NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
14151 | 1wfs | 10055 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 8.199 -10.720 19.935 2 HA2 GLY 1 1HA GLY 1 7.883 -11.239 17.084 3 HA3 GLY 1 2HA GLY 1 8.605 -9.696 17.516 4 H SER 2 H SER 2 8.963 -13.054 18.665 5 HA SER 2 HA SER 2 11.867 -12.670 18.651 6 HB2 SER 2 1HB SER 2 10.217 -13.778 20.547 7 HB3 SER 2 2HB SER 2 10.820 -15.212 19.698 8 HG SER 2 HG SER 2 12.956 -13.929 19.982 9 H SER 3 H SER 3 9.383 -14.925 17.500 10 HA SER 3 HA SER 3 10.948 -16.806 16.246 11 HB2 SER 3 1HB SER 3 9.049 -17.364 14.898 12 HB3 SER 3 2HB SER 3 8.428 -16.814 16.464 13 HG SER 3 HG SER 3 8.162 -15.678 13.970 14 H GLY 4 H GLY 4 12.551 -16.551 14.845 15 HA2 GLY 4 1HA GLY 4 12.660 -15.889 12.331 16 HA3 GLY 4 2HA GLY 4 12.479 -14.272 12.994 17 H SER 5 H SER 5 14.654 -14.822 11.468 18 HA SER 5 HA SER 5 16.811 -14.638 13.442 19 HB2 SER 5 1HB SER 5 16.411 -16.923 11.886 20 HB3 SER 5 2HB SER 5 17.697 -16.036 11.051 21 HG SER 5 HG SER 5 18.706 -17.269 12.569 22 H SER 6 H SER 6 18.678 -13.508 12.702 23 HA SER 6 HA SER 6 18.500 -12.159 10.125 24 HB2 SER 6 1HB SER 6 18.546 -9.953 10.965 25 HB3 SER 6 2HB SER 6 17.314 -10.775 11.938 26 HG SER 6 HG SER 6 19.329 -11.207 13.350 27 H GLY 7 H GLY 7 20.503 -10.662 9.877 28 HA2 GLY 7 1HA GLY 7 22.833 -11.721 11.304 29 HA3 GLY 7 2HA GLY 7 22.786 -11.914 9.558 30 H SER 8 H SER 8 23.043 -10.117 8.224 31 HA SER 8 HA SER 8 24.498 -7.938 9.459 32 HB2 SER 8 1HB SER 8 25.007 -9.208 7.202 33 HB3 SER 8 2HB SER 8 23.873 -8.022 6.531 34 HG SER 8 HG SER 8 25.911 -7.095 8.206 35 H ASP 9 H ASP 9 24.043 -5.687 8.934 36 HA ASP 9 HA ASP 9 21.146 -5.195 8.810 37 HB2 ASP 9 1HB ASP 9 23.109 -4.304 10.614 38 HB3 ASP 9 2HB ASP 9 22.702 -2.898 9.622 39 H SER 10 H SER 10 21.151 -5.313 6.491 40 HA SER 10 HA SER 10 21.355 -2.796 5.240 41 HB2 SER 10 1HB SER 10 23.665 -4.670 4.923 42 HB3 SER 10 2HB SER 10 23.129 -3.751 3.505 43 HG SER 10 HG SER 10 23.202 -1.921 5.216 44 H LEU 11 H LEU 11 20.180 -2.752 3.384 45 HA LEU 11 HA LEU 11 19.417 -5.320 2.177 46 HB2 LEU 11 1HB LEU 11 17.519 -3.049 2.793 47 HB3 LEU 11 2HB LEU 11 17.111 -4.574 1.988 48 HG LEU 11 HG LEU 11 18.223 -4.616 4.763 49 HD11 LEU 11 1HD1 LEU 11 15.387 -3.980 3.981 50 HD12 LEU 11 2HD1 LEU 11 16.470 -3.027 4.995 51 HD13 LEU 11 3HD1 LEU 11 15.854 -4.574 5.575 52 HD21 LEU 11 3HD2 LEU 11 17.979 -6.784 4.244 53 HD22 LEU 11 1HD2 LEU 11 16.882 -6.444 2.906 54 HD23 LEU 11 2HD2 LEU 11 16.267 -6.498 4.558 55 H VAL 12 H VAL 12 17.867 -4.595 0.154 56 HA VAL 12 HA VAL 12 19.650 -2.962 -1.494 57 HB VAL 12 HB VAL 12 18.934 -5.276 -2.222 58 HG11 VAL 12 1HG1 VAL 12 16.789 -5.822 -2.523 59 HG12 VAL 12 2HG1 VAL 12 16.410 -4.365 -1.602 60 HG13 VAL 12 3HG1 VAL 12 16.437 -4.313 -3.365 61 HG21 VAL 12 3HG2 VAL 12 19.886 -4.070 -3.933 62 HG22 VAL 12 1HG2 VAL 12 18.278 -4.367 -4.592 63 HG23 VAL 12 2HG2 VAL 12 18.659 -2.804 -3.870 64 H VAL 13 H VAL 13 18.181 -1.461 0.276 65 HA VAL 13 HA VAL 13 15.719 -0.516 -0.251 66 HB VAL 13 HB VAL 13 17.105 0.479 1.471 67 HG11 VAL 13 1HG1 VAL 13 19.182 0.471 -0.007 68 HG12 VAL 13 2HG1 VAL 13 18.594 2.008 -0.643 69 HG13 VAL 13 3HG1 VAL 13 18.970 1.849 1.073 70 HG21 VAL 13 3HG2 VAL 13 16.238 2.624 1.372 71 HG22 VAL 13 1HG2 VAL 13 16.495 2.757 -0.368 72 HG23 VAL 13 2HG2 VAL 13 15.191 1.747 0.256 73 H CYS 14 H CYS 14 14.668 0.713 -1.742 74 HA CYS 14 HA CYS 14 16.190 1.431 -4.160 75 HB2 CYS 14 1HB CYS 14 13.256 0.732 -3.970 76 HB3 CYS 14 2HB CYS 14 14.172 1.036 -5.455 77 HG CYS 14 HG CYS 14 14.663 -1.632 -3.367 78 H GLU 15 H GLU 15 15.337 3.276 -5.389 79 HA GLU 15 HA GLU 15 14.679 5.447 -3.587 80 HB2 GLU 15 1HB GLU 15 15.857 5.161 -6.254 81 HB3 GLU 15 2HB GLU 15 14.732 6.522 -6.125 82 HG2 GLU 15 1HG GLU 15 16.557 6.374 -3.863 83 HG3 GLU 15 2HG GLU 15 17.391 6.529 -5.415 84 H VAL 16 H VAL 16 13.107 7.155 -4.556 85 HA VAL 16 HA VAL 16 10.606 5.739 -5.155 86 HB VAL 16 HB VAL 16 10.424 7.060 -3.174 87 HG11 VAL 16 1HG1 VAL 16 11.914 8.720 -2.972 88 HG12 VAL 16 2HG1 VAL 16 12.017 8.968 -4.716 89 HG13 VAL 16 3HG1 VAL 16 10.706 9.706 -3.795 90 HG21 VAL 16 3HG2 VAL 16 9.071 9.016 -4.862 91 HG22 VAL 16 1HG2 VAL 16 8.759 7.348 -5.339 92 HG23 VAL 16 2HG2 VAL 16 8.406 7.875 -3.694 93 H ASP 17 H ASP 17 10.593 5.543 -7.354 94 HA ASP 17 HA ASP 17 11.518 7.060 -9.348 95 HB2 ASP 17 1HB ASP 17 10.112 5.006 -9.607 96 HB3 ASP 17 2HB ASP 17 8.681 6.012 -9.340 97 HA PRO 18 HA PRO 18 9.862 11.127 -8.995 98 HB2 PRO 18 2HB PRO 18 11.606 11.784 -10.339 99 HB3 PRO 18 1HB PRO 18 10.342 11.989 -11.550 100 HG2 PRO 18 1HG PRO 18 10.746 9.918 -12.524 101 HG3 PRO 18 2HG PRO 18 12.411 10.397 -12.023 102 HD2 PRO 18 1HD PRO 18 11.289 8.033 -11.303 103 HD3 PRO 18 2HD PRO 18 12.411 8.917 -10.256 104 H GLU 19 H GLU 19 8.823 9.005 -11.614 105 HA GLU 19 HA GLU 19 6.573 10.579 -12.378 106 HB2 GLU 19 1HB GLU 19 6.149 8.970 -13.947 107 HB3 GLU 19 2HB GLU 19 7.857 8.631 -13.627 108 HG2 GLU 19 1HG GLU 19 7.228 6.523 -13.305 109 HG3 GLU 19 2HG GLU 19 6.591 7.088 -11.754 110 H LEU 20 H LEU 20 7.163 8.207 -9.924 111 HA LEU 20 HA LEU 20 4.341 7.754 -9.417 112 HB2 LEU 20 1HB LEU 20 6.365 6.094 -9.160 113 HB3 LEU 20 2HB LEU 20 6.505 6.861 -7.569 114 HG LEU 20 HG LEU 20 4.021 5.478 -8.578 115 HD11 LEU 20 1HD1 LEU 20 5.371 4.206 -6.372 116 HD12 LEU 20 2HD1 LEU 20 6.419 4.305 -7.787 117 HD13 LEU 20 3HD1 LEU 20 4.841 3.527 -7.911 118 HD21 LEU 20 3HD2 LEU 20 4.774 6.882 -6.059 119 HD22 LEU 20 1HD2 LEU 20 3.688 5.495 -5.977 120 HD23 LEU 20 2HD2 LEU 20 3.252 6.900 -6.950 121 H LYS 21 H LYS 21 7.113 9.201 -7.725 122 HA LYS 21 HA LYS 21 6.167 9.971 -5.355 123 HB2 LYS 21 1HB LYS 21 8.358 10.648 -6.419 124 HB3 LYS 21 2HB LYS 21 7.478 11.979 -7.188 125 HG2 LYS 21 1HG LYS 21 6.738 12.356 -4.621 126 HG3 LYS 21 2HG LYS 21 8.348 11.649 -4.397 127 HD2 LYS 21 1HD LYS 21 8.232 13.701 -6.494 128 HD3 LYS 21 2HD LYS 21 7.843 14.295 -4.870 129 HE2 LYS 21 1HE LYS 21 10.034 12.721 -4.379 130 HE3 LYS 21 2HE LYS 21 10.397 13.382 -5.979 131 HZ1 LYS 21 3HZ LYS 21 11.170 15.107 -4.801 132 HZ2 LYS 21 1HZ LYS 21 10.274 14.721 -3.418 133 HZ3 LYS 21 2HZ LYS 21 9.546 15.566 -4.689 134 H GLU 22 H GLU 22 5.348 11.607 -8.397 135 HA GLU 22 HA GLU 22 3.687 13.577 -7.239 136 HB2 GLU 22 1HB GLU 22 3.375 12.469 -10.028 137 HB3 GLU 22 2HB GLU 22 3.000 14.100 -9.450 138 HG2 GLU 22 1HG GLU 22 5.567 14.175 -8.910 139 HG3 GLU 22 2HG GLU 22 5.632 12.890 -10.126 140 H THR 23 H THR 23 2.959 10.439 -8.732 141 HA THR 23 HA THR 23 0.241 10.409 -8.737 142 HB THR 23 HB THR 23 2.181 8.213 -8.051 143 HG1 THR 23 1HG THR 23 1.584 7.528 -10.139 144 HG21 THR 23 3HG2 THR 23 -0.746 8.226 -7.749 145 HG22 THR 23 1HG2 THR 23 0.462 7.163 -7.030 146 HG23 THR 23 2HG2 THR 23 -0.097 6.876 -8.678 147 H LEU 24 H LEU 24 2.337 9.899 -5.933 148 HA LEU 24 HA LEU 24 0.224 9.302 -4.124 149 HB2 LEU 24 1HB LEU 24 2.907 10.446 -3.369 150 HB3 LEU 24 2HB LEU 24 1.849 9.391 -2.416 151 HG LEU 24 HG LEU 24 3.402 8.576 -4.872 152 HD11 LEU 24 1HD1 LEU 24 5.084 8.004 -3.539 153 HD12 LEU 24 2HD1 LEU 24 4.000 7.196 -2.406 154 HD13 LEU 24 3HD1 LEU 24 4.290 8.930 -2.264 155 HD21 LEU 24 3HD2 LEU 24 2.348 6.591 -4.856 156 HD22 LEU 24 1HD2 LEU 24 1.071 7.483 -4.028 157 HD23 LEU 24 2HD2 LEU 24 2.239 6.546 -3.095 158 H ARG 25 H ARG 25 2.231 12.220 -4.555 159 HA ARG 25 HA ARG 25 0.990 13.863 -2.718 160 HB2 ARG 25 1HB ARG 25 3.057 14.426 -3.954 161 HB3 ARG 25 2HB ARG 25 2.085 14.689 -5.412 162 HG2 ARG 25 1HG ARG 25 0.815 16.449 -4.107 163 HG3 ARG 25 2HG ARG 25 2.080 16.298 -2.877 164 HD2 ARG 25 1HD ARG 25 3.169 16.596 -5.569 165 HD3 ARG 25 2HD ARG 25 2.140 17.952 -5.089 166 HE ARG 25 HE ARG 25 4.749 17.487 -4.198 167 HH11 ARG 25 2HH1 ARG 25 1.624 18.336 -2.920 168 HH12 ARG 25 1HH1 ARG 25 2.269 19.228 -1.582 169 HH21 ARG 25 1HH2 ARG 25 4.536 19.412 -1.311 170 HH22 ARG 25 2HH2 ARG 25 5.610 18.659 -2.441 171 H LYS 26 H LYS 26 -0.081 12.909 -5.900 172 HA LYS 26 HA LYS 26 -2.209 14.860 -5.997 173 HB2 LYS 26 1HB LYS 26 -1.960 12.425 -7.756 174 HB3 LYS 26 2HB LYS 26 -2.735 13.974 -8.124 175 HG2 LYS 26 1HG LYS 26 -0.002 14.488 -7.525 176 HG3 LYS 26 2HG LYS 26 -0.083 13.149 -8.683 177 HD2 LYS 26 1HD LYS 26 -1.884 14.757 -9.825 178 HD3 LYS 26 2HD LYS 26 -0.909 15.983 -8.995 179 HE2 LYS 26 1HE LYS 26 0.746 15.800 -10.485 180 HE3 LYS 26 2HE LYS 26 0.775 14.040 -10.308 181 HZ1 LYS 26 3HZ LYS 26 0.008 15.357 -12.532 182 HZ2 LYS 26 1HZ LYS 26 -1.483 15.015 -11.807 183 HZ3 LYS 26 2HZ LYS 26 -0.408 13.759 -12.165 184 H PHE 27 H PHE 27 -1.923 11.361 -5.493 185 HA PHE 27 HA PHE 27 -4.613 10.713 -5.324 186 HB2 PHE 27 1HB PHE 27 -2.560 9.170 -5.286 187 HB3 PHE 27 2HB PHE 27 -2.521 9.470 -3.548 188 HD1 PHE 27 2HD PHE 27 -5.219 8.713 -6.018 189 HD2 PHE 27 1HD PHE 27 -3.359 7.737 -2.315 190 HE1 PHE 27 2HE PHE 27 -6.883 6.938 -5.653 191 HE2 PHE 27 1HE PHE 27 -5.020 5.960 -1.945 192 HZ PHE 27 HZ PHE 27 -6.786 5.560 -3.615 193 H ARG 28 H ARG 28 -2.438 11.920 -2.806 194 HA ARG 28 HA ARG 28 -4.288 11.741 -0.678 195 HB2 ARG 28 1HB ARG 28 -2.198 13.872 -0.682 196 HB3 ARG 28 2HB ARG 28 -2.684 12.769 0.613 197 HG2 ARG 28 1HG ARG 28 -1.630 11.080 -1.311 198 HG3 ARG 28 2HG ARG 28 -0.573 12.501 -1.350 199 HD2 ARG 28 1HD ARG 28 -1.340 11.036 1.182 200 HD3 ARG 28 2HD ARG 28 0.135 10.722 0.258 201 HE ARG 28 HE ARG 28 -0.349 12.913 2.030 202 HH11 ARG 28 2HH1 ARG 28 1.407 11.908 -0.803 203 HH12 ARG 28 1HH1 ARG 28 2.680 13.063 -0.584 204 HH21 ARG 28 1HH2 ARG 28 2.631 14.500 1.200 205 HH22 ARG 28 2HH2 ARG 28 1.322 14.437 2.330 206 H PHE 29 H PHE 29 -3.824 14.051 -3.216 207 HA PHE 29 HA PHE 29 -6.003 15.674 -2.087 208 HB2 PHE 29 1HB PHE 29 -4.003 17.041 -3.809 209 HB3 PHE 29 2HB PHE 29 -4.911 17.656 -2.427 210 HD1 PHE 29 1HD PHE 29 -4.258 15.960 -0.234 211 HD2 PHE 29 2HD PHE 29 -1.749 17.307 -3.398 212 HE1 PHE 29 1HE PHE 29 -2.289 15.687 1.216 213 HE2 PHE 29 2HE PHE 29 0.224 17.035 -1.953 214 HZ PHE 29 HZ PHE 29 -0.044 16.223 0.356 215 H ARG 30 H ARG 30 -6.365 13.559 -3.872 216 HA ARG 30 HA ARG 30 -6.483 14.487 -6.571 217 HB2 ARG 30 1HB ARG 30 -7.797 12.424 -6.980 218 HB3 ARG 30 2HB ARG 30 -6.271 12.120 -6.138 219 HG2 ARG 30 1HG ARG 30 -7.799 12.325 -3.991 220 HG3 ARG 30 2HG ARG 30 -9.058 11.868 -5.151 221 HD2 ARG 30 1HD ARG 30 -6.704 10.219 -5.490 222 HD3 ARG 30 2HD ARG 30 -7.286 10.167 -3.820 223 HE ARG 30 HE ARG 30 -8.573 9.055 -6.130 224 HH11 ARG 30 2HH1 ARG 30 -9.067 10.314 -2.922 225 HH12 ARG 30 1HH1 ARG 30 -10.543 9.442 -2.667 226 HH21 ARG 30 1HH2 ARG 30 -11.364 8.071 -4.308 227 HH22 ARG 30 2HH2 ARG 30 -10.514 7.903 -5.806 228 H LYS 31 H LYS 31 -8.571 14.502 -7.805 229 HA LYS 31 HA LYS 31 -10.478 16.185 -6.381 230 HB2 LYS 31 1HB LYS 31 -10.383 15.473 -9.322 231 HB3 LYS 31 2HB LYS 31 -11.349 16.753 -8.571 232 HG2 LYS 31 1HG LYS 31 -9.595 17.952 -9.451 233 HG3 LYS 31 2HG LYS 31 -9.049 17.673 -7.789 234 HD2 LYS 31 1HD LYS 31 -7.244 16.580 -8.503 235 HD3 LYS 31 2HD LYS 31 -8.257 15.465 -9.438 236 HE2 LYS 31 1HE LYS 31 -8.382 17.621 -11.046 237 HE3 LYS 31 2HE LYS 31 -6.798 17.888 -10.305 238 HZ1 LYS 31 3HZ LYS 31 -7.323 15.192 -11.262 239 HZ2 LYS 31 1HZ LYS 31 -5.907 16.115 -11.342 240 HZ3 LYS 31 2HZ LYS 31 -7.154 16.383 -12.452 241 H GLU 32 H GLU 32 -10.415 13.368 -5.773 242 HA GLU 32 HA GLU 32 -13.037 12.528 -6.820 243 HB2 GLU 32 1HB GLU 32 -10.664 10.922 -5.873 244 HB3 GLU 32 2HB GLU 32 -12.276 10.213 -6.058 245 HG2 GLU 32 1HG GLU 32 -12.278 10.479 -8.375 246 HG3 GLU 32 2HG GLU 32 -10.961 11.659 -8.323 247 H THR 33 H THR 33 -14.104 10.909 -5.190 248 HA THR 33 HA THR 33 -13.719 11.701 -2.414 249 HB THR 33 HB THR 33 -16.123 12.215 -2.101 250 HG1 THR 33 1HG THR 33 -16.507 11.138 -4.354 251 HG21 THR 33 3HG2 THR 33 -14.605 14.070 -2.321 252 HG22 THR 33 1HG2 THR 33 -16.080 14.449 -3.210 253 HG23 THR 33 2HG2 THR 33 -14.632 13.940 -4.079 254 H ASN 34 H ASN 34 -13.497 9.248 -4.087 255 HA ASN 34 HA ASN 34 -15.325 7.554 -2.518 256 HB2 ASN 34 1HB ASN 34 -15.306 5.953 -4.447 257 HB3 ASN 34 2HB ASN 34 -16.112 7.490 -4.788 258 HD21 ASN 34 2HD2 ASN 34 -12.808 6.377 -6.836 259 HD22 ASN 34 1HD2 ASN 34 -13.415 5.461 -5.503 260 H ASN 35 H ASN 35 -14.419 5.113 -2.902 261 HA ASN 35 HA ASN 35 -11.830 5.154 -1.614 262 HB2 ASN 35 1HB ASN 35 -13.834 2.983 -2.232 263 HB3 ASN 35 2HB ASN 35 -12.229 2.612 -1.591 264 HD21 ASN 35 2HD2 ASN 35 -14.371 2.770 1.327 265 HD22 ASN 35 1HD2 ASN 35 -14.107 1.757 -0.048 266 H ALA 36 H ALA 36 -9.933 4.814 -2.569 267 HA ALA 36 HA ALA 36 -9.850 3.395 -5.135 268 HB1 ALA 36 3HB ALA 36 -9.889 5.758 -5.694 269 HB2 ALA 36 1HB ALA 36 -8.526 6.054 -4.615 270 HB3 ALA 36 2HB ALA 36 -8.309 5.066 -6.059 271 H ALA 37 H ALA 37 -7.775 2.507 -5.664 272 HA ALA 37 HA ALA 37 -5.901 2.350 -3.399 273 HB1 ALA 37 3HB ALA 37 -6.022 -0.099 -4.958 274 HB2 ALA 37 1HB ALA 37 -6.081 0.137 -3.211 275 HB3 ALA 37 2HB ALA 37 -7.553 0.283 -4.171 276 H ILE 38 H ILE 38 -3.718 1.997 -3.937 277 HA ILE 38 HA ILE 38 -3.042 2.212 -6.789 278 HB ILE 38 HB ILE 38 -1.559 3.764 -4.679 279 HG12 ILE 38 1HG1 ILE 38 -3.850 4.648 -6.446 280 HG13 ILE 38 2HG1 ILE 38 -3.804 4.646 -4.675 281 HG21 ILE 38 1HG2 ILE 38 -1.599 4.686 -7.456 282 HG22 ILE 38 2HG2 ILE 38 -0.246 4.495 -6.341 283 HG23 ILE 38 3HG2 ILE 38 -0.861 3.101 -7.229 284 HD11 ILE 38 3HD1 ILE 38 -2.598 6.554 -4.552 285 HD12 ILE 38 1HD1 ILE 38 -1.739 6.243 -6.060 286 HD13 ILE 38 2HD1 ILE 38 -3.397 6.844 -6.098 287 H ILE 39 H ILE 39 -1.978 0.400 -7.239 288 HA ILE 39 HA ILE 39 -0.232 -0.799 -5.221 289 HB ILE 39 HB ILE 39 -1.091 -1.903 -7.898 290 HG12 ILE 39 1HG1 ILE 39 -2.068 -3.299 -5.556 291 HG13 ILE 39 2HG1 ILE 39 -2.584 -1.604 -5.544 292 HG21 ILE 39 1HG2 ILE 39 1.003 -2.858 -7.209 293 HG22 ILE 39 2HG2 ILE 39 0.380 -3.159 -5.588 294 HG23 ILE 39 3HG2 ILE 39 -0.272 -4.051 -6.963 295 HD11 ILE 39 3HD1 ILE 39 -4.304 -2.714 -6.646 296 HD12 ILE 39 1HD1 ILE 39 -3.351 -1.997 -7.946 297 HD13 ILE 39 2HD1 ILE 39 -3.188 -3.714 -7.576 298 H MET 40 H MET 40 1.870 -0.394 -5.251 299 HA MET 40 HA MET 40 3.125 0.342 -7.814 300 HB2 MET 40 1HB MET 40 4.203 1.111 -5.107 301 HB3 MET 40 2HB MET 40 4.587 1.810 -6.686 302 HG2 MET 40 1HG MET 40 2.784 3.175 -6.697 303 HG3 MET 40 2HG MET 40 1.774 2.008 -5.839 304 HE1 MET 40 3HE MET 40 1.280 1.862 -3.682 305 HE2 MET 40 1HE MET 40 1.781 2.887 -2.338 306 HE3 MET 40 2HE MET 40 0.731 3.537 -3.597 307 H LYS 41 H LYS 41 5.128 -0.536 -8.326 308 HA LYS 41 HA LYS 41 6.031 -2.743 -6.594 309 HB2 LYS 41 1HB LYS 41 6.493 -4.100 -8.483 310 HB3 LYS 41 2HB LYS 41 4.865 -3.448 -8.727 311 HG2 LYS 41 1HG LYS 41 5.449 -2.555 -10.668 312 HG3 LYS 41 2HG LYS 41 6.783 -1.679 -9.899 313 HD2 LYS 41 1HD LYS 41 8.336 -3.315 -10.380 314 HD3 LYS 41 2HD LYS 41 7.108 -4.591 -10.463 315 HE2 LYS 41 1HE LYS 41 6.242 -3.517 -12.565 316 HE3 LYS 41 2HE LYS 41 7.642 -2.437 -12.503 317 HZ1 LYS 41 3HZ LYS 41 8.125 -4.262 -13.949 318 HZ2 LYS 41 1HZ LYS 41 7.703 -5.393 -12.763 319 HZ3 LYS 41 2HZ LYS 41 9.076 -4.427 -12.560 320 H VAL 42 H VAL 42 8.343 -3.461 -7.410 321 HA VAL 42 HA VAL 42 9.958 -1.025 -7.792 322 HB VAL 42 HB VAL 42 10.461 -1.487 -5.594 323 HG11 VAL 42 1HG1 VAL 42 9.719 -4.243 -6.321 324 HG12 VAL 42 2HG1 VAL 42 10.948 -4.087 -5.064 325 HG13 VAL 42 3HG1 VAL 42 9.372 -3.320 -4.859 326 HG21 VAL 42 3HG2 VAL 42 12.520 -1.497 -6.911 327 HG22 VAL 42 1HG2 VAL 42 12.657 -2.557 -5.507 328 HG23 VAL 42 2HG2 VAL 42 12.391 -3.245 -7.109 329 H ASP 43 H ASP 43 11.182 -1.081 -9.548 330 HA ASP 43 HA ASP 43 11.507 -3.540 -11.029 331 HB2 ASP 43 1HB ASP 43 12.081 -0.644 -11.525 332 HB3 ASP 43 2HB ASP 43 12.919 -1.856 -12.503 333 H LYS 44 H LYS 44 13.133 -4.903 -10.757 334 HA LYS 44 HA LYS 44 15.333 -4.349 -9.053 335 HB2 LYS 44 1HB LYS 44 14.257 -6.611 -9.539 336 HB3 LYS 44 2HB LYS 44 15.190 -6.607 -11.045 337 HG2 LYS 44 1HG LYS 44 16.913 -5.993 -8.826 338 HG3 LYS 44 2HG LYS 44 16.018 -7.492 -8.523 339 HD2 LYS 44 1HD LYS 44 16.811 -8.486 -10.544 340 HD3 LYS 44 2HD LYS 44 17.489 -6.945 -11.095 341 HE2 LYS 44 1HE LYS 44 18.411 -8.337 -8.577 342 HE3 LYS 44 2HE LYS 44 19.142 -8.617 -10.165 343 HZ1 LYS 44 3HZ LYS 44 19.115 -6.118 -8.586 344 HZ2 LYS 44 1HZ LYS 44 19.462 -6.118 -10.241 345 HZ3 LYS 44 2HZ LYS 44 20.449 -6.978 -9.170 346 H ASP 45 H ASP 45 14.752 -3.715 -12.340 347 HA ASP 45 HA ASP 45 17.499 -3.778 -13.200 348 HB2 ASP 45 1HB ASP 45 15.031 -3.754 -14.483 349 HB3 ASP 45 2HB ASP 45 15.710 -2.159 -14.834 350 H ARG 46 H ARG 46 15.192 -1.324 -12.154 351 HA ARG 46 HA ARG 46 17.349 0.678 -12.256 352 HB2 ARG 46 1HB ARG 46 14.367 1.171 -12.100 353 HB3 ARG 46 2HB ARG 46 15.634 2.382 -12.348 354 HG2 ARG 46 1HG ARG 46 16.103 1.617 -14.530 355 HG3 ARG 46 2HG ARG 46 15.166 0.134 -14.281 356 HD2 ARG 46 1HD ARG 46 13.481 1.209 -15.296 357 HD3 ARG 46 2HD ARG 46 13.315 2.092 -13.773 358 HE ARG 46 HE ARG 46 15.171 3.539 -15.088 359 HH11 ARG 46 2HH1 ARG 46 12.033 2.331 -15.992 360 HH12 ARG 46 1HH1 ARG 46 11.700 3.636 -17.082 361 HH21 ARG 46 1HH2 ARG 46 13.244 5.302 -17.383 362 HH22 ARG 46 2HH2 ARG 46 14.744 5.262 -16.521 363 H GLN 47 H GLN 47 16.223 -1.401 -10.148 364 HA GLN 47 HA GLN 47 15.689 -1.415 -7.895 365 HB2 GLN 47 1HB GLN 47 18.053 0.455 -7.761 366 HB3 GLN 47 2HB GLN 47 17.576 -0.794 -6.600 367 HG2 GLN 47 1HG GLN 47 18.096 -1.844 -9.276 368 HG3 GLN 47 2HG GLN 47 19.494 -1.055 -8.533 369 HE21 GLN 47 2HE2 GLN 47 18.399 -4.716 -7.391 370 HE22 GLN 47 1HE2 GLN 47 17.719 -3.877 -8.739 371 H MET 48 H MET 48 13.950 0.337 -8.979 372 HA MET 48 HA MET 48 13.753 2.365 -6.881 373 HB2 MET 48 1HB MET 48 13.663 4.176 -8.242 374 HB3 MET 48 2HB MET 48 14.662 3.150 -9.283 375 HG2 MET 48 1HG MET 48 12.287 2.360 -10.169 376 HG3 MET 48 2HG MET 48 11.828 3.960 -9.580 377 HE1 MET 48 3HE MET 48 12.834 6.425 -11.177 378 HE2 MET 48 1HE MET 48 13.712 5.781 -9.790 379 HE3 MET 48 2HE MET 48 14.568 6.124 -11.292 380 H VAL 49 H VAL 49 11.663 2.882 -6.282 381 HA VAL 49 HA VAL 49 9.662 0.933 -6.931 382 HB VAL 49 HB VAL 49 9.225 3.459 -5.348 383 HG11 VAL 49 1HG1 VAL 49 7.606 1.938 -4.149 384 HG12 VAL 49 2HG1 VAL 49 7.182 2.352 -5.812 385 HG13 VAL 49 3HG1 VAL 49 7.875 0.772 -5.444 386 HG21 VAL 49 3HG2 VAL 49 9.878 2.231 -3.353 387 HG22 VAL 49 1HG2 VAL 49 10.277 0.820 -4.333 388 HG23 VAL 49 2HG2 VAL 49 11.219 2.302 -4.496 389 H VAL 50 H VAL 50 8.389 1.021 -8.651 390 HA VAL 50 HA VAL 50 7.539 3.663 -9.644 391 HB VAL 50 HB VAL 50 7.505 2.741 -11.925 392 HG11 VAL 50 1HG1 VAL 50 10.128 2.632 -10.453 393 HG12 VAL 50 2HG1 VAL 50 9.998 2.565 -12.211 394 HG13 VAL 50 3HG1 VAL 50 9.438 3.992 -11.338 395 HG21 VAL 50 3HG2 VAL 50 9.131 0.403 -11.050 396 HG22 VAL 50 1HG2 VAL 50 7.375 0.319 -10.915 397 HG23 VAL 50 2HG2 VAL 50 8.125 0.603 -12.485 398 H LEU 51 H LEU 51 5.424 3.867 -10.328 399 HA LEU 51 HA LEU 51 3.447 2.445 -9.056 400 HB2 LEU 51 1HB LEU 51 3.145 4.635 -10.150 401 HB3 LEU 51 2HB LEU 51 3.217 3.827 -11.726 402 HG LEU 51 HG LEU 51 1.183 2.466 -10.576 403 HD11 LEU 51 1HD1 LEU 51 0.228 3.518 -8.875 404 HD12 LEU 51 2HD1 LEU 51 0.144 5.019 -9.797 405 HD13 LEU 51 3HD1 LEU 51 1.585 4.644 -8.852 406 HD21 LEU 51 3HD2 LEU 51 0.448 5.049 -11.818 407 HD22 LEU 51 1HD2 LEU 51 -0.078 3.411 -12.205 408 HD23 LEU 51 2HD2 LEU 51 1.499 3.982 -12.750 409 H GLU 52 H GLU 52 2.082 0.755 -9.577 410 HA GLU 52 HA GLU 52 2.944 -0.906 -11.854 411 HB2 GLU 52 1HB GLU 52 3.464 -1.899 -9.658 412 HB3 GLU 52 2HB GLU 52 1.748 -1.815 -9.231 413 HG2 GLU 52 1HG GLU 52 1.986 -4.014 -9.877 414 HG3 GLU 52 2HG GLU 52 1.382 -3.240 -11.349 415 H ASP 53 H ASP 53 0.191 0.176 -9.926 416 HA ASP 53 HA ASP 53 -1.523 0.226 -12.200 417 HB2 ASP 53 1HB ASP 53 -1.716 -2.059 -10.265 418 HB3 ASP 53 2HB ASP 53 -3.191 -1.414 -10.997 419 H GLU 54 H GLU 54 -3.742 0.928 -11.620 420 HA GLU 54 HA GLU 54 -4.052 2.029 -8.944 421 HB2 GLU 54 1HB GLU 54 -3.391 3.618 -11.318 422 HB3 GLU 54 2HB GLU 54 -4.838 4.181 -10.469 423 HG2 GLU 54 1HG GLU 54 -3.627 4.470 -8.426 424 HG3 GLU 54 2HG GLU 54 -2.192 3.706 -9.124 425 H LEU 55 H LEU 55 -6.008 1.418 -8.326 426 HA LEU 55 HA LEU 55 -8.156 1.315 -10.339 427 HB2 LEU 55 1HB LEU 55 -8.026 -0.217 -7.740 428 HB3 LEU 55 2HB LEU 55 -9.198 -0.417 -9.054 429 HG LEU 55 HG LEU 55 -6.294 -0.920 -9.567 430 HD11 LEU 55 1HD1 LEU 55 -6.921 -3.367 -9.053 431 HD12 LEU 55 2HD1 LEU 55 -8.198 -2.669 -8.058 432 HD13 LEU 55 3HD1 LEU 55 -6.509 -2.298 -7.713 433 HD21 LEU 55 3HD2 LEU 55 -8.791 -1.230 -10.961 434 HD22 LEU 55 1HD2 LEU 55 -7.965 -2.782 -10.816 435 HD23 LEU 55 2HD2 LEU 55 -7.142 -1.411 -11.560 436 H GLN 56 H GLN 56 -10.082 2.309 -9.927 437 HA GLN 56 HA GLN 56 -10.240 3.868 -7.432 438 HB2 GLN 56 1HB GLN 56 -11.310 4.576 -10.175 439 HB3 GLN 56 2HB GLN 56 -11.533 5.541 -8.707 440 HG2 GLN 56 1HG GLN 56 -9.786 6.607 -9.808 441 HG3 GLN 56 2HG GLN 56 -8.984 5.616 -8.582 442 HE21 GLN 56 2HE2 GLN 56 -7.048 3.903 -10.855 443 HE22 GLN 56 1HE2 GLN 56 -7.367 4.390 -9.228 444 H ASN 57 H ASN 57 -12.474 4.415 -6.753 445 HA ASN 57 HA ASN 57 -14.443 3.612 -5.911 446 HB2 ASN 57 1HB ASN 57 -14.880 2.887 -8.822 447 HB3 ASN 57 2HB ASN 57 -16.137 3.140 -7.604 448 HD21 ASN 57 2HD2 ASN 57 -14.247 6.316 -9.317 449 HD22 ASN 57 1HD2 ASN 57 -13.597 4.719 -9.435 450 H ILE 58 H ILE 58 -12.607 1.820 -5.278 451 HA ILE 58 HA ILE 58 -13.897 -0.766 -5.850 452 HB ILE 58 HB ILE 58 -11.980 -1.422 -6.787 453 HG12 ILE 58 1HG1 ILE 58 -11.870 -2.332 -4.401 454 HG13 ILE 58 2HG1 ILE 58 -10.363 -2.342 -5.333 455 HG21 ILE 58 1HG2 ILE 58 -11.091 0.645 -7.321 456 HG22 ILE 58 2HG2 ILE 58 -10.887 1.109 -5.633 457 HG23 ILE 58 3HG2 ILE 58 -9.802 -0.076 -6.358 458 HD11 ILE 58 3HD1 ILE 58 -10.838 -1.187 -2.806 459 HD12 ILE 58 1HD1 ILE 58 -9.353 -1.176 -3.756 460 HD13 ILE 58 2HD1 ILE 58 -10.527 0.127 -3.940 461 H SER 59 H SER 59 -14.261 -2.104 -4.140 462 HA SER 59 HA SER 59 -14.073 -0.926 -1.510 463 HB2 SER 59 1HB SER 59 -15.637 -3.003 -2.796 464 HB3 SER 59 2HB SER 59 -14.984 -3.567 -1.247 465 HG SER 59 HG SER 59 -16.211 -1.040 -1.433 466 HA PRO 60 HA PRO 60 -10.602 -3.054 0.126 467 HB2 PRO 60 2HB PRO 60 -11.204 -2.326 2.221 468 HB3 PRO 60 1HB PRO 60 -11.475 -4.040 2.527 469 HG2 PRO 60 1HG PRO 60 -13.760 -3.891 2.131 470 HG3 PRO 60 2HG PRO 60 -13.433 -2.285 2.882 471 HD2 PRO 60 1HD PRO 60 -14.671 -2.555 0.482 472 HD3 PRO 60 2HD PRO 60 -13.600 -1.196 0.857 473 H GLU 61 H GLU 61 -13.238 -4.772 -0.938 474 HA GLU 61 HA GLU 61 -12.120 -7.385 -0.226 475 HB2 GLU 61 1HB GLU 61 -14.795 -6.367 -0.860 476 HB3 GLU 61 2HB GLU 61 -14.403 -7.888 -1.677 477 HG2 GLU 61 1HG GLU 61 -13.751 -8.825 0.558 478 HG3 GLU 61 2HG GLU 61 -14.417 -7.354 1.280 479 H GLU 62 H GLU 62 -12.644 -5.239 -2.913 480 HA GLU 62 HA GLU 62 -12.087 -7.204 -4.935 481 HB2 GLU 62 1HB GLU 62 -13.217 -4.662 -4.896 482 HB3 GLU 62 2HB GLU 62 -11.680 -4.440 -5.747 483 HG2 GLU 62 1HG GLU 62 -13.180 -6.795 -6.624 484 HG3 GLU 62 2HG GLU 62 -14.018 -5.258 -6.888 485 H LEU 63 H LEU 63 -10.299 -4.552 -3.408 486 HA LEU 63 HA LEU 63 -7.986 -4.566 -4.892 487 HB2 LEU 63 1HB LEU 63 -8.837 -3.403 -2.534 488 HB3 LEU 63 2HB LEU 63 -7.456 -4.394 -2.033 489 HG LEU 63 HG LEU 63 -7.524 -1.992 -3.802 490 HD11 LEU 63 1HD1 LEU 63 -5.946 -2.953 -1.444 491 HD12 LEU 63 2HD1 LEU 63 -6.895 -1.478 -1.623 492 HD13 LEU 63 3HD1 LEU 63 -5.356 -1.644 -2.467 493 HD21 LEU 63 3HD2 LEU 63 -6.289 -3.090 -5.329 494 HD22 LEU 63 1HD2 LEU 63 -5.878 -4.394 -4.215 495 HD23 LEU 63 2HD2 LEU 63 -4.989 -2.872 -4.156 496 H LYS 64 H LYS 64 -8.766 -6.629 -2.107 497 HA LYS 64 HA LYS 64 -6.364 -8.019 -1.936 498 HB2 LYS 64 1HB LYS 64 -7.507 -8.798 -0.186 499 HB3 LYS 64 2HB LYS 64 -9.045 -8.295 -0.904 500 HG2 LYS 64 1HG LYS 64 -9.376 -10.351 -1.964 501 HG3 LYS 64 2HG LYS 64 -7.677 -10.814 -1.775 502 HD2 LYS 64 1HD LYS 64 -8.196 -11.885 0.105 503 HD3 LYS 64 2HD LYS 64 -8.672 -10.334 0.819 504 HE2 LYS 64 1HE LYS 64 -10.904 -10.750 -0.516 505 HE3 LYS 64 2HE LYS 64 -10.364 -12.434 -0.457 506 HZ1 LYS 64 3HZ LYS 64 -10.328 -10.907 2.038 507 HZ2 LYS 64 1HZ LYS 64 -10.638 -12.551 1.782 508 HZ3 LYS 64 2HZ LYS 64 -11.831 -11.402 1.440 509 H LEU 65 H LEU 65 -9.081 -8.446 -4.106 510 HA LEU 65 HA LEU 65 -8.211 -10.969 -5.139 511 HB2 LEU 65 1HB LEU 65 -10.292 -8.952 -5.871 512 HB3 LEU 65 2HB LEU 65 -9.840 -10.195 -7.050 513 HG LEU 65 HG LEU 65 -11.735 -11.049 -5.980 514 HD11 LEU 65 1HD1 LEU 65 -9.591 -12.298 -4.304 515 HD12 LEU 65 2HD1 LEU 65 -9.634 -12.531 -6.051 516 HD13 LEU 65 3HD1 LEU 65 -10.996 -13.051 -5.059 517 HD21 LEU 65 3HD2 LEU 65 -10.541 -9.842 -3.533 518 HD22 LEU 65 1HD2 LEU 65 -11.624 -11.224 -3.362 519 HD23 LEU 65 2HD2 LEU 65 -12.192 -9.751 -4.148 520 H GLU 66 H GLU 66 -7.728 -7.605 -6.001 521 HA GLU 66 HA GLU 66 -6.592 -8.099 -8.564 522 HB2 GLU 66 1HB GLU 66 -6.268 -5.705 -6.737 523 HB3 GLU 66 2HB GLU 66 -5.852 -5.760 -8.457 524 HG2 GLU 66 1HG GLU 66 -8.644 -6.314 -7.496 525 HG3 GLU 66 2HG GLU 66 -8.062 -4.672 -7.797 526 H LEU 67 H LEU 67 -5.339 -7.990 -5.311 527 HA LEU 67 HA LEU 67 -2.590 -7.768 -5.999 528 HB2 LEU 67 1HB LEU 67 -3.998 -8.772 -3.525 529 HB3 LEU 67 2HB LEU 67 -2.236 -8.645 -3.664 530 HG LEU 67 HG LEU 67 -4.098 -6.294 -3.960 531 HD11 LEU 67 1HD1 LEU 67 -3.984 -7.586 -1.673 532 HD12 LEU 67 2HD1 LEU 67 -3.943 -5.824 -1.728 533 HD13 LEU 67 3HD1 LEU 67 -2.447 -6.734 -1.525 534 HD21 LEU 67 3HD2 LEU 67 -2.236 -4.977 -4.070 535 HD22 LEU 67 1HD2 LEU 67 -1.618 -6.430 -4.856 536 HD23 LEU 67 2HD2 LEU 67 -1.239 -6.114 -3.162 537 HA PRO 68 HA PRO 68 -1.534 -11.855 -7.204 538 HB2 PRO 68 2HB PRO 68 0.588 -11.066 -7.594 539 HB3 PRO 68 1HB PRO 68 1.009 -12.068 -6.207 540 HG2 PRO 68 1HG PRO 68 0.929 -10.286 -4.718 541 HG3 PRO 68 2HG PRO 68 1.551 -9.472 -6.201 542 HD2 PRO 68 1HD PRO 68 -0.639 -8.595 -4.856 543 HD3 PRO 68 2HD PRO 68 -0.479 -8.462 -6.616 544 H GLU 69 H GLU 69 0.002 -13.740 -6.017 545 HA GLU 69 HA GLU 69 -1.311 -14.249 -3.430 546 HB2 GLU 69 1HB GLU 69 -1.289 -16.681 -4.063 547 HB3 GLU 69 2HB GLU 69 -2.389 -15.672 -5.015 548 HG2 GLU 69 1HG GLU 69 -1.438 -16.350 -6.889 549 HG3 GLU 69 2HG GLU 69 0.120 -15.722 -6.336 550 H ARG 70 H ARG 70 1.574 -14.088 -5.215 551 HA ARG 70 HA ARG 70 3.125 -14.772 -2.875 552 HB2 ARG 70 1HB ARG 70 4.600 -16.317 -4.335 553 HB3 ARG 70 2HB ARG 70 3.095 -16.964 -3.663 554 HG2 ARG 70 1HG ARG 70 2.946 -17.729 -5.811 555 HG3 ARG 70 2HG ARG 70 2.094 -16.182 -5.955 556 HD2 ARG 70 1HD ARG 70 3.705 -15.248 -7.244 557 HD3 ARG 70 2HD ARG 70 5.006 -16.054 -6.356 558 HE ARG 70 HE ARG 70 3.942 -16.883 -8.805 559 HH11 ARG 70 2HH1 ARG 70 4.836 -18.218 -5.717 560 HH12 ARG 70 1HH1 ARG 70 5.215 -19.783 -6.357 561 HH21 ARG 70 1HH2 ARG 70 4.991 -20.191 -8.600 562 HH22 ARG 70 2HH2 ARG 70 4.439 -18.939 -9.660 563 H GLN 71 H GLN 71 2.791 -12.336 -4.124 564 HA GLN 71 HA GLN 71 5.519 -11.816 -5.027 565 HB2 GLN 71 1HB GLN 71 4.572 -11.916 -7.144 566 HB3 GLN 71 2HB GLN 71 3.026 -11.255 -6.588 567 HG2 GLN 71 1HG GLN 71 3.735 -9.082 -6.699 568 HG3 GLN 71 2HG GLN 71 5.432 -9.518 -6.454 569 HE21 GLN 71 2HE2 GLN 71 4.099 -10.455 -10.186 570 HE22 GLN 71 1HE2 GLN 71 3.284 -11.026 -8.773 571 HA PRO 72 HA PRO 72 4.754 -8.658 -1.957 572 HB2 PRO 72 2HB PRO 72 6.814 -9.200 -1.096 573 HB3 PRO 72 1HB PRO 72 7.326 -7.720 -1.905 574 HG2 PRO 72 1HG PRO 72 8.126 -8.852 -3.770 575 HG3 PRO 72 2HG PRO 72 8.503 -10.033 -2.460 576 HD2 PRO 72 1HD PRO 72 7.076 -10.704 -4.670 577 HD3 PRO 72 2HD PRO 72 6.771 -11.422 -3.080 578 H ARG 73 H ARG 73 4.141 -6.580 -2.154 579 HA ARG 73 HA ARG 73 5.355 -4.745 -3.968 580 HB2 ARG 73 1HB ARG 73 3.314 -4.332 -5.344 581 HB3 ARG 73 2HB ARG 73 4.074 -5.904 -5.638 582 HG2 ARG 73 1HG ARG 73 2.401 -7.031 -4.315 583 HG3 ARG 73 2HG ARG 73 1.680 -5.476 -3.865 584 HD2 ARG 73 1HD ARG 73 0.290 -6.204 -5.585 585 HD3 ARG 73 2HD ARG 73 1.412 -5.110 -6.404 586 HE ARG 73 HE ARG 73 2.438 -7.726 -6.508 587 HH11 ARG 73 2HH1 ARG 73 -0.147 -5.793 -7.812 588 HH12 ARG 73 1HH1 ARG 73 -0.265 -6.707 -9.279 589 HH21 ARG 73 1HH2 ARG 73 1.123 -8.495 -9.632 590 HH22 ARG 73 2HH2 ARG 73 2.293 -8.936 -8.435 591 H PHE 74 H PHE 74 4.127 -2.628 -4.000 592 HA PHE 74 HA PHE 74 3.115 -2.132 -1.304 593 HB2 PHE 74 1HB PHE 74 3.918 -0.154 -3.455 594 HB3 PHE 74 2HB PHE 74 3.540 0.228 -1.774 595 HD1 PHE 74 2HD PHE 74 4.954 -1.560 -0.139 596 HD2 PHE 74 1HD PHE 74 6.165 0.091 -3.871 597 HE1 PHE 74 2HE PHE 74 7.312 -1.877 0.489 598 HE2 PHE 74 1HE PHE 74 8.524 -0.224 -3.249 599 HZ PHE 74 HZ PHE 74 9.100 -1.208 -1.066 600 H VAL 75 H VAL 75 1.161 -1.107 -0.889 601 HA VAL 75 HA VAL 75 -0.621 -0.526 -3.123 602 HB VAL 75 HB VAL 75 -1.447 -2.427 -0.926 603 HG11 VAL 75 1HG1 VAL 75 -3.090 -2.374 -3.299 604 HG12 VAL 75 2HG1 VAL 75 -3.545 -2.141 -1.611 605 HG13 VAL 75 3HG1 VAL 75 -2.974 -0.774 -2.568 606 HG21 VAL 75 3HG2 VAL 75 -1.311 -4.207 -2.471 607 HG22 VAL 75 1HG2 VAL 75 -1.054 -3.110 -3.828 608 HG23 VAL 75 2HG2 VAL 75 0.212 -3.330 -2.620 609 H VAL 76 H VAL 76 -1.592 1.346 -2.744 610 HA VAL 76 HA VAL 76 -1.906 2.229 0.049 611 HB VAL 76 HB VAL 76 -1.538 3.812 -2.489 612 HG11 VAL 76 1HG1 VAL 76 -3.290 4.912 -1.258 613 HG12 VAL 76 2HG1 VAL 76 -2.359 4.806 0.237 614 HG13 VAL 76 3HG1 VAL 76 -1.798 5.835 -1.081 615 HG21 VAL 76 3HG2 VAL 76 0.014 4.273 -0.002 616 HG22 VAL 76 1HG2 VAL 76 0.352 2.805 -0.920 617 HG23 VAL 76 2HG2 VAL 76 0.517 4.384 -1.689 618 H TYR 77 H TYR 77 -3.924 1.511 0.565 619 HA TYR 77 HA TYR 77 -6.140 2.024 -1.260 620 HB2 TYR 77 1HB TYR 77 -5.916 -0.180 -0.113 621 HB3 TYR 77 2HB TYR 77 -6.165 0.641 1.430 622 HD1 TYR 77 2HD TYR 77 -7.911 1.086 -1.838 623 HD2 TYR 77 1HD TYR 77 -8.221 -0.058 2.249 624 HE1 TYR 77 2HE TYR 77 -10.348 0.864 -2.090 625 HE2 TYR 77 1HE TYR 77 -10.658 -0.283 2.007 626 HH TYR 77 HH TYR 77 -12.260 0.334 -1.105 627 H SER 78 H SER 78 -7.741 3.478 -0.908 628 HA SER 78 HA SER 78 -7.484 5.184 1.482 629 HB2 SER 78 1HB SER 78 -6.854 6.344 -0.612 630 HB3 SER 78 2HB SER 78 -8.461 5.988 -1.270 631 HG SER 78 HG SER 78 -8.249 7.315 1.195 632 H TYR 79 H TYR 79 -9.003 4.277 2.790 633 HA TYR 79 HA TYR 79 -11.628 3.603 1.775 634 HB2 TYR 79 1HB TYR 79 -10.641 2.151 3.446 635 HB3 TYR 79 2HB TYR 79 -10.459 3.506 4.562 636 HD1 TYR 79 2HD TYR 79 -12.388 4.456 5.726 637 HD2 TYR 79 1HD TYR 79 -12.817 1.114 3.128 638 HE1 TYR 79 2HE TYR 79 -14.611 4.010 6.677 639 HE2 TYR 79 1HE TYR 79 -15.042 0.659 4.072 640 HH TYR 79 HH TYR 79 -16.878 2.239 5.301 641 H LYS 80 H LYS 80 -13.582 4.393 2.964 642 HA LYS 80 HA LYS 80 -13.297 7.252 3.624 643 HB2 LYS 80 1HB LYS 80 -14.427 7.152 1.547 644 HB3 LYS 80 2HB LYS 80 -15.447 5.808 2.084 645 HG2 LYS 80 1HG LYS 80 -16.443 7.399 3.785 646 HG3 LYS 80 2HG LYS 80 -15.608 8.692 2.906 647 HD2 LYS 80 1HD LYS 80 -17.029 8.613 1.150 648 HD3 LYS 80 2HD LYS 80 -17.177 6.849 1.229 649 HE2 LYS 80 1HE LYS 80 -18.408 7.695 3.563 650 HE3 LYS 80 2HE LYS 80 -18.882 8.913 2.370 651 HZ1 LYS 80 3HZ LYS 80 -20.252 6.728 2.658 652 HZ2 LYS 80 1HZ LYS 80 -19.077 6.083 1.626 653 HZ3 LYS 80 2HZ LYS 80 -20.017 7.395 1.122 654 H TYR 81 H TYR 81 -13.500 7.447 5.761 655 HA TYR 81 HA TYR 81 -15.464 5.776 7.164 656 HB2 TYR 81 1HB TYR 81 -12.847 6.267 7.773 657 HB3 TYR 81 2HB TYR 81 -13.665 7.479 8.761 658 HD1 TYR 81 2HD TYR 81 -15.976 6.360 9.852 659 HD2 TYR 81 1HD TYR 81 -12.315 4.372 8.987 660 HE1 TYR 81 2HE TYR 81 -16.502 4.662 11.553 661 HE2 TYR 81 1HE TYR 81 -12.831 2.669 10.684 662 HH TYR 81 HH TYR 81 -15.676 2.943 12.755 663 H VAL 82 H VAL 82 -17.221 6.628 8.108 664 HA VAL 82 HA VAL 82 -17.594 9.535 7.892 665 HB VAL 82 HB VAL 82 -19.231 7.981 6.756 666 HG11 VAL 82 1HG1 VAL 82 -19.189 6.487 8.927 667 HG12 VAL 82 2HG1 VAL 82 -20.521 7.544 9.401 668 HG13 VAL 82 3HG1 VAL 82 -20.631 6.595 7.918 669 HG21 VAL 82 3HG2 VAL 82 -20.931 9.489 7.021 670 HG22 VAL 82 1HG2 VAL 82 -20.740 9.561 8.772 671 HG23 VAL 82 2HG2 VAL 82 -19.603 10.411 7.726 672 H HIS 83 H HIS 83 -18.891 10.572 9.615 673 HA HIS 83 HA HIS 83 -18.089 9.525 12.240 674 HB2 HIS 83 1HB HIS 83 -18.814 12.323 11.341 675 HB3 HIS 83 2HB HIS 83 -18.490 11.880 13.020 676 HD1 HIS 83 1HD HIS 83 -16.218 12.551 13.683 677 HD2 HIS 83 2HD HIS 83 -16.353 11.322 9.717 678 HE1 HIS 83 1HE HIS 83 -13.858 12.750 12.837 679 HE2 HIS 83 2HE HIS 83 -13.939 11.999 10.413 680 H ASP 84 H ASP 84 -20.661 11.809 11.401 681 HA ASP 84 HA ASP 84 -22.902 10.276 11.569 682 HB2 ASP 84 1HB ASP 84 -21.573 10.441 14.152 683 HB3 ASP 84 2HB ASP 84 -23.219 11.085 14.222 684 H ASP 85 H ASP 85 -21.631 13.144 13.261 685 HA ASP 85 HA ASP 85 -23.961 14.677 13.154 686 HB2 ASP 85 1HB ASP 85 -21.488 15.025 14.229 687 HB3 ASP 85 2HB ASP 85 -21.417 16.153 12.870 688 H GLY 86 H GLY 86 -21.947 13.671 10.634 689 HA2 GLY 86 1HA GLY 86 -22.979 14.096 8.399 690 HA3 GLY 86 2HA GLY 86 -23.022 15.788 8.873 691 H ARG 87 H ARG 87 -20.283 13.931 9.828 692 HA ARG 87 HA ARG 87 -18.694 15.229 7.712 693 HB2 ARG 87 1HB ARG 87 -17.984 14.625 10.589 694 HB3 ARG 87 2HB ARG 87 -16.801 15.130 9.373 695 HG2 ARG 87 1HG ARG 87 -19.232 16.757 10.107 696 HG3 ARG 87 2HG ARG 87 -17.638 16.959 10.854 697 HD2 ARG 87 1HD ARG 87 -16.642 17.548 8.738 698 HD3 ARG 87 2HD ARG 87 -18.148 17.166 7.891 699 HE ARG 87 HE ARG 87 -18.465 19.198 9.891 700 HH11 ARG 87 2HH1 ARG 87 -17.540 18.562 6.596 701 HH12 ARG 87 1HH1 ARG 87 -17.899 20.166 6.048 702 HH21 ARG 87 1HH2 ARG 87 -18.695 21.730 7.520 703 HH22 ARG 87 2HH2 ARG 87 -18.942 21.313 9.182 704 H VAL 88 H VAL 88 -17.390 13.989 6.493 705 HA VAL 88 HA VAL 88 -16.767 11.265 7.365 706 HB VAL 88 HB VAL 88 -18.763 10.994 6.011 707 HG11 VAL 88 1HG1 VAL 88 -17.460 11.991 3.545 708 HG12 VAL 88 2HG1 VAL 88 -19.162 11.994 4.011 709 HG13 VAL 88 3HG1 VAL 88 -18.061 13.197 4.682 710 HG21 VAL 88 3HG2 VAL 88 -17.620 9.110 5.556 711 HG22 VAL 88 1HG2 VAL 88 -17.428 9.827 3.957 712 HG23 VAL 88 2HG2 VAL 88 -16.141 9.983 5.153 713 H SER 89 H SER 89 -14.663 10.933 7.150 714 HA SER 89 HA SER 89 -13.217 12.394 5.037 715 HB2 SER 89 1HB SER 89 -12.120 11.482 7.714 716 HB3 SER 89 2HB SER 89 -11.266 12.438 6.490 717 HG SER 89 HG SER 89 -12.031 14.063 7.591 718 H TYR 90 H TYR 90 -11.328 11.317 4.155 719 HA TYR 90 HA TYR 90 -11.696 8.400 4.089 720 HB2 TYR 90 1HB TYR 90 -10.027 9.792 2.048 721 HB3 TYR 90 2HB TYR 90 -11.093 8.396 1.872 722 HD1 TYR 90 2HD TYR 90 -13.689 9.070 2.486 723 HD2 TYR 90 1HD TYR 90 -10.721 11.648 0.859 724 HE1 TYR 90 2HE TYR 90 -15.455 10.501 1.546 725 HE2 TYR 90 1HE TYR 90 -12.478 13.086 -0.085 726 HH TYR 90 HH TYR 90 -14.712 13.569 0.012 727 HA PRO 91 HA PRO 91 -7.786 8.682 6.398 728 HB2 PRO 91 2HB PRO 91 -8.834 7.659 8.168 729 HB3 PRO 91 1HB PRO 91 -8.044 6.210 7.548 730 HG2 PRO 91 1HG PRO 91 -9.933 5.507 6.392 731 HG3 PRO 91 2HG PRO 91 -10.680 6.285 7.837 732 HD2 PRO 91 1HD PRO 91 -11.357 6.960 5.297 733 HD3 PRO 91 2HD PRO 91 -11.338 8.132 6.625 734 H LEU 92 H LEU 92 -6.417 8.577 4.607 735 HA LEU 92 HA LEU 92 -6.140 6.231 3.009 736 HB2 LEU 92 1HB LEU 92 -5.001 8.908 3.131 737 HB3 LEU 92 2HB LEU 92 -3.794 7.675 2.727 738 HG LEU 92 HG LEU 92 -6.048 7.173 1.100 739 HD11 LEU 92 1HD1 LEU 92 -7.001 9.235 1.113 740 HD12 LEU 92 2HD1 LEU 92 -5.772 9.512 -0.121 741 HD13 LEU 92 3HD1 LEU 92 -5.497 10.054 1.534 742 HD21 LEU 92 3HD2 LEU 92 -4.235 8.252 -0.573 743 HD22 LEU 92 1HD2 LEU 92 -4.126 6.611 0.065 744 HD23 LEU 92 2HD2 LEU 92 -3.208 7.914 0.822 745 H CYS 93 H CYS 93 -4.910 4.483 3.311 746 HA CYS 93 HA CYS 93 -2.832 4.575 5.393 747 HB2 CYS 93 1HB CYS 93 -4.854 2.384 4.899 748 HB3 CYS 93 2HB CYS 93 -3.461 2.225 5.981 749 HG CYS 93 HG CYS 93 -6.160 4.274 6.415 750 H PHE 94 H PHE 94 -1.233 2.792 5.191 751 HA PHE 94 HA PHE 94 -0.686 2.273 2.350 752 HB2 PHE 94 1HB PHE 94 0.979 3.629 3.640 753 HB3 PHE 94 2HB PHE 94 1.261 2.219 4.662 754 HD1 PHE 94 2HD PHE 94 1.445 3.366 1.140 755 HD2 PHE 94 1HD PHE 94 2.790 0.572 4.056 756 HE1 PHE 94 2HE PHE 94 3.128 2.527 -0.446 757 HE2 PHE 94 1HE PHE 94 4.476 -0.271 2.474 758 HZ PHE 94 HZ PHE 94 4.646 0.706 0.220 759 H ILE 95 H ILE 95 -1.472 0.322 1.831 760 HA ILE 95 HA ILE 95 -1.246 -1.891 3.720 761 HB ILE 95 HB ILE 95 -2.607 -1.746 1.027 762 HG12 ILE 95 1HG1 ILE 95 -3.755 -1.840 3.829 763 HG13 ILE 95 2HG1 ILE 95 -3.659 -0.388 2.817 764 HG21 ILE 95 1HG2 ILE 95 -3.648 -3.903 1.750 765 HG22 ILE 95 2HG2 ILE 95 -1.924 -4.000 1.396 766 HG23 ILE 95 3HG2 ILE 95 -2.480 -3.955 3.069 767 HD11 ILE 95 3HD1 ILE 95 -5.352 -2.826 2.389 768 HD12 ILE 95 1HD1 ILE 95 -5.866 -1.154 2.616 769 HD13 ILE 95 2HD1 ILE 95 -5.061 -1.635 1.122 770 H PHE 96 H PHE 96 0.656 -2.902 3.720 771 HA PHE 96 HA PHE 96 2.211 -3.133 1.274 772 HB2 PHE 96 1HB PHE 96 3.378 -2.518 3.327 773 HB3 PHE 96 2HB PHE 96 2.815 -3.996 4.110 774 HD1 PHE 96 1HD PHE 96 3.629 -4.470 0.673 775 HD2 PHE 96 2HD PHE 96 5.297 -4.293 4.585 776 HE1 PHE 96 1HE PHE 96 5.619 -5.677 -0.125 777 HE2 PHE 96 2HE PHE 96 7.290 -5.499 3.793 778 HZ PHE 96 HZ PHE 96 7.453 -6.192 1.436 779 H SER 97 H SER 97 1.576 -4.694 -0.073 780 HA SER 97 HA SER 97 0.376 -7.134 0.863 781 HB2 SER 97 1HB SER 97 -0.209 -5.924 -1.302 782 HB3 SER 97 2HB SER 97 1.316 -6.554 -1.948 783 HG SER 97 HG SER 97 0.107 -8.213 -2.439 784 H SER 98 H SER 98 1.766 -8.409 1.973 785 HA SER 98 HA SER 98 4.085 -9.428 0.485 786 HB2 SER 98 1HB SER 98 5.501 -9.361 2.421 787 HB3 SER 98 2HB SER 98 4.780 -7.752 2.240 788 HG SER 98 HG SER 98 3.087 -8.828 3.742 789 HA PRO 99 HA PRO 99 1.559 -13.007 1.731 790 HB2 PRO 99 2HB PRO 99 1.115 -13.392 -0.490 791 HB3 PRO 99 1HB PRO 99 2.402 -14.587 -0.341 792 HG2 PRO 99 1HG PRO 99 4.019 -13.160 -1.205 793 HG3 PRO 99 2HG PRO 99 2.567 -12.654 -2.150 794 HD2 PRO 99 1HD PRO 99 4.086 -10.898 -0.741 795 HD3 PRO 99 2HD PRO 99 2.334 -10.710 -0.933 796 H VAL 100 H VAL 100 2.268 -15.383 1.944 797 HA VAL 100 HA VAL 100 4.950 -15.413 3.150 798 HB VAL 100 HB VAL 100 2.881 -15.949 4.552 799 HG11 VAL 100 1HG1 VAL 100 2.981 -18.746 3.698 800 HG12 VAL 100 2HG1 VAL 100 1.597 -17.736 4.123 801 HG13 VAL 100 3HG1 VAL 100 2.287 -17.652 2.502 802 HG21 VAL 100 3HG2 VAL 100 5.444 -17.374 4.394 803 HG22 VAL 100 1HG2 VAL 100 4.684 -16.549 5.755 804 HG23 VAL 100 2HG2 VAL 100 4.197 -18.191 5.335 805 H GLY 101 H GLY 101 3.754 -16.094 0.288 806 HA2 GLY 101 1HA GLY 101 5.164 -18.676 0.026 807 HA3 GLY 101 2HA GLY 101 3.842 -18.163 -1.012 808 H CYS 102 H CYS 102 5.704 -15.501 -0.438 809 HA CYS 102 HA CYS 102 6.841 -15.612 -3.090 810 HB2 CYS 102 1HB CYS 102 7.703 -13.298 -2.428 811 HB3 CYS 102 2HB CYS 102 5.949 -13.504 -2.555 812 HG CYS 102 HG CYS 102 7.350 -13.906 0.502 813 H LYS 103 H LYS 103 9.158 -14.610 -3.263 814 HA LYS 103 HA LYS 103 10.897 -16.371 -1.722 815 HB2 LYS 103 1HB LYS 103 11.834 -14.538 -3.910 816 HB3 LYS 103 2HB LYS 103 12.490 -16.105 -3.410 817 HG2 LYS 103 1HG LYS 103 11.291 -17.160 -4.943 818 HG3 LYS 103 2HG LYS 103 9.797 -16.453 -4.302 819 HD2 LYS 103 1HD LYS 103 10.011 -15.843 -6.625 820 HD3 LYS 103 2HD LYS 103 10.249 -14.402 -5.622 821 HE2 LYS 103 1HE LYS 103 12.038 -14.130 -7.007 822 HE3 LYS 103 2HE LYS 103 12.789 -15.182 -5.798 823 HZ1 LYS 103 3HZ LYS 103 11.464 -16.704 -7.805 824 HZ2 LYS 103 1HZ LYS 103 13.079 -16.766 -7.304 825 HZ3 LYS 103 2HZ LYS 103 12.604 -15.660 -8.492 826 HA PRO 104 HA PRO 104 12.432 -13.228 0.941 827 HB2 PRO 104 2HB PRO 104 13.445 -14.918 2.122 828 HB3 PRO 104 1HB PRO 104 14.928 -14.228 1.464 829 HG2 PRO 104 1HG PRO 104 15.037 -15.765 -0.276 830 HG3 PRO 104 2HG PRO 104 14.328 -16.777 1.038 831 HD2 PRO 104 1HD PRO 104 13.172 -16.527 -1.406 832 HD3 PRO 104 2HD PRO 104 12.231 -16.720 0.083 833 H GLU 105 H GLU 105 13.856 -13.915 -2.098 834 HA GLU 105 HA GLU 105 15.948 -11.961 -1.979 835 HB2 GLU 105 1HB GLU 105 15.193 -14.047 -3.716 836 HB3 GLU 105 2HB GLU 105 15.114 -12.558 -4.672 837 HG2 GLU 105 1HG GLU 105 17.516 -12.599 -3.082 838 HG3 GLU 105 2HG GLU 105 17.379 -14.070 -4.058 839 H GLN 106 H GLN 106 12.618 -12.027 -3.092 840 HA GLN 106 HA GLN 106 12.808 -9.327 -4.156 841 HB2 GLN 106 1HB GLN 106 10.243 -10.864 -3.897 842 HB3 GLN 106 2HB GLN 106 10.713 -9.671 -5.118 843 HG2 GLN 106 1HG GLN 106 12.052 -12.356 -4.902 844 HG3 GLN 106 2HG GLN 106 10.586 -12.093 -5.858 845 HE21 GLN 106 2HE2 GLN 106 12.307 -9.822 -8.125 846 HE22 GLN 106 1HE2 GLN 106 10.895 -9.829 -7.130 847 H GLN 107 H GLN 107 10.772 -11.008 -1.755 848 HA GLN 107 HA GLN 107 9.341 -9.041 -0.650 849 HB2 GLN 107 1HB GLN 107 10.241 -11.555 0.204 850 HB3 GLN 107 2HB GLN 107 10.646 -10.440 1.518 851 HG2 GLN 107 1HG GLN 107 7.950 -10.050 0.460 852 HG3 GLN 107 2HG GLN 107 8.226 -11.657 1.147 853 HE21 GLN 107 2HE2 GLN 107 8.394 -8.355 3.555 854 HE22 GLN 107 1HE2 GLN 107 8.658 -8.220 1.853 855 H MET 108 H MET 108 12.797 -9.534 -0.088 856 HA MET 108 HA MET 108 13.140 -7.534 1.857 857 HB2 MET 108 1HB MET 108 14.952 -8.953 -0.059 858 HB3 MET 108 2HB MET 108 15.564 -7.550 0.828 859 HG2 MET 108 1HG MET 108 14.486 -8.905 2.877 860 HG3 MET 108 2HG MET 108 14.871 -10.249 1.799 861 HE1 MET 108 3HE MET 108 17.836 -8.824 0.436 862 HE2 MET 108 1HE MET 108 18.621 -10.130 1.324 863 HE3 MET 108 2HE MET 108 17.058 -10.403 0.555 864 H MET 109 H MET 109 13.422 -7.438 -1.677 865 HA MET 109 HA MET 109 14.379 -4.878 -2.027 866 HB2 MET 109 1HB MET 109 12.401 -6.470 -3.661 867 HB3 MET 109 2HB MET 109 13.047 -4.910 -4.191 868 HG2 MET 109 1HG MET 109 15.269 -5.756 -4.304 869 HG3 MET 109 2HG MET 109 14.793 -7.251 -3.493 870 HE1 MET 109 3HE MET 109 13.559 -6.067 -7.763 871 HE2 MET 109 1HE MET 109 12.489 -5.653 -6.422 872 HE3 MET 109 2HE MET 109 14.119 -4.981 -6.489 873 H TYR 110 H TYR 110 11.096 -5.925 -1.311 874 HA TYR 110 HA TYR 110 10.085 -3.203 -1.477 875 HB2 TYR 110 1HB TYR 110 8.642 -5.725 -0.625 876 HB3 TYR 110 2HB TYR 110 7.903 -4.179 -1.049 877 HD1 TYR 110 1HD TYR 110 9.977 -6.910 -2.499 878 HD2 TYR 110 2HD TYR 110 7.246 -3.734 -3.244 879 HE1 TYR 110 1HE TYR 110 9.809 -7.614 -4.850 880 HE2 TYR 110 2HE TYR 110 7.069 -4.429 -5.596 881 HH TYR 110 HH TYR 110 7.610 -5.984 -7.102 882 H ALA 111 H ALA 111 10.939 -5.599 0.931 883 HA ALA 111 HA ALA 111 9.774 -4.294 3.163 884 HB1 ALA 111 3HB ALA 111 11.341 -6.646 2.681 885 HB2 ALA 111 1HB ALA 111 11.984 -5.768 4.069 886 HB3 ALA 111 2HB ALA 111 10.291 -6.263 4.045 887 H GLY 112 H GLY 112 12.763 -3.880 1.430 888 HA2 GLY 112 1HA GLY 112 13.905 -2.213 3.537 889 HA3 GLY 112 2HA GLY 112 14.694 -2.683 2.038 890 H SER 113 H SER 113 12.321 -1.879 0.448 891 HA SER 113 HA SER 113 12.959 0.971 0.340 892 HB2 SER 113 1HB SER 113 11.354 -0.668 -1.643 893 HB3 SER 113 2HB SER 113 12.053 0.941 -1.895 894 HG SER 113 HG SER 113 13.442 -1.507 -1.554 895 H LYS 114 H LYS 114 10.589 -1.050 1.575 896 HA LYS 114 HA LYS 114 8.175 0.168 1.083 897 HB2 LYS 114 1HB LYS 114 8.210 -1.839 2.355 898 HB3 LYS 114 2HB LYS 114 9.240 -1.111 3.598 899 HG2 LYS 114 1HG LYS 114 7.433 0.334 4.318 900 HG3 LYS 114 2HG LYS 114 6.399 -0.295 3.022 901 HD2 LYS 114 1HD LYS 114 5.657 -1.696 4.631 902 HD3 LYS 114 2HD LYS 114 7.123 -2.604 4.226 903 HE2 LYS 114 1HE LYS 114 8.332 -1.664 6.053 904 HE3 LYS 114 2HE LYS 114 7.064 -0.464 6.342 905 HZ1 LYS 114 3HZ LYS 114 5.800 -2.896 6.524 906 HZ2 LYS 114 1HZ LYS 114 6.225 -1.879 7.807 907 HZ3 LYS 114 2HZ LYS 114 7.270 -3.120 7.330 908 H ASN 115 H ASN 115 10.331 0.924 3.827 909 HA ASN 115 HA ASN 115 8.935 3.087 4.837 910 HB2 ASN 115 1HB ASN 115 11.878 2.420 4.817 911 HB3 ASN 115 2HB ASN 115 11.264 3.871 5.619 912 HD21 ASN 115 2HD2 ASN 115 10.545 0.182 7.196 913 HD22 ASN 115 1HD2 ASN 115 11.054 0.366 5.555 914 H ARG 116 H ARG 116 11.321 2.996 2.233 915 HA ARG 116 HA ARG 116 11.558 5.772 1.854 916 HB2 ARG 116 1HB ARG 116 13.165 4.218 0.908 917 HB3 ARG 116 2HB ARG 116 11.906 3.503 -0.112 918 HG2 ARG 116 1HG ARG 116 13.121 4.907 -1.541 919 HG3 ARG 116 2HG ARG 116 11.643 5.802 -1.152 920 HD2 ARG 116 1HD ARG 116 13.173 7.467 -0.807 921 HD3 ARG 116 2HD ARG 116 13.152 6.743 0.807 922 HE ARG 116 HE ARG 116 15.115 5.516 -0.842 923 HH11 ARG 116 2HH1 ARG 116 14.456 8.373 1.035 924 HH12 ARG 116 1HH1 ARG 116 16.126 8.708 1.352 925 HH21 ARG 116 1HH2 ARG 116 17.753 7.328 0.516 926 HH22 ARG 116 2HH2 ARG 116 17.317 5.947 -0.432 927 H LEU 117 H LEU 117 9.605 3.394 0.050 928 HA LEU 117 HA LEU 117 8.280 5.216 -1.595 929 HB2 LEU 117 1HB LEU 117 8.307 2.768 -1.922 930 HB3 LEU 117 2HB LEU 117 7.232 2.600 -0.523 931 HG LEU 117 HG LEU 117 6.077 2.382 -2.705 932 HD11 LEU 117 1HD1 LEU 117 5.001 4.867 -1.486 933 HD12 LEU 117 2HD1 LEU 117 5.141 3.432 -0.470 934 HD13 LEU 117 3HD1 LEU 117 4.174 3.377 -1.944 935 HD21 LEU 117 3HD2 LEU 117 7.616 4.282 -3.668 936 HD22 LEU 117 1HD2 LEU 117 6.313 5.325 -3.098 937 HD23 LEU 117 2HD2 LEU 117 5.974 4.052 -4.271 938 H VAL 118 H VAL 118 7.331 3.897 1.562 939 HA VAL 118 HA VAL 118 4.843 5.186 1.747 940 HB VAL 118 HB VAL 118 6.724 4.254 3.915 941 HG11 VAL 118 1HG1 VAL 118 4.062 4.372 4.851 942 HG12 VAL 118 2HG1 VAL 118 5.459 5.292 5.414 943 HG13 VAL 118 3HG1 VAL 118 4.433 5.939 4.133 944 HG21 VAL 118 3HG2 VAL 118 4.879 2.483 4.104 945 HG22 VAL 118 1HG2 VAL 118 4.363 3.045 2.514 946 HG23 VAL 118 2HG2 VAL 118 5.981 2.378 2.730 947 H GLN 119 H GLN 119 7.985 6.107 3.161 948 HA GLN 119 HA GLN 119 7.234 8.484 4.348 949 HB2 GLN 119 1HB GLN 119 9.800 7.474 3.181 950 HB3 GLN 119 2HB GLN 119 9.698 9.162 3.707 951 HG2 GLN 119 1HG GLN 119 8.628 7.377 5.716 952 HG3 GLN 119 2HG GLN 119 10.288 6.951 5.279 953 HE21 GLN 119 2HE2 GLN 119 10.540 9.350 8.016 954 HE22 GLN 119 1HE2 GLN 119 9.957 7.743 7.765 955 H THR 120 H THR 120 7.825 7.788 0.980 956 HA THR 120 HA THR 120 8.038 10.474 0.086 957 HB THR 120 HB THR 120 7.031 8.186 -1.597 958 HG1 THR 120 1HG THR 120 9.555 8.618 -0.476 959 HG21 THR 120 3HG2 THR 120 7.847 10.900 -2.085 960 HG22 THR 120 1HG2 THR 120 7.157 9.725 -3.204 961 HG23 THR 120 2HG2 THR 120 8.901 9.783 -2.950 962 H ALA 121 H ALA 121 5.332 8.191 0.285 963 HA ALA 121 HA ALA 121 3.438 10.027 -0.833 964 HB1 ALA 121 3HB ALA 121 3.408 7.278 0.188 965 HB2 ALA 121 1HB ALA 121 1.911 8.176 0.440 966 HB3 ALA 121 2HB ALA 121 2.565 7.990 -1.188 967 H GLU 122 H GLU 122 4.879 9.709 2.205 968 HA GLU 122 HA GLU 122 4.551 10.744 4.204 969 HB2 GLU 122 1HB GLU 122 3.820 12.584 2.322 970 HB3 GLU 122 2HB GLU 122 2.350 12.479 3.305 971 HG2 GLU 122 1HG GLU 122 5.117 13.062 4.363 972 HG3 GLU 122 2HG GLU 122 3.857 14.263 4.050 973 H LEU 123 H LEU 123 3.349 8.388 4.102 974 HA LEU 123 HA LEU 123 0.580 8.747 4.995 975 HB2 LEU 123 1HB LEU 123 2.090 6.198 4.393 976 HB3 LEU 123 2HB LEU 123 0.360 6.343 4.746 977 HG LEU 123 HG LEU 123 1.638 7.630 2.344 978 HD11 LEU 123 1HD1 LEU 123 1.219 5.764 1.045 979 HD12 LEU 123 2HD1 LEU 123 0.110 5.063 2.223 980 HD13 LEU 123 3HD1 LEU 123 1.846 5.056 2.534 981 HD21 LEU 123 3HD2 LEU 123 -0.377 8.598 2.299 982 HD22 LEU 123 1HD2 LEU 123 -1.047 7.472 3.480 983 HD23 LEU 123 2HD2 LEU 123 -0.972 7.021 1.776 984 H THR 124 H THR 124 0.355 9.087 7.101 985 HA THR 124 HA THR 124 2.324 8.302 9.022 986 HB THR 124 HB THR 124 1.142 10.305 9.509 987 HG1 THR 124 1HG THR 124 -0.143 8.490 11.253 988 HG21 THR 124 3HG2 THR 124 -1.324 8.649 9.054 989 HG22 THR 124 1HG2 THR 124 -0.852 10.160 8.278 990 HG23 THR 124 2HG2 THR 124 -1.381 10.160 9.960 991 H LYS 125 H LYS 125 -0.304 6.728 7.576 992 HA LYS 125 HA LYS 125 -0.414 4.753 9.761 993 HB2 LYS 125 1HB LYS 125 -2.471 5.263 7.597 994 HB3 LYS 125 2HB LYS 125 -2.622 4.123 8.944 995 HG2 LYS 125 1HG LYS 125 -2.395 6.119 10.494 996 HG3 LYS 125 2HG LYS 125 -2.617 7.124 9.051 997 HD2 LYS 125 1HD LYS 125 -4.583 4.936 9.502 998 HD3 LYS 125 2HD LYS 125 -4.659 6.342 10.577 999 HE2 LYS 125 1HE LYS 125 -4.344 7.121 7.789 1000 HE3 LYS 125 2HE LYS 125 -5.787 6.131 8.053 1001 HZ1 LYS 125 3HZ LYS 125 -5.692 7.970 10.129 1002 HZ2 LYS 125 1HZ LYS 125 -6.785 7.927 8.838 1003 HZ3 LYS 125 2HZ LYS 125 -5.366 8.839 8.714 1004 H VAL 126 H VAL 126 0.685 2.961 9.354 1005 HA VAL 126 HA VAL 126 0.687 1.895 6.612 1006 HB VAL 126 HB VAL 126 3.089 1.762 8.429 1007 HG11 VAL 126 1HG1 VAL 126 2.364 0.444 6.021 1008 HG12 VAL 126 2HG1 VAL 126 3.703 1.539 5.668 1009 HG13 VAL 126 3HG1 VAL 126 3.868 0.321 6.933 1010 HG21 VAL 126 3HG2 VAL 126 4.058 3.447 6.795 1011 HG22 VAL 126 1HG2 VAL 126 2.398 3.752 6.284 1012 HG23 VAL 126 2HG2 VAL 126 2.879 4.063 7.952 1013 H PHE 127 H PHE 127 0.015 -0.142 6.502 1014 HA PHE 127 HA PHE 127 0.210 -1.817 8.918 1015 HB2 PHE 127 1HB PHE 127 -2.042 -1.831 6.889 1016 HB3 PHE 127 2HB PHE 127 -1.932 -2.840 8.333 1017 HD1 PHE 127 1HD PHE 127 -1.098 -1.007 10.410 1018 HD2 PHE 127 2HD PHE 127 -3.843 -0.413 7.212 1019 HE1 PHE 127 1HE PHE 127 -2.259 0.714 11.731 1020 HE2 PHE 127 2HE PHE 127 -5.008 1.309 8.527 1021 HZ PHE 127 HZ PHE 127 -4.216 1.875 10.789 1022 H GLU 128 H GLU 128 0.379 -4.105 8.550 1023 HA GLU 128 HA GLU 128 1.415 -4.785 5.876 1024 HB2 GLU 128 1HB GLU 128 3.147 -4.564 7.730 1025 HB3 GLU 128 2HB GLU 128 2.408 -6.005 8.448 1026 HG2 GLU 128 1HG GLU 128 3.188 -6.178 5.593 1027 HG3 GLU 128 2HG GLU 128 4.488 -6.118 6.791 1028 H ILE 129 H ILE 129 0.191 -6.243 4.900 1029 HA ILE 129 HA ILE 129 -1.533 -7.982 6.497 1030 HB ILE 129 HB ILE 129 -2.456 -8.588 4.175 1031 HG12 ILE 129 1HG1 ILE 129 -1.317 -5.937 3.351 1032 HG13 ILE 129 2HG1 ILE 129 -0.356 -7.409 3.133 1033 HG21 ILE 129 1HG2 ILE 129 -3.474 -7.062 5.920 1034 HG22 ILE 129 2HG2 ILE 129 -2.816 -5.718 4.989 1035 HG23 ILE 129 3HG2 ILE 129 -3.997 -6.803 4.256 1036 HD11 ILE 129 3HD1 ILE 129 -3.134 -7.093 2.037 1037 HD12 ILE 129 1HD1 ILE 129 -1.673 -6.697 1.132 1038 HD13 ILE 129 2HD1 ILE 129 -1.958 -8.354 1.666 1039 H ARG 130 H ARG 130 -0.932 -9.989 6.933 1040 HA ARG 130 HA ARG 130 1.383 -11.185 5.827 1041 HB2 ARG 130 1HB ARG 130 0.641 -11.711 8.081 1042 HB3 ARG 130 2HB ARG 130 -0.864 -12.394 7.446 1043 HG2 ARG 130 1HG ARG 130 0.722 -14.141 8.086 1044 HG3 ARG 130 2HG ARG 130 0.367 -14.172 6.350 1045 HD2 ARG 130 1HD ARG 130 2.455 -13.257 5.776 1046 HD3 ARG 130 2HD ARG 130 2.743 -12.692 7.428 1047 HE ARG 130 HE ARG 130 3.422 -15.230 6.376 1048 HH11 ARG 130 2HH1 ARG 130 2.238 -13.684 9.262 1049 HH12 ARG 130 1HH1 ARG 130 2.879 -14.890 10.328 1050 HH21 ARG 130 1HH2 ARG 130 4.035 -16.676 9.477 1051 HH22 ARG 130 2HH2 ARG 130 4.270 -16.825 7.769 1052 H THR 131 H THR 131 -1.684 -10.827 4.570 1053 HA THR 131 HA THR 131 -1.179 -12.285 2.243 1054 HB THR 131 HB THR 131 -1.421 -14.299 3.565 1055 HG1 THR 131 1HG THR 131 -3.781 -13.836 2.030 1056 HG21 THR 131 3HG2 THR 131 -4.249 -13.560 4.234 1057 HG22 THR 131 1HG2 THR 131 -2.920 -13.080 5.288 1058 HG23 THR 131 2HG2 THR 131 -3.218 -14.788 4.966 1059 H THR 132 H THR 132 -2.803 -12.036 0.687 1060 HA THR 132 HA THR 132 -4.322 -9.772 0.719 1061 HB THR 132 HB THR 132 -5.731 -10.819 -1.072 1062 HG1 THR 132 1HG THR 132 -5.806 -12.953 -0.570 1063 HG21 THR 132 3HG2 THR 132 -4.087 -10.563 -2.630 1064 HG22 THR 132 1HG2 THR 132 -2.939 -11.567 -1.746 1065 HG23 THR 132 2HG2 THR 132 -3.229 -9.903 -1.238 1066 H ASP 133 H ASP 133 -5.448 -13.044 1.544 1067 HA ASP 133 HA ASP 133 -8.091 -12.681 1.985 1068 HB2 ASP 133 1HB ASP 133 -6.033 -14.284 3.469 1069 HB3 ASP 133 2HB ASP 133 -7.699 -14.241 4.061 1070 H ASP 134 H ASP 134 -5.481 -11.662 4.137 1071 HA ASP 134 HA ASP 134 -6.992 -10.852 6.328 1072 HB2 ASP 134 1HB ASP 134 -4.312 -10.742 5.578 1073 HB3 ASP 134 2HB ASP 134 -4.772 -9.048 5.785 1074 H LEU 135 H LEU 135 -6.167 -9.096 3.371 1075 HA LEU 135 HA LEU 135 -7.218 -6.601 4.107 1076 HB2 LEU 135 1HB LEU 135 -5.809 -6.668 2.224 1077 HB3 LEU 135 2HB LEU 135 -6.777 -7.939 1.457 1078 HG LEU 135 HG LEU 135 -8.440 -6.431 0.785 1079 HD11 LEU 135 1HD1 LEU 135 -8.167 -3.950 1.559 1080 HD12 LEU 135 2HD1 LEU 135 -7.313 -4.679 2.918 1081 HD13 LEU 135 3HD1 LEU 135 -8.988 -5.122 2.590 1082 HD21 LEU 135 3HD2 LEU 135 -6.952 -5.907 -0.809 1083 HD22 LEU 135 1HD2 LEU 135 -5.650 -5.646 0.352 1084 HD23 LEU 135 2HD2 LEU 135 -6.825 -4.367 0.042 1085 H THR 136 H THR 136 -9.185 -7.056 5.196 1086 HA THR 136 HA THR 136 -11.430 -7.595 3.365 1087 HB THR 136 HB THR 136 -12.590 -8.429 5.556 1088 HG1 THR 136 1HG THR 136 -9.902 -9.121 6.163 1089 HG21 THR 136 3HG2 THR 136 -11.064 -10.678 5.051 1090 HG22 THR 136 1HG2 THR 136 -10.953 -9.759 3.550 1091 HG23 THR 136 2HG2 THR 136 -12.532 -10.206 4.196 1092 H GLU 137 H GLU 137 -13.345 -6.439 3.729 1093 HA GLU 137 HA GLU 137 -13.246 -3.805 4.279 1094 HB2 GLU 137 1HB GLU 137 -15.228 -4.926 3.374 1095 HB3 GLU 137 2HB GLU 137 -15.561 -5.624 4.968 1096 HG2 GLU 137 1HG GLU 137 -15.434 -2.985 5.587 1097 HG3 GLU 137 2HG GLU 137 -16.084 -2.927 3.942 1098 H THR 138 H THR 138 -13.672 -6.370 6.663 1099 HA THR 138 HA THR 138 -14.018 -4.571 8.868 1100 HB THR 138 HB THR 138 -13.215 -7.475 9.048 1101 HG1 THR 138 1HG THR 138 -15.900 -6.642 9.163 1102 HG21 THR 138 3HG2 THR 138 -13.278 -6.997 11.232 1103 HG22 THR 138 1HG2 THR 138 -15.024 -6.843 11.049 1104 HG23 THR 138 2HG2 THR 138 -13.997 -5.414 10.940 1105 H TRP 139 H TRP 139 -11.440 -6.953 8.212 1106 HA TRP 139 HA TRP 139 -9.596 -6.205 10.053 1107 HB2 TRP 139 1HB TRP 139 -9.006 -8.053 8.757 1108 HB3 TRP 139 2HB TRP 139 -9.289 -7.200 7.239 1109 HD1 TRP 139 HD TRP 139 -6.550 -8.079 9.619 1110 HE1 TRP 139 1HE TRP 139 -4.341 -7.005 8.852 1111 HE3 TRP 139 3HE TRP 139 -8.384 -4.908 6.052 1112 HZ2 TRP 139 2HZ TRP 139 -3.488 -5.069 6.983 1113 HZ3 TRP 139 3HZ TRP 139 -6.805 -3.478 4.821 1114 HH2 TRP 139 HH TRP 139 -4.408 -3.558 5.278 1115 H LEU 140 H LEU 140 -10.595 -4.385 7.293 1116 HA LEU 140 HA LEU 140 -8.326 -2.591 7.364 1117 HB2 LEU 140 1HB LEU 140 -9.209 -2.947 5.213 1118 HB3 LEU 140 2HB LEU 140 -10.871 -2.694 5.776 1119 HG LEU 140 HG LEU 140 -9.678 -0.873 4.342 1120 HD11 LEU 140 1HD1 LEU 140 -11.840 -0.887 5.995 1121 HD12 LEU 140 2HD1 LEU 140 -11.363 0.462 4.965 1122 HD13 LEU 140 3HD1 LEU 140 -10.887 0.438 6.663 1123 HD21 LEU 140 3HD2 LEU 140 -7.780 -0.928 6.177 1124 HD22 LEU 140 1HD2 LEU 140 -8.847 0.227 6.977 1125 HD23 LEU 140 2HD2 LEU 140 -8.230 0.570 5.360 1126 H LYS 141 H LYS 141 -11.843 -2.165 7.802 1127 HA LYS 141 HA LYS 141 -11.709 0.418 8.867 1128 HB2 LYS 141 1HB LYS 141 -13.720 -1.726 8.680 1129 HB3 LYS 141 2HB LYS 141 -13.955 -0.613 10.036 1130 HG2 LYS 141 1HG LYS 141 -14.527 1.121 8.712 1131 HG3 LYS 141 2HG LYS 141 -13.394 0.647 7.434 1132 HD2 LYS 141 1HD LYS 141 -15.229 0.019 6.300 1133 HD3 LYS 141 2HD LYS 141 -15.196 -1.402 7.358 1134 HE2 LYS 141 1HE LYS 141 -16.546 1.041 8.395 1135 HE3 LYS 141 2HE LYS 141 -17.353 0.141 7.102 1136 HZ1 LYS 141 3HZ LYS 141 -16.449 -1.707 8.993 1137 HZ2 LYS 141 1HZ LYS 141 -18.047 -1.309 8.601 1138 HZ3 LYS 141 2HZ LYS 141 -17.245 -0.473 9.833 1139 H GLU 142 H GLU 142 -10.966 -2.622 10.273 1140 HA GLU 142 HA GLU 142 -11.414 -1.956 12.998 1141 HB2 GLU 142 1HB GLU 142 -9.869 -4.086 11.559 1142 HB3 GLU 142 2HB GLU 142 -9.658 -3.874 13.304 1143 HG2 GLU 142 1HG GLU 142 -12.243 -4.004 13.399 1144 HG3 GLU 142 2HG GLU 142 -12.087 -4.730 11.792 1145 H LYS 143 H LYS 143 -8.539 -1.886 10.921 1146 HA LYS 143 HA LYS 143 -6.738 -1.013 12.912 1147 HB2 LYS 143 1HB LYS 143 -6.604 -0.582 9.918 1148 HB3 LYS 143 2HB LYS 143 -5.252 -0.443 11.052 1149 HG2 LYS 143 1HG LYS 143 -6.589 -3.021 11.240 1150 HG3 LYS 143 2HG LYS 143 -5.951 -2.688 9.620 1151 HD2 LYS 143 1HD LYS 143 -3.854 -1.874 11.117 1152 HD3 LYS 143 2HD LYS 143 -4.522 -3.138 12.164 1153 HE2 LYS 143 1HE LYS 143 -4.232 -4.815 10.545 1154 HE3 LYS 143 2HE LYS 143 -4.053 -3.631 9.242 1155 HZ1 LYS 143 3HZ LYS 143 -1.953 -2.914 10.385 1156 HZ2 LYS 143 1HZ LYS 143 -1.912 -4.462 9.702 1157 HZ3 LYS 143 2HZ LYS 143 -2.099 -4.280 11.373 1158 H LEU 144 H LEU 144 -8.878 0.694 10.709 1159 HA LEU 144 HA LEU 144 -7.818 3.289 11.241 1160 HB2 LEU 144 1HB LEU 144 -10.608 2.698 10.276 1161 HB3 LEU 144 2HB LEU 144 -9.613 4.130 9.965 1162 HG LEU 144 HG LEU 144 -9.091 1.375 8.847 1163 HD11 LEU 144 1HD1 LEU 144 -10.237 3.842 7.547 1164 HD12 LEU 144 2HD1 LEU 144 -11.102 2.346 7.895 1165 HD13 LEU 144 3HD1 LEU 144 -9.794 2.352 6.712 1166 HD21 LEU 144 3HD2 LEU 144 -7.559 2.741 7.339 1167 HD22 LEU 144 1HD2 LEU 144 -7.019 2.469 8.995 1168 HD23 LEU 144 2HD2 LEU 144 -7.710 4.026 8.538 1169 H ALA 145 H ALA 145 -10.802 1.640 12.280 1170 HA ALA 145 HA ALA 145 -12.007 3.446 13.857 1171 HB1 ALA 145 3HB ALA 145 -11.519 0.635 14.819 1172 HB2 ALA 145 1HB ALA 145 -12.895 1.678 15.179 1173 HB3 ALA 145 2HB ALA 145 -12.669 1.047 13.547 1174 H SER 146 H SER 146 -9.781 1.146 15.417 1175 HA SER 146 HA SER 146 -8.169 3.115 16.648 1176 HB2 SER 146 1HB SER 146 -10.668 2.870 17.860 1177 HB3 SER 146 2HB SER 146 -9.594 1.890 18.874 1178 HG SER 146 HG SER 146 -8.848 3.680 19.651 1179 H GLY 147 H GLY 147 -6.802 1.447 15.642 1180 HA2 GLY 147 1HA GLY 147 -5.317 -0.291 15.834 1181 HA3 GLY 147 2HA GLY 147 -5.635 -0.238 17.562 1182 HA PRO 148 HA PRO 148 -7.683 -3.950 15.261 1183 HB2 PRO 148 2HB PRO 148 -5.967 -4.672 13.915 1184 HB3 PRO 148 1HB PRO 148 -5.652 -5.788 15.243 1185 HG2 PRO 148 1HG PRO 148 -3.989 -4.449 16.160 1186 HG3 PRO 148 2HG PRO 148 -3.756 -4.136 14.399 1187 HD2 PRO 148 1HD PRO 148 -4.108 -2.142 16.207 1188 HD3 PRO 148 2HD PRO 148 -4.713 -2.044 14.545 1189 H SER 149 H SER 149 -7.340 -6.419 16.201 1190 HA SER 149 HA SER 149 -7.666 -6.085 19.099 1191 HB2 SER 149 1HB SER 149 -8.990 -7.707 17.053 1192 HB3 SER 149 2HB SER 149 -8.514 -8.650 18.476 1193 HG SER 149 HG SER 149 -9.769 -6.181 18.876 1194 H SER 150 H SER 150 -5.931 -6.561 20.261 1195 HA SER 150 HA SER 150 -4.046 -7.580 21.028 1196 HB2 SER 150 1HB SER 150 -5.477 -9.886 19.707 1197 HB3 SER 150 2HB SER 150 -3.913 -10.104 20.513 1198 HG SER 150 HG SER 150 -5.694 -10.495 21.918 1199 H GLY 151 H GLY 151 -2.000 -8.728 20.350 1200 HA2 GLY 151 1HA GLY 151 -0.123 -8.471 19.017 1201 HA3 GLY 151 2HA GLY 151 -1.126 -9.361 17.881 Start of MODEL 2 1 H1 GLY 1 H GLY 1 7.318 -0.857 17.830 2 HA2 GLY 1 1HA GLY 1 9.170 0.371 16.539 3 HA3 GLY 1 2HA GLY 1 9.215 -1.385 16.479 4 H SER 2 H SER 2 10.343 0.260 14.508 5 HA SER 2 HA SER 2 8.568 -0.296 12.222 6 HB2 SER 2 1HB SER 2 10.623 1.923 12.473 7 HB3 SER 2 2HB SER 2 9.614 1.598 11.053 8 HG SER 2 HG SER 2 8.302 2.946 12.006 9 H SER 3 H SER 3 11.977 0.081 13.174 10 HA SER 3 HA SER 3 12.788 -2.360 12.029 11 HB2 SER 3 1HB SER 3 12.298 -0.813 9.980 12 HB3 SER 3 2HB SER 3 13.837 -0.050 10.419 13 HG SER 3 HG SER 3 14.441 -1.638 9.072 14 H GLY 4 H GLY 4 14.053 0.962 12.393 15 HA2 GLY 4 1HA GLY 4 15.757 1.771 13.712 16 HA3 GLY 4 2HA GLY 4 15.708 0.255 14.598 17 H SER 5 H SER 5 17.900 -0.050 14.743 18 HA SER 5 HA SER 5 19.236 -0.723 12.215 19 HB2 SER 5 1HB SER 5 19.890 1.478 13.894 20 HB3 SER 5 2HB SER 5 21.175 0.271 14.076 21 HG SER 5 HG SER 5 20.401 1.714 11.815 22 H SER 6 H SER 6 19.923 -0.773 15.717 23 HA SER 6 HA SER 6 20.342 -2.536 17.124 24 HB2 SER 6 1HB SER 6 18.888 -3.765 15.121 25 HB3 SER 6 2HB SER 6 20.403 -4.685 15.132 26 HG SER 6 HG SER 6 18.387 -4.867 16.835 27 H GLY 7 H GLY 7 21.777 -3.155 13.913 28 HA2 GLY 7 1HA GLY 7 24.423 -2.632 14.841 29 HA3 GLY 7 2HA GLY 7 24.127 -4.360 14.720 30 H SER 8 H SER 8 23.618 -5.260 12.652 31 HA SER 8 HA SER 8 24.393 -3.547 10.386 32 HB2 SER 8 1HB SER 8 25.786 -5.813 11.409 33 HB3 SER 8 2HB SER 8 25.096 -6.265 9.840 34 HG SER 8 HG SER 8 27.262 -5.156 9.929 35 H ASP 9 H ASP 9 23.071 -3.598 8.676 36 HA ASP 9 HA ASP 9 21.404 -5.890 8.117 37 HB2 ASP 9 1HB ASP 9 20.344 -3.990 9.811 38 HB3 ASP 9 2HB ASP 9 19.746 -3.475 8.228 39 H SER 10 H SER 10 22.589 -5.884 6.172 40 HA SER 10 HA SER 10 22.404 -3.567 4.430 41 HB2 SER 10 1HB SER 10 23.684 -6.286 4.001 42 HB3 SER 10 2HB SER 10 23.800 -4.913 2.887 43 HG SER 10 HG SER 10 25.370 -5.419 4.915 44 H LEU 11 H LEU 11 20.973 -3.309 2.837 45 HA LEU 11 HA LEU 11 19.500 -5.642 1.845 46 HB2 LEU 11 1HB LEU 11 18.197 -3.030 2.629 47 HB3 LEU 11 2HB LEU 11 17.392 -4.462 1.966 48 HG LEU 11 HG LEU 11 18.867 -4.690 4.552 49 HD11 LEU 11 1HD1 LEU 11 16.417 -4.208 5.468 50 HD12 LEU 11 2HD1 LEU 11 16.391 -3.142 4.065 51 HD13 LEU 11 3HD1 LEU 11 17.633 -2.942 5.300 52 HD21 LEU 11 3HD2 LEU 11 16.242 -5.931 3.861 53 HD22 LEU 11 1HD2 LEU 11 17.534 -6.534 4.900 54 HD23 LEU 11 2HD2 LEU 11 17.723 -6.570 3.146 55 H VAL 12 H VAL 12 17.966 -4.759 -0.033 56 HA VAL 12 HA VAL 12 19.740 -3.238 -1.819 57 HB VAL 12 HB VAL 12 19.171 -5.500 -2.586 58 HG11 VAL 12 1HG1 VAL 12 16.342 -4.481 -2.429 59 HG12 VAL 12 2HG1 VAL 12 16.811 -5.922 -3.334 60 HG13 VAL 12 3HG1 VAL 12 17.042 -5.862 -1.586 61 HG21 VAL 12 3HG2 VAL 12 18.768 -3.062 -4.037 62 HG22 VAL 12 1HG2 VAL 12 19.435 -4.596 -4.597 63 HG23 VAL 12 2HG2 VAL 12 17.695 -4.315 -4.665 64 H VAL 13 H VAL 13 18.303 -1.719 -0.035 65 HA VAL 13 HA VAL 13 15.816 -0.821 -0.488 66 HB VAL 13 HB VAL 13 17.272 0.249 1.135 67 HG11 VAL 13 1HG1 VAL 13 18.718 1.258 -1.299 68 HG12 VAL 13 2HG1 VAL 13 18.876 2.026 0.282 69 HG13 VAL 13 3HG1 VAL 13 19.367 0.346 0.064 70 HG21 VAL 13 3HG2 VAL 13 16.277 2.256 -0.886 71 HG22 VAL 13 1HG2 VAL 13 15.282 1.457 0.332 72 HG23 VAL 13 2HG2 VAL 13 16.574 2.551 0.827 73 H CYS 14 H CYS 14 14.814 0.774 -1.808 74 HA CYS 14 HA CYS 14 16.174 1.301 -4.363 75 HB2 CYS 14 1HB CYS 14 13.306 0.429 -3.972 76 HB3 CYS 14 2HB CYS 14 13.999 0.950 -5.516 77 HG CYS 14 HG CYS 14 15.609 -1.180 -5.930 78 H GLU 15 H GLU 15 15.250 3.120 -5.576 79 HA GLU 15 HA GLU 15 14.609 5.294 -3.768 80 HB2 GLU 15 1HB GLU 15 15.732 5.011 -6.460 81 HB3 GLU 15 2HB GLU 15 14.597 6.360 -6.308 82 HG2 GLU 15 1HG GLU 15 16.485 6.227 -4.093 83 HG3 GLU 15 2HG GLU 15 17.268 6.409 -5.669 84 H VAL 16 H VAL 16 12.995 6.976 -4.727 85 HA VAL 16 HA VAL 16 10.510 5.514 -5.302 86 HB VAL 16 HB VAL 16 10.506 6.858 -3.241 87 HG11 VAL 16 1HG1 VAL 16 10.383 9.443 -4.597 88 HG12 VAL 16 2HG1 VAL 16 11.209 8.980 -3.109 89 HG13 VAL 16 3HG1 VAL 16 11.968 8.675 -4.672 90 HG21 VAL 16 3HG2 VAL 16 8.458 6.511 -4.696 91 HG22 VAL 16 1HG2 VAL 16 8.390 7.856 -3.558 92 HG23 VAL 16 2HG2 VAL 16 8.703 8.162 -5.266 93 H ASP 17 H ASP 17 10.483 5.384 -7.507 94 HA ASP 17 HA ASP 17 11.342 6.950 -9.476 95 HB2 ASP 17 1HB ASP 17 9.844 4.899 -9.664 96 HB3 ASP 17 2HB ASP 17 8.475 6.007 -9.501 97 HA PRO 18 HA PRO 18 9.727 11.019 -8.971 98 HB2 PRO 18 2HB PRO 18 11.452 11.702 -10.327 99 HB3 PRO 18 1HB PRO 18 10.168 11.949 -11.509 100 HG2 PRO 18 1HG PRO 18 10.539 9.906 -12.548 101 HG3 PRO 18 2HG PRO 18 12.216 10.357 -12.064 102 HD2 PRO 18 1HD PRO 18 11.088 7.982 -11.392 103 HD3 PRO 18 2HD PRO 18 12.236 8.828 -10.340 104 H GLU 19 H GLU 19 8.606 8.946 -11.586 105 HA GLU 19 HA GLU 19 6.373 10.563 -12.304 106 HB2 GLU 19 1HB GLU 19 5.893 8.969 -13.872 107 HB3 GLU 19 2HB GLU 19 7.597 8.591 -13.579 108 HG2 GLU 19 1HG GLU 19 6.923 6.497 -13.257 109 HG3 GLU 19 2HG GLU 19 6.333 7.070 -11.690 110 H LEU 20 H LEU 20 6.967 8.190 -9.859 111 HA LEU 20 HA LEU 20 4.144 7.792 -9.299 112 HB2 LEU 20 1HB LEU 20 6.295 6.169 -9.031 113 HB3 LEU 20 2HB LEU 20 6.165 6.819 -7.388 114 HG LEU 20 HG LEU 20 3.930 5.411 -8.846 115 HD11 LEU 20 1HD1 LEU 20 6.246 4.293 -7.767 116 HD12 LEU 20 2HD1 LEU 20 4.757 3.456 -8.202 117 HD13 LEU 20 3HD1 LEU 20 4.993 4.034 -6.554 118 HD21 LEU 20 3HD2 LEU 20 3.193 7.004 -7.138 119 HD22 LEU 20 1HD2 LEU 20 4.235 6.216 -5.954 120 HD23 LEU 20 2HD2 LEU 20 2.875 5.339 -6.653 121 H LYS 21 H LYS 21 6.988 9.174 -7.679 122 HA LYS 21 HA LYS 21 6.128 9.942 -5.274 123 HB2 LYS 21 1HB LYS 21 8.298 10.587 -6.391 124 HB3 LYS 21 2HB LYS 21 7.423 11.933 -7.140 125 HG2 LYS 21 1HG LYS 21 6.761 12.292 -4.533 126 HG3 LYS 21 2HG LYS 21 8.390 11.608 -4.389 127 HD2 LYS 21 1HD LYS 21 8.142 13.668 -6.469 128 HD3 LYS 21 2HD LYS 21 7.823 14.247 -4.825 129 HE2 LYS 21 1HE LYS 21 10.053 12.723 -4.424 130 HE3 LYS 21 2HE LYS 21 10.333 13.349 -6.055 131 HZ1 LYS 21 3HZ LYS 21 9.701 15.020 -3.683 132 HZ2 LYS 21 1HZ LYS 21 10.046 15.588 -5.239 133 HZ3 LYS 21 2HZ LYS 21 11.244 14.805 -4.339 134 H GLU 22 H GLU 22 5.315 11.704 -8.258 135 HA GLU 22 HA GLU 22 3.705 13.661 -7.042 136 HB2 GLU 22 1HB GLU 22 3.245 12.605 -9.827 137 HB3 GLU 22 2HB GLU 22 3.001 14.249 -9.217 138 HG2 GLU 22 1HG GLU 22 5.590 14.153 -8.792 139 HG3 GLU 22 2HG GLU 22 5.518 12.883 -10.022 140 H THR 23 H THR 23 2.838 10.585 -8.598 141 HA THR 23 HA THR 23 0.116 10.642 -8.463 142 HB THR 23 HB THR 23 2.027 8.361 -8.031 143 HG1 THR 23 1HG THR 23 0.123 8.606 -10.096 144 HG21 THR 23 3HG2 THR 23 0.317 7.392 -6.877 145 HG22 THR 23 1HG2 THR 23 -0.236 7.037 -8.513 146 HG23 THR 23 2HG2 THR 23 -0.913 8.406 -7.631 147 H LEU 24 H LEU 24 2.340 9.840 -5.823 148 HA LEU 24 HA LEU 24 0.347 9.188 -3.927 149 HB2 LEU 24 1HB LEU 24 3.082 10.309 -3.321 150 HB3 LEU 24 2HB LEU 24 2.076 9.271 -2.294 151 HG LEU 24 HG LEU 24 3.426 8.435 -4.861 152 HD11 LEU 24 1HD1 LEU 24 5.219 8.017 -3.632 153 HD12 LEU 24 2HD1 LEU 24 4.266 6.951 -2.601 154 HD13 LEU 24 3HD1 LEU 24 4.408 8.663 -2.205 155 HD21 LEU 24 3HD2 LEU 24 2.746 6.142 -4.020 156 HD22 LEU 24 1HD2 LEU 24 1.457 7.154 -4.671 157 HD23 LEU 24 2HD2 LEU 24 1.644 6.979 -2.926 158 H ARG 25 H ARG 25 2.265 12.160 -4.372 159 HA ARG 25 HA ARG 25 1.061 13.674 -2.367 160 HB2 ARG 25 1HB ARG 25 3.074 14.470 -3.359 161 HB3 ARG 25 2HB ARG 25 2.345 14.484 -4.972 162 HG2 ARG 25 1HG ARG 25 1.149 16.418 -4.583 163 HG3 ARG 25 2HG ARG 25 1.191 16.202 -2.826 164 HD2 ARG 25 1HD ARG 25 2.869 17.680 -2.799 165 HD3 ARG 25 2HD ARG 25 3.858 16.397 -3.510 166 HE ARG 25 HE ARG 25 2.626 17.566 -5.649 167 HH11 ARG 25 2HH1 ARG 25 4.640 18.691 -3.042 168 HH12 ARG 25 1HH1 ARG 25 5.340 19.980 -3.964 169 HH21 ARG 25 1HH2 ARG 25 4.712 20.302 -6.144 170 HH22 ARG 25 2HH2 ARG 25 3.539 19.259 -6.874 171 H LYS 26 H LYS 26 -0.014 12.914 -5.597 172 HA LYS 26 HA LYS 26 -2.114 14.887 -5.615 173 HB2 LYS 26 1HB LYS 26 -1.963 12.494 -7.438 174 HB3 LYS 26 2HB LYS 26 -2.655 14.092 -7.762 175 HG2 LYS 26 1HG LYS 26 0.108 14.426 -7.153 176 HG3 LYS 26 2HG LYS 26 -0.062 13.145 -8.367 177 HD2 LYS 26 1HD LYS 26 -1.780 14.930 -9.399 178 HD3 LYS 26 2HD LYS 26 -0.682 16.036 -8.554 179 HE2 LYS 26 1HE LYS 26 0.906 15.779 -10.104 180 HE3 LYS 26 2HE LYS 26 0.802 14.017 -9.984 181 HZ1 LYS 26 3HZ LYS 26 -0.567 15.833 -11.831 182 HZ2 LYS 26 1HZ LYS 26 -1.364 14.411 -11.374 183 HZ3 LYS 26 2HZ LYS 26 0.148 14.328 -12.129 184 H PHE 27 H PHE 27 -1.871 11.390 -5.125 185 HA PHE 27 HA PHE 27 -4.568 10.755 -4.991 186 HB2 PHE 27 1HB PHE 27 -2.552 9.187 -4.934 187 HB3 PHE 27 2HB PHE 27 -2.476 9.518 -3.202 188 HD1 PHE 27 1HD PHE 27 -5.389 8.937 -5.451 189 HD2 PHE 27 2HD PHE 27 -3.148 7.626 -2.078 190 HE1 PHE 27 1HE PHE 27 -7.065 7.187 -5.023 191 HE2 PHE 27 2HE PHE 27 -4.820 5.874 -1.645 192 HZ PHE 27 HZ PHE 27 -6.781 5.652 -3.118 193 H ARG 28 H ARG 28 -2.425 11.991 -2.463 194 HA ARG 28 HA ARG 28 -4.316 11.826 -0.359 195 HB2 ARG 28 1HB ARG 28 -2.199 13.927 -0.314 196 HB3 ARG 28 2HB ARG 28 -2.714 12.811 0.961 197 HG2 ARG 28 1HG ARG 28 -1.659 11.083 -0.867 198 HG3 ARG 28 2HG ARG 28 -0.629 12.510 -1.068 199 HD2 ARG 28 1HD ARG 28 -1.219 11.126 1.559 200 HD3 ARG 28 2HD ARG 28 0.266 10.958 0.612 201 HE ARG 28 HE ARG 28 -0.426 13.120 2.349 202 HH11 ARG 28 2HH1 ARG 28 1.376 12.255 -0.502 203 HH12 ARG 28 1HH1 ARG 28 2.516 13.549 -0.333 204 HH21 ARG 28 1HH2 ARG 28 2.340 15.011 1.423 205 HH22 ARG 28 2HH2 ARG 28 1.068 14.827 2.583 206 H PHE 29 H PHE 29 -3.674 14.191 -2.836 207 HA PHE 29 HA PHE 29 -5.846 15.856 -1.746 208 HB2 PHE 29 1HB PHE 29 -3.769 17.071 -3.519 209 HB3 PHE 29 2HB PHE 29 -4.718 17.811 -2.228 210 HD1 PHE 29 2HD PHE 29 -4.187 15.987 0.023 211 HD2 PHE 29 1HD PHE 29 -1.566 17.562 -2.937 212 HE1 PHE 29 2HE PHE 29 -2.296 15.755 1.579 213 HE2 PHE 29 1HE PHE 29 0.330 17.333 -1.386 214 HZ PHE 29 HZ PHE 29 -0.034 16.430 0.876 215 H ARG 30 H ARG 30 -6.272 13.704 -3.493 216 HA ARG 30 HA ARG 30 -6.421 14.582 -6.204 217 HB2 ARG 30 1HB ARG 30 -7.805 12.550 -6.543 218 HB3 ARG 30 2HB ARG 30 -6.269 12.221 -5.727 219 HG2 ARG 30 1HG ARG 30 -7.776 12.535 -3.561 220 HG3 ARG 30 2HG ARG 30 -9.038 12.031 -4.697 221 HD2 ARG 30 1HD ARG 30 -6.615 10.402 -4.887 222 HD3 ARG 30 2HD ARG 30 -7.371 10.354 -3.288 223 HE ARG 30 HE ARG 30 -8.389 9.205 -5.707 224 HH11 ARG 30 2HH1 ARG 30 -9.255 10.514 -2.599 225 HH12 ARG 30 1HH1 ARG 30 -10.746 9.637 -2.499 226 HH21 ARG 30 1HH2 ARG 30 -11.367 8.232 -4.199 227 HH22 ARG 30 2HH2 ARG 30 -10.350 8.045 -5.587 228 H LYS 31 H LYS 31 -8.481 14.721 -7.416 229 HA LYS 31 HA LYS 31 -10.347 16.428 -5.969 230 HB2 LYS 31 1HB LYS 31 -9.632 15.971 -8.818 231 HB3 LYS 31 2HB LYS 31 -11.295 16.476 -8.479 232 HG2 LYS 31 1HG LYS 31 -9.113 18.014 -7.176 233 HG3 LYS 31 2HG LYS 31 -9.339 18.214 -8.923 234 HD2 LYS 31 1HD LYS 31 -11.646 18.861 -8.615 235 HD3 LYS 31 2HD LYS 31 -11.538 18.515 -6.879 236 HE2 LYS 31 1HE LYS 31 -9.589 20.457 -8.031 237 HE3 LYS 31 2HE LYS 31 -11.273 20.973 -7.844 238 HZ1 LYS 31 3HZ LYS 31 -9.283 20.776 -5.873 239 HZ2 LYS 31 1HZ LYS 31 -10.524 19.694 -5.484 240 HZ3 LYS 31 2HZ LYS 31 -10.873 21.332 -5.712 241 H GLU 32 H GLU 32 -10.206 13.398 -5.775 242 HA GLU 32 HA GLU 32 -12.893 12.713 -6.724 243 HB2 GLU 32 1HB GLU 32 -10.693 10.953 -5.616 244 HB3 GLU 32 2HB GLU 32 -12.260 10.383 -6.212 245 HG2 GLU 32 1HG GLU 32 -11.129 10.037 -8.116 246 HG3 GLU 32 2HG GLU 32 -11.425 11.765 -8.359 247 H THR 33 H THR 33 -13.917 10.977 -5.111 248 HA THR 33 HA THR 33 -13.602 11.741 -2.328 249 HB THR 33 HB THR 33 -16.016 12.249 -2.039 250 HG1 THR 33 1HG THR 33 -17.209 11.685 -3.701 251 HG21 THR 33 3HG2 THR 33 -14.560 14.050 -3.979 252 HG22 THR 33 1HG2 THR 33 -14.406 14.076 -2.223 253 HG23 THR 33 2HG2 THR 33 -15.936 14.517 -2.981 254 H ASN 34 H ASN 34 -13.360 9.324 -4.044 255 HA ASN 34 HA ASN 34 -15.210 7.602 -2.534 256 HB2 ASN 34 1HB ASN 34 -15.076 6.034 -4.545 257 HB3 ASN 34 2HB ASN 34 -16.040 7.503 -4.746 258 HD21 ASN 34 2HD2 ASN 34 -13.173 6.739 -7.331 259 HD22 ASN 34 1HD2 ASN 34 -13.903 5.596 -6.259 260 H ASN 35 H ASN 35 -14.327 5.173 -2.925 261 HA ASN 35 HA ASN 35 -11.732 5.173 -1.652 262 HB2 ASN 35 1HB ASN 35 -13.735 3.010 -2.312 263 HB3 ASN 35 2HB ASN 35 -12.143 2.645 -1.635 264 HD21 ASN 35 2HD2 ASN 35 -14.366 2.789 1.228 265 HD22 ASN 35 1HD2 ASN 35 -14.074 1.784 -0.147 266 H ALA 36 H ALA 36 -9.833 4.763 -2.589 267 HA ALA 36 HA ALA 36 -9.772 3.406 -5.185 268 HB1 ALA 36 3HB ALA 36 -9.426 5.350 -6.223 269 HB2 ALA 36 1HB ALA 36 -9.139 6.206 -4.709 270 HB3 ALA 36 2HB ALA 36 -7.824 5.324 -5.486 271 H ALA 37 H ALA 37 -7.673 2.548 -5.747 272 HA ALA 37 HA ALA 37 -5.809 2.320 -3.483 273 HB1 ALA 37 3HB ALA 37 -7.472 0.308 -4.003 274 HB2 ALA 37 1HB ALA 37 -6.205 -0.086 -5.167 275 HB3 ALA 37 2HB ALA 37 -5.818 0.049 -3.451 276 H ILE 38 H ILE 38 -3.636 1.968 -4.031 277 HA ILE 38 HA ILE 38 -2.964 2.136 -6.885 278 HB ILE 38 HB ILE 38 -1.541 3.778 -4.797 279 HG12 ILE 38 1HG1 ILE 38 -3.739 4.582 -6.717 280 HG13 ILE 38 2HG1 ILE 38 -3.809 4.617 -4.947 281 HG21 ILE 38 1HG2 ILE 38 -1.313 3.398 -7.733 282 HG22 ILE 38 2HG2 ILE 38 -0.994 5.003 -7.078 283 HG23 ILE 38 3HG2 ILE 38 -0.053 3.619 -6.519 284 HD11 ILE 38 3HD1 ILE 38 -1.815 6.251 -5.133 285 HD12 ILE 38 1HD1 ILE 38 -2.358 6.448 -6.799 286 HD13 ILE 38 2HD1 ILE 38 -3.447 6.830 -5.466 287 H ILE 39 H ILE 39 -1.888 0.316 -7.279 288 HA ILE 39 HA ILE 39 -0.127 -0.805 -5.232 289 HB ILE 39 HB ILE 39 -0.893 -2.009 -7.891 290 HG12 ILE 39 1HG1 ILE 39 -2.027 -3.143 -5.422 291 HG13 ILE 39 2HG1 ILE 39 -2.621 -1.522 -5.823 292 HG21 ILE 39 1HG2 ILE 39 -0.297 -4.107 -6.392 293 HG22 ILE 39 2HG2 ILE 39 0.939 -3.219 -7.282 294 HG23 ILE 39 3HG2 ILE 39 0.705 -2.918 -5.561 295 HD11 ILE 39 3HD1 ILE 39 -2.851 -4.029 -7.448 296 HD12 ILE 39 1HD1 ILE 39 -4.137 -2.995 -6.824 297 HD13 ILE 39 2HD1 ILE 39 -3.110 -2.427 -8.140 298 H MET 40 H MET 40 1.922 -0.170 -5.249 299 HA MET 40 HA MET 40 3.173 0.536 -7.813 300 HB2 MET 40 1HB MET 40 4.307 1.132 -5.084 301 HB3 MET 40 2HB MET 40 4.682 1.912 -6.626 302 HG2 MET 40 1HG MET 40 2.936 3.331 -6.507 303 HG3 MET 40 2HG MET 40 1.881 2.118 -5.777 304 HE1 MET 40 3HE MET 40 0.824 3.528 -3.455 305 HE2 MET 40 1HE MET 40 1.291 1.842 -3.668 306 HE3 MET 40 2HE MET 40 1.797 2.720 -2.225 307 H LYS 41 H LYS 41 5.086 -0.392 -8.465 308 HA LYS 41 HA LYS 41 5.980 -2.722 -6.894 309 HB2 LYS 41 1HB LYS 41 6.466 -3.892 -8.906 310 HB3 LYS 41 2HB LYS 41 4.837 -3.218 -9.089 311 HG2 LYS 41 1HG LYS 41 5.536 -1.589 -10.608 312 HG3 LYS 41 2HG LYS 41 7.238 -1.771 -10.146 313 HD2 LYS 41 1HD LYS 41 7.573 -3.512 -11.538 314 HD3 LYS 41 2HD LYS 41 5.991 -4.223 -11.173 315 HE2 LYS 41 1HE LYS 41 4.887 -2.933 -12.776 316 HE3 LYS 41 2HE LYS 41 6.188 -1.734 -12.827 317 HZ1 LYS 41 3HZ LYS 41 5.829 -3.902 -14.515 318 HZ2 LYS 41 1HZ LYS 41 7.195 -4.260 -13.584 319 HZ3 LYS 41 2HZ LYS 41 7.136 -2.829 -14.483 320 H VAL 42 H VAL 42 8.286 -3.391 -7.555 321 HA VAL 42 HA VAL 42 9.959 -0.987 -7.884 322 HB VAL 42 HB VAL 42 10.321 -1.367 -5.645 323 HG11 VAL 42 1HG1 VAL 42 9.555 -4.131 -6.303 324 HG12 VAL 42 2HG1 VAL 42 10.717 -3.956 -4.986 325 HG13 VAL 42 3HG1 VAL 42 9.153 -3.143 -4.898 326 HG21 VAL 42 3HG2 VAL 42 12.452 -1.497 -6.871 327 HG22 VAL 42 1HG2 VAL 42 12.486 -2.428 -5.373 328 HG23 VAL 42 2HG2 VAL 42 12.301 -3.253 -6.921 329 H ASP 43 H ASP 43 10.972 -1.177 -9.769 330 HA ASP 43 HA ASP 43 11.483 -3.707 -11.006 331 HB2 ASP 43 1HB ASP 43 12.014 -0.840 -11.697 332 HB3 ASP 43 2HB ASP 43 12.867 -2.110 -12.583 333 H LYS 44 H LYS 44 13.116 -5.009 -10.545 334 HA LYS 44 HA LYS 44 15.239 -4.337 -8.833 335 HB2 LYS 44 1HB LYS 44 14.350 -6.643 -9.259 336 HB3 LYS 44 2HB LYS 44 15.180 -6.609 -10.824 337 HG2 LYS 44 1HG LYS 44 17.273 -6.022 -9.320 338 HG3 LYS 44 2HG LYS 44 16.304 -6.847 -8.086 339 HD2 LYS 44 1HD LYS 44 16.060 -8.784 -9.647 340 HD3 LYS 44 2HD LYS 44 17.186 -7.966 -10.745 341 HE2 LYS 44 1HE LYS 44 18.777 -9.119 -9.646 342 HE3 LYS 44 2HE LYS 44 18.571 -7.871 -8.408 343 HZ1 LYS 44 3HZ LYS 44 17.252 -9.257 -7.113 344 HZ2 LYS 44 1HZ LYS 44 18.454 -10.300 -7.688 345 HZ3 LYS 44 2HZ LYS 44 16.914 -10.316 -8.389 346 H ASP 45 H ASP 45 14.866 -4.100 -12.278 347 HA ASP 45 HA ASP 45 17.621 -3.906 -12.943 348 HB2 ASP 45 1HB ASP 45 15.515 -4.328 -14.455 349 HB3 ASP 45 2HB ASP 45 15.487 -2.563 -14.563 350 H ARG 46 H ARG 46 15.103 -1.490 -12.307 351 HA ARG 46 HA ARG 46 17.124 0.627 -12.393 352 HB2 ARG 46 1HB ARG 46 14.107 0.796 -12.181 353 HB3 ARG 46 2HB ARG 46 15.208 2.175 -12.326 354 HG2 ARG 46 1HG ARG 46 15.859 1.531 -14.537 355 HG3 ARG 46 2HG ARG 46 14.971 0.006 -14.396 356 HD2 ARG 46 1HD ARG 46 13.446 1.243 -15.586 357 HD3 ARG 46 2HD ARG 46 12.935 1.602 -13.930 358 HE ARG 46 HE ARG 46 14.855 3.492 -14.811 359 HH11 ARG 46 2HH1 ARG 46 11.513 2.587 -15.173 360 HH12 ARG 46 1HH1 ARG 46 10.986 4.189 -15.568 361 HH21 ARG 46 1HH2 ARG 46 12.500 5.906 -15.658 362 HH22 ARG 46 2HH2 ARG 46 14.174 5.606 -15.329 363 H GLN 47 H GLN 47 16.094 -1.477 -10.179 364 HA GLN 47 HA GLN 47 15.714 -1.461 -7.907 365 HB2 GLN 47 1HB GLN 47 17.961 0.546 -7.884 366 HB3 GLN 47 2HB GLN 47 17.621 -0.743 -6.717 367 HG2 GLN 47 1HG GLN 47 18.102 -1.715 -9.437 368 HG3 GLN 47 2HG GLN 47 19.475 -0.863 -8.716 369 HE21 GLN 47 2HE2 GLN 47 18.251 -4.457 -7.238 370 HE22 GLN 47 1HE2 GLN 47 17.244 -3.535 -8.296 371 H MET 48 H MET 48 13.909 0.266 -9.075 372 HA MET 48 HA MET 48 13.641 2.280 -6.965 373 HB2 MET 48 1HB MET 48 13.453 4.072 -8.343 374 HB3 MET 48 2HB MET 48 14.491 3.082 -9.377 375 HG2 MET 48 1HG MET 48 12.069 2.191 -10.167 376 HG3 MET 48 2HG MET 48 11.671 3.849 -9.710 377 HE1 MET 48 3HE MET 48 13.773 5.513 -10.070 378 HE2 MET 48 1HE MET 48 14.518 5.727 -11.654 379 HE3 MET 48 2HE MET 48 12.821 6.143 -11.416 380 H VAL 49 H VAL 49 11.448 3.006 -6.630 381 HA VAL 49 HA VAL 49 9.532 0.883 -7.165 382 HB VAL 49 HB VAL 49 9.043 3.379 -5.548 383 HG11 VAL 49 1HG1 VAL 49 7.050 2.140 -6.113 384 HG12 VAL 49 2HG1 VAL 49 7.783 0.638 -5.545 385 HG13 VAL 49 3HG1 VAL 49 7.406 1.925 -4.399 386 HG21 VAL 49 3HG2 VAL 49 10.139 0.750 -4.551 387 HG22 VAL 49 1HG2 VAL 49 11.070 2.237 -4.733 388 HG23 VAL 49 2HG2 VAL 49 9.744 2.164 -3.573 389 H VAL 50 H VAL 50 8.358 0.968 -8.957 390 HA VAL 50 HA VAL 50 7.429 3.602 -9.905 391 HB VAL 50 HB VAL 50 7.371 2.656 -12.184 392 HG11 VAL 50 1HG1 VAL 50 9.926 2.420 -12.407 393 HG12 VAL 50 2HG1 VAL 50 9.275 3.937 -11.786 394 HG13 VAL 50 3HG1 VAL 50 9.959 2.749 -10.676 395 HG21 VAL 50 3HG2 VAL 50 7.499 0.220 -10.945 396 HG22 VAL 50 1HG2 VAL 50 7.764 0.503 -12.666 397 HG23 VAL 50 2HG2 VAL 50 9.138 0.409 -11.566 398 H LEU 51 H LEU 51 5.312 3.778 -10.631 399 HA LEU 51 HA LEU 51 3.349 2.352 -9.323 400 HB2 LEU 51 1HB LEU 51 3.014 4.540 -10.396 401 HB3 LEU 51 2HB LEU 51 3.109 3.755 -11.981 402 HG LEU 51 HG LEU 51 1.082 2.361 -10.794 403 HD11 LEU 51 1HD1 LEU 51 1.425 4.554 -9.135 404 HD12 LEU 51 2HD1 LEU 51 0.002 3.517 -9.233 405 HD13 LEU 51 3HD1 LEU 51 0.076 5.002 -10.180 406 HD21 LEU 51 3HD2 LEU 51 -0.292 3.373 -12.378 407 HD22 LEU 51 1HD2 LEU 51 1.322 3.523 -13.074 408 HD23 LEU 51 2HD2 LEU 51 0.569 4.910 -12.287 409 H GLU 52 H GLU 52 1.931 0.697 -9.893 410 HA GLU 52 HA GLU 52 2.762 -0.936 -12.201 411 HB2 GLU 52 1HB GLU 52 3.464 -2.015 -10.142 412 HB3 GLU 52 2HB GLU 52 1.826 -1.873 -9.484 413 HG2 GLU 52 1HG GLU 52 1.116 -3.715 -10.517 414 HG3 GLU 52 2HG GLU 52 1.892 -3.256 -12.039 415 H ASP 53 H ASP 53 0.094 -0.016 -10.071 416 HA ASP 53 HA ASP 53 -1.747 -0.078 -12.283 417 HB2 ASP 53 1HB ASP 53 -1.786 -2.174 -10.145 418 HB3 ASP 53 2HB ASP 53 -3.322 -1.587 -10.797 419 H GLU 54 H GLU 54 -3.915 0.704 -11.652 420 HA GLU 54 HA GLU 54 -4.124 2.000 -9.065 421 HB2 GLU 54 1HB GLU 54 -3.441 3.431 -11.535 422 HB3 GLU 54 2HB GLU 54 -4.840 4.100 -10.684 423 HG2 GLU 54 1HG GLU 54 -3.364 4.037 -8.586 424 HG3 GLU 54 2HG GLU 54 -2.021 3.829 -9.719 425 H LEU 55 H LEU 55 -6.042 1.216 -8.468 426 HA LEU 55 HA LEU 55 -8.242 1.246 -10.421 427 HB2 LEU 55 1HB LEU 55 -8.149 -0.296 -7.829 428 HB3 LEU 55 2HB LEU 55 -9.285 -0.490 -9.174 429 HG LEU 55 HG LEU 55 -6.406 -0.979 -9.725 430 HD11 LEU 55 1HD1 LEU 55 -6.905 -3.407 -8.994 431 HD12 LEU 55 2HD1 LEU 55 -8.125 -2.670 -7.956 432 HD13 LEU 55 3HD1 LEU 55 -6.428 -2.225 -7.774 433 HD21 LEU 55 3HD2 LEU 55 -7.815 -1.218 -11.583 434 HD22 LEU 55 1HD2 LEU 55 -9.049 -2.064 -10.648 435 HD23 LEU 55 2HD2 LEU 55 -7.526 -2.868 -11.029 436 H GLN 56 H GLN 56 -10.072 2.372 -10.017 437 HA GLN 56 HA GLN 56 -10.153 3.912 -7.510 438 HB2 GLN 56 1HB GLN 56 -11.100 4.567 -10.298 439 HB3 GLN 56 2HB GLN 56 -11.653 5.471 -8.879 440 HG2 GLN 56 1HG GLN 56 -9.921 6.799 -9.496 441 HG3 GLN 56 2HG GLN 56 -9.064 5.677 -8.429 442 HE21 GLN 56 2HE2 GLN 56 -6.775 5.013 -10.917 443 HE22 GLN 56 1HE2 GLN 56 -7.117 5.426 -9.274 444 H ASN 57 H ASN 57 -12.354 4.498 -6.753 445 HA ASN 57 HA ASN 57 -14.280 3.705 -5.800 446 HB2 ASN 57 1HB ASN 57 -15.842 2.787 -7.809 447 HB3 ASN 57 2HB ASN 57 -15.571 4.505 -7.489 448 HD21 ASN 57 2HD2 ASN 57 -13.577 5.078 -10.320 449 HD22 ASN 57 1HD2 ASN 57 -13.985 5.625 -8.732 450 H ILE 58 H ILE 58 -12.551 1.883 -5.171 451 HA ILE 58 HA ILE 58 -13.875 -0.676 -5.776 452 HB ILE 58 HB ILE 58 -11.993 -1.354 -6.765 453 HG12 ILE 58 1HG1 ILE 58 -11.850 -2.308 -4.402 454 HG13 ILE 58 2HG1 ILE 58 -10.358 -2.321 -5.357 455 HG21 ILE 58 1HG2 ILE 58 -10.861 1.159 -5.625 456 HG22 ILE 58 2HG2 ILE 58 -9.774 -0.046 -6.314 457 HG23 ILE 58 3HG2 ILE 58 -11.041 0.667 -7.309 458 HD11 ILE 58 3HD1 ILE 58 -10.854 -1.114 -2.817 459 HD12 ILE 58 1HD1 ILE 58 -9.335 -1.286 -3.698 460 HD13 ILE 58 2HD1 ILE 58 -10.364 0.119 -3.981 461 H SER 59 H SER 59 -14.204 -2.043 -4.076 462 HA SER 59 HA SER 59 -13.952 -0.896 -1.437 463 HB2 SER 59 1HB SER 59 -15.731 -2.179 -0.966 464 HB3 SER 59 2HB SER 59 -15.720 -2.692 -2.662 465 HG SER 59 HG SER 59 -15.238 -4.596 -1.948 466 HA PRO 60 HA PRO 60 -10.470 -3.076 0.104 467 HB2 PRO 60 2HB PRO 60 -11.027 -2.376 2.221 468 HB3 PRO 60 1HB PRO 60 -11.305 -4.093 2.506 469 HG2 PRO 60 1HG PRO 60 -13.596 -3.922 2.156 470 HG3 PRO 60 2HG PRO 60 -13.243 -2.330 2.925 471 HD2 PRO 60 1HD PRO 60 -14.528 -2.555 0.544 472 HD3 PRO 60 2HD PRO 60 -13.439 -1.209 0.920 473 H GLU 61 H GLU 61 -13.146 -4.760 -0.925 474 HA GLU 61 HA GLU 61 -12.046 -7.393 -0.267 475 HB2 GLU 61 1HB GLU 61 -14.716 -6.362 -1.069 476 HB3 GLU 61 2HB GLU 61 -14.289 -7.993 -1.609 477 HG2 GLU 61 1HG GLU 61 -13.977 -8.748 0.635 478 HG3 GLU 61 2HG GLU 61 -14.140 -7.100 1.258 479 H GLU 62 H GLU 62 -12.638 -5.237 -2.951 480 HA GLU 62 HA GLU 62 -12.070 -7.175 -4.984 481 HB2 GLU 62 1HB GLU 62 -13.087 -4.533 -4.874 482 HB3 GLU 62 2HB GLU 62 -11.647 -4.495 -5.903 483 HG2 GLU 62 1HG GLU 62 -13.297 -6.774 -6.542 484 HG3 GLU 62 2HG GLU 62 -14.220 -5.268 -6.629 485 H LEU 63 H LEU 63 -10.278 -4.482 -3.521 486 HA LEU 63 HA LEU 63 -7.980 -4.485 -4.995 487 HB2 LEU 63 1HB LEU 63 -8.799 -3.368 -2.613 488 HB3 LEU 63 2HB LEU 63 -7.430 -4.385 -2.130 489 HG LEU 63 HG LEU 63 -7.463 -1.965 -3.882 490 HD11 LEU 63 1HD1 LEU 63 -6.882 -1.438 -1.697 491 HD12 LEU 63 2HD1 LEU 63 -5.320 -1.633 -2.492 492 HD13 LEU 63 3HD1 LEU 63 -5.960 -2.926 -1.478 493 HD21 LEU 63 3HD2 LEU 63 -5.827 -4.372 -4.263 494 HD22 LEU 63 1HD2 LEU 63 -4.920 -2.863 -4.162 495 HD23 LEU 63 2HD2 LEU 63 -6.186 -3.051 -5.376 496 H LYS 64 H LYS 64 -8.721 -6.622 -2.255 497 HA LYS 64 HA LYS 64 -6.300 -8.014 -2.193 498 HB2 LYS 64 1HB LYS 64 -7.361 -8.788 -0.390 499 HB3 LYS 64 2HB LYS 64 -8.931 -8.282 -1.033 500 HG2 LYS 64 1HG LYS 64 -9.318 -10.336 -2.075 501 HG3 LYS 64 2HG LYS 64 -7.608 -10.798 -1.978 502 HD2 LYS 64 1HD LYS 64 -7.918 -11.770 0.002 503 HD3 LYS 64 2HD LYS 64 -8.629 -10.285 0.657 504 HE2 LYS 64 1HE LYS 64 -10.502 -11.527 0.849 505 HE3 LYS 64 2HE LYS 64 -10.672 -11.186 -0.879 506 HZ1 LYS 64 3HZ LYS 64 -9.233 -13.299 -1.143 507 HZ2 LYS 64 1HZ LYS 64 -10.883 -13.459 -0.800 508 HZ3 LYS 64 2HZ LYS 64 -9.740 -13.648 0.432 509 H LEU 65 H LEU 65 -9.168 -8.463 -4.175 510 HA LEU 65 HA LEU 65 -8.371 -10.967 -5.278 511 HB2 LEU 65 1HB LEU 65 -10.462 -8.923 -5.868 512 HB3 LEU 65 2HB LEU 65 -10.069 -10.117 -7.118 513 HG LEU 65 HG LEU 65 -11.925 -10.996 -5.989 514 HD11 LEU 65 1HD1 LEU 65 -9.723 -12.430 -6.182 515 HD12 LEU 65 2HD1 LEU 65 -11.161 -13.059 -5.382 516 HD13 LEU 65 3HD1 LEU 65 -9.832 -12.410 -4.423 517 HD21 LEU 65 3HD2 LEU 65 -10.593 -9.896 -3.572 518 HD22 LEU 65 1HD2 LEU 65 -11.622 -11.315 -3.381 519 HD23 LEU 65 2HD2 LEU 65 -12.286 -9.830 -4.062 520 H GLU 66 H GLU 66 -7.492 -7.711 -5.881 521 HA GLU 66 HA GLU 66 -6.572 -8.212 -8.587 522 HB2 GLU 66 1HB GLU 66 -6.159 -5.775 -6.837 523 HB3 GLU 66 2HB GLU 66 -5.879 -5.882 -8.582 524 HG2 GLU 66 1HG GLU 66 -8.584 -6.354 -7.352 525 HG3 GLU 66 2HG GLU 66 -8.013 -4.749 -7.830 526 H LEU 67 H LEU 67 -5.325 -8.257 -5.370 527 HA LEU 67 HA LEU 67 -2.562 -7.989 -6.094 528 HB2 LEU 67 1HB LEU 67 -3.965 -8.885 -3.579 529 HB3 LEU 67 2HB LEU 67 -2.200 -8.840 -3.737 530 HG LEU 67 HG LEU 67 -4.000 -6.436 -4.022 531 HD11 LEU 67 1HD1 LEU 67 -3.592 -5.874 -1.824 532 HD12 LEU 67 2HD1 LEU 67 -2.180 -6.923 -1.706 533 HD13 LEU 67 3HD1 LEU 67 -3.799 -7.623 -1.718 534 HD21 LEU 67 3HD2 LEU 67 -1.423 -6.820 -4.918 535 HD22 LEU 67 1HD2 LEU 67 -1.199 -6.031 -3.357 536 HD23 LEU 67 2HD2 LEU 67 -2.192 -5.265 -4.598 537 HA PRO 68 HA PRO 68 -1.583 -12.120 -7.212 538 HB2 PRO 68 2HB PRO 68 0.541 -11.370 -7.664 539 HB3 PRO 68 1HB PRO 68 0.975 -12.341 -6.258 540 HG2 PRO 68 1HG PRO 68 0.945 -10.520 -4.816 541 HG3 PRO 68 2HG PRO 68 1.550 -9.752 -6.331 542 HD2 PRO 68 1HD PRO 68 -0.602 -8.812 -4.970 543 HD3 PRO 68 2HD PRO 68 -0.474 -8.727 -6.735 544 H GLU 69 H GLU 69 -0.152 -14.046 -6.066 545 HA GLU 69 HA GLU 69 -1.525 -14.526 -3.505 546 HB2 GLU 69 1HB GLU 69 -1.266 -16.940 -4.014 547 HB3 GLU 69 2HB GLU 69 -2.248 -16.077 -5.209 548 HG2 GLU 69 1HG GLU 69 0.365 -15.933 -6.186 549 HG3 GLU 69 2HG GLU 69 0.178 -17.583 -5.572 550 H ARG 70 H ARG 70 1.535 -14.489 -5.152 551 HA ARG 70 HA ARG 70 2.906 -14.717 -2.599 552 HB2 ARG 70 1HB ARG 70 3.862 -16.428 -4.884 553 HB3 ARG 70 2HB ARG 70 4.303 -16.518 -3.171 554 HG2 ARG 70 1HG ARG 70 1.525 -17.126 -4.165 555 HG3 ARG 70 2HG ARG 70 2.800 -18.349 -4.040 556 HD2 ARG 70 1HD ARG 70 2.693 -18.439 -1.782 557 HD3 ARG 70 2HD ARG 70 2.419 -16.697 -1.637 558 HE ARG 70 HE ARG 70 0.133 -17.983 -2.715 559 HH11 ARG 70 2HH1 ARG 70 1.876 -17.490 0.259 560 HH12 ARG 70 1HH1 ARG 70 0.477 -17.682 1.263 561 HH21 ARG 70 1HH2 ARG 70 -1.565 -18.108 0.316 562 HH22 ARG 70 2HH2 ARG 70 -1.716 -18.237 -1.403 563 H GLN 71 H GLN 71 2.653 -12.421 -3.946 564 HA GLN 71 HA GLN 71 5.374 -11.949 -4.916 565 HB2 GLN 71 1HB GLN 71 2.823 -11.410 -6.384 566 HB3 GLN 71 2HB GLN 71 4.178 -10.286 -6.578 567 HG2 GLN 71 1HG GLN 71 5.189 -11.638 -8.009 568 HG3 GLN 71 2HG GLN 71 5.111 -12.978 -6.857 569 HE21 GLN 71 2HE2 GLN 71 2.632 -12.825 -10.023 570 HE22 GLN 71 1HE2 GLN 71 3.820 -11.613 -9.702 571 HA PRO 72 HA PRO 72 4.796 -8.744 -1.855 572 HB2 PRO 72 2HB PRO 72 6.890 -9.302 -1.090 573 HB3 PRO 72 1HB PRO 72 7.378 -7.836 -1.940 574 HG2 PRO 72 1HG PRO 72 8.073 -8.998 -3.829 575 HG3 PRO 72 2HG PRO 72 8.501 -10.169 -2.525 576 HD2 PRO 72 1HD PRO 72 6.960 -10.846 -4.656 577 HD3 PRO 72 2HD PRO 72 6.725 -11.544 -3.044 578 H ARG 73 H ARG 73 4.207 -6.657 -2.042 579 HA ARG 73 HA ARG 73 5.355 -4.825 -3.873 580 HB2 ARG 73 1HB ARG 73 3.572 -4.510 -5.429 581 HB3 ARG 73 2HB ARG 73 3.975 -6.233 -5.425 582 HG2 ARG 73 1HG ARG 73 1.956 -5.825 -3.472 583 HG3 ARG 73 2HG ARG 73 1.463 -4.999 -4.960 584 HD2 ARG 73 1HD ARG 73 2.160 -7.912 -4.587 585 HD3 ARG 73 2HD ARG 73 0.630 -7.206 -5.126 586 HE ARG 73 HE ARG 73 2.987 -7.679 -6.730 587 HH11 ARG 73 2HH1 ARG 73 -0.050 -6.002 -6.447 588 HH12 ARG 73 1HH1 ARG 73 -0.217 -5.746 -8.152 589 HH21 ARG 73 1HH2 ARG 73 1.393 -6.514 -9.591 590 HH22 ARG 73 2HH2 ARG 73 2.780 -7.348 -8.977 591 H PHE 74 H PHE 74 4.223 -2.710 -3.843 592 HA PHE 74 HA PHE 74 3.051 -2.276 -1.201 593 HB2 PHE 74 1HB PHE 74 4.016 -0.222 -3.207 594 HB3 PHE 74 2HB PHE 74 3.606 0.065 -1.515 595 HD1 PHE 74 2HD PHE 74 4.914 -2.157 -0.143 596 HD2 PHE 74 1HD PHE 74 6.284 0.258 -3.368 597 HE1 PHE 74 2HE PHE 74 7.241 -2.594 0.524 598 HE2 PHE 74 1HE PHE 74 8.614 -0.175 -2.707 599 HZ PHE 74 HZ PHE 74 9.095 -1.602 -0.759 600 H VAL 75 H VAL 75 1.130 -1.121 -0.887 601 HA VAL 75 HA VAL 75 -0.483 -0.422 -3.204 602 HB VAL 75 HB VAL 75 -1.555 -2.361 -1.154 603 HG11 VAL 75 1HG1 VAL 75 -3.502 -2.472 -2.487 604 HG12 VAL 75 2HG1 VAL 75 -3.129 -0.755 -2.320 605 HG13 VAL 75 3HG1 VAL 75 -2.733 -1.603 -3.816 606 HG21 VAL 75 3HG2 VAL 75 -0.662 -2.898 -3.985 607 HG22 VAL 75 1HG2 VAL 75 0.150 -3.448 -2.520 608 HG23 VAL 75 2HG2 VAL 75 -1.458 -4.054 -2.918 609 H VAL 76 H VAL 76 -1.472 1.442 -2.812 610 HA VAL 76 HA VAL 76 -1.857 2.265 -0.014 611 HB VAL 76 HB VAL 76 -1.442 3.858 -2.531 612 HG11 VAL 76 1HG1 VAL 76 -2.885 5.376 -1.759 613 HG12 VAL 76 2HG1 VAL 76 -3.011 4.580 -0.189 614 HG13 VAL 76 3HG1 VAL 76 -1.691 5.707 -0.505 615 HG21 VAL 76 3HG2 VAL 76 -0.050 4.411 0.027 616 HG22 VAL 76 1HG2 VAL 76 0.376 2.926 -0.823 617 HG23 VAL 76 2HG2 VAL 76 0.550 4.485 -1.630 618 H TYR 77 H TYR 77 -3.869 1.626 0.544 619 HA TYR 77 HA TYR 77 -6.085 2.088 -1.307 620 HB2 TYR 77 1HB TYR 77 -5.833 -0.122 -0.164 621 HB3 TYR 77 2HB TYR 77 -6.117 0.692 1.377 622 HD1 TYR 77 2HD TYR 77 -7.835 1.221 -1.885 623 HD2 TYR 77 1HD TYR 77 -8.160 -0.138 2.133 624 HE1 TYR 77 2HE TYR 77 -10.265 0.966 -2.174 625 HE2 TYR 77 1HE TYR 77 -10.590 -0.398 1.855 626 HH TYR 77 HH TYR 77 -12.205 0.537 -1.158 627 H SER 78 H SER 78 -7.681 3.542 -0.962 628 HA SER 78 HA SER 78 -7.443 5.235 1.439 629 HB2 SER 78 1HB SER 78 -6.839 6.444 -0.609 630 HB3 SER 78 2HB SER 78 -8.397 6.006 -1.330 631 HG SER 78 HG SER 78 -7.982 8.153 -0.045 632 H TYR 79 H TYR 79 -8.937 4.275 2.748 633 HA TYR 79 HA TYR 79 -11.560 3.579 1.754 634 HB2 TYR 79 1HB TYR 79 -10.671 2.098 3.387 635 HB3 TYR 79 2HB TYR 79 -10.267 3.430 4.475 636 HD1 TYR 79 1HD TYR 79 -12.996 1.333 3.204 637 HD2 TYR 79 2HD TYR 79 -11.941 4.472 5.876 638 HE1 TYR 79 1HE TYR 79 -15.158 1.076 4.350 639 HE2 TYR 79 2HE TYR 79 -14.099 4.222 7.029 640 HH TYR 79 HH TYR 79 -16.509 1.857 5.929 641 H LYS 80 H LYS 80 -13.508 4.325 3.016 642 HA LYS 80 HA LYS 80 -13.261 7.187 3.680 643 HB2 LYS 80 1HB LYS 80 -14.371 7.063 1.573 644 HB3 LYS 80 2HB LYS 80 -15.420 5.753 2.137 645 HG2 LYS 80 1HG LYS 80 -16.330 7.427 3.838 646 HG3 LYS 80 2HG LYS 80 -15.521 8.661 2.856 647 HD2 LYS 80 1HD LYS 80 -17.223 8.675 1.423 648 HD3 LYS 80 2HD LYS 80 -16.972 6.949 1.106 649 HE2 LYS 80 1HE LYS 80 -18.226 6.960 3.575 650 HE3 LYS 80 2HE LYS 80 -19.019 8.277 2.697 651 HZ1 LYS 80 3HZ LYS 80 -19.464 6.730 0.875 652 HZ2 LYS 80 1HZ LYS 80 -20.164 6.201 2.322 653 HZ3 LYS 80 2HZ LYS 80 -18.748 5.474 1.752 654 H TYR 81 H TYR 81 -13.549 7.424 5.794 655 HA TYR 81 HA TYR 81 -15.481 5.687 7.169 656 HB2 TYR 81 1HB TYR 81 -12.885 6.167 7.815 657 HB3 TYR 81 2HB TYR 81 -13.694 7.407 8.776 658 HD1 TYR 81 2HD TYR 81 -16.069 6.288 9.805 659 HD2 TYR 81 1HD TYR 81 -12.349 4.338 9.129 660 HE1 TYR 81 2HE TYR 81 -16.632 4.627 11.531 661 HE2 TYR 81 1HE TYR 81 -12.902 2.672 10.852 662 HH TYR 81 HH TYR 81 -15.704 3.012 12.905 663 H VAL 82 H VAL 82 -17.207 6.513 8.225 664 HA VAL 82 HA VAL 82 -17.653 9.408 7.962 665 HB VAL 82 HB VAL 82 -19.270 7.709 6.913 666 HG11 VAL 82 1HG1 VAL 82 -20.617 7.581 9.551 667 HG12 VAL 82 2HG1 VAL 82 -20.653 6.443 8.202 668 HG13 VAL 82 3HG1 VAL 82 -19.256 6.493 9.278 669 HG21 VAL 82 3HG2 VAL 82 -19.602 10.254 7.867 670 HG22 VAL 82 1HG2 VAL 82 -20.764 9.377 6.872 671 HG23 VAL 82 2HG2 VAL 82 -20.938 9.389 8.626 672 H HIS 83 H HIS 83 -18.982 10.414 9.699 673 HA HIS 83 HA HIS 83 -18.061 9.452 12.316 674 HB2 HIS 83 1HB HIS 83 -18.943 12.182 11.359 675 HB3 HIS 83 2HB HIS 83 -18.641 11.804 13.058 676 HD1 HIS 83 1HD HIS 83 -16.436 12.656 13.745 677 HD2 HIS 83 2HD HIS 83 -16.378 11.225 9.846 678 HE1 HIS 83 1HE HIS 83 -14.065 12.945 12.959 679 HE2 HIS 83 2HE HIS 83 -14.029 12.070 10.575 680 H ASP 84 H ASP 84 -20.739 11.650 11.721 681 HA ASP 84 HA ASP 84 -22.905 9.963 11.900 682 HB2 ASP 84 1HB ASP 84 -21.471 9.953 14.336 683 HB3 ASP 84 2HB ASP 84 -22.941 10.896 14.621 684 H ASP 85 H ASP 85 -21.543 12.974 13.136 685 HA ASP 85 HA ASP 85 -24.051 14.355 13.177 686 HB2 ASP 85 1HB ASP 85 -21.349 14.865 14.006 687 HB3 ASP 85 2HB ASP 85 -21.924 16.222 13.027 688 H GLY 86 H GLY 86 -22.203 13.282 10.675 689 HA2 GLY 86 1HA GLY 86 -23.101 13.750 8.440 690 HA3 GLY 86 2HA GLY 86 -23.184 15.440 8.912 691 H ARG 87 H ARG 87 -20.414 13.752 9.988 692 HA ARG 87 HA ARG 87 -18.818 15.059 7.885 693 HB2 ARG 87 1HB ARG 87 -18.161 14.422 10.767 694 HB3 ARG 87 2HB ARG 87 -16.952 14.946 9.586 695 HG2 ARG 87 1HG ARG 87 -19.415 16.560 10.227 696 HG3 ARG 87 2HG ARG 87 -17.877 16.740 11.088 697 HD2 ARG 87 1HD ARG 87 -16.774 17.605 9.243 698 HD3 ARG 87 2HD ARG 87 -17.913 16.869 8.106 699 HE ARG 87 HE ARG 87 -19.054 18.907 9.804 700 HH11 ARG 87 2HH1 ARG 87 -17.477 18.196 6.784 701 HH12 ARG 87 1HH1 ARG 87 -18.063 19.621 5.992 702 HH21 ARG 87 1HH2 ARG 87 -19.401 21.095 7.125 703 HH22 ARG 87 2HH2 ARG 87 -19.831 20.788 8.773 704 H VAL 88 H VAL 88 -17.454 13.871 6.675 705 HA VAL 88 HA VAL 88 -16.789 11.148 7.505 706 HB VAL 88 HB VAL 88 -18.761 10.834 6.137 707 HG11 VAL 88 1HG1 VAL 88 -17.958 13.082 4.799 708 HG12 VAL 88 2HG1 VAL 88 -17.624 11.805 3.627 709 HG13 VAL 88 3HG1 VAL 88 -19.249 11.996 4.287 710 HG21 VAL 88 3HG2 VAL 88 -17.389 9.759 4.058 711 HG22 VAL 88 1HG2 VAL 88 -16.109 9.933 5.259 712 HG23 VAL 88 2HG2 VAL 88 -17.556 9.001 5.641 713 H SER 89 H SER 89 -14.698 10.764 7.203 714 HA SER 89 HA SER 89 -13.264 12.337 5.165 715 HB2 SER 89 1HB SER 89 -12.337 11.469 7.917 716 HB3 SER 89 2HB SER 89 -11.260 12.142 6.679 717 HG SER 89 HG SER 89 -12.541 14.037 6.696 718 H TYR 90 H TYR 90 -11.360 11.309 4.254 719 HA TYR 90 HA TYR 90 -11.704 8.396 4.080 720 HB2 TYR 90 1HB TYR 90 -10.057 9.979 2.136 721 HB3 TYR 90 2HB TYR 90 -10.943 8.474 1.883 722 HD1 TYR 90 2HD TYR 90 -13.601 8.745 2.313 723 HD2 TYR 90 1HD TYR 90 -10.951 11.847 1.104 724 HE1 TYR 90 2HE TYR 90 -15.498 9.987 1.360 725 HE2 TYR 90 1HE TYR 90 -12.841 13.098 0.149 726 HH TYR 90 HH TYR 90 -15.051 13.191 -0.100 727 HA PRO 91 HA PRO 91 -7.836 8.604 6.469 728 HB2 PRO 91 2HB PRO 91 -8.912 7.518 8.183 729 HB3 PRO 91 1HB PRO 91 -8.110 6.092 7.526 730 HG2 PRO 91 1HG PRO 91 -9.978 5.428 6.314 731 HG3 PRO 91 2HG PRO 91 -10.750 6.154 7.773 732 HD2 PRO 91 1HD PRO 91 -11.385 6.917 5.247 733 HD3 PRO 91 2HD PRO 91 -11.390 8.041 6.616 734 H LEU 92 H LEU 92 -6.460 8.568 4.671 735 HA LEU 92 HA LEU 92 -6.142 6.267 3.018 736 HB2 LEU 92 1HB LEU 92 -5.057 8.954 3.201 737 HB3 LEU 92 2HB LEU 92 -3.807 7.759 2.813 738 HG LEU 92 HG LEU 92 -6.009 7.222 1.124 739 HD11 LEU 92 1HD1 LEU 92 -5.404 10.136 1.457 740 HD12 LEU 92 2HD1 LEU 92 -6.966 9.330 1.315 741 HD13 LEU 92 3HD1 LEU 92 -5.924 9.488 -0.099 742 HD21 LEU 92 3HD2 LEU 92 -4.021 6.707 0.171 743 HD22 LEU 92 1HD2 LEU 92 -3.184 8.074 0.909 744 HD23 LEU 92 2HD2 LEU 92 -4.201 8.324 -0.512 745 H CYS 93 H CYS 93 -4.942 4.506 3.327 746 HA CYS 93 HA CYS 93 -2.855 4.576 5.403 747 HB2 CYS 93 1HB CYS 93 -4.851 2.368 4.870 748 HB3 CYS 93 2HB CYS 93 -3.479 2.234 5.982 749 HG CYS 93 HG CYS 93 -6.241 4.205 6.358 750 H PHE 94 H PHE 94 -1.336 2.663 5.194 751 HA PHE 94 HA PHE 94 -0.768 2.215 2.339 752 HB2 PHE 94 1HB PHE 94 0.907 3.579 3.579 753 HB3 PHE 94 2HB PHE 94 1.186 2.202 4.648 754 HD1 PHE 94 1HD PHE 94 1.334 3.185 1.070 755 HD2 PHE 94 2HD PHE 94 2.761 0.583 4.120 756 HE1 PHE 94 1HE PHE 94 3.019 2.293 -0.484 757 HE2 PHE 94 2HE PHE 94 4.451 -0.312 2.572 758 HZ PHE 94 HZ PHE 94 4.582 0.543 0.266 759 H ILE 95 H ILE 95 -1.545 0.260 1.827 760 HA ILE 95 HA ILE 95 -1.289 -1.951 3.714 761 HB ILE 95 HB ILE 95 -2.664 -1.853 1.027 762 HG12 ILE 95 1HG1 ILE 95 -3.817 -1.824 3.828 763 HG13 ILE 95 2HG1 ILE 95 -3.701 -0.414 2.761 764 HG21 ILE 95 1HG2 ILE 95 -2.515 -3.987 3.139 765 HG22 ILE 95 2HG2 ILE 95 -3.750 -3.963 1.882 766 HG23 ILE 95 3HG2 ILE 95 -2.047 -4.099 1.443 767 HD11 ILE 95 3HD1 ILE 95 -5.880 -1.055 2.446 768 HD12 ILE 95 1HD1 ILE 95 -5.074 -1.876 1.110 769 HD13 ILE 95 2HD1 ILE 95 -5.506 -2.774 2.566 770 H PHE 96 H PHE 96 0.599 -2.982 3.688 771 HA PHE 96 HA PHE 96 2.083 -3.244 1.187 772 HB2 PHE 96 1HB PHE 96 3.324 -2.471 3.142 773 HB3 PHE 96 2HB PHE 96 2.853 -3.918 4.034 774 HD1 PHE 96 2HD PHE 96 3.556 -4.484 0.567 775 HD2 PHE 96 1HD PHE 96 5.324 -4.188 4.427 776 HE1 PHE 96 2HE PHE 96 5.547 -5.671 -0.258 777 HE2 PHE 96 1HE PHE 96 7.318 -5.375 3.608 778 HZ PHE 96 HZ PHE 96 7.431 -6.119 1.263 779 H SER 97 H SER 97 1.563 -4.929 -0.040 780 HA SER 97 HA SER 97 0.420 -7.327 1.074 781 HB2 SER 97 1HB SER 97 -0.325 -6.403 -1.109 782 HB3 SER 97 2HB SER 97 1.281 -6.753 -1.772 783 HG SER 97 HG SER 97 0.587 -8.690 -2.133 784 H SER 98 H SER 98 1.954 -8.326 2.331 785 HA SER 98 HA SER 98 4.296 -9.379 0.886 786 HB2 SER 98 1HB SER 98 5.666 -9.159 2.812 787 HB3 SER 98 2HB SER 98 4.796 -7.622 2.670 788 HG SER 98 HG SER 98 4.886 -9.016 4.789 789 HA PRO 99 HA PRO 99 1.894 -13.044 2.123 790 HB2 PRO 99 2HB PRO 99 1.549 -13.496 -0.104 791 HB3 PRO 99 1HB PRO 99 2.883 -14.627 0.119 792 HG2 PRO 99 1HG PRO 99 4.464 -13.145 -0.720 793 HG3 PRO 99 2HG PRO 99 3.027 -12.727 -1.725 794 HD2 PRO 99 1HD PRO 99 4.411 -10.873 -0.304 795 HD3 PRO 99 2HD PRO 99 2.661 -10.771 -0.563 796 H VAL 100 H VAL 100 3.018 -15.511 1.810 797 HA VAL 100 HA VAL 100 5.524 -15.344 3.356 798 HB VAL 100 HB VAL 100 3.178 -17.196 3.738 799 HG11 VAL 100 1HG1 VAL 100 4.512 -18.460 5.323 800 HG12 VAL 100 2HG1 VAL 100 5.253 -18.516 3.722 801 HG13 VAL 100 3HG1 VAL 100 5.920 -17.459 4.968 802 HG21 VAL 100 3HG2 VAL 100 4.664 -15.541 5.766 803 HG22 VAL 100 1HG2 VAL 100 3.267 -14.943 4.871 804 HG23 VAL 100 2HG2 VAL 100 3.099 -16.332 5.944 805 H GLY 101 H GLY 101 3.686 -16.988 0.878 806 HA2 GLY 101 1HA GLY 101 5.637 -19.061 0.455 807 HA3 GLY 101 2HA GLY 101 4.250 -18.707 -0.565 808 H CYS 102 H CYS 102 6.048 -15.931 0.023 809 HA CYS 102 HA CYS 102 7.015 -15.918 -2.705 810 HB2 CYS 102 1HB CYS 102 7.828 -13.592 -2.020 811 HB3 CYS 102 2HB CYS 102 6.079 -13.861 -2.063 812 HG CYS 102 HG CYS 102 6.506 -12.271 0.138 813 H LYS 103 H LYS 103 9.289 -14.635 -2.819 814 HA LYS 103 HA LYS 103 11.176 -16.401 -1.426 815 HB2 LYS 103 1HB LYS 103 11.920 -14.605 -3.717 816 HB3 LYS 103 2HB LYS 103 12.654 -16.136 -3.212 817 HG2 LYS 103 1HG LYS 103 11.411 -17.264 -4.655 818 HG3 LYS 103 2HG LYS 103 9.933 -16.606 -3.932 819 HD2 LYS 103 1HD LYS 103 10.050 -16.077 -6.318 820 HD3 LYS 103 2HD LYS 103 10.127 -14.608 -5.330 821 HE2 LYS 103 1HE LYS 103 11.967 -14.052 -6.470 822 HE3 LYS 103 2HE LYS 103 12.779 -15.368 -5.612 823 HZ1 LYS 103 3HZ LYS 103 13.157 -15.773 -7.868 824 HZ2 LYS 103 1HZ LYS 103 11.559 -15.431 -8.304 825 HZ3 LYS 103 2HZ LYS 103 11.918 -16.849 -7.457 826 HA PRO 104 HA PRO 104 12.732 -13.116 1.049 827 HB2 PRO 104 2HB PRO 104 13.869 -14.729 2.225 828 HB3 PRO 104 1HB PRO 104 15.288 -14.009 1.465 829 HG2 PRO 104 1HG PRO 104 15.359 -15.599 -0.228 830 HG3 PRO 104 2HG PRO 104 14.761 -16.591 1.154 831 HD2 PRO 104 1HD PRO 104 13.465 -16.465 -1.228 832 HD3 PRO 104 2HD PRO 104 12.614 -16.640 0.316 833 H GLU 105 H GLU 105 14.050 -13.876 -2.029 834 HA GLU 105 HA GLU 105 16.062 -11.846 -2.094 835 HB2 GLU 105 1HB GLU 105 14.772 -13.634 -4.130 836 HB3 GLU 105 2HB GLU 105 15.777 -12.277 -4.660 837 HG2 GLU 105 1HG GLU 105 17.521 -13.636 -4.484 838 HG3 GLU 105 2HG GLU 105 17.320 -13.504 -2.731 839 H GLN 106 H GLN 106 12.693 -12.065 -3.100 840 HA GLN 106 HA GLN 106 12.737 -9.383 -4.212 841 HB2 GLN 106 1HB GLN 106 10.241 -10.996 -3.792 842 HB3 GLN 106 2HB GLN 106 10.613 -9.822 -5.064 843 HG2 GLN 106 1HG GLN 106 12.046 -12.459 -4.840 844 HG3 GLN 106 2HG GLN 106 10.533 -12.263 -5.737 845 HE21 GLN 106 2HE2 GLN 106 12.093 -9.991 -8.124 846 HE22 GLN 106 1HE2 GLN 106 10.731 -10.005 -7.061 847 H GLN 107 H GLN 107 10.811 -11.049 -1.710 848 HA GLN 107 HA GLN 107 9.414 -9.056 -0.594 849 HB2 GLN 107 1HB GLN 107 10.308 -11.576 0.256 850 HB3 GLN 107 2HB GLN 107 10.743 -10.456 1.557 851 HG2 GLN 107 1HG GLN 107 8.034 -10.047 0.543 852 HG3 GLN 107 2HG GLN 107 8.307 -11.657 1.225 853 HE21 GLN 107 2HE2 GLN 107 7.910 -8.458 3.611 854 HE22 GLN 107 1HE2 GLN 107 7.747 -8.388 1.893 855 H MET 108 H MET 108 12.878 -9.576 -0.133 856 HA MET 108 HA MET 108 13.294 -7.583 1.806 857 HB2 MET 108 1HB MET 108 15.012 -9.073 -0.125 858 HB3 MET 108 2HB MET 108 15.683 -7.620 0.635 859 HG2 MET 108 1HG MET 108 14.682 -8.867 2.812 860 HG3 MET 108 2HG MET 108 15.081 -10.254 1.795 861 HE1 MET 108 3HE MET 108 17.128 -10.235 0.380 862 HE2 MET 108 1HE MET 108 18.202 -8.836 0.387 863 HE3 MET 108 2HE MET 108 18.665 -10.307 1.243 864 H MET 109 H MET 109 13.424 -7.484 -1.732 865 HA MET 109 HA MET 109 14.400 -4.920 -2.095 866 HB2 MET 109 1HB MET 109 12.471 -6.597 -3.686 867 HB3 MET 109 2HB MET 109 12.932 -4.973 -4.218 868 HG2 MET 109 1HG MET 109 15.197 -5.579 -4.496 869 HG3 MET 109 2HG MET 109 14.967 -7.089 -3.610 870 HE1 MET 109 3HE MET 109 12.818 -6.321 -7.572 871 HE2 MET 109 1HE MET 109 12.975 -5.225 -6.199 872 HE3 MET 109 2HE MET 109 14.310 -5.410 -7.336 873 H TYR 110 H TYR 110 11.183 -5.979 -1.205 874 HA TYR 110 HA TYR 110 10.132 -3.266 -1.397 875 HB2 TYR 110 1HB TYR 110 8.721 -5.783 -0.479 876 HB3 TYR 110 2HB TYR 110 7.970 -4.248 -0.920 877 HD1 TYR 110 1HD TYR 110 9.854 -7.124 -2.300 878 HD2 TYR 110 2HD TYR 110 7.438 -3.730 -3.165 879 HE1 TYR 110 1HE TYR 110 9.641 -7.876 -4.632 880 HE2 TYR 110 2HE TYR 110 7.217 -4.474 -5.498 881 HH TYR 110 HH TYR 110 9.071 -6.367 -7.007 882 H ALA 111 H ALA 111 11.064 -5.647 0.997 883 HA ALA 111 HA ALA 111 9.960 -4.322 3.252 884 HB1 ALA 111 3HB ALA 111 12.245 -5.846 4.006 885 HB2 ALA 111 1HB ALA 111 10.536 -6.226 4.230 886 HB3 ALA 111 2HB ALA 111 11.366 -6.724 2.754 887 H GLY 112 H GLY 112 12.841 -3.869 1.390 888 HA2 GLY 112 1HA GLY 112 14.080 -2.228 3.472 889 HA3 GLY 112 2HA GLY 112 14.822 -2.711 1.954 890 H SER 113 H SER 113 12.234 -1.884 0.577 891 HA SER 113 HA SER 113 12.943 0.957 0.377 892 HB2 SER 113 1HB SER 113 11.218 -0.630 -1.541 893 HB3 SER 113 2HB SER 113 12.013 0.929 -1.826 894 HG SER 113 HG SER 113 13.629 -1.236 -1.127 895 H LYS 114 H LYS 114 10.516 -1.134 1.522 896 HA LYS 114 HA LYS 114 8.125 0.087 1.183 897 HB2 LYS 114 1HB LYS 114 8.207 -1.885 2.496 898 HB3 LYS 114 2HB LYS 114 9.297 -1.139 3.675 899 HG2 LYS 114 1HG LYS 114 7.582 0.205 4.582 900 HG3 LYS 114 2HG LYS 114 6.495 -0.157 3.229 901 HD2 LYS 114 1HD LYS 114 5.613 -1.717 4.578 902 HD3 LYS 114 2HD LYS 114 7.065 -2.657 4.190 903 HE2 LYS 114 1HE LYS 114 8.146 -2.056 6.185 904 HE3 LYS 114 2HE LYS 114 7.053 -0.691 6.456 905 HZ1 LYS 114 3HZ LYS 114 5.265 -2.539 6.598 906 HZ2 LYS 114 1HZ LYS 114 6.263 -2.243 7.931 907 HZ3 LYS 114 2HZ LYS 114 6.578 -3.557 6.914 908 H ASN 115 H ASN 115 10.377 0.933 3.821 909 HA ASN 115 HA ASN 115 8.965 3.131 4.785 910 HB2 ASN 115 1HB ASN 115 11.700 2.072 5.031 911 HB3 ASN 115 2HB ASN 115 11.575 3.818 5.275 912 HD21 ASN 115 2HD2 ASN 115 10.700 1.444 8.269 913 HD22 ASN 115 1HD2 ASN 115 11.669 1.051 6.893 914 H ARG 116 H ARG 116 11.355 2.906 2.200 915 HA ARG 116 HA ARG 116 11.704 5.657 1.754 916 HB2 ARG 116 1HB ARG 116 13.232 4.017 0.827 917 HB3 ARG 116 2HB ARG 116 11.933 3.331 -0.161 918 HG2 ARG 116 1HG ARG 116 12.917 4.619 -1.745 919 HG3 ARG 116 2HG ARG 116 11.807 5.820 -1.064 920 HD2 ARG 116 1HD ARG 116 13.593 7.121 -0.728 921 HD3 ARG 116 2HD ARG 116 14.030 5.998 0.567 922 HE ARG 116 HE ARG 116 14.975 5.025 -1.910 923 HH11 ARG 116 2HH1 ARG 116 15.588 7.495 0.465 924 HH12 ARG 116 1HH1 ARG 116 17.278 7.611 0.101 925 HH21 ARG 116 1HH2 ARG 116 18.192 6.286 -1.529 926 HH22 ARG 116 2HH2 ARG 116 17.198 5.167 -2.400 927 H LEU 117 H LEU 117 9.666 3.339 -0.039 928 HA LEU 117 HA LEU 117 8.388 5.223 -1.659 929 HB2 LEU 117 1HB LEU 117 8.345 2.822 -2.101 930 HB3 LEU 117 2HB LEU 117 7.359 2.575 -0.648 931 HG LEU 117 HG LEU 117 6.078 2.451 -2.769 932 HD11 LEU 117 1HD1 LEU 117 5.318 3.463 -0.402 933 HD12 LEU 117 2HD1 LEU 117 4.230 3.285 -1.778 934 HD13 LEU 117 3HD1 LEU 117 4.980 4.846 -1.443 935 HD21 LEU 117 3HD2 LEU 117 5.765 4.282 -4.172 936 HD22 LEU 117 1HD2 LEU 117 7.492 4.329 -3.813 937 HD23 LEU 117 2HD2 LEU 117 6.388 5.424 -2.981 938 H VAL 118 H VAL 118 7.376 3.830 1.450 939 HA VAL 118 HA VAL 118 4.920 5.155 1.666 940 HB VAL 118 HB VAL 118 6.777 4.275 3.881 941 HG11 VAL 118 1HG1 VAL 118 5.211 4.803 5.410 942 HG12 VAL 118 2HG1 VAL 118 4.666 5.942 4.178 943 HG13 VAL 118 3HG1 VAL 118 3.875 4.374 4.344 944 HG21 VAL 118 3HG2 VAL 118 5.988 2.178 3.657 945 HG22 VAL 118 1HG2 VAL 118 4.358 2.726 3.266 946 HG23 VAL 118 2HG2 VAL 118 5.601 2.693 2.015 947 H GLN 119 H GLN 119 8.100 6.052 2.998 948 HA GLN 119 HA GLN 119 7.387 8.405 4.262 949 HB2 GLN 119 1HB GLN 119 9.909 7.406 3.001 950 HB3 GLN 119 2HB GLN 119 9.831 9.092 3.539 951 HG2 GLN 119 1HG GLN 119 8.815 7.343 5.589 952 HG3 GLN 119 2HG GLN 119 10.432 6.842 5.077 953 HE21 GLN 119 2HE2 GLN 119 12.092 9.616 6.406 954 HE22 GLN 119 1HE2 GLN 119 12.170 8.279 5.316 955 H THR 120 H THR 120 8.133 7.843 0.864 956 HA THR 120 HA THR 120 8.216 10.525 0.031 957 HB THR 120 HB THR 120 7.216 8.262 -1.689 958 HG1 THR 120 1HG THR 120 9.948 8.941 -1.284 959 HG21 THR 120 3HG2 THR 120 7.232 9.903 -3.209 960 HG22 THR 120 1HG2 THR 120 8.991 9.853 -3.103 961 HG23 THR 120 2HG2 THR 120 8.080 11.002 -2.121 962 H ALA 121 H ALA 121 5.533 8.217 0.223 963 HA ALA 121 HA ALA 121 3.601 10.012 -0.868 964 HB1 ALA 121 3HB ALA 121 2.981 7.633 0.859 965 HB2 ALA 121 1HB ALA 121 2.002 8.346 -0.424 966 HB3 ALA 121 2HB ALA 121 3.482 7.473 -0.825 967 H GLU 122 H GLU 122 4.893 9.438 2.298 968 HA GLU 122 HA GLU 122 4.666 10.638 4.230 969 HB2 GLU 122 1HB GLU 122 3.956 12.465 2.345 970 HB3 GLU 122 2HB GLU 122 2.467 12.366 3.298 971 HG2 GLU 122 1HG GLU 122 3.338 13.502 5.004 972 HG3 GLU 122 2HG GLU 122 4.844 12.574 4.955 973 H LEU 123 H LEU 123 3.285 8.261 3.840 974 HA LEU 123 HA LEU 123 0.612 8.693 4.943 975 HB2 LEU 123 1HB LEU 123 1.931 6.104 4.112 976 HB3 LEU 123 2HB LEU 123 0.218 6.358 4.493 977 HG LEU 123 HG LEU 123 1.455 7.860 2.224 978 HD11 LEU 123 1HD1 LEU 123 1.185 6.099 0.709 979 HD12 LEU 123 2HD1 LEU 123 0.285 5.120 1.866 980 HD13 LEU 123 3HD1 LEU 123 2.017 5.374 2.085 981 HD21 LEU 123 3HD2 LEU 123 -0.981 7.999 3.289 982 HD22 LEU 123 1HD2 LEU 123 -1.253 6.657 2.178 983 HD23 LEU 123 2HD2 LEU 123 -0.689 8.210 1.562 984 H THR 124 H THR 124 1.000 9.255 7.062 985 HA THR 124 HA THR 124 2.832 8.216 8.827 986 HB THR 124 HB THR 124 0.013 9.144 9.401 987 HG1 THR 124 1HG THR 124 1.462 10.974 10.216 988 HG21 THR 124 3HG2 THR 124 0.513 7.978 11.339 989 HG22 THR 124 1HG2 THR 124 1.130 9.586 11.717 990 HG23 THR 124 2HG2 THR 124 2.241 8.311 11.218 991 H LYS 125 H LYS 125 -0.471 7.032 8.234 992 HA LYS 125 HA LYS 125 -0.162 4.792 9.996 993 HB2 LYS 125 1HB LYS 125 -2.272 5.928 8.286 994 HB3 LYS 125 2HB LYS 125 -2.307 4.162 8.420 995 HG2 LYS 125 1HG LYS 125 -2.556 4.241 10.778 996 HG3 LYS 125 2HG LYS 125 -2.202 5.977 10.813 997 HD2 LYS 125 1HD LYS 125 -4.566 4.839 9.323 998 HD3 LYS 125 2HD LYS 125 -4.645 5.306 11.031 999 HE2 LYS 125 1HE LYS 125 -3.765 7.166 8.812 1000 HE3 LYS 125 2HE LYS 125 -5.419 7.069 9.434 1001 HZ1 LYS 125 3HZ LYS 125 -3.444 7.400 11.498 1002 HZ2 LYS 125 1HZ LYS 125 -4.888 8.244 11.236 1003 HZ3 LYS 125 2HZ LYS 125 -3.485 8.688 10.401 1004 H VAL 126 H VAL 126 0.798 2.924 9.561 1005 HA VAL 126 HA VAL 126 0.928 2.004 6.773 1006 HB VAL 126 HB VAL 126 3.247 1.772 8.690 1007 HG11 VAL 126 1HG1 VAL 126 2.614 0.615 6.126 1008 HG12 VAL 126 2HG1 VAL 126 4.097 1.568 6.041 1009 HG13 VAL 126 3HG1 VAL 126 3.952 0.261 7.219 1010 HG21 VAL 126 3HG2 VAL 126 4.286 3.457 7.040 1011 HG22 VAL 126 1HG2 VAL 126 2.618 3.844 6.618 1012 HG23 VAL 126 2HG2 VAL 126 3.182 4.063 8.275 1013 H PHE 127 H PHE 127 0.028 0.069 6.608 1014 HA PHE 127 HA PHE 127 0.142 -1.741 8.930 1015 HB2 PHE 127 1HB PHE 127 -1.982 -1.662 6.772 1016 HB3 PHE 127 2HB PHE 127 -1.984 -2.677 8.216 1017 HD1 PHE 127 2HD PHE 127 -1.016 -0.599 10.188 1018 HD2 PHE 127 1HD PHE 127 -3.990 -0.472 7.146 1019 HE1 PHE 127 2HE PHE 127 -2.218 1.145 11.441 1020 HE2 PHE 127 1HE PHE 127 -5.196 1.272 8.394 1021 HZ PHE 127 HZ PHE 127 -4.312 2.082 10.544 1022 H GLU 128 H GLU 128 0.377 -3.988 8.520 1023 HA GLU 128 HA GLU 128 1.432 -4.635 5.847 1024 HB2 GLU 128 1HB GLU 128 3.228 -4.360 7.569 1025 HB3 GLU 128 2HB GLU 128 2.505 -5.709 8.458 1026 HG2 GLU 128 1HG GLU 128 3.064 -6.288 5.636 1027 HG3 GLU 128 2HG GLU 128 4.492 -5.935 6.619 1028 H ILE 129 H ILE 129 0.542 -6.353 4.901 1029 HA ILE 129 HA ILE 129 -1.182 -8.088 6.537 1030 HB ILE 129 HB ILE 129 -2.089 -8.728 4.182 1031 HG12 ILE 129 1HG1 ILE 129 -1.100 -5.941 3.578 1032 HG13 ILE 129 2HG1 ILE 129 -0.217 -7.391 3.070 1033 HG21 ILE 129 1HG2 ILE 129 -2.783 -5.955 5.069 1034 HG22 ILE 129 2HG2 ILE 129 -3.841 -7.231 4.470 1035 HG23 ILE 129 3HG2 ILE 129 -3.149 -7.348 6.087 1036 HD11 ILE 129 3HD1 ILE 129 -2.946 -6.501 2.195 1037 HD12 ILE 129 1HD1 ILE 129 -1.497 -6.717 1.214 1038 HD13 ILE 129 2HD1 ILE 129 -2.320 -8.121 1.893 1039 H ARG 130 H ARG 130 -0.803 -10.221 6.667 1040 HA ARG 130 HA ARG 130 1.626 -11.248 5.464 1041 HB2 ARG 130 1HB ARG 130 0.732 -11.628 7.891 1042 HB3 ARG 130 2HB ARG 130 -0.241 -12.895 7.131 1043 HG2 ARG 130 1HG ARG 130 1.646 -14.029 7.880 1044 HG3 ARG 130 2HG ARG 130 1.970 -13.751 6.160 1045 HD2 ARG 130 1HD ARG 130 3.980 -13.101 7.075 1046 HD3 ARG 130 2HD ARG 130 3.110 -11.561 7.034 1047 HE ARG 130 HE ARG 130 3.251 -11.509 9.304 1048 HH11 ARG 130 2HH1 ARG 130 3.484 -14.825 8.269 1049 HH12 ARG 130 1HH1 ARG 130 3.754 -15.440 9.866 1050 HH21 ARG 130 1HH2 ARG 130 3.823 -14.007 11.653 1051 HH22 ARG 130 2HH2 ARG 130 3.606 -12.308 11.411 1052 H THR 131 H THR 131 -1.404 -10.899 4.358 1053 HA THR 131 HA THR 131 -1.110 -12.607 2.169 1054 HB THR 131 HB THR 131 -1.479 -14.526 3.469 1055 HG1 THR 131 1HG THR 131 -2.882 -14.440 1.648 1056 HG21 THR 131 3HG2 THR 131 -2.374 -13.050 5.425 1057 HG22 THR 131 1HG2 THR 131 -2.883 -14.733 5.299 1058 HG23 THR 131 2HG2 THR 131 -3.956 -13.443 4.752 1059 H THR 132 H THR 132 -2.682 -12.262 0.621 1060 HA THR 132 HA THR 132 -4.095 -9.901 0.633 1061 HB THR 132 HB THR 132 -5.446 -10.856 -1.244 1062 HG1 THR 132 1HG THR 132 -3.865 -13.171 -1.156 1063 HG21 THR 132 3HG2 THR 132 -3.539 -11.194 -2.757 1064 HG22 THR 132 1HG2 THR 132 -2.470 -11.356 -1.364 1065 HG23 THR 132 2HG2 THR 132 -3.280 -9.823 -1.679 1066 H ASP 133 H ASP 133 -5.146 -13.088 1.689 1067 HA ASP 133 HA ASP 133 -7.872 -12.703 1.917 1068 HB2 ASP 133 1HB ASP 133 -5.865 -14.413 3.289 1069 HB3 ASP 133 2HB ASP 133 -7.431 -14.229 4.093 1070 H ASP 134 H ASP 134 -5.292 -11.609 4.036 1071 HA ASP 134 HA ASP 134 -6.827 -10.825 6.238 1072 HB2 ASP 134 1HB ASP 134 -4.144 -10.720 5.518 1073 HB3 ASP 134 2HB ASP 134 -4.605 -9.022 5.693 1074 H LEU 135 H LEU 135 -6.015 -9.111 3.259 1075 HA LEU 135 HA LEU 135 -7.035 -6.598 3.951 1076 HB2 LEU 135 1HB LEU 135 -5.668 -6.748 2.032 1077 HB3 LEU 135 2HB LEU 135 -6.698 -8.001 1.317 1078 HG LEU 135 HG LEU 135 -8.294 -6.470 0.610 1079 HD11 LEU 135 1HD1 LEU 135 -7.974 -3.984 1.460 1080 HD12 LEU 135 2HD1 LEU 135 -7.271 -4.812 2.849 1081 HD13 LEU 135 3HD1 LEU 135 -8.928 -5.162 2.360 1082 HD21 LEU 135 3HD2 LEU 135 -6.749 -4.397 -0.124 1083 HD22 LEU 135 1HD2 LEU 135 -6.714 -5.969 -0.923 1084 HD23 LEU 135 2HD2 LEU 135 -5.501 -5.571 0.294 1085 H THR 136 H THR 136 -8.972 -7.076 5.121 1086 HA THR 136 HA THR 136 -11.272 -7.604 3.355 1087 HB THR 136 HB THR 136 -12.341 -8.358 5.660 1088 HG1 THR 136 1HG THR 136 -10.910 -9.086 7.106 1089 HG21 THR 136 3HG2 THR 136 -12.481 -10.256 4.505 1090 HG22 THR 136 1HG2 THR 136 -10.789 -10.611 4.853 1091 HG23 THR 136 2HG2 THR 136 -11.218 -9.680 3.418 1092 H GLU 137 H GLU 137 -13.191 -6.458 3.797 1093 HA GLU 137 HA GLU 137 -13.026 -3.801 4.325 1094 HB2 GLU 137 1HB GLU 137 -15.029 -4.724 3.389 1095 HB3 GLU 137 2HB GLU 137 -15.339 -5.666 4.857 1096 HG2 GLU 137 1HG GLU 137 -15.213 -3.084 5.806 1097 HG3 GLU 137 2HG GLU 137 -16.008 -2.906 4.236 1098 H THR 138 H THR 138 -13.589 -6.367 6.691 1099 HA THR 138 HA THR 138 -13.909 -4.596 8.906 1100 HB THR 138 HB THR 138 -13.145 -7.518 8.996 1101 HG1 THR 138 1HG THR 138 -15.244 -6.648 7.876 1102 HG21 THR 138 3HG2 THR 138 -12.879 -6.730 11.159 1103 HG22 THR 138 1HG2 THR 138 -14.562 -7.256 11.168 1104 HG23 THR 138 2HG2 THR 138 -14.174 -5.543 10.996 1105 H TRP 139 H TRP 139 -11.262 -6.789 7.949 1106 HA TRP 139 HA TRP 139 -9.440 -6.104 9.915 1107 HB2 TRP 139 1HB TRP 139 -8.834 -7.947 8.622 1108 HB3 TRP 139 2HB TRP 139 -9.145 -7.103 7.104 1109 HD1 TRP 139 HD TRP 139 -6.374 -7.905 9.488 1110 HE1 TRP 139 1HE TRP 139 -4.184 -6.820 8.681 1111 HE3 TRP 139 3HE TRP 139 -8.274 -4.852 5.853 1112 HZ2 TRP 139 2HZ TRP 139 -3.370 -4.920 6.757 1113 HZ3 TRP 139 3HZ TRP 139 -6.722 -3.432 4.576 1114 HH2 TRP 139 HH TRP 139 -4.321 -3.467 5.020 1115 H LEU 140 H LEU 140 -10.508 -4.265 7.209 1116 HA LEU 140 HA LEU 140 -8.241 -2.452 7.279 1117 HB2 LEU 140 1HB LEU 140 -8.993 -2.723 5.109 1118 HB3 LEU 140 2HB LEU 140 -10.695 -2.728 5.603 1119 HG LEU 140 HG LEU 140 -9.778 -0.715 4.272 1120 HD11 LEU 140 1HD1 LEU 140 -11.880 -1.050 5.997 1121 HD12 LEU 140 2HD1 LEU 140 -11.631 0.337 4.937 1122 HD13 LEU 140 3HD1 LEU 140 -11.099 0.405 6.617 1123 HD21 LEU 140 3HD2 LEU 140 -7.928 -0.619 6.252 1124 HD22 LEU 140 1HD2 LEU 140 -9.110 0.551 6.837 1125 HD23 LEU 140 2HD2 LEU 140 -8.381 0.755 5.244 1126 H LYS 141 H LYS 141 -11.767 -2.162 7.734 1127 HA LYS 141 HA LYS 141 -11.734 0.454 8.738 1128 HB2 LYS 141 1HB LYS 141 -13.658 -1.770 8.593 1129 HB3 LYS 141 2HB LYS 141 -13.928 -0.654 9.941 1130 HG2 LYS 141 1HG LYS 141 -14.550 1.060 8.601 1131 HG3 LYS 141 2HG LYS 141 -13.445 0.577 7.301 1132 HD2 LYS 141 1HD LYS 141 -15.256 -0.175 6.223 1133 HD3 LYS 141 2HD LYS 141 -15.250 -1.507 7.393 1134 HE2 LYS 141 1HE LYS 141 -16.537 0.996 8.311 1135 HE3 LYS 141 2HE LYS 141 -17.352 0.140 6.993 1136 HZ1 LYS 141 3HZ LYS 141 -17.449 -1.838 8.326 1137 HZ2 LYS 141 1HZ LYS 141 -18.111 -0.555 9.209 1138 HZ3 LYS 141 2HZ LYS 141 -16.554 -1.112 9.565 1139 H GLU 142 H GLU 142 -11.037 -2.591 10.239 1140 HA GLU 142 HA GLU 142 -11.437 -1.857 12.934 1141 HB2 GLU 142 1HB GLU 142 -9.923 -4.001 11.510 1142 HB3 GLU 142 2HB GLU 142 -9.575 -3.722 13.223 1143 HG2 GLU 142 1HG GLU 142 -12.236 -3.818 13.372 1144 HG3 GLU 142 2HG GLU 142 -11.998 -4.823 11.935 1145 H LYS 143 H LYS 143 -8.587 -1.726 10.833 1146 HA LYS 143 HA LYS 143 -6.786 -0.798 12.801 1147 HB2 LYS 143 1HB LYS 143 -6.700 -0.385 9.802 1148 HB3 LYS 143 2HB LYS 143 -5.339 -0.193 10.920 1149 HG2 LYS 143 1HG LYS 143 -6.655 -2.815 11.056 1150 HG3 LYS 143 2HG LYS 143 -5.884 -2.445 9.504 1151 HD2 LYS 143 1HD LYS 143 -3.948 -1.613 11.205 1152 HD3 LYS 143 2HD LYS 143 -4.676 -2.922 12.153 1153 HE2 LYS 143 1HE LYS 143 -4.330 -4.501 10.351 1154 HE3 LYS 143 2HE LYS 143 -3.745 -3.203 9.298 1155 HZ1 LYS 143 3HZ LYS 143 -1.791 -2.985 10.523 1156 HZ2 LYS 143 1HZ LYS 143 -2.020 -4.658 10.431 1157 HZ3 LYS 143 2HZ LYS 143 -2.402 -3.830 11.855 1158 H LEU 144 H LEU 144 -8.951 0.851 10.567 1159 HA LEU 144 HA LEU 144 -7.969 3.471 11.101 1160 HB2 LEU 144 1HB LEU 144 -10.740 2.791 10.132 1161 HB3 LEU 144 2HB LEU 144 -9.797 4.261 9.830 1162 HG LEU 144 HG LEU 144 -9.091 1.545 8.726 1163 HD11 LEU 144 1HD1 LEU 144 -10.621 3.828 7.496 1164 HD12 LEU 144 2HD1 LEU 144 -11.176 2.175 7.756 1165 HD13 LEU 144 3HD1 LEU 144 -9.912 2.503 6.571 1166 HD21 LEU 144 3HD2 LEU 144 -7.787 3.082 7.133 1167 HD22 LEU 144 1HD2 LEU 144 -7.139 2.819 8.752 1168 HD23 LEU 144 2HD2 LEU 144 -7.995 4.315 8.377 1169 H ALA 145 H ALA 145 -10.751 1.609 12.281 1170 HA ALA 145 HA ALA 145 -11.971 3.518 13.860 1171 HB1 ALA 145 3HB ALA 145 -11.977 0.624 13.686 1172 HB2 ALA 145 1HB ALA 145 -12.227 1.193 15.336 1173 HB3 ALA 145 2HB ALA 145 -13.296 1.737 14.044 1174 H SER 146 H SER 146 -12.048 3.174 16.404 1175 HA SER 146 HA SER 146 -9.310 3.679 17.323 1176 HB2 SER 146 1HB SER 146 -10.249 4.916 19.139 1177 HB3 SER 146 2HB SER 146 -11.141 5.395 17.684 1178 HG SER 146 HG SER 146 -12.405 4.844 19.648 1179 H GLY 147 H GLY 147 -9.903 1.015 16.901 1180 HA2 GLY 147 1HA GLY 147 -9.641 -1.009 17.960 1181 HA3 GLY 147 2HA GLY 147 -9.264 -0.109 19.422 1182 HA PRO 148 HA PRO 148 -13.641 -2.093 19.398 1183 HB2 PRO 148 2HB PRO 148 -13.121 -4.252 18.811 1184 HB3 PRO 148 1HB PRO 148 -13.108 -4.517 20.555 1185 HG2 PRO 148 1HG PRO 148 -10.800 -4.307 20.709 1186 HG3 PRO 148 2HG PRO 148 -10.969 -5.086 19.092 1187 HD2 PRO 148 1HD PRO 148 -9.585 -2.781 19.470 1188 HD3 PRO 148 2HD PRO 148 -10.492 -3.121 17.986 1189 H SER 149 H SER 149 -14.605 -3.231 21.515 1190 HA SER 149 HA SER 149 -13.395 -1.940 23.868 1191 HB2 SER 149 1HB SER 149 -15.781 -1.149 22.628 1192 HB3 SER 149 2HB SER 149 -16.286 -2.074 24.053 1193 HG SER 149 HG SER 149 -14.559 -0.681 25.125 1194 H SER 150 H SER 150 -13.070 -3.285 25.507 1195 HA SER 150 HA SER 150 -14.118 -5.984 25.367 1196 HB2 SER 150 1HB SER 150 -11.826 -5.888 25.956 1197 HB3 SER 150 2HB SER 150 -12.113 -4.618 27.158 1198 HG SER 150 HG SER 150 -13.081 -7.283 27.333 1199 H GLY 151 H GLY 151 -15.912 -6.626 26.351 1200 HA2 GLY 151 1HA GLY 151 -16.637 -6.150 28.975 1201 HA3 GLY 151 2HA GLY 151 -17.412 -4.884 28.035 Start of MODEL 3 1 H1 GLY 1 H GLY 1 12.662 -2.284 13.069 2 HA2 GLY 1 1HA GLY 1 11.568 -2.527 10.358 3 HA3 GLY 1 2HA GLY 1 12.870 -3.610 10.829 4 H SER 2 H SER 2 10.364 -4.525 10.009 5 HA SER 2 HA SER 2 9.606 -6.045 12.359 6 HB2 SER 2 1HB SER 2 8.170 -3.839 12.095 7 HB3 SER 2 2HB SER 2 7.331 -4.800 10.864 8 HG SER 2 HG SER 2 7.798 -5.820 13.455 9 H SER 3 H SER 3 9.491 -8.091 11.748 10 HA SER 3 HA SER 3 9.121 -9.973 10.521 11 HB2 SER 3 1HB SER 3 7.079 -8.122 9.660 12 HB3 SER 3 2HB SER 3 7.609 -9.122 8.296 13 HG SER 3 HG SER 3 7.359 -10.926 9.915 14 H GLY 4 H GLY 4 10.635 -10.892 9.310 15 HA2 GLY 4 1HA GLY 4 11.453 -11.011 6.932 16 HA3 GLY 4 2HA GLY 4 11.809 -9.300 7.115 17 H SER 5 H SER 5 12.942 -9.222 9.618 18 HA SER 5 HA SER 5 15.571 -9.569 9.286 19 HB2 SER 5 1HB SER 5 13.922 -9.104 11.490 20 HB3 SER 5 2HB SER 5 14.892 -10.513 11.954 21 HG SER 5 HG SER 5 15.813 -7.964 11.134 22 H SER 6 H SER 6 16.863 -11.182 8.740 23 HA SER 6 HA SER 6 16.447 -13.839 9.857 24 HB2 SER 6 1HB SER 6 16.878 -14.745 7.430 25 HB3 SER 6 2HB SER 6 15.240 -14.273 7.919 26 HG SER 6 HG SER 6 15.634 -12.230 6.928 27 H GLY 7 H GLY 7 18.388 -11.986 7.505 28 HA2 GLY 7 1HA GLY 7 20.776 -13.427 8.430 29 HA3 GLY 7 2HA GLY 7 20.649 -12.503 6.941 30 H SER 8 H SER 8 19.476 -10.165 8.078 31 HA SER 8 HA SER 8 20.069 -8.183 9.024 32 HB2 SER 8 1HB SER 8 21.022 -10.216 10.923 33 HB3 SER 8 2HB SER 8 21.891 -8.675 11.025 34 HG SER 8 HG SER 8 19.150 -9.190 11.418 35 H ASP 9 H ASP 9 21.162 -7.612 7.082 36 HA ASP 9 HA ASP 9 23.833 -6.785 7.467 37 HB2 ASP 9 1HB ASP 9 23.738 -9.428 6.761 38 HB3 ASP 9 2HB ASP 9 23.881 -8.642 5.183 39 H SER 10 H SER 10 22.470 -4.932 6.874 40 HA SER 10 HA SER 10 21.688 -3.356 5.425 41 HB2 SER 10 1HB SER 10 23.120 -2.802 3.663 42 HB3 SER 10 2HB SER 10 24.177 -3.709 4.757 43 HG SER 10 HG SER 10 23.112 -4.466 2.282 44 H LEU 11 H LEU 11 20.829 -3.025 3.078 45 HA LEU 11 HA LEU 11 19.590 -5.443 2.012 46 HB2 LEU 11 1HB LEU 11 17.962 -2.993 2.691 47 HB3 LEU 11 2HB LEU 11 17.375 -4.538 2.052 48 HG LEU 11 HG LEU 11 18.741 -4.518 4.702 49 HD11 LEU 11 1HD1 LEU 11 16.332 -4.200 5.619 50 HD12 LEU 11 2HD1 LEU 11 16.058 -3.353 4.097 51 HD13 LEU 11 3HD1 LEU 11 17.305 -2.787 5.209 52 HD21 LEU 11 3HD2 LEU 11 16.305 -6.033 3.814 53 HD22 LEU 11 1HD2 LEU 11 17.437 -6.423 5.108 54 HD23 LEU 11 2HD2 LEU 11 17.938 -6.576 3.424 55 H VAL 12 H VAL 12 17.966 -4.477 0.132 56 HA VAL 12 HA VAL 12 19.786 -2.941 -1.590 57 HB VAL 12 HB VAL 12 19.138 -5.140 -2.450 58 HG11 VAL 12 1HG1 VAL 12 17.022 -5.516 -1.461 59 HG12 VAL 12 2HG1 VAL 12 16.345 -4.053 -2.179 60 HG13 VAL 12 3HG1 VAL 12 16.745 -5.435 -3.200 61 HG21 VAL 12 3HG2 VAL 12 19.416 -4.147 -4.420 62 HG22 VAL 12 1HG2 VAL 12 17.679 -3.847 -4.466 63 HG23 VAL 12 2HG2 VAL 12 18.767 -2.630 -3.796 64 H VAL 13 H VAL 13 18.409 -1.435 0.253 65 HA VAL 13 HA VAL 13 15.946 -0.431 -0.218 66 HB VAL 13 HB VAL 13 18.410 1.234 0.315 67 HG11 VAL 13 1HG1 VAL 13 15.479 1.854 0.628 68 HG12 VAL 13 2HG1 VAL 13 16.771 2.808 1.361 69 HG13 VAL 13 3HG1 VAL 13 16.651 2.685 -0.395 70 HG21 VAL 13 3HG2 VAL 13 18.282 -0.351 2.038 71 HG22 VAL 13 1HG2 VAL 13 17.490 1.081 2.695 72 HG23 VAL 13 2HG2 VAL 13 16.522 -0.268 2.102 73 H CYS 14 H CYS 14 14.932 0.920 -1.640 74 HA CYS 14 HA CYS 14 16.469 1.700 -4.029 75 HB2 CYS 14 1HB CYS 14 13.633 0.718 -3.748 76 HB3 CYS 14 2HB CYS 14 14.205 1.547 -5.205 77 HG CYS 14 HG CYS 14 14.518 -0.858 -6.191 78 H GLU 15 H GLU 15 14.944 3.395 -5.308 79 HA GLU 15 HA GLU 15 14.458 5.556 -3.368 80 HB2 GLU 15 1HB GLU 15 14.944 7.127 -5.162 81 HB3 GLU 15 2HB GLU 15 16.282 5.984 -4.963 82 HG2 GLU 15 1HG GLU 15 14.927 4.671 -6.846 83 HG3 GLU 15 2HG GLU 15 14.395 6.318 -7.215 84 H VAL 16 H VAL 16 12.795 7.164 -4.028 85 HA VAL 16 HA VAL 16 10.404 5.756 -4.916 86 HB VAL 16 HB VAL 16 10.299 7.102 -2.855 87 HG11 VAL 16 1HG1 VAL 16 10.930 9.251 -2.698 88 HG12 VAL 16 2HG1 VAL 16 11.832 8.915 -4.177 89 HG13 VAL 16 3HG1 VAL 16 10.242 9.672 -4.265 90 HG21 VAL 16 3HG2 VAL 16 8.571 7.649 -5.204 91 HG22 VAL 16 1HG2 VAL 16 8.178 6.898 -3.658 92 HG23 VAL 16 2HG2 VAL 16 8.344 8.650 -3.771 93 H ASP 17 H ASP 17 10.446 5.632 -7.114 94 HA ASP 17 HA ASP 17 11.410 7.179 -9.047 95 HB2 ASP 17 1HB ASP 17 9.958 5.172 -9.384 96 HB3 ASP 17 2HB ASP 17 8.548 6.204 -9.109 97 HA PRO 18 HA PRO 18 9.857 11.279 -8.620 98 HB2 PRO 18 2HB PRO 18 11.638 11.922 -9.920 99 HB3 PRO 18 1HB PRO 18 10.399 12.190 -11.145 100 HG2 PRO 18 1HG PRO 18 10.764 10.133 -12.163 101 HG3 PRO 18 2HG PRO 18 12.433 10.556 -11.626 102 HD2 PRO 18 1HD PRO 18 11.238 8.205 -10.982 103 HD3 PRO 18 2HD PRO 18 12.366 9.034 -9.897 104 H GLU 19 H GLU 19 8.791 9.230 -11.280 105 HA GLU 19 HA GLU 19 6.590 10.893 -12.027 106 HB2 GLU 19 1HB GLU 19 6.165 9.365 -13.674 107 HB3 GLU 19 2HB GLU 19 7.859 8.975 -13.339 108 HG2 GLU 19 1HG GLU 19 7.173 6.869 -13.130 109 HG3 GLU 19 2HG GLU 19 6.535 7.377 -11.559 110 H LEU 20 H LEU 20 7.106 8.404 -9.675 111 HA LEU 20 HA LEU 20 4.263 8.010 -9.214 112 HB2 LEU 20 1HB LEU 20 6.242 6.269 -9.056 113 HB3 LEU 20 2HB LEU 20 6.362 6.913 -7.410 114 HG LEU 20 HG LEU 20 3.929 5.597 -8.615 115 HD11 LEU 20 1HD1 LEU 20 5.885 4.630 -6.535 116 HD12 LEU 20 2HD1 LEU 20 5.721 4.013 -8.179 117 HD13 LEU 20 3HD1 LEU 20 4.406 3.802 -7.022 118 HD21 LEU 20 3HD2 LEU 20 4.322 7.250 -6.248 119 HD22 LEU 20 1HD2 LEU 20 3.622 5.672 -5.886 120 HD23 LEU 20 2HD2 LEU 20 2.832 6.742 -7.043 121 H LYS 21 H LYS 21 7.063 9.442 -7.605 122 HA LYS 21 HA LYS 21 6.209 10.033 -5.123 123 HB2 LYS 21 1HB LYS 21 8.354 10.780 -6.229 124 HB3 LYS 21 2HB LYS 21 7.440 12.139 -6.901 125 HG2 LYS 21 1HG LYS 21 6.780 12.503 -4.364 126 HG3 LYS 21 2HG LYS 21 8.303 11.633 -4.108 127 HD2 LYS 21 1HD LYS 21 8.279 13.868 -6.083 128 HD3 LYS 21 2HD LYS 21 8.233 14.268 -4.357 129 HE2 LYS 21 1HE LYS 21 10.303 13.216 -3.935 130 HE3 LYS 21 2HE LYS 21 10.261 12.358 -5.481 131 HZ1 LYS 21 3HZ LYS 21 11.789 14.112 -5.729 132 HZ2 LYS 21 1HZ LYS 21 10.746 15.244 -5.029 133 HZ3 LYS 21 2HZ LYS 21 10.399 14.608 -6.557 134 H GLU 22 H GLU 22 5.304 11.871 -8.029 135 HA GLU 22 HA GLU 22 3.645 13.723 -6.686 136 HB2 GLU 22 1HB GLU 22 3.169 12.900 -9.535 137 HB3 GLU 22 2HB GLU 22 3.032 14.503 -8.796 138 HG2 GLU 22 1HG GLU 22 5.611 14.252 -8.443 139 HG3 GLU 22 2HG GLU 22 5.459 13.056 -9.739 140 H THR 23 H THR 23 2.928 10.711 -8.423 141 HA THR 23 HA THR 23 0.207 10.658 -8.389 142 HB THR 23 HB THR 23 2.189 8.439 -7.961 143 HG1 THR 23 1HG THR 23 1.988 9.303 -10.061 144 HG21 THR 23 3HG2 THR 23 0.493 7.343 -6.913 145 HG22 THR 23 1HG2 THR 23 -0.024 7.061 -8.575 146 HG23 THR 23 2HG2 THR 23 -0.755 8.360 -7.632 147 H LEU 24 H LEU 24 2.343 9.756 -5.698 148 HA LEU 24 HA LEU 24 0.259 9.049 -3.916 149 HB2 LEU 24 1HB LEU 24 2.957 10.077 -3.069 150 HB3 LEU 24 2HB LEU 24 1.912 8.900 -2.253 151 HG LEU 24 HG LEU 24 3.453 8.427 -4.804 152 HD11 LEU 24 1HD1 LEU 24 3.991 6.796 -2.433 153 HD12 LEU 24 2HD1 LEU 24 4.442 8.493 -2.269 154 HD13 LEU 24 3HD1 LEU 24 5.104 7.529 -3.588 155 HD21 LEU 24 3HD2 LEU 24 1.246 7.008 -3.528 156 HD22 LEU 24 1HD2 LEU 24 2.661 5.995 -3.814 157 HD23 LEU 24 2HD2 LEU 24 1.907 6.853 -5.157 158 H ARG 25 H ARG 25 2.210 12.004 -4.251 159 HA ARG 25 HA ARG 25 1.023 13.450 -2.169 160 HB2 ARG 25 1HB ARG 25 3.126 14.079 -3.329 161 HB3 ARG 25 2HB ARG 25 2.168 14.551 -4.741 162 HG2 ARG 25 1HG ARG 25 1.187 16.370 -3.625 163 HG3 ARG 25 2HG ARG 25 1.708 15.772 -2.041 164 HD2 ARG 25 1HD ARG 25 3.603 16.933 -2.186 165 HD3 ARG 25 2HD ARG 25 4.010 16.090 -3.687 166 HE ARG 25 HE ARG 25 2.234 17.993 -4.474 167 HH11 ARG 25 2HH1 ARG 25 5.222 18.037 -2.689 168 HH12 ARG 25 1HH1 ARG 25 5.670 19.623 -3.224 169 HH21 ARG 25 1HH2 ARG 25 4.297 20.786 -4.643 170 HH22 ARG 25 2HH2 ARG 25 2.811 20.082 -5.185 171 H LYS 26 H LYS 26 -0.040 12.802 -5.418 172 HA LYS 26 HA LYS 26 -2.115 14.819 -5.357 173 HB2 LYS 26 1HB LYS 26 -1.917 12.582 -7.362 174 HB3 LYS 26 2HB LYS 26 -2.601 14.201 -7.573 175 HG2 LYS 26 1HG LYS 26 0.134 14.513 -6.874 176 HG3 LYS 26 2HG LYS 26 0.023 13.295 -8.158 177 HD2 LYS 26 1HD LYS 26 -1.694 15.128 -9.134 178 HD3 LYS 26 2HD LYS 26 -0.599 16.184 -8.225 179 HE2 LYS 26 1HE LYS 26 1.316 15.359 -9.438 180 HE3 LYS 26 2HE LYS 26 0.318 14.135 -10.238 181 HZ1 LYS 26 3HZ LYS 26 -0.731 15.722 -11.543 182 HZ2 LYS 26 1HZ LYS 26 0.873 16.258 -11.514 183 HZ3 LYS 26 2HZ LYS 26 -0.287 17.009 -10.539 184 H PHE 27 H PHE 27 -1.831 11.328 -4.992 185 HA PHE 27 HA PHE 27 -4.552 10.676 -5.017 186 HB2 PHE 27 1HB PHE 27 -2.473 9.135 -5.023 187 HB3 PHE 27 2HB PHE 27 -2.552 9.266 -3.266 188 HD1 PHE 27 2HD PHE 27 -5.285 8.970 -5.776 189 HD2 PHE 27 1HD PHE 27 -3.261 7.223 -2.463 190 HE1 PHE 27 2HE PHE 27 -6.969 7.178 -5.696 191 HE2 PHE 27 1HE PHE 27 -4.941 5.428 -2.380 192 HZ PHE 27 HZ PHE 27 -6.799 5.405 -3.997 193 H ARG 28 H ARG 28 -2.472 11.860 -2.440 194 HA ARG 28 HA ARG 28 -4.343 11.460 -0.335 195 HB2 ARG 28 1HB ARG 28 -2.165 13.545 -0.329 196 HB3 ARG 28 2HB ARG 28 -2.831 12.642 1.040 197 HG2 ARG 28 1HG ARG 28 -1.821 10.677 -0.653 198 HG3 ARG 28 2HG ARG 28 -0.625 11.984 -0.697 199 HD2 ARG 28 1HD ARG 28 -1.717 10.634 1.782 200 HD3 ARG 28 2HD ARG 28 -0.104 10.421 1.087 201 HE ARG 28 HE ARG 28 -0.143 13.056 1.525 202 HH11 ARG 28 2HH1 ARG 28 -1.060 10.376 3.549 203 HH12 ARG 28 1HH1 ARG 28 -0.655 11.184 5.026 204 HH21 ARG 28 1HH2 ARG 28 0.170 13.321 4.977 205 HH22 ARG 28 2HH2 ARG 28 0.393 14.131 3.464 206 H PHE 29 H PHE 29 -3.663 14.100 -2.549 207 HA PHE 29 HA PHE 29 -5.992 15.532 -1.453 208 HB2 PHE 29 1HB PHE 29 -3.967 17.119 -2.918 209 HB3 PHE 29 2HB PHE 29 -4.903 17.530 -1.479 210 HD1 PHE 29 2HD PHE 29 -4.254 15.727 0.551 211 HD2 PHE 29 1HD PHE 29 -1.707 17.218 -2.516 212 HE1 PHE 29 2HE PHE 29 -2.294 15.303 1.977 213 HE2 PHE 29 1HE PHE 29 0.257 16.796 -1.095 214 HZ PHE 29 HZ PHE 29 -0.036 15.838 1.154 215 H ARG 30 H ARG 30 -6.190 13.592 -3.461 216 HA ARG 30 HA ARG 30 -6.147 14.732 -6.064 217 HB2 ARG 30 1HB ARG 30 -7.491 12.750 -6.712 218 HB3 ARG 30 2HB ARG 30 -6.032 12.335 -5.800 219 HG2 ARG 30 1HG ARG 30 -7.621 12.370 -3.736 220 HG3 ARG 30 2HG ARG 30 -8.888 12.177 -4.960 221 HD2 ARG 30 1HD ARG 30 -6.670 10.368 -5.445 222 HD3 ARG 30 2HD ARG 30 -7.341 10.163 -3.821 223 HE ARG 30 HE ARG 30 -8.636 9.547 -6.327 224 HH11 ARG 30 2HH1 ARG 30 -9.053 10.185 -2.930 225 HH12 ARG 30 1HH1 ARG 30 -10.582 9.375 -2.832 226 HH21 ARG 30 1HH2 ARG 30 -11.487 8.404 -4.699 227 HH22 ARG 30 2HH2 ARG 30 -10.647 8.479 -6.211 228 H LYS 31 H LYS 31 -8.095 15.002 -7.428 229 HA LYS 31 HA LYS 31 -10.035 16.644 -6.034 230 HB2 LYS 31 1HB LYS 31 -9.243 16.193 -8.874 231 HB3 LYS 31 2HB LYS 31 -10.882 16.784 -8.556 232 HG2 LYS 31 1HG LYS 31 -9.214 18.373 -6.970 233 HG3 LYS 31 2HG LYS 31 -8.387 18.211 -8.529 234 HD2 LYS 31 1HD LYS 31 -10.888 18.672 -9.410 235 HD3 LYS 31 2HD LYS 31 -10.944 19.542 -7.867 236 HE2 LYS 31 1HE LYS 31 -8.571 20.428 -8.768 237 HE3 LYS 31 2HE LYS 31 -9.378 20.112 -10.312 238 HZ1 LYS 31 3HZ LYS 31 -9.993 22.266 -9.887 239 HZ2 LYS 31 1HZ LYS 31 -10.095 22.040 -8.213 240 HZ3 LYS 31 2HZ LYS 31 -11.307 21.431 -9.224 241 H GLU 32 H GLU 32 -10.067 13.753 -5.601 242 HA GLU 32 HA GLU 32 -12.720 13.114 -6.711 243 HB2 GLU 32 1HB GLU 32 -10.422 11.332 -5.901 244 HB3 GLU 32 2HB GLU 32 -12.064 10.714 -6.138 245 HG2 GLU 32 1HG GLU 32 -10.413 12.134 -8.228 246 HG3 GLU 32 2HG GLU 32 -10.658 10.385 -8.111 247 H THR 33 H THR 33 -13.814 11.368 -5.197 248 HA THR 33 HA THR 33 -13.412 11.939 -2.374 249 HB THR 33 HB THR 33 -15.823 12.490 -2.032 250 HG1 THR 33 1HG THR 33 -15.890 11.971 -4.691 251 HG21 THR 33 3HG2 THR 33 -14.257 14.380 -3.792 252 HG22 THR 33 1HG2 THR 33 -14.172 14.272 -2.034 253 HG23 THR 33 2HG2 THR 33 -15.654 14.827 -2.812 254 H ASN 34 H ASN 34 -13.199 9.603 -4.123 255 HA ASN 34 HA ASN 34 -15.126 7.870 -2.730 256 HB2 ASN 34 1HB ASN 34 -16.019 7.255 -4.682 257 HB3 ASN 34 2HB ASN 34 -14.873 8.276 -5.559 258 HD21 ASN 34 2HD2 ASN 34 -12.837 5.679 -6.627 259 HD22 ASN 34 1HD2 ASN 34 -13.104 7.382 -6.521 260 H ASN 35 H ASN 35 -14.360 5.470 -3.012 261 HA ASN 35 HA ASN 35 -11.750 5.335 -1.824 262 HB2 ASN 35 1HB ASN 35 -13.759 3.205 -2.591 263 HB3 ASN 35 2HB ASN 35 -12.223 2.856 -1.792 264 HD21 ASN 35 2HD2 ASN 35 -14.403 2.963 1.018 265 HD22 ASN 35 1HD2 ASN 35 -13.838 1.924 -0.241 266 H ALA 36 H ALA 36 -9.884 4.489 -2.662 267 HA ALA 36 HA ALA 36 -9.823 3.233 -5.253 268 HB1 ALA 36 3HB ALA 36 -9.955 5.544 -5.956 269 HB2 ALA 36 1HB ALA 36 -8.606 5.970 -4.904 270 HB3 ALA 36 2HB ALA 36 -8.344 4.910 -6.289 271 H ALA 37 H ALA 37 -7.718 2.413 -5.806 272 HA ALA 37 HA ALA 37 -5.777 2.441 -3.596 273 HB1 ALA 37 3HB ALA 37 -7.375 0.245 -4.326 274 HB2 ALA 37 1HB ALA 37 -5.743 -0.108 -4.896 275 HB3 ALA 37 2HB ALA 37 -6.021 0.273 -3.196 276 H ILE 38 H ILE 38 -3.597 1.983 -4.204 277 HA ILE 38 HA ILE 38 -3.043 2.136 -7.086 278 HB ILE 38 HB ILE 38 -1.560 3.754 -5.015 279 HG12 ILE 38 1HG1 ILE 38 -3.731 4.518 -6.971 280 HG13 ILE 38 2HG1 ILE 38 -3.735 4.724 -5.211 281 HG21 ILE 38 1HG2 ILE 38 -0.869 2.939 -7.615 282 HG22 ILE 38 2HG2 ILE 38 -1.272 4.652 -7.716 283 HG23 ILE 38 3HG2 ILE 38 -0.034 4.104 -6.587 284 HD11 ILE 38 3HD1 ILE 38 -1.663 6.239 -5.661 285 HD12 ILE 38 1HD1 ILE 38 -2.335 6.330 -7.289 286 HD13 ILE 38 2HD1 ILE 38 -3.295 6.860 -5.907 287 H ILE 39 H ILE 39 -2.121 0.217 -7.469 288 HA ILE 39 HA ILE 39 -0.327 -0.984 -5.524 289 HB ILE 39 HB ILE 39 -1.152 -2.017 -8.240 290 HG12 ILE 39 1HG1 ILE 39 -2.191 -3.250 -5.756 291 HG13 ILE 39 2HG1 ILE 39 -2.834 -1.647 -6.149 292 HG21 ILE 39 1HG2 ILE 39 0.520 -3.454 -7.886 293 HG22 ILE 39 2HG2 ILE 39 0.702 -2.958 -6.204 294 HG23 ILE 39 3HG2 ILE 39 -0.511 -4.160 -6.642 295 HD11 ILE 39 3HD1 ILE 39 -3.046 -2.883 -8.549 296 HD12 ILE 39 1HD1 ILE 39 -3.320 -4.226 -7.440 297 HD13 ILE 39 2HD1 ILE 39 -4.335 -2.786 -7.349 298 H MET 40 H MET 40 1.756 -0.486 -5.505 299 HA MET 40 HA MET 40 3.060 0.212 -8.053 300 HB2 MET 40 1HB MET 40 4.098 1.029 -5.348 301 HB3 MET 40 2HB MET 40 4.464 1.729 -6.932 302 HG2 MET 40 1HG MET 40 2.569 2.999 -6.985 303 HG3 MET 40 2HG MET 40 1.658 1.859 -5.992 304 HE1 MET 40 3HE MET 40 0.818 3.261 -3.530 305 HE2 MET 40 1HE MET 40 1.513 1.659 -3.777 306 HE3 MET 40 2HE MET 40 2.140 2.704 -2.502 307 H LYS 41 H LYS 41 5.246 -0.480 -8.351 308 HA LYS 41 HA LYS 41 6.098 -2.686 -6.605 309 HB2 LYS 41 1HB LYS 41 6.612 -4.103 -8.443 310 HB3 LYS 41 2HB LYS 41 4.963 -3.511 -8.705 311 HG2 LYS 41 1HG LYS 41 5.540 -2.236 -10.511 312 HG3 LYS 41 2HG LYS 41 7.203 -2.004 -9.944 313 HD2 LYS 41 1HD LYS 41 7.918 -4.059 -10.742 314 HD3 LYS 41 2HD LYS 41 6.279 -4.734 -10.739 315 HE2 LYS 41 1HE LYS 41 5.654 -3.413 -12.657 316 HE3 LYS 41 2HE LYS 41 7.197 -2.546 -12.599 317 HZ1 LYS 41 3HZ LYS 41 8.353 -4.585 -13.130 318 HZ2 LYS 41 1HZ LYS 41 7.175 -4.273 -14.304 319 HZ3 LYS 41 2HZ LYS 41 6.901 -5.454 -13.125 320 H VAL 42 H VAL 42 8.429 -3.389 -7.371 321 HA VAL 42 HA VAL 42 9.996 -0.924 -7.776 322 HB VAL 42 HB VAL 42 10.587 -1.402 -5.618 323 HG11 VAL 42 1HG1 VAL 42 10.982 -3.970 -5.023 324 HG12 VAL 42 2HG1 VAL 42 9.397 -3.204 -4.912 325 HG13 VAL 42 3HG1 VAL 42 9.813 -4.174 -6.327 326 HG21 VAL 42 3HG2 VAL 42 12.765 -2.385 -5.576 327 HG22 VAL 42 1HG2 VAL 42 12.433 -3.316 -7.037 328 HG23 VAL 42 2HG2 VAL 42 12.583 -1.561 -7.124 329 H ASP 43 H ASP 43 11.080 -0.924 -9.620 330 HA ASP 43 HA ASP 43 11.462 -3.336 -11.138 331 HB2 ASP 43 1HB ASP 43 11.969 -0.419 -11.574 332 HB3 ASP 43 2HB ASP 43 12.820 -1.587 -12.595 333 H LYS 44 H LYS 44 13.066 -4.704 -10.776 334 HA LYS 44 HA LYS 44 15.326 -4.094 -9.182 335 HB2 LYS 44 1HB LYS 44 14.306 -6.364 -9.454 336 HB3 LYS 44 2HB LYS 44 14.996 -6.419 -11.085 337 HG2 LYS 44 1HG LYS 44 17.145 -5.755 -9.440 338 HG3 LYS 44 2HG LYS 44 16.236 -6.984 -8.544 339 HD2 LYS 44 1HD LYS 44 16.207 -8.320 -10.733 340 HD3 LYS 44 2HD LYS 44 17.456 -7.190 -11.284 341 HE2 LYS 44 1HE LYS 44 18.606 -7.810 -9.001 342 HE3 LYS 44 2HE LYS 44 17.581 -9.246 -9.123 343 HZ1 LYS 44 3HZ LYS 44 19.638 -9.770 -10.129 344 HZ2 LYS 44 1HZ LYS 44 19.652 -8.348 -11.045 345 HZ3 LYS 44 2HZ LYS 44 18.536 -9.569 -11.396 346 H ASP 45 H ASP 45 14.634 -3.470 -12.426 347 HA ASP 45 HA ASP 45 17.360 -3.587 -13.379 348 HB2 ASP 45 1HB ASP 45 14.774 -3.460 -14.558 349 HB3 ASP 45 2HB ASP 45 15.679 -2.041 -15.104 350 H ARG 46 H ARG 46 15.195 -1.223 -12.031 351 HA ARG 46 HA ARG 46 17.283 0.828 -12.367 352 HB2 ARG 46 1HB ARG 46 14.315 1.341 -12.096 353 HB3 ARG 46 2HB ARG 46 15.579 2.524 -12.468 354 HG2 ARG 46 1HG ARG 46 15.944 1.596 -14.633 355 HG3 ARG 46 2HG ARG 46 14.909 0.206 -14.262 356 HD2 ARG 46 1HD ARG 46 13.304 1.387 -15.314 357 HD3 ARG 46 2HD ARG 46 13.205 2.266 -13.782 358 HE ARG 46 HE ARG 46 15.124 3.614 -15.121 359 HH11 ARG 46 2HH1 ARG 46 11.895 2.610 -15.953 360 HH12 ARG 46 1HH1 ARG 46 11.614 3.945 -17.020 361 HH21 ARG 46 1HH2 ARG 46 13.248 5.518 -17.345 362 HH22 ARG 46 2HH2 ARG 46 14.765 5.377 -16.524 363 H GLN 47 H GLN 47 16.052 -1.203 -10.191 364 HA GLN 47 HA GLN 47 15.681 -1.203 -7.925 365 HB2 GLN 47 1HB GLN 47 17.985 0.750 -7.916 366 HB3 GLN 47 2HB GLN 47 17.568 -0.449 -6.680 367 HG2 GLN 47 1HG GLN 47 18.038 -1.650 -9.292 368 HG3 GLN 47 2HG GLN 47 19.434 -0.754 -8.676 369 HE21 GLN 47 2HE2 GLN 47 18.174 -4.165 -6.833 370 HE22 GLN 47 1HE2 GLN 47 17.163 -3.330 -7.957 371 H MET 48 H MET 48 13.818 0.415 -8.939 372 HA MET 48 HA MET 48 13.575 2.459 -6.876 373 HB2 MET 48 1HB MET 48 13.383 4.279 -8.233 374 HB3 MET 48 2HB MET 48 14.494 3.320 -9.224 375 HG2 MET 48 1HG MET 48 12.154 2.391 -10.168 376 HG3 MET 48 2HG MET 48 11.668 4.018 -9.685 377 HE1 MET 48 3HE MET 48 12.970 5.980 -10.079 378 HE2 MET 48 1HE MET 48 14.561 5.942 -10.839 379 HE3 MET 48 2HE MET 48 13.149 6.434 -11.775 380 H VAL 49 H VAL 49 11.434 3.024 -6.384 381 HA VAL 49 HA VAL 49 9.499 0.989 -7.062 382 HB VAL 49 HB VAL 49 9.138 3.435 -5.327 383 HG11 VAL 49 1HG1 VAL 49 7.520 0.919 -5.675 384 HG12 VAL 49 2HG1 VAL 49 7.303 2.044 -4.333 385 HG13 VAL 49 3HG1 VAL 49 7.015 2.579 -5.989 386 HG21 VAL 49 3HG2 VAL 49 10.940 2.061 -4.464 387 HG22 VAL 49 1HG2 VAL 49 9.516 1.900 -3.436 388 HG23 VAL 49 2HG2 VAL 49 9.929 0.621 -4.578 389 H VAL 50 H VAL 50 8.350 1.126 -8.867 390 HA VAL 50 HA VAL 50 7.394 3.781 -9.723 391 HB VAL 50 HB VAL 50 7.400 2.922 -12.049 392 HG11 VAL 50 1HG1 VAL 50 10.126 2.727 -10.780 393 HG12 VAL 50 2HG1 VAL 50 9.740 3.222 -12.430 394 HG13 VAL 50 3HG1 VAL 50 9.283 4.248 -11.070 395 HG21 VAL 50 3HG2 VAL 50 7.466 0.466 -11.072 396 HG22 VAL 50 1HG2 VAL 50 8.141 0.848 -12.656 397 HG23 VAL 50 2HG2 VAL 50 9.204 0.695 -11.257 398 H LEU 51 H LEU 51 5.275 3.976 -10.327 399 HA LEU 51 HA LEU 51 3.345 2.384 -9.196 400 HB2 LEU 51 1HB LEU 51 2.809 4.582 -9.964 401 HB3 LEU 51 2HB LEU 51 3.201 4.141 -11.636 402 HG LEU 51 HG LEU 51 1.185 2.381 -11.010 403 HD11 LEU 51 1HD1 LEU 51 -0.256 3.204 -9.525 404 HD12 LEU 51 2HD1 LEU 51 -0.124 4.838 -10.175 405 HD13 LEU 51 3HD1 LEU 51 1.057 4.259 -8.999 406 HD21 LEU 51 3HD2 LEU 51 0.477 5.035 -12.149 407 HD22 LEU 51 1HD2 LEU 51 0.069 3.415 -12.714 408 HD23 LEU 51 2HD2 LEU 51 1.688 4.060 -12.982 409 H GLU 52 H GLU 52 1.963 0.759 -9.926 410 HA GLU 52 HA GLU 52 2.877 -0.664 -12.341 411 HB2 GLU 52 1HB GLU 52 3.480 -1.867 -10.288 412 HB3 GLU 52 2HB GLU 52 1.780 -1.856 -9.788 413 HG2 GLU 52 1HG GLU 52 1.210 -3.547 -11.158 414 HG3 GLU 52 2HG GLU 52 2.304 -3.008 -12.441 415 H ASP 53 H ASP 53 0.085 -0.251 -10.168 416 HA ASP 53 HA ASP 53 -1.664 -0.011 -12.474 417 HB2 ASP 53 1HB ASP 53 -1.723 -2.310 -10.555 418 HB3 ASP 53 2HB ASP 53 -3.251 -1.694 -11.198 419 H GLU 54 H GLU 54 -3.930 0.542 -11.781 420 HA GLU 54 HA GLU 54 -4.188 1.658 -9.116 421 HB2 GLU 54 1HB GLU 54 -3.716 3.290 -11.536 422 HB3 GLU 54 2HB GLU 54 -5.050 3.825 -10.501 423 HG2 GLU 54 1HG GLU 54 -3.241 3.508 -8.596 424 HG3 GLU 54 2HG GLU 54 -2.135 3.759 -9.955 425 H LEU 55 H LEU 55 -6.122 1.026 -8.454 426 HA LEU 55 HA LEU 55 -8.312 0.895 -10.421 427 HB2 LEU 55 1HB LEU 55 -8.210 -0.681 -7.859 428 HB3 LEU 55 2HB LEU 55 -9.231 -0.944 -9.283 429 HG LEU 55 HG LEU 55 -6.282 -1.228 -9.586 430 HD11 LEU 55 1HD1 LEU 55 -6.597 -2.485 -7.592 431 HD12 LEU 55 2HD1 LEU 55 -6.528 -3.634 -8.929 432 HD13 LEU 55 3HD1 LEU 55 -8.082 -3.210 -8.211 433 HD21 LEU 55 3HD2 LEU 55 -8.409 -1.538 -11.261 434 HD22 LEU 55 1HD2 LEU 55 -8.140 -3.192 -10.711 435 HD23 LEU 55 2HD2 LEU 55 -6.831 -2.296 -11.480 436 H GLN 56 H GLN 56 -10.084 2.075 -10.046 437 HA GLN 56 HA GLN 56 -10.311 3.405 -7.428 438 HB2 GLN 56 1HB GLN 56 -11.268 4.344 -10.144 439 HB3 GLN 56 2HB GLN 56 -11.519 5.204 -8.616 440 HG2 GLN 56 1HG GLN 56 -9.701 6.323 -9.433 441 HG3 GLN 56 2HG GLN 56 -8.917 5.077 -8.450 442 HE21 GLN 56 2HE2 GLN 56 -6.953 4.175 -11.136 443 HE22 GLN 56 1HE2 GLN 56 -7.091 4.614 -9.470 444 H ASN 57 H ASN 57 -12.507 3.894 -6.698 445 HA ASN 57 HA ASN 57 -14.593 3.225 -6.085 446 HB2 ASN 57 1HB ASN 57 -15.512 1.979 -8.504 447 HB3 ASN 57 2HB ASN 57 -15.986 3.532 -7.807 448 HD21 ASN 57 2HD2 ASN 57 -13.411 5.316 -9.660 449 HD22 ASN 57 1HD2 ASN 57 -13.929 5.134 -8.021 450 H ILE 58 H ILE 58 -12.623 1.444 -5.414 451 HA ILE 58 HA ILE 58 -13.980 -1.147 -5.775 452 HB ILE 58 HB ILE 58 -12.108 -1.873 -6.753 453 HG12 ILE 58 1HG1 ILE 58 -11.934 -2.696 -4.349 454 HG13 ILE 58 2HG1 ILE 58 -10.445 -2.745 -5.308 455 HG21 ILE 58 1HG2 ILE 58 -11.189 0.138 -7.414 456 HG22 ILE 58 2HG2 ILE 58 -10.941 0.689 -5.758 457 HG23 ILE 58 3HG2 ILE 58 -9.889 -0.550 -6.441 458 HD11 ILE 58 3HD1 ILE 58 -10.953 -1.396 -2.838 459 HD12 ILE 58 1HD1 ILE 58 -9.431 -1.621 -3.700 460 HD13 ILE 58 2HD1 ILE 58 -10.459 -0.237 -4.071 461 H SER 59 H SER 59 -14.205 -2.440 -3.983 462 HA SER 59 HA SER 59 -13.916 -1.100 -1.428 463 HB2 SER 59 1HB SER 59 -15.608 -3.171 -2.532 464 HB3 SER 59 2HB SER 59 -14.879 -3.712 -1.011 465 HG SER 59 HG SER 59 -16.032 -1.151 -1.195 466 HA PRO 60 HA PRO 60 -10.437 -3.242 0.171 467 HB2 PRO 60 2HB PRO 60 -10.935 -2.405 2.252 468 HB3 PRO 60 1HB PRO 60 -11.235 -4.097 2.649 469 HG2 PRO 60 1HG PRO 60 -13.529 -3.908 2.338 470 HG3 PRO 60 2HG PRO 60 -13.134 -2.278 3.000 471 HD2 PRO 60 1HD PRO 60 -14.476 -2.626 0.666 472 HD3 PRO 60 2HD PRO 60 -13.357 -1.278 0.935 473 H GLU 61 H GLU 61 -13.072 -4.926 -0.829 474 HA GLU 61 HA GLU 61 -11.955 -7.536 -0.055 475 HB2 GLU 61 1HB GLU 61 -14.647 -6.518 -0.233 476 HB3 GLU 61 2HB GLU 61 -14.450 -7.918 -1.299 477 HG2 GLU 61 1HG GLU 61 -13.202 -8.685 1.060 478 HG3 GLU 61 2HG GLU 61 -14.645 -7.802 1.581 479 H GLU 62 H GLU 62 -12.434 -5.390 -2.666 480 HA GLU 62 HA GLU 62 -12.229 -7.447 -4.707 481 HB2 GLU 62 1HB GLU 62 -13.432 -4.997 -4.669 482 HB3 GLU 62 2HB GLU 62 -11.919 -4.633 -5.514 483 HG2 GLU 62 1HG GLU 62 -13.216 -7.063 -6.483 484 HG3 GLU 62 2HG GLU 62 -14.208 -5.609 -6.663 485 H LEU 63 H LEU 63 -10.258 -4.894 -3.286 486 HA LEU 63 HA LEU 63 -8.098 -4.951 -5.044 487 HB2 LEU 63 1HB LEU 63 -8.727 -3.754 -2.569 488 HB3 LEU 63 2HB LEU 63 -7.186 -4.602 -2.346 489 HG LEU 63 HG LEU 63 -7.780 -2.451 -4.375 490 HD11 LEU 63 1HD1 LEU 63 -6.637 -2.486 -1.686 491 HD12 LEU 63 2HD1 LEU 63 -7.302 -1.148 -2.623 492 HD13 LEU 63 3HD1 LEU 63 -5.635 -1.664 -2.883 493 HD21 LEU 63 3HD2 LEU 63 -5.892 -2.936 -5.476 494 HD22 LEU 63 1HD2 LEU 63 -6.047 -4.529 -4.736 495 HD23 LEU 63 2HD2 LEU 63 -5.011 -3.311 -3.994 496 H LYS 64 H LYS 64 -8.390 -6.652 -1.920 497 HA LYS 64 HA LYS 64 -6.126 -8.086 -1.795 498 HB2 LYS 64 1HB LYS 64 -7.240 -9.034 -0.119 499 HB3 LYS 64 2HB LYS 64 -8.758 -8.383 -0.762 500 HG2 LYS 64 1HG LYS 64 -9.192 -10.341 -2.018 501 HG3 LYS 64 2HG LYS 64 -7.551 -10.953 -1.744 502 HD2 LYS 64 1HD LYS 64 -8.255 -12.028 0.071 503 HD3 LYS 64 2HD LYS 64 -8.698 -10.473 0.798 504 HE2 LYS 64 1HE LYS 64 -10.785 -10.880 -0.924 505 HE3 LYS 64 2HE LYS 64 -10.392 -12.531 -0.424 506 HZ1 LYS 64 3HZ LYS 64 -10.436 -11.589 1.931 507 HZ2 LYS 64 1HZ LYS 64 -11.920 -11.802 1.147 508 HZ3 LYS 64 2HZ LYS 64 -11.238 -10.259 1.261 509 H LEU 65 H LEU 65 -8.829 -8.771 -3.955 510 HA LEU 65 HA LEU 65 -7.813 -11.218 -4.962 511 HB2 LEU 65 1HB LEU 65 -9.870 -9.243 -5.894 512 HB3 LEU 65 2HB LEU 65 -9.377 -10.590 -6.934 513 HG LEU 65 HG LEU 65 -11.323 -11.341 -5.885 514 HD11 LEU 65 1HD1 LEU 65 -9.324 -12.878 -5.742 515 HD12 LEU 65 2HD1 LEU 65 -10.643 -13.214 -4.622 516 HD13 LEU 65 3HD1 LEU 65 -9.188 -12.397 -4.051 517 HD21 LEU 65 3HD2 LEU 65 -10.797 -11.113 -3.100 518 HD22 LEU 65 1HD2 LEU 65 -12.100 -10.386 -4.042 519 HD23 LEU 65 2HD2 LEU 65 -10.574 -9.527 -3.842 520 H GLU 66 H GLU 66 -7.577 -7.863 -6.061 521 HA GLU 66 HA GLU 66 -6.271 -8.352 -8.494 522 HB2 GLU 66 1HB GLU 66 -5.904 -5.939 -6.706 523 HB3 GLU 66 2HB GLU 66 -5.638 -6.022 -8.454 524 HG2 GLU 66 1HG GLU 66 -8.345 -6.725 -7.461 525 HG3 GLU 66 2HG GLU 66 -7.855 -5.025 -7.387 526 H LEU 67 H LEU 67 -5.125 -8.378 -5.228 527 HA LEU 67 HA LEU 67 -2.347 -8.089 -5.853 528 HB2 LEU 67 1HB LEU 67 -3.662 -9.238 -3.385 529 HB3 LEU 67 2HB LEU 67 -1.966 -8.744 -3.539 530 HG LEU 67 HG LEU 67 -4.323 -6.870 -3.735 531 HD11 LEU 67 1HD1 LEU 67 -3.766 -6.136 -1.521 532 HD12 LEU 67 2HD1 LEU 67 -2.391 -7.238 -1.451 533 HD13 LEU 67 3HD1 LEU 67 -4.034 -7.878 -1.485 534 HD21 LEU 67 3HD2 LEU 67 -2.877 -5.351 -4.458 535 HD22 LEU 67 1HD2 LEU 67 -1.633 -6.598 -4.538 536 HD23 LEU 67 2HD2 LEU 67 -1.830 -5.643 -3.069 537 HA PRO 68 HA PRO 68 -1.355 -12.190 -7.086 538 HB2 PRO 68 2HB PRO 68 0.710 -11.369 -7.668 539 HB3 PRO 68 1HB PRO 68 1.260 -12.314 -6.286 540 HG2 PRO 68 1HG PRO 68 1.254 -10.483 -4.855 541 HG3 PRO 68 2HG PRO 68 1.739 -9.706 -6.409 542 HD2 PRO 68 1HD PRO 68 -0.360 -8.830 -4.926 543 HD3 PRO 68 2HD PRO 68 -0.341 -8.756 -6.697 544 H GLU 69 H GLU 69 0.346 -13.979 -5.945 545 HA GLU 69 HA GLU 69 -0.825 -14.467 -3.285 546 HB2 GLU 69 1HB GLU 69 -0.694 -16.891 -3.796 547 HB3 GLU 69 2HB GLU 69 -1.797 -16.012 -4.868 548 HG2 GLU 69 1HG GLU 69 1.002 -16.337 -5.791 549 HG3 GLU 69 2HG GLU 69 -0.022 -17.779 -5.760 550 H ARG 70 H ARG 70 1.998 -14.589 -5.325 551 HA ARG 70 HA ARG 70 3.654 -14.966 -2.935 552 HB2 ARG 70 1HB ARG 70 4.372 -16.325 -5.523 553 HB3 ARG 70 2HB ARG 70 5.002 -16.633 -3.899 554 HG2 ARG 70 1HG ARG 70 2.103 -17.089 -4.293 555 HG3 ARG 70 2HG ARG 70 3.213 -18.213 -5.096 556 HD2 ARG 70 1HD ARG 70 4.392 -18.297 -2.761 557 HD3 ARG 70 2HD ARG 70 2.837 -17.687 -2.178 558 HE ARG 70 HE ARG 70 3.408 -20.336 -3.127 559 HH11 ARG 70 2HH1 ARG 70 0.923 -17.944 -2.658 560 HH12 ARG 70 1HH1 ARG 70 -0.362 -19.103 -2.587 561 HH21 ARG 70 1HH2 ARG 70 0.095 -21.338 -2.801 562 HH22 ARG 70 2HH2 ARG 70 1.725 -21.874 -3.036 563 H GLN 71 H GLN 71 2.966 -12.610 -4.459 564 HA GLN 71 HA GLN 71 5.667 -11.845 -5.328 565 HB2 GLN 71 1HB GLN 71 3.240 -11.882 -6.899 566 HB3 GLN 71 2HB GLN 71 3.883 -10.236 -6.775 567 HG2 GLN 71 1HG GLN 71 6.152 -11.585 -7.338 568 HG3 GLN 71 2HG GLN 71 4.959 -12.586 -8.176 569 HE21 GLN 71 2HE2 GLN 71 3.949 -9.914 -10.375 570 HE22 GLN 71 1HE2 GLN 71 3.261 -11.138 -9.370 571 HA PRO 72 HA PRO 72 4.702 -8.869 -2.095 572 HB2 PRO 72 2HB PRO 72 6.699 -9.458 -1.122 573 HB3 PRO 72 1HB PRO 72 7.274 -7.958 -1.848 574 HG2 PRO 72 1HG PRO 72 8.182 -9.036 -3.695 575 HG3 PRO 72 2HG PRO 72 8.465 -10.262 -2.403 576 HD2 PRO 72 1HD PRO 72 7.180 -10.846 -4.721 577 HD3 PRO 72 2HD PRO 72 6.768 -11.614 -3.178 578 H ARG 73 H ARG 73 3.807 -6.969 -2.561 579 HA ARG 73 HA ARG 73 5.241 -5.053 -4.219 580 HB2 ARG 73 1HB ARG 73 3.729 -4.860 -5.906 581 HB3 ARG 73 2HB ARG 73 3.468 -6.566 -5.516 582 HG2 ARG 73 1HG ARG 73 1.672 -5.581 -3.857 583 HG3 ARG 73 2HG ARG 73 1.729 -4.216 -4.986 584 HD2 ARG 73 1HD ARG 73 1.181 -7.103 -5.716 585 HD3 ARG 73 2HD ARG 73 -0.018 -5.807 -5.607 586 HE ARG 73 HE ARG 73 2.089 -5.163 -7.422 587 HH11 ARG 73 2HH1 ARG 73 -0.873 -6.961 -7.079 588 HH12 ARG 73 1HH1 ARG 73 -1.241 -6.928 -8.771 589 HH21 ARG 73 1HH2 ARG 73 0.175 -5.878 -10.235 590 HH22 ARG 73 2HH2 ARG 73 1.614 -5.113 -9.652 591 H PHE 74 H PHE 74 3.906 -2.928 -4.299 592 HA PHE 74 HA PHE 74 2.931 -2.432 -1.571 593 HB2 PHE 74 1HB PHE 74 4.037 -0.491 -3.618 594 HB3 PHE 74 2HB PHE 74 3.504 -0.066 -1.991 595 HD1 PHE 74 1HD PHE 74 4.607 -2.283 -0.401 596 HD2 PHE 74 2HD PHE 74 6.326 -0.045 -3.587 597 HE1 PHE 74 1HE PHE 74 6.854 -2.753 0.486 598 HE2 PHE 74 2HE PHE 74 8.575 -0.511 -2.706 599 HZ PHE 74 HZ PHE 74 8.842 -1.868 -0.667 600 H VAL 75 H VAL 75 1.053 -1.226 -1.220 601 HA VAL 75 HA VAL 75 -0.563 -0.415 -3.492 602 HB VAL 75 HB VAL 75 -1.554 -2.503 -1.545 603 HG11 VAL 75 1HG1 VAL 75 -3.087 -1.570 -3.929 604 HG12 VAL 75 2HG1 VAL 75 -3.669 -2.302 -2.432 605 HG13 VAL 75 3HG1 VAL 75 -3.131 -0.622 -2.443 606 HG21 VAL 75 3HG2 VAL 75 -1.886 -3.743 -3.797 607 HG22 VAL 75 1HG2 VAL 75 -0.686 -2.604 -4.407 608 HG23 VAL 75 2HG2 VAL 75 -0.278 -3.688 -3.076 609 H VAL 76 H VAL 76 -1.558 1.430 -3.022 610 HA VAL 76 HA VAL 76 -1.881 2.160 -0.189 611 HB VAL 76 HB VAL 76 -1.531 3.879 -2.639 612 HG11 VAL 76 1HG1 VAL 76 -3.247 4.900 -1.272 613 HG12 VAL 76 2HG1 VAL 76 -2.238 4.732 0.167 614 HG13 VAL 76 3HG1 VAL 76 -1.749 5.819 -1.133 615 HG21 VAL 76 3HG2 VAL 76 0.497 4.572 -1.667 616 HG22 VAL 76 1HG2 VAL 76 0.068 3.896 -0.096 617 HG23 VAL 76 2HG2 VAL 76 0.455 2.824 -1.442 618 H TYR 77 H TYR 77 -3.902 1.406 0.281 619 HA TYR 77 HA TYR 77 -6.120 2.001 -1.507 620 HB2 TYR 77 1HB TYR 77 -5.869 -0.224 -0.360 621 HB3 TYR 77 2HB TYR 77 -6.193 0.596 1.169 622 HD1 TYR 77 1HD TYR 77 -7.835 1.194 -2.114 623 HD2 TYR 77 2HD TYR 77 -8.245 -0.305 1.847 624 HE1 TYR 77 1HE TYR 77 -10.256 0.941 -2.466 625 HE2 TYR 77 2HE TYR 77 -10.667 -0.564 1.505 626 HH TYR 77 HH TYR 77 -12.301 0.796 -1.164 627 H SER 78 H SER 78 -7.662 3.503 -1.157 628 HA SER 78 HA SER 78 -7.397 5.155 1.270 629 HB2 SER 78 1HB SER 78 -6.793 6.277 -0.896 630 HB3 SER 78 2HB SER 78 -8.472 6.044 -1.416 631 HG SER 78 HG SER 78 -9.151 7.498 0.022 632 H TYR 79 H TYR 79 -8.915 4.270 2.586 633 HA TYR 79 HA TYR 79 -11.557 3.630 1.578 634 HB2 TYR 79 1HB TYR 79 -10.566 2.127 3.202 635 HB3 TYR 79 2HB TYR 79 -10.362 3.452 4.351 636 HD1 TYR 79 1HD TYR 79 -12.272 4.390 5.554 637 HD2 TYR 79 2HD TYR 79 -12.753 1.116 2.880 638 HE1 TYR 79 1HE TYR 79 -14.491 3.940 6.513 639 HE2 TYR 79 2HE TYR 79 -14.974 0.658 3.831 640 HH TYR 79 HH TYR 79 -16.688 1.673 5.079 641 H LYS 80 H LYS 80 -13.494 4.430 2.752 642 HA LYS 80 HA LYS 80 -13.169 7.270 3.470 643 HB2 LYS 80 1HB LYS 80 -14.356 7.095 1.391 644 HB3 LYS 80 2HB LYS 80 -15.442 5.866 2.062 645 HG2 LYS 80 1HG LYS 80 -16.345 7.544 3.631 646 HG3 LYS 80 2HG LYS 80 -15.310 8.765 2.870 647 HD2 LYS 80 1HD LYS 80 -16.904 9.137 1.362 648 HD3 LYS 80 2HD LYS 80 -16.685 7.478 0.776 649 HE2 LYS 80 1HE LYS 80 -18.394 8.029 3.186 650 HE3 LYS 80 2HE LYS 80 -19.035 8.245 1.551 651 HZ1 LYS 80 3HZ LYS 80 -17.683 5.753 1.809 652 HZ2 LYS 80 1HZ LYS 80 -19.272 6.065 1.318 653 HZ3 LYS 80 2HZ LYS 80 -18.913 5.897 2.962 654 H TYR 81 H TYR 81 -13.410 7.567 5.581 655 HA TYR 81 HA TYR 81 -15.312 5.863 7.042 656 HB2 TYR 81 1HB TYR 81 -12.694 6.225 7.593 657 HB3 TYR 81 2HB TYR 81 -13.384 7.546 8.540 658 HD1 TYR 81 2HD TYR 81 -15.835 6.534 9.622 659 HD2 TYR 81 1HD TYR 81 -12.149 4.491 9.039 660 HE1 TYR 81 2HE TYR 81 -16.420 4.973 11.431 661 HE2 TYR 81 1HE TYR 81 -12.724 2.923 10.844 662 HH TYR 81 HH TYR 81 -15.853 3.102 12.503 663 H VAL 82 H VAL 82 -17.027 6.737 8.043 664 HA VAL 82 HA VAL 82 -17.414 9.630 7.779 665 HB VAL 82 HB VAL 82 -19.499 7.600 8.568 666 HG11 VAL 82 1HG1 VAL 82 -20.044 10.152 7.130 667 HG12 VAL 82 2HG1 VAL 82 -21.057 9.256 8.263 668 HG13 VAL 82 3HG1 VAL 82 -19.694 10.204 8.858 669 HG21 VAL 82 3HG2 VAL 82 -19.557 8.599 5.815 670 HG22 VAL 82 1HG2 VAL 82 -18.191 7.543 6.176 671 HG23 VAL 82 2HG2 VAL 82 -19.839 6.974 6.440 672 H HIS 83 H HIS 83 -17.992 10.935 9.506 673 HA HIS 83 HA HIS 83 -17.066 10.022 12.089 674 HB2 HIS 83 1HB HIS 83 -18.033 12.686 11.047 675 HB3 HIS 83 2HB HIS 83 -17.634 12.423 12.748 676 HD1 HIS 83 1HD HIS 83 -15.352 13.154 13.308 677 HD2 HIS 83 2HD HIS 83 -15.600 11.780 9.394 678 HE1 HIS 83 1HE HIS 83 -13.040 13.423 12.353 679 HE2 HIS 83 2HE HIS 83 -13.192 12.582 9.961 680 H ASP 84 H ASP 84 -19.727 12.258 11.876 681 HA ASP 84 HA ASP 84 -21.887 10.560 12.305 682 HB2 ASP 84 1HB ASP 84 -20.169 10.768 14.591 683 HB3 ASP 84 2HB ASP 84 -21.707 11.559 14.959 684 H ASP 85 H ASP 85 -20.369 13.624 13.132 685 HA ASP 85 HA ASP 85 -22.847 15.026 13.474 686 HB2 ASP 85 1HB ASP 85 -20.155 15.527 14.055 687 HB3 ASP 85 2HB ASP 85 -20.588 16.731 12.834 688 H GLY 86 H GLY 86 -21.165 13.912 10.790 689 HA2 GLY 86 1HA GLY 86 -22.482 14.213 8.686 690 HA3 GLY 86 2HA GLY 86 -22.462 15.931 9.063 691 H ARG 87 H ARG 87 -19.571 14.407 9.908 692 HA ARG 87 HA ARG 87 -18.298 15.436 7.461 693 HB2 ARG 87 1HB ARG 87 -17.280 15.156 10.291 694 HB3 ARG 87 2HB ARG 87 -16.211 15.477 8.917 695 HG2 ARG 87 1HG ARG 87 -18.570 17.248 9.460 696 HG3 ARG 87 2HG ARG 87 -17.043 17.458 10.333 697 HD2 ARG 87 1HD ARG 87 -15.956 17.436 7.973 698 HD3 ARG 87 2HD ARG 87 -17.599 17.772 7.407 699 HE ARG 87 HE ARG 87 -16.911 19.569 9.474 700 HH11 ARG 87 2HH1 ARG 87 -16.233 18.870 6.132 701 HH12 ARG 87 1HH1 ARG 87 -15.841 20.510 5.733 702 HH21 ARG 87 1HH2 ARG 87 -15.935 22.137 7.343 703 HH22 ARG 87 2HH2 ARG 87 -16.398 21.731 8.961 704 H VAL 88 H VAL 88 -17.181 14.092 6.185 705 HA VAL 88 HA VAL 88 -16.464 11.433 7.219 706 HB VAL 88 HB VAL 88 -18.487 11.115 5.931 707 HG11 VAL 88 1HG1 VAL 88 -17.253 12.035 3.397 708 HG12 VAL 88 2HG1 VAL 88 -18.944 12.036 3.902 709 HG13 VAL 88 3HG1 VAL 88 -17.839 13.270 4.511 710 HG21 VAL 88 3HG2 VAL 88 -17.595 9.206 5.232 711 HG22 VAL 88 1HG2 VAL 88 -16.905 10.036 3.836 712 HG23 VAL 88 2HG2 VAL 88 -15.983 9.913 5.335 713 H SER 89 H SER 89 -14.362 11.100 7.002 714 HA SER 89 HA SER 89 -12.939 12.452 4.805 715 HB2 SER 89 1HB SER 89 -11.772 11.526 7.447 716 HB3 SER 89 2HB SER 89 -10.962 12.492 6.201 717 HG SER 89 HG SER 89 -12.883 13.981 6.623 718 H TYR 90 H TYR 90 -11.016 11.305 3.986 719 HA TYR 90 HA TYR 90 -11.480 8.396 3.955 720 HB2 TYR 90 1HB TYR 90 -9.865 9.671 1.809 721 HB3 TYR 90 2HB TYR 90 -11.011 8.332 1.716 722 HD1 TYR 90 1HD TYR 90 -13.523 8.911 1.983 723 HD2 TYR 90 2HD TYR 90 -10.527 11.783 1.045 724 HE1 TYR 90 1HE TYR 90 -15.252 10.411 1.083 725 HE2 TYR 90 2HE TYR 90 -12.248 13.292 0.146 726 HH TYR 90 HH TYR 90 -14.577 13.696 0.243 727 HA PRO 91 HA PRO 91 -7.473 8.678 6.092 728 HB2 PRO 91 2HB PRO 91 -8.459 7.717 7.931 729 HB3 PRO 91 1HB PRO 91 -7.718 6.240 7.316 730 HG2 PRO 91 1HG PRO 91 -9.665 5.538 6.260 731 HG3 PRO 91 2HG PRO 91 -10.338 6.364 7.714 732 HD2 PRO 91 1HD PRO 91 -11.112 6.983 5.187 733 HD3 PRO 91 2HD PRO 91 -11.020 8.189 6.482 734 H LEU 92 H LEU 92 -6.171 8.503 4.261 735 HA LEU 92 HA LEU 92 -6.001 6.121 2.703 736 HB2 LEU 92 1HB LEU 92 -4.877 8.780 2.681 737 HB3 LEU 92 2HB LEU 92 -3.622 7.565 2.379 738 HG LEU 92 HG LEU 92 -5.876 6.942 0.753 739 HD11 LEU 92 1HD1 LEU 92 -6.727 9.078 0.678 740 HD12 LEU 92 2HD1 LEU 92 -5.587 9.111 -0.666 741 HD13 LEU 92 3HD1 LEU 92 -5.146 9.832 0.881 742 HD21 LEU 92 3HD2 LEU 92 -4.278 6.679 -0.829 743 HD22 LEU 92 1HD2 LEU 92 -3.214 6.738 0.577 744 HD23 LEU 92 2HD2 LEU 92 -3.455 8.182 -0.409 745 H CYS 93 H CYS 93 -4.941 4.309 3.141 746 HA CYS 93 HA CYS 93 -2.769 4.401 5.131 747 HB2 CYS 93 1HB CYS 93 -4.821 2.237 4.639 748 HB3 CYS 93 2HB CYS 93 -3.418 2.049 5.705 749 HG CYS 93 HG CYS 93 -6.102 4.104 6.186 750 H PHE 94 H PHE 94 -1.193 2.596 4.918 751 HA PHE 94 HA PHE 94 -0.678 2.061 2.071 752 HB2 PHE 94 1HB PHE 94 0.997 3.447 3.327 753 HB3 PHE 94 2HB PHE 94 1.315 2.041 4.345 754 HD1 PHE 94 2HD PHE 94 1.739 3.471 1.009 755 HD2 PHE 94 1HD PHE 94 2.518 0.122 3.517 756 HE1 PHE 94 2HE PHE 94 3.395 2.645 -0.614 757 HE2 PHE 94 1HE PHE 94 4.176 -0.708 1.900 758 HZ PHE 94 HZ PHE 94 4.615 0.553 -0.169 759 H ILE 95 H ILE 95 -1.443 0.096 1.588 760 HA ILE 95 HA ILE 95 -1.182 -2.086 3.507 761 HB ILE 95 HB ILE 95 -2.562 -2.018 0.822 762 HG12 ILE 95 1HG1 ILE 95 -3.789 -2.099 3.583 763 HG13 ILE 95 2HG1 ILE 95 -3.535 -0.597 2.680 764 HG21 ILE 95 1HG2 ILE 95 -3.432 -4.102 2.597 765 HG22 ILE 95 2HG2 ILE 95 -2.811 -4.221 0.951 766 HG23 ILE 95 3HG2 ILE 95 -1.695 -4.219 2.317 767 HD11 ILE 95 3HD1 ILE 95 -4.937 -1.560 0.846 768 HD12 ILE 95 1HD1 ILE 95 -5.332 -2.887 1.938 769 HD13 ILE 95 2HD1 ILE 95 -5.791 -1.234 2.354 770 H PHE 96 H PHE 96 0.578 -3.304 3.475 771 HA PHE 96 HA PHE 96 2.150 -3.500 1.014 772 HB2 PHE 96 1HB PHE 96 3.362 -2.827 3.021 773 HB3 PHE 96 2HB PHE 96 2.815 -4.280 3.860 774 HD1 PHE 96 1HD PHE 96 3.808 -4.404 0.345 775 HD2 PHE 96 2HD PHE 96 5.053 -5.020 4.368 776 HE1 PHE 96 1HE PHE 96 5.780 -5.636 -0.459 777 HE2 PHE 96 2HE PHE 96 7.029 -6.253 3.571 778 HZ PHE 96 HZ PHE 96 7.394 -6.562 1.155 779 H SER 97 H SER 97 1.497 -5.103 -0.274 780 HA SER 97 HA SER 97 0.312 -7.513 0.753 781 HB2 SER 97 1HB SER 97 -0.480 -6.570 -1.359 782 HB3 SER 97 2HB SER 97 1.137 -6.755 -2.061 783 HG SER 97 HG SER 97 0.645 -8.735 -2.514 784 H SER 98 H SER 98 1.861 -8.552 1.984 785 HA SER 98 HA SER 98 4.090 -9.716 0.452 786 HB2 SER 98 1HB SER 98 4.510 -7.863 2.374 787 HB3 SER 98 2HB SER 98 4.490 -9.330 3.367 788 HG SER 98 HG SER 98 6.015 -9.278 1.008 789 HA PRO 99 HA PRO 99 1.670 -13.240 1.996 790 HB2 PRO 99 2HB PRO 99 1.236 -13.807 -0.188 791 HB3 PRO 99 1HB PRO 99 2.547 -14.962 0.053 792 HG2 PRO 99 1HG PRO 99 4.136 -13.575 -0.921 793 HG3 PRO 99 2HG PRO 99 2.676 -13.172 -1.900 794 HD2 PRO 99 1HD PRO 99 4.157 -11.282 -0.634 795 HD3 PRO 99 2HD PRO 99 2.402 -11.144 -0.840 796 H VAL 100 H VAL 100 2.652 -15.735 1.900 797 HA VAL 100 HA VAL 100 5.156 -15.545 3.440 798 HB VAL 100 HB VAL 100 3.124 -16.388 4.652 799 HG11 VAL 100 1HG1 VAL 100 2.433 -18.718 4.194 800 HG12 VAL 100 2HG1 VAL 100 2.064 -17.619 2.864 801 HG13 VAL 100 3HG1 VAL 100 3.446 -18.709 2.752 802 HG21 VAL 100 3HG2 VAL 100 5.078 -16.969 5.724 803 HG22 VAL 100 1HG2 VAL 100 4.371 -18.556 5.418 804 HG23 VAL 100 2HG2 VAL 100 5.655 -17.946 4.374 805 H GLY 101 H GLY 101 3.631 -16.946 0.679 806 HA2 GLY 101 1HA GLY 101 5.589 -19.045 0.332 807 HA3 GLY 101 2HA GLY 101 4.314 -18.606 -0.796 808 H CYS 102 H CYS 102 5.419 -15.721 -0.420 809 HA CYS 102 HA CYS 102 6.796 -15.546 -2.822 810 HB2 CYS 102 1HB CYS 102 7.640 -13.324 -1.875 811 HB3 CYS 102 2HB CYS 102 5.887 -13.542 -2.001 812 HG CYS 102 HG CYS 102 7.069 -14.498 0.964 813 H LYS 103 H LYS 103 9.099 -14.408 -2.829 814 HA LYS 103 HA LYS 103 10.891 -16.277 -1.441 815 HB2 LYS 103 1HB LYS 103 11.683 -14.515 -3.750 816 HB3 LYS 103 2HB LYS 103 12.428 -16.026 -3.202 817 HG2 LYS 103 1HG LYS 103 11.178 -17.226 -4.582 818 HG3 LYS 103 2HG LYS 103 9.696 -16.493 -3.944 819 HD2 LYS 103 1HD LYS 103 9.860 -16.076 -6.331 820 HD3 LYS 103 2HD LYS 103 10.027 -14.558 -5.432 821 HE2 LYS 103 1HE LYS 103 11.814 -14.257 -6.789 822 HE3 LYS 103 2HE LYS 103 12.613 -15.283 -5.588 823 HZ1 LYS 103 3HZ LYS 103 12.960 -15.973 -7.936 824 HZ2 LYS 103 1HZ LYS 103 11.312 -16.344 -8.034 825 HZ3 LYS 103 2HZ LYS 103 12.305 -17.185 -6.954 826 HA PRO 104 HA PRO 104 12.591 -13.075 1.042 827 HB2 PRO 104 2HB PRO 104 13.701 -14.733 2.183 828 HB3 PRO 104 1HB PRO 104 15.128 -14.041 1.414 829 HG2 PRO 104 1HG PRO 104 15.136 -15.609 -0.300 830 HG3 PRO 104 2HG PRO 104 14.529 -16.602 1.076 831 HD2 PRO 104 1HD PRO 104 13.208 -16.410 -1.288 832 HD3 PRO 104 2HD PRO 104 12.371 -16.585 0.264 833 H GLU 105 H GLU 105 14.045 -13.934 -1.995 834 HA GLU 105 HA GLU 105 16.037 -11.917 -2.072 835 HB2 GLU 105 1HB GLU 105 15.389 -14.078 -3.632 836 HB3 GLU 105 2HB GLU 105 14.906 -12.718 -4.658 837 HG2 GLU 105 1HG GLU 105 17.544 -12.416 -3.405 838 HG3 GLU 105 2HG GLU 105 17.405 -13.766 -4.541 839 H GLN 106 H GLN 106 12.672 -12.047 -3.120 840 HA GLN 106 HA GLN 106 12.795 -9.345 -4.177 841 HB2 GLN 106 1HB GLN 106 10.249 -10.896 -3.862 842 HB3 GLN 106 2HB GLN 106 10.706 -9.730 -5.114 843 HG2 GLN 106 1HG GLN 106 11.992 -12.441 -4.841 844 HG3 GLN 106 2HG GLN 106 10.571 -12.127 -5.848 845 HE21 GLN 106 2HE2 GLN 106 12.468 -9.918 -8.048 846 HE22 GLN 106 1HE2 GLN 106 11.031 -9.853 -7.091 847 H GLN 107 H GLN 107 10.785 -11.036 -1.760 848 HA GLN 107 HA GLN 107 9.384 -9.055 -0.633 849 HB2 GLN 107 1HB GLN 107 10.239 -11.596 0.187 850 HB3 GLN 107 2HB GLN 107 10.666 -10.504 1.516 851 HG2 GLN 107 1HG GLN 107 7.969 -10.083 0.446 852 HG3 GLN 107 2HG GLN 107 8.234 -11.678 1.164 853 HE21 GLN 107 2HE2 GLN 107 8.435 -8.333 3.509 854 HE22 GLN 107 1HE2 GLN 107 8.706 -8.233 1.805 855 H MET 108 H MET 108 12.835 -9.599 -0.121 856 HA MET 108 HA MET 108 13.223 -7.644 1.864 857 HB2 MET 108 1HB MET 108 14.955 -9.150 -0.027 858 HB3 MET 108 2HB MET 108 15.632 -7.682 0.692 859 HG2 MET 108 1HG MET 108 14.624 -8.861 2.903 860 HG3 MET 108 2HG MET 108 15.014 -10.279 1.926 861 HE1 MET 108 3HE MET 108 18.210 -8.589 0.570 862 HE2 MET 108 1HE MET 108 18.551 -10.215 1.165 863 HE3 MET 108 2HE MET 108 17.045 -9.887 0.307 864 H MET 109 H MET 109 13.459 -7.488 -1.670 865 HA MET 109 HA MET 109 14.441 -4.915 -1.955 866 HB2 MET 109 1HB MET 109 12.710 -6.689 -3.624 867 HB3 MET 109 2HB MET 109 12.887 -4.992 -4.100 868 HG2 MET 109 1HG MET 109 15.204 -5.198 -4.442 869 HG3 MET 109 2HG MET 109 15.268 -6.730 -3.568 870 HE1 MET 109 3HE MET 109 13.485 -4.898 -6.201 871 HE2 MET 109 1HE MET 109 14.265 -5.549 -7.643 872 HE3 MET 109 2HE MET 109 12.696 -6.172 -7.133 873 H TYR 110 H TYR 110 11.202 -5.999 -1.187 874 HA TYR 110 HA TYR 110 10.140 -3.292 -1.387 875 HB2 TYR 110 1HB TYR 110 8.716 -5.820 -0.522 876 HB3 TYR 110 2HB TYR 110 7.973 -4.288 -0.988 877 HD1 TYR 110 2HD TYR 110 9.831 -7.206 -2.283 878 HD2 TYR 110 1HD TYR 110 7.592 -3.725 -3.270 879 HE1 TYR 110 2HE TYR 110 9.701 -7.960 -4.619 880 HE2 TYR 110 1HE TYR 110 7.454 -4.470 -5.610 881 HH TYR 110 HH TYR 110 8.144 -5.971 -7.108 882 H ALA 111 H ALA 111 11.032 -5.677 1.015 883 HA ALA 111 HA ALA 111 9.857 -4.352 3.244 884 HB1 ALA 111 3HB ALA 111 12.063 -5.905 4.102 885 HB2 ALA 111 1HB ALA 111 10.345 -6.294 4.193 886 HB3 ALA 111 2HB ALA 111 11.283 -6.766 2.775 887 H GLY 112 H GLY 112 12.713 -3.835 1.414 888 HA2 GLY 112 1HA GLY 112 13.923 -2.233 3.562 889 HA3 GLY 112 2HA GLY 112 14.735 -2.762 2.095 890 H SER 113 H SER 113 12.026 -1.869 0.776 891 HA SER 113 HA SER 113 12.818 0.959 0.540 892 HB2 SER 113 1HB SER 113 11.238 -0.452 -1.590 893 HB3 SER 113 2HB SER 113 12.351 0.920 -1.737 894 HG SER 113 HG SER 113 13.386 -1.531 -0.878 895 H LYS 114 H LYS 114 10.412 -1.128 1.595 896 HA LYS 114 HA LYS 114 8.011 0.037 0.957 897 HB2 LYS 114 1HB LYS 114 8.016 -1.973 2.229 898 HB3 LYS 114 2HB LYS 114 8.938 -1.218 3.537 899 HG2 LYS 114 1HG LYS 114 7.068 0.127 4.190 900 HG3 LYS 114 2HG LYS 114 6.145 -0.402 2.773 901 HD2 LYS 114 1HD LYS 114 5.319 -1.658 4.609 902 HD3 LYS 114 2HD LYS 114 6.338 -2.756 3.662 903 HE2 LYS 114 1HE LYS 114 8.207 -2.377 5.214 904 HE3 LYS 114 2HE LYS 114 7.182 -1.286 6.158 905 HZ1 LYS 114 3HZ LYS 114 5.750 -3.629 5.917 906 HZ2 LYS 114 1HZ LYS 114 6.534 -3.053 7.301 907 HZ3 LYS 114 2HZ LYS 114 7.335 -4.115 6.256 908 H ASN 115 H ASN 115 10.053 0.882 3.756 909 HA ASN 115 HA ASN 115 8.490 3.038 4.637 910 HB2 ASN 115 1HB ASN 115 11.384 2.286 5.010 911 HB3 ASN 115 2HB ASN 115 10.741 3.790 5.684 912 HD21 ASN 115 2HD2 ASN 115 10.069 0.282 7.505 913 HD22 ASN 115 1HD2 ASN 115 11.047 0.444 6.090 914 H ARG 116 H ARG 116 11.139 2.862 2.316 915 HA ARG 116 HA ARG 116 11.636 5.575 1.964 916 HB2 ARG 116 1HB ARG 116 13.067 3.873 0.996 917 HB3 ARG 116 2HB ARG 116 11.751 3.331 -0.057 918 HG2 ARG 116 1HG ARG 116 13.106 4.614 -1.456 919 HG3 ARG 116 2HG ARG 116 11.776 5.698 -1.016 920 HD2 ARG 116 1HD ARG 116 13.354 7.174 -0.426 921 HD3 ARG 116 2HD ARG 116 13.610 6.139 0.985 922 HE ARG 116 HE ARG 116 15.138 5.111 -1.111 923 HH11 ARG 116 2HH1 ARG 116 14.982 7.959 0.886 924 HH12 ARG 116 1HH1 ARG 116 16.681 8.280 0.789 925 HH21 ARG 116 1HH2 ARG 116 18.042 6.894 -0.428 926 HH22 ARG 116 2HH2 ARG 116 17.377 5.523 -1.248 927 H LEU 117 H LEU 117 9.388 3.492 0.146 928 HA LEU 117 HA LEU 117 8.323 5.591 -1.427 929 HB2 LEU 117 1HB LEU 117 8.175 3.275 -2.130 930 HB3 LEU 117 2HB LEU 117 7.185 2.894 -0.712 931 HG LEU 117 HG LEU 117 5.591 4.722 -1.787 932 HD11 LEU 117 1HD1 LEU 117 6.362 5.434 -3.756 933 HD12 LEU 117 2HD1 LEU 117 5.864 3.859 -4.376 934 HD13 LEU 117 3HD1 LEU 117 7.535 4.120 -3.874 935 HD21 LEU 117 3HD2 LEU 117 5.573 2.044 -3.102 936 HD22 LEU 117 1HD2 LEU 117 4.236 2.983 -2.441 937 HD23 LEU 117 2HD2 LEU 117 5.351 2.154 -1.355 938 H VAL 118 H VAL 118 6.891 3.813 1.316 939 HA VAL 118 HA VAL 118 4.570 5.224 1.641 940 HB VAL 118 HB VAL 118 6.350 4.183 3.850 941 HG11 VAL 118 1HG1 VAL 118 4.747 4.633 5.361 942 HG12 VAL 118 2HG1 VAL 118 4.230 5.842 4.183 943 HG13 VAL 118 3HG1 VAL 118 3.439 4.266 4.236 944 HG21 VAL 118 3HG2 VAL 118 4.118 2.525 3.432 945 HG22 VAL 118 1HG2 VAL 118 4.795 2.863 1.838 946 HG23 VAL 118 2HG2 VAL 118 5.811 2.162 3.097 947 H GLN 119 H GLN 119 7.709 6.004 3.134 948 HA GLN 119 HA GLN 119 6.971 8.271 4.529 949 HB2 GLN 119 1HB GLN 119 9.530 7.370 3.259 950 HB3 GLN 119 2HB GLN 119 9.431 8.994 3.956 951 HG2 GLN 119 1HG GLN 119 8.381 7.483 5.967 952 HG3 GLN 119 2HG GLN 119 9.586 6.388 5.274 953 HE21 GLN 119 2HE2 GLN 119 12.000 7.874 7.247 954 HE22 GLN 119 1HE2 GLN 119 11.170 6.446 6.740 955 H THR 120 H THR 120 7.845 7.945 1.127 956 HA THR 120 HA THR 120 7.950 10.677 0.486 957 HB THR 120 HB THR 120 7.015 8.538 -1.423 958 HG1 THR 120 1HG THR 120 9.705 9.174 -0.715 959 HG21 THR 120 3HG2 THR 120 8.841 10.231 -2.649 960 HG22 THR 120 1HG2 THR 120 7.875 11.302 -1.635 961 HG23 THR 120 2HG2 THR 120 7.088 10.273 -2.832 962 H ALA 121 H ALA 121 5.264 8.363 0.404 963 HA ALA 121 HA ALA 121 3.370 10.228 -0.627 964 HB1 ALA 121 3HB ALA 121 2.753 7.708 0.900 965 HB2 ALA 121 1HB ALA 121 1.738 8.540 -0.280 966 HB3 ALA 121 2HB ALA 121 3.212 7.726 -0.803 967 H GLU 122 H GLU 122 4.691 9.665 2.474 968 HA GLU 122 HA GLU 122 4.330 10.625 4.505 969 HB2 GLU 122 1HB GLU 122 3.579 12.561 2.614 970 HB3 GLU 122 2HB GLU 122 2.281 12.543 3.819 971 HG2 GLU 122 1HG GLU 122 4.128 12.704 5.577 972 HG3 GLU 122 2HG GLU 122 5.192 13.126 4.227 973 H LEU 123 H LEU 123 2.610 8.458 3.447 974 HA LEU 123 HA LEU 123 -0.054 8.812 4.308 975 HB2 LEU 123 1HB LEU 123 1.612 6.309 4.001 976 HB3 LEU 123 2HB LEU 123 -0.135 6.323 4.305 977 HG LEU 123 HG LEU 123 0.971 7.724 1.903 978 HD11 LEU 123 1HD1 LEU 123 1.709 5.197 2.247 979 HD12 LEU 123 2HD1 LEU 123 1.242 5.837 0.672 980 HD13 LEU 123 3HD1 LEU 123 0.084 4.911 1.626 981 HD21 LEU 123 3HD2 LEU 123 -1.582 6.181 2.102 982 HD22 LEU 123 1HD2 LEU 123 -1.180 7.559 1.077 983 HD23 LEU 123 2HD2 LEU 123 -1.466 7.798 2.801 984 H THR 124 H THR 124 2.869 7.788 5.957 985 HA THR 124 HA THR 124 3.360 7.678 8.186 986 HB THR 124 HB THR 124 0.515 8.464 8.808 987 HG1 THR 124 1HG THR 124 1.908 9.885 7.293 988 HG21 THR 124 3HG2 THR 124 3.059 8.259 10.298 989 HG22 THR 124 1HG2 THR 124 1.398 8.061 10.858 990 HG23 THR 124 2HG2 THR 124 2.070 9.678 10.643 991 H LYS 125 H LYS 125 -0.066 6.703 7.930 992 HA LYS 125 HA LYS 125 0.302 4.448 9.640 993 HB2 LYS 125 1HB LYS 125 -1.893 5.820 8.352 994 HB3 LYS 125 2HB LYS 125 -2.058 4.066 8.163 995 HG2 LYS 125 1HG LYS 125 -1.989 3.727 10.537 996 HG3 LYS 125 2HG LYS 125 -1.609 5.438 10.805 997 HD2 LYS 125 1HD LYS 125 -4.115 4.660 9.344 998 HD3 LYS 125 2HD LYS 125 -4.054 4.609 11.115 999 HE2 LYS 125 1HE LYS 125 -3.125 7.068 9.670 1000 HE3 LYS 125 2HE LYS 125 -4.856 6.773 9.892 1001 HZ1 LYS 125 3HZ LYS 125 -3.518 6.330 12.331 1002 HZ2 LYS 125 1HZ LYS 125 -4.703 7.481 11.969 1003 HZ3 LYS 125 2HZ LYS 125 -3.069 7.846 11.729 1004 H VAL 126 H VAL 126 1.098 2.526 9.125 1005 HA VAL 126 HA VAL 126 0.884 1.605 6.335 1006 HB VAL 126 HB VAL 126 3.266 1.059 8.104 1007 HG11 VAL 126 1HG1 VAL 126 2.358 0.088 5.540 1008 HG12 VAL 126 2HG1 VAL 126 3.950 0.839 5.417 1009 HG13 VAL 126 3HG1 VAL 126 3.682 -0.483 6.554 1010 HG21 VAL 126 3HG2 VAL 126 2.639 3.512 6.997 1011 HG22 VAL 126 1HG2 VAL 126 4.241 2.974 7.504 1012 HG23 VAL 126 2HG2 VAL 126 3.741 2.794 5.822 1013 H PHE 127 H PHE 127 -0.105 -0.288 6.144 1014 HA PHE 127 HA PHE 127 -0.110 -2.110 8.460 1015 HB2 PHE 127 1HB PHE 127 -2.336 -1.710 6.443 1016 HB3 PHE 127 2HB PHE 127 -2.366 -2.815 7.819 1017 HD1 PHE 127 1HD PHE 127 -1.065 -0.995 9.851 1018 HD2 PHE 127 2HD PHE 127 -4.175 -0.339 7.020 1019 HE1 PHE 127 1HE PHE 127 -1.994 0.775 11.286 1020 HE2 PHE 127 2HE PHE 127 -5.108 1.433 8.449 1021 HZ PHE 127 HZ PHE 127 -4.016 1.992 10.585 1022 H GLU 128 H GLU 128 0.988 -3.901 8.052 1023 HA GLU 128 HA GLU 128 1.339 -4.777 5.284 1024 HB2 GLU 128 1HB GLU 128 3.372 -4.553 6.572 1025 HB3 GLU 128 2HB GLU 128 2.721 -5.603 7.842 1026 HG2 GLU 128 1HG GLU 128 2.811 -6.771 5.132 1027 HG3 GLU 128 2HG GLU 128 4.372 -6.448 5.899 1028 H ILE 129 H ILE 129 0.223 -6.417 4.470 1029 HA ILE 129 HA ILE 129 -1.325 -8.109 6.298 1030 HB ILE 129 HB ILE 129 -2.501 -8.821 4.161 1031 HG12 ILE 129 1HG1 ILE 129 -1.169 -6.337 3.062 1032 HG13 ILE 129 2HG1 ILE 129 -0.652 -7.985 2.669 1033 HG21 ILE 129 1HG2 ILE 129 -2.736 -5.880 4.729 1034 HG22 ILE 129 2HG2 ILE 129 -4.003 -7.010 4.251 1035 HG23 ILE 129 3HG2 ILE 129 -3.292 -7.112 5.861 1036 HD11 ILE 129 3HD1 ILE 129 -3.482 -7.671 2.237 1037 HD12 ILE 129 1HD1 ILE 129 -2.554 -6.478 1.329 1038 HD13 ILE 129 2HD1 ILE 129 -2.220 -8.197 1.123 1039 H ARG 130 H ARG 130 -0.822 -10.177 6.614 1040 HA ARG 130 HA ARG 130 1.498 -11.314 5.404 1041 HB2 ARG 130 1HB ARG 130 1.046 -11.900 7.665 1042 HB3 ARG 130 2HB ARG 130 -0.598 -12.419 7.269 1043 HG2 ARG 130 1HG ARG 130 0.795 -14.351 7.661 1044 HG3 ARG 130 2HG ARG 130 0.319 -14.283 5.956 1045 HD2 ARG 130 1HD ARG 130 2.562 -14.754 5.745 1046 HD3 ARG 130 2HD ARG 130 2.580 -12.987 5.687 1047 HE ARG 130 HE ARG 130 2.891 -13.538 8.327 1048 HH11 ARG 130 2HH1 ARG 130 4.535 -14.555 5.431 1049 HH12 ARG 130 1HH1 ARG 130 6.066 -14.759 6.216 1050 HH21 ARG 130 1HH2 ARG 130 6.273 -14.331 8.458 1051 HH22 ARG 130 2HH2 ARG 130 4.901 -13.802 9.371 1052 H THR 131 H THR 131 -1.760 -11.156 4.496 1053 HA THR 131 HA THR 131 -1.323 -12.684 2.137 1054 HB THR 131 HB THR 131 -1.634 -14.648 3.402 1055 HG1 THR 131 1HG THR 131 -3.770 -15.339 2.687 1056 HG21 THR 131 3HG2 THR 131 -3.125 -14.960 5.160 1057 HG22 THR 131 1HG2 THR 131 -4.183 -13.654 4.628 1058 HG23 THR 131 2HG2 THR 131 -2.628 -13.281 5.372 1059 H THR 132 H THR 132 -2.704 -12.052 0.577 1060 HA THR 132 HA THR 132 -4.179 -9.841 0.561 1061 HB THR 132 HB THR 132 -5.602 -10.765 -1.221 1062 HG1 THR 132 1HG THR 132 -4.341 -13.269 -0.869 1063 HG21 THR 132 3HG2 THR 132 -2.820 -11.873 -1.532 1064 HG22 THR 132 1HG2 THR 132 -3.164 -10.145 -1.577 1065 HG23 THR 132 2HG2 THR 132 -3.879 -11.217 -2.780 1066 H ASP 133 H ASP 133 -5.467 -12.998 1.563 1067 HA ASP 133 HA ASP 133 -8.082 -12.517 1.994 1068 HB2 ASP 133 1HB ASP 133 -6.054 -14.090 3.520 1069 HB3 ASP 133 2HB ASP 133 -7.651 -13.871 4.248 1070 H ASP 134 H ASP 134 -5.494 -11.608 4.260 1071 HA ASP 134 HA ASP 134 -6.838 -10.556 6.347 1072 HB2 ASP 134 1HB ASP 134 -4.277 -10.013 5.063 1073 HB3 ASP 134 2HB ASP 134 -4.937 -8.582 5.867 1074 H LEU 135 H LEU 135 -6.292 -8.891 3.258 1075 HA LEU 135 HA LEU 135 -7.429 -6.443 3.839 1076 HB2 LEU 135 1HB LEU 135 -6.376 -7.603 1.622 1077 HB3 LEU 135 2HB LEU 135 -8.092 -7.534 1.187 1078 HG LEU 135 HG LEU 135 -6.238 -5.243 1.786 1079 HD11 LEU 135 1HD1 LEU 135 -6.672 -6.465 -0.544 1080 HD12 LEU 135 2HD1 LEU 135 -6.392 -4.729 -0.414 1081 HD13 LEU 135 3HD1 LEU 135 -8.037 -5.348 -0.560 1082 HD21 LEU 135 3HD2 LEU 135 -7.935 -4.058 2.586 1083 HD22 LEU 135 1HD2 LEU 135 -9.030 -5.426 2.376 1084 HD23 LEU 135 2HD2 LEU 135 -8.785 -4.282 1.055 1085 H THR 136 H THR 136 -9.208 -6.736 5.218 1086 HA THR 136 HA THR 136 -11.676 -7.501 3.815 1087 HB THR 136 HB THR 136 -12.383 -8.192 6.299 1088 HG1 THR 136 1HG THR 136 -10.396 -9.506 6.971 1089 HG21 THR 136 3HG2 THR 136 -10.810 -10.267 4.867 1090 HG22 THR 136 1HG2 THR 136 -12.141 -9.505 3.997 1091 HG23 THR 136 2HG2 THR 136 -12.447 -10.339 5.521 1092 H GLU 137 H GLU 137 -13.300 -6.077 4.004 1093 HA GLU 137 HA GLU 137 -13.117 -3.510 4.696 1094 HB2 GLU 137 1HB GLU 137 -15.140 -4.618 3.743 1095 HB3 GLU 137 2HB GLU 137 -15.556 -5.158 5.378 1096 HG2 GLU 137 1HG GLU 137 -15.544 -2.720 6.059 1097 HG3 GLU 137 2HG GLU 137 -15.462 -2.346 4.332 1098 H THR 138 H THR 138 -13.464 -6.150 6.962 1099 HA THR 138 HA THR 138 -13.886 -4.446 9.243 1100 HB THR 138 HB THR 138 -13.035 -7.339 9.321 1101 HG1 THR 138 1HG THR 138 -15.738 -6.535 9.392 1102 HG21 THR 138 3HG2 THR 138 -14.480 -5.500 11.218 1103 HG22 THR 138 1HG2 THR 138 -12.965 -6.364 11.479 1104 HG23 THR 138 2HG2 THR 138 -14.486 -7.254 11.402 1105 H TRP 139 H TRP 139 -11.270 -6.749 8.466 1106 HA TRP 139 HA TRP 139 -9.441 -6.040 10.351 1107 HB2 TRP 139 1HB TRP 139 -8.812 -7.846 9.023 1108 HB3 TRP 139 2HB TRP 139 -9.135 -6.978 7.521 1109 HD1 TRP 139 HD TRP 139 -6.414 -7.450 10.154 1110 HE1 TRP 139 1HE TRP 139 -4.211 -6.468 9.254 1111 HE3 TRP 139 3HE TRP 139 -8.199 -5.181 5.934 1112 HZ2 TRP 139 2HZ TRP 139 -3.345 -4.934 7.048 1113 HZ3 TRP 139 3HZ TRP 139 -6.618 -3.977 4.484 1114 HH2 TRP 139 HH TRP 139 -4.241 -3.856 5.032 1115 H LEU 140 H LEU 140 -10.410 -4.191 7.583 1116 HA LEU 140 HA LEU 140 -8.179 -2.354 7.770 1117 HB2 LEU 140 1HB LEU 140 -8.968 -2.742 5.575 1118 HB3 LEU 140 2HB LEU 140 -10.650 -2.467 6.065 1119 HG LEU 140 HG LEU 140 -10.344 -0.128 6.175 1120 HD11 LEU 140 1HD1 LEU 140 -7.404 -0.434 5.647 1121 HD12 LEU 140 2HD1 LEU 140 -8.069 -0.334 7.277 1122 HD13 LEU 140 3HD1 LEU 140 -8.286 1.007 6.153 1123 HD21 LEU 140 3HD2 LEU 140 -10.362 -1.299 3.879 1124 HD22 LEU 140 1HD2 LEU 140 -8.662 -0.836 3.798 1125 HD23 LEU 140 2HD2 LEU 140 -9.907 0.404 3.953 1126 H LYS 141 H LYS 141 -11.721 -1.945 7.961 1127 HA LYS 141 HA LYS 141 -11.725 0.609 9.043 1128 HB2 LYS 141 1HB LYS 141 -13.639 -1.619 8.830 1129 HB3 LYS 141 2HB LYS 141 -13.959 -0.499 10.164 1130 HG2 LYS 141 1HG LYS 141 -14.564 1.191 8.800 1131 HG3 LYS 141 2HG LYS 141 -13.376 0.749 7.561 1132 HD2 LYS 141 1HD LYS 141 -15.097 -0.037 6.370 1133 HD3 LYS 141 2HD LYS 141 -15.140 -1.374 7.533 1134 HE2 LYS 141 1HE LYS 141 -16.578 1.197 8.126 1135 HE3 LYS 141 2HE LYS 141 -17.305 -0.019 7.067 1136 HZ1 LYS 141 3HZ LYS 141 -17.674 -1.420 8.772 1137 HZ2 LYS 141 1HZ LYS 141 -17.608 -0.008 9.703 1138 HZ3 LYS 141 2HZ LYS 141 -16.249 -1.009 9.586 1139 H GLU 142 H GLU 142 -10.820 -2.343 10.499 1140 HA GLU 142 HA GLU 142 -11.405 -1.683 13.207 1141 HB2 GLU 142 1HB GLU 142 -9.723 -3.744 11.828 1142 HB3 GLU 142 2HB GLU 142 -9.532 -3.492 13.570 1143 HG2 GLU 142 1HG GLU 142 -12.152 -3.726 13.575 1144 HG3 GLU 142 2HG GLU 142 -11.846 -4.584 12.058 1145 H LYS 143 H LYS 143 -8.409 -1.602 11.287 1146 HA LYS 143 HA LYS 143 -6.773 -0.536 13.313 1147 HB2 LYS 143 1HB LYS 143 -6.398 -0.066 10.353 1148 HB3 LYS 143 2HB LYS 143 -5.154 -0.151 11.611 1149 HG2 LYS 143 1HG LYS 143 -6.627 -2.602 11.603 1150 HG3 LYS 143 2HG LYS 143 -6.099 -2.222 9.954 1151 HD2 LYS 143 1HD LYS 143 -3.843 -1.632 11.346 1152 HD3 LYS 143 2HD LYS 143 -4.514 -2.946 12.327 1153 HE2 LYS 143 1HE LYS 143 -4.583 -4.427 10.425 1154 HE3 LYS 143 2HE LYS 143 -4.109 -3.108 9.345 1155 HZ1 LYS 143 3HZ LYS 143 -2.474 -4.664 11.196 1156 HZ2 LYS 143 1HZ LYS 143 -2.072 -3.033 11.002 1157 HZ3 LYS 143 2HZ LYS 143 -2.095 -4.063 9.660 1158 H LEU 144 H LEU 144 -8.798 0.984 10.864 1159 HA LEU 144 HA LEU 144 -7.896 3.640 11.378 1160 HB2 LEU 144 1HB LEU 144 -10.569 2.917 10.202 1161 HB3 LEU 144 2HB LEU 144 -9.573 4.351 9.897 1162 HG LEU 144 HG LEU 144 -8.770 1.579 9.036 1163 HD11 LEU 144 1HD1 LEU 144 -9.447 2.779 6.741 1164 HD12 LEU 144 2HD1 LEU 144 -10.635 3.515 7.815 1165 HD13 LEU 144 3HD1 LEU 144 -10.553 1.760 7.661 1166 HD21 LEU 144 3HD2 LEU 144 -6.841 2.624 8.649 1167 HD22 LEU 144 1HD2 LEU 144 -7.550 4.209 8.962 1168 HD23 LEU 144 2HD2 LEU 144 -7.677 3.487 7.357 1169 H ALA 145 H ALA 145 -10.688 1.729 12.426 1170 HA ALA 145 HA ALA 145 -12.266 3.493 13.710 1171 HB1 ALA 145 3HB ALA 145 -12.213 1.535 15.592 1172 HB2 ALA 145 1HB ALA 145 -13.128 1.456 14.086 1173 HB3 ALA 145 2HB ALA 145 -11.542 0.693 14.196 1174 H SER 146 H SER 146 -9.725 1.799 15.554 1175 HA SER 146 HA SER 146 -8.611 4.161 16.652 1176 HB2 SER 146 1HB SER 146 -10.887 4.037 17.805 1177 HB3 SER 146 2HB SER 146 -10.271 2.591 18.624 1178 HG SER 146 HG SER 146 -9.952 4.999 19.446 1179 H GLY 147 H GLY 147 -7.788 1.649 15.469 1180 HA2 GLY 147 1HA GLY 147 -5.590 0.736 15.996 1181 HA3 GLY 147 2HA GLY 147 -6.091 0.670 17.679 1182 HA PRO 148 HA PRO 148 -6.897 -3.389 15.315 1183 HB2 PRO 148 2HB PRO 148 -4.716 -3.904 14.804 1184 HB3 PRO 148 1HB PRO 148 -4.798 -4.857 16.283 1185 HG2 PRO 148 1HG PRO 148 -3.804 -3.198 17.572 1186 HG3 PRO 148 2HG PRO 148 -2.953 -2.972 15.998 1187 HD2 PRO 148 1HD PRO 148 -4.229 -0.947 17.278 1188 HD3 PRO 148 2HD PRO 148 -4.153 -1.065 15.512 1189 H SER 149 H SER 149 -7.013 -5.628 16.462 1190 HA SER 149 HA SER 149 -8.637 -5.311 18.760 1191 HB2 SER 149 1HB SER 149 -9.080 -7.139 17.256 1192 HB3 SER 149 2HB SER 149 -7.439 -7.775 17.477 1193 HG SER 149 HG SER 149 -7.941 -8.405 19.519 1194 H SER 150 H SER 150 -5.552 -7.074 18.408 1195 HA SER 150 HA SER 150 -4.703 -6.092 21.016 1196 HB2 SER 150 1HB SER 150 -4.133 -8.372 21.813 1197 HB3 SER 150 2HB SER 150 -5.876 -8.153 21.581 1198 HG SER 150 HG SER 150 -4.058 -9.656 20.062 1199 H GLY 151 H GLY 151 -2.416 -7.000 21.501 1200 HA2 GLY 151 1HA GLY 151 -0.607 -8.060 19.847 1201 HA3 GLY 151 2HA GLY 151 -0.825 -6.474 19.121 Start of MODEL 4 1 H1 GLY 1 H GLY 1 0.691 -2.031 15.733 2 HA2 GLY 1 1HA GLY 1 1.264 -4.251 16.428 3 HA3 GLY 1 2HA GLY 1 0.012 -4.869 15.360 4 H SER 2 H SER 2 3.302 -3.848 15.631 5 HA SER 2 HA SER 2 4.019 -5.247 13.245 6 HB2 SER 2 1HB SER 2 3.342 -3.306 12.059 7 HB3 SER 2 2HB SER 2 4.078 -2.231 13.260 8 HG SER 2 HG SER 2 6.082 -2.751 12.521 9 H SER 3 H SER 3 5.808 -6.250 13.850 10 HA SER 3 HA SER 3 7.532 -5.066 15.878 11 HB2 SER 3 1HB SER 3 6.990 -7.787 14.867 12 HB3 SER 3 2HB SER 3 8.685 -7.468 15.274 13 HG SER 3 HG SER 3 6.586 -6.801 17.044 14 H GLY 4 H GLY 4 8.602 -3.435 14.761 15 HA2 GLY 4 1HA GLY 4 10.941 -3.280 13.893 16 HA3 GLY 4 2HA GLY 4 10.411 -4.366 12.617 17 H SER 5 H SER 5 11.589 -1.996 11.958 18 HA SER 5 HA SER 5 9.744 -0.848 10.198 19 HB2 SER 5 1HB SER 5 9.856 1.515 11.361 20 HB3 SER 5 2HB SER 5 8.618 0.341 11.837 21 HG SER 5 HG SER 5 11.098 0.759 13.155 22 H SER 6 H SER 6 12.600 -0.161 12.180 23 HA SER 6 HA SER 6 13.814 1.504 10.183 24 HB2 SER 6 1HB SER 6 14.320 1.895 12.529 25 HB3 SER 6 2HB SER 6 14.948 0.245 12.693 26 HG SER 6 HG SER 6 16.061 2.425 11.292 27 H GLY 7 H GLY 7 14.564 -1.735 11.480 28 HA2 GLY 7 1HA GLY 7 14.924 -3.285 9.403 29 HA3 GLY 7 2HA GLY 7 16.297 -2.215 9.163 30 H SER 8 H SER 8 17.688 -4.038 9.367 31 HA SER 8 HA SER 8 18.621 -4.440 12.032 32 HB2 SER 8 1HB SER 8 16.569 -6.102 11.474 33 HB3 SER 8 2HB SER 8 17.914 -7.056 10.822 34 HG SER 8 HG SER 8 17.293 -7.233 13.189 35 H ASP 9 H ASP 9 18.632 -5.598 8.692 36 HA ASP 9 HA ASP 9 21.569 -5.733 8.836 37 HB2 ASP 9 1HB ASP 9 20.222 -7.986 8.727 38 HB3 ASP 9 2HB ASP 9 20.045 -7.565 7.019 39 H SER 10 H SER 10 21.336 -6.657 5.926 40 HA SER 10 HA SER 10 21.024 -3.955 4.799 41 HB2 SER 10 1HB SER 10 22.496 -4.833 2.937 42 HB3 SER 10 2HB SER 10 23.278 -4.715 4.523 43 HG SER 10 HG SER 10 23.569 -6.790 4.505 44 H LEU 11 H LEU 11 20.027 -3.705 2.753 45 HA LEU 11 HA LEU 11 18.559 -5.992 1.687 46 HB2 LEU 11 1HB LEU 11 17.147 -3.390 2.250 47 HB3 LEU 11 2HB LEU 11 16.443 -4.939 1.756 48 HG LEU 11 HG LEU 11 17.855 -4.802 4.376 49 HD11 LEU 11 1HD1 LEU 11 16.409 -2.782 4.270 50 HD12 LEU 11 2HD1 LEU 11 15.927 -3.943 5.506 51 HD13 LEU 11 3HD1 LEU 11 15.025 -3.840 3.993 52 HD21 LEU 11 3HD2 LEU 11 15.361 -6.218 3.438 53 HD22 LEU 11 1HD2 LEU 11 16.177 -6.443 4.986 54 HD23 LEU 11 2HD2 LEU 11 16.978 -6.922 3.489 55 H VAL 12 H VAL 12 17.046 -4.849 -0.204 56 HA VAL 12 HA VAL 12 19.046 -3.689 -1.989 57 HB VAL 12 HB VAL 12 16.284 -4.438 -2.870 58 HG11 VAL 12 1HG1 VAL 12 18.500 -5.228 -4.543 59 HG12 VAL 12 2HG1 VAL 12 17.136 -4.170 -4.908 60 HG13 VAL 12 3HG1 VAL 12 18.583 -3.513 -4.141 61 HG21 VAL 12 3HG2 VAL 12 17.167 -6.299 -1.467 62 HG22 VAL 12 1HG2 VAL 12 16.909 -6.736 -3.156 63 HG23 VAL 12 2HG2 VAL 12 18.540 -6.416 -2.566 64 H VAL 13 H VAL 13 18.170 -1.925 -0.044 65 HA VAL 13 HA VAL 13 16.056 -0.311 -0.315 66 HB VAL 13 HB VAL 13 18.071 0.085 1.159 67 HG11 VAL 13 1HG1 VAL 13 19.531 0.199 -1.043 68 HG12 VAL 13 2HG1 VAL 13 19.143 1.917 -0.921 69 HG13 VAL 13 3HG1 VAL 13 19.970 1.101 0.406 70 HG21 VAL 13 3HG2 VAL 13 17.255 2.642 -0.160 71 HG22 VAL 13 1HG2 VAL 13 16.063 1.664 0.698 72 HG23 VAL 13 2HG2 VAL 13 17.474 2.288 1.554 73 H CYS 14 H CYS 14 15.075 0.804 -1.867 74 HA CYS 14 HA CYS 14 16.631 1.536 -4.260 75 HB2 CYS 14 1HB CYS 14 13.728 0.714 -4.059 76 HB3 CYS 14 2HB CYS 14 14.511 1.290 -5.541 77 HG CYS 14 HG CYS 14 14.686 -1.229 -6.203 78 H GLU 15 H GLU 15 15.023 3.188 -5.569 79 HA GLU 15 HA GLU 15 14.588 5.393 -3.667 80 HB2 GLU 15 1HB GLU 15 14.964 6.910 -5.570 81 HB3 GLU 15 2HB GLU 15 16.355 5.858 -5.271 82 HG2 GLU 15 1HG GLU 15 15.010 4.373 -7.087 83 HG3 GLU 15 2HG GLU 15 14.566 6.008 -7.595 84 H VAL 16 H VAL 16 12.918 7.003 -4.384 85 HA VAL 16 HA VAL 16 10.510 5.554 -5.178 86 HB VAL 16 HB VAL 16 10.409 6.887 -3.121 87 HG11 VAL 16 1HG1 VAL 16 11.963 8.693 -4.406 88 HG12 VAL 16 2HG1 VAL 16 10.383 9.470 -4.525 89 HG13 VAL 16 3HG1 VAL 16 11.038 9.040 -2.945 90 HG21 VAL 16 3HG2 VAL 16 8.612 7.049 -5.338 91 HG22 VAL 16 1HG2 VAL 16 8.249 7.038 -3.612 92 HG23 VAL 16 2HG2 VAL 16 8.564 8.565 -4.437 93 H ASP 17 H ASP 17 10.385 5.448 -7.355 94 HA ASP 17 HA ASP 17 11.333 6.972 -9.330 95 HB2 ASP 17 1HB ASP 17 9.816 4.975 -9.574 96 HB3 ASP 17 2HB ASP 17 8.449 6.069 -9.322 97 HA PRO 18 HA PRO 18 9.846 11.093 -8.853 98 HB2 PRO 18 2HB PRO 18 11.598 11.714 -10.203 99 HB3 PRO 18 1HB PRO 18 10.327 11.997 -11.392 100 HG2 PRO 18 1HG PRO 18 10.639 9.937 -12.421 101 HG3 PRO 18 2HG PRO 18 12.326 10.339 -11.930 102 HD2 PRO 18 1HD PRO 18 11.120 8.002 -11.254 103 HD3 PRO 18 2HD PRO 18 12.289 8.816 -10.200 104 H GLU 19 H GLU 19 8.667 9.037 -11.454 105 HA GLU 19 HA GLU 19 6.465 10.736 -12.138 106 HB2 GLU 19 1HB GLU 19 5.977 9.224 -13.784 107 HB3 GLU 19 2HB GLU 19 7.680 8.823 -13.507 108 HG2 GLU 19 1HG GLU 19 6.991 6.719 -13.295 109 HG3 GLU 19 2HG GLU 19 6.410 7.215 -11.699 110 H LEU 20 H LEU 20 7.033 8.219 -9.827 111 HA LEU 20 HA LEU 20 4.209 7.811 -9.293 112 HB2 LEU 20 1HB LEU 20 6.238 6.111 -9.146 113 HB3 LEU 20 2HB LEU 20 6.339 6.763 -7.501 114 HG LEU 20 HG LEU 20 3.922 5.411 -8.702 115 HD11 LEU 20 1HD1 LEU 20 5.040 4.094 -6.428 116 HD12 LEU 20 2HD1 LEU 20 6.289 4.306 -7.654 117 HD13 LEU 20 3HD1 LEU 20 4.787 3.476 -8.060 118 HD21 LEU 20 3HD2 LEU 20 3.378 5.386 -6.137 119 HD22 LEU 20 1HD2 LEU 20 2.998 6.797 -7.124 120 HD23 LEU 20 2HD2 LEU 20 4.443 6.793 -6.112 121 H LYS 21 H LYS 21 6.976 9.437 -7.869 122 HA LYS 21 HA LYS 21 6.103 10.005 -5.335 123 HB2 LYS 21 1HB LYS 21 8.301 10.656 -6.433 124 HB3 LYS 21 2HB LYS 21 7.443 12.058 -7.094 125 HG2 LYS 21 1HG LYS 21 6.786 12.273 -4.475 126 HG3 LYS 21 2HG LYS 21 8.397 11.543 -4.364 127 HD2 LYS 21 1HD LYS 21 8.242 13.714 -6.325 128 HD3 LYS 21 2HD LYS 21 7.873 14.223 -4.667 129 HE2 LYS 21 1HE LYS 21 10.031 12.776 -4.117 130 HE3 LYS 21 2HE LYS 21 10.402 13.147 -5.806 131 HZ1 LYS 21 3HZ LYS 21 10.893 15.244 -5.303 132 HZ2 LYS 21 1HZ LYS 21 10.925 14.753 -3.684 133 HZ3 LYS 21 2HZ LYS 21 9.523 15.443 -4.331 134 H GLU 22 H GLU 22 5.310 11.768 -8.314 135 HA GLU 22 HA GLU 22 3.715 13.743 -7.076 136 HB2 GLU 22 1HB GLU 22 3.340 12.747 -9.899 137 HB3 GLU 22 2HB GLU 22 3.037 14.369 -9.259 138 HG2 GLU 22 1HG GLU 22 5.602 14.349 -8.754 139 HG3 GLU 22 2HG GLU 22 5.621 13.076 -9.983 140 H THR 23 H THR 23 2.932 10.626 -8.560 141 HA THR 23 HA THR 23 0.193 10.694 -8.575 142 HB THR 23 HB THR 23 2.093 8.431 -8.020 143 HG1 THR 23 1HG THR 23 0.624 9.426 -10.191 144 HG21 THR 23 3HG2 THR 23 -0.101 7.050 -8.524 145 HG22 THR 23 1HG2 THR 23 -0.878 8.453 -7.791 146 HG23 THR 23 2HG2 THR 23 0.317 7.530 -6.879 147 H LEU 24 H LEU 24 2.275 9.780 -5.839 148 HA LEU 24 HA LEU 24 0.186 9.253 -4.025 149 HB2 LEU 24 1HB LEU 24 2.868 10.305 -3.176 150 HB3 LEU 24 2HB LEU 24 1.822 9.123 -2.369 151 HG LEU 24 HG LEU 24 3.486 8.663 -4.843 152 HD11 LEU 24 1HD1 LEU 24 4.210 8.604 -2.183 153 HD12 LEU 24 2HD1 LEU 24 5.050 7.807 -3.511 154 HD13 LEU 24 3HD1 LEU 24 3.865 6.916 -2.557 155 HD21 LEU 24 3HD2 LEU 24 1.138 7.296 -3.851 156 HD22 LEU 24 1HD2 LEU 24 2.543 6.230 -3.893 157 HD23 LEU 24 2HD2 LEU 24 2.026 7.065 -5.358 158 H ARG 25 H ARG 25 2.193 12.156 -4.491 159 HA ARG 25 HA ARG 25 1.087 13.746 -2.505 160 HB2 ARG 25 1HB ARG 25 3.101 14.349 -3.775 161 HB3 ARG 25 2HB ARG 25 2.108 14.613 -5.215 162 HG2 ARG 25 1HG ARG 25 1.178 16.566 -4.401 163 HG3 ARG 25 2HG ARG 25 1.519 16.135 -2.717 164 HD2 ARG 25 1HD ARG 25 3.131 17.741 -3.080 165 HD3 ARG 25 2HD ARG 25 4.014 16.265 -3.494 166 HE ARG 25 HE ARG 25 2.900 17.107 -5.853 167 HH11 ARG 25 2HH1 ARG 25 5.042 18.473 -3.472 168 HH12 ARG 25 1HH1 ARG 25 5.883 19.471 -4.612 169 HH21 ARG 25 1HH2 ARG 25 5.289 19.439 -6.824 170 HH22 ARG 25 2HH2 ARG 25 3.999 18.416 -7.362 171 H LYS 26 H LYS 26 -0.157 12.898 -5.648 172 HA LYS 26 HA LYS 26 -2.255 14.890 -5.570 173 HB2 LYS 26 1HB LYS 26 -2.168 12.554 -7.463 174 HB3 LYS 26 2HB LYS 26 -2.844 14.170 -7.722 175 HG2 LYS 26 1HG LYS 26 -0.074 14.482 -7.192 176 HG3 LYS 26 2HG LYS 26 -0.265 13.194 -8.396 177 HD2 LYS 26 1HD LYS 26 -1.980 14.930 -9.451 178 HD3 LYS 26 2HD LYS 26 -0.955 16.081 -8.576 179 HE2 LYS 26 1HE LYS 26 0.661 15.920 -10.107 180 HE3 LYS 26 2HE LYS 26 0.672 14.156 -9.960 181 HZ1 LYS 26 3HZ LYS 26 -0.867 15.840 -11.822 182 HZ2 LYS 26 1HZ LYS 26 -1.428 14.295 -11.421 183 HZ3 LYS 26 2HZ LYS 26 0.087 14.482 -12.149 184 H PHE 27 H PHE 27 -1.889 11.437 -5.009 185 HA PHE 27 HA PHE 27 -4.586 10.723 -4.863 186 HB2 PHE 27 1HB PHE 27 -2.454 9.245 -4.828 187 HB3 PHE 27 2HB PHE 27 -2.497 9.495 -3.082 188 HD1 PHE 27 1HD PHE 27 -5.251 8.928 -5.525 189 HD2 PHE 27 2HD PHE 27 -3.156 7.520 -2.098 190 HE1 PHE 27 1HE PHE 27 -6.881 7.101 -5.283 191 HE2 PHE 27 2HE PHE 27 -4.782 5.690 -1.851 192 HZ PHE 27 HZ PHE 27 -6.647 5.478 -3.445 193 H ARG 28 H ARG 28 -2.451 12.178 -2.483 194 HA ARG 28 HA ARG 28 -4.232 11.889 -0.277 195 HB2 ARG 28 1HB ARG 28 -2.121 14.025 -0.480 196 HB3 ARG 28 2HB ARG 28 -2.689 13.159 0.955 197 HG2 ARG 28 1HG ARG 28 -1.686 11.145 -0.657 198 HG3 ARG 28 2HG ARG 28 -0.557 12.490 -0.887 199 HD2 ARG 28 1HD ARG 28 -1.415 11.319 1.769 200 HD3 ARG 28 2HD ARG 28 0.143 11.070 0.968 201 HE ARG 28 HE ARG 28 0.073 13.735 1.182 202 HH11 ARG 28 2HH1 ARG 28 -0.587 11.214 3.490 203 HH12 ARG 28 1HH1 ARG 28 -0.075 12.149 4.855 204 HH21 ARG 28 1HH2 ARG 28 0.684 14.291 4.560 205 HH22 ARG 28 2HH2 ARG 28 0.749 14.978 2.972 206 H PHE 29 H PHE 29 -3.661 14.385 -2.688 207 HA PHE 29 HA PHE 29 -5.979 15.857 -1.615 208 HB2 PHE 29 1HB PHE 29 -4.042 17.338 -3.299 209 HB3 PHE 29 2HB PHE 29 -4.928 17.863 -1.865 210 HD1 PHE 29 2HD PHE 29 -4.160 16.111 0.237 211 HD2 PHE 29 1HD PHE 29 -1.784 17.641 -2.946 212 HE1 PHE 29 2HE PHE 29 -2.141 15.837 1.616 213 HE2 PHE 29 1HE PHE 29 0.239 17.369 -1.572 214 HZ PHE 29 HZ PHE 29 0.062 16.468 0.713 215 H ARG 30 H ARG 30 -6.219 13.753 -3.456 216 HA ARG 30 HA ARG 30 -6.339 14.712 -6.137 217 HB2 ARG 30 1HB ARG 30 -7.597 12.630 -6.591 218 HB3 ARG 30 2HB ARG 30 -6.090 12.343 -5.710 219 HG2 ARG 30 1HG ARG 30 -7.606 12.444 -3.593 220 HG3 ARG 30 2HG ARG 30 -8.904 12.117 -4.753 221 HD2 ARG 30 1HD ARG 30 -6.650 10.371 -5.233 222 HD3 ARG 30 2HD ARG 30 -7.193 10.260 -3.553 223 HE ARG 30 HE ARG 30 -8.650 9.432 -5.912 224 HH11 ARG 30 2HH1 ARG 30 -8.784 10.198 -2.519 225 HH12 ARG 30 1HH1 ARG 30 -10.246 9.308 -2.243 226 HH21 ARG 30 1HH2 ARG 30 -11.262 8.205 -3.974 227 HH22 ARG 30 2HH2 ARG 30 -10.574 8.258 -5.561 228 H LYS 31 H LYS 31 -8.399 14.719 -7.404 229 HA LYS 31 HA LYS 31 -10.374 16.323 -5.975 230 HB2 LYS 31 1HB LYS 31 -9.667 15.893 -8.855 231 HB3 LYS 31 2HB LYS 31 -11.278 16.498 -8.439 232 HG2 LYS 31 1HG LYS 31 -9.254 17.967 -7.006 233 HG3 LYS 31 2HG LYS 31 -8.937 17.981 -8.750 234 HD2 LYS 31 1HD LYS 31 -11.757 18.410 -8.067 235 HD3 LYS 31 2HD LYS 31 -10.665 19.657 -7.437 236 HE2 LYS 31 1HE LYS 31 -9.663 19.589 -9.869 237 HE3 LYS 31 2HE LYS 31 -11.241 18.894 -10.266 238 HZ1 LYS 31 3HZ LYS 31 -10.559 21.604 -9.503 239 HZ2 LYS 31 1HZ LYS 31 -11.966 20.994 -8.786 240 HZ3 LYS 31 2HZ LYS 31 -11.825 21.036 -10.471 241 H GLU 32 H GLU 32 -10.299 13.519 -5.421 242 HA GLU 32 HA GLU 32 -12.857 12.651 -6.598 243 HB2 GLU 32 1HB GLU 32 -10.558 11.004 -5.523 244 HB3 GLU 32 2HB GLU 32 -12.124 10.334 -6.002 245 HG2 GLU 32 1HG GLU 32 -11.757 10.666 -8.243 246 HG3 GLU 32 2HG GLU 32 -10.608 11.981 -7.960 247 H THR 33 H THR 33 -14.022 11.046 -5.087 248 HA THR 33 HA THR 33 -13.720 11.725 -2.264 249 HB THR 33 HB THR 33 -16.184 12.153 -2.061 250 HG1 THR 33 1HG THR 33 -16.771 11.261 -4.119 251 HG21 THR 33 3HG2 THR 33 -14.793 14.057 -1.930 252 HG22 THR 33 1HG2 THR 33 -16.050 14.478 -3.093 253 HG23 THR 33 2HG2 THR 33 -14.443 14.018 -3.658 254 H ASN 34 H ASN 34 -13.569 9.349 -4.183 255 HA ASN 34 HA ASN 34 -15.386 7.582 -2.677 256 HB2 ASN 34 1HB ASN 34 -15.152 6.044 -4.712 257 HB3 ASN 34 2HB ASN 34 -16.140 7.497 -4.911 258 HD21 ASN 34 2HD2 ASN 34 -13.264 6.845 -7.480 259 HD22 ASN 34 1HD2 ASN 34 -14.056 5.670 -6.492 260 H ASN 35 H ASN 35 -14.481 5.170 -3.037 261 HA ASN 35 HA ASN 35 -11.898 5.188 -1.726 262 HB2 ASN 35 1HB ASN 35 -13.948 3.051 -2.303 263 HB3 ASN 35 2HB ASN 35 -12.345 2.650 -1.674 264 HD21 ASN 35 2HD2 ASN 35 -14.543 2.921 1.226 265 HD22 ASN 35 1HD2 ASN 35 -14.372 1.908 -0.163 266 H ALA 36 H ALA 36 -9.999 4.695 -2.631 267 HA ALA 36 HA ALA 36 -9.941 3.259 -5.180 268 HB1 ALA 36 3HB ALA 36 -8.421 4.876 -6.182 269 HB2 ALA 36 1HB ALA 36 -9.956 5.636 -5.761 270 HB3 ALA 36 2HB ALA 36 -8.536 5.892 -4.745 271 H ALA 37 H ALA 37 -7.673 2.639 -5.781 272 HA ALA 37 HA ALA 37 -5.872 2.419 -3.484 273 HB1 ALA 37 3HB ALA 37 -6.075 -0.061 -5.031 274 HB2 ALA 37 1HB ALA 37 -5.955 0.187 -3.288 275 HB3 ALA 37 2HB ALA 37 -7.516 0.339 -4.097 276 H ILE 38 H ILE 38 -3.685 1.969 -4.037 277 HA ILE 38 HA ILE 38 -3.033 2.174 -6.894 278 HB ILE 38 HB ILE 38 -1.608 3.755 -4.753 279 HG12 ILE 38 1HG1 ILE 38 -3.737 4.557 -6.742 280 HG13 ILE 38 2HG1 ILE 38 -3.773 4.737 -4.979 281 HG21 ILE 38 1HG2 ILE 38 -1.201 4.772 -7.360 282 HG22 ILE 38 2HG2 ILE 38 -0.024 4.026 -6.281 283 HG23 ILE 38 3HG2 ILE 38 -0.929 3.031 -7.420 284 HD11 ILE 38 3HD1 ILE 38 -1.629 6.221 -5.466 285 HD12 ILE 38 1HD1 ILE 38 -2.441 6.411 -7.020 286 HD13 ILE 38 2HD1 ILE 38 -3.269 6.870 -5.530 287 H ILE 39 H ILE 39 -2.041 0.308 -7.315 288 HA ILE 39 HA ILE 39 -0.282 -0.892 -5.314 289 HB ILE 39 HB ILE 39 -1.166 -2.007 -7.978 290 HG12 ILE 39 1HG1 ILE 39 -2.196 -3.329 -5.607 291 HG13 ILE 39 2HG1 ILE 39 -2.683 -1.626 -5.661 292 HG21 ILE 39 1HG2 ILE 39 0.948 -2.931 -7.123 293 HG22 ILE 39 2HG2 ILE 39 0.132 -3.372 -5.625 294 HG23 ILE 39 3HG2 ILE 39 -0.346 -4.129 -7.144 295 HD11 ILE 39 3HD1 ILE 39 -3.935 -1.886 -7.558 296 HD12 ILE 39 1HD1 ILE 39 -3.016 -3.288 -8.105 297 HD13 ILE 39 2HD1 ILE 39 -4.167 -3.451 -6.778 298 H MET 40 H MET 40 1.771 -0.262 -5.340 299 HA MET 40 HA MET 40 3.034 0.332 -7.931 300 HB2 MET 40 1HB MET 40 4.130 1.141 -5.244 301 HB3 MET 40 2HB MET 40 4.502 1.819 -6.836 302 HG2 MET 40 1HG MET 40 2.730 3.211 -6.826 303 HG3 MET 40 2HG MET 40 1.692 2.033 -6.019 304 HE1 MET 40 3HE MET 40 1.683 2.790 -2.471 305 HE2 MET 40 1HE MET 40 0.607 3.398 -3.730 306 HE3 MET 40 2HE MET 40 1.241 1.756 -3.830 307 H LYS 41 H LYS 41 5.109 -0.480 -8.378 308 HA LYS 41 HA LYS 41 6.004 -2.675 -6.630 309 HB2 LYS 41 1HB LYS 41 6.438 -4.087 -8.481 310 HB3 LYS 41 2HB LYS 41 4.812 -3.436 -8.734 311 HG2 LYS 41 1HG LYS 41 5.650 -1.828 -10.340 312 HG3 LYS 41 2HG LYS 41 7.309 -2.376 -10.041 313 HD2 LYS 41 1HD LYS 41 7.057 -4.292 -11.245 314 HD3 LYS 41 2HD LYS 41 5.343 -4.449 -10.824 315 HE2 LYS 41 1HE LYS 41 4.789 -3.611 -12.812 316 HE3 LYS 41 2HE LYS 41 5.586 -2.097 -12.361 317 HZ1 LYS 41 3HZ LYS 41 6.572 -2.828 -14.361 318 HZ2 LYS 41 1HZ LYS 41 6.780 -4.405 -13.786 319 HZ3 LYS 41 2HZ LYS 41 7.705 -3.142 -13.146 320 H VAL 42 H VAL 42 8.309 -3.388 -7.342 321 HA VAL 42 HA VAL 42 9.911 -0.976 -7.898 322 HB VAL 42 HB VAL 42 10.438 -1.254 -5.686 323 HG11 VAL 42 1HG1 VAL 42 10.750 -3.618 -4.700 324 HG12 VAL 42 2HG1 VAL 42 9.111 -3.046 -5.019 325 HG13 VAL 42 3HG1 VAL 42 9.890 -4.164 -6.139 326 HG21 VAL 42 3HG2 VAL 42 12.316 -3.235 -6.972 327 HG22 VAL 42 1HG2 VAL 42 12.483 -1.480 -7.042 328 HG23 VAL 42 2HG2 VAL 42 12.607 -2.317 -5.494 329 H ASP 43 H ASP 43 10.997 -1.172 -9.731 330 HA ASP 43 HA ASP 43 11.395 -3.721 -10.991 331 HB2 ASP 43 1HB ASP 43 11.979 -0.867 -11.698 332 HB3 ASP 43 2HB ASP 43 12.778 -2.161 -12.601 333 H LYS 44 H LYS 44 13.008 -5.057 -10.566 334 HA LYS 44 HA LYS 44 15.213 -4.367 -8.931 335 HB2 LYS 44 1HB LYS 44 14.196 -6.656 -9.167 336 HB3 LYS 44 2HB LYS 44 14.987 -6.770 -10.748 337 HG2 LYS 44 1HG LYS 44 17.094 -6.083 -9.182 338 HG3 LYS 44 2HG LYS 44 16.113 -7.035 -8.052 339 HD2 LYS 44 1HD LYS 44 15.959 -8.785 -9.920 340 HD3 LYS 44 2HD LYS 44 17.278 -7.885 -10.690 341 HE2 LYS 44 1HE LYS 44 17.616 -8.602 -7.821 342 HE3 LYS 44 2HE LYS 44 17.709 -9.910 -9.008 343 HZ1 LYS 44 3HZ LYS 44 19.226 -7.773 -9.973 344 HZ2 LYS 44 1HZ LYS 44 19.769 -9.293 -9.466 345 HZ3 LYS 44 2HZ LYS 44 19.669 -8.018 -8.360 346 H ASP 45 H ASP 45 14.649 -4.117 -12.304 347 HA ASP 45 HA ASP 45 17.404 -4.164 -13.112 348 HB2 ASP 45 1HB ASP 45 14.966 -4.359 -14.421 349 HB3 ASP 45 2HB ASP 45 15.578 -2.775 -14.917 350 H ARG 46 H ARG 46 15.072 -1.721 -12.177 351 HA ARG 46 HA ARG 46 17.116 0.356 -12.602 352 HB2 ARG 46 1HB ARG 46 14.135 0.735 -12.250 353 HB3 ARG 46 2HB ARG 46 15.321 1.972 -12.696 354 HG2 ARG 46 1HG ARG 46 15.724 0.909 -14.824 355 HG3 ARG 46 2HG ARG 46 14.662 -0.437 -14.376 356 HD2 ARG 46 1HD ARG 46 13.063 0.721 -15.455 357 HD3 ARG 46 2HD ARG 46 13.020 1.699 -13.982 358 HE ARG 46 HE ARG 46 14.996 2.679 -15.755 359 HH11 ARG 46 2HH1 ARG 46 11.549 2.545 -15.288 360 HH12 ARG 46 1HH1 ARG 46 11.243 4.013 -16.155 361 HH21 ARG 46 1HH2 ARG 46 12.982 5.188 -17.072 362 HH22 ARG 46 2HH2 ARG 46 14.606 4.614 -16.900 363 H GLN 47 H GLN 47 15.891 -1.558 -10.248 364 HA GLN 47 HA GLN 47 15.617 -1.410 -7.976 365 HB2 GLN 47 1HB GLN 47 17.995 0.439 -8.274 366 HB3 GLN 47 2HB GLN 47 17.551 -0.495 -6.835 367 HG2 GLN 47 1HG GLN 47 17.857 -2.175 -9.189 368 HG3 GLN 47 2HG GLN 47 19.322 -1.262 -8.799 369 HE21 GLN 47 2HE2 GLN 47 18.300 -4.471 -6.653 370 HE22 GLN 47 1HE2 GLN 47 17.489 -3.977 -8.096 371 H MET 48 H MET 48 13.710 0.117 -8.933 372 HA MET 48 HA MET 48 13.576 2.297 -7.024 373 HB2 MET 48 1HB MET 48 13.407 4.053 -8.461 374 HB3 MET 48 2HB MET 48 14.465 3.019 -9.433 375 HG2 MET 48 1HG MET 48 12.089 2.110 -10.285 376 HG3 MET 48 2HG MET 48 11.641 3.762 -9.851 377 HE1 MET 48 3HE MET 48 13.500 5.550 -10.196 378 HE2 MET 48 1HE MET 48 14.431 5.736 -11.682 379 HE3 MET 48 2HE MET 48 12.698 6.058 -11.683 380 H VAL 49 H VAL 49 11.457 2.933 -6.521 381 HA VAL 49 HA VAL 49 9.467 0.909 -7.046 382 HB VAL 49 HB VAL 49 9.124 3.476 -5.496 383 HG11 VAL 49 1HG1 VAL 49 6.995 2.647 -5.818 384 HG12 VAL 49 2HG1 VAL 49 7.531 0.966 -5.801 385 HG13 VAL 49 3HG1 VAL 49 7.449 1.883 -4.295 386 HG21 VAL 49 3HG2 VAL 49 11.007 2.217 -4.595 387 HG22 VAL 49 1HG2 VAL 49 9.631 2.159 -3.493 388 HG23 VAL 49 2HG2 VAL 49 10.008 0.766 -4.506 389 H VAL 50 H VAL 50 8.372 0.956 -8.896 390 HA VAL 50 HA VAL 50 7.427 3.565 -9.893 391 HB VAL 50 HB VAL 50 7.444 2.633 -12.157 392 HG11 VAL 50 1HG1 VAL 50 9.874 2.550 -12.476 393 HG12 VAL 50 2HG1 VAL 50 9.404 3.849 -11.377 394 HG13 VAL 50 3HG1 VAL 50 10.091 2.356 -10.736 395 HG21 VAL 50 3HG2 VAL 50 8.383 0.485 -12.661 396 HG22 VAL 50 1HG2 VAL 50 8.815 0.225 -10.971 397 HG23 VAL 50 2HG2 VAL 50 7.118 0.262 -11.452 398 H LEU 51 H LEU 51 5.302 3.771 -10.428 399 HA LEU 51 HA LEU 51 3.358 2.288 -9.207 400 HB2 LEU 51 1HB LEU 51 2.956 4.478 -10.198 401 HB3 LEU 51 2HB LEU 51 3.140 3.781 -11.817 402 HG LEU 51 HG LEU 51 1.110 2.271 -10.745 403 HD11 LEU 51 1HD1 LEU 51 1.308 4.520 -9.094 404 HD12 LEU 51 2HD1 LEU 51 -0.018 3.361 -9.179 405 HD13 LEU 51 3HD1 LEU 51 -0.064 4.825 -10.160 406 HD21 LEU 51 3HD2 LEU 51 0.686 4.826 -12.274 407 HD22 LEU 51 1HD2 LEU 51 -0.264 3.340 -12.339 408 HD23 LEU 51 2HD2 LEU 51 1.368 3.375 -13.007 409 H GLU 52 H GLU 52 2.056 0.561 -9.714 410 HA GLU 52 HA GLU 52 2.883 -1.016 -12.063 411 HB2 GLU 52 1HB GLU 52 3.501 -2.062 -9.927 412 HB3 GLU 52 2HB GLU 52 1.806 -2.008 -9.418 413 HG2 GLU 52 1HG GLU 52 1.151 -3.636 -10.961 414 HG3 GLU 52 2HG GLU 52 2.633 -3.446 -11.909 415 H ASP 53 H ASP 53 0.144 -0.201 -9.963 416 HA ASP 53 HA ASP 53 -1.632 -0.207 -12.241 417 HB2 ASP 53 1HB ASP 53 -1.722 -2.321 -10.122 418 HB3 ASP 53 2HB ASP 53 -3.242 -1.731 -10.808 419 H GLU 54 H GLU 54 -3.812 0.574 -11.667 420 HA GLU 54 HA GLU 54 -4.079 1.858 -9.076 421 HB2 GLU 54 1HB GLU 54 -3.352 3.290 -11.527 422 HB3 GLU 54 2HB GLU 54 -4.795 3.941 -10.733 423 HG2 GLU 54 1HG GLU 54 -3.394 3.918 -8.581 424 HG3 GLU 54 2HG GLU 54 -2.007 3.728 -9.665 425 H LEU 55 H LEU 55 -6.026 1.191 -8.466 426 HA LEU 55 HA LEU 55 -8.192 1.163 -10.462 427 HB2 LEU 55 1HB LEU 55 -8.136 -0.396 -7.882 428 HB3 LEU 55 2HB LEU 55 -9.236 -0.595 -9.257 429 HG LEU 55 HG LEU 55 -6.348 -1.047 -9.762 430 HD11 LEU 55 1HD1 LEU 55 -8.072 -2.852 -8.088 431 HD12 LEU 55 2HD1 LEU 55 -6.465 -2.223 -7.723 432 HD13 LEU 55 3HD1 LEU 55 -6.673 -3.433 -8.989 433 HD21 LEU 55 3HD2 LEU 55 -7.328 -1.676 -11.662 434 HD22 LEU 55 1HD2 LEU 55 -8.928 -1.704 -10.921 435 HD23 LEU 55 2HD2 LEU 55 -7.871 -3.110 -10.789 436 H GLN 56 H GLN 56 -9.986 2.338 -10.096 437 HA GLN 56 HA GLN 56 -10.111 3.840 -7.569 438 HB2 GLN 56 1HB GLN 56 -11.002 4.499 -10.370 439 HB3 GLN 56 2HB GLN 56 -11.640 5.373 -8.968 440 HG2 GLN 56 1HG GLN 56 -9.926 6.762 -9.461 441 HG3 GLN 56 2HG GLN 56 -9.056 5.621 -8.426 442 HE21 GLN 56 2HE2 GLN 56 -6.833 4.664 -10.878 443 HE22 GLN 56 1HE2 GLN 56 -7.294 4.705 -9.214 444 H ASN 57 H ASN 57 -12.376 4.485 -6.923 445 HA ASN 57 HA ASN 57 -14.291 3.664 -5.955 446 HB2 ASN 57 1HB ASN 57 -15.811 2.722 -7.991 447 HB3 ASN 57 2HB ASN 57 -15.573 4.442 -7.656 448 HD21 ASN 57 2HD2 ASN 57 -13.502 5.050 -10.433 449 HD22 ASN 57 1HD2 ASN 57 -13.921 5.571 -8.838 450 H ILE 58 H ILE 58 -12.564 1.852 -5.293 451 HA ILE 58 HA ILE 58 -13.870 -0.716 -5.905 452 HB ILE 58 HB ILE 58 -11.964 -1.371 -6.871 453 HG12 ILE 58 1HG1 ILE 58 -11.889 -2.352 -4.512 454 HG13 ILE 58 2HG1 ILE 58 -10.378 -2.373 -5.438 455 HG21 ILE 58 1HG2 ILE 58 -10.846 1.116 -5.660 456 HG22 ILE 58 2HG2 ILE 58 -9.752 -0.082 -6.351 457 HG23 ILE 58 3HG2 ILE 58 -10.996 0.660 -7.356 458 HD11 ILE 58 3HD1 ILE 58 -10.888 -1.217 -2.890 459 HD12 ILE 58 1HD1 ILE 58 -9.366 -1.339 -3.772 460 HD13 ILE 58 2HD1 ILE 58 -10.418 0.056 -4.017 461 H SER 59 H SER 59 -14.249 -2.057 -4.202 462 HA SER 59 HA SER 59 -14.000 -0.902 -1.563 463 HB2 SER 59 1HB SER 59 -15.825 -2.123 -1.106 464 HB3 SER 59 2HB SER 59 -15.815 -2.640 -2.801 465 HG SER 59 HG SER 59 -15.715 -4.302 -1.009 466 HA PRO 60 HA PRO 60 -10.609 -3.191 0.019 467 HB2 PRO 60 2HB PRO 60 -11.165 -2.471 2.129 468 HB3 PRO 60 1HB PRO 60 -11.502 -4.178 2.412 469 HG2 PRO 60 1HG PRO 60 -13.782 -3.933 2.037 470 HG3 PRO 60 2HG PRO 60 -13.385 -2.352 2.809 471 HD2 PRO 60 1HD PRO 60 -14.652 -2.539 0.415 472 HD3 PRO 60 2HD PRO 60 -13.525 -1.228 0.802 473 H GLU 61 H GLU 61 -13.267 -4.776 -1.122 474 HA GLU 61 HA GLU 61 -12.277 -7.448 -0.424 475 HB2 GLU 61 1HB GLU 61 -14.901 -6.309 -1.016 476 HB3 GLU 61 2HB GLU 61 -14.578 -7.794 -1.923 477 HG2 GLU 61 1HG GLU 61 -13.910 -8.838 0.298 478 HG3 GLU 61 2HG GLU 61 -14.645 -7.416 1.051 479 H GLU 62 H GLU 62 -12.590 -5.212 -3.046 480 HA GLU 62 HA GLU 62 -12.082 -7.195 -5.092 481 HB2 GLU 62 1HB GLU 62 -12.579 -4.248 -5.040 482 HB3 GLU 62 2HB GLU 62 -11.786 -4.951 -6.458 483 HG2 GLU 62 1HG GLU 62 -14.384 -6.019 -5.384 484 HG3 GLU 62 2HG GLU 62 -14.307 -4.690 -6.550 485 H LEU 63 H LEU 63 -10.326 -4.574 -3.491 486 HA LEU 63 HA LEU 63 -7.998 -4.562 -4.980 487 HB2 LEU 63 1HB LEU 63 -8.881 -3.343 -2.684 488 HB3 LEU 63 2HB LEU 63 -7.549 -4.354 -2.097 489 HG LEU 63 HG LEU 63 -7.481 -1.985 -3.903 490 HD11 LEU 63 1HD1 LEU 63 -5.909 -2.979 -1.542 491 HD12 LEU 63 2HD1 LEU 63 -6.935 -1.550 -1.650 492 HD13 LEU 63 3HD1 LEU 63 -5.401 -1.601 -2.518 493 HD21 LEU 63 3HD2 LEU 63 -6.255 -3.161 -5.384 494 HD22 LEU 63 1HD2 LEU 63 -5.877 -4.435 -4.224 495 HD23 LEU 63 2HD2 LEU 63 -4.973 -2.922 -4.196 496 H LYS 64 H LYS 64 -8.806 -6.602 -2.185 497 HA LYS 64 HA LYS 64 -6.395 -7.970 -1.961 498 HB2 LYS 64 1HB LYS 64 -7.565 -8.726 -0.218 499 HB3 LYS 64 2HB LYS 64 -9.098 -8.267 -0.979 500 HG2 LYS 64 1HG LYS 64 -9.370 -10.348 -1.999 501 HG3 LYS 64 2HG LYS 64 -7.662 -10.770 -1.782 502 HD2 LYS 64 1HD LYS 64 -8.204 -11.841 0.094 503 HD3 LYS 64 2HD LYS 64 -8.668 -10.281 0.794 504 HE2 LYS 64 1HE LYS 64 -10.756 -11.057 0.942 505 HE3 LYS 64 2HE LYS 64 -10.818 -10.983 -0.826 506 HZ1 LYS 64 3HZ LYS 64 -9.511 -13.324 -0.283 507 HZ2 LYS 64 1HZ LYS 64 -11.125 -13.166 -0.764 508 HZ3 LYS 64 2HZ LYS 64 -10.737 -13.266 0.879 509 H LEU 65 H LEU 65 -9.174 -8.596 -4.045 510 HA LEU 65 HA LEU 65 -8.234 -11.068 -5.070 511 HB2 LEU 65 1HB LEU 65 -10.118 -9.097 -6.375 512 HB3 LEU 65 2HB LEU 65 -9.943 -10.818 -6.761 513 HG LEU 65 HG LEU 65 -10.954 -9.761 -4.123 514 HD11 LEU 65 1HD1 LEU 65 -12.331 -10.432 -6.670 515 HD12 LEU 65 2HD1 LEU 65 -12.700 -9.189 -5.476 516 HD13 LEU 65 3HD1 LEU 65 -13.111 -10.872 -5.150 517 HD21 LEU 65 3HD2 LEU 65 -11.400 -11.959 -3.533 518 HD22 LEU 65 1HD2 LEU 65 -9.837 -12.082 -4.341 519 HD23 LEU 65 2HD2 LEU 65 -11.311 -12.531 -5.200 520 H GLU 66 H GLU 66 -7.890 -7.715 -6.107 521 HA GLU 66 HA GLU 66 -6.673 -8.271 -8.603 522 HB2 GLU 66 1HB GLU 66 -6.507 -5.818 -6.837 523 HB3 GLU 66 2HB GLU 66 -5.934 -5.900 -8.510 524 HG2 GLU 66 1HG GLU 66 -8.776 -6.156 -7.539 525 HG3 GLU 66 2HG GLU 66 -8.072 -4.841 -8.491 526 H LEU 67 H LEU 67 -5.475 -8.097 -5.344 527 HA LEU 67 HA LEU 67 -2.728 -7.760 -5.952 528 HB2 LEU 67 1HB LEU 67 -4.237 -8.780 -3.562 529 HB3 LEU 67 2HB LEU 67 -2.467 -8.832 -3.621 530 HG LEU 67 HG LEU 67 -4.127 -6.322 -3.849 531 HD11 LEU 67 1HD1 LEU 67 -4.097 -7.584 -1.611 532 HD12 LEU 67 2HD1 LEU 67 -3.678 -5.872 -1.612 533 HD13 LEU 67 3HD1 LEU 67 -2.407 -7.090 -1.519 534 HD21 LEU 67 3HD2 LEU 67 -2.088 -5.969 -4.982 535 HD22 LEU 67 1HD2 LEU 67 -1.167 -6.848 -3.762 536 HD23 LEU 67 2HD2 LEU 67 -1.867 -5.276 -3.375 537 HA PRO 68 HA PRO 68 -1.461 -11.755 -7.261 538 HB2 PRO 68 2HB PRO 68 0.632 -10.860 -7.570 539 HB3 PRO 68 1HB PRO 68 1.063 -11.891 -6.205 540 HG2 PRO 68 1HG PRO 68 0.866 -10.164 -4.662 541 HG3 PRO 68 2HG PRO 68 1.488 -9.275 -6.101 542 HD2 PRO 68 1HD PRO 68 -0.770 -8.539 -4.786 543 HD3 PRO 68 2HD PRO 68 -0.573 -8.340 -6.536 544 H GLU 69 H GLU 69 0.145 -13.599 -6.082 545 HA GLU 69 HA GLU 69 -1.214 -14.254 -3.552 546 HB2 GLU 69 1HB GLU 69 -1.038 -16.668 -4.273 547 HB3 GLU 69 2HB GLU 69 -2.196 -15.681 -5.178 548 HG2 GLU 69 1HG GLU 69 -0.124 -15.340 -6.786 549 HG3 GLU 69 2HG GLU 69 0.372 -16.875 -6.059 550 H ARG 70 H ARG 70 1.702 -14.247 -5.432 551 HA ARG 70 HA ARG 70 3.234 -14.839 -3.018 552 HB2 ARG 70 1HB ARG 70 3.910 -16.187 -5.634 553 HB3 ARG 70 2HB ARG 70 4.595 -16.504 -4.032 554 HG2 ARG 70 1HG ARG 70 1.672 -16.938 -4.497 555 HG3 ARG 70 2HG ARG 70 2.851 -18.140 -5.049 556 HD2 ARG 70 1HD ARG 70 3.691 -17.572 -2.475 557 HD3 ARG 70 2HD ARG 70 1.927 -17.534 -2.356 558 HE ARG 70 HE ARG 70 2.990 -19.833 -3.742 559 HH11 ARG 70 2HH1 ARG 70 2.004 -18.486 -0.686 560 HH12 ARG 70 1HH1 ARG 70 1.727 -20.029 0.052 561 HH21 ARG 70 1HH2 ARG 70 2.085 -21.953 -1.140 562 HH22 ARG 70 2HH2 ARG 70 2.629 -21.870 -2.781 563 H GLN 71 H GLN 71 2.741 -12.401 -4.433 564 HA GLN 71 HA GLN 71 5.502 -11.743 -5.181 565 HB2 GLN 71 1HB GLN 71 2.988 -11.200 -6.725 566 HB3 GLN 71 2HB GLN 71 4.344 -10.066 -6.828 567 HG2 GLN 71 1HG GLN 71 5.442 -11.371 -8.244 568 HG3 GLN 71 2HG GLN 71 5.264 -12.768 -7.174 569 HE21 GLN 71 2HE2 GLN 71 2.858 -12.287 -10.396 570 HE22 GLN 71 1HE2 GLN 71 3.971 -11.066 -9.895 571 HA PRO 72 HA PRO 72 4.526 -8.775 -1.954 572 HB2 PRO 72 2HB PRO 72 6.490 -9.415 -0.949 573 HB3 PRO 72 1HB PRO 72 7.107 -7.914 -1.639 574 HG2 PRO 72 1HG PRO 72 8.037 -8.977 -3.482 575 HG3 PRO 72 2HG PRO 72 8.270 -10.229 -2.205 576 HD2 PRO 72 1HD PRO 72 7.025 -10.753 -4.560 577 HD3 PRO 72 2HD PRO 72 6.566 -11.538 -3.038 578 H ARG 73 H ARG 73 3.909 -6.709 -2.161 579 HA ARG 73 HA ARG 73 5.340 -4.826 -3.787 580 HB2 ARG 73 1HB ARG 73 3.370 -4.277 -5.233 581 HB3 ARG 73 2HB ARG 73 4.124 -5.840 -5.580 582 HG2 ARG 73 1HG ARG 73 2.352 -6.923 -4.173 583 HG3 ARG 73 2HG ARG 73 1.553 -5.342 -4.100 584 HD2 ARG 73 1HD ARG 73 0.583 -6.734 -5.865 585 HD3 ARG 73 2HD ARG 73 1.375 -5.299 -6.532 586 HE ARG 73 HE ARG 73 3.131 -7.545 -6.475 587 HH11 ARG 73 2HH1 ARG 73 0.503 -6.088 -8.233 588 HH12 ARG 73 1HH1 ARG 73 0.930 -6.826 -9.741 589 HH21 ARG 73 1HH2 ARG 73 2.750 -8.212 -9.865 590 HH22 ARG 73 2HH2 ARG 73 3.703 -8.523 -8.455 591 H PHE 74 H PHE 74 4.076 -2.680 -3.860 592 HA PHE 74 HA PHE 74 2.995 -2.238 -1.175 593 HB2 PHE 74 1HB PHE 74 3.922 -0.208 -3.225 594 HB3 PHE 74 2HB PHE 74 3.496 0.121 -1.543 595 HD1 PHE 74 2HD PHE 74 4.816 -2.030 -0.090 596 HD2 PHE 74 1HD PHE 74 6.186 0.272 -3.398 597 HE1 PHE 74 2HE PHE 74 7.143 -2.424 0.603 598 HE2 PHE 74 1HE PHE 74 8.516 -0.119 -2.709 599 HZ PHE 74 HZ PHE 74 8.997 -1.468 -0.706 600 H VAL 75 H VAL 75 1.095 -1.012 -0.838 601 HA VAL 75 HA VAL 75 -0.586 -0.375 -3.117 602 HB VAL 75 HB VAL 75 -1.282 -2.542 -1.150 603 HG11 VAL 75 1HG1 VAL 75 -3.588 -2.436 -2.169 604 HG12 VAL 75 2HG1 VAL 75 -3.181 -1.129 -1.056 605 HG13 VAL 75 3HG1 VAL 75 -3.146 -0.849 -2.797 606 HG21 VAL 75 3HG2 VAL 75 -2.167 -3.306 -3.608 607 HG22 VAL 75 1HG2 VAL 75 -0.747 -2.346 -4.026 608 HG23 VAL 75 2HG2 VAL 75 -0.591 -3.721 -2.933 609 H VAL 76 H VAL 76 -1.604 1.473 -2.720 610 HA VAL 76 HA VAL 76 -1.943 2.308 0.084 611 HB VAL 76 HB VAL 76 -1.717 4.007 -2.404 612 HG11 VAL 76 1HG1 VAL 76 -1.529 5.308 0.210 613 HG12 VAL 76 2HG1 VAL 76 -2.385 5.809 -1.250 614 HG13 VAL 76 3HG1 VAL 76 -3.122 4.643 -0.151 615 HG21 VAL 76 3HG2 VAL 76 0.463 4.296 -1.947 616 HG22 VAL 76 1HG2 VAL 76 0.192 4.354 -0.205 617 HG23 VAL 76 2HG2 VAL 76 0.298 2.799 -1.030 618 H TYR 77 H TYR 77 -3.961 1.525 0.547 619 HA TYR 77 HA TYR 77 -6.167 2.057 -1.274 620 HB2 TYR 77 1HB TYR 77 -5.913 -0.146 -0.099 621 HB3 TYR 77 2HB TYR 77 -6.235 0.690 1.423 622 HD1 TYR 77 1HD TYR 77 -7.887 1.182 -1.877 623 HD2 TYR 77 2HD TYR 77 -8.287 -0.159 2.141 624 HE1 TYR 77 1HE TYR 77 -10.308 0.910 -2.216 625 HE2 TYR 77 2HE TYR 77 -10.709 -0.437 1.813 626 HH TYR 77 HH TYR 77 -12.290 0.589 -1.162 627 H SER 78 H SER 78 -7.695 3.576 -0.988 628 HA SER 78 HA SER 78 -7.481 5.268 1.414 629 HB2 SER 78 1HB SER 78 -6.883 6.373 -0.747 630 HB3 SER 78 2HB SER 78 -8.535 6.064 -1.310 631 HG SER 78 HG SER 78 -9.005 7.207 0.876 632 H TYR 79 H TYR 79 -8.981 4.334 2.734 633 HA TYR 79 HA TYR 79 -11.606 3.632 1.748 634 HB2 TYR 79 1HB TYR 79 -10.585 2.221 3.438 635 HB3 TYR 79 2HB TYR 79 -10.430 3.597 4.534 636 HD1 TYR 79 2HD TYR 79 -12.839 1.282 2.980 637 HD2 TYR 79 1HD TYR 79 -12.278 4.384 5.838 638 HE1 TYR 79 2HE TYR 79 -15.057 0.801 3.926 639 HE2 TYR 79 1HE TYR 79 -14.495 3.910 6.794 640 HH TYR 79 HH TYR 79 -16.677 1.577 5.309 641 H LYS 80 H LYS 80 -13.548 4.399 3.030 642 HA LYS 80 HA LYS 80 -13.298 7.278 3.609 643 HB2 LYS 80 1HB LYS 80 -14.438 6.872 1.467 644 HB3 LYS 80 2HB LYS 80 -15.627 5.859 2.302 645 HG2 LYS 80 1HG LYS 80 -16.221 7.875 3.694 646 HG3 LYS 80 2HG LYS 80 -15.217 8.822 2.583 647 HD2 LYS 80 1HD LYS 80 -17.108 9.073 1.394 648 HD3 LYS 80 2HD LYS 80 -16.781 7.421 0.842 649 HE2 LYS 80 1HE LYS 80 -18.264 7.783 3.409 650 HE3 LYS 80 2HE LYS 80 -19.114 8.100 1.890 651 HZ1 LYS 80 3HZ LYS 80 -17.739 5.568 2.612 652 HZ2 LYS 80 1HZ LYS 80 -18.514 5.871 1.139 653 HZ3 LYS 80 2HZ LYS 80 -19.411 5.816 2.572 654 H TYR 81 H TYR 81 -13.421 7.435 5.763 655 HA TYR 81 HA TYR 81 -15.383 5.791 7.198 656 HB2 TYR 81 1HB TYR 81 -12.758 6.262 7.766 657 HB3 TYR 81 2HB TYR 81 -13.543 7.498 8.751 658 HD1 TYR 81 1HD TYR 81 -15.729 6.547 10.049 659 HD2 TYR 81 2HD TYR 81 -12.350 4.258 8.847 660 HE1 TYR 81 1HE TYR 81 -16.249 4.880 11.782 661 HE2 TYR 81 2HE TYR 81 -12.861 2.585 10.576 662 HH TYR 81 HH TYR 81 -14.755 3.090 13.120 663 H VAL 82 H VAL 82 -17.093 6.654 8.236 664 HA VAL 82 HA VAL 82 -17.558 9.523 7.875 665 HB VAL 82 HB VAL 82 -19.562 7.476 8.816 666 HG11 VAL 82 1HG1 VAL 82 -19.638 10.330 8.025 667 HG12 VAL 82 2HG1 VAL 82 -20.997 9.317 7.531 668 HG13 VAL 82 3HG1 VAL 82 -20.580 9.463 9.238 669 HG21 VAL 82 3HG2 VAL 82 -19.672 8.376 6.017 670 HG22 VAL 82 1HG2 VAL 82 -18.338 7.294 6.413 671 HG23 VAL 82 2HG2 VAL 82 -20.000 6.790 6.714 672 H HIS 83 H HIS 83 -18.591 10.734 9.626 673 HA HIS 83 HA HIS 83 -17.414 10.008 12.206 674 HB2 HIS 83 1HB HIS 83 -18.456 12.605 11.072 675 HB3 HIS 83 2HB HIS 83 -18.053 12.418 12.780 676 HD1 HIS 83 1HD HIS 83 -15.741 13.044 13.375 677 HD2 HIS 83 2HD HIS 83 -16.049 11.890 9.396 678 HE1 HIS 83 1HE HIS 83 -13.450 13.385 12.399 679 HE2 HIS 83 2HE HIS 83 -13.637 12.680 9.966 680 H ASP 84 H ASP 84 -20.115 12.180 11.989 681 HA ASP 84 HA ASP 84 -22.224 10.416 12.499 682 HB2 ASP 84 1HB ASP 84 -20.642 10.254 14.622 683 HB3 ASP 84 2HB ASP 84 -21.491 11.739 15.074 684 H ASP 85 H ASP 85 -20.870 13.571 13.373 685 HA ASP 85 HA ASP 85 -23.376 14.892 13.577 686 HB2 ASP 85 1HB ASP 85 -20.556 15.593 13.763 687 HB3 ASP 85 2HB ASP 85 -21.492 16.841 12.930 688 H GLY 86 H GLY 86 -21.692 13.711 10.927 689 HA2 GLY 86 1HA GLY 86 -23.017 13.846 8.825 690 HA3 GLY 86 2HA GLY 86 -23.110 15.575 9.124 691 H ARG 87 H ARG 87 -20.133 14.106 9.936 692 HA ARG 87 HA ARG 87 -18.937 15.200 7.476 693 HB2 ARG 87 1HB ARG 87 -17.832 14.977 10.281 694 HB3 ARG 87 2HB ARG 87 -16.840 15.389 8.874 695 HG2 ARG 87 1HG ARG 87 -19.298 16.989 9.473 696 HG3 ARG 87 2HG ARG 87 -17.800 17.275 10.377 697 HD2 ARG 87 1HD ARG 87 -16.586 17.684 8.297 698 HD3 ARG 87 2HD ARG 87 -18.056 17.344 7.373 699 HE ARG 87 HE ARG 87 -18.561 19.414 9.219 700 HH11 ARG 87 2HH1 ARG 87 -16.852 18.778 6.253 701 HH12 ARG 87 1HH1 ARG 87 -16.953 20.414 5.691 702 HH21 ARG 87 1HH2 ARG 87 -18.004 22.003 6.966 703 HH22 ARG 87 2HH2 ARG 87 -18.700 21.570 8.491 704 H VAL 88 H VAL 88 -17.444 13.997 6.351 705 HA VAL 88 HA VAL 88 -16.737 11.345 7.364 706 HB VAL 88 HB VAL 88 -18.716 10.919 6.039 707 HG11 VAL 88 1HG1 VAL 88 -18.963 11.568 3.759 708 HG12 VAL 88 2HG1 VAL 88 -18.522 13.013 4.673 709 HG13 VAL 88 3HG1 VAL 88 -17.311 12.183 3.694 710 HG21 VAL 88 3HG2 VAL 88 -17.395 9.693 4.037 711 HG22 VAL 88 1HG2 VAL 88 -16.059 10.009 5.145 712 HG23 VAL 88 2HG2 VAL 88 -17.455 9.078 5.689 713 H SER 89 H SER 89 -14.654 10.922 7.039 714 HA SER 89 HA SER 89 -13.240 12.411 4.925 715 HB2 SER 89 1HB SER 89 -12.124 11.510 7.600 716 HB3 SER 89 2HB SER 89 -11.257 12.425 6.355 717 HG SER 89 HG SER 89 -13.218 13.929 6.685 718 H TYR 90 H TYR 90 -11.274 11.335 4.112 719 HA TYR 90 HA TYR 90 -11.670 8.420 4.000 720 HB2 TYR 90 1HB TYR 90 -10.024 9.866 1.967 721 HB3 TYR 90 2HB TYR 90 -11.020 8.420 1.784 722 HD1 TYR 90 2HD TYR 90 -13.492 8.618 1.593 723 HD2 TYR 90 1HD TYR 90 -10.959 12.037 1.577 724 HE1 TYR 90 2HE TYR 90 -15.322 9.962 0.646 725 HE2 TYR 90 1HE TYR 90 -12.782 13.391 0.631 726 HH TYR 90 HH TYR 90 -15.928 12.516 0.662 727 HA PRO 91 HA PRO 91 -7.759 8.696 6.308 728 HB2 PRO 91 2HB PRO 91 -8.805 7.666 8.075 729 HB3 PRO 91 1HB PRO 91 -8.016 6.220 7.449 730 HG2 PRO 91 1HG PRO 91 -9.906 5.520 6.292 731 HG3 PRO 91 2HG PRO 91 -10.651 6.294 7.742 732 HD2 PRO 91 1HD PRO 91 -11.331 6.977 5.203 733 HD3 PRO 91 2HD PRO 91 -11.310 8.144 6.536 734 H LEU 92 H LEU 92 -6.396 8.597 4.509 735 HA LEU 92 HA LEU 92 -6.118 6.251 2.911 736 HB2 LEU 92 1HB LEU 92 -4.963 8.930 3.040 737 HB3 LEU 92 2HB LEU 92 -3.785 7.686 2.588 738 HG LEU 92 HG LEU 92 -6.068 7.218 1.007 739 HD11 LEU 92 1HD1 LEU 92 -7.049 9.266 1.092 740 HD12 LEU 92 2HD1 LEU 92 -5.857 9.588 -0.167 741 HD13 LEU 92 3HD1 LEU 92 -5.545 10.097 1.493 742 HD21 LEU 92 3HD2 LEU 92 -4.191 6.718 -0.124 743 HD22 LEU 92 1HD2 LEU 92 -3.245 7.966 0.686 744 HD23 LEU 92 2HD2 LEU 92 -4.291 8.392 -0.668 745 H CYS 93 H CYS 93 -5.009 4.465 3.337 746 HA CYS 93 HA CYS 93 -2.882 4.584 5.372 747 HB2 CYS 93 1HB CYS 93 -4.909 2.398 4.874 748 HB3 CYS 93 2HB CYS 93 -3.510 2.222 5.944 749 HG CYS 93 HG CYS 93 -6.116 4.388 6.415 750 H PHE 94 H PHE 94 -1.314 2.743 5.189 751 HA PHE 94 HA PHE 94 -0.748 2.233 2.346 752 HB2 PHE 94 1HB PHE 94 0.920 3.611 3.577 753 HB3 PHE 94 2HB PHE 94 1.187 2.253 4.672 754 HD1 PHE 94 1HD PHE 94 1.361 3.167 1.075 755 HD2 PHE 94 2HD PHE 94 2.776 0.636 4.190 756 HE1 PHE 94 1HE PHE 94 3.061 2.249 -0.448 757 HE2 PHE 94 2HE PHE 94 4.480 -0.286 2.672 758 HZ PHE 94 HZ PHE 94 4.624 0.521 0.350 759 H ILE 95 H ILE 95 -1.523 0.271 1.852 760 HA ILE 95 HA ILE 95 -1.270 -1.921 3.763 761 HB ILE 95 HB ILE 95 -2.671 -1.786 1.091 762 HG12 ILE 95 1HG1 ILE 95 -3.804 -1.999 3.890 763 HG13 ILE 95 2HG1 ILE 95 -3.679 -0.483 2.981 764 HG21 ILE 95 1HG2 ILE 95 -3.698 -3.972 1.974 765 HG22 ILE 95 2HG2 ILE 95 -2.074 -4.027 1.288 766 HG23 ILE 95 3HG2 ILE 95 -2.293 -4.030 3.038 767 HD11 ILE 95 3HD1 ILE 95 -5.033 -1.792 1.172 768 HD12 ILE 95 1HD1 ILE 95 -5.501 -2.791 2.548 769 HD13 ILE 95 2HD1 ILE 95 -5.847 -1.063 2.556 770 H PHE 96 H PHE 96 0.468 -3.166 3.723 771 HA PHE 96 HA PHE 96 2.057 -3.340 1.270 772 HB2 PHE 96 1HB PHE 96 3.191 -2.693 3.380 773 HB3 PHE 96 2HB PHE 96 2.740 -4.251 4.073 774 HD1 PHE 96 1HD PHE 96 3.414 -4.675 0.655 775 HD2 PHE 96 2HD PHE 96 5.336 -4.189 4.421 776 HE1 PHE 96 1HE PHE 96 5.457 -5.697 -0.259 777 HE2 PHE 96 2HE PHE 96 7.382 -5.210 3.514 778 HZ PHE 96 HZ PHE 96 7.444 -5.965 1.170 779 H SER 97 H SER 97 1.420 -4.930 -0.038 780 HA SER 97 HA SER 97 0.216 -7.346 0.962 781 HB2 SER 97 1HB SER 97 -0.472 -6.246 -1.183 782 HB3 SER 97 2HB SER 97 1.095 -6.717 -1.865 783 HG SER 97 HG SER 97 0.461 -8.741 -1.988 784 H SER 98 H SER 98 1.764 -8.403 2.181 785 HA SER 98 HA SER 98 3.992 -9.549 0.637 786 HB2 SER 98 1HB SER 98 5.490 -9.343 2.474 787 HB3 SER 98 2HB SER 98 4.689 -7.769 2.320 788 HG SER 98 HG SER 98 3.892 -8.024 4.240 789 HA PRO 99 HA PRO 99 1.553 -13.090 2.119 790 HB2 PRO 99 2HB PRO 99 1.109 -13.613 -0.074 791 HB3 PRO 99 1HB PRO 99 2.414 -14.777 0.141 792 HG2 PRO 99 1HG PRO 99 4.006 -13.381 -0.813 793 HG3 PRO 99 2HG PRO 99 2.545 -12.953 -1.780 794 HD2 PRO 99 1HD PRO 99 4.040 -11.095 -0.484 795 HD3 PRO 99 2HD PRO 99 2.286 -10.944 -0.679 796 H VAL 100 H VAL 100 2.488 -15.574 2.037 797 HA VAL 100 HA VAL 100 5.002 -15.429 3.560 798 HB VAL 100 HB VAL 100 2.945 -16.307 4.722 799 HG11 VAL 100 1HG1 VAL 100 3.346 -18.607 2.813 800 HG12 VAL 100 2HG1 VAL 100 2.281 -18.626 4.220 801 HG13 VAL 100 3HG1 VAL 100 1.954 -17.527 2.879 802 HG21 VAL 100 3HG2 VAL 100 5.490 -17.853 4.466 803 HG22 VAL 100 1HG2 VAL 100 4.913 -16.856 5.802 804 HG23 VAL 100 2HG2 VAL 100 4.201 -18.443 5.514 805 H GLY 101 H GLY 101 3.486 -16.777 0.764 806 HA2 GLY 101 1HA GLY 101 5.463 -18.851 0.375 807 HA3 GLY 101 2HA GLY 101 4.179 -18.408 -0.739 808 H CYS 102 H CYS 102 5.464 -15.543 -0.091 809 HA CYS 102 HA CYS 102 6.727 -15.251 -2.576 810 HB2 CYS 102 1HB CYS 102 7.692 -13.126 -1.438 811 HB3 CYS 102 2HB CYS 102 5.943 -13.251 -1.691 812 HG CYS 102 HG CYS 102 5.399 -12.640 0.735 813 H LYS 103 H LYS 103 9.046 -14.261 -2.675 814 HA LYS 103 HA LYS 103 10.827 -16.206 -1.385 815 HB2 LYS 103 1HB LYS 103 11.642 -14.397 -3.642 816 HB3 LYS 103 2HB LYS 103 12.283 -15.987 -3.198 817 HG2 LYS 103 1HG LYS 103 10.943 -16.978 -4.654 818 HG3 LYS 103 2HG LYS 103 9.527 -16.272 -3.854 819 HD2 LYS 103 1HD LYS 103 9.564 -15.639 -6.204 820 HD3 LYS 103 2HD LYS 103 9.813 -14.217 -5.174 821 HE2 LYS 103 1HE LYS 103 11.581 -13.783 -6.487 822 HE3 LYS 103 2HE LYS 103 12.376 -15.084 -5.590 823 HZ1 LYS 103 3HZ LYS 103 10.819 -16.199 -7.655 824 HZ2 LYS 103 1HZ LYS 103 12.494 -16.277 -7.433 825 HZ3 LYS 103 2HZ LYS 103 11.816 -14.999 -8.309 826 HA PRO 104 HA PRO 104 12.718 -13.143 1.134 827 HB2 PRO 104 2HB PRO 104 13.820 -14.870 2.174 828 HB3 PRO 104 1HB PRO 104 15.236 -14.192 1.375 829 HG2 PRO 104 1HG PRO 104 15.135 -15.699 -0.391 830 HG3 PRO 104 2HG PRO 104 14.550 -16.723 0.973 831 HD2 PRO 104 1HD PRO 104 13.147 -16.410 -1.330 832 HD3 PRO 104 2HD PRO 104 12.365 -16.615 0.246 833 H GLU 105 H GLU 105 13.917 -13.871 -2.019 834 HA GLU 105 HA GLU 105 15.979 -11.888 -2.077 835 HB2 GLU 105 1HB GLU 105 14.891 -13.902 -3.864 836 HB3 GLU 105 2HB GLU 105 15.208 -12.381 -4.714 837 HG2 GLU 105 1HG GLU 105 17.521 -12.445 -3.626 838 HG3 GLU 105 2HG GLU 105 17.143 -14.131 -3.241 839 H GLN 106 H GLN 106 12.581 -12.003 -2.958 840 HA GLN 106 HA GLN 106 12.668 -9.313 -4.062 841 HB2 GLN 106 1HB GLN 106 10.142 -10.868 -3.608 842 HB3 GLN 106 2HB GLN 106 10.519 -9.692 -4.876 843 HG2 GLN 106 1HG GLN 106 11.893 -12.362 -4.710 844 HG3 GLN 106 2HG GLN 106 10.361 -12.129 -5.562 845 HE21 GLN 106 2HE2 GLN 106 11.951 -9.805 -7.919 846 HE22 GLN 106 1HE2 GLN 106 10.650 -9.756 -6.784 847 H GLN 107 H GLN 107 10.773 -10.971 -1.533 848 HA GLN 107 HA GLN 107 9.423 -8.999 -0.351 849 HB2 GLN 107 1HB GLN 107 10.421 -11.501 0.480 850 HB3 GLN 107 2HB GLN 107 10.828 -10.353 1.764 851 HG2 GLN 107 1HG GLN 107 8.092 -10.060 0.783 852 HG3 GLN 107 2HG GLN 107 8.436 -11.650 1.476 853 HE21 GLN 107 2HE2 GLN 107 8.057 -8.400 3.829 854 HE22 GLN 107 1HE2 GLN 107 7.938 -8.324 2.108 855 H MET 108 H MET 108 12.907 -9.497 0.022 856 HA MET 108 HA MET 108 13.350 -7.454 1.907 857 HB2 MET 108 1HB MET 108 15.098 -8.873 -0.085 858 HB3 MET 108 2HB MET 108 15.732 -7.529 0.877 859 HG2 MET 108 1HG MET 108 14.771 -8.887 2.897 860 HG3 MET 108 2HG MET 108 14.858 -10.236 1.760 861 HE1 MET 108 3HE MET 108 16.928 -10.423 0.180 862 HE2 MET 108 1HE MET 108 17.840 -8.914 0.179 863 HE3 MET 108 2HE MET 108 18.577 -10.389 0.806 864 H MET 109 H MET 109 13.543 -7.463 -1.638 865 HA MET 109 HA MET 109 14.503 -4.938 -2.112 866 HB2 MET 109 1HB MET 109 12.494 -6.631 -3.575 867 HB3 MET 109 2HB MET 109 12.921 -5.020 -4.169 868 HG2 MET 109 1HG MET 109 15.194 -5.629 -4.496 869 HG3 MET 109 2HG MET 109 14.968 -7.145 -3.621 870 HE1 MET 109 3HE MET 109 14.102 -5.198 -6.990 871 HE2 MET 109 1HE MET 109 12.930 -6.324 -7.676 872 HE3 MET 109 2HE MET 109 12.566 -5.483 -6.169 873 H TYR 110 H TYR 110 11.273 -5.878 -1.115 874 HA TYR 110 HA TYR 110 10.316 -3.131 -1.321 875 HB2 TYR 110 1HB TYR 110 8.803 -5.544 -0.302 876 HB3 TYR 110 2HB TYR 110 8.132 -4.008 -0.856 877 HD1 TYR 110 2HD TYR 110 9.854 -7.076 -2.003 878 HD2 TYR 110 1HD TYR 110 7.675 -3.604 -3.146 879 HE1 TYR 110 2HE TYR 110 9.626 -7.975 -4.281 880 HE2 TYR 110 1HE TYR 110 7.440 -4.494 -5.426 881 HH TYR 110 HH TYR 110 8.696 -6.138 -6.899 882 H ALA 111 H ALA 111 11.128 -5.549 1.096 883 HA ALA 111 HA ALA 111 10.117 -4.257 3.366 884 HB1 ALA 111 3HB ALA 111 12.582 -5.658 3.921 885 HB2 ALA 111 1HB ALA 111 10.931 -6.041 4.412 886 HB3 ALA 111 2HB ALA 111 11.537 -6.589 2.849 887 H GLY 112 H GLY 112 13.045 -3.746 1.523 888 HA2 GLY 112 1HA GLY 112 14.131 -1.940 3.541 889 HA3 GLY 112 2HA GLY 112 14.923 -2.433 2.052 890 H SER 113 H SER 113 12.524 -1.814 0.443 891 HA SER 113 HA SER 113 13.029 1.048 0.191 892 HB2 SER 113 1HB SER 113 11.333 -0.637 -1.661 893 HB3 SER 113 2HB SER 113 12.172 0.883 -2.013 894 HG SER 113 HG SER 113 13.704 -1.304 -1.188 895 H LYS 114 H LYS 114 10.780 -0.975 1.627 896 HA LYS 114 HA LYS 114 8.306 0.125 1.164 897 HB2 LYS 114 1HB LYS 114 8.512 -1.807 2.557 898 HB3 LYS 114 2HB LYS 114 9.498 -0.922 3.733 899 HG2 LYS 114 1HG LYS 114 7.636 0.384 4.449 900 HG3 LYS 114 2HG LYS 114 6.632 -0.238 3.127 901 HD2 LYS 114 1HD LYS 114 5.879 -1.635 4.748 902 HD3 LYS 114 2HD LYS 114 7.315 -2.561 4.279 903 HE2 LYS 114 1HE LYS 114 8.589 -1.695 6.102 904 HE3 LYS 114 2HE LYS 114 7.343 -0.492 6.465 905 HZ1 LYS 114 3HZ LYS 114 7.415 -3.336 7.108 906 HZ2 LYS 114 1HZ LYS 114 5.903 -2.676 6.730 907 HZ3 LYS 114 2HZ LYS 114 6.809 -2.038 8.008 908 H ASN 115 H ASN 115 10.472 1.098 3.833 909 HA ASN 115 HA ASN 115 9.017 3.317 4.660 910 HB2 ASN 115 1HB ASN 115 11.810 2.367 4.973 911 HB3 ASN 115 2HB ASN 115 11.538 4.089 5.269 912 HD21 ASN 115 2HD2 ASN 115 9.782 1.325 7.723 913 HD22 ASN 115 1HD2 ASN 115 10.199 0.917 6.097 914 H ARG 116 H ARG 116 11.486 3.026 2.158 915 HA ARG 116 HA ARG 116 11.843 5.752 1.619 916 HB2 ARG 116 1HB ARG 116 13.421 4.241 0.709 917 HB3 ARG 116 2HB ARG 116 12.158 3.287 -0.082 918 HG2 ARG 116 1HG ARG 116 13.151 4.465 -1.830 919 HG3 ARG 116 2HG ARG 116 11.682 5.384 -1.462 920 HD2 ARG 116 1HD ARG 116 13.065 7.163 -1.414 921 HD3 ARG 116 2HD ARG 116 13.458 6.573 0.207 922 HE ARG 116 HE ARG 116 15.148 5.253 -1.551 923 HH11 ARG 116 2HH1 ARG 116 14.518 8.523 -0.536 924 HH12 ARG 116 1HH1 ARG 116 16.142 9.060 -0.810 925 HH21 ARG 116 1HH2 ARG 116 17.717 7.594 -1.595 926 HH22 ARG 116 2HH2 ARG 116 17.289 5.948 -1.916 927 H LEU 117 H LEU 117 9.625 3.389 0.161 928 HA LEU 117 HA LEU 117 8.425 5.243 -1.624 929 HB2 LEU 117 1HB LEU 117 8.383 2.828 -2.007 930 HB3 LEU 117 2HB LEU 117 7.388 2.620 -0.556 931 HG LEU 117 HG LEU 117 6.139 2.460 -2.710 932 HD11 LEU 117 1HD1 LEU 117 5.057 4.836 -1.298 933 HD12 LEU 117 2HD1 LEU 117 5.295 3.355 -0.371 934 HD13 LEU 117 3HD1 LEU 117 4.253 3.346 -1.794 935 HD21 LEU 117 3HD2 LEU 117 6.557 5.436 -2.881 936 HD22 LEU 117 1HD2 LEU 117 5.725 4.389 -4.032 937 HD23 LEU 117 2HD2 LEU 117 7.474 4.269 -3.834 938 H VAL 118 H VAL 118 7.321 3.836 1.456 939 HA VAL 118 HA VAL 118 4.904 5.197 1.664 940 HB VAL 118 HB VAL 118 6.759 4.291 3.868 941 HG11 VAL 118 1HG1 VAL 118 5.409 5.266 5.334 942 HG12 VAL 118 2HG1 VAL 118 4.432 5.919 4.017 943 HG13 VAL 118 3HG1 VAL 118 4.050 4.337 4.700 944 HG21 VAL 118 3HG2 VAL 118 6.149 2.290 3.042 945 HG22 VAL 118 1HG2 VAL 118 4.630 2.608 3.877 946 HG23 VAL 118 2HG2 VAL 118 4.779 2.958 2.155 947 H GLN 119 H GLN 119 8.050 6.089 3.086 948 HA GLN 119 HA GLN 119 7.349 8.456 4.294 949 HB2 GLN 119 1HB GLN 119 9.880 7.499 3.000 950 HB3 GLN 119 2HB GLN 119 9.778 9.155 3.621 951 HG2 GLN 119 1HG GLN 119 8.885 7.922 5.784 952 HG3 GLN 119 2HG GLN 119 9.801 6.578 5.090 953 HE21 GLN 119 2HE2 GLN 119 12.525 7.820 6.860 954 HE22 GLN 119 1HE2 GLN 119 11.343 6.571 6.691 955 H THR 120 H THR 120 8.086 7.872 0.897 956 HA THR 120 HA THR 120 8.174 10.546 0.045 957 HB THR 120 HB THR 120 7.186 8.233 -1.625 958 HG1 THR 120 1HG THR 120 9.165 7.476 -1.638 959 HG21 THR 120 3HG2 THR 120 7.255 9.682 -3.315 960 HG22 THR 120 1HG2 THR 120 8.939 10.061 -2.956 961 HG23 THR 120 2HG2 THR 120 7.645 10.967 -2.173 962 H ALA 121 H ALA 121 5.482 8.250 0.265 963 HA ALA 121 HA ALA 121 3.551 10.045 -0.829 964 HB1 ALA 121 3HB ALA 121 2.784 7.769 0.941 965 HB2 ALA 121 1HB ALA 121 2.008 8.364 -0.527 966 HB3 ALA 121 2HB ALA 121 3.510 7.443 -0.634 967 H GLU 122 H GLU 122 4.859 9.491 2.333 968 HA GLU 122 HA GLU 122 4.671 10.766 4.229 969 HB2 GLU 122 1HB GLU 122 3.634 12.458 2.283 970 HB3 GLU 122 2HB GLU 122 2.357 12.378 3.507 971 HG2 GLU 122 1HG GLU 122 4.740 12.700 4.942 972 HG3 GLU 122 2HG GLU 122 4.852 13.800 3.559 973 H LEU 123 H LEU 123 3.371 8.304 3.873 974 HA LEU 123 HA LEU 123 0.733 8.601 5.080 975 HB2 LEU 123 1HB LEU 123 2.222 6.114 4.222 976 HB3 LEU 123 2HB LEU 123 0.536 6.190 4.762 977 HG LEU 123 HG LEU 123 1.385 7.770 2.371 978 HD11 LEU 123 1HD1 LEU 123 1.932 5.099 2.467 979 HD12 LEU 123 2HD1 LEU 123 1.593 6.015 0.999 980 HD13 LEU 123 3HD1 LEU 123 0.302 5.115 1.795 981 HD21 LEU 123 3HD2 LEU 123 -0.834 8.142 3.255 982 HD22 LEU 123 1HD2 LEU 123 -1.172 6.412 3.216 983 HD23 LEU 123 2HD2 LEU 123 -0.944 7.301 1.709 984 H THR 124 H THR 124 0.769 8.959 7.207 985 HA THR 124 HA THR 124 2.848 8.036 8.928 986 HB THR 124 HB THR 124 1.702 10.073 9.508 987 HG1 THR 124 1HG THR 124 2.268 9.224 11.402 988 HG21 THR 124 3HG2 THR 124 -0.694 8.417 9.081 989 HG22 THR 124 1HG2 THR 124 -0.455 10.148 8.843 990 HG23 THR 124 2HG2 THR 124 -0.775 9.516 10.458 991 H LYS 125 H LYS 125 0.076 6.571 7.655 992 HA LYS 125 HA LYS 125 0.011 4.576 9.819 993 HB2 LYS 125 1HB LYS 125 -2.045 4.914 7.633 994 HB3 LYS 125 2HB LYS 125 -2.205 4.017 9.152 995 HG2 LYS 125 1HG LYS 125 -1.964 6.218 10.359 996 HG3 LYS 125 2HG LYS 125 -2.122 6.998 8.776 997 HD2 LYS 125 1HD LYS 125 -4.195 5.004 9.203 998 HD3 LYS 125 2HD LYS 125 -4.194 6.249 10.466 999 HE2 LYS 125 1HE LYS 125 -3.970 7.095 7.604 1000 HE3 LYS 125 2HE LYS 125 -5.542 6.585 8.233 1001 HZ1 LYS 125 3HZ LYS 125 -4.643 8.272 10.149 1002 HZ2 LYS 125 1HZ LYS 125 -5.725 8.684 8.915 1003 HZ3 LYS 125 2HZ LYS 125 -4.074 9.003 8.733 1004 H VAL 126 H VAL 126 1.098 2.773 9.429 1005 HA VAL 126 HA VAL 126 1.162 1.733 6.673 1006 HB VAL 126 HB VAL 126 3.448 1.369 8.595 1007 HG11 VAL 126 1HG1 VAL 126 4.390 0.189 6.957 1008 HG12 VAL 126 2HG1 VAL 126 2.820 0.214 6.151 1009 HG13 VAL 126 3HG1 VAL 126 4.033 1.434 5.761 1010 HG21 VAL 126 3HG2 VAL 126 4.608 3.182 7.362 1011 HG22 VAL 126 1HG2 VAL 126 3.085 3.564 6.560 1012 HG23 VAL 126 2HG2 VAL 126 3.233 3.752 8.307 1013 H PHE 127 H PHE 127 0.038 -0.091 6.619 1014 HA PHE 127 HA PHE 127 0.126 -1.875 8.960 1015 HB2 PHE 127 1HB PHE 127 -1.976 -1.717 6.782 1016 HB3 PHE 127 2HB PHE 127 -2.024 -2.770 8.196 1017 HD1 PHE 127 2HD PHE 127 -0.956 -0.732 10.198 1018 HD2 PHE 127 1HD PHE 127 -3.983 -0.518 7.214 1019 HE1 PHE 127 2HE PHE 127 -2.103 1.017 11.493 1020 HE2 PHE 127 1HE PHE 127 -5.135 1.232 8.504 1021 HZ PHE 127 HZ PHE 127 -4.196 2.001 10.646 1022 H GLU 128 H GLU 128 0.297 -4.135 8.620 1023 HA GLU 128 HA GLU 128 1.412 -4.873 5.993 1024 HB2 GLU 128 1HB GLU 128 3.082 -4.726 7.879 1025 HB3 GLU 128 2HB GLU 128 2.224 -6.073 8.641 1026 HG2 GLU 128 1HG GLU 128 2.620 -7.281 6.372 1027 HG3 GLU 128 2HG GLU 128 3.877 -6.055 6.159 1028 H ILE 129 H ILE 129 0.615 -6.650 5.023 1029 HA ILE 129 HA ILE 129 -1.347 -8.249 6.536 1030 HB ILE 129 HB ILE 129 -2.291 -8.751 4.197 1031 HG12 ILE 129 1HG1 ILE 129 -0.975 -6.108 3.556 1032 HG13 ILE 129 2HG1 ILE 129 -0.275 -7.664 3.074 1033 HG21 ILE 129 1HG2 ILE 129 -2.886 -6.849 6.119 1034 HG22 ILE 129 2HG2 ILE 129 -2.921 -5.953 4.601 1035 HG23 ILE 129 3HG2 ILE 129 -3.937 -7.379 4.805 1036 HD11 ILE 129 3HD1 ILE 129 -1.670 -6.432 1.346 1037 HD12 ILE 129 1HD1 ILE 129 -2.028 -8.139 1.607 1038 HD13 ILE 129 2HD1 ILE 129 -3.069 -6.902 2.311 1039 H ARG 130 H ARG 130 -0.937 -10.349 6.745 1040 HA ARG 130 HA ARG 130 1.423 -11.496 5.612 1041 HB2 ARG 130 1HB ARG 130 0.570 -12.063 7.873 1042 HB3 ARG 130 2HB ARG 130 -0.818 -12.857 7.115 1043 HG2 ARG 130 1HG ARG 130 0.715 -14.566 7.697 1044 HG3 ARG 130 2HG ARG 130 0.802 -14.367 5.938 1045 HD2 ARG 130 1HD ARG 130 3.043 -14.458 6.485 1046 HD3 ARG 130 2HD ARG 130 2.740 -12.715 6.496 1047 HE ARG 130 HE ARG 130 2.295 -13.376 9.060 1048 HH11 ARG 130 2HH1 ARG 130 4.906 -14.101 6.876 1049 HH12 ARG 130 1HH1 ARG 130 6.103 -14.181 8.126 1050 HH21 ARG 130 1HH2 ARG 130 5.507 -13.828 10.309 1051 HH22 ARG 130 2HH2 ARG 130 3.861 -13.478 10.715 1052 H THR 131 H THR 131 -1.800 -11.204 4.575 1053 HA THR 131 HA THR 131 -1.291 -12.533 2.122 1054 HB THR 131 HB THR 131 -1.612 -14.557 3.450 1055 HG1 THR 131 1HG THR 131 -3.462 -13.789 1.496 1056 HG21 THR 131 3HG2 THR 131 -3.175 -13.272 5.095 1057 HG22 THR 131 1HG2 THR 131 -3.442 -14.989 4.802 1058 HG23 THR 131 2HG2 THR 131 -4.452 -13.788 3.996 1059 H THR 132 H THR 132 -2.823 -12.056 0.573 1060 HA THR 132 HA THR 132 -4.264 -9.779 0.658 1061 HB THR 132 HB THR 132 -5.714 -10.673 -1.144 1062 HG1 THR 132 1HG THR 132 -4.369 -13.127 -0.587 1063 HG21 THR 132 3HG2 THR 132 -3.024 -11.756 -1.788 1064 HG22 THR 132 1HG2 THR 132 -3.129 -10.061 -1.313 1065 HG23 THR 132 2HG2 THR 132 -4.046 -10.647 -2.702 1066 H ASP 133 H ASP 133 -5.546 -12.992 1.486 1067 HA ASP 133 HA ASP 133 -8.154 -12.553 1.955 1068 HB2 ASP 133 1HB ASP 133 -6.139 -14.315 3.084 1069 HB3 ASP 133 2HB ASP 133 -7.385 -13.912 4.274 1070 H ASP 134 H ASP 134 -5.573 -11.704 4.248 1071 HA ASP 134 HA ASP 134 -7.027 -10.719 6.341 1072 HB2 ASP 134 1HB ASP 134 -4.345 -10.532 5.440 1073 HB3 ASP 134 2HB ASP 134 -4.870 -8.891 5.839 1074 H LEU 135 H LEU 135 -6.091 -8.937 3.411 1075 HA LEU 135 HA LEU 135 -7.200 -6.471 4.071 1076 HB2 LEU 135 1HB LEU 135 -5.774 -6.574 2.197 1077 HB3 LEU 135 2HB LEU 135 -6.746 -7.847 1.441 1078 HG LEU 135 HG LEU 135 -8.360 -6.349 0.693 1079 HD11 LEU 135 1HD1 LEU 135 -8.313 -3.918 1.498 1080 HD12 LEU 135 2HD1 LEU 135 -7.325 -4.518 2.830 1081 HD13 LEU 135 3HD1 LEU 135 -8.960 -5.139 2.595 1082 HD21 LEU 135 3HD2 LEU 135 -6.904 -4.284 -0.083 1083 HD22 LEU 135 1HD2 LEU 135 -6.665 -5.894 -0.765 1084 HD23 LEU 135 2HD2 LEU 135 -5.586 -5.302 0.499 1085 H THR 136 H THR 136 -9.174 -6.925 5.155 1086 HA THR 136 HA THR 136 -11.406 -7.469 3.312 1087 HB THR 136 HB THR 136 -12.544 -8.272 5.569 1088 HG1 THR 136 1HG THR 136 -11.165 -8.706 7.109 1089 HG21 THR 136 3HG2 THR 136 -10.628 -10.098 4.125 1090 HG22 THR 136 1HG2 THR 136 -12.164 -9.564 3.439 1091 HG23 THR 136 2HG2 THR 136 -12.144 -10.530 4.916 1092 H GLU 137 H GLU 137 -13.376 -6.380 3.760 1093 HA GLU 137 HA GLU 137 -13.267 -3.723 4.297 1094 HB2 GLU 137 1HB GLU 137 -15.244 -4.749 3.353 1095 HB3 GLU 137 2HB GLU 137 -15.560 -5.605 4.871 1096 HG2 GLU 137 1HG GLU 137 -15.474 -3.002 5.704 1097 HG3 GLU 137 2HG GLU 137 -16.193 -2.863 4.093 1098 H THR 138 H THR 138 -13.570 -6.324 6.637 1099 HA THR 138 HA THR 138 -13.987 -4.548 8.867 1100 HB THR 138 HB THR 138 -13.183 -7.454 9.004 1101 HG1 THR 138 1HG THR 138 -15.630 -7.593 9.269 1102 HG21 THR 138 3HG2 THR 138 -14.730 -7.183 11.091 1103 HG22 THR 138 1HG2 THR 138 -14.363 -5.469 10.905 1104 HG23 THR 138 2HG2 THR 138 -13.058 -6.627 11.162 1105 H TRP 139 H TRP 139 -11.372 -6.837 8.044 1106 HA TRP 139 HA TRP 139 -9.539 -6.106 9.951 1107 HB2 TRP 139 1HB TRP 139 -8.935 -7.966 8.687 1108 HB3 TRP 139 2HB TRP 139 -9.249 -7.148 7.156 1109 HD1 TRP 139 HD TRP 139 -6.471 -7.923 9.537 1110 HE1 TRP 139 1HE TRP 139 -4.283 -6.855 8.706 1111 HE3 TRP 139 3HE TRP 139 -8.379 -4.910 5.873 1112 HZ2 TRP 139 2HZ TRP 139 -3.471 -4.983 6.756 1113 HZ3 TRP 139 3HZ TRP 139 -6.829 -3.512 4.571 1114 HH2 TRP 139 HH TRP 139 -4.425 -3.548 5.005 1115 H LEU 140 H LEU 140 -10.604 -4.280 7.245 1116 HA LEU 140 HA LEU 140 -8.320 -2.483 7.295 1117 HB2 LEU 140 1HB LEU 140 -9.087 -2.817 5.124 1118 HB3 LEU 140 2HB LEU 140 -10.786 -2.725 5.619 1119 HG LEU 140 HG LEU 140 -9.661 -0.784 4.254 1120 HD11 LEU 140 1HD1 LEU 140 -11.964 -1.045 5.599 1121 HD12 LEU 140 2HD1 LEU 140 -11.483 0.440 4.779 1122 HD13 LEU 140 3HD1 LEU 140 -11.233 0.272 6.517 1123 HD21 LEU 140 3HD2 LEU 140 -9.227 0.495 6.870 1124 HD22 LEU 140 1HD2 LEU 140 -8.364 0.697 5.345 1125 HD23 LEU 140 2HD2 LEU 140 -8.007 -0.683 6.384 1126 H LYS 141 H LYS 141 -11.851 -2.134 7.677 1127 HA LYS 141 HA LYS 141 -11.782 0.482 8.684 1128 HB2 LYS 141 1HB LYS 141 -13.761 -1.721 8.564 1129 HB3 LYS 141 2HB LYS 141 -14.045 -0.489 9.803 1130 HG2 LYS 141 1HG LYS 141 -14.489 1.157 8.290 1131 HG3 LYS 141 2HG LYS 141 -13.439 0.443 7.053 1132 HD2 LYS 141 1HD LYS 141 -15.383 -0.170 6.086 1133 HD3 LYS 141 2HD LYS 141 -15.335 -1.482 7.276 1134 HE2 LYS 141 1HE LYS 141 -16.548 1.119 8.098 1135 HE3 LYS 141 2HE LYS 141 -17.460 0.068 7.004 1136 HZ1 LYS 141 3HZ LYS 141 -18.060 -0.446 9.243 1137 HZ2 LYS 141 1HZ LYS 141 -16.443 -0.641 9.701 1138 HZ3 LYS 141 2HZ LYS 141 -17.161 -1.744 8.638 1139 H GLU 142 H GLU 142 -11.047 -2.531 10.163 1140 HA GLU 142 HA GLU 142 -11.551 -1.796 12.866 1141 HB2 GLU 142 1HB GLU 142 -10.071 -3.994 11.482 1142 HB3 GLU 142 2HB GLU 142 -9.767 -3.721 13.205 1143 HG2 GLU 142 1HG GLU 142 -12.471 -3.711 13.183 1144 HG3 GLU 142 2HG GLU 142 -12.129 -4.829 11.855 1145 H LYS 143 H LYS 143 -8.640 -1.806 10.838 1146 HA LYS 143 HA LYS 143 -6.840 -0.940 12.818 1147 HB2 LYS 143 1HB LYS 143 -6.725 -0.474 9.827 1148 HB3 LYS 143 2HB LYS 143 -5.365 -0.338 10.954 1149 HG2 LYS 143 1HG LYS 143 -6.725 -2.924 11.082 1150 HG3 LYS 143 2HG LYS 143 -6.008 -2.561 9.502 1151 HD2 LYS 143 1HD LYS 143 -3.983 -1.786 11.108 1152 HD3 LYS 143 2HD LYS 143 -4.705 -3.059 12.106 1153 HE2 LYS 143 1HE LYS 143 -4.463 -4.683 10.345 1154 HE3 LYS 143 2HE LYS 143 -3.945 -3.424 9.213 1155 HZ1 LYS 143 3HZ LYS 143 -2.290 -4.975 10.677 1156 HZ2 LYS 143 1HZ LYS 143 -2.339 -3.555 11.595 1157 HZ3 LYS 143 2HZ LYS 143 -1.864 -3.497 9.973 1158 H LEU 144 H LEU 144 -8.936 0.822 10.603 1159 HA LEU 144 HA LEU 144 -7.875 3.397 11.210 1160 HB2 LEU 144 1HB LEU 144 -10.649 2.832 10.178 1161 HB3 LEU 144 2HB LEU 144 -9.650 4.274 9.924 1162 HG LEU 144 HG LEU 144 -8.941 1.574 8.795 1163 HD11 LEU 144 1HD1 LEU 144 -11.103 2.207 7.905 1164 HD12 LEU 144 2HD1 LEU 144 -9.859 2.392 6.670 1165 HD13 LEU 144 3HD1 LEU 144 -10.492 3.812 7.501 1166 HD21 LEU 144 3HD2 LEU 144 -7.943 4.377 8.437 1167 HD22 LEU 144 1HD2 LEU 144 -7.724 3.164 7.175 1168 HD23 LEU 144 2HD2 LEU 144 -7.032 2.905 8.777 1169 H ALA 145 H ALA 145 -10.915 1.780 12.139 1170 HA ALA 145 HA ALA 145 -12.071 3.603 13.762 1171 HB1 ALA 145 3HB ALA 145 -13.393 1.811 13.898 1172 HB2 ALA 145 1HB ALA 145 -12.051 0.698 13.637 1173 HB3 ALA 145 2HB ALA 145 -12.385 1.311 15.256 1174 H SER 146 H SER 146 -10.234 1.033 15.372 1175 HA SER 146 HA SER 146 -8.592 2.920 16.811 1176 HB2 SER 146 1HB SER 146 -10.844 2.894 18.003 1177 HB3 SER 146 2HB SER 146 -10.487 1.212 18.428 1178 HG SER 146 HG SER 146 -8.831 3.431 19.058 1179 H GLY 147 H GLY 147 -8.164 0.667 15.054 1180 HA2 GLY 147 1HA GLY 147 -7.591 -1.770 15.992 1181 HA3 GLY 147 2HA GLY 147 -6.453 -0.907 14.967 1182 HA PRO 148 HA PRO 148 -4.951 -1.568 19.496 1183 HB2 PRO 148 2HB PRO 148 -5.434 -3.792 19.810 1184 HB3 PRO 148 1HB PRO 148 -3.758 -4.027 19.315 1185 HG2 PRO 148 1HG PRO 148 -4.327 -4.507 17.115 1186 HG3 PRO 148 2HG PRO 148 -5.726 -5.223 17.999 1187 HD2 PRO 148 1HD PRO 148 -6.030 -3.427 15.987 1188 HD3 PRO 148 2HD PRO 148 -7.127 -3.502 17.376 1189 H SER 149 H SER 149 -3.258 -0.221 19.473 1190 HA SER 149 HA SER 149 -1.153 -0.534 17.485 1191 HB2 SER 149 1HB SER 149 -2.281 1.702 18.352 1192 HB3 SER 149 2HB SER 149 -1.050 1.559 19.619 1193 HG SER 149 HG SER 149 0.517 1.399 17.903 1194 H SER 150 H SER 150 1.105 -0.542 18.102 1195 HA SER 150 HA SER 150 1.555 -2.278 20.389 1196 HB2 SER 150 1HB SER 150 2.561 -2.520 17.981 1197 HB3 SER 150 2HB SER 150 3.736 -1.325 18.559 1198 HG SER 150 HG SER 150 3.208 -3.896 19.625 1199 H GLY 151 H GLY 151 0.918 -0.305 21.750 1200 HA2 GLY 151 1HA GLY 151 1.665 1.086 23.432 1201 HA3 GLY 151 2HA GLY 151 3.311 0.724 22.935 Start of MODEL 5 1 H1 GLY 1 H GLY 1 23.833 -2.906 0.408 2 HA2 GLY 1 1HA GLY 1 25.875 -0.931 0.179 3 HA3 GLY 1 2HA GLY 1 25.348 -1.099 1.847 4 H SER 2 H SER 2 27.789 -1.909 0.033 5 HA SER 2 HA SER 2 28.173 -4.598 -0.087 6 HB2 SER 2 1HB SER 2 29.795 -2.412 -0.373 7 HB3 SER 2 2HB SER 2 30.487 -3.183 1.065 8 HG SER 2 HG SER 2 29.879 -4.786 -1.148 9 H SER 3 H SER 3 29.007 -2.602 2.751 10 HA SER 3 HA SER 3 29.039 -3.077 4.979 11 HB2 SER 3 1HB SER 3 26.780 -4.184 4.305 12 HB3 SER 3 2HB SER 3 27.672 -5.707 4.472 13 HG SER 3 HG SER 3 28.260 -4.909 6.626 14 H GLY 4 H GLY 4 30.965 -3.532 5.801 15 HA2 GLY 4 1HA GLY 4 32.462 -5.836 4.823 16 HA3 GLY 4 2HA GLY 4 33.084 -4.545 5.841 17 H SER 5 H SER 5 32.708 -4.617 8.094 18 HA SER 5 HA SER 5 31.688 -7.174 9.123 19 HB2 SER 5 1HB SER 5 34.401 -6.486 9.042 20 HB3 SER 5 2HB SER 5 33.902 -6.175 10.714 21 HG SER 5 HG SER 5 33.965 -8.243 11.000 22 H SER 6 H SER 6 30.256 -4.793 9.044 23 HA SER 6 HA SER 6 30.093 -4.148 11.909 24 HB2 SER 6 1HB SER 6 30.947 -2.351 10.002 25 HB3 SER 6 2HB SER 6 29.215 -1.992 10.121 26 HG SER 6 HG SER 6 29.806 -2.149 12.554 27 H GLY 7 H GLY 7 28.296 -5.212 12.502 28 HA2 GLY 7 1HA GLY 7 26.065 -5.730 12.666 29 HA3 GLY 7 2HA GLY 7 25.753 -4.290 11.709 30 H SER 8 H SER 8 25.087 -7.422 11.793 31 HA SER 8 HA SER 8 25.438 -7.915 8.925 32 HB2 SER 8 1HB SER 8 24.732 -10.247 9.472 33 HB3 SER 8 2HB SER 8 26.178 -9.727 10.356 34 HG SER 8 HG SER 8 23.573 -9.529 11.448 35 H ASP 9 H ASP 9 23.812 -6.408 8.276 36 HA ASP 9 HA ASP 9 21.273 -7.585 7.882 37 HB2 ASP 9 1HB ASP 9 19.872 -6.021 9.141 38 HB3 ASP 9 2HB ASP 9 20.930 -6.933 10.225 39 H SER 10 H SER 10 21.804 -7.059 5.748 40 HA SER 10 HA SER 10 21.512 -4.201 5.097 41 HB2 SER 10 1HB SER 10 23.077 -4.431 3.270 42 HB3 SER 10 2HB SER 10 23.849 -5.029 4.749 43 HG SER 10 HG SER 10 24.248 -6.619 3.346 44 H LEU 11 H LEU 11 20.487 -3.727 3.083 45 HA LEU 11 HA LEU 11 19.017 -5.949 1.855 46 HB2 LEU 11 1HB LEU 11 17.764 -3.310 2.629 47 HB3 LEU 11 2HB LEU 11 16.959 -4.686 1.855 48 HG LEU 11 HG LEU 11 18.207 -5.075 4.536 49 HD11 LEU 11 1HD1 LEU 11 16.996 -3.406 5.397 50 HD12 LEU 11 2HD1 LEU 11 15.612 -4.468 5.137 51 HD13 LEU 11 3HD1 LEU 11 16.017 -3.238 3.940 52 HD21 LEU 11 3HD2 LEU 11 15.965 -6.260 2.943 53 HD22 LEU 11 1HD2 LEU 11 16.048 -6.481 4.691 54 HD23 LEU 11 2HD2 LEU 11 17.364 -7.057 3.666 55 H VAL 12 H VAL 12 17.646 -4.839 -0.075 56 HA VAL 12 HA VAL 12 19.655 -3.387 -1.657 57 HB VAL 12 HB VAL 12 18.948 -5.586 -2.544 58 HG11 VAL 12 1HG1 VAL 12 16.531 -5.168 -1.649 59 HG12 VAL 12 2HG1 VAL 12 16.283 -4.432 -3.234 60 HG13 VAL 12 3HG1 VAL 12 16.781 -6.120 -3.112 61 HG21 VAL 12 3HG2 VAL 12 17.850 -4.186 -4.718 62 HG22 VAL 12 1HG2 VAL 12 18.964 -3.072 -3.923 63 HG23 VAL 12 2HG2 VAL 12 19.535 -4.647 -4.472 64 H VAL 13 H VAL 13 18.216 -1.838 0.089 65 HA VAL 13 HA VAL 13 15.840 -0.736 -0.454 66 HB VAL 13 HB VAL 13 17.277 0.187 1.263 67 HG11 VAL 13 1HG1 VAL 13 18.888 1.991 -0.256 68 HG12 VAL 13 2HG1 VAL 13 19.393 0.738 0.880 69 HG13 VAL 13 3HG1 VAL 13 19.168 0.346 -0.825 70 HG21 VAL 13 3HG2 VAL 13 15.441 1.563 0.125 71 HG22 VAL 13 1HG2 VAL 13 16.622 2.430 1.107 72 HG23 VAL 13 2HG2 VAL 13 16.759 2.443 -0.651 73 H CYS 14 H CYS 14 15.026 0.977 -1.763 74 HA CYS 14 HA CYS 14 16.546 1.508 -4.221 75 HB2 CYS 14 1HB CYS 14 13.704 0.538 -3.981 76 HB3 CYS 14 2HB CYS 14 14.301 1.347 -5.439 77 HG CYS 14 HG CYS 14 16.537 -0.813 -5.113 78 H GLU 15 H GLU 15 15.050 3.186 -5.563 79 HA GLU 15 HA GLU 15 14.572 5.395 -3.683 80 HB2 GLU 15 1HB GLU 15 15.065 6.914 -5.501 81 HB3 GLU 15 2HB GLU 15 16.379 5.739 -5.339 82 HG2 GLU 15 1HG GLU 15 14.912 4.452 -7.162 83 HG3 GLU 15 2HG GLU 15 14.433 6.115 -7.530 84 H VAL 16 H VAL 16 12.872 6.944 -4.264 85 HA VAL 16 HA VAL 16 10.487 5.530 -5.148 86 HB VAL 16 HB VAL 16 10.393 6.858 -3.077 87 HG11 VAL 16 1HG1 VAL 16 10.382 9.415 -4.570 88 HG12 VAL 16 2HG1 VAL 16 10.902 9.064 -2.919 89 HG13 VAL 16 3HG1 VAL 16 11.950 8.661 -4.280 90 HG21 VAL 16 3HG2 VAL 16 8.391 8.330 -3.835 91 HG22 VAL 16 1HG2 VAL 16 8.653 7.567 -5.403 92 HG23 VAL 16 2HG2 VAL 16 8.284 6.577 -3.991 93 H ASP 17 H ASP 17 10.422 5.433 -7.334 94 HA ASP 17 HA ASP 17 11.373 6.975 -9.286 95 HB2 ASP 17 1HB ASP 17 9.848 4.981 -9.548 96 HB3 ASP 17 2HB ASP 17 8.485 6.086 -9.319 97 HA PRO 18 HA PRO 18 9.888 11.094 -8.789 98 HB2 PRO 18 2HB PRO 18 11.654 11.722 -10.117 99 HB3 PRO 18 1HB PRO 18 10.397 12.018 -11.317 100 HG2 PRO 18 1HG PRO 18 10.714 9.966 -12.359 101 HG3 PRO 18 2HG PRO 18 12.398 10.359 -11.848 102 HD2 PRO 18 1HD PRO 18 11.181 8.020 -11.201 103 HD3 PRO 18 2HD PRO 18 12.341 8.824 -10.131 104 H GLU 19 H GLU 19 8.727 9.054 -11.409 105 HA GLU 19 HA GLU 19 6.539 10.763 -12.112 106 HB2 GLU 19 1HB GLU 19 6.059 9.253 -13.762 107 HB3 GLU 19 2HB GLU 19 7.758 8.848 -13.472 108 HG2 GLU 19 1HG GLU 19 7.063 6.744 -13.265 109 HG3 GLU 19 2HG GLU 19 6.464 7.242 -11.676 110 H LEU 20 H LEU 20 7.073 8.237 -9.801 111 HA LEU 20 HA LEU 20 4.239 7.856 -9.289 112 HB2 LEU 20 1HB LEU 20 6.242 6.125 -9.150 113 HB3 LEU 20 2HB LEU 20 6.347 6.762 -7.499 114 HG LEU 20 HG LEU 20 3.856 5.540 -8.681 115 HD11 LEU 20 1HD1 LEU 20 4.546 3.499 -8.104 116 HD12 LEU 20 2HD1 LEU 20 5.228 4.065 -6.579 117 HD13 LEU 20 3HD1 LEU 20 6.168 4.191 -8.065 118 HD21 LEU 20 3HD2 LEU 20 4.551 6.819 -6.118 119 HD22 LEU 20 1HD2 LEU 20 3.632 5.317 -6.008 120 HD23 LEU 20 2HD2 LEU 20 2.993 6.676 -6.934 121 H LYS 21 H LYS 21 7.070 9.233 -7.671 122 HA LYS 21 HA LYS 21 6.169 9.845 -5.198 123 HB2 LYS 21 1HB LYS 21 8.392 10.468 -6.233 124 HB3 LYS 21 2HB LYS 21 7.580 11.885 -6.920 125 HG2 LYS 21 1HG LYS 21 6.865 12.149 -4.331 126 HG3 LYS 21 2HG LYS 21 8.438 11.350 -4.156 127 HD2 LYS 21 1HD LYS 21 8.413 13.528 -6.129 128 HD3 LYS 21 2HD LYS 21 8.070 14.039 -4.467 129 HE2 LYS 21 1HE LYS 21 10.142 12.541 -3.878 130 HE3 LYS 21 2HE LYS 21 10.530 12.768 -5.590 131 HZ1 LYS 21 3HZ LYS 21 9.885 15.272 -4.644 132 HZ2 LYS 21 1HZ LYS 21 11.430 14.694 -5.017 133 HZ3 LYS 21 2HZ LYS 21 10.845 14.584 -3.435 134 H GLU 22 H GLU 22 5.292 11.508 -8.184 135 HA GLU 22 HA GLU 22 3.778 13.561 -6.913 136 HB2 GLU 22 1HB GLU 22 3.354 12.609 -9.740 137 HB3 GLU 22 2HB GLU 22 3.138 14.237 -9.081 138 HG2 GLU 22 1HG GLU 22 5.725 14.028 -8.602 139 HG3 GLU 22 2HG GLU 22 5.625 12.846 -9.914 140 H THR 23 H THR 23 2.966 10.455 -8.397 141 HA THR 23 HA THR 23 0.226 10.554 -8.428 142 HB THR 23 HB THR 23 2.076 8.257 -7.817 143 HG1 THR 23 1HG THR 23 1.541 7.696 -9.936 144 HG21 THR 23 3HG2 THR 23 -0.886 8.371 -7.673 145 HG22 THR 23 1HG2 THR 23 0.250 7.340 -6.802 146 HG23 THR 23 2HG2 THR 23 -0.170 6.973 -8.475 147 H LEU 24 H LEU 24 2.307 9.736 -5.672 148 HA LEU 24 HA LEU 24 0.193 9.202 -3.867 149 HB2 LEU 24 1HB LEU 24 2.896 10.220 -3.032 150 HB3 LEU 24 2HB LEU 24 1.824 9.083 -2.195 151 HG LEU 24 HG LEU 24 3.482 8.531 -4.653 152 HD11 LEU 24 1HD1 LEU 24 5.013 7.665 -3.292 153 HD12 LEU 24 2HD1 LEU 24 3.798 6.804 -2.346 154 HD13 LEU 24 3HD1 LEU 24 4.172 8.487 -1.977 155 HD21 LEU 24 3HD2 LEU 24 2.121 6.849 -5.139 156 HD22 LEU 24 1HD2 LEU 24 1.050 7.328 -3.823 157 HD23 LEU 24 2HD2 LEU 24 2.357 6.182 -3.524 158 H ARG 25 H ARG 25 2.268 12.067 -4.295 159 HA ARG 25 HA ARG 25 1.133 13.680 -2.343 160 HB2 ARG 25 1HB ARG 25 3.205 14.080 -3.819 161 HB3 ARG 25 2HB ARG 25 2.068 14.771 -4.985 162 HG2 ARG 25 1HG ARG 25 1.409 16.488 -3.464 163 HG3 ARG 25 2HG ARG 25 2.313 15.725 -2.144 164 HD2 ARG 25 1HD ARG 25 3.953 16.288 -4.509 165 HD3 ARG 25 2HD ARG 25 3.246 17.731 -3.767 166 HE ARG 25 HE ARG 25 5.426 16.284 -2.778 167 HH11 ARG 25 2HH1 ARG 25 2.454 17.704 -1.649 168 HH12 ARG 25 1HH1 ARG 25 3.049 17.998 -0.048 169 HH21 ARG 25 1HH2 ARG 25 5.193 17.405 0.505 170 HH22 ARG 25 2HH2 ARG 25 6.221 16.664 -0.674 171 H LYS 26 H LYS 26 -0.076 12.777 -5.463 172 HA LYS 26 HA LYS 26 -2.104 14.850 -5.499 173 HB2 LYS 26 1HB LYS 26 -1.973 12.454 -7.327 174 HB3 LYS 26 2HB LYS 26 -2.707 14.035 -7.637 175 HG2 LYS 26 1HG LYS 26 0.070 14.408 -7.073 176 HG3 LYS 26 2HG LYS 26 -0.118 13.155 -8.313 177 HD2 LYS 26 1HD LYS 26 -1.856 14.900 -9.307 178 HD3 LYS 26 2HD LYS 26 -0.843 16.038 -8.402 179 HE2 LYS 26 1HE LYS 26 0.806 15.916 -9.909 180 HE3 LYS 26 2HE LYS 26 0.769 14.147 -9.881 181 HZ1 LYS 26 3HZ LYS 26 -1.501 14.948 -11.247 182 HZ2 LYS 26 1HZ LYS 26 -0.117 14.219 -11.893 183 HZ3 LYS 26 2HZ LYS 26 -0.242 15.906 -11.847 184 H PHE 27 H PHE 27 -1.913 11.351 -5.010 185 HA PHE 27 HA PHE 27 -4.631 10.782 -4.838 186 HB2 PHE 27 1HB PHE 27 -2.558 9.208 -4.812 187 HB3 PHE 27 2HB PHE 27 -2.627 9.422 -3.061 188 HD1 PHE 27 2HD PHE 27 -5.379 9.070 -5.543 189 HD2 PHE 27 1HD PHE 27 -3.370 7.429 -2.168 190 HE1 PHE 27 2HE PHE 27 -7.098 7.317 -5.376 191 HE2 PHE 27 1HE PHE 27 -5.086 5.673 -1.996 192 HZ PHE 27 HZ PHE 27 -6.953 5.616 -3.601 193 H ARG 28 H ARG 28 -2.414 12.051 -2.418 194 HA ARG 28 HA ARG 28 -4.241 11.853 -0.237 195 HB2 ARG 28 1HB ARG 28 -1.984 13.833 -0.338 196 HB3 ARG 28 2HB ARG 28 -2.612 12.927 1.046 197 HG2 ARG 28 1HG ARG 28 -1.730 10.934 -0.646 198 HG3 ARG 28 2HG ARG 28 -0.528 12.220 -0.848 199 HD2 ARG 28 1HD ARG 28 -1.423 11.047 1.796 200 HD3 ARG 28 2HD ARG 28 0.084 10.668 0.951 201 HE ARG 28 HE ARG 28 0.900 12.812 1.478 202 HH11 ARG 28 2HH1 ARG 28 -2.283 12.225 2.764 203 HH12 ARG 28 1HH1 ARG 28 -2.209 13.537 3.894 204 HH21 ARG 28 1HH2 ARG 28 -0.338 14.854 4.005 205 HH22 ARG 28 2HH2 ARG 28 1.008 14.541 2.962 206 H PHE 29 H PHE 29 -3.541 14.272 -2.664 207 HA PHE 29 HA PHE 29 -5.674 15.955 -1.523 208 HB2 PHE 29 1HB PHE 29 -3.662 17.235 -3.290 209 HB3 PHE 29 2HB PHE 29 -4.471 17.866 -1.854 210 HD1 PHE 29 1HD PHE 29 -3.813 16.033 0.249 211 HD2 PHE 29 2HD PHE 29 -1.383 17.419 -2.959 212 HE1 PHE 29 1HE PHE 29 -1.799 15.615 1.599 213 HE2 PHE 29 2HE PHE 29 0.634 17.003 -1.614 214 HZ PHE 29 HZ PHE 29 0.429 16.100 0.668 215 H ARG 30 H ARG 30 -6.217 13.882 -3.298 216 HA ARG 30 HA ARG 30 -6.402 14.941 -5.976 217 HB2 ARG 30 1HB ARG 30 -7.581 12.843 -6.491 218 HB3 ARG 30 2HB ARG 30 -6.040 12.557 -5.668 219 HG2 ARG 30 1HG ARG 30 -7.429 12.441 -3.508 220 HG3 ARG 30 2HG ARG 30 -8.817 12.260 -4.593 221 HD2 ARG 30 1HD ARG 30 -6.763 10.499 -5.492 222 HD3 ARG 30 2HD ARG 30 -6.958 10.285 -3.747 223 HE ARG 30 HE ARG 30 -8.859 9.599 -5.804 224 HH11 ARG 30 2HH1 ARG 30 -8.379 10.287 -2.425 225 HH12 ARG 30 1HH1 ARG 30 -9.802 9.438 -1.917 226 HH21 ARG 30 1HH2 ARG 30 -11.140 8.410 -3.465 227 HH22 ARG 30 2HH2 ARG 30 -10.734 8.480 -5.147 228 H LYS 31 H LYS 31 -8.435 15.168 -7.124 229 HA LYS 31 HA LYS 31 -10.416 16.507 -5.476 230 HB2 LYS 31 1HB LYS 31 -9.675 16.468 -8.343 231 HB3 LYS 31 2HB LYS 31 -11.393 16.716 -7.992 232 HG2 LYS 31 1HG LYS 31 -9.528 18.357 -6.402 233 HG3 LYS 31 2HG LYS 31 -9.582 18.703 -8.139 234 HD2 LYS 31 1HD LYS 31 -11.720 19.480 -8.073 235 HD3 LYS 31 2HD LYS 31 -12.187 18.371 -6.772 236 HE2 LYS 31 1HE LYS 31 -12.009 20.056 -5.323 237 HE3 LYS 31 2HE LYS 31 -10.272 20.094 -5.659 238 HZ1 LYS 31 3HZ LYS 31 -10.482 21.853 -7.065 239 HZ2 LYS 31 1HZ LYS 31 -11.778 22.189 -6.030 240 HZ3 LYS 31 2HZ LYS 31 -12.060 21.461 -7.530 241 H GLU 32 H GLU 32 -10.195 13.629 -5.262 242 HA GLU 32 HA GLU 32 -12.713 12.733 -6.481 243 HB2 GLU 32 1HB GLU 32 -10.380 11.217 -5.303 244 HB3 GLU 32 2HB GLU 32 -11.909 10.443 -5.748 245 HG2 GLU 32 1HG GLU 32 -10.130 11.973 -7.646 246 HG3 GLU 32 2HG GLU 32 -10.169 10.213 -7.473 247 H THR 33 H THR 33 -13.744 10.921 -4.964 248 HA THR 33 HA THR 33 -13.694 11.607 -2.157 249 HB THR 33 HB THR 33 -16.068 12.168 -1.987 250 HG1 THR 33 1HG THR 33 -16.990 12.774 -4.211 251 HG21 THR 33 3HG2 THR 33 -14.642 13.921 -3.992 252 HG22 THR 33 1HG2 THR 33 -14.434 13.989 -2.243 253 HG23 THR 33 2HG2 THR 33 -15.990 14.403 -2.962 254 H ASN 34 H ASN 34 -13.385 9.281 -4.058 255 HA ASN 34 HA ASN 34 -15.312 7.486 -2.735 256 HB2 ASN 34 1HB ASN 34 -14.939 6.014 -4.827 257 HB3 ASN 34 2HB ASN 34 -15.990 7.427 -4.976 258 HD21 ASN 34 2HD2 ASN 34 -12.998 7.046 -7.480 259 HD22 ASN 34 1HD2 ASN 34 -13.733 5.783 -6.559 260 H ASN 35 H ASN 35 -14.366 5.070 -3.249 261 HA ASN 35 HA ASN 35 -11.818 5.050 -1.834 262 HB2 ASN 35 1HB ASN 35 -13.916 2.959 -2.400 263 HB3 ASN 35 2HB ASN 35 -12.323 2.521 -1.771 264 HD21 ASN 35 2HD2 ASN 35 -14.624 2.920 1.079 265 HD22 ASN 35 1HD2 ASN 35 -14.554 1.933 -0.336 266 H ALA 36 H ALA 36 -9.936 4.650 -2.791 267 HA ALA 36 HA ALA 36 -9.884 3.116 -5.287 268 HB1 ALA 36 3HB ALA 36 -8.202 4.790 -6.182 269 HB2 ALA 36 1HB ALA 36 -9.887 5.309 -6.142 270 HB3 ALA 36 2HB ALA 36 -8.760 5.877 -4.910 271 H ALA 37 H ALA 37 -7.696 2.376 -5.860 272 HA ALA 37 HA ALA 37 -5.848 2.278 -3.579 273 HB1 ALA 37 3HB ALA 37 -5.472 -0.189 -4.339 274 HB2 ALA 37 1HB ALA 37 -6.819 0.213 -3.273 275 HB3 ALA 37 2HB ALA 37 -7.100 -0.030 -4.998 276 H ILE 38 H ILE 38 -3.659 1.893 -4.121 277 HA ILE 38 HA ILE 38 -3.013 2.076 -6.984 278 HB ILE 38 HB ILE 38 -1.535 3.630 -4.864 279 HG12 ILE 38 1HG1 ILE 38 -3.724 4.518 -6.755 280 HG13 ILE 38 2HG1 ILE 38 -3.765 4.548 -4.985 281 HG21 ILE 38 1HG2 ILE 38 -0.080 3.360 -6.638 282 HG22 ILE 38 2HG2 ILE 38 -1.371 3.407 -7.838 283 HG23 ILE 38 3HG2 ILE 38 -0.862 4.891 -7.033 284 HD11 ILE 38 3HD1 ILE 38 -3.250 6.712 -5.286 285 HD12 ILE 38 1HD1 ILE 38 -1.607 6.081 -5.401 286 HD13 ILE 38 2HD1 ILE 38 -2.521 6.432 -6.867 287 H ILE 39 H ILE 39 -1.919 0.298 -7.479 288 HA ILE 39 HA ILE 39 -0.223 -0.975 -5.467 289 HB ILE 39 HB ILE 39 -1.093 -1.959 -8.186 290 HG12 ILE 39 1HG1 ILE 39 -1.947 -3.516 -5.899 291 HG13 ILE 39 2HG1 ILE 39 -2.494 -1.838 -5.758 292 HG21 ILE 39 1HG2 ILE 39 1.028 -2.925 -7.673 293 HG22 ILE 39 2HG2 ILE 39 0.529 -3.279 -6.020 294 HG23 ILE 39 3HG2 ILE 39 -0.205 -4.148 -7.368 295 HD11 ILE 39 3HD1 ILE 39 -3.858 -3.744 -7.067 296 HD12 ILE 39 1HD1 ILE 39 -3.964 -2.025 -7.442 297 HD13 ILE 39 2HD1 ILE 39 -2.908 -3.072 -8.391 298 H MET 40 H MET 40 1.823 -0.332 -5.395 299 HA MET 40 HA MET 40 3.160 0.417 -7.907 300 HB2 MET 40 1HB MET 40 4.150 1.055 -5.131 301 HB3 MET 40 2HB MET 40 4.609 1.815 -6.662 302 HG2 MET 40 1HG MET 40 2.815 3.195 -6.696 303 HG3 MET 40 2HG MET 40 1.764 2.007 -5.921 304 HE1 MET 40 3HE MET 40 0.753 3.434 -3.368 305 HE2 MET 40 1HE MET 40 1.143 1.802 -3.911 306 HE3 MET 40 2HE MET 40 1.829 2.417 -2.407 307 H LYS 41 H LYS 41 5.207 -0.400 -8.388 308 HA LYS 41 HA LYS 41 6.071 -2.697 -6.757 309 HB2 LYS 41 1HB LYS 41 6.435 -4.024 -8.626 310 HB3 LYS 41 2HB LYS 41 4.938 -3.174 -9.044 311 HG2 LYS 41 1HG LYS 41 6.103 -1.654 -10.478 312 HG3 LYS 41 2HG LYS 41 7.670 -2.284 -9.939 313 HD2 LYS 41 1HD LYS 41 7.622 -3.790 -11.576 314 HD3 LYS 41 2HD LYS 41 6.164 -4.494 -10.855 315 HE2 LYS 41 1HE LYS 41 4.743 -3.004 -12.129 316 HE3 LYS 41 2HE LYS 41 6.162 -2.154 -12.757 317 HZ1 LYS 41 3HZ LYS 41 4.962 -4.059 -14.107 318 HZ2 LYS 41 1HZ LYS 41 6.025 -5.033 -13.222 319 HZ3 LYS 41 2HZ LYS 41 6.630 -3.805 -14.215 320 H VAL 42 H VAL 42 8.400 -3.365 -7.519 321 HA VAL 42 HA VAL 42 10.014 -0.915 -7.806 322 HB VAL 42 HB VAL 42 10.490 -1.377 -5.615 323 HG11 VAL 42 1HG1 VAL 42 9.268 -3.163 -4.939 324 HG12 VAL 42 2HG1 VAL 42 9.723 -4.144 -6.334 325 HG13 VAL 42 3HG1 VAL 42 10.846 -3.947 -4.988 326 HG21 VAL 42 3HG2 VAL 42 12.529 -1.659 -7.153 327 HG22 VAL 42 1HG2 VAL 42 12.670 -2.203 -5.481 328 HG23 VAL 42 2HG2 VAL 42 12.405 -3.376 -6.771 329 H ASP 43 H ASP 43 10.831 -1.027 -9.802 330 HA ASP 43 HA ASP 43 11.349 -3.426 -11.205 331 HB2 ASP 43 1HB ASP 43 12.009 -0.532 -11.635 332 HB3 ASP 43 2HB ASP 43 12.786 -1.757 -12.645 333 H LYS 44 H LYS 44 12.972 -4.805 -11.001 334 HA LYS 44 HA LYS 44 15.136 -4.355 -9.222 335 HB2 LYS 44 1HB LYS 44 14.187 -6.588 -9.657 336 HB3 LYS 44 2HB LYS 44 14.798 -6.509 -11.318 337 HG2 LYS 44 1HG LYS 44 17.114 -6.275 -10.352 338 HG3 LYS 44 2HG LYS 44 16.396 -6.662 -8.778 339 HD2 LYS 44 1HD LYS 44 15.387 -8.712 -10.096 340 HD3 LYS 44 2HD LYS 44 16.754 -8.396 -11.179 341 HE2 LYS 44 1HE LYS 44 18.103 -9.492 -9.786 342 HE3 LYS 44 2HE LYS 44 17.754 -8.283 -8.541 343 HZ1 LYS 44 3HZ LYS 44 16.773 -9.890 -7.399 344 HZ2 LYS 44 1HZ LYS 44 16.917 -10.985 -8.680 345 HZ3 LYS 44 2HZ LYS 44 15.570 -9.967 -8.586 346 H ASP 45 H ASP 45 14.709 -3.950 -12.654 347 HA ASP 45 HA ASP 45 17.472 -3.814 -13.332 348 HB2 ASP 45 1HB ASP 45 15.662 -4.302 -14.968 349 HB3 ASP 45 2HB ASP 45 15.111 -2.629 -14.805 350 H ARG 46 H ARG 46 15.017 -1.408 -12.506 351 HA ARG 46 HA ARG 46 17.068 0.690 -12.596 352 HB2 ARG 46 1HB ARG 46 14.071 0.995 -12.298 353 HB3 ARG 46 2HB ARG 46 15.246 2.283 -12.600 354 HG2 ARG 46 1HG ARG 46 15.707 1.464 -14.800 355 HG3 ARG 46 2HG ARG 46 14.734 0.013 -14.505 356 HD2 ARG 46 1HD ARG 46 13.098 1.170 -15.538 357 HD3 ARG 46 2HD ARG 46 12.923 1.952 -13.961 358 HE ARG 46 HE ARG 46 14.819 3.439 -15.238 359 HH11 ARG 46 2HH1 ARG 46 11.563 2.448 -15.973 360 HH12 ARG 46 1HH1 ARG 46 11.208 3.859 -16.915 361 HH21 ARG 46 1HH2 ARG 46 12.801 5.480 -17.200 362 HH22 ARG 46 2HH2 ARG 46 14.363 5.301 -16.474 363 H GLN 47 H GLN 47 15.934 -1.442 -10.438 364 HA GLN 47 HA GLN 47 15.541 -1.466 -8.167 365 HB2 GLN 47 1HB GLN 47 17.932 0.386 -8.237 366 HB3 GLN 47 2HB GLN 47 17.459 -0.696 -6.918 367 HG2 GLN 47 1HG GLN 47 17.884 -2.015 -9.514 368 HG3 GLN 47 2HG GLN 47 19.321 -1.279 -8.789 369 HE21 GLN 47 2HE2 GLN 47 17.479 -4.417 -6.919 370 HE22 GLN 47 1HE2 GLN 47 16.603 -3.407 -8.012 371 H MET 48 H MET 48 13.732 0.248 -9.161 372 HA MET 48 HA MET 48 13.600 2.285 -7.069 373 HB2 MET 48 1HB MET 48 13.391 4.093 -8.434 374 HB3 MET 48 2HB MET 48 14.411 3.094 -9.481 375 HG2 MET 48 1HG MET 48 12.025 2.217 -10.301 376 HG3 MET 48 2HG MET 48 11.562 3.832 -9.756 377 HE1 MET 48 3HE MET 48 13.398 5.641 -10.029 378 HE2 MET 48 1HE MET 48 14.412 5.848 -11.458 379 HE3 MET 48 2HE MET 48 12.705 6.287 -11.517 380 H VAL 49 H VAL 49 11.470 2.969 -6.557 381 HA VAL 49 HA VAL 49 9.484 0.926 -7.040 382 HB VAL 49 HB VAL 49 8.925 3.462 -5.544 383 HG11 VAL 49 1HG1 VAL 49 7.841 0.713 -5.687 384 HG12 VAL 49 2HG1 VAL 49 7.833 1.493 -4.103 385 HG13 VAL 49 3HG1 VAL 49 7.009 2.252 -5.466 386 HG21 VAL 49 3HG2 VAL 49 10.726 1.221 -4.713 387 HG22 VAL 49 1HG2 VAL 49 10.939 2.960 -4.514 388 HG23 VAL 49 2HG2 VAL 49 9.777 2.094 -3.510 389 H VAL 50 H VAL 50 8.430 0.991 -8.924 390 HA VAL 50 HA VAL 50 7.418 3.598 -9.860 391 HB VAL 50 HB VAL 50 7.394 2.650 -12.137 392 HG11 VAL 50 1HG1 VAL 50 9.330 3.950 -11.234 393 HG12 VAL 50 2HG1 VAL 50 10.130 2.413 -10.899 394 HG13 VAL 50 3HG1 VAL 50 9.734 2.858 -12.559 395 HG21 VAL 50 3HG2 VAL 50 7.790 0.498 -12.600 396 HG22 VAL 50 1HG2 VAL 50 9.204 0.443 -11.547 397 HG23 VAL 50 2HG2 VAL 50 7.592 0.216 -10.871 398 H LEU 51 H LEU 51 5.288 3.779 -10.414 399 HA LEU 51 HA LEU 51 3.375 2.252 -9.175 400 HB2 LEU 51 1HB LEU 51 3.219 4.529 -10.419 401 HB3 LEU 51 2HB LEU 51 2.798 3.529 -11.821 402 HG LEU 51 HG LEU 51 1.232 3.024 -9.369 403 HD11 LEU 51 1HD1 LEU 51 0.535 5.444 -10.982 404 HD12 LEU 51 2HD1 LEU 51 1.616 5.573 -9.594 405 HD13 LEU 51 3HD1 LEU 51 -0.026 4.966 -9.379 406 HD21 LEU 51 3HD2 LEU 51 0.231 1.876 -11.014 407 HD22 LEU 51 1HD2 LEU 51 0.971 2.856 -12.281 408 HD23 LEU 51 2HD2 LEU 51 -0.478 3.430 -11.453 409 H GLU 52 H GLU 52 1.906 0.650 -9.857 410 HA GLU 52 HA GLU 52 2.801 -0.918 -12.187 411 HB2 GLU 52 1HB GLU 52 3.354 -1.983 -10.008 412 HB3 GLU 52 2HB GLU 52 1.626 -2.008 -9.623 413 HG2 GLU 52 1HG GLU 52 1.152 -3.657 -11.156 414 HG3 GLU 52 2HG GLU 52 2.571 -3.282 -12.144 415 H ASP 53 H ASP 53 0.062 -0.013 -10.142 416 HA ASP 53 HA ASP 53 -1.689 0.070 -12.412 417 HB2 ASP 53 1HB ASP 53 -1.857 -2.170 -10.421 418 HB3 ASP 53 2HB ASP 53 -3.337 -1.541 -11.157 419 H GLU 54 H GLU 54 -3.966 0.653 -11.707 420 HA GLU 54 HA GLU 54 -4.185 1.851 -9.079 421 HB2 GLU 54 1HB GLU 54 -3.615 3.406 -11.505 422 HB3 GLU 54 2HB GLU 54 -5.019 3.981 -10.592 423 HG2 GLU 54 1HG GLU 54 -3.367 3.760 -8.548 424 HG3 GLU 54 2HG GLU 54 -2.151 3.925 -9.823 425 H LEU 55 H LEU 55 -6.087 1.091 -8.441 426 HA LEU 55 HA LEU 55 -8.283 0.936 -10.390 427 HB2 LEU 55 1HB LEU 55 -8.098 -0.408 -7.691 428 HB3 LEU 55 2HB LEU 55 -9.296 -0.705 -8.963 429 HG LEU 55 HG LEU 55 -6.396 -1.232 -9.484 430 HD11 LEU 55 1HD1 LEU 55 -6.457 -2.599 -7.677 431 HD12 LEU 55 2HD1 LEU 55 -7.230 -3.676 -8.840 432 HD13 LEU 55 3HD1 LEU 55 -8.214 -2.749 -7.708 433 HD21 LEU 55 3HD2 LEU 55 -7.432 -1.602 -11.455 434 HD22 LEU 55 1HD2 LEU 55 -9.005 -1.867 -10.702 435 HD23 LEU 55 2HD2 LEU 55 -7.806 -3.162 -10.719 436 H GLN 56 H GLN 56 -10.103 2.095 -10.121 437 HA GLN 56 HA GLN 56 -10.291 3.764 -7.703 438 HB2 GLN 56 1HB GLN 56 -11.278 4.280 -10.516 439 HB3 GLN 56 2HB GLN 56 -11.637 5.318 -9.126 440 HG2 GLN 56 1HG GLN 56 -9.865 6.405 -10.144 441 HG3 GLN 56 2HG GLN 56 -9.092 5.483 -8.845 442 HE21 GLN 56 2HE2 GLN 56 -6.950 3.838 -10.976 443 HE22 GLN 56 1HE2 GLN 56 -7.349 4.402 -9.392 444 H ASN 57 H ASN 57 -12.413 4.224 -6.874 445 HA ASN 57 HA ASN 57 -14.394 3.498 -6.010 446 HB2 ASN 57 1HB ASN 57 -15.917 2.518 -8.004 447 HB3 ASN 57 2HB ASN 57 -15.630 4.247 -7.768 448 HD21 ASN 57 2HD2 ASN 57 -13.519 4.625 -10.563 449 HD22 ASN 57 1HD2 ASN 57 -13.905 5.242 -8.996 450 H ILE 58 H ILE 58 -12.629 1.705 -5.321 451 HA ILE 58 HA ILE 58 -13.935 -0.880 -5.856 452 HB ILE 58 HB ILE 58 -12.030 -1.560 -6.802 453 HG12 ILE 58 1HG1 ILE 58 -11.935 -2.466 -4.415 454 HG13 ILE 58 2HG1 ILE 58 -10.426 -2.500 -5.343 455 HG21 ILE 58 1HG2 ILE 58 -9.825 -0.243 -6.347 456 HG22 ILE 58 2HG2 ILE 58 -11.084 0.465 -7.357 457 HG23 ILE 58 3HG2 ILE 58 -10.916 0.970 -5.675 458 HD11 ILE 58 3HD1 ILE 58 -10.465 -0.029 -4.014 459 HD12 ILE 58 1HD1 ILE 58 -10.958 -1.246 -2.837 460 HD13 ILE 58 2HD1 ILE 58 -9.428 -1.420 -3.697 461 H SER 59 H SER 59 -14.287 -2.193 -4.120 462 HA SER 59 HA SER 59 -14.061 -0.965 -1.511 463 HB2 SER 59 1HB SER 59 -15.871 -2.198 -1.034 464 HB3 SER 59 2HB SER 59 -15.837 -2.779 -2.708 465 HG SER 59 HG SER 59 -14.959 -4.618 -2.083 466 HA PRO 60 HA PRO 60 -10.638 -3.160 0.139 467 HB2 PRO 60 2HB PRO 60 -11.221 -2.412 2.232 468 HB3 PRO 60 1HB PRO 60 -11.526 -4.120 2.545 469 HG2 PRO 60 1HG PRO 60 -13.808 -3.928 2.154 470 HG3 PRO 60 2HG PRO 60 -13.448 -2.325 2.896 471 HD2 PRO 60 1HD PRO 60 -14.696 -2.581 0.500 472 HD3 PRO 60 2HD PRO 60 -13.597 -1.241 0.868 473 H GLU 61 H GLU 61 -13.247 -4.817 -1.000 474 HA GLU 61 HA GLU 61 -12.182 -7.454 -0.266 475 HB2 GLU 61 1HB GLU 61 -14.853 -6.400 -0.778 476 HB3 GLU 61 2HB GLU 61 -14.518 -7.875 -1.699 477 HG2 GLU 61 1HG GLU 61 -14.242 -9.173 0.200 478 HG3 GLU 61 2HG GLU 61 -13.926 -7.765 1.225 479 H GLU 62 H GLU 62 -12.601 -5.256 -2.897 480 HA GLU 62 HA GLU 62 -12.135 -7.244 -4.945 481 HB2 GLU 62 1HB GLU 62 -13.102 -4.551 -4.839 482 HB3 GLU 62 2HB GLU 62 -11.740 -4.627 -5.968 483 HG2 GLU 62 1HG GLU 62 -13.594 -6.841 -6.323 484 HG3 GLU 62 2HG GLU 62 -14.363 -5.259 -6.524 485 H LEU 63 H LEU 63 -10.331 -4.663 -3.347 486 HA LEU 63 HA LEU 63 -8.037 -4.653 -4.911 487 HB2 LEU 63 1HB LEU 63 -8.874 -3.426 -2.587 488 HB3 LEU 63 2HB LEU 63 -7.496 -4.408 -2.055 489 HG LEU 63 HG LEU 63 -7.552 -2.066 -3.909 490 HD11 LEU 63 1HD1 LEU 63 -7.012 -1.643 -1.609 491 HD12 LEU 63 2HD1 LEU 63 -5.546 -1.478 -2.575 492 HD13 LEU 63 3HD1 LEU 63 -5.806 -2.931 -1.610 493 HD21 LEU 63 3HD2 LEU 63 -4.991 -3.037 -4.120 494 HD22 LEU 63 1HD2 LEU 63 -6.234 -3.127 -5.367 495 HD23 LEU 63 2HD2 LEU 63 -5.977 -4.491 -4.280 496 H LYS 64 H LYS 64 -8.592 -6.497 -1.908 497 HA LYS 64 HA LYS 64 -6.250 -7.909 -1.776 498 HB2 LYS 64 1HB LYS 64 -7.387 -8.604 0.018 499 HB3 LYS 64 2HB LYS 64 -8.939 -8.217 -0.740 500 HG2 LYS 64 1HG LYS 64 -9.176 -10.343 -1.662 501 HG3 LYS 64 2HG LYS 64 -7.451 -10.705 -1.483 502 HD2 LYS 64 1HD LYS 64 -7.921 -11.740 0.434 503 HD3 LYS 64 2HD LYS 64 -8.374 -10.163 1.106 504 HE2 LYS 64 1HE LYS 64 -10.418 -11.034 1.399 505 HE3 LYS 64 2HE LYS 64 -10.596 -10.867 -0.354 506 HZ1 LYS 64 3HZ LYS 64 -9.204 -13.243 0.176 507 HZ2 LYS 64 1HZ LYS 64 -10.732 -13.055 -0.524 508 HZ3 LYS 64 2HZ LYS 64 -10.585 -13.215 1.154 509 H LEU 65 H LEU 65 -9.058 -8.575 -3.802 510 HA LEU 65 HA LEU 65 -8.101 -11.069 -4.790 511 HB2 LEU 65 1HB LEU 65 -10.124 -9.167 -5.988 512 HB3 LEU 65 2HB LEU 65 -9.873 -10.859 -6.456 513 HG LEU 65 HG LEU 65 -10.832 -9.955 -3.741 514 HD11 LEU 65 1HD1 LEU 65 -12.644 -9.456 -5.061 515 HD12 LEU 65 2HD1 LEU 65 -12.959 -11.147 -4.678 516 HD13 LEU 65 3HD1 LEU 65 -12.271 -10.712 -6.241 517 HD21 LEU 65 3HD2 LEU 65 -9.572 -12.175 -4.024 518 HD22 LEU 65 1HD2 LEU 65 -11.001 -12.714 -4.904 519 HD23 LEU 65 2HD2 LEU 65 -11.142 -12.207 -3.220 520 H GLU 66 H GLU 66 -7.923 -7.732 -5.920 521 HA GLU 66 HA GLU 66 -6.805 -8.288 -8.453 522 HB2 GLU 66 1HB GLU 66 -6.564 -5.809 -6.732 523 HB3 GLU 66 2HB GLU 66 -6.134 -5.910 -8.446 524 HG2 GLU 66 1HG GLU 66 -8.899 -6.621 -7.545 525 HG3 GLU 66 2HG GLU 66 -8.426 -4.930 -7.758 526 H LEU 67 H LEU 67 -5.459 -8.124 -5.265 527 HA LEU 67 HA LEU 67 -2.730 -7.845 -6.140 528 HB2 LEU 67 1HB LEU 67 -3.950 -8.545 -3.466 529 HB3 LEU 67 2HB LEU 67 -2.211 -8.349 -3.747 530 HG LEU 67 HG LEU 67 -4.211 -6.150 -4.233 531 HD11 LEU 67 1HD1 LEU 67 -2.467 -6.011 -1.871 532 HD12 LEU 67 2HD1 LEU 67 -3.772 -7.193 -1.782 533 HD13 LEU 67 3HD1 LEU 67 -4.139 -5.495 -2.084 534 HD21 LEU 67 3HD2 LEU 67 -1.934 -6.118 -5.344 535 HD22 LEU 67 1HD2 LEU 67 -1.254 -5.963 -3.723 536 HD23 LEU 67 2HD2 LEU 67 -2.339 -4.719 -4.347 537 HA PRO 68 HA PRO 68 -1.853 -12.080 -6.948 538 HB2 PRO 68 2HB PRO 68 0.093 -11.340 -7.918 539 HB3 PRO 68 1HB PRO 68 0.849 -12.073 -6.504 540 HG2 PRO 68 1HG PRO 68 0.989 -10.057 -5.359 541 HG3 PRO 68 2HG PRO 68 1.241 -9.509 -7.058 542 HD2 PRO 68 1HD PRO 68 -0.659 -8.441 -5.441 543 HD3 PRO 68 2HD PRO 68 -0.882 -8.620 -7.190 544 H GLU 69 H GLU 69 -0.421 -13.905 -5.911 545 HA GLU 69 HA GLU 69 -0.952 -13.877 -3.013 546 HB2 GLU 69 1HB GLU 69 -1.239 -16.293 -3.133 547 HB3 GLU 69 2HB GLU 69 -2.341 -15.481 -4.253 548 HG2 GLU 69 1HG GLU 69 0.149 -16.126 -5.560 549 HG3 GLU 69 2HG GLU 69 -0.583 -17.560 -4.826 550 H ARG 70 H ARG 70 1.418 -14.241 -5.460 551 HA ARG 70 HA ARG 70 3.431 -14.832 -3.406 552 HB2 ARG 70 1HB ARG 70 3.572 -16.011 -6.180 553 HB3 ARG 70 2HB ARG 70 4.548 -16.426 -4.762 554 HG2 ARG 70 1HG ARG 70 1.648 -16.821 -4.436 555 HG3 ARG 70 2HG ARG 70 2.438 -17.867 -5.629 556 HD2 ARG 70 1HD ARG 70 3.873 -18.820 -4.044 557 HD3 ARG 70 2HD ARG 70 3.607 -17.501 -2.895 558 HE ARG 70 HE ARG 70 1.710 -18.560 -2.145 559 HH11 ARG 70 2HH1 ARG 70 2.796 -20.051 -5.098 560 HH12 ARG 70 1HH1 ARG 70 1.705 -21.392 -4.975 561 HH21 ARG 70 1HH2 ARG 70 0.268 -21.543 -3.197 562 HH22 ARG 70 2HH2 ARG 70 0.270 -20.321 -1.972 563 H GLN 71 H GLN 71 2.753 -12.302 -4.383 564 HA GLN 71 HA GLN 71 5.292 -11.545 -5.601 565 HB2 GLN 71 1HB GLN 71 2.621 -11.251 -6.861 566 HB3 GLN 71 2HB GLN 71 3.706 -9.857 -6.972 567 HG2 GLN 71 1HG GLN 71 5.446 -11.329 -7.946 568 HG3 GLN 71 2HG GLN 71 4.270 -12.650 -7.934 569 HE21 GLN 71 2HE2 GLN 71 2.446 -11.513 -10.698 570 HE22 GLN 71 1HE2 GLN 71 2.443 -12.521 -9.296 571 HA PRO 72 HA PRO 72 4.497 -8.724 -2.160 572 HB2 PRO 72 2HB PRO 72 6.451 -9.479 -1.218 573 HB3 PRO 72 1HB PRO 72 7.118 -7.986 -1.874 574 HG2 PRO 72 1HG PRO 72 7.962 -9.031 -3.770 575 HG3 PRO 72 2HG PRO 72 8.168 -10.330 -2.536 576 HD2 PRO 72 1HD PRO 72 6.851 -10.727 -4.877 577 HD3 PRO 72 2HD PRO 72 6.391 -11.539 -3.370 578 H ARG 73 H ARG 73 3.936 -6.641 -2.316 579 HA ARG 73 HA ARG 73 5.429 -4.737 -3.839 580 HB2 ARG 73 1HB ARG 73 3.377 -4.120 -5.266 581 HB3 ARG 73 2HB ARG 73 4.345 -5.518 -5.760 582 HG2 ARG 73 1HG ARG 73 2.271 -6.359 -3.955 583 HG3 ARG 73 2HG ARG 73 1.587 -5.426 -5.299 584 HD2 ARG 73 1HD ARG 73 3.599 -7.604 -5.804 585 HD3 ARG 73 2HD ARG 73 1.886 -7.978 -5.575 586 HE ARG 73 HE ARG 73 3.073 -6.930 -7.914 587 HH11 ARG 73 2HH1 ARG 73 0.212 -6.654 -5.949 588 HH12 ARG 73 1HH1 ARG 73 -0.802 -6.160 -7.265 589 HH21 ARG 73 1HH2 ARG 73 0.074 -5.948 -9.371 590 HH22 ARG 73 2HH2 ARG 73 1.749 -6.279 -9.654 591 H PHE 74 H PHE 74 4.195 -2.574 -3.893 592 HA PHE 74 HA PHE 74 3.042 -2.192 -1.234 593 HB2 PHE 74 1HB PHE 74 3.909 -0.080 -3.224 594 HB3 PHE 74 2HB PHE 74 3.556 0.152 -1.510 595 HD1 PHE 74 1HD PHE 74 4.971 -1.730 -0.029 596 HD2 PHE 74 2HD PHE 74 6.152 0.116 -3.678 597 HE1 PHE 74 1HE PHE 74 7.332 -2.128 0.538 598 HE2 PHE 74 2HE PHE 74 8.515 -0.280 -3.118 599 HZ PHE 74 HZ PHE 74 9.108 -1.404 -1.009 600 H VAL 75 H VAL 75 1.079 -1.156 -0.881 601 HA VAL 75 HA VAL 75 -0.578 -0.484 -3.188 602 HB VAL 75 HB VAL 75 -1.553 -2.405 -1.073 603 HG11 VAL 75 1HG1 VAL 75 -2.884 -0.769 -3.004 604 HG12 VAL 75 2HG1 VAL 75 -3.135 -2.470 -3.400 605 HG13 VAL 75 3HG1 VAL 75 -3.577 -1.860 -1.805 606 HG21 VAL 75 3HG2 VAL 75 -1.008 -3.076 -3.951 607 HG22 VAL 75 1HG2 VAL 75 0.199 -3.300 -2.685 608 HG23 VAL 75 2HG2 VAL 75 -1.330 -4.175 -2.610 609 H VAL 76 H VAL 76 -1.567 1.382 -2.818 610 HA VAL 76 HA VAL 76 -1.948 2.245 -0.030 611 HB VAL 76 HB VAL 76 -1.588 3.839 -2.563 612 HG11 VAL 76 1HG1 VAL 76 -3.351 4.916 -1.329 613 HG12 VAL 76 2HG1 VAL 76 -2.423 4.808 0.169 614 HG13 VAL 76 3HG1 VAL 76 -1.868 5.852 -1.142 615 HG21 VAL 76 3HG2 VAL 76 0.435 4.525 -1.688 616 HG22 VAL 76 1HG2 VAL 76 -0.052 4.193 -0.026 617 HG23 VAL 76 2HG2 VAL 76 0.348 2.861 -1.111 618 H TYR 77 H TYR 77 -3.960 1.521 0.479 619 HA TYR 77 HA TYR 77 -6.167 1.989 -1.371 620 HB2 TYR 77 1HB TYR 77 -5.914 -0.203 -0.192 621 HB3 TYR 77 2HB TYR 77 -6.213 0.634 1.333 622 HD1 TYR 77 2HD TYR 77 -7.921 1.183 -1.924 623 HD2 TYR 77 1HD TYR 77 -8.246 -0.272 2.062 624 HE1 TYR 77 2HE TYR 77 -10.347 0.913 -2.226 625 HE2 TYR 77 1HE TYR 77 -10.673 -0.547 1.770 626 HH TYR 77 HH TYR 77 -12.307 0.549 -1.154 627 H SER 78 H SER 78 -7.712 3.494 -1.097 628 HA SER 78 HA SER 78 -7.519 5.202 1.297 629 HB2 SER 78 1HB SER 78 -6.899 6.291 -0.876 630 HB3 SER 78 2HB SER 78 -8.556 5.996 -1.434 631 HG SER 78 HG SER 78 -9.207 7.203 0.513 632 H TYR 79 H TYR 79 -9.032 4.261 2.600 633 HA TYR 79 HA TYR 79 -11.651 3.578 1.576 634 HB2 TYR 79 1HB TYR 79 -10.669 2.119 3.238 635 HB3 TYR 79 2HB TYR 79 -10.477 3.467 4.360 636 HD1 TYR 79 2HD TYR 79 -12.389 4.410 5.548 637 HD2 TYR 79 1HD TYR 79 -12.857 1.100 2.917 638 HE1 TYR 79 2HE TYR 79 -14.609 3.966 6.510 639 HE2 TYR 79 1HE TYR 79 -15.079 0.648 3.872 640 HH TYR 79 HH TYR 79 -16.670 1.368 5.254 641 H LYS 80 H LYS 80 -13.608 4.344 2.792 642 HA LYS 80 HA LYS 80 -13.340 7.200 3.471 643 HB2 LYS 80 1HB LYS 80 -14.443 7.090 1.367 644 HB3 LYS 80 2HB LYS 80 -15.497 5.777 1.916 645 HG2 LYS 80 1HG LYS 80 -16.391 7.465 3.636 646 HG3 LYS 80 2HG LYS 80 -15.611 8.687 2.614 647 HD2 LYS 80 1HD LYS 80 -17.150 8.499 0.977 648 HD3 LYS 80 2HD LYS 80 -17.249 6.738 1.150 649 HE2 LYS 80 1HE LYS 80 -18.383 7.587 3.494 650 HE3 LYS 80 2HE LYS 80 -18.891 8.845 2.357 651 HZ1 LYS 80 3HZ LYS 80 -20.235 6.606 2.677 652 HZ2 LYS 80 1HZ LYS 80 -19.170 6.080 1.473 653 HZ3 LYS 80 2HZ LYS 80 -20.173 7.412 1.190 654 H TYR 81 H TYR 81 -13.557 7.357 5.611 655 HA TYR 81 HA TYR 81 -15.547 5.675 6.965 656 HB2 TYR 81 1HB TYR 81 -12.938 6.089 7.608 657 HB3 TYR 81 2HB TYR 81 -13.717 7.333 8.589 658 HD1 TYR 81 2HD TYR 81 -16.116 6.242 9.602 659 HD2 TYR 81 1HD TYR 81 -12.430 4.236 8.899 660 HE1 TYR 81 2HE TYR 81 -16.710 4.568 11.304 661 HE2 TYR 81 1HE TYR 81 -13.013 2.557 10.599 662 HH TYR 81 HH TYR 81 -15.420 2.963 12.835 663 H VAL 82 H VAL 82 -17.311 6.528 7.888 664 HA VAL 82 HA VAL 82 -17.648 9.442 7.733 665 HB VAL 82 HB VAL 82 -19.300 7.997 6.540 666 HG11 VAL 82 1HG1 VAL 82 -20.973 7.266 8.682 667 HG12 VAL 82 2HG1 VAL 82 -20.119 6.203 7.562 668 HG13 VAL 82 3HG1 VAL 82 -19.358 6.681 9.081 669 HG21 VAL 82 3HG2 VAL 82 -19.737 10.328 7.525 670 HG22 VAL 82 1HG2 VAL 82 -21.130 9.353 7.058 671 HG23 VAL 82 2HG2 VAL 82 -20.672 9.481 8.757 672 H HIS 83 H HIS 83 -18.916 10.476 9.465 673 HA HIS 83 HA HIS 83 -18.125 9.394 12.075 674 HB2 HIS 83 1HB HIS 83 -18.902 12.184 11.195 675 HB3 HIS 83 2HB HIS 83 -18.608 11.736 12.879 676 HD1 HIS 83 1HD HIS 83 -16.373 12.480 13.591 677 HD2 HIS 83 2HD HIS 83 -16.375 11.207 9.636 678 HE1 HIS 83 1HE HIS 83 -13.996 12.722 12.806 679 HE2 HIS 83 2HE HIS 83 -13.997 11.944 10.388 680 H ASP 84 H ASP 84 -20.734 11.661 11.352 681 HA ASP 84 HA ASP 84 -22.941 10.038 11.494 682 HB2 ASP 84 1HB ASP 84 -21.603 10.244 14.058 683 HB3 ASP 84 2HB ASP 84 -23.246 10.893 14.146 684 H ASP 85 H ASP 85 -21.789 12.952 13.197 685 HA ASP 85 HA ASP 85 -24.161 14.409 13.040 686 HB2 ASP 85 1HB ASP 85 -21.665 14.837 14.103 687 HB3 ASP 85 2HB ASP 85 -21.716 16.018 12.787 688 H GLY 86 H GLY 86 -22.101 13.445 10.551 689 HA2 GLY 86 1HA GLY 86 -23.097 13.834 8.300 690 HA3 GLY 86 2HA GLY 86 -23.211 15.525 8.767 691 H ARG 87 H ARG 87 -20.418 13.791 9.787 692 HA ARG 87 HA ARG 87 -18.845 15.141 7.694 693 HB2 ARG 87 1HB ARG 87 -18.134 14.531 10.571 694 HB3 ARG 87 2HB ARG 87 -16.979 15.131 9.371 695 HG2 ARG 87 1HG ARG 87 -19.511 16.632 9.960 696 HG3 ARG 87 2HG ARG 87 -18.067 16.816 10.970 697 HD2 ARG 87 1HD ARG 87 -16.782 17.680 9.191 698 HD3 ARG 87 2HD ARG 87 -17.954 17.126 7.986 699 HE ARG 87 HE ARG 87 -19.387 18.880 9.462 700 HH11 ARG 87 2HH1 ARG 87 -16.303 19.064 7.858 701 HH12 ARG 87 1HH1 ARG 87 -16.423 20.764 7.542 702 HH21 ARG 87 1HH2 ARG 87 -18.274 21.930 8.221 703 HH22 ARG 87 2HH2 ARG 87 -19.556 21.117 9.051 704 H VAL 88 H VAL 88 -17.539 13.937 6.455 705 HA VAL 88 HA VAL 88 -16.854 11.220 7.330 706 HB VAL 88 HB VAL 88 -18.763 10.923 5.877 707 HG11 VAL 88 1HG1 VAL 88 -19.159 12.055 3.972 708 HG12 VAL 88 2HG1 VAL 88 -17.988 13.200 4.632 709 HG13 VAL 88 3HG1 VAL 88 -17.473 11.986 3.459 710 HG21 VAL 88 3HG2 VAL 88 -17.526 9.727 3.920 711 HG22 VAL 88 1HG2 VAL 88 -16.075 10.148 4.829 712 HG23 VAL 88 2HG2 VAL 88 -17.321 9.145 5.572 713 H SER 89 H SER 89 -14.786 10.700 6.980 714 HA SER 89 HA SER 89 -13.243 12.333 5.073 715 HB2 SER 89 1HB SER 89 -12.348 11.344 7.800 716 HB3 SER 89 2HB SER 89 -11.315 12.176 6.625 717 HG SER 89 HG SER 89 -13.583 13.213 7.968 718 H TYR 90 H TYR 90 -11.378 11.295 4.151 719 HA TYR 90 HA TYR 90 -11.731 8.384 3.955 720 HB2 TYR 90 1HB TYR 90 -10.024 9.913 2.035 721 HB3 TYR 90 2HB TYR 90 -11.015 8.479 1.762 722 HD1 TYR 90 2HD TYR 90 -13.637 8.897 2.114 723 HD2 TYR 90 1HD TYR 90 -10.791 11.894 1.106 724 HE1 TYR 90 2HE TYR 90 -15.439 10.284 1.177 725 HE2 TYR 90 1HE TYR 90 -12.585 13.290 0.166 726 HH TYR 90 HH TYR 90 -14.881 13.575 0.158 727 HA PRO 91 HA PRO 91 -7.885 8.548 6.383 728 HB2 PRO 91 2HB PRO 91 -8.984 7.447 8.075 729 HB3 PRO 91 1HB PRO 91 -8.181 6.026 7.411 730 HG2 PRO 91 1HG PRO 91 -10.040 5.383 6.173 731 HG3 PRO 91 2HG PRO 91 -10.824 6.097 7.631 732 HD2 PRO 91 1HD PRO 91 -11.429 6.890 5.106 733 HD3 PRO 91 2HD PRO 91 -11.443 8.000 6.488 734 H LEU 92 H LEU 92 -6.530 8.533 4.553 735 HA LEU 92 HA LEU 92 -6.190 6.219 2.919 736 HB2 LEU 92 1HB LEU 92 -5.150 8.927 3.063 737 HB3 LEU 92 2HB LEU 92 -3.883 7.750 2.678 738 HG LEU 92 HG LEU 92 -6.082 7.151 1.012 739 HD11 LEU 92 1HD1 LEU 92 -5.685 10.051 1.468 740 HD12 LEU 92 2HD1 LEU 92 -7.136 9.161 1.007 741 HD13 LEU 92 3HD1 LEU 92 -5.895 9.507 -0.197 742 HD21 LEU 92 3HD2 LEU 92 -4.288 8.336 -0.620 743 HD22 LEU 92 1HD2 LEU 92 -4.128 6.690 -0.008 744 HD23 LEU 92 2HD2 LEU 92 -3.275 8.013 0.789 745 H CYS 93 H CYS 93 -5.007 4.465 3.286 746 HA CYS 93 HA CYS 93 -2.896 4.598 5.336 747 HB2 CYS 93 1HB CYS 93 -4.856 2.357 4.813 748 HB3 CYS 93 2HB CYS 93 -3.472 2.237 5.911 749 HG CYS 93 HG CYS 93 -6.243 4.193 6.321 750 H PHE 94 H PHE 94 -1.328 2.729 5.135 751 HA PHE 94 HA PHE 94 -0.752 2.277 2.284 752 HB2 PHE 94 1HB PHE 94 0.895 3.681 3.512 753 HB3 PHE 94 2HB PHE 94 1.197 2.323 4.597 754 HD1 PHE 94 1HD PHE 94 1.499 3.442 1.092 755 HD2 PHE 94 2HD PHE 94 2.644 0.560 4.007 756 HE1 PHE 94 1HE PHE 94 3.209 2.570 -0.446 757 HE2 PHE 94 2HE PHE 94 4.356 -0.317 2.474 758 HZ PHE 94 HZ PHE 94 4.641 0.689 0.243 759 H ILE 95 H ILE 95 -1.531 0.307 1.804 760 HA ILE 95 HA ILE 95 -1.186 -1.892 3.692 761 HB ILE 95 HB ILE 95 -2.627 -1.833 1.038 762 HG12 ILE 95 1HG1 ILE 95 -3.692 -1.770 3.874 763 HG13 ILE 95 2HG1 ILE 95 -3.669 -0.398 2.754 764 HG21 ILE 95 1HG2 ILE 95 -3.093 -4.021 1.259 765 HG22 ILE 95 2HG2 ILE 95 -1.659 -4.034 2.284 766 HG23 ILE 95 3HG2 ILE 95 -3.262 -3.914 3.011 767 HD11 ILE 95 3HD1 ILE 95 -5.175 -2.954 2.263 768 HD12 ILE 95 1HD1 ILE 95 -5.879 -1.479 2.926 769 HD13 ILE 95 2HD1 ILE 95 -5.224 -1.485 1.288 770 H PHE 96 H PHE 96 0.651 -2.993 3.614 771 HA PHE 96 HA PHE 96 2.121 -3.184 1.093 772 HB2 PHE 96 1HB PHE 96 3.426 -2.452 2.991 773 HB3 PHE 96 2HB PHE 96 2.903 -3.848 3.936 774 HD1 PHE 96 1HD PHE 96 3.555 -4.573 0.492 775 HD2 PHE 96 2HD PHE 96 5.373 -4.187 4.321 776 HE1 PHE 96 1HE PHE 96 5.493 -5.866 -0.302 777 HE2 PHE 96 2HE PHE 96 7.314 -5.477 3.534 778 HZ PHE 96 HZ PHE 96 7.377 -6.318 1.220 779 H SER 97 H SER 97 1.301 -4.791 -0.126 780 HA SER 97 HA SER 97 0.374 -7.262 1.021 781 HB2 SER 97 1HB SER 97 -0.631 -6.184 -1.025 782 HB3 SER 97 2HB SER 97 0.841 -6.638 -1.902 783 HG SER 97 HG SER 97 0.113 -8.597 -2.054 784 H SER 98 H SER 98 2.056 -8.327 1.983 785 HA SER 98 HA SER 98 4.183 -9.264 0.174 786 HB2 SER 98 1HB SER 98 4.788 -7.531 2.066 787 HB3 SER 98 2HB SER 98 4.711 -8.963 3.107 788 HG SER 98 HG SER 98 6.822 -8.492 2.171 789 HA PRO 99 HA PRO 99 2.043 -13.005 1.646 790 HB2 PRO 99 2HB PRO 99 1.362 -13.394 -0.513 791 HB3 PRO 99 1HB PRO 99 2.727 -14.509 -0.537 792 HG2 PRO 99 1HG PRO 99 4.141 -12.976 -1.561 793 HG3 PRO 99 2HG PRO 99 2.561 -12.550 -2.319 794 HD2 PRO 99 1HD PRO 99 4.128 -10.720 -1.068 795 HD3 PRO 99 2HD PRO 99 2.358 -10.637 -1.050 796 H VAL 100 H VAL 100 2.849 -15.187 2.094 797 HA VAL 100 HA VAL 100 5.726 -15.142 2.693 798 HB VAL 100 HB VAL 100 4.116 -15.441 4.592 799 HG11 VAL 100 1HG1 VAL 100 2.546 -17.026 4.608 800 HG12 VAL 100 2HG1 VAL 100 2.886 -17.234 2.890 801 HG13 VAL 100 3HG1 VAL 100 3.681 -18.267 4.077 802 HG21 VAL 100 3HG2 VAL 100 6.468 -16.982 3.956 803 HG22 VAL 100 1HG2 VAL 100 5.967 -16.281 5.495 804 HG23 VAL 100 2HG2 VAL 100 5.397 -17.884 5.028 805 H GLY 101 H GLY 101 4.244 -15.972 0.138 806 HA2 GLY 101 1HA GLY 101 5.294 -18.726 -0.029 807 HA3 GLY 101 2HA GLY 101 3.990 -18.097 -1.025 808 H CYS 102 H CYS 102 6.040 -15.606 -0.892 809 HA CYS 102 HA CYS 102 7.161 -16.234 -3.494 810 HB2 CYS 102 1HB CYS 102 6.108 -13.974 -2.551 811 HB3 CYS 102 2HB CYS 102 7.797 -13.675 -2.112 812 HG CYS 102 HG CYS 102 7.051 -14.586 -5.303 813 H LYS 103 H LYS 103 9.494 -14.989 -3.670 814 HA LYS 103 HA LYS 103 11.231 -16.638 -2.018 815 HB2 LYS 103 1HB LYS 103 12.186 -14.746 -4.150 816 HB3 LYS 103 2HB LYS 103 12.904 -16.272 -3.610 817 HG2 LYS 103 1HG LYS 103 11.877 -17.373 -5.232 818 HG3 LYS 103 2HG LYS 103 10.305 -16.811 -4.637 819 HD2 LYS 103 1HD LYS 103 10.663 -16.184 -6.986 820 HD3 LYS 103 2HD LYS 103 10.515 -14.763 -5.936 821 HE2 LYS 103 1HE LYS 103 12.398 -14.049 -6.935 822 HE3 LYS 103 2HE LYS 103 13.209 -15.221 -5.885 823 HZ1 LYS 103 3HZ LYS 103 12.559 -16.815 -7.877 824 HZ2 LYS 103 1HZ LYS 103 13.995 -15.921 -7.870 825 HZ3 LYS 103 2HZ LYS 103 12.658 -15.366 -8.744 826 HA PRO 104 HA PRO 104 12.492 -13.448 0.729 827 HB2 PRO 104 2HB PRO 104 13.592 -15.083 1.910 828 HB3 PRO 104 1HB PRO 104 15.039 -14.274 1.308 829 HG2 PRO 104 1HG PRO 104 15.308 -15.766 -0.455 830 HG3 PRO 104 2HG PRO 104 14.638 -16.851 0.820 831 HD2 PRO 104 1HD PRO 104 13.537 -16.638 -1.652 832 HD3 PRO 104 2HD PRO 104 12.570 -16.929 -0.195 833 H GLU 105 H GLU 105 13.946 -13.913 -2.309 834 HA GLU 105 HA GLU 105 15.929 -11.843 -2.093 835 HB2 GLU 105 1HB GLU 105 14.822 -13.467 -4.375 836 HB3 GLU 105 2HB GLU 105 15.938 -12.121 -4.655 837 HG2 GLU 105 1HG GLU 105 16.664 -14.273 -2.708 838 HG3 GLU 105 2HG GLU 105 16.846 -14.544 -4.448 839 H GLN 106 H GLN 106 12.596 -12.068 -3.088 840 HA GLN 106 HA GLN 106 12.617 -9.359 -4.167 841 HB2 GLN 106 1HB GLN 106 10.161 -11.068 -3.868 842 HB3 GLN 106 2HB GLN 106 10.504 -9.808 -5.064 843 HG2 GLN 106 1HG GLN 106 11.930 -12.463 -4.950 844 HG3 GLN 106 2HG GLN 106 10.526 -12.120 -5.971 845 HE21 GLN 106 2HE2 GLN 106 12.398 -9.720 -7.971 846 HE22 GLN 106 1HE2 GLN 106 10.929 -9.778 -7.064 847 H GLN 107 H GLN 107 10.683 -11.163 -1.769 848 HA GLN 107 HA GLN 107 9.202 -9.261 -0.611 849 HB2 GLN 107 1HB GLN 107 10.228 -11.763 0.197 850 HB3 GLN 107 2HB GLN 107 10.519 -10.644 1.539 851 HG2 GLN 107 1HG GLN 107 7.868 -10.237 0.546 852 HG3 GLN 107 2HG GLN 107 8.126 -11.958 0.860 853 HE21 GLN 107 2HE2 GLN 107 8.661 -9.408 4.022 854 HE22 GLN 107 1HE2 GLN 107 9.216 -8.975 2.445 855 H MET 108 H MET 108 12.684 -9.579 -0.253 856 HA MET 108 HA MET 108 12.947 -7.590 1.771 857 HB2 MET 108 1HB MET 108 14.861 -8.969 -0.095 858 HB3 MET 108 2HB MET 108 15.398 -7.623 0.923 859 HG2 MET 108 1HG MET 108 14.246 -9.065 2.826 860 HG3 MET 108 2HG MET 108 14.585 -10.370 1.686 861 HE1 MET 108 3HE MET 108 17.782 -10.907 1.117 862 HE2 MET 108 1HE MET 108 16.751 -9.797 0.214 863 HE3 MET 108 2HE MET 108 18.276 -9.229 0.893 864 H MET 109 H MET 109 13.355 -7.587 -1.754 865 HA MET 109 HA MET 109 14.337 -5.082 -2.202 866 HB2 MET 109 1HB MET 109 12.285 -6.684 -3.720 867 HB3 MET 109 2HB MET 109 12.862 -5.118 -4.307 868 HG2 MET 109 1HG MET 109 15.121 -5.924 -4.464 869 HG3 MET 109 2HG MET 109 14.664 -7.445 -3.695 870 HE1 MET 109 3HE MET 109 13.580 -5.041 -6.303 871 HE2 MET 109 1HE MET 109 13.631 -5.923 -7.829 872 HE3 MET 109 2HE MET 109 12.192 -6.004 -6.813 873 H TYR 110 H TYR 110 11.062 -5.959 -1.291 874 HA TYR 110 HA TYR 110 10.180 -3.186 -1.494 875 HB2 TYR 110 1HB TYR 110 8.586 -5.596 -0.590 876 HB3 TYR 110 2HB TYR 110 7.956 -4.023 -1.087 877 HD1 TYR 110 2HD TYR 110 9.814 -6.971 -2.387 878 HD2 TYR 110 1HD TYR 110 7.383 -3.605 -3.316 879 HE1 TYR 110 2HE TYR 110 9.617 -7.762 -4.708 880 HE2 TYR 110 1HE TYR 110 7.179 -4.387 -5.639 881 HH TYR 110 HH TYR 110 9.098 -6.404 -7.076 882 H ALA 111 H ALA 111 10.862 -5.656 0.907 883 HA ALA 111 HA ALA 111 9.806 -4.354 3.160 884 HB1 ALA 111 3HB ALA 111 12.057 -5.812 4.000 885 HB2 ALA 111 1HB ALA 111 10.367 -6.317 4.026 886 HB3 ALA 111 2HB ALA 111 11.378 -6.685 2.628 887 H GLY 112 H GLY 112 12.783 -3.918 1.399 888 HA2 GLY 112 1HA GLY 112 13.940 -2.251 3.492 889 HA3 GLY 112 2HA GLY 112 14.699 -2.689 1.969 890 H SER 113 H SER 113 12.457 -1.893 0.323 891 HA SER 113 HA SER 113 12.991 0.970 0.308 892 HB2 SER 113 1HB SER 113 11.370 -0.588 -1.718 893 HB3 SER 113 2HB SER 113 12.180 0.973 -1.933 894 HG SER 113 HG SER 113 13.712 -1.269 -1.233 895 H LYS 114 H LYS 114 10.773 -0.983 1.725 896 HA LYS 114 HA LYS 114 8.284 0.131 1.183 897 HB2 LYS 114 1HB LYS 114 8.483 -1.883 2.493 898 HB3 LYS 114 2HB LYS 114 9.375 -1.019 3.756 899 HG2 LYS 114 1HG LYS 114 7.470 0.140 4.486 900 HG3 LYS 114 2HG LYS 114 6.570 -0.262 3.012 901 HD2 LYS 114 1HD LYS 114 5.641 -1.761 4.487 902 HD3 LYS 114 2HD LYS 114 6.964 -2.732 3.816 903 HE2 LYS 114 1HE LYS 114 8.381 -2.162 5.731 904 HE3 LYS 114 2HE LYS 114 7.080 -1.163 6.392 905 HZ1 LYS 114 3HZ LYS 114 5.836 -2.985 6.962 906 HZ2 LYS 114 1HZ LYS 114 7.397 -3.589 7.209 907 HZ3 LYS 114 2HZ LYS 114 6.548 -3.992 5.803 908 H ASN 115 H ASN 115 10.227 0.874 4.083 909 HA ASN 115 HA ASN 115 8.837 3.085 4.933 910 HB2 ASN 115 1HB ASN 115 11.540 2.007 5.336 911 HB3 ASN 115 2HB ASN 115 11.432 3.757 5.566 912 HD21 ASN 115 2HD2 ASN 115 10.038 1.253 8.357 913 HD22 ASN 115 1HD2 ASN 115 10.880 0.732 6.941 914 H ARG 116 H ARG 116 11.349 2.902 2.468 915 HA ARG 116 HA ARG 116 11.722 5.666 2.099 916 HB2 ARG 116 1HB ARG 116 13.341 4.153 1.210 917 HB3 ARG 116 2HB ARG 116 12.113 3.320 0.244 918 HG2 ARG 116 1HG ARG 116 13.177 4.603 -1.346 919 HG3 ARG 116 2HG ARG 116 11.802 5.626 -0.898 920 HD2 ARG 116 1HD ARG 116 13.194 7.267 -0.326 921 HD3 ARG 116 2HD ARG 116 13.920 6.208 0.892 922 HE ARG 116 HE ARG 116 15.140 5.424 -1.388 923 HH11 ARG 116 2HH1 ARG 116 14.650 8.529 0.109 924 HH12 ARG 116 1HH1 ARG 116 16.112 9.210 -0.522 925 HH21 ARG 116 1HH2 ARG 116 17.487 7.948 -1.852 926 HH22 ARG 116 2HH2 ARG 116 17.068 6.310 -2.226 927 H LEU 117 H LEU 117 9.607 3.352 0.424 928 HA LEU 117 HA LEU 117 8.472 5.251 -1.342 929 HB2 LEU 117 1HB LEU 117 8.462 2.787 -1.683 930 HB3 LEU 117 2HB LEU 117 7.275 2.659 -0.373 931 HG LEU 117 HG LEU 117 6.404 2.550 -2.765 932 HD11 LEU 117 1HD1 LEU 117 5.268 3.387 -0.440 933 HD12 LEU 117 2HD1 LEU 117 4.400 3.132 -1.953 934 HD13 LEU 117 3HD1 LEU 117 4.939 4.752 -1.507 935 HD21 LEU 117 3HD2 LEU 117 7.737 4.401 -3.655 936 HD22 LEU 117 1HD2 LEU 117 6.891 5.522 -2.588 937 HD23 LEU 117 2HD2 LEU 117 6.009 4.687 -3.866 938 H VAL 118 H VAL 118 7.294 3.831 1.700 939 HA VAL 118 HA VAL 118 4.856 5.183 1.832 940 HB VAL 118 HB VAL 118 6.649 4.161 4.032 941 HG11 VAL 118 1HG1 VAL 118 4.222 5.793 4.182 942 HG12 VAL 118 2HG1 VAL 118 4.164 4.315 5.143 943 HG13 VAL 118 3HG1 VAL 118 5.460 5.485 5.399 944 HG21 VAL 118 3HG2 VAL 118 5.864 2.241 3.146 945 HG22 VAL 118 1HG2 VAL 118 4.414 2.642 4.066 946 HG23 VAL 118 2HG2 VAL 118 4.508 3.039 2.350 947 H GLN 119 H GLN 119 7.951 6.043 3.383 948 HA GLN 119 HA GLN 119 7.219 8.396 4.597 949 HB2 GLN 119 1HB GLN 119 9.779 7.410 3.403 950 HB3 GLN 119 2HB GLN 119 9.683 9.087 3.960 951 HG2 GLN 119 1HG GLN 119 8.616 7.713 6.080 952 HG3 GLN 119 2HG GLN 119 9.872 6.615 5.490 953 HE21 GLN 119 2HE2 GLN 119 12.570 8.733 6.319 954 HE22 GLN 119 1HE2 GLN 119 12.039 7.489 5.244 955 H THR 120 H THR 120 7.990 7.837 1.213 956 HA THR 120 HA THR 120 8.118 10.541 0.412 957 HB THR 120 HB THR 120 7.228 8.246 -1.335 958 HG1 THR 120 1HG THR 120 9.853 9.043 -0.564 959 HG21 THR 120 3HG2 THR 120 7.879 11.025 -1.779 960 HG22 THR 120 1HG2 THR 120 7.203 9.841 -2.897 961 HG23 THR 120 2HG2 THR 120 8.951 9.970 -2.698 962 H ALA 121 H ALA 121 5.452 8.204 0.478 963 HA ALA 121 HA ALA 121 3.537 9.961 -0.678 964 HB1 ALA 121 3HB ALA 121 3.514 7.368 -0.447 965 HB2 ALA 121 1HB ALA 121 2.752 7.701 1.109 966 HB3 ALA 121 2HB ALA 121 2.000 8.269 -0.382 967 H GLU 122 H GLU 122 4.775 9.523 2.520 968 HA GLU 122 HA GLU 122 4.487 10.784 4.404 969 HB2 GLU 122 1HB GLU 122 3.478 12.442 2.360 970 HB3 GLU 122 2HB GLU 122 2.268 12.459 3.652 971 HG2 GLU 122 1HG GLU 122 3.558 13.652 5.039 972 HG3 GLU 122 2HG GLU 122 5.022 12.766 4.587 973 H LEU 123 H LEU 123 3.087 8.349 3.899 974 HA LEU 123 HA LEU 123 0.433 8.726 5.037 975 HB2 LEU 123 1HB LEU 123 1.839 6.174 4.233 976 HB3 LEU 123 2HB LEU 123 0.125 6.357 4.641 977 HG LEU 123 HG LEU 123 1.210 7.927 2.355 978 HD11 LEU 123 1HD1 LEU 123 0.197 5.231 1.723 979 HD12 LEU 123 2HD1 LEU 123 1.826 5.316 2.391 980 HD13 LEU 123 3HD1 LEU 123 1.431 6.202 0.919 981 HD21 LEU 123 3HD2 LEU 123 -1.115 8.181 3.190 982 HD22 LEU 123 1HD2 LEU 123 -1.407 6.493 2.774 983 HD23 LEU 123 2HD2 LEU 123 -1.021 7.658 1.508 984 H THR 124 H THR 124 0.644 9.242 7.162 985 HA THR 124 HA THR 124 2.542 8.231 8.947 986 HB THR 124 HB THR 124 1.237 10.223 9.467 987 HG1 THR 124 1HG THR 124 2.061 9.094 11.249 988 HG21 THR 124 3HG2 THR 124 -1.059 10.255 9.844 989 HG22 THR 124 1HG2 THR 124 -1.144 8.512 10.096 990 HG23 THR 124 2HG2 THR 124 -0.908 9.159 8.471 991 H LYS 125 H LYS 125 -0.300 6.794 7.659 992 HA LYS 125 HA LYS 125 -0.335 4.730 9.741 993 HB2 LYS 125 1HB LYS 125 -2.262 5.067 7.435 994 HB3 LYS 125 2HB LYS 125 -2.479 4.076 8.885 995 HG2 LYS 125 1HG LYS 125 -2.340 6.266 10.201 996 HG3 LYS 125 2HG LYS 125 -2.572 7.062 8.634 997 HD2 LYS 125 1HD LYS 125 -4.470 4.890 9.071 998 HD3 LYS 125 2HD LYS 125 -4.570 6.151 10.313 999 HE2 LYS 125 1HE LYS 125 -4.532 6.795 7.364 1000 HE3 LYS 125 2HE LYS 125 -6.028 6.451 8.245 1001 HZ1 LYS 125 3HZ LYS 125 -5.917 8.392 9.389 1002 HZ2 LYS 125 1HZ LYS 125 -5.092 8.885 7.997 1003 HZ3 LYS 125 2HZ LYS 125 -4.226 8.452 9.384 1004 H VAL 126 H VAL 126 0.872 2.993 9.408 1005 HA VAL 126 HA VAL 126 1.157 1.986 6.652 1006 HB VAL 126 HB VAL 126 3.267 1.719 8.793 1007 HG11 VAL 126 1HG1 VAL 126 3.266 1.203 5.823 1008 HG12 VAL 126 2HG1 VAL 126 4.702 1.159 6.847 1009 HG13 VAL 126 3HG1 VAL 126 3.394 0.005 7.111 1010 HG21 VAL 126 3HG2 VAL 126 3.349 3.995 8.432 1011 HG22 VAL 126 1HG2 VAL 126 4.459 3.406 7.195 1012 HG23 VAL 126 2HG2 VAL 126 2.812 3.857 6.758 1013 H PHE 127 H PHE 127 -0.031 0.196 6.516 1014 HA PHE 127 HA PHE 127 0.012 -1.689 8.778 1015 HB2 PHE 127 1HB PHE 127 -2.087 -1.350 6.618 1016 HB3 PHE 127 2HB PHE 127 -2.146 -2.534 7.925 1017 HD1 PHE 127 2HD PHE 127 -1.169 -0.855 10.187 1018 HD2 PHE 127 1HD PHE 127 -3.970 -0.033 7.089 1019 HE1 PHE 127 2HE PHE 127 -2.301 0.773 11.645 1020 HE2 PHE 127 1HE PHE 127 -5.104 1.597 8.541 1021 HZ PHE 127 HZ PHE 127 -4.270 2.001 10.824 1022 H GLU 128 H GLU 128 1.300 -3.366 8.433 1023 HA GLU 128 HA GLU 128 1.847 -4.232 5.696 1024 HB2 GLU 128 1HB GLU 128 3.760 -3.819 7.179 1025 HB3 GLU 128 2HB GLU 128 3.148 -5.043 8.303 1026 HG2 GLU 128 1HG GLU 128 3.475 -6.019 5.562 1027 HG3 GLU 128 2HG GLU 128 4.976 -5.484 6.331 1028 H ILE 129 H ILE 129 0.559 -5.738 4.881 1029 HA ILE 129 HA ILE 129 -0.726 -7.669 6.664 1030 HB ILE 129 HB ILE 129 -2.027 -8.297 4.598 1031 HG12 ILE 129 1HG1 ILE 129 -1.103 -5.697 3.423 1032 HG13 ILE 129 2HG1 ILE 129 -0.156 -7.168 3.139 1033 HG21 ILE 129 1HG2 ILE 129 -3.114 -6.925 6.167 1034 HG22 ILE 129 2HG2 ILE 129 -2.135 -5.522 5.741 1035 HG23 ILE 129 3HG2 ILE 129 -3.348 -6.125 4.612 1036 HD11 ILE 129 3HD1 ILE 129 -3.089 -7.149 2.583 1037 HD12 ILE 129 1HD1 ILE 129 -1.947 -6.482 1.418 1038 HD13 ILE 129 2HD1 ILE 129 -1.826 -8.174 1.903 1039 H ARG 130 H ARG 130 -0.218 -9.775 6.711 1040 HA ARG 130 HA ARG 130 2.118 -10.674 5.303 1041 HB2 ARG 130 1HB ARG 130 1.732 -11.363 7.608 1042 HB3 ARG 130 2HB ARG 130 0.217 -12.146 7.134 1043 HG2 ARG 130 1HG ARG 130 1.836 -13.861 7.385 1044 HG3 ARG 130 2HG ARG 130 1.556 -13.650 5.648 1045 HD2 ARG 130 1HD ARG 130 3.877 -13.781 5.778 1046 HD3 ARG 130 2HD ARG 130 3.571 -12.038 5.746 1047 HE ARG 130 HE ARG 130 3.629 -12.725 8.409 1048 HH11 ARG 130 2HH1 ARG 130 5.807 -12.930 5.702 1049 HH12 ARG 130 1HH1 ARG 130 7.235 -12.787 6.672 1050 HH21 ARG 130 1HH2 ARG 130 7.060 -12.565 8.946 1051 HH22 ARG 130 2HH2 ARG 130 5.501 -12.536 9.698 1052 H THR 131 H THR 131 -1.232 -10.698 4.701 1053 HA THR 131 HA THR 131 -0.862 -12.102 2.222 1054 HB THR 131 HB THR 131 -1.144 -14.089 3.467 1055 HG1 THR 131 1HG THR 131 -3.588 -14.478 2.946 1056 HG21 THR 131 3HG2 THR 131 -2.479 -14.393 5.308 1057 HG22 THR 131 1HG2 THR 131 -3.678 -13.219 4.770 1058 HG23 THR 131 2HG2 THR 131 -2.149 -12.667 5.454 1059 H THR 132 H THR 132 -2.777 -12.052 0.869 1060 HA THR 132 HA THR 132 -4.151 -9.598 1.022 1061 HB THR 132 HB THR 132 -5.566 -10.523 -0.836 1062 HG1 THR 132 1HG THR 132 -4.638 -12.603 -1.663 1063 HG21 THR 132 3HG2 THR 132 -3.211 -9.458 -1.045 1064 HG22 THR 132 1HG2 THR 132 -3.891 -10.302 -2.435 1065 HG23 THR 132 2HG2 THR 132 -2.684 -11.097 -1.426 1066 H ASP 133 H ASP 133 -5.142 -12.913 1.780 1067 HA ASP 133 HA ASP 133 -7.813 -12.693 2.181 1068 HB2 ASP 133 1HB ASP 133 -5.683 -14.352 3.263 1069 HB3 ASP 133 2HB ASP 133 -6.981 -14.106 4.440 1070 H ASP 134 H ASP 134 -5.285 -11.364 4.210 1071 HA ASP 134 HA ASP 134 -6.873 -10.689 6.437 1072 HB2 ASP 134 1HB ASP 134 -4.180 -10.444 5.706 1073 HB3 ASP 134 2HB ASP 134 -4.737 -8.787 5.973 1074 H LEU 135 H LEU 135 -5.971 -8.850 3.540 1075 HA LEU 135 HA LEU 135 -7.164 -6.422 4.222 1076 HB2 LEU 135 1HB LEU 135 -5.735 -6.379 2.380 1077 HB3 LEU 135 2HB LEU 135 -6.547 -7.755 1.613 1078 HG LEU 135 HG LEU 135 -8.318 -6.426 0.839 1079 HD11 LEU 135 1HD1 LEU 135 -9.140 -5.015 2.379 1080 HD12 LEU 135 2HD1 LEU 135 -8.072 -3.843 1.609 1081 HD13 LEU 135 3HD1 LEU 135 -7.553 -4.680 3.072 1082 HD21 LEU 135 3HD2 LEU 135 -6.661 -5.948 -0.659 1083 HD22 LEU 135 1HD2 LEU 135 -5.620 -5.211 0.559 1084 HD23 LEU 135 2HD2 LEU 135 -7.007 -4.322 -0.070 1085 H THR 136 H THR 136 -9.161 -6.750 5.197 1086 HA THR 136 HA THR 136 -11.332 -7.414 3.329 1087 HB THR 136 HB THR 136 -12.489 -8.276 5.560 1088 HG1 THR 136 1HG THR 136 -9.865 -9.209 6.018 1089 HG21 THR 136 3HG2 THR 136 -12.128 -9.543 3.448 1090 HG22 THR 136 1HG2 THR 136 -11.967 -10.535 4.897 1091 HG23 THR 136 2HG2 THR 136 -10.527 -9.991 4.036 1092 H GLU 137 H GLU 137 -13.351 -6.402 3.777 1093 HA GLU 137 HA GLU 137 -13.332 -3.747 4.333 1094 HB2 GLU 137 1HB GLU 137 -15.265 -4.907 3.384 1095 HB3 GLU 137 2HB GLU 137 -15.584 -5.668 4.951 1096 HG2 GLU 137 1HG GLU 137 -15.592 -3.076 5.688 1097 HG3 GLU 137 2HG GLU 137 -16.163 -2.938 4.018 1098 H THR 138 H THR 138 -13.596 -6.369 6.661 1099 HA THR 138 HA THR 138 -14.051 -4.610 8.895 1100 HB THR 138 HB THR 138 -13.158 -7.480 9.095 1101 HG1 THR 138 1HG THR 138 -15.793 -6.485 8.647 1102 HG21 THR 138 3HG2 THR 138 -14.473 -7.442 11.151 1103 HG22 THR 138 1HG2 THR 138 -14.942 -5.773 10.835 1104 HG23 THR 138 2HG2 THR 138 -13.256 -6.166 11.170 1105 H TRP 139 H TRP 139 -11.427 -6.946 8.266 1106 HA TRP 139 HA TRP 139 -9.618 -6.143 10.127 1107 HB2 TRP 139 1HB TRP 139 -8.996 -8.014 8.878 1108 HB3 TRP 139 2HB TRP 139 -9.260 -7.192 7.339 1109 HD1 TRP 139 HD TRP 139 -6.557 -8.006 9.782 1110 HE1 TRP 139 1HE TRP 139 -4.341 -6.928 9.035 1111 HE3 TRP 139 3HE TRP 139 -8.351 -4.915 6.125 1112 HZ2 TRP 139 2HZ TRP 139 -3.471 -5.020 7.146 1113 HZ3 TRP 139 3HZ TRP 139 -6.760 -3.497 4.896 1114 HH2 TRP 139 HH TRP 139 -4.372 -3.548 5.398 1115 H LEU 140 H LEU 140 -10.605 -4.393 7.318 1116 HA LEU 140 HA LEU 140 -8.356 -2.569 7.388 1117 HB2 LEU 140 1HB LEU 140 -9.206 -3.027 5.228 1118 HB3 LEU 140 2HB LEU 140 -10.870 -2.714 5.749 1119 HG LEU 140 HG LEU 140 -9.716 -0.972 4.265 1120 HD11 LEU 140 1HD1 LEU 140 -11.130 0.627 5.067 1121 HD12 LEU 140 2HD1 LEU 140 -10.724 0.304 6.752 1122 HD13 LEU 140 3HD1 LEU 140 -11.794 -0.791 5.878 1123 HD21 LEU 140 3HD2 LEU 140 -8.164 0.482 5.167 1124 HD22 LEU 140 1HD2 LEU 140 -7.652 -1.066 5.840 1125 HD23 LEU 140 2HD2 LEU 140 -8.580 0.063 6.829 1126 H LYS 141 H LYS 141 -11.889 -2.195 7.735 1127 HA LYS 141 HA LYS 141 -11.857 0.418 8.701 1128 HB2 LYS 141 1HB LYS 141 -13.776 -1.807 8.605 1129 HB3 LYS 141 2HB LYS 141 -14.049 -0.673 9.937 1130 HG2 LYS 141 1HG LYS 141 -14.718 0.996 8.581 1131 HG3 LYS 141 2HG LYS 141 -13.563 0.558 7.310 1132 HD2 LYS 141 1HD LYS 141 -15.293 -0.277 6.170 1133 HD3 LYS 141 2HD LYS 141 -15.327 -1.581 7.370 1134 HE2 LYS 141 1HE LYS 141 -16.724 1.005 7.961 1135 HE3 LYS 141 2HE LYS 141 -17.480 -0.179 6.883 1136 HZ1 LYS 141 3HZ LYS 141 -17.165 -0.250 9.736 1137 HZ2 LYS 141 1HZ LYS 141 -16.683 -1.688 8.987 1138 HZ3 LYS 141 2HZ LYS 141 -18.247 -1.093 8.748 1139 H GLU 142 H GLU 142 -11.132 -2.572 10.288 1140 HA GLU 142 HA GLU 142 -11.526 -1.716 12.963 1141 HB2 GLU 142 1HB GLU 142 -10.136 -3.987 11.619 1142 HB3 GLU 142 2HB GLU 142 -9.722 -3.641 13.306 1143 HG2 GLU 142 1HG GLU 142 -12.355 -3.621 13.580 1144 HG3 GLU 142 2HG GLU 142 -12.257 -4.651 12.144 1145 H LYS 143 H LYS 143 -8.733 -1.713 10.798 1146 HA LYS 143 HA LYS 143 -6.855 -0.808 12.717 1147 HB2 LYS 143 1HB LYS 143 -6.821 -0.532 9.700 1148 HB3 LYS 143 2HB LYS 143 -5.433 -0.289 10.774 1149 HG2 LYS 143 1HG LYS 143 -6.794 -2.891 11.043 1150 HG3 LYS 143 2HG LYS 143 -5.975 -2.600 9.497 1151 HD2 LYS 143 1HD LYS 143 -4.114 -1.699 11.299 1152 HD3 LYS 143 2HD LYS 143 -4.850 -3.061 12.162 1153 HE2 LYS 143 1HE LYS 143 -4.287 -4.598 10.455 1154 HE3 LYS 143 2HE LYS 143 -3.920 -3.298 9.314 1155 HZ1 LYS 143 3HZ LYS 143 -1.959 -4.460 10.353 1156 HZ2 LYS 143 1HZ LYS 143 -2.367 -3.692 11.804 1157 HZ3 LYS 143 2HZ LYS 143 -1.949 -2.771 10.449 1158 H LEU 144 H LEU 144 -9.004 0.840 10.467 1159 HA LEU 144 HA LEU 144 -7.922 3.440 10.903 1160 HB2 LEU 144 1HB LEU 144 -10.731 2.859 9.992 1161 HB3 LEU 144 2HB LEU 144 -9.704 4.250 9.602 1162 HG LEU 144 HG LEU 144 -9.201 1.440 8.627 1163 HD11 LEU 144 1HD1 LEU 144 -11.215 2.117 7.601 1164 HD12 LEU 144 2HD1 LEU 144 -9.943 2.432 6.422 1165 HD13 LEU 144 3HD1 LEU 144 -10.628 3.761 7.357 1166 HD21 LEU 144 3HD2 LEU 144 -7.909 3.038 6.919 1167 HD22 LEU 144 1HD2 LEU 144 -7.160 2.387 8.377 1168 HD23 LEU 144 2HD2 LEU 144 -7.798 4.031 8.373 1169 H ALA 145 H ALA 145 -10.874 1.819 12.060 1170 HA ALA 145 HA ALA 145 -12.048 3.717 13.580 1171 HB1 ALA 145 3HB ALA 145 -13.031 1.561 13.467 1172 HB2 ALA 145 1HB ALA 145 -11.636 0.811 14.245 1173 HB3 ALA 145 2HB ALA 145 -12.695 1.877 15.170 1174 H SER 146 H SER 146 -9.740 1.436 15.065 1175 HA SER 146 HA SER 146 -8.114 3.376 16.269 1176 HB2 SER 146 1HB SER 146 -10.543 3.404 17.495 1177 HB3 SER 146 2HB SER 146 -9.693 2.192 18.470 1178 HG SER 146 HG SER 146 -9.500 4.560 19.029 1179 H GLY 147 H GLY 147 -6.965 1.512 15.165 1180 HA2 GLY 147 1HA GLY 147 -5.613 -0.336 15.315 1181 HA3 GLY 147 2HA GLY 147 -5.597 -0.020 17.044 1182 HA PRO 148 HA PRO 148 -7.808 -4.067 15.994 1183 HB2 PRO 148 2HB PRO 148 -5.915 -5.241 15.431 1184 HB3 PRO 148 1HB PRO 148 -5.974 -5.767 17.112 1185 HG2 PRO 148 1HG PRO 148 -4.433 -4.175 17.810 1186 HG3 PRO 148 2HG PRO 148 -3.816 -4.554 16.159 1187 HD2 PRO 148 1HD PRO 148 -4.371 -2.024 16.969 1188 HD3 PRO 148 2HD PRO 148 -4.608 -2.567 15.300 1189 H SER 149 H SER 149 -9.424 -3.813 17.461 1190 HA SER 149 HA SER 149 -8.824 -3.699 20.303 1191 HB2 SER 149 1HB SER 149 -10.873 -2.670 18.671 1192 HB3 SER 149 2HB SER 149 -11.644 -3.890 19.700 1193 HG SER 149 HG SER 149 -10.237 -2.694 21.399 1194 H SER 150 H SER 150 -9.923 -5.113 21.832 1195 HA SER 150 HA SER 150 -9.397 -7.743 21.616 1196 HB2 SER 150 1HB SER 150 -11.798 -6.524 23.016 1197 HB3 SER 150 2HB SER 150 -11.188 -8.165 23.297 1198 HG SER 150 HG SER 150 -9.223 -7.249 23.999 1199 H GLY 151 H GLY 151 -10.155 -9.501 20.594 1200 HA2 GLY 151 1HA GLY 151 -11.618 -9.499 18.329 1201 HA3 GLY 151 2HA GLY 151 -11.609 -10.875 19.424 Start of MODEL 6 1 H1 GLY 1 H GLY 1 9.728 -24.683 16.916 2 HA2 GLY 1 1HA GLY 1 10.082 -23.967 14.389 3 HA3 GLY 1 2HA GLY 1 8.714 -22.946 14.801 4 H SER 2 H SER 2 12.036 -23.129 14.687 5 HA SER 2 HA SER 2 12.288 -20.826 16.507 6 HB2 SER 2 1HB SER 2 14.024 -23.253 16.195 7 HB3 SER 2 2HB SER 2 14.770 -21.710 16.648 8 HG SER 2 HG SER 2 14.186 -22.791 18.517 9 H SER 3 H SER 3 14.094 -19.368 15.977 10 HA SER 3 HA SER 3 15.175 -17.975 14.539 11 HB2 SER 3 1HB SER 3 15.542 -20.664 13.287 12 HB3 SER 3 2HB SER 3 15.971 -19.234 12.332 13 HG SER 3 HG SER 3 17.296 -18.583 14.132 14 H GLY 4 H GLY 4 14.792 -16.629 12.758 15 HA2 GLY 4 1HA GLY 4 12.256 -17.191 11.345 16 HA3 GLY 4 2HA GLY 4 12.746 -15.582 11.855 17 H SER 5 H SER 5 15.091 -15.053 10.983 18 HA SER 5 HA SER 5 16.294 -14.433 9.153 19 HB2 SER 5 1HB SER 5 15.815 -17.318 8.878 20 HB3 SER 5 2HB SER 5 16.147 -16.505 7.339 21 HG SER 5 HG SER 5 18.045 -17.250 8.497 22 H SER 6 H SER 6 15.423 -12.820 8.029 23 HA SER 6 HA SER 6 13.466 -13.481 5.943 24 HB2 SER 6 1HB SER 6 12.316 -12.504 7.963 25 HB3 SER 6 2HB SER 6 13.248 -11.022 7.692 26 HG SER 6 HG SER 6 11.085 -12.023 6.301 27 H GLY 7 H GLY 7 15.681 -11.018 7.231 28 HA2 GLY 7 1HA GLY 7 16.983 -10.673 4.731 29 HA3 GLY 7 2HA GLY 7 15.846 -9.363 5.010 30 H SER 8 H SER 8 18.966 -10.495 5.569 31 HA SER 8 HA SER 8 19.432 -8.324 7.500 32 HB2 SER 8 1HB SER 8 19.511 -10.753 8.429 33 HB3 SER 8 2HB SER 8 21.053 -10.856 7.562 34 HG SER 8 HG SER 8 20.345 -9.133 9.685 35 H ASP 9 H ASP 9 21.928 -7.928 7.642 36 HA ASP 9 HA ASP 9 23.751 -7.051 6.601 37 HB2 ASP 9 1HB ASP 9 23.229 -9.464 4.856 38 HB3 ASP 9 2HB ASP 9 24.638 -8.415 4.645 39 H SER 10 H SER 10 22.460 -5.166 6.073 40 HA SER 10 HA SER 10 21.652 -3.562 4.674 41 HB2 SER 10 1HB SER 10 24.003 -4.616 3.533 42 HB3 SER 10 2HB SER 10 22.849 -4.445 2.198 43 HG SER 10 HG SER 10 22.493 -2.248 3.142 44 H LEU 11 H LEU 11 20.563 -3.216 2.427 45 HA LEU 11 HA LEU 11 19.065 -5.568 1.563 46 HB2 LEU 11 1HB LEU 11 17.692 -3.001 2.372 47 HB3 LEU 11 2HB LEU 11 16.928 -4.497 1.806 48 HG LEU 11 HG LEU 11 18.557 -4.575 4.303 49 HD11 LEU 11 1HD1 LEU 11 15.737 -3.524 4.122 50 HD12 LEU 11 2HD1 LEU 11 17.165 -2.618 4.625 51 HD13 LEU 11 3HD1 LEU 11 16.576 -3.956 5.613 52 HD21 LEU 11 3HD2 LEU 11 16.159 -6.028 3.212 53 HD22 LEU 11 1HD2 LEU 11 16.706 -6.197 4.880 54 HD23 LEU 11 2HD2 LEU 11 17.765 -6.673 3.553 55 H VAL 12 H VAL 12 17.324 -4.562 -0.168 56 HA VAL 12 HA VAL 12 19.043 -3.347 -2.185 57 HB VAL 12 HB VAL 12 16.212 -4.207 -2.677 58 HG11 VAL 12 1HG1 VAL 12 17.452 -2.997 -4.429 59 HG12 VAL 12 2HG1 VAL 12 18.679 -4.265 -4.411 60 HG13 VAL 12 3HG1 VAL 12 17.031 -4.639 -4.913 61 HG21 VAL 12 3HG2 VAL 12 17.122 -6.097 -1.543 62 HG22 VAL 12 1HG2 VAL 12 17.143 -6.459 -3.270 63 HG23 VAL 12 2HG2 VAL 12 18.631 -5.989 -2.449 64 H VAL 13 H VAL 13 18.342 -1.589 -0.147 65 HA VAL 13 HA VAL 13 16.134 -0.038 -0.281 66 HB VAL 13 HB VAL 13 18.978 0.964 -0.095 67 HG11 VAL 13 1HG1 VAL 13 17.852 2.919 -0.513 68 HG12 VAL 13 2HG1 VAL 13 16.347 2.334 0.199 69 HG13 VAL 13 3HG1 VAL 13 17.686 2.818 1.239 70 HG21 VAL 13 3HG2 VAL 13 17.063 -0.231 1.825 71 HG22 VAL 13 1HG2 VAL 13 18.823 -0.332 1.764 72 HG23 VAL 13 2HG2 VAL 13 18.044 1.117 2.400 73 H CYS 14 H CYS 14 15.061 0.506 -2.078 74 HA CYS 14 HA CYS 14 16.551 1.499 -4.395 75 HB2 CYS 14 1HB CYS 14 13.700 0.578 -4.040 76 HB3 CYS 14 2HB CYS 14 14.299 1.306 -5.540 77 HG CYS 14 HG CYS 14 15.116 -1.724 -4.218 78 H GLU 15 H GLU 15 15.005 3.180 -5.663 79 HA GLU 15 HA GLU 15 14.548 5.365 -3.745 80 HB2 GLU 15 1HB GLU 15 15.169 6.923 -5.415 81 HB3 GLU 15 2HB GLU 15 16.373 5.626 -5.484 82 HG2 GLU 15 1HG GLU 15 14.701 4.670 -7.312 83 HG3 GLU 15 2HG GLU 15 14.289 6.386 -7.448 84 H VAL 16 H VAL 16 12.777 6.788 -4.092 85 HA VAL 16 HA VAL 16 10.427 5.432 -5.075 86 HB VAL 16 HB VAL 16 10.331 6.747 -3.001 87 HG11 VAL 16 1HG1 VAL 16 10.341 9.309 -4.496 88 HG12 VAL 16 2HG1 VAL 16 10.817 8.964 -2.832 89 HG13 VAL 16 3HG1 VAL 16 11.899 8.551 -4.164 90 HG21 VAL 16 3HG2 VAL 16 8.163 7.014 -3.410 91 HG22 VAL 16 1HG2 VAL 16 8.490 8.400 -4.451 92 HG23 VAL 16 2HG2 VAL 16 8.492 6.770 -5.125 93 H ASP 17 H ASP 17 10.404 5.336 -7.271 94 HA ASP 17 HA ASP 17 11.324 6.899 -9.212 95 HB2 ASP 17 1HB ASP 17 9.837 4.892 -9.504 96 HB3 ASP 17 2HB ASP 17 8.452 5.959 -9.237 97 HA PRO 18 HA PRO 18 9.792 10.998 -8.709 98 HB2 PRO 18 2HB PRO 18 11.543 11.650 -10.045 99 HB3 PRO 18 1HB PRO 18 10.276 11.931 -11.237 100 HG2 PRO 18 1HG PRO 18 10.612 9.884 -12.283 101 HG3 PRO 18 2HG PRO 18 12.293 10.297 -11.782 102 HD2 PRO 18 1HD PRO 18 11.108 7.944 -11.133 103 HD3 PRO 18 2HD PRO 18 12.265 8.759 -10.066 104 H GLU 19 H GLU 19 8.652 8.966 -11.347 105 HA GLU 19 HA GLU 19 6.452 10.638 -12.060 106 HB2 GLU 19 1HB GLU 19 5.958 9.081 -13.661 107 HB3 GLU 19 2HB GLU 19 7.658 8.681 -13.368 108 HG2 GLU 19 1HG GLU 19 6.961 6.586 -13.095 109 HG3 GLU 19 2HG GLU 19 6.369 7.132 -11.519 110 H LEU 20 H LEU 20 6.988 8.194 -9.667 111 HA LEU 20 HA LEU 20 4.155 7.831 -9.138 112 HB2 LEU 20 1HB LEU 20 6.206 6.130 -8.927 113 HB3 LEU 20 2HB LEU 20 6.218 6.791 -7.282 114 HG LEU 20 HG LEU 20 3.843 5.463 -8.585 115 HD11 LEU 20 1HD1 LEU 20 4.727 3.510 -8.030 116 HD12 LEU 20 2HD1 LEU 20 4.844 4.033 -6.350 117 HD13 LEU 20 3HD1 LEU 20 6.185 4.322 -7.459 118 HD21 LEU 20 3HD2 LEU 20 2.981 6.903 -6.972 119 HD22 LEU 20 1HD2 LEU 20 4.345 6.653 -5.880 120 HD23 LEU 20 2HD2 LEU 20 3.151 5.375 -6.108 121 H LYS 21 H LYS 21 6.964 9.384 -7.689 122 HA LYS 21 HA LYS 21 6.116 10.042 -5.191 123 HB2 LYS 21 1HB LYS 21 8.295 10.677 -6.319 124 HB3 LYS 21 2HB LYS 21 7.427 12.052 -7.020 125 HG2 LYS 21 1HG LYS 21 6.786 12.358 -4.408 126 HG3 LYS 21 2HG LYS 21 8.398 11.632 -4.280 127 HD2 LYS 21 1HD LYS 21 8.260 13.718 -6.319 128 HD3 LYS 21 2HD LYS 21 7.853 14.303 -4.696 129 HE2 LYS 21 1HE LYS 21 10.037 12.771 -4.152 130 HE3 LYS 21 2HE LYS 21 10.420 13.356 -5.777 131 HZ1 LYS 21 3HZ LYS 21 9.478 15.268 -3.754 132 HZ2 LYS 21 1HZ LYS 21 10.490 15.527 -5.086 133 HZ3 LYS 21 2HZ LYS 21 11.086 14.745 -3.710 134 H GLU 22 H GLU 22 5.256 11.728 -8.194 135 HA GLU 22 HA GLU 22 3.680 13.729 -6.969 136 HB2 GLU 22 1HB GLU 22 3.197 12.688 -9.753 137 HB3 GLU 22 2HB GLU 22 3.005 14.338 -9.139 138 HG2 GLU 22 1HG GLU 22 5.602 14.134 -8.725 139 HG3 GLU 22 2HG GLU 22 5.463 12.909 -9.994 140 H THR 23 H THR 23 2.844 10.615 -8.448 141 HA THR 23 HA THR 23 0.115 10.675 -8.368 142 HB THR 23 HB THR 23 2.030 8.415 -7.866 143 HG1 THR 23 1HG THR 23 0.746 7.817 -9.914 144 HG21 THR 23 3HG2 THR 23 0.338 7.434 -6.710 145 HG22 THR 23 1HG2 THR 23 -0.251 7.086 -8.335 146 HG23 THR 23 2HG2 THR 23 -0.899 8.459 -7.437 147 H LEU 24 H LEU 24 2.259 9.724 -5.691 148 HA LEU 24 HA LEU 24 0.235 9.206 -3.818 149 HB2 LEU 24 1HB LEU 24 2.968 10.275 -3.133 150 HB3 LEU 24 2HB LEU 24 1.931 9.206 -2.173 151 HG LEU 24 HG LEU 24 3.339 8.446 -4.732 152 HD11 LEU 24 1HD1 LEU 24 5.087 7.786 -3.525 153 HD12 LEU 24 2HD1 LEU 24 4.059 7.016 -2.316 154 HD13 LEU 24 3HD1 LEU 24 4.415 8.739 -2.203 155 HD21 LEU 24 3HD2 LEU 24 2.215 6.511 -4.729 156 HD22 LEU 24 1HD2 LEU 24 1.054 7.350 -3.699 157 HD23 LEU 24 2HD2 LEU 24 2.311 6.349 -2.975 158 H ARG 25 H ARG 25 2.251 12.118 -4.231 159 HA ARG 25 HA ARG 25 1.148 13.700 -2.263 160 HB2 ARG 25 1HB ARG 25 3.126 14.300 -3.621 161 HB3 ARG 25 2HB ARG 25 2.058 14.619 -4.995 162 HG2 ARG 25 1HG ARG 25 0.958 16.413 -3.755 163 HG3 ARG 25 2HG ARG 25 2.014 16.094 -2.371 164 HD2 ARG 25 1HD ARG 25 3.580 16.438 -4.775 165 HD3 ARG 25 2HD ARG 25 2.503 17.817 -4.521 166 HE ARG 25 HE ARG 25 4.844 17.243 -3.063 167 HH11 ARG 25 2HH1 ARG 25 1.582 18.373 -2.614 168 HH12 ARG 25 1HH1 ARG 25 1.960 19.305 -1.203 169 HH21 ARG 25 1HH2 ARG 25 4.107 19.358 -0.405 170 HH22 ARG 25 2HH2 ARG 25 5.355 18.467 -1.207 171 H LYS 26 H LYS 26 -0.177 12.813 -5.355 172 HA LYS 26 HA LYS 26 -2.305 14.781 -5.206 173 HB2 LYS 26 1HB LYS 26 -2.247 12.502 -7.160 174 HB3 LYS 26 2HB LYS 26 -2.893 14.137 -7.369 175 HG2 LYS 26 1HG LYS 26 -0.119 14.401 -6.873 176 HG3 LYS 26 2HG LYS 26 -0.332 13.124 -8.085 177 HD2 LYS 26 1HD LYS 26 -1.978 14.807 -9.205 178 HD3 LYS 26 2HD LYS 26 -1.122 16.008 -8.221 179 HE2 LYS 26 1HE LYS 26 0.625 16.017 -9.611 180 HE3 LYS 26 2HE LYS 26 0.754 14.255 -9.521 181 HZ1 LYS 26 3HZ LYS 26 -1.152 14.220 -11.166 182 HZ2 LYS 26 1HZ LYS 26 0.349 14.731 -11.757 183 HZ3 LYS 26 2HZ LYS 26 -0.854 15.867 -11.407 184 H PHE 27 H PHE 27 -1.881 11.296 -4.838 185 HA PHE 27 HA PHE 27 -4.583 10.594 -4.582 186 HB2 PHE 27 1HB PHE 27 -2.506 9.083 -4.845 187 HB3 PHE 27 2HB PHE 27 -2.367 9.206 -3.090 188 HD1 PHE 27 2HD PHE 27 -4.989 8.458 -5.640 189 HD2 PHE 27 1HD PHE 27 -3.337 7.567 -1.819 190 HE1 PHE 27 2HE PHE 27 -6.622 6.639 -5.361 191 HE2 PHE 27 1HE PHE 27 -4.967 5.745 -1.536 192 HZ PHE 27 HZ PHE 27 -6.613 5.280 -3.308 193 H ARG 28 H ARG 28 -2.451 12.218 -2.432 194 HA ARG 28 HA ARG 28 -3.993 11.631 -0.055 195 HB2 ARG 28 1HB ARG 28 -1.858 13.745 -0.347 196 HB3 ARG 28 2HB ARG 28 -2.391 12.926 1.128 197 HG2 ARG 28 1HG ARG 28 -1.545 10.845 -0.483 198 HG3 ARG 28 2HG ARG 28 -0.380 12.140 -0.805 199 HD2 ARG 28 1HD ARG 28 -1.128 11.021 1.906 200 HD3 ARG 28 2HD ARG 28 0.392 10.769 1.038 201 HE ARG 28 HE ARG 28 0.367 13.422 1.238 202 HH11 ARG 28 2HH1 ARG 28 -0.323 10.961 3.602 203 HH12 ARG 28 1HH1 ARG 28 0.217 11.916 4.944 204 HH21 ARG 28 1HH2 ARG 28 1.014 14.036 4.598 205 HH22 ARG 28 2HH2 ARG 28 1.080 14.688 2.996 206 H PHE 29 H PHE 29 -3.659 14.225 -2.389 207 HA PHE 29 HA PHE 29 -5.854 15.649 -1.032 208 HB2 PHE 29 1HB PHE 29 -4.061 17.174 -2.848 209 HB3 PHE 29 2HB PHE 29 -4.851 17.681 -1.354 210 HD1 PHE 29 1HD PHE 29 -3.931 15.765 0.612 211 HD2 PHE 29 2HD PHE 29 -1.802 17.614 -2.577 212 HE1 PHE 29 1HE PHE 29 -1.827 15.478 1.854 213 HE2 PHE 29 2HE PHE 29 0.305 17.329 -1.340 214 HZ PHE 29 HZ PHE 29 0.295 16.259 0.878 215 H ARG 30 H ARG 30 -6.345 13.629 -2.875 216 HA ARG 30 HA ARG 30 -6.935 14.951 -5.410 217 HB2 ARG 30 1HB ARG 30 -7.722 12.636 -6.077 218 HB3 ARG 30 2HB ARG 30 -6.000 12.794 -5.702 219 HG2 ARG 30 1HG ARG 30 -6.295 11.785 -3.547 220 HG3 ARG 30 2HG ARG 30 -8.054 11.781 -3.752 221 HD2 ARG 30 1HD ARG 30 -6.586 10.439 -5.919 222 HD3 ARG 30 2HD ARG 30 -6.402 9.686 -4.329 223 HE ARG 30 HE ARG 30 -8.810 9.818 -5.925 224 HH11 ARG 30 2HH1 ARG 30 -7.432 9.255 -2.777 225 HH12 ARG 30 1HH1 ARG 30 -8.783 8.333 -2.207 226 HH21 ARG 30 1HH2 ARG 30 -10.581 7.963 -3.577 227 HH22 ARG 30 2HH2 ARG 30 -10.595 8.606 -5.185 228 H LYS 31 H LYS 31 -9.173 13.927 -6.327 229 HA LYS 31 HA LYS 31 -11.212 15.324 -5.007 230 HB2 LYS 31 1HB LYS 31 -11.298 13.153 -7.107 231 HB3 LYS 31 2HB LYS 31 -12.742 14.006 -6.540 232 HG2 LYS 31 1HG LYS 31 -12.175 15.148 -8.479 233 HG3 LYS 31 2HG LYS 31 -11.485 16.150 -7.189 234 HD2 LYS 31 1HD LYS 31 -9.291 15.391 -7.611 235 HD3 LYS 31 2HD LYS 31 -9.873 14.035 -8.591 236 HE2 LYS 31 1HE LYS 31 -10.868 15.876 -10.134 237 HE3 LYS 31 2HE LYS 31 -9.735 16.943 -9.292 238 HZ1 LYS 31 3HZ LYS 31 -8.061 16.160 -10.491 239 HZ2 LYS 31 1HZ LYS 31 -9.180 15.317 -11.438 240 HZ3 LYS 31 2HZ LYS 31 -8.443 14.554 -10.121 241 H GLU 32 H GLU 32 -9.834 12.324 -4.297 242 HA GLU 32 HA GLU 32 -10.580 10.469 -3.127 243 HB2 GLU 32 1HB GLU 32 -11.539 12.660 -1.278 244 HB3 GLU 32 2HB GLU 32 -10.987 11.039 -0.832 245 HG2 GLU 32 1HG GLU 32 -8.794 11.571 -0.989 246 HG3 GLU 32 2HG GLU 32 -9.063 12.722 -2.305 247 H THR 33 H THR 33 -12.866 11.178 -1.092 248 HA THR 33 HA THR 33 -15.057 10.569 -0.903 249 HB THR 33 HB THR 33 -16.581 11.825 -2.128 250 HG1 THR 33 1HG THR 33 -14.878 11.250 -4.244 251 HG21 THR 33 3HG2 THR 33 -15.712 13.791 -1.550 252 HG22 THR 33 1HG2 THR 33 -14.676 13.771 -2.977 253 HG23 THR 33 2HG2 THR 33 -14.113 13.052 -1.468 254 H ASN 34 H ASN 34 -13.140 8.906 -2.657 255 HA ASN 34 HA ASN 34 -15.140 6.980 -3.452 256 HB2 ASN 34 1HB ASN 34 -14.656 6.857 -5.748 257 HB3 ASN 34 2HB ASN 34 -14.779 8.590 -5.422 258 HD21 ASN 34 2HD2 ASN 34 -11.185 6.925 -6.390 259 HD22 ASN 34 1HD2 ASN 34 -12.501 5.946 -5.847 260 H ASN 35 H ASN 35 -14.420 5.094 -2.737 261 HA ASN 35 HA ASN 35 -11.892 4.618 -1.706 262 HB2 ASN 35 1HB ASN 35 -14.025 2.742 -2.732 263 HB3 ASN 35 2HB ASN 35 -12.525 2.152 -2.004 264 HD21 ASN 35 2HD2 ASN 35 -15.095 2.307 0.629 265 HD22 ASN 35 1HD2 ASN 35 -14.903 1.493 -0.883 266 H ALA 36 H ALA 36 -9.976 4.419 -2.641 267 HA ALA 36 HA ALA 36 -9.775 3.100 -5.247 268 HB1 ALA 36 3HB ALA 36 -8.641 5.818 -4.610 269 HB2 ALA 36 1HB ALA 36 -8.169 4.852 -6.008 270 HB3 ALA 36 2HB ALA 36 -9.833 5.414 -5.845 271 H ALA 37 H ALA 37 -7.559 2.437 -5.771 272 HA ALA 37 HA ALA 37 -5.740 2.293 -3.482 273 HB1 ALA 37 3HB ALA 37 -7.373 0.207 -3.916 274 HB2 ALA 37 1HB ALA 37 -6.039 -0.229 -4.984 275 HB3 ALA 37 2HB ALA 37 -5.741 0.044 -3.267 276 H ILE 38 H ILE 38 -3.585 2.171 -4.016 277 HA ILE 38 HA ILE 38 -2.953 2.204 -6.895 278 HB ILE 38 HB ILE 38 -1.530 3.790 -4.757 279 HG12 ILE 38 1HG1 ILE 38 -3.672 4.523 -6.742 280 HG13 ILE 38 2HG1 ILE 38 -3.616 4.856 -5.003 281 HG21 ILE 38 1HG2 ILE 38 -0.530 2.927 -7.123 282 HG22 ILE 38 2HG2 ILE 38 -1.216 4.482 -7.592 283 HG23 ILE 38 3HG2 ILE 38 -0.016 4.401 -6.302 284 HD11 ILE 38 3HD1 ILE 38 -1.565 6.314 -5.579 285 HD12 ILE 38 1HD1 ILE 38 -2.200 6.256 -7.224 286 HD13 ILE 38 2HD1 ILE 38 -3.184 6.924 -5.922 287 H ILE 39 H ILE 39 -2.039 0.282 -7.282 288 HA ILE 39 HA ILE 39 -0.284 -0.948 -5.317 289 HB ILE 39 HB ILE 39 -1.047 -1.976 -8.050 290 HG12 ILE 39 1HG1 ILE 39 -2.236 -3.218 -5.659 291 HG13 ILE 39 2HG1 ILE 39 -2.781 -1.561 -5.974 292 HG21 ILE 39 1HG2 ILE 39 0.159 -3.334 -5.645 293 HG22 ILE 39 2HG2 ILE 39 -0.389 -4.160 -7.103 294 HG23 ILE 39 3HG2 ILE 39 0.952 -3.017 -7.188 295 HD11 ILE 39 3HD1 ILE 39 -2.901 -3.817 -7.961 296 HD12 ILE 39 1HD1 ILE 39 -4.253 -3.230 -6.993 297 HD13 ILE 39 2HD1 ILE 39 -3.505 -2.177 -8.195 298 H MET 40 H MET 40 1.788 -0.403 -5.264 299 HA MET 40 HA MET 40 3.121 0.332 -7.783 300 HB2 MET 40 1HB MET 40 4.167 0.963 -5.029 301 HB3 MET 40 2HB MET 40 4.580 1.730 -6.571 302 HG2 MET 40 1HG MET 40 2.773 3.100 -6.555 303 HG3 MET 40 2HG MET 40 1.762 1.922 -5.715 304 HE1 MET 40 3HE MET 40 0.908 3.459 -3.082 305 HE2 MET 40 1HE MET 40 1.145 1.838 -3.737 306 HE3 MET 40 2HE MET 40 1.971 2.319 -2.255 307 H LYS 41 H LYS 41 5.218 -0.463 -8.205 308 HA LYS 41 HA LYS 41 6.059 -2.752 -6.557 309 HB2 LYS 41 1HB LYS 41 6.438 -4.126 -8.439 310 HB3 LYS 41 2HB LYS 41 4.834 -3.417 -8.685 311 HG2 LYS 41 1HG LYS 41 5.561 -2.002 -10.381 312 HG3 LYS 41 2HG LYS 41 7.258 -2.143 -9.888 313 HD2 LYS 41 1HD LYS 41 7.561 -4.143 -10.952 314 HD3 LYS 41 2HD LYS 41 5.870 -4.627 -10.736 315 HE2 LYS 41 1HE LYS 41 5.251 -2.847 -12.424 316 HE3 LYS 41 2HE LYS 41 6.982 -2.676 -12.742 317 HZ1 LYS 41 3HZ LYS 41 5.412 -5.176 -13.070 318 HZ2 LYS 41 1HZ LYS 41 7.068 -5.006 -13.376 319 HZ3 LYS 41 2HZ LYS 41 5.942 -4.172 -14.323 320 H VAL 42 H VAL 42 8.346 -3.492 -7.384 321 HA VAL 42 HA VAL 42 9.980 -1.083 -7.853 322 HB VAL 42 HB VAL 42 10.496 -1.472 -5.642 323 HG11 VAL 42 1HG1 VAL 42 9.421 -3.268 -4.816 324 HG12 VAL 42 2HG1 VAL 42 9.708 -4.236 -6.264 325 HG13 VAL 42 3HG1 VAL 42 10.975 -4.069 -5.048 326 HG21 VAL 42 3HG2 VAL 42 12.514 -1.631 -7.127 327 HG22 VAL 42 1HG2 VAL 42 12.697 -2.376 -5.538 328 HG23 VAL 42 2HG2 VAL 42 12.418 -3.384 -6.958 329 H ASP 43 H ASP 43 11.027 -1.231 -9.713 330 HA ASP 43 HA ASP 43 11.389 -3.759 -11.042 331 HB2 ASP 43 1HB ASP 43 11.983 -0.890 -11.726 332 HB3 ASP 43 2HB ASP 43 12.661 -2.199 -12.704 333 H LYS 44 H LYS 44 13.041 -5.077 -10.722 334 HA LYS 44 HA LYS 44 15.285 -4.392 -9.136 335 HB2 LYS 44 1HB LYS 44 14.184 -6.709 -9.603 336 HB3 LYS 44 2HB LYS 44 15.268 -6.742 -11.002 337 HG2 LYS 44 1HG LYS 44 16.549 -6.044 -8.442 338 HG3 LYS 44 2HG LYS 44 15.911 -7.694 -8.562 339 HD2 LYS 44 1HD LYS 44 17.170 -8.027 -10.654 340 HD3 LYS 44 2HD LYS 44 17.829 -6.388 -10.495 341 HE2 LYS 44 1HE LYS 44 18.307 -7.649 -8.023 342 HE3 LYS 44 2HE LYS 44 18.716 -8.834 -9.272 343 HZ1 LYS 44 3HZ LYS 44 19.722 -6.274 -9.962 344 HZ2 LYS 44 1HZ LYS 44 20.559 -7.729 -9.751 345 HZ3 LYS 44 2HZ LYS 44 20.266 -6.721 -8.424 346 H ASP 45 H ASP 45 14.624 -4.156 -12.510 347 HA ASP 45 HA ASP 45 17.329 -4.139 -13.420 348 HB2 ASP 45 1HB ASP 45 14.695 -3.932 -14.577 349 HB3 ASP 45 2HB ASP 45 15.746 -2.669 -15.234 350 H ARG 46 H ARG 46 15.037 -1.673 -12.394 351 HA ARG 46 HA ARG 46 17.142 0.360 -12.719 352 HB2 ARG 46 1HB ARG 46 14.164 0.809 -12.427 353 HB3 ARG 46 2HB ARG 46 15.391 2.026 -12.807 354 HG2 ARG 46 1HG ARG 46 15.776 1.116 -14.965 355 HG3 ARG 46 2HG ARG 46 14.824 -0.328 -14.585 356 HD2 ARG 46 1HD ARG 46 13.168 0.765 -15.662 357 HD3 ARG 46 2HD ARG 46 12.992 1.605 -14.114 358 HE ARG 46 HE ARG 46 14.855 3.073 -15.459 359 HH11 ARG 46 2HH1 ARG 46 11.616 1.994 -16.147 360 HH12 ARG 46 1HH1 ARG 46 11.235 3.358 -17.145 361 HH21 ARG 46 1HH2 ARG 46 12.798 4.995 -17.499 362 HH22 ARG 46 2HH2 ARG 46 14.364 4.873 -16.770 363 H GLN 47 H GLN 47 15.928 -1.603 -10.446 364 HA GLN 47 HA GLN 47 15.580 -1.507 -8.176 365 HB2 GLN 47 1HB GLN 47 17.962 0.348 -8.309 366 HB3 GLN 47 2HB GLN 47 17.510 -0.734 -6.984 367 HG2 GLN 47 1HG GLN 47 17.858 -2.176 -9.476 368 HG3 GLN 47 2HG GLN 47 19.306 -1.270 -9.016 369 HE21 GLN 47 2HE2 GLN 47 18.064 -4.467 -6.825 370 HE22 GLN 47 1HE2 GLN 47 17.039 -3.734 -8.007 371 H MET 48 H MET 48 13.705 0.065 -9.107 372 HA MET 48 HA MET 48 13.626 2.246 -7.178 373 HB2 MET 48 1HB MET 48 13.381 3.978 -8.633 374 HB3 MET 48 2HB MET 48 14.398 2.933 -9.637 375 HG2 MET 48 1HG MET 48 12.037 1.990 -10.408 376 HG3 MET 48 2HG MET 48 11.525 3.603 -9.906 377 HE1 MET 48 3HE MET 48 13.136 5.507 -10.273 378 HE2 MET 48 1HE MET 48 14.509 5.447 -11.379 379 HE3 MET 48 2HE MET 48 12.956 6.071 -11.935 380 H VAL 49 H VAL 49 11.498 2.962 -6.681 381 HA VAL 49 HA VAL 49 9.506 0.890 -7.054 382 HB VAL 49 HB VAL 49 9.124 3.475 -5.554 383 HG11 VAL 49 1HG1 VAL 49 7.068 2.416 -5.720 384 HG12 VAL 49 2HG1 VAL 49 7.774 0.804 -5.605 385 HG13 VAL 49 3HG1 VAL 49 7.678 1.829 -4.174 386 HG21 VAL 49 3HG2 VAL 49 10.568 0.980 -4.727 387 HG22 VAL 49 1HG2 VAL 49 11.059 2.664 -4.540 388 HG23 VAL 49 2HG2 VAL 49 9.766 2.007 -3.537 389 H VAL 50 H VAL 50 8.462 0.930 -8.949 390 HA VAL 50 HA VAL 50 7.412 3.517 -9.896 391 HB VAL 50 HB VAL 50 7.387 2.593 -12.157 392 HG11 VAL 50 1HG1 VAL 50 9.356 3.810 -11.496 393 HG12 VAL 50 2HG1 VAL 50 10.050 2.364 -10.760 394 HG13 VAL 50 3HG1 VAL 50 9.836 2.449 -12.509 395 HG21 VAL 50 3HG2 VAL 50 7.071 0.225 -11.477 396 HG22 VAL 50 1HG2 VAL 50 8.337 0.446 -12.684 397 HG23 VAL 50 2HG2 VAL 50 8.767 0.174 -10.996 398 H LEU 51 H LEU 51 5.269 3.710 -10.300 399 HA LEU 51 HA LEU 51 3.389 2.183 -9.046 400 HB2 LEU 51 1HB LEU 51 3.199 4.450 -10.302 401 HB3 LEU 51 2HB LEU 51 2.748 3.440 -11.685 402 HG LEU 51 HG LEU 51 1.247 2.988 -9.174 403 HD11 LEU 51 1HD1 LEU 51 0.125 4.946 -9.090 404 HD12 LEU 51 2HD1 LEU 51 0.267 5.231 -10.824 405 HD13 LEU 51 3HD1 LEU 51 1.631 5.575 -9.759 406 HD21 LEU 51 3HD2 LEU 51 0.083 1.818 -10.661 407 HD22 LEU 51 1HD2 LEU 51 0.987 2.517 -12.004 408 HD23 LEU 51 2HD2 LEU 51 -0.434 3.348 -11.371 409 H GLU 52 H GLU 52 2.015 0.497 -9.588 410 HA GLU 52 HA GLU 52 2.845 -1.084 -11.933 411 HB2 GLU 52 1HB GLU 52 3.394 -2.163 -9.801 412 HB3 GLU 52 2HB GLU 52 1.697 -2.051 -9.308 413 HG2 GLU 52 1HG GLU 52 2.303 -4.301 -10.080 414 HG3 GLU 52 2HG GLU 52 1.034 -3.559 -11.063 415 H ASP 53 H ASP 53 0.108 -0.045 -9.962 416 HA ASP 53 HA ASP 53 -1.620 -0.007 -12.243 417 HB2 ASP 53 1HB ASP 53 -1.785 -2.235 -10.257 418 HB3 ASP 53 2HB ASP 53 -3.294 -1.563 -10.887 419 H GLU 54 H GLU 54 -3.796 0.797 -11.694 420 HA GLU 54 HA GLU 54 -4.069 1.997 -9.053 421 HB2 GLU 54 1HB GLU 54 -3.479 3.485 -11.537 422 HB3 GLU 54 2HB GLU 54 -4.805 4.133 -10.560 423 HG2 GLU 54 1HG GLU 54 -3.179 3.988 -8.582 424 HG3 GLU 54 2HG GLU 54 -1.925 3.802 -9.815 425 H LEU 55 H LEU 55 -6.003 1.303 -8.434 426 HA LEU 55 HA LEU 55 -8.188 1.278 -10.411 427 HB2 LEU 55 1HB LEU 55 -8.049 -0.295 -7.836 428 HB3 LEU 55 2HB LEU 55 -9.227 -0.466 -9.150 429 HG LEU 55 HG LEU 55 -6.302 -1.040 -9.546 430 HD11 LEU 55 1HD1 LEU 55 -6.880 -2.521 -7.809 431 HD12 LEU 55 2HD1 LEU 55 -7.020 -3.456 -9.297 432 HD13 LEU 55 3HD1 LEU 55 -8.470 -2.842 -8.504 433 HD21 LEU 55 3HD2 LEU 55 -7.245 -0.912 -11.634 434 HD22 LEU 55 1HD2 LEU 55 -8.824 -1.463 -11.076 435 HD23 LEU 55 2HD2 LEU 55 -7.503 -2.617 -11.263 436 H GLN 56 H GLN 56 -10.008 2.412 -10.016 437 HA GLN 56 HA GLN 56 -10.151 3.868 -7.459 438 HB2 GLN 56 1HB GLN 56 -11.117 4.681 -10.210 439 HB3 GLN 56 2HB GLN 56 -11.440 5.591 -8.725 440 HG2 GLN 56 1HG GLN 56 -9.636 6.706 -9.670 441 HG3 GLN 56 2HG GLN 56 -8.903 5.671 -8.437 442 HE21 GLN 56 2HE2 GLN 56 -6.817 4.064 -10.654 443 HE22 GLN 56 1HE2 GLN 56 -7.236 4.487 -9.032 444 H ASN 57 H ASN 57 -12.294 4.348 -6.641 445 HA ASN 57 HA ASN 57 -14.314 3.626 -5.874 446 HB2 ASN 57 1HB ASN 57 -15.664 2.664 -8.098 447 HB3 ASN 57 2HB ASN 57 -15.643 4.341 -7.537 448 HD21 ASN 57 2HD2 ASN 57 -13.328 5.458 -9.984 449 HD22 ASN 57 1HD2 ASN 57 -13.823 5.686 -8.345 450 H ILE 58 H ILE 58 -12.540 1.775 -5.273 451 HA ILE 58 HA ILE 58 -13.902 -0.760 -5.896 452 HB ILE 58 HB ILE 58 -12.027 -1.444 -6.896 453 HG12 ILE 58 1HG1 ILE 58 -11.903 -2.429 -4.541 454 HG13 ILE 58 2HG1 ILE 58 -10.415 -2.463 -5.504 455 HG21 ILE 58 1HG2 ILE 58 -10.852 1.028 -5.708 456 HG22 ILE 58 2HG2 ILE 58 -9.792 -0.178 -6.436 457 HG23 ILE 58 3HG2 ILE 58 -11.056 0.581 -7.402 458 HD11 ILE 58 3HD1 ILE 58 -10.397 -0.036 -4.083 459 HD12 ILE 58 1HD1 ILE 58 -10.851 -1.303 -2.943 460 HD13 ILE 58 2HD1 ILE 58 -9.352 -1.439 -3.865 461 H SER 59 H SER 59 -14.272 -2.122 -4.208 462 HA SER 59 HA SER 59 -13.992 -1.015 -1.558 463 HB2 SER 59 1HB SER 59 -15.623 -3.044 -2.855 464 HB3 SER 59 2HB SER 59 -14.971 -3.624 -1.312 465 HG SER 59 HG SER 59 -15.735 -1.385 -0.583 466 HA PRO 60 HA PRO 60 -10.542 -3.265 -0.047 467 HB2 PRO 60 2HB PRO 60 -11.080 -2.569 2.077 468 HB3 PRO 60 1HB PRO 60 -11.390 -4.283 2.352 469 HG2 PRO 60 1HG PRO 60 -13.677 -4.067 2.011 470 HG3 PRO 60 2HG PRO 60 -13.292 -2.487 2.787 471 HD2 PRO 60 1HD PRO 60 -14.589 -2.673 0.410 472 HD3 PRO 60 2HD PRO 60 -13.475 -1.349 0.792 473 H GLU 61 H GLU 61 -13.210 -4.882 -1.140 474 HA GLU 61 HA GLU 61 -12.162 -7.543 -0.489 475 HB2 GLU 61 1HB GLU 61 -14.816 -6.440 -1.029 476 HB3 GLU 61 2HB GLU 61 -14.486 -7.925 -1.934 477 HG2 GLU 61 1HG GLU 61 -13.679 -8.831 0.380 478 HG3 GLU 61 2HG GLU 61 -14.674 -7.510 1.010 479 H GLU 62 H GLU 62 -12.613 -5.305 -3.102 480 HA GLU 62 HA GLU 62 -12.123 -7.253 -5.173 481 HB2 GLU 62 1HB GLU 62 -12.602 -4.303 -5.072 482 HB3 GLU 62 2HB GLU 62 -11.850 -4.997 -6.517 483 HG2 GLU 62 1HG GLU 62 -14.424 -6.067 -5.391 484 HG3 GLU 62 2HG GLU 62 -14.375 -4.717 -6.533 485 H LEU 63 H LEU 63 -10.320 -4.670 -3.566 486 HA LEU 63 HA LEU 63 -8.024 -4.653 -5.112 487 HB2 LEU 63 1HB LEU 63 -8.855 -3.436 -2.798 488 HB3 LEU 63 2HB LEU 63 -7.520 -4.458 -2.236 489 HG LEU 63 HG LEU 63 -7.465 -2.089 -4.047 490 HD11 LEU 63 1HD1 LEU 63 -6.831 -1.516 -1.905 491 HD12 LEU 63 2HD1 LEU 63 -5.278 -1.859 -2.664 492 HD13 LEU 63 3HD1 LEU 63 -6.030 -3.060 -1.613 493 HD21 LEU 63 3HD2 LEU 63 -4.970 -3.016 -4.381 494 HD22 LEU 63 1HD2 LEU 63 -6.274 -3.303 -5.534 495 HD23 LEU 63 2HD2 LEU 63 -5.852 -4.544 -4.354 496 H LYS 64 H LYS 64 -8.623 -6.575 -2.169 497 HA LYS 64 HA LYS 64 -6.273 -7.982 -2.035 498 HB2 LYS 64 1HB LYS 64 -7.436 -8.716 -0.272 499 HB3 LYS 64 2HB LYS 64 -8.979 -8.321 -1.046 500 HG2 LYS 64 1HG LYS 64 -9.198 -10.426 -2.007 501 HG3 LYS 64 2HG LYS 64 -7.470 -10.783 -1.828 502 HD2 LYS 64 1HD LYS 64 -7.851 -11.776 0.126 503 HD3 LYS 64 2HD LYS 64 -8.545 -10.273 0.758 504 HE2 LYS 64 1HE LYS 64 -10.653 -11.061 -0.648 505 HE3 LYS 64 2HE LYS 64 -9.904 -12.647 -0.413 506 HZ1 LYS 64 3HZ LYS 64 -11.103 -10.855 1.557 507 HZ2 LYS 64 1HZ LYS 64 -9.778 -11.780 2.056 508 HZ3 LYS 64 2HZ LYS 64 -11.162 -12.542 1.454 509 H LEU 65 H LEU 65 -9.155 -8.812 -3.940 510 HA LEU 65 HA LEU 65 -8.139 -11.204 -5.025 511 HB2 LEU 65 1HB LEU 65 -10.151 -9.323 -6.270 512 HB3 LEU 65 2HB LEU 65 -9.926 -11.041 -6.642 513 HG LEU 65 HG LEU 65 -10.872 -9.983 -3.979 514 HD11 LEU 65 1HD1 LEU 65 -12.371 -10.982 -6.383 515 HD12 LEU 65 2HD1 LEU 65 -12.599 -9.479 -5.490 516 HD13 LEU 65 3HD1 LEU 65 -13.058 -11.016 -4.759 517 HD21 LEU 65 3HD2 LEU 65 -11.030 -12.134 -3.265 518 HD22 LEU 65 1HD2 LEU 65 -9.676 -12.326 -4.379 519 HD23 LEU 65 2HD2 LEU 65 -11.305 -12.772 -4.887 520 H GLU 66 H GLU 66 -7.793 -7.852 -5.955 521 HA GLU 66 HA GLU 66 -6.773 -8.314 -8.563 522 HB2 GLU 66 1HB GLU 66 -6.508 -5.961 -6.682 523 HB3 GLU 66 2HB GLU 66 -5.912 -5.960 -8.348 524 HG2 GLU 66 1HG GLU 66 -8.789 -6.471 -7.612 525 HG3 GLU 66 2HG GLU 66 -8.139 -4.875 -8.007 526 H LEU 67 H LEU 67 -5.309 -8.087 -5.379 527 HA LEU 67 HA LEU 67 -2.618 -7.905 -6.212 528 HB2 LEU 67 1HB LEU 67 -3.916 -8.900 -3.680 529 HB3 LEU 67 2HB LEU 67 -2.158 -8.854 -3.902 530 HG LEU 67 HG LEU 67 -3.898 -6.407 -4.128 531 HD11 LEU 67 1HD1 LEU 67 -3.783 -6.011 -1.903 532 HD12 LEU 67 2HD1 LEU 67 -2.246 -6.855 -1.718 533 HD13 LEU 67 3HD1 LEU 67 -3.747 -7.774 -1.839 534 HD21 LEU 67 3HD2 LEU 67 -1.293 -6.850 -4.879 535 HD22 LEU 67 1HD2 LEU 67 -1.126 -6.152 -3.267 536 HD23 LEU 67 2HD2 LEU 67 -2.010 -5.278 -4.519 537 HA PRO 68 HA PRO 68 -1.593 -11.972 -7.509 538 HB2 PRO 68 2HB PRO 68 0.507 -11.166 -7.983 539 HB3 PRO 68 1HB PRO 68 0.993 -12.186 -6.629 540 HG2 PRO 68 1HG PRO 68 0.970 -10.425 -5.114 541 HG3 PRO 68 2HG PRO 68 1.523 -9.587 -6.612 542 HD2 PRO 68 1HD PRO 68 -0.609 -8.738 -5.161 543 HD3 PRO 68 2HD PRO 68 -0.527 -8.581 -6.924 544 H GLU 69 H GLU 69 -0.146 -13.936 -6.502 545 HA GLU 69 HA GLU 69 -1.501 -14.584 -3.977 546 HB2 GLU 69 1HB GLU 69 -1.078 -16.936 -4.545 547 HB3 GLU 69 2HB GLU 69 -1.982 -16.105 -5.821 548 HG2 GLU 69 1HG GLU 69 0.674 -15.772 -6.555 549 HG3 GLU 69 2HG GLU 69 0.586 -17.427 -5.936 550 H ARG 70 H ARG 70 1.635 -14.396 -5.525 551 HA ARG 70 HA ARG 70 2.907 -14.488 -2.908 552 HB2 ARG 70 1HB ARG 70 3.811 -16.273 -5.180 553 HB3 ARG 70 2HB ARG 70 4.569 -16.133 -3.586 554 HG2 ARG 70 1HG ARG 70 1.745 -17.103 -4.025 555 HG3 ARG 70 2HG ARG 70 3.158 -18.162 -3.885 556 HD2 ARG 70 1HD ARG 70 3.585 -17.451 -1.641 557 HD3 ARG 70 2HD ARG 70 2.390 -16.154 -1.778 558 HE ARG 70 HE ARG 70 1.323 -18.809 -2.151 559 HH11 ARG 70 2HH1 ARG 70 2.048 -16.269 0.116 560 HH12 ARG 70 1HH1 ARG 70 0.899 -16.813 1.293 561 HH21 ARG 70 1HH2 ARG 70 -0.375 -18.671 0.880 562 HH22 ARG 70 2HH2 ARG 70 -0.194 -19.535 -0.609 563 H GLN 71 H GLN 71 2.586 -12.230 -4.303 564 HA GLN 71 HA GLN 71 5.303 -11.662 -5.260 565 HB2 GLN 71 1HB GLN 71 2.745 -11.300 -6.694 566 HB3 GLN 71 2HB GLN 71 3.854 -9.921 -6.752 567 HG2 GLN 71 1HG GLN 71 5.011 -10.903 -8.359 568 HG3 GLN 71 2HG GLN 71 5.377 -12.244 -7.264 569 HE21 GLN 71 2HE2 GLN 71 3.251 -13.007 -10.443 570 HE22 GLN 71 1HE2 GLN 71 4.372 -11.713 -10.219 571 HA PRO 72 HA PRO 72 4.683 -8.613 -2.030 572 HB2 PRO 72 2HB PRO 72 6.729 -9.262 -1.209 573 HB3 PRO 72 1HB PRO 72 7.292 -7.780 -1.979 574 HG2 PRO 72 1HG PRO 72 8.026 -8.886 -3.886 575 HG3 PRO 72 2HG PRO 72 8.369 -10.120 -2.616 576 HD2 PRO 72 1HD PRO 72 6.895 -10.666 -4.829 577 HD3 PRO 72 2HD PRO 72 6.578 -11.420 -3.258 578 H ARG 73 H ARG 73 4.116 -6.524 -2.181 579 HA ARG 73 HA ARG 73 5.399 -4.649 -3.889 580 HB2 ARG 73 1HB ARG 73 3.328 -4.164 -5.274 581 HB3 ARG 73 2HB ARG 73 4.223 -5.632 -5.691 582 HG2 ARG 73 1HG ARG 73 2.440 -6.625 -3.902 583 HG3 ARG 73 2HG ARG 73 1.502 -5.318 -4.646 584 HD2 ARG 73 1HD ARG 73 2.988 -6.887 -6.609 585 HD3 ARG 73 2HD ARG 73 1.850 -7.859 -5.666 586 HE ARG 73 HE ARG 73 0.339 -5.754 -6.382 587 HH11 ARG 73 2HH1 ARG 73 2.430 -7.868 -8.192 588 HH12 ARG 73 1HH1 ARG 73 1.516 -7.731 -9.657 589 HH21 ARG 73 1HH2 ARG 73 -0.360 -6.420 -9.721 590 HH22 ARG 73 2HH2 ARG 73 -0.871 -5.565 -8.305 591 H PHE 74 H PHE 74 4.170 -2.523 -3.910 592 HA PHE 74 HA PHE 74 3.062 -2.109 -1.237 593 HB2 PHE 74 1HB PHE 74 3.785 0.043 -3.227 594 HB3 PHE 74 2HB PHE 74 3.637 0.183 -1.474 595 HD1 PHE 74 2HD PHE 74 5.251 -1.497 -0.141 596 HD2 PHE 74 1HD PHE 74 5.927 0.014 -4.062 597 HE1 PHE 74 2HE PHE 74 7.662 -1.906 0.122 598 HE2 PHE 74 1HE PHE 74 8.340 -0.393 -3.806 599 HZ PHE 74 HZ PHE 74 9.211 -1.352 -1.712 600 H VAL 75 H VAL 75 1.132 -0.954 -0.882 601 HA VAL 75 HA VAL 75 -0.568 -0.313 -3.144 602 HB VAL 75 HB VAL 75 -1.404 -2.399 -1.125 603 HG11 VAL 75 1HG1 VAL 75 -3.152 -2.026 -3.397 604 HG12 VAL 75 2HG1 VAL 75 -3.530 -2.033 -1.674 605 HG13 VAL 75 3HG1 VAL 75 -2.990 -0.546 -2.454 606 HG21 VAL 75 3HG2 VAL 75 -0.950 -2.623 -4.099 607 HG22 VAL 75 1HG2 VAL 75 0.106 -3.268 -2.842 608 HG23 VAL 75 2HG2 VAL 75 -1.525 -3.909 -3.038 609 H VAL 76 H VAL 76 -1.608 1.511 -2.704 610 HA VAL 76 HA VAL 76 -1.982 2.267 0.117 611 HB VAL 76 HB VAL 76 -1.647 3.968 -2.349 612 HG11 VAL 76 1HG1 VAL 76 -3.077 4.555 0.104 613 HG12 VAL 76 2HG1 VAL 76 -1.741 5.673 -0.171 614 HG13 VAL 76 3HG1 VAL 76 -2.990 5.472 -1.400 615 HG21 VAL 76 3HG2 VAL 76 0.346 4.720 -1.374 616 HG22 VAL 76 1HG2 VAL 76 -0.095 4.097 0.216 617 HG23 VAL 76 2HG2 VAL 76 0.342 2.982 -1.078 618 H TYR 77 H TYR 77 -3.989 1.598 0.651 619 HA TYR 77 HA TYR 77 -6.201 2.030 -1.201 620 HB2 TYR 77 1HB TYR 77 -5.893 -0.142 0.053 621 HB3 TYR 77 2HB TYR 77 -6.290 0.738 1.530 622 HD1 TYR 77 1HD TYR 77 -7.843 1.087 -1.834 623 HD2 TYR 77 2HD TYR 77 -8.339 -0.161 2.203 624 HE1 TYR 77 1HE TYR 77 -10.241 0.734 -2.244 625 HE2 TYR 77 2HE TYR 77 -10.739 -0.519 1.804 626 HH TYR 77 HH TYR 77 -12.226 0.300 -1.302 627 H SER 78 H SER 78 -7.838 3.454 -0.882 628 HA SER 78 HA SER 78 -7.644 5.197 1.488 629 HB2 SER 78 1HB SER 78 -6.964 6.279 -0.682 630 HB3 SER 78 2HB SER 78 -8.623 6.028 -1.252 631 HG SER 78 HG SER 78 -9.372 7.401 0.317 632 H TYR 79 H TYR 79 -9.198 4.262 2.743 633 HA TYR 79 HA TYR 79 -11.808 3.650 1.626 634 HB2 TYR 79 1HB TYR 79 -10.952 2.057 3.197 635 HB3 TYR 79 2HB TYR 79 -10.631 3.321 4.387 636 HD1 TYR 79 1HD TYR 79 -12.420 4.298 5.714 637 HD2 TYR 79 2HD TYR 79 -13.231 1.245 2.862 638 HE1 TYR 79 1HE TYR 79 -14.640 3.959 6.716 639 HE2 TYR 79 2HE TYR 79 -15.454 0.900 3.855 640 HH TYR 79 HH TYR 79 -16.700 3.020 6.354 641 H LYS 80 H LYS 80 -13.775 4.519 2.485 642 HA LYS 80 HA LYS 80 -13.459 7.293 3.412 643 HB2 LYS 80 1HB LYS 80 -14.569 7.202 1.293 644 HB3 LYS 80 2HB LYS 80 -15.671 5.939 1.866 645 HG2 LYS 80 1HG LYS 80 -16.632 7.562 3.481 646 HG3 LYS 80 2HG LYS 80 -15.604 8.813 2.762 647 HD2 LYS 80 1HD LYS 80 -16.997 9.104 1.040 648 HD3 LYS 80 2HD LYS 80 -17.077 7.360 0.736 649 HE2 LYS 80 1HE LYS 80 -18.527 8.090 3.148 650 HE3 LYS 80 2HE LYS 80 -19.112 8.971 1.730 651 HZ1 LYS 80 3HZ LYS 80 -19.075 6.065 2.209 652 HZ2 LYS 80 1HZ LYS 80 -19.093 6.660 0.625 653 HZ3 LYS 80 2HZ LYS 80 -20.352 7.045 1.687 654 H TYR 81 H TYR 81 -13.666 7.408 5.555 655 HA TYR 81 HA TYR 81 -15.625 5.692 6.900 656 HB2 TYR 81 1HB TYR 81 -13.038 6.214 7.551 657 HB3 TYR 81 2HB TYR 81 -13.869 7.433 8.521 658 HD1 TYR 81 1HD TYR 81 -16.096 6.411 9.727 659 HD2 TYR 81 2HD TYR 81 -12.596 4.237 8.667 660 HE1 TYR 81 1HE TYR 81 -16.631 4.728 11.439 661 HE2 TYR 81 2HE TYR 81 -13.122 2.548 10.375 662 HH TYR 81 HH TYR 81 -16.133 2.360 11.911 663 H VAL 82 H VAL 82 -17.434 6.477 7.788 664 HA VAL 82 HA VAL 82 -17.886 9.375 7.622 665 HB VAL 82 HB VAL 82 -20.024 7.317 8.116 666 HG11 VAL 82 1HG1 VAL 82 -20.763 9.554 6.487 667 HG12 VAL 82 2HG1 VAL 82 -21.391 9.066 8.063 668 HG13 VAL 82 3HG1 VAL 82 -19.982 10.123 7.961 669 HG21 VAL 82 3HG2 VAL 82 -19.277 8.320 5.383 670 HG22 VAL 82 1HG2 VAL 82 -18.629 6.818 6.045 671 HG23 VAL 82 2HG2 VAL 82 -20.367 7.001 5.811 672 H HIS 83 H HIS 83 -18.737 10.536 9.357 673 HA HIS 83 HA HIS 83 -18.004 9.510 11.957 674 HB2 HIS 83 1HB HIS 83 -19.070 12.174 11.009 675 HB3 HIS 83 2HB HIS 83 -18.768 11.815 12.711 676 HD1 HIS 83 1HD HIS 83 -16.596 12.686 13.473 677 HD2 HIS 83 2HD HIS 83 -16.465 11.520 9.487 678 HE1 HIS 83 1HE HIS 83 -14.249 13.167 12.709 679 HE2 HIS 83 2HE HIS 83 -14.167 12.455 10.273 680 H ASP 84 H ASP 84 -20.839 11.514 11.403 681 HA ASP 84 HA ASP 84 -22.912 9.761 11.526 682 HB2 ASP 84 1HB ASP 84 -21.458 9.833 14.061 683 HB3 ASP 84 2HB ASP 84 -23.174 10.219 14.248 684 H ASP 85 H ASP 85 -21.558 12.730 12.762 685 HA ASP 85 HA ASP 85 -24.122 13.994 13.151 686 HB2 ASP 85 1HB ASP 85 -21.258 14.893 13.345 687 HB3 ASP 85 2HB ASP 85 -22.570 16.079 13.348 688 H GLY 86 H GLY 86 -22.058 13.414 10.520 689 HA2 GLY 86 1HA GLY 86 -23.297 13.972 8.371 690 HA3 GLY 86 2HA GLY 86 -23.280 15.619 8.984 691 H ARG 87 H ARG 87 -20.482 13.938 9.829 692 HA ARG 87 HA ARG 87 -19.027 15.173 7.583 693 HB2 ARG 87 1HB ARG 87 -18.152 14.714 10.444 694 HB3 ARG 87 2HB ARG 87 -17.085 15.288 9.154 695 HG2 ARG 87 1HG ARG 87 -19.603 16.733 9.963 696 HG3 ARG 87 2HG ARG 87 -18.014 17.059 10.674 697 HD2 ARG 87 1HD ARG 87 -17.241 18.122 8.828 698 HD3 ARG 87 2HD ARG 87 -18.099 17.029 7.730 699 HE ARG 87 HE ARG 87 -19.832 18.519 7.661 700 HH11 ARG 87 2HH1 ARG 87 -17.826 19.244 10.413 701 HH12 ARG 87 1HH1 ARG 87 -18.661 20.713 10.799 702 HH21 ARG 87 1HH2 ARG 87 -20.433 21.396 9.517 703 HH22 ARG 87 2HH2 ARG 87 -20.940 20.450 8.159 704 H VAL 88 H VAL 88 -17.694 13.935 6.388 705 HA VAL 88 HA VAL 88 -17.121 11.204 7.326 706 HB VAL 88 HB VAL 88 -18.817 10.836 5.739 707 HG11 VAL 88 1HG1 VAL 88 -19.381 12.418 4.289 708 HG12 VAL 88 2HG1 VAL 88 -17.874 13.280 4.607 709 HG13 VAL 88 3HG1 VAL 88 -17.938 12.047 3.346 710 HG21 VAL 88 3HG2 VAL 88 -17.637 9.786 3.823 711 HG22 VAL 88 1HG2 VAL 88 -16.146 10.557 4.368 712 HG23 VAL 88 2HG2 VAL 88 -16.946 9.362 5.389 713 H SER 89 H SER 89 -15.036 10.683 7.256 714 HA SER 89 HA SER 89 -13.257 12.272 5.524 715 HB2 SER 89 1HB SER 89 -12.493 11.020 8.176 716 HB3 SER 89 2HB SER 89 -11.536 12.150 7.200 717 HG SER 89 HG SER 89 -13.037 13.763 7.645 718 H TYR 90 H TYR 90 -11.517 11.207 4.540 719 HA TYR 90 HA TYR 90 -11.855 8.290 4.362 720 HB2 TYR 90 1HB TYR 90 -10.196 9.664 2.335 721 HB3 TYR 90 2HB TYR 90 -11.410 8.397 2.136 722 HD1 TYR 90 2HD TYR 90 -13.791 8.949 1.916 723 HD2 TYR 90 1HD TYR 90 -10.833 11.996 2.187 724 HE1 TYR 90 2HE TYR 90 -15.420 10.595 1.087 725 HE2 TYR 90 1HE TYR 90 -12.454 13.651 1.359 726 HH TYR 90 HH TYR 90 -14.714 14.017 1.044 727 HA PRO 91 HA PRO 91 -7.911 8.541 6.617 728 HB2 PRO 91 2HB PRO 91 -8.917 7.445 8.368 729 HB3 PRO 91 1HB PRO 91 -8.122 6.028 7.684 730 HG2 PRO 91 1HG PRO 91 -10.022 5.343 6.537 731 HG3 PRO 91 2HG PRO 91 -10.753 6.062 8.021 732 HD2 PRO 91 1HD PRO 91 -11.481 6.815 5.516 733 HD3 PRO 91 2HD PRO 91 -11.452 7.940 6.884 734 H LEU 92 H LEU 92 -6.561 8.511 4.814 735 HA LEU 92 HA LEU 92 -6.285 6.217 3.135 736 HB2 LEU 92 1HB LEU 92 -5.195 8.911 3.306 737 HB3 LEU 92 2HB LEU 92 -3.973 7.713 2.842 738 HG LEU 92 HG LEU 92 -6.237 7.199 1.245 739 HD11 LEU 92 1HD1 LEU 92 -6.445 9.391 0.084 740 HD12 LEU 92 2HD1 LEU 92 -5.565 10.129 1.421 741 HD13 LEU 92 3HD1 LEU 92 -7.129 9.368 1.709 742 HD21 LEU 92 3HD2 LEU 92 -4.506 8.401 -0.429 743 HD22 LEU 92 1HD2 LEU 92 -4.315 6.747 0.155 744 HD23 LEU 92 2HD2 LEU 92 -3.436 8.065 0.933 745 H CYS 93 H CYS 93 -5.185 4.422 3.532 746 HA CYS 93 HA CYS 93 -3.008 4.518 5.516 747 HB2 CYS 93 1HB CYS 93 -4.990 2.295 4.996 748 HB3 CYS 93 2HB CYS 93 -3.601 2.167 6.087 749 HG CYS 93 HG CYS 93 -6.301 4.223 6.517 750 H PHE 94 H PHE 94 -1.283 2.983 5.207 751 HA PHE 94 HA PHE 94 -0.841 2.417 2.362 752 HB2 PHE 94 1HB PHE 94 0.821 3.856 3.467 753 HB3 PHE 94 2HB PHE 94 1.143 2.578 4.641 754 HD1 PHE 94 2HD PHE 94 2.383 0.587 4.039 755 HD2 PHE 94 1HD PHE 94 1.650 3.668 1.196 756 HE1 PHE 94 2HE PHE 94 4.101 -0.372 2.563 757 HE2 PHE 94 1HE PHE 94 3.367 2.713 -0.287 758 HZ PHE 94 HZ PHE 94 4.595 0.691 0.397 759 H ILE 95 H ILE 95 -1.518 0.423 1.869 760 HA ILE 95 HA ILE 95 -1.130 -1.762 3.764 761 HB ILE 95 HB ILE 95 -2.609 -1.626 1.138 762 HG12 ILE 95 1HG1 ILE 95 -3.610 -2.094 3.956 763 HG13 ILE 95 2HG1 ILE 95 -3.633 -0.521 3.141 764 HG21 ILE 95 1HG2 ILE 95 -3.439 -3.933 1.907 765 HG22 ILE 95 2HG2 ILE 95 -1.839 -3.824 1.175 766 HG23 ILE 95 3HG2 ILE 95 -1.999 -3.953 2.926 767 HD11 ILE 95 3HD1 ILE 95 -4.874 -2.438 1.443 768 HD12 ILE 95 1HD1 ILE 95 -5.586 -2.544 3.054 769 HD13 ILE 95 2HD1 ILE 95 -5.568 -1.002 2.196 770 H PHE 96 H PHE 96 0.496 -3.155 3.624 771 HA PHE 96 HA PHE 96 2.074 -3.211 1.140 772 HB2 PHE 96 1HB PHE 96 3.311 -2.406 3.099 773 HB3 PHE 96 2HB PHE 96 2.915 -3.892 3.966 774 HD1 PHE 96 1HD PHE 96 3.508 -4.495 0.519 775 HD2 PHE 96 2HD PHE 96 5.463 -3.923 4.257 776 HE1 PHE 96 1HE PHE 96 5.527 -5.581 -0.374 777 HE2 PHE 96 2HE PHE 96 7.485 -5.008 3.369 778 HZ PHE 96 HZ PHE 96 7.519 -5.839 1.052 779 H SER 97 H SER 97 1.607 -4.916 -0.074 780 HA SER 97 HA SER 97 0.481 -7.319 1.034 781 HB2 SER 97 1HB SER 97 -0.358 -6.698 -1.101 782 HB3 SER 97 2HB SER 97 1.275 -6.493 -1.759 783 HG SER 97 HG SER 97 0.202 -8.970 -0.880 784 H SER 98 H SER 98 1.889 -8.445 2.271 785 HA SER 98 HA SER 98 4.336 -9.406 0.946 786 HB2 SER 98 1HB SER 98 4.518 -7.659 2.940 787 HB3 SER 98 2HB SER 98 4.293 -9.120 3.919 788 HG SER 98 HG SER 98 6.184 -9.887 3.266 789 HA PRO 99 HA PRO 99 1.907 -13.116 1.982 790 HB2 PRO 99 2HB PRO 99 1.678 -13.522 -0.268 791 HB3 PRO 99 1HB PRO 99 3.009 -14.647 -0.003 792 HG2 PRO 99 1HG PRO 99 4.617 -13.135 -0.729 793 HG3 PRO 99 2HG PRO 99 3.229 -12.705 -1.797 794 HD2 PRO 99 1HD PRO 99 4.522 -10.872 -0.269 795 HD3 PRO 99 2HD PRO 99 2.787 -10.778 -0.613 796 H VAL 100 H VAL 100 3.069 -15.566 1.671 797 HA VAL 100 HA VAL 100 5.503 -15.415 3.328 798 HB VAL 100 HB VAL 100 3.149 -17.276 3.601 799 HG11 VAL 100 1HG1 VAL 100 4.436 -18.513 5.267 800 HG12 VAL 100 2HG1 VAL 100 5.201 -18.603 3.679 801 HG13 VAL 100 3HG1 VAL 100 5.854 -17.525 4.914 802 HG21 VAL 100 3HG2 VAL 100 2.970 -16.422 5.807 803 HG22 VAL 100 1HG2 VAL 100 4.533 -15.614 5.693 804 HG23 VAL 100 2HG2 VAL 100 3.167 -15.027 4.746 805 H GLY 101 H GLY 101 3.678 -17.242 0.921 806 HA2 GLY 101 1HA GLY 101 5.715 -19.208 0.505 807 HA3 GLY 101 2HA GLY 101 4.320 -18.921 -0.525 808 H CYS 102 H CYS 102 5.957 -16.053 -0.036 809 HA CYS 102 HA CYS 102 6.917 -16.039 -2.747 810 HB2 CYS 102 1HB CYS 102 7.675 -13.713 -2.159 811 HB3 CYS 102 2HB CYS 102 5.939 -14.010 -1.972 812 HG CYS 102 HG CYS 102 8.218 -13.849 0.575 813 H LYS 103 H LYS 103 9.186 -14.643 -2.809 814 HA LYS 103 HA LYS 103 11.116 -16.432 -1.493 815 HB2 LYS 103 1HB LYS 103 11.790 -14.659 -3.822 816 HB3 LYS 103 2HB LYS 103 12.551 -16.175 -3.316 817 HG2 LYS 103 1HG LYS 103 11.271 -17.352 -4.687 818 HG3 LYS 103 2HG LYS 103 9.806 -16.652 -3.977 819 HD2 LYS 103 1HD LYS 103 9.966 -16.225 -6.403 820 HD3 LYS 103 2HD LYS 103 9.961 -14.732 -5.449 821 HE2 LYS 103 1HE LYS 103 11.808 -14.131 -6.551 822 HE3 LYS 103 2HE LYS 103 12.647 -15.399 -5.644 823 HZ1 LYS 103 3HZ LYS 103 12.669 -15.353 -8.250 824 HZ2 LYS 103 1HZ LYS 103 11.201 -16.174 -8.070 825 HZ3 LYS 103 2HZ LYS 103 12.617 -16.818 -7.406 826 HA PRO 104 HA PRO 104 12.689 -13.101 0.910 827 HB2 PRO 104 2HB PRO 104 13.843 -14.692 2.099 828 HB3 PRO 104 1HB PRO 104 15.251 -13.985 1.307 829 HG2 PRO 104 1HG PRO 104 15.301 -15.604 -0.358 830 HG3 PRO 104 2HG PRO 104 14.722 -16.572 1.050 831 HD2 PRO 104 1HD PRO 104 13.395 -16.489 -1.318 832 HD3 PRO 104 2HD PRO 104 12.565 -16.638 0.241 833 H GLU 105 H GLU 105 14.044 -13.955 -2.146 834 HA GLU 105 HA GLU 105 16.034 -11.925 -2.285 835 HB2 GLU 105 1HB GLU 105 14.862 -13.930 -4.084 836 HB3 GLU 105 2HB GLU 105 15.379 -12.444 -4.897 837 HG2 GLU 105 1HG GLU 105 17.172 -13.987 -3.034 838 HG3 GLU 105 2HG GLU 105 17.074 -14.307 -4.772 839 H GLN 106 H GLN 106 12.641 -12.112 -3.207 840 HA GLN 106 HA GLN 106 12.700 -9.435 -4.340 841 HB2 GLN 106 1HB GLN 106 10.204 -11.049 -3.904 842 HB3 GLN 106 2HB GLN 106 10.555 -9.856 -5.164 843 HG2 GLN 106 1HG GLN 106 11.920 -12.537 -4.975 844 HG3 GLN 106 2HG GLN 106 10.472 -12.226 -5.943 845 HE21 GLN 106 2HE2 GLN 106 12.303 -9.923 -8.118 846 HE22 GLN 106 1HE2 GLN 106 10.899 -9.881 -7.112 847 H GLN 107 H GLN 107 10.777 -11.089 -1.828 848 HA GLN 107 HA GLN 107 9.407 -9.080 -0.702 849 HB2 GLN 107 1HB GLN 107 10.233 -11.616 0.126 850 HB3 GLN 107 2HB GLN 107 10.752 -10.527 1.421 851 HG2 GLN 107 1HG GLN 107 8.037 -9.982 0.514 852 HG3 GLN 107 2HG GLN 107 8.252 -11.626 1.131 853 HE21 GLN 107 2HE2 GLN 107 8.868 -8.457 3.655 854 HE22 GLN 107 1HE2 GLN 107 9.151 -8.294 1.958 855 H MET 108 H MET 108 12.869 -9.626 -0.294 856 HA MET 108 HA MET 108 13.319 -7.653 1.664 857 HB2 MET 108 1HB MET 108 15.002 -9.164 -0.278 858 HB3 MET 108 2HB MET 108 15.697 -7.713 0.458 859 HG2 MET 108 1HG MET 108 14.679 -8.962 2.649 860 HG3 MET 108 2HG MET 108 15.130 -10.334 1.634 861 HE1 MET 108 3HE MET 108 18.503 -10.461 1.032 862 HE2 MET 108 1HE MET 108 17.145 -9.874 0.070 863 HE3 MET 108 2HE MET 108 18.489 -8.797 0.447 864 H MET 109 H MET 109 13.415 -7.540 -1.875 865 HA MET 109 HA MET 109 14.415 -4.980 -2.228 866 HB2 MET 109 1HB MET 109 12.767 -6.855 -3.805 867 HB3 MET 109 2HB MET 109 12.624 -5.152 -4.268 868 HG2 MET 109 1HG MET 109 15.390 -5.772 -3.907 869 HG3 MET 109 2HG MET 109 14.651 -6.987 -4.953 870 HE1 MET 109 3HE MET 109 13.727 -5.211 -8.137 871 HE2 MET 109 1HE MET 109 14.145 -6.722 -7.329 872 HE3 MET 109 2HE MET 109 12.674 -5.861 -6.879 873 H TYR 110 H TYR 110 11.229 -6.022 -1.259 874 HA TYR 110 HA TYR 110 10.184 -3.299 -1.457 875 HB2 TYR 110 1HB TYR 110 8.757 -5.823 -0.584 876 HB3 TYR 110 2HB TYR 110 8.012 -4.272 -0.980 877 HD1 TYR 110 2HD TYR 110 9.861 -7.128 -2.444 878 HD2 TYR 110 1HD TYR 110 7.475 -3.689 -3.209 879 HE1 TYR 110 2HE TYR 110 9.630 -7.818 -4.794 880 HE2 TYR 110 1HE TYR 110 7.236 -4.369 -5.560 881 HH TYR 110 HH TYR 110 7.530 -7.104 -6.721 882 H ALA 111 H ALA 111 11.117 -5.709 0.902 883 HA ALA 111 HA ALA 111 10.004 -4.458 3.184 884 HB1 ALA 111 3HB ALA 111 11.450 -6.803 2.641 885 HB2 ALA 111 1HB ALA 111 12.383 -5.912 3.844 886 HB3 ALA 111 2HB ALA 111 10.698 -6.324 4.162 887 H GLY 112 H GLY 112 12.959 -3.972 1.390 888 HA2 GLY 112 1HA GLY 112 14.034 -2.213 3.468 889 HA3 GLY 112 2HA GLY 112 14.878 -2.745 2.021 890 H SER 113 H SER 113 12.331 -2.036 0.482 891 HA SER 113 HA SER 113 13.020 0.796 0.155 892 HB2 SER 113 1HB SER 113 11.462 -1.029 -1.704 893 HB3 SER 113 2HB SER 113 12.005 0.620 -2.060 894 HG SER 113 HG SER 113 13.921 -1.255 -1.266 895 H LYS 114 H LYS 114 10.617 -1.209 1.431 896 HA LYS 114 HA LYS 114 8.224 0.027 0.914 897 HB2 LYS 114 1HB LYS 114 8.162 -1.930 2.218 898 HB3 LYS 114 2HB LYS 114 9.288 -1.266 3.413 899 HG2 LYS 114 1HG LYS 114 7.605 0.271 4.222 900 HG3 LYS 114 2HG LYS 114 6.479 -0.276 2.968 901 HD2 LYS 114 1HD LYS 114 5.730 -1.809 4.402 902 HD3 LYS 114 2HD LYS 114 7.306 -2.608 4.265 903 HE2 LYS 114 1HE LYS 114 8.156 -1.526 6.183 904 HE3 LYS 114 2HE LYS 114 6.844 -0.338 6.179 905 HZ1 LYS 114 3HZ LYS 114 6.849 -2.425 7.778 906 HZ2 LYS 114 1HZ LYS 114 6.084 -3.141 6.450 907 HZ3 LYS 114 2HZ LYS 114 5.416 -1.765 7.170 908 H ASN 115 H ASN 115 10.447 0.852 3.579 909 HA ASN 115 HA ASN 115 9.041 3.039 4.565 910 HB2 ASN 115 1HB ASN 115 11.011 3.645 5.736 911 HB3 ASN 115 2HB ASN 115 11.062 1.884 5.592 912 HD21 ASN 115 2HD2 ASN 115 13.986 1.772 3.740 913 HD22 ASN 115 1HD2 ASN 115 12.667 0.919 4.459 914 H ARG 116 H ARG 116 11.485 2.884 2.008 915 HA ARG 116 HA ARG 116 11.837 5.596 1.540 916 HB2 ARG 116 1HB ARG 116 13.267 4.016 0.462 917 HB3 ARG 116 2HB ARG 116 11.898 3.252 -0.358 918 HG2 ARG 116 1HG ARG 116 12.937 4.523 -2.020 919 HG3 ARG 116 2HG ARG 116 11.542 5.491 -1.516 920 HD2 ARG 116 1HD ARG 116 13.131 7.130 -1.465 921 HD3 ARG 116 2HD ARG 116 13.324 6.496 0.176 922 HE ARG 116 HE ARG 116 15.012 5.112 -1.631 923 HH11 ARG 116 2HH1 ARG 116 14.675 8.140 0.052 924 HH12 ARG 116 1HH1 ARG 116 16.377 8.459 0.090 925 HH21 ARG 116 1HH2 ARG 116 17.845 6.969 -0.845 926 HH22 ARG 116 2HH2 ARG 116 17.256 5.520 -1.588 927 H LEU 117 H LEU 117 9.582 3.406 -0.151 928 HA LEU 117 HA LEU 117 8.295 5.382 -1.657 929 HB2 LEU 117 1HB LEU 117 8.036 3.100 -2.273 930 HB3 LEU 117 2HB LEU 117 7.382 2.689 -0.678 931 HG LEU 117 HG LEU 117 5.415 4.214 -1.290 932 HD11 LEU 117 1HD1 LEU 117 6.100 3.628 -4.123 933 HD12 LEU 117 2HD1 LEU 117 6.843 5.027 -3.349 934 HD13 LEU 117 3HD1 LEU 117 5.087 4.901 -3.442 935 HD21 LEU 117 3HD2 LEU 117 5.551 1.831 -3.081 936 HD22 LEU 117 1HD2 LEU 117 4.231 2.397 -2.059 937 HD23 LEU 117 2HD2 LEU 117 5.633 1.611 -1.333 938 H VAL 118 H VAL 118 7.101 3.770 1.296 939 HA VAL 118 HA VAL 118 4.834 5.236 1.744 940 HB VAL 118 HB VAL 118 6.784 4.215 3.812 941 HG11 VAL 118 1HG1 VAL 118 4.670 5.970 4.219 942 HG12 VAL 118 2HG1 VAL 118 4.020 4.387 4.649 943 HG13 VAL 118 3HG1 VAL 118 5.478 4.988 5.441 944 HG21 VAL 118 3HG2 VAL 118 5.907 2.474 2.354 945 HG22 VAL 118 1HG2 VAL 118 5.226 2.325 3.974 946 HG23 VAL 118 2HG2 VAL 118 4.259 3.016 2.672 947 H GLN 119 H GLN 119 8.070 6.002 3.035 948 HA GLN 119 HA GLN 119 7.489 8.348 4.346 949 HB2 GLN 119 1HB GLN 119 9.922 7.307 2.956 950 HB3 GLN 119 2HB GLN 119 9.916 8.989 3.511 951 HG2 GLN 119 1HG GLN 119 9.055 7.837 5.755 952 HG3 GLN 119 2HG GLN 119 9.959 6.478 5.072 953 HE21 GLN 119 2HE2 GLN 119 11.905 9.303 7.010 954 HE22 GLN 119 1HE2 GLN 119 10.207 9.001 7.099 955 H THR 120 H THR 120 8.221 7.904 0.910 956 HA THR 120 HA THR 120 8.284 10.585 0.145 957 HB THR 120 HB THR 120 7.181 8.366 -1.577 958 HG1 THR 120 1HG THR 120 9.093 7.485 -1.475 959 HG21 THR 120 3HG2 THR 120 7.816 11.115 -2.018 960 HG22 THR 120 1HG2 THR 120 7.192 9.929 -3.163 961 HG23 THR 120 2HG2 THR 120 8.932 10.116 -2.948 962 H ALA 121 H ALA 121 5.545 8.336 0.329 963 HA ALA 121 HA ALA 121 3.619 10.190 -0.639 964 HB1 ALA 121 3HB ALA 121 2.027 8.505 0.556 965 HB2 ALA 121 1HB ALA 121 2.923 8.009 -0.880 966 HB3 ALA 121 2HB ALA 121 3.493 7.536 0.721 967 H GLU 122 H GLU 122 5.025 9.581 2.471 968 HA GLU 122 HA GLU 122 4.918 10.803 4.402 969 HB2 GLU 122 1HB GLU 122 4.405 12.713 2.728 970 HB3 GLU 122 2HB GLU 122 2.725 12.499 3.244 971 HG2 GLU 122 1HG GLU 122 3.183 13.151 5.448 972 HG3 GLU 122 2HG GLU 122 4.927 12.945 5.226 973 H LEU 123 H LEU 123 3.351 8.459 3.884 974 HA LEU 123 HA LEU 123 0.784 8.911 5.165 975 HB2 LEU 123 1HB LEU 123 2.027 6.270 4.401 976 HB3 LEU 123 2HB LEU 123 0.317 6.623 4.708 977 HG LEU 123 HG LEU 123 1.651 8.037 2.456 978 HD11 LEU 123 1HD1 LEU 123 2.165 5.452 2.522 979 HD12 LEU 123 2HD1 LEU 123 1.720 6.265 1.021 980 HD13 LEU 123 3HD1 LEU 123 0.511 5.346 1.919 981 HD21 LEU 123 3HD2 LEU 123 -0.730 8.400 3.218 982 HD22 LEU 123 1HD2 LEU 123 -1.071 6.768 2.641 983 HD23 LEU 123 2HD2 LEU 123 -0.518 8.005 1.511 984 H THR 124 H THR 124 0.667 9.051 7.297 985 HA THR 124 HA THR 124 2.723 8.249 9.060 986 HB THR 124 HB THR 124 -0.127 9.103 9.508 987 HG1 THR 124 1HG THR 124 0.972 10.910 10.423 988 HG21 THR 124 3HG2 THR 124 1.863 8.079 11.512 989 HG22 THR 124 1HG2 THR 124 0.162 7.654 11.329 990 HG23 THR 124 2HG2 THR 124 0.612 9.236 11.965 991 H LYS 125 H LYS 125 -0.474 6.850 8.370 992 HA LYS 125 HA LYS 125 0.013 4.575 10.068 993 HB2 LYS 125 1HB LYS 125 -2.201 5.270 8.132 994 HB3 LYS 125 2HB LYS 125 -2.161 3.758 9.056 995 HG2 LYS 125 1HG LYS 125 -1.862 5.439 11.091 996 HG3 LYS 125 2HG LYS 125 -2.699 6.527 9.969 997 HD2 LYS 125 1HD LYS 125 -4.303 4.441 9.674 998 HD3 LYS 125 2HD LYS 125 -3.672 4.035 11.279 999 HE2 LYS 125 1HE LYS 125 -4.454 6.849 11.010 1000 HE3 LYS 125 2HE LYS 125 -5.786 5.709 10.770 1001 HZ1 LYS 125 3HZ LYS 125 -5.912 5.515 12.958 1002 HZ2 LYS 125 1HZ LYS 125 -4.542 6.484 13.181 1003 HZ3 LYS 125 2HZ LYS 125 -4.373 4.812 12.978 1004 H VAL 126 H VAL 126 1.007 2.754 9.513 1005 HA VAL 126 HA VAL 126 1.107 1.986 6.679 1006 HB VAL 126 HB VAL 126 3.460 2.043 8.570 1007 HG11 VAL 126 1HG1 VAL 126 4.348 0.356 7.433 1008 HG12 VAL 126 2HG1 VAL 126 2.910 0.257 6.416 1009 HG13 VAL 126 3HG1 VAL 126 4.246 1.313 5.956 1010 HG21 VAL 126 3HG2 VAL 126 4.442 3.446 6.730 1011 HG22 VAL 126 1HG2 VAL 126 2.833 3.497 6.008 1012 HG23 VAL 126 2HG2 VAL 126 3.104 4.191 7.607 1013 H PHE 127 H PHE 127 -0.147 0.212 6.726 1014 HA PHE 127 HA PHE 127 0.207 -1.738 8.879 1015 HB2 PHE 127 1HB PHE 127 -1.851 -1.740 6.657 1016 HB3 PHE 127 2HB PHE 127 -1.862 -2.734 8.116 1017 HD1 PHE 127 1HD PHE 127 -0.945 -0.450 9.986 1018 HD2 PHE 127 2HD PHE 127 -4.011 -0.766 7.050 1019 HE1 PHE 127 1HE PHE 127 -2.254 1.262 11.173 1020 HE2 PHE 127 2HE PHE 127 -5.324 0.946 8.231 1021 HZ PHE 127 HZ PHE 127 -4.445 1.963 10.296 1022 H GLU 128 H GLU 128 0.261 -4.052 8.296 1023 HA GLU 128 HA GLU 128 1.464 -4.592 5.678 1024 HB2 GLU 128 1HB GLU 128 3.270 -4.219 7.371 1025 HB3 GLU 128 2HB GLU 128 2.638 -5.607 8.270 1026 HG2 GLU 128 1HG GLU 128 3.281 -6.032 5.406 1027 HG3 GLU 128 2HG GLU 128 4.632 -5.812 6.526 1028 H ILE 129 H ILE 129 0.468 -6.239 4.740 1029 HA ILE 129 HA ILE 129 -1.080 -8.092 6.404 1030 HB ILE 129 HB ILE 129 -2.008 -8.785 4.090 1031 HG12 ILE 129 1HG1 ILE 129 -1.103 -6.000 3.367 1032 HG13 ILE 129 2HG1 ILE 129 -0.156 -7.433 2.932 1033 HG21 ILE 129 1HG2 ILE 129 -3.780 -7.309 4.351 1034 HG22 ILE 129 2HG2 ILE 129 -3.063 -7.357 5.961 1035 HG23 ILE 129 3HG2 ILE 129 -2.735 -5.994 4.890 1036 HD11 ILE 129 3HD1 ILE 129 -3.040 -7.251 2.175 1037 HD12 ILE 129 1HD1 ILE 129 -1.797 -6.461 1.205 1038 HD13 ILE 129 2HD1 ILE 129 -1.750 -8.207 1.446 1039 H ARG 130 H ARG 130 -0.633 -10.217 6.517 1040 HA ARG 130 HA ARG 130 1.855 -11.143 5.377 1041 HB2 ARG 130 1HB ARG 130 1.040 -11.645 7.731 1042 HB3 ARG 130 2HB ARG 130 -0.116 -12.761 6.988 1043 HG2 ARG 130 1HG ARG 130 1.569 -14.216 7.485 1044 HG3 ARG 130 2HG ARG 130 2.043 -13.731 5.848 1045 HD2 ARG 130 1HD ARG 130 4.047 -13.368 6.849 1046 HD3 ARG 130 2HD ARG 130 3.294 -11.815 7.238 1047 HE ARG 130 HE ARG 130 3.214 -12.431 9.448 1048 HH11 ARG 130 2HH1 ARG 130 3.946 -15.214 7.488 1049 HH12 ARG 130 1HH1 ARG 130 4.324 -16.229 8.841 1050 HH21 ARG 130 1HH2 ARG 130 4.188 -15.400 10.972 1051 HH22 ARG 130 2HH2 ARG 130 3.710 -13.757 11.237 1052 H THR 131 H THR 131 -1.323 -11.045 4.357 1053 HA THR 131 HA THR 131 -0.819 -12.584 2.036 1054 HB THR 131 HB THR 131 -1.103 -14.492 3.531 1055 HG1 THR 131 1HG THR 131 -3.014 -13.921 1.556 1056 HG21 THR 131 3HG2 THR 131 -2.899 -14.822 4.943 1057 HG22 THR 131 1HG2 THR 131 -3.956 -13.752 4.024 1058 HG23 THR 131 2HG2 THR 131 -2.696 -13.074 5.056 1059 H THR 132 H THR 132 -2.384 -12.286 0.466 1060 HA THR 132 HA THR 132 -3.884 -10.010 0.441 1061 HB THR 132 HB THR 132 -5.289 -11.099 -1.348 1062 HG1 THR 132 1HG THR 132 -3.549 -13.304 -1.230 1063 HG21 THR 132 3HG2 THR 132 -3.640 -10.819 -2.899 1064 HG22 THR 132 1HG2 THR 132 -2.470 -11.774 -1.991 1065 HG23 THR 132 2HG2 THR 132 -2.817 -10.114 -1.508 1066 H ASP 133 H ASP 133 -4.953 -13.230 1.457 1067 HA ASP 133 HA ASP 133 -7.639 -12.853 1.795 1068 HB2 ASP 133 1HB ASP 133 -5.640 -14.651 2.830 1069 HB3 ASP 133 2HB ASP 133 -6.799 -14.246 4.103 1070 H ASP 134 H ASP 134 -5.037 -11.721 3.876 1071 HA ASP 134 HA ASP 134 -6.463 -10.925 6.107 1072 HB2 ASP 134 1HB ASP 134 -4.068 -9.610 4.797 1073 HB3 ASP 134 2HB ASP 134 -4.666 -9.206 6.411 1074 H LEU 135 H LEU 135 -5.596 -8.854 3.332 1075 HA LEU 135 HA LEU 135 -6.916 -6.565 3.995 1076 HB2 LEU 135 1HB LEU 135 -5.592 -6.592 2.035 1077 HB3 LEU 135 2HB LEU 135 -6.567 -7.888 1.320 1078 HG LEU 135 HG LEU 135 -8.331 -6.419 0.794 1079 HD11 LEU 135 1HD1 LEU 135 -7.141 -4.754 2.914 1080 HD12 LEU 135 2HD1 LEU 135 -8.830 -5.010 2.480 1081 HD13 LEU 135 3HD1 LEU 135 -7.840 -3.887 1.547 1082 HD21 LEU 135 3HD2 LEU 135 -6.909 -4.375 -0.183 1083 HD22 LEU 135 1HD2 LEU 135 -6.904 -5.982 -0.907 1084 HD23 LEU 135 2HD2 LEU 135 -5.592 -5.495 0.168 1085 H THR 136 H THR 136 -8.843 -6.799 5.065 1086 HA THR 136 HA THR 136 -11.117 -7.638 3.404 1087 HB THR 136 HB THR 136 -12.092 -8.366 5.771 1088 HG1 THR 136 1HG THR 136 -10.534 -9.176 7.110 1089 HG21 THR 136 3HG2 THR 136 -11.864 -9.747 3.701 1090 HG22 THR 136 1HG2 THR 136 -11.620 -10.649 5.196 1091 HG23 THR 136 2HG2 THR 136 -10.232 -10.166 4.221 1092 H GLU 137 H GLU 137 -13.017 -6.493 3.705 1093 HA GLU 137 HA GLU 137 -12.991 -3.848 4.219 1094 HB2 GLU 137 1HB GLU 137 -14.927 -5.078 3.306 1095 HB3 GLU 137 2HB GLU 137 -15.283 -5.688 4.930 1096 HG2 GLU 137 1HG GLU 137 -15.315 -3.124 5.536 1097 HG3 GLU 137 2HG GLU 137 -15.654 -2.963 3.807 1098 H THR 138 H THR 138 -13.613 -6.365 6.642 1099 HA THR 138 HA THR 138 -13.975 -4.562 8.806 1100 HB THR 138 HB THR 138 -13.077 -7.432 9.058 1101 HG1 THR 138 1HG THR 138 -15.237 -8.006 8.876 1102 HG21 THR 138 3HG2 THR 138 -13.079 -6.189 11.136 1103 HG22 THR 138 1HG2 THR 138 -14.427 -7.326 11.132 1104 HG23 THR 138 2HG2 THR 138 -14.717 -5.613 10.825 1105 H TRP 139 H TRP 139 -11.294 -6.844 8.206 1106 HA TRP 139 HA TRP 139 -9.518 -6.067 10.089 1107 HB2 TRP 139 1HB TRP 139 -8.858 -7.853 8.715 1108 HB3 TRP 139 2HB TRP 139 -9.081 -6.913 7.239 1109 HD1 TRP 139 HD TRP 139 -6.505 -7.671 9.906 1110 HE1 TRP 139 1HE TRP 139 -4.262 -6.593 9.249 1111 HE3 TRP 139 3HE TRP 139 -8.094 -4.832 5.964 1112 HZ2 TRP 139 2HZ TRP 139 -3.295 -4.778 7.315 1113 HZ3 TRP 139 3HZ TRP 139 -6.448 -3.453 4.764 1114 HH2 TRP 139 HH TRP 139 -4.098 -3.427 5.427 1115 H LEU 140 H LEU 140 -10.528 -4.213 7.349 1116 HA LEU 140 HA LEU 140 -8.357 -2.308 7.570 1117 HB2 LEU 140 1HB LEU 140 -9.104 -2.664 5.366 1118 HB3 LEU 140 2HB LEU 140 -10.803 -2.506 5.842 1119 HG LEU 140 HG LEU 140 -10.614 -0.143 6.056 1120 HD11 LEU 140 1HD1 LEU 140 -7.678 -0.350 5.430 1121 HD12 LEU 140 2HD1 LEU 140 -8.317 -0.214 7.068 1122 HD13 LEU 140 3HD1 LEU 140 -8.589 1.084 5.906 1123 HD21 LEU 140 3HD2 LEU 140 -11.008 -0.610 3.823 1124 HD22 LEU 140 1HD2 LEU 140 -9.415 -1.325 3.583 1125 HD23 LEU 140 2HD2 LEU 140 -9.580 0.423 3.744 1126 H LYS 141 H LYS 141 -11.904 -1.926 7.654 1127 HA LYS 141 HA LYS 141 -11.993 0.577 8.803 1128 HB2 LYS 141 1HB LYS 141 -13.845 -1.726 8.619 1129 HB3 LYS 141 2HB LYS 141 -14.215 -0.537 9.878 1130 HG2 LYS 141 1HG LYS 141 -14.779 1.084 8.399 1131 HG3 LYS 141 2HG LYS 141 -13.613 0.527 7.187 1132 HD2 LYS 141 1HD LYS 141 -15.407 -0.265 6.092 1133 HD3 LYS 141 2HD LYS 141 -15.359 -1.572 7.288 1134 HE2 LYS 141 1HE LYS 141 -16.765 0.883 8.148 1135 HE3 LYS 141 2HE LYS 141 -17.524 -0.017 6.826 1136 HZ1 LYS 141 3HZ LYS 141 -16.794 -1.102 9.493 1137 HZ2 LYS 141 1HZ LYS 141 -17.425 -2.021 8.219 1138 HZ3 LYS 141 2HZ LYS 141 -18.357 -0.798 8.923 1139 H GLU 142 H GLU 142 -11.048 -2.379 10.242 1140 HA GLU 142 HA GLU 142 -11.678 -1.806 12.943 1141 HB2 GLU 142 1HB GLU 142 -9.877 -3.724 11.526 1142 HB3 GLU 142 2HB GLU 142 -9.642 -3.473 13.263 1143 HG2 GLU 142 1HG GLU 142 -12.234 -3.883 13.365 1144 HG3 GLU 142 2HG GLU 142 -11.936 -4.698 11.822 1145 H LYS 143 H LYS 143 -8.595 -1.577 11.165 1146 HA LYS 143 HA LYS 143 -7.152 -0.360 13.252 1147 HB2 LYS 143 1HB LYS 143 -6.641 -0.033 10.289 1148 HB3 LYS 143 2HB LYS 143 -5.466 0.116 11.604 1149 HG2 LYS 143 1HG LYS 143 -6.684 -2.465 11.752 1150 HG3 LYS 143 2HG LYS 143 -6.112 -2.175 10.098 1151 HD2 LYS 143 1HD LYS 143 -4.001 -1.237 11.529 1152 HD3 LYS 143 2HD LYS 143 -4.588 -2.527 12.593 1153 HE2 LYS 143 1HE LYS 143 -4.315 -4.185 10.923 1154 HE3 LYS 143 2HE LYS 143 -4.127 -2.965 9.654 1155 HZ1 LYS 143 3HZ LYS 143 -2.068 -4.188 10.708 1156 HZ2 LYS 143 1HZ LYS 143 -2.190 -2.941 11.844 1157 HZ3 LYS 143 2HZ LYS 143 -1.975 -2.576 10.208 1158 H LEU 144 H LEU 144 -9.077 0.974 10.618 1159 HA LEU 144 HA LEU 144 -8.341 3.676 10.987 1160 HB2 LEU 144 1HB LEU 144 -10.993 2.696 9.938 1161 HB3 LEU 144 2HB LEU 144 -10.167 4.220 9.571 1162 HG LEU 144 HG LEU 144 -9.251 1.480 8.699 1163 HD11 LEU 144 1HD1 LEU 144 -10.926 1.761 7.224 1164 HD12 LEU 144 2HD1 LEU 144 -9.778 2.841 6.434 1165 HD13 LEU 144 3HD1 LEU 144 -11.022 3.501 7.497 1166 HD21 LEU 144 3HD2 LEU 144 -7.962 3.292 7.139 1167 HD22 LEU 144 1HD2 LEU 144 -7.272 2.532 8.574 1168 HD23 LEU 144 2HD2 LEU 144 -8.000 4.134 8.689 1169 H ALA 145 H ALA 145 -11.119 1.793 12.160 1170 HA ALA 145 HA ALA 145 -12.690 3.545 13.410 1171 HB1 ALA 145 3HB ALA 145 -12.296 0.849 13.653 1172 HB2 ALA 145 1HB ALA 145 -11.954 1.429 15.282 1173 HB3 ALA 145 2HB ALA 145 -13.507 1.787 14.527 1174 H SER 146 H SER 146 -10.009 2.113 15.276 1175 HA SER 146 HA SER 146 -8.983 4.596 16.169 1176 HB2 SER 146 1HB SER 146 -11.318 4.073 17.432 1177 HB3 SER 146 2HB SER 146 -10.191 3.217 18.499 1178 HG SER 146 HG SER 146 -10.145 5.225 19.289 1179 H GLY 147 H GLY 147 -7.948 2.190 15.103 1180 HA2 GLY 147 1HA GLY 147 -5.864 1.175 15.484 1181 HA3 GLY 147 2HA GLY 147 -6.004 1.578 17.188 1182 HA PRO 148 HA PRO 148 -7.455 -2.881 16.063 1183 HB2 PRO 148 2HB PRO 148 -5.762 -3.583 14.677 1184 HB3 PRO 148 1HB PRO 148 -5.098 -4.273 16.156 1185 HG2 PRO 148 1HG PRO 148 -3.669 -2.475 16.517 1186 HG3 PRO 148 2HG PRO 148 -3.676 -2.557 14.716 1187 HD2 PRO 148 1HD PRO 148 -4.260 -0.286 16.080 1188 HD3 PRO 148 2HD PRO 148 -5.027 -0.699 14.539 1189 H SER 149 H SER 149 -6.629 -4.940 17.464 1190 HA SER 149 HA SER 149 -6.903 -4.055 20.214 1191 HB2 SER 149 1HB SER 149 -8.314 -5.897 19.383 1192 HB3 SER 149 2HB SER 149 -6.858 -6.852 19.053 1193 HG SER 149 HG SER 149 -6.404 -6.519 21.389 1194 H SER 150 H SER 150 -5.314 -3.975 21.663 1195 HA SER 150 HA SER 150 -3.075 -5.722 21.669 1196 HB2 SER 150 1HB SER 150 -2.679 -3.880 19.793 1197 HB3 SER 150 2HB SER 150 -2.196 -2.907 21.192 1198 HG SER 150 HG SER 150 -0.697 -4.559 21.726 1199 H GLY 151 H GLY 151 -3.643 -6.006 23.817 1200 HA2 GLY 151 1HA GLY 151 -2.909 -3.756 25.571 1201 HA3 GLY 151 2HA GLY 151 -4.401 -4.639 25.857 Start of MODEL 7 1 H1 GLY 1 H GLY 1 4.095 -10.218 16.135 2 HA2 GLY 1 1HA GLY 1 5.436 -10.956 14.063 3 HA3 GLY 1 2HA GLY 1 4.196 -10.060 13.197 4 H SER 2 H SER 2 4.289 -7.854 13.105 5 HA SER 2 HA SER 2 5.249 -5.792 13.115 6 HB2 SER 2 1HB SER 2 6.051 -6.752 15.873 7 HB3 SER 2 2HB SER 2 6.367 -5.108 15.290 8 HG SER 2 HG SER 2 4.430 -4.995 16.314 9 H SER 3 H SER 3 6.813 -5.503 11.674 10 HA SER 3 HA SER 3 9.537 -6.345 12.385 11 HB2 SER 3 1HB SER 3 8.029 -7.610 10.427 12 HB3 SER 3 2HB SER 3 9.024 -6.462 9.512 13 HG SER 3 HG SER 3 10.848 -7.411 10.268 14 H GLY 4 H GLY 4 10.278 -4.320 12.851 15 HA2 GLY 4 1HA GLY 4 10.839 -2.601 10.612 16 HA3 GLY 4 2HA GLY 4 9.679 -1.907 11.737 17 H SER 5 H SER 5 12.953 -2.387 11.039 18 HA SER 5 HA SER 5 13.792 -1.762 13.776 19 HB2 SER 5 1HB SER 5 14.877 -3.412 11.768 20 HB3 SER 5 2HB SER 5 15.976 -2.028 11.902 21 HG SER 5 HG SER 5 16.232 -3.956 13.388 22 H SER 6 H SER 6 15.548 -0.137 14.024 23 HA SER 6 HA SER 6 14.899 2.229 12.429 24 HB2 SER 6 1HB SER 6 14.885 2.102 15.044 25 HB3 SER 6 2HB SER 6 16.641 2.283 14.874 26 HG SER 6 HG SER 6 15.149 4.251 15.029 27 H GLY 7 H GLY 7 16.119 1.824 10.573 28 HA2 GLY 7 1HA GLY 7 17.987 1.866 9.238 29 HA3 GLY 7 2HA GLY 7 18.706 2.847 10.505 30 H SER 8 H SER 8 18.494 -0.299 9.086 31 HA SER 8 HA SER 8 21.001 -1.132 9.946 32 HB2 SER 8 1HB SER 8 20.314 -2.927 11.593 33 HB3 SER 8 2HB SER 8 20.191 -1.264 12.196 34 HG SER 8 HG SER 8 18.053 -1.385 12.186 35 H ASP 9 H ASP 9 21.357 -3.509 9.567 36 HA ASP 9 HA ASP 9 21.207 -5.348 8.235 37 HB2 ASP 9 1HB ASP 9 18.394 -4.666 8.825 38 HB3 ASP 9 2HB ASP 9 18.636 -5.654 7.377 39 H SER 10 H SER 10 22.056 -5.334 6.272 40 HA SER 10 HA SER 10 21.628 -3.232 4.421 41 HB2 SER 10 1HB SER 10 22.982 -4.681 2.861 42 HB3 SER 10 2HB SER 10 23.755 -4.343 4.420 43 HG SER 10 HG SER 10 23.635 -6.640 3.531 44 H LEU 11 H LEU 11 20.410 -3.115 2.591 45 HA LEU 11 HA LEU 11 18.899 -5.444 1.710 46 HB2 LEU 11 1HB LEU 11 17.498 -2.847 2.341 47 HB3 LEU 11 2HB LEU 11 16.769 -4.381 1.837 48 HG LEU 11 HG LEU 11 18.288 -4.312 4.399 49 HD11 LEU 11 1HD1 LEU 11 16.342 -3.533 5.613 50 HD12 LEU 11 2HD1 LEU 11 15.469 -3.288 4.100 51 HD13 LEU 11 3HD1 LEU 11 16.882 -2.300 4.472 52 HD21 LEU 11 3HD2 LEU 11 16.617 -5.962 5.034 53 HD22 LEU 11 1HD2 LEU 11 17.388 -6.412 3.513 54 HD23 LEU 11 2HD2 LEU 11 15.769 -5.713 3.507 55 H VAL 12 H VAL 12 17.155 -4.134 -0.016 56 HA VAL 12 HA VAL 12 19.052 -3.088 -1.995 57 HB VAL 12 HB VAL 12 16.235 -3.855 -2.659 58 HG11 VAL 12 1HG1 VAL 12 16.979 -3.996 -4.817 59 HG12 VAL 12 2HG1 VAL 12 18.085 -2.769 -4.196 60 HG13 VAL 12 3HG1 VAL 12 18.616 -4.445 -4.340 61 HG21 VAL 12 3HG2 VAL 12 18.536 -5.780 -2.343 62 HG22 VAL 12 1HG2 VAL 12 17.074 -5.727 -1.358 63 HG23 VAL 12 2HG2 VAL 12 16.974 -6.164 -3.064 64 H VAL 13 H VAL 13 18.192 -1.353 0.060 65 HA VAL 13 HA VAL 13 16.072 0.258 -0.180 66 HB VAL 13 HB VAL 13 18.927 1.218 0.065 67 HG11 VAL 13 1HG1 VAL 13 16.319 2.634 0.233 68 HG12 VAL 13 2HG1 VAL 13 17.593 3.092 1.365 69 HG13 VAL 13 3HG1 VAL 13 17.877 3.198 -0.372 70 HG21 VAL 13 3HG2 VAL 13 17.887 1.413 2.535 71 HG22 VAL 13 1HG2 VAL 13 16.968 0.033 1.931 72 HG23 VAL 13 2HG2 VAL 13 18.732 -0.021 1.950 73 H CYS 14 H CYS 14 15.068 0.711 -2.053 74 HA CYS 14 HA CYS 14 16.638 1.757 -4.295 75 HB2 CYS 14 1HB CYS 14 13.852 0.631 -4.082 76 HB3 CYS 14 2HB CYS 14 14.424 1.461 -5.539 77 HG CYS 14 HG CYS 14 14.665 -1.136 -6.247 78 H GLU 15 H GLU 15 15.058 3.338 -5.661 79 HA GLU 15 HA GLU 15 14.439 5.527 -3.797 80 HB2 GLU 15 1HB GLU 15 14.791 7.043 -5.698 81 HB3 GLU 15 2HB GLU 15 16.219 6.045 -5.378 82 HG2 GLU 15 1HG GLU 15 15.045 4.486 -7.198 83 HG3 GLU 15 2HG GLU 15 14.392 6.052 -7.703 84 H VAL 16 H VAL 16 12.736 7.078 -4.655 85 HA VAL 16 HA VAL 16 10.413 5.492 -5.477 86 HB VAL 16 HB VAL 16 10.558 8.255 -4.263 87 HG11 VAL 16 1HG1 VAL 16 8.546 8.495 -5.227 88 HG12 VAL 16 2HG1 VAL 16 8.378 6.767 -5.540 89 HG13 VAL 16 3HG1 VAL 16 7.991 7.418 -3.946 90 HG21 VAL 16 3HG2 VAL 16 9.776 5.581 -3.111 91 HG22 VAL 16 1HG2 VAL 16 11.158 6.577 -2.654 92 HG23 VAL 16 2HG2 VAL 16 9.519 7.128 -2.304 93 H ASP 17 H ASP 17 10.270 5.419 -7.642 94 HA ASP 17 HA ASP 17 11.210 6.955 -9.604 95 HB2 ASP 17 1HB ASP 17 9.706 4.969 -9.889 96 HB3 ASP 17 2HB ASP 17 8.329 6.036 -9.583 97 HA PRO 18 HA PRO 18 9.738 11.077 -9.121 98 HB2 PRO 18 2HB PRO 18 11.475 11.693 -10.494 99 HB3 PRO 18 1HB PRO 18 10.190 11.981 -11.667 100 HG2 PRO 18 1HG PRO 18 10.481 9.919 -12.699 101 HG3 PRO 18 2HG PRO 18 12.177 10.315 -12.230 102 HD2 PRO 18 1HD PRO 18 10.971 7.983 -11.538 103 HD3 PRO 18 2HD PRO 18 12.156 8.793 -10.499 104 H GLU 19 H GLU 19 8.515 9.019 -11.698 105 HA GLU 19 HA GLU 19 6.309 10.729 -12.354 106 HB2 GLU 19 1HB GLU 19 5.798 9.223 -13.998 107 HB3 GLU 19 2HB GLU 19 7.503 8.821 -13.746 108 HG2 GLU 19 1HG GLU 19 6.819 6.716 -13.530 109 HG3 GLU 19 2HG GLU 19 6.251 7.208 -11.927 110 H LEU 20 H LEU 20 6.907 8.215 -10.051 111 HA LEU 20 HA LEU 20 4.084 7.821 -9.479 112 HB2 LEU 20 1HB LEU 20 6.038 6.068 -9.414 113 HB3 LEU 20 2HB LEU 20 6.279 6.722 -7.784 114 HG LEU 20 HG LEU 20 3.757 5.418 -8.811 115 HD11 LEU 20 1HD1 LEU 20 4.652 3.489 -8.196 116 HD12 LEU 20 2HD1 LEU 20 4.914 4.115 -6.568 117 HD13 LEU 20 3HD1 LEU 20 6.162 4.312 -7.799 118 HD21 LEU 20 3HD2 LEU 20 2.797 6.634 -7.192 119 HD22 LEU 20 1HD2 LEU 20 4.344 7.062 -6.461 120 HD23 LEU 20 2HD2 LEU 20 3.591 5.510 -6.088 121 H LYS 21 H LYS 21 6.948 9.225 -7.951 122 HA LYS 21 HA LYS 21 6.142 9.815 -5.444 123 HB2 LYS 21 1HB LYS 21 8.294 10.502 -6.621 124 HB3 LYS 21 2HB LYS 21 7.405 11.924 -7.191 125 HG2 LYS 21 1HG LYS 21 6.855 12.124 -4.583 126 HG3 LYS 21 2HG LYS 21 8.407 11.271 -4.487 127 HD2 LYS 21 1HD LYS 21 8.402 13.496 -6.400 128 HD3 LYS 21 2HD LYS 21 8.101 13.984 -4.723 129 HE2 LYS 21 1HE LYS 21 10.154 12.276 -4.332 130 HE3 LYS 21 2HE LYS 21 10.533 12.851 -5.963 131 HZ1 LYS 21 3HZ LYS 21 11.489 14.152 -4.030 132 HZ2 LYS 21 1HZ LYS 21 9.922 14.728 -3.760 133 HZ3 LYS 21 2HZ LYS 21 10.699 15.049 -5.228 134 H GLU 22 H GLU 22 5.208 11.613 -8.356 135 HA GLU 22 HA GLU 22 3.672 13.574 -7.021 136 HB2 GLU 22 1HB GLU 22 3.141 12.615 -9.828 137 HB3 GLU 22 2HB GLU 22 2.908 14.236 -9.155 138 HG2 GLU 22 1HG GLU 22 5.495 14.161 -8.799 139 HG3 GLU 22 2HG GLU 22 5.420 12.899 -10.037 140 H THR 23 H THR 23 2.811 10.487 -8.532 141 HA THR 23 HA THR 23 0.076 10.553 -8.390 142 HB THR 23 HB THR 23 2.001 8.276 -8.004 143 HG1 THR 23 1HG THR 23 1.409 9.392 -10.106 144 HG21 THR 23 3HG2 THR 23 0.302 7.316 -6.811 145 HG22 THR 23 1HG2 THR 23 -0.246 6.930 -8.442 146 HG23 THR 23 2HG2 THR 23 -0.943 8.302 -7.579 147 H LEU 24 H LEU 24 2.359 9.910 -5.779 148 HA LEU 24 HA LEU 24 0.395 9.180 -3.854 149 HB2 LEU 24 1HB LEU 24 3.106 10.344 -3.246 150 HB3 LEU 24 2HB LEU 24 2.140 9.229 -2.264 151 HG LEU 24 HG LEU 24 3.618 8.590 -4.813 152 HD11 LEU 24 1HD1 LEU 24 4.434 8.625 -2.140 153 HD12 LEU 24 2HD1 LEU 24 5.271 7.892 -3.509 154 HD13 LEU 24 3HD1 LEU 24 4.163 6.927 -2.533 155 HD21 LEU 24 3HD2 LEU 24 2.843 6.208 -4.106 156 HD22 LEU 24 1HD2 LEU 24 1.755 7.247 -5.028 157 HD23 LEU 24 2HD2 LEU 24 1.545 7.075 -3.284 158 H ARG 25 H ARG 25 2.275 12.168 -4.343 159 HA ARG 25 HA ARG 25 1.084 13.674 -2.321 160 HB2 ARG 25 1HB ARG 25 3.126 14.370 -3.470 161 HB3 ARG 25 2HB ARG 25 2.211 14.613 -4.964 162 HG2 ARG 25 1HG ARG 25 0.798 16.215 -3.348 163 HG3 ARG 25 2HG ARG 25 2.379 16.305 -2.553 164 HD2 ARG 25 1HD ARG 25 2.394 16.568 -5.503 165 HD3 ARG 25 2HD ARG 25 1.645 17.892 -4.600 166 HE ARG 25 HE ARG 25 4.121 17.282 -3.426 167 HH11 ARG 25 2HH1 ARG 25 2.801 18.664 -6.337 168 HH12 ARG 25 1HH1 ARG 25 4.173 19.679 -6.633 169 HH21 ARG 25 1HH2 ARG 25 5.955 19.648 -5.193 170 HH22 ARG 25 2HH2 ARG 25 5.933 18.614 -3.805 171 H LYS 26 H LYS 26 0.012 12.954 -5.570 172 HA LYS 26 HA LYS 26 -2.121 14.890 -5.538 173 HB2 LYS 26 1HB LYS 26 -1.945 12.541 -7.412 174 HB3 LYS 26 2HB LYS 26 -2.652 14.138 -7.701 175 HG2 LYS 26 1HG LYS 26 0.117 14.469 -7.085 176 HG3 LYS 26 2HG LYS 26 -0.059 13.233 -8.343 177 HD2 LYS 26 1HD LYS 26 -1.800 15.072 -9.271 178 HD3 LYS 26 2HD LYS 26 -0.647 16.126 -8.435 179 HE2 LYS 26 1HE LYS 26 0.908 15.853 -10.021 180 HE3 LYS 26 2HE LYS 26 0.705 14.095 -9.994 181 HZ1 LYS 26 3HZ LYS 26 -1.440 15.571 -11.269 182 HZ2 LYS 26 1HZ LYS 26 -0.683 14.134 -11.741 183 HZ3 LYS 26 2HZ LYS 26 0.049 15.623 -12.071 184 H PHE 27 H PHE 27 -1.786 11.418 -5.014 185 HA PHE 27 HA PHE 27 -4.492 10.733 -4.917 186 HB2 PHE 27 1HB PHE 27 -2.406 9.216 -4.896 187 HB3 PHE 27 2HB PHE 27 -2.413 9.460 -3.149 188 HD1 PHE 27 2HD PHE 27 -5.251 8.977 -5.508 189 HD2 PHE 27 1HD PHE 27 -3.055 7.462 -2.191 190 HE1 PHE 27 2HE PHE 27 -6.905 7.176 -5.240 191 HE2 PHE 27 1HE PHE 27 -4.705 5.658 -1.918 192 HZ PHE 27 HZ PHE 27 -6.634 5.513 -3.442 193 H ARG 28 H ARG 28 -2.352 12.033 -2.436 194 HA ARG 28 HA ARG 28 -4.250 11.784 -0.313 195 HB2 ARG 28 1HB ARG 28 -1.990 13.760 -0.281 196 HB3 ARG 28 2HB ARG 28 -2.655 12.799 1.048 197 HG2 ARG 28 1HG ARG 28 -1.719 10.864 -0.661 198 HG3 ARG 28 2HG ARG 28 -0.526 12.162 -0.833 199 HD2 ARG 28 1HD ARG 28 -1.433 10.935 1.782 200 HD3 ARG 28 2HD ARG 28 0.088 10.593 0.946 201 HE ARG 28 HE ARG 28 0.869 12.736 1.522 202 HH11 ARG 28 2HH1 ARG 28 -2.321 12.090 2.758 203 HH12 ARG 28 1HH1 ARG 28 -2.278 13.382 3.910 204 HH21 ARG 28 1HH2 ARG 28 -0.426 14.721 4.066 205 HH22 ARG 28 2HH2 ARG 28 0.937 14.442 3.035 206 H PHE 29 H PHE 29 -3.541 14.181 -2.731 207 HA PHE 29 HA PHE 29 -5.672 15.877 -1.611 208 HB2 PHE 29 1HB PHE 29 -3.584 17.170 -3.283 209 HB3 PHE 29 2HB PHE 29 -4.461 17.795 -1.885 210 HD1 PHE 29 2HD PHE 29 -3.914 16.052 0.276 211 HD2 PHE 29 1HD PHE 29 -1.320 17.243 -2.881 212 HE1 PHE 29 2HE PHE 29 -1.967 15.625 1.719 213 HE2 PHE 29 1HE PHE 29 0.631 16.816 -1.444 214 HZ PHE 29 HZ PHE 29 0.309 16.007 0.861 215 H ARG 30 H ARG 30 -6.137 13.826 -3.446 216 HA ARG 30 HA ARG 30 -6.211 14.895 -6.114 217 HB2 ARG 30 1HB ARG 30 -7.429 12.840 -6.680 218 HB3 ARG 30 2HB ARG 30 -5.954 12.497 -5.763 219 HG2 ARG 30 1HG ARG 30 -7.538 12.512 -3.695 220 HG3 ARG 30 2HG ARG 30 -8.802 12.257 -4.909 221 HD2 ARG 30 1HD ARG 30 -6.645 10.491 -5.506 222 HD3 ARG 30 2HD ARG 30 -7.020 10.354 -3.782 223 HE ARG 30 HE ARG 30 -8.680 9.531 -5.988 224 HH11 ARG 30 2HH1 ARG 30 -8.592 10.427 -2.625 225 HH12 ARG 30 1HH1 ARG 30 -10.057 9.592 -2.230 226 HH21 ARG 30 1HH2 ARG 30 -11.205 8.455 -3.854 227 HH22 ARG 30 2HH2 ARG 30 -10.610 8.427 -5.480 228 H LYS 31 H LYS 31 -8.395 14.747 -7.314 229 HA LYS 31 HA LYS 31 -10.329 16.320 -5.767 230 HB2 LYS 31 1HB LYS 31 -9.587 16.159 -8.655 231 HB3 LYS 31 2HB LYS 31 -11.245 16.623 -8.240 232 HG2 LYS 31 1HG LYS 31 -9.181 18.058 -6.727 233 HG3 LYS 31 2HG LYS 31 -9.158 18.345 -8.476 234 HD2 LYS 31 1HD LYS 31 -11.867 18.387 -7.441 235 HD3 LYS 31 2HD LYS 31 -10.830 19.556 -6.606 236 HE2 LYS 31 1HE LYS 31 -10.459 19.511 -9.519 237 HE3 LYS 31 2HE LYS 31 -12.084 19.984 -8.999 238 HZ1 LYS 31 3HZ LYS 31 -10.229 21.312 -7.378 239 HZ2 LYS 31 1HZ LYS 31 -11.306 21.978 -8.501 240 HZ3 LYS 31 2HZ LYS 31 -9.752 21.525 -8.987 241 H GLU 32 H GLU 32 -10.246 13.518 -5.375 242 HA GLU 32 HA GLU 32 -12.724 12.636 -6.699 243 HB2 GLU 32 1HB GLU 32 -10.324 11.158 -5.672 244 HB3 GLU 32 2HB GLU 32 -11.888 10.335 -5.769 245 HG2 GLU 32 1HG GLU 32 -10.833 11.792 -8.157 246 HG3 GLU 32 2HG GLU 32 -10.206 10.189 -7.746 247 H THR 33 H THR 33 -13.822 10.856 -5.205 248 HA THR 33 HA THR 33 -13.784 11.557 -2.393 249 HB THR 33 HB THR 33 -16.210 12.047 -2.300 250 HG1 THR 33 1HG THR 33 -16.161 12.485 -5.090 251 HG21 THR 33 3HG2 THR 33 -16.083 14.330 -3.227 252 HG22 THR 33 1HG2 THR 33 -14.603 13.888 -4.076 253 HG23 THR 33 2HG2 THR 33 -14.638 13.900 -2.313 254 H ASN 34 H ASN 34 -13.302 9.186 -4.054 255 HA ASN 34 HA ASN 34 -15.236 7.400 -2.751 256 HB2 ASN 34 1HB ASN 34 -15.088 5.917 -4.797 257 HB3 ASN 34 2HB ASN 34 -15.976 7.430 -5.015 258 HD21 ASN 34 2HD2 ASN 34 -12.910 6.586 -7.384 259 HD22 ASN 34 1HD2 ASN 34 -13.671 5.460 -6.318 260 H ASN 35 H ASN 35 -14.380 5.033 -2.960 261 HA ASN 35 HA ASN 35 -11.790 5.009 -1.721 262 HB2 ASN 35 1HB ASN 35 -13.834 2.897 -2.387 263 HB3 ASN 35 2HB ASN 35 -12.226 2.456 -1.796 264 HD21 ASN 35 2HD2 ASN 35 -14.442 2.627 1.118 265 HD22 ASN 35 1HD2 ASN 35 -14.329 1.696 -0.332 266 H ALA 36 H ALA 36 -9.887 4.715 -2.672 267 HA ALA 36 HA ALA 36 -9.760 3.294 -5.233 268 HB1 ALA 36 3HB ALA 36 -9.448 5.204 -6.336 269 HB2 ALA 36 1HB ALA 36 -9.287 6.127 -4.841 270 HB3 ALA 36 2HB ALA 36 -7.884 5.309 -5.528 271 H ALA 37 H ALA 37 -7.589 2.567 -5.786 272 HA ALA 37 HA ALA 37 -5.715 2.480 -3.530 273 HB1 ALA 37 3HB ALA 37 -7.346 0.368 -4.036 274 HB2 ALA 37 1HB ALA 37 -5.930 -0.048 -5.002 275 HB3 ALA 37 2HB ALA 37 -5.761 0.251 -3.271 276 H ILE 38 H ILE 38 -3.537 2.081 -4.105 277 HA ILE 38 HA ILE 38 -2.943 2.209 -6.983 278 HB ILE 38 HB ILE 38 -1.444 3.808 -4.912 279 HG12 ILE 38 1HG1 ILE 38 -3.661 4.618 -6.801 280 HG13 ILE 38 2HG1 ILE 38 -3.639 4.764 -5.035 281 HG21 ILE 38 1HG2 ILE 38 -1.185 4.820 -7.543 282 HG22 ILE 38 2HG2 ILE 38 0.054 4.094 -6.521 283 HG23 ILE 38 3HG2 ILE 38 -0.900 3.082 -7.606 284 HD11 ILE 38 3HD1 ILE 38 -3.198 6.919 -5.620 285 HD12 ILE 38 1HD1 ILE 38 -1.555 6.288 -5.503 286 HD13 ILE 38 2HD1 ILE 38 -2.322 6.461 -7.082 287 H ILE 39 H ILE 39 -1.970 0.329 -7.390 288 HA ILE 39 HA ILE 39 -0.212 -0.882 -5.408 289 HB ILE 39 HB ILE 39 -1.063 -1.919 -8.115 290 HG12 ILE 39 1HG1 ILE 39 -2.005 -3.205 -5.624 291 HG13 ILE 39 2HG1 ILE 39 -2.674 -1.597 -5.952 292 HG21 ILE 39 1HG2 ILE 39 1.087 -2.819 -7.290 293 HG22 ILE 39 2HG2 ILE 39 0.264 -3.373 -5.832 294 HG23 ILE 39 3HG2 ILE 39 -0.177 -4.045 -7.402 295 HD11 ILE 39 3HD1 ILE 39 -4.115 -3.347 -6.830 296 HD12 ILE 39 1HD1 ILE 39 -3.463 -2.344 -8.127 297 HD13 ILE 39 2HD1 ILE 39 -2.789 -3.947 -7.827 298 H MET 40 H MET 40 1.848 -0.287 -5.370 299 HA MET 40 HA MET 40 3.165 0.404 -7.912 300 HB2 MET 40 1HB MET 40 4.192 1.132 -5.174 301 HB3 MET 40 2HB MET 40 4.609 1.854 -6.735 302 HG2 MET 40 1HG MET 40 2.785 3.202 -6.778 303 HG3 MET 40 2HG MET 40 1.781 2.039 -5.909 304 HE1 MET 40 3HE MET 40 1.889 2.796 -2.401 305 HE2 MET 40 1HE MET 40 0.781 3.547 -3.549 306 HE3 MET 40 2HE MET 40 1.303 1.880 -3.789 307 H LYS 41 H LYS 41 5.169 -0.473 -8.408 308 HA LYS 41 HA LYS 41 6.059 -2.690 -6.683 309 HB2 LYS 41 1HB LYS 41 6.573 -4.019 -8.603 310 HB3 LYS 41 2HB LYS 41 4.910 -3.439 -8.783 311 HG2 LYS 41 1HG LYS 41 5.387 -2.160 -10.587 312 HG3 LYS 41 2HG LYS 41 7.017 -1.772 -10.008 313 HD2 LYS 41 1HD LYS 41 7.961 -3.604 -10.977 314 HD3 LYS 41 2HD LYS 41 6.506 -4.592 -10.757 315 HE2 LYS 41 1HE LYS 41 5.442 -3.660 -12.648 316 HE3 LYS 41 2HE LYS 41 6.593 -2.319 -12.719 317 HZ1 LYS 41 3HZ LYS 41 7.375 -3.668 -14.373 318 HZ2 LYS 41 1HZ LYS 41 6.937 -5.101 -13.588 319 HZ3 LYS 41 2HZ LYS 41 8.298 -4.238 -13.075 320 H VAL 42 H VAL 42 8.373 -3.408 -7.491 321 HA VAL 42 HA VAL 42 9.993 -0.989 -7.943 322 HB VAL 42 HB VAL 42 10.434 -1.297 -5.702 323 HG11 VAL 42 1HG1 VAL 42 10.950 -3.904 -5.066 324 HG12 VAL 42 2HG1 VAL 42 9.412 -3.080 -4.809 325 HG13 VAL 42 3HG1 VAL 42 9.657 -4.063 -6.253 326 HG21 VAL 42 3HG2 VAL 42 12.643 -2.252 -5.489 327 HG22 VAL 42 1HG2 VAL 42 12.424 -3.170 -6.979 328 HG23 VAL 42 2HG2 VAL 42 12.517 -1.409 -7.033 329 H ASP 43 H ASP 43 10.985 -1.211 -9.830 330 HA ASP 43 HA ASP 43 11.449 -3.759 -11.045 331 HB2 ASP 43 1HB ASP 43 11.910 -0.906 -11.778 332 HB3 ASP 43 2HB ASP 43 12.864 -2.132 -12.621 333 H LYS 44 H LYS 44 13.080 -5.074 -10.620 334 HA LYS 44 HA LYS 44 15.253 -4.390 -8.960 335 HB2 LYS 44 1HB LYS 44 14.268 -6.697 -9.360 336 HB3 LYS 44 2HB LYS 44 15.180 -6.718 -10.878 337 HG2 LYS 44 1HG LYS 44 17.062 -5.993 -8.963 338 HG3 LYS 44 2HG LYS 44 16.075 -7.243 -8.183 339 HD2 LYS 44 1HD LYS 44 16.412 -8.706 -10.156 340 HD3 LYS 44 2HD LYS 44 17.478 -7.469 -10.847 341 HE2 LYS 44 1HE LYS 44 19.156 -7.840 -9.301 342 HE3 LYS 44 2HE LYS 44 18.030 -8.480 -8.095 343 HZ1 LYS 44 3HZ LYS 44 17.743 -10.367 -9.842 344 HZ2 LYS 44 1HZ LYS 44 19.073 -10.376 -8.797 345 HZ3 LYS 44 2HZ LYS 44 19.254 -9.840 -10.391 346 H ASP 45 H ASP 45 14.751 -4.090 -12.353 347 HA ASP 45 HA ASP 45 17.514 -4.006 -13.102 348 HB2 ASP 45 1HB ASP 45 15.263 -4.398 -14.513 349 HB3 ASP 45 2HB ASP 45 15.474 -2.665 -14.793 350 H ARG 46 H ARG 46 15.022 -1.593 -12.408 351 HA ARG 46 HA ARG 46 17.039 0.527 -12.634 352 HB2 ARG 46 1HB ARG 46 14.038 0.792 -12.337 353 HB3 ARG 46 2HB ARG 46 15.186 2.087 -12.711 354 HG2 ARG 46 1HG ARG 46 15.719 1.027 -14.849 355 HG3 ARG 46 2HG ARG 46 14.573 -0.272 -14.478 356 HD2 ARG 46 1HD ARG 46 13.183 1.042 -15.715 357 HD3 ARG 46 2HD ARG 46 12.938 1.798 -14.134 358 HE ARG 46 HE ARG 46 15.054 3.145 -15.238 359 HH11 ARG 46 2HH1 ARG 46 11.758 2.495 -16.153 360 HH12 ARG 46 1HH1 ARG 46 11.580 3.965 -17.051 361 HH21 ARG 46 1HH2 ARG 46 13.328 5.438 -17.201 362 HH22 ARG 46 2HH2 ARG 46 14.831 5.085 -16.418 363 H GLN 47 H GLN 47 16.050 -1.495 -10.344 364 HA GLN 47 HA GLN 47 15.652 -1.391 -8.070 365 HB2 GLN 47 1HB GLN 47 17.971 0.541 -8.223 366 HB3 GLN 47 2HB GLN 47 17.569 -0.565 -6.900 367 HG2 GLN 47 1HG GLN 47 17.944 -1.980 -9.404 368 HG3 GLN 47 2HG GLN 47 19.363 -1.022 -8.955 369 HE21 GLN 47 2HE2 GLN 47 18.273 -4.279 -6.775 370 HE22 GLN 47 1HE2 GLN 47 17.212 -3.585 -7.948 371 H MET 48 H MET 48 13.771 0.190 -9.108 372 HA MET 48 HA MET 48 13.590 2.327 -7.133 373 HB2 MET 48 1HB MET 48 13.379 4.080 -8.567 374 HB3 MET 48 2HB MET 48 14.425 3.059 -9.565 375 HG2 MET 48 1HG MET 48 12.034 2.125 -10.354 376 HG3 MET 48 2HG MET 48 11.586 3.775 -9.915 377 HE1 MET 48 3HE MET 48 13.446 5.563 -10.304 378 HE2 MET 48 1HE MET 48 14.346 5.743 -11.810 379 HE3 MET 48 2HE MET 48 12.614 6.077 -11.773 380 H VAL 49 H VAL 49 11.418 3.062 -6.763 381 HA VAL 49 HA VAL 49 9.475 0.948 -7.202 382 HB VAL 49 HB VAL 49 8.924 3.504 -5.722 383 HG11 VAL 49 1HG1 VAL 49 6.960 2.427 -5.590 384 HG12 VAL 49 2HG1 VAL 49 7.672 0.870 -6.021 385 HG13 VAL 49 3HG1 VAL 49 7.764 1.454 -4.357 386 HG21 VAL 49 3HG2 VAL 49 10.793 2.979 -4.527 387 HG22 VAL 49 1HG2 VAL 49 9.638 1.928 -3.707 388 HG23 VAL 49 2HG2 VAL 49 10.712 1.266 -4.940 389 H VAL 50 H VAL 50 8.280 0.965 -8.983 390 HA VAL 50 HA VAL 50 7.329 3.561 -10.010 391 HB VAL 50 HB VAL 50 7.268 2.520 -12.267 392 HG11 VAL 50 1HG1 VAL 50 9.914 2.705 -10.844 393 HG12 VAL 50 2HG1 VAL 50 9.765 2.525 -12.594 394 HG13 VAL 50 3HG1 VAL 50 9.103 3.950 -11.792 395 HG21 VAL 50 3HG2 VAL 50 7.585 0.150 -10.905 396 HG22 VAL 50 1HG2 VAL 50 7.741 0.369 -12.648 397 HG23 VAL 50 2HG2 VAL 50 9.174 0.413 -11.621 398 H LEU 51 H LEU 51 5.197 3.737 -10.561 399 HA LEU 51 HA LEU 51 3.283 2.241 -9.284 400 HB2 LEU 51 1HB LEU 51 2.779 4.403 -10.207 401 HB3 LEU 51 2HB LEU 51 3.069 3.804 -11.849 402 HG LEU 51 HG LEU 51 1.050 2.163 -10.915 403 HD11 LEU 51 1HD1 LEU 51 -0.128 4.769 -10.356 404 HD12 LEU 51 2HD1 LEU 51 1.059 4.263 -9.154 405 HD13 LEU 51 3HD1 LEU 51 -0.324 3.230 -9.517 406 HD21 LEU 51 3HD2 LEU 51 -0.362 3.454 -12.469 407 HD22 LEU 51 1HD2 LEU 51 1.216 3.064 -13.154 408 HD23 LEU 51 2HD2 LEU 51 0.892 4.691 -12.554 409 H GLU 52 H GLU 52 1.940 0.537 -9.812 410 HA GLU 52 HA GLU 52 2.770 -1.046 -12.156 411 HB2 GLU 52 1HB GLU 52 3.405 -2.164 -10.110 412 HB3 GLU 52 2HB GLU 52 1.768 -1.979 -9.464 413 HG2 GLU 52 1HG GLU 52 2.033 -4.239 -10.183 414 HG3 GLU 52 2HG GLU 52 0.930 -3.419 -11.297 415 H ASP 53 H ASP 53 0.039 -0.166 -10.082 416 HA ASP 53 HA ASP 53 -1.734 -0.159 -12.351 417 HB2 ASP 53 1HB ASP 53 -1.835 -2.316 -10.277 418 HB3 ASP 53 2HB ASP 53 -3.353 -1.706 -10.948 419 H GLU 54 H GLU 54 -3.920 0.608 -11.762 420 HA GLU 54 HA GLU 54 -4.122 1.907 -9.159 421 HB2 GLU 54 1HB GLU 54 -3.588 3.289 -11.682 422 HB3 GLU 54 2HB GLU 54 -5.025 3.899 -10.847 423 HG2 GLU 54 1HG GLU 54 -3.520 4.004 -8.759 424 HG3 GLU 54 2HG GLU 54 -2.183 3.867 -9.911 425 H LEU 55 H LEU 55 -5.992 1.153 -8.421 426 HA LEU 55 HA LEU 55 -8.251 0.896 -10.286 427 HB2 LEU 55 1HB LEU 55 -7.983 -0.369 -7.559 428 HB3 LEU 55 2HB LEU 55 -9.181 -0.735 -8.813 429 HG LEU 55 HG LEU 55 -6.308 -1.182 -9.449 430 HD11 LEU 55 1HD1 LEU 55 -7.939 -2.820 -7.537 431 HD12 LEU 55 2HD1 LEU 55 -6.285 -2.232 -7.362 432 HD13 LEU 55 3HD1 LEU 55 -6.642 -3.530 -8.500 433 HD21 LEU 55 3HD2 LEU 55 -7.342 -1.971 -11.255 434 HD22 LEU 55 1HD2 LEU 55 -8.919 -1.917 -10.466 435 HD23 LEU 55 2HD2 LEU 55 -7.873 -3.321 -10.252 436 H GLN 56 H GLN 56 -10.004 2.132 -10.032 437 HA GLN 56 HA GLN 56 -10.159 3.805 -7.615 438 HB2 GLN 56 1HB GLN 56 -10.981 4.292 -10.470 439 HB3 GLN 56 2HB GLN 56 -11.656 5.249 -9.143 440 HG2 GLN 56 1HG GLN 56 -9.927 6.604 -9.693 441 HG3 GLN 56 2HG GLN 56 -9.100 5.548 -8.539 442 HE21 GLN 56 2HE2 GLN 56 -6.641 5.052 -10.926 443 HE22 GLN 56 1HE2 GLN 56 -7.080 5.626 -9.356 444 H ASN 57 H ASN 57 -12.325 4.367 -6.856 445 HA ASN 57 HA ASN 57 -14.270 3.618 -5.912 446 HB2 ASN 57 1HB ASN 57 -15.829 2.681 -7.915 447 HB3 ASN 57 2HB ASN 57 -15.545 4.400 -7.621 448 HD21 ASN 57 2HD2 ASN 57 -13.418 4.864 -10.405 449 HD22 ASN 57 1HD2 ASN 57 -13.760 5.410 -8.802 450 H ILE 58 H ILE 58 -12.530 1.784 -5.279 451 HA ILE 58 HA ILE 58 -13.884 -0.771 -5.840 452 HB ILE 58 HB ILE 58 -11.991 -1.464 -6.804 453 HG12 ILE 58 1HG1 ILE 58 -11.911 -2.397 -4.419 454 HG13 ILE 58 2HG1 ILE 58 -10.416 -2.469 -5.368 455 HG21 ILE 58 1HG2 ILE 58 -10.831 1.025 -5.632 456 HG22 ILE 58 2HG2 ILE 58 -9.766 -0.191 -6.336 457 HG23 ILE 58 3HG2 ILE 58 -11.019 0.561 -7.323 458 HD11 ILE 58 3HD1 ILE 58 -10.423 -0.003 -3.980 459 HD12 ILE 58 1HD1 ILE 58 -10.832 -1.279 -2.833 460 HD13 ILE 58 2HD1 ILE 58 -9.344 -1.382 -3.776 461 H SER 59 H SER 59 -14.307 -2.064 -4.120 462 HA SER 59 HA SER 59 -14.037 -0.893 -1.497 463 HB2 SER 59 1HB SER 59 -15.698 -2.907 -2.758 464 HB3 SER 59 2HB SER 59 -15.051 -3.494 -1.216 465 HG SER 59 HG SER 59 -17.112 -2.084 -1.365 466 HA PRO 60 HA PRO 60 -10.643 -3.157 0.117 467 HB2 PRO 60 2HB PRO 60 -11.205 -2.416 2.218 468 HB3 PRO 60 1HB PRO 60 -11.538 -4.121 2.520 469 HG2 PRO 60 1HG PRO 60 -13.818 -3.885 2.139 470 HG3 PRO 60 2HG PRO 60 -13.427 -2.295 2.893 471 HD2 PRO 60 1HD PRO 60 -14.690 -2.511 0.499 472 HD3 PRO 60 2HD PRO 60 -13.565 -1.193 0.874 473 H GLU 61 H GLU 61 -13.271 -4.756 -1.043 474 HA GLU 61 HA GLU 61 -12.255 -7.419 -0.328 475 HB2 GLU 61 1HB GLU 61 -14.913 -6.315 -0.859 476 HB3 GLU 61 2HB GLU 61 -14.593 -7.816 -1.741 477 HG2 GLU 61 1HG GLU 61 -13.921 -8.869 0.423 478 HG3 GLU 61 2HG GLU 61 -14.473 -7.396 1.234 479 H GLU 62 H GLU 62 -12.526 -5.169 -2.903 480 HA GLU 62 HA GLU 62 -12.136 -7.153 -4.984 481 HB2 GLU 62 1HB GLU 62 -12.657 -4.225 -4.879 482 HB3 GLU 62 2HB GLU 62 -11.792 -4.845 -6.294 483 HG2 GLU 62 1HG GLU 62 -14.200 -4.698 -6.690 484 HG3 GLU 62 2HG GLU 62 -13.608 -6.362 -6.788 485 H LEU 63 H LEU 63 -10.305 -4.538 -3.447 486 HA LEU 63 HA LEU 63 -8.008 -4.584 -4.976 487 HB2 LEU 63 1HB LEU 63 -8.826 -3.350 -2.651 488 HB3 LEU 63 2HB LEU 63 -7.467 -4.354 -2.118 489 HG LEU 63 HG LEU 63 -7.473 -2.031 -4.004 490 HD11 LEU 63 1HD1 LEU 63 -5.284 -1.755 -2.553 491 HD12 LEU 63 2HD1 LEU 63 -6.171 -2.803 -1.448 492 HD13 LEU 63 3HD1 LEU 63 -6.865 -1.260 -1.947 493 HD21 LEU 63 3HD2 LEU 63 -6.070 -3.069 -5.385 494 HD22 LEU 63 1HD2 LEU 63 -5.948 -4.471 -4.320 495 HD23 LEU 63 2HD2 LEU 63 -4.903 -3.074 -4.062 496 H LYS 64 H LYS 64 -8.691 -6.508 -2.058 497 HA LYS 64 HA LYS 64 -6.336 -7.930 -1.889 498 HB2 LYS 64 1HB LYS 64 -7.503 -8.645 -0.124 499 HB3 LYS 64 2HB LYS 64 -9.039 -8.209 -0.889 500 HG2 LYS 64 1HG LYS 64 -9.309 -10.308 -1.864 501 HG3 LYS 64 2HG LYS 64 -7.596 -10.715 -1.660 502 HD2 LYS 64 1HD LYS 64 -8.154 -11.795 0.211 503 HD3 LYS 64 2HD LYS 64 -8.518 -10.214 0.923 504 HE2 LYS 64 1HE LYS 64 -10.640 -10.868 1.140 505 HE3 LYS 64 2HE LYS 64 -10.753 -10.846 -0.626 506 HZ1 LYS 64 3HZ LYS 64 -9.874 -13.177 -0.568 507 HZ2 LYS 64 1HZ LYS 64 -11.428 -12.978 0.072 508 HZ3 LYS 64 2HZ LYS 64 -10.103 -13.157 1.109 509 H LEU 65 H LEU 65 -9.167 -8.601 -3.901 510 HA LEU 65 HA LEU 65 -8.230 -11.070 -4.927 511 HB2 LEU 65 1HB LEU 65 -10.150 -9.126 -6.218 512 HB3 LEU 65 2HB LEU 65 -9.978 -10.852 -6.577 513 HG LEU 65 HG LEU 65 -10.931 -9.759 -3.933 514 HD11 LEU 65 1HD1 LEU 65 -13.133 -10.785 -4.817 515 HD12 LEU 65 2HD1 LEU 65 -12.398 -10.579 -6.407 516 HD13 LEU 65 3HD1 LEU 65 -12.654 -9.178 -5.366 517 HD21 LEU 65 3HD2 LEU 65 -11.426 -11.968 -3.343 518 HD22 LEU 65 1HD2 LEU 65 -9.826 -12.059 -4.078 519 HD23 LEU 65 2HD2 LEU 65 -11.248 -12.546 -4.999 520 H GLU 66 H GLU 66 -7.880 -7.726 -5.964 521 HA GLU 66 HA GLU 66 -6.767 -8.257 -8.506 522 HB2 GLU 66 1HB GLU 66 -6.459 -5.859 -6.684 523 HB3 GLU 66 2HB GLU 66 -5.930 -5.915 -8.372 524 HG2 GLU 66 1HG GLU 66 -8.782 -6.366 -7.509 525 HG3 GLU 66 2HG GLU 66 -8.128 -4.788 -7.973 526 H LEU 67 H LEU 67 -5.403 -8.079 -5.292 527 HA LEU 67 HA LEU 67 -2.677 -7.947 -6.102 528 HB2 LEU 67 1HB LEU 67 -4.020 -8.750 -3.523 529 HB3 LEU 67 2HB LEU 67 -2.260 -8.725 -3.731 530 HG LEU 67 HG LEU 67 -3.957 -6.282 -4.172 531 HD11 LEU 67 1HD1 LEU 67 -4.019 -7.456 -1.806 532 HD12 LEU 67 2HD1 LEU 67 -3.893 -5.705 -1.969 533 HD13 LEU 67 3HD1 LEU 67 -2.451 -6.666 -1.642 534 HD21 LEU 67 3HD2 LEU 67 -1.271 -6.865 -4.649 535 HD22 LEU 67 1HD2 LEU 67 -1.282 -5.905 -3.169 536 HD23 LEU 67 2HD2 LEU 67 -2.032 -5.274 -4.635 537 HA PRO 68 HA PRO 68 -1.812 -12.123 -7.153 538 HB2 PRO 68 2HB PRO 68 0.273 -11.397 -7.789 539 HB3 PRO 68 1HB PRO 68 0.808 -12.310 -6.379 540 HG2 PRO 68 1HG PRO 68 0.884 -10.429 -5.017 541 HG3 PRO 68 2HG PRO 68 1.375 -9.727 -6.604 542 HD2 PRO 68 1HD PRO 68 -0.672 -8.726 -5.129 543 HD3 PRO 68 2HD PRO 68 -0.675 -8.715 -6.902 544 H GLU 69 H GLU 69 -0.224 -13.964 -5.999 545 HA GLU 69 HA GLU 69 -1.404 -14.330 -3.323 546 HB2 GLU 69 1HB GLU 69 -1.307 -16.750 -3.730 547 HB3 GLU 69 2HB GLU 69 -2.298 -15.921 -4.940 548 HG2 GLU 69 1HG GLU 69 -0.084 -15.891 -6.328 549 HG3 GLU 69 2HG GLU 69 0.366 -17.216 -5.245 550 H ARG 70 H ARG 70 1.475 -14.145 -5.156 551 HA ARG 70 HA ARG 70 3.064 -14.482 -2.756 552 HB2 ARG 70 1HB ARG 70 4.665 -15.996 -4.150 553 HB3 ARG 70 2HB ARG 70 3.263 -16.712 -3.343 554 HG2 ARG 70 1HG ARG 70 3.095 -17.691 -5.402 555 HG3 ARG 70 2HG ARG 70 2.087 -16.253 -5.638 556 HD2 ARG 70 1HD ARG 70 3.565 -15.264 -7.056 557 HD3 ARG 70 2HD ARG 70 4.967 -15.942 -6.216 558 HE ARG 70 HE ARG 70 3.524 -17.982 -7.553 559 HH11 ARG 70 2HH1 ARG 70 5.707 -15.329 -8.116 560 HH12 ARG 70 1HH1 ARG 70 6.377 -16.015 -9.560 561 HH21 ARG 70 1HH2 ARG 70 5.630 -18.044 -10.319 562 HH22 ARG 70 2HH2 ARG 70 4.398 -18.895 -9.452 563 H GLN 71 H GLN 71 2.586 -12.163 -4.093 564 HA GLN 71 HA GLN 71 5.225 -11.576 -5.230 565 HB2 GLN 71 1HB GLN 71 2.651 -11.403 -6.583 566 HB3 GLN 71 2HB GLN 71 3.509 -9.854 -6.575 567 HG2 GLN 71 1HG GLN 71 5.411 -10.801 -7.662 568 HG3 GLN 71 2HG GLN 71 4.754 -12.434 -7.485 569 HE21 GLN 71 2HE2 GLN 71 2.196 -11.857 -9.990 570 HE22 GLN 71 1HE2 GLN 71 2.329 -12.443 -8.371 571 HA PRO 72 HA PRO 72 4.654 -8.557 -1.933 572 HB2 PRO 72 2HB PRO 72 6.644 -9.303 -1.059 573 HB3 PRO 72 1HB PRO 72 7.298 -7.850 -1.816 574 HG2 PRO 72 1HG PRO 72 8.028 -8.992 -3.703 575 HG3 PRO 72 2HG PRO 72 8.277 -10.239 -2.425 576 HD2 PRO 72 1HD PRO 72 6.835 -10.716 -4.676 577 HD3 PRO 72 2HD PRO 72 6.442 -11.452 -3.112 578 H ARG 73 H ARG 73 4.027 -6.516 -2.225 579 HA ARG 73 HA ARG 73 5.496 -4.675 -3.859 580 HB2 ARG 73 1HB ARG 73 3.546 -4.120 -5.338 581 HB3 ARG 73 2HB ARG 73 4.299 -5.688 -5.662 582 HG2 ARG 73 1HG ARG 73 2.378 -6.426 -3.901 583 HG3 ARG 73 2HG ARG 73 1.595 -5.056 -4.708 584 HD2 ARG 73 1HD ARG 73 2.888 -6.661 -6.693 585 HD3 ARG 73 2HD ARG 73 1.911 -7.708 -5.653 586 HE ARG 73 HE ARG 73 0.297 -5.564 -6.272 587 HH11 ARG 73 2HH1 ARG 73 1.999 -8.041 -8.029 588 HH12 ARG 73 1HH1 ARG 73 0.863 -8.077 -9.337 589 HH21 ARG 73 1HH2 ARG 73 -0.960 -6.689 -9.311 590 HH22 ARG 73 2HH2 ARG 73 -1.206 -5.603 -7.987 591 H PHE 74 H PHE 74 4.181 -2.530 -4.019 592 HA PHE 74 HA PHE 74 3.132 -2.018 -1.335 593 HB2 PHE 74 1HB PHE 74 3.885 0.027 -3.432 594 HB3 PHE 74 2HB PHE 74 3.661 0.291 -1.703 595 HD1 PHE 74 2HD PHE 74 5.211 -1.324 -0.198 596 HD2 PHE 74 1HD PHE 74 6.066 -0.012 -4.156 597 HE1 PHE 74 2HE PHE 74 7.610 -1.702 0.198 598 HE2 PHE 74 1HE PHE 74 8.465 -0.390 -3.767 599 HZ PHE 74 HZ PHE 74 9.241 -1.234 -1.588 600 H VAL 75 H VAL 75 1.198 -0.884 -0.991 601 HA VAL 75 HA VAL 75 -0.522 -0.277 -3.243 602 HB VAL 75 HB VAL 75 -1.458 -2.281 -1.188 603 HG11 VAL 75 1HG1 VAL 75 -2.708 -1.350 -3.771 604 HG12 VAL 75 2HG1 VAL 75 -3.385 -2.532 -2.647 605 HG13 VAL 75 3HG1 VAL 75 -3.203 -0.848 -2.155 606 HG21 VAL 75 3HG2 VAL 75 -1.398 -3.905 -3.084 607 HG22 VAL 75 1HG2 VAL 75 -0.499 -2.706 -4.014 608 HG23 VAL 75 2HG2 VAL 75 0.192 -3.376 -2.537 609 H VAL 76 H VAL 76 -1.466 1.590 -2.790 610 HA VAL 76 HA VAL 76 -1.875 2.323 0.029 611 HB VAL 76 HB VAL 76 -1.639 4.065 -2.426 612 HG11 VAL 76 1HG1 VAL 76 -1.965 4.986 0.422 613 HG12 VAL 76 2HG1 VAL 76 -1.955 5.971 -1.041 614 HG13 VAL 76 3HG1 VAL 76 -3.301 4.876 -0.722 615 HG21 VAL 76 3HG2 VAL 76 0.372 2.928 -1.069 616 HG22 VAL 76 1HG2 VAL 76 0.491 4.525 -1.807 617 HG23 VAL 76 2HG2 VAL 76 0.142 4.373 -0.086 618 H TYR 77 H TYR 77 -3.875 1.541 0.510 619 HA TYR 77 HA TYR 77 -6.094 2.019 -1.312 620 HB2 TYR 77 1HB TYR 77 -5.818 -0.173 -0.150 621 HB3 TYR 77 2HB TYR 77 -6.104 0.650 1.386 622 HD1 TYR 77 2HD TYR 77 -7.840 1.089 -1.883 623 HD2 TYR 77 1HD TYR 77 -8.139 -0.160 2.173 624 HE1 TYR 77 2HE TYR 77 -10.268 0.802 -2.155 625 HE2 TYR 77 1HE TYR 77 -10.566 -0.452 1.912 626 HH TYR 77 HH TYR 77 -12.170 0.199 -1.193 627 H SER 78 H SER 78 -7.647 3.513 -1.035 628 HA SER 78 HA SER 78 -7.472 5.211 1.367 629 HB2 SER 78 1HB SER 78 -6.870 6.307 -0.811 630 HB3 SER 78 2HB SER 78 -8.531 6.010 -1.353 631 HG SER 78 HG SER 78 -9.197 7.225 0.551 632 H TYR 79 H TYR 79 -8.973 4.250 2.669 633 HA TYR 79 HA TYR 79 -11.587 3.543 1.644 634 HB2 TYR 79 1HB TYR 79 -10.675 2.058 3.277 635 HB3 TYR 79 2HB TYR 79 -10.336 3.388 4.388 636 HD1 TYR 79 2HD TYR 79 -13.032 1.332 2.937 637 HD2 TYR 79 1HD TYR 79 -12.017 4.272 5.841 638 HE1 TYR 79 2HE TYR 79 -15.216 1.007 4.021 639 HE2 TYR 79 1HE TYR 79 -14.199 3.956 6.932 640 HH TYR 79 HH TYR 79 -16.589 3.077 6.048 641 H LYS 80 H LYS 80 -13.542 4.270 2.920 642 HA LYS 80 HA LYS 80 -13.314 7.145 3.533 643 HB2 LYS 80 1HB LYS 80 -14.514 6.849 1.462 644 HB3 LYS 80 2HB LYS 80 -15.574 5.640 2.206 645 HG2 LYS 80 1HG LYS 80 -16.518 7.347 3.679 646 HG3 LYS 80 2HG LYS 80 -15.456 8.559 2.941 647 HD2 LYS 80 1HD LYS 80 -17.353 8.919 1.711 648 HD3 LYS 80 2HD LYS 80 -16.571 7.681 0.712 649 HE2 LYS 80 1HE LYS 80 -17.913 6.012 2.228 650 HE3 LYS 80 2HE LYS 80 -18.918 7.433 2.545 651 HZ1 LYS 80 3HZ LYS 80 -18.798 5.791 0.212 652 HZ2 LYS 80 1HZ LYS 80 -18.603 7.428 -0.167 653 HZ3 LYS 80 2HZ LYS 80 -19.975 6.914 0.677 654 H TYR 81 H TYR 81 -13.507 7.445 5.651 655 HA TYR 81 HA TYR 81 -15.358 5.730 7.161 656 HB2 TYR 81 1HB TYR 81 -12.721 6.233 7.658 657 HB3 TYR 81 2HB TYR 81 -13.500 7.453 8.667 658 HD1 TYR 81 1HD TYR 81 -15.566 6.522 10.091 659 HD2 TYR 81 2HD TYR 81 -12.328 4.172 8.644 660 HE1 TYR 81 1HE TYR 81 -16.018 4.842 11.828 661 HE2 TYR 81 2HE TYR 81 -12.771 2.485 10.377 662 HH TYR 81 HH TYR 81 -14.022 1.915 12.116 663 H VAL 82 H VAL 82 -17.085 6.582 8.155 664 HA VAL 82 HA VAL 82 -17.568 9.446 7.817 665 HB VAL 82 HB VAL 82 -19.490 7.310 8.751 666 HG11 VAL 82 1HG1 VAL 82 -19.724 10.220 8.164 667 HG12 VAL 82 2HG1 VAL 82 -21.089 9.167 7.789 668 HG13 VAL 82 3HG1 VAL 82 -20.474 9.262 9.440 669 HG21 VAL 82 3HG2 VAL 82 -19.342 8.527 6.002 670 HG22 VAL 82 1HG2 VAL 82 -18.559 7.004 6.423 671 HG23 VAL 82 2HG2 VAL 82 -20.313 7.154 6.536 672 H HIS 83 H HIS 83 -18.408 10.732 9.552 673 HA HIS 83 HA HIS 83 -17.194 10.040 12.107 674 HB2 HIS 83 1HB HIS 83 -18.414 12.591 11.040 675 HB3 HIS 83 2HB HIS 83 -17.825 12.420 12.695 676 HD1 HIS 83 1HD HIS 83 -15.544 13.293 12.996 677 HD2 HIS 83 2HD HIS 83 -16.121 11.805 9.160 678 HE1 HIS 83 1HE HIS 83 -13.370 13.680 11.790 679 HE2 HIS 83 2HE HIS 83 -13.722 12.771 9.446 680 H ASP 84 H ASP 84 -20.117 11.958 11.657 681 HA ASP 84 HA ASP 84 -22.109 10.227 12.325 682 HB2 ASP 84 1HB ASP 84 -20.330 10.646 14.576 683 HB3 ASP 84 2HB ASP 84 -21.971 11.185 14.955 684 H ASP 85 H ASP 85 -20.729 13.362 13.171 685 HA ASP 85 HA ASP 85 -23.243 14.646 13.586 686 HB2 ASP 85 1HB ASP 85 -21.258 15.544 14.638 687 HB3 ASP 85 2HB ASP 85 -20.484 15.766 13.063 688 H GLY 86 H GLY 86 -21.571 13.660 10.814 689 HA2 GLY 86 1HA GLY 86 -23.054 13.853 8.786 690 HA3 GLY 86 2HA GLY 86 -23.086 15.573 9.149 691 H ARG 87 H ARG 87 -20.100 14.105 9.817 692 HA ARG 87 HA ARG 87 -19.011 15.138 7.282 693 HB2 ARG 87 1HB ARG 87 -17.806 15.062 10.052 694 HB3 ARG 87 2HB ARG 87 -16.870 15.426 8.596 695 HG2 ARG 87 1HG ARG 87 -19.277 17.004 9.504 696 HG3 ARG 87 2HG ARG 87 -17.595 17.435 9.852 697 HD2 ARG 87 1HD ARG 87 -17.113 17.599 7.458 698 HD3 ARG 87 2HD ARG 87 -18.779 17.128 7.095 699 HE ARG 87 HE ARG 87 -18.547 19.470 8.761 700 HH11 ARG 87 2HH1 ARG 87 -18.709 18.242 5.508 701 HH12 ARG 87 1HH1 ARG 87 -19.276 19.733 4.833 702 HH21 ARG 87 1HH2 ARG 87 -19.607 21.552 6.187 703 HH22 ARG 87 2HH2 ARG 87 -19.294 21.439 7.886 704 H VAL 88 H VAL 88 -17.573 13.904 6.137 705 HA VAL 88 HA VAL 88 -16.789 11.304 7.241 706 HB VAL 88 HB VAL 88 -18.753 10.764 5.975 707 HG11 VAL 88 1HG1 VAL 88 -17.923 11.542 3.329 708 HG12 VAL 88 2HG1 VAL 88 -19.425 11.898 4.184 709 HG13 VAL 88 3HG1 VAL 88 -18.020 12.946 4.391 710 HG21 VAL 88 3HG2 VAL 88 -17.799 9.295 4.228 711 HG22 VAL 88 1HG2 VAL 88 -16.247 10.109 4.430 712 HG23 VAL 88 2HG2 VAL 88 -16.938 9.184 5.763 713 H SER 89 H SER 89 -14.693 10.952 6.949 714 HA SER 89 HA SER 89 -13.329 12.364 4.750 715 HB2 SER 89 1HB SER 89 -12.257 11.629 7.493 716 HB3 SER 89 2HB SER 89 -11.303 12.361 6.190 717 HG SER 89 HG SER 89 -12.280 13.811 7.846 718 H TYR 90 H TYR 90 -11.413 11.291 3.888 719 HA TYR 90 HA TYR 90 -11.755 8.369 3.895 720 HB2 TYR 90 1HB TYR 90 -10.135 9.809 1.826 721 HB3 TYR 90 2HB TYR 90 -11.060 8.313 1.682 722 HD1 TYR 90 1HD TYR 90 -13.675 8.580 1.977 723 HD2 TYR 90 2HD TYR 90 -11.034 11.726 0.867 724 HE1 TYR 90 1HE TYR 90 -15.562 9.808 0.987 725 HE2 TYR 90 2HE TYR 90 -12.915 12.963 -0.124 726 HH TYR 90 HH TYR 90 -15.749 12.778 0.456 727 HA PRO 91 HA PRO 91 -7.848 8.733 6.197 728 HB2 PRO 91 2HB PRO 91 -8.888 7.741 7.989 729 HB3 PRO 91 1HB PRO 91 -8.087 6.285 7.400 730 HG2 PRO 91 1HG PRO 91 -9.972 5.542 6.260 731 HG3 PRO 91 2HG PRO 91 -10.724 6.346 7.688 732 HD2 PRO 91 1HD PRO 91 -11.406 6.959 5.133 733 HD3 PRO 91 2HD PRO 91 -11.396 8.161 6.436 734 H LEU 92 H LEU 92 -6.468 8.597 4.422 735 HA LEU 92 HA LEU 92 -6.176 6.226 2.865 736 HB2 LEU 92 1HB LEU 92 -5.035 8.905 2.955 737 HB3 LEU 92 2HB LEU 92 -3.831 7.663 2.565 738 HG LEU 92 HG LEU 92 -6.063 7.129 0.937 739 HD11 LEU 92 1HD1 LEU 92 -7.051 9.205 1.063 740 HD12 LEU 92 2HD1 LEU 92 -5.964 9.413 -0.308 741 HD13 LEU 92 3HD1 LEU 92 -5.515 10.043 1.276 742 HD21 LEU 92 3HD2 LEU 92 -4.152 6.632 -0.135 743 HD22 LEU 92 1HD2 LEU 92 -3.245 7.911 0.672 744 HD23 LEU 92 2HD2 LEU 92 -4.261 8.294 -0.718 745 H CYS 93 H CYS 93 -4.895 4.504 3.159 746 HA CYS 93 HA CYS 93 -2.830 4.630 5.246 747 HB2 CYS 93 1HB CYS 93 -4.848 2.417 4.836 748 HB3 CYS 93 2HB CYS 93 -3.467 2.326 5.942 749 HG CYS 93 HG CYS 93 -6.206 4.342 6.246 750 H PHE 94 H PHE 94 -1.102 3.118 5.004 751 HA PHE 94 HA PHE 94 -0.630 2.431 2.201 752 HB2 PHE 94 1HB PHE 94 1.046 3.792 3.462 753 HB3 PHE 94 2HB PHE 94 1.317 2.402 4.514 754 HD1 PHE 94 2HD PHE 94 1.721 3.664 1.084 755 HD2 PHE 94 1HD PHE 94 2.629 0.541 3.830 756 HE1 PHE 94 2HE PHE 94 3.401 2.781 -0.482 757 HE2 PHE 94 1HE PHE 94 4.311 -0.346 2.269 758 HZ PHE 94 HZ PHE 94 4.698 0.773 0.110 759 H ILE 95 H ILE 95 -1.396 0.474 1.691 760 HA ILE 95 HA ILE 95 -1.198 -1.717 3.607 761 HB ILE 95 HB ILE 95 -2.567 -1.539 0.924 762 HG12 ILE 95 1HG1 ILE 95 -3.674 -1.799 3.731 763 HG13 ILE 95 2HG1 ILE 95 -3.630 -0.298 2.789 764 HG21 ILE 95 1HG2 ILE 95 -3.568 -3.758 1.644 765 HG22 ILE 95 2HG2 ILE 95 -1.890 -3.785 1.104 766 HG23 ILE 95 3HG2 ILE 95 -2.263 -3.844 2.827 767 HD11 ILE 95 3HD1 ILE 95 -5.804 -1.047 2.510 768 HD12 ILE 95 1HD1 ILE 95 -4.994 -1.589 1.041 769 HD13 ILE 95 2HD1 ILE 95 -5.308 -2.732 2.347 770 H PHE 96 H PHE 96 0.526 -2.985 3.600 771 HA PHE 96 HA PHE 96 2.127 -3.206 1.152 772 HB2 PHE 96 1HB PHE 96 3.342 -2.466 3.132 773 HB3 PHE 96 2HB PHE 96 2.799 -3.891 4.021 774 HD1 PHE 96 2HD PHE 96 3.501 -4.656 0.629 775 HD2 PHE 96 1HD PHE 96 5.328 -4.082 4.430 776 HE1 PHE 96 2HE PHE 96 5.475 -5.911 -0.134 777 HE2 PHE 96 1HE PHE 96 7.305 -5.336 3.673 778 HZ PHE 96 HZ PHE 96 7.380 -6.253 1.388 779 H SER 97 H SER 97 1.485 -4.850 -0.086 780 HA SER 97 HA SER 97 0.315 -7.235 1.019 781 HB2 SER 97 1HB SER 97 -0.449 -6.295 -1.139 782 HB3 SER 97 2HB SER 97 1.147 -6.632 -1.829 783 HG SER 97 HG SER 97 0.096 -8.420 -2.357 784 H SER 98 H SER 98 1.814 -8.318 2.233 785 HA SER 98 HA SER 98 4.161 -9.346 0.775 786 HB2 SER 98 1HB SER 98 4.472 -7.685 2.799 787 HB3 SER 98 2HB SER 98 4.162 -9.140 3.763 788 HG SER 98 HG SER 98 6.402 -8.427 2.438 789 HA PRO 99 HA PRO 99 1.669 -13.039 1.720 790 HB2 PRO 99 2HB PRO 99 1.373 -13.345 -0.539 791 HB3 PRO 99 1HB PRO 99 2.683 -14.510 -0.356 792 HG2 PRO 99 1HG PRO 99 4.307 -13.005 -1.063 793 HG3 PRO 99 2HG PRO 99 2.902 -12.500 -2.074 794 HD2 PRO 99 1HD PRO 99 4.278 -10.763 -0.506 795 HD3 PRO 99 2HD PRO 99 2.538 -10.615 -0.799 796 H VAL 100 H VAL 100 2.760 -15.500 1.282 797 HA VAL 100 HA VAL 100 5.240 -15.475 2.876 798 HB VAL 100 HB VAL 100 2.852 -17.295 3.134 799 HG11 VAL 100 1HG1 VAL 100 4.834 -18.692 3.121 800 HG12 VAL 100 2HG1 VAL 100 5.600 -17.652 4.324 801 HG13 VAL 100 3HG1 VAL 100 4.172 -18.593 4.752 802 HG21 VAL 100 3HG2 VAL 100 4.313 -15.773 5.277 803 HG22 VAL 100 1HG2 VAL 100 2.976 -15.080 4.361 804 HG23 VAL 100 2HG2 VAL 100 2.714 -16.512 5.357 805 H GLY 101 H GLY 101 3.397 -16.935 0.291 806 HA2 GLY 101 1HA GLY 101 5.253 -19.064 -0.207 807 HA3 GLY 101 2HA GLY 101 3.939 -18.558 -1.259 808 H CYS 102 H CYS 102 5.745 -15.882 -0.495 809 HA CYS 102 HA CYS 102 6.916 -15.821 -3.136 810 HB2 CYS 102 1HB CYS 102 7.655 -13.530 -2.455 811 HB3 CYS 102 2HB CYS 102 5.905 -13.787 -2.385 812 HG CYS 102 HG CYS 102 8.023 -13.702 0.300 813 H LYS 103 H LYS 103 9.218 -14.572 -3.044 814 HA LYS 103 HA LYS 103 10.964 -16.405 -1.550 815 HB2 LYS 103 1HB LYS 103 11.859 -14.635 -3.814 816 HB3 LYS 103 2HB LYS 103 12.585 -16.139 -3.227 817 HG2 LYS 103 1HG LYS 103 11.419 -17.354 -4.669 818 HG3 LYS 103 2HG LYS 103 9.900 -16.621 -4.126 819 HD2 LYS 103 1HD LYS 103 10.208 -16.212 -6.499 820 HD3 LYS 103 2HD LYS 103 10.322 -14.691 -5.598 821 HE2 LYS 103 1HE LYS 103 12.242 -14.342 -6.696 822 HE3 LYS 103 2HE LYS 103 12.926 -15.581 -5.634 823 HZ1 LYS 103 3HZ LYS 103 12.247 -17.248 -7.329 824 HZ2 LYS 103 1HZ LYS 103 13.431 -16.165 -7.864 825 HZ3 LYS 103 2HZ LYS 103 11.825 -15.976 -8.360 826 HA PRO 104 HA PRO 104 12.491 -13.174 1.004 827 HB2 PRO 104 2HB PRO 104 13.600 -14.806 2.180 828 HB3 PRO 104 1HB PRO 104 15.036 -14.068 1.472 829 HG2 PRO 104 1HG PRO 104 15.158 -15.625 -0.248 830 HG3 PRO 104 2HG PRO 104 14.525 -16.645 1.098 831 HD2 PRO 104 1HD PRO 104 13.295 -16.476 -1.316 832 HD3 PRO 104 2HD PRO 104 12.402 -16.683 0.201 833 H GLU 105 H GLU 105 13.876 -13.862 -2.056 834 HA GLU 105 HA GLU 105 15.889 -11.827 -2.026 835 HB2 GLU 105 1HB GLU 105 14.594 -13.367 -4.285 836 HB3 GLU 105 2HB GLU 105 15.928 -12.225 -4.507 837 HG2 GLU 105 1HG GLU 105 16.498 -14.198 -2.447 838 HG3 GLU 105 2HG GLU 105 16.152 -14.927 -4.022 839 H GLN 106 H GLN 106 12.530 -12.020 -3.026 840 HA GLN 106 HA GLN 106 12.592 -9.333 -4.138 841 HB2 GLN 106 1HB GLN 106 10.085 -10.939 -3.755 842 HB3 GLN 106 2HB GLN 106 10.479 -9.763 -5.018 843 HG2 GLN 106 1HG GLN 106 11.919 -12.393 -4.798 844 HG3 GLN 106 2HG GLN 106 10.394 -12.219 -5.677 845 HE21 GLN 106 2HE2 GLN 106 11.884 -9.964 -8.110 846 HE22 GLN 106 1HE2 GLN 106 10.524 -10.008 -7.046 847 H GLN 107 H GLN 107 10.622 -11.015 -1.681 848 HA GLN 107 HA GLN 107 9.224 -9.035 -0.554 849 HB2 GLN 107 1HB GLN 107 10.146 -11.558 0.295 850 HB3 GLN 107 2HB GLN 107 10.520 -10.431 1.609 851 HG2 GLN 107 1HG GLN 107 7.839 -10.040 0.549 852 HG3 GLN 107 2HG GLN 107 8.105 -11.678 1.164 853 HE21 GLN 107 2HE2 GLN 107 8.530 -8.546 3.775 854 HE22 GLN 107 1HE2 GLN 107 8.984 -8.370 2.118 855 H MET 108 H MET 108 12.687 -9.540 -0.090 856 HA MET 108 HA MET 108 13.067 -7.539 1.863 857 HB2 MET 108 1HB MET 108 14.834 -9.041 -0.022 858 HB3 MET 108 2HB MET 108 15.485 -7.609 0.790 859 HG2 MET 108 1HG MET 108 14.380 -8.891 2.900 860 HG3 MET 108 2HG MET 108 14.825 -10.258 1.875 861 HE1 MET 108 3HE MET 108 18.239 -8.709 0.823 862 HE2 MET 108 1HE MET 108 18.238 -10.398 1.331 863 HE3 MET 108 2HE MET 108 16.904 -9.766 0.366 864 H MET 109 H MET 109 13.357 -7.492 -1.673 865 HA MET 109 HA MET 109 14.359 -4.971 -2.081 866 HB2 MET 109 1HB MET 109 12.349 -6.593 -3.629 867 HB3 MET 109 2HB MET 109 12.867 -4.996 -4.187 868 HG2 MET 109 1HG MET 109 15.104 -5.693 -4.480 869 HG3 MET 109 2HG MET 109 14.826 -7.181 -3.571 870 HE1 MET 109 3HE MET 109 12.679 -6.389 -7.532 871 HE2 MET 109 1HE MET 109 12.860 -5.287 -6.168 872 HE3 MET 109 2HE MET 109 14.194 -5.516 -7.298 873 H TYR 110 H TYR 110 11.113 -5.890 -1.139 874 HA TYR 110 HA TYR 110 10.198 -3.121 -1.325 875 HB2 TYR 110 1HB TYR 110 8.611 -5.547 -0.456 876 HB3 TYR 110 2HB TYR 110 7.982 -3.976 -0.960 877 HD1 TYR 110 1HD TYR 110 9.753 -6.986 -2.204 878 HD2 TYR 110 2HD TYR 110 7.552 -3.493 -3.229 879 HE1 TYR 110 1HE TYR 110 9.587 -7.780 -4.527 880 HE2 TYR 110 2HE TYR 110 7.379 -4.276 -5.553 881 HH TYR 110 HH TYR 110 7.830 -7.304 -6.512 882 H ALA 111 H ALA 111 10.886 -5.630 1.036 883 HA ALA 111 HA ALA 111 9.810 -4.384 3.309 884 HB1 ALA 111 3HB ALA 111 10.429 -6.324 4.185 885 HB2 ALA 111 1HB ALA 111 11.367 -6.695 2.739 886 HB3 ALA 111 2HB ALA 111 12.118 -5.831 4.081 887 H GLY 112 H GLY 112 12.752 -3.825 1.540 888 HA2 GLY 112 1HA GLY 112 13.840 -2.148 3.678 889 HA3 GLY 112 2HA GLY 112 14.671 -2.613 2.200 890 H SER 113 H SER 113 12.341 -1.877 0.535 891 HA SER 113 HA SER 113 12.913 0.984 0.417 892 HB2 SER 113 1HB SER 113 11.254 -0.495 -1.612 893 HB3 SER 113 2HB SER 113 12.302 0.918 -1.836 894 HG SER 113 HG SER 113 13.981 -0.801 -1.076 895 H LYS 114 H LYS 114 10.568 -1.061 1.646 896 HA LYS 114 HA LYS 114 8.150 0.172 1.078 897 HB2 LYS 114 1HB LYS 114 8.134 -1.903 2.239 898 HB3 LYS 114 2HB LYS 114 9.117 -1.247 3.558 899 HG2 LYS 114 1HG LYS 114 7.274 0.197 4.246 900 HG3 LYS 114 2HG LYS 114 6.288 -0.437 2.916 901 HD2 LYS 114 1HD LYS 114 5.534 -1.862 4.502 902 HD3 LYS 114 2HD LYS 114 7.014 -2.748 4.096 903 HE2 LYS 114 1HE LYS 114 8.198 -1.798 5.948 904 HE3 LYS 114 2HE LYS 114 6.878 -0.662 6.265 905 HZ1 LYS 114 3HZ LYS 114 6.705 -2.404 7.837 906 HZ2 LYS 114 1HZ LYS 114 6.848 -3.603 6.650 907 HZ3 LYS 114 2HZ LYS 114 5.455 -2.646 6.722 908 H ASN 115 H ASN 115 9.993 0.669 4.095 909 HA ASN 115 HA ASN 115 8.601 2.888 4.988 910 HB2 ASN 115 1HB ASN 115 11.452 1.998 5.420 911 HB3 ASN 115 2HB ASN 115 10.794 3.436 6.210 912 HD21 ASN 115 2HD2 ASN 115 10.147 -0.141 7.787 913 HD22 ASN 115 1HD2 ASN 115 11.293 0.196 6.537 914 H ARG 116 H ARG 116 11.386 2.721 2.823 915 HA ARG 116 HA ARG 116 11.980 5.438 2.657 916 HB2 ARG 116 1HB ARG 116 13.552 4.004 1.694 917 HB3 ARG 116 2HB ARG 116 12.324 3.141 0.757 918 HG2 ARG 116 1HG ARG 116 13.545 4.425 -0.798 919 HG3 ARG 116 2HG ARG 116 12.002 5.264 -0.564 920 HD2 ARG 116 1HD ARG 116 13.628 6.968 -0.513 921 HD3 ARG 116 2HD ARG 116 13.204 6.673 1.180 922 HE ARG 116 HE ARG 116 15.336 5.059 0.810 923 HH11 ARG 116 2HH1 ARG 116 14.763 8.430 0.158 924 HH12 ARG 116 1HH1 ARG 116 16.417 8.892 0.394 925 HH21 ARG 116 1HH2 ARG 116 17.982 7.311 0.942 926 HH22 ARG 116 2HH2 ARG 116 17.516 5.653 1.123 927 H LEU 117 H LEU 117 9.898 3.503 0.504 928 HA LEU 117 HA LEU 117 9.008 5.680 -1.047 929 HB2 LEU 117 1HB LEU 117 8.828 3.426 -1.871 930 HB3 LEU 117 2HB LEU 117 7.775 2.983 -0.517 931 HG LEU 117 HG LEU 117 6.228 4.860 -1.553 932 HD11 LEU 117 1HD1 LEU 117 7.847 3.911 -3.913 933 HD12 LEU 117 2HD1 LEU 117 7.788 5.554 -3.277 934 HD13 LEU 117 3HD1 LEU 117 6.349 4.838 -4.003 935 HD21 LEU 117 3HD2 LEU 117 5.446 2.645 -1.277 936 HD22 LEU 117 1HD2 LEU 117 6.552 2.022 -2.500 937 HD23 LEU 117 2HD2 LEU 117 5.197 3.044 -2.977 938 H VAL 118 H VAL 118 7.261 3.859 1.478 939 HA VAL 118 HA VAL 118 4.960 5.249 1.692 940 HB VAL 118 HB VAL 118 6.651 4.343 4.026 941 HG11 VAL 118 1HG1 VAL 118 4.723 5.995 4.451 942 HG12 VAL 118 2HG1 VAL 118 3.668 4.640 4.048 943 HG13 VAL 118 3HG1 VAL 118 4.784 4.516 5.409 944 HG21 VAL 118 3HG2 VAL 118 5.565 2.266 3.889 945 HG22 VAL 118 1HG2 VAL 118 4.338 2.885 2.785 946 HG23 VAL 118 2HG2 VAL 118 5.995 2.659 2.224 947 H GLN 119 H GLN 119 7.998 6.185 3.298 948 HA GLN 119 HA GLN 119 7.143 8.470 4.582 949 HB2 GLN 119 1HB GLN 119 9.733 7.473 3.552 950 HB3 GLN 119 2HB GLN 119 9.643 9.215 3.859 951 HG2 GLN 119 1HG GLN 119 8.483 7.969 6.099 952 HG3 GLN 119 2HG GLN 119 9.955 7.063 5.717 953 HE21 GLN 119 2HE2 GLN 119 12.169 9.694 6.478 954 HE22 GLN 119 1HE2 GLN 119 11.952 8.257 5.544 955 H THR 120 H THR 120 8.263 8.121 1.238 956 HA THR 120 HA THR 120 8.217 10.823 0.522 957 HB THR 120 HB THR 120 7.558 8.522 -1.322 958 HG1 THR 120 1HG THR 120 10.029 8.940 -1.643 959 HG21 THR 120 3HG2 THR 120 7.232 10.413 -2.593 960 HG22 THR 120 1HG2 THR 120 8.956 10.144 -2.851 961 HG23 THR 120 2HG2 THR 120 8.417 11.356 -1.689 962 H ALA 121 H ALA 121 5.674 8.356 0.344 963 HA ALA 121 HA ALA 121 3.731 10.002 -0.882 964 HB1 ALA 121 3HB ALA 121 3.775 7.442 -0.637 965 HB2 ALA 121 1HB ALA 121 3.039 7.726 0.940 966 HB3 ALA 121 2HB ALA 121 2.220 8.267 -0.526 967 H GLU 122 H GLU 122 4.923 9.837 2.328 968 HA GLU 122 HA GLU 122 4.477 11.106 4.170 969 HB2 GLU 122 1HB GLU 122 3.599 12.682 2.065 970 HB3 GLU 122 2HB GLU 122 2.199 12.611 3.145 971 HG2 GLU 122 1HG GLU 122 4.760 13.129 4.490 972 HG3 GLU 122 2HG GLU 122 4.232 14.387 3.363 973 H LEU 123 H LEU 123 3.366 8.617 4.012 974 HA LEU 123 HA LEU 123 0.601 8.908 4.948 975 HB2 LEU 123 1HB LEU 123 2.150 6.406 4.249 976 HB3 LEU 123 2HB LEU 123 0.430 6.496 4.665 977 HG LEU 123 HG LEU 123 1.480 7.988 2.291 978 HD11 LEU 123 1HD1 LEU 123 1.692 6.176 0.990 979 HD12 LEU 123 2HD1 LEU 123 0.339 5.344 1.755 980 HD13 LEU 123 3HD1 LEU 123 1.932 5.314 2.511 981 HD21 LEU 123 3HD2 LEU 123 -1.147 7.039 3.319 982 HD22 LEU 123 1HD2 LEU 123 -0.919 7.179 1.576 983 HD23 LEU 123 2HD2 LEU 123 -0.703 8.592 2.609 984 H THR 124 H THR 124 0.413 9.206 7.064 985 HA THR 124 HA THR 124 2.430 8.381 8.928 986 HB THR 124 HB THR 124 1.154 10.430 9.323 987 HG1 THR 124 1HG THR 124 0.623 8.415 11.274 988 HG21 THR 124 3HG2 THR 124 -1.202 8.559 9.567 989 HG22 THR 124 1HG2 THR 124 -0.985 9.855 8.391 990 HG23 THR 124 2HG2 THR 124 -1.214 10.240 10.097 991 H LYS 125 H LYS 125 -0.200 6.836 7.488 992 HA LYS 125 HA LYS 125 -0.373 4.874 9.679 993 HB2 LYS 125 1HB LYS 125 -2.337 5.227 7.409 994 HB3 LYS 125 2HB LYS 125 -2.552 4.274 8.886 995 HG2 LYS 125 1HG LYS 125 -2.270 6.533 10.119 996 HG3 LYS 125 2HG LYS 125 -2.633 7.241 8.535 997 HD2 LYS 125 1HD LYS 125 -4.571 5.286 8.805 998 HD3 LYS 125 2HD LYS 125 -4.406 5.938 10.445 999 HE2 LYS 125 1HE LYS 125 -4.417 8.068 8.480 1000 HE3 LYS 125 2HE LYS 125 -5.853 7.044 8.332 1001 HZ1 LYS 125 3HZ LYS 125 -6.292 7.374 10.687 1002 HZ2 LYS 125 1HZ LYS 125 -6.226 8.857 9.876 1003 HZ3 LYS 125 2HZ LYS 125 -4.921 8.355 10.829 1004 H VAL 126 H VAL 126 0.517 2.949 9.355 1005 HA VAL 126 HA VAL 126 0.779 1.941 6.607 1006 HB VAL 126 HB VAL 126 2.983 1.561 8.617 1007 HG11 VAL 126 1HG1 VAL 126 2.453 0.759 5.877 1008 HG12 VAL 126 2HG1 VAL 126 4.011 1.566 6.053 1009 HG13 VAL 126 3HG1 VAL 126 3.640 0.143 7.026 1010 HG21 VAL 126 3HG2 VAL 126 3.063 3.870 8.447 1011 HG22 VAL 126 1HG2 VAL 126 4.146 3.360 7.150 1012 HG23 VAL 126 2HG2 VAL 126 2.498 3.870 6.777 1013 H PHE 127 H PHE 127 0.238 -0.145 6.364 1014 HA PHE 127 HA PHE 127 0.052 -1.835 8.762 1015 HB2 PHE 127 1HB PHE 127 -2.014 -1.740 6.548 1016 HB3 PHE 127 2HB PHE 127 -2.076 -2.739 8.001 1017 HD1 PHE 127 1HD PHE 127 -1.202 -0.772 10.048 1018 HD2 PHE 127 2HD PHE 127 -3.915 -0.394 6.791 1019 HE1 PHE 127 1HE PHE 127 -2.397 1.010 11.254 1020 HE2 PHE 127 2HE PHE 127 -5.114 1.389 7.991 1021 HZ PHE 127 HZ PHE 127 -4.355 2.093 10.225 1022 H GLU 128 H GLU 128 0.610 -3.959 8.503 1023 HA GLU 128 HA GLU 128 1.597 -4.717 5.832 1024 HB2 GLU 128 1HB GLU 128 3.278 -4.402 7.737 1025 HB3 GLU 128 2HB GLU 128 2.582 -5.874 8.433 1026 HG2 GLU 128 1HG GLU 128 3.080 -6.664 5.869 1027 HG3 GLU 128 2HG GLU 128 4.413 -5.544 6.180 1028 H ILE 129 H ILE 129 0.596 -6.351 4.875 1029 HA ILE 129 HA ILE 129 -1.052 -8.146 6.526 1030 HB ILE 129 HB ILE 129 -2.123 -8.673 4.223 1031 HG12 ILE 129 1HG1 ILE 129 -1.143 -5.882 3.625 1032 HG13 ILE 129 2HG1 ILE 129 -0.284 -7.320 3.048 1033 HG21 ILE 129 1HG2 ILE 129 -2.710 -5.911 5.211 1034 HG22 ILE 129 2HG2 ILE 129 -3.824 -7.169 4.679 1035 HG23 ILE 129 3HG2 ILE 129 -3.013 -7.312 6.237 1036 HD11 ILE 129 3HD1 ILE 129 -3.184 -6.831 2.452 1037 HD12 ILE 129 1HD1 ILE 129 -1.876 -6.260 1.415 1038 HD13 ILE 129 2HD1 ILE 129 -2.090 -7.988 1.693 1039 H ARG 130 H ARG 130 -0.547 -10.236 6.633 1040 HA ARG 130 HA ARG 130 1.775 -11.219 5.257 1041 HB2 ARG 130 1HB ARG 130 1.042 -11.780 7.646 1042 HB3 ARG 130 2HB ARG 130 -0.134 -12.870 6.898 1043 HG2 ARG 130 1HG ARG 130 1.633 -14.285 7.369 1044 HG3 ARG 130 2HG ARG 130 1.903 -13.867 5.669 1045 HD2 ARG 130 1HD ARG 130 4.019 -13.648 6.671 1046 HD3 ARG 130 2HD ARG 130 3.403 -11.995 6.533 1047 HE ARG 130 HE ARG 130 3.266 -11.867 8.831 1048 HH11 ARG 130 2HH1 ARG 130 3.930 -15.141 7.852 1049 HH12 ARG 130 1HH1 ARG 130 4.301 -15.683 9.455 1050 HH21 ARG 130 1HH2 ARG 130 4.198 -14.220 11.215 1051 HH22 ARG 130 2HH2 ARG 130 3.752 -12.569 10.946 1052 H THR 131 H THR 131 -1.466 -10.990 4.464 1053 HA THR 131 HA THR 131 -1.151 -12.469 2.060 1054 HB THR 131 HB THR 131 -1.478 -14.460 3.276 1055 HG1 THR 131 1HG THR 131 -3.219 -15.184 2.226 1056 HG21 THR 131 3HG2 THR 131 -3.979 -13.526 4.606 1057 HG22 THR 131 1HG2 THR 131 -2.424 -13.056 5.292 1058 HG23 THR 131 2HG2 THR 131 -2.831 -14.763 5.113 1059 H THR 132 H THR 132 -2.843 -12.128 0.600 1060 HA THR 132 HA THR 132 -4.212 -9.742 0.738 1061 HB THR 132 HB THR 132 -5.672 -10.620 -1.080 1062 HG1 THR 132 1HG THR 132 -4.227 -12.983 -1.242 1063 HG21 THR 132 3HG2 THR 132 -3.232 -9.795 -1.347 1064 HG22 THR 132 1HG2 THR 132 -3.990 -10.646 -2.692 1065 HG23 THR 132 2HG2 THR 132 -2.857 -11.492 -1.638 1066 H ASP 133 H ASP 133 -5.311 -12.958 1.700 1067 HA ASP 133 HA ASP 133 -7.984 -12.559 2.117 1068 HB2 ASP 133 1HB ASP 133 -5.914 -14.286 3.326 1069 HB3 ASP 133 2HB ASP 133 -7.363 -14.049 4.312 1070 H ASP 134 H ASP 134 -5.311 -11.433 4.094 1071 HA ASP 134 HA ASP 134 -6.737 -10.643 6.368 1072 HB2 ASP 134 1HB ASP 134 -4.091 -10.489 5.471 1073 HB3 ASP 134 2HB ASP 134 -4.578 -8.810 5.741 1074 H LEU 135 H LEU 135 -6.093 -8.948 3.336 1075 HA LEU 135 HA LEU 135 -7.174 -6.456 4.112 1076 HB2 LEU 135 1HB LEU 135 -5.768 -6.453 2.232 1077 HB3 LEU 135 2HB LEU 135 -6.675 -7.764 1.459 1078 HG LEU 135 HG LEU 135 -8.425 -6.320 0.818 1079 HD11 LEU 135 1HD1 LEU 135 -7.833 -3.759 1.643 1080 HD12 LEU 135 2HD1 LEU 135 -7.498 -4.737 3.070 1081 HD13 LEU 135 3HD1 LEU 135 -9.087 -4.805 2.310 1082 HD21 LEU 135 3HD2 LEU 135 -5.669 -5.295 0.382 1083 HD22 LEU 135 1HD2 LEU 135 -7.024 -4.299 -0.149 1084 HD23 LEU 135 2HD2 LEU 135 -6.835 -5.937 -0.775 1085 H THR 136 H THR 136 -9.146 -6.812 5.144 1086 HA THR 136 HA THR 136 -11.365 -7.446 3.321 1087 HB THR 136 HB THR 136 -12.513 -8.359 5.482 1088 HG1 THR 136 1HG THR 136 -9.863 -9.102 6.127 1089 HG21 THR 136 3HG2 THR 136 -10.370 -9.969 4.091 1090 HG22 THR 136 1HG2 THR 136 -11.993 -9.683 3.465 1091 HG23 THR 136 2HG2 THR 136 -11.771 -10.613 4.948 1092 H GLU 137 H GLU 137 -13.323 -6.365 3.733 1093 HA GLU 137 HA GLU 137 -13.298 -3.737 4.316 1094 HB2 GLU 137 1HB GLU 137 -15.255 -4.983 3.442 1095 HB3 GLU 137 2HB GLU 137 -15.562 -5.589 5.077 1096 HG2 GLU 137 1HG GLU 137 -15.501 -2.953 5.589 1097 HG3 GLU 137 2HG GLU 137 -16.076 -2.930 3.917 1098 H THR 138 H THR 138 -13.614 -6.342 6.676 1099 HA THR 138 HA THR 138 -13.969 -4.575 8.906 1100 HB THR 138 HB THR 138 -13.093 -7.457 9.055 1101 HG1 THR 138 1HG THR 138 -15.360 -7.922 9.097 1102 HG21 THR 138 3HG2 THR 138 -14.691 -7.190 11.123 1103 HG22 THR 138 1HG2 THR 138 -14.307 -5.480 10.932 1104 HG23 THR 138 2HG2 THR 138 -13.015 -6.647 11.210 1105 H TRP 139 H TRP 139 -11.352 -6.895 8.192 1106 HA TRP 139 HA TRP 139 -9.500 -6.106 10.013 1107 HB2 TRP 139 1HB TRP 139 -8.894 -7.957 8.727 1108 HB3 TRP 139 2HB TRP 139 -9.212 -7.122 7.206 1109 HD1 TRP 139 HD TRP 139 -6.430 -7.916 9.571 1110 HE1 TRP 139 1HE TRP 139 -4.249 -6.818 8.758 1111 HE3 TRP 139 3HE TRP 139 -8.360 -4.849 5.965 1112 HZ2 TRP 139 2HZ TRP 139 -3.452 -4.905 6.843 1113 HZ3 TRP 139 3HZ TRP 139 -6.820 -3.415 4.689 1114 HH2 TRP 139 HH TRP 139 -4.417 -3.444 5.120 1115 H LEU 140 H LEU 140 -10.576 -4.321 7.265 1116 HA LEU 140 HA LEU 140 -8.335 -2.482 7.308 1117 HB2 LEU 140 1HB LEU 140 -9.182 -2.885 5.153 1118 HB3 LEU 140 2HB LEU 140 -10.856 -2.683 5.695 1119 HG LEU 140 HG LEU 140 -9.752 -0.841 4.248 1120 HD11 LEU 140 1HD1 LEU 140 -11.417 0.510 4.926 1121 HD12 LEU 140 2HD1 LEU 140 -10.943 0.422 6.622 1122 HD13 LEU 140 3HD1 LEU 140 -11.885 -0.882 5.901 1123 HD21 LEU 140 3HD2 LEU 140 -8.229 0.555 5.156 1124 HD22 LEU 140 1HD2 LEU 140 -7.851 -0.851 6.153 1125 HD23 LEU 140 2HD2 LEU 140 -8.907 0.416 6.778 1126 H LYS 141 H LYS 141 -11.865 -2.141 7.710 1127 HA LYS 141 HA LYS 141 -11.792 0.463 8.745 1128 HB2 LYS 141 1HB LYS 141 -13.771 -1.737 8.607 1129 HB3 LYS 141 2HB LYS 141 -14.052 -0.519 9.861 1130 HG2 LYS 141 1HG LYS 141 -14.526 1.132 8.374 1131 HG3 LYS 141 2HG LYS 141 -13.445 0.468 7.137 1132 HD2 LYS 141 1HD LYS 141 -15.374 -0.143 6.131 1133 HD3 LYS 141 2HD LYS 141 -15.295 -1.500 7.269 1134 HE2 LYS 141 1HE LYS 141 -16.588 1.034 8.180 1135 HE3 LYS 141 2HE LYS 141 -17.463 -0.004 7.045 1136 HZ1 LYS 141 3HZ LYS 141 -16.621 -1.790 8.853 1137 HZ2 LYS 141 1HZ LYS 141 -18.133 -1.030 8.903 1138 HZ3 LYS 141 2HZ LYS 141 -16.856 -0.434 9.839 1139 H GLU 142 H GLU 142 -10.952 -2.522 10.171 1140 HA GLU 142 HA GLU 142 -11.486 -1.844 12.891 1141 HB2 GLU 142 1HB GLU 142 -9.983 -3.999 11.470 1142 HB3 GLU 142 2HB GLU 142 -9.654 -3.739 13.189 1143 HG2 GLU 142 1HG GLU 142 -12.352 -3.779 13.229 1144 HG3 GLU 142 2HG GLU 142 -12.029 -4.860 11.867 1145 H LYS 143 H LYS 143 -8.553 -1.833 10.887 1146 HA LYS 143 HA LYS 143 -6.794 -0.914 12.878 1147 HB2 LYS 143 1HB LYS 143 -6.629 -0.479 9.885 1148 HB3 LYS 143 2HB LYS 143 -5.290 -0.343 11.036 1149 HG2 LYS 143 1HG LYS 143 -6.655 -2.923 11.159 1150 HG3 LYS 143 2HG LYS 143 -5.926 -2.572 9.582 1151 HD2 LYS 143 1HD LYS 143 -3.922 -1.784 11.230 1152 HD3 LYS 143 2HD LYS 143 -4.647 -3.089 12.186 1153 HE2 LYS 143 1HE LYS 143 -4.304 -4.688 10.464 1154 HE3 LYS 143 2HE LYS 143 -3.922 -3.423 9.286 1155 HZ1 LYS 143 3HZ LYS 143 -1.827 -3.150 10.107 1156 HZ2 LYS 143 1HZ LYS 143 -2.041 -4.795 10.443 1157 HZ3 LYS 143 2HZ LYS 143 -2.236 -3.650 11.671 1158 H LEU 144 H LEU 144 -8.964 0.767 10.699 1159 HA LEU 144 HA LEU 144 -7.913 3.374 11.242 1160 HB2 LEU 144 1HB LEU 144 -10.675 2.774 10.205 1161 HB3 LEU 144 2HB LEU 144 -9.671 4.206 9.916 1162 HG LEU 144 HG LEU 144 -9.007 1.467 8.850 1163 HD11 LEU 144 1HD1 LEU 144 -9.830 2.342 6.685 1164 HD12 LEU 144 2HD1 LEU 144 -10.479 3.745 7.535 1165 HD13 LEU 144 3HD1 LEU 144 -11.107 2.134 7.885 1166 HD21 LEU 144 3HD2 LEU 144 -7.981 4.228 8.206 1167 HD22 LEU 144 1HD2 LEU 144 -7.554 2.755 7.334 1168 HD23 LEU 144 2HD2 LEU 144 -7.098 2.940 9.028 1169 H ALA 145 H ALA 145 -10.846 1.628 12.250 1170 HA ALA 145 HA ALA 145 -12.085 3.478 13.814 1171 HB1 ALA 145 3HB ALA 145 -12.305 0.747 13.452 1172 HB2 ALA 145 1HB ALA 145 -12.009 0.922 15.182 1173 HB3 ALA 145 2HB ALA 145 -13.365 1.762 14.429 1174 H SER 146 H SER 146 -9.758 1.113 15.135 1175 HA SER 146 HA SER 146 -8.165 2.885 16.540 1176 HB2 SER 146 1HB SER 146 -10.725 2.765 17.700 1177 HB3 SER 146 2HB SER 146 -9.682 1.786 18.746 1178 HG SER 146 HG SER 146 -9.512 3.877 19.450 1179 H GLY 147 H GLY 147 -7.893 0.469 15.139 1180 HA2 GLY 147 1HA GLY 147 -7.697 -1.861 16.616 1181 HA3 GLY 147 2HA GLY 147 -6.650 -1.460 15.262 1182 HA PRO 148 HA PRO 148 -4.454 -1.387 19.528 1183 HB2 PRO 148 2HB PRO 148 -5.008 -3.480 20.298 1184 HB3 PRO 148 1HB PRO 148 -3.453 -3.935 19.603 1185 HG2 PRO 148 1HG PRO 148 -4.405 -4.721 17.634 1186 HG3 PRO 148 2HG PRO 148 -5.678 -5.158 18.834 1187 HD2 PRO 148 1HD PRO 148 -6.203 -3.699 16.607 1188 HD3 PRO 148 2HD PRO 148 -7.059 -3.450 18.137 1189 H SER 149 H SER 149 -2.918 -0.044 18.650 1190 HA SER 149 HA SER 149 -0.749 -1.366 17.158 1191 HB2 SER 149 1HB SER 149 -2.371 0.471 16.021 1192 HB3 SER 149 2HB SER 149 -1.151 1.542 16.732 1193 HG SER 149 HG SER 149 0.110 1.000 15.157 1194 H SER 150 H SER 150 1.280 0.150 17.208 1195 HA SER 150 HA SER 150 1.943 0.473 19.994 1196 HB2 SER 150 1HB SER 150 3.413 0.384 17.419 1197 HB3 SER 150 2HB SER 150 4.144 1.375 18.694 1198 HG SER 150 HG SER 150 3.328 -1.323 19.034 1199 H GLY 151 H GLY 151 1.101 2.241 20.944 1200 HA2 GLY 151 1HA GLY 151 1.091 4.789 19.515 1201 HA3 GLY 151 2HA GLY 151 0.306 4.456 21.051 Start of MODEL 8 1 H1 GLY 1 H GLY 1 11.844 -3.935 8.519 2 HA2 GLY 1 1HA GLY 1 9.158 -4.977 8.542 3 HA3 GLY 1 2HA GLY 1 9.697 -4.488 6.943 4 H SER 2 H SER 2 10.536 -6.551 9.700 5 HA SER 2 HA SER 2 11.734 -8.445 7.789 6 HB2 SER 2 1HB SER 2 13.327 -9.096 9.640 7 HB3 SER 2 2HB SER 2 13.581 -7.474 8.969 8 HG SER 2 HG SER 2 13.506 -6.959 11.025 9 H SER 3 H SER 3 11.801 -10.694 8.616 10 HA SER 3 HA SER 3 9.237 -11.379 9.744 11 HB2 SER 3 1HB SER 3 11.555 -13.087 8.790 12 HB3 SER 3 2HB SER 3 10.007 -13.734 9.358 13 HG SER 3 HG SER 3 10.637 -12.550 6.961 14 H GLY 4 H GLY 4 12.627 -12.068 10.620 15 HA2 GLY 4 1HA GLY 4 13.165 -11.582 13.016 16 HA3 GLY 4 2HA GLY 4 11.701 -12.476 13.397 17 H SER 5 H SER 5 15.045 -12.670 12.622 18 HA SER 5 HA SER 5 15.388 -15.221 13.681 19 HB2 SER 5 1HB SER 5 14.185 -15.438 11.211 20 HB3 SER 5 2HB SER 5 15.903 -15.628 10.820 21 HG SER 5 HG SER 5 15.154 -17.640 11.333 22 H SER 6 H SER 6 16.683 -13.703 10.725 23 HA SER 6 HA SER 6 18.977 -12.619 11.932 24 HB2 SER 6 1HB SER 6 20.649 -14.252 10.878 25 HB3 SER 6 2HB SER 6 19.807 -14.800 12.338 26 HG SER 6 HG SER 6 19.927 -16.168 10.238 27 H GLY 7 H GLY 7 20.492 -11.734 10.369 28 HA2 GLY 7 1HA GLY 7 20.209 -11.980 7.587 29 HA3 GLY 7 2HA GLY 7 19.210 -10.637 8.121 30 H SER 8 H SER 8 20.283 -8.888 7.419 31 HA SER 8 HA SER 8 22.857 -8.312 8.628 32 HB2 SER 8 1HB SER 8 23.498 -9.438 6.541 33 HB3 SER 8 2HB SER 8 22.497 -8.303 5.620 34 HG SER 8 HG SER 8 23.883 -6.633 6.681 35 H ASP 9 H ASP 9 23.426 -6.076 8.536 36 HA ASP 9 HA ASP 9 21.107 -4.354 8.489 37 HB2 ASP 9 1HB ASP 9 23.193 -4.377 10.129 38 HB3 ASP 9 2HB ASP 9 23.865 -3.289 8.907 39 H SER 10 H SER 10 21.541 -5.285 5.958 40 HA SER 10 HA SER 10 21.870 -2.839 4.499 41 HB2 SER 10 1HB SER 10 23.949 -5.019 4.302 42 HB3 SER 10 2HB SER 10 23.643 -3.904 2.958 43 HG SER 10 HG SER 10 23.858 -2.380 5.055 44 H LEU 11 H LEU 11 20.592 -2.863 2.754 45 HA LEU 11 HA LEU 11 19.830 -5.443 1.582 46 HB2 LEU 11 1HB LEU 11 17.882 -3.230 2.246 47 HB3 LEU 11 2HB LEU 11 17.503 -4.786 1.487 48 HG LEU 11 HG LEU 11 18.717 -4.746 4.217 49 HD11 LEU 11 1HD1 LEU 11 16.166 -4.886 4.895 50 HD12 LEU 11 2HD1 LEU 11 15.982 -3.863 3.470 51 HD13 LEU 11 3HD1 LEU 11 17.018 -3.345 4.800 52 HD21 LEU 11 3HD2 LEU 11 17.920 -6.877 4.374 53 HD22 LEU 11 1HD2 LEU 11 18.156 -6.782 2.629 54 HD23 LEU 11 2HD2 LEU 11 16.546 -6.563 3.314 55 H VAL 12 H VAL 12 18.192 -4.743 -0.382 56 HA VAL 12 HA VAL 12 19.884 -3.073 -2.084 57 HB VAL 12 HB VAL 12 19.304 -5.295 -2.931 58 HG11 VAL 12 1HG1 VAL 12 17.151 -5.569 -1.825 59 HG12 VAL 12 2HG1 VAL 12 16.452 -4.312 -2.847 60 HG13 VAL 12 3HG1 VAL 12 16.999 -5.829 -3.562 61 HG21 VAL 12 3HG2 VAL 12 19.270 -4.521 -5.028 62 HG22 VAL 12 1HG2 VAL 12 17.707 -3.735 -4.801 63 HG23 VAL 12 2HG2 VAL 12 19.187 -2.914 -4.306 64 H VAL 13 H VAL 13 18.461 -1.609 -0.235 65 HA VAL 13 HA VAL 13 15.972 -0.682 -0.678 66 HB VAL 13 HB VAL 13 17.592 0.242 0.990 67 HG11 VAL 13 1HG1 VAL 13 19.338 0.659 -0.858 68 HG12 VAL 13 2HG1 VAL 13 18.465 2.167 -1.136 69 HG13 VAL 13 3HG1 VAL 13 19.190 1.844 0.440 70 HG21 VAL 13 3HG2 VAL 13 15.345 1.282 0.258 71 HG22 VAL 13 1HG2 VAL 13 16.459 2.260 1.213 72 HG23 VAL 13 2HG2 VAL 13 16.344 2.503 -0.530 73 H CYS 14 H CYS 14 14.960 0.875 -1.979 74 HA CYS 14 HA CYS 14 16.362 1.470 -4.502 75 HB2 CYS 14 1HB CYS 14 14.544 0.911 -5.748 76 HB3 CYS 14 2HB CYS 14 14.287 -0.191 -4.384 77 HG CYS 14 HG CYS 14 11.968 0.675 -3.719 78 H GLU 15 H GLU 15 14.633 3.195 -5.666 79 HA GLU 15 HA GLU 15 14.451 5.419 -3.741 80 HB2 GLU 15 1HB GLU 15 15.275 6.940 -5.308 81 HB3 GLU 15 2HB GLU 15 16.301 5.515 -5.530 82 HG2 GLU 15 1HG GLU 15 14.498 4.903 -7.351 83 HG3 GLU 15 2HG GLU 15 14.218 6.649 -7.320 84 H VAL 16 H VAL 16 12.669 6.741 -3.839 85 HA VAL 16 HA VAL 16 10.290 5.624 -4.914 86 HB VAL 16 HB VAL 16 10.191 6.941 -2.887 87 HG11 VAL 16 1HG1 VAL 16 11.926 8.665 -4.242 88 HG12 VAL 16 2HG1 VAL 16 10.444 9.588 -3.986 89 HG13 VAL 16 3HG1 VAL 16 11.279 8.859 -2.613 90 HG21 VAL 16 3HG2 VAL 16 8.568 8.838 -3.996 91 HG22 VAL 16 1HG2 VAL 16 8.621 7.612 -5.262 92 HG23 VAL 16 2HG2 VAL 16 8.091 7.178 -3.638 93 H ASP 17 H ASP 17 10.397 5.460 -7.131 94 HA ASP 17 HA ASP 17 11.365 7.006 -9.065 95 HB2 ASP 17 1HB ASP 17 9.947 4.985 -9.417 96 HB3 ASP 17 2HB ASP 17 8.517 5.987 -9.131 97 HA PRO 18 HA PRO 18 9.766 11.092 -8.675 98 HB2 PRO 18 2HB PRO 18 11.544 11.744 -9.976 99 HB3 PRO 18 1HB PRO 18 10.304 11.990 -11.206 100 HG2 PRO 18 1HG PRO 18 10.694 9.931 -12.209 101 HG3 PRO 18 2HG PRO 18 12.357 10.374 -11.670 102 HD2 PRO 18 1HD PRO 18 11.183 8.016 -11.012 103 HD3 PRO 18 2HD PRO 18 12.301 8.864 -9.930 104 H GLU 19 H GLU 19 8.742 9.036 -11.353 105 HA GLU 19 HA GLU 19 6.529 10.659 -12.122 106 HB2 GLU 19 1HB GLU 19 6.111 9.092 -13.735 107 HB3 GLU 19 2HB GLU 19 7.808 8.723 -13.392 108 HG2 GLU 19 1HG GLU 19 7.145 6.617 -13.128 109 HG3 GLU 19 2HG GLU 19 6.486 7.156 -11.577 110 H LEU 20 H LEU 20 7.041 8.221 -9.716 111 HA LEU 20 HA LEU 20 4.194 7.838 -9.257 112 HB2 LEU 20 1HB LEU 20 6.201 6.110 -9.056 113 HB3 LEU 20 2HB LEU 20 6.257 6.761 -7.408 114 HG LEU 20 HG LEU 20 3.815 5.507 -8.660 115 HD11 LEU 20 1HD1 LEU 20 6.116 4.202 -7.885 116 HD12 LEU 20 2HD1 LEU 20 4.510 3.489 -8.023 117 HD13 LEU 20 3HD1 LEU 20 5.078 4.085 -6.464 118 HD21 LEU 20 3HD2 LEU 20 3.376 5.346 -6.055 119 HD22 LEU 20 1HD2 LEU 20 2.936 6.778 -6.986 120 HD23 LEU 20 2HD2 LEU 20 4.424 6.764 -6.039 121 H LYS 21 H LYS 21 7.009 9.199 -7.590 122 HA LYS 21 HA LYS 21 6.093 9.858 -5.149 123 HB2 LYS 21 1HB LYS 21 8.313 10.490 -6.153 124 HB3 LYS 21 2HB LYS 21 7.499 11.866 -6.915 125 HG2 LYS 21 1HG LYS 21 6.727 12.302 -4.400 126 HG3 LYS 21 2HG LYS 21 8.236 11.429 -4.083 127 HD2 LYS 21 1HD LYS 21 8.406 13.525 -6.156 128 HD3 LYS 21 2HD LYS 21 8.087 14.098 -4.510 129 HE2 LYS 21 1HE LYS 21 10.042 12.548 -3.818 130 HE3 LYS 21 2HE LYS 21 10.445 12.561 -5.541 131 HZ1 LYS 21 3HZ LYS 21 9.954 15.192 -4.550 132 HZ2 LYS 21 1HZ LYS 21 11.303 14.586 -5.372 133 HZ3 LYS 21 2HZ LYS 21 11.196 14.427 -3.693 134 H GLU 22 H GLU 22 5.314 11.613 -8.131 135 HA GLU 22 HA GLU 22 3.755 13.624 -6.909 136 HB2 GLU 22 1HB GLU 22 3.392 12.568 -9.717 137 HB3 GLU 22 2HB GLU 22 3.018 14.188 -9.110 138 HG2 GLU 22 1HG GLU 22 5.599 14.223 -8.566 139 HG3 GLU 22 2HG GLU 22 5.637 12.997 -9.842 140 H THR 23 H THR 23 2.881 10.535 -8.420 141 HA THR 23 HA THR 23 0.155 10.634 -8.370 142 HB THR 23 HB THR 23 2.027 8.342 -7.834 143 HG1 THR 23 1HG THR 23 1.505 7.826 -9.913 144 HG21 THR 23 3HG2 THR 23 -0.901 8.442 -7.437 145 HG22 THR 23 1HG2 THR 23 0.304 7.369 -6.725 146 HG23 THR 23 2HG2 THR 23 -0.287 7.070 -8.360 147 H LEU 24 H LEU 24 2.277 9.771 -5.654 148 HA LEU 24 HA LEU 24 0.238 9.218 -3.800 149 HB2 LEU 24 1HB LEU 24 2.922 10.372 -3.073 150 HB3 LEU 24 2HB LEU 24 1.908 9.257 -2.142 151 HG LEU 24 HG LEU 24 3.469 8.601 -4.639 152 HD11 LEU 24 1HD1 LEU 24 4.042 7.006 -2.327 153 HD12 LEU 24 2HD1 LEU 24 4.245 8.716 -1.949 154 HD13 LEU 24 3HD1 LEU 24 5.127 8.001 -3.298 155 HD21 LEU 24 3HD2 LEU 24 1.439 7.065 -3.066 156 HD22 LEU 24 1HD2 LEU 24 2.745 6.227 -3.907 157 HD23 LEU 24 2HD2 LEU 24 1.610 7.228 -4.815 158 H ARG 25 H ARG 25 2.112 12.188 -4.367 159 HA ARG 25 HA ARG 25 0.880 13.752 -2.395 160 HB2 ARG 25 1HB ARG 25 2.987 14.193 -3.871 161 HB3 ARG 25 2HB ARG 25 1.825 14.941 -4.977 162 HG2 ARG 25 1HG ARG 25 1.440 16.719 -3.621 163 HG3 ARG 25 2HG ARG 25 1.701 15.778 -2.144 164 HD2 ARG 25 1HD ARG 25 3.708 16.753 -2.003 165 HD3 ARG 25 2HD ARG 25 4.174 15.750 -3.384 166 HE ARG 25 HE ARG 25 4.081 17.605 -4.739 167 HH11 ARG 25 2HH1 ARG 25 2.614 18.324 -1.665 168 HH12 ARG 25 1HH1 ARG 25 2.500 20.026 -1.970 169 HH21 ARG 25 1HH2 ARG 25 3.253 20.889 -3.955 170 HH22 ARG 25 2HH2 ARG 25 3.937 19.843 -5.152 171 H LYS 26 H LYS 26 -0.084 12.940 -5.655 172 HA LYS 26 HA LYS 26 -2.206 14.889 -5.748 173 HB2 LYS 26 1HB LYS 26 -2.038 12.511 -7.573 174 HB3 LYS 26 2HB LYS 26 -2.614 14.149 -7.920 175 HG2 LYS 26 1HG LYS 26 0.103 14.390 -7.195 176 HG3 LYS 26 2HG LYS 26 -0.020 13.032 -8.327 177 HD2 LYS 26 1HD LYS 26 -1.603 14.775 -9.606 178 HD3 LYS 26 2HD LYS 26 -0.547 15.917 -8.757 179 HE2 LYS 26 1HE LYS 26 1.299 15.339 -9.961 180 HE3 LYS 26 2HE LYS 26 0.784 13.652 -10.116 181 HZ1 LYS 26 3HZ LYS 26 0.380 15.840 -11.911 182 HZ2 LYS 26 1HZ LYS 26 -1.067 15.039 -11.558 183 HZ3 LYS 26 2HZ LYS 26 0.242 14.178 -12.192 184 H PHE 27 H PHE 27 -1.848 11.512 -4.920 185 HA PHE 27 HA PHE 27 -4.594 10.823 -4.964 186 HB2 PHE 27 1HB PHE 27 -2.513 9.286 -4.891 187 HB3 PHE 27 2HB PHE 27 -2.575 9.534 -3.145 188 HD1 PHE 27 2HD PHE 27 -5.338 9.079 -5.596 189 HD2 PHE 27 1HD PHE 27 -3.269 7.542 -2.208 190 HE1 PHE 27 2HE PHE 27 -7.020 7.297 -5.381 191 HE2 PHE 27 1HE PHE 27 -4.948 5.757 -1.989 192 HZ PHE 27 HZ PHE 27 -6.828 5.633 -3.575 193 H ARG 28 H ARG 28 -2.465 12.112 -2.466 194 HA ARG 28 HA ARG 28 -4.314 11.879 -0.329 195 HB2 ARG 28 1HB ARG 28 -2.142 13.961 -0.477 196 HB3 ARG 28 2HB ARG 28 -2.781 13.130 0.949 197 HG2 ARG 28 1HG ARG 28 -1.791 11.075 -0.638 198 HG3 ARG 28 2HG ARG 28 -0.606 12.382 -0.799 199 HD2 ARG 28 1HD ARG 28 -1.647 11.299 1.830 200 HD3 ARG 28 2HD ARG 28 -0.106 10.859 1.081 201 HE ARG 28 HE ARG 28 0.105 13.527 1.234 202 HH11 ARG 28 2HH1 ARG 28 -0.858 11.134 3.573 203 HH12 ARG 28 1HH1 ARG 28 -0.274 12.038 4.931 204 HH21 ARG 28 1HH2 ARG 28 0.712 14.081 4.612 205 HH22 ARG 28 2HH2 ARG 28 0.878 14.725 3.014 206 H PHE 29 H PHE 29 -3.813 14.241 -2.833 207 HA PHE 29 HA PHE 29 -6.042 15.816 -1.730 208 HB2 PHE 29 1HB PHE 29 -4.128 17.258 -3.458 209 HB3 PHE 29 2HB PHE 29 -4.947 17.788 -1.987 210 HD1 PHE 29 1HD PHE 29 -4.129 16.086 0.102 211 HD2 PHE 29 2HD PHE 29 -1.847 17.450 -3.223 212 HE1 PHE 29 1HE PHE 29 -2.061 15.774 1.397 213 HE2 PHE 29 2HE PHE 29 0.225 17.140 -1.932 214 HZ PHE 29 HZ PHE 29 0.119 16.300 0.380 215 H ARG 30 H ARG 30 -6.366 13.692 -3.517 216 HA ARG 30 HA ARG 30 -6.473 14.586 -6.220 217 HB2 ARG 30 1HB ARG 30 -7.805 12.537 -6.612 218 HB3 ARG 30 2HB ARG 30 -6.302 12.222 -5.732 219 HG2 ARG 30 1HG ARG 30 -7.863 12.484 -3.622 220 HG3 ARG 30 2HG ARG 30 -9.115 12.045 -4.797 221 HD2 ARG 30 1HD ARG 30 -6.710 10.367 -4.947 222 HD3 ARG 30 2HD ARG 30 -7.565 10.275 -3.400 223 HE ARG 30 HE ARG 30 -8.508 9.335 -5.965 224 HH11 ARG 30 2HH1 ARG 30 -9.340 10.209 -2.701 225 HH12 ARG 30 1HH1 ARG 30 -10.806 9.286 -2.689 226 HH21 ARG 30 1HH2 ARG 30 -11.427 8.094 -4.544 227 HH22 ARG 30 2HH2 ARG 30 -10.435 8.115 -5.962 228 H LYS 31 H LYS 31 -8.562 14.593 -7.467 229 HA LYS 31 HA LYS 31 -10.482 16.282 -6.049 230 HB2 LYS 31 1HB LYS 31 -9.876 15.800 -8.960 231 HB3 LYS 31 2HB LYS 31 -11.363 16.615 -8.450 232 HG2 LYS 31 1HG LYS 31 -8.850 17.662 -7.296 233 HG3 LYS 31 2HG LYS 31 -9.088 17.907 -9.035 234 HD2 LYS 31 1HD LYS 31 -10.490 19.590 -8.632 235 HD3 LYS 31 2HD LYS 31 -11.537 18.500 -7.706 236 HE2 LYS 31 1HE LYS 31 -10.563 19.060 -5.671 237 HE3 LYS 31 2HE LYS 31 -9.071 19.620 -6.440 238 HZ1 LYS 31 3HZ LYS 31 -10.556 21.436 -7.436 239 HZ2 LYS 31 1HZ LYS 31 -10.122 21.566 -5.805 240 HZ3 LYS 31 2HZ LYS 31 -11.663 21.011 -6.229 241 H GLU 32 H GLU 32 -10.469 13.454 -5.548 242 HA GLU 32 HA GLU 32 -13.044 12.671 -6.748 243 HB2 GLU 32 1HB GLU 32 -10.684 11.048 -5.821 244 HB3 GLU 32 2HB GLU 32 -12.293 10.324 -5.964 245 HG2 GLU 32 1HG GLU 32 -12.337 10.499 -8.260 246 HG3 GLU 32 2HG GLU 32 -11.154 11.814 -8.279 247 H THR 33 H THR 33 -14.102 10.908 -5.191 248 HA THR 33 HA THR 33 -13.885 11.670 -2.392 249 HB THR 33 HB THR 33 -16.323 12.077 -2.181 250 HG1 THR 33 1HG THR 33 -17.202 12.729 -4.433 251 HG21 THR 33 3HG2 THR 33 -14.943 14.015 -2.252 252 HG22 THR 33 1HG2 THR 33 -16.311 14.331 -3.319 253 HG23 THR 33 2HG2 THR 33 -14.745 13.890 -4.000 254 H ASN 34 H ASN 34 -13.618 9.272 -4.252 255 HA ASN 34 HA ASN 34 -15.371 7.468 -2.717 256 HB2 ASN 34 1HB ASN 34 -15.253 5.932 -4.718 257 HB3 ASN 34 2HB ASN 34 -16.163 7.426 -4.970 258 HD21 ASN 34 2HD2 ASN 34 -13.054 6.548 -7.306 259 HD22 ASN 34 1HD2 ASN 34 -13.729 5.461 -6.145 260 H ASN 35 H ASN 35 -14.418 5.081 -3.077 261 HA ASN 35 HA ASN 35 -11.821 5.159 -1.821 262 HB2 ASN 35 1HB ASN 35 -13.771 2.949 -2.477 263 HB3 ASN 35 2HB ASN 35 -12.157 2.609 -1.838 264 HD21 ASN 35 2HD2 ASN 35 -14.462 2.718 1.013 265 HD22 ASN 35 1HD2 ASN 35 -14.266 1.770 -0.417 266 H ALA 36 H ALA 36 -9.897 4.549 -2.672 267 HA ALA 36 HA ALA 36 -9.785 3.259 -5.275 268 HB1 ALA 36 3HB ALA 36 -9.099 4.995 -6.496 269 HB2 ALA 36 1HB ALA 36 -9.698 6.009 -5.183 270 HB3 ALA 36 2HB ALA 36 -7.996 5.551 -5.238 271 H ALA 37 H ALA 37 -7.647 2.494 -5.824 272 HA ALA 37 HA ALA 37 -5.752 2.452 -3.577 273 HB1 ALA 37 3HB ALA 37 -5.499 0.135 -3.612 274 HB2 ALA 37 1HB ALA 37 -7.242 0.369 -3.752 275 HB3 ALA 37 2HB ALA 37 -6.287 -0.022 -5.182 276 H ILE 38 H ILE 38 -3.561 1.987 -4.169 277 HA ILE 38 HA ILE 38 -2.962 2.187 -7.035 278 HB ILE 38 HB ILE 38 -1.485 3.808 -4.966 279 HG12 ILE 38 1HG1 ILE 38 -3.710 4.625 -6.849 280 HG13 ILE 38 2HG1 ILE 38 -3.741 4.675 -5.078 281 HG21 ILE 38 1HG2 ILE 38 -0.946 5.035 -7.240 282 HG22 ILE 38 2HG2 ILE 38 -0.025 3.629 -6.711 283 HG23 ILE 38 3HG2 ILE 38 -1.304 3.443 -7.910 284 HD11 ILE 38 3HD1 ILE 38 -1.670 6.265 -5.420 285 HD12 ILE 38 1HD1 ILE 38 -2.428 6.518 -6.991 286 HD13 ILE 38 2HD1 ILE 38 -3.326 6.865 -5.512 287 H ILE 39 H ILE 39 -1.986 0.296 -7.412 288 HA ILE 39 HA ILE 39 -0.196 -0.866 -5.434 289 HB ILE 39 HB ILE 39 -1.013 -1.930 -8.141 290 HG12 ILE 39 1HG1 ILE 39 -1.966 -3.159 -5.610 291 HG13 ILE 39 2HG1 ILE 39 -2.685 -1.603 -6.056 292 HG21 ILE 39 1HG2 ILE 39 -0.188 -4.088 -7.237 293 HG22 ILE 39 2HG2 ILE 39 1.081 -2.881 -7.443 294 HG23 ILE 39 3HG2 ILE 39 0.438 -3.219 -5.836 295 HD11 ILE 39 3HD1 ILE 39 -3.097 -2.685 -8.352 296 HD12 ILE 39 1HD1 ILE 39 -2.827 -4.210 -7.507 297 HD13 ILE 39 2HD1 ILE 39 -4.133 -3.139 -6.998 298 H MET 40 H MET 40 1.901 -0.434 -5.423 299 HA MET 40 HA MET 40 3.184 0.386 -7.945 300 HB2 MET 40 1HB MET 40 4.258 0.992 -5.195 301 HB3 MET 40 2HB MET 40 4.654 1.776 -6.732 302 HG2 MET 40 1HG MET 40 2.867 3.160 -6.667 303 HG3 MET 40 2HG MET 40 1.839 1.954 -5.889 304 HE1 MET 40 3HE MET 40 0.768 3.309 -3.649 305 HE2 MET 40 1HE MET 40 1.375 1.654 -3.681 306 HE3 MET 40 2HE MET 40 1.789 2.718 -2.337 307 H LYS 41 H LYS 41 5.179 -0.482 -8.497 308 HA LYS 41 HA LYS 41 6.057 -2.786 -6.883 309 HB2 LYS 41 1HB LYS 41 6.523 -4.041 -8.849 310 HB3 LYS 41 2HB LYS 41 4.885 -3.392 -9.033 311 HG2 LYS 41 1HG LYS 41 5.447 -2.043 -10.765 312 HG3 LYS 41 2HG LYS 41 7.084 -1.764 -10.148 313 HD2 LYS 41 1HD LYS 41 7.956 -3.555 -11.229 314 HD3 LYS 41 2HD LYS 41 6.491 -4.525 -11.003 315 HE2 LYS 41 1HE LYS 41 5.404 -3.544 -12.847 316 HE3 LYS 41 2HE LYS 41 6.551 -2.198 -12.900 317 HZ1 LYS 41 3HZ LYS 41 8.285 -3.785 -13.561 318 HZ2 LYS 41 1HZ LYS 41 7.010 -3.733 -14.672 319 HZ3 LYS 41 2HZ LYS 41 7.136 -5.027 -13.590 320 H VAL 42 H VAL 42 8.360 -3.486 -7.732 321 HA VAL 42 HA VAL 42 10.001 -1.058 -8.036 322 HB VAL 42 HB VAL 42 10.556 -1.512 -5.872 323 HG11 VAL 42 1HG1 VAL 42 8.972 -3.467 -5.798 324 HG12 VAL 42 2HG1 VAL 42 10.327 -4.484 -6.293 325 HG13 VAL 42 3HG1 VAL 42 10.395 -3.605 -4.765 326 HG21 VAL 42 3HG2 VAL 42 12.335 -3.630 -7.028 327 HG22 VAL 42 1HG2 VAL 42 12.527 -1.936 -7.476 328 HG23 VAL 42 2HG2 VAL 42 12.698 -2.427 -5.792 329 H ASP 43 H ASP 43 10.776 -1.176 -10.048 330 HA ASP 43 HA ASP 43 11.192 -3.541 -11.509 331 HB2 ASP 43 1HB ASP 43 12.204 -0.717 -11.846 332 HB3 ASP 43 2HB ASP 43 12.634 -2.006 -12.978 333 H LYS 44 H LYS 44 12.711 -5.035 -11.324 334 HA LYS 44 HA LYS 44 14.954 -4.683 -9.582 335 HB2 LYS 44 1HB LYS 44 13.657 -6.836 -9.969 336 HB3 LYS 44 2HB LYS 44 14.519 -6.961 -11.511 337 HG2 LYS 44 1HG LYS 44 16.417 -6.478 -9.423 338 HG3 LYS 44 2HG LYS 44 15.364 -7.832 -8.971 339 HD2 LYS 44 1HD LYS 44 15.827 -8.535 -11.505 340 HD3 LYS 44 2HD LYS 44 17.303 -7.599 -11.207 341 HE2 LYS 44 1HE LYS 44 17.540 -8.994 -9.058 342 HE3 LYS 44 2HE LYS 44 16.328 -10.059 -9.785 343 HZ1 LYS 44 3HZ LYS 44 19.088 -9.946 -10.302 344 HZ2 LYS 44 1HZ LYS 44 18.260 -9.564 -11.728 345 HZ3 LYS 44 2HZ LYS 44 17.942 -11.020 -10.929 346 H ASP 45 H ASP 45 14.450 -3.570 -12.599 347 HA ASP 45 HA ASP 45 17.203 -4.024 -13.514 348 HB2 ASP 45 1HB ASP 45 14.729 -3.991 -14.863 349 HB3 ASP 45 2HB ASP 45 15.580 -2.527 -15.372 350 H ARG 46 H ARG 46 14.993 -1.571 -12.418 351 HA ARG 46 HA ARG 46 17.085 0.466 -12.809 352 HB2 ARG 46 1HB ARG 46 14.115 0.922 -12.453 353 HB3 ARG 46 2HB ARG 46 15.338 2.143 -12.833 354 HG2 ARG 46 1HG ARG 46 15.741 1.134 -15.001 355 HG3 ARG 46 2HG ARG 46 14.592 -0.160 -14.623 356 HD2 ARG 46 1HD ARG 46 13.040 1.115 -15.613 357 HD3 ARG 46 2HD ARG 46 13.123 2.117 -14.157 358 HE ARG 46 HE ARG 46 15.084 3.176 -15.622 359 HH11 ARG 46 2HH1 ARG 46 11.823 2.291 -16.461 360 HH12 ARG 46 1HH1 ARG 46 11.665 3.514 -17.678 361 HH21 ARG 46 1HH2 ARG 46 13.409 4.933 -18.112 362 HH22 ARG 46 2HH2 ARG 46 14.888 4.789 -17.223 363 H GLN 47 H GLN 47 15.709 -1.472 -10.527 364 HA GLN 47 HA GLN 47 15.484 -1.418 -8.253 365 HB2 GLN 47 1HB GLN 47 17.854 0.452 -8.400 366 HB3 GLN 47 2HB GLN 47 17.426 -0.648 -7.080 367 HG2 GLN 47 1HG GLN 47 17.796 -1.987 -9.657 368 HG3 GLN 47 2HG GLN 47 19.241 -1.168 -9.047 369 HE21 GLN 47 2HE2 GLN 47 17.789 -4.490 -7.212 370 HE22 GLN 47 1HE2 GLN 47 16.883 -3.656 -8.423 371 H MET 48 H MET 48 13.581 0.141 -9.128 372 HA MET 48 HA MET 48 13.487 2.277 -7.164 373 HB2 MET 48 1HB MET 48 13.190 4.061 -8.580 374 HB3 MET 48 2HB MET 48 14.354 3.101 -9.507 375 HG2 MET 48 1HG MET 48 12.108 2.055 -10.499 376 HG3 MET 48 2HG MET 48 11.497 3.646 -10.040 377 HE1 MET 48 3HE MET 48 12.681 6.142 -11.919 378 HE2 MET 48 1HE MET 48 13.003 5.620 -10.264 379 HE3 MET 48 2HE MET 48 14.334 5.796 -11.409 380 H VAL 49 H VAL 49 11.457 2.647 -6.393 381 HA VAL 49 HA VAL 49 9.437 0.722 -7.022 382 HB VAL 49 HB VAL 49 9.493 3.097 -5.170 383 HG11 VAL 49 1HG1 VAL 49 7.247 3.120 -5.626 384 HG12 VAL 49 2HG1 VAL 49 7.195 1.400 -6.015 385 HG13 VAL 49 3HG1 VAL 49 7.295 1.923 -4.333 386 HG21 VAL 49 3HG2 VAL 49 10.401 0.468 -4.941 387 HG22 VAL 49 1HG2 VAL 49 10.208 1.646 -3.643 388 HG23 VAL 49 2HG2 VAL 49 8.902 0.521 -4.014 389 H VAL 50 H VAL 50 8.544 0.940 -9.008 390 HA VAL 50 HA VAL 50 7.437 3.573 -9.730 391 HB VAL 50 HB VAL 50 7.427 2.809 -12.053 392 HG11 VAL 50 1HG1 VAL 50 9.770 2.943 -12.459 393 HG12 VAL 50 2HG1 VAL 50 9.427 3.926 -11.036 394 HG13 VAL 50 3HG1 VAL 50 10.145 2.326 -10.850 395 HG21 VAL 50 3HG2 VAL 50 8.954 0.366 -11.215 396 HG22 VAL 50 1HG2 VAL 50 7.195 0.354 -11.347 397 HG23 VAL 50 2HG2 VAL 50 8.182 0.714 -12.763 398 H LEU 51 H LEU 51 5.306 3.762 -10.336 399 HA LEU 51 HA LEU 51 3.369 2.274 -9.134 400 HB2 LEU 51 1HB LEU 51 3.251 4.485 -10.510 401 HB3 LEU 51 2HB LEU 51 2.841 3.403 -11.852 402 HG LEU 51 HG LEU 51 1.252 3.083 -9.378 403 HD11 LEU 51 1HD1 LEU 51 0.326 5.255 -11.140 404 HD12 LEU 51 2HD1 LEU 51 1.682 5.642 -10.082 405 HD13 LEU 51 3HD1 LEU 51 0.166 5.057 -9.396 406 HD21 LEU 51 3HD2 LEU 51 -0.296 3.395 -11.715 407 HD22 LEU 51 1HD2 LEU 51 0.052 1.912 -10.828 408 HD23 LEU 51 2HD2 LEU 51 1.105 2.415 -12.150 409 H GLU 52 H GLU 52 2.034 0.558 -9.670 410 HA GLU 52 HA GLU 52 2.940 -1.081 -11.946 411 HB2 GLU 52 1HB GLU 52 3.571 -2.153 -9.883 412 HB3 GLU 52 2HB GLU 52 1.936 -1.954 -9.234 413 HG2 GLU 52 1HG GLU 52 2.200 -4.231 -9.890 414 HG3 GLU 52 2HG GLU 52 1.097 -3.446 -11.030 415 H ASP 53 H ASP 53 0.198 -0.006 -10.023 416 HA ASP 53 HA ASP 53 -1.551 -0.119 -12.273 417 HB2 ASP 53 1HB ASP 53 -1.737 -2.239 -10.146 418 HB3 ASP 53 2HB ASP 53 -3.185 -1.698 -11.006 419 H GLU 54 H GLU 54 -3.768 0.596 -11.708 420 HA GLU 54 HA GLU 54 -4.050 1.875 -9.108 421 HB2 GLU 54 1HB GLU 54 -3.522 3.306 -11.633 422 HB3 GLU 54 2HB GLU 54 -4.884 3.929 -10.689 423 HG2 GLU 54 1HG GLU 54 -3.366 4.062 -8.708 424 HG3 GLU 54 2HG GLU 54 -2.030 3.640 -9.788 425 H LEU 55 H LEU 55 -5.954 1.143 -8.443 426 HA LEU 55 HA LEU 55 -8.144 0.922 -10.397 427 HB2 LEU 55 1HB LEU 55 -8.021 -0.416 -7.699 428 HB3 LEU 55 2HB LEU 55 -9.105 -0.775 -9.053 429 HG LEU 55 HG LEU 55 -6.176 -1.155 -9.443 430 HD11 LEU 55 1HD1 LEU 55 -6.580 -3.545 -8.613 431 HD12 LEU 55 2HD1 LEU 55 -7.954 -2.867 -7.741 432 HD13 LEU 55 3HD1 LEU 55 -6.323 -2.283 -7.408 433 HD21 LEU 55 3HD2 LEU 55 -7.486 -3.274 -10.523 434 HD22 LEU 55 1HD2 LEU 55 -7.118 -1.779 -11.383 435 HD23 LEU 55 2HD2 LEU 55 -8.708 -2.009 -10.655 436 H GLN 56 H GLN 56 -9.989 2.040 -10.103 437 HA GLN 56 HA GLN 56 -10.192 3.680 -7.663 438 HB2 GLN 56 1HB GLN 56 -11.071 4.254 -10.498 439 HB3 GLN 56 2HB GLN 56 -11.571 5.230 -9.109 440 HG2 GLN 56 1HG GLN 56 -9.790 6.444 -9.889 441 HG3 GLN 56 2HG GLN 56 -9.021 5.429 -8.661 442 HE21 GLN 56 2HE2 GLN 56 -6.820 3.944 -10.858 443 HE22 GLN 56 1HE2 GLN 56 -7.322 4.263 -9.236 444 H ASN 57 H ASN 57 -12.398 4.225 -6.978 445 HA ASN 57 HA ASN 57 -14.377 3.459 -6.128 446 HB2 ASN 57 1HB ASN 57 -14.868 2.663 -9.009 447 HB3 ASN 57 2HB ASN 57 -16.088 3.049 -7.789 448 HD21 ASN 57 2HD2 ASN 57 -14.157 5.992 -9.802 449 HD22 ASN 57 1HD2 ASN 57 -13.670 4.339 -9.921 450 H ILE 58 H ILE 58 -12.570 1.649 -5.472 451 HA ILE 58 HA ILE 58 -13.898 -0.924 -6.012 452 HB ILE 58 HB ILE 58 -11.994 -1.595 -6.974 453 HG12 ILE 58 1HG1 ILE 58 -11.914 -2.542 -4.603 454 HG13 ILE 58 2HG1 ILE 58 -10.404 -2.573 -5.527 455 HG21 ILE 58 1HG2 ILE 58 -9.781 -0.304 -6.492 456 HG22 ILE 58 2HG2 ILE 58 -11.034 0.433 -7.491 457 HG23 ILE 58 3HG2 ILE 58 -10.862 0.905 -5.799 458 HD11 ILE 58 3HD1 ILE 58 -9.397 -1.521 -3.870 459 HD12 ILE 58 1HD1 ILE 58 -10.437 -0.125 -4.149 460 HD13 ILE 58 2HD1 ILE 58 -10.923 -1.372 -2.999 461 H SER 59 H SER 59 -14.242 -2.254 -4.285 462 HA SER 59 HA SER 59 -13.995 -1.045 -1.667 463 HB2 SER 59 1HB SER 59 -15.657 -3.074 -2.911 464 HB3 SER 59 2HB SER 59 -15.013 -3.638 -1.359 465 HG SER 59 HG SER 59 -15.737 -1.355 -0.689 466 HA PRO 60 HA PRO 60 -10.589 -3.300 -0.066 467 HB2 PRO 60 2HB PRO 60 -11.127 -2.530 2.030 468 HB3 PRO 60 1HB PRO 60 -11.464 -4.229 2.357 469 HG2 PRO 60 1HG PRO 60 -13.747 -3.989 1.996 470 HG3 PRO 60 2HG PRO 60 -13.342 -2.391 2.726 471 HD2 PRO 60 1HD PRO 60 -14.629 -2.631 0.349 472 HD3 PRO 60 2HD PRO 60 -13.496 -1.313 0.695 473 H GLU 61 H GLU 61 -13.253 -4.904 -1.157 474 HA GLU 61 HA GLU 61 -12.260 -7.562 -0.406 475 HB2 GLU 61 1HB GLU 61 -14.893 -6.436 -1.008 476 HB3 GLU 61 2HB GLU 61 -14.577 -7.958 -1.855 477 HG2 GLU 61 1HG GLU 61 -13.822 -8.818 0.477 478 HG3 GLU 61 2HG GLU 61 -14.746 -7.435 1.079 479 H GLU 62 H GLU 62 -12.539 -5.369 -3.051 480 HA GLU 62 HA GLU 62 -12.076 -7.404 -5.066 481 HB2 GLU 62 1HB GLU 62 -12.775 -4.537 -5.031 482 HB3 GLU 62 2HB GLU 62 -11.734 -5.043 -6.371 483 HG2 GLU 62 1HG GLU 62 -14.198 -5.075 -6.845 484 HG3 GLU 62 2HG GLU 62 -13.332 -6.583 -7.169 485 H LEU 63 H LEU 63 -10.325 -4.697 -3.595 486 HA LEU 63 HA LEU 63 -8.013 -4.724 -5.095 487 HB2 LEU 63 1HB LEU 63 -8.882 -3.464 -2.803 488 HB3 LEU 63 2HB LEU 63 -7.503 -4.422 -2.239 489 HG LEU 63 HG LEU 63 -7.548 -2.153 -4.194 490 HD11 LEU 63 1HD1 LEU 63 -7.058 -1.337 -2.101 491 HD12 LEU 63 2HD1 LEU 63 -5.445 -1.679 -2.724 492 HD13 LEU 63 3HD1 LEU 63 -6.214 -2.804 -1.605 493 HD21 LEU 63 3HD2 LEU 63 -5.949 -4.549 -4.397 494 HD22 LEU 63 1HD2 LEU 63 -4.942 -3.126 -4.131 495 HD23 LEU 63 2HD2 LEU 63 -6.060 -3.173 -5.495 496 H LYS 64 H LYS 64 -8.717 -6.639 -2.180 497 HA LYS 64 HA LYS 64 -6.315 -7.989 -1.945 498 HB2 LYS 64 1HB LYS 64 -7.468 -8.733 -0.187 499 HB3 LYS 64 2HB LYS 64 -9.005 -8.288 -0.945 500 HG2 LYS 64 1HG LYS 64 -9.271 -10.386 -1.947 501 HG3 LYS 64 2HG LYS 64 -7.569 -10.808 -1.695 502 HD2 LYS 64 1HD LYS 64 -8.264 -11.922 0.120 503 HD3 LYS 64 2HD LYS 64 -8.459 -10.325 0.864 504 HE2 LYS 64 1HE LYS 64 -10.617 -10.839 1.142 505 HE3 LYS 64 2HE LYS 64 -10.778 -10.647 -0.610 506 HZ1 LYS 64 3HZ LYS 64 -10.253 -13.173 0.857 507 HZ2 LYS 64 1HZ LYS 64 -10.211 -13.032 -0.828 508 HZ3 LYS 64 2HZ LYS 64 -11.656 -12.760 0.007 509 H LEU 65 H LEU 65 -8.977 -8.552 -4.150 510 HA LEU 65 HA LEU 65 -8.041 -11.094 -5.068 511 HB2 LEU 65 1HB LEU 65 -9.955 -9.149 -6.370 512 HB3 LEU 65 2HB LEU 65 -9.717 -10.846 -6.823 513 HG LEU 65 HG LEU 65 -10.783 -9.940 -4.152 514 HD11 LEU 65 1HD1 LEU 65 -12.337 -9.317 -5.903 515 HD12 LEU 65 2HD1 LEU 65 -12.965 -10.690 -4.992 516 HD13 LEU 65 3HD1 LEU 65 -12.254 -10.941 -6.585 517 HD21 LEU 65 3HD2 LEU 65 -11.052 -12.143 -3.609 518 HD22 LEU 65 1HD2 LEU 65 -9.597 -12.255 -4.599 519 HD23 LEU 65 2HD2 LEU 65 -11.167 -12.659 -5.292 520 H GLU 66 H GLU 66 -7.743 -7.758 -6.181 521 HA GLU 66 HA GLU 66 -6.488 -8.342 -8.646 522 HB2 GLU 66 1HB GLU 66 -6.272 -5.848 -6.943 523 HB3 GLU 66 2HB GLU 66 -5.835 -5.979 -8.653 524 HG2 GLU 66 1HG GLU 66 -8.613 -6.414 -7.561 525 HG3 GLU 66 2HG GLU 66 -8.025 -4.903 -8.267 526 H LEU 67 H LEU 67 -5.343 -8.232 -5.390 527 HA LEU 67 HA LEU 67 -2.565 -7.922 -6.064 528 HB2 LEU 67 1HB LEU 67 -3.991 -8.707 -3.522 529 HB3 LEU 67 2HB LEU 67 -2.229 -8.575 -3.655 530 HG LEU 67 HG LEU 67 -4.115 -6.283 -4.177 531 HD11 LEU 67 1HD1 LEU 67 -2.938 -7.325 -1.658 532 HD12 LEU 67 2HD1 LEU 67 -4.487 -6.533 -1.943 533 HD13 LEU 67 3HD1 LEU 67 -3.006 -5.577 -1.887 534 HD21 LEU 67 3HD2 LEU 67 -1.524 -6.569 -4.930 535 HD22 LEU 67 1HD2 LEU 67 -1.339 -5.825 -3.341 536 HD23 LEU 67 2HD2 LEU 67 -2.301 -5.024 -4.584 537 HA PRO 68 HA PRO 68 -1.570 -12.108 -6.968 538 HB2 PRO 68 2HB PRO 68 0.469 -11.321 -7.679 539 HB3 PRO 68 1HB PRO 68 1.069 -12.134 -6.236 540 HG2 PRO 68 1HG PRO 68 1.078 -10.184 -4.972 541 HG3 PRO 68 2HG PRO 68 1.511 -9.545 -6.602 542 HD2 PRO 68 1HD PRO 68 -0.556 -8.560 -5.144 543 HD3 PRO 68 2HD PRO 68 -0.587 -8.643 -6.913 544 H GLU 69 H GLU 69 0.026 -13.866 -5.790 545 HA GLU 69 HA GLU 69 -0.862 -14.018 -2.986 546 HB2 GLU 69 1HB GLU 69 -0.899 -16.562 -3.417 547 HB3 GLU 69 2HB GLU 69 -2.248 -15.584 -4.018 548 HG2 GLU 69 1HG GLU 69 -0.026 -15.923 -5.915 549 HG3 GLU 69 2HG GLU 69 -0.892 -17.407 -5.489 550 H ARG 70 H ARG 70 1.694 -14.130 -5.189 551 HA ARG 70 HA ARG 70 3.530 -14.924 -3.058 552 HB2 ARG 70 1HB ARG 70 3.401 -16.184 -5.801 553 HB3 ARG 70 2HB ARG 70 4.829 -16.286 -4.761 554 HG2 ARG 70 1HG ARG 70 3.950 -17.915 -3.522 555 HG3 ARG 70 2HG ARG 70 2.406 -17.062 -3.369 556 HD2 ARG 70 1HD ARG 70 1.474 -18.492 -4.798 557 HD3 ARG 70 2HD ARG 70 2.602 -17.944 -6.046 558 HE ARG 70 HE ARG 70 4.028 -19.746 -4.559 559 HH11 ARG 70 2HH1 ARG 70 1.037 -19.805 -6.338 560 HH12 ARG 70 1HH1 ARG 70 1.158 -21.486 -6.740 561 HH21 ARG 70 1HH2 ARG 70 2.957 -22.711 -6.026 562 HH22 ARG 70 2HH2 ARG 70 4.201 -21.959 -5.084 563 H GLN 71 H GLN 71 2.712 -12.469 -4.659 564 HA GLN 71 HA GLN 71 5.438 -11.687 -5.450 565 HB2 GLN 71 1HB GLN 71 2.826 -11.240 -6.849 566 HB3 GLN 71 2HB GLN 71 4.119 -10.043 -7.016 567 HG2 GLN 71 1HG GLN 71 5.505 -12.300 -7.532 568 HG3 GLN 71 2HG GLN 71 3.902 -12.757 -8.126 569 HE21 GLN 71 2HE2 GLN 71 3.865 -10.046 -10.550 570 HE22 GLN 71 1HE2 GLN 71 2.868 -10.666 -9.283 571 HA PRO 72 HA PRO 72 4.485 -8.789 -2.136 572 HB2 PRO 72 2HB PRO 72 6.453 -9.447 -1.149 573 HB3 PRO 72 1HB PRO 72 7.070 -7.941 -1.827 574 HG2 PRO 72 1HG PRO 72 7.986 -8.991 -3.687 575 HG3 PRO 72 2HG PRO 72 8.221 -10.256 -2.425 576 HD2 PRO 72 1HD PRO 72 6.959 -10.750 -4.776 577 HD3 PRO 72 2HD PRO 72 6.507 -11.549 -3.261 578 H ARG 73 H ARG 73 3.924 -6.695 -2.277 579 HA ARG 73 HA ARG 73 5.339 -4.803 -3.885 580 HB2 ARG 73 1HB ARG 73 3.426 -4.238 -5.372 581 HB3 ARG 73 2HB ARG 73 4.120 -5.834 -5.690 582 HG2 ARG 73 1HG ARG 73 2.172 -6.483 -3.917 583 HG3 ARG 73 2HG ARG 73 1.442 -5.100 -4.748 584 HD2 ARG 73 1HD ARG 73 2.669 -6.748 -6.720 585 HD3 ARG 73 2HD ARG 73 1.704 -7.782 -5.656 586 HE ARG 73 HE ARG 73 0.002 -5.770 -6.188 587 HH11 ARG 73 2HH1 ARG 73 1.995 -7.761 -8.234 588 HH12 ARG 73 1HH1 ARG 73 0.915 -7.679 -9.586 589 HH21 ARG 73 1HH2 ARG 73 -1.030 -6.480 -9.431 590 HH22 ARG 73 2HH2 ARG 73 -1.427 -5.654 -7.962 591 H PHE 74 H PHE 74 4.200 -2.641 -3.869 592 HA PHE 74 HA PHE 74 2.995 -2.267 -1.228 593 HB2 PHE 74 1HB PHE 74 4.143 -0.231 -3.159 594 HB3 PHE 74 2HB PHE 74 3.564 0.111 -1.526 595 HD1 PHE 74 2HD PHE 74 4.648 -1.763 0.226 596 HD2 PHE 74 1HD PHE 74 6.435 -0.160 -3.290 597 HE1 PHE 74 2HE PHE 74 6.879 -2.244 1.144 598 HE2 PHE 74 1HE PHE 74 8.669 -0.640 -2.377 599 HZ PHE 74 HZ PHE 74 8.894 -1.681 -0.158 600 H VAL 75 H VAL 75 1.131 -0.974 -0.931 601 HA VAL 75 HA VAL 75 -0.415 -0.177 -3.250 602 HB VAL 75 HB VAL 75 -1.564 -2.199 -1.323 603 HG11 VAL 75 1HG1 VAL 75 -3.115 -0.496 -2.336 604 HG12 VAL 75 2HG1 VAL 75 -2.725 -1.190 -3.910 605 HG13 VAL 75 3HG1 VAL 75 -3.511 -2.179 -2.679 606 HG21 VAL 75 3HG2 VAL 75 -1.538 -3.753 -3.231 607 HG22 VAL 75 1HG2 VAL 75 -0.664 -2.550 -4.181 608 HG23 VAL 75 2HG2 VAL 75 0.087 -3.262 -2.752 609 H VAL 76 H VAL 76 -1.615 1.576 -2.821 610 HA VAL 76 HA VAL 76 -1.945 2.343 0.006 611 HB VAL 76 HB VAL 76 -1.634 4.077 -2.444 612 HG11 VAL 76 1HG1 VAL 76 -2.310 4.870 0.386 613 HG12 VAL 76 2HG1 VAL 76 -1.827 5.992 -0.888 614 HG13 VAL 76 3HG1 VAL 76 -3.325 5.074 -1.042 615 HG21 VAL 76 3HG2 VAL 76 0.505 4.285 -1.857 616 HG22 VAL 76 1HG2 VAL 76 0.075 4.644 -0.184 617 HG23 VAL 76 2HG2 VAL 76 0.243 2.969 -0.711 618 H TYR 77 H TYR 77 -3.956 1.515 0.423 619 HA TYR 77 HA TYR 77 -6.154 2.024 -1.402 620 HB2 TYR 77 1HB TYR 77 -5.877 -0.148 -0.167 621 HB3 TYR 77 2HB TYR 77 -6.240 0.722 1.326 622 HD1 TYR 77 1HD TYR 77 -7.845 1.146 -2.002 623 HD2 TYR 77 2HD TYR 77 -8.285 -0.184 2.015 624 HE1 TYR 77 1HE TYR 77 -10.255 0.827 -2.378 625 HE2 TYR 77 2HE TYR 77 -10.695 -0.508 1.651 626 HH TYR 77 HH TYR 77 -12.263 0.534 -1.305 627 H SER 78 H SER 78 -7.802 3.440 -1.093 628 HA SER 78 HA SER 78 -7.578 5.234 1.234 629 HB2 SER 78 1HB SER 78 -7.036 6.491 -0.726 630 HB3 SER 78 2HB SER 78 -8.414 5.814 -1.611 631 HG SER 78 HG SER 78 -8.410 7.723 0.462 632 H TYR 79 H TYR 79 -9.040 4.323 2.606 633 HA TYR 79 HA TYR 79 -11.672 3.558 1.654 634 HB2 TYR 79 1HB TYR 79 -10.720 2.093 3.275 635 HB3 TYR 79 2HB TYR 79 -10.333 3.433 4.355 636 HD1 TYR 79 2HD TYR 79 -13.095 1.381 3.028 637 HD2 TYR 79 1HD TYR 79 -11.950 4.340 5.864 638 HE1 TYR 79 2HE TYR 79 -15.239 1.084 4.195 639 HE2 TYR 79 1HE TYR 79 -14.091 4.049 7.040 640 HH TYR 79 HH TYR 79 -16.524 3.176 6.244 641 H LYS 80 H LYS 80 -13.616 4.319 2.847 642 HA LYS 80 HA LYS 80 -13.377 7.185 3.495 643 HB2 LYS 80 1HB LYS 80 -14.575 6.812 1.399 644 HB3 LYS 80 2HB LYS 80 -15.694 5.714 2.224 645 HG2 LYS 80 1HG LYS 80 -16.556 7.529 3.575 646 HG3 LYS 80 2HG LYS 80 -15.380 8.643 2.854 647 HD2 LYS 80 1HD LYS 80 -17.203 9.124 1.556 648 HD3 LYS 80 2HD LYS 80 -16.487 7.813 0.604 649 HE2 LYS 80 1HE LYS 80 -18.205 6.412 0.996 650 HE3 LYS 80 2HE LYS 80 -18.310 6.889 2.698 651 HZ1 LYS 80 3HZ LYS 80 -19.221 9.088 1.462 652 HZ2 LYS 80 1HZ LYS 80 -20.210 7.847 2.049 653 HZ3 LYS 80 2HZ LYS 80 -19.777 7.881 0.415 654 H TYR 81 H TYR 81 -13.534 7.445 5.624 655 HA TYR 81 HA TYR 81 -15.396 5.738 7.128 656 HB2 TYR 81 1HB TYR 81 -12.773 6.208 7.632 657 HB3 TYR 81 2HB TYR 81 -13.514 7.486 8.598 658 HD1 TYR 81 1HD TYR 81 -15.798 6.482 9.847 659 HD2 TYR 81 2HD TYR 81 -12.233 4.356 8.908 660 HE1 TYR 81 1HE TYR 81 -16.287 4.879 11.646 661 HE2 TYR 81 2HE TYR 81 -12.714 2.746 10.705 662 HH TYR 81 HH TYR 81 -15.412 3.213 12.917 663 H VAL 82 H VAL 82 -17.158 6.578 8.047 664 HA VAL 82 HA VAL 82 -17.651 9.436 7.732 665 HB VAL 82 HB VAL 82 -19.569 7.312 8.697 666 HG11 VAL 82 1HG1 VAL 82 -19.926 10.145 7.744 667 HG12 VAL 82 2HG1 VAL 82 -21.257 8.996 7.892 668 HG13 VAL 82 3HG1 VAL 82 -20.337 9.471 9.321 669 HG21 VAL 82 3HG2 VAL 82 -18.573 6.983 6.365 670 HG22 VAL 82 1HG2 VAL 82 -20.331 7.012 6.500 671 HG23 VAL 82 2HG2 VAL 82 -19.468 8.433 5.911 672 H HIS 83 H HIS 83 -18.766 10.598 9.512 673 HA HIS 83 HA HIS 83 -17.497 9.931 12.073 674 HB2 HIS 83 1HB HIS 83 -18.572 12.519 10.942 675 HB3 HIS 83 2HB HIS 83 -18.102 12.341 12.636 676 HD1 HIS 83 1HD HIS 83 -15.764 12.950 13.143 677 HD2 HIS 83 2HD HIS 83 -16.236 11.820 9.173 678 HE1 HIS 83 1HE HIS 83 -13.514 13.293 12.075 679 HE2 HIS 83 2HE HIS 83 -13.802 12.603 9.648 680 H ASP 84 H ASP 84 -20.205 12.097 11.855 681 HA ASP 84 HA ASP 84 -22.291 10.316 12.440 682 HB2 ASP 84 1HB ASP 84 -20.693 10.263 14.552 683 HB3 ASP 84 2HB ASP 84 -21.545 11.763 14.946 684 H ASP 85 H ASP 85 -21.076 13.510 13.450 685 HA ASP 85 HA ASP 85 -23.557 14.800 13.541 686 HB2 ASP 85 1HB ASP 85 -22.386 16.745 13.886 687 HB3 ASP 85 2HB ASP 85 -21.133 15.559 14.275 688 H GLY 86 H GLY 86 -21.719 13.724 10.872 689 HA2 GLY 86 1HA GLY 86 -23.176 13.697 8.800 690 HA3 GLY 86 2HA GLY 86 -23.291 15.433 9.048 691 H ARG 87 H ARG 87 -20.274 14.038 9.844 692 HA ARG 87 HA ARG 87 -19.143 15.084 7.335 693 HB2 ARG 87 1HB ARG 87 -17.986 14.929 10.122 694 HB3 ARG 87 2HB ARG 87 -17.015 15.304 8.690 695 HG2 ARG 87 1HG ARG 87 -19.441 16.909 9.473 696 HG3 ARG 87 2HG ARG 87 -17.806 17.275 10.049 697 HD2 ARG 87 1HD ARG 87 -17.013 17.640 7.809 698 HD3 ARG 87 2HD ARG 87 -18.542 17.057 7.135 699 HE ARG 87 HE ARG 87 -19.002 19.268 8.841 700 HH11 ARG 87 2HH1 ARG 87 -17.751 18.440 5.700 701 HH12 ARG 87 1HH1 ARG 87 -18.137 19.976 4.996 702 HH21 ARG 87 1HH2 ARG 87 -19.140 21.599 6.265 703 HH22 ARG 87 2HH2 ARG 87 -19.515 21.294 7.927 704 H VAL 88 H VAL 88 -17.671 13.874 6.194 705 HA VAL 88 HA VAL 88 -16.929 11.240 7.238 706 HB VAL 88 HB VAL 88 -18.845 10.657 5.976 707 HG11 VAL 88 1HG1 VAL 88 -17.959 11.908 3.445 708 HG12 VAL 88 2HG1 VAL 88 -19.586 11.653 4.078 709 HG13 VAL 88 3HG1 VAL 88 -18.600 12.982 4.688 710 HG21 VAL 88 3HG2 VAL 88 -16.671 10.238 3.954 711 HG22 VAL 88 1HG2 VAL 88 -16.618 9.442 5.527 712 HG23 VAL 88 2HG2 VAL 88 -17.970 9.145 4.434 713 H SER 89 H SER 89 -14.831 10.897 6.957 714 HA SER 89 HA SER 89 -13.452 12.338 4.786 715 HB2 SER 89 1HB SER 89 -12.409 11.554 7.526 716 HB3 SER 89 2HB SER 89 -11.429 12.279 6.238 717 HG SER 89 HG SER 89 -12.161 13.887 7.645 718 H TYR 90 H TYR 90 -11.410 11.262 4.066 719 HA TYR 90 HA TYR 90 -11.804 8.345 3.970 720 HB2 TYR 90 1HB TYR 90 -10.150 9.748 1.917 721 HB3 TYR 90 2HB TYR 90 -11.170 8.316 1.755 722 HD1 TYR 90 1HD TYR 90 -13.696 8.610 1.746 723 HD2 TYR 90 2HD TYR 90 -10.993 11.866 1.299 724 HE1 TYR 90 1HE TYR 90 -15.503 9.969 0.777 725 HE2 TYR 90 2HE TYR 90 -12.793 13.234 0.329 726 HH TYR 90 HH TYR 90 -15.635 13.016 0.630 727 HA PRO 91 HA PRO 91 -7.903 8.699 6.288 728 HB2 PRO 91 2HB PRO 91 -8.947 7.694 8.070 729 HB3 PRO 91 1HB PRO 91 -8.144 6.242 7.475 730 HG2 PRO 91 1HG PRO 91 -10.024 5.505 6.325 731 HG3 PRO 91 2HG PRO 91 -10.781 6.299 7.756 732 HD2 PRO 91 1HD PRO 91 -11.457 6.928 5.204 733 HD3 PRO 91 2HD PRO 91 -11.451 8.121 6.514 734 H LEU 92 H LEU 92 -6.509 8.573 4.527 735 HA LEU 92 HA LEU 92 -6.215 6.220 2.945 736 HB2 LEU 92 1HB LEU 92 -5.113 8.899 3.040 737 HB3 LEU 92 2HB LEU 92 -3.857 7.689 2.725 738 HG LEU 92 HG LEU 92 -6.016 7.076 1.013 739 HD11 LEU 92 1HD1 LEU 92 -5.944 9.294 -0.288 740 HD12 LEU 92 2HD1 LEU 92 -5.451 10.009 1.246 741 HD13 LEU 92 3HD1 LEU 92 -7.002 9.179 1.118 742 HD21 LEU 92 3HD2 LEU 92 -3.660 8.554 -0.006 743 HD22 LEU 92 1HD2 LEU 92 -4.381 7.042 -0.559 744 HD23 LEU 92 2HD2 LEU 92 -3.354 7.056 0.874 745 H CYS 93 H CYS 93 -4.832 4.539 3.139 746 HA CYS 93 HA CYS 93 -2.846 4.613 5.302 747 HB2 CYS 93 1HB CYS 93 -4.834 2.405 4.756 748 HB3 CYS 93 2HB CYS 93 -3.452 2.246 5.853 749 HG CYS 93 HG CYS 93 -6.113 4.356 6.281 750 H PHE 94 H PHE 94 -1.342 2.653 5.129 751 HA PHE 94 HA PHE 94 -0.703 2.231 2.285 752 HB2 PHE 94 1HB PHE 94 0.942 3.589 3.586 753 HB3 PHE 94 2HB PHE 94 1.209 2.190 4.628 754 HD1 PHE 94 1HD PHE 94 1.447 3.300 1.097 755 HD2 PHE 94 2HD PHE 94 2.757 0.545 4.065 756 HE1 PHE 94 1HE PHE 94 3.159 2.449 -0.452 757 HE2 PHE 94 2HE PHE 94 4.471 -0.309 2.522 758 HZ PHE 94 HZ PHE 94 4.676 0.643 0.260 759 H ILE 95 H ILE 95 -1.506 0.282 1.769 760 HA ILE 95 HA ILE 95 -1.257 -1.938 3.647 761 HB ILE 95 HB ILE 95 -2.666 -1.762 0.982 762 HG12 ILE 95 1HG1 ILE 95 -3.774 -1.968 3.793 763 HG13 ILE 95 2HG1 ILE 95 -3.676 -0.467 2.858 764 HG21 ILE 95 1HG2 ILE 95 -2.409 -3.993 0.994 765 HG22 ILE 95 2HG2 ILE 95 -1.993 -4.037 2.707 766 HG23 ILE 95 3HG2 ILE 95 -3.684 -3.957 2.212 767 HD11 ILE 95 3HD1 ILE 95 -5.854 -1.091 2.503 768 HD12 ILE 95 1HD1 ILE 95 -5.054 -1.782 1.091 769 HD13 ILE 95 2HD1 ILE 95 -5.469 -2.811 2.463 770 H PHE 96 H PHE 96 0.404 -3.284 3.555 771 HA PHE 96 HA PHE 96 1.987 -3.417 1.086 772 HB2 PHE 96 1HB PHE 96 3.192 -2.753 3.130 773 HB3 PHE 96 2HB PHE 96 2.713 -4.268 3.898 774 HD1 PHE 96 1HD PHE 96 3.306 -4.870 0.496 775 HD2 PHE 96 2HD PHE 96 5.318 -4.251 4.194 776 HE1 PHE 96 1HE PHE 96 5.302 -5.988 -0.408 777 HE2 PHE 96 2HE PHE 96 7.318 -5.366 3.297 778 HZ PHE 96 HZ PHE 96 7.313 -6.236 0.993 779 H SER 97 H SER 97 1.329 -5.018 -0.198 780 HA SER 97 HA SER 97 0.132 -7.420 0.833 781 HB2 SER 97 1HB SER 97 -0.427 -6.226 -1.383 782 HB3 SER 97 2HB SER 97 1.032 -7.010 -2.013 783 HG SER 97 HG SER 97 -0.136 -8.724 -2.268 784 H SER 98 H SER 98 1.675 -8.473 2.059 785 HA SER 98 HA SER 98 3.947 -9.578 0.540 786 HB2 SER 98 1HB SER 98 4.473 -7.865 2.405 787 HB3 SER 98 2HB SER 98 4.017 -9.164 3.522 788 HG SER 98 HG SER 98 6.186 -9.372 3.207 789 HA PRO 99 HA PRO 99 1.438 -13.191 1.720 790 HB2 PRO 99 2HB PRO 99 1.041 -13.569 -0.511 791 HB3 PRO 99 1HB PRO 99 2.338 -14.751 -0.343 792 HG2 PRO 99 1HG PRO 99 3.955 -13.301 -1.170 793 HG3 PRO 99 2HG PRO 99 2.518 -12.805 -2.138 794 HD2 PRO 99 1HD PRO 99 3.989 -11.042 -0.692 795 HD3 PRO 99 2HD PRO 99 2.240 -10.871 -0.916 796 H VAL 100 H VAL 100 2.423 -15.679 1.400 797 HA VAL 100 HA VAL 100 4.914 -15.640 2.976 798 HB VAL 100 HB VAL 100 2.767 -16.529 4.058 799 HG11 VAL 100 1HG1 VAL 100 1.954 -17.815 2.158 800 HG12 VAL 100 2HG1 VAL 100 3.383 -18.850 2.230 801 HG13 VAL 100 3HG1 VAL 100 2.215 -18.862 3.553 802 HG21 VAL 100 3HG2 VAL 100 4.993 -16.894 4.986 803 HG22 VAL 100 1HG2 VAL 100 3.980 -18.321 5.204 804 HG23 VAL 100 2HG2 VAL 100 5.210 -18.299 3.940 805 H GLY 101 H GLY 101 3.501 -16.596 0.046 806 HA2 GLY 101 1HA GLY 101 5.354 -18.799 -0.413 807 HA3 GLY 101 2HA GLY 101 4.088 -18.257 -1.505 808 H CYS 102 H CYS 102 5.557 -15.505 -0.604 809 HA CYS 102 HA CYS 102 6.882 -15.187 -3.103 810 HB2 CYS 102 1HB CYS 102 7.673 -13.011 -2.046 811 HB3 CYS 102 2HB CYS 102 5.922 -13.227 -2.202 812 HG CYS 102 HG CYS 102 5.405 -13.721 0.428 813 H LYS 103 H LYS 103 9.163 -14.405 -3.264 814 HA LYS 103 HA LYS 103 10.885 -16.206 -1.739 815 HB2 LYS 103 1HB LYS 103 11.867 -14.478 -3.983 816 HB3 LYS 103 2HB LYS 103 12.407 -16.090 -3.488 817 HG2 LYS 103 1HG LYS 103 11.171 -16.974 -5.096 818 HG3 LYS 103 2HG LYS 103 9.723 -16.367 -4.273 819 HD2 LYS 103 1HD LYS 103 9.650 -15.538 -6.507 820 HD3 LYS 103 2HD LYS 103 10.079 -14.178 -5.454 821 HE2 LYS 103 1HE LYS 103 11.736 -13.832 -6.946 822 HE3 LYS 103 2HE LYS 103 12.538 -15.141 -6.068 823 HZ1 LYS 103 3HZ LYS 103 12.669 -15.764 -8.290 824 HZ2 LYS 103 1HZ LYS 103 11.084 -15.285 -8.634 825 HZ3 LYS 103 2HZ LYS 103 11.366 -16.672 -7.709 826 HA PRO 104 HA PRO 104 12.692 -13.071 0.750 827 HB2 PRO 104 2HB PRO 104 13.843 -14.751 1.814 828 HB3 PRO 104 1HB PRO 104 15.243 -14.027 1.025 829 HG2 PRO 104 1HG PRO 104 15.215 -15.549 -0.731 830 HG3 PRO 104 2HG PRO 104 14.653 -16.584 0.634 831 HD2 PRO 104 1HD PRO 104 13.265 -16.338 -1.687 832 HD3 PRO 104 2HD PRO 104 12.473 -16.561 -0.117 833 H GLU 105 H GLU 105 13.943 -13.773 -2.388 834 HA GLU 105 HA GLU 105 15.959 -11.757 -2.455 835 HB2 GLU 105 1HB GLU 105 14.538 -13.354 -4.580 836 HB3 GLU 105 2HB GLU 105 15.720 -12.101 -4.985 837 HG2 GLU 105 1HG GLU 105 16.819 -13.847 -2.993 838 HG3 GLU 105 2HG GLU 105 16.204 -14.790 -4.357 839 H GLN 106 H GLN 106 12.553 -11.889 -3.321 840 HA GLN 106 HA GLN 106 12.602 -9.177 -4.365 841 HB2 GLN 106 1HB GLN 106 10.114 -10.802 -3.907 842 HB3 GLN 106 2HB GLN 106 10.418 -9.551 -5.122 843 HG2 GLN 106 1HG GLN 106 11.778 -12.242 -5.105 844 HG3 GLN 106 2HG GLN 106 10.311 -11.872 -6.019 845 HE21 GLN 106 2HE2 GLN 106 12.010 -9.626 -8.263 846 HE22 GLN 106 1HE2 GLN 106 10.571 -9.723 -7.314 847 H GLN 107 H GLN 107 10.772 -10.900 -1.831 848 HA GLN 107 HA GLN 107 9.457 -8.884 -0.614 849 HB2 GLN 107 1HB GLN 107 10.247 -11.481 0.100 850 HB3 GLN 107 2HB GLN 107 10.760 -10.443 1.439 851 HG2 GLN 107 1HG GLN 107 8.068 -9.818 0.542 852 HG3 GLN 107 2HG GLN 107 8.243 -11.503 1.053 853 HE21 GLN 107 2HE2 GLN 107 8.191 -8.515 3.750 854 HE22 GLN 107 1HE2 GLN 107 8.056 -8.244 2.049 855 H MET 108 H MET 108 12.909 -9.494 -0.429 856 HA MET 108 HA MET 108 13.484 -7.669 1.654 857 HB2 MET 108 1HB MET 108 15.012 -9.197 -0.363 858 HB3 MET 108 2HB MET 108 15.791 -7.718 0.221 859 HG2 MET 108 1HG MET 108 15.042 -8.761 2.577 860 HG3 MET 108 2HG MET 108 15.223 -10.243 1.635 861 HE1 MET 108 3HE MET 108 18.776 -10.185 0.376 862 HE2 MET 108 1HE MET 108 17.110 -10.166 -0.205 863 HE3 MET 108 2HE MET 108 18.085 -8.697 -0.274 864 H MET 109 H MET 109 13.353 -7.345 -1.863 865 HA MET 109 HA MET 109 14.436 -4.805 -2.139 866 HB2 MET 109 1HB MET 109 12.283 -6.240 -3.694 867 HB3 MET 109 2HB MET 109 12.903 -4.653 -4.173 868 HG2 MET 109 1HG MET 109 14.976 -5.468 -4.763 869 HG3 MET 109 2HG MET 109 14.825 -6.877 -3.710 870 HE1 MET 109 3HE MET 109 13.744 -4.997 -6.621 871 HE2 MET 109 1HE MET 109 14.155 -6.157 -7.884 872 HE3 MET 109 2HE MET 109 12.478 -5.969 -7.373 873 H TYR 110 H TYR 110 11.204 -5.789 -1.173 874 HA TYR 110 HA TYR 110 10.264 -3.038 -1.112 875 HB2 TYR 110 1HB TYR 110 8.812 -5.521 -0.178 876 HB3 TYR 110 2HB TYR 110 8.107 -3.951 -0.570 877 HD1 TYR 110 2HD TYR 110 9.916 -6.813 -2.109 878 HD2 TYR 110 1HD TYR 110 7.354 -3.473 -2.735 879 HE1 TYR 110 2HE TYR 110 9.551 -7.534 -4.431 880 HE2 TYR 110 1HE TYR 110 6.982 -4.187 -5.058 881 HH TYR 110 HH TYR 110 8.444 -5.674 -6.784 882 H ALA 111 H ALA 111 11.006 -5.657 1.145 883 HA ALA 111 HA ALA 111 10.186 -4.450 3.515 884 HB1 ALA 111 3HB ALA 111 11.980 -6.644 2.770 885 HB2 ALA 111 1HB ALA 111 12.350 -5.886 4.319 886 HB3 ALA 111 2HB ALA 111 10.746 -6.560 4.027 887 H GLY 112 H GLY 112 12.927 -3.791 1.505 888 HA2 GLY 112 1HA GLY 112 14.184 -2.173 3.608 889 HA3 GLY 112 2HA GLY 112 14.930 -2.642 2.089 890 H SER 113 H SER 113 12.532 -1.888 0.542 891 HA SER 113 HA SER 113 13.027 1.005 0.521 892 HB2 SER 113 1HB SER 113 11.605 -0.467 -1.685 893 HB3 SER 113 2HB SER 113 12.585 1.007 -1.771 894 HG SER 113 HG SER 113 13.844 -1.342 -0.941 895 H LYS 114 H LYS 114 10.970 -0.848 2.026 896 HA LYS 114 HA LYS 114 8.406 0.018 1.189 897 HB2 LYS 114 1HB LYS 114 8.509 -1.958 2.493 898 HB3 LYS 114 2HB LYS 114 9.441 -1.153 3.766 899 HG2 LYS 114 1HG LYS 114 7.567 0.064 4.527 900 HG3 LYS 114 2HG LYS 114 6.625 -0.361 3.087 901 HD2 LYS 114 1HD LYS 114 5.742 -1.842 4.605 902 HD3 LYS 114 2HD LYS 114 7.051 -2.818 3.916 903 HE2 LYS 114 1HE LYS 114 8.506 -2.277 5.781 904 HE3 LYS 114 2HE LYS 114 7.280 -1.185 6.442 905 HZ1 LYS 114 3HZ LYS 114 7.543 -3.685 7.242 906 HZ2 LYS 114 1HZ LYS 114 6.452 -3.938 5.974 907 HZ3 LYS 114 2HZ LYS 114 6.051 -2.887 7.237 908 H ASN 115 H ASN 115 10.334 0.974 4.038 909 HA ASN 115 HA ASN 115 8.692 3.077 4.852 910 HB2 ASN 115 1HB ASN 115 11.554 2.337 5.303 911 HB3 ASN 115 2HB ASN 115 11.020 3.951 5.788 912 HD21 ASN 115 2HD2 ASN 115 10.266 0.832 8.124 913 HD22 ASN 115 1HD2 ASN 115 11.341 0.812 6.772 914 H ARG 116 H ARG 116 11.344 3.000 2.534 915 HA ARG 116 HA ARG 116 11.711 5.730 2.147 916 HB2 ARG 116 1HB ARG 116 13.265 4.205 1.181 917 HB3 ARG 116 2HB ARG 116 11.991 3.403 0.249 918 HG2 ARG 116 1HG ARG 116 13.158 4.713 -1.308 919 HG3 ARG 116 2HG ARG 116 11.673 5.611 -0.955 920 HD2 ARG 116 1HD ARG 116 13.357 7.245 -0.898 921 HD3 ARG 116 2HD ARG 116 13.046 6.861 0.801 922 HE ARG 116 HE ARG 116 15.143 5.251 -0.236 923 HH11 ARG 116 2HH1 ARG 116 14.417 8.465 0.887 924 HH12 ARG 116 1HH1 ARG 116 16.042 8.798 1.387 925 HH21 ARG 116 1HH2 ARG 116 17.673 7.213 1.118 926 HH22 ARG 116 2HH2 ARG 116 17.285 5.678 0.418 927 H LEU 117 H LEU 117 9.561 3.513 0.370 928 HA LEU 117 HA LEU 117 8.405 5.507 -1.261 929 HB2 LEU 117 1HB LEU 117 8.269 3.233 -1.953 930 HB3 LEU 117 2HB LEU 117 7.476 2.768 -0.439 931 HG LEU 117 HG LEU 117 5.577 4.356 -1.253 932 HD11 LEU 117 1HD1 LEU 117 6.477 5.393 -3.129 933 HD12 LEU 117 2HD1 LEU 117 5.447 4.135 -3.811 934 HD13 LEU 117 3HD1 LEU 117 7.194 3.898 -3.733 935 HD21 LEU 117 3HD2 LEU 117 4.421 2.509 -2.011 936 HD22 LEU 117 1HD2 LEU 117 5.718 1.764 -1.075 937 HD23 LEU 117 2HD2 LEU 117 5.827 1.833 -2.835 938 H VAL 118 H VAL 118 7.088 3.828 1.598 939 HA VAL 118 HA VAL 118 4.716 5.190 1.872 940 HB VAL 118 HB VAL 118 6.538 4.225 4.080 941 HG11 VAL 118 1HG1 VAL 118 5.092 5.007 5.571 942 HG12 VAL 118 2HG1 VAL 118 4.221 5.815 4.266 943 HG13 VAL 118 3HG1 VAL 118 3.760 4.185 4.759 944 HG21 VAL 118 3HG2 VAL 118 5.891 2.457 2.547 945 HG22 VAL 118 1HG2 VAL 118 5.057 2.259 4.089 946 HG23 VAL 118 2HG2 VAL 118 4.196 2.917 2.698 947 H GLN 119 H GLN 119 7.821 6.059 3.396 948 HA GLN 119 HA GLN 119 7.040 8.369 4.685 949 HB2 GLN 119 1HB GLN 119 9.631 7.463 3.479 950 HB3 GLN 119 2HB GLN 119 9.497 9.104 4.130 951 HG2 GLN 119 1HG GLN 119 8.447 7.659 6.175 952 HG3 GLN 119 2HG GLN 119 9.643 6.530 5.523 953 HE21 GLN 119 2HE2 GLN 119 11.871 8.110 7.698 954 HE22 GLN 119 1HE2 GLN 119 10.904 6.713 7.384 955 H THR 120 H THR 120 7.875 7.904 1.300 956 HA THR 120 HA THR 120 7.995 10.617 0.556 957 HB THR 120 HB THR 120 7.072 8.402 -1.270 958 HG1 THR 120 1HG THR 120 9.521 8.385 -1.648 959 HG21 THR 120 3HG2 THR 120 7.191 10.027 -2.791 960 HG22 THR 120 1HG2 THR 120 8.929 10.110 -2.501 961 HG23 THR 120 2HG2 THR 120 7.832 11.158 -1.600 962 H ALA 121 H ALA 121 5.320 8.287 0.541 963 HA ALA 121 HA ALA 121 3.420 10.103 -0.559 964 HB1 ALA 121 3HB ALA 121 3.347 7.536 -0.528 965 HB2 ALA 121 1HB ALA 121 2.693 7.714 1.101 966 HB3 ALA 121 2HB ALA 121 1.838 8.414 -0.274 967 H GLU 122 H GLU 122 4.716 9.637 2.579 968 HA GLU 122 HA GLU 122 4.381 10.746 4.540 969 HB2 GLU 122 1HB GLU 122 3.161 12.464 2.541 970 HB3 GLU 122 2HB GLU 122 2.319 12.571 4.093 971 HG2 GLU 122 1HG GLU 122 3.991 13.676 5.083 972 HG3 GLU 122 2HG GLU 122 5.228 12.665 4.323 973 H LEU 123 H LEU 123 2.851 8.394 3.770 974 HA LEU 123 HA LEU 123 0.166 8.668 4.681 975 HB2 LEU 123 1HB LEU 123 1.937 6.245 4.336 976 HB3 LEU 123 2HB LEU 123 0.216 6.174 4.752 977 HG LEU 123 HG LEU 123 1.066 7.585 2.258 978 HD11 LEU 123 1HD1 LEU 123 0.366 4.740 1.990 979 HD12 LEU 123 2HD1 LEU 123 1.965 5.073 2.654 980 HD13 LEU 123 3HD1 LEU 123 1.513 5.722 1.078 981 HD21 LEU 123 3HD2 LEU 123 -1.127 6.847 1.499 982 HD22 LEU 123 1HD2 LEU 123 -1.254 7.734 3.017 983 HD23 LEU 123 2HD2 LEU 123 -1.370 5.973 3.012 984 H THR 124 H THR 124 2.980 7.029 6.143 985 HA THR 124 HA THR 124 3.664 6.965 8.337 986 HB THR 124 HB THR 124 2.082 9.212 8.388 987 HG1 THR 124 1HG THR 124 3.943 9.212 9.537 988 HG21 THR 124 3HG2 THR 124 1.133 7.570 10.712 989 HG22 THR 124 1HG2 THR 124 0.239 7.586 9.193 990 HG23 THR 124 2HG2 THR 124 0.488 9.086 10.085 991 H LYS 125 H LYS 125 0.838 5.765 7.034 992 HA LYS 125 HA LYS 125 0.384 3.998 9.347 993 HB2 LYS 125 1HB LYS 125 -1.506 4.833 7.135 994 HB3 LYS 125 2HB LYS 125 -1.880 3.611 8.361 995 HG2 LYS 125 1HG LYS 125 -1.175 5.639 9.974 996 HG3 LYS 125 2HG LYS 125 -1.787 6.550 8.583 997 HD2 LYS 125 1HD LYS 125 -3.761 4.758 8.779 998 HD3 LYS 125 2HD LYS 125 -3.227 4.770 10.469 999 HE2 LYS 125 1HE LYS 125 -3.350 7.473 9.570 1000 HE3 LYS 125 2HE LYS 125 -4.854 6.664 9.109 1001 HZ1 LYS 125 3HZ LYS 125 -4.772 5.803 11.541 1002 HZ2 LYS 125 1HZ LYS 125 -5.331 7.368 11.222 1003 HZ3 LYS 125 2HZ LYS 125 -3.757 7.134 11.793 1004 H VAL 126 H VAL 126 1.854 2.401 8.854 1005 HA VAL 126 HA VAL 126 1.597 1.079 6.244 1006 HB VAL 126 HB VAL 126 3.718 0.345 8.219 1007 HG11 VAL 126 1HG1 VAL 126 3.115 -0.567 5.747 1008 HG12 VAL 126 2HG1 VAL 126 4.292 0.687 5.353 1009 HG13 VAL 126 3HG1 VAL 126 4.730 -0.621 6.454 1010 HG21 VAL 126 3HG2 VAL 126 4.308 2.523 8.333 1011 HG22 VAL 126 1HG2 VAL 126 5.019 2.190 6.754 1012 HG23 VAL 126 2HG2 VAL 126 3.431 2.950 6.864 1013 H PHE 127 H PHE 127 0.138 -0.503 6.256 1014 HA PHE 127 HA PHE 127 -0.064 -2.220 8.636 1015 HB2 PHE 127 1HB PHE 127 -2.044 -1.642 6.423 1016 HB3 PHE 127 2HB PHE 127 -2.289 -2.888 7.648 1017 HD1 PHE 127 1HD PHE 127 -1.294 -1.575 10.075 1018 HD2 PHE 127 2HD PHE 127 -3.672 -0.045 6.895 1019 HE1 PHE 127 1HE PHE 127 -2.269 0.085 11.607 1020 HE2 PHE 127 2HE PHE 127 -4.649 1.618 8.421 1021 HZ PHE 127 HZ PHE 127 -3.947 1.686 10.781 1022 H GLU 128 H GLU 128 1.055 -4.041 8.451 1023 HA GLU 128 HA GLU 128 1.614 -5.178 5.839 1024 HB2 GLU 128 1HB GLU 128 3.186 -4.971 7.964 1025 HB3 GLU 128 2HB GLU 128 2.438 -6.524 8.369 1026 HG2 GLU 128 1HG GLU 128 3.128 -6.854 5.725 1027 HG3 GLU 128 2HG GLU 128 4.460 -5.889 6.379 1028 H ILE 129 H ILE 129 0.549 -6.824 4.952 1029 HA ILE 129 HA ILE 129 -1.351 -8.314 6.639 1030 HB ILE 129 HB ILE 129 -2.418 -8.851 4.339 1031 HG12 ILE 129 1HG1 ILE 129 -1.142 -6.215 3.618 1032 HG13 ILE 129 2HG1 ILE 129 -0.413 -7.762 3.153 1033 HG21 ILE 129 1HG2 ILE 129 -3.963 -7.164 4.673 1034 HG22 ILE 129 2HG2 ILE 129 -3.194 -7.284 6.255 1035 HG23 ILE 129 3HG2 ILE 129 -2.734 -5.991 5.148 1036 HD11 ILE 129 3HD1 ILE 129 -3.263 -7.259 2.466 1037 HD12 ILE 129 1HD1 ILE 129 -1.993 -6.498 1.508 1038 HD13 ILE 129 2HD1 ILE 129 -2.062 -8.256 1.646 1039 H ARG 130 H ARG 130 -0.685 -10.296 7.102 1040 HA ARG 130 HA ARG 130 1.445 -11.629 5.894 1041 HB2 ARG 130 1HB ARG 130 0.711 -12.232 8.108 1042 HB3 ARG 130 2HB ARG 130 -0.877 -12.712 7.493 1043 HG2 ARG 130 1HG ARG 130 0.566 -14.639 8.015 1044 HG3 ARG 130 2HG ARG 130 0.082 -14.576 6.313 1045 HD2 ARG 130 1HD ARG 130 2.216 -13.797 5.621 1046 HD3 ARG 130 2HD ARG 130 2.691 -13.445 7.289 1047 HE ARG 130 HE ARG 130 2.871 -15.963 5.951 1048 HH11 ARG 130 2HH1 ARG 130 2.445 -14.447 9.055 1049 HH12 ARG 130 1HH1 ARG 130 3.082 -15.790 9.944 1050 HH21 ARG 130 1HH2 ARG 130 3.802 -17.661 8.837 1051 HH22 ARG 130 2HH2 ARG 130 3.710 -17.738 7.110 1052 H THR 131 H THR 131 -1.666 -11.117 4.716 1053 HA THR 131 HA THR 131 -1.195 -12.535 2.321 1054 HB THR 131 HB THR 131 -1.662 -14.565 3.439 1055 HG1 THR 131 1HG THR 131 -3.419 -15.233 2.291 1056 HG21 THR 131 3HG2 THR 131 -2.801 -13.223 5.391 1057 HG22 THR 131 1HG2 THR 131 -3.218 -14.911 5.101 1058 HG23 THR 131 2HG2 THR 131 -4.281 -13.628 4.522 1059 H THR 132 H THR 132 -2.897 -12.274 0.772 1060 HA THR 132 HA THR 132 -4.151 -9.812 0.796 1061 HB THR 132 HB THR 132 -5.653 -10.778 -1.014 1062 HG1 THR 132 1HG THR 132 -4.855 -12.898 -1.748 1063 HG21 THR 132 3HG2 THR 132 -2.760 -11.396 -1.529 1064 HG22 THR 132 1HG2 THR 132 -3.314 -9.739 -1.291 1065 HG23 THR 132 2HG2 THR 132 -3.955 -10.700 -2.623 1066 H ASP 133 H ASP 133 -5.456 -12.967 1.732 1067 HA ASP 133 HA ASP 133 -8.110 -12.420 2.060 1068 HB2 ASP 133 1HB ASP 133 -6.244 -14.358 3.078 1069 HB3 ASP 133 2HB ASP 133 -7.363 -13.884 4.363 1070 H ASP 134 H ASP 134 -5.451 -11.379 4.087 1071 HA ASP 134 HA ASP 134 -6.879 -10.528 6.333 1072 HB2 ASP 134 1HB ASP 134 -4.230 -10.497 5.526 1073 HB3 ASP 134 2HB ASP 134 -4.642 -8.781 5.634 1074 H LEU 135 H LEU 135 -6.229 -8.919 3.266 1075 HA LEU 135 HA LEU 135 -7.224 -6.375 4.005 1076 HB2 LEU 135 1HB LEU 135 -5.851 -6.411 2.114 1077 HB3 LEU 135 2HB LEU 135 -6.748 -7.757 1.390 1078 HG LEU 135 HG LEU 135 -8.434 -6.379 0.593 1079 HD11 LEU 135 1HD1 LEU 135 -7.626 -4.571 2.815 1080 HD12 LEU 135 2HD1 LEU 135 -9.229 -5.132 2.339 1081 HD13 LEU 135 3HD1 LEU 135 -8.419 -3.879 1.399 1082 HD21 LEU 135 3HD2 LEU 135 -7.158 -4.255 -0.245 1083 HD22 LEU 135 1HD2 LEU 135 -6.700 -5.858 -0.822 1084 HD23 LEU 135 2HD2 LEU 135 -5.755 -5.074 0.445 1085 H THR 136 H THR 136 -9.187 -6.753 5.095 1086 HA THR 136 HA THR 136 -11.444 -7.317 3.291 1087 HB THR 136 HB THR 136 -12.571 -8.177 5.505 1088 HG1 THR 136 1HG THR 136 -11.221 -8.752 7.055 1089 HG21 THR 136 3HG2 THR 136 -10.577 -9.845 3.969 1090 HG22 THR 136 1HG2 THR 136 -12.238 -9.517 3.480 1091 HG23 THR 136 2HG2 THR 136 -11.918 -10.464 4.933 1092 H GLU 137 H GLU 137 -13.388 -6.210 3.749 1093 HA GLU 137 HA GLU 137 -13.268 -3.569 4.341 1094 HB2 GLU 137 1HB GLU 137 -15.247 -4.835 3.437 1095 HB3 GLU 137 2HB GLU 137 -15.626 -5.292 5.105 1096 HG2 GLU 137 1HG GLU 137 -15.646 -2.788 5.613 1097 HG3 GLU 137 2HG GLU 137 -15.694 -2.569 3.858 1098 H THR 138 H THR 138 -13.819 -6.185 6.661 1099 HA THR 138 HA THR 138 -14.121 -4.447 8.908 1100 HB THR 138 HB THR 138 -13.346 -7.361 9.017 1101 HG1 THR 138 1HG THR 138 -16.022 -6.484 9.113 1102 HG21 THR 138 3HG2 THR 138 -15.029 -5.726 10.910 1103 HG22 THR 138 1HG2 THR 138 -13.295 -5.972 11.113 1104 HG23 THR 138 2HG2 THR 138 -14.392 -7.352 11.163 1105 H TRP 139 H TRP 139 -11.565 -6.845 8.233 1106 HA TRP 139 HA TRP 139 -9.723 -6.201 10.088 1107 HB2 TRP 139 1HB TRP 139 -9.170 -7.968 8.642 1108 HB3 TRP 139 2HB TRP 139 -9.364 -6.966 7.204 1109 HD1 TRP 139 HD TRP 139 -6.828 -7.771 9.941 1110 HE1 TRP 139 1HE TRP 139 -4.531 -6.842 9.241 1111 HE3 TRP 139 3HE TRP 139 -8.250 -5.123 5.806 1112 HZ2 TRP 139 2HZ TRP 139 -3.464 -5.203 7.206 1113 HZ3 TRP 139 3HZ TRP 139 -6.531 -3.902 4.539 1114 HH2 TRP 139 HH TRP 139 -4.188 -3.942 5.226 1115 H LEU 140 H LEU 140 -10.555 -4.287 7.288 1116 HA LEU 140 HA LEU 140 -8.340 -2.472 7.576 1117 HB2 LEU 140 1HB LEU 140 -9.093 -2.653 5.382 1118 HB3 LEU 140 2HB LEU 140 -10.795 -2.571 5.870 1119 HG LEU 140 HG LEU 140 -10.597 -0.193 6.295 1120 HD11 LEU 140 1HD1 LEU 140 -8.236 -0.240 7.046 1121 HD12 LEU 140 2HD1 LEU 140 -8.577 1.038 5.880 1122 HD13 LEU 140 3HD1 LEU 140 -7.741 -0.426 5.363 1123 HD21 LEU 140 3HD2 LEU 140 -10.455 -1.434 3.795 1124 HD22 LEU 140 1HD2 LEU 140 -9.338 -0.071 3.710 1125 HD23 LEU 140 2HD2 LEU 140 -11.026 0.197 4.151 1126 H LYS 141 H LYS 141 -11.868 -1.973 7.815 1127 HA LYS 141 HA LYS 141 -11.813 0.522 9.004 1128 HB2 LYS 141 1HB LYS 141 -13.764 -1.701 8.840 1129 HB3 LYS 141 2HB LYS 141 -14.042 -0.517 10.127 1130 HG2 LYS 141 1HG LYS 141 -14.596 1.144 8.693 1131 HG3 LYS 141 2HG LYS 141 -13.478 0.573 7.441 1132 HD2 LYS 141 1HD LYS 141 -15.354 -0.094 6.385 1133 HD3 LYS 141 2HD LYS 141 -15.264 -1.469 7.500 1134 HE2 LYS 141 1HE LYS 141 -16.646 1.014 8.422 1135 HE3 LYS 141 2HE LYS 141 -17.468 -0.032 7.255 1136 HZ1 LYS 141 3HZ LYS 141 -16.541 -1.777 9.117 1137 HZ2 LYS 141 1HZ LYS 141 -18.123 -1.181 9.027 1138 HZ3 LYS 141 2HZ LYS 141 -16.999 -0.444 10.053 1139 H GLU 142 H GLU 142 -10.843 -2.455 10.321 1140 HA GLU 142 HA GLU 142 -11.386 -1.931 13.067 1141 HB2 GLU 142 1HB GLU 142 -9.699 -3.891 11.560 1142 HB3 GLU 142 2HB GLU 142 -9.454 -3.705 13.303 1143 HG2 GLU 142 1HG GLU 142 -12.056 -4.008 13.403 1144 HG3 GLU 142 2HG GLU 142 -11.807 -4.771 11.826 1145 H LYS 143 H LYS 143 -8.318 -1.915 11.244 1146 HA LYS 143 HA LYS 143 -6.739 -0.802 13.253 1147 HB2 LYS 143 1HB LYS 143 -6.366 -0.347 10.287 1148 HB3 LYS 143 2HB LYS 143 -5.119 -0.336 11.544 1149 HG2 LYS 143 1HG LYS 143 -6.514 -2.852 11.571 1150 HG3 LYS 143 2HG LYS 143 -5.917 -2.488 9.942 1151 HD2 LYS 143 1HD LYS 143 -3.752 -1.786 11.412 1152 HD3 LYS 143 2HD LYS 143 -4.424 -3.084 12.414 1153 HE2 LYS 143 1HE LYS 143 -4.392 -4.620 10.530 1154 HE3 LYS 143 2HE LYS 143 -3.832 -3.323 9.466 1155 HZ1 LYS 143 3HZ LYS 143 -2.356 -4.789 11.535 1156 HZ2 LYS 143 1HZ LYS 143 -1.910 -3.190 11.203 1157 HZ3 LYS 143 2HZ LYS 143 -1.872 -4.351 9.974 1158 H LEU 144 H LEU 144 -8.709 0.749 10.771 1159 HA LEU 144 HA LEU 144 -7.832 3.393 11.252 1160 HB2 LEU 144 1HB LEU 144 -10.567 2.610 10.253 1161 HB3 LEU 144 2HB LEU 144 -9.657 4.094 9.917 1162 HG LEU 144 HG LEU 144 -8.831 1.364 8.939 1163 HD11 LEU 144 1HD1 LEU 144 -9.625 2.863 6.763 1164 HD12 LEU 144 2HD1 LEU 144 -10.869 3.188 7.969 1165 HD13 LEU 144 3HD1 LEU 144 -10.516 1.528 7.494 1166 HD21 LEU 144 3HD2 LEU 144 -6.911 2.536 8.722 1167 HD22 LEU 144 1HD2 LEU 144 -7.731 4.097 8.744 1168 HD23 LEU 144 2HD2 LEU 144 -7.707 3.134 7.267 1169 H ALA 145 H ALA 145 -10.769 1.677 12.319 1170 HA ALA 145 HA ALA 145 -12.119 3.467 13.758 1171 HB1 ALA 145 3HB ALA 145 -13.166 1.669 14.531 1172 HB2 ALA 145 1HB ALA 145 -11.899 0.676 13.808 1173 HB3 ALA 145 2HB ALA 145 -11.759 1.202 15.486 1174 H SER 146 H SER 146 -9.350 1.699 15.157 1175 HA SER 146 HA SER 146 -9.255 3.458 17.434 1176 HB2 SER 146 1HB SER 146 -7.211 2.139 18.035 1177 HB3 SER 146 2HB SER 146 -8.652 1.142 17.764 1178 HG SER 146 HG SER 146 -6.451 1.530 16.027 1179 H GLY 147 H GLY 147 -9.054 5.041 15.243 1180 HA2 GLY 147 1HA GLY 147 -6.408 5.543 14.364 1181 HA3 GLY 147 2HA GLY 147 -7.766 6.651 14.229 1182 HA PRO 148 HA PRO 148 -4.631 7.747 17.723 1183 HB2 PRO 148 2HB PRO 148 -2.624 7.506 16.631 1184 HB3 PRO 148 1HB PRO 148 -2.785 9.240 16.358 1185 HG2 PRO 148 1HG PRO 148 -3.655 8.963 14.220 1186 HG3 PRO 148 2HG PRO 148 -2.506 7.576 14.310 1187 HD2 PRO 148 1HD PRO 148 -5.126 7.269 13.666 1188 HD3 PRO 148 2HD PRO 148 -4.214 6.052 14.574 1189 H SER 149 H SER 149 -3.901 10.119 18.206 1190 HA SER 149 HA SER 149 -6.124 11.737 18.360 1191 HB2 SER 149 1HB SER 149 -4.314 12.234 19.806 1192 HB3 SER 149 2HB SER 149 -3.182 12.401 18.452 1193 HG SER 149 HG SER 149 -4.386 14.345 19.596 1194 H SER 150 H SER 150 -6.707 13.711 17.312 1195 HA SER 150 HA SER 150 -7.062 15.100 15.538 1196 HB2 SER 150 1HB SER 150 -4.418 14.908 15.488 1197 HB3 SER 150 2HB SER 150 -4.744 13.991 14.008 1198 HG SER 150 HG SER 150 -4.466 16.371 13.826 1199 H GLY 151 H GLY 151 -8.956 14.121 14.896 1200 HA2 GLY 151 1HA GLY 151 -8.696 12.093 12.762 1201 HA3 GLY 151 2HA GLY 151 -10.045 12.157 13.886 Start of MODEL 9 1 H1 GLY 1 H GLY 1 10.231 -5.421 15.904 2 HA2 GLY 1 1HA GLY 1 8.056 -6.694 14.403 3 HA3 GLY 1 2HA GLY 1 9.158 -5.473 13.785 4 H SER 2 H SER 2 8.805 -7.475 12.139 5 HA SER 2 HA SER 2 10.250 -9.824 12.460 6 HB2 SER 2 1HB SER 2 9.884 -8.266 9.882 7 HB3 SER 2 2HB SER 2 10.244 -9.996 10.028 8 HG SER 2 HG SER 2 8.202 -10.098 11.257 9 H SER 3 H SER 3 12.264 -10.415 11.220 10 HA SER 3 HA SER 3 14.200 -8.391 10.675 11 HB2 SER 3 1HB SER 3 15.756 -8.820 12.477 12 HB3 SER 3 2HB SER 3 14.188 -8.380 13.177 13 HG SER 3 HG SER 3 15.305 -10.291 14.082 14 H GLY 4 H GLY 4 16.004 -9.194 9.614 15 HA2 GLY 4 1HA GLY 4 15.696 -11.723 8.364 16 HA3 GLY 4 2HA GLY 4 17.097 -10.669 8.230 17 H SER 5 H SER 5 16.945 -13.592 8.506 18 HA SER 5 HA SER 5 17.424 -14.756 10.861 19 HB2 SER 5 1HB SER 5 19.282 -15.063 8.480 20 HB3 SER 5 2HB SER 5 19.039 -16.240 9.783 21 HG SER 5 HG SER 5 16.740 -16.172 9.088 22 H SER 6 H SER 6 19.825 -12.775 9.149 23 HA SER 6 HA SER 6 20.923 -11.718 11.527 24 HB2 SER 6 1HB SER 6 21.776 -14.214 11.362 25 HB3 SER 6 2HB SER 6 22.916 -13.514 10.197 26 HG SER 6 HG SER 6 22.540 -12.355 12.743 27 H GLY 7 H GLY 7 21.990 -12.729 8.271 28 HA2 GLY 7 1HA GLY 7 23.291 -11.548 6.743 29 HA3 GLY 7 2HA GLY 7 21.921 -10.455 6.878 30 H SER 8 H SER 8 22.692 -8.450 6.934 31 HA SER 8 HA SER 8 24.503 -7.703 9.071 32 HB2 SER 8 1HB SER 8 25.431 -8.063 6.361 33 HB3 SER 8 2HB SER 8 25.572 -6.360 6.831 34 HG SER 8 HG SER 8 27.344 -7.983 7.382 35 H ASP 9 H ASP 9 21.726 -7.192 8.311 36 HA ASP 9 HA ASP 9 20.231 -5.477 8.270 37 HB2 ASP 9 1HB ASP 9 22.680 -4.064 9.329 38 HB3 ASP 9 2HB ASP 9 21.133 -3.232 9.120 39 H SER 10 H SER 10 21.214 -6.126 5.815 40 HA SER 10 HA SER 10 21.278 -3.508 4.479 41 HB2 SER 10 1HB SER 10 23.106 -5.861 4.061 42 HB3 SER 10 2HB SER 10 22.745 -4.765 2.716 43 HG SER 10 HG SER 10 24.429 -4.399 4.776 44 H LEU 11 H LEU 11 19.995 -3.314 2.713 45 HA LEU 11 HA LEU 11 18.734 -5.731 1.628 46 HB2 LEU 11 1HB LEU 11 17.198 -3.213 2.275 47 HB3 LEU 11 2HB LEU 11 16.552 -4.756 1.690 48 HG LEU 11 HG LEU 11 17.944 -4.618 4.338 49 HD11 LEU 11 1HD1 LEU 11 16.294 -2.830 4.393 50 HD12 LEU 11 2HD1 LEU 11 15.793 -4.179 5.411 51 HD13 LEU 11 3HD1 LEU 11 15.049 -3.944 3.829 52 HD21 LEU 11 3HD2 LEU 11 16.030 -6.375 4.690 53 HD22 LEU 11 1HD2 LEU 11 17.513 -6.816 3.843 54 HD23 LEU 11 2HD2 LEU 11 16.053 -6.440 2.926 55 H VAL 12 H VAL 12 17.050 -4.606 -0.192 56 HA VAL 12 HA VAL 12 18.946 -3.414 -2.072 57 HB VAL 12 HB VAL 12 16.163 -4.237 -2.817 58 HG11 VAL 12 1HG1 VAL 12 17.934 -5.040 -4.764 59 HG12 VAL 12 2HG1 VAL 12 16.992 -3.547 -4.774 60 HG13 VAL 12 3HG1 VAL 12 18.648 -3.542 -4.166 61 HG21 VAL 12 3HG2 VAL 12 16.813 -6.512 -3.116 62 HG22 VAL 12 1HG2 VAL 12 18.483 -6.153 -2.677 63 HG23 VAL 12 2HG2 VAL 12 17.211 -6.065 -1.458 64 H VAL 13 H VAL 13 18.066 -1.691 -0.059 65 HA VAL 13 HA VAL 13 15.919 -0.123 -0.255 66 HB VAL 13 HB VAL 13 18.751 0.922 -0.144 67 HG11 VAL 13 1HG1 VAL 13 17.668 2.885 -0.477 68 HG12 VAL 13 2HG1 VAL 13 16.116 2.248 0.071 69 HG13 VAL 13 3HG1 VAL 13 17.343 2.720 1.248 70 HG21 VAL 13 3HG2 VAL 13 16.851 -0.147 1.901 71 HG22 VAL 13 1HG2 VAL 13 18.570 -0.474 1.689 72 HG23 VAL 13 2HG2 VAL 13 18.041 1.071 2.357 73 H CYS 14 H CYS 14 14.814 0.411 -2.029 74 HA CYS 14 HA CYS 14 16.274 1.373 -4.385 75 HB2 CYS 14 1HB CYS 14 13.457 0.354 -4.018 76 HB3 CYS 14 2HB CYS 14 14.036 1.071 -5.530 77 HG CYS 14 HG CYS 14 16.225 -1.179 -4.801 78 H GLU 15 H GLU 15 15.258 3.173 -5.611 79 HA GLU 15 HA GLU 15 14.599 5.322 -3.773 80 HB2 GLU 15 1HB GLU 15 15.742 5.090 -6.457 81 HB3 GLU 15 2HB GLU 15 14.567 6.406 -6.311 82 HG2 GLU 15 1HG GLU 15 16.404 6.349 -4.066 83 HG3 GLU 15 2HG GLU 15 17.243 6.491 -5.618 84 H VAL 16 H VAL 16 12.954 6.983 -4.709 85 HA VAL 16 HA VAL 16 10.496 5.485 -5.300 86 HB VAL 16 HB VAL 16 10.500 6.835 -3.227 87 HG11 VAL 16 1HG1 VAL 16 10.366 9.349 -4.807 88 HG12 VAL 16 2HG1 VAL 16 10.892 9.083 -3.143 89 HG13 VAL 16 3HG1 VAL 16 11.953 8.651 -4.485 90 HG21 VAL 16 3HG2 VAL 16 8.304 7.070 -3.503 91 HG22 VAL 16 1HG2 VAL 16 8.536 8.384 -4.657 92 HG23 VAL 16 2HG2 VAL 16 8.541 6.711 -5.214 93 H ASP 17 H ASP 17 10.420 5.373 -7.496 94 HA ASP 17 HA ASP 17 11.264 6.938 -9.472 95 HB2 ASP 17 1HB ASP 17 9.800 4.909 -9.713 96 HB3 ASP 17 2HB ASP 17 8.407 5.956 -9.409 97 HA PRO 18 HA PRO 18 9.690 11.018 -8.939 98 HB2 PRO 18 2HB PRO 18 11.399 11.689 -10.320 99 HB3 PRO 18 1HB PRO 18 10.099 11.949 -11.482 100 HG2 PRO 18 1HG PRO 18 10.438 9.904 -12.530 101 HG3 PRO 18 2HG PRO 18 12.126 10.342 -12.070 102 HD2 PRO 18 1HD PRO 18 10.988 7.974 -11.384 103 HD3 PRO 18 2HD PRO 18 12.160 8.809 -10.349 104 H GLU 19 H GLU 19 8.516 8.963 -11.547 105 HA GLU 19 HA GLU 19 6.272 10.603 -12.201 106 HB2 GLU 19 1HB GLU 19 5.768 9.047 -13.800 107 HB3 GLU 19 2HB GLU 19 7.480 8.674 -13.549 108 HG2 GLU 19 1HG GLU 19 6.830 6.566 -13.266 109 HG3 GLU 19 2HG GLU 19 6.256 7.096 -11.678 110 H LEU 20 H LEU 20 6.906 8.138 -9.849 111 HA LEU 20 HA LEU 20 4.095 7.725 -9.250 112 HB2 LEU 20 1HB LEU 20 6.125 6.034 -9.117 113 HB3 LEU 20 2HB LEU 20 6.276 6.721 -7.491 114 HG LEU 20 HG LEU 20 3.863 5.291 -8.605 115 HD11 LEU 20 1HD1 LEU 20 6.246 4.393 -7.257 116 HD12 LEU 20 2HD1 LEU 20 4.930 3.454 -7.963 117 HD13 LEU 20 3HD1 LEU 20 4.806 4.038 -6.303 118 HD21 LEU 20 3HD2 LEU 20 3.147 5.431 -6.162 119 HD22 LEU 20 1HD2 LEU 20 3.010 6.901 -7.127 120 HD23 LEU 20 2HD2 LEU 20 4.354 6.707 -6.001 121 H LYS 21 H LYS 21 6.911 9.311 -7.843 122 HA LYS 21 HA LYS 21 6.064 9.946 -5.328 123 HB2 LYS 21 1HB LYS 21 8.252 10.566 -6.452 124 HB3 LYS 21 2HB LYS 21 7.399 11.958 -7.137 125 HG2 LYS 21 1HG LYS 21 6.762 12.239 -4.522 126 HG3 LYS 21 2HG LYS 21 8.366 11.494 -4.401 127 HD2 LYS 21 1HD LYS 21 8.236 13.616 -6.412 128 HD3 LYS 21 2HD LYS 21 7.864 14.173 -4.771 129 HE2 LYS 21 1HE LYS 21 10.024 12.629 -4.257 130 HE3 LYS 21 2HE LYS 21 10.397 13.163 -5.903 131 HZ1 LYS 21 3HZ LYS 21 11.074 14.577 -3.810 132 HZ2 LYS 21 1HZ LYS 21 9.507 15.189 -3.991 133 HZ3 LYS 21 2HZ LYS 21 10.617 15.317 -5.261 134 H GLU 22 H GLU 22 5.225 11.647 -8.327 135 HA GLU 22 HA GLU 22 3.673 13.667 -7.106 136 HB2 GLU 22 1HB GLU 22 3.230 12.596 -9.891 137 HB3 GLU 22 2HB GLU 22 2.945 14.236 -9.290 138 HG2 GLU 22 1HG GLU 22 5.539 14.168 -8.827 139 HG3 GLU 22 2HG GLU 22 5.488 12.926 -10.087 140 H THR 23 H THR 23 2.791 10.562 -8.583 141 HA THR 23 HA THR 23 0.062 10.660 -8.477 142 HB THR 23 HB THR 23 1.951 8.369 -8.009 143 HG1 THR 23 1HG THR 23 1.270 9.506 -10.144 144 HG21 THR 23 3HG2 THR 23 -0.250 6.998 -8.408 145 HG22 THR 23 1HG2 THR 23 -1.020 8.417 -7.698 146 HG23 THR 23 2HG2 THR 23 0.193 7.519 -6.783 147 H LEU 24 H LEU 24 2.257 9.810 -5.821 148 HA LEU 24 HA LEU 24 0.265 9.221 -3.922 149 HB2 LEU 24 1HB LEU 24 2.988 10.366 -3.310 150 HB3 LEU 24 2HB LEU 24 1.985 9.322 -2.286 151 HG LEU 24 HG LEU 24 3.388 8.499 -4.829 152 HD11 LEU 24 1HD1 LEU 24 5.106 7.826 -3.585 153 HD12 LEU 24 2HD1 LEU 24 4.052 7.113 -2.365 154 HD13 LEU 24 3HD1 LEU 24 4.436 8.833 -2.301 155 HD21 LEU 24 3HD2 LEU 24 2.686 6.188 -3.836 156 HD22 LEU 24 1HD2 LEU 24 1.547 7.117 -4.809 157 HD23 LEU 24 2HD2 LEU 24 1.419 7.131 -3.049 158 H ARG 25 H ARG 25 2.149 12.199 -4.447 159 HA ARG 25 HA ARG 25 0.934 13.738 -2.457 160 HB2 ARG 25 1HB ARG 25 3.022 14.311 -3.727 161 HB3 ARG 25 2HB ARG 25 1.991 14.763 -5.093 162 HG2 ARG 25 1HG ARG 25 0.872 16.444 -3.642 163 HG3 ARG 25 2HG ARG 25 2.048 16.052 -2.375 164 HD2 ARG 25 1HD ARG 25 3.553 17.421 -3.283 165 HD3 ARG 25 2HD ARG 25 3.446 16.545 -4.815 166 HE ARG 25 HE ARG 25 2.328 18.344 -5.634 167 HH11 ARG 25 2HH1 ARG 25 1.718 18.154 -2.212 168 HH12 ARG 25 1HH1 ARG 25 0.724 19.573 -2.178 169 HH21 ARG 25 1HH2 ARG 25 0.326 20.742 -4.108 170 HH22 ARG 25 2HH2 ARG 25 1.021 20.212 -5.603 171 H LYS 26 H LYS 26 -0.175 12.806 -5.601 172 HA LYS 26 HA LYS 26 -2.276 14.802 -5.676 173 HB2 LYS 26 1HB LYS 26 -2.054 12.419 -7.505 174 HB3 LYS 26 2HB LYS 26 -2.788 13.997 -7.831 175 HG2 LYS 26 1HG LYS 26 -0.041 14.413 -7.200 176 HG3 LYS 26 2HG LYS 26 -0.161 13.124 -8.411 177 HD2 LYS 26 1HD LYS 26 -1.936 14.876 -9.439 178 HD3 LYS 26 2HD LYS 26 -0.827 15.994 -8.626 179 HE2 LYS 26 1HE LYS 26 0.733 15.725 -10.201 180 HE3 LYS 26 2HE LYS 26 0.636 13.963 -10.060 181 HZ1 LYS 26 3HZ LYS 26 -0.722 13.807 -11.825 182 HZ2 LYS 26 1HZ LYS 26 -0.084 15.318 -12.238 183 HZ3 LYS 26 2HZ LYS 26 -1.578 15.217 -11.451 184 H PHE 27 H PHE 27 -1.936 11.341 -5.090 185 HA PHE 27 HA PHE 27 -4.655 10.676 -4.993 186 HB2 PHE 27 1HB PHE 27 -2.540 9.161 -4.976 187 HB3 PHE 27 2HB PHE 27 -2.618 9.356 -3.224 188 HD1 PHE 27 2HD PHE 27 -5.349 8.942 -5.719 189 HD2 PHE 27 1HD PHE 27 -3.312 7.341 -2.342 190 HE1 PHE 27 2HE PHE 27 -7.018 7.140 -5.571 191 HE2 PHE 27 1HE PHE 27 -4.977 5.536 -2.188 192 HZ PHE 27 HZ PHE 27 -6.834 5.435 -3.803 193 H ARG 28 H ARG 28 -2.529 12.117 -2.618 194 HA ARG 28 HA ARG 28 -4.327 11.792 -0.412 195 HB2 ARG 28 1HB ARG 28 -2.186 13.895 -0.499 196 HB3 ARG 28 2HB ARG 28 -2.742 12.918 0.869 197 HG2 ARG 28 1HG ARG 28 -1.739 11.053 -0.934 198 HG3 ARG 28 2HG ARG 28 -0.606 12.412 -1.007 199 HD2 ARG 28 1HD ARG 28 -1.522 11.054 1.537 200 HD3 ARG 28 2HD ARG 28 0.008 10.742 0.705 201 HE ARG 28 HE ARG 28 0.775 12.873 1.352 202 HH11 ARG 28 2HH1 ARG 28 -2.414 12.161 2.554 203 HH12 ARG 28 1HH1 ARG 28 -2.383 13.412 3.752 204 HH21 ARG 28 1HH2 ARG 28 -0.540 14.756 3.961 205 HH22 ARG 28 2HH2 ARG 28 0.827 14.524 2.924 206 H PHE 29 H PHE 29 -3.830 14.175 -2.898 207 HA PHE 29 HA PHE 29 -6.045 15.749 -1.765 208 HB2 PHE 29 1HB PHE 29 -4.062 17.192 -3.433 209 HB3 PHE 29 2HB PHE 29 -4.949 17.735 -2.008 210 HD1 PHE 29 1HD PHE 29 -4.254 16.054 0.132 211 HD2 PHE 29 2HD PHE 29 -1.793 17.347 -3.091 212 HE1 PHE 29 1HE PHE 29 -2.257 15.729 1.531 213 HE2 PHE 29 2HE PHE 29 0.208 17.024 -1.697 214 HZ PHE 29 HZ PHE 29 -0.022 16.213 0.617 215 H ARG 30 H ARG 30 -6.319 13.661 -3.629 216 HA ARG 30 HA ARG 30 -6.433 14.674 -6.296 217 HB2 ARG 30 1HB ARG 30 -7.660 12.597 -6.804 218 HB3 ARG 30 2HB ARG 30 -6.173 12.292 -5.894 219 HG2 ARG 30 1HG ARG 30 -7.760 12.372 -3.814 220 HG3 ARG 30 2HG ARG 30 -9.009 12.026 -5.023 221 HD2 ARG 30 1HD ARG 30 -6.833 10.291 -5.563 222 HD3 ARG 30 2HD ARG 30 -7.130 10.242 -3.819 223 HE ARG 30 HE ARG 30 -8.832 9.216 -5.892 224 HH11 ARG 30 2HH1 ARG 30 -8.710 10.414 -2.626 225 HH12 ARG 30 1HH1 ARG 30 -10.148 9.585 -2.130 226 HH21 ARG 30 1HH2 ARG 30 -11.294 8.280 -3.624 227 HH22 ARG 30 2HH2 ARG 30 -10.727 8.120 -5.251 228 H LYS 31 H LYS 31 -8.609 14.462 -7.516 229 HA LYS 31 HA LYS 31 -10.545 16.123 -6.074 230 HB2 LYS 31 1HB LYS 31 -9.911 15.675 -8.974 231 HB3 LYS 31 2HB LYS 31 -11.495 16.314 -8.503 232 HG2 LYS 31 1HG LYS 31 -9.344 17.730 -7.174 233 HG3 LYS 31 2HG LYS 31 -9.179 17.770 -8.938 234 HD2 LYS 31 1HD LYS 31 -11.925 18.224 -8.029 235 HD3 LYS 31 2HD LYS 31 -10.774 19.433 -7.435 236 HE2 LYS 31 1HE LYS 31 -10.712 18.643 -10.326 237 HE3 LYS 31 2HE LYS 31 -11.962 19.752 -9.746 238 HZ1 LYS 31 3HZ LYS 31 -10.342 21.301 -9.050 239 HZ2 LYS 31 1HZ LYS 31 -9.884 20.819 -10.606 240 HZ3 LYS 31 2HZ LYS 31 -9.074 20.200 -9.256 241 H GLU 32 H GLU 32 -10.448 13.350 -5.476 242 HA GLU 32 HA GLU 32 -13.003 12.432 -6.625 243 HB2 GLU 32 1HB GLU 32 -10.662 10.827 -5.579 244 HB3 GLU 32 2HB GLU 32 -12.230 10.128 -6.014 245 HG2 GLU 32 1HG GLU 32 -11.951 10.583 -8.289 246 HG3 GLU 32 2HG GLU 32 -10.647 11.738 -7.980 247 H THR 33 H THR 33 -14.173 10.878 -5.105 248 HA THR 33 HA THR 33 -13.829 11.569 -2.285 249 HB THR 33 HB THR 33 -16.229 12.043 -2.007 250 HG1 THR 33 1HG THR 33 -16.453 12.292 -4.813 251 HG21 THR 33 3HG2 THR 33 -15.640 14.007 -4.083 252 HG22 THR 33 1HG2 THR 33 -14.296 13.744 -2.975 253 HG23 THR 33 2HG2 THR 33 -15.872 14.230 -2.350 254 H ASN 34 H ASN 34 -13.582 9.164 -4.097 255 HA ASN 34 HA ASN 34 -15.388 7.389 -2.589 256 HB2 ASN 34 1HB ASN 34 -14.999 5.821 -4.634 257 HB3 ASN 34 2HB ASN 34 -16.163 7.145 -4.769 258 HD21 ASN 34 2HD2 ASN 34 -13.215 6.904 -7.375 259 HD22 ASN 34 1HD2 ASN 34 -13.749 5.629 -6.338 260 H ASN 35 H ASN 35 -14.377 4.972 -3.054 261 HA ASN 35 HA ASN 35 -11.808 5.083 -1.690 262 HB2 ASN 35 1HB ASN 35 -13.766 2.844 -2.235 263 HB3 ASN 35 2HB ASN 35 -12.183 2.572 -1.498 264 HD21 ASN 35 2HD2 ASN 35 -14.678 2.918 1.194 265 HD22 ASN 35 1HD2 ASN 35 -14.448 1.873 -0.164 266 H ALA 36 H ALA 36 -9.922 4.734 -2.659 267 HA ALA 36 HA ALA 36 -9.866 3.226 -5.178 268 HB1 ALA 36 3HB ALA 36 -8.651 5.935 -4.694 269 HB2 ALA 36 1HB ALA 36 -8.166 4.884 -6.025 270 HB3 ALA 36 2HB ALA 36 -9.826 5.473 -5.926 271 H ALA 37 H ALA 37 -7.634 2.545 -5.775 272 HA ALA 37 HA ALA 37 -5.832 2.303 -3.474 273 HB1 ALA 37 3HB ALA 37 -6.023 -0.146 -5.066 274 HB2 ALA 37 1HB ALA 37 -5.936 0.071 -3.317 275 HB3 ALA 37 2HB ALA 37 -7.481 0.242 -4.153 276 H ILE 38 H ILE 38 -3.649 1.983 -3.998 277 HA ILE 38 HA ILE 38 -2.963 2.170 -6.852 278 HB ILE 38 HB ILE 38 -1.597 3.778 -4.694 279 HG12 ILE 38 1HG1 ILE 38 -3.733 4.515 -6.694 280 HG13 ILE 38 2HG1 ILE 38 -3.752 4.747 -4.938 281 HG21 ILE 38 1HG2 ILE 38 -0.589 4.946 -6.644 282 HG22 ILE 38 2HG2 ILE 38 -0.114 3.254 -6.502 283 HG23 ILE 38 3HG2 ILE 38 -1.322 3.733 -7.693 284 HD11 ILE 38 3HD1 ILE 38 -2.143 6.263 -6.968 285 HD12 ILE 38 1HD1 ILE 38 -3.401 6.874 -5.894 286 HD13 ILE 38 2HD1 ILE 38 -1.849 6.361 -5.232 287 H ILE 39 H ILE 39 -1.957 0.302 -7.242 288 HA ILE 39 HA ILE 39 -0.200 -0.866 -5.226 289 HB ILE 39 HB ILE 39 -0.992 -1.987 -7.915 290 HG12 ILE 39 1HG1 ILE 39 -2.065 -3.158 -5.420 291 HG13 ILE 39 2HG1 ILE 39 -2.701 -1.561 -5.847 292 HG21 ILE 39 1HG2 ILE 39 1.012 -3.020 -7.195 293 HG22 ILE 39 2HG2 ILE 39 0.428 -3.160 -5.538 294 HG23 ILE 39 3HG2 ILE 39 -0.291 -4.144 -6.812 295 HD11 ILE 39 3HD1 ILE 39 -2.666 -3.824 -7.813 296 HD12 ILE 39 1HD1 ILE 39 -3.998 -3.568 -6.686 297 HD13 ILE 39 2HD1 ILE 39 -3.594 -2.326 -7.872 298 H MET 40 H MET 40 1.880 -0.358 -5.220 299 HA MET 40 HA MET 40 3.156 0.407 -7.759 300 HB2 MET 40 1HB MET 40 4.246 0.984 -5.007 301 HB3 MET 40 2HB MET 40 4.672 1.756 -6.542 302 HG2 MET 40 1HG MET 40 2.900 3.169 -6.504 303 HG3 MET 40 2HG MET 40 1.857 1.996 -5.695 304 HE1 MET 40 3HE MET 40 1.136 2.011 -3.726 305 HE2 MET 40 1HE MET 40 1.813 2.658 -2.231 306 HE3 MET 40 2HE MET 40 0.921 3.716 -3.326 307 H LYS 41 H LYS 41 5.271 -0.360 -8.215 308 HA LYS 41 HA LYS 41 6.096 -2.724 -6.669 309 HB2 LYS 41 1HB LYS 41 6.505 -3.994 -8.619 310 HB3 LYS 41 2HB LYS 41 4.900 -3.278 -8.842 311 HG2 LYS 41 1HG LYS 41 5.521 -2.213 -10.690 312 HG3 LYS 41 2HG LYS 41 6.974 -1.568 -9.904 313 HD2 LYS 41 1HD LYS 41 8.314 -3.183 -10.738 314 HD3 LYS 41 2HD LYS 41 7.080 -4.439 -10.535 315 HE2 LYS 41 1HE LYS 41 5.903 -3.620 -12.532 316 HE3 LYS 41 2HE LYS 41 7.138 -2.368 -12.729 317 HZ1 LYS 41 3HZ LYS 41 8.727 -4.423 -12.717 318 HZ2 LYS 41 1HZ LYS 41 7.917 -3.971 -14.132 319 HZ3 LYS 41 2HZ LYS 41 7.336 -5.256 -13.198 320 H VAL 42 H VAL 42 8.391 -3.429 -7.552 321 HA VAL 42 HA VAL 42 10.038 -1.011 -7.891 322 HB VAL 42 HB VAL 42 10.531 -1.417 -5.688 323 HG11 VAL 42 1HG1 VAL 42 9.344 -3.183 -4.924 324 HG12 VAL 42 2HG1 VAL 42 9.724 -4.185 -6.325 325 HG13 VAL 42 3HG1 VAL 42 10.907 -3.990 -5.031 326 HG21 VAL 42 3HG2 VAL 42 12.561 -1.677 -7.183 327 HG22 VAL 42 1HG2 VAL 42 12.707 -2.328 -5.550 328 HG23 VAL 42 2HG2 VAL 42 12.422 -3.414 -6.910 329 H ASP 43 H ASP 43 10.999 -1.156 -9.804 330 HA ASP 43 HA ASP 43 11.451 -3.671 -11.110 331 HB2 ASP 43 1HB ASP 43 11.963 -0.791 -11.796 332 HB3 ASP 43 2HB ASP 43 12.703 -2.075 -12.762 333 H LYS 44 H LYS 44 13.042 -4.963 -10.468 334 HA LYS 44 HA LYS 44 15.277 -4.230 -8.976 335 HB2 LYS 44 1HB LYS 44 14.496 -6.530 -9.095 336 HB3 LYS 44 2HB LYS 44 14.902 -6.599 -10.817 337 HG2 LYS 44 1HG LYS 44 17.262 -5.815 -9.519 338 HG3 LYS 44 2HG LYS 44 16.561 -7.112 -8.535 339 HD2 LYS 44 1HD LYS 44 16.250 -8.365 -10.774 340 HD3 LYS 44 2HD LYS 44 17.409 -7.186 -11.412 341 HE2 LYS 44 1HE LYS 44 18.947 -7.844 -9.497 342 HE3 LYS 44 2HE LYS 44 17.832 -9.187 -9.203 343 HZ1 LYS 44 3HZ LYS 44 18.301 -9.382 -11.855 344 HZ2 LYS 44 1HZ LYS 44 19.099 -10.276 -10.660 345 HZ3 LYS 44 2HZ LYS 44 19.803 -8.867 -11.274 346 H ASP 45 H ASP 45 14.701 -4.061 -12.382 347 HA ASP 45 HA ASP 45 17.407 -3.964 -13.240 348 HB2 ASP 45 1HB ASP 45 14.750 -3.569 -14.425 349 HB3 ASP 45 2HB ASP 45 16.001 -2.536 -15.130 350 H ARG 46 H ARG 46 15.038 -1.488 -12.356 351 HA ARG 46 HA ARG 46 17.149 0.548 -12.572 352 HB2 ARG 46 1HB ARG 46 14.159 0.956 -12.331 353 HB3 ARG 46 2HB ARG 46 15.374 2.200 -12.658 354 HG2 ARG 46 1HG ARG 46 15.848 1.298 -14.819 355 HG3 ARG 46 2HG ARG 46 14.843 -0.124 -14.491 356 HD2 ARG 46 1HD ARG 46 13.117 0.952 -15.402 357 HD3 ARG 46 2HD ARG 46 13.176 2.070 -14.032 358 HE ARG 46 HE ARG 46 15.019 3.115 -15.679 359 HH11 ARG 46 2HH1 ARG 46 11.750 2.045 -16.216 360 HH12 ARG 46 1HH1 ARG 46 11.451 3.175 -17.494 361 HH21 ARG 46 1HH2 ARG 46 13.095 4.634 -18.144 362 HH22 ARG 46 2HH2 ARG 46 14.637 4.609 -17.360 363 H GLN 47 H GLN 47 16.167 -1.464 -10.333 364 HA GLN 47 HA GLN 47 15.728 -1.395 -8.062 365 HB2 GLN 47 1HB GLN 47 18.056 0.529 -8.197 366 HB3 GLN 47 2HB GLN 47 17.628 -0.544 -6.856 367 HG2 GLN 47 1HG GLN 47 18.018 -2.013 -9.328 368 HG3 GLN 47 2HG GLN 47 19.441 -1.065 -8.876 369 HE21 GLN 47 2HE2 GLN 47 18.384 -4.361 -6.787 370 HE22 GLN 47 1HE2 GLN 47 17.416 -3.734 -8.073 371 H MET 48 H MET 48 13.834 0.172 -9.054 372 HA MET 48 HA MET 48 13.642 2.289 -7.063 373 HB2 MET 48 1HB MET 48 13.504 4.056 -8.464 374 HB3 MET 48 2HB MET 48 14.448 3.014 -9.538 375 HG2 MET 48 1HG MET 48 12.021 2.195 -10.259 376 HG3 MET 48 2HG MET 48 11.602 3.813 -9.692 377 HE1 MET 48 3HE MET 48 13.970 6.052 -11.838 378 HE2 MET 48 1HE MET 48 12.330 6.147 -11.194 379 HE3 MET 48 2HE MET 48 13.657 5.632 -10.152 380 H VAL 49 H VAL 49 11.489 2.932 -6.603 381 HA VAL 49 HA VAL 49 9.554 0.840 -7.112 382 HB VAL 49 HB VAL 49 9.078 3.372 -5.551 383 HG11 VAL 49 1HG1 VAL 49 7.074 2.147 -6.016 384 HG12 VAL 49 2HG1 VAL 49 7.825 0.632 -5.511 385 HG13 VAL 49 3HG1 VAL 49 7.492 1.892 -4.322 386 HG21 VAL 49 3HG2 VAL 49 9.847 2.258 -3.565 387 HG22 VAL 49 1HG2 VAL 49 10.166 0.777 -4.468 388 HG23 VAL 49 2HG2 VAL 49 11.138 2.217 -4.767 389 H VAL 50 H VAL 50 8.393 0.885 -8.918 390 HA VAL 50 HA VAL 50 7.425 3.493 -9.898 391 HB VAL 50 HB VAL 50 7.361 2.513 -12.160 392 HG11 VAL 50 1HG1 VAL 50 9.279 3.823 -11.595 393 HG12 VAL 50 2HG1 VAL 50 10.028 2.463 -10.756 394 HG13 VAL 50 3HG1 VAL 50 9.832 2.419 -12.508 395 HG21 VAL 50 3HG2 VAL 50 7.173 0.141 -11.331 396 HG22 VAL 50 1HG2 VAL 50 8.298 0.392 -12.665 397 HG23 VAL 50 2HG2 VAL 50 8.909 0.194 -11.023 398 H LEU 51 H LEU 51 5.288 3.713 -10.343 399 HA LEU 51 HA LEU 51 3.373 2.233 -9.082 400 HB2 LEU 51 1HB LEU 51 3.221 4.483 -10.361 401 HB3 LEU 51 2HB LEU 51 2.787 3.467 -11.747 402 HG LEU 51 HG LEU 51 1.238 3.083 -9.245 403 HD11 LEU 51 1HD1 LEU 51 1.191 5.566 -10.911 404 HD12 LEU 51 2HD1 LEU 51 1.118 5.393 -9.158 405 HD13 LEU 51 3HD1 LEU 51 -0.282 4.971 -10.144 406 HD21 LEU 51 3HD2 LEU 51 0.161 1.815 -10.725 407 HD22 LEU 51 1HD2 LEU 51 1.014 2.544 -12.085 408 HD23 LEU 51 2HD2 LEU 51 -0.433 3.316 -11.437 409 H GLU 52 H GLU 52 2.117 0.472 -9.513 410 HA GLU 52 HA GLU 52 2.905 -1.130 -11.852 411 HB2 GLU 52 1HB GLU 52 3.420 -2.196 -9.725 412 HB3 GLU 52 2HB GLU 52 1.739 -2.003 -9.203 413 HG2 GLU 52 1HG GLU 52 1.208 -3.953 -10.093 414 HG3 GLU 52 2HG GLU 52 1.723 -3.372 -11.683 415 H ASP 53 H ASP 53 0.139 -0.070 -9.924 416 HA ASP 53 HA ASP 53 -1.552 -0.039 -12.239 417 HB2 ASP 53 1HB ASP 53 -1.729 -2.258 -10.255 418 HB3 ASP 53 2HB ASP 53 -3.247 -1.567 -10.844 419 H GLU 54 H GLU 54 -3.790 0.691 -11.671 420 HA GLU 54 HA GLU 54 -4.060 1.971 -9.075 421 HB2 GLU 54 1HB GLU 54 -3.385 3.403 -11.542 422 HB3 GLU 54 2HB GLU 54 -4.821 4.039 -10.725 423 HG2 GLU 54 1HG GLU 54 -3.379 4.031 -8.597 424 HG3 GLU 54 2HG GLU 54 -2.013 3.867 -9.708 425 H LEU 55 H LEU 55 -6.003 1.338 -8.431 426 HA LEU 55 HA LEU 55 -8.178 1.224 -10.415 427 HB2 LEU 55 1HB LEU 55 -8.053 -0.266 -7.792 428 HB3 LEU 55 2HB LEU 55 -9.210 -0.491 -9.117 429 HG LEU 55 HG LEU 55 -6.315 -0.985 -9.639 430 HD11 LEU 55 1HD1 LEU 55 -8.130 -2.701 -7.988 431 HD12 LEU 55 2HD1 LEU 55 -6.448 -2.260 -7.701 432 HD13 LEU 55 3HD1 LEU 55 -6.852 -3.412 -8.974 433 HD21 LEU 55 3HD2 LEU 55 -8.953 -1.847 -10.730 434 HD22 LEU 55 1HD2 LEU 55 -7.548 -2.891 -10.941 435 HD23 LEU 55 2HD2 LEU 55 -7.527 -1.245 -11.574 436 H GLN 56 H GLN 56 -9.938 2.447 -10.105 437 HA GLN 56 HA GLN 56 -10.084 4.002 -7.613 438 HB2 GLN 56 1HB GLN 56 -10.995 4.577 -10.428 439 HB3 GLN 56 2HB GLN 56 -11.605 5.498 -9.044 440 HG2 GLN 56 1HG GLN 56 -9.886 6.849 -9.666 441 HG3 GLN 56 2HG GLN 56 -9.045 5.789 -8.526 442 HE21 GLN 56 2HE2 GLN 56 -6.637 5.290 -10.965 443 HE22 GLN 56 1HE2 GLN 56 -7.041 5.879 -9.393 444 H ASN 57 H ASN 57 -12.278 4.569 -6.858 445 HA ASN 57 HA ASN 57 -14.188 3.757 -5.881 446 HB2 ASN 57 1HB ASN 57 -15.745 2.852 -7.925 447 HB3 ASN 57 2HB ASN 57 -15.528 4.558 -7.520 448 HD21 ASN 57 2HD2 ASN 57 -13.473 5.301 -10.287 449 HD22 ASN 57 1HD2 ASN 57 -13.852 5.738 -8.658 450 H ILE 58 H ILE 58 -12.506 1.927 -5.248 451 HA ILE 58 HA ILE 58 -13.802 -0.627 -5.935 452 HB ILE 58 HB ILE 58 -11.876 -1.282 -6.853 453 HG12 ILE 58 1HG1 ILE 58 -11.826 -2.258 -4.489 454 HG13 ILE 58 2HG1 ILE 58 -10.305 -2.271 -5.396 455 HG21 ILE 58 1HG2 ILE 58 -10.796 1.213 -5.625 456 HG22 ILE 58 2HG2 ILE 58 -9.686 0.027 -6.309 457 HG23 ILE 58 3HG2 ILE 58 -10.926 0.762 -7.325 458 HD11 ILE 58 3HD1 ILE 58 -10.848 -1.117 -2.857 459 HD12 ILE 58 1HD1 ILE 58 -9.317 -1.219 -3.728 460 HD13 ILE 58 2HD1 ILE 58 -10.386 0.163 -3.979 461 H SER 59 H SER 59 -14.223 -2.002 -4.270 462 HA SER 59 HA SER 59 -14.081 -0.904 -1.608 463 HB2 SER 59 1HB SER 59 -15.623 -2.938 -2.983 464 HB3 SER 59 2HB SER 59 -15.002 -3.551 -1.440 465 HG SER 59 HG SER 59 -17.110 -2.222 -1.603 466 HA PRO 60 HA PRO 60 -10.661 -3.089 0.058 467 HB2 PRO 60 2HB PRO 60 -11.325 -2.438 2.160 468 HB3 PRO 60 1HB PRO 60 -11.601 -4.164 2.395 469 HG2 PRO 60 1HG PRO 60 -13.873 -4.004 1.940 470 HG3 PRO 60 2HG PRO 60 -13.572 -2.426 2.758 471 HD2 PRO 60 1HD PRO 60 -14.741 -2.612 0.315 472 HD3 PRO 60 2HD PRO 60 -13.684 -1.264 0.769 473 H GLU 61 H GLU 61 -13.290 -4.780 -1.103 474 HA GLU 61 HA GLU 61 -12.138 -7.408 -0.495 475 HB2 GLU 61 1HB GLU 61 -14.839 -6.403 -1.083 476 HB3 GLU 61 2HB GLU 61 -14.428 -7.915 -1.909 477 HG2 GLU 61 1HG GLU 61 -13.767 -8.869 0.303 478 HG3 GLU 61 2HG GLU 61 -14.403 -7.398 1.053 479 H GLU 62 H GLU 62 -12.610 -5.130 -3.051 480 HA GLU 62 HA GLU 62 -12.135 -7.005 -5.184 481 HB2 GLU 62 1HB GLU 62 -12.637 -4.087 -4.944 482 HB3 GLU 62 2HB GLU 62 -11.733 -4.626 -6.368 483 HG2 GLU 62 1HG GLU 62 -14.173 -6.165 -5.755 484 HG3 GLU 62 2HG GLU 62 -14.419 -4.483 -6.247 485 H LEU 63 H LEU 63 -10.270 -4.509 -3.502 486 HA LEU 63 HA LEU 63 -7.963 -4.528 -5.028 487 HB2 LEU 63 1HB LEU 63 -8.785 -3.395 -2.634 488 HB3 LEU 63 2HB LEU 63 -7.401 -4.405 -2.179 489 HG LEU 63 HG LEU 63 -7.485 -1.981 -3.926 490 HD11 LEU 63 1HD1 LEU 63 -6.763 -1.312 -1.883 491 HD12 LEU 63 2HD1 LEU 63 -5.215 -1.832 -2.546 492 HD13 LEU 63 3HD1 LEU 63 -6.113 -2.897 -1.466 493 HD21 LEU 63 3HD2 LEU 63 -5.893 -4.384 -4.396 494 HD22 LEU 63 1HD2 LEU 63 -4.931 -2.916 -4.224 495 HD23 LEU 63 2HD2 LEU 63 -6.201 -3.001 -5.446 496 H LYS 64 H LYS 64 -8.661 -6.511 -2.149 497 HA LYS 64 HA LYS 64 -6.328 -7.994 -2.085 498 HB2 LYS 64 1HB LYS 64 -7.498 -8.558 -0.248 499 HB3 LYS 64 2HB LYS 64 -9.055 -8.292 -1.049 500 HG2 LYS 64 1HG LYS 64 -9.226 -10.459 -1.782 501 HG3 LYS 64 2HG LYS 64 -7.470 -10.704 -1.774 502 HD2 LYS 64 1HD LYS 64 -7.663 -11.713 0.202 503 HD3 LYS 64 2HD LYS 64 -8.176 -10.161 0.887 504 HE2 LYS 64 1HE LYS 64 -10.082 -11.232 1.411 505 HE3 LYS 64 2HE LYS 64 -10.475 -11.024 -0.302 506 HZ1 LYS 64 3HZ LYS 64 -10.393 -13.203 -0.611 507 HZ2 LYS 64 1HZ LYS 64 -10.226 -13.403 1.061 508 HZ3 LYS 64 2HZ LYS 64 -8.852 -13.320 0.078 509 H LEU 65 H LEU 65 -9.222 -8.479 -4.038 510 HA LEU 65 HA LEU 65 -8.474 -11.002 -5.092 511 HB2 LEU 65 1HB LEU 65 -10.511 -8.934 -5.677 512 HB3 LEU 65 2HB LEU 65 -10.091 -10.032 -7.003 513 HG LEU 65 HG LEU 65 -10.813 -11.938 -5.752 514 HD11 LEU 65 1HD1 LEU 65 -11.929 -10.661 -3.428 515 HD12 LEU 65 2HD1 LEU 65 -10.190 -10.384 -3.518 516 HD13 LEU 65 3HD1 LEU 65 -10.822 -12.030 -3.535 517 HD21 LEU 65 3HD2 LEU 65 -12.656 -9.595 -5.859 518 HD22 LEU 65 1HD2 LEU 65 -13.206 -11.095 -5.112 519 HD23 LEU 65 2HD2 LEU 65 -12.677 -11.090 -6.795 520 H GLU 66 H GLU 66 -7.906 -7.682 -6.106 521 HA GLU 66 HA GLU 66 -6.804 -8.348 -8.649 522 HB2 GLU 66 1HB GLU 66 -6.537 -5.850 -6.960 523 HB3 GLU 66 2HB GLU 66 -5.983 -5.999 -8.634 524 HG2 GLU 66 1HG GLU 66 -8.845 -6.462 -7.827 525 HG3 GLU 66 2HG GLU 66 -8.215 -4.870 -8.271 526 H LEU 67 H LEU 67 -5.513 -7.989 -5.420 527 HA LEU 67 HA LEU 67 -2.773 -7.854 -6.145 528 HB2 LEU 67 1HB LEU 67 -4.186 -8.639 -3.598 529 HB3 LEU 67 2HB LEU 67 -2.421 -8.593 -3.749 530 HG LEU 67 HG LEU 67 -4.194 -6.199 -4.209 531 HD11 LEU 67 1HD1 LEU 67 -2.530 -6.398 -1.778 532 HD12 LEU 67 2HD1 LEU 67 -3.993 -7.381 -1.815 533 HD13 LEU 67 3HD1 LEU 67 -4.100 -5.633 -2.024 534 HD21 LEU 67 3HD2 LEU 67 -1.738 -6.488 -5.123 535 HD22 LEU 67 1HD2 LEU 67 -1.318 -6.076 -3.460 536 HD23 LEU 67 2HD2 LEU 67 -2.284 -4.962 -4.427 537 HA PRO 68 HA PRO 68 -1.791 -12.028 -7.092 538 HB2 PRO 68 2HB PRO 68 0.310 -11.277 -7.642 539 HB3 PRO 68 1HB PRO 68 0.795 -12.165 -6.198 540 HG2 PRO 68 1HG PRO 68 0.778 -10.268 -4.857 541 HG3 PRO 68 2HG PRO 68 1.332 -9.577 -6.428 542 HD2 PRO 68 1HD PRO 68 -0.795 -8.589 -5.062 543 HD3 PRO 68 2HD PRO 68 -0.716 -8.601 -6.831 544 H GLU 69 H GLU 69 -0.469 -13.946 -5.958 545 HA GLU 69 HA GLU 69 -1.683 -14.257 -3.297 546 HB2 GLU 69 1HB GLU 69 -1.512 -16.693 -3.697 547 HB3 GLU 69 2HB GLU 69 -2.510 -15.868 -4.905 548 HG2 GLU 69 1HG GLU 69 0.387 -16.328 -5.471 549 HG3 GLU 69 2HG GLU 69 -0.763 -17.664 -5.626 550 H ARG 70 H ARG 70 1.293 -14.484 -5.113 551 HA ARG 70 HA ARG 70 2.773 -14.638 -2.596 552 HB2 ARG 70 1HB ARG 70 3.535 -16.363 -4.955 553 HB3 ARG 70 2HB ARG 70 4.191 -16.409 -3.312 554 HG2 ARG 70 1HG ARG 70 1.299 -17.019 -3.852 555 HG3 ARG 70 2HG ARG 70 2.560 -18.252 -4.013 556 HD2 ARG 70 1HD ARG 70 3.235 -17.318 -1.601 557 HD3 ARG 70 2HD ARG 70 1.513 -16.913 -1.583 558 HE ARG 70 HE ARG 70 2.678 -19.549 -1.479 559 HH11 ARG 70 2HH1 ARG 70 -0.174 -17.671 -2.154 560 HH12 ARG 70 1HH1 ARG 70 -1.265 -18.990 -1.889 561 HH21 ARG 70 1HH2 ARG 70 -0.453 -21.051 -1.304 562 HH22 ARG 70 2HH2 ARG 70 1.252 -21.295 -1.127 563 H GLN 71 H GLN 71 2.504 -12.321 -3.850 564 HA GLN 71 HA GLN 71 5.174 -11.851 -4.942 565 HB2 GLN 71 1HB GLN 71 2.579 -11.318 -6.327 566 HB3 GLN 71 2HB GLN 71 3.914 -10.175 -6.551 567 HG2 GLN 71 1HG GLN 71 5.312 -11.828 -7.510 568 HG3 GLN 71 2HG GLN 71 4.209 -13.125 -7.025 569 HE21 GLN 71 2HE2 GLN 71 2.246 -12.947 -9.862 570 HE22 GLN 71 1HE2 GLN 71 2.620 -13.722 -8.364 571 HA PRO 72 HA PRO 72 4.634 -8.685 -1.816 572 HB2 PRO 72 2HB PRO 72 6.687 -9.325 -1.008 573 HB3 PRO 72 1HB PRO 72 7.251 -7.875 -1.837 574 HG2 PRO 72 1HG PRO 72 7.943 -9.048 -3.718 575 HG3 PRO 72 2HG PRO 72 8.298 -10.242 -2.413 576 HD2 PRO 72 1HD PRO 72 6.781 -10.848 -4.583 577 HD3 PRO 72 2HD PRO 72 6.485 -11.547 -2.983 578 H ARG 73 H ARG 73 4.112 -6.584 -2.009 579 HA ARG 73 HA ARG 73 5.375 -4.783 -3.807 580 HB2 ARG 73 1HB ARG 73 3.291 -4.319 -5.174 581 HB3 ARG 73 2HB ARG 73 4.152 -5.819 -5.551 582 HG2 ARG 73 1HG ARG 73 2.303 -6.558 -3.606 583 HG3 ARG 73 2HG ARG 73 1.434 -5.431 -4.663 584 HD2 ARG 73 1HD ARG 73 3.110 -7.548 -5.936 585 HD3 ARG 73 2HD ARG 73 1.572 -8.018 -5.201 586 HE ARG 73 HE ARG 73 0.819 -5.954 -6.722 587 HH11 ARG 73 2HH1 ARG 73 2.829 -8.710 -7.417 588 HH12 ARG 73 1HH1 ARG 73 2.399 -8.765 -9.094 589 HH21 ARG 73 1HH2 ARG 73 0.930 -7.232 -9.953 590 HH22 ARG 73 2HH2 ARG 73 0.246 -6.015 -8.928 591 H PHE 74 H PHE 74 4.116 -2.654 -3.901 592 HA PHE 74 HA PHE 74 3.078 -2.139 -1.213 593 HB2 PHE 74 1HB PHE 74 3.886 -0.131 -3.330 594 HB3 PHE 74 2HB PHE 74 3.587 0.189 -1.620 595 HD1 PHE 74 2HD PHE 74 5.043 -1.608 -0.085 596 HD2 PHE 74 1HD PHE 74 6.113 0.020 -3.869 597 HE1 PHE 74 2HE PHE 74 7.420 -1.987 0.428 598 HE2 PHE 74 1HE PHE 74 8.491 -0.357 -3.363 599 HZ PHE 74 HZ PHE 74 9.147 -1.361 -1.212 600 H VAL 75 H VAL 75 1.169 -0.940 -0.867 601 HA VAL 75 HA VAL 75 -0.562 -0.350 -3.113 602 HB VAL 75 HB VAL 75 -1.516 -2.297 -1.014 603 HG11 VAL 75 1HG1 VAL 75 -3.284 -2.585 -2.928 604 HG12 VAL 75 2HG1 VAL 75 -3.419 -1.258 -1.773 605 HG13 VAL 75 3HG1 VAL 75 -2.752 -0.966 -3.378 606 HG21 VAL 75 3HG2 VAL 75 -1.493 -3.959 -2.883 607 HG22 VAL 75 1HG2 VAL 75 -0.566 -2.795 -3.830 608 HG23 VAL 75 2HG2 VAL 75 0.106 -3.454 -2.339 609 H VAL 76 H VAL 76 -1.578 1.493 -2.693 610 HA VAL 76 HA VAL 76 -1.917 2.297 0.119 611 HB VAL 76 HB VAL 76 -1.571 3.947 -2.378 612 HG11 VAL 76 1HG1 VAL 76 -2.388 4.871 0.373 613 HG12 VAL 76 2HG1 VAL 76 -1.871 5.933 -0.938 614 HG13 VAL 76 3HG1 VAL 76 -3.344 4.978 -1.104 615 HG21 VAL 76 3HG2 VAL 76 0.469 4.559 -1.541 616 HG22 VAL 76 1HG2 VAL 76 -0.029 4.331 0.136 617 HG23 VAL 76 2HG2 VAL 76 0.346 2.933 -0.870 618 H TYR 77 H TYR 77 -3.924 1.584 0.642 619 HA TYR 77 HA TYR 77 -6.148 2.049 -1.184 620 HB2 TYR 77 1HB TYR 77 -5.868 -0.127 0.041 621 HB3 TYR 77 2HB TYR 77 -6.195 0.742 1.542 622 HD1 TYR 77 2HD TYR 77 -7.851 1.130 -1.770 623 HD2 TYR 77 1HD TYR 77 -8.242 -0.097 2.285 624 HE1 TYR 77 2HE TYR 77 -10.269 0.829 -2.100 625 HE2 TYR 77 1HE TYR 77 -10.661 -0.402 1.966 626 HH TYR 77 HH TYR 77 -12.238 0.478 -1.070 627 H SER 78 H SER 78 -7.673 3.573 -0.925 628 HA SER 78 HA SER 78 -7.478 5.290 1.463 629 HB2 SER 78 1HB SER 78 -6.802 6.424 -0.627 630 HB3 SER 78 2HB SER 78 -8.390 6.056 -1.322 631 HG SER 78 HG SER 78 -9.197 7.222 0.654 632 H TYR 79 H TYR 79 -9.027 4.411 2.755 633 HA TYR 79 HA TYR 79 -11.642 3.753 1.691 634 HB2 TYR 79 1HB TYR 79 -10.666 2.292 3.378 635 HB3 TYR 79 2HB TYR 79 -10.543 3.643 4.507 636 HD1 TYR 79 2HD TYR 79 -12.858 1.293 2.905 637 HD2 TYR 79 1HD TYR 79 -12.481 4.494 5.682 638 HE1 TYR 79 2HE TYR 79 -15.110 0.804 3.767 639 HE2 TYR 79 1HE TYR 79 -14.730 4.013 6.552 640 HH TYR 79 HH TYR 79 -16.716 1.408 5.173 641 H LYS 80 H LYS 80 -13.590 4.532 2.973 642 HA LYS 80 HA LYS 80 -13.290 7.397 3.595 643 HB2 LYS 80 1HB LYS 80 -14.427 7.048 1.446 644 HB3 LYS 80 2HB LYS 80 -15.631 6.030 2.254 645 HG2 LYS 80 1HG LYS 80 -16.255 8.001 3.662 646 HG3 LYS 80 2HG LYS 80 -15.185 8.980 2.642 647 HD2 LYS 80 1HD LYS 80 -16.535 8.085 0.654 648 HD3 LYS 80 2HD LYS 80 -17.712 7.547 1.866 649 HE2 LYS 80 1HE LYS 80 -18.491 9.625 2.209 650 HE3 LYS 80 2HE LYS 80 -16.860 10.309 2.250 651 HZ1 LYS 80 3HZ LYS 80 -16.892 10.046 -0.254 652 HZ2 LYS 80 1HZ LYS 80 -17.884 11.255 0.391 653 HZ3 LYS 80 2HZ LYS 80 -18.558 9.790 -0.116 654 H TYR 81 H TYR 81 -13.412 7.519 5.753 655 HA TYR 81 HA TYR 81 -15.413 5.899 7.159 656 HB2 TYR 81 1HB TYR 81 -12.780 6.322 7.740 657 HB3 TYR 81 2HB TYR 81 -13.555 7.547 8.748 658 HD1 TYR 81 1HD TYR 81 -15.711 6.629 10.067 659 HD2 TYR 81 2HD TYR 81 -12.444 4.255 8.729 660 HE1 TYR 81 1HE TYR 81 -16.258 4.932 11.761 661 HE2 TYR 81 2HE TYR 81 -12.982 2.551 10.419 662 HH TYR 81 HH TYR 81 -15.456 3.093 12.852 663 H VAL 82 H VAL 82 -17.159 6.780 8.081 664 HA VAL 82 HA VAL 82 -17.575 9.649 7.766 665 HB VAL 82 HB VAL 82 -19.586 7.656 8.798 666 HG11 VAL 82 1HG1 VAL 82 -19.637 10.469 7.861 667 HG12 VAL 82 2HG1 VAL 82 -21.021 9.448 7.462 668 HG13 VAL 82 3HG1 VAL 82 -20.555 9.685 9.148 669 HG21 VAL 82 3HG2 VAL 82 -18.478 7.125 6.504 670 HG22 VAL 82 1HG2 VAL 82 -20.234 7.068 6.659 671 HG23 VAL 82 2HG2 VAL 82 -19.459 8.471 5.924 672 H HIS 83 H HIS 83 -18.653 10.851 9.535 673 HA HIS 83 HA HIS 83 -17.411 10.162 12.101 674 HB2 HIS 83 1HB HIS 83 -18.440 12.767 10.968 675 HB3 HIS 83 2HB HIS 83 -17.964 12.583 12.659 676 HD1 HIS 83 1HD HIS 83 -15.694 13.442 13.053 677 HD2 HIS 83 2HD HIS 83 -16.047 11.730 9.284 678 HE1 HIS 83 1HE HIS 83 -13.422 13.669 11.996 679 HE2 HIS 83 2HE HIS 83 -13.637 12.622 9.692 680 H ASP 84 H ASP 84 -20.102 12.357 11.821 681 HA ASP 84 HA ASP 84 -22.188 10.583 12.471 682 HB2 ASP 84 1HB ASP 84 -20.676 10.565 14.585 683 HB3 ASP 84 2HB ASP 84 -21.351 12.174 14.880 684 H ASP 85 H ASP 85 -21.112 13.822 13.518 685 HA ASP 85 HA ASP 85 -23.595 15.067 13.399 686 HB2 ASP 85 1HB ASP 85 -21.110 15.854 14.136 687 HB3 ASP 85 2HB ASP 85 -21.269 16.712 12.597 688 H GLY 86 H GLY 86 -21.689 13.883 10.861 689 HA2 GLY 86 1HA GLY 86 -23.016 13.810 8.724 690 HA3 GLY 86 2HA GLY 86 -23.155 15.553 8.913 691 H ARG 87 H ARG 87 -20.162 14.364 9.946 692 HA ARG 87 HA ARG 87 -18.915 15.360 7.480 693 HB2 ARG 87 1HB ARG 87 -17.918 15.110 10.318 694 HB3 ARG 87 2HB ARG 87 -16.836 15.446 8.957 695 HG2 ARG 87 1HG ARG 87 -19.212 17.157 9.696 696 HG3 ARG 87 2HG ARG 87 -17.544 17.467 10.208 697 HD2 ARG 87 1HD ARG 87 -16.875 17.538 7.799 698 HD3 ARG 87 2HD ARG 87 -18.589 17.405 7.382 699 HE ARG 87 HE ARG 87 -17.992 19.586 9.162 700 HH11 ARG 87 2HH1 ARG 87 -18.203 18.559 5.843 701 HH12 ARG 87 1HH1 ARG 87 -18.440 20.161 5.226 702 HH21 ARG 87 1HH2 ARG 87 -18.497 21.947 6.661 703 HH22 ARG 87 2HH2 ARG 87 -18.304 21.699 8.363 704 H VAL 88 H VAL 88 -17.419 14.165 6.355 705 HA VAL 88 HA VAL 88 -16.757 11.484 7.329 706 HB VAL 88 HB VAL 88 -18.690 11.068 5.962 707 HG11 VAL 88 1HG1 VAL 88 -17.631 12.009 3.418 708 HG12 VAL 88 2HG1 VAL 88 -19.236 12.212 4.122 709 HG13 VAL 88 3HG1 VAL 88 -17.932 13.314 4.565 710 HG21 VAL 88 3HG2 VAL 88 -17.765 9.561 4.321 711 HG22 VAL 88 1HG2 VAL 88 -16.225 10.418 4.352 712 HG23 VAL 88 2HG2 VAL 88 -16.763 9.522 5.772 713 H SER 89 H SER 89 -14.703 10.935 6.934 714 HA SER 89 HA SER 89 -13.212 12.497 4.928 715 HB2 SER 89 1HB SER 89 -12.248 11.553 7.646 716 HB3 SER 89 2HB SER 89 -11.230 12.327 6.419 717 HG SER 89 HG SER 89 -12.714 14.140 6.546 718 H TYR 90 H TYR 90 -11.136 11.383 4.276 719 HA TYR 90 HA TYR 90 -11.617 8.485 4.033 720 HB2 TYR 90 1HB TYR 90 -9.921 9.946 2.051 721 HB3 TYR 90 2HB TYR 90 -10.934 8.518 1.828 722 HD1 TYR 90 1HD TYR 90 -13.394 8.749 1.584 723 HD2 TYR 90 2HD TYR 90 -10.827 12.140 1.701 724 HE1 TYR 90 1HE TYR 90 -15.192 10.134 0.634 725 HE2 TYR 90 2HE TYR 90 -12.617 13.535 0.754 726 HH TYR 90 HH TYR 90 -14.739 13.033 -0.751 727 HA PRO 91 HA PRO 91 -7.740 8.674 6.406 728 HB2 PRO 91 2HB PRO 91 -8.826 7.624 8.137 729 HB3 PRO 91 1HB PRO 91 -8.042 6.180 7.496 730 HG2 PRO 91 1HG PRO 91 -9.922 5.524 6.296 731 HG3 PRO 91 2HG PRO 91 -10.681 6.276 7.748 732 HD2 PRO 91 1HD PRO 91 -11.312 7.016 5.213 733 HD3 PRO 91 2HD PRO 91 -11.300 8.157 6.568 734 H LEU 92 H LEU 92 -6.353 8.596 4.625 735 HA LEU 92 HA LEU 92 -6.071 6.267 2.996 736 HB2 LEU 92 1HB LEU 92 -4.934 8.945 3.152 737 HB3 LEU 92 2HB LEU 92 -3.728 7.716 2.734 738 HG LEU 92 HG LEU 92 -5.997 7.251 1.106 739 HD11 LEU 92 1HD1 LEU 92 -6.899 9.343 1.161 740 HD12 LEU 92 2HD1 LEU 92 -5.700 9.574 -0.110 741 HD13 LEU 92 3HD1 LEU 92 -5.361 10.121 1.532 742 HD21 LEU 92 3HD2 LEU 92 -4.095 6.656 0.056 743 HD22 LEU 92 1HD2 LEU 92 -3.143 7.920 0.835 744 HD23 LEU 92 2HD2 LEU 92 -4.154 8.309 -0.557 745 H CYS 93 H CYS 93 -4.996 4.466 3.437 746 HA CYS 93 HA CYS 93 -2.862 4.562 5.466 747 HB2 CYS 93 1HB CYS 93 -4.906 2.387 4.987 748 HB3 CYS 93 2HB CYS 93 -3.523 2.235 6.085 749 HG CYS 93 HG CYS 93 -6.280 4.202 6.473 750 H PHE 94 H PHE 94 -1.161 3.001 5.221 751 HA PHE 94 HA PHE 94 -0.665 2.377 2.403 752 HB2 PHE 94 1HB PHE 94 1.010 3.722 3.673 753 HB3 PHE 94 2HB PHE 94 1.267 2.333 4.729 754 HD1 PHE 94 2HD PHE 94 1.485 3.387 1.178 755 HD2 PHE 94 1HD PHE 94 2.799 0.672 4.181 756 HE1 PHE 94 2HE PHE 94 3.176 2.497 -0.371 757 HE2 PHE 94 1HE PHE 94 4.493 -0.222 2.636 758 HZ PHE 94 HZ PHE 94 4.682 0.689 0.356 759 H ILE 95 H ILE 95 -1.471 0.432 1.888 760 HA ILE 95 HA ILE 95 -1.248 -1.785 3.771 761 HB ILE 95 HB ILE 95 -2.644 -1.587 1.103 762 HG12 ILE 95 1HG1 ILE 95 -3.678 -1.734 3.946 763 HG13 ILE 95 2HG1 ILE 95 -3.734 -0.317 2.883 764 HG21 ILE 95 1HG2 ILE 95 -2.262 -3.885 2.985 765 HG22 ILE 95 2HG2 ILE 95 -3.682 -3.792 1.943 766 HG23 ILE 95 3HG2 ILE 95 -2.069 -3.836 1.232 767 HD11 ILE 95 3HD1 ILE 95 -5.019 -2.156 1.362 768 HD12 ILE 95 1HD1 ILE 95 -5.494 -2.652 2.987 769 HD13 ILE 95 2HD1 ILE 95 -5.811 -1.005 2.438 770 H PHE 96 H PHE 96 0.615 -2.856 3.756 771 HA PHE 96 HA PHE 96 2.161 -3.083 1.297 772 HB2 PHE 96 1HB PHE 96 3.349 -2.458 3.339 773 HB3 PHE 96 2HB PHE 96 2.794 -3.935 4.129 774 HD1 PHE 96 1HD PHE 96 3.616 -4.325 0.663 775 HD2 PHE 96 2HD PHE 96 5.235 -4.323 4.599 776 HE1 PHE 96 1HE PHE 96 5.597 -5.533 -0.155 777 HE2 PHE 96 2HE PHE 96 7.219 -5.531 3.788 778 HZ PHE 96 HZ PHE 96 7.401 -6.137 1.408 779 H SER 97 H SER 97 1.509 -4.651 -0.032 780 HA SER 97 HA SER 97 0.306 -7.079 0.933 781 HB2 SER 97 1HB SER 97 -0.504 -6.136 -1.147 782 HB3 SER 97 2HB SER 97 1.123 -6.203 -1.847 783 HG SER 97 HG SER 97 0.547 -8.107 -2.513 784 H SER 98 H SER 98 1.825 -8.178 2.136 785 HA SER 98 HA SER 98 4.082 -9.283 0.600 786 HB2 SER 98 1HB SER 98 4.574 -7.516 2.498 787 HB3 SER 98 2HB SER 98 4.313 -8.909 3.562 788 HG SER 98 HG SER 98 6.393 -8.384 1.820 789 HA PRO 99 HA PRO 99 1.666 -12.897 1.878 790 HB2 PRO 99 2HB PRO 99 1.401 -13.398 -0.349 791 HB3 PRO 99 1HB PRO 99 2.709 -14.541 -0.047 792 HG2 PRO 99 1HG PRO 99 4.341 -13.100 -0.860 793 HG3 PRO 99 2HG PRO 99 2.949 -12.688 -1.931 794 HD2 PRO 99 1HD PRO 99 4.303 -10.818 -0.503 795 HD3 PRO 99 2HD PRO 99 2.566 -10.699 -0.829 796 H VAL 100 H VAL 100 2.773 -15.385 1.661 797 HA VAL 100 HA VAL 100 5.202 -15.209 3.324 798 HB VAL 100 HB VAL 100 2.836 -17.054 3.590 799 HG11 VAL 100 1HG1 VAL 100 4.092 -18.302 5.266 800 HG12 VAL 100 2HG1 VAL 100 4.878 -18.400 3.689 801 HG13 VAL 100 3HG1 VAL 100 5.523 -17.328 4.932 802 HG21 VAL 100 3HG2 VAL 100 2.653 -16.184 5.790 803 HG22 VAL 100 1HG2 VAL 100 4.227 -15.394 5.682 804 HG23 VAL 100 2HG2 VAL 100 2.872 -14.799 4.721 805 H GLY 101 H GLY 101 3.442 -17.006 0.860 806 HA2 GLY 101 1HA GLY 101 5.496 -18.989 0.522 807 HA3 GLY 101 2HA GLY 101 4.101 -18.743 -0.517 808 H CYS 102 H CYS 102 5.869 -15.905 0.034 809 HA CYS 102 HA CYS 102 6.771 -15.890 -2.716 810 HB2 CYS 102 1HB CYS 102 7.576 -13.560 -2.078 811 HB3 CYS 102 2HB CYS 102 5.828 -13.841 -2.032 812 HG CYS 102 HG CYS 102 7.247 -14.447 0.913 813 H LYS 103 H LYS 103 9.036 -14.624 -2.909 814 HA LYS 103 HA LYS 103 10.962 -16.391 -1.582 815 HB2 LYS 103 1HB LYS 103 11.633 -14.511 -3.830 816 HB3 LYS 103 2HB LYS 103 12.413 -16.036 -3.382 817 HG2 LYS 103 1HG LYS 103 11.165 -17.157 -4.827 818 HG3 LYS 103 2HG LYS 103 9.687 -16.547 -4.062 819 HD2 LYS 103 1HD LYS 103 9.714 -15.941 -6.417 820 HD3 LYS 103 2HD LYS 103 9.854 -14.491 -5.407 821 HE2 LYS 103 1HE LYS 103 11.646 -13.941 -6.625 822 HE3 LYS 103 2HE LYS 103 12.481 -15.272 -5.809 823 HZ1 LYS 103 3HZ LYS 103 12.522 -16.456 -7.674 824 HZ2 LYS 103 1HZ LYS 103 12.044 -15.054 -8.492 825 HZ3 LYS 103 2HZ LYS 103 10.885 -16.184 -7.999 826 HA PRO 104 HA PRO 104 12.537 -13.182 0.979 827 HB2 PRO 104 2HB PRO 104 13.695 -14.829 2.087 828 HB3 PRO 104 1HB PRO 104 15.100 -14.080 1.331 829 HG2 PRO 104 1HG PRO 104 15.153 -15.614 -0.414 830 HG3 PRO 104 2HG PRO 104 14.577 -16.652 0.943 831 HD2 PRO 104 1HD PRO 104 13.247 -16.454 -1.415 832 HD3 PRO 104 2HD PRO 104 12.418 -16.681 0.134 833 H GLU 105 H GLU 105 13.967 -13.918 -2.091 834 HA GLU 105 HA GLU 105 15.909 -11.842 -2.122 835 HB2 GLU 105 1HB GLU 105 14.662 -13.628 -4.176 836 HB3 GLU 105 2HB GLU 105 15.600 -12.224 -4.709 837 HG2 GLU 105 1HG GLU 105 16.653 -14.347 -2.843 838 HG3 GLU 105 2HG GLU 105 16.886 -14.351 -4.597 839 H GLN 106 H GLN 106 12.532 -12.057 -3.068 840 HA GLN 106 HA GLN 106 12.551 -9.370 -4.172 841 HB2 GLN 106 1HB GLN 106 10.077 -11.013 -3.715 842 HB3 GLN 106 2HB GLN 106 10.396 -9.803 -4.968 843 HG2 GLN 106 1HG GLN 106 11.841 -12.443 -4.840 844 HG3 GLN 106 2HG GLN 106 10.331 -12.202 -5.729 845 HE21 GLN 106 2HE2 GLN 106 11.923 -9.849 -8.022 846 HE22 GLN 106 1HE2 GLN 106 10.566 -9.879 -6.955 847 H GLN 107 H GLN 107 10.652 -11.050 -1.659 848 HA GLN 107 HA GLN 107 9.274 -9.085 -0.496 849 HB2 GLN 107 1HB GLN 107 10.214 -11.592 0.328 850 HB3 GLN 107 2HB GLN 107 10.688 -10.472 1.615 851 HG2 GLN 107 1HG GLN 107 7.942 -10.080 0.696 852 HG3 GLN 107 2HG GLN 107 8.249 -11.686 1.369 853 HE21 GLN 107 2HE2 GLN 107 8.924 -8.472 3.821 854 HE22 GLN 107 1HE2 GLN 107 9.338 -8.397 2.145 855 H MET 108 H MET 108 12.748 -9.595 -0.021 856 HA MET 108 HA MET 108 13.147 -7.541 1.858 857 HB2 MET 108 1HB MET 108 14.918 -9.029 -0.050 858 HB3 MET 108 2HB MET 108 15.555 -7.622 0.814 859 HG2 MET 108 1HG MET 108 14.554 -8.871 2.915 860 HG3 MET 108 2HG MET 108 14.735 -10.277 1.864 861 HE1 MET 108 3HE MET 108 17.878 -8.749 0.413 862 HE2 MET 108 1HE MET 108 18.404 -10.343 0.957 863 HE3 MET 108 2HE MET 108 16.814 -10.143 0.221 864 H MET 109 H MET 109 13.424 -7.563 -1.682 865 HA MET 109 HA MET 109 14.412 -5.058 -2.162 866 HB2 MET 109 1HB MET 109 12.320 -6.655 -3.635 867 HB3 MET 109 2HB MET 109 12.915 -5.103 -4.243 868 HG2 MET 109 1HG MET 109 15.142 -5.941 -4.463 869 HG3 MET 109 2HG MET 109 14.709 -7.430 -3.617 870 HE1 MET 109 3HE MET 109 14.216 -5.354 -6.965 871 HE2 MET 109 1HE MET 109 12.995 -6.347 -7.762 872 HE3 MET 109 2HE MET 109 12.605 -5.503 -6.263 873 H TYR 110 H TYR 110 11.158 -5.933 -1.177 874 HA TYR 110 HA TYR 110 10.272 -3.159 -1.377 875 HB2 TYR 110 1HB TYR 110 8.664 -5.526 -0.401 876 HB3 TYR 110 2HB TYR 110 8.059 -3.977 -0.991 877 HD1 TYR 110 1HD TYR 110 9.747 -7.095 -2.061 878 HD2 TYR 110 2HD TYR 110 7.657 -3.599 -3.290 879 HE1 TYR 110 1HE TYR 110 9.561 -8.014 -4.335 880 HE2 TYR 110 2HE TYR 110 7.462 -4.510 -5.566 881 HH TYR 110 HH TYR 110 9.254 -6.811 -6.786 882 H ALA 111 H ALA 111 10.966 -5.635 1.021 883 HA ALA 111 HA ALA 111 9.963 -4.299 3.283 884 HB1 ALA 111 3HB ALA 111 10.531 -6.220 4.231 885 HB2 ALA 111 1HB ALA 111 11.357 -6.702 2.748 886 HB3 ALA 111 2HB ALA 111 12.241 -5.844 4.011 887 H GLY 112 H GLY 112 12.833 -3.834 1.409 888 HA2 GLY 112 1HA GLY 112 14.087 -2.222 3.506 889 HA3 GLY 112 2HA GLY 112 14.827 -2.699 1.986 890 H SER 113 H SER 113 12.333 -1.858 0.535 891 HA SER 113 HA SER 113 13.020 0.988 0.401 892 HB2 SER 113 1HB SER 113 11.340 -0.573 -1.576 893 HB3 SER 113 2HB SER 113 12.152 0.983 -1.823 894 HG SER 113 HG SER 113 13.730 -1.206 -1.109 895 H LYS 114 H LYS 114 10.804 -0.908 1.890 896 HA LYS 114 HA LYS 114 8.314 0.191 1.393 897 HB2 LYS 114 1HB LYS 114 8.823 -1.773 2.869 898 HB3 LYS 114 2HB LYS 114 9.339 -0.625 4.115 899 HG2 LYS 114 1HG LYS 114 7.139 0.291 4.302 900 HG3 LYS 114 2HG LYS 114 6.587 -0.644 2.901 901 HD2 LYS 114 1HD LYS 114 5.810 -2.023 4.536 902 HD3 LYS 114 2HD LYS 114 7.457 -2.666 4.407 903 HE2 LYS 114 1HE LYS 114 8.193 -1.419 6.309 904 HE3 LYS 114 2HE LYS 114 6.689 -0.486 6.338 905 HZ1 LYS 114 3HZ LYS 114 6.592 -3.413 6.640 906 HZ2 LYS 114 1HZ LYS 114 5.504 -2.243 7.198 907 HZ3 LYS 114 2HZ LYS 114 6.997 -2.445 7.967 908 H ASN 115 H ASN 115 10.329 1.089 4.196 909 HA ASN 115 HA ASN 115 8.971 3.334 4.981 910 HB2 ASN 115 1HB ASN 115 11.801 2.435 5.204 911 HB3 ASN 115 2HB ASN 115 11.462 4.128 5.584 912 HD21 ASN 115 2HD2 ASN 115 10.783 1.368 8.317 913 HD22 ASN 115 1HD2 ASN 115 11.756 1.167 6.905 914 H ARG 116 H ARG 116 11.498 3.109 2.510 915 HA ARG 116 HA ARG 116 11.768 5.830 1.952 916 HB2 ARG 116 1HB ARG 116 13.381 4.333 1.065 917 HB3 ARG 116 2HB ARG 116 12.140 3.383 0.233 918 HG2 ARG 116 1HG ARG 116 13.331 4.687 -1.390 919 HG3 ARG 116 2HG ARG 116 11.686 5.325 -1.230 920 HD2 ARG 116 1HD ARG 116 12.749 7.316 -1.078 921 HD3 ARG 116 2HD ARG 116 12.947 6.830 0.611 922 HE ARG 116 HE ARG 116 15.006 6.893 -1.437 923 HH11 ARG 116 2HH1 ARG 116 14.068 5.928 1.773 924 HH12 ARG 116 1HH1 ARG 116 15.696 5.759 2.340 925 HH21 ARG 116 1HH2 ARG 116 17.451 6.184 0.930 926 HH22 ARG 116 2HH2 ARG 116 17.155 6.674 -0.704 927 H LEU 117 H LEU 117 9.689 3.411 0.369 928 HA LEU 117 HA LEU 117 8.445 5.206 -1.407 929 HB2 LEU 117 1HB LEU 117 8.440 2.752 -1.665 930 HB3 LEU 117 2HB LEU 117 7.358 2.635 -0.266 931 HG LEU 117 HG LEU 117 6.238 2.380 -2.484 932 HD11 LEU 117 1HD1 LEU 117 5.233 3.332 -0.268 933 HD12 LEU 117 2HD1 LEU 117 4.308 3.397 -1.766 934 HD13 LEU 117 3HD1 LEU 117 5.150 4.835 -1.187 935 HD21 LEU 117 3HD2 LEU 117 6.042 4.128 -3.996 936 HD22 LEU 117 1HD2 LEU 117 7.727 4.239 -3.488 937 HD23 LEU 117 2HD2 LEU 117 6.529 5.341 -2.811 938 H VAL 118 H VAL 118 7.261 3.836 1.666 939 HA VAL 118 HA VAL 118 4.856 5.190 1.831 940 HB VAL 118 HB VAL 118 6.730 4.300 4.018 941 HG11 VAL 118 1HG1 VAL 118 5.391 6.148 4.869 942 HG12 VAL 118 2HG1 VAL 118 3.918 5.359 4.302 943 HG13 VAL 118 3HG1 VAL 118 4.876 4.622 5.587 944 HG21 VAL 118 3HG2 VAL 118 4.525 2.769 4.226 945 HG22 VAL 118 1HG2 VAL 118 4.510 3.099 2.494 946 HG23 VAL 118 2HG2 VAL 118 5.920 2.342 3.235 947 H GLN 119 H GLN 119 7.976 6.187 3.244 948 HA GLN 119 HA GLN 119 7.222 8.591 4.348 949 HB2 GLN 119 1HB GLN 119 9.765 7.523 3.224 950 HB3 GLN 119 2HB GLN 119 9.680 9.260 3.557 951 HG2 GLN 119 1HG GLN 119 8.784 8.495 5.886 952 HG3 GLN 119 2HG GLN 119 9.560 6.965 5.454 953 HE21 GLN 119 2HE2 GLN 119 12.806 8.064 5.998 954 HE22 GLN 119 1HE2 GLN 119 11.757 6.808 5.446 955 H THR 120 H THR 120 7.979 7.868 0.988 956 HA THR 120 HA THR 120 8.040 10.519 0.036 957 HB THR 120 HB THR 120 7.139 8.142 -1.587 958 HG1 THR 120 1HG THR 120 9.279 7.614 -1.852 959 HG21 THR 120 3HG2 THR 120 7.045 9.789 -3.120 960 HG22 THR 120 1HG2 THR 120 8.802 9.652 -3.132 961 HG23 THR 120 2HG2 THR 120 8.021 10.887 -2.144 962 H ALA 121 H ALA 121 5.412 8.154 0.290 963 HA ALA 121 HA ALA 121 3.460 9.873 -0.904 964 HB1 ALA 121 3HB ALA 121 2.624 7.811 -1.150 965 HB2 ALA 121 1HB ALA 121 3.532 7.175 0.222 966 HB3 ALA 121 2HB ALA 121 2.010 8.026 0.488 967 H GLU 122 H GLU 122 4.698 9.397 2.297 968 HA GLU 122 HA GLU 122 4.394 10.625 4.201 969 HB2 GLU 122 1HB GLU 122 3.913 12.485 2.458 970 HB3 GLU 122 2HB GLU 122 2.215 12.212 2.877 971 HG2 GLU 122 1HG GLU 122 2.682 13.884 4.337 972 HG3 GLU 122 2HG GLU 122 3.134 12.492 5.332 973 H LEU 123 H LEU 123 3.325 8.270 4.305 974 HA LEU 123 HA LEU 123 0.534 8.602 5.182 975 HB2 LEU 123 1HB LEU 123 1.983 6.053 4.448 976 HB3 LEU 123 2HB LEU 123 0.266 6.218 4.854 977 HG LEU 123 HG LEU 123 1.373 7.697 2.504 978 HD11 LEU 123 1HD1 LEU 123 0.265 4.956 2.143 979 HD12 LEU 123 2HD1 LEU 123 1.969 5.148 2.557 980 HD13 LEU 123 3HD1 LEU 123 1.327 5.893 1.092 981 HD21 LEU 123 3HD2 LEU 123 -0.825 7.769 1.788 982 HD22 LEU 123 1HD2 LEU 123 -0.998 7.902 3.538 983 HD23 LEU 123 2HD2 LEU 123 -1.291 6.357 2.738 984 H THR 124 H THR 124 0.484 8.968 7.305 985 HA THR 124 HA THR 124 2.481 8.116 9.125 986 HB THR 124 HB THR 124 1.292 10.037 9.783 987 HG1 THR 124 1HG THR 124 -0.048 8.145 11.390 988 HG21 THR 124 3HG2 THR 124 -0.685 10.039 8.556 989 HG22 THR 124 1HG2 THR 124 -1.257 9.813 10.208 990 HG23 THR 124 2HG2 THR 124 -1.152 8.433 9.116 991 H LYS 125 H LYS 125 -0.366 6.627 7.873 992 HA LYS 125 HA LYS 125 -0.284 4.548 9.945 993 HB2 LYS 125 1HB LYS 125 -2.368 5.019 7.800 994 HB3 LYS 125 2HB LYS 125 -2.477 3.868 9.141 995 HG2 LYS 125 1HG LYS 125 -2.503 5.697 10.750 996 HG3 LYS 125 2HG LYS 125 -2.353 6.864 9.423 997 HD2 LYS 125 1HD LYS 125 -4.575 4.934 9.165 998 HD3 LYS 125 2HD LYS 125 -4.711 6.090 10.502 999 HE2 LYS 125 1HE LYS 125 -4.137 6.881 7.638 1000 HE3 LYS 125 2HE LYS 125 -5.752 6.852 8.361 1001 HZ1 LYS 125 3HZ LYS 125 -5.372 8.733 9.491 1002 HZ2 LYS 125 1HZ LYS 125 -4.135 8.985 8.363 1003 HZ3 LYS 125 2HZ LYS 125 -3.778 8.322 9.877 1004 H VAL 126 H VAL 126 0.927 2.839 9.494 1005 HA VAL 126 HA VAL 126 0.984 1.851 6.717 1006 HB VAL 126 HB VAL 126 3.283 1.664 8.666 1007 HG11 VAL 126 1HG1 VAL 126 4.040 1.417 5.939 1008 HG12 VAL 126 2HG1 VAL 126 4.147 0.214 7.226 1009 HG13 VAL 126 3HG1 VAL 126 2.690 0.323 6.238 1010 HG21 VAL 126 3HG2 VAL 126 2.794 4.005 7.970 1011 HG22 VAL 126 1HG2 VAL 126 4.369 3.417 7.437 1012 HG23 VAL 126 2HG2 VAL 126 3.030 3.510 6.294 1013 H PHE 127 H PHE 127 -0.172 0.038 6.679 1014 HA PHE 127 HA PHE 127 0.042 -1.821 8.950 1015 HB2 PHE 127 1HB PHE 127 -2.101 -1.716 6.811 1016 HB3 PHE 127 2HB PHE 127 -2.102 -2.734 8.253 1017 HD1 PHE 127 2HD PHE 127 -1.147 -0.743 10.269 1018 HD2 PHE 127 1HD PHE 127 -4.037 -0.432 7.159 1019 HE1 PHE 127 2HE PHE 127 -2.318 1.011 11.536 1020 HE2 PHE 127 1HE PHE 127 -5.211 1.324 8.420 1021 HZ PHE 127 HZ PHE 127 -4.352 2.046 10.613 1022 H GLU 128 H GLU 128 0.742 -3.873 8.656 1023 HA GLU 128 HA GLU 128 1.594 -4.599 5.933 1024 HB2 GLU 128 1HB GLU 128 3.363 -4.276 7.720 1025 HB3 GLU 128 2HB GLU 128 2.698 -5.716 8.509 1026 HG2 GLU 128 1HG GLU 128 3.105 -6.453 5.838 1027 HG3 GLU 128 2HG GLU 128 4.535 -5.525 6.311 1028 H ILE 129 H ILE 129 0.523 -6.193 4.990 1029 HA ILE 129 HA ILE 129 -1.075 -8.006 6.656 1030 HB ILE 129 HB ILE 129 -2.175 -8.612 4.462 1031 HG12 ILE 129 1HG1 ILE 129 -0.822 -6.085 3.492 1032 HG13 ILE 129 2HG1 ILE 129 -0.265 -7.713 3.073 1033 HG21 ILE 129 1HG2 ILE 129 -3.711 -6.873 4.626 1034 HG22 ILE 129 2HG2 ILE 129 -2.956 -6.898 6.218 1035 HG23 ILE 129 3HG2 ILE 129 -2.473 -5.686 5.032 1036 HD11 ILE 129 3HD1 ILE 129 -3.105 -7.038 2.542 1037 HD12 ILE 129 1HD1 ILE 129 -1.865 -6.369 1.482 1038 HD13 ILE 129 2HD1 ILE 129 -2.013 -8.116 1.672 1039 H ARG 130 H ARG 130 -0.668 -10.134 6.759 1040 HA ARG 130 HA ARG 130 1.769 -11.140 5.633 1041 HB2 ARG 130 1HB ARG 130 0.585 -11.715 7.904 1042 HB3 ARG 130 2HB ARG 130 -0.277 -12.905 6.918 1043 HG2 ARG 130 1HG ARG 130 1.509 -14.114 7.779 1044 HG3 ARG 130 2HG ARG 130 2.049 -13.669 6.152 1045 HD2 ARG 130 1HD ARG 130 3.898 -12.875 7.135 1046 HD3 ARG 130 2HD ARG 130 2.877 -11.534 7.673 1047 HE ARG 130 HE ARG 130 3.176 -12.286 9.795 1048 HH11 ARG 130 2HH1 ARG 130 3.493 -14.993 7.627 1049 HH12 ARG 130 1HH1 ARG 130 3.854 -16.127 8.886 1050 HH21 ARG 130 1HH2 ARG 130 3.941 -15.431 11.066 1051 HH22 ARG 130 2HH2 ARG 130 3.650 -13.770 11.462 1052 H THR 131 H THR 131 -1.538 -11.121 4.706 1053 HA THR 131 HA THR 131 -0.943 -12.370 2.203 1054 HB THR 131 HB THR 131 -1.180 -14.449 3.290 1055 HG1 THR 131 1HG THR 131 -2.511 -15.013 1.755 1056 HG21 THR 131 3HG2 THR 131 -3.814 -13.726 4.512 1057 HG22 THR 131 1HG2 THR 131 -2.316 -13.285 5.329 1058 HG23 THR 131 2HG2 THR 131 -2.667 -14.978 4.986 1059 H THR 132 H THR 132 -2.543 -12.028 0.660 1060 HA THR 132 HA THR 132 -4.071 -9.780 0.774 1061 HB THR 132 HB THR 132 -5.523 -10.842 -1.025 1062 HG1 THR 132 1HG THR 132 -5.417 -12.945 -1.133 1063 HG21 THR 132 3HG2 THR 132 -3.185 -9.653 -1.245 1064 HG22 THR 132 1HG2 THR 132 -3.924 -10.450 -2.634 1065 HG23 THR 132 2HG2 THR 132 -2.652 -11.265 -1.723 1066 H ASP 133 H ASP 133 -5.224 -13.083 1.434 1067 HA ASP 133 HA ASP 133 -7.855 -12.746 1.899 1068 HB2 ASP 133 1HB ASP 133 -5.775 -14.430 3.198 1069 HB3 ASP 133 2HB ASP 133 -7.339 -14.317 4.015 1070 H ASP 134 H ASP 134 -5.259 -11.536 3.902 1071 HA ASP 134 HA ASP 134 -6.758 -10.878 6.191 1072 HB2 ASP 134 1HB ASP 134 -4.134 -10.824 5.613 1073 HB3 ASP 134 2HB ASP 134 -4.502 -9.106 5.416 1074 H LEU 135 H LEU 135 -5.967 -9.004 3.286 1075 HA LEU 135 HA LEU 135 -7.122 -6.580 4.065 1076 HB2 LEU 135 1HB LEU 135 -5.722 -6.541 2.180 1077 HB3 LEU 135 2HB LEU 135 -6.625 -7.846 1.391 1078 HG LEU 135 HG LEU 135 -8.368 -6.406 0.754 1079 HD11 LEU 135 1HD1 LEU 135 -8.981 -5.102 2.520 1080 HD12 LEU 135 2HD1 LEU 135 -8.120 -3.903 1.555 1081 HD13 LEU 135 3HD1 LEU 135 -7.320 -4.671 2.925 1082 HD21 LEU 135 3HD2 LEU 135 -6.949 -4.312 -0.090 1083 HD22 LEU 135 1HD2 LEU 135 -6.812 -5.912 -0.820 1084 HD23 LEU 135 2HD2 LEU 135 -5.618 -5.379 0.364 1085 H THR 136 H THR 136 -9.097 -6.878 5.068 1086 HA THR 136 HA THR 136 -11.313 -7.549 3.254 1087 HB THR 136 HB THR 136 -12.437 -8.390 5.495 1088 HG1 THR 136 1HG THR 136 -10.928 -9.372 6.859 1089 HG21 THR 136 3HG2 THR 136 -10.453 -10.093 3.983 1090 HG22 THR 136 1HG2 THR 136 -12.084 -9.711 3.431 1091 HG23 THR 136 2HG2 THR 136 -11.850 -10.664 4.895 1092 H GLU 137 H GLU 137 -13.259 -6.445 3.624 1093 HA GLU 137 HA GLU 137 -13.242 -3.816 4.168 1094 HB2 GLU 137 1HB GLU 137 -15.211 -4.957 3.305 1095 HB3 GLU 137 2HB GLU 137 -15.472 -5.729 4.877 1096 HG2 GLU 137 1HG GLU 137 -15.428 -3.097 5.578 1097 HG3 GLU 137 2HG GLU 137 -16.159 -3.034 3.968 1098 H THR 138 H THR 138 -13.703 -6.355 6.595 1099 HA THR 138 HA THR 138 -13.980 -4.531 8.777 1100 HB THR 138 HB THR 138 -13.207 -7.445 8.961 1101 HG1 THR 138 1HG THR 138 -15.180 -6.954 7.689 1102 HG21 THR 138 3HG2 THR 138 -13.010 -6.578 11.098 1103 HG22 THR 138 1HG2 THR 138 -14.690 -7.114 11.084 1104 HG23 THR 138 2HG2 THR 138 -14.306 -5.408 10.856 1105 H TRP 139 H TRP 139 -11.396 -6.865 7.986 1106 HA TRP 139 HA TRP 139 -9.528 -6.150 9.842 1107 HB2 TRP 139 1HB TRP 139 -8.999 -7.996 8.491 1108 HB3 TRP 139 2HB TRP 139 -9.236 -7.083 7.000 1109 HD1 TRP 139 HD TRP 139 -6.555 -8.145 9.354 1110 HE1 TRP 139 1HE TRP 139 -4.311 -7.081 8.679 1111 HE3 TRP 139 3HE TRP 139 -8.266 -4.720 5.965 1112 HZ2 TRP 139 2HZ TRP 139 -3.388 -5.058 6.940 1113 HZ3 TRP 139 3HZ TRP 139 -6.638 -3.259 4.840 1114 HH2 TRP 139 HH TRP 139 -4.250 -3.425 5.320 1115 H LEU 140 H LEU 140 -10.631 -4.276 7.180 1116 HA LEU 140 HA LEU 140 -8.352 -2.475 7.234 1117 HB2 LEU 140 1HB LEU 140 -9.198 -2.821 5.072 1118 HB3 LEU 140 2HB LEU 140 -10.873 -2.623 5.616 1119 HG LEU 140 HG LEU 140 -9.719 -0.755 4.214 1120 HD11 LEU 140 1HD1 LEU 140 -11.903 -0.848 5.822 1121 HD12 LEU 140 2HD1 LEU 140 -11.440 0.539 4.835 1122 HD13 LEU 140 3HD1 LEU 140 -10.999 0.484 6.542 1123 HD21 LEU 140 3HD2 LEU 140 -7.852 -0.776 6.098 1124 HD22 LEU 140 1HD2 LEU 140 -8.960 0.371 6.853 1125 HD23 LEU 140 2HD2 LEU 140 -8.308 0.702 5.248 1126 H LYS 141 H LYS 141 -11.879 -2.047 7.583 1127 HA LYS 141 HA LYS 141 -11.775 0.514 8.686 1128 HB2 LYS 141 1HB LYS 141 -13.781 -1.654 8.499 1129 HB3 LYS 141 2HB LYS 141 -14.049 -0.465 9.784 1130 HG2 LYS 141 1HG LYS 141 -14.549 1.205 8.344 1131 HG3 LYS 141 2HG LYS 141 -13.413 0.622 7.115 1132 HD2 LYS 141 1HD LYS 141 -15.224 -0.082 5.997 1133 HD3 LYS 141 2HD LYS 141 -15.287 -1.387 7.195 1134 HE2 LYS 141 1HE LYS 141 -16.572 1.243 7.833 1135 HE3 LYS 141 2HE LYS 141 -17.388 0.115 6.740 1136 HZ1 LYS 141 3HZ LYS 141 -16.398 -1.146 9.123 1137 HZ2 LYS 141 1HZ LYS 141 -17.934 -1.222 8.419 1138 HZ3 LYS 141 2HZ LYS 141 -17.538 0.063 9.443 1139 H GLU 142 H GLU 142 -10.966 -2.500 10.062 1140 HA GLU 142 HA GLU 142 -11.502 -1.864 12.793 1141 HB2 GLU 142 1HB GLU 142 -9.994 -4.004 11.347 1142 HB3 GLU 142 2HB GLU 142 -9.710 -3.784 13.079 1143 HG2 GLU 142 1HG GLU 142 -12.371 -3.826 13.130 1144 HG3 GLU 142 2HG GLU 142 -12.108 -4.780 11.664 1145 H LYS 143 H LYS 143 -8.601 -1.774 10.756 1146 HA LYS 143 HA LYS 143 -6.822 -0.930 12.779 1147 HB2 LYS 143 1HB LYS 143 -6.663 -0.475 9.789 1148 HB3 LYS 143 2HB LYS 143 -5.321 -0.319 10.934 1149 HG2 LYS 143 1HG LYS 143 -6.653 -2.917 11.068 1150 HG3 LYS 143 2HG LYS 143 -5.933 -2.559 9.488 1151 HD2 LYS 143 1HD LYS 143 -3.918 -1.752 11.080 1152 HD3 LYS 143 2HD LYS 143 -4.635 -3.006 12.107 1153 HE2 LYS 143 1HE LYS 143 -4.403 -4.661 10.359 1154 HE3 LYS 143 2HE LYS 143 -3.846 -3.421 9.227 1155 HZ1 LYS 143 3HZ LYS 143 -1.867 -4.289 9.901 1156 HZ2 LYS 143 1HZ LYS 143 -2.415 -4.673 11.455 1157 HZ3 LYS 143 2HZ LYS 143 -2.032 -3.073 11.065 1158 H LEU 144 H LEU 144 -9.014 0.789 10.664 1159 HA LEU 144 HA LEU 144 -7.935 3.385 11.250 1160 HB2 LEU 144 1HB LEU 144 -10.701 2.895 10.193 1161 HB3 LEU 144 2HB LEU 144 -9.602 4.248 9.871 1162 HG LEU 144 HG LEU 144 -9.159 1.442 8.856 1163 HD11 LEU 144 1HD1 LEU 144 -11.221 2.431 7.936 1164 HD12 LEU 144 2HD1 LEU 144 -9.965 2.217 6.717 1165 HD13 LEU 144 3HD1 LEU 144 -10.284 3.818 7.382 1166 HD21 LEU 144 3HD2 LEU 144 -7.092 2.372 8.695 1167 HD22 LEU 144 1HD2 LEU 144 -7.714 4.022 8.645 1168 HD23 LEU 144 2HD2 LEU 144 -7.784 3.008 7.202 1169 H ALA 145 H ALA 145 -10.875 1.619 12.193 1170 HA ALA 145 HA ALA 145 -12.150 3.435 13.764 1171 HB1 ALA 145 3HB ALA 145 -13.425 1.650 14.083 1172 HB2 ALA 145 1HB ALA 145 -12.130 0.591 13.525 1173 HB3 ALA 145 2HB ALA 145 -12.239 1.028 15.230 1174 H SER 146 H SER 146 -9.758 1.115 15.051 1175 HA SER 146 HA SER 146 -8.319 2.983 16.557 1176 HB2 SER 146 1HB SER 146 -10.452 3.173 17.821 1177 HB3 SER 146 2HB SER 146 -10.346 1.444 18.199 1178 HG SER 146 HG SER 146 -8.173 3.108 18.813 1179 H GLY 147 H GLY 147 -7.660 0.840 14.945 1180 HA2 GLY 147 1HA GLY 147 -7.108 -1.541 16.389 1181 HA3 GLY 147 2HA GLY 147 -6.384 -1.070 14.858 1182 HA PRO 148 HA PRO 148 -3.128 -1.009 18.192 1183 HB2 PRO 148 2HB PRO 148 -2.609 -3.226 17.890 1184 HB3 PRO 148 1HB PRO 148 -1.341 -2.587 16.846 1185 HG2 PRO 148 1HG PRO 148 -2.582 -2.909 14.908 1186 HG3 PRO 148 2HG PRO 148 -3.118 -4.316 15.900 1187 HD2 PRO 148 1HD PRO 148 -4.862 -2.555 14.795 1188 HD3 PRO 148 2HD PRO 148 -5.159 -3.345 16.352 1189 H SER 149 H SER 149 -0.645 -0.620 17.680 1190 HA SER 149 HA SER 149 0.033 0.733 15.286 1191 HB2 SER 149 1HB SER 149 -1.400 2.506 16.036 1192 HB3 SER 149 2HB SER 149 -0.710 2.442 17.667 1193 HG SER 149 HG SER 149 0.448 3.427 15.296 1194 H SER 150 H SER 150 1.804 -0.682 15.561 1195 HA SER 150 HA SER 150 3.829 0.354 17.418 1196 HB2 SER 150 1HB SER 150 2.808 -2.449 17.194 1197 HB3 SER 150 2HB SER 150 4.535 -2.206 17.509 1198 HG SER 150 HG SER 150 3.530 -0.619 19.184 1199 H GLY 151 H GLY 151 4.810 1.413 15.669 1200 HA2 GLY 151 1HA GLY 151 6.501 -0.332 14.062 1201 HA3 GLY 151 2HA GLY 151 5.402 0.709 13.169 Start of MODEL 10 1 H1 GLY 1 H GLY 1 2.621 -4.285 11.812 2 HA2 GLY 1 1HA GLY 1 2.636 -3.924 14.098 3 HA3 GLY 1 2HA GLY 1 3.968 -5.063 14.232 4 H SER 2 H SER 2 6.006 -4.074 12.932 5 HA SER 2 HA SER 2 7.689 -2.542 12.966 6 HB2 SER 2 1HB SER 2 5.338 -1.055 12.430 7 HB3 SER 2 2HB SER 2 6.271 -0.127 13.618 8 HG SER 2 HG SER 2 6.805 0.253 11.346 9 H SER 3 H SER 3 8.717 -0.803 14.407 10 HA SER 3 HA SER 3 9.647 -0.374 16.444 11 HB2 SER 3 1HB SER 3 6.686 -0.273 16.993 12 HB3 SER 3 2HB SER 3 7.859 0.000 18.295 13 HG SER 3 HG SER 3 8.461 1.848 17.408 14 H GLY 4 H GLY 4 10.848 -2.134 16.981 15 HA2 GLY 4 1HA GLY 4 10.812 -3.553 19.139 16 HA3 GLY 4 2HA GLY 4 9.489 -4.373 18.323 17 H SER 5 H SER 5 10.071 -5.120 16.027 18 HA SER 5 HA SER 5 12.191 -6.968 16.231 19 HB2 SER 5 1HB SER 5 10.537 -6.041 13.869 20 HB3 SER 5 2HB SER 5 11.736 -7.341 13.765 21 HG SER 5 HG SER 5 10.376 -8.072 15.773 22 H SER 6 H SER 6 14.168 -7.086 15.137 23 HA SER 6 HA SER 6 15.132 -4.592 13.916 24 HB2 SER 6 1HB SER 6 16.450 -6.187 16.123 25 HB3 SER 6 2HB SER 6 17.351 -5.057 15.098 26 HG SER 6 HG SER 6 15.804 -3.435 15.774 27 H GLY 7 H GLY 7 17.116 -4.892 12.626 28 HA2 GLY 7 1HA GLY 7 17.439 -7.654 11.650 29 HA3 GLY 7 2HA GLY 7 17.149 -6.345 10.514 30 H SER 8 H SER 8 18.747 -4.358 11.647 31 HA SER 8 HA SER 8 20.874 -3.583 11.266 32 HB2 SER 8 1HB SER 8 21.478 -5.956 13.061 33 HB3 SER 8 2HB SER 8 22.533 -4.556 12.800 34 HG SER 8 HG SER 8 20.815 -3.249 13.662 35 H ASP 9 H ASP 9 20.074 -5.108 9.120 36 HA ASP 9 HA ASP 9 22.584 -6.455 8.369 37 HB2 ASP 9 1HB ASP 9 20.414 -7.895 8.726 38 HB3 ASP 9 2HB ASP 9 19.976 -7.261 7.135 39 H SER 10 H SER 10 21.151 -6.864 5.688 40 HA SER 10 HA SER 10 21.200 -4.118 4.674 41 HB2 SER 10 1HB SER 10 22.813 -6.370 3.434 42 HB3 SER 10 2HB SER 10 22.717 -4.697 2.857 43 HG SER 10 HG SER 10 24.600 -5.223 4.178 44 H LEU 11 H LEU 11 19.936 -3.766 2.874 45 HA LEU 11 HA LEU 11 18.511 -6.082 1.761 46 HB2 LEU 11 1HB LEU 11 17.236 -3.460 2.563 47 HB3 LEU 11 2HB LEU 11 16.421 -4.829 1.790 48 HG LEU 11 HG LEU 11 17.751 -5.223 4.436 49 HD11 LEU 11 1HD1 LEU 11 16.042 -4.301 5.663 50 HD12 LEU 11 2HD1 LEU 11 14.901 -4.351 4.320 51 HD13 LEU 11 3HD1 LEU 11 16.181 -3.137 4.346 52 HD21 LEU 11 3HD2 LEU 11 16.328 -7.033 4.634 53 HD22 LEU 11 1HD2 LEU 11 16.663 -7.017 2.904 54 HD23 LEU 11 2HD2 LEU 11 15.144 -6.361 3.513 55 H VAL 12 H VAL 12 17.060 -5.157 -0.164 56 HA VAL 12 HA VAL 12 18.960 -3.852 -1.953 57 HB VAL 12 HB VAL 12 16.275 -4.894 -2.798 58 HG11 VAL 12 1HG1 VAL 12 18.179 -5.528 -4.688 59 HG12 VAL 12 2HG1 VAL 12 17.086 -4.143 -4.737 60 HG13 VAL 12 3HG1 VAL 12 18.712 -3.962 -4.080 61 HG21 VAL 12 3HG2 VAL 12 17.437 -6.622 -1.410 62 HG22 VAL 12 1HG2 VAL 12 17.154 -7.098 -3.084 63 HG23 VAL 12 2HG2 VAL 12 18.761 -6.584 -2.574 64 H VAL 13 H VAL 13 17.778 -2.199 0.018 65 HA VAL 13 HA VAL 13 15.570 -0.768 -0.382 66 HB VAL 13 HB VAL 13 17.072 -0.006 1.284 67 HG11 VAL 13 1HG1 VAL 13 19.094 -0.644 -0.257 68 HG12 VAL 13 2HG1 VAL 13 19.045 1.070 -0.674 69 HG13 VAL 13 3HG1 VAL 13 19.275 0.574 1.004 70 HG21 VAL 13 3HG2 VAL 13 17.113 2.210 -0.749 71 HG22 VAL 13 1HG2 VAL 13 15.640 1.706 0.079 72 HG23 VAL 13 2HG2 VAL 13 17.000 2.338 1.007 73 H CYS 14 H CYS 14 14.769 0.844 -1.712 74 HA CYS 14 HA CYS 14 16.291 1.400 -4.168 75 HB2 CYS 14 1HB CYS 14 13.419 0.536 -3.894 76 HB3 CYS 14 2HB CYS 14 14.008 1.372 -5.340 77 HG CYS 14 HG CYS 14 14.414 -1.818 -4.436 78 H GLU 15 H GLU 15 14.829 3.166 -5.445 79 HA GLU 15 HA GLU 15 14.474 5.350 -3.506 80 HB2 GLU 15 1HB GLU 15 14.988 6.889 -5.325 81 HB3 GLU 15 2HB GLU 15 16.282 5.696 -5.133 82 HG2 GLU 15 1HG GLU 15 14.755 4.451 -6.982 83 HG3 GLU 15 2HG GLU 15 14.446 6.146 -7.382 84 H VAL 16 H VAL 16 12.832 6.972 -4.013 85 HA VAL 16 HA VAL 16 10.377 5.692 -4.883 86 HB VAL 16 HB VAL 16 10.210 6.968 -2.865 87 HG11 VAL 16 1HG1 VAL 16 12.000 8.733 -4.193 88 HG12 VAL 16 2HG1 VAL 16 10.568 9.648 -3.716 89 HG13 VAL 16 3HG1 VAL 16 11.485 8.748 -2.507 90 HG21 VAL 16 3HG2 VAL 16 8.207 7.845 -3.362 91 HG22 VAL 16 1HG2 VAL 16 8.886 8.958 -4.551 92 HG23 VAL 16 2HG2 VAL 16 8.537 7.290 -5.004 93 H ASP 17 H ASP 17 10.394 5.556 -7.088 94 HA ASP 17 HA ASP 17 11.366 7.110 -9.028 95 HB2 ASP 17 1HB ASP 17 9.879 5.078 -9.298 96 HB3 ASP 17 2HB ASP 17 8.497 6.170 -9.132 97 HA PRO 18 HA PRO 18 9.777 11.195 -8.577 98 HB2 PRO 18 2HB PRO 18 11.555 11.860 -9.870 99 HB3 PRO 18 1HB PRO 18 10.317 12.123 -11.097 100 HG2 PRO 18 1HG PRO 18 10.703 10.075 -12.124 101 HG3 PRO 18 2HG PRO 18 12.366 10.510 -11.580 102 HD2 PRO 18 1HD PRO 18 11.191 8.146 -10.951 103 HD3 PRO 18 2HD PRO 18 12.309 8.979 -9.858 104 H GLU 19 H GLU 19 8.740 9.155 -11.259 105 HA GLU 19 HA GLU 19 6.524 10.799 -12.001 106 HB2 GLU 19 1HB GLU 19 6.114 9.271 -13.653 107 HB3 GLU 19 2HB GLU 19 7.814 8.906 -13.324 108 HG2 GLU 19 1HG GLU 19 7.161 6.789 -13.125 109 HG3 GLU 19 2HG GLU 19 6.522 7.278 -11.549 110 H LEU 20 H LEU 20 7.057 8.299 -9.662 111 HA LEU 20 HA LEU 20 4.213 7.884 -9.210 112 HB2 LEU 20 1HB LEU 20 6.269 6.185 -9.037 113 HB3 LEU 20 2HB LEU 20 6.252 6.774 -7.366 114 HG LEU 20 HG LEU 20 3.884 5.520 -8.751 115 HD11 LEU 20 1HD1 LEU 20 5.524 4.214 -6.615 116 HD12 LEU 20 2HD1 LEU 20 5.965 4.061 -8.316 117 HD13 LEU 20 3HD1 LEU 20 4.394 3.487 -7.758 118 HD21 LEU 20 3HD2 LEU 20 3.196 6.987 -6.985 119 HD22 LEU 20 1HD2 LEU 20 4.410 6.321 -5.893 120 HD23 LEU 20 2HD2 LEU 20 3.050 5.325 -6.413 121 H LYS 21 H LYS 21 6.989 9.386 -7.645 122 HA LYS 21 HA LYS 21 6.074 9.930 -5.136 123 HB2 LYS 21 1HB LYS 21 8.292 10.593 -6.165 124 HB3 LYS 21 2HB LYS 21 7.460 12.002 -6.840 125 HG2 LYS 21 1HG LYS 21 6.737 12.210 -4.239 126 HG3 LYS 21 2HG LYS 21 8.338 11.464 -4.089 127 HD2 LYS 21 1HD LYS 21 8.308 13.619 -6.050 128 HD3 LYS 21 2HD LYS 21 7.813 14.159 -4.437 129 HE2 LYS 21 1HE LYS 21 9.944 12.639 -3.772 130 HE3 LYS 21 2HE LYS 21 10.431 13.177 -5.385 131 HZ1 LYS 21 3HZ LYS 21 11.226 14.728 -3.767 132 HZ2 LYS 21 1HZ LYS 21 9.683 14.917 -3.100 133 HZ3 LYS 21 2HZ LYS 21 10.005 15.480 -4.662 134 H GLU 22 H GLU 22 5.281 11.705 -8.100 135 HA GLU 22 HA GLU 22 3.715 13.701 -6.855 136 HB2 GLU 22 1HB GLU 22 3.354 12.682 -9.675 137 HB3 GLU 22 2HB GLU 22 2.988 14.296 -9.047 138 HG2 GLU 22 1HG GLU 22 5.580 14.286 -8.502 139 HG3 GLU 22 2HG GLU 22 5.592 13.108 -9.823 140 H THR 23 H THR 23 2.885 10.598 -8.349 141 HA THR 23 HA THR 23 0.151 10.683 -8.329 142 HB THR 23 HB THR 23 2.035 8.404 -7.789 143 HG1 THR 23 1HG THR 23 1.546 9.471 -9.949 144 HG21 THR 23 3HG2 THR 23 -0.915 8.471 -7.478 145 HG22 THR 23 1HG2 THR 23 0.285 7.464 -6.669 146 HG23 THR 23 2HG2 THR 23 -0.222 7.081 -8.315 147 H LEU 24 H LEU 24 2.214 9.618 -5.624 148 HA LEU 24 HA LEU 24 0.165 9.133 -3.790 149 HB2 LEU 24 1HB LEU 24 2.863 10.213 -3.007 150 HB3 LEU 24 2HB LEU 24 1.822 9.081 -2.125 151 HG LEU 24 HG LEU 24 3.385 8.483 -4.636 152 HD11 LEU 24 1HD1 LEU 24 3.931 6.848 -2.328 153 HD12 LEU 24 2HD1 LEU 24 4.203 8.553 -1.972 154 HD13 LEU 24 3HD1 LEU 24 5.037 7.792 -3.325 155 HD21 LEU 24 3HD2 LEU 24 2.419 6.418 -4.741 156 HD22 LEU 24 1HD2 LEU 24 1.053 7.346 -4.123 157 HD23 LEU 24 2HD2 LEU 24 2.036 6.384 -3.020 158 H ARG 25 H ARG 25 2.132 12.066 -4.249 159 HA ARG 25 HA ARG 25 0.975 13.628 -2.260 160 HB2 ARG 25 1HB ARG 25 3.013 14.267 -3.455 161 HB3 ARG 25 2HB ARG 25 2.074 14.511 -4.935 162 HG2 ARG 25 1HG ARG 25 0.725 16.224 -3.563 163 HG3 ARG 25 2HG ARG 25 2.091 16.155 -2.436 164 HD2 ARG 25 1HD ARG 25 3.209 17.596 -3.716 165 HD3 ARG 25 2HD ARG 25 3.183 16.405 -5.025 166 HE ARG 25 HE ARG 25 1.494 17.589 -6.045 167 HH11 ARG 25 2HH1 ARG 25 1.978 18.775 -2.808 168 HH12 ARG 25 1HH1 ARG 25 0.966 20.165 -3.027 169 HH21 ARG 25 1HH2 ARG 25 -0.068 20.527 -5.038 170 HH22 ARG 25 2HH2 ARG 25 0.160 19.414 -6.345 171 H LYS 26 H LYS 26 -0.156 12.850 -5.473 172 HA LYS 26 HA LYS 26 -2.274 14.813 -5.425 173 HB2 LYS 26 1HB LYS 26 -2.111 12.482 -7.324 174 HB3 LYS 26 2HB LYS 26 -2.818 14.083 -7.592 175 HG2 LYS 26 1HG LYS 26 -0.078 14.477 -7.003 176 HG3 LYS 26 2HG LYS 26 -0.193 13.169 -8.194 177 HD2 LYS 26 1HD LYS 26 -1.929 14.831 -9.324 178 HD3 LYS 26 2HD LYS 26 -0.977 16.029 -8.431 179 HE2 LYS 26 1HE LYS 26 0.716 15.894 -9.882 180 HE3 LYS 26 2HE LYS 26 0.744 14.129 -9.758 181 HZ1 LYS 26 3HZ LYS 26 -1.233 15.577 -11.424 182 HZ2 LYS 26 1HZ LYS 26 -0.859 13.928 -11.454 183 HZ3 LYS 26 2HZ LYS 26 0.262 15.059 -12.022 184 H PHE 27 H PHE 27 -1.912 11.361 -4.861 185 HA PHE 27 HA PHE 27 -4.631 10.672 -4.772 186 HB2 PHE 27 1HB PHE 27 -2.489 9.179 -4.762 187 HB3 PHE 27 2HB PHE 27 -2.594 9.346 -3.008 188 HD1 PHE 27 1HD PHE 27 -5.222 8.886 -5.613 189 HD2 PHE 27 2HD PHE 27 -3.347 7.372 -2.104 190 HE1 PHE 27 1HE PHE 27 -6.876 7.068 -5.517 191 HE2 PHE 27 2HE PHE 27 -4.997 5.551 -2.004 192 HZ PHE 27 HZ PHE 27 -6.764 5.395 -3.712 193 H ARG 28 H ARG 28 -2.505 12.108 -2.393 194 HA ARG 28 HA ARG 28 -4.325 11.771 -0.198 195 HB2 ARG 28 1HB ARG 28 -2.165 13.840 -0.179 196 HB3 ARG 28 2HB ARG 28 -2.710 12.767 1.120 197 HG2 ARG 28 1HG ARG 28 -1.718 10.996 -0.733 198 HG3 ARG 28 2HG ARG 28 -0.620 12.379 -0.868 199 HD2 ARG 28 1HD ARG 28 -1.348 10.960 1.706 200 HD3 ARG 28 2HD ARG 28 0.154 10.745 0.795 201 HE ARG 28 HE ARG 28 0.841 12.897 1.452 202 HH11 ARG 28 2HH1 ARG 28 -2.255 12.011 2.774 203 HH12 ARG 28 1HH1 ARG 28 -2.234 13.245 3.991 204 HH21 ARG 28 1HH2 ARG 28 -0.451 14.675 4.146 205 HH22 ARG 28 2HH2 ARG 28 0.880 14.525 3.049 206 H PHE 29 H PHE 29 -3.807 14.126 -2.683 207 HA PHE 29 HA PHE 29 -5.956 15.767 -1.523 208 HB2 PHE 29 1HB PHE 29 -3.887 17.123 -3.182 209 HB3 PHE 29 2HB PHE 29 -4.826 17.742 -1.822 210 HD1 PHE 29 2HD PHE 29 -4.294 16.185 0.424 211 HD2 PHE 29 1HD PHE 29 -1.631 17.155 -2.752 212 HE1 PHE 29 2HE PHE 29 -2.379 15.851 1.932 213 HE2 PHE 29 1HE PHE 29 0.288 16.821 -1.249 214 HZ PHE 29 HZ PHE 29 -0.084 16.169 1.097 215 H ARG 30 H ARG 30 -6.296 13.698 -3.394 216 HA ARG 30 HA ARG 30 -6.425 14.787 -6.047 217 HB2 ARG 30 1HB ARG 30 -7.593 12.688 -6.614 218 HB3 ARG 30 2HB ARG 30 -6.080 12.404 -5.740 219 HG2 ARG 30 1HG ARG 30 -7.622 12.347 -3.631 220 HG3 ARG 30 2HG ARG 30 -8.889 12.014 -4.825 221 HD2 ARG 30 1HD ARG 30 -6.654 10.372 -5.463 222 HD3 ARG 30 2HD ARG 30 -6.963 10.229 -3.726 223 HE ARG 30 HE ARG 30 -8.626 9.266 -5.863 224 HH11 ARG 30 2HH1 ARG 30 -8.544 10.282 -2.535 225 HH12 ARG 30 1HH1 ARG 30 -9.958 9.385 -2.091 226 HH21 ARG 30 1HH2 ARG 30 -11.062 8.132 -3.659 227 HH22 ARG 30 2HH2 ARG 30 -10.489 8.080 -5.292 228 H LYS 31 H LYS 31 -8.478 14.851 -7.285 229 HA LYS 31 HA LYS 31 -10.484 16.293 -5.750 230 HB2 LYS 31 1HB LYS 31 -10.297 15.807 -8.734 231 HB3 LYS 31 2HB LYS 31 -11.403 16.928 -7.924 232 HG2 LYS 31 1HG LYS 31 -9.813 18.423 -8.524 233 HG3 LYS 31 2HG LYS 31 -9.110 17.895 -6.985 234 HD2 LYS 31 1HD LYS 31 -7.257 17.440 -8.158 235 HD3 LYS 31 2HD LYS 31 -8.145 16.029 -8.759 236 HE2 LYS 31 1HE LYS 31 -7.810 16.863 -10.811 237 HE3 LYS 31 2HE LYS 31 -9.044 18.057 -10.387 238 HZ1 LYS 31 3HZ LYS 31 -6.734 18.829 -11.229 239 HZ2 LYS 31 1HZ LYS 31 -6.248 18.556 -9.631 240 HZ3 LYS 31 2HZ LYS 31 -7.483 19.664 -9.963 241 H GLU 32 H GLU 32 -10.178 13.355 -5.531 242 HA GLU 32 HA GLU 32 -12.750 12.458 -6.631 243 HB2 GLU 32 1HB GLU 32 -10.381 10.920 -5.549 244 HB3 GLU 32 2HB GLU 32 -11.917 10.168 -6.006 245 HG2 GLU 32 1HG GLU 32 -11.562 10.429 -8.240 246 HG3 GLU 32 2HG GLU 32 -10.579 11.883 -8.017 247 H THR 33 H THR 33 -13.882 10.800 -5.161 248 HA THR 33 HA THR 33 -13.632 11.370 -2.322 249 HB THR 33 HB THR 33 -16.064 11.901 -2.104 250 HG1 THR 33 1HG THR 33 -15.867 11.714 -4.893 251 HG21 THR 33 3HG2 THR 33 -15.860 14.250 -2.978 252 HG22 THR 33 1HG2 THR 33 -14.324 13.777 -3.703 253 HG23 THR 33 2HG2 THR 33 -14.528 13.723 -1.952 254 H ASN 34 H ASN 34 -13.275 9.032 -4.000 255 HA ASN 34 HA ASN 34 -15.279 7.287 -2.738 256 HB2 ASN 34 1HB ASN 34 -14.989 5.809 -4.834 257 HB3 ASN 34 2HB ASN 34 -16.001 7.252 -4.970 258 HD21 ASN 34 2HD2 ASN 34 -12.921 6.777 -7.416 259 HD22 ASN 34 1HD2 ASN 34 -13.590 5.540 -6.412 260 H ASN 35 H ASN 35 -14.428 4.866 -3.146 261 HA ASN 35 HA ASN 35 -11.870 4.781 -1.788 262 HB2 ASN 35 1HB ASN 35 -13.829 2.595 -2.543 263 HB3 ASN 35 2HB ASN 35 -12.347 2.334 -1.616 264 HD21 ASN 35 2HD2 ASN 35 -15.045 2.608 0.825 265 HD22 ASN 35 1HD2 ASN 35 -14.573 1.539 -0.448 266 H ALA 36 H ALA 36 -10.010 4.620 -2.834 267 HA ALA 36 HA ALA 36 -9.924 3.100 -5.352 268 HB1 ALA 36 3HB ALA 36 -9.944 5.479 -5.901 269 HB2 ALA 36 1HB ALA 36 -8.544 5.736 -4.859 270 HB3 ALA 36 2HB ALA 36 -8.394 4.743 -6.310 271 H ALA 37 H ALA 37 -7.679 2.456 -5.950 272 HA ALA 37 HA ALA 37 -5.889 2.193 -3.641 273 HB1 ALA 37 3HB ALA 37 -7.233 0.150 -3.726 274 HB2 ALA 37 1HB ALA 37 -6.727 -0.115 -5.394 275 HB3 ALA 37 2HB ALA 37 -5.539 -0.176 -4.091 276 H ILE 38 H ILE 38 -3.697 1.923 -4.153 277 HA ILE 38 HA ILE 38 -2.991 2.185 -6.995 278 HB ILE 38 HB ILE 38 -1.658 3.754 -4.789 279 HG12 ILE 38 1HG1 ILE 38 -3.793 4.526 -6.779 280 HG13 ILE 38 2HG1 ILE 38 -3.834 4.689 -5.015 281 HG21 ILE 38 1HG2 ILE 38 -0.684 4.998 -6.724 282 HG22 ILE 38 2HG2 ILE 38 -0.154 3.322 -6.593 283 HG23 ILE 38 3HG2 ILE 38 -1.372 3.770 -7.787 284 HD11 ILE 38 3HD1 ILE 38 -1.916 6.325 -5.257 285 HD12 ILE 38 1HD1 ILE 38 -2.271 6.321 -6.985 286 HD13 ILE 38 2HD1 ILE 38 -3.496 6.857 -5.834 287 H ILE 39 H ILE 39 -1.964 0.334 -7.419 288 HA ILE 39 HA ILE 39 -0.210 -0.862 -5.418 289 HB ILE 39 HB ILE 39 -0.972 -1.911 -8.145 290 HG12 ILE 39 1HG1 ILE 39 -2.008 -3.166 -5.667 291 HG13 ILE 39 2HG1 ILE 39 -2.694 -1.586 -6.086 292 HG21 ILE 39 1HG2 ILE 39 -0.234 -4.093 -7.087 293 HG22 ILE 39 2HG2 ILE 39 1.042 -2.946 -7.494 294 HG23 ILE 39 3HG2 ILE 39 0.506 -3.113 -5.822 295 HD11 ILE 39 3HD1 ILE 39 -2.590 -3.333 -8.385 296 HD12 ILE 39 1HD1 ILE 39 -3.512 -4.039 -7.057 297 HD13 ILE 39 2HD1 ILE 39 -3.951 -2.452 -7.692 298 H MET 40 H MET 40 1.896 -0.477 -5.399 299 HA MET 40 HA MET 40 3.186 0.412 -7.894 300 HB2 MET 40 1HB MET 40 4.254 0.959 -5.131 301 HB3 MET 40 2HB MET 40 4.648 1.780 -6.650 302 HG2 MET 40 1HG MET 40 2.815 3.125 -6.583 303 HG3 MET 40 2HG MET 40 1.838 1.919 -5.742 304 HE1 MET 40 3HE MET 40 0.838 3.407 -3.515 305 HE2 MET 40 1HE MET 40 1.383 1.730 -3.551 306 HE3 MET 40 2HE MET 40 1.872 2.788 -2.228 307 H LYS 41 H LYS 41 5.251 -0.384 -8.395 308 HA LYS 41 HA LYS 41 6.122 -2.722 -6.832 309 HB2 LYS 41 1HB LYS 41 6.610 -3.948 -8.837 310 HB3 LYS 41 2HB LYS 41 4.932 -3.390 -8.922 311 HG2 LYS 41 1HG LYS 41 5.302 -2.098 -10.719 312 HG3 LYS 41 2HG LYS 41 6.886 -1.567 -10.128 313 HD2 LYS 41 1HD LYS 41 7.994 -3.418 -11.007 314 HD3 LYS 41 2HD LYS 41 6.504 -4.372 -11.105 315 HE2 LYS 41 1HE LYS 41 5.720 -2.624 -12.828 316 HE3 LYS 41 2HE LYS 41 7.421 -2.142 -12.891 317 HZ1 LYS 41 3HZ LYS 41 6.149 -4.384 -14.089 318 HZ2 LYS 41 1HZ LYS 41 7.447 -4.877 -13.122 319 HZ3 LYS 41 2HZ LYS 41 7.696 -3.758 -14.365 320 H VAL 42 H VAL 42 8.416 -3.392 -7.539 321 HA VAL 42 HA VAL 42 10.041 -0.972 -7.980 322 HB VAL 42 HB VAL 42 10.531 -1.353 -5.770 323 HG11 VAL 42 1HG1 VAL 42 9.755 -4.132 -6.389 324 HG12 VAL 42 2HG1 VAL 42 10.948 -3.925 -5.104 325 HG13 VAL 42 3HG1 VAL 42 9.376 -3.131 -4.987 326 HG21 VAL 42 3HG2 VAL 42 12.716 -2.291 -5.614 327 HG22 VAL 42 1HG2 VAL 42 12.447 -3.304 -7.033 328 HG23 VAL 42 2HG2 VAL 42 12.576 -1.554 -7.211 329 H ASP 43 H ASP 43 10.892 -1.155 -9.950 330 HA ASP 43 HA ASP 43 11.348 -3.626 -11.266 331 HB2 ASP 43 1HB ASP 43 12.051 -0.762 -11.837 332 HB3 ASP 43 2HB ASP 43 12.744 -2.055 -12.823 333 H LYS 44 H LYS 44 12.875 -5.032 -10.736 334 HA LYS 44 HA LYS 44 15.082 -4.507 -9.103 335 HB2 LYS 44 1HB LYS 44 14.143 -6.751 -9.441 336 HB3 LYS 44 2HB LYS 44 14.722 -6.737 -11.115 337 HG2 LYS 44 1HG LYS 44 16.819 -6.197 -9.143 338 HG3 LYS 44 2HG LYS 44 16.063 -7.793 -8.987 339 HD2 LYS 44 1HD LYS 44 16.482 -8.217 -11.384 340 HD3 LYS 44 2HD LYS 44 17.291 -6.644 -11.494 341 HE2 LYS 44 1HE LYS 44 19.174 -7.380 -10.476 342 HE3 LYS 44 2HE LYS 44 18.271 -8.401 -9.348 343 HZ1 LYS 44 3HZ LYS 44 17.898 -9.956 -11.243 344 HZ2 LYS 44 1HZ LYS 44 19.514 -9.818 -10.760 345 HZ3 LYS 44 2HZ LYS 44 18.979 -9.030 -12.158 346 H ASP 45 H ASP 45 14.601 -3.911 -12.437 347 HA ASP 45 HA ASP 45 17.393 -3.906 -13.156 348 HB2 ASP 45 1HB ASP 45 16.673 -3.748 -15.288 349 HB3 ASP 45 2HB ASP 45 15.088 -4.129 -14.600 350 H ARG 46 H ARG 46 14.931 -1.510 -12.345 351 HA ARG 46 HA ARG 46 16.946 0.614 -12.528 352 HB2 ARG 46 1HB ARG 46 13.930 0.711 -12.312 353 HB3 ARG 46 2HB ARG 46 14.969 2.143 -12.274 354 HG2 ARG 46 1HG ARG 46 15.686 1.813 -14.511 355 HG3 ARG 46 2HG ARG 46 14.962 0.197 -14.563 356 HD2 ARG 46 1HD ARG 46 13.043 1.051 -15.302 357 HD3 ARG 46 2HD ARG 46 12.929 2.046 -13.843 358 HE ARG 46 HE ARG 46 14.681 3.380 -15.480 359 HH11 ARG 46 2HH1 ARG 46 11.392 2.260 -15.715 360 HH12 ARG 46 1HH1 ARG 46 10.901 3.526 -16.792 361 HH21 ARG 46 1HH2 ARG 46 12.412 5.112 -17.464 362 HH22 ARG 46 2HH2 ARG 46 14.046 5.051 -16.897 363 H GLN 47 H GLN 47 15.763 -1.480 -10.292 364 HA GLN 47 HA GLN 47 15.509 -1.484 -8.013 365 HB2 GLN 47 1HB GLN 47 17.846 0.430 -8.124 366 HB3 GLN 47 2HB GLN 47 17.455 -0.729 -6.843 367 HG2 GLN 47 1HG GLN 47 17.719 -2.152 -9.301 368 HG3 GLN 47 2HG GLN 47 19.124 -1.098 -9.088 369 HE21 GLN 47 2HE2 GLN 47 18.547 -4.320 -6.687 370 HE22 GLN 47 1HE2 GLN 47 17.326 -3.771 -7.780 371 H MET 48 H MET 48 13.776 0.362 -9.192 372 HA MET 48 HA MET 48 13.605 2.354 -7.043 373 HB2 MET 48 1HB MET 48 13.351 4.154 -8.429 374 HB3 MET 48 2HB MET 48 14.436 3.172 -9.425 375 HG2 MET 48 1HG MET 48 12.137 2.217 -10.347 376 HG3 MET 48 2HG MET 48 11.565 3.794 -9.800 377 HE1 MET 48 3HE MET 48 14.486 5.907 -11.395 378 HE2 MET 48 1HE MET 48 12.778 6.348 -11.363 379 HE3 MET 48 2HE MET 48 13.528 5.622 -9.941 380 H VAL 49 H VAL 49 11.491 3.001 -6.488 381 HA VAL 49 HA VAL 49 9.496 0.976 -6.978 382 HB VAL 49 HB VAL 49 9.164 3.538 -5.418 383 HG11 VAL 49 1HG1 VAL 49 7.049 2.594 -5.788 384 HG12 VAL 49 2HG1 VAL 49 7.647 0.950 -5.556 385 HG13 VAL 49 3HG1 VAL 49 7.508 2.042 -4.178 386 HG21 VAL 49 3HG2 VAL 49 10.155 0.850 -4.473 387 HG22 VAL 49 1HG2 VAL 49 11.084 2.347 -4.545 388 HG23 VAL 49 2HG2 VAL 49 9.730 2.202 -3.424 389 H VAL 50 H VAL 50 8.483 1.045 -8.888 390 HA VAL 50 HA VAL 50 7.452 3.647 -9.816 391 HB VAL 50 HB VAL 50 7.433 2.697 -12.094 392 HG11 VAL 50 1HG1 VAL 50 9.953 2.585 -12.358 393 HG12 VAL 50 2HG1 VAL 50 9.308 4.034 -11.585 394 HG13 VAL 50 3HG1 VAL 50 10.044 2.765 -10.606 395 HG21 VAL 50 3HG2 VAL 50 8.394 0.601 -12.620 396 HG22 VAL 50 1HG2 VAL 50 9.032 0.402 -10.987 397 HG23 VAL 50 2HG2 VAL 50 7.294 0.307 -11.274 398 H LEU 51 H LEU 51 5.318 3.841 -10.292 399 HA LEU 51 HA LEU 51 3.394 2.362 -9.078 400 HB2 LEU 51 1HB LEU 51 3.247 4.565 -10.443 401 HB3 LEU 51 2HB LEU 51 2.860 3.491 -11.799 402 HG LEU 51 HG LEU 51 1.250 3.132 -9.343 403 HD11 LEU 51 1HD1 LEU 51 1.412 5.683 -10.821 404 HD12 LEU 51 2HD1 LEU 51 0.923 5.359 -9.158 405 HD13 LEU 51 3HD1 LEU 51 -0.206 5.069 -10.480 406 HD21 LEU 51 3HD2 LEU 51 1.132 2.508 -12.132 407 HD22 LEU 51 1HD2 LEU 51 -0.291 3.449 -11.677 408 HD23 LEU 51 2HD2 LEU 51 0.089 1.954 -10.821 409 H GLU 52 H GLU 52 1.956 0.708 -9.668 410 HA GLU 52 HA GLU 52 2.905 -1.002 -11.875 411 HB2 GLU 52 1HB GLU 52 3.337 -1.925 -9.604 412 HB3 GLU 52 2HB GLU 52 1.590 -1.906 -9.307 413 HG2 GLU 52 1HG GLU 52 2.609 -4.123 -9.988 414 HG3 GLU 52 2HG GLU 52 1.183 -3.583 -10.887 415 H ASP 53 H ASP 53 0.065 -0.061 -9.966 416 HA ASP 53 HA ASP 53 -1.577 -0.010 -12.324 417 HB2 ASP 53 1HB ASP 53 -1.692 -2.286 -10.418 418 HB3 ASP 53 2HB ASP 53 -3.243 -1.610 -10.934 419 H GLU 54 H GLU 54 -3.831 0.672 -11.803 420 HA GLU 54 HA GLU 54 -4.174 1.907 -9.188 421 HB2 GLU 54 1HB GLU 54 -3.530 3.373 -11.640 422 HB3 GLU 54 2HB GLU 54 -5.004 3.949 -10.845 423 HG2 GLU 54 1HG GLU 54 -3.655 4.072 -8.704 424 HG3 GLU 54 2HG GLU 54 -2.225 3.822 -9.717 425 H LEU 55 H LEU 55 -6.090 1.172 -8.562 426 HA LEU 55 HA LEU 55 -8.253 1.003 -10.555 427 HB2 LEU 55 1HB LEU 55 -8.096 -0.506 -7.948 428 HB3 LEU 55 2HB LEU 55 -9.217 -0.772 -9.295 429 HG LEU 55 HG LEU 55 -6.265 -1.170 -9.653 430 HD11 LEU 55 1HD1 LEU 55 -6.722 -2.549 -7.780 431 HD12 LEU 55 2HD1 LEU 55 -6.730 -3.599 -9.196 432 HD13 LEU 55 3HD1 LEU 55 -8.254 -3.092 -8.466 433 HD21 LEU 55 3HD2 LEU 55 -8.771 -1.892 -11.090 434 HD22 LEU 55 1HD2 LEU 55 -7.380 -2.969 -11.214 435 HD23 LEU 55 2HD2 LEU 55 -7.238 -1.286 -11.721 436 H GLN 56 H GLN 56 -10.007 2.223 -10.267 437 HA GLN 56 HA GLN 56 -10.251 3.698 -7.736 438 HB2 GLN 56 1HB GLN 56 -11.093 4.323 -10.559 439 HB3 GLN 56 2HB GLN 56 -11.791 5.182 -9.177 440 HG2 GLN 56 1HG GLN 56 -10.101 6.612 -9.698 441 HG3 GLN 56 2HG GLN 56 -9.271 5.557 -8.546 442 HE21 GLN 56 2HE2 GLN 56 -6.743 5.234 -10.897 443 HE22 GLN 56 1HE2 GLN 56 -7.237 5.791 -9.338 444 H ASN 57 H ASN 57 -12.441 4.156 -6.962 445 HA ASN 57 HA ASN 57 -14.383 3.329 -6.089 446 HB2 ASN 57 1HB ASN 57 -15.841 2.326 -8.150 447 HB3 ASN 57 2HB ASN 57 -15.679 4.052 -7.801 448 HD21 ASN 57 2HD2 ASN 57 -13.559 4.750 -10.529 449 HD22 ASN 57 1HD2 ASN 57 -13.999 5.234 -8.930 450 H ILE 58 H ILE 58 -12.553 1.569 -5.458 451 HA ILE 58 HA ILE 58 -13.777 -1.041 -6.066 452 HB ILE 58 HB ILE 58 -11.828 -1.611 -7.005 453 HG12 ILE 58 1HG1 ILE 58 -11.781 -2.610 -4.645 454 HG13 ILE 58 2HG1 ILE 58 -10.258 -2.593 -5.548 455 HG21 ILE 58 1HG2 ILE 58 -9.673 -0.264 -6.432 456 HG22 ILE 58 2HG2 ILE 58 -10.926 0.466 -7.434 457 HG23 ILE 58 3HG2 ILE 58 -10.808 0.886 -5.725 458 HD11 ILE 58 3HD1 ILE 58 -9.276 -1.503 -3.902 459 HD12 ILE 58 1HD1 ILE 58 -10.420 -0.174 -4.085 460 HD13 ILE 58 2HD1 ILE 58 -10.787 -1.510 -2.994 461 H SER 59 H SER 59 -14.185 -2.366 -4.370 462 HA SER 59 HA SER 59 -14.001 -1.214 -1.725 463 HB2 SER 59 1HB SER 59 -15.628 -3.197 -3.043 464 HB3 SER 59 2HB SER 59 -14.954 -3.868 -1.548 465 HG SER 59 HG SER 59 -16.712 -2.845 -0.834 466 HA PRO 60 HA PRO 60 -10.580 -3.422 -0.090 467 HB2 PRO 60 2HB PRO 60 -11.180 -2.701 2.007 468 HB3 PRO 60 1HB PRO 60 -11.487 -4.412 2.297 469 HG2 PRO 60 1HG PRO 60 -13.766 -4.216 1.889 470 HG3 PRO 60 2HG PRO 60 -13.412 -2.623 2.657 471 HD2 PRO 60 1HD PRO 60 -14.642 -2.847 0.247 472 HD3 PRO 60 2HD PRO 60 -13.545 -1.513 0.640 473 H GLU 61 H GLU 61 -13.176 -5.063 -1.277 474 HA GLU 61 HA GLU 61 -12.133 -7.711 -0.554 475 HB2 GLU 61 1HB GLU 61 -14.789 -6.642 -1.194 476 HB3 GLU 61 2HB GLU 61 -14.414 -8.163 -2.018 477 HG2 GLU 61 1HG GLU 61 -13.674 -8.965 0.345 478 HG3 GLU 61 2HG GLU 61 -14.671 -7.612 0.901 479 H GLU 62 H GLU 62 -12.458 -5.478 -3.166 480 HA GLU 62 HA GLU 62 -11.942 -7.450 -5.221 481 HB2 GLU 62 1HB GLU 62 -12.589 -4.560 -5.123 482 HB3 GLU 62 2HB GLU 62 -11.597 -5.092 -6.489 483 HG2 GLU 62 1HG GLU 62 -14.228 -6.358 -5.741 484 HG3 GLU 62 2HG GLU 62 -14.054 -5.051 -6.921 485 H LEU 63 H LEU 63 -10.205 -4.797 -3.645 486 HA LEU 63 HA LEU 63 -7.872 -4.796 -5.122 487 HB2 LEU 63 1HB LEU 63 -8.773 -3.569 -2.823 488 HB3 LEU 63 2HB LEU 63 -7.405 -4.541 -2.254 489 HG LEU 63 HG LEU 63 -7.425 -2.205 -4.113 490 HD11 LEU 63 1HD1 LEU 63 -5.856 -3.061 -1.699 491 HD12 LEU 63 2HD1 LEU 63 -6.914 -1.662 -1.881 492 HD13 LEU 63 3HD1 LEU 63 -5.366 -1.710 -2.723 493 HD21 LEU 63 3HD2 LEU 63 -6.055 -3.244 -5.535 494 HD22 LEU 63 1HD2 LEU 63 -5.842 -4.621 -4.453 495 HD23 LEU 63 2HD2 LEU 63 -4.851 -3.176 -4.247 496 H LYS 64 H LYS 64 -8.607 -6.740 -2.234 497 HA LYS 64 HA LYS 64 -6.208 -8.109 -2.019 498 HB2 LYS 64 1HB LYS 64 -7.393 -8.759 -0.235 499 HB3 LYS 64 2HB LYS 64 -8.933 -8.445 -1.052 500 HG2 LYS 64 1HG LYS 64 -9.092 -10.597 -1.897 501 HG3 LYS 64 2HG LYS 64 -7.352 -10.889 -1.726 502 HD2 LYS 64 1HD LYS 64 -7.737 -11.882 0.229 503 HD3 LYS 64 2HD LYS 64 -8.321 -10.332 0.859 504 HE2 LYS 64 1HE LYS 64 -10.524 -11.085 -0.467 505 HE3 LYS 64 2HE LYS 64 -9.843 -12.680 -0.119 506 HZ1 LYS 64 3HZ LYS 64 -11.240 -12.161 1.677 507 HZ2 LYS 64 1HZ LYS 64 -10.636 -10.586 1.818 508 HZ3 LYS 64 2HZ LYS 64 -9.672 -11.905 2.256 509 H LEU 65 H LEU 65 -8.983 -8.764 -4.092 510 HA LEU 65 HA LEU 65 -8.040 -11.267 -5.058 511 HB2 LEU 65 1HB LEU 65 -10.010 -9.312 -6.258 512 HB3 LEU 65 2HB LEU 65 -9.742 -10.971 -6.820 513 HG LEU 65 HG LEU 65 -10.804 -10.211 -4.099 514 HD11 LEU 65 1HD1 LEU 65 -12.556 -9.697 -5.515 515 HD12 LEU 65 2HD1 LEU 65 -12.874 -11.387 -5.128 516 HD13 LEU 65 3HD1 LEU 65 -12.131 -10.961 -6.670 517 HD21 LEU 65 3HD2 LEU 65 -10.591 -12.902 -5.443 518 HD22 LEU 65 1HD2 LEU 65 -11.266 -12.575 -3.848 519 HD23 LEU 65 2HD2 LEU 65 -9.546 -12.325 -4.145 520 H GLU 66 H GLU 66 -7.821 -7.941 -6.243 521 HA GLU 66 HA GLU 66 -6.605 -8.540 -8.714 522 HB2 GLU 66 1HB GLU 66 -6.368 -6.033 -7.034 523 HB3 GLU 66 2HB GLU 66 -5.949 -6.173 -8.748 524 HG2 GLU 66 1HG GLU 66 -8.709 -6.560 -7.587 525 HG3 GLU 66 2HG GLU 66 -8.124 -5.104 -8.404 526 H LEU 67 H LEU 67 -5.352 -8.234 -5.481 527 HA LEU 67 HA LEU 67 -2.602 -8.015 -6.267 528 HB2 LEU 67 1HB LEU 67 -3.948 -8.627 -3.636 529 HB3 LEU 67 2HB LEU 67 -2.189 -8.529 -3.834 530 HG LEU 67 HG LEU 67 -4.042 -6.239 -4.467 531 HD11 LEU 67 1HD1 LEU 67 -3.939 -5.463 -2.332 532 HD12 LEU 67 2HD1 LEU 67 -2.409 -6.272 -1.990 533 HD13 LEU 67 3HD1 LEU 67 -3.912 -7.196 -2.000 534 HD21 LEU 67 3HD2 LEU 67 -1.197 -5.937 -3.676 535 HD22 LEU 67 1HD2 LEU 67 -2.174 -4.979 -4.790 536 HD23 LEU 67 2HD2 LEU 67 -1.541 -6.546 -5.296 537 HA PRO 68 HA PRO 68 -1.682 -12.258 -6.963 538 HB2 PRO 68 2HB PRO 68 0.319 -11.534 -7.830 539 HB3 PRO 68 1HB PRO 68 0.992 -12.255 -6.368 540 HG2 PRO 68 1HG PRO 68 1.074 -10.226 -5.238 541 HG3 PRO 68 2HG PRO 68 1.423 -9.697 -6.927 542 HD2 PRO 68 1HD PRO 68 -0.561 -8.607 -5.430 543 HD3 PRO 68 2HD PRO 68 -0.686 -8.805 -7.186 544 H GLU 69 H GLU 69 -0.046 -13.954 -5.762 545 HA GLU 69 HA GLU 69 -0.807 -13.927 -2.915 546 HB2 GLU 69 1HB GLU 69 -0.775 -16.510 -3.215 547 HB3 GLU 69 2HB GLU 69 -2.190 -15.591 -3.752 548 HG2 GLU 69 1HG GLU 69 -0.033 -16.067 -5.738 549 HG3 GLU 69 2HG GLU 69 -1.039 -17.441 -5.260 550 H ARG 70 H ARG 70 1.674 -14.138 -5.195 551 HA ARG 70 HA ARG 70 3.587 -14.810 -3.084 552 HB2 ARG 70 1HB ARG 70 3.434 -16.108 -5.808 553 HB3 ARG 70 2HB ARG 70 4.879 -16.168 -4.787 554 HG2 ARG 70 1HG ARG 70 4.056 -17.805 -3.524 555 HG3 ARG 70 2HG ARG 70 2.499 -16.978 -3.347 556 HD2 ARG 70 1HD ARG 70 1.526 -18.264 -4.899 557 HD3 ARG 70 2HD ARG 70 2.859 -17.999 -6.031 558 HE ARG 70 HE ARG 70 2.434 -20.301 -4.428 559 HH11 ARG 70 2HH1 ARG 70 4.939 -18.271 -5.741 560 HH12 ARG 70 1HH1 ARG 70 6.128 -19.531 -5.764 561 HH21 ARG 70 1HH2 ARG 70 5.587 -21.633 -5.034 562 HH22 ARG 70 2HH2 ARG 70 3.990 -21.968 -4.455 563 H GLN 71 H GLN 71 2.631 -12.450 -4.839 564 HA GLN 71 HA GLN 71 5.314 -11.617 -5.726 565 HB2 GLN 71 1HB GLN 71 2.768 -11.588 -7.091 566 HB3 GLN 71 2HB GLN 71 3.418 -9.948 -6.955 567 HG2 GLN 71 1HG GLN 71 5.616 -10.962 -7.838 568 HG3 GLN 71 2HG GLN 71 4.601 -12.323 -8.335 569 HE21 GLN 71 2HE2 GLN 71 2.615 -9.928 -10.412 570 HE22 GLN 71 1HE2 GLN 71 2.283 -10.819 -8.969 571 HA PRO 72 HA PRO 72 4.575 -8.781 -2.288 572 HB2 PRO 72 2HB PRO 72 6.556 -9.520 -1.387 573 HB3 PRO 72 1HB PRO 72 7.197 -8.023 -2.062 574 HG2 PRO 72 1HG PRO 72 8.007 -9.068 -3.973 575 HG3 PRO 72 2HG PRO 72 8.249 -10.362 -2.741 576 HD2 PRO 72 1HD PRO 72 6.883 -10.774 -5.051 577 HD3 PRO 72 2HD PRO 72 6.463 -11.585 -3.533 578 H ARG 73 H ARG 73 4.114 -6.655 -2.347 579 HA ARG 73 HA ARG 73 5.522 -4.759 -3.923 580 HB2 ARG 73 1HB ARG 73 3.487 -4.148 -5.347 581 HB3 ARG 73 2HB ARG 73 4.412 -5.579 -5.827 582 HG2 ARG 73 1HG ARG 73 2.498 -6.591 -4.097 583 HG3 ARG 73 2HG ARG 73 1.638 -5.353 -5.029 584 HD2 ARG 73 1HD ARG 73 3.418 -7.250 -6.497 585 HD3 ARG 73 2HD ARG 73 1.858 -7.835 -5.904 586 HE ARG 73 HE ARG 73 1.174 -5.565 -7.177 587 HH11 ARG 73 2HH1 ARG 73 3.113 -8.300 -8.113 588 HH12 ARG 73 1HH1 ARG 73 2.722 -8.167 -9.796 589 HH21 ARG 73 1HH2 ARG 73 1.323 -6.505 -10.522 590 HH22 ARG 73 2HH2 ARG 73 0.651 -5.378 -9.390 591 H PHE 74 H PHE 74 4.277 -2.604 -3.956 592 HA PHE 74 HA PHE 74 3.119 -2.250 -1.292 593 HB2 PHE 74 1HB PHE 74 4.064 -0.140 -3.249 594 HB3 PHE 74 2HB PHE 74 3.637 0.109 -1.555 595 HD1 PHE 74 2HD PHE 74 4.962 -2.054 -0.167 596 HD2 PHE 74 1HD PHE 74 6.328 0.306 -3.435 597 HE1 PHE 74 2HE PHE 74 7.290 -2.474 0.508 598 HE2 PHE 74 1HE PHE 74 8.659 -0.112 -2.767 599 HZ PHE 74 HZ PHE 74 9.143 -1.502 -0.793 600 H VAL 75 H VAL 75 1.213 -1.027 -0.963 601 HA VAL 75 HA VAL 75 -0.417 -0.314 -3.253 602 HB VAL 75 HB VAL 75 -1.414 -2.380 -1.287 603 HG11 VAL 75 1HG1 VAL 75 -3.420 -1.628 -1.900 604 HG12 VAL 75 2HG1 VAL 75 -2.733 -0.614 -3.170 605 HG13 VAL 75 3HG1 VAL 75 -3.086 -2.312 -3.491 606 HG21 VAL 75 3HG2 VAL 75 -1.445 -3.889 -3.257 607 HG22 VAL 75 1HG2 VAL 75 -0.584 -2.651 -4.172 608 HG23 VAL 75 2HG2 VAL 75 0.179 -3.405 -2.772 609 H VAL 76 H VAL 76 -1.579 1.447 -2.809 610 HA VAL 76 HA VAL 76 -1.926 2.196 0.020 611 HB VAL 76 HB VAL 76 -1.677 3.940 -2.432 612 HG11 VAL 76 1HG1 VAL 76 -2.374 4.681 0.405 613 HG12 VAL 76 2HG1 VAL 76 -1.849 5.838 -0.819 614 HG13 VAL 76 3HG1 VAL 76 -3.349 4.937 -1.042 615 HG21 VAL 76 3HG2 VAL 76 0.302 2.844 -0.963 616 HG22 VAL 76 1HG2 VAL 76 0.433 4.403 -1.778 617 HG23 VAL 76 2HG2 VAL 76 0.032 4.336 -0.062 618 H TYR 77 H TYR 77 -3.921 1.468 0.540 619 HA TYR 77 HA TYR 77 -6.146 1.899 -1.297 620 HB2 TYR 77 1HB TYR 77 -5.818 -0.284 -0.089 621 HB3 TYR 77 2HB TYR 77 -6.187 0.563 1.415 622 HD1 TYR 77 1HD TYR 77 -7.818 0.990 -1.901 623 HD2 TYR 77 2HD TYR 77 -8.212 -0.381 2.108 624 HE1 TYR 77 1HE TYR 77 -10.223 0.633 -2.266 625 HE2 TYR 77 2HE TYR 77 -10.619 -0.744 1.753 626 HH TYR 77 HH TYR 77 -12.222 0.304 -1.178 627 H SER 78 H SER 78 -7.669 3.418 -1.047 628 HA SER 78 HA SER 78 -7.541 5.088 1.378 629 HB2 SER 78 1HB SER 78 -6.846 6.229 -0.730 630 HB3 SER 78 2HB SER 78 -8.464 5.922 -1.383 631 HG SER 78 HG SER 78 -8.157 8.032 -0.386 632 H TYR 79 H TYR 79 -9.098 4.136 2.617 633 HA TYR 79 HA TYR 79 -11.699 3.524 1.482 634 HB2 TYR 79 1HB TYR 79 -10.878 1.918 3.042 635 HB3 TYR 79 2HB TYR 79 -10.512 3.168 4.234 636 HD1 TYR 79 2HD TYR 79 -13.282 1.363 2.582 637 HD2 TYR 79 1HD TYR 79 -12.153 3.963 5.755 638 HE1 TYR 79 2HE TYR 79 -15.494 1.057 3.612 639 HE2 TYR 79 1HE TYR 79 -14.363 3.664 6.793 640 HH TYR 79 HH TYR 79 -16.658 1.319 5.587 641 H LYS 80 H LYS 80 -13.668 4.242 2.720 642 HA LYS 80 HA LYS 80 -13.380 7.075 3.478 643 HB2 LYS 80 1HB LYS 80 -14.606 6.715 1.364 644 HB3 LYS 80 2HB LYS 80 -15.773 5.705 2.233 645 HG2 LYS 80 1HG LYS 80 -16.433 7.620 3.605 646 HG3 LYS 80 2HG LYS 80 -15.267 8.632 2.735 647 HD2 LYS 80 1HD LYS 80 -17.037 9.139 1.431 648 HD3 LYS 80 2HD LYS 80 -16.659 7.588 0.661 649 HE2 LYS 80 1HE LYS 80 -18.658 6.795 1.240 650 HE3 LYS 80 2HE LYS 80 -18.254 7.052 2.945 651 HZ1 LYS 80 3HZ LYS 80 -20.229 8.252 2.483 652 HZ2 LYS 80 1HZ LYS 80 -19.562 8.976 1.106 653 HZ3 LYS 80 2HZ LYS 80 -18.993 9.397 2.643 654 H TYR 81 H TYR 81 -13.579 7.333 5.599 655 HA TYR 81 HA TYR 81 -15.423 5.577 7.072 656 HB2 TYR 81 1HB TYR 81 -12.791 6.039 7.574 657 HB3 TYR 81 2HB TYR 81 -13.536 7.274 8.590 658 HD1 TYR 81 2HD TYR 81 -15.783 6.236 9.839 659 HD2 TYR 81 1HD TYR 81 -12.262 4.115 8.741 660 HE1 TYR 81 2HE TYR 81 -16.256 4.563 11.579 661 HE2 TYR 81 1HE TYR 81 -12.728 2.435 10.477 662 HH TYR 81 HH TYR 81 -14.402 2.747 12.938 663 H VAL 82 H VAL 82 -17.215 6.406 7.920 664 HA VAL 82 HA VAL 82 -17.649 9.286 7.748 665 HB VAL 82 HB VAL 82 -19.586 7.067 8.427 666 HG11 VAL 82 1HG1 VAL 82 -21.298 8.842 7.945 667 HG12 VAL 82 2HG1 VAL 82 -20.371 9.078 9.428 668 HG13 VAL 82 3HG1 VAL 82 -19.986 10.019 7.986 669 HG21 VAL 82 3HG2 VAL 82 -19.994 8.539 5.948 670 HG22 VAL 82 1HG2 VAL 82 -18.466 7.658 5.982 671 HG23 VAL 82 2HG2 VAL 82 -19.985 6.801 6.243 672 H HIS 83 H HIS 83 -18.686 10.430 9.532 673 HA HIS 83 HA HIS 83 -17.558 9.581 12.099 674 HB2 HIS 83 1HB HIS 83 -18.570 12.248 11.094 675 HB3 HIS 83 2HB HIS 83 -18.111 11.964 12.776 676 HD1 HIS 83 1HD HIS 83 -15.794 12.617 13.298 677 HD2 HIS 83 2HD HIS 83 -16.211 11.498 9.319 678 HE1 HIS 83 1HE HIS 83 -13.527 12.955 12.264 679 HE2 HIS 83 2HE HIS 83 -13.781 12.270 9.832 680 H ASP 84 H ASP 84 -20.231 11.800 11.887 681 HA ASP 84 HA ASP 84 -22.343 10.002 12.361 682 HB2 ASP 84 1HB ASP 84 -21.148 9.595 14.477 683 HB3 ASP 84 2HB ASP 84 -21.233 11.322 14.847 684 H ASP 85 H ASP 85 -21.234 13.172 13.567 685 HA ASP 85 HA ASP 85 -23.709 14.449 13.518 686 HB2 ASP 85 1HB ASP 85 -21.033 15.754 12.963 687 HB3 ASP 85 2HB ASP 85 -22.487 16.531 13.605 688 H GLY 86 H GLY 86 -21.776 13.399 10.925 689 HA2 GLY 86 1HA GLY 86 -23.099 13.428 8.782 690 HA3 GLY 86 2HA GLY 86 -23.245 15.157 9.061 691 H ARG 87 H ARG 87 -20.252 13.893 10.032 692 HA ARG 87 HA ARG 87 -19.002 15.000 7.613 693 HB2 ARG 87 1HB ARG 87 -17.962 14.657 10.432 694 HB3 ARG 87 2HB ARG 87 -16.948 15.154 9.068 695 HG2 ARG 87 1HG ARG 87 -19.407 16.654 9.966 696 HG3 ARG 87 2HG ARG 87 -17.758 17.027 10.495 697 HD2 ARG 87 1HD ARG 87 -17.177 17.964 8.515 698 HD3 ARG 87 2HD ARG 87 -18.127 16.798 7.583 699 HE ARG 87 HE ARG 87 -19.903 18.249 7.623 700 HH11 ARG 87 2HH1 ARG 87 -17.525 19.266 9.953 701 HH12 ARG 87 1HH1 ARG 87 -18.303 20.780 10.279 702 HH21 ARG 87 1HH2 ARG 87 -20.243 21.332 9.191 703 HH22 ARG 87 2HH2 ARG 87 -20.936 20.238 8.042 704 H VAL 88 H VAL 88 -17.640 13.803 6.388 705 HA VAL 88 HA VAL 88 -16.898 11.123 7.334 706 HB VAL 88 HB VAL 88 -18.807 10.715 5.944 707 HG11 VAL 88 1HG1 VAL 88 -19.290 11.734 3.961 708 HG12 VAL 88 2HG1 VAL 88 -18.357 13.022 4.725 709 HG13 VAL 88 3HG1 VAL 88 -17.595 11.965 3.536 710 HG21 VAL 88 3HG2 VAL 88 -16.602 9.380 5.660 711 HG22 VAL 88 1HG2 VAL 88 -17.906 9.143 4.497 712 HG23 VAL 88 2HG2 VAL 88 -16.528 10.163 4.082 713 H SER 89 H SER 89 -14.815 10.679 7.031 714 HA SER 89 HA SER 89 -13.328 12.251 5.029 715 HB2 SER 89 1HB SER 89 -12.429 11.361 7.785 716 HB3 SER 89 2HB SER 89 -11.359 12.079 6.569 717 HG SER 89 HG SER 89 -12.227 13.993 6.897 718 H TYR 90 H TYR 90 -11.419 11.210 4.151 719 HA TYR 90 HA TYR 90 -11.766 8.292 4.001 720 HB2 TYR 90 1HB TYR 90 -10.133 9.858 2.030 721 HB3 TYR 90 2HB TYR 90 -11.012 8.344 1.800 722 HD1 TYR 90 1HD TYR 90 -13.434 8.331 1.421 723 HD2 TYR 90 2HD TYR 90 -11.278 11.981 1.789 724 HE1 TYR 90 1HE TYR 90 -15.341 9.548 0.456 725 HE2 TYR 90 2HE TYR 90 -13.180 13.208 0.828 726 HH TYR 90 HH TYR 90 -16.256 11.668 0.245 727 HA PRO 91 HA PRO 91 -7.889 8.547 6.372 728 HB2 PRO 91 2HB PRO 91 -8.954 7.475 8.103 729 HB3 PRO 91 1HB PRO 91 -8.146 6.046 7.459 730 HG2 PRO 91 1HG PRO 91 -10.016 5.358 6.261 731 HG3 PRO 91 2HG PRO 91 -10.786 6.097 7.714 732 HD2 PRO 91 1HD PRO 91 -11.435 6.827 5.182 733 HD3 PRO 91 2HD PRO 91 -11.441 7.968 6.538 734 H LEU 92 H LEU 92 -6.569 8.506 4.513 735 HA LEU 92 HA LEU 92 -6.225 6.157 2.933 736 HB2 LEU 92 1HB LEU 92 -5.201 8.878 3.004 737 HB3 LEU 92 2HB LEU 92 -3.943 7.696 2.602 738 HG LEU 92 HG LEU 92 -6.178 7.059 1.006 739 HD11 LEU 92 1HD1 LEU 92 -7.245 9.082 1.075 740 HD12 LEU 92 2HD1 LEU 92 -6.119 9.363 -0.252 741 HD13 LEU 92 3HD1 LEU 92 -5.756 9.984 1.358 742 HD21 LEU 92 3HD2 LEU 92 -4.255 6.612 -0.073 743 HD22 LEU 92 1HD2 LEU 92 -3.390 7.943 0.697 744 HD23 LEU 92 2HD2 LEU 92 -4.440 8.256 -0.685 745 H CYS 93 H CYS 93 -4.865 4.488 3.177 746 HA CYS 93 HA CYS 93 -2.754 4.682 5.214 747 HB2 CYS 93 1HB CYS 93 -4.710 2.403 4.858 748 HB3 CYS 93 2HB CYS 93 -3.290 2.351 5.917 749 HG CYS 93 HG CYS 93 -6.106 4.235 6.328 750 H PHE 94 H PHE 94 -1.177 2.827 5.024 751 HA PHE 94 HA PHE 94 -0.695 2.282 2.171 752 HB2 PHE 94 1HB PHE 94 1.006 3.689 3.286 753 HB3 PHE 94 2HB PHE 94 1.298 2.391 4.445 754 HD1 PHE 94 1HD PHE 94 1.542 3.262 0.861 755 HD2 PHE 94 2HD PHE 94 2.742 0.604 3.962 756 HE1 PHE 94 1HE PHE 94 3.217 2.269 -0.643 757 HE2 PHE 94 2HE PHE 94 4.419 -0.392 2.462 758 HZ PHE 94 HZ PHE 94 4.659 0.440 0.157 759 H ILE 95 H ILE 95 -1.449 0.305 1.720 760 HA ILE 95 HA ILE 95 -1.135 -1.854 3.659 761 HB ILE 95 HB ILE 95 -2.586 -1.773 1.011 762 HG12 ILE 95 1HG1 ILE 95 -3.674 -1.976 3.828 763 HG13 ILE 95 2HG1 ILE 95 -3.564 -0.460 2.917 764 HG21 ILE 95 1HG2 ILE 95 -1.862 -4.006 1.305 765 HG22 ILE 95 2HG2 ILE 95 -2.257 -3.984 3.023 766 HG23 ILE 95 3HG2 ILE 95 -3.548 -3.963 1.822 767 HD11 ILE 95 3HD1 ILE 95 -4.941 -1.760 1.126 768 HD12 ILE 95 1HD1 ILE 95 -5.378 -2.781 2.496 769 HD13 ILE 95 2HD1 ILE 95 -5.740 -1.055 2.532 770 H PHE 96 H PHE 96 0.601 -3.104 3.601 771 HA PHE 96 HA PHE 96 2.159 -3.285 1.130 772 HB2 PHE 96 1HB PHE 96 3.341 -2.615 3.190 773 HB3 PHE 96 2HB PHE 96 2.870 -4.139 3.945 774 HD1 PHE 96 2HD PHE 96 3.511 -4.670 0.526 775 HD2 PHE 96 1HD PHE 96 5.458 -4.140 4.274 776 HE1 PHE 96 2HE PHE 96 5.525 -5.762 -0.369 777 HE2 PHE 96 1HE PHE 96 7.476 -5.230 3.383 778 HZ PHE 96 HZ PHE 96 7.510 -6.044 1.059 779 H SER 97 H SER 97 1.540 -4.893 -0.160 780 HA SER 97 HA SER 97 0.336 -7.298 0.859 781 HB2 SER 97 1HB SER 97 -0.439 -6.363 -1.260 782 HB3 SER 97 2HB SER 97 1.185 -6.537 -1.947 783 HG SER 97 HG SER 97 0.693 -8.901 -1.137 784 H SER 98 H SER 98 1.868 -8.343 2.104 785 HA SER 98 HA SER 98 4.213 -9.371 0.642 786 HB2 SER 98 1HB SER 98 4.454 -7.779 2.749 787 HB3 SER 98 2HB SER 98 4.178 -9.291 3.631 788 HG SER 98 HG SER 98 6.043 -9.343 1.560 789 HA PRO 99 HA PRO 99 1.697 -13.086 1.417 790 HB2 PRO 99 2HB PRO 99 1.452 -13.322 -0.855 791 HB3 PRO 99 1HB PRO 99 2.756 -14.496 -0.678 792 HG2 PRO 99 1HG PRO 99 4.399 -12.974 -1.301 793 HG3 PRO 99 2HG PRO 99 3.018 -12.434 -2.328 794 HD2 PRO 99 1HD PRO 99 4.361 -10.750 -0.675 795 HD3 PRO 99 2HD PRO 99 2.627 -10.588 -1.004 796 H VAL 100 H VAL 100 2.794 -15.535 0.930 797 HA VAL 100 HA VAL 100 5.249 -15.565 2.562 798 HB VAL 100 HB VAL 100 2.839 -17.361 2.768 799 HG11 VAL 100 1HG1 VAL 100 4.859 -18.746 2.738 800 HG12 VAL 100 2HG1 VAL 100 5.546 -17.768 4.036 801 HG13 VAL 100 3HG1 VAL 100 4.102 -18.739 4.330 802 HG21 VAL 100 3HG2 VAL 100 4.301 -15.868 4.933 803 HG22 VAL 100 1HG2 VAL 100 2.947 -15.181 4.034 804 HG23 VAL 100 2HG2 VAL 100 2.711 -16.627 5.017 805 H GLY 101 H GLY 101 3.406 -16.976 -0.054 806 HA2 GLY 101 1HA GLY 101 5.259 -19.105 -0.575 807 HA3 GLY 101 2HA GLY 101 3.945 -18.587 -1.619 808 H CYS 102 H CYS 102 5.726 -15.907 -0.847 809 HA CYS 102 HA CYS 102 6.885 -15.803 -3.484 810 HB2 CYS 102 1HB CYS 102 7.701 -13.544 -2.697 811 HB3 CYS 102 2HB CYS 102 5.944 -13.764 -2.713 812 HG CYS 102 HG CYS 102 5.707 -14.155 0.037 813 H LYS 103 H LYS 103 9.205 -14.517 -3.313 814 HA LYS 103 HA LYS 103 10.949 -16.438 -1.924 815 HB2 LYS 103 1HB LYS 103 11.900 -14.619 -4.113 816 HB3 LYS 103 2HB LYS 103 12.519 -16.206 -3.627 817 HG2 LYS 103 1HG LYS 103 11.326 -17.184 -5.213 818 HG3 LYS 103 2HG LYS 103 9.839 -16.541 -4.496 819 HD2 LYS 103 1HD LYS 103 10.013 -15.850 -6.823 820 HD3 LYS 103 2HD LYS 103 10.146 -14.448 -5.748 821 HE2 LYS 103 1HE LYS 103 11.998 -13.921 -6.897 822 HE3 LYS 103 2HE LYS 103 12.761 -15.256 -6.020 823 HZ1 LYS 103 3HZ LYS 103 13.126 -15.481 -8.380 824 HZ2 LYS 103 1HZ LYS 103 11.462 -15.444 -8.684 825 HZ3 LYS 103 2HZ LYS 103 12.138 -16.743 -7.839 826 HA PRO 104 HA PRO 104 12.530 -13.292 0.702 827 HB2 PRO 104 2HB PRO 104 13.620 -14.968 1.833 828 HB3 PRO 104 1HB PRO 104 15.064 -14.237 1.135 829 HG2 PRO 104 1HG PRO 104 15.153 -15.754 -0.622 830 HG3 PRO 104 2HG PRO 104 14.511 -16.795 0.704 831 HD2 PRO 104 1HD PRO 104 13.271 -16.550 -1.699 832 HD3 PRO 104 2HD PRO 104 12.382 -16.779 -0.183 833 H GLU 105 H GLU 105 13.840 -13.898 -2.396 834 HA GLU 105 HA GLU 105 15.894 -11.893 -2.319 835 HB2 GLU 105 1HB GLU 105 14.653 -13.581 -4.472 836 HB3 GLU 105 2HB GLU 105 15.723 -12.234 -4.893 837 HG2 GLU 105 1HG GLU 105 17.325 -13.383 -3.146 838 HG3 GLU 105 2HG GLU 105 16.355 -14.807 -3.551 839 H GLN 106 H GLN 106 12.535 -12.052 -3.316 840 HA GLN 106 HA GLN 106 12.616 -9.340 -4.374 841 HB2 GLN 106 1HB GLN 106 10.116 -10.979 -4.077 842 HB3 GLN 106 2HB GLN 106 10.504 -9.743 -5.284 843 HG2 GLN 106 1HG GLN 106 11.940 -12.385 -5.155 844 HG3 GLN 106 2HG GLN 106 10.456 -12.138 -6.085 845 HE21 GLN 106 2HE2 GLN 106 12.144 -9.678 -8.232 846 HE22 GLN 106 1HE2 GLN 106 10.780 -9.697 -7.171 847 H GLN 107 H GLN 107 10.671 -11.106 -1.958 848 HA GLN 107 HA GLN 107 9.224 -9.166 -0.808 849 HB2 GLN 107 1HB GLN 107 10.112 -11.700 -0.030 850 HB3 GLN 107 2HB GLN 107 10.562 -10.630 1.307 851 HG2 GLN 107 1HG GLN 107 7.864 -10.108 0.376 852 HG3 GLN 107 2HG GLN 107 8.089 -11.789 0.877 853 HE21 GLN 107 2HE2 GLN 107 8.729 -8.851 3.662 854 HE22 GLN 107 1HE2 GLN 107 9.136 -8.587 2.004 855 H MET 108 H MET 108 12.685 -9.667 -0.278 856 HA MET 108 HA MET 108 13.017 -7.691 1.704 857 HB2 MET 108 1HB MET 108 14.856 -9.086 -0.214 858 HB3 MET 108 2HB MET 108 15.454 -7.726 0.750 859 HG2 MET 108 1HG MET 108 14.387 -9.089 2.742 860 HG3 MET 108 2HG MET 108 14.604 -10.436 1.621 861 HE1 MET 108 3HE MET 108 17.796 -9.130 0.281 862 HE2 MET 108 1HE MET 108 18.255 -10.695 0.952 863 HE3 MET 108 2HE MET 108 16.692 -10.501 0.160 864 H MET 109 H MET 109 13.370 -7.581 -1.825 865 HA MET 109 HA MET 109 14.364 -5.049 -2.174 866 HB2 MET 109 1HB MET 109 12.348 -6.614 -3.783 867 HB3 MET 109 2HB MET 109 12.947 -5.035 -4.312 868 HG2 MET 109 1HG MET 109 15.183 -5.834 -4.496 869 HG3 MET 109 2HG MET 109 14.761 -7.347 -3.692 870 HE1 MET 109 3HE MET 109 12.583 -6.034 -7.326 871 HE2 MET 109 1HE MET 109 13.576 -5.020 -6.278 872 HE3 MET 109 2HE MET 109 14.280 -5.753 -7.720 873 H TYR 110 H TYR 110 11.067 -5.998 -1.399 874 HA TYR 110 HA TYR 110 10.144 -3.240 -1.534 875 HB2 TYR 110 1HB TYR 110 8.596 -5.696 -0.682 876 HB3 TYR 110 2HB TYR 110 7.934 -4.128 -1.150 877 HD1 TYR 110 2HD TYR 110 9.694 -7.111 -2.454 878 HD2 TYR 110 1HD TYR 110 7.532 -3.576 -3.419 879 HE1 TYR 110 2HE TYR 110 9.525 -7.859 -4.791 880 HE2 TYR 110 1HE TYR 110 7.356 -4.315 -5.759 881 HH TYR 110 HH TYR 110 8.873 -5.982 -7.280 882 H ALA 111 H ALA 111 10.890 -5.718 0.833 883 HA ALA 111 HA ALA 111 9.791 -4.428 3.094 884 HB1 ALA 111 3HB ALA 111 12.074 -5.988 3.820 885 HB2 ALA 111 1HB ALA 111 10.362 -6.339 4.060 886 HB3 ALA 111 2HB ALA 111 11.162 -6.829 2.566 887 H GLY 112 H GLY 112 12.774 -4.020 1.349 888 HA2 GLY 112 1HA GLY 112 13.931 -2.385 3.478 889 HA3 GLY 112 2HA GLY 112 14.732 -2.872 1.991 890 H SER 113 H SER 113 12.292 -2.020 0.445 891 HA SER 113 HA SER 113 13.031 0.806 0.286 892 HB2 SER 113 1HB SER 113 11.373 -0.840 -1.649 893 HB3 SER 113 2HB SER 113 12.035 0.780 -1.930 894 HG SER 113 HG SER 113 13.571 -1.564 -1.467 895 H LYS 114 H LYS 114 10.535 -1.202 1.412 896 HA LYS 114 HA LYS 114 8.191 0.121 1.000 897 HB2 LYS 114 1HB LYS 114 8.278 -1.932 2.270 898 HB3 LYS 114 2HB LYS 114 9.179 -1.130 3.568 899 HG2 LYS 114 1HG LYS 114 7.294 0.173 4.204 900 HG3 LYS 114 2HG LYS 114 6.395 -0.330 2.762 901 HD2 LYS 114 1HD LYS 114 5.464 -1.833 4.169 902 HD3 LYS 114 2HD LYS 114 6.952 -2.742 3.847 903 HE2 LYS 114 1HE LYS 114 7.978 -1.962 5.856 904 HE3 LYS 114 2HE LYS 114 6.689 -0.777 6.114 905 HZ1 LYS 114 3HZ LYS 114 6.712 -3.633 6.663 906 HZ2 LYS 114 1HZ LYS 114 5.259 -3.005 6.064 907 HZ3 LYS 114 2HZ LYS 114 5.929 -2.378 7.484 908 H ASN 115 H ASN 115 10.236 0.724 3.864 909 HA ASN 115 HA ASN 115 8.964 2.931 4.861 910 HB2 ASN 115 1HB ASN 115 11.792 1.983 4.904 911 HB3 ASN 115 2HB ASN 115 11.473 3.631 5.459 912 HD21 ASN 115 2HD2 ASN 115 10.815 0.581 7.896 913 HD22 ASN 115 1HD2 ASN 115 11.707 0.496 6.419 914 H ARG 116 H ARG 116 11.480 2.885 2.356 915 HA ARG 116 HA ARG 116 11.748 5.629 1.988 916 HB2 ARG 116 1HB ARG 116 13.321 4.147 0.971 917 HB3 ARG 116 2HB ARG 116 12.046 3.339 0.047 918 HG2 ARG 116 1HG ARG 116 13.303 4.772 -1.421 919 HG3 ARG 116 2HG ARG 116 11.669 5.423 -1.213 920 HD2 ARG 116 1HD ARG 116 12.397 7.168 0.174 921 HD3 ARG 116 2HD ARG 116 13.933 6.361 0.513 922 HE ARG 116 HE ARG 116 13.337 8.059 -1.715 923 HH11 ARG 116 2HH1 ARG 116 15.320 5.421 -0.610 924 HH12 ARG 116 1HH1 ARG 116 16.595 5.736 -1.739 925 HH21 ARG 116 1HH2 ARG 116 16.418 7.479 -3.214 926 HH22 ARG 116 2HH2 ARG 116 15.009 8.483 -3.207 927 H LEU 117 H LEU 117 9.672 3.367 0.176 928 HA LEU 117 HA LEU 117 8.408 5.288 -1.416 929 HB2 LEU 117 1HB LEU 117 8.351 2.859 -1.836 930 HB3 LEU 117 2HB LEU 117 7.295 2.666 -0.424 931 HG LEU 117 HG LEU 117 6.087 2.560 -2.578 932 HD11 LEU 117 1HD1 LEU 117 4.238 3.605 -1.754 933 HD12 LEU 117 2HD1 LEU 117 5.126 5.052 -1.281 934 HD13 LEU 117 3HD1 LEU 117 5.236 3.592 -0.300 935 HD21 LEU 117 3HD2 LEU 117 5.971 4.314 -4.076 936 HD22 LEU 117 1HD2 LEU 117 7.660 4.377 -3.572 937 HD23 LEU 117 2HD2 LEU 117 6.492 5.505 -2.884 938 H VAL 118 H VAL 118 7.167 3.701 1.530 939 HA VAL 118 HA VAL 118 4.820 5.110 1.827 940 HB VAL 118 HB VAL 118 6.681 4.048 3.950 941 HG11 VAL 118 1HG1 VAL 118 4.427 5.793 4.246 942 HG12 VAL 118 2HG1 VAL 118 4.070 4.222 4.967 943 HG13 VAL 118 3HG1 VAL 118 5.493 5.128 5.483 944 HG21 VAL 118 3HG2 VAL 118 5.854 2.234 2.746 945 HG22 VAL 118 1HG2 VAL 118 4.730 2.367 4.099 946 HG23 VAL 118 2HG2 VAL 118 4.275 2.986 2.511 947 H GLN 119 H GLN 119 7.985 5.936 3.248 948 HA GLN 119 HA GLN 119 7.299 8.262 4.549 949 HB2 GLN 119 1HB GLN 119 9.816 7.308 3.234 950 HB3 GLN 119 2HB GLN 119 9.738 8.962 3.862 951 HG2 GLN 119 1HG GLN 119 8.895 7.830 6.045 952 HG3 GLN 119 2HG GLN 119 9.621 6.376 5.346 953 HE21 GLN 119 2HE2 GLN 119 12.076 8.190 7.498 954 HE22 GLN 119 1HE2 GLN 119 10.458 7.631 7.731 955 H THR 120 H THR 120 7.965 7.772 1.131 956 HA THR 120 HA THR 120 8.078 10.485 0.374 957 HB THR 120 HB THR 120 7.100 8.226 -1.373 958 HG1 THR 120 1HG THR 120 9.332 8.192 -0.120 959 HG21 THR 120 3HG2 THR 120 7.703 11.007 -1.803 960 HG22 THR 120 1HG2 THR 120 7.035 9.825 -2.927 961 HG23 THR 120 2HG2 THR 120 8.783 9.992 -2.759 962 H ALA 121 H ALA 121 5.391 8.176 0.507 963 HA ALA 121 HA ALA 121 3.462 10.025 -0.508 964 HB1 ALA 121 3HB ALA 121 2.726 7.625 1.116 965 HB2 ALA 121 1HB ALA 121 1.906 8.331 -0.277 966 HB3 ALA 121 2HB ALA 121 3.408 7.432 -0.498 967 H GLU 122 H GLU 122 4.878 9.475 2.560 968 HA GLU 122 HA GLU 122 4.628 10.549 4.556 969 HB2 GLU 122 1HB GLU 122 3.586 12.355 2.673 970 HB3 GLU 122 2HB GLU 122 2.388 12.277 3.973 971 HG2 GLU 122 1HG GLU 122 3.619 13.619 5.224 972 HG3 GLU 122 2HG GLU 122 4.950 12.454 5.168 973 H LEU 123 H LEU 123 3.127 8.178 3.839 974 HA LEU 123 HA LEU 123 0.522 8.467 5.069 975 HB2 LEU 123 1HB LEU 123 2.010 6.029 4.077 976 HB3 LEU 123 2HB LEU 123 0.342 6.034 4.673 977 HG LEU 123 HG LEU 123 1.141 7.730 2.332 978 HD11 LEU 123 1HD1 LEU 123 0.002 4.997 1.954 979 HD12 LEU 123 2HD1 LEU 123 1.744 5.203 2.129 980 HD13 LEU 123 3HD1 LEU 123 0.889 6.016 0.818 981 HD21 LEU 123 3HD2 LEU 123 -1.473 6.428 2.431 982 HD22 LEU 123 1HD2 LEU 123 -1.053 8.111 2.115 983 HD23 LEU 123 2HD2 LEU 123 -1.174 7.530 3.776 984 H THR 124 H THR 124 1.006 9.092 7.186 985 HA THR 124 HA THR 124 2.832 7.925 8.914 986 HB THR 124 HB THR 124 1.672 9.985 9.491 987 HG1 THR 124 1HG THR 124 2.406 8.378 11.158 988 HG21 THR 124 3HG2 THR 124 -0.706 9.729 10.418 989 HG22 THR 124 1HG2 THR 124 -0.754 8.209 9.526 990 HG23 THR 124 2HG2 THR 124 -0.511 9.730 8.666 991 H LYS 125 H LYS 125 -0.268 6.773 7.849 992 HA LYS 125 HA LYS 125 -0.209 4.602 9.823 993 HB2 LYS 125 1HB LYS 125 -2.399 5.374 7.879 994 HB3 LYS 125 2HB LYS 125 -2.516 4.160 9.163 995 HG2 LYS 125 1HG LYS 125 -1.698 6.472 10.476 996 HG3 LYS 125 2HG LYS 125 -2.900 7.016 9.293 997 HD2 LYS 125 1HD LYS 125 -4.038 4.719 10.330 998 HD3 LYS 125 2HD LYS 125 -3.257 5.469 11.734 999 HE2 LYS 125 1HE LYS 125 -4.377 7.656 10.947 1000 HE3 LYS 125 2HE LYS 125 -5.382 6.601 9.942 1001 HZ1 LYS 125 3HZ LYS 125 -6.303 7.186 12.189 1002 HZ2 LYS 125 1HZ LYS 125 -5.097 6.209 12.865 1003 HZ3 LYS 125 2HZ LYS 125 -6.255 5.532 11.834 1004 H VAL 126 H VAL 126 1.215 3.118 9.056 1005 HA VAL 126 HA VAL 126 0.625 1.976 6.403 1006 HB VAL 126 HB VAL 126 2.702 2.897 5.999 1007 HG11 VAL 126 1HG1 VAL 126 3.063 3.741 8.272 1008 HG12 VAL 126 2HG1 VAL 126 3.572 2.132 8.785 1009 HG13 VAL 126 3HG1 VAL 126 4.527 3.026 7.602 1010 HG21 VAL 126 3HG2 VAL 126 3.799 0.398 7.192 1011 HG22 VAL 126 1HG2 VAL 126 2.574 0.268 5.929 1012 HG23 VAL 126 2HG2 VAL 126 4.089 1.112 5.607 1013 H PHE 127 H PHE 127 -0.234 0.028 6.634 1014 HA PHE 127 HA PHE 127 0.557 -1.616 8.937 1015 HB2 PHE 127 1HB PHE 127 -1.801 -2.090 7.108 1016 HB3 PHE 127 2HB PHE 127 -1.513 -2.784 8.704 1017 HD1 PHE 127 2HD PHE 127 -0.839 -0.565 10.385 1018 HD2 PHE 127 1HD PHE 127 -3.689 -0.767 7.231 1019 HE1 PHE 127 2HE PHE 127 -2.123 1.253 11.434 1020 HE2 PHE 127 1HE PHE 127 -4.977 1.051 8.274 1021 HZ PHE 127 HZ PHE 127 -4.196 2.063 10.380 1022 H GLU 128 H GLU 128 0.783 -3.946 8.588 1023 HA GLU 128 HA GLU 128 1.776 -4.578 5.886 1024 HB2 GLU 128 1HB GLU 128 3.605 -4.259 7.550 1025 HB3 GLU 128 2HB GLU 128 2.924 -5.595 8.490 1026 HG2 GLU 128 1HG GLU 128 3.222 -7.048 6.451 1027 HG3 GLU 128 2HG GLU 128 4.148 -5.714 5.750 1028 H ILE 129 H ILE 129 0.542 -6.064 4.966 1029 HA ILE 129 HA ILE 129 -0.934 -7.955 6.648 1030 HB ILE 129 HB ILE 129 -2.096 -8.514 4.452 1031 HG12 ILE 129 1HG1 ILE 129 -0.930 -5.872 3.568 1032 HG13 ILE 129 2HG1 ILE 129 -0.230 -7.427 3.089 1033 HG21 ILE 129 1HG2 ILE 129 -3.572 -6.585 4.601 1034 HG22 ILE 129 2HG2 ILE 129 -3.095 -7.130 6.208 1035 HG23 ILE 129 3HG2 ILE 129 -2.343 -5.699 5.505 1036 HD11 ILE 129 3HD1 ILE 129 -1.925 -6.218 1.529 1037 HD12 ILE 129 1HD1 ILE 129 -1.988 -7.969 1.726 1038 HD13 ILE 129 2HD1 ILE 129 -3.125 -6.942 2.599 1039 H ARG 130 H ARG 130 -0.472 -10.066 6.719 1040 HA ARG 130 HA ARG 130 1.908 -11.043 5.485 1041 HB2 ARG 130 1HB ARG 130 0.942 -11.725 7.746 1042 HB3 ARG 130 2HB ARG 130 -0.200 -12.722 6.833 1043 HG2 ARG 130 1HG ARG 130 1.502 -14.203 7.428 1044 HG3 ARG 130 2HG ARG 130 1.853 -13.779 5.745 1045 HD2 ARG 130 1HD ARG 130 3.937 -13.622 6.793 1046 HD3 ARG 130 2HD ARG 130 3.365 -11.950 6.720 1047 HE ARG 130 HE ARG 130 2.612 -13.186 9.167 1048 HH11 ARG 130 2HH1 ARG 130 5.307 -11.752 7.494 1049 HH12 ARG 130 1HH1 ARG 130 6.120 -11.270 8.946 1050 HH21 ARG 130 1HH2 ARG 130 5.189 -11.729 10.989 1051 HH22 ARG 130 2HH2 ARG 130 3.671 -12.557 11.086 1052 H THR 131 H THR 131 -1.513 -11.274 4.799 1053 HA THR 131 HA THR 131 -0.925 -12.345 2.173 1054 HB THR 131 HB THR 131 -1.158 -14.449 3.186 1055 HG1 THR 131 1HG THR 131 -2.961 -15.212 2.173 1056 HG21 THR 131 3HG2 THR 131 -3.723 -13.758 4.558 1057 HG22 THR 131 1HG2 THR 131 -2.189 -13.319 5.309 1058 HG23 THR 131 2HG2 THR 131 -2.543 -15.009 4.950 1059 H THR 132 H THR 132 -2.552 -11.965 0.666 1060 HA THR 132 HA THR 132 -4.073 -9.711 0.872 1061 HB THR 132 HB THR 132 -5.514 -10.664 -0.966 1062 HG1 THR 132 1HG THR 132 -5.371 -12.734 -1.431 1063 HG21 THR 132 3HG2 THR 132 -2.615 -11.153 -1.565 1064 HG22 THR 132 1HG2 THR 132 -3.208 -9.529 -1.217 1065 HG23 THR 132 2HG2 THR 132 -3.853 -10.428 -2.590 1066 H ASP 133 H ASP 133 -5.099 -13.023 1.609 1067 HA ASP 133 HA ASP 133 -7.758 -12.783 2.034 1068 HB2 ASP 133 1HB ASP 133 -5.643 -14.470 3.080 1069 HB3 ASP 133 2HB ASP 133 -6.896 -14.195 4.296 1070 H ASP 134 H ASP 134 -5.214 -11.447 4.032 1071 HA ASP 134 HA ASP 134 -6.769 -10.778 6.284 1072 HB2 ASP 134 1HB ASP 134 -4.190 -10.768 5.964 1073 HB3 ASP 134 2HB ASP 134 -4.435 -9.120 5.369 1074 H LEU 135 H LEU 135 -5.864 -8.873 3.420 1075 HA LEU 135 HA LEU 135 -7.047 -6.467 4.075 1076 HB2 LEU 135 1HB LEU 135 -5.712 -6.525 2.146 1077 HB3 LEU 135 2HB LEU 135 -6.646 -7.860 1.449 1078 HG LEU 135 HG LEU 135 -8.416 -6.432 0.823 1079 HD11 LEU 135 1HD1 LEU 135 -7.370 -4.746 2.962 1080 HD12 LEU 135 2HD1 LEU 135 -9.009 -4.895 2.331 1081 HD13 LEU 135 3HD1 LEU 135 -7.843 -3.850 1.519 1082 HD21 LEU 135 3HD2 LEU 135 -5.671 -5.493 0.233 1083 HD22 LEU 135 1HD2 LEU 135 -7.001 -4.425 -0.218 1084 HD23 LEU 135 2HD2 LEU 135 -6.935 -6.069 -0.855 1085 H THR 136 H THR 136 -8.978 -6.806 5.197 1086 HA THR 136 HA THR 136 -11.264 -7.505 3.478 1087 HB THR 136 HB THR 136 -12.324 -8.242 5.772 1088 HG1 THR 136 1HG THR 136 -10.507 -9.388 6.925 1089 HG21 THR 136 3HG2 THR 136 -11.971 -9.674 3.781 1090 HG22 THR 136 1HG2 THR 136 -11.722 -10.539 5.298 1091 HG23 THR 136 2HG2 THR 136 -10.335 -10.010 4.345 1092 H GLU 137 H GLU 137 -13.170 -6.347 3.819 1093 HA GLU 137 HA GLU 137 -13.064 -3.687 4.312 1094 HB2 GLU 137 1HB GLU 137 -15.025 -4.914 3.394 1095 HB3 GLU 137 2HB GLU 137 -15.421 -5.433 5.040 1096 HG2 GLU 137 1HG GLU 137 -15.413 -2.885 5.571 1097 HG3 GLU 137 2HG GLU 137 -15.610 -2.718 3.822 1098 H THR 138 H THR 138 -13.702 -6.201 6.725 1099 HA THR 138 HA THR 138 -14.061 -4.393 8.892 1100 HB THR 138 HB THR 138 -13.253 -7.298 9.075 1101 HG1 THR 138 1HG THR 138 -15.318 -6.525 7.850 1102 HG21 THR 138 3HG2 THR 138 -13.703 -7.184 11.281 1103 HG22 THR 138 1HG2 THR 138 -15.080 -6.110 11.047 1104 HG23 THR 138 2HG2 THR 138 -13.444 -5.453 11.068 1105 H TRP 139 H TRP 139 -11.424 -6.728 8.312 1106 HA TRP 139 HA TRP 139 -9.639 -5.985 10.198 1107 HB2 TRP 139 1HB TRP 139 -9.033 -7.784 8.798 1108 HB3 TRP 139 2HB TRP 139 -9.182 -6.805 7.338 1109 HD1 TRP 139 HD TRP 139 -6.738 -7.579 10.159 1110 HE1 TRP 139 1HE TRP 139 -4.431 -6.619 9.545 1111 HE3 TRP 139 3HE TRP 139 -8.048 -4.916 5.996 1112 HZ2 TRP 139 2HZ TRP 139 -3.314 -4.952 7.560 1113 HZ3 TRP 139 3HZ TRP 139 -6.300 -3.665 4.797 1114 HH2 TRP 139 HH TRP 139 -3.982 -3.684 5.566 1115 H LEU 140 H LEU 140 -10.464 -4.181 7.323 1116 HA LEU 140 HA LEU 140 -8.306 -2.296 7.606 1117 HB2 LEU 140 1HB LEU 140 -9.022 -2.610 5.398 1118 HB3 LEU 140 2HB LEU 140 -10.729 -2.482 5.851 1119 HG LEU 140 HG LEU 140 -10.532 -0.100 6.137 1120 HD11 LEU 140 1HD1 LEU 140 -8.497 1.112 5.838 1121 HD12 LEU 140 2HD1 LEU 140 -7.630 -0.352 5.375 1122 HD13 LEU 140 3HD1 LEU 140 -8.204 -0.155 7.030 1123 HD21 LEU 140 3HD2 LEU 140 -9.668 -1.380 3.618 1124 HD22 LEU 140 1HD2 LEU 140 -9.447 0.366 3.735 1125 HD23 LEU 140 2HD2 LEU 140 -11.051 -0.337 3.947 1126 H LYS 141 H LYS 141 -11.846 -1.845 7.682 1127 HA LYS 141 HA LYS 141 -11.916 0.669 8.785 1128 HB2 LYS 141 1HB LYS 141 -13.770 -1.639 8.708 1129 HB3 LYS 141 2HB LYS 141 -14.115 -0.407 9.931 1130 HG2 LYS 141 1HG LYS 141 -14.718 1.156 8.409 1131 HG3 LYS 141 2HG LYS 141 -13.560 0.573 7.201 1132 HD2 LYS 141 1HD LYS 141 -15.388 -0.228 6.156 1133 HD3 LYS 141 2HD LYS 141 -15.261 -1.540 7.341 1134 HE2 LYS 141 1HE LYS 141 -16.691 0.818 8.346 1135 HE3 LYS 141 2HE LYS 141 -17.462 0.047 6.953 1136 HZ1 LYS 141 3HZ LYS 141 -17.579 -2.009 8.102 1137 HZ2 LYS 141 1HZ LYS 141 -18.172 -0.828 9.158 1138 HZ3 LYS 141 2HZ LYS 141 -16.611 -1.446 9.371 1139 H GLU 142 H GLU 142 -11.011 -2.281 10.298 1140 HA GLU 142 HA GLU 142 -11.559 -1.610 12.989 1141 HB2 GLU 142 1HB GLU 142 -9.785 -3.588 11.609 1142 HB3 GLU 142 2HB GLU 142 -9.576 -3.309 13.345 1143 HG2 GLU 142 1HG GLU 142 -12.148 -3.701 13.455 1144 HG3 GLU 142 2HG GLU 142 -11.899 -4.484 11.888 1145 H LYS 143 H LYS 143 -8.427 -1.643 11.276 1146 HA LYS 143 HA LYS 143 -6.915 -0.393 13.227 1147 HB2 LYS 143 1HB LYS 143 -6.569 -0.017 10.245 1148 HB3 LYS 143 2HB LYS 143 -5.320 0.126 11.491 1149 HG2 LYS 143 1HG LYS 143 -6.608 -2.469 11.579 1150 HG3 LYS 143 2HG LYS 143 -5.912 -2.123 9.985 1151 HD2 LYS 143 1HD LYS 143 -3.859 -1.302 11.463 1152 HD3 LYS 143 2HD LYS 143 -4.567 -2.446 12.617 1153 HE2 LYS 143 1HE LYS 143 -4.378 -4.262 11.066 1154 HE3 LYS 143 2HE LYS 143 -3.937 -3.155 9.757 1155 HZ1 LYS 143 3HZ LYS 143 -2.093 -4.466 10.938 1156 HZ2 LYS 143 1HZ LYS 143 -2.267 -3.331 12.182 1157 HZ3 LYS 143 2HZ LYS 143 -1.835 -2.823 10.627 1158 H LEU 144 H LEU 144 -8.809 1.073 10.615 1159 HA LEU 144 HA LEU 144 -8.060 3.742 11.131 1160 HB2 LEU 144 1HB LEU 144 -10.731 2.922 10.016 1161 HB3 LEU 144 2HB LEU 144 -9.777 4.373 9.661 1162 HG LEU 144 HG LEU 144 -9.071 1.569 8.800 1163 HD11 LEU 144 1HD1 LEU 144 -10.580 3.780 7.512 1164 HD12 LEU 144 2HD1 LEU 144 -10.810 2.036 7.401 1165 HD13 LEU 144 3HD1 LEU 144 -9.498 2.810 6.512 1166 HD21 LEU 144 3HD2 LEU 144 -7.646 3.273 7.239 1167 HD22 LEU 144 1HD2 LEU 144 -7.021 2.476 8.683 1168 HD23 LEU 144 2HD2 LEU 144 -7.632 4.127 8.783 1169 H ALA 145 H ALA 145 -10.847 1.820 12.203 1170 HA ALA 145 HA ALA 145 -12.441 3.532 13.486 1171 HB1 ALA 145 3HB ALA 145 -11.910 1.467 15.386 1172 HB2 ALA 145 1HB ALA 145 -13.293 1.658 14.306 1173 HB3 ALA 145 2HB ALA 145 -11.860 0.789 13.758 1174 H SER 146 H SER 146 -9.950 1.970 15.482 1175 HA SER 146 HA SER 146 -8.799 4.389 16.410 1176 HB2 SER 146 1HB SER 146 -11.247 4.015 17.530 1177 HB3 SER 146 2HB SER 146 -10.222 3.144 18.684 1178 HG SER 146 HG SER 146 -9.848 5.061 19.460 1179 H GLY 147 H GLY 147 -8.064 1.719 15.476 1180 HA2 GLY 147 1HA GLY 147 -5.923 0.757 16.079 1181 HA3 GLY 147 2HA GLY 147 -6.370 0.955 17.767 1182 HA PRO 148 HA PRO 148 -7.643 -3.276 15.860 1183 HB2 PRO 148 2HB PRO 148 -5.683 -3.905 14.839 1184 HB3 PRO 148 1HB PRO 148 -5.401 -4.772 16.347 1185 HG2 PRO 148 1HG PRO 148 -4.067 -3.086 17.229 1186 HG3 PRO 148 2HG PRO 148 -3.647 -2.981 15.479 1187 HD2 PRO 148 1HD PRO 148 -4.499 -0.838 16.911 1188 HD3 PRO 148 2HD PRO 148 -4.885 -1.057 15.197 1189 H SER 149 H SER 149 -6.913 -1.808 18.672 1190 HA SER 149 HA SER 149 -7.464 -4.212 20.286 1191 HB2 SER 149 1HB SER 149 -5.283 -3.270 20.828 1192 HB3 SER 149 2HB SER 149 -6.013 -1.674 21.075 1193 HG SER 149 HG SER 149 -7.184 -2.548 22.824 1194 H SER 150 H SER 150 -7.863 -0.671 20.498 1195 HA SER 150 HA SER 150 -10.264 -0.989 22.077 1196 HB2 SER 150 1HB SER 150 -8.535 0.836 22.439 1197 HB3 SER 150 2HB SER 150 -9.146 1.584 20.952 1198 HG SER 150 HG SER 150 -10.444 1.234 23.423 1199 H GLY 151 H GLY 151 -10.613 -2.189 19.626 1200 HA2 GLY 151 1HA GLY 151 -12.304 -0.293 18.127 1201 HA3 GLY 151 2HA GLY 151 -11.603 -1.759 17.460 Start of MODEL 11 1 H1 GLY 1 H GLY 1 1.408 -7.175 16.609 2 HA2 GLY 1 1HA GLY 1 3.439 -5.416 15.712 3 HA3 GLY 1 2HA GLY 1 3.562 -6.524 17.070 4 H SER 2 H SER 2 4.703 -8.380 16.854 5 HA SER 2 HA SER 2 6.453 -9.602 15.990 6 HB2 SER 2 1HB SER 2 4.399 -9.940 13.780 7 HB3 SER 2 2HB SER 2 5.738 -11.043 14.145 8 HG SER 2 HG SER 2 3.482 -11.438 15.056 9 H SER 3 H SER 3 7.863 -7.788 15.623 10 HA SER 3 HA SER 3 7.969 -6.277 13.278 11 HB2 SER 3 1HB SER 3 9.371 -6.301 15.622 12 HB3 SER 3 2HB SER 3 10.581 -6.929 14.489 13 HG SER 3 HG SER 3 9.082 -4.627 13.859 14 H GLY 4 H GLY 4 9.578 -9.334 14.101 15 HA2 GLY 4 1HA GLY 4 10.198 -11.048 12.662 16 HA3 GLY 4 2HA GLY 4 9.681 -10.057 11.306 17 H SER 5 H SER 5 12.323 -11.223 13.082 18 HA SER 5 HA SER 5 14.260 -9.257 12.577 19 HB2 SER 5 1HB SER 5 14.231 -12.080 13.422 20 HB3 SER 5 2HB SER 5 15.701 -11.591 12.561 21 HG SER 5 HG SER 5 14.743 -10.778 15.037 22 H SER 6 H SER 6 13.836 -12.361 10.868 23 HA SER 6 HA SER 6 14.398 -13.016 8.758 24 HB2 SER 6 1HB SER 6 12.610 -11.008 8.522 25 HB3 SER 6 2HB SER 6 13.973 -10.302 7.636 26 HG SER 6 HG SER 6 13.202 -12.947 7.094 27 H GLY 7 H GLY 7 15.724 -12.248 6.697 28 HA2 GLY 7 1HA GLY 7 18.368 -12.235 7.253 29 HA3 GLY 7 2HA GLY 7 17.715 -11.463 5.815 30 H SER 8 H SER 8 19.276 -11.002 8.806 31 HA SER 8 HA SER 8 18.828 -8.106 8.737 32 HB2 SER 8 1HB SER 8 19.893 -9.984 10.847 33 HB3 SER 8 2HB SER 8 20.106 -8.230 10.971 34 HG SER 8 HG SER 8 18.162 -9.193 11.989 35 H ASP 9 H ASP 9 20.152 -7.743 6.885 36 HA ASP 9 HA ASP 9 22.798 -7.010 7.486 37 HB2 ASP 9 1HB ASP 9 22.892 -9.608 7.269 38 HB3 ASP 9 2HB ASP 9 22.764 -9.292 5.534 39 H SER 10 H SER 10 21.870 -5.127 6.544 40 HA SER 10 HA SER 10 21.474 -3.636 4.870 41 HB2 SER 10 1HB SER 10 23.760 -5.042 4.178 42 HB3 SER 10 2HB SER 10 22.759 -5.142 2.717 43 HG SER 10 HG SER 10 24.235 -3.168 3.268 44 H LEU 11 H LEU 11 20.310 -3.270 2.852 45 HA LEU 11 HA LEU 11 18.772 -5.554 1.868 46 HB2 LEU 11 1HB LEU 11 17.490 -2.964 2.750 47 HB3 LEU 11 2HB LEU 11 16.670 -4.388 2.084 48 HG LEU 11 HG LEU 11 18.223 -4.663 4.620 49 HD11 LEU 11 1HD1 LEU 11 16.200 -4.051 5.888 50 HD12 LEU 11 2HD1 LEU 11 15.457 -3.484 4.393 51 HD13 LEU 11 3HD1 LEU 11 16.898 -2.684 5.020 52 HD21 LEU 11 3HD2 LEU 11 15.656 -5.911 3.643 53 HD22 LEU 11 1HD2 LEU 11 16.581 -6.372 5.072 54 HD23 LEU 11 2HD2 LEU 11 17.260 -6.624 3.463 55 H VAL 12 H VAL 12 17.118 -4.477 0.116 56 HA VAL 12 HA VAL 12 18.912 -3.261 -1.830 57 HB VAL 12 HB VAL 12 16.058 -4.100 -2.309 58 HG11 VAL 12 1HG1 VAL 12 16.441 -3.601 -4.445 59 HG12 VAL 12 2HG1 VAL 12 17.917 -2.797 -3.902 60 HG13 VAL 12 3HG1 VAL 12 17.973 -4.475 -4.447 61 HG21 VAL 12 3HG2 VAL 12 17.045 -6.248 -3.146 62 HG22 VAL 12 1HG2 VAL 12 18.560 -5.777 -2.374 63 HG23 VAL 12 2HG2 VAL 12 17.114 -6.036 -1.396 64 H VAL 13 H VAL 13 18.124 -1.582 0.312 65 HA VAL 13 HA VAL 13 16.022 0.065 0.170 66 HB VAL 13 HB VAL 13 18.893 0.981 0.382 67 HG11 VAL 13 1HG1 VAL 13 16.321 2.425 0.585 68 HG12 VAL 13 2HG1 VAL 13 17.539 2.795 1.807 69 HG13 VAL 13 3HG1 VAL 13 17.912 3.005 0.095 70 HG21 VAL 13 3HG2 VAL 13 18.087 1.079 2.872 71 HG22 VAL 13 1HG2 VAL 13 16.904 -0.107 2.318 72 HG23 VAL 13 2HG2 VAL 13 18.628 -0.445 2.167 73 H CYS 14 H CYS 14 15.046 0.344 -1.803 74 HA CYS 14 HA CYS 14 16.552 1.464 -4.019 75 HB2 CYS 14 1HB CYS 14 13.713 0.513 -3.691 76 HB3 CYS 14 2HB CYS 14 14.260 1.339 -5.159 77 HG CYS 14 HG CYS 14 14.459 -1.125 -6.089 78 H GLU 15 H GLU 15 14.973 3.150 -5.295 79 HA GLU 15 HA GLU 15 14.544 5.338 -3.370 80 HB2 GLU 15 1HB GLU 15 15.063 6.894 -5.165 81 HB3 GLU 15 2HB GLU 15 16.383 5.733 -4.959 82 HG2 GLU 15 1HG GLU 15 14.941 4.459 -6.846 83 HG3 GLU 15 2HG GLU 15 14.561 6.142 -7.232 84 H VAL 16 H VAL 16 12.886 6.939 -3.996 85 HA VAL 16 HA VAL 16 10.496 5.561 -4.926 86 HB VAL 16 HB VAL 16 10.175 6.781 -2.908 87 HG11 VAL 16 1HG1 VAL 16 11.934 8.695 -4.172 88 HG12 VAL 16 2HG1 VAL 16 10.511 9.478 -3.487 89 HG13 VAL 16 3HG1 VAL 16 11.546 8.479 -2.466 90 HG21 VAL 16 3HG2 VAL 16 8.216 7.756 -3.464 91 HG22 VAL 16 1HG2 VAL 16 8.955 8.787 -4.690 92 HG23 VAL 16 2HG2 VAL 16 8.584 7.104 -5.061 93 H ASP 17 H ASP 17 10.518 5.473 -7.120 94 HA ASP 17 HA ASP 17 11.516 7.046 -9.026 95 HB2 ASP 17 1HB ASP 17 10.061 5.039 -9.394 96 HB3 ASP 17 2HB ASP 17 8.653 6.078 -9.134 97 HA PRO 18 HA PRO 18 9.951 11.137 -8.546 98 HB2 PRO 18 2HB PRO 18 11.747 11.803 -9.815 99 HB3 PRO 18 1HB PRO 18 10.522 12.090 -11.050 100 HG2 PRO 18 1HG PRO 18 10.903 10.051 -12.097 101 HG3 PRO 18 2HG PRO 18 12.564 10.467 -11.533 102 HD2 PRO 18 1HD PRO 18 11.365 8.104 -10.942 103 HD3 PRO 18 2HD PRO 18 12.479 8.916 -9.830 104 H GLU 19 H GLU 19 8.914 9.119 -11.238 105 HA GLU 19 HA GLU 19 6.729 10.790 -12.008 106 HB2 GLU 19 1HB GLU 19 6.305 9.254 -13.651 107 HB3 GLU 19 2HB GLU 19 7.998 8.867 -13.307 108 HG2 GLU 19 1HG GLU 19 7.317 6.762 -13.091 109 HG3 GLU 19 2HG GLU 19 6.665 7.274 -11.528 110 H LEU 20 H LEU 20 7.200 8.301 -9.645 111 HA LEU 20 HA LEU 20 4.359 7.895 -9.225 112 HB2 LEU 20 1HB LEU 20 6.303 6.164 -8.995 113 HB3 LEU 20 2HB LEU 20 6.485 6.883 -7.385 114 HG LEU 20 HG LEU 20 3.988 5.552 -8.437 115 HD11 LEU 20 1HD1 LEU 20 5.614 3.870 -8.079 116 HD12 LEU 20 2HD1 LEU 20 4.565 3.863 -6.662 117 HD13 LEU 20 3HD1 LEU 20 6.157 4.615 -6.575 118 HD21 LEU 20 3HD2 LEU 20 3.033 6.838 -6.860 119 HD22 LEU 20 1HD2 LEU 20 4.571 7.196 -6.074 120 HD23 LEU 20 2HD2 LEU 20 3.743 5.675 -5.739 121 H LYS 21 H LYS 21 7.113 9.263 -7.451 122 HA LYS 21 HA LYS 21 6.142 9.945 -5.058 123 HB2 LYS 21 1HB LYS 21 8.351 10.642 -6.061 124 HB3 LYS 21 2HB LYS 21 7.497 12.001 -6.806 125 HG2 LYS 21 1HG LYS 21 6.714 12.302 -4.237 126 HG3 LYS 21 2HG LYS 21 8.322 11.592 -4.014 127 HD2 LYS 21 1HD LYS 21 8.248 13.694 -6.057 128 HD3 LYS 21 2HD LYS 21 7.803 14.253 -4.435 129 HE2 LYS 21 1HE LYS 21 9.973 12.718 -3.859 130 HE3 LYS 21 2HE LYS 21 10.397 13.322 -5.468 131 HZ1 LYS 21 3HZ LYS 21 10.923 15.265 -4.582 132 HZ2 LYS 21 1HZ LYS 21 10.569 14.671 -3.038 133 HZ3 LYS 21 2HZ LYS 21 9.368 15.446 -3.941 134 H GLU 22 H GLU 22 5.400 11.731 -8.040 135 HA GLU 22 HA GLU 22 3.734 13.660 -6.839 136 HB2 GLU 22 1HB GLU 22 3.397 12.664 -9.664 137 HB3 GLU 22 2HB GLU 22 3.109 14.290 -9.025 138 HG2 GLU 22 1HG GLU 22 5.703 14.145 -8.488 139 HG3 GLU 22 2HG GLU 22 5.648 12.989 -9.827 140 H THR 23 H THR 23 2.996 10.574 -8.429 141 HA THR 23 HA THR 23 0.267 10.591 -8.446 142 HB THR 23 HB THR 23 2.173 8.330 -7.876 143 HG1 THR 23 1HG THR 23 2.237 8.460 -9.984 144 HG21 THR 23 3HG2 THR 23 -0.783 8.367 -7.700 145 HG22 THR 23 1HG2 THR 23 0.386 7.323 -6.893 146 HG23 THR 23 2HG2 THR 23 -0.057 7.018 -8.573 147 H LEU 24 H LEU 24 2.335 9.667 -5.703 148 HA LEU 24 HA LEU 24 0.244 9.064 -3.920 149 HB2 LEU 24 1HB LEU 24 2.962 10.134 -3.163 150 HB3 LEU 24 2HB LEU 24 1.887 9.110 -2.196 151 HG LEU 24 HG LEU 24 3.321 8.252 -4.708 152 HD11 LEU 24 1HD1 LEU 24 4.301 8.556 -2.098 153 HD12 LEU 24 2HD1 LEU 24 5.067 7.723 -3.450 154 HD13 LEU 24 3HD1 LEU 24 4.042 6.826 -2.330 155 HD21 LEU 24 3HD2 LEU 24 2.594 5.979 -3.935 156 HD22 LEU 24 1HD2 LEU 24 1.293 7.022 -4.512 157 HD23 LEU 24 2HD2 LEU 24 1.532 6.785 -2.780 158 H ARG 25 H ARG 25 2.212 12.017 -4.249 159 HA ARG 25 HA ARG 25 0.952 13.529 -2.281 160 HB2 ARG 25 1HB ARG 25 3.050 14.197 -3.350 161 HB3 ARG 25 2HB ARG 25 2.190 14.477 -4.872 162 HG2 ARG 25 1HG ARG 25 0.948 16.302 -3.914 163 HG3 ARG 25 2HG ARG 25 1.640 15.971 -2.317 164 HD2 ARG 25 1HD ARG 25 3.562 16.430 -4.535 165 HD3 ARG 25 2HD ARG 25 2.624 17.825 -3.980 166 HE ARG 25 HE ARG 25 4.751 16.516 -2.580 167 HH11 ARG 25 2HH1 ARG 25 1.834 18.379 -2.200 168 HH12 ARG 25 1HH1 ARG 25 2.288 19.016 -0.654 169 HH21 ARG 25 1HH2 ARG 25 4.293 18.431 0.285 170 HH22 ARG 25 2HH2 ARG 25 5.359 17.350 -0.546 171 H LYS 26 H LYS 26 -0.003 12.836 -5.572 172 HA LYS 26 HA LYS 26 -2.093 14.811 -5.637 173 HB2 LYS 26 1HB LYS 26 -1.873 12.423 -7.463 174 HB3 LYS 26 2HB LYS 26 -2.591 14.006 -7.801 175 HG2 LYS 26 1HG LYS 26 0.157 14.379 -7.113 176 HG3 LYS 26 2HG LYS 26 0.028 13.124 -8.357 177 HD2 LYS 26 1HD LYS 26 -1.701 14.921 -9.371 178 HD3 LYS 26 2HD LYS 26 -0.607 16.010 -8.500 179 HE2 LYS 26 1HE LYS 26 1.010 15.762 -10.026 180 HE3 LYS 26 2HE LYS 26 0.860 14.000 -9.977 181 HZ1 LYS 26 3HZ LYS 26 -1.170 14.313 -11.425 182 HZ2 LYS 26 1HZ LYS 26 0.326 14.618 -12.155 183 HZ3 LYS 26 2HZ LYS 26 -0.652 15.906 -11.660 184 H PHE 27 H PHE 27 -1.911 11.301 -5.196 185 HA PHE 27 HA PHE 27 -4.615 10.700 -5.139 186 HB2 PHE 27 1HB PHE 27 -2.555 9.141 -5.001 187 HB3 PHE 27 2HB PHE 27 -2.660 9.398 -3.258 188 HD1 PHE 27 2HD PHE 27 -5.360 8.957 -5.780 189 HD2 PHE 27 1HD PHE 27 -3.401 7.421 -2.328 190 HE1 PHE 27 2HE PHE 27 -7.066 7.193 -5.600 191 HE2 PHE 27 1HE PHE 27 -5.102 5.654 -2.143 192 HZ PHE 27 HZ PHE 27 -6.939 5.539 -3.780 193 H ARG 28 H ARG 28 -2.551 11.981 -2.584 194 HA ARG 28 HA ARG 28 -4.484 11.779 -0.512 195 HB2 ARG 28 1HB ARG 28 -2.365 13.883 -0.432 196 HB3 ARG 28 2HB ARG 28 -2.925 12.792 0.846 197 HG2 ARG 28 1HG ARG 28 -1.813 11.080 -1.027 198 HG3 ARG 28 2HG ARG 28 -0.733 12.485 -1.019 199 HD2 ARG 28 1HD ARG 28 -1.637 11.034 1.476 200 HD3 ARG 28 2HD ARG 28 -0.124 10.702 0.621 201 HE ARG 28 HE ARG 28 -0.678 12.922 2.350 202 HH11 ARG 28 2HH1 ARG 28 1.251 11.813 -0.327 203 HH12 ARG 28 1HH1 ARG 28 2.540 12.933 -0.031 204 HH21 ARG 28 1HH2 ARG 28 2.403 14.404 1.720 205 HH22 ARG 28 2HH2 ARG 28 1.012 14.400 2.750 206 H PHE 29 H PHE 29 -3.604 14.307 -2.804 207 HA PHE 29 HA PHE 29 -5.900 15.886 -1.845 208 HB2 PHE 29 1HB PHE 29 -3.803 17.223 -3.468 209 HB3 PHE 29 2HB PHE 29 -4.734 17.835 -2.099 210 HD1 PHE 29 2HD PHE 29 -4.171 15.916 0.011 211 HD2 PHE 29 1HD PHE 29 -1.576 17.575 -2.927 212 HE1 PHE 29 2HE PHE 29 -2.252 15.555 1.508 213 HE2 PHE 29 1HE PHE 29 0.347 17.216 -1.435 214 HZ PHE 29 HZ PHE 29 0.011 16.207 0.787 215 H ARG 30 H ARG 30 -6.213 13.791 -3.682 216 HA ARG 30 HA ARG 30 -6.209 14.771 -6.366 217 HB2 ARG 30 1HB ARG 30 -7.519 12.731 -6.872 218 HB3 ARG 30 2HB ARG 30 -6.041 12.393 -5.960 219 HG2 ARG 30 1HG ARG 30 -7.585 12.505 -3.875 220 HG3 ARG 30 2HG ARG 30 -8.883 12.257 -5.056 221 HD2 ARG 30 1HD ARG 30 -6.664 10.431 -5.502 222 HD3 ARG 30 2HD ARG 30 -7.324 10.292 -3.866 223 HE ARG 30 HE ARG 30 -8.650 9.601 -6.342 224 HH11 ARG 30 2HH1 ARG 30 -8.988 10.278 -2.944 225 HH12 ARG 30 1HH1 ARG 30 -10.503 9.450 -2.796 226 HH21 ARG 30 1HH2 ARG 30 -11.444 8.443 -4.626 227 HH22 ARG 30 2HH2 ARG 30 -10.644 8.508 -6.160 228 H LYS 31 H LYS 31 -8.182 14.958 -7.691 229 HA LYS 31 HA LYS 31 -10.136 16.606 -6.321 230 HB2 LYS 31 1HB LYS 31 -9.473 16.032 -9.192 231 HB3 LYS 31 2HB LYS 31 -11.023 16.779 -8.772 232 HG2 LYS 31 1HG LYS 31 -8.365 17.904 -7.902 233 HG3 LYS 31 2HG LYS 31 -9.183 18.367 -9.404 234 HD2 LYS 31 1HD LYS 31 -11.029 19.293 -8.245 235 HD3 LYS 31 2HD LYS 31 -10.528 18.545 -6.718 236 HE2 LYS 31 1HE LYS 31 -9.774 20.677 -6.354 237 HE3 LYS 31 2HE LYS 31 -8.347 19.974 -7.129 238 HZ1 LYS 31 3HZ LYS 31 -10.007 22.100 -8.027 239 HZ2 LYS 31 1HZ LYS 31 -9.912 20.882 -9.197 240 HZ3 LYS 31 2HZ LYS 31 -8.499 21.601 -8.608 241 H GLU 32 H GLU 32 -10.118 13.748 -5.780 242 HA GLU 32 HA GLU 32 -12.736 12.987 -6.896 243 HB2 GLU 32 1HB GLU 32 -10.405 11.332 -5.940 244 HB3 GLU 32 2HB GLU 32 -12.026 10.646 -6.126 245 HG2 GLU 32 1HG GLU 32 -10.391 11.935 -8.311 246 HG3 GLU 32 2HG GLU 32 -10.638 10.200 -8.074 247 H THR 33 H THR 33 -13.890 11.378 -5.328 248 HA THR 33 HA THR 33 -13.556 12.102 -2.526 249 HB THR 33 HB THR 33 -15.947 12.685 -2.260 250 HG1 THR 33 1HG THR 33 -16.935 13.339 -4.406 251 HG21 THR 33 3HG2 THR 33 -15.813 14.919 -3.465 252 HG22 THR 33 1HG2 THR 33 -14.272 14.363 -4.117 253 HG23 THR 33 2HG2 THR 33 -14.480 14.538 -2.375 254 H ASN 34 H ASN 34 -13.225 9.663 -4.053 255 HA ASN 34 HA ASN 34 -15.143 7.991 -2.591 256 HB2 ASN 34 1HB ASN 34 -16.080 7.224 -4.464 257 HB3 ASN 34 2HB ASN 34 -15.043 8.287 -5.423 258 HD21 ASN 34 2HD2 ASN 34 -12.847 5.795 -6.470 259 HD22 ASN 34 1HD2 ASN 34 -13.161 7.488 -6.337 260 H ASN 35 H ASN 35 -14.350 5.561 -2.897 261 HA ASN 35 HA ASN 35 -11.723 5.491 -1.733 262 HB2 ASN 35 1HB ASN 35 -13.785 3.379 -2.370 263 HB3 ASN 35 2HB ASN 35 -12.185 2.968 -1.740 264 HD21 ASN 35 2HD2 ASN 35 -14.452 3.176 1.130 265 HD22 ASN 35 1HD2 ASN 35 -14.300 2.214 -0.297 266 H ALA 36 H ALA 36 -9.872 4.565 -2.566 267 HA ALA 36 HA ALA 36 -9.868 3.352 -5.186 268 HB1 ALA 36 3HB ALA 36 -9.812 5.516 -6.040 269 HB2 ALA 36 1HB ALA 36 -8.784 6.108 -4.734 270 HB3 ALA 36 2HB ALA 36 -8.111 5.057 -5.980 271 H ALA 37 H ALA 37 -7.821 2.420 -5.745 272 HA ALA 37 HA ALA 37 -5.904 2.274 -3.515 273 HB1 ALA 37 3HB ALA 37 -6.398 -0.139 -5.191 274 HB2 ALA 37 1HB ALA 37 -5.828 -0.017 -3.526 275 HB3 ALA 37 2HB ALA 37 -7.532 0.255 -3.898 276 H ILE 38 H ILE 38 -3.730 1.796 -4.101 277 HA ILE 38 HA ILE 38 -3.101 2.027 -6.960 278 HB ILE 38 HB ILE 38 -1.630 3.588 -4.838 279 HG12 ILE 38 1HG1 ILE 38 -3.826 4.415 -6.741 280 HG13 ILE 38 2HG1 ILE 38 -3.799 4.574 -4.977 281 HG21 ILE 38 1HG2 ILE 38 -0.866 2.822 -7.381 282 HG22 ILE 38 2HG2 ILE 38 -1.429 4.479 -7.591 283 HG23 ILE 38 3HG2 ILE 38 -0.156 4.121 -6.424 284 HD11 ILE 38 3HD1 ILE 38 -3.369 6.726 -5.625 285 HD12 ILE 38 1HD1 ILE 38 -1.735 6.098 -5.417 286 HD13 ILE 38 2HD1 ILE 38 -2.430 6.231 -7.033 287 H ILE 39 H ILE 39 -2.053 0.214 -7.437 288 HA ILE 39 HA ILE 39 -0.339 -1.051 -5.438 289 HB ILE 39 HB ILE 39 -1.171 -2.059 -8.161 290 HG12 ILE 39 1HG1 ILE 39 -2.188 -3.531 -5.888 291 HG13 ILE 39 2HG1 ILE 39 -2.681 -1.831 -5.805 292 HG21 ILE 39 1HG2 ILE 39 0.866 -3.107 -7.563 293 HG22 ILE 39 2HG2 ILE 39 0.340 -3.336 -5.896 294 HG23 ILE 39 3HG2 ILE 39 -0.415 -4.262 -7.194 295 HD11 ILE 39 3HD1 ILE 39 -3.033 -2.878 -8.467 296 HD12 ILE 39 1HD1 ILE 39 -3.900 -3.840 -7.272 297 HD13 ILE 39 2HD1 ILE 39 -4.199 -2.106 -7.392 298 H MET 40 H MET 40 1.685 -0.318 -5.377 299 HA MET 40 HA MET 40 3.025 0.336 -7.913 300 HB2 MET 40 1HB MET 40 4.026 1.097 -5.174 301 HB3 MET 40 2HB MET 40 4.428 1.822 -6.739 302 HG2 MET 40 1HG MET 40 2.550 3.109 -6.807 303 HG3 MET 40 2HG MET 40 1.601 1.949 -5.874 304 HE1 MET 40 3HE MET 40 1.449 1.630 -3.693 305 HE2 MET 40 1HE MET 40 2.159 2.526 -2.349 306 HE3 MET 40 2HE MET 40 0.790 3.202 -3.233 307 H LYS 41 H LYS 41 5.123 -0.435 -8.316 308 HA LYS 41 HA LYS 41 5.989 -2.668 -6.602 309 HB2 LYS 41 1HB LYS 41 6.516 -4.008 -8.474 310 HB3 LYS 41 2HB LYS 41 4.904 -3.351 -8.799 311 HG2 LYS 41 1HG LYS 41 5.585 -2.412 -10.688 312 HG3 LYS 41 2HG LYS 41 6.918 -1.596 -9.852 313 HD2 LYS 41 1HD LYS 41 8.443 -3.120 -10.508 314 HD3 LYS 41 2HD LYS 41 7.327 -4.473 -10.259 315 HE2 LYS 41 1HE LYS 41 6.130 -3.655 -12.379 316 HE3 LYS 41 2HE LYS 41 7.578 -2.676 -12.653 317 HZ1 LYS 41 3HZ LYS 41 8.839 -4.490 -13.108 318 HZ2 LYS 41 1HZ LYS 41 7.343 -5.105 -13.605 319 HZ3 LYS 41 2HZ LYS 41 7.965 -5.517 -12.087 320 H VAL 42 H VAL 42 8.341 -3.329 -7.333 321 HA VAL 42 HA VAL 42 9.918 -0.863 -7.675 322 HB VAL 42 HB VAL 42 10.324 -1.278 -5.444 323 HG11 VAL 42 1HG1 VAL 42 10.888 -3.885 -4.909 324 HG12 VAL 42 2HG1 VAL 42 9.308 -3.131 -4.686 325 HG13 VAL 42 3HG1 VAL 42 9.653 -4.041 -6.158 326 HG21 VAL 42 3HG2 VAL 42 12.424 -3.179 -6.308 327 HG22 VAL 42 1HG2 VAL 42 12.387 -1.604 -7.100 328 HG23 VAL 42 2HG2 VAL 42 12.553 -1.706 -5.348 329 H ASP 43 H ASP 43 10.765 -1.023 -9.655 330 HA ASP 43 HA ASP 43 11.335 -3.458 -10.975 331 HB2 ASP 43 1HB ASP 43 12.100 -0.587 -11.502 332 HB3 ASP 43 2HB ASP 43 12.666 -1.906 -12.536 333 H LYS 44 H LYS 44 12.940 -4.820 -10.601 334 HA LYS 44 HA LYS 44 15.103 -4.229 -8.870 335 HB2 LYS 44 1HB LYS 44 14.090 -6.498 -9.256 336 HB3 LYS 44 2HB LYS 44 14.914 -6.526 -10.823 337 HG2 LYS 44 1HG LYS 44 16.817 -5.866 -8.794 338 HG3 LYS 44 2HG LYS 44 15.920 -7.317 -8.315 339 HD2 LYS 44 1HD LYS 44 16.628 -8.541 -10.152 340 HD3 LYS 44 2HD LYS 44 16.970 -7.085 -11.104 341 HE2 LYS 44 1HE LYS 44 19.034 -6.775 -10.173 342 HE3 LYS 44 2HE LYS 44 18.549 -7.486 -8.627 343 HZ1 LYS 44 3HZ LYS 44 19.742 -9.226 -9.327 344 HZ2 LYS 44 1HZ LYS 44 19.696 -8.754 -10.951 345 HZ3 LYS 44 2HZ LYS 44 18.394 -9.599 -10.279 346 H ASP 45 H ASP 45 14.637 -3.882 -12.268 347 HA ASP 45 HA ASP 45 17.391 -3.882 -13.020 348 HB2 ASP 45 1HB ASP 45 15.519 -4.334 -14.601 349 HB3 ASP 45 2HB ASP 45 15.043 -2.635 -14.464 350 H ARG 46 H ARG 46 15.081 -1.421 -12.031 351 HA ARG 46 HA ARG 46 17.208 0.605 -12.223 352 HB2 ARG 46 1HB ARG 46 14.226 1.056 -11.978 353 HB3 ARG 46 2HB ARG 46 15.464 2.282 -12.286 354 HG2 ARG 46 1HG ARG 46 15.912 1.415 -14.465 355 HG3 ARG 46 2HG ARG 46 14.888 0.002 -14.158 356 HD2 ARG 46 1HD ARG 46 13.331 1.212 -15.265 357 HD3 ARG 46 2HD ARG 46 13.113 1.968 -13.680 358 HE ARG 46 HE ARG 46 15.012 3.517 -14.740 359 HH11 ARG 46 2HH1 ARG 46 12.019 2.329 -16.062 360 HH12 ARG 46 1HH1 ARG 46 11.781 3.698 -17.097 361 HH21 ARG 46 1HH2 ARG 46 13.314 5.401 -17.118 362 HH22 ARG 46 2HH2 ARG 46 14.710 5.325 -16.098 363 H GLN 47 H GLN 47 15.945 -1.431 -10.046 364 HA GLN 47 HA GLN 47 15.561 -1.420 -7.781 365 HB2 GLN 47 1HB GLN 47 17.955 0.429 -7.872 366 HB3 GLN 47 2HB GLN 47 17.458 -0.597 -6.517 367 HG2 GLN 47 1HG GLN 47 17.824 -2.141 -8.942 368 HG3 GLN 47 2HG GLN 47 19.279 -1.235 -8.501 369 HE21 GLN 47 2HE2 GLN 47 18.256 -4.540 -6.498 370 HE22 GLN 47 1HE2 GLN 47 17.439 -3.982 -7.914 371 H MET 48 H MET 48 13.752 0.258 -8.816 372 HA MET 48 HA MET 48 13.562 2.312 -6.754 373 HB2 MET 48 1HB MET 48 13.345 4.126 -8.138 374 HB3 MET 48 2HB MET 48 14.504 3.165 -9.069 375 HG2 MET 48 1HG MET 48 12.184 2.197 -10.061 376 HG3 MET 48 2HG MET 48 11.709 3.851 -9.666 377 HE1 MET 48 3HE MET 48 14.622 5.804 -11.255 378 HE2 MET 48 1HE MET 48 12.911 6.141 -11.522 379 HE3 MET 48 2HE MET 48 13.475 5.663 -9.921 380 H VAL 49 H VAL 49 11.402 3.063 -6.389 381 HA VAL 49 HA VAL 49 9.427 1.017 -6.956 382 HB VAL 49 HB VAL 49 8.906 3.546 -5.414 383 HG11 VAL 49 1HG1 VAL 49 7.665 0.844 -5.639 384 HG12 VAL 49 2HG1 VAL 49 7.514 1.738 -4.125 385 HG13 VAL 49 3HG1 VAL 49 6.906 2.436 -5.627 386 HG21 VAL 49 3HG2 VAL 49 10.239 1.034 -4.407 387 HG22 VAL 49 1HG2 VAL 49 10.940 2.650 -4.479 388 HG23 VAL 49 2HG2 VAL 49 9.603 2.317 -3.379 389 H VAL 50 H VAL 50 8.222 1.106 -8.725 390 HA VAL 50 HA VAL 50 7.340 3.743 -9.700 391 HB VAL 50 HB VAL 50 7.403 2.865 -12.000 392 HG11 VAL 50 1HG1 VAL 50 9.867 2.853 -12.254 393 HG12 VAL 50 2HG1 VAL 50 9.282 4.163 -11.226 394 HG13 VAL 50 3HG1 VAL 50 10.017 2.732 -10.501 395 HG21 VAL 50 3HG2 VAL 50 7.190 0.462 -11.326 396 HG22 VAL 50 1HG2 VAL 50 8.428 0.778 -12.542 397 HG23 VAL 50 2HG2 VAL 50 8.892 0.503 -10.863 398 H LEU 51 H LEU 51 5.220 3.953 -10.197 399 HA LEU 51 HA LEU 51 3.292 2.339 -9.112 400 HB2 LEU 51 1HB LEU 51 2.837 4.593 -9.882 401 HB3 LEU 51 2HB LEU 51 3.083 4.084 -11.562 402 HG LEU 51 HG LEU 51 1.064 2.417 -10.705 403 HD11 LEU 51 1HD1 LEU 51 -0.335 3.424 -9.259 404 HD12 LEU 51 2HD1 LEU 51 0.033 5.040 -9.858 405 HD13 LEU 51 3HD1 LEU 51 1.130 4.249 -8.727 406 HD21 LEU 51 3HD2 LEU 51 0.482 5.074 -11.953 407 HD22 LEU 51 1HD2 LEU 51 -0.217 3.494 -12.306 408 HD23 LEU 51 2HD2 LEU 51 1.429 3.863 -12.819 409 H GLU 52 H GLU 52 1.869 0.760 -9.897 410 HA GLU 52 HA GLU 52 2.790 -0.631 -12.327 411 HB2 GLU 52 1HB GLU 52 3.329 -1.834 -10.213 412 HB3 GLU 52 2HB GLU 52 1.596 -1.908 -9.863 413 HG2 GLU 52 1HG GLU 52 1.941 -3.977 -10.779 414 HG3 GLU 52 2HG GLU 52 1.454 -3.044 -12.202 415 H ASP 53 H ASP 53 -0.008 -0.169 -10.179 416 HA ASP 53 HA ASP 53 -1.737 0.143 -12.481 417 HB2 ASP 53 1HB ASP 53 -1.881 -2.217 -10.628 418 HB3 ASP 53 2HB ASP 53 -3.358 -1.577 -11.361 419 H GLU 54 H GLU 54 -4.022 0.648 -11.762 420 HA GLU 54 HA GLU 54 -4.281 1.664 -9.060 421 HB2 GLU 54 1HB GLU 54 -3.771 3.386 -11.398 422 HB3 GLU 54 2HB GLU 54 -5.145 3.879 -10.396 423 HG2 GLU 54 1HG GLU 54 -3.396 3.505 -8.441 424 HG3 GLU 54 2HG GLU 54 -2.252 3.825 -9.751 425 H LEU 55 H LEU 55 -6.233 1.080 -8.410 426 HA LEU 55 HA LEU 55 -8.404 0.960 -10.397 427 HB2 LEU 55 1HB LEU 55 -8.270 -0.620 -7.832 428 HB3 LEU 55 2HB LEU 55 -9.373 -0.846 -9.201 429 HG LEU 55 HG LEU 55 -6.422 -1.246 -9.540 430 HD11 LEU 55 1HD1 LEU 55 -8.406 -3.108 -8.285 431 HD12 LEU 55 2HD1 LEU 55 -6.774 -2.700 -7.757 432 HD13 LEU 55 3HD1 LEU 55 -7.013 -3.720 -9.176 433 HD21 LEU 55 3HD2 LEU 55 -7.859 -3.083 -11.025 434 HD22 LEU 55 1HD2 LEU 55 -7.144 -1.585 -11.620 435 HD23 LEU 55 2HD2 LEU 55 -8.833 -1.615 -11.112 436 H GLN 56 H GLN 56 -10.192 2.127 -10.036 437 HA GLN 56 HA GLN 56 -10.403 3.524 -7.453 438 HB2 GLN 56 1HB GLN 56 -11.453 4.335 -10.175 439 HB3 GLN 56 2HB GLN 56 -11.683 5.248 -8.675 440 HG2 GLN 56 1HG GLN 56 -9.923 6.348 -9.715 441 HG3 GLN 56 2HG GLN 56 -9.130 5.300 -8.529 442 HE21 GLN 56 2HE2 GLN 56 -7.092 3.896 -10.914 443 HE22 GLN 56 1HE2 GLN 56 -7.348 4.450 -9.299 444 H ASN 57 H ASN 57 -12.616 4.031 -6.729 445 HA ASN 57 HA ASN 57 -14.625 3.268 -5.971 446 HB2 ASN 57 1HB ASN 57 -15.790 2.123 -8.270 447 HB3 ASN 57 2HB ASN 57 -16.017 3.763 -7.650 448 HD21 ASN 57 2HD2 ASN 57 -13.698 5.254 -9.903 449 HD22 ASN 57 1HD2 ASN 57 -14.273 5.335 -8.276 450 H ILE 58 H ILE 58 -12.857 1.519 -5.185 451 HA ILE 58 HA ILE 58 -14.114 -1.086 -5.716 452 HB ILE 58 HB ILE 58 -12.222 -1.779 -6.676 453 HG12 ILE 58 1HG1 ILE 58 -12.059 -2.613 -4.262 454 HG13 ILE 58 2HG1 ILE 58 -10.579 -2.667 -5.234 455 HG21 ILE 58 1HG2 ILE 58 -11.325 0.251 -7.302 456 HG22 ILE 58 2HG2 ILE 58 -11.110 0.790 -5.638 457 HG23 ILE 58 3HG2 ILE 58 -10.026 -0.424 -6.318 458 HD11 ILE 58 3HD1 ILE 58 -10.974 -1.426 -2.736 459 HD12 ILE 58 1HD1 ILE 58 -9.516 -1.457 -3.726 460 HD13 ILE 58 2HD1 ILE 58 -10.687 -0.152 -3.920 461 H SER 59 H SER 59 -14.454 -2.366 -3.960 462 HA SER 59 HA SER 59 -14.205 -1.118 -1.372 463 HB2 SER 59 1HB SER 59 -15.766 -3.270 -2.559 464 HB3 SER 59 2HB SER 59 -15.109 -3.730 -0.979 465 HG SER 59 HG SER 59 -16.818 -1.577 -1.616 466 HA PRO 60 HA PRO 60 -10.693 -3.184 0.253 467 HB2 PRO 60 2HB PRO 60 -11.252 -2.394 2.337 468 HB3 PRO 60 1HB PRO 60 -11.512 -4.099 2.702 469 HG2 PRO 60 1HG PRO 60 -13.804 -3.969 2.351 470 HG3 PRO 60 2HG PRO 60 -13.466 -2.339 3.044 471 HD2 PRO 60 1HD PRO 60 -14.756 -2.687 0.680 472 HD3 PRO 60 2HD PRO 60 -13.680 -1.314 0.992 473 H GLU 61 H GLU 61 -13.275 -4.927 -0.804 474 HA GLU 61 HA GLU 61 -12.099 -7.515 -0.052 475 HB2 GLU 61 1HB GLU 61 -14.855 -6.580 -0.554 476 HB3 GLU 61 2HB GLU 61 -14.459 -8.168 -1.227 477 HG2 GLU 61 1HG GLU 61 -13.678 -8.880 1.022 478 HG3 GLU 61 2HG GLU 61 -14.249 -7.330 1.654 479 H GLU 62 H GLU 62 -12.595 -5.348 -2.648 480 HA GLU 62 HA GLU 62 -12.302 -7.360 -4.715 481 HB2 GLU 62 1HB GLU 62 -12.980 -4.499 -4.588 482 HB3 GLU 62 2HB GLU 62 -11.999 -4.960 -5.987 483 HG2 GLU 62 1HG GLU 62 -14.035 -5.315 -6.898 484 HG3 GLU 62 2HG GLU 62 -13.811 -6.895 -6.132 485 H LEU 63 H LEU 63 -10.383 -4.811 -3.212 486 HA LEU 63 HA LEU 63 -8.181 -4.826 -4.912 487 HB2 LEU 63 1HB LEU 63 -8.879 -3.642 -2.477 488 HB3 LEU 63 2HB LEU 63 -7.390 -4.547 -2.149 489 HG LEU 63 HG LEU 63 -7.791 -2.304 -4.118 490 HD11 LEU 63 1HD1 LEU 63 -6.670 -2.575 -1.446 491 HD12 LEU 63 2HD1 LEU 63 -7.155 -1.130 -2.333 492 HD13 LEU 63 3HD1 LEU 63 -5.556 -1.828 -2.591 493 HD21 LEU 63 3HD2 LEU 63 -5.089 -3.361 -3.854 494 HD22 LEU 63 1HD2 LEU 63 -5.993 -2.903 -5.297 495 HD23 LEU 63 2HD2 LEU 63 -6.213 -4.504 -4.591 496 H LYS 64 H LYS 64 -8.470 -6.554 -1.802 497 HA LYS 64 HA LYS 64 -6.216 -7.992 -1.692 498 HB2 LYS 64 1HB LYS 64 -7.325 -8.977 -0.034 499 HB3 LYS 64 2HB LYS 64 -8.837 -8.295 -0.653 500 HG2 LYS 64 1HG LYS 64 -9.302 -10.221 -1.950 501 HG3 LYS 64 2HG LYS 64 -7.669 -10.861 -1.691 502 HD2 LYS 64 1HD LYS 64 -8.253 -11.836 0.232 503 HD3 LYS 64 2HD LYS 64 -9.010 -10.345 0.822 504 HE2 LYS 64 1HE LYS 64 -10.944 -10.954 -0.801 505 HE3 LYS 64 2HE LYS 64 -10.225 -12.572 -0.773 506 HZ1 LYS 64 3HZ LYS 64 -12.012 -11.607 1.027 507 HZ2 LYS 64 1HZ LYS 64 -10.540 -11.448 1.848 508 HZ3 LYS 64 2HZ LYS 64 -11.019 -12.958 1.257 509 H LEU 65 H LEU 65 -8.990 -8.825 -3.740 510 HA LEU 65 HA LEU 65 -7.917 -11.199 -4.806 511 HB2 LEU 65 1HB LEU 65 -10.096 -9.313 -5.534 512 HB3 LEU 65 2HB LEU 65 -9.516 -10.419 -6.793 513 HG LEU 65 HG LEU 65 -10.230 -12.319 -5.611 514 HD11 LEU 65 1HD1 LEU 65 -9.341 -11.575 -3.411 515 HD12 LEU 65 2HD1 LEU 65 -10.924 -12.348 -3.320 516 HD13 LEU 65 3HD1 LEU 65 -10.793 -10.593 -3.208 517 HD21 LEU 65 3HD2 LEU 65 -12.221 -10.081 -5.345 518 HD22 LEU 65 1HD2 LEU 65 -12.619 -11.766 -5.010 519 HD23 LEU 65 2HD2 LEU 65 -12.100 -11.288 -6.625 520 H GLU 66 H GLU 66 -7.729 -7.834 -5.870 521 HA GLU 66 HA GLU 66 -6.508 -8.246 -8.348 522 HB2 GLU 66 1HB GLU 66 -6.074 -5.928 -6.449 523 HB3 GLU 66 2HB GLU 66 -5.760 -5.929 -8.191 524 HG2 GLU 66 1HG GLU 66 -8.503 -6.496 -7.114 525 HG3 GLU 66 2HG GLU 66 -7.918 -4.840 -7.331 526 H LEU 67 H LEU 67 -5.163 -8.137 -5.109 527 HA LEU 67 HA LEU 67 -2.437 -7.998 -5.865 528 HB2 LEU 67 1HB LEU 67 -3.747 -9.065 -3.358 529 HB3 LEU 67 2HB LEU 67 -2.005 -8.814 -3.559 530 HG LEU 67 HG LEU 67 -4.043 -6.601 -3.737 531 HD11 LEU 67 1HD1 LEU 67 -3.726 -6.099 -1.507 532 HD12 LEU 67 2HD1 LEU 67 -2.230 -7.025 -1.401 533 HD13 LEU 67 3HD1 LEU 67 -3.779 -7.861 -1.483 534 HD21 LEU 67 3HD2 LEU 67 -1.175 -6.195 -3.085 535 HD22 LEU 67 1HD2 LEU 67 -2.301 -5.150 -3.952 536 HD23 LEU 67 2HD2 LEU 67 -1.601 -6.553 -4.760 537 HA PRO 68 HA PRO 68 -1.516 -12.097 -7.144 538 HB2 PRO 68 2HB PRO 68 0.591 -11.332 -7.650 539 HB3 PRO 68 1HB PRO 68 1.074 -12.339 -6.286 540 HG2 PRO 68 1HG PRO 68 1.095 -10.555 -4.797 541 HG3 PRO 68 2HG PRO 68 1.646 -9.749 -6.313 542 HD2 PRO 68 1HD PRO 68 -0.457 -8.846 -4.854 543 HD3 PRO 68 2HD PRO 68 -0.391 -8.715 -6.619 544 H GLU 69 H GLU 69 0.079 -13.988 -6.028 545 HA GLU 69 HA GLU 69 -1.249 -14.560 -3.461 546 HB2 GLU 69 1HB GLU 69 -0.964 -16.963 -4.032 547 HB3 GLU 69 2HB GLU 69 -2.017 -16.089 -5.155 548 HG2 GLU 69 1HG GLU 69 0.464 -15.836 -6.322 549 HG3 GLU 69 2HG GLU 69 0.493 -17.470 -5.643 550 H ARG 70 H ARG 70 1.738 -14.210 -5.105 551 HA ARG 70 HA ARG 70 3.192 -14.565 -2.634 552 HB2 ARG 70 1HB ARG 70 4.872 -16.098 -3.868 553 HB3 ARG 70 2HB ARG 70 3.384 -16.811 -3.224 554 HG2 ARG 70 1HG ARG 70 3.274 -17.751 -5.266 555 HG3 ARG 70 2HG ARG 70 2.545 -16.194 -5.694 556 HD2 ARG 70 1HD ARG 70 4.436 -15.430 -6.769 557 HD3 ARG 70 2HD ARG 70 5.509 -16.460 -5.810 558 HE ARG 70 HE ARG 70 3.802 -17.998 -7.497 559 HH11 ARG 70 2HH1 ARG 70 6.701 -16.071 -7.459 560 HH12 ARG 70 1HH1 ARG 70 7.408 -16.874 -8.821 561 HH21 ARG 70 1HH2 ARG 70 6.282 -18.574 -9.864 562 HH22 ARG 70 2HH2 ARG 70 4.723 -19.062 -9.292 563 H GLN 71 H GLN 71 2.733 -12.288 -4.138 564 HA GLN 71 HA GLN 71 5.450 -11.688 -5.081 565 HB2 GLN 71 1HB GLN 71 2.906 -11.446 -6.545 566 HB3 GLN 71 2HB GLN 71 3.929 -10.002 -6.600 567 HG2 GLN 71 1HG GLN 71 5.706 -11.151 -7.625 568 HG3 GLN 71 2HG GLN 71 4.993 -12.727 -7.256 569 HE21 GLN 71 2HE2 GLN 71 2.726 -12.705 -9.952 570 HE22 GLN 71 1HE2 GLN 71 3.025 -13.316 -8.364 571 HA PRO 72 HA PRO 72 4.751 -8.586 -1.915 572 HB2 PRO 72 2HB PRO 72 6.793 -9.193 -1.054 573 HB3 PRO 72 1HB PRO 72 7.349 -7.721 -1.849 574 HG2 PRO 72 1HG PRO 72 8.121 -8.857 -3.722 575 HG3 PRO 72 2HG PRO 72 8.460 -10.060 -2.423 576 HD2 PRO 72 1HD PRO 72 7.021 -10.670 -4.642 577 HD3 PRO 72 2HD PRO 72 6.692 -11.395 -3.059 578 H ARG 73 H ARG 73 3.989 -6.597 -2.249 579 HA ARG 73 HA ARG 73 5.326 -4.723 -3.969 580 HB2 ARG 73 1HB ARG 73 3.315 -4.294 -5.390 581 HB3 ARG 73 2HB ARG 73 4.092 -5.858 -5.683 582 HG2 ARG 73 1HG ARG 73 2.388 -6.969 -4.305 583 HG3 ARG 73 2HG ARG 73 1.600 -5.401 -4.055 584 HD2 ARG 73 1HD ARG 73 0.384 -6.398 -5.804 585 HD3 ARG 73 2HD ARG 73 1.465 -5.243 -6.595 586 HE ARG 73 HE ARG 73 2.781 -7.692 -6.534 587 HH11 ARG 73 2HH1 ARG 73 -0.075 -6.299 -7.958 588 HH12 ARG 73 1HH1 ARG 73 -0.050 -7.340 -9.342 589 HH21 ARG 73 1HH2 ARG 73 1.598 -8.915 -9.566 590 HH22 ARG 73 2HH2 ARG 73 2.824 -9.068 -8.352 591 H PHE 74 H PHE 74 4.107 -2.601 -4.025 592 HA PHE 74 HA PHE 74 3.025 -2.112 -1.354 593 HB2 PHE 74 1HB PHE 74 3.876 -0.119 -3.471 594 HB3 PHE 74 2HB PHE 74 3.479 0.243 -1.791 595 HD1 PHE 74 2HD PHE 74 4.868 -1.794 -0.280 596 HD2 PHE 74 1HD PHE 74 6.128 0.343 -3.740 597 HE1 PHE 74 2HE PHE 74 7.216 -2.130 0.371 598 HE2 PHE 74 1HE PHE 74 8.479 0.010 -3.093 599 HZ PHE 74 HZ PHE 74 9.026 -1.227 -1.035 600 H VAL 75 H VAL 75 1.026 -1.245 -0.971 601 HA VAL 75 HA VAL 75 -0.685 -0.593 -3.252 602 HB VAL 75 HB VAL 75 -1.433 -2.603 -1.125 603 HG11 VAL 75 1HG1 VAL 75 -3.052 -0.886 -2.816 604 HG12 VAL 75 2HG1 VAL 75 -3.408 -2.597 -3.058 605 HG13 VAL 75 3HG1 VAL 75 -3.522 -1.891 -1.445 606 HG21 VAL 75 3HG2 VAL 75 -1.103 -4.248 -2.634 607 HG22 VAL 75 1HG2 VAL 75 -1.652 -3.260 -3.988 608 HG23 VAL 75 2HG2 VAL 75 -0.009 -3.077 -3.372 609 H VAL 76 H VAL 76 -1.562 1.323 -2.876 610 HA VAL 76 HA VAL 76 -1.984 2.170 -0.089 611 HB VAL 76 HB VAL 76 -1.457 3.708 -2.612 612 HG11 VAL 76 1HG1 VAL 76 -3.251 4.964 -1.859 613 HG12 VAL 76 2HG1 VAL 76 -2.893 4.646 -0.160 614 HG13 VAL 76 3HG1 VAL 76 -1.880 5.756 -1.083 615 HG21 VAL 76 3HG2 VAL 76 0.248 4.781 -1.210 616 HG22 VAL 76 1HG2 VAL 76 -0.264 3.793 0.159 617 HG23 VAL 76 2HG2 VAL 76 0.454 3.031 -1.260 618 H TYR 77 H TYR 77 -4.007 1.502 0.421 619 HA TYR 77 HA TYR 77 -6.194 2.004 -1.452 620 HB2 TYR 77 1HB TYR 77 -5.970 -0.215 -0.317 621 HB3 TYR 77 2HB TYR 77 -6.279 0.592 1.222 622 HD1 TYR 77 2HD TYR 77 -7.955 1.285 -2.018 623 HD2 TYR 77 1HD TYR 77 -8.319 -0.372 1.884 624 HE1 TYR 77 2HE TYR 77 -10.379 1.043 -2.352 625 HE2 TYR 77 1HE TYR 77 -10.744 -0.618 1.559 626 HH TYR 77 HH TYR 77 -12.387 0.780 -1.150 627 H SER 78 H SER 78 -7.822 3.432 -1.091 628 HA SER 78 HA SER 78 -7.578 5.133 1.304 629 HB2 SER 78 1HB SER 78 -6.996 6.310 -0.791 630 HB3 SER 78 2HB SER 78 -8.597 5.913 -1.439 631 HG SER 78 HG SER 78 -9.411 7.506 -0.345 632 H TYR 79 H TYR 79 -9.059 4.170 2.625 633 HA TYR 79 HA TYR 79 -11.695 3.485 1.636 634 HB2 TYR 79 1HB TYR 79 -10.743 1.970 3.228 635 HB3 TYR 79 2HB TYR 79 -10.405 3.282 4.360 636 HD1 TYR 79 1HD TYR 79 -13.034 1.128 2.981 637 HD2 TYR 79 2HD TYR 79 -12.143 4.232 5.751 638 HE1 TYR 79 1HE TYR 79 -15.206 0.766 4.077 639 HE2 TYR 79 2HE TYR 79 -14.312 3.878 6.855 640 HH TYR 79 HH TYR 79 -16.704 1.664 5.537 641 H LYS 80 H LYS 80 -13.633 4.222 2.881 642 HA LYS 80 HA LYS 80 -13.375 7.079 3.556 643 HB2 LYS 80 1HB LYS 80 -14.636 6.648 1.478 644 HB3 LYS 80 2HB LYS 80 -15.767 5.640 2.393 645 HG2 LYS 80 1HG LYS 80 -16.396 7.596 3.754 646 HG3 LYS 80 2HG LYS 80 -15.313 8.593 2.768 647 HD2 LYS 80 1HD LYS 80 -17.323 8.977 1.712 648 HD3 LYS 80 2HD LYS 80 -16.703 7.604 0.776 649 HE2 LYS 80 1HE LYS 80 -18.098 6.057 1.921 650 HE3 LYS 80 2HE LYS 80 -18.515 7.259 3.153 651 HZ1 LYS 80 3HZ LYS 80 -20.051 6.697 1.047 652 HZ2 LYS 80 1HZ LYS 80 -19.172 8.004 0.429 653 HZ3 LYS 80 2HZ LYS 80 -20.072 8.186 1.850 654 H TYR 81 H TYR 81 -13.529 7.385 5.673 655 HA TYR 81 HA TYR 81 -15.305 5.636 7.235 656 HB2 TYR 81 1HB TYR 81 -12.682 6.184 7.672 657 HB3 TYR 81 2HB TYR 81 -13.441 7.437 8.657 658 HD1 TYR 81 2HD TYR 81 -15.525 6.497 10.107 659 HD2 TYR 81 1HD TYR 81 -12.192 4.211 8.777 660 HE1 TYR 81 2HE TYR 81 -15.923 4.877 11.915 661 HE2 TYR 81 1HE TYR 81 -12.580 2.584 10.580 662 HH TYR 81 HH TYR 81 -15.237 2.160 12.133 663 H VAL 82 H VAL 82 -16.999 6.448 8.333 664 HA VAL 82 HA VAL 82 -17.609 9.283 7.948 665 HB VAL 82 HB VAL 82 -19.411 7.110 9.021 666 HG11 VAL 82 1HG1 VAL 82 -20.525 8.974 9.661 667 HG12 VAL 82 2HG1 VAL 82 -19.730 9.995 8.460 668 HG13 VAL 82 3HG1 VAL 82 -21.063 8.941 7.982 669 HG21 VAL 82 3HG2 VAL 82 -18.528 6.818 6.638 670 HG22 VAL 82 1HG2 VAL 82 -20.277 6.787 6.867 671 HG23 VAL 82 2HG2 VAL 82 -19.495 8.237 6.239 672 H HIS 83 H HIS 83 -18.357 10.601 9.677 673 HA HIS 83 HA HIS 83 -17.060 9.964 12.209 674 HB2 HIS 83 1HB HIS 83 -18.241 12.498 11.067 675 HB3 HIS 83 2HB HIS 83 -17.690 12.379 12.741 676 HD1 HIS 83 1HD HIS 83 -15.357 13.091 13.106 677 HD2 HIS 83 2HD HIS 83 -15.964 11.742 9.224 678 HE1 HIS 83 1HE HIS 83 -13.163 13.432 11.926 679 HE2 HIS 83 2HE HIS 83 -13.533 12.609 9.552 680 H ASP 84 H ASP 84 -19.848 12.048 12.038 681 HA ASP 84 HA ASP 84 -21.855 10.265 12.797 682 HB2 ASP 84 1HB ASP 84 -20.077 10.383 14.828 683 HB3 ASP 84 2HB ASP 84 -21.123 11.740 15.260 684 H ASP 85 H ASP 85 -20.584 13.495 13.566 685 HA ASP 85 HA ASP 85 -23.102 14.749 13.808 686 HB2 ASP 85 1HB ASP 85 -20.493 15.492 14.256 687 HB3 ASP 85 2HB ASP 85 -20.920 16.457 12.837 688 H GLY 86 H GLY 86 -21.517 13.520 11.109 689 HA2 GLY 86 1HA GLY 86 -22.987 13.520 9.091 690 HA3 GLY 86 2HA GLY 86 -23.100 15.259 9.317 691 H ARG 87 H ARG 87 -20.032 14.069 10.074 692 HA ARG 87 HA ARG 87 -19.015 15.023 7.485 693 HB2 ARG 87 1HB ARG 87 -17.767 14.926 10.233 694 HB3 ARG 87 2HB ARG 87 -16.836 15.269 8.767 695 HG2 ARG 87 1HG ARG 87 -19.239 16.888 9.595 696 HG3 ARG 87 2HG ARG 87 -17.582 17.274 10.089 697 HD2 ARG 87 1HD ARG 87 -16.899 17.764 7.908 698 HD3 ARG 87 2HD ARG 87 -18.257 16.879 7.198 699 HE ARG 87 HE ARG 87 -19.540 18.766 7.377 700 HH11 ARG 87 2HH1 ARG 87 -16.718 19.113 9.384 701 HH12 ARG 87 1HH1 ARG 87 -17.025 20.777 9.755 702 HH21 ARG 87 1HH2 ARG 87 -18.868 21.825 8.887 703 HH22 ARG 87 2HH2 ARG 87 -19.956 20.956 7.857 704 H VAL 88 H VAL 88 -17.590 13.811 6.295 705 HA VAL 88 HA VAL 88 -16.772 11.200 7.342 706 HB VAL 88 HB VAL 88 -18.783 10.672 6.139 707 HG11 VAL 88 1HG1 VAL 88 -17.636 11.948 3.669 708 HG12 VAL 88 2HG1 VAL 88 -19.278 11.359 3.938 709 HG13 VAL 88 3HG1 VAL 88 -18.712 12.808 4.771 710 HG21 VAL 88 3HG2 VAL 88 -17.757 9.348 4.178 711 HG22 VAL 88 1HG2 VAL 88 -16.215 9.976 4.758 712 HG23 VAL 88 2HG2 VAL 88 -17.213 8.979 5.815 713 H SER 89 H SER 89 -14.676 10.905 7.006 714 HA SER 89 HA SER 89 -13.403 12.314 4.751 715 HB2 SER 89 1HB SER 89 -12.323 11.677 7.509 716 HB3 SER 89 2HB SER 89 -11.310 12.242 6.169 717 HG SER 89 HG SER 89 -12.850 14.068 6.066 718 H TYR 90 H TYR 90 -11.430 11.261 3.911 719 HA TYR 90 HA TYR 90 -11.756 8.336 3.918 720 HB2 TYR 90 1HB TYR 90 -10.206 9.778 1.798 721 HB3 TYR 90 2HB TYR 90 -11.122 8.273 1.689 722 HD1 TYR 90 2HD TYR 90 -13.648 8.366 1.686 723 HD2 TYR 90 1HD TYR 90 -11.229 11.835 1.214 724 HE1 TYR 90 2HE TYR 90 -15.570 9.571 0.734 725 HE2 TYR 90 1HE TYR 90 -13.144 13.049 0.261 726 HH TYR 90 HH TYR 90 -15.266 12.934 -0.373 727 HA PRO 91 HA PRO 91 -7.797 8.787 6.119 728 HB2 PRO 91 2HB PRO 91 -8.779 7.818 7.956 729 HB3 PRO 91 1HB PRO 91 -7.978 6.360 7.373 730 HG2 PRO 91 1HG PRO 91 -9.883 5.576 6.297 731 HG3 PRO 91 2HG PRO 91 -10.607 6.399 7.730 732 HD2 PRO 91 1HD PRO 91 -11.362 6.957 5.182 733 HD3 PRO 91 2HD PRO 91 -11.330 8.183 6.462 734 H LEU 92 H LEU 92 -6.477 8.633 4.294 735 HA LEU 92 HA LEU 92 -6.196 6.231 2.785 736 HB2 LEU 92 1HB LEU 92 -5.060 8.925 2.797 737 HB3 LEU 92 2HB LEU 92 -3.891 7.671 2.349 738 HG LEU 92 HG LEU 92 -6.210 7.141 0.850 739 HD11 LEU 92 1HD1 LEU 92 -6.016 9.508 -0.381 740 HD12 LEU 92 2HD1 LEU 92 -5.751 10.027 1.282 741 HD13 LEU 92 3HD1 LEU 92 -7.226 9.161 0.854 742 HD21 LEU 92 3HD2 LEU 92 -3.407 7.907 0.426 743 HD22 LEU 92 1HD2 LEU 92 -4.495 8.296 -0.906 744 HD23 LEU 92 2HD2 LEU 92 -4.366 6.634 -0.329 745 H CYS 93 H CYS 93 -4.907 4.525 3.103 746 HA CYS 93 HA CYS 93 -2.788 4.731 5.134 747 HB2 CYS 93 1HB CYS 93 -4.799 2.505 4.778 748 HB3 CYS 93 2HB CYS 93 -3.358 2.375 5.801 749 HG CYS 93 HG CYS 93 -6.070 4.384 6.311 750 H PHE 94 H PHE 94 -1.198 2.905 4.971 751 HA PHE 94 HA PHE 94 -0.689 2.324 2.133 752 HB2 PHE 94 1HB PHE 94 1.008 3.721 3.266 753 HB3 PHE 94 2HB PHE 94 1.269 2.427 4.438 754 HD1 PHE 94 1HD PHE 94 1.528 3.224 0.829 755 HD2 PHE 94 2HD PHE 94 2.757 0.677 4.012 756 HE1 PHE 94 1HE PHE 94 3.218 2.207 -0.641 757 HE2 PHE 94 2HE PHE 94 4.449 -0.342 2.547 758 HZ PHE 94 HZ PHE 94 4.683 0.422 0.217 759 H ILE 95 H ILE 95 -1.528 0.363 1.720 760 HA ILE 95 HA ILE 95 -1.198 -1.798 3.654 761 HB ILE 95 HB ILE 95 -2.673 -1.769 1.018 762 HG12 ILE 95 1HG1 ILE 95 -3.714 -1.654 3.861 763 HG13 ILE 95 2HG1 ILE 95 -3.647 -0.281 2.742 764 HG21 ILE 95 1HG2 ILE 95 -3.754 -3.838 2.149 765 HG22 ILE 95 2HG2 ILE 95 -2.186 -4.004 1.360 766 HG23 ILE 95 3HG2 ILE 95 -2.279 -3.862 3.115 767 HD11 ILE 95 3HD1 ILE 95 -5.068 -1.859 1.206 768 HD12 ILE 95 1HD1 ILE 95 -5.475 -2.621 2.743 769 HD13 ILE 95 2HD1 ILE 95 -5.822 -0.910 2.488 770 H PHE 96 H PHE 96 0.757 -2.720 3.586 771 HA PHE 96 HA PHE 96 2.153 -3.059 1.062 772 HB2 PHE 96 1HB PHE 96 3.452 -2.329 2.979 773 HB3 PHE 96 2HB PHE 96 2.937 -3.743 3.902 774 HD1 PHE 96 1HD PHE 96 3.595 -4.374 0.433 775 HD2 PHE 96 2HD PHE 96 5.392 -4.114 4.282 776 HE1 PHE 96 1HE PHE 96 5.533 -5.646 -0.391 777 HE2 PHE 96 2HE PHE 96 7.334 -5.384 3.465 778 HZ PHE 96 HZ PHE 96 7.406 -6.152 1.125 779 H SER 97 H SER 97 1.568 -4.717 -0.174 780 HA SER 97 HA SER 97 0.401 -7.106 0.920 781 HB2 SER 97 1HB SER 97 -0.266 -6.081 -1.283 782 HB3 SER 97 2HB SER 97 1.294 -6.619 -1.929 783 HG SER 97 HG SER 97 0.483 -8.771 -0.969 784 H SER 98 H SER 98 1.767 -8.370 2.046 785 HA SER 98 HA SER 98 4.160 -9.343 0.639 786 HB2 SER 98 1HB SER 98 4.461 -7.665 2.671 787 HB3 SER 98 2HB SER 98 4.201 -9.139 3.621 788 HG SER 98 HG SER 98 6.192 -8.732 1.639 789 HA PRO 99 HA PRO 99 1.638 -13.002 1.634 790 HB2 PRO 99 2HB PRO 99 1.332 -13.331 -0.620 791 HB3 PRO 99 1HB PRO 99 2.631 -14.507 -0.429 792 HG2 PRO 99 1HG PRO 99 4.266 -13.025 -1.157 793 HG3 PRO 99 2HG PRO 99 2.862 -12.518 -2.170 794 HD2 PRO 99 1HD PRO 99 4.261 -10.776 -0.625 795 HD3 PRO 99 2HD PRO 99 2.520 -10.615 -0.914 796 H VAL 100 H VAL 100 2.705 -15.478 1.219 797 HA VAL 100 HA VAL 100 5.170 -15.456 2.839 798 HB VAL 100 HB VAL 100 2.783 -17.285 3.025 799 HG11 VAL 100 1HG1 VAL 100 4.838 -18.637 2.992 800 HG12 VAL 100 2HG1 VAL 100 5.476 -17.676 4.327 801 HG13 VAL 100 3HG1 VAL 100 4.041 -18.675 4.564 802 HG21 VAL 100 3HG2 VAL 100 4.224 -15.804 5.211 803 HG22 VAL 100 1HG2 VAL 100 2.885 -15.103 4.301 804 HG23 VAL 100 2HG2 VAL 100 2.629 -16.555 5.269 805 H GLY 101 H GLY 101 3.394 -16.895 0.195 806 HA2 GLY 101 1HA GLY 101 5.314 -18.981 -0.293 807 HA3 GLY 101 2HA GLY 101 3.979 -18.524 -1.341 808 H CYS 102 H CYS 102 5.831 -15.850 -0.483 809 HA CYS 102 HA CYS 102 6.919 -15.690 -3.166 810 HB2 CYS 102 1HB CYS 102 7.721 -13.417 -2.314 811 HB3 CYS 102 2HB CYS 102 5.973 -13.659 -2.459 812 HG CYS 102 HG CYS 102 7.545 -14.116 0.532 813 H LYS 103 H LYS 103 9.211 -14.474 -3.132 814 HA LYS 103 HA LYS 103 10.998 -16.307 -1.693 815 HB2 LYS 103 1HB LYS 103 11.886 -14.494 -3.916 816 HB3 LYS 103 2HB LYS 103 12.554 -16.055 -3.410 817 HG2 LYS 103 1HG LYS 103 11.349 -17.115 -4.934 818 HG3 LYS 103 2HG LYS 103 9.858 -16.438 -4.258 819 HD2 LYS 103 1HD LYS 103 10.098 -15.863 -6.628 820 HD3 LYS 103 2HD LYS 103 10.144 -14.420 -5.600 821 HE2 LYS 103 1HE LYS 103 12.027 -13.867 -6.679 822 HE3 LYS 103 2HE LYS 103 12.794 -15.167 -5.754 823 HZ1 LYS 103 3HZ LYS 103 13.219 -16.155 -7.675 824 HZ2 LYS 103 1HZ LYS 103 12.319 -15.014 -8.539 825 HZ3 LYS 103 2HZ LYS 103 11.560 -16.386 -7.906 826 HA PRO 104 HA PRO 104 12.526 -13.097 0.893 827 HB2 PRO 104 2HB PRO 104 13.605 -14.748 2.071 828 HB3 PRO 104 1HB PRO 104 15.056 -14.031 1.371 829 HG2 PRO 104 1HG PRO 104 15.163 -15.585 -0.352 830 HG3 PRO 104 2HG PRO 104 14.509 -16.597 0.988 831 HD2 PRO 104 1HD PRO 104 13.292 -16.406 -1.430 832 HD3 PRO 104 2HD PRO 104 12.390 -16.604 0.082 833 H GLU 105 H GLU 105 13.849 -13.757 -2.182 834 HA GLU 105 HA GLU 105 15.919 -11.771 -2.135 835 HB2 GLU 105 1HB GLU 105 14.643 -13.461 -4.269 836 HB3 GLU 105 2HB GLU 105 15.726 -12.130 -4.707 837 HG2 GLU 105 1HG GLU 105 16.413 -14.515 -2.992 838 HG3 GLU 105 2HG GLU 105 16.949 -14.205 -4.649 839 H GLN 106 H GLN 106 12.562 -11.907 -3.169 840 HA GLN 106 HA GLN 106 12.676 -9.189 -4.206 841 HB2 GLN 106 1HB GLN 106 10.169 -10.830 -3.959 842 HB3 GLN 106 2HB GLN 106 10.562 -9.568 -5.138 843 HG2 GLN 106 1HG GLN 106 11.941 -12.248 -5.034 844 HG3 GLN 106 2HG GLN 106 10.536 -11.891 -6.048 845 HE21 GLN 106 2HE2 GLN 106 12.403 -9.533 -8.082 846 HE22 GLN 106 1HE2 GLN 106 10.927 -9.597 -7.187 847 H GLN 107 H GLN 107 10.669 -10.954 -1.841 848 HA GLN 107 HA GLN 107 9.220 -9.013 -0.699 849 HB2 GLN 107 1HB GLN 107 10.066 -11.559 0.073 850 HB3 GLN 107 2HB GLN 107 10.522 -10.506 1.422 851 HG2 GLN 107 1HG GLN 107 7.835 -9.949 0.465 852 HG3 GLN 107 2HG GLN 107 8.041 -11.629 0.981 853 HE21 GLN 107 2HE2 GLN 107 8.748 -8.702 3.762 854 HE22 GLN 107 1HE2 GLN 107 9.208 -8.470 2.113 855 H MET 108 H MET 108 12.673 -9.515 -0.162 856 HA MET 108 HA MET 108 13.006 -7.589 1.866 857 HB2 MET 108 1HB MET 108 14.827 -8.947 -0.086 858 HB3 MET 108 2HB MET 108 15.436 -7.575 0.851 859 HG2 MET 108 1HG MET 108 14.360 -8.981 2.853 860 HG3 MET 108 2HG MET 108 14.713 -10.300 1.734 861 HE1 MET 108 3HE MET 108 16.887 -10.301 0.386 862 HE2 MET 108 1HE MET 108 17.721 -8.748 0.435 863 HE3 MET 108 2HE MET 108 18.457 -10.166 1.180 864 H MET 109 H MET 109 13.249 -7.376 -1.661 865 HA MET 109 HA MET 109 14.216 -4.786 -1.894 866 HB2 MET 109 1HB MET 109 12.651 -6.629 -3.605 867 HB3 MET 109 2HB MET 109 12.573 -4.914 -4.035 868 HG2 MET 109 1HG MET 109 15.286 -5.437 -3.568 869 HG3 MET 109 2HG MET 109 14.677 -6.815 -4.487 870 HE1 MET 109 3HE MET 109 13.986 -6.551 -7.267 871 HE2 MET 109 1HE MET 109 12.640 -6.126 -6.210 872 HE3 MET 109 2HE MET 109 13.054 -5.085 -7.571 873 H TYR 110 H TYR 110 11.018 -5.921 -1.097 874 HA TYR 110 HA TYR 110 9.912 -3.222 -1.292 875 HB2 TYR 110 1HB TYR 110 8.520 -5.801 -0.526 876 HB3 TYR 110 2HB TYR 110 7.749 -4.261 -0.919 877 HD1 TYR 110 2HD TYR 110 9.692 -7.059 -2.358 878 HD2 TYR 110 1HD TYR 110 7.323 -3.617 -3.163 879 HE1 TYR 110 2HE TYR 110 9.572 -7.703 -4.730 880 HE2 TYR 110 1HE TYR 110 7.196 -4.253 -5.536 881 HH TYR 110 HH TYR 110 8.584 -7.288 -6.701 882 H ALA 111 H ALA 111 10.783 -5.661 1.067 883 HA ALA 111 HA ALA 111 9.569 -4.399 3.309 884 HB1 ALA 111 3HB ALA 111 11.798 -5.960 4.133 885 HB2 ALA 111 1HB ALA 111 10.079 -6.341 4.246 886 HB3 ALA 111 2HB ALA 111 10.991 -6.795 2.806 887 H GLY 112 H GLY 112 12.613 -4.021 1.656 888 HA2 GLY 112 1HA GLY 112 13.734 -2.412 3.817 889 HA3 GLY 112 2HA GLY 112 14.549 -2.870 2.328 890 H SER 113 H SER 113 12.287 -1.993 0.660 891 HA SER 113 HA SER 113 12.979 0.839 0.617 892 HB2 SER 113 1HB SER 113 11.244 -0.562 -1.416 893 HB3 SER 113 2HB SER 113 12.277 0.864 -1.629 894 HG SER 113 HG SER 113 13.375 -1.644 -0.944 895 H LYS 114 H LYS 114 10.611 -1.049 1.947 896 HA LYS 114 HA LYS 114 8.197 0.170 1.420 897 HB2 LYS 114 1HB LYS 114 8.344 -1.813 2.795 898 HB3 LYS 114 2HB LYS 114 9.232 -0.922 4.042 899 HG2 LYS 114 1HG LYS 114 7.336 0.316 4.680 900 HG3 LYS 114 2HG LYS 114 6.449 -0.156 3.220 901 HD2 LYS 114 1HD LYS 114 5.485 -1.567 4.756 902 HD3 LYS 114 2HD LYS 114 6.811 -2.583 4.166 903 HE2 LYS 114 1HE LYS 114 8.195 -1.947 6.070 904 HE3 LYS 114 2HE LYS 114 6.921 -0.860 6.640 905 HZ1 LYS 114 3HZ LYS 114 5.485 -2.977 6.644 906 HZ2 LYS 114 1HZ LYS 114 6.599 -2.749 7.899 907 HZ3 LYS 114 2HZ LYS 114 6.961 -3.805 6.628 908 H ASN 115 H ASN 115 10.148 0.928 4.311 909 HA ASN 115 HA ASN 115 8.865 3.177 5.149 910 HB2 ASN 115 1HB ASN 115 11.767 2.391 5.226 911 HB3 ASN 115 2HB ASN 115 11.248 3.950 5.880 912 HD21 ASN 115 2HD2 ASN 115 11.122 0.939 8.296 913 HD22 ASN 115 1HD2 ASN 115 12.203 1.221 6.978 914 H ARG 116 H ARG 116 11.261 2.947 2.569 915 HA ARG 116 HA ARG 116 11.569 5.705 2.102 916 HB2 ARG 116 1HB ARG 116 13.194 4.251 1.178 917 HB3 ARG 116 2HB ARG 116 11.961 3.285 0.352 918 HG2 ARG 116 1HG ARG 116 13.037 4.573 -1.314 919 HG3 ARG 116 2HG ARG 116 11.448 5.308 -1.044 920 HD2 ARG 116 1HD ARG 116 12.701 7.210 -0.984 921 HD3 ARG 116 2HD ARG 116 12.839 6.738 0.716 922 HE ARG 116 HE ARG 116 14.933 5.511 -0.632 923 HH11 ARG 116 2HH1 ARG 116 13.844 8.741 0.074 924 HH12 ARG 116 1HH1 ARG 116 15.438 9.420 0.070 925 HH21 ARG 116 1HH2 ARG 116 17.253 8.084 -0.338 926 HH22 ARG 116 2HH2 ARG 116 17.036 6.393 -0.641 927 H LEU 117 H LEU 117 9.518 3.306 0.451 928 HA LEU 117 HA LEU 117 8.255 5.132 -1.275 929 HB2 LEU 117 1HB LEU 117 8.303 2.625 -1.485 930 HB3 LEU 117 2HB LEU 117 7.074 2.575 -0.208 931 HG LEU 117 HG LEU 117 6.270 2.343 -2.610 932 HD11 LEU 117 1HD1 LEU 117 4.228 3.214 -2.044 933 HD12 LEU 117 2HD1 LEU 117 4.922 4.655 -1.301 934 HD13 LEU 117 3HD1 LEU 117 4.988 3.109 -0.456 935 HD21 LEU 117 3HD2 LEU 117 6.248 4.133 -4.043 936 HD22 LEU 117 1HD2 LEU 117 7.790 4.394 -3.227 937 HD23 LEU 117 2HD2 LEU 117 6.368 5.319 -2.743 938 H VAL 118 H VAL 118 7.118 3.704 1.787 939 HA VAL 118 HA VAL 118 4.687 5.021 1.978 940 HB VAL 118 HB VAL 118 6.565 4.175 4.186 941 HG11 VAL 118 1HG1 VAL 118 5.205 5.067 5.699 942 HG12 VAL 118 2HG1 VAL 118 4.332 5.863 4.388 943 HG13 VAL 118 3HG1 VAL 118 3.806 4.281 4.967 944 HG21 VAL 118 3HG2 VAL 118 4.628 2.801 2.488 945 HG22 VAL 118 1HG2 VAL 118 5.937 2.149 3.474 946 HG23 VAL 118 2HG2 VAL 118 4.376 2.519 4.210 947 H GLN 119 H GLN 119 7.830 6.035 3.314 948 HA GLN 119 HA GLN 119 7.055 8.401 4.507 949 HB2 GLN 119 1HB GLN 119 9.590 7.362 3.352 950 HB3 GLN 119 2HB GLN 119 9.502 9.103 3.665 951 HG2 GLN 119 1HG GLN 119 8.519 7.521 5.903 952 HG3 GLN 119 2HG GLN 119 10.197 7.154 5.479 953 HE21 GLN 119 2HE2 GLN 119 11.406 9.913 7.137 954 HE22 GLN 119 1HE2 GLN 119 11.605 8.288 6.584 955 H THR 120 H THR 120 7.815 7.767 1.125 956 HA THR 120 HA THR 120 7.824 10.431 0.225 957 HB THR 120 HB THR 120 6.904 8.089 -1.437 958 HG1 THR 120 1HG THR 120 8.906 7.351 -1.469 959 HG21 THR 120 3HG2 THR 120 7.661 10.846 -1.945 960 HG22 THR 120 1HG2 THR 120 6.863 9.685 -3.004 961 HG23 THR 120 2HG2 THR 120 8.623 9.709 -2.890 962 H ALA 121 H ALA 121 5.212 8.048 0.475 963 HA ALA 121 HA ALA 121 3.239 9.819 -0.628 964 HB1 ALA 121 3HB ALA 121 3.233 7.080 0.530 965 HB2 ALA 121 1HB ALA 121 1.708 7.962 0.453 966 HB3 ALA 121 2HB ALA 121 2.625 7.654 -1.022 967 H GLU 122 H GLU 122 4.726 9.550 2.381 968 HA GLU 122 HA GLU 122 4.368 10.532 4.401 969 HB2 GLU 122 1HB GLU 122 3.502 12.350 2.535 970 HB3 GLU 122 2HB GLU 122 2.083 12.181 3.580 971 HG2 GLU 122 1HG GLU 122 3.582 14.032 4.245 972 HG3 GLU 122 2HG GLU 122 3.339 12.819 5.511 973 H LEU 123 H LEU 123 3.095 8.100 3.946 974 HA LEU 123 HA LEU 123 0.418 8.379 5.091 975 HB2 LEU 123 1HB LEU 123 1.863 5.927 4.070 976 HB3 LEU 123 2HB LEU 123 0.176 5.995 4.608 977 HG LEU 123 HG LEU 123 1.077 7.718 2.334 978 HD11 LEU 123 1HD1 LEU 123 1.728 5.196 2.103 979 HD12 LEU 123 2HD1 LEU 123 0.953 6.047 0.767 980 HD13 LEU 123 3HD1 LEU 123 0.001 4.988 1.807 981 HD21 LEU 123 3HD2 LEU 123 -1.367 6.933 1.701 982 HD22 LEU 123 1HD2 LEU 123 -1.083 8.266 2.821 983 HD23 LEU 123 2HD2 LEU 123 -1.470 6.661 3.441 984 H THR 124 H THR 124 1.100 9.023 7.191 985 HA THR 124 HA THR 124 2.915 7.822 8.854 986 HB THR 124 HB THR 124 0.254 9.084 9.484 987 HG1 THR 124 1HG THR 124 2.891 9.896 9.253 988 HG21 THR 124 3HG2 THR 124 1.178 9.173 11.867 989 HG22 THR 124 1HG2 THR 124 2.264 7.877 11.368 990 HG23 THR 124 2HG2 THR 124 0.518 7.633 11.318 991 H LYS 125 H LYS 125 -0.361 6.761 8.104 992 HA LYS 125 HA LYS 125 -0.126 4.495 9.924 993 HB2 LYS 125 1HB LYS 125 -2.319 5.852 8.471 994 HB3 LYS 125 2HB LYS 125 -2.486 4.098 8.652 995 HG2 LYS 125 1HG LYS 125 -2.301 4.284 11.062 996 HG3 LYS 125 2HG LYS 125 -2.037 6.031 10.918 997 HD2 LYS 125 1HD LYS 125 -4.519 4.660 9.879 998 HD3 LYS 125 2HD LYS 125 -4.387 5.304 11.524 999 HE2 LYS 125 1HE LYS 125 -3.577 7.167 9.380 1000 HE3 LYS 125 2HE LYS 125 -5.289 6.721 9.397 1001 HZ1 LYS 125 3HZ LYS 125 -4.235 8.680 10.878 1002 HZ2 LYS 125 1HZ LYS 125 -4.189 7.401 11.984 1003 HZ3 LYS 125 2HZ LYS 125 -5.656 7.856 11.278 1004 H VAL 126 H VAL 126 1.184 2.951 9.131 1005 HA VAL 126 HA VAL 126 0.586 1.930 6.432 1006 HB VAL 126 HB VAL 126 2.700 2.796 6.088 1007 HG11 VAL 126 1HG1 VAL 126 3.095 3.546 8.373 1008 HG12 VAL 126 2HG1 VAL 126 3.476 1.893 8.861 1009 HG13 VAL 126 3HG1 VAL 126 4.523 2.741 7.723 1010 HG21 VAL 126 3HG2 VAL 126 4.003 0.979 5.610 1011 HG22 VAL 126 1HG2 VAL 126 3.708 0.217 7.174 1012 HG23 VAL 126 2HG2 VAL 126 2.468 0.168 5.920 1013 H PHE 127 H PHE 127 -0.342 0.005 6.583 1014 HA PHE 127 HA PHE 127 0.419 -1.767 8.805 1015 HB2 PHE 127 1HB PHE 127 -2.023 -2.163 7.093 1016 HB3 PHE 127 2HB PHE 127 -1.724 -2.717 8.742 1017 HD1 PHE 127 1HD PHE 127 -0.966 -0.439 10.245 1018 HD2 PHE 127 2HD PHE 127 -3.799 -0.697 7.078 1019 HE1 PHE 127 1HE PHE 127 -2.147 1.522 11.145 1020 HE2 PHE 127 2HE PHE 127 -4.983 1.265 7.973 1021 HZ PHE 127 HZ PHE 127 -4.158 2.377 10.009 1022 H GLU 128 H GLU 128 0.379 -4.117 8.309 1023 HA GLU 128 HA GLU 128 1.228 -4.672 5.545 1024 HB2 GLU 128 1HB GLU 128 3.119 -4.515 7.251 1025 HB3 GLU 128 2HB GLU 128 2.455 -5.996 7.958 1026 HG2 GLU 128 1HG GLU 128 2.625 -6.764 5.385 1027 HG3 GLU 128 2HG GLU 128 3.956 -5.600 5.455 1028 H ILE 129 H ILE 129 0.441 -6.496 4.631 1029 HA ILE 129 HA ILE 129 -1.293 -8.184 6.313 1030 HB ILE 129 HB ILE 129 -2.395 -8.740 4.045 1031 HG12 ILE 129 1HG1 ILE 129 -1.316 -6.013 3.333 1032 HG13 ILE 129 2HG1 ILE 129 -0.530 -7.507 2.797 1033 HG21 ILE 129 1HG2 ILE 129 -2.916 -5.920 4.865 1034 HG22 ILE 129 2HG2 ILE 129 -4.055 -7.213 4.492 1035 HG23 ILE 129 3HG2 ILE 129 -3.183 -7.222 6.024 1036 HD11 ILE 129 3HD1 ILE 129 -2.407 -6.199 1.376 1037 HD12 ILE 129 1HD1 ILE 129 -2.077 -7.925 1.233 1038 HD13 ILE 129 2HD1 ILE 129 -3.407 -7.363 2.245 1039 H ARG 130 H ARG 130 -0.713 -10.237 6.535 1040 HA ARG 130 HA ARG 130 1.559 -11.294 5.169 1041 HB2 ARG 130 1HB ARG 130 0.690 -11.798 7.563 1042 HB3 ARG 130 2HB ARG 130 -0.365 -12.965 6.752 1043 HG2 ARG 130 1HG ARG 130 1.441 -14.270 7.356 1044 HG3 ARG 130 2HG ARG 130 1.813 -13.843 5.677 1045 HD2 ARG 130 1HD ARG 130 3.813 -13.202 6.480 1046 HD3 ARG 130 2HD ARG 130 2.942 -11.764 7.030 1047 HE ARG 130 HE ARG 130 3.355 -12.439 9.160 1048 HH11 ARG 130 2HH1 ARG 130 3.359 -15.251 7.108 1049 HH12 ARG 130 1HH1 ARG 130 3.768 -16.345 8.387 1050 HH21 ARG 130 1HH2 ARG 130 4.070 -15.559 10.517 1051 HH22 ARG 130 2HH2 ARG 130 3.893 -13.870 10.853 1052 H THR 131 H THR 131 -1.693 -11.066 4.360 1053 HA THR 131 HA THR 131 -1.365 -12.544 1.958 1054 HB THR 131 HB THR 131 -1.668 -14.535 3.190 1055 HG1 THR 131 1HG THR 131 -3.250 -15.236 1.963 1056 HG21 THR 131 3HG2 THR 131 -2.710 -13.086 5.162 1057 HG22 THR 131 1HG2 THR 131 -2.976 -14.825 5.040 1058 HG23 THR 131 2HG2 THR 131 -4.213 -13.701 4.476 1059 H THR 132 H THR 132 -3.101 -12.273 0.513 1060 HA THR 132 HA THR 132 -4.512 -9.882 0.713 1061 HB THR 132 HB THR 132 -5.733 -10.549 -1.258 1062 HG1 THR 132 1HG THR 132 -6.198 -12.722 -0.519 1063 HG21 THR 132 3HG2 THR 132 -3.904 -11.145 -2.743 1064 HG22 THR 132 1HG2 THR 132 -2.945 -11.708 -1.375 1065 HG23 THR 132 2HG2 THR 132 -3.341 -9.995 -1.530 1066 H ASP 133 H ASP 133 -5.409 -13.138 1.652 1067 HA ASP 133 HA ASP 133 -8.154 -12.871 1.934 1068 HB2 ASP 133 1HB ASP 133 -6.202 -14.771 2.628 1069 HB3 ASP 133 2HB ASP 133 -7.047 -14.388 4.133 1070 H ASP 134 H ASP 134 -5.706 -11.230 3.589 1071 HA ASP 134 HA ASP 134 -7.190 -10.779 6.027 1072 HB2 ASP 134 1HB ASP 134 -4.702 -9.382 5.004 1073 HB3 ASP 134 2HB ASP 134 -5.336 -9.327 6.655 1074 H LEU 135 H LEU 135 -6.529 -9.064 3.028 1075 HA LEU 135 HA LEU 135 -7.495 -6.540 3.743 1076 HB2 LEU 135 1HB LEU 135 -6.374 -7.602 1.521 1077 HB3 LEU 135 2HB LEU 135 -8.060 -7.455 0.999 1078 HG LEU 135 HG LEU 135 -6.468 -5.148 2.104 1079 HD11 LEU 135 1HD1 LEU 135 -5.289 -5.667 0.167 1080 HD12 LEU 135 2HD1 LEU 135 -6.465 -4.469 -0.376 1081 HD13 LEU 135 3HD1 LEU 135 -6.740 -6.182 -0.696 1082 HD21 LEU 135 3HD2 LEU 135 -9.058 -5.220 2.054 1083 HD22 LEU 135 1HD2 LEU 135 -8.862 -4.994 0.317 1084 HD23 LEU 135 2HD2 LEU 135 -8.223 -3.794 1.439 1085 H THR 136 H THR 136 -9.337 -7.016 5.073 1086 HA THR 136 HA THR 136 -11.769 -7.531 3.489 1087 HB THR 136 HB THR 136 -12.773 -8.453 5.616 1088 HG1 THR 136 1HG THR 136 -10.658 -7.573 6.738 1089 HG21 THR 136 3HG2 THR 136 -10.524 -9.831 4.178 1090 HG22 THR 136 1HG2 THR 136 -12.262 -10.049 3.975 1091 HG23 THR 136 2HG2 THR 136 -11.461 -10.653 5.426 1092 H GLU 137 H GLU 137 -13.570 -6.283 3.942 1093 HA GLU 137 HA GLU 137 -13.364 -3.667 4.524 1094 HB2 GLU 137 1HB GLU 137 -15.432 -4.722 3.732 1095 HB3 GLU 137 2HB GLU 137 -15.686 -5.423 5.337 1096 HG2 GLU 137 1HG GLU 137 -15.497 -2.859 6.051 1097 HG3 GLU 137 2HG GLU 137 -16.087 -2.651 4.395 1098 H THR 138 H THR 138 -13.248 -6.252 6.822 1099 HA THR 138 HA THR 138 -13.629 -4.537 9.120 1100 HB THR 138 HB THR 138 -12.641 -7.391 9.111 1101 HG1 THR 138 1HG THR 138 -14.658 -8.019 8.834 1102 HG21 THR 138 3HG2 THR 138 -13.756 -5.539 11.190 1103 HG22 THR 138 1HG2 THR 138 -12.298 -6.529 11.253 1104 HG23 THR 138 2HG2 THR 138 -13.887 -7.287 11.373 1105 H TRP 139 H TRP 139 -10.988 -6.817 8.410 1106 HA TRP 139 HA TRP 139 -9.057 -5.876 10.033 1107 HB2 TRP 139 1HB TRP 139 -8.511 -7.768 8.752 1108 HB3 TRP 139 2HB TRP 139 -8.862 -6.949 7.231 1109 HD1 TRP 139 HD TRP 139 -6.036 -7.681 9.575 1110 HE1 TRP 139 1HE TRP 139 -3.875 -6.589 8.704 1111 HE3 TRP 139 3HE TRP 139 -8.040 -4.717 5.923 1112 HZ2 TRP 139 2HZ TRP 139 -3.118 -4.717 6.731 1113 HZ3 TRP 139 3HZ TRP 139 -6.528 -3.305 4.589 1114 HH2 TRP 139 HH TRP 139 -4.120 -3.306 4.987 1115 H LEU 140 H LEU 140 -10.254 -4.300 7.173 1116 HA LEU 140 HA LEU 140 -8.109 -2.387 7.020 1117 HB2 LEU 140 1HB LEU 140 -9.156 -2.895 4.971 1118 HB3 LEU 140 2HB LEU 140 -10.772 -2.660 5.660 1119 HG LEU 140 HG LEU 140 -9.842 -0.886 4.041 1120 HD11 LEU 140 1HD1 LEU 140 -11.306 0.618 4.918 1121 HD12 LEU 140 2HD1 LEU 140 -10.732 0.389 6.568 1122 HD13 LEU 140 3HD1 LEU 140 -11.792 -0.811 5.829 1123 HD21 LEU 140 3HD2 LEU 140 -8.360 0.721 4.849 1124 HD22 LEU 140 1HD2 LEU 140 -7.653 -0.804 5.386 1125 HD23 LEU 140 2HD2 LEU 140 -8.555 0.199 6.523 1126 H LYS 141 H LYS 141 -11.598 -2.064 7.710 1127 HA LYS 141 HA LYS 141 -11.531 0.563 8.616 1128 HB2 LYS 141 1HB LYS 141 -13.383 -1.725 8.835 1129 HB3 LYS 141 2HB LYS 141 -13.554 -0.495 10.099 1130 HG2 LYS 141 1HG LYS 141 -14.398 1.050 8.692 1131 HG3 LYS 141 2HG LYS 141 -13.369 0.529 7.345 1132 HD2 LYS 141 1HD LYS 141 -15.219 -0.380 6.472 1133 HD3 LYS 141 2HD LYS 141 -15.035 -1.632 7.713 1134 HE2 LYS 141 1HE LYS 141 -16.426 0.884 8.497 1135 HE3 LYS 141 2HE LYS 141 -17.280 -0.232 7.422 1136 HZ1 LYS 141 3HZ LYS 141 -16.057 -1.075 9.988 1137 HZ2 LYS 141 1HZ LYS 141 -17.118 -1.961 9.013 1138 HZ3 LYS 141 2HZ LYS 141 -17.673 -0.595 9.841 1139 H GLU 142 H GLU 142 -11.152 -2.458 10.433 1140 HA GLU 142 HA GLU 142 -11.103 -1.522 13.011 1141 HB2 GLU 142 1HB GLU 142 -9.709 -3.761 11.607 1142 HB3 GLU 142 2HB GLU 142 -9.229 -3.377 13.267 1143 HG2 GLU 142 1HG GLU 142 -11.828 -3.468 13.696 1144 HG3 GLU 142 2HG GLU 142 -11.791 -4.475 12.241 1145 H LYS 143 H LYS 143 -8.392 -1.622 10.720 1146 HA LYS 143 HA LYS 143 -6.458 -0.547 12.462 1147 HB2 LYS 143 1HB LYS 143 -6.592 -0.363 9.441 1148 HB3 LYS 143 2HB LYS 143 -5.150 -0.101 10.436 1149 HG2 LYS 143 1HG LYS 143 -6.512 -2.696 10.805 1150 HG3 LYS 143 2HG LYS 143 -5.730 -2.431 9.236 1151 HD2 LYS 143 1HD LYS 143 -3.765 -1.546 10.832 1152 HD3 LYS 143 2HD LYS 143 -4.532 -2.703 11.933 1153 HE2 LYS 143 1HE LYS 143 -4.269 -4.496 10.332 1154 HE3 LYS 143 2HE LYS 143 -3.654 -3.359 9.123 1155 HZ1 LYS 143 3HZ LYS 143 -1.719 -4.217 9.941 1156 HZ2 LYS 143 1HZ LYS 143 -2.321 -4.425 11.508 1157 HZ3 LYS 143 2HZ LYS 143 -1.890 -2.883 10.966 1158 H LEU 144 H LEU 144 -8.652 0.977 10.140 1159 HA LEU 144 HA LEU 144 -7.660 3.600 10.398 1160 HB2 LEU 144 1HB LEU 144 -10.508 2.811 9.780 1161 HB3 LEU 144 2HB LEU 144 -9.681 4.314 9.336 1162 HG LEU 144 HG LEU 144 -9.004 1.582 8.248 1163 HD11 LEU 144 1HD1 LEU 144 -10.600 3.855 7.084 1164 HD12 LEU 144 2HD1 LEU 144 -11.154 2.216 7.425 1165 HD13 LEU 144 3HD1 LEU 144 -9.976 2.500 6.143 1166 HD21 LEU 144 3HD2 LEU 144 -7.884 4.323 7.842 1167 HD22 LEU 144 1HD2 LEU 144 -7.850 3.150 6.525 1168 HD23 LEU 144 2HD2 LEU 144 -7.044 2.785 8.052 1169 H ALA 145 H ALA 145 -10.260 1.883 12.088 1170 HA ALA 145 HA ALA 145 -11.288 3.964 13.600 1171 HB1 ALA 145 3HB ALA 145 -11.820 1.329 13.420 1172 HB2 ALA 145 1HB ALA 145 -11.041 1.385 15.002 1173 HB3 ALA 145 2HB ALA 145 -12.466 2.377 14.683 1174 H SER 146 H SER 146 -8.851 1.599 14.708 1175 HA SER 146 HA SER 146 -7.092 3.460 15.819 1176 HB2 SER 146 1HB SER 146 -9.425 3.256 17.353 1177 HB3 SER 146 2HB SER 146 -8.230 2.266 18.210 1178 HG SER 146 HG SER 146 -7.285 4.026 18.826 1179 H GLY 147 H GLY 147 -6.813 1.146 14.352 1180 HA2 GLY 147 1HA GLY 147 -6.384 -1.258 15.569 1181 HA3 GLY 147 2HA GLY 147 -5.358 -0.641 14.282 1182 HA PRO 148 HA PRO 148 -3.220 -0.857 18.581 1183 HB2 PRO 148 2HB PRO 148 -3.700 -3.022 19.181 1184 HB3 PRO 148 1HB PRO 148 -2.121 -3.364 18.477 1185 HG2 PRO 148 1HG PRO 148 -3.019 -4.033 16.441 1186 HG3 PRO 148 2HG PRO 148 -4.288 -4.607 17.585 1187 HD2 PRO 148 1HD PRO 148 -4.844 -3.003 15.467 1188 HD3 PRO 148 2HD PRO 148 -5.726 -2.903 17.000 1189 H SER 149 H SER 149 -0.769 -1.689 18.809 1190 HA SER 149 HA SER 149 0.618 -0.888 16.334 1191 HB2 SER 149 1HB SER 149 1.135 -0.132 19.207 1192 HB3 SER 149 2HB SER 149 2.422 -0.050 17.991 1193 HG SER 149 HG SER 149 1.161 1.400 16.807 1194 H SER 150 H SER 150 1.373 -2.405 19.476 1195 HA SER 150 HA SER 150 2.768 -4.540 18.006 1196 HB2 SER 150 1HB SER 150 3.872 -2.636 19.888 1197 HB3 SER 150 2HB SER 150 4.049 -4.291 20.498 1198 HG SER 150 HG SER 150 5.447 -3.080 18.576 1199 H GLY 151 H GLY 151 1.391 -6.205 18.261 1200 HA2 GLY 151 1HA GLY 151 0.778 -8.089 19.572 1201 HA3 GLY 151 2HA GLY 151 0.868 -7.082 21.010 Start of MODEL 12 1 H1 GLY 1 H GLY 1 7.004 -18.834 6.107 2 HA2 GLY 1 1HA GLY 1 7.478 -17.766 8.490 3 HA3 GLY 1 2HA GLY 1 8.637 -18.878 7.777 4 H SER 2 H SER 2 10.559 -18.066 8.369 5 HA SER 2 HA SER 2 12.384 -16.703 8.356 6 HB2 SER 2 1HB SER 2 10.848 -15.871 6.055 7 HB3 SER 2 2HB SER 2 11.643 -14.472 6.799 8 HG SER 2 HG SER 2 13.611 -15.745 6.741 9 H SER 3 H SER 3 12.761 -15.717 10.219 10 HA SER 3 HA SER 3 11.831 -13.098 10.769 11 HB2 SER 3 1HB SER 3 9.752 -14.321 11.318 12 HB3 SER 3 2HB SER 3 10.654 -15.295 12.493 13 HG SER 3 HG SER 3 9.959 -13.725 13.761 14 H GLY 4 H GLY 4 14.341 -14.263 10.624 15 HA2 GLY 4 1HA GLY 4 15.232 -14.613 13.394 16 HA3 GLY 4 2HA GLY 4 16.182 -14.945 11.953 17 H SER 5 H SER 5 17.827 -13.741 13.210 18 HA SER 5 HA SER 5 17.898 -11.001 12.319 19 HB2 SER 5 1HB SER 5 16.664 -11.084 14.605 20 HB3 SER 5 2HB SER 5 18.272 -11.407 15.276 21 HG SER 5 HG SER 5 17.730 -9.203 13.581 22 H SER 6 H SER 6 19.955 -10.274 12.040 23 HA SER 6 HA SER 6 22.148 -11.888 13.144 24 HB2 SER 6 1HB SER 6 23.316 -11.884 11.011 25 HB3 SER 6 2HB SER 6 21.704 -12.588 10.797 26 HG SER 6 HG SER 6 22.714 -10.618 9.437 27 H GLY 7 H GLY 7 24.290 -10.763 12.910 28 HA2 GLY 7 1HA GLY 7 24.374 -8.371 14.219 29 HA3 GLY 7 2HA GLY 7 25.645 -8.912 13.132 30 H SER 8 H SER 8 25.505 -8.302 10.883 31 HA SER 8 HA SER 8 24.793 -5.583 10.555 32 HB2 SER 8 1HB SER 8 25.515 -5.847 8.242 33 HB3 SER 8 2HB SER 8 26.645 -6.684 9.321 34 HG SER 8 HG SER 8 24.498 -8.132 8.260 35 H ASP 9 H ASP 9 23.215 -4.639 9.217 36 HA ASP 9 HA ASP 9 21.028 -6.387 8.338 37 HB2 ASP 9 1HB ASP 9 20.927 -4.673 10.602 38 HB3 ASP 9 2HB ASP 9 19.923 -3.942 9.344 39 H SER 10 H SER 10 21.871 -6.006 6.225 40 HA SER 10 HA SER 10 21.311 -3.298 5.203 41 HB2 SER 10 1HB SER 10 22.992 -3.688 3.464 42 HB3 SER 10 2HB SER 10 23.705 -3.890 5.073 43 HG SER 10 HG SER 10 23.788 -5.613 3.134 44 H LEU 11 H LEU 11 20.246 -3.104 3.220 45 HA LEU 11 HA LEU 11 19.158 -5.563 2.049 46 HB2 LEU 11 1HB LEU 11 17.491 -3.119 2.664 47 HB3 LEU 11 2HB LEU 11 16.934 -4.648 1.958 48 HG LEU 11 HG LEU 11 18.141 -4.637 4.694 49 HD11 LEU 11 1HD1 LEU 11 16.582 -2.986 5.105 50 HD12 LEU 11 2HD1 LEU 11 15.661 -4.451 5.440 51 HD13 LEU 11 3HD1 LEU 11 15.449 -3.608 3.905 52 HD21 LEU 11 3HD2 LEU 11 17.613 -6.742 3.456 53 HD22 LEU 11 1HD2 LEU 11 15.913 -6.271 3.492 54 HD23 LEU 11 2HD2 LEU 11 16.777 -6.573 5.000 55 H VAL 12 H VAL 12 17.805 -4.868 -0.003 56 HA VAL 12 HA VAL 12 19.637 -3.280 -1.626 57 HB VAL 12 HB VAL 12 18.956 -5.503 -2.444 58 HG11 VAL 12 1HG1 VAL 12 16.781 -6.113 -2.919 59 HG12 VAL 12 2HG1 VAL 12 16.575 -5.162 -1.448 60 HG13 VAL 12 3HG1 VAL 12 16.223 -4.443 -3.021 61 HG21 VAL 12 3HG2 VAL 12 17.745 -4.263 -4.620 62 HG22 VAL 12 1HG2 VAL 12 18.747 -3.008 -3.889 63 HG23 VAL 12 2HG2 VAL 12 19.471 -4.538 -4.386 64 H VAL 13 H VAL 13 18.169 -1.740 0.145 65 HA VAL 13 HA VAL 13 15.769 -0.688 -0.429 66 HB VAL 13 HB VAL 13 17.103 0.273 1.321 67 HG11 VAL 13 1HG1 VAL 13 19.301 0.112 0.371 68 HG12 VAL 13 2HG1 VAL 13 18.891 1.277 -0.889 69 HG13 VAL 13 3HG1 VAL 13 18.997 1.797 0.793 70 HG21 VAL 13 3HG2 VAL 13 16.481 2.515 1.112 71 HG22 VAL 13 1HG2 VAL 13 16.746 2.521 -0.633 72 HG23 VAL 13 2HG2 VAL 13 15.362 1.664 0.048 73 H CYS 14 H CYS 14 14.930 0.981 -1.760 74 HA CYS 14 HA CYS 14 16.487 1.544 -4.192 75 HB2 CYS 14 1HB CYS 14 13.613 0.643 -3.998 76 HB3 CYS 14 2HB CYS 14 14.303 1.362 -5.461 77 HG CYS 14 HG CYS 14 15.963 -1.289 -4.203 78 H GLU 15 H GLU 15 14.955 3.211 -5.543 79 HA GLU 15 HA GLU 15 14.491 5.428 -3.665 80 HB2 GLU 15 1HB GLU 15 15.059 6.950 -5.411 81 HB3 GLU 15 2HB GLU 15 16.304 5.692 -5.384 82 HG2 GLU 15 1HG GLU 15 14.703 4.590 -7.195 83 HG3 GLU 15 2HG GLU 15 14.248 6.283 -7.432 84 H VAL 16 H VAL 16 12.734 6.875 -4.071 85 HA VAL 16 HA VAL 16 10.368 5.494 -4.993 86 HB VAL 16 HB VAL 16 10.323 6.875 -2.941 87 HG11 VAL 16 1HG1 VAL 16 11.832 8.659 -4.154 88 HG12 VAL 16 2HG1 VAL 16 10.270 9.358 -4.584 89 HG13 VAL 16 3HG1 VAL 16 10.700 9.134 -2.888 90 HG21 VAL 16 3HG2 VAL 16 8.209 8.031 -3.428 91 HG22 VAL 16 1HG2 VAL 16 8.505 7.824 -5.154 92 HG23 VAL 16 2HG2 VAL 16 8.252 6.413 -4.127 93 H ASP 17 H ASP 17 10.326 5.352 -7.185 94 HA ASP 17 HA ASP 17 11.243 6.878 -9.162 95 HB2 ASP 17 1HB ASP 17 9.805 4.869 -9.462 96 HB3 ASP 17 2HB ASP 17 8.391 5.873 -9.117 97 HA PRO 18 HA PRO 18 9.692 10.980 -8.741 98 HB2 PRO 18 2HB PRO 18 11.431 11.610 -10.103 99 HB3 PRO 18 1HB PRO 18 10.155 11.859 -11.293 100 HG2 PRO 18 1HG PRO 18 10.496 9.792 -12.297 101 HG3 PRO 18 2HG PRO 18 12.178 10.224 -11.814 102 HD2 PRO 18 1HD PRO 18 11.008 7.879 -11.106 103 HD3 PRO 18 2HD PRO 18 12.167 8.723 -10.065 104 H GLU 19 H GLU 19 8.588 8.961 -11.427 105 HA GLU 19 HA GLU 19 6.354 10.588 -12.102 106 HB2 GLU 19 1HB GLU 19 5.875 9.030 -13.710 107 HB3 GLU 19 2HB GLU 19 7.584 8.659 -13.427 108 HG2 GLU 19 1HG GLU 19 6.946 6.552 -13.134 109 HG3 GLU 19 2HG GLU 19 6.297 7.087 -11.577 110 H LEU 20 H LEU 20 6.932 8.154 -9.714 111 HA LEU 20 HA LEU 20 4.100 7.760 -9.180 112 HB2 LEU 20 1HB LEU 20 6.172 6.068 -9.003 113 HB3 LEU 20 2HB LEU 20 6.163 6.693 -7.345 114 HG LEU 20 HG LEU 20 3.817 5.366 -8.701 115 HD11 LEU 20 1HD1 LEU 20 6.016 4.052 -7.999 116 HD12 LEU 20 2HD1 LEU 20 4.403 3.380 -7.767 117 HD13 LEU 20 3HD1 LEU 20 5.245 4.134 -6.415 118 HD21 LEU 20 3HD2 LEU 20 3.015 5.255 -6.299 119 HD22 LEU 20 1HD2 LEU 20 2.981 6.842 -7.065 120 HD23 LEU 20 2HD2 LEU 20 4.268 6.440 -5.929 121 H LYS 21 H LYS 21 6.940 9.204 -7.650 122 HA LYS 21 HA LYS 21 6.088 9.848 -5.166 123 HB2 LYS 21 1HB LYS 21 8.277 10.484 -6.245 124 HB3 LYS 21 2HB LYS 21 7.433 11.860 -6.973 125 HG2 LYS 21 1HG LYS 21 6.741 12.261 -4.419 126 HG3 LYS 21 2HG LYS 21 8.284 11.423 -4.178 127 HD2 LYS 21 1HD LYS 21 8.276 13.560 -6.229 128 HD3 LYS 21 2HD LYS 21 8.077 14.083 -4.547 129 HE2 LYS 21 1HE LYS 21 10.109 12.708 -3.969 130 HE3 LYS 21 2HE LYS 21 10.341 12.470 -5.708 131 HZ1 LYS 21 3HZ LYS 21 10.020 15.217 -4.771 132 HZ2 LYS 21 1HZ LYS 21 10.990 14.604 -6.015 133 HZ3 LYS 21 2HZ LYS 21 11.479 14.442 -4.404 134 H GLU 22 H GLU 22 5.322 11.701 -8.105 135 HA GLU 22 HA GLU 22 3.745 13.658 -6.852 136 HB2 GLU 22 1HB GLU 22 3.299 12.656 -9.663 137 HB3 GLU 22 2HB GLU 22 3.027 14.285 -9.023 138 HG2 GLU 22 1HG GLU 22 5.640 14.123 -8.551 139 HG3 GLU 22 2HG GLU 22 5.537 12.990 -9.907 140 H THR 23 H THR 23 2.855 10.592 -8.401 141 HA THR 23 HA THR 23 0.120 10.709 -8.286 142 HB THR 23 HB THR 23 1.970 8.369 -7.869 143 HG1 THR 23 1HG THR 23 0.587 9.545 -9.998 144 HG21 THR 23 3HG2 THR 23 -0.321 7.148 -8.497 145 HG22 THR 23 1HG2 THR 23 -0.980 8.508 -7.587 146 HG23 THR 23 2HG2 THR 23 0.181 7.418 -6.828 147 H LEU 24 H LEU 24 2.324 9.724 -5.681 148 HA LEU 24 HA LEU 24 0.335 9.089 -3.793 149 HB2 LEU 24 1HB LEU 24 3.076 10.167 -3.145 150 HB3 LEU 24 2HB LEU 24 2.066 9.084 -2.171 151 HG LEU 24 HG LEU 24 3.457 8.377 -4.755 152 HD11 LEU 24 1HD1 LEU 24 5.185 7.722 -3.530 153 HD12 LEU 24 2HD1 LEU 24 4.139 6.798 -2.453 154 HD13 LEU 24 3HD1 LEU 24 4.436 8.507 -2.140 155 HD21 LEU 24 3HD2 LEU 24 1.499 7.093 -4.738 156 HD22 LEU 24 1HD2 LEU 24 1.561 6.859 -2.991 157 HD23 LEU 24 2HD2 LEU 24 2.725 6.038 -4.032 158 H ARG 25 H ARG 25 2.282 12.050 -4.180 159 HA ARG 25 HA ARG 25 1.118 13.528 -2.128 160 HB2 ARG 25 1HB ARG 25 3.164 14.021 -3.694 161 HB3 ARG 25 2HB ARG 25 1.955 14.861 -4.676 162 HG2 ARG 25 1HG ARG 25 1.562 16.484 -3.078 163 HG3 ARG 25 2HG ARG 25 2.171 15.466 -1.762 164 HD2 ARG 25 1HD ARG 25 4.243 16.264 -1.989 165 HD3 ARG 25 2HD ARG 25 4.229 15.926 -3.726 166 HE ARG 25 HE ARG 25 3.672 18.122 -4.134 167 HH11 ARG 25 2HH1 ARG 25 3.379 17.438 -0.733 168 HH12 ARG 25 1HH1 ARG 25 3.189 19.100 -0.282 169 HH21 ARG 25 1HH2 ARG 25 3.212 20.735 -1.887 170 HH22 ARG 25 2HH2 ARG 25 3.423 20.314 -3.553 171 H LYS 26 H LYS 26 0.018 12.903 -5.388 172 HA LYS 26 HA LYS 26 -2.083 14.870 -5.302 173 HB2 LYS 26 1HB LYS 26 -1.917 12.550 -7.221 174 HB3 LYS 26 2HB LYS 26 -2.666 14.136 -7.472 175 HG2 LYS 26 1HG LYS 26 0.096 14.533 -6.886 176 HG3 LYS 26 2HG LYS 26 -0.053 13.299 -8.149 177 HD2 LYS 26 1HD LYS 26 -1.836 15.060 -9.092 178 HD3 LYS 26 2HD LYS 26 -0.778 16.172 -8.208 179 HE2 LYS 26 1HE LYS 26 0.804 16.049 -9.781 180 HE3 LYS 26 2HE LYS 26 0.779 14.280 -9.727 181 HZ1 LYS 26 3HZ LYS 26 -0.970 16.044 -11.348 182 HZ2 LYS 26 1HZ LYS 26 -1.222 14.380 -11.179 183 HZ3 LYS 26 2HZ LYS 26 0.191 14.951 -11.911 184 H PHE 27 H PHE 27 -1.825 11.368 -4.907 185 HA PHE 27 HA PHE 27 -4.545 10.758 -4.771 186 HB2 PHE 27 1HB PHE 27 -2.510 9.180 -4.860 187 HB3 PHE 27 2HB PHE 27 -2.465 9.359 -3.104 188 HD1 PHE 27 2HD PHE 27 -5.316 8.982 -5.475 189 HD2 PHE 27 1HD PHE 27 -3.198 7.408 -2.136 190 HE1 PHE 27 2HE PHE 27 -7.017 7.220 -5.230 191 HE2 PHE 27 1HE PHE 27 -4.894 5.643 -1.887 192 HZ PHE 27 HZ PHE 27 -6.807 5.547 -3.434 193 H ARG 28 H ARG 28 -2.343 11.999 -2.336 194 HA ARG 28 HA ARG 28 -4.167 11.674 -0.153 195 HB2 ARG 28 1HB ARG 28 -1.882 13.629 -0.172 196 HB3 ARG 28 2HB ARG 28 -2.536 12.696 1.182 197 HG2 ARG 28 1HG ARG 28 -1.674 10.749 -0.592 198 HG3 ARG 28 2HG ARG 28 -0.437 12.013 -0.689 199 HD2 ARG 28 1HD ARG 28 -1.446 10.755 1.872 200 HD3 ARG 28 2HD ARG 28 0.059 10.333 1.044 201 HE ARG 28 HE ARG 28 0.969 12.411 1.674 202 HH11 ARG 28 2HH1 ARG 28 -2.263 11.932 2.875 203 HH12 ARG 28 1HH1 ARG 28 -2.149 13.189 4.062 204 HH21 ARG 28 1HH2 ARG 28 -0.218 14.405 4.263 205 HH22 ARG 28 2HH2 ARG 28 1.132 14.070 3.232 206 H PHE 29 H PHE 29 -3.542 14.128 -2.531 207 HA PHE 29 HA PHE 29 -5.651 15.781 -1.314 208 HB2 PHE 29 1HB PHE 29 -3.602 17.167 -2.949 209 HB3 PHE 29 2HB PHE 29 -4.445 17.708 -1.495 210 HD1 PHE 29 2HD PHE 29 -3.833 15.902 0.571 211 HD2 PHE 29 1HD PHE 29 -1.326 17.183 -2.621 212 HE1 PHE 29 2HE PHE 29 -1.848 15.408 1.937 213 HE2 PHE 29 1HE PHE 29 0.664 16.691 -1.261 214 HZ PHE 29 HZ PHE 29 0.405 15.804 1.021 215 H ARG 30 H ARG 30 -6.101 13.798 -3.237 216 HA ARG 30 HA ARG 30 -6.201 14.972 -5.855 217 HB2 ARG 30 1HB ARG 30 -7.457 12.937 -6.474 218 HB3 ARG 30 2HB ARG 30 -5.942 12.571 -5.634 219 HG2 ARG 30 1HG ARG 30 -7.445 12.492 -3.504 220 HG3 ARG 30 2HG ARG 30 -8.751 12.262 -4.681 221 HD2 ARG 30 1HD ARG 30 -6.572 10.556 -5.401 222 HD3 ARG 30 2HD ARG 30 -6.928 10.340 -3.681 223 HE ARG 30 HE ARG 30 -8.599 9.590 -5.904 224 HH11 ARG 30 2HH1 ARG 30 -8.489 10.343 -2.506 225 HH12 ARG 30 1HH1 ARG 30 -9.939 9.472 -2.133 226 HH21 ARG 30 1HH2 ARG 30 -11.088 8.390 -3.794 227 HH22 ARG 30 2HH2 ARG 30 -10.510 8.440 -5.425 228 H LYS 31 H LYS 31 -8.358 14.943 -7.060 229 HA LYS 31 HA LYS 31 -10.289 16.440 -5.445 230 HB2 LYS 31 1HB LYS 31 -10.177 16.158 -8.455 231 HB3 LYS 31 2HB LYS 31 -11.136 17.320 -7.524 232 HG2 LYS 31 1HG LYS 31 -9.394 18.639 -8.221 233 HG3 LYS 31 2HG LYS 31 -8.816 18.103 -6.632 234 HD2 LYS 31 1HD LYS 31 -7.010 17.200 -7.568 235 HD3 LYS 31 2HD LYS 31 -8.044 16.157 -8.559 236 HE2 LYS 31 1HE LYS 31 -8.132 17.735 -10.328 237 HE3 LYS 31 2HE LYS 31 -7.455 19.010 -9.305 238 HZ1 LYS 31 3HZ LYS 31 -5.363 18.280 -9.617 239 HZ2 LYS 31 1HZ LYS 31 -6.010 17.589 -11.020 240 HZ3 LYS 31 2HZ LYS 31 -5.799 16.646 -9.632 241 H GLU 32 H GLU 32 -10.195 13.610 -5.163 242 HA GLU 32 HA GLU 32 -12.665 12.755 -6.510 243 HB2 GLU 32 1HB GLU 32 -10.331 11.254 -5.353 244 HB3 GLU 32 2HB GLU 32 -11.892 10.454 -5.596 245 HG2 GLU 32 1HG GLU 32 -10.619 11.944 -7.856 246 HG3 GLU 32 2HG GLU 32 -10.061 10.319 -7.432 247 H THR 33 H THR 33 -13.722 10.908 -4.990 248 HA THR 33 HA THR 33 -13.805 11.669 -2.205 249 HB THR 33 HB THR 33 -16.195 12.183 -2.149 250 HG1 THR 33 1HG THR 33 -17.106 12.680 -4.355 251 HG21 THR 33 3HG2 THR 33 -16.103 14.400 -3.045 252 HG22 THR 33 1HG2 THR 33 -14.839 13.946 -4.186 253 HG23 THR 33 2HG2 THR 33 -14.490 13.996 -2.459 254 H ASN 34 H ASN 34 -13.394 9.305 -4.058 255 HA ASN 34 HA ASN 34 -15.273 7.494 -2.694 256 HB2 ASN 34 1HB ASN 34 -15.036 6.015 -4.762 257 HB3 ASN 34 2HB ASN 34 -16.011 7.479 -4.942 258 HD21 ASN 34 2HD2 ASN 34 -13.056 6.856 -7.453 259 HD22 ASN 34 1HD2 ASN 34 -13.831 5.662 -6.473 260 H ASN 35 H ASN 35 -14.376 5.116 -2.997 261 HA ASN 35 HA ASN 35 -11.775 5.129 -1.738 262 HB2 ASN 35 1HB ASN 35 -13.749 2.922 -2.360 263 HB3 ASN 35 2HB ASN 35 -12.188 2.636 -1.580 264 HD21 ASN 35 2HD2 ASN 35 -14.805 2.975 1.017 265 HD22 ASN 35 1HD2 ASN 35 -14.565 1.963 -0.363 266 H ALA 36 H ALA 36 -9.884 4.652 -2.667 267 HA ALA 36 HA ALA 36 -9.849 3.215 -5.217 268 HB1 ALA 36 3HB ALA 36 -8.750 5.968 -4.755 269 HB2 ALA 36 1HB ALA 36 -8.107 4.914 -6.015 270 HB3 ALA 36 2HB ALA 36 -9.803 5.399 -6.050 271 H ALA 37 H ALA 37 -7.703 2.417 -5.794 272 HA ALA 37 HA ALA 37 -5.870 2.214 -3.502 273 HB1 ALA 37 3HB ALA 37 -6.727 0.121 -3.306 274 HB2 ALA 37 1HB ALA 37 -7.199 0.034 -5.004 275 HB3 ALA 37 2HB ALA 37 -5.513 -0.209 -4.542 276 H ILE 38 H ILE 38 -3.670 1.838 -4.028 277 HA ILE 38 HA ILE 38 -2.954 2.147 -6.858 278 HB ILE 38 HB ILE 38 -1.610 3.716 -4.660 279 HG12 ILE 38 1HG1 ILE 38 -3.767 4.506 -6.623 280 HG13 ILE 38 2HG1 ILE 38 -3.809 4.627 -4.855 281 HG21 ILE 38 1HG2 ILE 38 -0.690 4.979 -6.619 282 HG22 ILE 38 2HG2 ILE 38 -0.129 3.315 -6.479 283 HG23 ILE 38 3HG2 ILE 38 -1.369 3.729 -7.661 284 HD11 ILE 38 3HD1 ILE 38 -3.471 6.815 -5.566 285 HD12 ILE 38 1HD1 ILE 38 -1.864 6.264 -5.093 286 HD13 ILE 38 2HD1 ILE 38 -2.307 6.334 -6.800 287 H ILE 39 H ILE 39 -1.952 0.271 -7.253 288 HA ILE 39 HA ILE 39 -0.189 -0.900 -5.248 289 HB ILE 39 HB ILE 39 -0.898 -2.001 -7.966 290 HG12 ILE 39 1HG1 ILE 39 -2.109 -3.188 -5.550 291 HG13 ILE 39 2HG1 ILE 39 -2.696 -1.568 -5.961 292 HG21 ILE 39 1HG2 ILE 39 -0.250 -4.159 -6.880 293 HG22 ILE 39 2HG2 ILE 39 1.077 -3.021 -7.102 294 HG23 ILE 39 3HG2 ILE 39 0.347 -3.222 -5.511 295 HD11 ILE 39 3HD1 ILE 39 -2.690 -2.970 -8.371 296 HD12 ILE 39 1HD1 ILE 39 -3.341 -4.086 -7.171 297 HD13 ILE 39 2HD1 ILE 39 -4.086 -2.504 -7.399 298 H MET 40 H MET 40 1.906 -0.461 -5.232 299 HA MET 40 HA MET 40 3.198 0.335 -7.758 300 HB2 MET 40 1HB MET 40 4.234 1.029 -5.014 301 HB3 MET 40 2HB MET 40 4.637 1.776 -6.567 302 HG2 MET 40 1HG MET 40 2.829 3.133 -6.563 303 HG3 MET 40 2HG MET 40 1.811 1.938 -5.756 304 HE1 MET 40 3HE MET 40 0.727 3.139 -3.492 305 HE2 MET 40 1HE MET 40 1.511 1.560 -3.468 306 HE3 MET 40 2HE MET 40 1.835 2.724 -2.183 307 H LYS 41 H LYS 41 5.184 -0.544 -8.289 308 HA LYS 41 HA LYS 41 6.115 -2.758 -6.582 309 HB2 LYS 41 1HB LYS 41 6.602 -4.085 -8.521 310 HB3 LYS 41 2HB LYS 41 4.921 -3.538 -8.634 311 HG2 LYS 41 1HG LYS 41 5.291 -2.550 -10.585 312 HG3 LYS 41 2HG LYS 41 6.673 -1.659 -9.924 313 HD2 LYS 41 1HD LYS 41 8.203 -3.165 -10.681 314 HD3 LYS 41 2HD LYS 41 7.096 -4.535 -10.487 315 HE2 LYS 41 1HE LYS 41 5.799 -3.297 -12.454 316 HE3 LYS 41 2HE LYS 41 7.421 -2.665 -12.774 317 HZ1 LYS 41 3HZ LYS 41 8.082 -5.156 -12.568 318 HZ2 LYS 41 1HZ LYS 41 7.418 -4.576 -14.012 319 HZ3 LYS 41 2HZ LYS 41 6.452 -5.433 -12.921 320 H VAL 42 H VAL 42 8.410 -3.475 -7.447 321 HA VAL 42 HA VAL 42 10.012 -1.052 -7.938 322 HB VAL 42 HB VAL 42 10.566 -1.346 -5.736 323 HG11 VAL 42 1HG1 VAL 42 9.294 -3.095 -4.972 324 HG12 VAL 42 2HG1 VAL 42 9.882 -4.208 -6.208 325 HG13 VAL 42 3HG1 VAL 42 10.910 -3.787 -4.839 326 HG21 VAL 42 3HG2 VAL 42 12.607 -1.557 -7.066 327 HG22 VAL 42 1HG2 VAL 42 12.720 -2.486 -5.571 328 HG23 VAL 42 2HG2 VAL 42 12.409 -3.309 -7.100 329 H ASP 43 H ASP 43 11.012 -1.248 -9.820 330 HA ASP 43 HA ASP 43 11.439 -3.804 -11.060 331 HB2 ASP 43 1HB ASP 43 11.872 -0.945 -11.821 332 HB3 ASP 43 2HB ASP 43 12.753 -2.195 -12.712 333 H LYS 44 H LYS 44 13.041 -5.093 -10.453 334 HA LYS 44 HA LYS 44 15.269 -4.355 -8.948 335 HB2 LYS 44 1HB LYS 44 14.311 -6.680 -9.289 336 HB3 LYS 44 2HB LYS 44 15.180 -6.711 -10.831 337 HG2 LYS 44 1HG LYS 44 16.918 -5.927 -8.646 338 HG3 LYS 44 2HG LYS 44 16.155 -7.502 -8.364 339 HD2 LYS 44 1HD LYS 44 17.121 -8.470 -10.235 340 HD3 LYS 44 2HD LYS 44 17.367 -6.907 -11.032 341 HE2 LYS 44 1HE LYS 44 19.007 -6.410 -9.093 342 HE3 LYS 44 2HE LYS 44 18.955 -8.157 -8.815 343 HZ1 LYS 44 3HZ LYS 44 19.440 -8.197 -11.382 344 HZ2 LYS 44 1HZ LYS 44 20.691 -8.033 -10.254 345 HZ3 LYS 44 2HZ LYS 44 20.096 -6.672 -11.062 346 H ASP 45 H ASP 45 14.695 -4.166 -12.349 347 HA ASP 45 HA ASP 45 17.408 -4.077 -13.198 348 HB2 ASP 45 1HB ASP 45 14.820 -3.966 -14.409 349 HB3 ASP 45 2HB ASP 45 15.770 -2.591 -14.990 350 H ARG 46 H ARG 46 15.037 -1.620 -12.293 351 HA ARG 46 HA ARG 46 17.137 0.428 -12.520 352 HB2 ARG 46 1HB ARG 46 14.144 0.826 -12.306 353 HB3 ARG 46 2HB ARG 46 15.359 2.074 -12.625 354 HG2 ARG 46 1HG ARG 46 15.840 1.199 -14.783 355 HG3 ARG 46 2HG ARG 46 14.884 -0.258 -14.460 356 HD2 ARG 46 1HD ARG 46 13.222 0.811 -15.526 357 HD3 ARG 46 2HD ARG 46 13.053 1.712 -14.012 358 HE ARG 46 HE ARG 46 14.948 3.091 -15.413 359 HH11 ARG 46 2HH1 ARG 46 11.679 2.068 -16.033 360 HH12 ARG 46 1HH1 ARG 46 11.319 3.406 -17.072 361 HH21 ARG 46 1HH2 ARG 46 12.917 4.992 -17.497 362 HH22 ARG 46 2HH2 ARG 46 14.486 4.858 -16.780 363 H GLN 47 H GLN 47 16.047 -1.575 -10.283 364 HA GLN 47 HA GLN 47 15.604 -1.494 -8.018 365 HB2 GLN 47 1HB GLN 47 17.930 0.430 -8.050 366 HB3 GLN 47 2HB GLN 47 17.506 -0.752 -6.801 367 HG2 GLN 47 1HG GLN 47 18.007 -1.915 -9.449 368 HG3 GLN 47 2HG GLN 47 19.401 -1.118 -8.707 369 HE21 GLN 47 2HE2 GLN 47 17.798 -4.459 -6.978 370 HE22 GLN 47 1HE2 GLN 47 16.855 -3.474 -8.037 371 H MET 48 H MET 48 13.763 0.118 -9.077 372 HA MET 48 HA MET 48 13.589 2.260 -7.099 373 HB2 MET 48 1HB MET 48 13.380 3.995 -8.549 374 HB3 MET 48 2HB MET 48 14.393 2.952 -9.559 375 HG2 MET 48 1HG MET 48 12.045 2.024 -10.355 376 HG3 MET 48 2HG MET 48 11.514 3.619 -9.814 377 HE1 MET 48 3HE MET 48 12.173 5.843 -10.826 378 HE2 MET 48 1HE MET 48 13.888 5.591 -10.501 379 HE3 MET 48 2HE MET 48 13.360 6.082 -12.109 380 H VAL 49 H VAL 49 11.488 2.802 -6.499 381 HA VAL 49 HA VAL 49 9.522 0.752 -7.003 382 HB VAL 49 HB VAL 49 9.253 3.277 -5.365 383 HG11 VAL 49 1HG1 VAL 49 7.513 1.718 -4.214 384 HG12 VAL 49 2HG1 VAL 49 7.081 2.569 -5.699 385 HG13 VAL 49 3HG1 VAL 49 7.533 0.865 -5.758 386 HG21 VAL 49 3HG2 VAL 49 10.027 0.484 -4.523 387 HG22 VAL 49 1HG2 VAL 49 11.076 1.902 -4.534 388 HG23 VAL 49 2HG2 VAL 49 9.703 1.829 -3.428 389 H VAL 50 H VAL 50 8.503 0.838 -8.912 390 HA VAL 50 HA VAL 50 7.458 3.441 -9.814 391 HB VAL 50 HB VAL 50 7.380 2.511 -12.077 392 HG11 VAL 50 1HG1 VAL 50 9.352 3.629 -11.905 393 HG12 VAL 50 2HG1 VAL 50 9.911 2.660 -10.541 394 HG13 VAL 50 3HG1 VAL 50 9.991 2.008 -12.179 395 HG21 VAL 50 3HG2 VAL 50 8.097 0.354 -12.643 396 HG22 VAL 50 1HG2 VAL 50 8.874 0.106 -11.079 397 HG23 VAL 50 2HG2 VAL 50 7.115 0.119 -11.198 398 H LEU 51 H LEU 51 5.319 3.640 -10.381 399 HA LEU 51 HA LEU 51 3.401 2.199 -9.044 400 HB2 LEU 51 1HB LEU 51 3.279 4.429 -10.396 401 HB3 LEU 51 2HB LEU 51 2.778 3.368 -11.723 402 HG LEU 51 HG LEU 51 1.299 3.066 -9.179 403 HD11 LEU 51 1HD1 LEU 51 -0.032 5.009 -9.455 404 HD12 LEU 51 2HD1 LEU 51 0.765 5.422 -10.973 405 HD13 LEU 51 3HD1 LEU 51 1.651 5.539 -9.452 406 HD21 LEU 51 3HD2 LEU 51 0.950 2.602 -12.030 407 HD22 LEU 51 1HD2 LEU 51 -0.449 3.376 -11.285 408 HD23 LEU 51 2HD2 LEU 51 0.150 1.844 -10.650 409 H GLU 52 H GLU 52 2.038 0.498 -9.511 410 HA GLU 52 HA GLU 52 2.860 -1.178 -11.789 411 HB2 GLU 52 1HB GLU 52 3.274 -2.132 -9.533 412 HB3 GLU 52 2HB GLU 52 1.534 -2.047 -9.215 413 HG2 GLU 52 1HG GLU 52 1.030 -3.753 -10.689 414 HG3 GLU 52 2HG GLU 52 2.529 -3.533 -11.602 415 H ASP 53 H ASP 53 0.086 -0.009 -9.940 416 HA ASP 53 HA ASP 53 -1.564 0.098 -12.254 417 HB2 ASP 53 1HB ASP 53 -1.739 -2.272 -10.472 418 HB3 ASP 53 2HB ASP 53 -3.272 -1.535 -10.956 419 H GLU 54 H GLU 54 -3.809 0.797 -11.704 420 HA GLU 54 HA GLU 54 -4.125 1.914 -9.031 421 HB2 GLU 54 1HB GLU 54 -3.528 3.479 -11.450 422 HB3 GLU 54 2HB GLU 54 -4.932 4.051 -10.536 423 HG2 GLU 54 1HG GLU 54 -3.371 3.905 -8.478 424 HG3 GLU 54 2HG GLU 54 -2.075 3.884 -9.683 425 H LEU 55 H LEU 55 -6.030 1.114 -8.443 426 HA LEU 55 HA LEU 55 -8.201 1.031 -10.427 427 HB2 LEU 55 1HB LEU 55 -8.051 -0.479 -7.817 428 HB3 LEU 55 2HB LEU 55 -9.201 -0.718 -9.144 429 HG LEU 55 HG LEU 55 -6.269 -1.173 -9.567 430 HD11 LEU 55 1HD1 LEU 55 -7.018 -3.652 -9.158 431 HD12 LEU 55 2HD1 LEU 55 -8.209 -2.893 -8.103 432 HD13 LEU 55 3HD1 LEU 55 -6.488 -2.635 -7.818 433 HD21 LEU 55 3HD2 LEU 55 -7.735 -3.018 -10.979 434 HD22 LEU 55 1HD2 LEU 55 -7.090 -1.505 -11.618 435 HD23 LEU 55 2HD2 LEU 55 -8.754 -1.578 -11.036 436 H GLN 56 H GLN 56 -9.917 2.305 -10.160 437 HA GLN 56 HA GLN 56 -10.178 3.753 -7.614 438 HB2 GLN 56 1HB GLN 56 -10.910 4.453 -10.448 439 HB3 GLN 56 2HB GLN 56 -11.637 5.303 -9.076 440 HG2 GLN 56 1HG GLN 56 -9.906 6.707 -9.412 441 HG3 GLN 56 2HG GLN 56 -9.078 5.534 -8.380 442 HE21 GLN 56 2HE2 GLN 56 -6.621 5.089 -10.751 443 HE22 GLN 56 1HE2 GLN 56 -7.085 5.327 -9.104 444 H ASN 57 H ASN 57 -12.398 4.299 -6.933 445 HA ASN 57 HA ASN 57 -14.386 3.515 -6.121 446 HB2 ASN 57 1HB ASN 57 -15.800 2.569 -8.240 447 HB3 ASN 57 2HB ASN 57 -15.603 4.286 -7.869 448 HD21 ASN 57 2HD2 ASN 57 -13.343 4.936 -10.504 449 HD22 ASN 57 1HD2 ASN 57 -13.805 5.411 -8.909 450 H ILE 58 H ILE 58 -12.647 1.700 -5.426 451 HA ILE 58 HA ILE 58 -13.948 -0.862 -6.063 452 HB ILE 58 HB ILE 58 -12.037 -1.521 -7.017 453 HG12 ILE 58 1HG1 ILE 58 -11.982 -2.512 -4.663 454 HG13 ILE 58 2HG1 ILE 58 -10.462 -2.529 -5.573 455 HG21 ILE 58 1HG2 ILE 58 -11.062 0.510 -7.489 456 HG22 ILE 58 2HG2 ILE 58 -10.921 0.958 -5.790 457 HG23 ILE 58 3HG2 ILE 58 -9.826 -0.240 -6.480 458 HD11 ILE 58 3HD1 ILE 58 -10.480 -0.109 -4.164 459 HD12 ILE 58 1HD1 ILE 58 -11.023 -1.348 -3.032 460 HD13 ILE 58 2HD1 ILE 58 -9.479 -1.530 -3.867 461 H SER 59 H SER 59 -14.323 -2.222 -4.368 462 HA SER 59 HA SER 59 -14.111 -1.071 -1.724 463 HB2 SER 59 1HB SER 59 -15.768 -3.042 -3.031 464 HB3 SER 59 2HB SER 59 -15.102 -3.703 -1.527 465 HG SER 59 HG SER 59 -16.138 -1.111 -1.461 466 HA PRO 60 HA PRO 60 -10.710 -3.332 -0.120 467 HB2 PRO 60 2HB PRO 60 -11.285 -2.613 1.985 468 HB3 PRO 60 1HB PRO 60 -11.612 -4.320 2.270 469 HG2 PRO 60 1HG PRO 60 -13.892 -4.092 1.880 470 HG3 PRO 60 2HG PRO 60 -13.510 -2.507 2.650 471 HD2 PRO 60 1HD PRO 60 -14.761 -2.705 0.249 472 HD3 PRO 60 2HD PRO 60 -13.644 -1.387 0.640 473 H GLU 61 H GLU 61 -13.331 -4.933 -1.299 474 HA GLU 61 HA GLU 61 -12.313 -7.597 -0.600 475 HB2 GLU 61 1HB GLU 61 -14.964 -6.495 -1.146 476 HB3 GLU 61 2HB GLU 61 -14.634 -7.981 -2.051 477 HG2 GLU 61 1HG GLU 61 -14.439 -9.274 -0.150 478 HG3 GLU 61 2HG GLU 61 -14.063 -7.880 0.874 479 H GLU 62 H GLU 62 -12.670 -5.350 -3.198 480 HA GLU 62 HA GLU 62 -12.200 -7.316 -5.269 481 HB2 GLU 62 1HB GLU 62 -13.172 -4.630 -5.140 482 HB3 GLU 62 2HB GLU 62 -11.795 -4.683 -6.252 483 HG2 GLU 62 1HG GLU 62 -13.631 -6.898 -6.667 484 HG3 GLU 62 2HG GLU 62 -14.409 -5.320 -6.850 485 H LEU 63 H LEU 63 -10.410 -4.738 -3.645 486 HA LEU 63 HA LEU 63 -8.102 -4.734 -5.188 487 HB2 LEU 63 1HB LEU 63 -8.962 -3.502 -2.870 488 HB3 LEU 63 2HB LEU 63 -7.581 -4.474 -2.332 489 HG LEU 63 HG LEU 63 -7.636 -2.168 -4.241 490 HD11 LEU 63 1HD1 LEU 63 -7.138 -1.441 -2.100 491 HD12 LEU 63 2HD1 LEU 63 -5.541 -1.687 -2.806 492 HD13 LEU 63 3HD1 LEU 63 -6.216 -2.893 -1.710 493 HD21 LEU 63 3HD2 LEU 63 -6.151 -3.137 -5.579 494 HD22 LEU 63 1HD2 LEU 63 -6.078 -4.567 -4.549 495 HD23 LEU 63 2HD2 LEU 63 -5.032 -3.187 -4.214 496 H LYS 64 H LYS 64 -8.735 -6.600 -2.217 497 HA LYS 64 HA LYS 64 -6.382 -8.001 -2.029 498 HB2 LYS 64 1HB LYS 64 -7.577 -8.668 -0.259 499 HB3 LYS 64 2HB LYS 64 -9.111 -8.345 -1.082 500 HG2 LYS 64 1HG LYS 64 -9.275 -10.489 -1.936 501 HG3 LYS 64 2HG LYS 64 -7.536 -10.785 -1.775 502 HD2 LYS 64 1HD LYS 64 -7.971 -11.848 0.137 503 HD3 LYS 64 2HD LYS 64 -8.410 -10.274 0.823 504 HE2 LYS 64 1HE LYS 64 -10.733 -10.587 0.141 505 HE3 LYS 64 2HE LYS 64 -10.306 -12.128 -0.617 506 HZ1 LYS 64 3HZ LYS 64 -9.943 -13.131 1.431 507 HZ2 LYS 64 1HZ LYS 64 -11.312 -12.176 1.711 508 HZ3 LYS 64 2HZ LYS 64 -9.795 -11.659 2.253 509 H LEU 65 H LEU 65 -9.054 -8.533 -4.229 510 HA LEU 65 HA LEU 65 -8.145 -11.076 -5.166 511 HB2 LEU 65 1HB LEU 65 -10.022 -9.107 -6.484 512 HB3 LEU 65 2HB LEU 65 -9.823 -10.818 -6.904 513 HG LEU 65 HG LEU 65 -10.882 -9.824 -4.260 514 HD11 LEU 65 1HD1 LEU 65 -12.951 -11.080 -5.487 515 HD12 LEU 65 2HD1 LEU 65 -12.176 -10.279 -6.852 516 HD13 LEU 65 3HD1 LEU 65 -12.710 -9.333 -5.463 517 HD21 LEU 65 3HD2 LEU 65 -11.252 -12.024 -3.686 518 HD22 LEU 65 1HD2 LEU 65 -9.720 -12.140 -4.552 519 HD23 LEU 65 2HD2 LEU 65 -11.226 -12.580 -5.360 520 H GLU 66 H GLU 66 -7.789 -7.736 -6.243 521 HA GLU 66 HA GLU 66 -6.530 -8.332 -8.711 522 HB2 GLU 66 1HB GLU 66 -6.261 -5.824 -7.037 523 HB3 GLU 66 2HB GLU 66 -5.922 -5.982 -8.768 524 HG2 GLU 66 1HG GLU 66 -8.653 -6.630 -7.739 525 HG3 GLU 66 2HG GLU 66 -8.166 -4.943 -7.954 526 H LEU 67 H LEU 67 -5.398 -8.120 -5.439 527 HA LEU 67 HA LEU 67 -2.610 -7.929 -6.164 528 HB2 LEU 67 1HB LEU 67 -3.828 -8.604 -3.483 529 HB3 LEU 67 2HB LEU 67 -2.168 -8.073 -3.802 530 HG LEU 67 HG LEU 67 -4.605 -6.361 -4.273 531 HD11 LEU 67 1HD1 LEU 67 -4.228 -6.993 -1.873 532 HD12 LEU 67 2HD1 LEU 67 -4.153 -5.265 -2.216 533 HD13 LEU 67 3HD1 LEU 67 -2.665 -6.182 -1.979 534 HD21 LEU 67 3HD2 LEU 67 -1.654 -5.741 -4.219 535 HD22 LEU 67 1HD2 LEU 67 -2.943 -4.545 -4.350 536 HD23 LEU 67 2HD2 LEU 67 -2.707 -5.730 -5.635 537 HA PRO 68 HA PRO 68 -1.887 -12.242 -6.706 538 HB2 PRO 68 2HB PRO 68 0.054 -11.624 -7.770 539 HB3 PRO 68 1HB PRO 68 0.824 -12.258 -6.316 540 HG2 PRO 68 1HG PRO 68 1.027 -10.158 -5.342 541 HG3 PRO 68 2HG PRO 68 1.255 -9.755 -7.084 542 HD2 PRO 68 1HD PRO 68 -0.590 -8.519 -5.522 543 HD3 PRO 68 2HD PRO 68 -0.853 -8.835 -7.246 544 H GLU 69 H GLU 69 -0.199 -13.891 -5.517 545 HA GLU 69 HA GLU 69 -0.511 -13.578 -2.618 546 HB2 GLU 69 1HB GLU 69 -1.165 -16.014 -2.500 547 HB3 GLU 69 2HB GLU 69 -2.387 -14.926 -3.176 548 HG2 GLU 69 1HG GLU 69 -1.512 -15.589 -5.469 549 HG3 GLU 69 2HG GLU 69 -0.637 -16.879 -4.630 550 H ARG 70 H ARG 70 1.532 -14.016 -5.092 551 HA ARG 70 HA ARG 70 3.454 -15.472 -3.411 552 HB2 ARG 70 1HB ARG 70 2.874 -15.897 -6.344 553 HB3 ARG 70 2HB ARG 70 4.377 -16.437 -5.580 554 HG2 ARG 70 1HG ARG 70 2.104 -17.322 -4.045 555 HG3 ARG 70 2HG ARG 70 1.962 -17.824 -5.738 556 HD2 ARG 70 1HD ARG 70 4.154 -18.864 -5.669 557 HD3 ARG 70 2HD ARG 70 4.399 -18.270 -4.020 558 HE ARG 70 HE ARG 70 2.089 -19.773 -3.941 559 HH11 ARG 70 2HH1 ARG 70 5.434 -20.296 -4.752 560 HH12 ARG 70 1HH1 ARG 70 5.426 -21.960 -4.269 561 HH21 ARG 70 1HH2 ARG 70 3.509 -22.907 -3.446 562 HH22 ARG 70 2HH2 ARG 70 2.065 -21.962 -3.302 563 H GLN 71 H GLN 71 2.704 -12.780 -5.298 564 HA GLN 71 HA GLN 71 5.542 -12.003 -5.443 565 HB2 GLN 71 1HB GLN 71 3.212 -11.171 -7.184 566 HB3 GLN 71 2HB GLN 71 4.817 -10.424 -7.251 567 HG2 GLN 71 1HG GLN 71 5.830 -12.394 -8.058 568 HG3 GLN 71 2HG GLN 71 4.404 -13.367 -7.666 569 HE21 GLN 71 2HE2 GLN 71 2.582 -12.456 -10.537 570 HE22 GLN 71 1HE2 GLN 71 2.465 -13.003 -8.903 571 HA PRO 72 HA PRO 72 4.289 -9.060 -2.327 572 HB2 PRO 72 2HB PRO 72 6.286 -9.531 -1.292 573 HB3 PRO 72 1HB PRO 72 6.780 -7.979 -1.968 574 HG2 PRO 72 1HG PRO 72 7.827 -8.954 -3.799 575 HG3 PRO 72 2HG PRO 72 8.149 -10.184 -2.520 576 HD2 PRO 72 1HD PRO 72 6.991 -10.808 -4.894 577 HD3 PRO 72 2HD PRO 72 6.577 -11.634 -3.382 578 H ARG 73 H ARG 73 4.162 -6.763 -2.140 579 HA ARG 73 HA ARG 73 5.243 -4.896 -3.886 580 HB2 ARG 73 1HB ARG 73 3.188 -4.402 -5.279 581 HB3 ARG 73 2HB ARG 73 4.086 -5.863 -5.714 582 HG2 ARG 73 1HG ARG 73 2.279 -6.865 -3.937 583 HG3 ARG 73 2HG ARG 73 1.353 -5.568 -4.713 584 HD2 ARG 73 1HD ARG 73 2.904 -7.183 -6.605 585 HD3 ARG 73 2HD ARG 73 1.690 -8.105 -5.705 586 HE ARG 73 HE ARG 73 0.300 -5.944 -6.531 587 HH11 ARG 73 2HH1 ARG 73 2.351 -8.224 -8.180 588 HH12 ARG 73 1HH1 ARG 73 1.502 -8.098 -9.685 589 HH21 ARG 73 1HH2 ARG 73 -0.305 -6.700 -9.870 590 HH22 ARG 73 2HH2 ARG 73 -0.826 -5.769 -8.507 591 H PHE 74 H PHE 74 3.922 -2.798 -3.893 592 HA PHE 74 HA PHE 74 2.818 -2.463 -1.204 593 HB2 PHE 74 1HB PHE 74 3.551 -0.280 -3.163 594 HB3 PHE 74 2HB PHE 74 3.312 -0.131 -1.421 595 HD1 PHE 74 1HD PHE 74 4.889 -1.755 0.011 596 HD2 PHE 74 2HD PHE 74 5.733 -0.286 -3.893 597 HE1 PHE 74 1HE PHE 74 7.292 -2.114 0.399 598 HE2 PHE 74 2HE PHE 74 8.137 -0.644 -3.513 599 HZ PHE 74 HZ PHE 74 8.920 -1.558 -1.364 600 H VAL 75 H VAL 75 0.910 -1.185 -0.865 601 HA VAL 75 HA VAL 75 -0.812 -0.648 -3.134 602 HB VAL 75 HB VAL 75 -1.783 -2.538 -0.993 603 HG11 VAL 75 1HG1 VAL 75 -3.809 -2.181 -1.829 604 HG12 VAL 75 2HG1 VAL 75 -3.128 -0.931 -2.871 605 HG13 VAL 75 3HG1 VAL 75 -3.249 -2.593 -3.449 606 HG21 VAL 75 3HG2 VAL 75 -1.651 -4.310 -2.657 607 HG22 VAL 75 1HG2 VAL 75 -0.950 -3.183 -3.819 608 HG23 VAL 75 2HG2 VAL 75 -0.056 -3.617 -2.362 609 H VAL 76 H VAL 76 -1.537 1.328 -2.730 610 HA VAL 76 HA VAL 76 -2.002 2.147 0.050 611 HB VAL 76 HB VAL 76 -1.658 3.777 -2.467 612 HG11 VAL 76 1HG1 VAL 76 -2.092 4.821 0.327 613 HG12 VAL 76 2HG1 VAL 76 -1.944 5.759 -1.161 614 HG13 VAL 76 3HG1 VAL 76 -3.355 4.733 -0.901 615 HG21 VAL 76 3HG2 VAL 76 0.466 4.181 -1.806 616 HG22 VAL 76 1HG2 VAL 76 0.046 4.180 -0.093 617 HG23 VAL 76 2HG2 VAL 76 0.262 2.654 -0.950 618 H TYR 77 H TYR 77 -4.032 1.421 0.522 619 HA TYR 77 HA TYR 77 -6.219 1.992 -1.323 620 HB2 TYR 77 1HB TYR 77 -5.983 -0.246 -0.195 621 HB3 TYR 77 2HB TYR 77 -6.341 0.559 1.335 622 HD1 TYR 77 2HD TYR 77 -7.900 1.093 -2.006 623 HD2 TYR 77 1HD TYR 77 -8.420 -0.264 1.992 624 HE1 TYR 77 2HE TYR 77 -10.312 0.838 -2.413 625 HE2 TYR 77 1HE TYR 77 -10.834 -0.525 1.597 626 HH TYR 77 HH TYR 77 -12.364 0.670 -1.275 627 H SER 78 H SER 78 -7.713 3.536 -1.016 628 HA SER 78 HA SER 78 -7.504 5.149 1.441 629 HB2 SER 78 1HB SER 78 -6.884 6.254 -0.755 630 HB3 SER 78 2HB SER 78 -8.586 6.082 -1.223 631 HG SER 78 HG SER 78 -8.795 7.925 -0.228 632 H TYR 79 H TYR 79 -9.036 4.230 2.726 633 HA TYR 79 HA TYR 79 -11.659 3.586 1.688 634 HB2 TYR 79 1HB TYR 79 -10.733 2.094 3.336 635 HB3 TYR 79 2HB TYR 79 -10.469 3.428 4.461 636 HD1 TYR 79 1HD TYR 79 -13.083 1.366 2.861 637 HD2 TYR 79 2HD TYR 79 -12.201 4.229 5.882 638 HE1 TYR 79 1HE TYR 79 -15.302 0.993 3.854 639 HE2 TYR 79 2HE TYR 79 -14.417 3.862 6.884 640 HH TYR 79 HH TYR 79 -16.664 1.462 5.548 641 H LYS 80 H LYS 80 -13.607 4.354 2.946 642 HA LYS 80 HA LYS 80 -13.320 7.218 3.583 643 HB2 LYS 80 1HB LYS 80 -14.501 6.817 1.451 644 HB3 LYS 80 2HB LYS 80 -15.692 5.833 2.317 645 HG2 LYS 80 1HG LYS 80 -16.323 7.808 3.660 646 HG3 LYS 80 2HG LYS 80 -15.192 8.778 2.698 647 HD2 LYS 80 1HD LYS 80 -17.017 9.197 1.435 648 HD3 LYS 80 2HD LYS 80 -16.624 7.621 0.724 649 HE2 LYS 80 1HE LYS 80 -18.265 7.508 3.175 650 HE3 LYS 80 2HE LYS 80 -19.039 8.269 1.777 651 HZ1 LYS 80 3HZ LYS 80 -18.583 5.527 2.265 652 HZ2 LYS 80 1HZ LYS 80 -17.794 5.978 0.837 653 HZ3 LYS 80 2HZ LYS 80 -19.455 6.250 1.009 654 H TYR 81 H TYR 81 -13.426 7.383 5.734 655 HA TYR 81 HA TYR 81 -15.353 5.725 7.197 656 HB2 TYR 81 1HB TYR 81 -12.727 6.226 7.729 657 HB3 TYR 81 2HB TYR 81 -13.513 7.456 8.721 658 HD1 TYR 81 2HD TYR 81 -15.663 6.488 10.058 659 HD2 TYR 81 1HD TYR 81 -12.289 4.223 8.800 660 HE1 TYR 81 2HE TYR 81 -16.140 4.820 11.801 661 HE2 TYR 81 1HE TYR 81 -12.757 2.548 10.539 662 HH TYR 81 HH TYR 81 -14.485 1.776 11.936 663 H VAL 82 H VAL 82 -17.121 6.565 8.107 664 HA VAL 82 HA VAL 82 -17.567 9.445 7.839 665 HB VAL 82 HB VAL 82 -19.603 7.373 8.645 666 HG11 VAL 82 1HG1 VAL 82 -19.637 10.252 8.010 667 HG12 VAL 82 2HG1 VAL 82 -20.949 9.293 7.322 668 HG13 VAL 82 3HG1 VAL 82 -20.687 9.308 9.066 669 HG21 VAL 82 3HG2 VAL 82 -18.305 7.226 6.295 670 HG22 VAL 82 1HG2 VAL 82 -19.998 6.780 6.500 671 HG23 VAL 82 2HG2 VAL 82 -19.576 8.371 5.867 672 H HIS 83 H HIS 83 -18.475 10.676 9.571 673 HA HIS 83 HA HIS 83 -17.434 9.855 12.165 674 HB2 HIS 83 1HB HIS 83 -18.534 12.474 11.128 675 HB3 HIS 83 2HB HIS 83 -18.061 12.224 12.810 676 HD1 HIS 83 1HD HIS 83 -15.802 13.078 13.283 677 HD2 HIS 83 2HD HIS 83 -16.121 11.667 9.388 678 HE1 HIS 83 1HE HIS 83 -13.542 13.452 12.245 679 HE2 HIS 83 2HE HIS 83 -13.736 12.591 9.865 680 H ASP 84 H ASP 84 -20.243 11.914 11.742 681 HA ASP 84 HA ASP 84 -22.316 10.163 12.193 682 HB2 ASP 84 1HB ASP 84 -20.650 10.361 14.496 683 HB3 ASP 84 2HB ASP 84 -22.180 11.170 14.864 684 H ASP 85 H ASP 85 -20.971 13.258 13.252 685 HA ASP 85 HA ASP 85 -23.482 14.568 13.517 686 HB2 ASP 85 1HB ASP 85 -20.860 15.161 14.179 687 HB3 ASP 85 2HB ASP 85 -21.222 16.313 12.887 688 H GLY 86 H GLY 86 -21.667 13.614 10.824 689 HA2 GLY 86 1HA GLY 86 -23.027 13.866 8.720 690 HA3 GLY 86 2HA GLY 86 -23.066 15.578 9.116 691 H ARG 87 H ARG 87 -20.133 14.081 9.929 692 HA ARG 87 HA ARG 87 -18.889 15.179 7.495 693 HB2 ARG 87 1HB ARG 87 -17.754 14.883 10.286 694 HB3 ARG 87 2HB ARG 87 -16.841 15.450 8.879 695 HG2 ARG 87 1HG ARG 87 -19.362 16.882 9.507 696 HG3 ARG 87 2HG ARG 87 -17.995 17.108 10.610 697 HD2 ARG 87 1HD ARG 87 -16.724 18.199 9.059 698 HD3 ARG 87 2HD ARG 87 -17.428 17.298 7.709 699 HE ARG 87 HE ARG 87 -19.394 18.976 8.808 700 HH11 ARG 87 2HH1 ARG 87 -16.434 19.143 6.984 701 HH12 ARG 87 1HH1 ARG 87 -16.859 20.618 6.180 702 HH21 ARG 87 1HH2 ARG 87 -18.868 21.626 6.620 703 HH22 ARG 87 2HH2 ARG 87 -19.966 20.917 7.756 704 H VAL 88 H VAL 88 -17.561 13.920 6.298 705 HA VAL 88 HA VAL 88 -16.784 11.293 7.350 706 HB VAL 88 HB VAL 88 -18.753 10.793 6.082 707 HG11 VAL 88 1HG1 VAL 88 -19.402 11.815 4.189 708 HG12 VAL 88 2HG1 VAL 88 -18.216 13.038 4.650 709 HG13 VAL 88 3HG1 VAL 88 -17.783 11.779 3.493 710 HG21 VAL 88 3HG2 VAL 88 -17.136 9.921 3.912 711 HG22 VAL 88 1HG2 VAL 88 -16.174 9.838 5.389 712 HG23 VAL 88 2HG2 VAL 88 -17.719 8.992 5.293 713 H SER 89 H SER 89 -14.704 10.878 7.003 714 HA SER 89 HA SER 89 -13.328 12.337 4.841 715 HB2 SER 89 1HB SER 89 -12.158 11.485 7.509 716 HB3 SER 89 2HB SER 89 -11.327 12.399 6.238 717 HG SER 89 HG SER 89 -12.128 14.122 7.106 718 H TYR 90 H TYR 90 -11.297 11.249 4.107 719 HA TYR 90 HA TYR 90 -11.716 8.336 4.006 720 HB2 TYR 90 1HB TYR 90 -10.045 9.740 1.967 721 HB3 TYR 90 2HB TYR 90 -11.064 8.309 1.795 722 HD1 TYR 90 2HD TYR 90 -13.537 8.551 1.603 723 HD2 TYR 90 1HD TYR 90 -10.935 11.916 1.528 724 HE1 TYR 90 2HE TYR 90 -15.338 9.914 0.628 725 HE2 TYR 90 1HE TYR 90 -12.728 13.289 0.556 726 HH TYR 90 HH TYR 90 -15.963 12.296 0.472 727 HA PRO 91 HA PRO 91 -7.822 8.633 6.340 728 HB2 PRO 91 2HB PRO 91 -8.884 7.627 8.112 729 HB3 PRO 91 1HB PRO 91 -8.093 6.171 7.509 730 HG2 PRO 91 1HG PRO 91 -9.976 5.462 6.347 731 HG3 PRO 91 2HG PRO 91 -10.731 6.253 7.781 732 HD2 PRO 91 1HD PRO 91 -11.390 6.907 5.230 733 HD3 PRO 91 2HD PRO 91 -11.377 8.090 6.548 734 H LEU 92 H LEU 92 -6.440 8.507 4.561 735 HA LEU 92 HA LEU 92 -6.157 6.151 2.982 736 HB2 LEU 92 1HB LEU 92 -5.007 8.822 3.099 737 HB3 LEU 92 2HB LEU 92 -3.801 7.581 2.713 738 HG LEU 92 HG LEU 92 -6.038 7.076 1.067 739 HD11 LEU 92 1HD1 LEU 92 -5.803 9.386 -0.171 740 HD12 LEU 92 2HD1 LEU 92 -5.460 9.967 1.458 741 HD13 LEU 92 3HD1 LEU 92 -6.987 9.154 1.116 742 HD21 LEU 92 3HD2 LEU 92 -3.197 7.795 0.822 743 HD22 LEU 92 1HD2 LEU 92 -4.197 8.176 -0.580 744 HD23 LEU 92 2HD2 LEU 92 -4.122 6.521 0.026 745 H CYS 93 H CYS 93 -4.827 4.443 3.211 746 HA CYS 93 HA CYS 93 -2.801 4.524 5.337 747 HB2 CYS 93 1HB CYS 93 -4.851 2.356 4.867 748 HB3 CYS 93 2HB CYS 93 -3.441 2.166 5.923 749 HG CYS 93 HG CYS 93 -6.062 4.306 6.414 750 H PHE 94 H PHE 94 -1.170 2.805 5.137 751 HA PHE 94 HA PHE 94 -0.644 2.229 2.304 752 HB2 PHE 94 1HB PHE 94 1.035 3.606 3.501 753 HB3 PHE 94 2HB PHE 94 1.288 2.274 4.633 754 HD1 PHE 94 2HD PHE 94 1.674 3.284 1.104 755 HD2 PHE 94 1HD PHE 94 2.683 0.447 4.112 756 HE1 PHE 94 2HE PHE 94 3.377 2.316 -0.384 757 HE2 PHE 94 1HE PHE 94 4.390 -0.524 2.629 758 HZ PHE 94 HZ PHE 94 4.738 0.410 0.377 759 H ILE 95 H ILE 95 -1.412 0.267 1.809 760 HA ILE 95 HA ILE 95 -1.175 -1.920 3.727 761 HB ILE 95 HB ILE 95 -2.561 -1.766 1.050 762 HG12 ILE 95 1HG1 ILE 95 -3.700 -2.066 3.838 763 HG13 ILE 95 2HG1 ILE 95 -3.581 -0.522 2.977 764 HG21 ILE 95 1HG2 ILE 95 -3.564 -3.992 2.115 765 HG22 ILE 95 2HG2 ILE 95 -2.141 -3.995 1.077 766 HG23 ILE 95 3HG2 ILE 95 -1.953 -4.053 2.829 767 HD11 ILE 95 3HD1 ILE 95 -5.765 -1.154 2.588 768 HD12 ILE 95 1HD1 ILE 95 -4.938 -1.699 1.129 769 HD13 ILE 95 2HD1 ILE 95 -5.347 -2.856 2.396 770 H PHE 96 H PHE 96 0.462 -3.299 3.672 771 HA PHE 96 HA PHE 96 2.147 -3.405 1.278 772 HB2 PHE 96 1HB PHE 96 3.001 -2.952 3.706 773 HB3 PHE 96 2HB PHE 96 2.852 -4.702 3.891 774 HD1 PHE 96 2HD PHE 96 3.579 -5.271 0.917 775 HD2 PHE 96 1HD PHE 96 5.399 -2.974 4.005 776 HE1 PHE 96 2HE PHE 96 5.776 -5.595 -0.142 777 HE2 PHE 96 1HE PHE 96 7.599 -3.294 2.950 778 HZ PHE 96 HZ PHE 96 7.790 -4.607 0.876 779 H SER 97 H SER 97 1.479 -4.914 -0.113 780 HA SER 97 HA SER 97 0.185 -7.333 0.750 781 HB2 SER 97 1HB SER 97 -0.583 -6.385 -1.310 782 HB3 SER 97 2HB SER 97 1.064 -6.329 -1.962 783 HG SER 97 HG SER 97 0.022 -8.116 -2.816 784 H SER 98 H SER 98 1.689 -8.447 1.993 785 HA SER 98 HA SER 98 4.032 -9.474 0.526 786 HB2 SER 98 1HB SER 98 4.377 -8.008 2.637 787 HB3 SER 98 2HB SER 98 3.829 -9.438 3.530 788 HG SER 98 HG SER 98 6.054 -9.532 3.359 789 HA PRO 99 HA PRO 99 1.468 -13.190 0.969 790 HB2 PRO 99 2HB PRO 99 1.450 -13.349 -1.323 791 HB3 PRO 99 1HB PRO 99 2.715 -14.548 -1.058 792 HG2 PRO 99 1HG PRO 99 4.430 -13.032 -1.461 793 HG3 PRO 99 2HG PRO 99 3.166 -12.439 -2.603 794 HD2 PRO 99 1HD PRO 99 4.357 -10.829 -0.770 795 HD3 PRO 99 2HD PRO 99 2.667 -10.631 -1.264 796 H VAL 100 H VAL 100 2.580 -15.638 0.510 797 HA VAL 100 HA VAL 100 4.841 -15.756 2.400 798 HB VAL 100 HB VAL 100 2.417 -17.538 2.236 799 HG11 VAL 100 1HG1 VAL 100 4.289 -19.028 2.363 800 HG12 VAL 100 2HG1 VAL 100 5.038 -18.057 3.633 801 HG13 VAL 100 3HG1 VAL 100 3.546 -18.940 3.960 802 HG21 VAL 100 3HG2 VAL 100 2.411 -15.433 3.632 803 HG22 VAL 100 1HG2 VAL 100 2.050 -16.928 4.495 804 HG23 VAL 100 2HG2 VAL 100 3.648 -16.194 4.632 805 H GLY 101 H GLY 101 3.410 -16.880 -0.551 806 HA2 GLY 101 1HA GLY 101 5.334 -19.014 -0.928 807 HA3 GLY 101 2HA GLY 101 4.094 -18.512 -2.067 808 H CYS 102 H CYS 102 5.805 -15.854 -0.956 809 HA CYS 102 HA CYS 102 7.120 -15.556 -3.512 810 HB2 CYS 102 1HB CYS 102 7.741 -13.323 -2.685 811 HB3 CYS 102 2HB CYS 102 6.000 -13.626 -2.548 812 HG CYS 102 HG CYS 102 8.225 -13.766 0.050 813 H LYS 103 H LYS 103 9.412 -14.490 -3.365 814 HA LYS 103 HA LYS 103 11.069 -16.337 -1.795 815 HB2 LYS 103 1HB LYS 103 12.088 -14.596 -4.026 816 HB3 LYS 103 2HB LYS 103 12.740 -16.128 -3.423 817 HG2 LYS 103 1HG LYS 103 11.601 -17.277 -4.937 818 HG3 LYS 103 2HG LYS 103 10.082 -16.542 -4.396 819 HD2 LYS 103 1HD LYS 103 10.454 -16.096 -6.766 820 HD3 LYS 103 2HD LYS 103 10.511 -14.596 -5.825 821 HE2 LYS 103 1HE LYS 103 12.446 -14.194 -6.890 822 HE3 LYS 103 2HE LYS 103 13.128 -15.401 -5.790 823 HZ1 LYS 103 3HZ LYS 103 13.200 -15.550 -8.478 824 HZ2 LYS 103 1HZ LYS 103 11.870 -16.533 -8.121 825 HZ3 LYS 103 2HZ LYS 103 13.380 -16.869 -7.436 826 HA PRO 104 HA PRO 104 12.634 -13.146 0.785 827 HB2 PRO 104 2HB PRO 104 13.749 -14.791 1.935 828 HB3 PRO 104 1HB PRO 104 15.182 -14.042 1.236 829 HG2 PRO 104 1HG PRO 104 15.304 -15.574 -0.506 830 HG3 PRO 104 2HG PRO 104 14.676 -16.613 0.826 831 HD2 PRO 104 1HD PRO 104 13.441 -16.414 -1.583 832 HD3 PRO 104 2HD PRO 104 12.552 -16.644 -0.068 833 H GLU 105 H GLU 105 13.953 -13.752 -2.307 834 HA GLU 105 HA GLU 105 15.990 -11.735 -2.252 835 HB2 GLU 105 1HB GLU 105 14.831 -13.587 -4.256 836 HB3 GLU 105 2HB GLU 105 15.541 -12.093 -4.890 837 HG2 GLU 105 1HG GLU 105 17.676 -12.611 -4.097 838 HG3 GLU 105 2HG GLU 105 17.052 -13.835 -2.982 839 H GLN 106 H GLN 106 12.617 -11.893 -3.210 840 HA GLN 106 HA GLN 106 12.675 -9.187 -4.273 841 HB2 GLN 106 1HB GLN 106 10.174 -10.800 -3.871 842 HB3 GLN 106 2HB GLN 106 10.534 -9.587 -5.109 843 HG2 GLN 106 1HG GLN 106 11.855 -12.295 -4.963 844 HG3 GLN 106 2HG GLN 106 10.437 -11.922 -5.953 845 HE21 GLN 106 2HE2 GLN 106 12.390 -9.590 -8.003 846 HE22 GLN 106 1HE2 GLN 106 10.975 -9.526 -7.014 847 H GLN 107 H GLN 107 10.731 -10.898 -1.814 848 HA GLN 107 HA GLN 107 9.367 -8.934 -0.625 849 HB2 GLN 107 1HB GLN 107 10.297 -11.473 0.166 850 HB3 GLN 107 2HB GLN 107 10.696 -10.367 1.491 851 HG2 GLN 107 1HG GLN 107 7.989 -10.000 0.450 852 HG3 GLN 107 2HG GLN 107 8.289 -11.611 1.119 853 HE21 GLN 107 2HE2 GLN 107 8.471 -8.333 3.564 854 HE22 GLN 107 1HE2 GLN 107 8.752 -8.181 1.867 855 H MET 108 H MET 108 12.829 -9.504 -0.142 856 HA MET 108 HA MET 108 13.252 -7.527 1.806 857 HB2 MET 108 1HB MET 108 14.980 -8.999 -0.137 858 HB3 MET 108 2HB MET 108 15.652 -7.583 0.684 859 HG2 MET 108 1HG MET 108 14.674 -8.818 2.826 860 HG3 MET 108 2HG MET 108 14.892 -10.225 1.783 861 HE1 MET 108 3HE MET 108 17.953 -10.906 0.972 862 HE2 MET 108 1HE MET 108 16.921 -9.808 0.057 863 HE3 MET 108 2HE MET 108 18.529 -9.290 0.563 864 H MET 109 H MET 109 13.498 -7.405 -1.733 865 HA MET 109 HA MET 109 14.485 -4.858 -2.072 866 HB2 MET 109 1HB MET 109 12.500 -6.452 -3.688 867 HB3 MET 109 2HB MET 109 13.063 -4.857 -4.209 868 HG2 MET 109 1HG MET 109 15.327 -5.613 -4.369 869 HG3 MET 109 2HG MET 109 14.906 -7.156 -3.619 870 HE1 MET 109 3HE MET 109 13.944 -4.881 -6.777 871 HE2 MET 109 1HE MET 109 12.936 -6.054 -7.626 872 HE3 MET 109 2HE MET 109 12.458 -5.471 -6.031 873 H TYR 110 H TYR 110 11.147 -5.850 -1.459 874 HA TYR 110 HA TYR 110 10.178 -3.128 -1.571 875 HB2 TYR 110 1HB TYR 110 8.725 -5.601 -0.602 876 HB3 TYR 110 2HB TYR 110 8.004 -4.069 -1.101 877 HD1 TYR 110 2HD TYR 110 9.818 -7.039 -2.355 878 HD2 TYR 110 1HD TYR 110 7.538 -3.595 -3.378 879 HE1 TYR 110 2HE TYR 110 9.619 -7.864 -4.664 880 HE2 TYR 110 1HE TYR 110 7.332 -4.411 -5.689 881 HH TYR 110 HH TYR 110 7.431 -6.596 -6.885 882 H ALA 111 H ALA 111 11.059 -5.489 0.867 883 HA ALA 111 HA ALA 111 9.978 -4.093 3.093 884 HB1 ALA 111 3HB ALA 111 11.416 -6.523 2.637 885 HB2 ALA 111 1HB ALA 111 12.157 -5.641 3.973 886 HB3 ALA 111 2HB ALA 111 10.442 -6.050 4.029 887 H GLY 112 H GLY 112 12.884 -3.767 1.241 888 HA2 GLY 112 1HA GLY 112 14.152 -2.117 3.300 889 HA3 GLY 112 2HA GLY 112 14.898 -2.664 1.806 890 H SER 113 H SER 113 12.386 -1.797 0.347 891 HA SER 113 HA SER 113 13.166 1.023 0.113 892 HB2 SER 113 1HB SER 113 11.418 -0.445 -1.856 893 HB3 SER 113 2HB SER 113 12.458 0.964 -2.126 894 HG SER 113 HG SER 113 13.693 -1.384 -1.276 895 H LYS 114 H LYS 114 10.799 -0.872 1.477 896 HA LYS 114 HA LYS 114 8.398 0.396 0.936 897 HB2 LYS 114 1HB LYS 114 8.410 -1.619 2.223 898 HB3 LYS 114 2HB LYS 114 9.411 -0.875 3.480 899 HG2 LYS 114 1HG LYS 114 7.457 0.760 3.810 900 HG3 LYS 114 2HG LYS 114 6.512 -0.418 2.884 901 HD2 LYS 114 1HD LYS 114 6.120 -1.185 5.011 902 HD3 LYS 114 2HD LYS 114 7.565 -2.122 4.595 903 HE2 LYS 114 1HE LYS 114 8.971 -0.407 5.710 904 HE3 LYS 114 2HE LYS 114 7.492 0.441 6.184 905 HZ1 LYS 114 3HZ LYS 114 8.395 -2.239 7.064 906 HZ2 LYS 114 1HZ LYS 114 6.821 -1.674 7.325 907 HZ3 LYS 114 2HZ LYS 114 8.135 -0.866 8.016 908 H ASN 115 H ASN 115 10.350 1.013 3.860 909 HA ASN 115 HA ASN 115 9.096 3.243 4.787 910 HB2 ASN 115 1HB ASN 115 11.984 2.410 4.833 911 HB3 ASN 115 2HB ASN 115 11.498 3.958 5.534 912 HD21 ASN 115 2HD2 ASN 115 11.072 0.634 7.642 913 HD22 ASN 115 1HD2 ASN 115 12.002 0.777 6.193 914 H ARG 116 H ARG 116 11.509 3.093 2.211 915 HA ARG 116 HA ARG 116 11.861 5.852 1.845 916 HB2 ARG 116 1HB ARG 116 13.392 4.260 0.864 917 HB3 ARG 116 2HB ARG 116 12.095 3.570 -0.122 918 HG2 ARG 116 1HG ARG 116 13.328 4.925 -1.589 919 HG3 ARG 116 2HG ARG 116 11.876 5.858 -1.190 920 HD2 ARG 116 1HD ARG 116 13.064 7.508 -0.256 921 HD3 ARG 116 2HD ARG 116 14.027 6.360 0.685 922 HE ARG 116 HE ARG 116 14.801 6.413 -2.063 923 HH11 ARG 116 2HH1 ARG 116 15.136 8.058 0.987 924 HH12 ARG 116 1HH1 ARG 116 16.673 8.752 0.592 925 HH21 ARG 116 1HH2 ARG 116 17.633 8.334 -1.445 926 HH22 ARG 116 2HH2 ARG 116 16.825 7.321 -2.595 927 H LEU 117 H LEU 117 9.720 3.581 0.125 928 HA LEU 117 HA LEU 117 8.475 5.545 -1.477 929 HB2 LEU 117 1HB LEU 117 8.300 3.341 -2.240 930 HB3 LEU 117 2HB LEU 117 7.751 2.754 -0.661 931 HG LEU 117 HG LEU 117 5.640 4.185 -1.129 932 HD11 LEU 117 1HD1 LEU 117 5.338 5.089 -3.143 933 HD12 LEU 117 2HD1 LEU 117 5.935 3.653 -3.972 934 HD13 LEU 117 3HD1 LEU 117 7.071 4.866 -3.381 935 HD21 LEU 117 3HD2 LEU 117 5.569 1.789 -0.988 936 HD22 LEU 117 1HD2 LEU 117 6.263 1.629 -2.602 937 HD23 LEU 117 2HD2 LEU 117 4.643 2.298 -2.400 938 H VAL 118 H VAL 118 7.278 3.849 1.426 939 HA VAL 118 HA VAL 118 4.881 5.152 1.759 940 HB VAL 118 HB VAL 118 6.795 4.229 3.904 941 HG11 VAL 118 1HG1 VAL 118 5.421 5.048 5.441 942 HG12 VAL 118 2HG1 VAL 118 4.452 5.790 4.167 943 HG13 VAL 118 3HG1 VAL 118 4.070 4.163 4.734 944 HG21 VAL 118 3HG2 VAL 118 5.019 2.350 3.980 945 HG22 VAL 118 1HG2 VAL 118 4.583 2.920 2.369 946 HG23 VAL 118 2HG2 VAL 118 6.217 2.336 2.686 947 H GLN 119 H GLN 119 7.955 6.082 3.319 948 HA GLN 119 HA GLN 119 7.135 8.400 4.546 949 HB2 GLN 119 1HB GLN 119 9.752 7.520 3.376 950 HB3 GLN 119 2HB GLN 119 9.586 9.167 4.008 951 HG2 GLN 119 1HG GLN 119 8.668 8.014 6.137 952 HG3 GLN 119 2HG GLN 119 9.442 6.568 5.472 953 HE21 GLN 119 2HE2 GLN 119 11.609 9.346 7.361 954 HE22 GLN 119 1HE2 GLN 119 9.884 9.370 7.269 955 H THR 120 H THR 120 7.907 7.876 1.169 956 HA THR 120 HA THR 120 8.037 10.588 0.386 957 HB THR 120 HB THR 120 7.189 8.263 -1.348 958 HG1 THR 120 1HG THR 120 9.368 8.321 -0.055 959 HG21 THR 120 3HG2 THR 120 7.835 11.079 -1.825 960 HG22 THR 120 1HG2 THR 120 6.960 9.930 -2.837 961 HG23 THR 120 2HG2 THR 120 8.723 9.958 -2.857 962 H ALA 121 H ALA 121 5.383 8.235 0.409 963 HA ALA 121 HA ALA 121 3.463 10.005 -0.722 964 HB1 ALA 121 3HB ALA 121 1.846 8.325 -0.230 965 HB2 ALA 121 1HB ALA 121 3.323 7.505 -0.739 966 HB3 ALA 121 2HB ALA 121 2.899 7.580 0.972 967 H GLU 122 H GLU 122 4.656 9.462 2.489 968 HA GLU 122 HA GLU 122 4.369 10.714 4.385 969 HB2 GLU 122 1HB GLU 122 3.454 12.428 2.413 970 HB3 GLU 122 2HB GLU 122 2.087 12.322 3.532 971 HG2 GLU 122 1HG GLU 122 4.691 12.705 4.832 972 HG3 GLU 122 2HG GLU 122 4.174 14.035 3.786 973 H LEU 123 H LEU 123 2.975 8.266 3.772 974 HA LEU 123 HA LEU 123 0.321 8.551 4.906 975 HB2 LEU 123 1HB LEU 123 1.831 6.038 4.175 976 HB3 LEU 123 2HB LEU 123 0.098 6.178 4.518 977 HG LEU 123 HG LEU 123 1.335 7.650 2.216 978 HD11 LEU 123 1HD1 LEU 123 0.219 4.854 2.102 979 HD12 LEU 123 2HD1 LEU 123 1.937 5.247 2.049 980 HD13 LEU 123 3HD1 LEU 123 0.866 5.801 0.762 981 HD21 LEU 123 3HD2 LEU 123 -1.232 6.727 1.636 982 HD22 LEU 123 1HD2 LEU 123 -0.759 8.375 2.049 983 HD23 LEU 123 2HD2 LEU 123 -1.306 7.271 3.312 984 H THR 124 H THR 124 0.606 9.192 7.020 985 HA THR 124 HA THR 124 2.447 8.292 8.863 986 HB THR 124 HB THR 124 -0.408 9.175 9.286 987 HG1 THR 124 1HG THR 124 2.027 10.523 9.873 988 HG21 THR 124 3HG2 THR 124 0.296 9.536 11.666 989 HG22 THR 124 1HG2 THR 124 1.737 8.579 11.322 990 HG23 THR 124 2HG2 THR 124 0.139 7.843 11.199 991 H LYS 125 H LYS 125 -0.695 6.880 8.035 992 HA LYS 125 HA LYS 125 -0.339 4.710 9.921 993 HB2 LYS 125 1HB LYS 125 -2.500 5.637 8.088 994 HB3 LYS 125 2HB LYS 125 -2.487 3.927 8.549 995 HG2 LYS 125 1HG LYS 125 -2.769 4.416 10.834 996 HG3 LYS 125 2HG LYS 125 -2.368 6.124 10.589 997 HD2 LYS 125 1HD LYS 125 -4.637 5.227 8.970 998 HD3 LYS 125 2HD LYS 125 -4.906 5.080 10.716 999 HE2 LYS 125 1HE LYS 125 -3.671 7.615 9.807 1000 HE3 LYS 125 2HE LYS 125 -5.350 7.342 9.318 1001 HZ1 LYS 125 3HZ LYS 125 -6.010 7.891 11.343 1002 HZ2 LYS 125 1HZ LYS 125 -4.409 8.192 11.799 1003 HZ3 LYS 125 2HZ LYS 125 -5.079 6.656 12.028 1004 H VAL 126 H VAL 126 0.798 2.952 9.476 1005 HA VAL 126 HA VAL 126 0.907 2.004 6.690 1006 HB VAL 126 HB VAL 126 3.210 1.955 8.644 1007 HG11 VAL 126 1HG1 VAL 126 2.667 0.533 6.177 1008 HG12 VAL 126 2HG1 VAL 126 4.158 1.472 6.088 1009 HG13 VAL 126 3HG1 VAL 126 3.940 0.278 7.370 1010 HG21 VAL 126 3HG2 VAL 126 4.267 3.556 7.087 1011 HG22 VAL 126 1HG2 VAL 126 2.752 3.646 6.189 1012 HG23 VAL 126 2HG2 VAL 126 2.823 4.210 7.857 1013 H PHE 127 H PHE 127 -0.151 0.138 6.620 1014 HA PHE 127 HA PHE 127 0.103 -1.714 8.893 1015 HB2 PHE 127 1HB PHE 127 -2.052 -1.764 6.774 1016 HB3 PHE 127 2HB PHE 127 -2.035 -2.624 8.315 1017 HD1 PHE 127 1HD PHE 127 -1.037 -0.315 10.024 1018 HD2 PHE 127 2HD PHE 127 -4.094 -0.587 7.074 1019 HE1 PHE 127 1HE PHE 127 -2.240 1.540 11.103 1020 HE2 PHE 127 2HE PHE 127 -5.300 1.268 8.148 1021 HZ PHE 127 HZ PHE 127 -4.373 2.335 10.164 1022 H GLU 128 H GLU 128 0.144 -4.019 8.381 1023 HA GLU 128 HA GLU 128 1.288 -4.592 5.731 1024 HB2 GLU 128 1HB GLU 128 2.875 -4.463 7.849 1025 HB3 GLU 128 2HB GLU 128 2.262 -6.103 8.111 1026 HG2 GLU 128 1HG GLU 128 2.911 -6.341 5.539 1027 HG3 GLU 128 2HG GLU 128 4.046 -5.061 5.993 1028 H ILE 129 H ILE 129 0.976 -6.724 4.947 1029 HA ILE 129 HA ILE 129 -0.944 -8.379 6.422 1030 HB ILE 129 HB ILE 129 -2.123 -8.811 4.210 1031 HG12 ILE 129 1HG1 ILE 129 -0.841 -6.165 3.489 1032 HG13 ILE 129 2HG1 ILE 129 -0.340 -7.729 2.823 1033 HG21 ILE 129 1HG2 ILE 129 -2.991 -7.437 6.124 1034 HG22 ILE 129 2HG2 ILE 129 -2.411 -6.009 5.268 1035 HG23 ILE 129 3HG2 ILE 129 -3.657 -7.026 4.544 1036 HD11 ILE 129 3HD1 ILE 129 -3.193 -6.935 2.574 1037 HD12 ILE 129 1HD1 ILE 129 -2.000 -6.187 1.515 1038 HD13 ILE 129 2HD1 ILE 129 -2.201 -7.938 1.517 1039 H ARG 130 H ARG 130 -0.387 -10.457 6.432 1040 HA ARG 130 HA ARG 130 1.920 -11.334 4.962 1041 HB2 ARG 130 1HB ARG 130 1.233 -12.006 7.345 1042 HB3 ARG 130 2HB ARG 130 0.090 -13.109 6.561 1043 HG2 ARG 130 1HG ARG 130 1.898 -14.487 6.930 1044 HG3 ARG 130 2HG ARG 130 2.172 -13.948 5.264 1045 HD2 ARG 130 1HD ARG 130 4.254 -13.518 6.067 1046 HD3 ARG 130 2HD ARG 130 3.477 -12.002 6.547 1047 HE ARG 130 HE ARG 130 3.591 -12.659 8.756 1048 HH11 ARG 130 2HH1 ARG 130 4.453 -15.309 6.671 1049 HH12 ARG 130 1HH1 ARG 130 5.059 -16.296 7.959 1050 HH21 ARG 130 1HH2 ARG 130 5.020 -15.522 10.114 1051 HH22 ARG 130 2HH2 ARG 130 4.386 -13.949 10.461 1052 H THR 131 H THR 131 -1.335 -11.122 4.241 1053 HA THR 131 HA THR 131 -1.063 -12.466 1.766 1054 HB THR 131 HB THR 131 -1.261 -14.540 2.859 1055 HG1 THR 131 1HG THR 131 -2.695 -14.682 1.228 1056 HG21 THR 131 3HG2 THR 131 -3.714 -13.730 4.372 1057 HG22 THR 131 1HG2 THR 131 -2.116 -13.355 5.015 1058 HG23 THR 131 2HG2 THR 131 -2.571 -15.030 4.708 1059 H THR 132 H THR 132 -2.709 -11.959 0.367 1060 HA THR 132 HA THR 132 -4.194 -9.704 0.692 1061 HB THR 132 HB THR 132 -5.668 -10.486 -1.127 1062 HG1 THR 132 1HG THR 132 -5.297 -12.623 -1.941 1063 HG21 THR 132 3HG2 THR 132 -3.291 -9.665 -1.504 1064 HG22 THR 132 1HG2 THR 132 -4.006 -10.616 -2.806 1065 HG23 THR 132 2HG2 THR 132 -2.845 -11.359 -1.705 1066 H ASP 133 H ASP 133 -5.313 -13.022 1.310 1067 HA ASP 133 HA ASP 133 -7.910 -12.766 1.904 1068 HB2 ASP 133 1HB ASP 133 -5.772 -14.480 2.828 1069 HB3 ASP 133 2HB ASP 133 -6.934 -14.185 4.128 1070 H ASP 134 H ASP 134 -5.286 -11.419 3.777 1071 HA ASP 134 HA ASP 134 -6.748 -10.759 6.100 1072 HB2 ASP 134 1HB ASP 134 -4.115 -10.619 5.361 1073 HB3 ASP 134 2HB ASP 134 -4.579 -8.912 5.358 1074 H LEU 135 H LEU 135 -5.900 -8.821 3.237 1075 HA LEU 135 HA LEU 135 -7.097 -6.435 3.963 1076 HB2 LEU 135 1HB LEU 135 -5.738 -6.450 2.039 1077 HB3 LEU 135 2HB LEU 135 -6.692 -7.744 1.292 1078 HG LEU 135 HG LEU 135 -8.461 -6.258 0.755 1079 HD11 LEU 135 1HD1 LEU 135 -7.690 -3.709 1.512 1080 HD12 LEU 135 2HD1 LEU 135 -7.364 -4.699 2.934 1081 HD13 LEU 135 3HD1 LEU 135 -8.979 -4.677 2.229 1082 HD21 LEU 135 3HD2 LEU 135 -5.702 -5.367 0.121 1083 HD22 LEU 135 1HD2 LEU 135 -7.033 -4.297 -0.316 1084 HD23 LEU 135 2HD2 LEU 135 -6.981 -5.943 -0.947 1085 H THR 136 H THR 136 -9.021 -6.914 5.092 1086 HA THR 136 HA THR 136 -11.290 -7.587 3.334 1087 HB THR 136 HB THR 136 -12.326 -8.301 5.679 1088 HG1 THR 136 1HG THR 136 -10.843 -9.017 7.099 1089 HG21 THR 136 3HG2 THR 136 -10.461 -10.100 4.131 1090 HG22 THR 136 1HG2 THR 136 -12.107 -9.703 3.643 1091 HG23 THR 136 2HG2 THR 136 -11.822 -10.604 5.131 1092 H GLU 137 H GLU 137 -13.253 -6.503 3.730 1093 HA GLU 137 HA GLU 137 -13.201 -3.829 4.178 1094 HB2 GLU 137 1HB GLU 137 -15.150 -5.021 3.288 1095 HB3 GLU 137 2HB GLU 137 -15.476 -5.685 4.897 1096 HG2 GLU 137 1HG GLU 137 -15.557 -3.174 5.615 1097 HG3 GLU 137 2HG GLU 137 -15.847 -2.907 3.891 1098 H THR 138 H THR 138 -13.713 -6.333 6.630 1099 HA THR 138 HA THR 138 -14.069 -4.490 8.780 1100 HB THR 138 HB THR 138 -13.217 -7.372 9.051 1101 HG1 THR 138 1HG THR 138 -15.030 -7.653 7.925 1102 HG21 THR 138 3HG2 THR 138 -13.170 -6.078 11.109 1103 HG22 THR 138 1HG2 THR 138 -14.504 -7.230 11.150 1104 HG23 THR 138 2HG2 THR 138 -14.820 -5.525 10.825 1105 H TRP 139 H TRP 139 -11.451 -6.858 8.250 1106 HA TRP 139 HA TRP 139 -9.639 -6.058 10.080 1107 HB2 TRP 139 1HB TRP 139 -9.059 -7.906 8.734 1108 HB3 TRP 139 2HB TRP 139 -9.219 -6.976 7.244 1109 HD1 TRP 139 HD TRP 139 -6.731 -7.757 10.003 1110 HE1 TRP 139 1HE TRP 139 -4.431 -6.799 9.357 1111 HE3 TRP 139 3HE TRP 139 -8.112 -5.020 5.912 1112 HZ2 TRP 139 2HZ TRP 139 -3.346 -5.106 7.376 1113 HZ3 TRP 139 3HZ TRP 139 -6.383 -3.759 4.697 1114 HH2 TRP 139 HH TRP 139 -4.050 -3.802 5.417 1115 H LEU 140 H LEU 140 -10.626 -4.264 7.292 1116 HA LEU 140 HA LEU 140 -8.405 -2.418 7.398 1117 HB2 LEU 140 1HB LEU 140 -9.211 -2.718 5.236 1118 HB3 LEU 140 2HB LEU 140 -10.901 -2.643 5.764 1119 HG LEU 140 HG LEU 140 -10.777 -0.257 6.028 1120 HD11 LEU 140 1HD1 LEU 140 -8.411 -0.239 6.836 1121 HD12 LEU 140 2HD1 LEU 140 -8.803 1.026 5.672 1122 HD13 LEU 140 3HD1 LEU 140 -7.898 -0.397 5.155 1123 HD21 LEU 140 3HD2 LEU 140 -11.323 -0.320 3.865 1124 HD22 LEU 140 1HD2 LEU 140 -10.142 -1.585 3.517 1125 HD23 LEU 140 2HD2 LEU 140 -9.640 0.106 3.547 1126 H LYS 141 H LYS 141 -11.935 -2.017 7.750 1127 HA LYS 141 HA LYS 141 -11.872 0.548 8.831 1128 HB2 LYS 141 1HB LYS 141 -13.829 -1.679 8.743 1129 HB3 LYS 141 2HB LYS 141 -14.102 -0.442 9.982 1130 HG2 LYS 141 1HG LYS 141 -14.617 1.178 8.475 1131 HG3 LYS 141 2HG LYS 141 -13.547 0.504 7.232 1132 HD2 LYS 141 1HD LYS 141 -15.505 -0.111 6.274 1133 HD3 LYS 141 2HD LYS 141 -15.352 -1.481 7.389 1134 HE2 LYS 141 1HE LYS 141 -16.677 0.990 8.404 1135 HE3 LYS 141 2HE LYS 141 -17.563 -0.014 7.247 1136 HZ1 LYS 141 3HZ LYS 141 -16.634 -1.849 8.977 1137 HZ2 LYS 141 1HZ LYS 141 -18.170 -1.145 9.060 1138 HZ3 LYS 141 2HZ LYS 141 -16.909 -0.537 10.008 1139 H GLU 142 H GLU 142 -10.997 -2.439 10.245 1140 HA GLU 142 HA GLU 142 -11.514 -1.856 12.963 1141 HB2 GLU 142 1HB GLU 142 -9.764 -3.796 11.499 1142 HB3 GLU 142 2HB GLU 142 -9.541 -3.579 13.242 1143 HG2 GLU 142 1HG GLU 142 -12.108 -3.965 13.370 1144 HG3 GLU 142 2HG GLU 142 -11.888 -4.680 11.766 1145 H LYS 143 H LYS 143 -8.499 -1.668 11.072 1146 HA LYS 143 HA LYS 143 -6.938 -0.521 13.108 1147 HB2 LYS 143 1HB LYS 143 -6.592 -0.170 10.121 1148 HB3 LYS 143 2HB LYS 143 -5.344 0.017 11.364 1149 HG2 LYS 143 1HG LYS 143 -6.544 -2.590 11.563 1150 HG3 LYS 143 2HG LYS 143 -5.976 -2.288 9.911 1151 HD2 LYS 143 1HD LYS 143 -3.857 -1.346 11.266 1152 HD3 LYS 143 2HD LYS 143 -4.441 -2.549 12.430 1153 HE2 LYS 143 1HE LYS 143 -4.221 -4.325 10.872 1154 HE3 LYS 143 2HE LYS 143 -4.016 -3.198 9.523 1155 HZ1 LYS 143 3HZ LYS 143 -1.927 -2.451 10.722 1156 HZ2 LYS 143 1HZ LYS 143 -1.882 -3.980 10.001 1157 HZ3 LYS 143 2HZ LYS 143 -2.089 -3.841 11.673 1158 H LEU 144 H LEU 144 -8.799 0.955 10.474 1159 HA LEU 144 HA LEU 144 -8.052 3.618 10.966 1160 HB2 LEU 144 1HB LEU 144 -10.726 2.719 9.898 1161 HB3 LEU 144 2HB LEU 144 -9.883 4.246 9.586 1162 HG LEU 144 HG LEU 144 -8.981 1.537 8.610 1163 HD11 LEU 144 1HD1 LEU 144 -10.732 1.877 7.214 1164 HD12 LEU 144 2HD1 LEU 144 -9.551 2.891 6.385 1165 HD13 LEU 144 3HD1 LEU 144 -10.738 3.623 7.464 1166 HD21 LEU 144 3HD2 LEU 144 -7.729 3.404 7.087 1167 HD22 LEU 144 1HD2 LEU 144 -7.013 2.607 8.488 1168 HD23 LEU 144 2HD2 LEU 144 -7.752 4.200 8.662 1169 H ALA 145 H ALA 145 -10.759 1.684 12.184 1170 HA ALA 145 HA ALA 145 -12.331 3.435 13.477 1171 HB1 ALA 145 3HB ALA 145 -13.149 1.644 14.532 1172 HB2 ALA 145 1HB ALA 145 -11.934 0.723 13.645 1173 HB3 ALA 145 2HB ALA 145 -11.600 1.272 15.288 1174 H SER 146 H SER 146 -9.608 1.940 15.233 1175 HA SER 146 HA SER 146 -8.480 4.333 16.157 1176 HB2 SER 146 1HB SER 146 -10.884 3.973 17.387 1177 HB3 SER 146 2HB SER 146 -9.803 3.131 18.510 1178 HG SER 146 HG SER 146 -9.440 5.077 19.231 1179 H GLY 147 H GLY 147 -7.507 1.934 15.158 1180 HA2 GLY 147 1HA GLY 147 -6.676 0.048 17.046 1181 HA3 GLY 147 2HA GLY 147 -5.849 0.394 15.535 1182 HA PRO 148 HA PRO 148 -3.329 1.729 19.320 1183 HB2 PRO 148 2HB PRO 148 -2.845 -0.386 20.074 1184 HB3 PRO 148 1HB PRO 148 -1.366 -0.171 19.140 1185 HG2 PRO 148 1HG PRO 148 -2.194 -1.326 17.302 1186 HG3 PRO 148 2HG PRO 148 -2.974 -2.225 18.657 1187 HD2 PRO 148 1HD PRO 148 -4.387 -1.167 16.594 1188 HD3 PRO 148 2HD PRO 148 -5.026 -1.260 18.244 1189 H SER 149 H SER 149 -0.777 1.991 19.205 1190 HA SER 149 HA SER 149 -0.087 2.873 16.478 1191 HB2 SER 149 1HB SER 149 -0.601 4.575 18.566 1192 HB3 SER 149 2HB SER 149 1.158 4.381 18.679 1193 HG SER 149 HG SER 149 0.201 6.082 17.204 1194 H SER 150 H SER 150 1.292 2.142 19.681 1195 HA SER 150 HA SER 150 3.718 1.165 18.336 1196 HB2 SER 150 1HB SER 150 3.492 2.937 20.424 1197 HB3 SER 150 2HB SER 150 3.788 1.406 21.267 1198 HG SER 150 HG SER 150 5.564 2.927 20.069 1199 H GLY 151 H GLY 151 4.635 -0.836 18.948 1200 HA2 GLY 151 1HA GLY 151 4.370 -3.122 19.201 1201 HA3 GLY 151 2HA GLY 151 3.925 -2.637 20.831 Start of MODEL 13 1 H1 GLY 1 H GLY 1 16.592 -14.412 12.755 2 HA2 GLY 1 1HA GLY 1 14.740 -15.257 10.728 3 HA3 GLY 1 2HA GLY 1 14.333 -15.888 12.317 4 H SER 2 H SER 2 14.572 -13.039 10.327 5 HA SER 2 HA SER 2 13.763 -10.922 10.548 6 HB2 SER 2 1HB SER 2 11.777 -12.694 11.852 7 HB3 SER 2 2HB SER 2 11.644 -10.969 12.241 8 HG SER 2 HG SER 2 10.715 -12.118 10.120 9 H SER 3 H SER 3 13.179 -9.159 12.185 10 HA SER 3 HA SER 3 14.092 -9.469 14.874 11 HB2 SER 3 1HB SER 3 16.221 -9.361 13.389 12 HB3 SER 3 2HB SER 3 15.816 -7.643 13.216 13 HG SER 3 HG SER 3 16.688 -9.047 15.460 14 H GLY 4 H GLY 4 14.266 -7.244 15.962 15 HA2 GLY 4 1HA GLY 4 11.858 -5.817 15.376 16 HA3 GLY 4 2HA GLY 4 13.029 -5.415 16.625 17 H SER 5 H SER 5 14.601 -3.898 16.225 18 HA SER 5 HA SER 5 14.976 -2.827 13.568 19 HB2 SER 5 1HB SER 5 12.887 -1.710 14.556 20 HB3 SER 5 2HB SER 5 13.995 -0.921 15.691 21 HG SER 5 HG SER 5 13.440 -0.208 13.199 22 H SER 6 H SER 6 17.116 -3.525 13.989 23 HA SER 6 HA SER 6 18.872 -1.562 14.884 24 HB2 SER 6 1HB SER 6 17.915 -3.416 16.983 25 HB3 SER 6 2HB SER 6 19.674 -3.206 16.900 26 HG SER 6 HG SER 6 19.457 -1.063 17.294 27 H GLY 7 H GLY 7 21.160 -2.455 15.167 28 HA2 GLY 7 1HA GLY 7 22.755 -4.154 14.696 29 HA3 GLY 7 2HA GLY 7 21.527 -5.016 13.782 30 H SER 8 H SER 8 21.135 -4.467 11.638 31 HA SER 8 HA SER 8 22.454 -2.253 10.385 32 HB2 SER 8 1HB SER 8 24.011 -4.540 10.702 33 HB3 SER 8 2HB SER 8 23.408 -4.656 9.040 34 HG SER 8 HG SER 8 25.437 -3.373 9.537 35 H ASP 9 H ASP 9 20.973 -5.436 9.883 36 HA ASP 9 HA ASP 9 19.608 -6.210 8.200 37 HB2 ASP 9 1HB ASP 9 17.504 -4.948 8.047 38 HB3 ASP 9 2HB ASP 9 18.050 -5.097 9.723 39 H SER 10 H SER 10 21.114 -6.098 6.467 40 HA SER 10 HA SER 10 21.050 -3.727 4.773 41 HB2 SER 10 1HB SER 10 22.679 -6.277 4.700 42 HB3 SER 10 2HB SER 10 22.744 -5.057 3.417 43 HG SER 10 HG SER 10 24.340 -4.901 5.204 44 H LEU 11 H LEU 11 19.709 -3.530 3.115 45 HA LEU 11 HA LEU 11 18.739 -5.952 1.766 46 HB2 LEU 11 1HB LEU 11 16.980 -3.576 2.370 47 HB3 LEU 11 2HB LEU 11 16.503 -5.145 1.696 48 HG LEU 11 HG LEU 11 17.654 -4.984 4.455 49 HD11 LEU 11 1HD1 LEU 11 14.838 -4.339 3.623 50 HD12 LEU 11 2HD1 LEU 11 15.937 -3.368 4.603 51 HD13 LEU 11 3HD1 LEU 11 15.265 -4.864 5.252 52 HD21 LEU 11 3HD2 LEU 11 17.365 -7.183 4.157 53 HD22 LEU 11 1HD2 LEU 11 16.306 -6.951 2.765 54 HD23 LEU 11 2HD2 LEU 11 15.650 -6.843 4.399 55 H VAL 12 H VAL 12 17.122 -4.770 -0.114 56 HA VAL 12 HA VAL 12 19.103 -3.362 -1.748 57 HB VAL 12 HB VAL 12 16.483 -4.288 -2.844 58 HG11 VAL 12 1HG1 VAL 12 17.620 -4.407 -4.871 59 HG12 VAL 12 2HG1 VAL 12 18.341 -3.000 -4.088 60 HG13 VAL 12 3HG1 VAL 12 19.195 -4.543 -4.091 61 HG21 VAL 12 3HG2 VAL 12 18.827 -6.139 -2.445 62 HG22 VAL 12 1HG2 VAL 12 17.388 -6.137 -1.427 63 HG23 VAL 12 2HG2 VAL 12 17.255 -6.532 -3.141 64 H VAL 13 H VAL 13 18.155 -1.695 0.122 65 HA VAL 13 HA VAL 13 15.844 -0.306 -0.122 66 HB VAL 13 HB VAL 13 18.590 0.898 0.244 67 HG11 VAL 13 1HG1 VAL 13 17.319 2.759 -0.228 68 HG12 VAL 13 2HG1 VAL 13 15.846 2.055 0.444 69 HG13 VAL 13 3HG1 VAL 13 17.119 2.636 1.519 70 HG21 VAL 13 3HG2 VAL 13 18.547 0.125 2.332 71 HG22 VAL 13 1HG2 VAL 13 16.913 0.738 2.588 72 HG23 VAL 13 2HG2 VAL 13 17.155 -0.854 1.868 73 H CYS 14 H CYS 14 14.811 0.378 -1.875 74 HA CYS 14 HA CYS 14 16.367 1.422 -4.135 75 HB2 CYS 14 1HB CYS 14 13.474 0.551 -4.009 76 HB3 CYS 14 2HB CYS 14 14.335 1.063 -5.470 77 HG CYS 14 HG CYS 14 14.901 -1.349 -6.126 78 H GLU 15 H GLU 15 15.189 3.195 -5.395 79 HA GLU 15 HA GLU 15 14.540 5.310 -3.496 80 HB2 GLU 15 1HB GLU 15 15.673 5.161 -6.204 81 HB3 GLU 15 2HB GLU 15 14.519 6.484 -5.975 82 HG2 GLU 15 1HG GLU 15 16.389 6.298 -3.766 83 HG3 GLU 15 2HG GLU 15 17.207 6.498 -5.323 84 H VAL 16 H VAL 16 12.881 6.969 -4.417 85 HA VAL 16 HA VAL 16 10.448 5.448 -5.051 86 HB VAL 16 HB VAL 16 10.346 6.726 -2.973 87 HG11 VAL 16 1HG1 VAL 16 11.096 8.814 -2.733 88 HG12 VAL 16 2HG1 VAL 16 11.838 8.608 -4.322 89 HG13 VAL 16 3HG1 VAL 16 10.253 9.370 -4.179 90 HG21 VAL 16 3HG2 VAL 16 8.542 7.011 -5.192 91 HG22 VAL 16 1HG2 VAL 16 8.184 6.852 -3.473 92 HG23 VAL 16 2HG2 VAL 16 8.483 8.445 -4.168 93 H ASP 17 H ASP 17 10.390 5.364 -7.249 94 HA ASP 17 HA ASP 17 11.229 6.970 -9.195 95 HB2 ASP 17 1HB ASP 17 9.832 4.930 -9.521 96 HB3 ASP 17 2HB ASP 17 8.401 5.898 -9.141 97 HA PRO 18 HA PRO 18 9.578 11.014 -8.627 98 HB2 PRO 18 2HB PRO 18 11.282 11.732 -9.991 99 HB3 PRO 18 1HB PRO 18 9.983 11.983 -11.157 100 HG2 PRO 18 1HG PRO 18 10.362 9.955 -12.227 101 HG3 PRO 18 2HG PRO 18 12.040 10.418 -11.753 102 HD2 PRO 18 1HD PRO 18 10.942 8.023 -11.102 103 HD3 PRO 18 2HD PRO 18 12.093 8.865 -10.051 104 H GLU 19 H GLU 19 8.498 9.066 -11.375 105 HA GLU 19 HA GLU 19 6.217 10.645 -11.977 106 HB2 GLU 19 1HB GLU 19 5.748 9.109 -13.609 107 HB3 GLU 19 2HB GLU 19 7.468 8.773 -13.358 108 HG2 GLU 19 1HG GLU 19 6.873 6.645 -13.115 109 HG3 GLU 19 2HG GLU 19 6.267 7.128 -11.524 110 H LEU 20 H LEU 20 6.872 8.165 -9.653 111 HA LEU 20 HA LEU 20 4.061 7.688 -9.096 112 HB2 LEU 20 1HB LEU 20 6.095 6.014 -8.986 113 HB3 LEU 20 2HB LEU 20 6.260 6.684 -7.354 114 HG LEU 20 HG LEU 20 3.876 5.209 -8.467 115 HD11 LEU 20 1HD1 LEU 20 4.967 3.414 -7.753 116 HD12 LEU 20 2HD1 LEU 20 4.807 4.039 -6.113 117 HD13 LEU 20 3HD1 LEU 20 6.253 4.400 -7.057 118 HD21 LEU 20 3HD2 LEU 20 4.278 6.687 -5.882 119 HD22 LEU 20 1HD2 LEU 20 3.096 5.389 -6.052 120 HD23 LEU 20 2HD2 LEU 20 2.960 6.839 -7.045 121 H LYS 21 H LYS 21 6.842 9.278 -7.623 122 HA LYS 21 HA LYS 21 5.960 9.852 -5.108 123 HB2 LYS 21 1HB LYS 21 8.150 10.527 -6.202 124 HB3 LYS 21 2HB LYS 21 7.282 11.923 -6.858 125 HG2 LYS 21 1HG LYS 21 6.619 12.147 -4.251 126 HG3 LYS 21 2HG LYS 21 8.219 11.397 -4.120 127 HD2 LYS 21 1HD LYS 21 8.125 13.562 -6.086 128 HD3 LYS 21 2HD LYS 21 7.726 14.084 -4.440 129 HE2 LYS 21 1HE LYS 21 9.870 12.552 -3.898 130 HE3 LYS 21 2HE LYS 21 10.274 13.062 -5.543 131 HZ1 LYS 21 3HZ LYS 21 10.120 15.344 -4.897 132 HZ2 LYS 21 1HZ LYS 21 11.137 14.557 -3.797 133 HZ3 LYS 21 2HZ LYS 21 9.548 14.936 -3.359 134 H GLU 22 H GLU 22 5.213 11.715 -8.047 135 HA GLU 22 HA GLU 22 3.590 13.641 -6.803 136 HB2 GLU 22 1HB GLU 22 3.194 12.661 -9.628 137 HB3 GLU 22 2HB GLU 22 2.906 14.282 -8.976 138 HG2 GLU 22 1HG GLU 22 5.490 14.197 -8.483 139 HG3 GLU 22 2HG GLU 22 5.459 12.987 -9.774 140 H THR 23 H THR 23 2.770 10.572 -8.383 141 HA THR 23 HA THR 23 0.036 10.644 -8.327 142 HB THR 23 HB THR 23 1.942 8.358 -7.904 143 HG1 THR 23 1HG THR 23 0.868 7.806 -9.985 144 HG21 THR 23 3HG2 THR 23 0.169 7.467 -6.720 145 HG22 THR 23 1HG2 THR 23 -0.226 6.965 -8.364 146 HG23 THR 23 2HG2 THR 23 -1.037 8.358 -7.648 147 H LEU 24 H LEU 24 2.192 9.719 -5.661 148 HA LEU 24 HA LEU 24 0.164 9.063 -3.819 149 HB2 LEU 24 1HB LEU 24 2.872 10.180 -3.104 150 HB3 LEU 24 2HB LEU 24 1.853 9.081 -2.158 151 HG LEU 24 HG LEU 24 3.331 8.400 -4.700 152 HD11 LEU 24 1HD1 LEU 24 5.033 7.815 -3.409 153 HD12 LEU 24 2HD1 LEU 24 3.982 6.795 -2.428 154 HD13 LEU 24 3HD1 LEU 24 4.186 8.499 -2.020 155 HD21 LEU 24 3HD2 LEU 24 1.472 7.036 -4.814 156 HD22 LEU 24 1HD2 LEU 24 1.318 6.918 -3.061 157 HD23 LEU 24 2HD2 LEU 24 2.598 6.036 -3.893 158 H ARG 25 H ARG 25 2.078 12.047 -4.188 159 HA ARG 25 HA ARG 25 0.841 13.522 -2.170 160 HB2 ARG 25 1HB ARG 25 2.942 14.119 -3.433 161 HB3 ARG 25 2HB ARG 25 1.901 14.659 -4.758 162 HG2 ARG 25 1HG ARG 25 0.847 16.304 -3.265 163 HG3 ARG 25 2HG ARG 25 1.927 15.778 -1.962 164 HD2 ARG 25 1HD ARG 25 3.334 16.461 -4.443 165 HD3 ARG 25 2HD ARG 25 2.435 17.810 -3.732 166 HE ARG 25 HE ARG 25 4.767 16.499 -2.632 167 HH11 ARG 25 2HH1 ARG 25 2.047 18.589 -2.036 168 HH12 ARG 25 1HH1 ARG 25 2.755 19.329 -0.638 169 HH21 ARG 25 1HH2 ARG 25 4.839 18.691 0.066 170 HH22 ARG 25 2HH2 ARG 25 5.710 17.466 -0.794 171 H LYS 26 H LYS 26 -0.143 12.880 -5.467 172 HA LYS 26 HA LYS 26 -2.258 14.828 -5.467 173 HB2 LYS 26 1HB LYS 26 -2.019 12.481 -7.345 174 HB3 LYS 26 2HB LYS 26 -2.774 14.056 -7.642 175 HG2 LYS 26 1HG LYS 26 -0.039 14.497 -6.982 176 HG3 LYS 26 2HG LYS 26 -0.131 13.234 -8.222 177 HD2 LYS 26 1HD LYS 26 -1.925 14.981 -9.226 178 HD3 LYS 26 2HD LYS 26 -0.840 16.098 -8.378 179 HE2 LYS 26 1HE LYS 26 1.080 15.227 -9.590 180 HE3 LYS 26 2HE LYS 26 0.051 14.019 -10.374 181 HZ1 LYS 26 3HZ LYS 26 -0.828 16.756 -10.701 182 HZ2 LYS 26 1HZ LYS 26 -0.730 15.505 -11.837 183 HZ3 LYS 26 2HZ LYS 26 0.652 16.396 -11.438 184 H PHE 27 H PHE 27 -2.000 11.333 -5.017 185 HA PHE 27 HA PHE 27 -4.710 10.694 -4.968 186 HB2 PHE 27 1HB PHE 27 -2.668 9.135 -4.922 187 HB3 PHE 27 2HB PHE 27 -2.674 9.381 -3.175 188 HD1 PHE 27 1HD PHE 27 -5.494 8.926 -5.563 189 HD2 PHE 27 2HD PHE 27 -3.372 7.416 -2.196 190 HE1 PHE 27 1HE PHE 27 -7.182 7.155 -5.297 191 HE2 PHE 27 2HE PHE 27 -5.056 5.642 -1.926 192 HZ PHE 27 HZ PHE 27 -6.964 5.509 -3.478 193 H ARG 28 H ARG 28 -2.613 11.935 -2.420 194 HA ARG 28 HA ARG 28 -4.536 11.681 -0.333 195 HB2 ARG 28 1HB ARG 28 -2.440 13.769 -0.116 196 HB3 ARG 28 2HB ARG 28 -2.922 12.517 1.040 197 HG2 ARG 28 1HG ARG 28 -1.814 11.022 -0.964 198 HG3 ARG 28 2HG ARG 28 -0.819 12.489 -0.987 199 HD2 ARG 28 1HD ARG 28 -1.395 10.782 1.447 200 HD3 ARG 28 2HD ARG 28 0.108 10.791 0.514 201 HE ARG 28 HE ARG 28 -0.721 12.722 2.469 202 HH11 ARG 28 2HH1 ARG 28 1.252 12.179 -0.347 203 HH12 ARG 28 1HH1 ARG 28 2.360 13.459 0.021 204 HH21 ARG 28 1HH2 ARG 28 2.063 14.727 1.907 205 HH22 ARG 28 2HH2 ARG 28 0.730 14.410 2.965 206 H PHE 29 H PHE 29 -3.732 14.174 -2.656 207 HA PHE 29 HA PHE 29 -5.921 15.821 -1.569 208 HB2 PHE 29 1HB PHE 29 -3.845 17.088 -3.286 209 HB3 PHE 29 2HB PHE 29 -4.734 17.751 -1.914 210 HD1 PHE 29 1HD PHE 29 -4.191 15.999 0.278 211 HD2 PHE 29 2HD PHE 29 -1.587 17.262 -2.842 212 HE1 PHE 29 1HE PHE 29 -2.254 15.624 1.748 213 HE2 PHE 29 2HE PHE 29 0.355 16.888 -1.378 214 HZ PHE 29 HZ PHE 29 0.022 16.067 0.920 215 H ARG 30 H ARG 30 -6.361 13.733 -3.394 216 HA ARG 30 HA ARG 30 -6.489 14.759 -6.067 217 HB2 ARG 30 1HB ARG 30 -7.765 12.706 -6.561 218 HB3 ARG 30 2HB ARG 30 -6.255 12.371 -5.699 219 HG2 ARG 30 1HG ARG 30 -7.792 12.467 -3.573 220 HG3 ARG 30 2HG ARG 30 -9.066 12.122 -4.755 221 HD2 ARG 30 1HD ARG 30 -6.687 10.443 -5.087 222 HD3 ARG 30 2HD ARG 30 -7.482 10.252 -3.517 223 HE ARG 30 HE ARG 30 -8.532 9.496 -6.104 224 HH11 ARG 30 2HH1 ARG 30 -9.223 10.135 -2.752 225 HH12 ARG 30 1HH1 ARG 30 -10.692 9.217 -2.745 226 HH21 ARG 30 1HH2 ARG 30 -11.396 8.163 -4.652 227 HH22 ARG 30 2HH2 ARG 30 -10.465 8.283 -6.106 228 H LYS 31 H LYS 31 -8.445 15.118 -7.276 229 HA LYS 31 HA LYS 31 -10.409 16.578 -5.725 230 HB2 LYS 31 1HB LYS 31 -10.169 16.165 -8.716 231 HB3 LYS 31 2HB LYS 31 -11.284 17.284 -7.914 232 HG2 LYS 31 1HG LYS 31 -9.581 18.694 -8.554 233 HG3 LYS 31 2HG LYS 31 -9.129 18.297 -6.886 234 HD2 LYS 31 1HD LYS 31 -7.200 17.404 -7.551 235 HD3 LYS 31 2HD LYS 31 -8.046 16.335 -8.684 236 HE2 LYS 31 1HE LYS 31 -6.856 17.507 -10.222 237 HE3 LYS 31 2HE LYS 31 -8.216 18.627 -10.057 238 HZ1 LYS 31 3HZ LYS 31 -6.981 20.107 -8.860 239 HZ2 LYS 31 1HZ LYS 31 -5.767 19.461 -9.846 240 HZ3 LYS 31 2HZ LYS 31 -5.929 18.933 -8.248 241 H GLU 32 H GLU 32 -10.317 13.670 -5.478 242 HA GLU 32 HA GLU 32 -12.923 12.946 -6.639 243 HB2 GLU 32 1HB GLU 32 -10.652 11.217 -5.638 244 HB3 GLU 32 2HB GLU 32 -12.230 10.588 -6.136 245 HG2 GLU 32 1HG GLU 32 -11.895 11.141 -8.378 246 HG3 GLU 32 2HG GLU 32 -10.578 12.258 -7.991 247 H THR 33 H THR 33 -14.111 11.272 -5.209 248 HA THR 33 HA THR 33 -13.823 11.808 -2.358 249 HB THR 33 HB THR 33 -16.240 12.326 -2.111 250 HG1 THR 33 1HG THR 33 -16.115 12.067 -4.902 251 HG21 THR 33 3HG2 THR 33 -14.354 14.067 -2.392 252 HG22 THR 33 1HG2 THR 33 -16.025 14.610 -2.552 253 HG23 THR 33 2HG2 THR 33 -15.043 14.336 -3.992 254 H ASN 34 H ASN 34 -13.414 9.471 -4.000 255 HA ASN 34 HA ASN 34 -15.355 7.691 -2.705 256 HB2 ASN 34 1HB ASN 34 -16.186 6.965 -4.643 257 HB3 ASN 34 2HB ASN 34 -15.194 8.156 -5.495 258 HD21 ASN 34 2HD2 ASN 34 -12.935 5.868 -6.779 259 HD22 ASN 34 1HD2 ASN 34 -13.419 7.516 -6.602 260 H ASN 35 H ASN 35 -14.540 5.322 -2.942 261 HA ASN 35 HA ASN 35 -11.934 5.236 -1.757 262 HB2 ASN 35 1HB ASN 35 -13.850 3.037 -2.576 263 HB3 ASN 35 2HB ASN 35 -12.340 2.765 -1.697 264 HD21 ASN 35 2HD2 ASN 35 -15.053 2.891 0.774 265 HD22 ASN 35 1HD2 ASN 35 -14.632 1.910 -0.585 266 H ALA 36 H ALA 36 -10.056 4.340 -2.565 267 HA ALA 36 HA ALA 36 -9.982 3.214 -5.226 268 HB1 ALA 36 3HB ALA 36 -8.037 5.349 -5.154 269 HB2 ALA 36 1HB ALA 36 -9.246 4.966 -6.380 270 HB3 ALA 36 2HB ALA 36 -9.681 5.967 -4.993 271 H ALA 37 H ALA 37 -7.801 2.464 -5.813 272 HA ALA 37 HA ALA 37 -5.992 2.166 -3.519 273 HB1 ALA 37 3HB ALA 37 -7.595 0.089 -4.671 274 HB2 ALA 37 1HB ALA 37 -5.885 -0.266 -4.918 275 HB3 ALA 37 2HB ALA 37 -6.500 0.019 -3.290 276 H ILE 38 H ILE 38 -3.807 1.765 -4.056 277 HA ILE 38 HA ILE 38 -3.105 2.034 -6.894 278 HB ILE 38 HB ILE 38 -1.663 3.582 -4.751 279 HG12 ILE 38 1HG1 ILE 38 -3.895 4.470 -6.591 280 HG13 ILE 38 2HG1 ILE 38 -3.915 4.458 -4.820 281 HG21 ILE 38 1HG2 ILE 38 -1.022 2.945 -7.387 282 HG22 ILE 38 2HG2 ILE 38 -1.554 4.624 -7.434 283 HG23 ILE 38 3HG2 ILE 38 -0.239 4.146 -6.361 284 HD11 ILE 38 3HD1 ILE 38 -2.991 6.466 -4.702 285 HD12 ILE 38 1HD1 ILE 38 -1.711 6.024 -5.831 286 HD13 ILE 38 2HD1 ILE 38 -3.264 6.599 -6.439 287 H ILE 39 H ILE 39 -2.063 0.199 -7.325 288 HA ILE 39 HA ILE 39 -0.366 -1.037 -5.303 289 HB ILE 39 HB ILE 39 -0.930 -2.077 -8.075 290 HG12 ILE 39 1HG1 ILE 39 -2.388 -3.256 -5.799 291 HG13 ILE 39 2HG1 ILE 39 -2.880 -1.606 -6.219 292 HG21 ILE 39 1HG2 ILE 39 0.273 -3.857 -7.492 293 HG22 ILE 39 2HG2 ILE 39 0.823 -2.921 -6.103 294 HG23 ILE 39 3HG2 ILE 39 -0.561 -4.003 -5.946 295 HD11 ILE 39 3HD1 ILE 39 -3.233 -2.341 -8.552 296 HD12 ILE 39 1HD1 ILE 39 -2.879 -3.993 -8.047 297 HD13 ILE 39 2HD1 ILE 39 -4.282 -3.150 -7.390 298 H MET 40 H MET 40 1.703 -0.500 -5.188 299 HA MET 40 HA MET 40 3.089 0.306 -7.659 300 HB2 MET 40 1HB MET 40 4.005 0.981 -4.867 301 HB3 MET 40 2HB MET 40 4.477 1.740 -6.394 302 HG2 MET 40 1HG MET 40 2.630 3.062 -6.492 303 HG3 MET 40 2HG MET 40 1.617 1.879 -5.660 304 HE1 MET 40 3HE MET 40 1.297 1.559 -3.383 305 HE2 MET 40 1HE MET 40 1.625 2.730 -2.106 306 HE3 MET 40 2HE MET 40 0.510 3.137 -3.411 307 H LYS 41 H LYS 41 5.124 -0.530 -8.104 308 HA LYS 41 HA LYS 41 6.022 -2.739 -6.377 309 HB2 LYS 41 1HB LYS 41 6.454 -4.137 -8.227 310 HB3 LYS 41 2HB LYS 41 4.842 -3.462 -8.515 311 HG2 LYS 41 1HG LYS 41 5.638 -1.970 -10.165 312 HG3 LYS 41 2HG LYS 41 7.325 -2.274 -9.716 313 HD2 LYS 41 1HD LYS 41 7.463 -4.111 -10.998 314 HD3 LYS 41 2HD LYS 41 5.882 -4.701 -10.454 315 HE2 LYS 41 1HE LYS 41 4.791 -3.067 -11.988 316 HE3 LYS 41 2HE LYS 41 6.398 -2.635 -12.589 317 HZ1 LYS 41 3HZ LYS 41 6.473 -4.440 -13.866 318 HZ2 LYS 41 1HZ LYS 41 4.813 -4.606 -13.579 319 HZ3 LYS 41 2HZ LYS 41 5.926 -5.462 -12.634 320 H VAL 42 H VAL 42 8.336 -3.450 -7.226 321 HA VAL 42 HA VAL 42 9.921 -0.994 -7.611 322 HB VAL 42 HB VAL 42 10.490 -1.490 -5.441 323 HG11 VAL 42 1HG1 VAL 42 9.183 -3.387 -4.997 324 HG12 VAL 42 2HG1 VAL 42 10.055 -4.371 -6.174 325 HG13 VAL 42 3HG1 VAL 42 10.838 -3.895 -4.668 326 HG21 VAL 42 3HG2 VAL 42 12.501 -1.541 -6.887 327 HG22 VAL 42 1HG2 VAL 42 12.684 -2.491 -5.413 328 HG23 VAL 42 2HG2 VAL 42 12.375 -3.299 -6.950 329 H ASP 43 H ASP 43 10.961 -1.013 -9.480 330 HA ASP 43 HA ASP 43 11.335 -3.443 -10.974 331 HB2 ASP 43 1HB ASP 43 11.845 -0.529 -11.458 332 HB3 ASP 43 2HB ASP 43 12.638 -1.725 -12.492 333 H LYS 44 H LYS 44 12.990 -4.776 -10.744 334 HA LYS 44 HA LYS 44 15.248 -4.171 -9.135 335 HB2 LYS 44 1HB LYS 44 14.305 -6.449 -9.410 336 HB3 LYS 44 2HB LYS 44 14.879 -6.452 -11.086 337 HG2 LYS 44 1HG LYS 44 17.204 -5.954 -9.997 338 HG3 LYS 44 2HG LYS 44 16.437 -6.641 -8.554 339 HD2 LYS 44 1HD LYS 44 15.759 -8.607 -10.051 340 HD3 LYS 44 2HD LYS 44 16.929 -7.955 -11.212 341 HE2 LYS 44 1HE LYS 44 18.551 -7.960 -9.147 342 HE3 LYS 44 2HE LYS 44 17.400 -9.147 -8.514 343 HZ1 LYS 44 3HZ LYS 44 19.014 -10.390 -9.627 344 HZ2 LYS 44 1HZ LYS 44 19.062 -9.340 -10.952 345 HZ3 LYS 44 2HZ LYS 44 17.718 -10.338 -10.713 346 H ASP 45 H ASP 45 14.561 -3.827 -12.502 347 HA ASP 45 HA ASP 45 17.253 -3.764 -13.432 348 HB2 ASP 45 1HB ASP 45 14.626 -3.560 -14.561 349 HB3 ASP 45 2HB ASP 45 15.604 -2.204 -15.139 350 H ARG 46 H ARG 46 15.001 -1.355 -12.223 351 HA ARG 46 HA ARG 46 17.113 0.683 -12.485 352 HB2 ARG 46 1HB ARG 46 14.118 1.086 -12.272 353 HB3 ARG 46 2HB ARG 46 15.329 2.364 -12.448 354 HG2 ARG 46 1HG ARG 46 15.865 1.707 -14.659 355 HG3 ARG 46 2HG ARG 46 14.965 0.191 -14.489 356 HD2 ARG 46 1HD ARG 46 13.241 1.250 -15.445 357 HD3 ARG 46 2HD ARG 46 13.074 2.113 -13.910 358 HE ARG 46 HE ARG 46 14.924 3.571 -15.258 359 HH11 ARG 46 2HH1 ARG 46 11.721 2.433 -16.010 360 HH12 ARG 46 1HH1 ARG 46 11.348 3.769 -17.048 361 HH21 ARG 46 1HH2 ARG 46 12.900 5.419 -17.396 362 HH22 ARG 46 2HH2 ARG 46 14.446 5.335 -16.623 363 H GLN 47 H GLN 47 16.081 -1.381 -10.307 364 HA GLN 47 HA GLN 47 15.663 -1.381 -8.034 365 HB2 GLN 47 1HB GLN 47 17.996 0.537 -8.060 366 HB3 GLN 47 2HB GLN 47 17.581 -0.655 -6.817 367 HG2 GLN 47 1HG GLN 47 17.929 -1.977 -9.341 368 HG3 GLN 47 2HG GLN 47 19.334 -0.962 -8.983 369 HE21 GLN 47 2HE2 GLN 47 18.633 -4.357 -6.907 370 HE22 GLN 47 1HE2 GLN 47 17.535 -3.760 -8.100 371 H MET 48 H MET 48 13.763 0.203 -8.916 372 HA MET 48 HA MET 48 13.616 2.273 -6.878 373 HB2 MET 48 1HB MET 48 13.435 4.086 -8.227 374 HB3 MET 48 2HB MET 48 14.425 3.090 -9.305 375 HG2 MET 48 1HG MET 48 12.024 2.242 -10.097 376 HG3 MET 48 2HG MET 48 11.574 3.847 -9.515 377 HE1 MET 48 3HE MET 48 12.853 6.353 -11.508 378 HE2 MET 48 1HE MET 48 13.049 5.769 -9.855 379 HE3 MET 48 2HE MET 48 14.435 5.811 -10.945 380 H VAL 49 H VAL 49 11.475 2.920 -6.378 381 HA VAL 49 HA VAL 49 9.519 0.856 -6.896 382 HB VAL 49 HB VAL 49 9.223 3.392 -5.281 383 HG11 VAL 49 1HG1 VAL 49 7.066 2.585 -5.815 384 HG12 VAL 49 2HG1 VAL 49 7.541 0.910 -5.528 385 HG13 VAL 49 3HG1 VAL 49 7.399 2.033 -4.175 386 HG21 VAL 49 3HG2 VAL 49 9.649 1.990 -3.327 387 HG22 VAL 49 1HG2 VAL 49 9.931 0.603 -4.379 388 HG23 VAL 49 2HG2 VAL 49 11.029 1.982 -4.425 389 H VAL 50 H VAL 50 8.409 0.908 -8.738 390 HA VAL 50 HA VAL 50 7.430 3.514 -9.707 391 HB VAL 50 HB VAL 50 7.435 2.632 -11.964 392 HG11 VAL 50 1HG1 VAL 50 9.978 2.440 -10.397 393 HG12 VAL 50 2HG1 VAL 50 9.965 2.120 -12.132 394 HG13 VAL 50 3HG1 VAL 50 9.453 3.693 -11.520 395 HG21 VAL 50 3HG2 VAL 50 7.278 0.442 -12.308 396 HG22 VAL 50 1HG2 VAL 50 8.946 0.270 -11.763 397 HG23 VAL 50 2HG2 VAL 50 7.621 0.113 -10.610 398 H LEU 51 H LEU 51 5.298 3.711 -10.267 399 HA LEU 51 HA LEU 51 3.376 2.222 -8.980 400 HB2 LEU 51 1HB LEU 51 3.218 4.493 -10.201 401 HB3 LEU 51 2HB LEU 51 2.815 3.516 -11.624 402 HG LEU 51 HG LEU 51 1.225 3.056 -9.159 403 HD11 LEU 51 1HD1 LEU 51 0.123 5.015 -9.128 404 HD12 LEU 51 2HD1 LEU 51 0.243 5.234 -10.872 405 HD13 LEU 51 3HD1 LEU 51 1.611 5.640 -9.837 406 HD21 LEU 51 3HD2 LEU 51 -0.323 3.382 -11.492 407 HD22 LEU 51 1HD2 LEU 51 0.058 1.887 -10.638 408 HD23 LEU 51 2HD2 LEU 51 1.100 2.444 -11.946 409 H GLU 52 H GLU 52 2.253 0.395 -9.372 410 HA GLU 52 HA GLU 52 3.027 -1.156 -11.741 411 HB2 GLU 52 1HB GLU 52 3.461 -2.230 -9.594 412 HB3 GLU 52 2HB GLU 52 1.758 -2.044 -9.144 413 HG2 GLU 52 1HG GLU 52 1.188 -3.921 -10.174 414 HG3 GLU 52 2HG GLU 52 1.995 -3.412 -11.663 415 H ASP 53 H ASP 53 0.225 -0.017 -9.928 416 HA ASP 53 HA ASP 53 -1.397 0.108 -12.254 417 HB2 ASP 53 1HB ASP 53 -1.725 -2.235 -10.401 418 HB3 ASP 53 2HB ASP 53 -3.135 -1.555 -11.224 419 H GLU 54 H GLU 54 -3.603 0.859 -11.767 420 HA GLU 54 HA GLU 54 -4.032 1.843 -9.058 421 HB2 GLU 54 1HB GLU 54 -3.296 3.523 -11.367 422 HB3 GLU 54 2HB GLU 54 -4.706 4.083 -10.456 423 HG2 GLU 54 1HG GLU 54 -3.253 3.827 -8.369 424 HG3 GLU 54 2HG GLU 54 -1.892 3.713 -9.495 425 H LEU 55 H LEU 55 -6.023 1.232 -8.562 426 HA LEU 55 HA LEU 55 -8.091 1.333 -10.660 427 HB2 LEU 55 1HB LEU 55 -8.159 -0.478 -8.253 428 HB3 LEU 55 2HB LEU 55 -9.150 -0.556 -9.720 429 HG LEU 55 HG LEU 55 -6.230 -0.909 -10.071 430 HD11 LEU 55 1HD1 LEU 55 -6.610 -3.389 -9.530 431 HD12 LEU 55 2HD1 LEU 55 -7.979 -2.827 -8.572 432 HD13 LEU 55 3HD1 LEU 55 -6.349 -2.274 -8.188 433 HD21 LEU 55 3HD2 LEU 55 -8.709 -2.205 -11.197 434 HD22 LEU 55 1HD2 LEU 55 -7.061 -2.642 -11.648 435 HD23 LEU 55 2HD2 LEU 55 -7.667 -1.022 -11.990 436 H GLN 56 H GLN 56 -10.073 2.207 -10.156 437 HA GLN 56 HA GLN 56 -10.269 3.512 -7.522 438 HB2 GLN 56 1HB GLN 56 -11.268 4.482 -10.210 439 HB3 GLN 56 2HB GLN 56 -11.612 5.271 -8.663 440 HG2 GLN 56 1HG GLN 56 -9.856 6.522 -9.500 441 HG3 GLN 56 2HG GLN 56 -9.061 5.395 -8.391 442 HE21 GLN 56 2HE2 GLN 56 -6.903 4.259 -10.814 443 HE22 GLN 56 1HE2 GLN 56 -7.249 4.611 -9.158 444 H ASN 57 H ASN 57 -12.595 4.077 -6.953 445 HA ASN 57 HA ASN 57 -14.571 3.191 -6.217 446 HB2 ASN 57 1HB ASN 57 -14.825 2.616 -9.183 447 HB3 ASN 57 2HB ASN 57 -16.164 2.682 -8.030 448 HD21 ASN 57 2HD2 ASN 57 -14.423 6.109 -9.380 449 HD22 ASN 57 1HD2 ASN 57 -13.652 4.576 -9.581 450 H ILE 58 H ILE 58 -12.727 1.418 -5.561 451 HA ILE 58 HA ILE 58 -13.958 -1.168 -6.239 452 HB ILE 58 HB ILE 58 -12.036 -1.769 -7.203 453 HG12 ILE 58 1HG1 ILE 58 -11.907 -2.758 -4.852 454 HG13 ILE 58 2HG1 ILE 58 -10.401 -2.714 -5.783 455 HG21 ILE 58 1HG2 ILE 58 -11.000 0.753 -5.994 456 HG22 ILE 58 2HG2 ILE 58 -9.868 -0.403 -6.693 457 HG23 ILE 58 3HG2 ILE 58 -11.143 0.294 -7.691 458 HD11 ILE 58 3HD1 ILE 58 -10.538 -0.295 -4.348 459 HD12 ILE 58 1HD1 ILE 58 -10.944 -1.595 -3.227 460 HD13 ILE 58 2HD1 ILE 58 -9.423 -1.642 -4.121 461 H SER 59 H SER 59 -14.285 -2.570 -4.570 462 HA SER 59 HA SER 59 -14.114 -1.468 -1.907 463 HB2 SER 59 1HB SER 59 -15.625 -3.558 -3.250 464 HB3 SER 59 2HB SER 59 -14.977 -4.121 -1.700 465 HG SER 59 HG SER 59 -16.857 -2.137 -2.223 466 HA PRO 60 HA PRO 60 -10.595 -3.571 -0.343 467 HB2 PRO 60 2HB PRO 60 -11.203 -2.914 1.772 468 HB3 PRO 60 1HB PRO 60 -11.440 -4.642 2.031 469 HG2 PRO 60 1HG PRO 60 -13.729 -4.526 1.647 470 HG3 PRO 60 2HG PRO 60 -13.430 -2.935 2.442 471 HD2 PRO 60 1HD PRO 60 -14.672 -3.163 0.038 472 HD3 PRO 60 2HD PRO 60 -13.626 -1.793 0.449 473 H GLU 61 H GLU 61 -13.131 -5.289 -1.544 474 HA GLU 61 HA GLU 61 -11.999 -7.909 -0.866 475 HB2 GLU 61 1HB GLU 61 -14.682 -6.920 -1.567 476 HB3 GLU 61 2HB GLU 61 -14.233 -8.445 -2.348 477 HG2 GLU 61 1HG GLU 61 -14.119 -9.605 -0.371 478 HG3 GLU 61 2HG GLU 61 -13.801 -8.148 0.581 479 H GLU 62 H GLU 62 -12.464 -5.672 -3.478 480 HA GLU 62 HA GLU 62 -11.812 -7.585 -5.541 481 HB2 GLU 62 1HB GLU 62 -12.565 -4.718 -5.417 482 HB3 GLU 62 2HB GLU 62 -11.569 -5.215 -6.793 483 HG2 GLU 62 1HG GLU 62 -13.697 -7.102 -6.422 484 HG3 GLU 62 2HG GLU 62 -14.347 -5.458 -6.499 485 H LEU 63 H LEU 63 -10.201 -4.906 -3.884 486 HA LEU 63 HA LEU 63 -7.863 -4.756 -5.347 487 HB2 LEU 63 1HB LEU 63 -8.828 -3.631 -3.029 488 HB3 LEU 63 2HB LEU 63 -7.435 -4.570 -2.465 489 HG LEU 63 HG LEU 63 -7.514 -2.176 -4.242 490 HD11 LEU 63 1HD1 LEU 63 -5.501 -1.642 -2.831 491 HD12 LEU 63 2HD1 LEU 63 -5.880 -3.079 -1.883 492 HD13 LEU 63 3HD1 LEU 63 -7.033 -1.746 -1.963 493 HD21 LEU 63 3HD2 LEU 63 -6.154 -3.184 -5.711 494 HD22 LEU 63 1HD2 LEU 63 -5.805 -4.524 -4.618 495 HD23 LEU 63 2HD2 LEU 63 -4.926 -3.003 -4.457 496 H LYS 64 H LYS 64 -8.512 -6.803 -2.508 497 HA LYS 64 HA LYS 64 -6.052 -8.080 -2.357 498 HB2 LYS 64 1HB LYS 64 -7.170 -8.797 -0.555 499 HB3 LYS 64 2HB LYS 64 -8.739 -8.524 -1.331 500 HG2 LYS 64 1HG LYS 64 -8.858 -10.667 -2.185 501 HG3 LYS 64 2HG LYS 64 -7.103 -10.900 -2.099 502 HD2 LYS 64 1HD LYS 64 -7.319 -11.893 -0.120 503 HD3 LYS 64 2HD LYS 64 -8.033 -10.410 0.537 504 HE2 LYS 64 1HE LYS 64 -9.868 -11.663 0.876 505 HE3 LYS 64 2HE LYS 64 -10.129 -11.456 -0.862 506 HZ1 LYS 64 3HZ LYS 64 -9.933 -13.632 -1.109 507 HZ2 LYS 64 1HZ LYS 64 -9.648 -13.828 0.548 508 HZ3 LYS 64 2HZ LYS 64 -8.351 -13.582 -0.511 509 H LEU 65 H LEU 65 -8.699 -8.578 -4.560 510 HA LEU 65 HA LEU 65 -7.730 -11.109 -5.534 511 HB2 LEU 65 1HB LEU 65 -9.935 -9.230 -6.307 512 HB3 LEU 65 2HB LEU 65 -9.453 -10.543 -7.395 513 HG LEU 65 HG LEU 65 -10.184 -12.202 -5.907 514 HD11 LEU 65 1HD1 LEU 65 -9.387 -11.731 -3.816 515 HD12 LEU 65 2HD1 LEU 65 -11.096 -11.359 -3.592 516 HD13 LEU 65 3HD1 LEU 65 -9.939 -10.056 -3.859 517 HD21 LEU 65 3HD2 LEU 65 -12.510 -11.391 -5.231 518 HD22 LEU 65 1HD2 LEU 65 -12.086 -11.309 -6.941 519 HD23 LEU 65 2HD2 LEU 65 -12.048 -9.849 -5.953 520 H GLU 66 H GLU 66 -7.437 -7.737 -6.407 521 HA GLU 66 HA GLU 66 -6.360 -8.178 -9.010 522 HB2 GLU 66 1HB GLU 66 -6.193 -5.774 -7.177 523 HB3 GLU 66 2HB GLU 66 -5.691 -5.790 -8.875 524 HG2 GLU 66 1HG GLU 66 -8.472 -6.099 -7.764 525 HG3 GLU 66 2HG GLU 66 -7.840 -4.810 -8.799 526 H LEU 67 H LEU 67 -5.078 -8.343 -5.839 527 HA LEU 67 HA LEU 67 -2.328 -7.938 -6.663 528 HB2 LEU 67 1HB LEU 67 -3.524 -8.796 -4.023 529 HB3 LEU 67 2HB LEU 67 -1.805 -8.473 -4.307 530 HG LEU 67 HG LEU 67 -3.822 -6.330 -4.835 531 HD11 LEU 67 1HD1 LEU 67 -2.581 -6.800 -2.137 532 HD12 LEU 67 2HD1 LEU 67 -4.217 -7.310 -2.549 533 HD13 LEU 67 3HD1 LEU 67 -3.792 -5.599 -2.585 534 HD21 LEU 67 3HD2 LEU 67 -1.066 -6.529 -5.066 535 HD22 LEU 67 1HD2 LEU 67 -1.315 -5.627 -3.571 536 HD23 LEU 67 2HD2 LEU 67 -2.021 -5.046 -5.079 537 HA PRO 68 HA PRO 68 -1.316 -12.121 -7.532 538 HB2 PRO 68 2HB PRO 68 0.763 -11.363 -8.150 539 HB3 PRO 68 1HB PRO 68 1.291 -12.216 -6.701 540 HG2 PRO 68 1HG PRO 68 1.291 -10.292 -5.398 541 HG3 PRO 68 2HG PRO 68 1.798 -9.629 -6.997 542 HD2 PRO 68 1HD PRO 68 -0.304 -8.632 -5.598 543 HD3 PRO 68 2HD PRO 68 -0.269 -8.679 -7.369 544 H GLU 69 H GLU 69 0.391 -13.822 -6.235 545 HA GLU 69 HA GLU 69 -0.680 -14.050 -3.506 546 HB2 GLU 69 1HB GLU 69 -0.754 -16.570 -3.937 547 HB3 GLU 69 2HB GLU 69 -2.027 -15.584 -4.673 548 HG2 GLU 69 1HG GLU 69 -0.139 -15.596 -6.643 549 HG3 GLU 69 2HG GLU 69 0.059 -17.202 -5.928 550 H ARG 70 H ARG 70 1.881 -14.660 -5.785 551 HA ARG 70 HA ARG 70 3.662 -15.315 -3.534 552 HB2 ARG 70 1HB ARG 70 4.970 -16.565 -5.475 553 HB3 ARG 70 2HB ARG 70 3.685 -17.363 -4.555 554 HG2 ARG 70 1HG ARG 70 3.205 -17.910 -6.764 555 HG3 ARG 70 2HG ARG 70 2.112 -16.563 -6.408 556 HD2 ARG 70 1HD ARG 70 3.142 -15.154 -7.851 557 HD3 ARG 70 2HD ARG 70 4.746 -15.797 -7.473 558 HE ARG 70 HE ARG 70 3.197 -16.474 -9.700 559 HH11 ARG 70 2HH1 ARG 70 5.101 -18.017 -7.227 560 HH12 ARG 70 1HH1 ARG 70 5.533 -19.369 -8.221 561 HH21 ARG 70 1HH2 ARG 70 4.770 -19.499 -10.378 562 HH22 ARG 70 2HH2 ARG 70 3.760 -18.249 -11.018 563 H GLN 71 H GLN 71 3.192 -12.724 -4.516 564 HA GLN 71 HA GLN 71 5.889 -12.025 -5.335 565 HB2 GLN 71 1HB GLN 71 3.438 -11.266 -6.936 566 HB3 GLN 71 2HB GLN 71 5.020 -10.493 -7.123 567 HG2 GLN 71 1HG GLN 71 6.015 -12.453 -7.964 568 HG3 GLN 71 2HG GLN 71 4.651 -13.451 -7.442 569 HE21 GLN 71 2HE2 GLN 71 4.117 -11.038 -10.713 570 HE22 GLN 71 1HE2 GLN 71 5.098 -10.514 -9.392 571 HA PRO 72 HA PRO 72 4.858 -9.000 -2.230 572 HB2 PRO 72 2HB PRO 72 6.970 -9.360 -1.399 573 HB3 PRO 72 1HB PRO 72 7.326 -7.814 -2.169 574 HG2 PRO 72 1HG PRO 72 8.216 -8.808 -4.072 575 HG3 PRO 72 2HG PRO 72 8.720 -9.982 -2.798 576 HD2 PRO 72 1HD PRO 72 7.345 -10.729 -5.017 577 HD3 PRO 72 2HD PRO 72 7.128 -11.518 -3.446 578 H ARG 73 H ARG 73 3.919 -7.067 -2.454 579 HA ARG 73 HA ARG 73 4.958 -5.083 -4.277 580 HB2 ARG 73 1HB ARG 73 3.013 -4.844 -5.644 581 HB3 ARG 73 2HB ARG 73 3.499 -6.545 -5.698 582 HG2 ARG 73 1HG ARG 73 1.396 -5.585 -3.778 583 HG3 ARG 73 2HG ARG 73 1.011 -6.014 -5.454 584 HD2 ARG 73 1HD ARG 73 1.736 -8.261 -5.155 585 HD3 ARG 73 2HD ARG 73 2.481 -7.870 -3.599 586 HE ARG 73 HE ARG 73 -0.284 -7.312 -3.503 587 HH11 ARG 73 2HH1 ARG 73 1.957 -9.975 -3.566 588 HH12 ARG 73 1HH1 ARG 73 0.905 -11.051 -2.708 589 HH21 ARG 73 1HH2 ARG 73 -1.163 -10.336 -2.031 590 HH22 ARG 73 2HH2 ARG 73 -1.679 -8.720 -2.372 591 H PHE 74 H PHE 74 3.801 -3.014 -4.089 592 HA PHE 74 HA PHE 74 2.765 -2.685 -1.368 593 HB2 PHE 74 1HB PHE 74 3.760 -0.594 -3.322 594 HB3 PHE 74 2HB PHE 74 3.306 -0.308 -1.641 595 HD1 PHE 74 2HD PHE 74 4.538 -2.385 -0.128 596 HD2 PHE 74 1HD PHE 74 6.040 -0.320 -3.534 597 HE1 PHE 74 2HE PHE 74 6.838 -2.862 0.602 598 HE2 PHE 74 1HE PHE 74 8.343 -0.795 -2.810 599 HZ PHE 74 HZ PHE 74 8.745 -2.066 -0.739 600 H VAL 75 H VAL 75 0.932 -1.337 -0.969 601 HA VAL 75 HA VAL 75 -0.758 -0.588 -3.201 602 HB VAL 75 HB VAL 75 -1.624 -2.703 -1.228 603 HG11 VAL 75 1HG1 VAL 75 -3.683 -2.431 -2.994 604 HG12 VAL 75 2HG1 VAL 75 -3.636 -1.723 -1.378 605 HG13 VAL 75 3HG1 VAL 75 -3.168 -0.758 -2.779 606 HG21 VAL 75 3HG2 VAL 75 -2.212 -3.792 -3.538 607 HG22 VAL 75 1HG2 VAL 75 -0.988 -2.675 -4.142 608 HG23 VAL 75 2HG2 VAL 75 -0.566 -3.865 -2.910 609 H VAL 76 H VAL 76 -1.950 1.162 -2.729 610 HA VAL 76 HA VAL 76 -2.192 1.930 0.109 611 HB VAL 76 HB VAL 76 -1.673 3.659 -2.303 612 HG11 VAL 76 1HG1 VAL 76 -3.436 4.726 -1.030 613 HG12 VAL 76 2HG1 VAL 76 -2.513 4.526 0.462 614 HG13 VAL 76 3HG1 VAL 76 -1.921 5.601 -0.806 615 HG21 VAL 76 3HG2 VAL 76 -0.199 3.845 0.276 616 HG22 VAL 76 1HG2 VAL 76 0.135 2.480 -0.790 617 HG23 VAL 76 2HG2 VAL 76 0.365 4.129 -1.371 618 H TYR 77 H TYR 77 -4.250 1.330 0.555 619 HA TYR 77 HA TYR 77 -6.387 2.008 -1.313 620 HB2 TYR 77 1HB TYR 77 -6.213 -0.249 -0.150 621 HB3 TYR 77 2HB TYR 77 -6.665 0.589 1.336 622 HD1 TYR 77 2HD TYR 77 -7.967 1.046 -2.128 623 HD2 TYR 77 1HD TYR 77 -8.805 -0.151 1.869 624 HE1 TYR 77 2HE TYR 77 -10.348 0.820 -2.700 625 HE2 TYR 77 1HE TYR 77 -11.188 -0.382 1.307 626 HH TYR 77 HH TYR 77 -12.500 0.782 -1.649 627 H SER 78 H SER 78 -7.954 3.500 -0.932 628 HA SER 78 HA SER 78 -7.664 5.123 1.512 629 HB2 SER 78 1HB SER 78 -6.996 6.262 -0.627 630 HB3 SER 78 2HB SER 78 -8.672 6.083 -1.175 631 HG SER 78 HG SER 78 -9.253 7.252 0.796 632 H TYR 79 H TYR 79 -9.219 4.186 2.770 633 HA TYR 79 HA TYR 79 -11.852 3.625 1.726 634 HB2 TYR 79 1HB TYR 79 -10.918 2.133 3.395 635 HB3 TYR 79 2HB TYR 79 -10.723 3.472 4.528 636 HD1 TYR 79 1HD TYR 79 -12.639 4.446 5.683 637 HD2 TYR 79 2HD TYR 79 -13.117 1.154 3.029 638 HE1 TYR 79 1HE TYR 79 -14.886 4.041 6.598 639 HE2 TYR 79 2HE TYR 79 -15.365 0.741 3.937 640 HH TYR 79 HH TYR 79 -17.080 2.896 5.654 641 H LYS 80 H LYS 80 -13.808 4.487 2.771 642 HA LYS 80 HA LYS 80 -13.467 7.338 3.429 643 HB2 LYS 80 1HB LYS 80 -14.687 6.958 1.349 644 HB3 LYS 80 2HB LYS 80 -15.832 5.909 2.201 645 HG2 LYS 80 1HG LYS 80 -16.319 7.966 3.672 646 HG3 LYS 80 2HG LYS 80 -15.521 8.880 2.380 647 HD2 LYS 80 1HD LYS 80 -17.185 7.401 0.879 648 HD3 LYS 80 2HD LYS 80 -18.128 7.475 2.379 649 HE2 LYS 80 1HE LYS 80 -18.431 9.752 2.257 650 HE3 LYS 80 2HE LYS 80 -16.939 9.996 1.336 651 HZ1 LYS 80 3HZ LYS 80 -18.169 10.069 -0.487 652 HZ2 LYS 80 1HZ LYS 80 -19.574 9.686 0.374 653 HZ3 LYS 80 2HZ LYS 80 -18.605 8.451 -0.254 654 H TYR 81 H TYR 81 -13.545 7.588 5.571 655 HA TYR 81 HA TYR 81 -15.455 5.992 7.124 656 HB2 TYR 81 1HB TYR 81 -12.824 6.439 7.599 657 HB3 TYR 81 2HB TYR 81 -13.539 7.758 8.528 658 HD1 TYR 81 2HD TYR 81 -15.840 6.818 9.808 659 HD2 TYR 81 1HD TYR 81 -12.293 4.633 8.942 660 HE1 TYR 81 2HE TYR 81 -16.342 5.280 11.661 661 HE2 TYR 81 1HE TYR 81 -12.785 3.089 10.792 662 HH TYR 81 HH TYR 81 -14.427 2.392 12.221 663 H VAL 82 H VAL 82 -17.224 6.881 7.970 664 HA VAL 82 HA VAL 82 -17.594 9.774 7.689 665 HB VAL 82 HB VAL 82 -19.647 7.645 8.312 666 HG11 VAL 82 1HG1 VAL 82 -20.522 9.644 9.132 667 HG12 VAL 82 2HG1 VAL 82 -19.819 10.600 7.826 668 HG13 VAL 82 3HG1 VAL 82 -21.190 9.537 7.504 669 HG21 VAL 82 3HG2 VAL 82 -19.519 9.088 5.708 670 HG22 VAL 82 1HG2 VAL 82 -18.413 7.744 5.990 671 HG23 VAL 82 2HG2 VAL 82 -20.155 7.485 6.081 672 H HIS 83 H HIS 83 -18.749 10.926 9.420 673 HA HIS 83 HA HIS 83 -17.754 10.072 12.040 674 HB2 HIS 83 1HB HIS 83 -18.657 12.749 10.968 675 HB3 HIS 83 2HB HIS 83 -18.323 12.469 12.680 676 HD1 HIS 83 1HD HIS 83 -16.048 13.130 13.348 677 HD2 HIS 83 2HD HIS 83 -16.182 11.904 9.381 678 HE1 HIS 83 1HE HIS 83 -13.705 13.411 12.478 679 HE2 HIS 83 2HE HIS 83 -13.786 12.661 10.053 680 H ASP 84 H ASP 84 -20.381 12.328 11.679 681 HA ASP 84 HA ASP 84 -22.563 10.614 11.995 682 HB2 ASP 84 1HB ASP 84 -21.038 10.572 14.282 683 HB3 ASP 84 2HB ASP 84 -22.237 11.819 14.654 684 H ASP 85 H ASP 85 -21.237 13.691 13.178 685 HA ASP 85 HA ASP 85 -23.696 15.079 13.212 686 HB2 ASP 85 1HB ASP 85 -20.952 15.647 13.770 687 HB3 ASP 85 2HB ASP 85 -21.568 16.903 12.688 688 H GLY 86 H GLY 86 -21.826 13.970 10.637 689 HA2 GLY 86 1HA GLY 86 -23.040 14.205 8.461 690 HA3 GLY 86 2HA GLY 86 -23.081 15.927 8.812 691 H ARG 87 H ARG 87 -20.214 14.392 9.799 692 HA ARG 87 HA ARG 87 -18.819 15.502 7.457 693 HB2 ARG 87 1HB ARG 87 -17.958 15.108 10.322 694 HB3 ARG 87 2HB ARG 87 -16.803 15.442 9.024 695 HG2 ARG 87 1HG ARG 87 -19.151 17.252 9.468 696 HG3 ARG 87 2HG ARG 87 -17.685 17.399 10.451 697 HD2 ARG 87 1HD ARG 87 -16.349 17.610 8.359 698 HD3 ARG 87 2HD ARG 87 -17.866 17.596 7.448 699 HE ARG 87 HE ARG 87 -17.970 19.611 9.414 700 HH11 ARG 87 2HH1 ARG 87 -16.416 18.853 6.394 701 HH12 ARG 87 1HH1 ARG 87 -16.217 20.511 5.930 702 HH21 ARG 87 1HH2 ARG 87 -16.955 22.184 7.309 703 HH22 ARG 87 2HH2 ARG 87 -17.714 21.797 8.817 704 H VAL 88 H VAL 88 -17.315 14.292 6.356 705 HA VAL 88 HA VAL 88 -16.797 11.554 7.249 706 HB VAL 88 HB VAL 88 -18.679 11.217 5.818 707 HG11 VAL 88 1HG1 VAL 88 -19.117 12.298 3.861 708 HG12 VAL 88 2HG1 VAL 88 -18.136 13.536 4.649 709 HG13 VAL 88 3HG1 VAL 88 -17.413 12.469 3.444 710 HG21 VAL 88 3HG2 VAL 88 -16.270 10.647 4.104 711 HG22 VAL 88 1HG2 VAL 88 -16.659 9.730 5.559 712 HG23 VAL 88 2HG2 VAL 88 -17.778 9.738 4.196 713 H SER 89 H SER 89 -14.719 11.056 7.024 714 HA SER 89 HA SER 89 -13.126 12.554 5.046 715 HB2 SER 89 1HB SER 89 -12.246 11.593 7.788 716 HB3 SER 89 2HB SER 89 -11.223 12.427 6.605 717 HG SER 89 HG SER 89 -12.794 13.518 8.423 718 H TYR 90 H TYR 90 -11.353 11.443 4.094 719 HA TYR 90 HA TYR 90 -11.744 8.532 4.033 720 HB2 TYR 90 1HB TYR 90 -10.136 10.081 2.016 721 HB3 TYR 90 2HB TYR 90 -10.948 8.527 1.825 722 HD1 TYR 90 2HD TYR 90 -11.429 12.162 1.867 723 HD2 TYR 90 1HD TYR 90 -13.313 8.385 1.330 724 HE1 TYR 90 2HE TYR 90 -13.387 13.285 0.890 725 HE2 TYR 90 1HE TYR 90 -15.276 9.497 0.351 726 HH TYR 90 HH TYR 90 -16.217 11.429 -0.193 727 HA PRO 91 HA PRO 91 -7.828 8.760 6.349 728 HB2 PRO 91 2HB PRO 91 -8.897 7.792 8.137 729 HB3 PRO 91 1HB PRO 91 -8.146 6.314 7.537 730 HG2 PRO 91 1HG PRO 91 -10.057 5.642 6.397 731 HG3 PRO 91 2HG PRO 91 -10.779 6.461 7.833 732 HD2 PRO 91 1HD PRO 91 -11.445 7.113 5.283 733 HD3 PRO 91 2HD PRO 91 -11.392 8.305 6.593 734 H LEU 92 H LEU 92 -6.526 8.602 4.489 735 HA LEU 92 HA LEU 92 -6.293 6.200 2.975 736 HB2 LEU 92 1HB LEU 92 -5.117 8.870 2.989 737 HB3 LEU 92 2HB LEU 92 -3.950 7.604 2.571 738 HG LEU 92 HG LEU 92 -6.255 7.091 1.036 739 HD11 LEU 92 1HD1 LEU 92 -5.671 9.986 1.367 740 HD12 LEU 92 2HD1 LEU 92 -7.207 9.165 1.093 741 HD13 LEU 92 3HD1 LEU 92 -6.076 9.388 -0.242 742 HD21 LEU 92 3HD2 LEU 92 -4.400 6.530 -0.099 743 HD22 LEU 92 1HD2 LEU 92 -3.429 7.794 0.657 744 HD23 LEU 92 2HD2 LEU 92 -4.484 8.186 -0.700 745 H CYS 93 H CYS 93 -4.915 4.518 3.175 746 HA CYS 93 HA CYS 93 -2.831 4.652 5.238 747 HB2 CYS 93 1HB CYS 93 -4.880 2.457 4.907 748 HB3 CYS 93 2HB CYS 93 -3.447 2.329 5.939 749 HG CYS 93 HG CYS 93 -6.109 4.420 6.399 750 H PHE 94 H PHE 94 -1.144 3.055 4.993 751 HA PHE 94 HA PHE 94 -0.758 2.333 2.176 752 HB2 PHE 94 1HB PHE 94 0.956 3.776 3.203 753 HB3 PHE 94 2HB PHE 94 1.263 2.535 4.419 754 HD1 PHE 94 1HD PHE 94 1.655 3.408 0.880 755 HD2 PHE 94 2HD PHE 94 2.524 0.561 3.922 756 HE1 PHE 94 1HE PHE 94 3.320 2.350 -0.590 757 HE2 PHE 94 2HE PHE 94 4.191 -0.501 2.457 758 HZ PHE 94 HZ PHE 94 4.591 0.393 0.198 759 H ILE 95 H ILE 95 -1.514 0.341 1.795 760 HA ILE 95 HA ILE 95 -1.164 -1.762 3.785 761 HB ILE 95 HB ILE 95 -2.638 -1.755 1.150 762 HG12 ILE 95 1HG1 ILE 95 -3.668 -1.877 3.995 763 HG13 ILE 95 2HG1 ILE 95 -3.636 -0.411 2.999 764 HG21 ILE 95 1HG2 ILE 95 -3.593 -3.932 2.180 765 HG22 ILE 95 2HG2 ILE 95 -2.026 -3.976 1.375 766 HG23 ILE 95 3HG2 ILE 95 -2.112 -3.927 3.136 767 HD11 ILE 95 3HD1 ILE 95 -4.947 -2.276 1.423 768 HD12 ILE 95 1HD1 ILE 95 -5.572 -2.544 3.050 769 HD13 ILE 95 2HD1 ILE 95 -5.673 -0.942 2.319 770 H PHE 96 H PHE 96 0.881 -2.517 3.757 771 HA PHE 96 HA PHE 96 2.343 -2.879 1.304 772 HB2 PHE 96 1HB PHE 96 3.581 -2.226 3.264 773 HB3 PHE 96 2HB PHE 96 2.962 -3.608 4.171 774 HD1 PHE 96 1HD PHE 96 3.805 -4.278 0.742 775 HD2 PHE 96 2HD PHE 96 5.359 -4.095 4.700 776 HE1 PHE 96 1HE PHE 96 5.737 -5.632 0.042 777 HE2 PHE 96 2HE PHE 96 7.294 -5.447 4.007 778 HZ PHE 96 HZ PHE 96 7.485 -6.217 1.676 779 H SER 97 H SER 97 1.420 -4.408 0.025 780 HA SER 97 HA SER 97 0.480 -6.914 1.070 781 HB2 SER 97 1HB SER 97 -0.087 -5.468 -1.185 782 HB3 SER 97 2HB SER 97 0.967 -6.740 -1.831 783 HG SER 97 HG SER 97 -0.498 -8.177 -0.493 784 H SER 98 H SER 98 2.033 -8.185 1.918 785 HA SER 98 HA SER 98 4.176 -9.051 0.105 786 HB2 SER 98 1HB SER 98 5.844 -8.949 1.802 787 HB3 SER 98 2HB SER 98 4.997 -7.393 1.854 788 HG SER 98 HG SER 98 3.729 -9.097 3.465 789 HA PRO 99 HA PRO 99 2.015 -12.797 1.490 790 HB2 PRO 99 2HB PRO 99 1.415 -13.167 -0.696 791 HB3 PRO 99 1HB PRO 99 2.775 -14.290 -0.677 792 HG2 PRO 99 1HG PRO 99 4.235 -12.757 -1.635 793 HG3 PRO 99 2HG PRO 99 2.685 -12.318 -2.449 794 HD2 PRO 99 1HD PRO 99 4.212 -10.503 -1.127 795 HD3 PRO 99 2HD PRO 99 2.444 -10.413 -1.175 796 H VAL 100 H VAL 100 2.980 -15.211 1.259 797 HA VAL 100 HA VAL 100 5.714 -15.084 2.354 798 HB VAL 100 HB VAL 100 3.776 -15.794 3.897 799 HG11 VAL 100 1HG1 VAL 100 3.211 -17.529 1.866 800 HG12 VAL 100 2HG1 VAL 100 4.088 -18.561 2.997 801 HG13 VAL 100 3HG1 VAL 100 2.646 -17.695 3.528 802 HG21 VAL 100 3HG2 VAL 100 6.463 -16.889 3.562 803 HG22 VAL 100 1HG2 VAL 100 5.662 -16.266 5.005 804 HG23 VAL 100 2HG2 VAL 100 5.388 -17.931 4.493 805 H GLY 101 H GLY 101 3.703 -16.364 -0.086 806 HA2 GLY 101 1HA GLY 101 5.285 -18.703 -0.647 807 HA3 GLY 101 2HA GLY 101 3.989 -18.056 -1.641 808 H CYS 102 H CYS 102 5.922 -15.497 -1.064 809 HA CYS 102 HA CYS 102 7.077 -15.622 -3.702 810 HB2 CYS 102 1HB CYS 102 7.992 -13.349 -3.065 811 HB3 CYS 102 2HB CYS 102 6.226 -13.497 -3.081 812 HG CYS 102 HG CYS 102 6.204 -12.169 -0.852 813 H LYS 103 H LYS 103 9.448 -14.446 -3.640 814 HA LYS 103 HA LYS 103 11.119 -16.380 -2.197 815 HB2 LYS 103 1HB LYS 103 12.141 -14.535 -4.335 816 HB3 LYS 103 2HB LYS 103 12.732 -16.136 -3.864 817 HG2 LYS 103 1HG LYS 103 11.540 -17.088 -5.467 818 HG3 LYS 103 2HG LYS 103 10.053 -16.401 -4.787 819 HD2 LYS 103 1HD LYS 103 10.300 -15.707 -7.101 820 HD3 LYS 103 2HD LYS 103 10.471 -14.310 -6.023 821 HE2 LYS 103 1HE LYS 103 12.286 -13.915 -7.340 822 HE3 LYS 103 2HE LYS 103 13.039 -15.017 -6.178 823 HZ1 LYS 103 3HZ LYS 103 13.505 -16.383 -7.837 824 HZ2 LYS 103 1HZ LYS 103 12.754 -15.347 -8.944 825 HZ3 LYS 103 2HZ LYS 103 11.859 -16.564 -8.184 826 HA PRO 104 HA PRO 104 12.742 -13.338 0.525 827 HB2 PRO 104 2HB PRO 104 13.784 -15.067 1.624 828 HB3 PRO 104 1HB PRO 104 15.251 -14.348 0.961 829 HG2 PRO 104 1HG PRO 104 15.329 -15.821 -0.834 830 HG3 PRO 104 2HG PRO 104 14.649 -16.882 0.456 831 HD2 PRO 104 1HD PRO 104 13.442 -16.548 -1.953 832 HD3 PRO 104 2HD PRO 104 12.533 -16.797 -0.454 833 H GLU 105 H GLU 105 14.095 -13.902 -2.567 834 HA GLU 105 HA GLU 105 16.183 -11.943 -2.417 835 HB2 GLU 105 1HB GLU 105 15.032 -13.724 -4.488 836 HB3 GLU 105 2HB GLU 105 15.791 -12.235 -5.072 837 HG2 GLU 105 1HG GLU 105 17.877 -12.809 -4.005 838 HG3 GLU 105 2HG GLU 105 17.136 -14.239 -3.276 839 H GLN 106 H GLN 106 12.841 -12.005 -3.502 840 HA GLN 106 HA GLN 106 12.994 -9.268 -4.471 841 HB2 GLN 106 1HB GLN 106 10.438 -10.821 -4.230 842 HB3 GLN 106 2HB GLN 106 10.899 -9.602 -5.428 843 HG2 GLN 106 1HG GLN 106 12.241 -12.291 -5.283 844 HG3 GLN 106 2HG GLN 106 10.764 -12.009 -6.216 845 HE21 GLN 106 2HE2 GLN 106 12.509 -9.622 -8.389 846 HE22 GLN 106 1HE2 GLN 106 11.137 -9.607 -7.339 847 H GLN 107 H GLN 107 10.995 -11.042 -2.106 848 HA GLN 107 HA GLN 107 9.568 -9.121 -0.918 849 HB2 GLN 107 1HB GLN 107 10.517 -11.657 -0.152 850 HB3 GLN 107 2HB GLN 107 10.878 -10.572 1.200 851 HG2 GLN 107 1HG GLN 107 8.180 -10.252 0.096 852 HG3 GLN 107 2HG GLN 107 8.507 -11.842 0.800 853 HE21 GLN 107 2HE2 GLN 107 8.295 -8.527 3.155 854 HE22 GLN 107 1HE2 GLN 107 8.439 -8.401 1.438 855 H MET 108 H MET 108 13.033 -9.607 -0.431 856 HA MET 108 HA MET 108 13.409 -7.705 1.595 857 HB2 MET 108 1HB MET 108 15.181 -8.974 -0.460 858 HB3 MET 108 2HB MET 108 15.797 -7.618 0.497 859 HG2 MET 108 1HG MET 108 14.834 -9.095 2.497 860 HG3 MET 108 2HG MET 108 15.141 -10.381 1.327 861 HE1 MET 108 3HE MET 108 17.314 -10.262 -0.146 862 HE2 MET 108 1HE MET 108 17.974 -8.629 -0.064 863 HE3 MET 108 2HE MET 108 18.908 -9.989 0.557 864 H MET 109 H MET 109 13.564 -7.406 -1.935 865 HA MET 109 HA MET 109 14.455 -4.794 -2.142 866 HB2 MET 109 1HB MET 109 12.520 -6.355 -3.860 867 HB3 MET 109 2HB MET 109 13.125 -4.751 -4.302 868 HG2 MET 109 1HG MET 109 15.328 -5.510 -4.567 869 HG3 MET 109 2HG MET 109 14.997 -7.005 -3.687 870 HE1 MET 109 3HE MET 109 12.835 -6.002 -7.503 871 HE2 MET 109 1HE MET 109 13.550 -4.884 -6.342 872 HE3 MET 109 2HE MET 109 14.525 -5.521 -7.666 873 H TYR 110 H TYR 110 11.229 -6.006 -1.444 874 HA TYR 110 HA TYR 110 10.081 -3.341 -1.502 875 HB2 TYR 110 1HB TYR 110 8.817 -5.964 -0.664 876 HB3 TYR 110 2HB TYR 110 7.971 -4.449 -0.989 877 HD1 TYR 110 2HD TYR 110 10.150 -6.970 -2.654 878 HD2 TYR 110 1HD TYR 110 7.153 -3.986 -3.120 879 HE1 TYR 110 2HE TYR 110 9.908 -7.592 -5.021 880 HE2 TYR 110 1HE TYR 110 6.901 -4.601 -5.489 881 HH TYR 110 HH TYR 110 8.548 -7.385 -6.849 882 H ALA 111 H ALA 111 11.081 -5.753 0.846 883 HA ALA 111 HA ALA 111 9.959 -4.485 3.125 884 HB1 ALA 111 3HB ALA 111 12.266 -5.996 3.843 885 HB2 ALA 111 1HB ALA 111 10.564 -6.395 4.073 886 HB3 ALA 111 2HB ALA 111 11.386 -6.861 2.583 887 H GLY 112 H GLY 112 12.892 -4.030 1.314 888 HA2 GLY 112 1HA GLY 112 14.074 -2.375 3.414 889 HA3 GLY 112 2HA GLY 112 14.842 -2.844 1.905 890 H SER 113 H SER 113 12.203 -2.016 0.558 891 HA SER 113 HA SER 113 12.907 0.833 0.379 892 HB2 SER 113 1HB SER 113 11.322 -0.828 -1.603 893 HB3 SER 113 2HB SER 113 11.954 0.810 -1.844 894 HG SER 113 HG SER 113 13.411 -1.604 -1.610 895 H LYS 114 H LYS 114 10.486 -1.316 1.426 896 HA LYS 114 HA LYS 114 8.094 -0.075 1.026 897 HB2 LYS 114 1HB LYS 114 8.134 -2.135 2.210 898 HB3 LYS 114 2HB LYS 114 9.153 -1.456 3.489 899 HG2 LYS 114 1HG LYS 114 7.253 0.073 4.081 900 HG3 LYS 114 2HG LYS 114 6.256 -0.858 2.949 901 HD2 LYS 114 1HD LYS 114 5.775 -2.147 4.725 902 HD3 LYS 114 2HD LYS 114 7.383 -2.841 4.451 903 HE2 LYS 114 1HE LYS 114 8.354 -1.200 6.017 904 HE3 LYS 114 2HE LYS 114 6.734 -0.552 6.307 905 HZ1 LYS 114 3HZ LYS 114 7.374 -3.400 6.781 906 HZ2 LYS 114 1HZ LYS 114 6.062 -2.508 7.368 907 HZ3 LYS 114 2HZ LYS 114 7.616 -2.222 7.970 908 H ASN 115 H ASN 115 10.301 0.617 3.743 909 HA ASN 115 HA ASN 115 8.840 2.741 4.821 910 HB2 ASN 115 1HB ASN 115 11.727 1.921 4.946 911 HB3 ASN 115 2HB ASN 115 11.211 3.448 5.671 912 HD21 ASN 115 2HD2 ASN 115 11.039 0.468 8.030 913 HD22 ASN 115 1HD2 ASN 115 12.216 0.908 6.845 914 H ARG 116 H ARG 116 11.363 2.696 2.346 915 HA ARG 116 HA ARG 116 11.744 5.445 2.070 916 HB2 ARG 116 1HB ARG 116 13.242 3.866 1.027 917 HB3 ARG 116 2HB ARG 116 11.933 3.242 0.011 918 HG2 ARG 116 1HG ARG 116 13.127 4.615 -1.432 919 HG3 ARG 116 2HG ARG 116 11.772 5.630 -0.912 920 HD2 ARG 116 1HD ARG 116 13.436 7.138 -0.557 921 HD3 ARG 116 2HD ARG 116 13.525 6.286 0.991 922 HE ARG 116 HE ARG 116 15.210 4.937 -0.741 923 HH11 ARG 116 2HH1 ARG 116 14.948 8.127 0.626 924 HH12 ARG 116 1HH1 ARG 116 16.655 8.422 0.596 925 HH21 ARG 116 1HH2 ARG 116 18.082 6.820 -0.207 926 HH22 ARG 116 2HH2 ARG 116 17.459 5.312 -0.784 927 H LEU 117 H LEU 117 9.630 3.318 0.135 928 HA LEU 117 HA LEU 117 8.424 5.355 -1.361 929 HB2 LEU 117 1HB LEU 117 8.223 3.127 -2.130 930 HB3 LEU 117 2HB LEU 117 7.519 2.595 -0.593 931 HG LEU 117 HG LEU 117 5.581 4.233 -1.258 932 HD11 LEU 117 1HD1 LEU 117 5.828 3.502 -4.009 933 HD12 LEU 117 2HD1 LEU 117 7.246 4.428 -3.520 934 HD13 LEU 117 3HD1 LEU 117 5.634 5.104 -3.295 935 HD21 LEU 117 3HD2 LEU 117 4.413 2.384 -2.283 936 HD22 LEU 117 1HD2 LEU 117 5.421 1.789 -0.964 937 HD23 LEU 117 2HD2 LEU 117 5.941 1.574 -2.636 938 H VAL 118 H VAL 118 7.126 3.616 1.472 939 HA VAL 118 HA VAL 118 4.778 4.964 1.843 940 HB VAL 118 HB VAL 118 6.681 4.044 4.001 941 HG11 VAL 118 1HG1 VAL 118 5.181 4.582 5.574 942 HG12 VAL 118 2HG1 VAL 118 4.512 5.670 4.356 943 HG13 VAL 118 3HG1 VAL 118 3.817 4.066 4.584 944 HG21 VAL 118 3HG2 VAL 118 6.102 1.980 3.421 945 HG22 VAL 118 1HG2 VAL 118 4.407 2.375 3.703 946 HG23 VAL 118 2HG2 VAL 118 5.114 2.617 2.106 947 H GLN 119 H GLN 119 7.927 5.889 3.236 948 HA GLN 119 HA GLN 119 7.143 8.197 4.541 949 HB2 GLN 119 1HB GLN 119 9.705 7.249 3.335 950 HB3 GLN 119 2HB GLN 119 9.597 8.937 3.861 951 HG2 GLN 119 1HG GLN 119 8.540 7.435 5.974 952 HG3 GLN 119 2HG GLN 119 9.975 6.558 5.425 953 HE21 GLN 119 2HE2 GLN 119 12.269 8.855 6.655 954 HE22 GLN 119 1HE2 GLN 119 11.981 7.423 5.733 955 H THR 120 H THR 120 7.890 7.703 1.143 956 HA THR 120 HA THR 120 7.982 10.410 0.369 957 HB THR 120 HB THR 120 7.009 8.193 -1.423 958 HG1 THR 120 1HG THR 120 9.526 8.586 -0.270 959 HG21 THR 120 3HG2 THR 120 7.085 9.868 -2.901 960 HG22 THR 120 1HG2 THR 120 8.839 9.803 -2.747 961 HG23 THR 120 2HG2 THR 120 7.909 10.932 -1.762 962 H ALA 121 H ALA 121 5.319 8.070 0.456 963 HA ALA 121 HA ALA 121 3.388 9.902 -0.590 964 HB1 ALA 121 3HB ALA 121 3.352 7.317 -0.608 965 HB2 ALA 121 1HB ALA 121 2.669 7.476 1.010 966 HB3 ALA 121 2HB ALA 121 1.837 8.191 -0.371 967 H GLU 122 H GLU 122 4.899 9.669 2.382 968 HA GLU 122 HA GLU 122 4.546 10.611 4.423 969 HB2 GLU 122 1HB GLU 122 3.652 12.438 2.525 970 HB3 GLU 122 2HB GLU 122 2.332 12.354 3.702 971 HG2 GLU 122 1HG GLU 122 5.222 12.954 4.330 972 HG3 GLU 122 2HG GLU 122 3.904 14.131 4.244 973 H LEU 123 H LEU 123 3.121 8.233 3.828 974 HA LEU 123 HA LEU 123 0.476 8.593 5.003 975 HB2 LEU 123 1HB LEU 123 1.841 6.097 3.978 976 HB3 LEU 123 2HB LEU 123 0.151 6.226 4.495 977 HG LEU 123 HG LEU 123 1.122 7.950 2.258 978 HD11 LEU 123 1HD1 LEU 123 0.081 5.197 1.725 979 HD12 LEU 123 2HD1 LEU 123 1.807 5.479 1.950 980 HD13 LEU 123 3HD1 LEU 123 0.942 6.295 0.648 981 HD21 LEU 123 3HD2 LEU 123 -1.448 6.688 1.974 982 HD22 LEU 123 1HD2 LEU 123 -1.042 8.403 2.054 983 HD23 LEU 123 2HD2 LEU 123 -1.319 7.491 3.539 984 H THR 124 H THR 124 1.155 9.195 7.113 985 HA THR 124 HA THR 124 2.912 7.924 8.787 986 HB THR 124 HB THR 124 0.271 9.235 9.415 987 HG1 THR 124 1HG THR 124 2.807 10.073 8.978 988 HG21 THR 124 3HG2 THR 124 0.648 7.664 11.201 989 HG22 THR 124 1HG2 THR 124 1.046 9.280 11.782 990 HG23 THR 124 2HG2 THR 124 2.334 8.161 11.339 991 H LYS 125 H LYS 125 -0.421 7.000 8.061 992 HA LYS 125 HA LYS 125 -0.285 4.719 9.853 993 HB2 LYS 125 1HB LYS 125 -2.373 6.196 8.434 994 HB3 LYS 125 2HB LYS 125 -2.598 4.442 8.361 995 HG2 LYS 125 1HG LYS 125 -2.540 4.290 10.783 996 HG3 LYS 125 2HG LYS 125 -2.230 6.032 10.893 997 HD2 LYS 125 1HD LYS 125 -4.698 4.790 9.658 998 HD3 LYS 125 2HD LYS 125 -4.599 5.443 11.303 999 HE2 LYS 125 1HE LYS 125 -3.731 7.601 10.076 1000 HE3 LYS 125 2HE LYS 125 -4.554 6.879 8.686 1001 HZ1 LYS 125 3HZ LYS 125 -6.609 7.001 9.735 1002 HZ2 LYS 125 1HZ LYS 125 -5.872 8.463 10.161 1003 HZ3 LYS 125 2HZ LYS 125 -5.937 7.194 11.276 1004 H VAL 126 H VAL 126 1.158 3.258 9.050 1005 HA VAL 126 HA VAL 126 0.562 2.159 6.380 1006 HB VAL 126 HB VAL 126 2.669 3.045 6.038 1007 HG11 VAL 126 1HG1 VAL 126 3.076 3.864 8.270 1008 HG12 VAL 126 2HG1 VAL 126 3.380 2.227 8.852 1009 HG13 VAL 126 3HG1 VAL 126 4.493 2.978 7.706 1010 HG21 VAL 126 3HG2 VAL 126 2.470 0.413 5.909 1011 HG22 VAL 126 1HG2 VAL 126 3.998 1.237 5.601 1012 HG23 VAL 126 2HG2 VAL 126 3.697 0.495 7.172 1013 H PHE 127 H PHE 127 -0.232 0.174 6.467 1014 HA PHE 127 HA PHE 127 0.442 -1.517 8.779 1015 HB2 PHE 127 1HB PHE 127 -1.898 -1.887 6.900 1016 HB3 PHE 127 2HB PHE 127 -1.645 -2.649 8.471 1017 HD1 PHE 127 2HD PHE 127 -0.985 -0.558 10.280 1018 HD2 PHE 127 1HD PHE 127 -3.725 -0.489 7.024 1019 HE1 PHE 127 2HE PHE 127 -2.247 1.241 11.385 1020 HE2 PHE 127 1HE PHE 127 -4.991 1.312 8.123 1021 HZ PHE 127 HZ PHE 127 -4.254 2.178 10.307 1022 H GLU 128 H GLU 128 0.515 -3.879 8.332 1023 HA GLU 128 HA GLU 128 1.520 -4.474 5.633 1024 HB2 GLU 128 1HB GLU 128 3.469 -4.202 7.019 1025 HB3 GLU 128 2HB GLU 128 2.782 -5.258 8.262 1026 HG2 GLU 128 1HG GLU 128 2.838 -6.692 5.802 1027 HG3 GLU 128 2HG GLU 128 4.424 -5.957 6.073 1028 H ILE 129 H ILE 129 0.437 -6.086 4.734 1029 HA ILE 129 HA ILE 129 -1.104 -7.896 6.445 1030 HB ILE 129 HB ILE 129 -2.051 -8.603 4.126 1031 HG12 ILE 129 1HG1 ILE 129 -1.143 -5.809 3.434 1032 HG13 ILE 129 2HG1 ILE 129 -0.224 -7.245 2.952 1033 HG21 ILE 129 1HG2 ILE 129 -3.076 -7.180 6.034 1034 HG22 ILE 129 2HG2 ILE 129 -2.789 -5.824 4.945 1035 HG23 ILE 129 3HG2 ILE 129 -3.829 -7.154 4.439 1036 HD11 ILE 129 3HD1 ILE 129 -1.525 -6.723 1.089 1037 HD12 ILE 129 1HD1 ILE 129 -2.370 -8.064 1.862 1038 HD13 ILE 129 2HD1 ILE 129 -2.960 -6.414 2.066 1039 H ARG 130 H ARG 130 -0.560 -9.962 6.712 1040 HA ARG 130 HA ARG 130 1.857 -10.981 5.586 1041 HB2 ARG 130 1HB ARG 130 1.265 -11.620 7.824 1042 HB3 ARG 130 2HB ARG 130 -0.289 -12.268 7.276 1043 HG2 ARG 130 1HG ARG 130 1.159 -14.113 7.704 1044 HG3 ARG 130 2HG ARG 130 0.957 -13.967 5.951 1045 HD2 ARG 130 1HD ARG 130 3.213 -14.156 5.940 1046 HD3 ARG 130 2HD ARG 130 3.131 -12.422 6.284 1047 HE ARG 130 HE ARG 130 3.090 -13.488 8.751 1048 HH11 ARG 130 2HH1 ARG 130 5.147 -14.030 5.995 1049 HH12 ARG 130 1HH1 ARG 130 6.537 -14.433 6.948 1050 HH21 ARG 130 1HH2 ARG 130 6.403 -14.426 9.235 1051 HH22 ARG 130 2HH2 ARG 130 4.913 -14.016 10.016 1052 H THR 131 H THR 131 -1.405 -10.979 4.596 1053 HA THR 131 HA THR 131 -0.802 -12.362 2.180 1054 HB THR 131 HB THR 131 -1.030 -14.402 3.313 1055 HG1 THR 131 1HG THR 131 -3.182 -15.137 2.608 1056 HG21 THR 131 3HG2 THR 131 -1.971 -13.332 5.399 1057 HG22 THR 131 1HG2 THR 131 -2.638 -14.912 4.989 1058 HG23 THR 131 2HG2 THR 131 -3.560 -13.448 4.644 1059 H THR 132 H THR 132 -2.346 -12.026 0.606 1060 HA THR 132 HA THR 132 -3.883 -9.824 0.556 1061 HB THR 132 HB THR 132 -5.396 -11.008 -1.100 1062 HG1 THR 132 1HG THR 132 -5.386 -13.114 -0.838 1063 HG21 THR 132 3HG2 THR 132 -3.823 -10.838 -2.772 1064 HG22 THR 132 1HG2 THR 132 -2.558 -11.598 -1.809 1065 HG23 THR 132 2HG2 THR 132 -3.028 -9.929 -1.487 1066 H ASP 133 H ASP 133 -5.053 -13.018 1.599 1067 HA ASP 133 HA ASP 133 -7.670 -12.612 2.080 1068 HB2 ASP 133 1HB ASP 133 -5.570 -14.121 3.570 1069 HB3 ASP 133 2HB ASP 133 -7.154 -13.942 4.333 1070 H ASP 134 H ASP 134 -5.044 -11.517 4.199 1071 HA ASP 134 HA ASP 134 -6.463 -10.500 6.314 1072 HB2 ASP 134 1HB ASP 134 -3.921 -9.626 4.972 1073 HB3 ASP 134 2HB ASP 134 -4.585 -8.680 6.311 1074 H LEU 135 H LEU 135 -5.755 -8.876 3.238 1075 HA LEU 135 HA LEU 135 -6.898 -6.404 3.795 1076 HB2 LEU 135 1HB LEU 135 -5.574 -6.696 1.830 1077 HB3 LEU 135 2HB LEU 135 -6.678 -7.938 1.216 1078 HG LEU 135 HG LEU 135 -8.220 -6.401 0.476 1079 HD11 LEU 135 1HD1 LEU 135 -7.169 -4.674 2.670 1080 HD12 LEU 135 2HD1 LEU 135 -8.827 -5.155 2.311 1081 HD13 LEU 135 3HD1 LEU 135 -8.026 -3.939 1.315 1082 HD21 LEU 135 3HD2 LEU 135 -6.792 -4.349 -0.346 1083 HD22 LEU 135 1HD2 LEU 135 -6.535 -5.962 -1.010 1084 HD23 LEU 135 2HD2 LEU 135 -5.449 -5.339 0.231 1085 H THR 136 H THR 136 -8.772 -6.848 5.057 1086 HA THR 136 HA THR 136 -11.115 -7.568 3.420 1087 HB THR 136 HB THR 136 -12.014 -8.213 5.870 1088 HG1 THR 136 1HG THR 136 -10.441 -8.969 7.154 1089 HG21 THR 136 3HG2 THR 136 -11.944 -9.582 3.740 1090 HG22 THR 136 1HG2 THR 136 -11.795 -10.492 5.244 1091 HG23 THR 136 2HG2 THR 136 -10.363 -10.159 4.269 1092 H GLU 137 H GLU 137 -12.943 -6.335 3.676 1093 HA GLU 137 HA GLU 137 -12.847 -3.698 4.195 1094 HB2 GLU 137 1HB GLU 137 -14.813 -4.947 3.295 1095 HB3 GLU 137 2HB GLU 137 -15.213 -5.416 4.954 1096 HG2 GLU 137 1HG GLU 137 -15.169 -2.846 5.406 1097 HG3 GLU 137 2HG GLU 137 -15.390 -2.741 3.653 1098 H THR 138 H THR 138 -13.611 -6.177 6.623 1099 HA THR 138 HA THR 138 -13.914 -4.367 8.780 1100 HB THR 138 HB THR 138 -13.108 -7.268 9.005 1101 HG1 THR 138 1HG THR 138 -15.045 -7.765 8.326 1102 HG21 THR 138 3HG2 THR 138 -13.024 -5.905 11.071 1103 HG22 THR 138 1HG2 THR 138 -14.243 -7.177 11.142 1104 HG23 THR 138 2HG2 THR 138 -14.728 -5.506 10.848 1105 H TRP 139 H TRP 139 -11.273 -6.684 8.143 1106 HA TRP 139 HA TRP 139 -9.490 -5.961 10.054 1107 HB2 TRP 139 1HB TRP 139 -8.833 -7.748 8.701 1108 HB3 TRP 139 2HB TRP 139 -9.089 -6.837 7.212 1109 HD1 TRP 139 HD TRP 139 -6.471 -7.457 9.900 1110 HE1 TRP 139 1HE TRP 139 -4.236 -6.429 9.143 1111 HE3 TRP 139 3HE TRP 139 -8.103 -4.905 5.782 1112 HZ2 TRP 139 2HZ TRP 139 -3.290 -4.758 7.075 1113 HZ3 TRP 139 3HZ TRP 139 -6.470 -3.616 4.469 1114 HH2 TRP 139 HH TRP 139 -4.114 -3.544 5.105 1115 H LEU 140 H LEU 140 -10.476 -4.064 7.343 1116 HA LEU 140 HA LEU 140 -8.254 -2.220 7.530 1117 HB2 LEU 140 1HB LEU 140 -9.011 -2.424 5.347 1118 HB3 LEU 140 2HB LEU 140 -10.712 -2.425 5.845 1119 HG LEU 140 HG LEU 140 -10.612 -0.032 6.272 1120 HD11 LEU 140 1HD1 LEU 140 -8.651 1.278 5.750 1121 HD12 LEU 140 2HD1 LEU 140 -7.768 -0.176 5.286 1122 HD13 LEU 140 3HD1 LEU 140 -8.251 0.064 6.965 1123 HD21 LEU 140 3HD2 LEU 140 -11.224 0.152 4.148 1124 HD22 LEU 140 1HD2 LEU 140 -10.299 -1.288 3.724 1125 HD23 LEU 140 2HD2 LEU 140 -9.525 0.296 3.695 1126 H LYS 141 H LYS 141 -11.789 -1.805 7.804 1127 HA LYS 141 HA LYS 141 -11.756 0.707 8.980 1128 HB2 LYS 141 1HB LYS 141 -13.694 -1.535 8.824 1129 HB3 LYS 141 2HB LYS 141 -13.991 -0.318 10.076 1130 HG2 LYS 141 1HG LYS 141 -14.543 1.297 8.592 1131 HG3 LYS 141 2HG LYS 141 -13.397 0.709 7.375 1132 HD2 LYS 141 1HD LYS 141 -15.153 -0.134 6.282 1133 HD3 LYS 141 2HD LYS 141 -15.260 -1.336 7.580 1134 HE2 LYS 141 1HE LYS 141 -16.504 1.291 8.148 1135 HE3 LYS 141 2HE LYS 141 -17.280 0.311 6.896 1136 HZ1 LYS 141 3HZ LYS 141 -17.099 -1.561 8.641 1137 HZ2 LYS 141 1HZ LYS 141 -18.316 -0.398 8.809 1138 HZ3 LYS 141 2HZ LYS 141 -16.916 -0.298 9.753 1139 H GLU 142 H GLU 142 -10.765 -2.259 10.295 1140 HA GLU 142 HA GLU 142 -11.343 -1.764 13.037 1141 HB2 GLU 142 1HB GLU 142 -9.586 -3.671 11.538 1142 HB3 GLU 142 2HB GLU 142 -9.379 -3.495 13.288 1143 HG2 GLU 142 1HG GLU 142 -11.962 -3.871 13.358 1144 HG3 GLU 142 2HG GLU 142 -11.695 -4.580 11.758 1145 H LYS 143 H LYS 143 -8.353 -1.482 11.123 1146 HA LYS 143 HA LYS 143 -6.792 -0.390 13.205 1147 HB2 LYS 143 1HB LYS 143 -6.404 0.029 10.234 1148 HB3 LYS 143 2HB LYS 143 -5.170 0.137 11.500 1149 HG2 LYS 143 1HG LYS 143 -6.435 -2.444 11.590 1150 HG3 LYS 143 2HG LYS 143 -5.849 -2.096 9.954 1151 HD2 LYS 143 1HD LYS 143 -3.718 -1.253 11.368 1152 HD3 LYS 143 2HD LYS 143 -4.338 -2.501 12.464 1153 HE2 LYS 143 1HE LYS 143 -4.293 -4.146 10.642 1154 HE3 LYS 143 2HE LYS 143 -3.689 -2.896 9.543 1155 HZ1 LYS 143 3HZ LYS 143 -1.624 -3.129 10.308 1156 HZ2 LYS 143 1HZ LYS 143 -2.152 -4.573 11.016 1157 HZ3 LYS 143 2HZ LYS 143 -2.111 -3.148 11.927 1158 H LEU 144 H LEU 144 -8.818 1.069 10.723 1159 HA LEU 144 HA LEU 144 -8.016 3.751 11.216 1160 HB2 LEU 144 1HB LEU 144 -10.674 2.878 10.091 1161 HB3 LEU 144 2HB LEU 144 -9.801 4.394 9.801 1162 HG LEU 144 HG LEU 144 -8.895 1.682 8.836 1163 HD11 LEU 144 1HD1 LEU 144 -10.707 3.708 7.686 1164 HD12 LEU 144 2HD1 LEU 144 -10.630 1.967 7.420 1165 HD13 LEU 144 3HD1 LEU 144 -9.490 3.035 6.602 1166 HD21 LEU 144 3HD2 LEU 144 -7.690 3.587 7.296 1167 HD22 LEU 144 1HD2 LEU 144 -6.943 2.768 8.668 1168 HD23 LEU 144 2HD2 LEU 144 -7.693 4.349 8.886 1169 H ALA 145 H ALA 145 -10.889 1.885 12.189 1170 HA ALA 145 HA ALA 145 -12.400 3.613 13.551 1171 HB1 ALA 145 3HB ALA 145 -11.869 0.808 13.775 1172 HB2 ALA 145 1HB ALA 145 -12.133 1.495 15.378 1173 HB3 ALA 145 2HB ALA 145 -13.355 1.693 14.119 1174 H SER 146 H SER 146 -9.865 1.859 15.345 1175 HA SER 146 HA SER 146 -8.684 4.160 16.469 1176 HB2 SER 146 1HB SER 146 -11.094 3.877 17.585 1177 HB3 SER 146 2HB SER 146 -10.202 2.730 18.601 1178 HG SER 146 HG SER 146 -10.202 5.407 18.709 1179 H GLY 147 H GLY 147 -7.802 1.761 15.289 1180 HA2 GLY 147 1HA GLY 147 -5.969 0.385 15.618 1181 HA3 GLY 147 2HA GLY 147 -5.915 0.917 17.293 1182 HA PRO 148 HA PRO 148 -8.025 -3.369 16.619 1183 HB2 PRO 148 2HB PRO 148 -6.574 -4.381 15.154 1184 HB3 PRO 148 1HB PRO 148 -5.874 -5.062 16.621 1185 HG2 PRO 148 1HG PRO 148 -4.194 -3.459 16.729 1186 HG3 PRO 148 2HG PRO 148 -4.377 -3.651 14.946 1187 HD2 PRO 148 1HD PRO 148 -4.530 -1.240 16.182 1188 HD3 PRO 148 2HD PRO 148 -5.483 -1.640 14.743 1189 H SER 149 H SER 149 -8.831 -3.645 18.607 1190 HA SER 149 HA SER 149 -6.940 -4.125 20.815 1191 HB2 SER 149 1HB SER 149 -8.232 -1.897 20.865 1192 HB3 SER 149 2HB SER 149 -9.660 -2.887 21.214 1193 HG SER 149 HG SER 149 -8.425 -2.055 23.078 1194 H SER 150 H SER 150 -7.300 -5.878 22.067 1195 HA SER 150 HA SER 150 -9.511 -7.630 21.272 1196 HB2 SER 150 1HB SER 150 -8.222 -9.430 22.377 1197 HB3 SER 150 2HB SER 150 -7.278 -8.609 21.122 1198 HG SER 150 HG SER 150 -6.810 -8.781 23.796 1199 H GLY 151 H GLY 151 -11.139 -8.131 22.612 1200 HA2 GLY 151 1HA GLY 151 -10.904 -7.249 25.424 1201 HA3 GLY 151 2HA GLY 151 -12.377 -7.054 24.487 Start of MODEL 14 1 H1 GLY 1 H GLY 1 13.435 -6.429 11.178 2 HA2 GLY 1 1HA GLY 1 10.939 -5.333 10.675 3 HA3 GLY 1 2HA GLY 1 12.002 -4.823 11.979 4 H SER 2 H SER 2 10.489 -2.891 11.093 5 HA SER 2 HA SER 2 12.116 -1.377 9.159 6 HB2 SER 2 1HB SER 2 10.163 -0.153 8.527 7 HB3 SER 2 2HB SER 2 9.703 -1.864 8.553 8 HG SER 2 HG SER 2 8.373 -0.090 9.715 9 H SER 3 H SER 3 13.132 0.395 9.837 10 HA SER 3 HA SER 3 14.045 1.844 11.367 11 HB2 SER 3 1HB SER 3 12.430 3.550 12.149 12 HB3 SER 3 2HB SER 3 12.215 3.163 10.432 13 HG SER 3 HG SER 3 10.198 3.024 11.163 14 H GLY 4 H GLY 4 14.875 0.432 12.927 15 HA2 GLY 4 1HA GLY 4 14.090 0.823 15.554 16 HA3 GLY 4 2HA GLY 4 13.306 -0.660 15.033 17 H SER 5 H SER 5 15.316 -0.341 17.089 18 HA SER 5 HA SER 5 17.203 -1.356 17.852 19 HB2 SER 5 1HB SER 5 16.374 -3.154 15.588 20 HB3 SER 5 2HB SER 5 17.891 -3.457 16.453 21 HG SER 5 HG SER 5 15.569 -4.272 17.195 22 H SER 6 H SER 6 19.504 -1.924 17.285 23 HA SER 6 HA SER 6 20.439 -0.428 14.931 24 HB2 SER 6 1HB SER 6 20.827 0.262 17.697 25 HB3 SER 6 2HB SER 6 22.390 -0.140 16.965 26 HG SER 6 HG SER 6 21.918 2.051 16.647 27 H GLY 7 H GLY 7 21.347 -1.908 13.657 28 HA2 GLY 7 1HA GLY 7 23.626 -3.387 14.555 29 HA3 GLY 7 2HA GLY 7 22.231 -4.426 14.309 30 H SER 8 H SER 8 24.121 -5.187 12.779 31 HA SER 8 HA SER 8 24.392 -3.727 10.329 32 HB2 SER 8 1HB SER 8 25.291 -6.422 11.315 33 HB3 SER 8 2HB SER 8 25.403 -6.026 9.591 34 HG SER 8 HG SER 8 26.565 -4.086 10.304 35 H ASP 9 H ASP 9 23.036 -3.713 8.671 36 HA ASP 9 HA ASP 9 21.586 -6.057 7.863 37 HB2 ASP 9 1HB ASP 9 19.338 -4.977 8.015 38 HB3 ASP 9 2HB ASP 9 20.061 -5.343 9.586 39 H SER 10 H SER 10 22.808 -5.658 5.968 40 HA SER 10 HA SER 10 22.280 -3.202 4.496 41 HB2 SER 10 1HB SER 10 24.109 -5.564 4.006 42 HB3 SER 10 2HB SER 10 23.879 -4.266 2.819 43 HG SER 10 HG SER 10 25.674 -4.123 4.481 44 H LEU 11 H LEU 11 20.866 -3.019 2.877 45 HA LEU 11 HA LEU 11 19.786 -5.471 1.663 46 HB2 LEU 11 1HB LEU 11 18.171 -3.037 2.443 47 HB3 LEU 11 2HB LEU 11 17.560 -4.504 1.661 48 HG LEU 11 HG LEU 11 18.862 -4.691 4.347 49 HD11 LEU 11 1HD1 LEU 11 16.228 -4.576 4.968 50 HD12 LEU 11 2HD1 LEU 11 16.334 -3.343 3.712 51 HD13 LEU 11 3HD1 LEU 11 17.356 -3.232 5.146 52 HD21 LEU 11 3HD2 LEU 11 16.469 -6.243 3.705 53 HD22 LEU 11 1HD2 LEU 11 18.022 -6.765 4.362 54 HD23 LEU 11 2HD2 LEU 11 17.830 -6.541 2.622 55 H VAL 12 H VAL 12 18.353 -4.770 -0.321 56 HA VAL 12 HA VAL 12 20.099 -3.146 -2.002 57 HB VAL 12 HB VAL 12 19.440 -5.337 -2.855 58 HG11 VAL 12 1HG1 VAL 12 16.958 -5.456 -3.646 59 HG12 VAL 12 2HG1 VAL 12 17.373 -5.865 -1.980 60 HG13 VAL 12 3HG1 VAL 12 16.690 -4.281 -2.358 61 HG21 VAL 12 3HG2 VAL 12 19.133 -2.853 -4.211 62 HG22 VAL 12 1HG2 VAL 12 19.641 -4.411 -4.863 63 HG23 VAL 12 2HG2 VAL 12 17.929 -3.982 -4.833 64 H VAL 13 H VAL 13 18.699 -1.636 -0.153 65 HA VAL 13 HA VAL 13 16.276 -0.593 -0.577 66 HB VAL 13 HB VAL 13 18.820 0.981 -0.174 67 HG11 VAL 13 1HG1 VAL 13 15.948 1.874 -0.094 68 HG12 VAL 13 2HG1 VAL 13 17.248 2.754 0.712 69 HG13 VAL 13 3HG1 VAL 13 17.275 2.548 -1.040 70 HG21 VAL 13 3HG2 VAL 13 16.703 0.419 1.871 71 HG22 VAL 13 1HG2 VAL 13 17.970 -0.760 1.528 72 HG23 VAL 13 2HG2 VAL 13 18.395 0.850 2.112 73 H CYS 14 H CYS 14 15.241 0.846 -1.944 74 HA CYS 14 HA CYS 14 16.636 1.433 -4.473 75 HB2 CYS 14 1HB CYS 14 13.698 0.817 -4.109 76 HB3 CYS 14 2HB CYS 14 14.517 1.134 -5.648 77 HG CYS 14 HG CYS 14 15.124 -1.301 -6.153 78 H GLU 15 H GLU 15 14.942 3.078 -5.712 79 HA GLU 15 HA GLU 15 14.671 5.342 -3.846 80 HB2 GLU 15 1HB GLU 15 15.096 6.830 -5.724 81 HB3 GLU 15 2HB GLU 15 16.419 5.667 -5.546 82 HG2 GLU 15 1HG GLU 15 14.828 4.350 -7.302 83 HG3 GLU 15 2HG GLU 15 14.514 6.033 -7.745 84 H VAL 16 H VAL 16 12.962 6.884 -4.314 85 HA VAL 16 HA VAL 16 10.525 5.521 -5.107 86 HB VAL 16 HB VAL 16 10.425 6.823 -3.077 87 HG11 VAL 16 1HG1 VAL 16 10.601 9.478 -4.219 88 HG12 VAL 16 2HG1 VAL 16 11.410 8.802 -2.803 89 HG13 VAL 16 3HG1 VAL 16 12.109 8.583 -4.407 90 HG21 VAL 16 3HG2 VAL 16 8.439 8.028 -3.483 91 HG22 VAL 16 1HG2 VAL 16 8.905 8.389 -5.146 92 HG23 VAL 16 2HG2 VAL 16 8.464 6.743 -4.690 93 H ASP 17 H ASP 17 10.465 5.375 -7.306 94 HA ASP 17 HA ASP 17 11.336 6.905 -9.298 95 HB2 ASP 17 1HB ASP 17 9.900 4.908 -9.600 96 HB3 ASP 17 2HB ASP 17 8.490 5.886 -9.173 97 HA PRO 18 HA PRO 18 9.808 11.010 -8.839 98 HB2 PRO 18 2HB PRO 18 11.511 11.634 -10.250 99 HB3 PRO 18 1HB PRO 18 10.202 11.888 -11.404 100 HG2 PRO 18 1HG PRO 18 10.505 9.820 -12.416 101 HG3 PRO 18 2HG PRO 18 12.202 10.246 -11.984 102 HD2 PRO 18 1HD PRO 18 11.045 7.905 -11.241 103 HD3 PRO 18 2HD PRO 18 12.236 8.745 -10.235 104 H GLU 19 H GLU 19 8.639 9.034 -11.535 105 HA GLU 19 HA GLU 19 6.375 10.663 -12.100 106 HB2 GLU 19 1HB GLU 19 5.873 9.161 -13.748 107 HB3 GLU 19 2HB GLU 19 7.585 8.779 -13.512 108 HG2 GLU 19 1HG GLU 19 6.943 6.664 -13.285 109 HG3 GLU 19 2HG GLU 19 6.351 7.146 -11.689 110 H LEU 20 H LEU 20 7.038 8.160 -9.807 111 HA LEU 20 HA LEU 20 4.231 7.701 -9.216 112 HB2 LEU 20 1HB LEU 20 6.251 6.009 -9.145 113 HB3 LEU 20 2HB LEU 20 6.446 6.666 -7.511 114 HG LEU 20 HG LEU 20 4.035 5.217 -8.600 115 HD11 LEU 20 1HD1 LEU 20 5.623 3.600 -8.084 116 HD12 LEU 20 2HD1 LEU 20 4.669 3.717 -6.606 117 HD13 LEU 20 3HD1 LEU 20 6.242 4.507 -6.704 118 HD21 LEU 20 3HD2 LEU 20 3.084 6.770 -7.165 119 HD22 LEU 20 1HD2 LEU 20 4.468 6.762 -6.073 120 HD23 LEU 20 2HD2 LEU 20 3.366 5.385 -6.109 121 H LYS 21 H LYS 21 7.003 9.373 -7.867 122 HA LYS 21 HA LYS 21 6.194 9.903 -5.299 123 HB2 LYS 21 1HB LYS 21 8.350 10.596 -6.430 124 HB3 LYS 21 2HB LYS 21 7.458 11.975 -7.093 125 HG2 LYS 21 1HG LYS 21 6.830 12.274 -4.505 126 HG3 LYS 21 2HG LYS 21 8.406 11.477 -4.342 127 HD2 LYS 21 1HD LYS 21 8.333 13.636 -6.343 128 HD3 LYS 21 2HD LYS 21 8.048 14.157 -4.674 129 HE2 LYS 21 1HE LYS 21 10.143 12.555 -4.231 130 HE3 LYS 21 2HE LYS 21 10.479 12.993 -5.912 131 HZ1 LYS 21 3HZ LYS 21 11.530 14.502 -4.312 132 HZ2 LYS 21 1HZ LYS 21 10.007 14.946 -3.726 133 HZ3 LYS 21 2HZ LYS 21 10.438 15.311 -5.320 134 H GLU 22 H GLU 22 5.341 11.744 -8.222 135 HA GLU 22 HA GLU 22 3.727 13.651 -6.922 136 HB2 GLU 22 1HB GLU 22 3.243 12.721 -9.744 137 HB3 GLU 22 2HB GLU 22 3.047 14.343 -9.062 138 HG2 GLU 22 1HG GLU 22 5.628 14.190 -8.678 139 HG3 GLU 22 2HG GLU 22 5.530 12.947 -9.932 140 H THR 23 H THR 23 2.922 10.589 -8.526 141 HA THR 23 HA THR 23 0.204 10.592 -8.473 142 HB THR 23 HB THR 23 2.149 8.364 -7.949 143 HG1 THR 23 1HG THR 23 1.622 7.831 -10.023 144 HG21 THR 23 3HG2 THR 23 -0.797 8.341 -7.587 145 HG22 THR 23 1HG2 THR 23 0.447 7.384 -6.786 146 HG23 THR 23 2HG2 THR 23 -0.069 6.967 -8.420 147 H LEU 24 H LEU 24 2.347 9.904 -5.738 148 HA LEU 24 HA LEU 24 0.247 9.304 -3.913 149 HB2 LEU 24 1HB LEU 24 2.967 10.311 -3.121 150 HB3 LEU 24 2HB LEU 24 1.900 9.193 -2.256 151 HG LEU 24 HG LEU 24 3.392 8.559 -4.801 152 HD11 LEU 24 1HD1 LEU 24 5.121 7.900 -3.573 153 HD12 LEU 24 2HD1 LEU 24 4.080 7.015 -2.460 154 HD13 LEU 24 3HD1 LEU 24 4.377 8.735 -2.209 155 HD21 LEU 24 3HD2 LEU 24 2.281 6.421 -3.115 156 HD22 LEU 24 1HD2 LEU 24 2.344 6.569 -4.871 157 HD23 LEU 24 2HD2 LEU 24 1.091 7.411 -3.961 158 H ARG 25 H ARG 25 2.391 12.142 -4.204 159 HA ARG 25 HA ARG 25 1.347 13.766 -2.283 160 HB2 ARG 25 1HB ARG 25 3.279 14.326 -3.728 161 HB3 ARG 25 2HB ARG 25 2.157 14.661 -5.055 162 HG2 ARG 25 1HG ARG 25 1.370 16.608 -4.102 163 HG3 ARG 25 2HG ARG 25 1.837 16.108 -2.468 164 HD2 ARG 25 1HD ARG 25 3.765 17.206 -2.654 165 HD3 ARG 25 2HD ARG 25 4.188 16.217 -4.058 166 HE ARG 25 HE ARG 25 3.797 18.041 -5.356 167 HH11 ARG 25 2HH1 ARG 25 1.932 18.361 -2.434 168 HH12 ARG 25 1HH1 ARG 25 1.313 19.926 -2.845 169 HH21 ARG 25 1HH2 ARG 25 1.914 20.914 -4.822 170 HH22 ARG 25 2HH2 ARG 25 2.989 20.101 -5.908 171 H LYS 26 H LYS 26 -0.129 12.841 -5.285 172 HA LYS 26 HA LYS 26 -2.239 14.835 -5.028 173 HB2 LYS 26 1HB LYS 26 -2.259 12.644 -7.075 174 HB3 LYS 26 2HB LYS 26 -2.868 14.302 -7.200 175 HG2 LYS 26 1HG LYS 26 -0.115 14.571 -6.787 176 HG3 LYS 26 2HG LYS 26 -0.302 13.238 -7.940 177 HD2 LYS 26 1HD LYS 26 -1.982 14.840 -9.131 178 HD3 LYS 26 2HD LYS 26 -1.143 16.097 -8.205 179 HE2 LYS 26 1HE LYS 26 0.626 16.053 -9.572 180 HE3 LYS 26 2HE LYS 26 0.736 14.290 -9.455 181 HZ1 LYS 26 3HZ LYS 26 0.337 15.062 -11.731 182 HZ2 LYS 26 1HZ LYS 26 -1.131 15.750 -11.246 183 HZ3 LYS 26 2HZ LYS 26 -0.918 14.073 -11.174 184 H PHE 27 H PHE 27 -1.884 11.301 -5.039 185 HA PHE 27 HA PHE 27 -4.520 10.565 -4.684 186 HB2 PHE 27 1HB PHE 27 -2.401 9.108 -4.980 187 HB3 PHE 27 2HB PHE 27 -2.291 9.170 -3.221 188 HD1 PHE 27 2HD PHE 27 -4.833 8.443 -5.854 189 HD2 PHE 27 1HD PHE 27 -3.275 7.492 -2.008 190 HE1 PHE 27 2HE PHE 27 -6.436 6.585 -5.667 191 HE2 PHE 27 1HE PHE 27 -4.875 5.632 -1.817 192 HZ PHE 27 HZ PHE 27 -6.458 5.177 -3.647 193 H ARG 28 H ARG 28 -2.425 12.176 -2.492 194 HA ARG 28 HA ARG 28 -3.975 11.498 -0.138 195 HB2 ARG 28 1HB ARG 28 -1.907 13.674 -0.232 196 HB3 ARG 28 2HB ARG 28 -2.344 12.605 1.108 197 HG2 ARG 28 1HG ARG 28 -1.424 10.861 -0.839 198 HG3 ARG 28 2HG ARG 28 -0.343 12.259 -0.954 199 HD2 ARG 28 1HD ARG 28 -0.994 10.761 1.596 200 HD3 ARG 28 2HD ARG 28 0.477 10.565 0.634 201 HE ARG 28 HE ARG 28 1.196 12.697 1.325 202 HH11 ARG 28 2HH1 ARG 28 -1.863 11.788 2.719 203 HH12 ARG 28 1HH1 ARG 28 -1.798 12.988 3.967 204 HH21 ARG 28 1HH2 ARG 28 -0.005 14.406 4.103 205 HH22 ARG 28 2HH2 ARG 28 1.292 14.282 2.963 206 H PHE 29 H PHE 29 -3.746 14.062 -2.477 207 HA PHE 29 HA PHE 29 -5.887 15.495 -1.052 208 HB2 PHE 29 1HB PHE 29 -4.136 17.070 -2.855 209 HB3 PHE 29 2HB PHE 29 -4.878 17.523 -1.318 210 HD1 PHE 29 1HD PHE 29 -3.908 15.718 0.632 211 HD2 PHE 29 2HD PHE 29 -1.852 17.334 -2.727 212 HE1 PHE 29 1HE PHE 29 -1.763 15.395 1.793 213 HE2 PHE 29 2HE PHE 29 0.296 17.013 -1.572 214 HZ PHE 29 HZ PHE 29 0.343 16.041 0.691 215 H ARG 30 H ARG 30 -6.266 13.475 -2.998 216 HA ARG 30 HA ARG 30 -6.890 14.825 -5.493 217 HB2 ARG 30 1HB ARG 30 -7.748 12.518 -6.139 218 HB3 ARG 30 2HB ARG 30 -6.015 12.655 -5.802 219 HG2 ARG 30 1HG ARG 30 -6.312 11.698 -3.601 220 HG3 ARG 30 2HG ARG 30 -8.066 11.645 -3.844 221 HD2 ARG 30 1HD ARG 30 -6.588 10.329 -5.994 222 HD3 ARG 30 2HD ARG 30 -6.290 9.614 -4.404 223 HE ARG 30 HE ARG 30 -8.721 9.495 -5.920 224 HH11 ARG 30 2HH1 ARG 30 -7.352 9.381 -2.721 225 HH12 ARG 30 1HH1 ARG 30 -8.663 8.467 -2.051 226 HH21 ARG 30 1HH2 ARG 30 -10.426 7.848 -3.377 227 HH22 ARG 30 2HH2 ARG 30 -10.453 8.292 -5.050 228 H LYS 31 H LYS 31 -9.155 13.778 -6.395 229 HA LYS 31 HA LYS 31 -11.167 15.254 -5.101 230 HB2 LYS 31 1HB LYS 31 -11.087 13.246 -7.310 231 HB3 LYS 31 2HB LYS 31 -12.658 13.652 -6.602 232 HG2 LYS 31 1HG LYS 31 -11.605 16.131 -7.005 233 HG3 LYS 31 2HG LYS 31 -10.927 15.221 -8.366 234 HD2 LYS 31 1HD LYS 31 -13.662 14.478 -8.112 235 HD3 LYS 31 2HD LYS 31 -13.565 16.246 -8.052 236 HE2 LYS 31 1HE LYS 31 -11.895 14.953 -10.121 237 HE3 LYS 31 2HE LYS 31 -13.645 14.811 -10.342 238 HZ1 LYS 31 3HZ LYS 31 -13.489 17.381 -9.776 239 HZ2 LYS 31 1HZ LYS 31 -13.330 16.790 -11.353 240 HZ3 LYS 31 2HZ LYS 31 -11.952 17.180 -10.452 241 H GLU 32 H GLU 32 -9.794 12.339 -4.230 242 HA GLU 32 HA GLU 32 -10.565 10.490 -3.050 243 HB2 GLU 32 1HB GLU 32 -11.615 12.709 -1.287 244 HB3 GLU 32 2HB GLU 32 -11.019 11.120 -0.787 245 HG2 GLU 32 1HG GLU 32 -9.001 11.970 -0.493 246 HG3 GLU 32 2HG GLU 32 -8.931 12.353 -2.218 247 H THR 33 H THR 33 -12.902 11.176 -1.096 248 HA THR 33 HA THR 33 -15.091 10.550 -0.952 249 HB THR 33 HB THR 33 -16.598 11.777 -2.221 250 HG1 THR 33 1HG THR 33 -15.996 12.501 -4.402 251 HG21 THR 33 3HG2 THR 33 -15.758 13.770 -1.694 252 HG22 THR 33 1HG2 THR 33 -14.678 13.711 -3.085 253 HG23 THR 33 2HG2 THR 33 -14.161 13.039 -1.539 254 H ASN 34 H ASN 34 -13.105 8.899 -2.653 255 HA ASN 34 HA ASN 34 -15.061 6.932 -3.465 256 HB2 ASN 34 1HB ASN 34 -14.536 6.795 -5.744 257 HB3 ASN 34 2HB ASN 34 -14.647 8.535 -5.445 258 HD21 ASN 34 2HD2 ASN 34 -11.045 6.819 -6.294 259 HD22 ASN 34 1HD2 ASN 34 -12.381 5.863 -5.757 260 H ASN 35 H ASN 35 -14.337 5.064 -2.711 261 HA ASN 35 HA ASN 35 -11.780 4.662 -1.660 262 HB2 ASN 35 1HB ASN 35 -13.968 2.755 -2.489 263 HB3 ASN 35 2HB ASN 35 -12.445 2.181 -1.796 264 HD21 ASN 35 2HD2 ASN 35 -14.824 2.482 0.969 265 HD22 ASN 35 1HD2 ASN 35 -14.670 1.555 -0.481 266 H ALA 36 H ALA 36 -9.912 4.523 -2.696 267 HA ALA 36 HA ALA 36 -9.791 2.997 -5.203 268 HB1 ALA 36 3HB ALA 36 -8.551 4.627 -6.340 269 HB2 ALA 36 1HB ALA 36 -9.860 5.522 -5.567 270 HB3 ALA 36 2HB ALA 36 -8.240 5.545 -4.866 271 H ALA 37 H ALA 37 -7.537 2.384 -5.779 272 HA ALA 37 HA ALA 37 -5.707 2.270 -3.496 273 HB1 ALA 37 3HB ALA 37 -6.163 -0.241 -5.044 274 HB2 ALA 37 1HB ALA 37 -5.543 -0.024 -3.407 275 HB3 ALA 37 2HB ALA 37 -7.264 0.190 -3.735 276 H ILE 38 H ILE 38 -3.549 2.152 -4.038 277 HA ILE 38 HA ILE 38 -2.929 2.201 -6.919 278 HB ILE 38 HB ILE 38 -1.531 3.798 -4.770 279 HG12 ILE 38 1HG1 ILE 38 -3.626 4.517 -6.815 280 HG13 ILE 38 2HG1 ILE 38 -3.627 4.841 -5.073 281 HG21 ILE 38 1HG2 ILE 38 -0.315 4.833 -6.581 282 HG22 ILE 38 2HG2 ILE 38 -0.103 3.084 -6.653 283 HG23 ILE 38 3HG2 ILE 38 -1.213 3.883 -7.766 284 HD11 ILE 38 3HD1 ILE 38 -3.239 6.863 -6.410 285 HD12 ILE 38 1HD1 ILE 38 -1.897 6.498 -5.326 286 HD13 ILE 38 2HD1 ILE 38 -1.764 6.137 -7.047 287 H ILE 39 H ILE 39 -2.075 0.230 -7.259 288 HA ILE 39 HA ILE 39 -0.273 -0.967 -5.325 289 HB ILE 39 HB ILE 39 -1.088 -2.009 -8.040 290 HG12 ILE 39 1HG1 ILE 39 -2.197 -3.253 -5.609 291 HG13 ILE 39 2HG1 ILE 39 -2.768 -1.604 -5.920 292 HG21 ILE 39 1HG2 ILE 39 0.242 -3.317 -5.674 293 HG22 ILE 39 2HG2 ILE 39 -0.409 -4.196 -7.056 294 HG23 ILE 39 3HG2 ILE 39 0.923 -3.062 -7.280 295 HD11 ILE 39 3HD1 ILE 39 -4.291 -3.171 -6.910 296 HD12 ILE 39 1HD1 ILE 39 -3.448 -2.294 -8.186 297 HD13 ILE 39 2HD1 ILE 39 -2.977 -3.948 -7.792 298 H MET 40 H MET 40 1.798 -0.411 -5.301 299 HA MET 40 HA MET 40 3.101 0.287 -7.847 300 HB2 MET 40 1HB MET 40 4.177 0.983 -5.122 301 HB3 MET 40 2HB MET 40 4.555 1.726 -6.684 302 HG2 MET 40 1HG MET 40 2.716 3.065 -6.671 303 HG3 MET 40 2HG MET 40 1.752 1.899 -5.763 304 HE1 MET 40 3HE MET 40 1.406 1.766 -3.469 305 HE2 MET 40 1HE MET 40 1.788 3.026 -2.297 306 HE3 MET 40 2HE MET 40 0.735 3.385 -3.665 307 H LYS 41 H LYS 41 5.238 -0.468 -8.232 308 HA LYS 41 HA LYS 41 6.118 -2.703 -6.543 309 HB2 LYS 41 1HB LYS 41 6.535 -4.115 -8.434 310 HB3 LYS 41 2HB LYS 41 4.856 -3.558 -8.526 311 HG2 LYS 41 1HG LYS 41 5.183 -2.433 -10.443 312 HG3 LYS 41 2HG LYS 41 6.793 -1.876 -9.954 313 HD2 LYS 41 1HD LYS 41 7.818 -3.909 -10.603 314 HD3 LYS 41 2HD LYS 41 6.254 -4.729 -10.743 315 HE2 LYS 41 1HE LYS 41 5.668 -3.493 -12.697 316 HE3 LYS 41 2HE LYS 41 7.030 -2.387 -12.467 317 HZ1 LYS 41 3HZ LYS 41 7.878 -3.771 -14.045 318 HZ2 LYS 41 1HZ LYS 41 7.020 -5.126 -13.507 319 HZ3 LYS 41 2HZ LYS 41 8.389 -4.602 -12.663 320 H VAL 42 H VAL 42 8.385 -3.458 -7.390 321 HA VAL 42 HA VAL 42 9.982 -1.055 -7.998 322 HB VAL 42 HB VAL 42 10.610 -1.382 -5.816 323 HG11 VAL 42 1HG1 VAL 42 9.499 -3.130 -4.914 324 HG12 VAL 42 2HG1 VAL 42 9.784 -4.172 -6.310 325 HG13 VAL 42 3HG1 VAL 42 11.055 -3.937 -5.109 326 HG21 VAL 42 3HG2 VAL 42 12.591 -1.559 -7.257 327 HG22 VAL 42 1HG2 VAL 42 12.783 -2.474 -5.762 328 HG23 VAL 42 2HG2 VAL 42 12.418 -3.314 -7.269 329 H ASP 43 H ASP 43 11.006 -1.227 -9.869 330 HA ASP 43 HA ASP 43 11.302 -3.767 -11.189 331 HB2 ASP 43 1HB ASP 43 11.882 -0.909 -11.902 332 HB3 ASP 43 2HB ASP 43 12.577 -2.213 -12.874 333 H LYS 44 H LYS 44 12.986 -5.085 -11.050 334 HA LYS 44 HA LYS 44 15.256 -4.457 -9.459 335 HB2 LYS 44 1HB LYS 44 14.318 -6.737 -9.669 336 HB3 LYS 44 2HB LYS 44 14.848 -6.774 -11.358 337 HG2 LYS 44 1HG LYS 44 16.930 -6.150 -9.350 338 HG3 LYS 44 2HG LYS 44 16.278 -7.798 -9.342 339 HD2 LYS 44 1HD LYS 44 16.804 -8.053 -11.712 340 HD3 LYS 44 2HD LYS 44 17.407 -6.388 -11.761 341 HE2 LYS 44 1HE LYS 44 19.059 -7.070 -9.948 342 HE3 LYS 44 2HE LYS 44 18.571 -8.737 -10.284 343 HZ1 LYS 44 3HZ LYS 44 20.537 -7.393 -11.568 344 HZ2 LYS 44 1HZ LYS 44 19.247 -7.257 -12.652 345 HZ3 LYS 44 2HZ LYS 44 19.770 -8.785 -12.147 346 H ASP 45 H ASP 45 14.510 -4.052 -12.781 347 HA ASP 45 HA ASP 45 17.225 -4.015 -13.723 348 HB2 ASP 45 1HB ASP 45 15.148 -4.562 -15.106 349 HB3 ASP 45 2HB ASP 45 14.834 -2.822 -15.123 350 H ARG 46 H ARG 46 14.989 -1.723 -12.388 351 HA ARG 46 HA ARG 46 16.960 0.422 -12.841 352 HB2 ARG 46 1HB ARG 46 13.983 0.797 -12.457 353 HB3 ARG 46 2HB ARG 46 15.172 2.027 -12.911 354 HG2 ARG 46 1HG ARG 46 15.502 1.034 -15.065 355 HG3 ARG 46 2HG ARG 46 14.510 -0.363 -14.615 356 HD2 ARG 46 1HD ARG 46 12.797 0.727 -15.565 357 HD3 ARG 46 2HD ARG 46 12.829 1.754 -14.124 358 HE ARG 46 HE ARG 46 14.628 2.959 -15.716 359 HH11 ARG 46 2HH1 ARG 46 11.379 1.840 -16.278 360 HH12 ARG 46 1HH1 ARG 46 11.030 3.048 -17.470 361 HH21 ARG 46 1HH2 ARG 46 12.625 4.590 -18.042 362 HH22 ARG 46 2HH2 ARG 46 14.181 4.554 -17.284 363 H GLN 47 H GLN 47 15.927 -1.622 -10.578 364 HA GLN 47 HA GLN 47 15.561 -1.548 -8.298 365 HB2 GLN 47 1HB GLN 47 17.913 0.334 -8.335 366 HB3 GLN 47 2HB GLN 47 17.529 -0.932 -7.158 367 HG2 GLN 47 1HG GLN 47 17.901 -1.948 -9.873 368 HG3 GLN 47 2HG GLN 47 19.329 -1.146 -9.205 369 HE21 GLN 47 2HE2 GLN 47 18.050 -4.706 -7.722 370 HE22 GLN 47 1HE2 GLN 47 17.084 -3.781 -8.815 371 H MET 48 H MET 48 13.692 0.070 -9.199 372 HA MET 48 HA MET 48 13.653 2.210 -7.223 373 HB2 MET 48 1HB MET 48 13.356 3.972 -8.652 374 HB3 MET 48 2HB MET 48 14.426 2.965 -9.640 375 HG2 MET 48 1HG MET 48 12.126 1.974 -10.503 376 HG3 MET 48 2HG MET 48 11.537 3.551 -9.971 377 HE1 MET 48 3HE MET 48 13.715 5.392 -10.251 378 HE2 MET 48 1HE MET 48 14.129 5.854 -11.903 379 HE3 MET 48 2HE MET 48 12.468 6.016 -11.332 380 H VAL 49 H VAL 49 11.551 2.902 -6.651 381 HA VAL 49 HA VAL 49 9.535 0.868 -7.033 382 HB VAL 49 HB VAL 49 9.389 3.445 -5.463 383 HG11 VAL 49 1HG1 VAL 49 7.571 1.058 -5.644 384 HG12 VAL 49 2HG1 VAL 49 7.543 2.168 -4.272 385 HG13 VAL 49 3HG1 VAL 49 7.178 2.760 -5.894 386 HG21 VAL 49 3HG2 VAL 49 10.161 0.645 -4.672 387 HG22 VAL 49 1HG2 VAL 49 11.104 2.126 -4.502 388 HG23 VAL 49 2HG2 VAL 49 9.672 1.873 -3.504 389 H VAL 50 H VAL 50 8.452 0.909 -8.904 390 HA VAL 50 HA VAL 50 7.412 3.503 -9.843 391 HB VAL 50 HB VAL 50 7.304 2.481 -12.108 392 HG11 VAL 50 1HG1 VAL 50 10.117 2.319 -11.072 393 HG12 VAL 50 2HG1 VAL 50 9.547 2.901 -12.638 394 HG13 VAL 50 3HG1 VAL 50 9.254 3.853 -11.181 395 HG21 VAL 50 3HG2 VAL 50 9.152 0.326 -11.196 396 HG22 VAL 50 1HG2 VAL 50 7.412 0.104 -11.006 397 HG23 VAL 50 2HG2 VAL 50 8.096 0.382 -12.607 398 H LEU 51 H LEU 51 5.267 3.682 -10.322 399 HA LEU 51 HA LEU 51 3.392 2.154 -9.024 400 HB2 LEU 51 1HB LEU 51 3.215 4.435 -10.283 401 HB3 LEU 51 2HB LEU 51 2.708 3.421 -11.644 402 HG LEU 51 HG LEU 51 1.254 2.891 -9.154 403 HD11 LEU 51 1HD1 LEU 51 1.760 5.473 -9.336 404 HD12 LEU 51 2HD1 LEU 51 0.169 4.877 -8.865 405 HD13 LEU 51 3HD1 LEU 51 0.458 5.407 -10.523 406 HD21 LEU 51 3HD2 LEU 51 0.928 2.550 -11.918 407 HD22 LEU 51 1HD2 LEU 51 -0.314 3.698 -11.419 408 HD23 LEU 51 2HD2 LEU 51 -0.207 2.120 -10.637 409 H GLU 52 H GLU 52 2.134 0.399 -9.491 410 HA GLU 52 HA GLU 52 2.932 -1.152 -11.861 411 HB2 GLU 52 1HB GLU 52 3.383 -2.195 -9.661 412 HB3 GLU 52 2HB GLU 52 1.650 -2.128 -9.303 413 HG2 GLU 52 1HG GLU 52 2.227 -4.351 -10.003 414 HG3 GLU 52 2HG GLU 52 1.217 -3.587 -11.238 415 H ASP 53 H ASP 53 0.125 -0.222 -9.906 416 HA ASP 53 HA ASP 53 -1.533 -0.121 -12.259 417 HB2 ASP 53 1HB ASP 53 -1.762 -2.333 -10.264 418 HB3 ASP 53 2HB ASP 53 -3.252 -1.651 -10.927 419 H GLU 54 H GLU 54 -3.781 0.602 -11.703 420 HA GLU 54 HA GLU 54 -4.056 1.885 -9.107 421 HB2 GLU 54 1HB GLU 54 -3.486 3.318 -11.626 422 HB3 GLU 54 2HB GLU 54 -4.827 3.969 -10.671 423 HG2 GLU 54 1HG GLU 54 -3.437 4.356 -8.790 424 HG3 GLU 54 2HG GLU 54 -2.111 3.429 -9.508 425 H LEU 55 H LEU 55 -5.977 1.167 -8.472 426 HA LEU 55 HA LEU 55 -8.175 1.115 -10.434 427 HB2 LEU 55 1HB LEU 55 -7.984 -0.519 -7.903 428 HB3 LEU 55 2HB LEU 55 -9.167 -0.682 -9.212 429 HG LEU 55 HG LEU 55 -6.260 -1.134 -9.762 430 HD11 LEU 55 1HD1 LEU 55 -6.386 -2.633 -8.032 431 HD12 LEU 55 2HD1 LEU 55 -6.967 -3.625 -9.370 432 HD13 LEU 55 3HD1 LEU 55 -8.115 -2.902 -8.244 433 HD21 LEU 55 3HD2 LEU 55 -7.275 -1.316 -11.767 434 HD22 LEU 55 1HD2 LEU 55 -8.856 -1.649 -11.058 435 HD23 LEU 55 2HD2 LEU 55 -7.660 -2.939 -11.191 436 H GLN 56 H GLN 56 -9.860 2.404 -10.072 437 HA GLN 56 HA GLN 56 -10.055 3.717 -7.448 438 HB2 GLN 56 1HB GLN 56 -11.072 4.605 -10.158 439 HB3 GLN 56 2HB GLN 56 -11.316 5.487 -8.642 440 HG2 GLN 56 1HG GLN 56 -9.528 6.575 -9.676 441 HG3 GLN 56 2HG GLN 56 -8.788 5.548 -8.440 442 HE21 GLN 56 2HE2 GLN 56 -6.848 3.749 -10.657 443 HE22 GLN 56 1HE2 GLN 56 -7.282 4.124 -9.027 444 H ASN 57 H ASN 57 -12.271 4.293 -6.736 445 HA ASN 57 HA ASN 57 -14.286 3.547 -5.969 446 HB2 ASN 57 1HB ASN 57 -14.693 2.845 -8.890 447 HB3 ASN 57 2HB ASN 57 -15.961 3.131 -7.691 448 HD21 ASN 57 2HD2 ASN 57 -13.860 6.292 -9.212 449 HD22 ASN 57 1HD2 ASN 57 -13.188 4.699 -9.223 450 H ILE 58 H ILE 58 -12.411 1.699 -5.419 451 HA ILE 58 HA ILE 58 -13.754 -0.855 -6.020 452 HB ILE 58 HB ILE 58 -11.813 -1.512 -6.906 453 HG12 ILE 58 1HG1 ILE 58 -11.807 -2.459 -4.523 454 HG13 ILE 58 2HG1 ILE 58 -10.278 -2.501 -5.418 455 HG21 ILE 58 1HG2 ILE 58 -10.907 0.585 -7.341 456 HG22 ILE 58 2HG2 ILE 58 -10.696 0.957 -5.630 457 HG23 ILE 58 3HG2 ILE 58 -9.639 -0.218 -6.414 458 HD11 ILE 58 3HD1 ILE 58 -10.717 -1.437 -2.881 459 HD12 ILE 58 1HD1 ILE 58 -9.258 -1.308 -3.863 460 HD13 ILE 58 2HD1 ILE 58 -10.490 -0.048 -3.944 461 H SER 59 H SER 59 -14.165 -2.231 -4.343 462 HA SER 59 HA SER 59 -14.052 -1.089 -1.689 463 HB2 SER 59 1HB SER 59 -15.605 -3.131 -3.056 464 HB3 SER 59 2HB SER 59 -15.028 -3.704 -1.482 465 HG SER 59 HG SER 59 -16.108 -1.135 -1.598 466 HA PRO 60 HA PRO 60 -10.677 -3.313 0.017 467 HB2 PRO 60 2HB PRO 60 -11.331 -2.611 2.104 468 HB3 PRO 60 1HB PRO 60 -11.644 -4.325 2.370 469 HG2 PRO 60 1HG PRO 60 -13.912 -4.126 1.906 470 HG3 PRO 60 2HG PRO 60 -13.578 -2.540 2.696 471 HD2 PRO 60 1HD PRO 60 -14.746 -2.743 0.253 472 HD3 PRO 60 2HD PRO 60 -13.661 -1.411 0.688 473 H GLU 61 H GLU 61 -13.246 -4.945 -1.245 474 HA GLU 61 HA GLU 61 -12.228 -7.599 -0.515 475 HB2 GLU 61 1HB GLU 61 -14.855 -6.527 -1.346 476 HB3 GLU 61 2HB GLU 61 -14.432 -8.111 -2.012 477 HG2 GLU 61 1HG GLU 61 -14.015 -8.941 0.280 478 HG3 GLU 61 2HG GLU 61 -14.550 -7.373 0.904 479 H GLU 62 H GLU 62 -12.610 -5.390 -3.179 480 HA GLU 62 HA GLU 62 -11.979 -7.332 -5.207 481 HB2 GLU 62 1HB GLU 62 -12.497 -4.394 -5.125 482 HB3 GLU 62 2HB GLU 62 -11.615 -5.048 -6.514 483 HG2 GLU 62 1HG GLU 62 -14.079 -6.491 -5.766 484 HG3 GLU 62 2HG GLU 62 -14.290 -4.850 -6.395 485 H LEU 63 H LEU 63 -10.265 -4.704 -3.562 486 HA LEU 63 HA LEU 63 -7.895 -4.682 -4.958 487 HB2 LEU 63 1HB LEU 63 -8.843 -3.546 -2.630 488 HB3 LEU 63 2HB LEU 63 -7.490 -4.546 -2.074 489 HG LEU 63 HG LEU 63 -7.459 -2.152 -3.867 490 HD11 LEU 63 1HD1 LEU 63 -7.036 -1.597 -1.641 491 HD12 LEU 63 2HD1 LEU 63 -5.432 -1.723 -2.363 492 HD13 LEU 63 3HD1 LEU 63 -6.058 -3.039 -1.369 493 HD21 LEU 63 3HD2 LEU 63 -6.004 -3.139 -5.236 494 HD22 LEU 63 1HD2 LEU 63 -5.859 -4.553 -4.192 495 HD23 LEU 63 2HD2 LEU 63 -4.873 -3.123 -3.882 496 H LYS 64 H LYS 64 -8.651 -6.686 -2.109 497 HA LYS 64 HA LYS 64 -6.270 -8.102 -1.973 498 HB2 LYS 64 1HB LYS 64 -7.414 -8.746 -0.160 499 HB3 LYS 64 2HB LYS 64 -8.970 -8.388 -0.926 500 HG2 LYS 64 1HG LYS 64 -9.201 -10.525 -1.795 501 HG3 LYS 64 2HG LYS 64 -7.465 -10.862 -1.668 502 HD2 LYS 64 1HD LYS 64 -7.851 -11.885 0.273 503 HD3 LYS 64 2HD LYS 64 -8.326 -10.316 0.946 504 HE2 LYS 64 1HE LYS 64 -10.383 -11.130 1.240 505 HE3 LYS 64 2HE LYS 64 -10.540 -11.186 -0.522 506 HZ1 LYS 64 3HZ LYS 64 -9.616 -13.369 1.261 507 HZ2 LYS 64 1HZ LYS 64 -9.503 -13.432 -0.427 508 HZ3 LYS 64 2HZ LYS 64 -11.020 -13.336 0.317 509 H LEU 65 H LEU 65 -9.076 -8.611 -4.025 510 HA LEU 65 HA LEU 65 -8.283 -11.154 -5.014 511 HB2 LEU 65 1HB LEU 65 -10.309 -9.098 -5.727 512 HB3 LEU 65 2HB LEU 65 -9.864 -10.279 -6.972 513 HG LEU 65 HG LEU 65 -10.649 -12.096 -5.648 514 HD11 LEU 65 1HD1 LEU 65 -11.827 -11.015 -3.382 515 HD12 LEU 65 2HD1 LEU 65 -10.246 -10.238 -3.469 516 HD13 LEU 65 3HD1 LEU 65 -10.363 -11.997 -3.446 517 HD21 LEU 65 3HD2 LEU 65 -13.030 -11.285 -5.125 518 HD22 LEU 65 1HD2 LEU 65 -12.453 -11.157 -6.787 519 HD23 LEU 65 2HD2 LEU 65 -12.487 -9.728 -5.754 520 H GLU 66 H GLU 66 -7.763 -7.836 -6.078 521 HA GLU 66 HA GLU 66 -6.594 -8.490 -8.580 522 HB2 GLU 66 1HB GLU 66 -6.338 -6.012 -6.861 523 HB3 GLU 66 2HB GLU 66 -5.747 -6.147 -8.525 524 HG2 GLU 66 1HG GLU 66 -8.629 -6.643 -7.833 525 HG3 GLU 66 2HG GLU 66 -8.003 -5.017 -8.141 526 H LEU 67 H LEU 67 -5.342 -8.146 -5.330 527 HA LEU 67 HA LEU 67 -2.599 -8.003 -5.976 528 HB2 LEU 67 1HB LEU 67 -4.082 -8.918 -3.516 529 HB3 LEU 67 2HB LEU 67 -2.312 -8.897 -3.612 530 HG LEU 67 HG LEU 67 -4.048 -6.456 -3.966 531 HD11 LEU 67 1HD1 LEU 67 -3.841 -7.776 -1.638 532 HD12 LEU 67 2HD1 LEU 67 -3.959 -6.020 -1.754 533 HD13 LEU 67 3HD1 LEU 67 -2.383 -6.786 -1.553 534 HD21 LEU 67 3HD2 LEU 67 -1.247 -6.209 -3.139 535 HD22 LEU 67 1HD2 LEU 67 -2.168 -5.290 -4.330 536 HD23 LEU 67 2HD2 LEU 67 -1.476 -6.852 -4.766 537 HA PRO 68 HA PRO 68 -1.598 -12.110 -7.172 538 HB2 PRO 68 2HB PRO 68 0.474 -11.294 -7.743 539 HB3 PRO 68 1HB PRO 68 1.013 -12.234 -6.353 540 HG2 PRO 68 1HG PRO 68 0.999 -10.397 -4.930 541 HG3 PRO 68 2HG PRO 68 1.495 -9.628 -6.483 542 HD2 PRO 68 1HD PRO 68 -0.613 -8.744 -5.019 543 HD3 PRO 68 2HD PRO 68 -0.581 -8.676 -6.790 544 H GLU 69 H GLU 69 0.065 -13.914 -6.027 545 HA GLU 69 HA GLU 69 -1.123 -14.388 -3.372 546 HB2 GLU 69 1HB GLU 69 -0.853 -16.845 -3.926 547 HB3 GLU 69 2HB GLU 69 -2.102 -15.975 -4.831 548 HG2 GLU 69 1HG GLU 69 -0.573 -15.758 -6.738 549 HG3 GLU 69 2HG GLU 69 0.649 -16.667 -5.836 550 H ARG 70 H ARG 70 1.726 -14.511 -5.376 551 HA ARG 70 HA ARG 70 3.355 -14.862 -2.965 552 HB2 ARG 70 1HB ARG 70 3.986 -16.301 -5.545 553 HB3 ARG 70 2HB ARG 70 4.773 -16.497 -3.972 554 HG2 ARG 70 1HG ARG 70 1.859 -17.125 -4.314 555 HG3 ARG 70 2HG ARG 70 3.113 -18.296 -4.756 556 HD2 ARG 70 1HD ARG 70 3.948 -18.405 -2.537 557 HD3 ARG 70 2HD ARG 70 3.022 -16.977 -2.055 558 HE ARG 70 HE ARG 70 1.151 -18.296 -1.790 559 HH11 ARG 70 2HH1 ARG 70 3.668 -20.105 -3.375 560 HH12 ARG 70 1HH1 ARG 70 2.858 -21.627 -3.212 561 HH21 ARG 70 1HH2 ARG 70 0.812 -21.733 -2.184 562 HH22 ARG 70 2HH2 ARG 70 0.073 -20.294 -1.568 563 H GLN 71 H GLN 71 2.812 -12.458 -4.223 564 HA GLN 71 HA GLN 71 5.483 -11.740 -5.172 565 HB2 GLN 71 1HB GLN 71 2.895 -11.080 -6.589 566 HB3 GLN 71 2HB GLN 71 4.426 -10.251 -6.911 567 HG2 GLN 71 1HG GLN 71 5.343 -12.656 -7.317 568 HG3 GLN 71 2HG GLN 71 3.633 -13.058 -7.532 569 HE21 GLN 71 2HE2 GLN 71 3.834 -12.184 -10.861 570 HE22 GLN 71 1HE2 GLN 71 3.372 -13.318 -9.642 571 HA PRO 72 HA PRO 72 4.473 -8.737 -1.980 572 HB2 PRO 72 2HB PRO 72 6.459 -9.316 -0.979 573 HB3 PRO 72 1HB PRO 72 7.040 -7.820 -1.706 574 HG2 PRO 72 1HG PRO 72 7.974 -8.908 -3.535 575 HG3 PRO 72 2HG PRO 72 8.243 -10.125 -2.232 576 HD2 PRO 72 1HD PRO 72 6.986 -10.727 -4.562 577 HD3 PRO 72 2HD PRO 72 6.557 -11.485 -3.020 578 H ARG 73 H ARG 73 3.966 -6.613 -2.111 579 HA ARG 73 HA ARG 73 5.299 -4.773 -3.831 580 HB2 ARG 73 1HB ARG 73 3.212 -4.267 -5.203 581 HB3 ARG 73 2HB ARG 73 4.110 -5.732 -5.627 582 HG2 ARG 73 1HG ARG 73 2.275 -6.624 -3.755 583 HG3 ARG 73 2HG ARG 73 1.377 -5.437 -4.717 584 HD2 ARG 73 1HD ARG 73 3.046 -7.596 -5.998 585 HD3 ARG 73 2HD ARG 73 1.359 -7.854 -5.531 586 HE ARG 73 HE ARG 73 1.173 -5.634 -7.015 587 HH11 ARG 73 2HH1 ARG 73 2.803 -8.660 -7.572 588 HH12 ARG 73 1HH1 ARG 73 2.626 -8.589 -9.293 589 HH21 ARG 73 1HH2 ARG 73 1.565 -6.806 -10.264 590 HH22 ARG 73 2HH2 ARG 73 0.935 -5.528 -9.281 591 H PHE 74 H PHE 74 4.108 -2.625 -3.874 592 HA PHE 74 HA PHE 74 3.009 -2.162 -1.204 593 HB2 PHE 74 1HB PHE 74 3.850 -0.095 -3.248 594 HB3 PHE 74 2HB PHE 74 3.574 0.154 -1.523 595 HD1 PHE 74 2HD PHE 74 5.028 -1.663 -0.051 596 HD2 PHE 74 1HD PHE 74 6.068 -0.016 -3.837 597 HE1 PHE 74 2HE PHE 74 7.404 -2.094 0.418 598 HE2 PHE 74 1HE PHE 74 8.446 -0.445 -3.374 599 HZ PHE 74 HZ PHE 74 9.117 -1.485 -1.244 600 H VAL 75 H VAL 75 1.092 -1.008 -0.855 601 HA VAL 75 HA VAL 75 -0.592 -0.353 -3.133 602 HB VAL 75 HB VAL 75 -1.340 -2.472 -1.122 603 HG11 VAL 75 1HG1 VAL 75 -3.103 -0.940 -3.025 604 HG12 VAL 75 2HG1 VAL 75 -3.575 -2.447 -2.238 605 HG13 VAL 75 3HG1 VAL 75 -3.230 -1.014 -1.268 606 HG21 VAL 75 3HG2 VAL 75 -2.037 -3.436 -3.536 607 HG22 VAL 75 1HG2 VAL 75 -0.675 -2.413 -3.995 608 HG23 VAL 75 2HG2 VAL 75 -0.453 -3.694 -2.804 609 H VAL 76 H VAL 76 -1.598 1.500 -2.732 610 HA VAL 76 HA VAL 76 -1.924 2.340 0.072 611 HB VAL 76 HB VAL 76 -1.650 3.969 -2.452 612 HG11 VAL 76 1HG1 VAL 76 -1.649 5.630 -0.164 613 HG12 VAL 76 2HG1 VAL 76 -2.795 5.619 -1.506 614 HG13 VAL 76 3HG1 VAL 76 -3.093 4.619 -0.083 615 HG21 VAL 76 3HG2 VAL 76 0.305 2.930 -0.939 616 HG22 VAL 76 1HG2 VAL 76 0.449 4.479 -1.770 617 HG23 VAL 76 2HG2 VAL 76 0.023 4.432 -0.059 618 H TYR 77 H TYR 77 -3.924 1.626 0.627 619 HA TYR 77 HA TYR 77 -6.169 2.074 -1.178 620 HB2 TYR 77 1HB TYR 77 -5.845 -0.098 0.065 621 HB3 TYR 77 2HB TYR 77 -6.208 0.781 1.553 622 HD1 TYR 77 1HD TYR 77 -7.827 1.133 -1.781 623 HD2 TYR 77 2HD TYR 77 -8.248 -0.105 2.268 624 HE1 TYR 77 1HE TYR 77 -10.236 0.791 -2.141 625 HE2 TYR 77 2HE TYR 77 -10.658 -0.452 1.918 626 HH TYR 77 HH TYR 77 -12.187 0.285 -1.200 627 H SER 78 H SER 78 -7.777 3.521 -0.844 628 HA SER 78 HA SER 78 -7.548 5.249 1.534 629 HB2 SER 78 1HB SER 78 -6.889 6.294 -0.692 630 HB3 SER 78 2HB SER 78 -8.591 6.137 -1.159 631 HG SER 78 HG SER 78 -8.090 8.196 -0.238 632 H TYR 79 H TYR 79 -9.103 4.324 2.796 633 HA TYR 79 HA TYR 79 -11.714 3.703 1.705 634 HB2 TYR 79 1HB TYR 79 -10.782 2.193 3.357 635 HB3 TYR 79 2HB TYR 79 -10.604 3.515 4.513 636 HD1 TYR 79 2HD TYR 79 -13.033 1.307 2.856 637 HD2 TYR 79 1HD TYR 79 -12.473 4.349 5.778 638 HE1 TYR 79 2HE TYR 79 -15.282 0.861 3.743 639 HE2 TYR 79 1HE TYR 79 -14.722 3.910 6.673 640 HH TYR 79 HH TYR 79 -16.924 2.912 5.709 641 H LYS 80 H LYS 80 -13.691 4.547 2.675 642 HA LYS 80 HA LYS 80 -13.382 7.371 3.452 643 HB2 LYS 80 1HB LYS 80 -14.503 7.258 1.361 644 HB3 LYS 80 2HB LYS 80 -15.557 5.950 1.922 645 HG2 LYS 80 1HG LYS 80 -16.614 7.516 3.517 646 HG3 LYS 80 2HG LYS 80 -15.612 8.815 2.848 647 HD2 LYS 80 1HD LYS 80 -17.193 9.169 1.319 648 HD3 LYS 80 2HD LYS 80 -16.799 7.583 0.634 649 HE2 LYS 80 1HE LYS 80 -18.696 7.873 2.959 650 HE3 LYS 80 2HE LYS 80 -19.237 8.033 1.282 651 HZ1 LYS 80 3HZ LYS 80 -18.560 5.669 2.757 652 HZ2 LYS 80 1HZ LYS 80 -17.789 5.739 1.252 653 HZ3 LYS 80 2HZ LYS 80 -19.476 5.835 1.344 654 H TYR 81 H TYR 81 -13.576 7.549 5.593 655 HA TYR 81 HA TYR 81 -15.545 5.882 6.991 656 HB2 TYR 81 1HB TYR 81 -12.945 6.368 7.613 657 HB3 TYR 81 2HB TYR 81 -13.745 7.625 8.561 658 HD1 TYR 81 1HD TYR 81 -15.992 6.669 9.795 659 HD2 TYR 81 2HD TYR 81 -12.526 4.418 8.782 660 HE1 TYR 81 1HE TYR 81 -16.546 5.036 11.549 661 HE2 TYR 81 2HE TYR 81 -13.071 2.779 10.532 662 HH TYR 81 HH TYR 81 -14.580 2.125 12.038 663 H VAL 82 H VAL 82 -17.356 6.717 7.810 664 HA VAL 82 HA VAL 82 -17.779 9.604 7.565 665 HB VAL 82 HB VAL 82 -19.866 7.524 8.202 666 HG11 VAL 82 1HG1 VAL 82 -20.945 9.468 8.619 667 HG12 VAL 82 2HG1 VAL 82 -19.857 10.418 7.605 668 HG13 VAL 82 3HG1 VAL 82 -21.145 9.464 6.868 669 HG21 VAL 82 3HG2 VAL 82 -18.459 7.352 5.956 670 HG22 VAL 82 1HG2 VAL 82 -20.195 7.044 6.000 671 HG23 VAL 82 2HG2 VAL 82 -19.590 8.607 5.451 672 H HIS 83 H HIS 83 -18.936 10.742 9.272 673 HA HIS 83 HA HIS 83 -18.011 9.874 11.907 674 HB2 HIS 83 1HB HIS 83 -19.021 12.529 10.872 675 HB3 HIS 83 2HB HIS 83 -18.646 12.230 12.572 676 HD1 HIS 83 1HD HIS 83 -16.394 12.987 13.214 677 HD2 HIS 83 2HD HIS 83 -16.535 11.809 9.232 678 HE1 HIS 83 1HE HIS 83 -14.079 13.382 12.313 679 HE2 HIS 83 2HE HIS 83 -14.164 12.662 9.880 680 H ASP 84 H ASP 84 -20.749 11.994 11.398 681 HA ASP 84 HA ASP 84 -22.880 10.272 11.629 682 HB2 ASP 84 1HB ASP 84 -22.272 9.349 13.664 683 HB3 ASP 84 2HB ASP 84 -21.562 10.859 14.250 684 H ASP 85 H ASP 85 -21.546 13.273 12.944 685 HA ASP 85 HA ASP 85 -24.040 14.626 13.117 686 HB2 ASP 85 1HB ASP 85 -21.339 15.151 13.808 687 HB3 ASP 85 2HB ASP 85 -21.869 16.467 12.751 688 H GLY 86 H GLY 86 -22.126 13.739 10.489 689 HA2 GLY 86 1HA GLY 86 -23.346 14.152 8.329 690 HA3 GLY 86 2HA GLY 86 -23.342 15.843 8.808 691 H ARG 87 H ARG 87 -20.514 14.248 9.734 692 HA ARG 87 HA ARG 87 -19.096 15.377 7.412 693 HB2 ARG 87 1HB ARG 87 -18.226 15.016 10.283 694 HB3 ARG 87 2HB ARG 87 -17.111 15.438 8.976 695 HG2 ARG 87 1HG ARG 87 -19.545 17.083 9.644 696 HG3 ARG 87 2HG ARG 87 -17.951 17.358 10.366 697 HD2 ARG 87 1HD ARG 87 -17.041 18.164 8.428 698 HD3 ARG 87 2HD ARG 87 -18.089 17.166 7.411 699 HE ARG 87 HE ARG 87 -19.674 18.838 7.426 700 HH11 ARG 87 2HH1 ARG 87 -17.185 19.534 9.758 701 HH12 ARG 87 1HH1 ARG 87 -17.719 21.158 10.039 702 HH21 ARG 87 1HH2 ARG 87 -19.542 21.975 8.918 703 HH22 ARG 87 2HH2 ARG 87 -20.388 20.974 7.787 704 H VAL 88 H VAL 88 -17.519 14.177 6.385 705 HA VAL 88 HA VAL 88 -17.021 11.451 7.328 706 HB VAL 88 HB VAL 88 -18.845 11.149 5.786 707 HG11 VAL 88 1HG1 VAL 88 -19.186 12.393 3.970 708 HG12 VAL 88 2HG1 VAL 88 -17.822 13.381 4.499 709 HG13 VAL 88 3HG1 VAL 88 -17.567 12.064 3.354 710 HG21 VAL 88 3HG2 VAL 88 -16.180 10.145 5.270 711 HG22 VAL 88 1HG2 VAL 88 -17.728 9.300 5.243 712 HG23 VAL 88 2HG2 VAL 88 -17.167 10.157 3.808 713 H SER 89 H SER 89 -14.946 10.895 7.145 714 HA SER 89 HA SER 89 -13.246 12.456 5.311 715 HB2 SER 89 1HB SER 89 -12.410 11.304 7.990 716 HB3 SER 89 2HB SER 89 -11.442 12.337 6.924 717 HG SER 89 HG SER 89 -12.797 14.043 7.348 718 H TYR 90 H TYR 90 -11.446 11.364 4.386 719 HA TYR 90 HA TYR 90 -11.825 8.448 4.246 720 HB2 TYR 90 1HB TYR 90 -10.193 9.812 2.178 721 HB3 TYR 90 2HB TYR 90 -11.364 8.502 2.012 722 HD1 TYR 90 2HD TYR 90 -13.815 9.017 1.990 723 HD2 TYR 90 1HD TYR 90 -10.858 12.070 1.795 724 HE1 TYR 90 2HE TYR 90 -15.504 10.590 1.140 725 HE2 TYR 90 1HE TYR 90 -12.539 13.651 0.946 726 HH TYR 90 HH TYR 90 -15.718 13.269 1.201 727 HA PRO 91 HA PRO 91 -7.853 8.728 6.451 728 HB2 PRO 91 2HB PRO 91 -8.845 7.688 8.243 729 HB3 PRO 91 1HB PRO 91 -8.071 6.246 7.588 730 HG2 PRO 91 1HG PRO 91 -9.991 5.547 6.483 731 HG3 PRO 91 2HG PRO 91 -10.697 6.312 7.956 732 HD2 PRO 91 1HD PRO 91 -11.451 7.005 5.442 733 HD3 PRO 91 2HD PRO 91 -11.395 8.166 6.779 734 H LEU 92 H LEU 92 -6.415 8.608 4.764 735 HA LEU 92 HA LEU 92 -6.215 6.289 3.085 736 HB2 LEU 92 1HB LEU 92 -5.081 8.966 3.203 737 HB3 LEU 92 2HB LEU 92 -3.873 7.741 2.780 738 HG LEU 92 HG LEU 92 -6.135 7.226 1.175 739 HD11 LEU 92 1HD1 LEU 92 -6.981 9.426 1.575 740 HD12 LEU 92 2HD1 LEU 92 -6.286 9.390 -0.044 741 HD13 LEU 92 3HD1 LEU 92 -5.398 10.145 1.280 742 HD21 LEU 92 3HD2 LEU 92 -3.310 7.979 0.882 743 HD22 LEU 92 1HD2 LEU 92 -4.341 8.378 -0.493 744 HD23 LEU 92 2HD2 LEU 92 -4.241 6.713 0.080 745 H CYS 93 H CYS 93 -5.057 4.510 3.424 746 HA CYS 93 HA CYS 93 -2.915 4.592 5.442 747 HB2 CYS 93 1HB CYS 93 -4.949 2.407 4.968 748 HB3 CYS 93 2HB CYS 93 -3.544 2.249 6.038 749 HG CYS 93 HG CYS 93 -6.259 4.270 6.499 750 H PHE 94 H PHE 94 -1.238 2.977 5.169 751 HA PHE 94 HA PHE 94 -0.779 2.405 2.330 752 HB2 PHE 94 1HB PHE 94 0.904 3.773 3.561 753 HB3 PHE 94 2HB PHE 94 1.208 2.388 4.611 754 HD1 PHE 94 2HD PHE 94 1.427 3.542 1.106 755 HD2 PHE 94 1HD PHE 94 2.653 0.650 3.980 756 HE1 PHE 94 2HE PHE 94 3.095 2.676 -0.482 757 HE2 PHE 94 1HE PHE 94 4.324 -0.219 2.396 758 HZ PHE 94 HZ PHE 94 4.546 0.793 0.162 759 H ILE 95 H ILE 95 -1.552 0.447 1.822 760 HA ILE 95 HA ILE 95 -1.266 -1.768 3.700 761 HB ILE 95 HB ILE 95 -2.726 -1.553 1.069 762 HG12 ILE 95 1HG1 ILE 95 -3.711 -1.906 3.912 763 HG13 ILE 95 2HG1 ILE 95 -3.760 -0.393 2.991 764 HG21 ILE 95 1HG2 ILE 95 -2.161 -3.779 1.040 765 HG22 ILE 95 2HG2 ILE 95 -2.124 -3.904 2.798 766 HG23 ILE 95 3HG2 ILE 95 -3.670 -3.829 1.953 767 HD11 ILE 95 3HD1 ILE 95 -5.051 -2.140 1.324 768 HD12 ILE 95 1HD1 ILE 95 -5.570 -2.666 2.924 769 HD13 ILE 95 2HD1 ILE 95 -5.821 -0.994 2.420 770 H PHE 96 H PHE 96 0.583 -2.855 3.651 771 HA PHE 96 HA PHE 96 2.088 -3.058 1.157 772 HB2 PHE 96 1HB PHE 96 3.337 -2.367 3.124 773 HB3 PHE 96 2HB PHE 96 2.812 -3.809 3.995 774 HD1 PHE 96 1HD PHE 96 3.728 -4.014 0.469 775 HD2 PHE 96 2HD PHE 96 5.080 -4.502 4.475 776 HE1 PHE 96 1HE PHE 96 5.693 -5.249 -0.348 777 HE2 PHE 96 2HE PHE 96 7.047 -5.737 3.665 778 HZ PHE 96 HZ PHE 96 7.356 -6.113 1.251 779 H SER 97 H SER 97 1.478 -4.677 -0.125 780 HA SER 97 HA SER 97 0.323 -7.100 0.904 781 HB2 SER 97 1HB SER 97 -0.466 -6.172 -1.218 782 HB3 SER 97 2HB SER 97 1.157 -6.346 -1.908 783 HG SER 97 HG SER 97 -0.072 -8.110 -2.530 784 H SER 98 H SER 98 1.739 -8.314 2.047 785 HA SER 98 HA SER 98 4.055 -9.362 0.573 786 HB2 SER 98 1HB SER 98 4.625 -7.566 2.350 787 HB3 SER 98 2HB SER 98 4.213 -8.821 3.531 788 HG SER 98 HG SER 98 6.120 -9.607 3.207 789 HA PRO 99 HA PRO 99 1.654 -12.961 1.930 790 HB2 PRO 99 2HB PRO 99 1.371 -13.502 -0.285 791 HB3 PRO 99 1HB PRO 99 2.687 -14.634 0.024 792 HG2 PRO 99 1HG PRO 99 4.306 -13.201 -0.830 793 HG3 PRO 99 2HG PRO 99 2.903 -12.812 -1.894 794 HD2 PRO 99 1HD PRO 99 4.261 -10.914 -0.508 795 HD3 PRO 99 2HD PRO 99 2.521 -10.807 -0.823 796 H VAL 100 H VAL 100 2.649 -15.421 1.929 797 HA VAL 100 HA VAL 100 5.126 -15.217 3.513 798 HB VAL 100 HB VAL 100 2.952 -15.952 4.671 799 HG11 VAL 100 1HG1 VAL 100 1.877 -17.770 3.981 800 HG12 VAL 100 2HG1 VAL 100 2.941 -17.796 2.574 801 HG13 VAL 100 3HG1 VAL 100 3.358 -18.726 4.014 802 HG21 VAL 100 3HG2 VAL 100 4.150 -17.573 6.059 803 HG22 VAL 100 1HG2 VAL 100 5.394 -17.717 4.818 804 HG23 VAL 100 2HG2 VAL 100 5.169 -16.188 5.667 805 H GLY 101 H GLY 101 3.677 -16.551 0.736 806 HA2 GLY 101 1HA GLY 101 5.565 -18.769 0.549 807 HA3 GLY 101 2HA GLY 101 4.258 -18.417 -0.572 808 H CYS 102 H CYS 102 5.623 -15.522 -0.166 809 HA CYS 102 HA CYS 102 6.836 -15.480 -2.709 810 HB2 CYS 102 1HB CYS 102 7.784 -13.239 -1.826 811 HB3 CYS 102 2HB CYS 102 6.030 -13.407 -2.015 812 HG CYS 102 HG CYS 102 7.680 -13.726 0.967 813 H LYS 103 H LYS 103 9.161 -14.368 -2.815 814 HA LYS 103 HA LYS 103 10.958 -16.221 -1.409 815 HB2 LYS 103 1HB LYS 103 11.798 -14.556 -3.758 816 HB3 LYS 103 2HB LYS 103 12.406 -16.132 -3.227 817 HG2 LYS 103 1HG LYS 103 11.084 -17.155 -4.675 818 HG3 LYS 103 2HG LYS 103 9.665 -16.437 -3.890 819 HD2 LYS 103 1HD LYS 103 9.651 -15.851 -6.234 820 HD3 LYS 103 2HD LYS 103 9.972 -14.401 -5.266 821 HE2 LYS 103 1HE LYS 103 11.693 -14.073 -6.675 822 HE3 LYS 103 2HE LYS 103 12.497 -15.325 -5.716 823 HZ1 LYS 103 3HZ LYS 103 12.335 -15.533 -8.293 824 HZ2 LYS 103 1HZ LYS 103 10.795 -16.148 -7.960 825 HZ3 LYS 103 2HZ LYS 103 12.164 -16.903 -7.317 826 HA PRO 104 HA PRO 104 12.805 -12.976 0.905 827 HB2 PRO 104 2HB PRO 104 13.963 -14.612 2.028 828 HB3 PRO 104 1HB PRO 104 15.353 -13.940 1.178 829 HG2 PRO 104 1HG PRO 104 15.278 -15.545 -0.500 830 HG3 PRO 104 2HG PRO 104 14.735 -16.507 0.925 831 HD2 PRO 104 1HD PRO 104 13.304 -16.363 -1.378 832 HD3 PRO 104 2HD PRO 104 12.542 -16.500 0.216 833 H GLU 105 H GLU 105 13.896 -13.788 -2.242 834 HA GLU 105 HA GLU 105 15.960 -11.816 -2.444 835 HB2 GLU 105 1HB GLU 105 15.255 -14.006 -3.919 836 HB3 GLU 105 2HB GLU 105 14.666 -12.684 -4.937 837 HG2 GLU 105 1HG GLU 105 17.378 -12.288 -3.886 838 HG3 GLU 105 2HG GLU 105 17.193 -13.669 -4.977 839 H GLN 106 H GLN 106 12.530 -11.953 -3.205 840 HA GLN 106 HA GLN 106 12.585 -9.273 -4.342 841 HB2 GLN 106 1HB GLN 106 10.074 -10.840 -3.853 842 HB3 GLN 106 2HB GLN 106 10.435 -9.674 -5.137 843 HG2 GLN 106 1HG GLN 106 11.805 -12.347 -4.949 844 HG3 GLN 106 2HG GLN 106 10.280 -12.107 -5.813 845 HE21 GLN 106 2HE2 GLN 106 11.911 -9.801 -8.165 846 HE22 GLN 106 1HE2 GLN 106 10.606 -9.731 -7.035 847 H GLN 107 H GLN 107 10.767 -10.945 -1.767 848 HA GLN 107 HA GLN 107 9.435 -8.916 -0.596 849 HB2 GLN 107 1HB GLN 107 10.275 -11.482 0.187 850 HB3 GLN 107 2HB GLN 107 10.762 -10.396 1.498 851 HG2 GLN 107 1HG GLN 107 8.035 -9.942 0.511 852 HG3 GLN 107 2HG GLN 107 8.307 -11.531 1.240 853 HE21 GLN 107 2HE2 GLN 107 9.001 -8.257 3.605 854 HE22 GLN 107 1HE2 GLN 107 9.451 -8.243 1.938 855 H MET 108 H MET 108 12.892 -9.539 -0.294 856 HA MET 108 HA MET 108 13.407 -7.572 1.676 857 HB2 MET 108 1HB MET 108 15.074 -9.110 -0.280 858 HB3 MET 108 2HB MET 108 15.794 -7.741 0.583 859 HG2 MET 108 1HG MET 108 14.769 -8.969 2.690 860 HG3 MET 108 2HG MET 108 14.887 -10.369 1.620 861 HE1 MET 108 3HE MET 108 18.622 -9.511 0.433 862 HE2 MET 108 1HE MET 108 17.867 -11.095 0.611 863 HE3 MET 108 2HE MET 108 16.981 -9.777 -0.159 864 H MET 109 H MET 109 13.365 -7.510 -1.848 865 HA MET 109 HA MET 109 14.516 -4.989 -2.239 866 HB2 MET 109 1HB MET 109 12.643 -6.712 -3.820 867 HB3 MET 109 2HB MET 109 12.959 -5.055 -4.355 868 HG2 MET 109 1HG MET 109 15.262 -5.475 -4.677 869 HG3 MET 109 2HG MET 109 15.169 -7.003 -3.797 870 HE1 MET 109 3HE MET 109 13.022 -5.285 -6.432 871 HE2 MET 109 1HE MET 109 14.483 -5.309 -7.420 872 HE3 MET 109 2HE MET 109 13.111 -6.331 -7.849 873 H TYR 110 H TYR 110 11.327 -5.925 -1.219 874 HA TYR 110 HA TYR 110 10.315 -3.203 -1.534 875 HB2 TYR 110 1HB TYR 110 8.878 -5.670 -0.520 876 HB3 TYR 110 2HB TYR 110 8.140 -4.127 -0.958 877 HD1 TYR 110 1HD TYR 110 9.697 -7.176 -2.285 878 HD2 TYR 110 2HD TYR 110 7.786 -3.503 -3.265 879 HE1 TYR 110 1HE TYR 110 9.403 -7.954 -4.599 880 HE2 TYR 110 2HE TYR 110 7.486 -4.271 -5.582 881 HH TYR 110 HH TYR 110 7.444 -6.232 -6.882 882 H ALA 111 H ALA 111 11.040 -5.582 0.968 883 HA ALA 111 HA ALA 111 10.059 -4.145 3.173 884 HB1 ALA 111 3HB ALA 111 11.332 -6.589 2.763 885 HB2 ALA 111 1HB ALA 111 12.394 -5.694 3.850 886 HB3 ALA 111 2HB ALA 111 10.705 -5.957 4.285 887 H GLY 112 H GLY 112 13.032 -3.893 1.360 888 HA2 GLY 112 1HA GLY 112 14.231 -2.121 3.347 889 HA3 GLY 112 2HA GLY 112 14.995 -2.703 1.874 890 H SER 113 H SER 113 12.431 -1.913 0.415 891 HA SER 113 HA SER 113 13.164 0.917 0.106 892 HB2 SER 113 1HB SER 113 11.512 -0.639 -1.877 893 HB3 SER 113 2HB SER 113 12.531 0.785 -2.148 894 HG SER 113 HG SER 113 13.706 -1.605 -1.256 895 H LYS 114 H LYS 114 10.850 -0.991 1.504 896 HA LYS 114 HA LYS 114 8.413 0.169 0.856 897 HB2 LYS 114 1HB LYS 114 8.543 -1.826 2.216 898 HB3 LYS 114 2HB LYS 114 9.371 -0.933 3.503 899 HG2 LYS 114 1HG LYS 114 7.430 0.284 4.067 900 HG3 LYS 114 2HG LYS 114 6.601 -0.226 2.585 901 HD2 LYS 114 1HD LYS 114 5.661 -1.832 3.826 902 HD3 LYS 114 2HD LYS 114 7.249 -2.619 3.789 903 HE2 LYS 114 1HE LYS 114 7.886 -1.536 5.871 904 HE3 LYS 114 2HE LYS 114 6.357 -0.644 5.887 905 HZ1 LYS 114 3HZ LYS 114 6.364 -3.593 5.838 906 HZ2 LYS 114 1HZ LYS 114 5.153 -2.542 6.375 907 HZ3 LYS 114 2HZ LYS 114 6.554 -2.757 7.296 908 H ASN 115 H ASN 115 10.340 0.953 3.758 909 HA ASN 115 HA ASN 115 8.962 3.176 4.586 910 HB2 ASN 115 1HB ASN 115 11.879 2.444 4.767 911 HB3 ASN 115 2HB ASN 115 11.279 3.960 5.451 912 HD21 ASN 115 2HD2 ASN 115 11.251 1.410 8.109 913 HD22 ASN 115 1HD2 ASN 115 12.438 2.126 7.076 914 H ARG 116 H ARG 116 11.503 2.992 2.136 915 HA ARG 116 HA ARG 116 11.914 5.698 1.682 916 HB2 ARG 116 1HB ARG 116 13.317 3.975 0.689 917 HB3 ARG 116 2HB ARG 116 11.962 3.422 -0.307 918 HG2 ARG 116 1HG ARG 116 13.269 4.700 -1.761 919 HG3 ARG 116 2HG ARG 116 11.938 5.771 -1.293 920 HD2 ARG 116 1HD ARG 116 13.280 7.097 0.050 921 HD3 ARG 116 2HD ARG 116 14.469 5.810 0.286 922 HE ARG 116 HE ARG 116 14.399 6.583 -2.433 923 HH11 ARG 116 2HH1 ARG 116 15.485 7.663 0.693 924 HH12 ARG 116 1HH1 ARG 116 16.780 8.622 0.056 925 HH21 ARG 116 1HH2 ARG 116 17.129 8.724 -2.206 926 HH22 ARG 116 2HH2 ARG 116 16.101 7.842 -3.284 927 H LEU 117 H LEU 117 9.644 3.528 -0.006 928 HA LEU 117 HA LEU 117 8.452 5.552 -1.568 929 HB2 LEU 117 1HB LEU 117 8.240 3.289 -2.268 930 HB3 LEU 117 2HB LEU 117 7.515 2.823 -0.720 931 HG LEU 117 HG LEU 117 5.628 4.502 -1.466 932 HD11 LEU 117 1HD1 LEU 117 7.306 4.486 -3.739 933 HD12 LEU 117 2HD1 LEU 117 5.739 5.270 -3.540 934 HD13 LEU 117 3HD1 LEU 117 5.828 3.625 -4.167 935 HD21 LEU 117 3HD2 LEU 117 4.356 2.666 -2.161 936 HD22 LEU 117 1HD2 LEU 117 5.584 1.967 -1.105 937 HD23 LEU 117 2HD2 LEU 117 5.754 1.844 -2.857 938 H VAL 118 H VAL 118 7.193 3.862 1.313 939 HA VAL 118 HA VAL 118 4.871 5.255 1.709 940 HB VAL 118 HB VAL 118 6.780 4.338 3.865 941 HG11 VAL 118 1HG1 VAL 118 3.912 4.319 4.426 942 HG12 VAL 118 2HG1 VAL 118 5.261 4.871 5.421 943 HG13 VAL 118 3HG1 VAL 118 4.581 5.934 4.189 944 HG21 VAL 118 3HG2 VAL 118 6.076 2.236 3.542 945 HG22 VAL 118 1HG2 VAL 118 4.402 2.738 3.307 946 HG23 VAL 118 2HG2 VAL 118 5.540 2.805 1.962 947 H GLN 119 H GLN 119 8.036 6.106 3.122 948 HA GLN 119 HA GLN 119 7.311 8.443 4.397 949 HB2 GLN 119 1HB GLN 119 9.865 7.488 3.151 950 HB3 GLN 119 2HB GLN 119 9.766 9.135 3.791 951 HG2 GLN 119 1HG GLN 119 9.021 8.165 5.976 952 HG3 GLN 119 2HG GLN 119 9.379 6.567 5.306 953 HE21 GLN 119 2HE2 GLN 119 12.255 8.378 7.162 954 HE22 GLN 119 1HE2 GLN 119 10.553 8.507 7.434 955 H THR 120 H THR 120 8.123 7.933 1.007 956 HA THR 120 HA THR 120 8.276 10.614 0.208 957 HB THR 120 HB THR 120 7.208 8.404 -1.541 958 HG1 THR 120 1HG THR 120 9.956 9.000 -1.116 959 HG21 THR 120 3HG2 THR 120 8.120 11.123 -1.945 960 HG22 THR 120 1HG2 THR 120 7.284 10.041 -3.059 961 HG23 THR 120 2HG2 THR 120 9.041 9.978 -2.918 962 H ALA 121 H ALA 121 5.515 8.386 0.303 963 HA ALA 121 HA ALA 121 3.645 10.239 -0.763 964 HB1 ALA 121 3HB ALA 121 2.984 7.882 0.985 965 HB2 ALA 121 1HB ALA 121 1.979 8.639 -0.253 966 HB3 ALA 121 2HB ALA 121 3.415 7.726 -0.719 967 H GLU 122 H GLU 122 4.912 9.656 2.412 968 HA GLU 122 HA GLU 122 4.761 10.963 4.294 969 HB2 GLU 122 1HB GLU 122 4.138 12.786 2.531 970 HB3 GLU 122 2HB GLU 122 2.490 12.533 3.128 971 HG2 GLU 122 1HG GLU 122 2.896 13.507 5.130 972 HG3 GLU 122 2HG GLU 122 4.581 12.966 5.167 973 H LEU 123 H LEU 123 3.309 8.535 3.817 974 HA LEU 123 HA LEU 123 0.715 8.903 5.072 975 HB2 LEU 123 1HB LEU 123 2.094 6.327 4.305 976 HB3 LEU 123 2HB LEU 123 0.380 6.556 4.688 977 HG LEU 123 HG LEU 123 1.535 8.033 2.369 978 HD11 LEU 123 1HD1 LEU 123 0.577 5.195 2.128 979 HD12 LEU 123 2HD1 LEU 123 2.283 5.617 2.261 980 HD13 LEU 123 3HD1 LEU 123 1.335 6.206 0.897 981 HD21 LEU 123 3HD2 LEU 123 -0.695 8.586 2.824 982 HD22 LEU 123 1HD2 LEU 123 -1.135 6.912 3.160 983 HD23 LEU 123 2HD2 LEU 123 -0.791 7.416 1.506 984 H THR 124 H THR 124 0.589 9.080 7.202 985 HA THR 124 HA THR 124 2.683 8.291 8.963 986 HB THR 124 HB THR 124 -0.134 9.240 9.481 987 HG1 THR 124 1HG THR 124 2.225 10.585 10.224 988 HG21 THR 124 3HG2 THR 124 2.030 8.468 11.426 989 HG22 THR 124 1HG2 THR 124 0.364 7.896 11.368 990 HG23 THR 124 2HG2 THR 124 0.710 9.555 11.854 991 H LYS 125 H LYS 125 -0.553 7.005 8.275 992 HA LYS 125 HA LYS 125 -0.215 4.797 10.098 993 HB2 LYS 125 1HB LYS 125 -2.358 5.835 8.331 994 HB3 LYS 125 2HB LYS 125 -2.372 4.091 8.638 995 HG2 LYS 125 1HG LYS 125 -2.462 4.471 11.034 996 HG3 LYS 125 2HG LYS 125 -2.372 6.222 10.767 997 HD2 LYS 125 1HD LYS 125 -4.554 4.572 9.514 998 HD3 LYS 125 2HD LYS 125 -4.684 5.162 11.181 999 HE2 LYS 125 1HE LYS 125 -3.912 7.435 9.892 1000 HE3 LYS 125 2HE LYS 125 -4.864 6.627 8.638 1001 HZ1 LYS 125 3HZ LYS 125 -5.989 6.783 11.338 1002 HZ2 LYS 125 1HZ LYS 125 -6.776 6.794 9.841 1003 HZ3 LYS 125 2HZ LYS 125 -5.989 8.185 10.393 1004 H VAL 126 H VAL 126 1.002 3.098 9.630 1005 HA VAL 126 HA VAL 126 1.069 2.141 6.842 1006 HB VAL 126 HB VAL 126 3.349 1.957 8.816 1007 HG11 VAL 126 1HG1 VAL 126 4.231 0.484 7.411 1008 HG12 VAL 126 2HG1 VAL 126 2.784 0.572 6.405 1009 HG13 VAL 126 3HG1 VAL 126 4.139 1.662 6.103 1010 HG21 VAL 126 3HG2 VAL 126 4.431 3.592 7.188 1011 HG22 VAL 126 1HG2 VAL 126 2.801 3.901 6.590 1012 HG23 VAL 126 2HG2 VAL 126 3.202 4.241 8.274 1013 H PHE 127 H PHE 127 -0.070 0.320 6.757 1014 HA PHE 127 HA PHE 127 0.024 -1.530 9.035 1015 HB2 PHE 127 1HB PHE 127 -1.891 -1.498 6.687 1016 HB3 PHE 127 2HB PHE 127 -2.006 -2.524 8.119 1017 HD1 PHE 127 2HD PHE 127 -1.110 -0.224 10.037 1018 HD2 PHE 127 1HD PHE 127 -4.101 -0.568 7.028 1019 HE1 PHE 127 2HE PHE 127 -2.456 1.487 11.184 1020 HE2 PHE 127 1HE PHE 127 -5.451 1.144 8.169 1021 HZ PHE 127 HZ PHE 127 -4.630 2.172 10.251 1022 H GLU 128 H GLU 128 0.012 -3.873 8.502 1023 HA GLU 128 HA GLU 128 1.374 -4.527 5.995 1024 HB2 GLU 128 1HB GLU 128 3.088 -4.138 7.779 1025 HB3 GLU 128 2HB GLU 128 2.368 -5.477 8.686 1026 HG2 GLU 128 1HG GLU 128 2.775 -6.787 6.432 1027 HG3 GLU 128 2HG GLU 128 3.998 -5.529 6.204 1028 H ILE 129 H ILE 129 0.111 -5.989 5.066 1029 HA ILE 129 HA ILE 129 -1.468 -7.814 6.701 1030 HB ILE 129 HB ILE 129 -2.378 -8.519 4.411 1031 HG12 ILE 129 1HG1 ILE 129 -1.271 -5.867 3.516 1032 HG13 ILE 129 2HG1 ILE 129 -0.358 -7.365 3.270 1033 HG21 ILE 129 1HG2 ILE 129 -3.972 -6.762 4.412 1034 HG22 ILE 129 2HG2 ILE 129 -3.471 -6.993 6.087 1035 HG23 ILE 129 3HG2 ILE 129 -2.833 -5.640 5.154 1036 HD11 ILE 129 3HD1 ILE 129 -1.893 -6.471 1.382 1037 HD12 ILE 129 1HD1 ILE 129 -1.851 -8.197 1.736 1038 HD13 ILE 129 2HD1 ILE 129 -3.182 -7.206 2.334 1039 H ARG 130 H ARG 130 -1.070 -9.935 6.919 1040 HA ARG 130 HA ARG 130 1.418 -10.987 5.945 1041 HB2 ARG 130 1HB ARG 130 0.754 -11.598 8.160 1042 HB3 ARG 130 2HB ARG 130 -0.811 -12.191 7.584 1043 HG2 ARG 130 1HG ARG 130 0.545 -14.088 8.062 1044 HG3 ARG 130 2HG ARG 130 0.404 -13.950 6.301 1045 HD2 ARG 130 1HD ARG 130 2.658 -14.293 6.446 1046 HD3 ARG 130 2HD ARG 130 2.619 -12.530 6.595 1047 HE ARG 130 HE ARG 130 2.421 -13.516 9.166 1048 HH11 ARG 130 2HH1 ARG 130 4.704 -13.671 6.542 1049 HH12 ARG 130 1HH1 ARG 130 6.083 -13.827 7.578 1050 HH21 ARG 130 1HH2 ARG 130 5.812 -13.856 9.853 1051 HH22 ARG 130 2HH2 ARG 130 4.229 -13.720 10.541 1052 H THR 131 H THR 131 -1.854 -11.022 4.907 1053 HA THR 131 HA THR 131 -1.183 -12.402 2.497 1054 HB THR 131 HB THR 131 -1.436 -14.431 3.651 1055 HG1 THR 131 1HG THR 131 -3.734 -15.047 2.966 1056 HG21 THR 131 3HG2 THR 131 -4.080 -13.744 4.839 1057 HG22 THR 131 1HG2 THR 131 -2.623 -13.127 5.617 1058 HG23 THR 131 2HG2 THR 131 -2.846 -14.864 5.411 1059 H THR 132 H THR 132 -2.592 -11.923 0.882 1060 HA THR 132 HA THR 132 -4.164 -9.772 0.811 1061 HB THR 132 HB THR 132 -5.602 -10.925 -0.929 1062 HG1 THR 132 1HG THR 132 -5.604 -13.040 -0.529 1063 HG21 THR 132 3HG2 THR 132 -3.965 -10.708 -2.526 1064 HG22 THR 132 1HG2 THR 132 -2.748 -11.524 -1.546 1065 HG23 THR 132 2HG2 THR 132 -3.200 -9.858 -1.184 1066 H ASP 133 H ASP 133 -5.346 -12.986 1.770 1067 HA ASP 133 HA ASP 133 -7.986 -12.595 2.148 1068 HB2 ASP 133 1HB ASP 133 -5.950 -14.264 3.409 1069 HB3 ASP 133 2HB ASP 133 -7.288 -13.892 4.504 1070 H ASP 134 H ASP 134 -5.502 -11.713 4.543 1071 HA ASP 134 HA ASP 134 -6.997 -10.693 6.560 1072 HB2 ASP 134 1HB ASP 134 -4.320 -10.176 5.497 1073 HB3 ASP 134 2HB ASP 134 -5.008 -8.783 6.341 1074 H LEU 135 H LEU 135 -6.102 -8.955 3.594 1075 HA LEU 135 HA LEU 135 -7.308 -6.513 4.200 1076 HB2 LEU 135 1HB LEU 135 -5.830 -6.599 2.362 1077 HB3 LEU 135 2HB LEU 135 -6.753 -7.905 1.598 1078 HG LEU 135 HG LEU 135 -8.409 -6.451 0.827 1079 HD11 LEU 135 1HD1 LEU 135 -8.387 -4.002 1.575 1080 HD12 LEU 135 2HD1 LEU 135 -7.392 -4.559 2.920 1081 HD13 LEU 135 3HD1 LEU 135 -9.020 -5.202 2.701 1082 HD21 LEU 135 3HD2 LEU 135 -6.779 -5.965 -0.667 1083 HD22 LEU 135 1HD2 LEU 135 -5.637 -5.453 0.576 1084 HD23 LEU 135 2HD2 LEU 135 -6.924 -4.363 0.059 1085 H THR 136 H THR 136 -9.315 -6.757 5.145 1086 HA THR 136 HA THR 136 -11.472 -7.479 3.289 1087 HB THR 136 HB THR 136 -12.660 -8.351 5.471 1088 HG1 THR 136 1HG THR 136 -10.804 -9.584 6.586 1089 HG21 THR 136 3HG2 THR 136 -12.211 -9.678 3.445 1090 HG22 THR 136 1HG2 THR 136 -11.973 -10.621 4.915 1091 HG23 THR 136 2HG2 THR 136 -10.579 -10.001 4.029 1092 H GLU 137 H GLU 137 -13.489 -6.459 3.711 1093 HA GLU 137 HA GLU 137 -13.490 -3.807 4.238 1094 HB2 GLU 137 1HB GLU 137 -15.421 -5.027 3.331 1095 HB3 GLU 137 2HB GLU 137 -15.732 -5.710 4.934 1096 HG2 GLU 137 1HG GLU 137 -15.725 -3.079 5.537 1097 HG3 GLU 137 2HG GLU 137 -16.324 -3.034 3.873 1098 H THR 138 H THR 138 -13.720 -6.390 6.613 1099 HA THR 138 HA THR 138 -14.152 -4.588 8.819 1100 HB THR 138 HB THR 138 -13.288 -7.466 9.049 1101 HG1 THR 138 1HG THR 138 -15.104 -7.374 7.662 1102 HG21 THR 138 3HG2 THR 138 -14.892 -7.228 11.061 1103 HG22 THR 138 1HG2 THR 138 -14.701 -5.493 10.813 1104 HG23 THR 138 2HG2 THR 138 -13.294 -6.493 11.170 1105 H TRP 139 H TRP 139 -11.536 -6.915 8.122 1106 HA TRP 139 HA TRP 139 -9.704 -6.123 9.979 1107 HB2 TRP 139 1HB TRP 139 -9.120 -8.005 8.716 1108 HB3 TRP 139 2HB TRP 139 -9.374 -7.169 7.184 1109 HD1 TRP 139 HD TRP 139 -6.670 -8.090 9.561 1110 HE1 TRP 139 1HE TRP 139 -4.447 -7.009 8.842 1111 HE3 TRP 139 3HE TRP 139 -8.454 -4.812 6.065 1112 HZ2 TRP 139 2HZ TRP 139 -3.566 -5.031 7.033 1113 HZ3 TRP 139 3HZ TRP 139 -6.855 -3.361 4.887 1114 HH2 TRP 139 HH TRP 139 -4.462 -3.469 5.362 1115 H LEU 140 H LEU 140 -10.784 -4.337 7.253 1116 HA LEU 140 HA LEU 140 -8.511 -2.526 7.273 1117 HB2 LEU 140 1HB LEU 140 -9.368 -2.995 5.117 1118 HB3 LEU 140 2HB LEU 140 -11.031 -2.683 5.644 1119 HG LEU 140 HG LEU 140 -9.713 -0.950 4.166 1120 HD11 LEU 140 1HD1 LEU 140 -11.276 0.636 4.772 1121 HD12 LEU 140 2HD1 LEU 140 -11.213 0.201 6.480 1122 HD13 LEU 140 3HD1 LEU 140 -12.032 -0.856 5.330 1123 HD21 LEU 140 3HD2 LEU 140 -9.080 0.270 6.801 1124 HD22 LEU 140 1HD2 LEU 140 -8.337 0.532 5.223 1125 HD23 LEU 140 2HD2 LEU 140 -7.961 -0.925 6.143 1126 H LYS 141 H LYS 141 -12.045 -2.137 7.598 1127 HA LYS 141 HA LYS 141 -11.958 0.470 8.619 1128 HB2 LYS 141 1HB LYS 141 -13.965 -1.700 8.444 1129 HB3 LYS 141 2HB LYS 141 -14.257 -0.475 9.690 1130 HG2 LYS 141 1HG LYS 141 -14.678 1.177 8.189 1131 HG3 LYS 141 2HG LYS 141 -13.574 0.500 6.980 1132 HD2 LYS 141 1HD LYS 141 -15.460 -0.125 5.919 1133 HD3 LYS 141 2HD LYS 141 -15.469 -1.445 7.100 1134 HE2 LYS 141 1HE LYS 141 -16.715 1.141 7.904 1135 HE3 LYS 141 2HE LYS 141 -17.573 0.133 6.729 1136 HZ1 LYS 141 3HZ LYS 141 -17.809 -0.155 9.361 1137 HZ2 LYS 141 1HZ LYS 141 -16.558 -1.255 9.068 1138 HZ3 LYS 141 2HZ LYS 141 -18.037 -1.423 8.266 1139 H GLU 142 H GLU 142 -11.215 -2.524 10.089 1140 HA GLU 142 HA GLU 142 -11.791 -1.802 12.790 1141 HB2 GLU 142 1HB GLU 142 -10.375 -4.026 11.406 1142 HB3 GLU 142 2HB GLU 142 -9.979 -3.744 13.108 1143 HG2 GLU 142 1HG GLU 142 -12.673 -3.685 13.241 1144 HG3 GLU 142 2HG GLU 142 -12.438 -4.801 11.889 1145 H LYS 143 H LYS 143 -8.841 -1.846 10.819 1146 HA LYS 143 HA LYS 143 -7.083 -0.979 12.844 1147 HB2 LYS 143 1HB LYS 143 -6.893 -0.624 9.842 1148 HB3 LYS 143 2HB LYS 143 -5.560 -0.397 10.988 1149 HG2 LYS 143 1HG LYS 143 -6.896 -3.008 11.176 1150 HG3 LYS 143 2HG LYS 143 -6.068 -2.695 9.640 1151 HD2 LYS 143 1HD LYS 143 -4.232 -1.796 11.473 1152 HD3 LYS 143 2HD LYS 143 -4.961 -3.180 12.306 1153 HE2 LYS 143 1HE LYS 143 -4.364 -4.683 10.580 1154 HE3 LYS 143 2HE LYS 143 -4.002 -3.359 9.464 1155 HZ1 LYS 143 3HZ LYS 143 -2.442 -4.142 11.863 1156 HZ2 LYS 143 1HZ LYS 143 -2.151 -2.731 10.974 1157 HZ3 LYS 143 2HZ LYS 143 -1.955 -4.245 10.246 1158 H LEU 144 H LEU 144 -9.129 0.756 10.573 1159 HA LEU 144 HA LEU 144 -8.037 3.334 11.120 1160 HB2 LEU 144 1HB LEU 144 -10.816 2.800 10.094 1161 HB3 LEU 144 2HB LEU 144 -9.772 4.199 9.787 1162 HG LEU 144 HG LEU 144 -9.173 1.432 8.756 1163 HD11 LEU 144 1HD1 LEU 144 -10.334 3.662 7.123 1164 HD12 LEU 144 2HD1 LEU 144 -11.362 2.489 7.945 1165 HD13 LEU 144 3HD1 LEU 144 -10.205 1.947 6.729 1166 HD21 LEU 144 3HD2 LEU 144 -7.205 2.395 8.340 1167 HD22 LEU 144 1HD2 LEU 144 -7.820 4.006 8.710 1168 HD23 LEU 144 2HD2 LEU 144 -8.049 3.324 7.100 1169 H ALA 145 H ALA 145 -11.077 1.745 12.092 1170 HA ALA 145 HA ALA 145 -12.263 3.605 13.641 1171 HB1 ALA 145 3HB ALA 145 -12.243 0.729 13.567 1172 HB2 ALA 145 1HB ALA 145 -12.426 1.307 15.224 1173 HB3 ALA 145 2HB ALA 145 -13.557 1.832 13.975 1174 H SER 146 H SER 146 -10.273 1.171 15.300 1175 HA SER 146 HA SER 146 -8.736 3.182 16.679 1176 HB2 SER 146 1HB SER 146 -11.125 2.740 17.825 1177 HB3 SER 146 2HB SER 146 -10.212 1.408 18.556 1178 HG SER 146 HG SER 146 -8.594 3.309 18.873 1179 H GLY 147 H GLY 147 -8.149 0.959 14.968 1180 HA2 GLY 147 1HA GLY 147 -6.538 -0.676 14.832 1181 HA3 GLY 147 2HA GLY 147 -6.055 -0.238 16.463 1182 HA PRO 148 HA PRO 148 -8.033 -4.501 16.376 1183 HB2 PRO 148 2HB PRO 148 -6.154 -5.564 15.586 1184 HB3 PRO 148 1HB PRO 148 -5.848 -5.874 17.295 1185 HG2 PRO 148 1HG PRO 148 -4.394 -4.073 17.504 1186 HG3 PRO 148 2HG PRO 148 -4.048 -4.604 15.815 1187 HD2 PRO 148 1HD PRO 148 -4.726 -2.050 16.437 1188 HD3 PRO 148 2HD PRO 148 -5.201 -2.822 14.915 1189 H SER 149 H SER 149 -7.763 -6.144 18.354 1190 HA SER 149 HA SER 149 -7.228 -4.936 20.894 1191 HB2 SER 149 1HB SER 149 -9.867 -4.647 19.772 1192 HB3 SER 149 2HB SER 149 -9.938 -5.674 21.215 1193 HG SER 149 HG SER 149 -10.125 -3.471 21.764 1194 H SER 150 H SER 150 -7.455 -6.419 22.654 1195 HA SER 150 HA SER 150 -8.294 -9.126 22.159 1196 HB2 SER 150 1HB SER 150 -5.779 -8.660 21.312 1197 HB3 SER 150 2HB SER 150 -5.453 -9.010 23.018 1198 HG SER 150 HG SER 150 -6.717 -10.672 21.108 1199 H GLY 151 H GLY 151 -7.924 -10.519 24.113 1200 HA2 GLY 151 1HA GLY 151 -7.113 -10.173 26.545 1201 HA3 GLY 151 2HA GLY 151 -8.282 -8.861 26.515 Start of MODEL 15 1 H1 GLY 1 H GLY 1 12.484 -17.000 23.278 2 HA2 GLY 1 1HA GLY 1 12.226 -14.689 23.406 3 HA3 GLY 1 2HA GLY 1 12.859 -14.737 25.046 4 H SER 2 H SER 2 13.603 -12.768 23.234 5 HA SER 2 HA SER 2 16.454 -13.084 23.275 6 HB2 SER 2 1HB SER 2 14.925 -13.251 20.702 7 HB3 SER 2 2HB SER 2 16.493 -12.424 20.716 8 HG SER 2 HG SER 2 16.658 -14.756 22.051 9 H SER 3 H SER 3 13.933 -11.179 21.618 10 HA SER 3 HA SER 3 13.467 -8.949 21.632 11 HB2 SER 3 1HB SER 3 14.317 -9.478 24.226 12 HB3 SER 3 2HB SER 3 15.316 -8.101 23.725 13 HG SER 3 HG SER 3 13.200 -7.193 22.974 14 H GLY 4 H GLY 4 14.228 -7.195 20.527 15 HA2 GLY 4 1HA GLY 4 16.128 -5.714 20.023 16 HA3 GLY 4 2HA GLY 4 17.128 -7.158 19.962 17 H SER 5 H SER 5 17.847 -6.928 17.881 18 HA SER 5 HA SER 5 15.981 -7.696 15.814 19 HB2 SER 5 1HB SER 5 16.564 -5.794 14.318 20 HB3 SER 5 2HB SER 5 15.673 -5.284 15.764 21 HG SER 5 HG SER 5 17.541 -3.974 15.261 22 H SER 6 H SER 6 16.953 -9.009 14.406 23 HA SER 6 HA SER 6 19.898 -8.962 14.275 24 HB2 SER 6 1HB SER 6 19.917 -11.362 14.041 25 HB3 SER 6 2HB SER 6 18.940 -10.955 15.464 26 HG SER 6 HG SER 6 18.118 -12.528 13.741 27 H GLY 7 H GLY 7 20.782 -9.928 12.244 28 HA2 GLY 7 1HA GLY 7 20.355 -10.539 9.924 29 HA3 GLY 7 2HA GLY 7 18.985 -9.439 9.953 30 H SER 8 H SER 8 21.724 -9.727 8.464 31 HA SER 8 HA SER 8 23.451 -7.697 8.885 32 HB2 SER 8 1HB SER 8 23.816 -9.162 7.030 33 HB3 SER 8 2HB SER 8 22.306 -8.649 6.255 34 HG SER 8 HG SER 8 24.464 -7.691 5.564 35 H ASP 9 H ASP 9 23.667 -5.521 8.177 36 HA ASP 9 HA ASP 9 21.095 -4.111 8.059 37 HB2 ASP 9 1HB ASP 9 22.843 -3.628 9.878 38 HB3 ASP 9 2HB ASP 9 23.774 -2.842 8.595 39 H SER 10 H SER 10 21.927 -5.317 5.704 40 HA SER 10 HA SER 10 22.413 -2.954 4.037 41 HB2 SER 10 1HB SER 10 23.825 -5.624 3.734 42 HB3 SER 10 2HB SER 10 23.908 -4.291 2.567 43 HG SER 10 HG SER 10 25.646 -4.466 4.221 44 H LEU 11 H LEU 11 20.757 -2.740 2.700 45 HA LEU 11 HA LEU 11 19.543 -5.161 1.550 46 HB2 LEU 11 1HB LEU 11 18.083 -2.689 2.497 47 HB3 LEU 11 2HB LEU 11 17.349 -4.070 1.665 48 HG LEU 11 HG LEU 11 18.777 -4.493 4.258 49 HD11 LEU 11 1HD1 LEU 11 16.717 -4.078 5.472 50 HD12 LEU 11 2HD1 LEU 11 15.920 -3.569 3.983 51 HD13 LEU 11 3HD1 LEU 11 17.250 -2.615 4.643 52 HD21 LEU 11 3HD2 LEU 11 16.259 -5.837 3.436 53 HD22 LEU 11 1HD2 LEU 11 17.645 -6.470 4.326 54 HD23 LEU 11 2HD2 LEU 11 17.743 -6.256 2.578 55 H VAL 12 H VAL 12 17.913 -4.307 -0.283 56 HA VAL 12 HA VAL 12 19.617 -2.787 -2.109 57 HB VAL 12 HB VAL 12 18.786 -4.939 -2.914 58 HG11 VAL 12 1HG1 VAL 12 16.114 -3.733 -2.286 59 HG12 VAL 12 2HG1 VAL 12 16.281 -5.018 -3.483 60 HG13 VAL 12 3HG1 VAL 12 16.763 -5.302 -1.811 61 HG21 VAL 12 3HG2 VAL 12 18.685 -4.130 -4.990 62 HG22 VAL 12 1HG2 VAL 12 17.172 -3.285 -4.665 63 HG23 VAL 12 2HG2 VAL 12 18.711 -2.523 -4.264 64 H VAL 13 H VAL 13 18.362 -1.287 -0.093 65 HA VAL 13 HA VAL 13 15.986 -0.117 -0.360 66 HB VAL 13 HB VAL 13 18.606 1.361 -0.096 67 HG11 VAL 13 1HG1 VAL 13 15.771 2.307 0.222 68 HG12 VAL 13 2HG1 VAL 13 17.131 3.119 0.999 69 HG13 VAL 13 3HG1 VAL 13 17.058 3.007 -0.759 70 HG21 VAL 13 3HG2 VAL 13 17.632 1.447 2.340 71 HG22 VAL 13 1HG2 VAL 13 16.740 0.023 1.805 72 HG23 VAL 13 2HG2 VAL 13 18.503 0.024 1.770 73 H CYS 14 H CYS 14 14.794 0.678 -1.953 74 HA CYS 14 HA CYS 14 16.115 1.514 -4.431 75 HB2 CYS 14 1HB CYS 14 14.266 0.862 -5.583 76 HB3 CYS 14 2HB CYS 14 14.108 -0.209 -4.182 77 HG CYS 14 HG CYS 14 12.526 2.224 -3.068 78 H GLU 15 H GLU 15 14.415 3.185 -5.601 79 HA GLU 15 HA GLU 15 14.088 5.415 -3.705 80 HB2 GLU 15 1HB GLU 15 15.019 6.944 -5.179 81 HB3 GLU 15 2HB GLU 15 16.043 5.518 -5.412 82 HG2 GLU 15 1HG GLU 15 14.394 4.948 -7.335 83 HG3 GLU 15 2HG GLU 15 13.965 6.661 -7.224 84 H VAL 16 H VAL 16 12.274 6.670 -3.901 85 HA VAL 16 HA VAL 16 10.011 5.501 -5.160 86 HB VAL 16 HB VAL 16 10.233 8.300 -4.049 87 HG11 VAL 16 1HG1 VAL 16 7.723 7.518 -3.524 88 HG12 VAL 16 2HG1 VAL 16 8.183 8.353 -5.009 89 HG13 VAL 16 3HG1 VAL 16 8.013 6.597 -4.999 90 HG21 VAL 16 3HG2 VAL 16 10.849 7.090 -2.202 91 HG22 VAL 16 1HG2 VAL 16 9.093 7.028 -2.045 92 HG23 VAL 16 2HG2 VAL 16 9.968 5.651 -2.714 93 H ASP 17 H ASP 17 10.243 5.396 -7.364 94 HA ASP 17 HA ASP 17 11.300 6.954 -9.219 95 HB2 ASP 17 1HB ASP 17 9.851 4.983 -9.684 96 HB3 ASP 17 2HB ASP 17 8.434 6.008 -9.425 97 HA PRO 18 HA PRO 18 9.798 11.075 -8.842 98 HB2 PRO 18 2HB PRO 18 11.630 11.693 -10.083 99 HB3 PRO 18 1HB PRO 18 10.435 11.987 -11.345 100 HG2 PRO 18 1HG PRO 18 10.797 9.929 -12.362 101 HG3 PRO 18 2HG PRO 18 12.455 10.320 -11.769 102 HD2 PRO 18 1HD PRO 18 11.197 7.988 -11.175 103 HD3 PRO 18 2HD PRO 18 12.306 8.791 -10.051 104 H GLU 19 H GLU 19 8.775 9.048 -11.533 105 HA GLU 19 HA GLU 19 6.623 10.758 -12.335 106 HB2 GLU 19 1HB GLU 19 6.243 9.268 -14.022 107 HB3 GLU 19 2HB GLU 19 7.914 8.832 -13.627 108 HG2 GLU 19 1HG GLU 19 7.170 6.741 -13.478 109 HG3 GLU 19 2HG GLU 19 6.486 7.240 -11.925 110 H LEU 20 H LEU 20 7.045 8.266 -9.978 111 HA LEU 20 HA LEU 20 4.182 7.884 -9.620 112 HB2 LEU 20 1HB LEU 20 6.014 6.066 -9.462 113 HB3 LEU 20 2HB LEU 20 6.320 6.747 -7.855 114 HG LEU 20 HG LEU 20 3.674 5.613 -8.760 115 HD11 LEU 20 1HD1 LEU 20 6.031 4.254 -8.058 116 HD12 LEU 20 2HD1 LEU 20 4.410 3.588 -8.244 117 HD13 LEU 20 3HD1 LEU 20 4.957 4.147 -6.663 118 HD21 LEU 20 3HD2 LEU 20 4.582 7.078 -6.389 119 HD22 LEU 20 1HD2 LEU 20 3.707 5.587 -6.040 120 HD23 LEU 20 2HD2 LEU 20 2.954 6.840 -7.026 121 H LYS 21 H LYS 21 6.960 9.087 -7.759 122 HA LYS 21 HA LYS 21 5.982 9.714 -5.358 123 HB2 LYS 21 1HB LYS 21 8.225 10.374 -6.303 124 HB3 LYS 21 2HB LYS 21 7.426 11.786 -7.013 125 HG2 LYS 21 1HG LYS 21 6.618 12.001 -4.432 126 HG3 LYS 21 2HG LYS 21 8.220 11.266 -4.238 127 HD2 LYS 21 1HD LYS 21 8.129 13.463 -6.189 128 HD3 LYS 21 2HD LYS 21 7.751 13.939 -4.524 129 HE2 LYS 21 1HE LYS 21 9.903 12.385 -4.059 130 HE3 LYS 21 2HE LYS 21 10.285 12.957 -5.690 131 HZ1 LYS 21 3HZ LYS 21 9.372 15.102 -4.074 132 HZ2 LYS 21 1HZ LYS 21 10.845 14.932 -4.890 133 HZ3 LYS 21 2HZ LYS 21 10.670 14.317 -3.324 134 H GLU 22 H GLU 22 5.317 11.612 -8.285 135 HA GLU 22 HA GLU 22 3.749 13.595 -7.077 136 HB2 GLU 22 1HB GLU 22 3.258 12.571 -9.867 137 HB3 GLU 22 2HB GLU 22 3.084 14.221 -9.249 138 HG2 GLU 22 1HG GLU 22 5.636 14.101 -8.846 139 HG3 GLU 22 2HG GLU 22 5.574 12.735 -9.970 140 H THR 23 H THR 23 2.848 10.487 -8.521 141 HA THR 23 HA THR 23 0.109 10.640 -8.451 142 HB THR 23 HB THR 23 1.928 8.295 -7.929 143 HG1 THR 23 1HG THR 23 1.965 8.820 -10.050 144 HG21 THR 23 3HG2 THR 23 0.107 7.405 -6.886 145 HG22 THR 23 1HG2 THR 23 -0.362 7.076 -8.554 146 HG23 THR 23 2HG2 THR 23 -1.025 8.476 -7.711 147 H LEU 24 H LEU 24 2.281 9.746 -5.789 148 HA LEU 24 HA LEU 24 0.241 9.212 -3.907 149 HB2 LEU 24 1HB LEU 24 2.991 10.210 -3.200 150 HB3 LEU 24 2HB LEU 24 1.942 9.111 -2.288 151 HG LEU 24 HG LEU 24 3.423 8.465 -4.836 152 HD11 LEU 24 1HD1 LEU 24 3.905 6.863 -2.452 153 HD12 LEU 24 2HD1 LEU 24 4.375 8.552 -2.265 154 HD13 LEU 24 3HD1 LEU 24 5.047 7.592 -3.582 155 HD21 LEU 24 3HD2 LEU 24 2.256 6.563 -5.042 156 HD22 LEU 24 1HD2 LEU 24 1.038 7.393 -4.074 157 HD23 LEU 24 2HD2 LEU 24 2.185 6.301 -3.299 158 H ARG 25 H ARG 25 2.307 12.077 -4.377 159 HA ARG 25 HA ARG 25 1.235 13.670 -2.371 160 HB2 ARG 25 1HB ARG 25 3.233 14.379 -3.442 161 HB3 ARG 25 2HB ARG 25 2.457 14.379 -5.034 162 HG2 ARG 25 1HG ARG 25 1.509 16.412 -4.746 163 HG3 ARG 25 2HG ARG 25 1.275 16.167 -3.006 164 HD2 ARG 25 1HD ARG 25 2.983 17.606 -2.755 165 HD3 ARG 25 2HD ARG 25 3.996 16.225 -3.198 166 HE ARG 25 HE ARG 25 3.186 17.459 -5.560 167 HH11 ARG 25 2HH1 ARG 25 5.128 18.175 -2.760 168 HH12 ARG 25 1HH1 ARG 25 6.180 19.261 -3.605 169 HH21 ARG 25 1HH2 ARG 25 5.859 19.665 -5.837 170 HH22 ARG 25 2HH2 ARG 25 4.566 18.886 -6.684 171 H LYS 26 H LYS 26 0.003 12.918 -5.548 172 HA LYS 26 HA LYS 26 -2.038 14.963 -5.463 173 HB2 LYS 26 1HB LYS 26 -1.983 12.628 -7.365 174 HB3 LYS 26 2HB LYS 26 -2.658 14.245 -7.618 175 HG2 LYS 26 1HG LYS 26 0.140 14.484 -7.074 176 HG3 LYS 26 2HG LYS 26 -0.116 13.287 -8.355 177 HD2 LYS 26 1HD LYS 26 -1.800 15.155 -9.243 178 HD3 LYS 26 2HD LYS 26 -0.693 16.201 -8.336 179 HE2 LYS 26 1HE LYS 26 0.865 16.060 -9.928 180 HE3 LYS 26 2HE LYS 26 0.792 14.293 -9.895 181 HZ1 LYS 26 3HZ LYS 26 0.067 15.768 -11.993 182 HZ2 LYS 26 1HZ LYS 26 -1.431 15.594 -11.224 183 HZ3 LYS 26 2HZ LYS 26 -0.548 14.224 -11.677 184 H PHE 27 H PHE 27 -1.831 11.462 -5.035 185 HA PHE 27 HA PHE 27 -4.507 10.805 -4.897 186 HB2 PHE 27 1HB PHE 27 -2.390 9.313 -4.718 187 HB3 PHE 27 2HB PHE 27 -2.518 9.613 -2.983 188 HD1 PHE 27 2HD PHE 27 -5.180 9.028 -5.518 189 HD2 PHE 27 1HD PHE 27 -3.212 7.639 -2.008 190 HE1 PHE 27 2HE PHE 27 -6.835 7.220 -5.309 191 HE2 PHE 27 1HE PHE 27 -4.864 5.829 -1.795 192 HZ PHE 27 HZ PHE 27 -6.680 5.618 -3.445 193 H ARG 28 H ARG 28 -2.419 12.071 -2.331 194 HA ARG 28 HA ARG 28 -4.270 11.921 -0.231 195 HB2 ARG 28 1HB ARG 28 -2.344 14.199 -0.332 196 HB3 ARG 28 2HB ARG 28 -2.749 13.120 1.011 197 HG2 ARG 28 1HG ARG 28 -1.577 11.372 -0.708 198 HG3 ARG 28 2HG ARG 28 -0.684 12.863 -1.053 199 HD2 ARG 28 1HD ARG 28 -1.016 11.508 1.630 200 HD3 ARG 28 2HD ARG 28 0.469 11.674 0.681 201 HE ARG 28 HE ARG 28 0.581 13.944 1.281 202 HH11 ARG 28 2HH1 ARG 28 -2.155 12.319 2.693 203 HH12 ARG 28 1HH1 ARG 28 -2.438 13.548 3.880 204 HH21 ARG 28 1HH2 ARG 28 -1.088 15.397 3.963 205 HH22 ARG 28 2HH2 ARG 28 0.219 15.570 2.840 206 H PHE 29 H PHE 29 -3.808 14.297 -2.763 207 HA PHE 29 HA PHE 29 -6.183 15.728 -1.769 208 HB2 PHE 29 1HB PHE 29 -4.166 17.177 -3.427 209 HB3 PHE 29 2HB PHE 29 -5.244 17.793 -2.173 210 HD1 PHE 29 1HD PHE 29 -4.753 17.041 0.259 211 HD2 PHE 29 2HD PHE 29 -1.925 16.852 -2.916 212 HE1 PHE 29 1HE PHE 29 -2.921 16.989 1.899 213 HE2 PHE 29 2HE PHE 29 -0.088 16.798 -1.280 214 HZ PHE 29 HZ PHE 29 -0.584 16.867 1.131 215 H ARG 30 H ARG 30 -6.323 13.567 -3.532 216 HA ARG 30 HA ARG 30 -6.370 14.381 -6.252 217 HB2 ARG 30 1HB ARG 30 -7.654 12.291 -6.624 218 HB3 ARG 30 2HB ARG 30 -6.167 12.040 -5.698 219 HG2 ARG 30 1HG ARG 30 -7.685 12.242 -3.615 220 HG3 ARG 30 2HG ARG 30 -9.002 11.938 -4.759 221 HD2 ARG 30 1HD ARG 30 -6.872 10.068 -5.235 222 HD3 ARG 30 2HD ARG 30 -7.314 10.054 -3.522 223 HE ARG 30 HE ARG 30 -8.941 9.185 -5.747 224 HH11 ARG 30 2HH1 ARG 30 -8.864 10.148 -2.403 225 HH12 ARG 30 1HH1 ARG 30 -10.351 9.353 -2.005 226 HH21 ARG 30 1HH2 ARG 30 -11.508 8.208 -3.616 227 HH22 ARG 30 2HH2 ARG 30 -10.900 8.135 -5.235 228 H LYS 31 H LYS 31 -8.566 13.984 -7.492 229 HA LYS 31 HA LYS 31 -10.529 15.782 -6.242 230 HB2 LYS 31 1HB LYS 31 -9.685 15.281 -9.071 231 HB3 LYS 31 2HB LYS 31 -11.328 15.859 -8.753 232 HG2 LYS 31 1HG LYS 31 -9.191 17.347 -7.376 233 HG3 LYS 31 2HG LYS 31 -9.202 17.471 -9.144 234 HD2 LYS 31 1HD LYS 31 -11.890 17.713 -8.172 235 HD3 LYS 31 2HD LYS 31 -10.839 18.841 -7.297 236 HE2 LYS 31 1HE LYS 31 -10.953 18.594 -10.313 237 HE3 LYS 31 2HE LYS 31 -11.835 19.798 -9.364 238 HZ1 LYS 31 3HZ LYS 31 -8.889 19.522 -9.236 239 HZ2 LYS 31 1HZ LYS 31 -9.838 20.803 -8.671 240 HZ3 LYS 31 2HZ LYS 31 -9.664 20.549 -10.335 241 H GLU 32 H GLU 32 -10.518 13.067 -5.512 242 HA GLU 32 HA GLU 32 -12.997 12.116 -6.791 243 HB2 GLU 32 1HB GLU 32 -10.661 10.563 -5.673 244 HB3 GLU 32 2HB GLU 32 -12.236 9.820 -5.999 245 HG2 GLU 32 1HG GLU 32 -12.001 9.946 -8.268 246 HG3 GLU 32 2HG GLU 32 -10.932 11.354 -8.182 247 H THR 33 H THR 33 -14.148 10.488 -5.246 248 HA THR 33 HA THR 33 -13.962 11.267 -2.446 249 HB THR 33 HB THR 33 -16.433 11.681 -2.330 250 HG1 THR 33 1HG THR 33 -17.447 12.220 -4.341 251 HG21 THR 33 3HG2 THR 33 -16.272 13.976 -3.459 252 HG22 THR 33 1HG2 THR 33 -14.629 13.509 -3.894 253 HG23 THR 33 2HG2 THR 33 -15.099 13.611 -2.196 254 H ASN 34 H ASN 34 -13.463 8.823 -3.926 255 HA ASN 34 HA ASN 34 -15.362 7.087 -2.512 256 HB2 ASN 34 1HB ASN 34 -15.058 5.494 -4.548 257 HB3 ASN 34 2HB ASN 34 -16.204 6.834 -4.668 258 HD21 ASN 34 2HD2 ASN 34 -13.368 6.505 -7.374 259 HD22 ASN 34 1HD2 ASN 34 -13.915 5.251 -6.319 260 H ASN 35 H ASN 35 -14.392 4.658 -2.961 261 HA ASN 35 HA ASN 35 -11.818 4.739 -1.629 262 HB2 ASN 35 1HB ASN 35 -13.788 2.540 -2.255 263 HB3 ASN 35 2HB ASN 35 -12.181 2.192 -1.607 264 HD21 ASN 35 2HD2 ASN 35 -14.476 2.369 1.243 265 HD22 ASN 35 1HD2 ASN 35 -14.279 1.390 -0.167 266 H ALA 36 H ALA 36 -9.969 4.694 -2.706 267 HA ALA 36 HA ALA 36 -9.826 3.167 -5.217 268 HB1 ALA 36 3HB ALA 36 -8.244 5.681 -4.913 269 HB2 ALA 36 1HB ALA 36 -8.776 4.857 -6.379 270 HB3 ALA 36 2HB ALA 36 -9.935 5.764 -5.407 271 H ALA 37 H ALA 37 -7.677 2.433 -5.783 272 HA ALA 37 HA ALA 37 -5.781 2.373 -3.539 273 HB1 ALA 37 3HB ALA 37 -7.354 0.201 -4.323 274 HB2 ALA 37 1HB ALA 37 -5.744 -0.125 -4.968 275 HB3 ALA 37 2HB ALA 37 -5.960 0.179 -3.244 276 H ILE 38 H ILE 38 -3.595 2.077 -4.115 277 HA ILE 38 HA ILE 38 -2.992 2.267 -6.987 278 HB ILE 38 HB ILE 38 -1.582 3.909 -4.886 279 HG12 ILE 38 1HG1 ILE 38 -3.805 4.633 -6.801 280 HG13 ILE 38 2HG1 ILE 38 -3.806 4.784 -5.035 281 HG21 ILE 38 1HG2 ILE 38 -0.997 3.239 -7.600 282 HG22 ILE 38 2HG2 ILE 38 -1.299 4.972 -7.479 283 HG23 ILE 38 3HG2 ILE 38 -0.062 4.220 -6.471 284 HD11 ILE 38 3HD1 ILE 38 -3.374 6.938 -5.497 285 HD12 ILE 38 1HD1 ILE 38 -1.714 6.357 -5.612 286 HD13 ILE 38 2HD1 ILE 38 -2.675 6.575 -7.075 287 H ILE 39 H ILE 39 -2.020 0.362 -7.344 288 HA ILE 39 HA ILE 39 -0.172 -0.742 -5.388 289 HB ILE 39 HB ILE 39 -1.039 -1.857 -8.058 290 HG12 ILE 39 1HG1 ILE 39 -1.904 -3.185 -5.583 291 HG13 ILE 39 2HG1 ILE 39 -2.578 -1.560 -5.802 292 HG21 ILE 39 1HG2 ILE 39 -0.138 -3.983 -7.177 293 HG22 ILE 39 2HG2 ILE 39 1.101 -2.748 -7.396 294 HG23 ILE 39 3HG2 ILE 39 0.491 -3.107 -5.781 295 HD11 ILE 39 3HD1 ILE 39 -4.158 -2.563 -7.003 296 HD12 ILE 39 1HD1 ILE 39 -2.939 -2.664 -8.274 297 HD13 ILE 39 2HD1 ILE 39 -3.205 -4.035 -7.197 298 H MET 40 H MET 40 1.897 -0.188 -5.414 299 HA MET 40 HA MET 40 3.122 0.576 -7.980 300 HB2 MET 40 1HB MET 40 4.245 1.258 -5.270 301 HB3 MET 40 2HB MET 40 4.576 2.028 -6.828 302 HG2 MET 40 1HG MET 40 2.790 3.393 -6.704 303 HG3 MET 40 2HG MET 40 1.777 2.152 -5.961 304 HE1 MET 40 3HE MET 40 0.800 3.349 -3.324 305 HE2 MET 40 1HE MET 40 1.295 1.759 -3.907 306 HE3 MET 40 2HE MET 40 1.970 2.397 -2.407 307 H LYS 41 H LYS 41 4.817 -0.546 -8.736 308 HA LYS 41 HA LYS 41 5.829 -2.748 -7.068 309 HB2 LYS 41 1HB LYS 41 6.361 -3.927 -9.075 310 HB3 LYS 41 2HB LYS 41 4.711 -3.307 -9.247 311 HG2 LYS 41 1HG LYS 41 5.312 -1.726 -10.826 312 HG3 LYS 41 2HG LYS 41 7.013 -1.738 -10.324 313 HD2 LYS 41 1HD LYS 41 7.505 -3.653 -11.502 314 HD3 LYS 41 2HD LYS 41 5.834 -4.242 -11.432 315 HE2 LYS 41 1HE LYS 41 5.137 -2.564 -13.058 316 HE3 LYS 41 2HE LYS 41 6.777 -1.900 -13.085 317 HZ1 LYS 41 3HZ LYS 41 5.967 -4.612 -13.984 318 HZ2 LYS 41 1HZ LYS 41 7.564 -4.054 -13.926 319 HZ3 LYS 41 2HZ LYS 41 6.452 -3.326 -14.971 320 H VAL 42 H VAL 42 8.153 -3.421 -7.924 321 HA VAL 42 HA VAL 42 9.799 -0.991 -8.153 322 HB VAL 42 HB VAL 42 10.031 -1.562 -5.872 323 HG11 VAL 42 1HG1 VAL 42 10.851 -4.374 -6.358 324 HG12 VAL 42 2HG1 VAL 42 10.031 -3.656 -4.970 325 HG13 VAL 42 3HG1 VAL 42 9.132 -3.990 -6.451 326 HG21 VAL 42 3HG2 VAL 42 12.145 -1.093 -6.995 327 HG22 VAL 42 1HG2 VAL 42 12.372 -2.257 -5.688 328 HG23 VAL 42 2HG2 VAL 42 12.341 -2.807 -7.364 329 H ASP 43 H ASP 43 10.787 -1.106 -10.056 330 HA ASP 43 HA ASP 43 11.253 -3.555 -11.437 331 HB2 ASP 43 1HB ASP 43 11.691 -0.673 -11.932 332 HB3 ASP 43 2HB ASP 43 12.823 -1.759 -12.749 333 H LYS 44 H LYS 44 12.862 -4.937 -11.160 334 HA LYS 44 HA LYS 44 14.990 -4.471 -9.352 335 HB2 LYS 44 1HB LYS 44 14.203 -6.710 -9.655 336 HB3 LYS 44 2HB LYS 44 14.509 -6.639 -11.398 337 HG2 LYS 44 1HG LYS 44 16.954 -6.385 -10.871 338 HG3 LYS 44 2HG LYS 44 16.540 -6.741 -9.184 339 HD2 LYS 44 1HD LYS 44 15.268 -8.748 -10.634 340 HD3 LYS 44 2HD LYS 44 16.835 -8.543 -11.435 341 HE2 LYS 44 1HE LYS 44 17.689 -8.517 -8.903 342 HE3 LYS 44 2HE LYS 44 16.214 -9.470 -8.686 343 HZ1 LYS 44 3HZ LYS 44 18.394 -10.098 -10.604 344 HZ2 LYS 44 1HZ LYS 44 16.988 -11.012 -10.374 345 HZ3 LYS 44 2HZ LYS 44 18.125 -10.880 -9.128 346 H ASP 45 H ASP 45 14.626 -3.995 -12.767 347 HA ASP 45 HA ASP 45 17.396 -3.902 -13.420 348 HB2 ASP 45 1HB ASP 45 14.985 -3.847 -14.834 349 HB3 ASP 45 2HB ASP 45 15.729 -2.274 -15.148 350 H ARG 46 H ARG 46 14.970 -1.424 -12.677 351 HA ARG 46 HA ARG 46 17.094 0.598 -12.608 352 HB2 ARG 46 1HB ARG 46 14.162 1.185 -12.298 353 HB3 ARG 46 2HB ARG 46 15.450 2.239 -12.897 354 HG2 ARG 46 1HG ARG 46 15.518 1.189 -14.990 355 HG3 ARG 46 2HG ARG 46 14.623 -0.220 -14.396 356 HD2 ARG 46 1HD ARG 46 13.477 2.572 -14.612 357 HD3 ARG 46 2HD ARG 46 13.264 1.297 -15.819 358 HE ARG 46 HE ARG 46 12.443 0.575 -13.145 359 HH11 ARG 46 2HH1 ARG 46 11.493 1.932 -16.208 360 HH12 ARG 46 1HH1 ARG 46 9.809 1.593 -15.983 361 HH21 ARG 46 1HH2 ARG 46 9.091 0.564 -14.067 362 HH22 ARG 46 2HH2 ARG 46 10.228 0.122 -12.838 363 H GLN 47 H GLN 47 15.828 -1.531 -10.544 364 HA GLN 47 HA GLN 47 15.305 -1.574 -8.297 365 HB2 GLN 47 1HB GLN 47 17.679 0.261 -8.045 366 HB3 GLN 47 2HB GLN 47 17.191 -1.068 -6.983 367 HG2 GLN 47 1HG GLN 47 17.738 -1.951 -9.705 368 HG3 GLN 47 2HG GLN 47 19.126 -1.175 -8.931 369 HE21 GLN 47 2HE2 GLN 47 17.617 -4.635 -7.345 370 HE22 GLN 47 1HE2 GLN 47 16.602 -3.568 -8.247 371 H MET 48 H MET 48 13.552 0.149 -9.276 372 HA MET 48 HA MET 48 13.406 2.187 -7.192 373 HB2 MET 48 1HB MET 48 13.164 4.012 -8.574 374 HB3 MET 48 2HB MET 48 14.351 3.062 -9.479 375 HG2 MET 48 1HG MET 48 12.121 2.063 -10.565 376 HG3 MET 48 2HG MET 48 11.528 3.663 -10.108 377 HE1 MET 48 3HE MET 48 14.549 5.696 -11.322 378 HE2 MET 48 1HE MET 48 12.937 6.167 -11.860 379 HE3 MET 48 2HE MET 48 13.179 5.574 -10.217 380 H VAL 49 H VAL 49 11.369 2.547 -6.450 381 HA VAL 49 HA VAL 49 9.335 0.680 -7.178 382 HB VAL 49 HB VAL 49 9.403 3.006 -5.271 383 HG11 VAL 49 1HG1 VAL 49 7.169 3.064 -6.014 384 HG12 VAL 49 2HG1 VAL 49 7.055 1.304 -6.063 385 HG13 VAL 49 3HG1 VAL 49 7.139 2.141 -4.512 386 HG21 VAL 49 3HG2 VAL 49 8.672 0.357 -4.300 387 HG22 VAL 49 1HG2 VAL 49 10.266 0.405 -5.052 388 HG23 VAL 49 2HG2 VAL 49 9.891 1.483 -3.707 389 H VAL 50 H VAL 50 8.287 0.890 -9.052 390 HA VAL 50 HA VAL 50 7.339 3.573 -9.826 391 HB VAL 50 HB VAL 50 7.301 2.805 -12.143 392 HG11 VAL 50 1HG1 VAL 50 9.910 2.463 -10.682 393 HG12 VAL 50 2HG1 VAL 50 9.785 2.495 -12.442 394 HG13 VAL 50 3HG1 VAL 50 9.300 3.903 -11.497 395 HG21 VAL 50 3HG2 VAL 50 7.657 0.675 -12.826 396 HG22 VAL 50 1HG2 VAL 50 8.847 0.356 -11.565 397 HG23 VAL 50 2HG2 VAL 50 7.125 0.301 -11.186 398 H LEU 51 H LEU 51 5.224 3.813 -10.543 399 HA LEU 51 HA LEU 51 3.238 2.371 -9.296 400 HB2 LEU 51 1HB LEU 51 2.873 4.574 -10.252 401 HB3 LEU 51 2HB LEU 51 3.081 3.912 -11.883 402 HG LEU 51 HG LEU 51 1.009 2.405 -10.893 403 HD11 LEU 51 1HD1 LEU 51 -0.300 3.537 -9.469 404 HD12 LEU 51 2HD1 LEU 51 0.045 5.092 -10.225 405 HD13 LEU 51 3HD1 LEU 51 1.180 4.406 -9.064 406 HD21 LEU 51 3HD2 LEU 51 -0.137 3.290 -12.640 407 HD22 LEU 51 1HD2 LEU 51 1.471 3.877 -13.067 408 HD23 LEU 51 2HD2 LEU 51 0.328 4.947 -12.254 409 H GLU 52 H GLU 52 2.008 0.612 -9.759 410 HA GLU 52 HA GLU 52 2.799 -0.948 -12.126 411 HB2 GLU 52 1HB GLU 52 3.361 -2.184 -10.193 412 HB3 GLU 52 2HB GLU 52 1.830 -1.783 -9.402 413 HG2 GLU 52 1HG GLU 52 0.921 -3.649 -10.159 414 HG3 GLU 52 2HG GLU 52 1.222 -3.123 -11.821 415 H ASP 53 H ASP 53 0.030 -0.005 -10.132 416 HA ASP 53 HA ASP 53 -1.676 0.077 -12.444 417 HB2 ASP 53 1HB ASP 53 -1.764 -2.202 -10.551 418 HB3 ASP 53 2HB ASP 53 -3.326 -1.486 -10.973 419 H GLU 54 H GLU 54 -3.991 0.639 -11.742 420 HA GLU 54 HA GLU 54 -4.188 1.952 -9.166 421 HB2 GLU 54 1HB GLU 54 -3.640 3.397 -11.650 422 HB3 GLU 54 2HB GLU 54 -5.088 3.977 -10.814 423 HG2 GLU 54 1HG GLU 54 -3.640 4.088 -8.715 424 HG3 GLU 54 2HG GLU 54 -2.264 3.902 -9.812 425 H LEU 55 H LEU 55 -6.042 1.097 -8.485 426 HA LEU 55 HA LEU 55 -8.293 0.922 -10.371 427 HB2 LEU 55 1HB LEU 55 -8.023 -0.486 -7.715 428 HB3 LEU 55 2HB LEU 55 -9.209 -0.798 -8.996 429 HG LEU 55 HG LEU 55 -6.276 -1.219 -9.471 430 HD11 LEU 55 1HD1 LEU 55 -6.575 -2.571 -7.589 431 HD12 LEU 55 2HD1 LEU 55 -6.827 -3.660 -8.952 432 HD13 LEU 55 3HD1 LEU 55 -8.212 -3.027 -8.063 433 HD21 LEU 55 3HD2 LEU 55 -7.670 -3.111 -10.840 434 HD22 LEU 55 1HD2 LEU 55 -7.168 -1.555 -11.501 435 HD23 LEU 55 2HD2 LEU 55 -8.800 -1.756 -10.863 436 H GLN 56 H GLN 56 -10.022 2.172 -10.081 437 HA GLN 56 HA GLN 56 -10.210 3.705 -7.578 438 HB2 GLN 56 1HB GLN 56 -11.042 4.303 -10.406 439 HB3 GLN 56 2HB GLN 56 -11.747 5.183 -9.041 440 HG2 GLN 56 1HG GLN 56 -10.054 6.609 -9.426 441 HG3 GLN 56 2HG GLN 56 -9.147 5.449 -8.446 442 HE21 GLN 56 2HE2 GLN 56 -6.813 5.106 -10.957 443 HE22 GLN 56 1HE2 GLN 56 -7.185 5.362 -9.289 444 H ASN 57 H ASN 57 -12.416 4.250 -6.845 445 HA ASN 57 HA ASN 57 -14.352 3.447 -5.924 446 HB2 ASN 57 1HB ASN 57 -15.855 2.475 -7.960 447 HB3 ASN 57 2HB ASN 57 -15.638 4.199 -7.633 448 HD21 ASN 57 2HD2 ASN 57 -13.527 4.800 -10.391 449 HD22 ASN 57 1HD2 ASN 57 -13.933 5.315 -8.792 450 H ILE 58 H ILE 58 -12.512 1.642 -5.352 451 HA ILE 58 HA ILE 58 -13.804 -0.942 -5.935 452 HB ILE 58 HB ILE 58 -11.866 -1.585 -6.836 453 HG12 ILE 58 1HG1 ILE 58 -11.790 -2.503 -4.453 454 HG13 ILE 58 2HG1 ILE 58 -10.265 -2.493 -5.354 455 HG21 ILE 58 1HG2 ILE 58 -11.000 0.507 -7.339 456 HG22 ILE 58 2HG2 ILE 58 -10.794 0.941 -5.643 457 HG23 ILE 58 3HG2 ILE 58 -9.709 -0.230 -6.391 458 HD11 ILE 58 3HD1 ILE 58 -10.779 -1.377 -2.831 459 HD12 ILE 58 1HD1 ILE 58 -9.292 -1.297 -3.776 460 HD13 ILE 58 2HD1 ILE 58 -10.510 -0.031 -3.939 461 H SER 59 H SER 59 -14.187 -2.298 -4.242 462 HA SER 59 HA SER 59 -14.071 -1.139 -1.603 463 HB2 SER 59 1HB SER 59 -15.820 -2.479 -1.177 464 HB3 SER 59 2HB SER 59 -15.759 -2.954 -2.884 465 HG SER 59 HG SER 59 -14.878 -4.811 -2.358 466 HA PRO 60 HA PRO 60 -10.596 -3.216 0.088 467 HB2 PRO 60 2HB PRO 60 -11.240 -2.490 2.170 468 HB3 PRO 60 1HB PRO 60 -11.497 -4.207 2.477 469 HG2 PRO 60 1HG PRO 60 -13.776 -4.086 2.044 470 HG3 PRO 60 2HG PRO 60 -13.480 -2.474 2.796 471 HD2 PRO 60 1HD PRO 60 -14.677 -2.764 0.376 472 HD3 PRO 60 2HD PRO 60 -13.626 -1.392 0.766 473 H GLU 61 H GLU 61 -13.147 -4.955 -1.079 474 HA GLU 61 HA GLU 61 -12.018 -7.558 -0.327 475 HB2 GLU 61 1HB GLU 61 -14.707 -6.600 -1.122 476 HB3 GLU 61 2HB GLU 61 -14.242 -8.202 -1.716 477 HG2 GLU 61 1HG GLU 61 -13.766 -8.915 0.586 478 HG3 GLU 61 2HG GLU 61 -14.284 -7.325 1.163 479 H GLU 62 H GLU 62 -12.543 -5.412 -3.013 480 HA GLU 62 HA GLU 62 -11.946 -7.365 -5.036 481 HB2 GLU 62 1HB GLU 62 -12.461 -4.423 -4.973 482 HB3 GLU 62 2HB GLU 62 -11.648 -5.108 -6.388 483 HG2 GLU 62 1HG GLU 62 -14.170 -6.371 -5.408 484 HG3 GLU 62 2HG GLU 62 -14.246 -4.863 -6.330 485 H LEU 63 H LEU 63 -10.204 -4.696 -3.485 486 HA LEU 63 HA LEU 63 -7.877 -4.679 -4.949 487 HB2 LEU 63 1HB LEU 63 -8.767 -3.557 -2.569 488 HB3 LEU 63 2HB LEU 63 -7.339 -4.498 -2.103 489 HG LEU 63 HG LEU 63 -7.513 -2.144 -3.955 490 HD11 LEU 63 1HD1 LEU 63 -5.380 -1.709 -2.447 491 HD12 LEU 63 2HD1 LEU 63 -6.237 -2.800 -1.359 492 HD13 LEU 63 3HD1 LEU 63 -7.009 -1.310 -1.900 493 HD21 LEU 63 3HD2 LEU 63 -4.858 -3.090 -3.871 494 HD22 LEU 63 1HD2 LEU 63 -5.925 -2.961 -5.269 495 HD23 LEU 63 2HD2 LEU 63 -5.877 -4.455 -4.332 496 H LYS 64 H LYS 64 -8.570 -6.683 -2.088 497 HA LYS 64 HA LYS 64 -6.172 -8.068 -1.959 498 HB2 LYS 64 1HB LYS 64 -7.298 -8.762 -0.156 499 HB3 LYS 64 2HB LYS 64 -8.859 -8.384 -0.904 500 HG2 LYS 64 1HG LYS 64 -9.102 -10.505 -1.811 501 HG3 LYS 64 2HG LYS 64 -7.368 -10.850 -1.695 502 HD2 LYS 64 1HD LYS 64 -7.698 -11.854 0.264 503 HD3 LYS 64 2HD LYS 64 -8.297 -10.323 0.928 504 HE2 LYS 64 1HE LYS 64 -10.133 -11.649 1.293 505 HE3 LYS 64 2HE LYS 64 -10.507 -11.027 -0.322 506 HZ1 LYS 64 3HZ LYS 64 -10.042 -13.025 -1.307 507 HZ2 LYS 64 1HZ LYS 64 -10.656 -13.560 0.176 508 HZ3 LYS 64 2HZ LYS 64 -8.985 -13.527 -0.087 509 H LEU 65 H LEU 65 -8.991 -8.643 -3.987 510 HA LEU 65 HA LEU 65 -8.152 -11.157 -4.997 511 HB2 LEU 65 1HB LEU 65 -10.205 -9.125 -5.701 512 HB3 LEU 65 2HB LEU 65 -9.738 -10.285 -6.958 513 HG LEU 65 HG LEU 65 -10.487 -12.132 -5.641 514 HD11 LEU 65 1HD1 LEU 65 -11.725 -11.159 -3.395 515 HD12 LEU 65 2HD1 LEU 65 -10.233 -10.221 -3.457 516 HD13 LEU 65 3HD1 LEU 65 -10.166 -11.984 -3.439 517 HD21 LEU 65 3HD2 LEU 65 -12.370 -9.807 -5.801 518 HD22 LEU 65 1HD2 LEU 65 -12.894 -11.357 -5.145 519 HD23 LEU 65 2HD2 LEU 65 -12.300 -11.257 -6.803 520 H GLU 66 H GLU 66 -7.657 -7.829 -6.038 521 HA GLU 66 HA GLU 66 -6.475 -8.464 -8.542 522 HB2 GLU 66 1HB GLU 66 -6.010 -5.967 -6.902 523 HB3 GLU 66 2HB GLU 66 -5.849 -6.151 -8.655 524 HG2 GLU 66 1HG GLU 66 -8.489 -6.640 -7.331 525 HG3 GLU 66 2HG GLU 66 -7.944 -4.992 -7.673 526 H LEU 67 H LEU 67 -5.246 -8.126 -5.286 527 HA LEU 67 HA LEU 67 -2.500 -7.947 -5.929 528 HB2 LEU 67 1HB LEU 67 -3.855 -9.005 -3.443 529 HB3 LEU 67 2HB LEU 67 -2.128 -8.633 -3.590 530 HG LEU 67 HG LEU 67 -4.324 -6.589 -3.890 531 HD11 LEU 67 1HD1 LEU 67 -4.232 -7.593 -1.617 532 HD12 LEU 67 2HD1 LEU 67 -3.837 -5.875 -1.658 533 HD13 LEU 67 3HD1 LEU 67 -2.551 -7.071 -1.503 534 HD21 LEU 67 3HD2 LEU 67 -2.719 -5.050 -4.248 535 HD22 LEU 67 1HD2 LEU 67 -1.788 -6.443 -4.800 536 HD23 LEU 67 2HD2 LEU 67 -1.573 -5.835 -3.159 537 HA PRO 68 HA PRO 68 -1.447 -12.059 -7.065 538 HB2 PRO 68 2HB PRO 68 0.630 -11.238 -7.605 539 HB3 PRO 68 1HB PRO 68 1.148 -12.166 -6.198 540 HG2 PRO 68 1HG PRO 68 1.098 -10.321 -4.787 541 HG3 PRO 68 2HG PRO 68 1.623 -9.560 -6.337 542 HD2 PRO 68 1HD PRO 68 -0.517 -8.674 -4.918 543 HD3 PRO 68 2HD PRO 68 -0.454 -8.619 -6.688 544 H GLU 69 H GLU 69 -0.181 -14.027 -6.058 545 HA GLU 69 HA GLU 69 -1.296 -14.431 -3.367 546 HB2 GLU 69 1HB GLU 69 -1.042 -16.881 -3.914 547 HB3 GLU 69 2HB GLU 69 -2.227 -16.000 -4.891 548 HG2 GLU 69 1HG GLU 69 0.334 -15.898 -6.176 549 HG3 GLU 69 2HG GLU 69 -0.081 -17.572 -5.783 550 H ARG 70 H ARG 70 1.623 -14.393 -5.221 551 HA ARG 70 HA ARG 70 3.170 -14.757 -2.781 552 HB2 ARG 70 1HB ARG 70 3.730 -16.381 -5.274 553 HB3 ARG 70 2HB ARG 70 4.654 -16.413 -3.764 554 HG2 ARG 70 1HG ARG 70 1.737 -17.145 -3.857 555 HG3 ARG 70 2HG ARG 70 3.025 -18.320 -4.177 556 HD2 ARG 70 1HD ARG 70 3.988 -17.336 -1.899 557 HD3 ARG 70 2HD ARG 70 2.277 -16.964 -1.641 558 HE ARG 70 HE ARG 70 3.498 -19.534 -1.518 559 HH11 ARG 70 2HH1 ARG 70 0.550 -17.881 -2.354 560 HH12 ARG 70 1HH1 ARG 70 -0.461 -19.252 -2.044 561 HH21 ARG 70 1HH2 ARG 70 0.466 -21.225 -1.334 562 HH22 ARG 70 2HH2 ARG 70 2.177 -21.348 -1.107 563 H GLN 71 H GLN 71 2.842 -12.373 -3.903 564 HA GLN 71 HA GLN 71 5.497 -11.779 -4.935 565 HB2 GLN 71 1HB GLN 71 2.936 -11.076 -6.377 566 HB3 GLN 71 2HB GLN 71 4.480 -10.269 -6.694 567 HG2 GLN 71 1HG GLN 71 5.483 -12.351 -7.402 568 HG3 GLN 71 2HG GLN 71 4.000 -13.225 -6.991 569 HE21 GLN 71 2HE2 GLN 71 3.118 -12.965 -10.335 570 HE22 GLN 71 1HE2 GLN 71 3.560 -13.980 -9.010 571 HA PRO 72 HA PRO 72 4.578 -8.691 -1.795 572 HB2 PRO 72 2HB PRO 72 6.528 -9.334 -0.764 573 HB3 PRO 72 1HB PRO 72 7.177 -7.874 -1.509 574 HG2 PRO 72 1HG PRO 72 8.084 -9.028 -3.310 575 HG3 PRO 72 2HG PRO 72 8.291 -10.234 -1.986 576 HD2 PRO 72 1HD PRO 72 7.034 -10.821 -4.320 577 HD3 PRO 72 2HD PRO 72 6.558 -11.537 -2.770 578 H ARG 73 H ARG 73 3.893 -6.684 -2.183 579 HA ARG 73 HA ARG 73 5.393 -4.908 -3.916 580 HB2 ARG 73 1HB ARG 73 3.401 -4.335 -5.286 581 HB3 ARG 73 2HB ARG 73 3.980 -5.987 -5.544 582 HG2 ARG 73 1HG ARG 73 2.215 -6.772 -3.938 583 HG3 ARG 73 2HG ARG 73 1.571 -5.122 -3.970 584 HD2 ARG 73 1HD ARG 73 0.388 -6.614 -5.541 585 HD3 ARG 73 2HD ARG 73 1.196 -5.268 -6.356 586 HE ARG 73 HE ARG 73 2.905 -7.512 -6.304 587 HH11 ARG 73 2HH1 ARG 73 0.008 -6.335 -7.834 588 HH12 ARG 73 1HH1 ARG 73 0.239 -7.261 -9.279 589 HH21 ARG 73 1HH2 ARG 73 2.067 -8.627 -9.488 590 HH22 ARG 73 2HH2 ARG 73 3.221 -8.736 -8.203 591 H PHE 74 H PHE 74 3.974 -2.755 -4.111 592 HA PHE 74 HA PHE 74 3.108 -2.136 -1.365 593 HB2 PHE 74 1HB PHE 74 4.298 -0.316 -3.475 594 HB3 PHE 74 2HB PHE 74 3.747 0.207 -1.883 595 HD1 PHE 74 2HD PHE 74 4.737 -1.873 -0.109 596 HD2 PHE 74 1HD PHE 74 6.601 -0.043 -3.469 597 HE1 PHE 74 2HE PHE 74 6.946 -2.376 0.848 598 HE2 PHE 74 1HE PHE 74 8.815 -0.545 -2.517 599 HZ PHE 74 HZ PHE 74 8.989 -1.711 -0.356 600 H VAL 75 H VAL 75 1.229 -0.992 -1.017 601 HA VAL 75 HA VAL 75 -0.352 -0.091 -3.285 602 HB VAL 75 HB VAL 75 -1.455 -2.147 -1.365 603 HG11 VAL 75 1HG1 VAL 75 -3.444 -2.091 -2.736 604 HG12 VAL 75 2HG1 VAL 75 -3.080 -0.462 -2.160 605 HG13 VAL 75 3HG1 VAL 75 -2.700 -0.918 -3.821 606 HG21 VAL 75 3HG2 VAL 75 -0.053 -3.363 -2.789 607 HG22 VAL 75 1HG2 VAL 75 -1.643 -3.493 -3.541 608 HG23 VAL 75 2HG2 VAL 75 -0.452 -2.364 -4.186 609 H VAL 76 H VAL 76 -1.727 1.551 -2.783 610 HA VAL 76 HA VAL 76 -1.890 2.321 0.060 611 HB VAL 76 HB VAL 76 -1.756 4.145 -2.345 612 HG11 VAL 76 1HG1 VAL 76 -3.157 4.710 -0.151 613 HG12 VAL 76 2HG1 VAL 76 -1.556 5.184 0.422 614 HG13 VAL 76 3HG1 VAL 76 -2.233 5.931 -1.026 615 HG21 VAL 76 3HG2 VAL 76 0.424 4.626 -1.801 616 HG22 VAL 76 1HG2 VAL 76 0.219 4.155 -0.113 617 HG23 VAL 76 2HG2 VAL 76 0.348 2.918 -1.365 618 H TYR 77 H TYR 77 -3.887 1.511 0.543 619 HA TYR 77 HA TYR 77 -6.140 2.019 -1.213 620 HB2 TYR 77 1HB TYR 77 -5.819 -0.151 0.023 621 HB3 TYR 77 2HB TYR 77 -6.152 0.725 1.518 622 HD1 TYR 77 1HD TYR 77 -7.825 1.081 -1.789 623 HD2 TYR 77 2HD TYR 77 -8.185 -0.138 2.271 624 HE1 TYR 77 1HE TYR 77 -10.241 0.752 -2.110 625 HE2 TYR 77 2HE TYR 77 -10.603 -0.471 1.962 626 HH TYR 77 HH TYR 77 -12.171 0.226 -1.148 627 H SER 78 H SER 78 -7.582 3.609 -0.990 628 HA SER 78 HA SER 78 -7.396 5.301 1.415 629 HB2 SER 78 1HB SER 78 -6.734 6.392 -0.729 630 HB3 SER 78 2HB SER 78 -8.371 6.096 -1.339 631 HG SER 78 HG SER 78 -7.962 7.476 1.086 632 H TYR 79 H TYR 79 -8.938 4.404 2.711 633 HA TYR 79 HA TYR 79 -11.548 3.722 1.681 634 HB2 TYR 79 1HB TYR 79 -10.568 2.346 3.432 635 HB3 TYR 79 2HB TYR 79 -10.454 3.747 4.501 636 HD1 TYR 79 2HD TYR 79 -12.783 1.362 2.947 637 HD2 TYR 79 1HD TYR 79 -12.365 4.584 5.694 638 HE1 TYR 79 2HE TYR 79 -15.032 0.894 3.828 639 HE2 TYR 79 1HE TYR 79 -14.611 4.125 6.583 640 HH TYR 79 HH TYR 79 -16.857 2.771 5.299 641 H LYS 80 H LYS 80 -13.517 4.547 2.857 642 HA LYS 80 HA LYS 80 -13.243 7.429 3.410 643 HB2 LYS 80 1HB LYS 80 -14.305 6.996 1.225 644 HB3 LYS 80 2HB LYS 80 -15.551 6.036 2.040 645 HG2 LYS 80 1HG LYS 80 -16.253 8.036 3.300 646 HG3 LYS 80 2HG LYS 80 -15.050 8.982 2.407 647 HD2 LYS 80 1HD LYS 80 -16.167 8.379 0.286 648 HD3 LYS 80 2HD LYS 80 -17.396 7.505 1.214 649 HE2 LYS 80 1HE LYS 80 -18.358 9.430 2.041 650 HE3 LYS 80 2HE LYS 80 -16.855 10.354 1.898 651 HZ1 LYS 80 3HZ LYS 80 -18.414 9.438 -0.453 652 HZ2 LYS 80 1HZ LYS 80 -17.143 10.556 -0.426 653 HZ3 LYS 80 2HZ LYS 80 -18.632 10.952 0.270 654 H TYR 81 H TYR 81 -13.374 7.512 5.584 655 HA TYR 81 HA TYR 81 -15.419 5.937 6.958 656 HB2 TYR 81 1HB TYR 81 -12.828 6.442 7.620 657 HB3 TYR 81 2HB TYR 81 -13.654 7.702 8.538 658 HD1 TYR 81 1HD TYR 81 -15.900 6.763 9.759 659 HD2 TYR 81 2HD TYR 81 -12.437 4.488 8.793 660 HE1 TYR 81 1HE TYR 81 -16.480 5.146 11.519 661 HE2 TYR 81 2HE TYR 81 -13.007 2.863 10.550 662 HH TYR 81 HH TYR 81 -14.803 2.125 11.861 663 H VAL 82 H VAL 82 -17.149 6.807 7.979 664 HA VAL 82 HA VAL 82 -17.591 9.689 7.593 665 HB VAL 82 HB VAL 82 -19.718 7.664 8.258 666 HG11 VAL 82 1HG1 VAL 82 -20.948 9.537 6.814 667 HG12 VAL 82 2HG1 VAL 82 -20.731 9.674 8.561 668 HG13 VAL 82 3HG1 VAL 82 -19.635 10.517 7.467 669 HG21 VAL 82 3HG2 VAL 82 -18.335 7.210 6.108 670 HG22 VAL 82 1HG2 VAL 82 -20.097 7.189 6.022 671 HG23 VAL 82 2HG2 VAL 82 -19.203 8.603 5.463 672 H HIS 83 H HIS 83 -18.745 10.856 9.276 673 HA HIS 83 HA HIS 83 -17.864 10.000 11.930 674 HB2 HIS 83 1HB HIS 83 -18.779 12.656 10.819 675 HB3 HIS 83 2HB HIS 83 -18.523 12.386 12.546 676 HD1 HIS 83 1HD HIS 83 -16.309 13.145 13.308 677 HD2 HIS 83 2HD HIS 83 -16.201 11.811 9.375 678 HE1 HIS 83 1HE HIS 83 -13.930 13.462 12.556 679 HE2 HIS 83 2HE HIS 83 -13.863 12.646 10.152 680 H ASP 84 H ASP 84 -20.541 12.183 11.441 681 HA ASP 84 HA ASP 84 -22.695 10.445 11.676 682 HB2 ASP 84 1HB ASP 84 -21.209 10.659 14.105 683 HB3 ASP 84 2HB ASP 84 -22.766 11.467 14.335 684 H ASP 85 H ASP 85 -21.369 13.530 12.775 685 HA ASP 85 HA ASP 85 -23.880 14.880 12.825 686 HB2 ASP 85 1HB ASP 85 -21.414 15.436 13.828 687 HB3 ASP 85 2HB ASP 85 -21.443 16.497 12.413 688 H GLY 86 H GLY 86 -22.010 13.763 10.302 689 HA2 GLY 86 1HA GLY 86 -23.085 14.058 8.088 690 HA3 GLY 86 2HA GLY 86 -23.167 15.771 8.467 691 H ARG 87 H ARG 87 -20.320 14.247 9.534 692 HA ARG 87 HA ARG 87 -18.856 15.374 7.240 693 HB2 ARG 87 1HB ARG 87 -18.084 15.098 10.147 694 HB3 ARG 87 2HB ARG 87 -16.917 15.482 8.874 695 HG2 ARG 87 1HG ARG 87 -19.381 17.136 9.404 696 HG3 ARG 87 2HG ARG 87 -17.807 17.446 10.157 697 HD2 ARG 87 1HD ARG 87 -16.777 17.907 8.065 698 HD3 ARG 87 2HD ARG 87 -18.167 17.267 7.176 699 HE ARG 87 HE ARG 87 -18.761 19.536 8.858 700 HH11 ARG 87 2HH1 ARG 87 -17.769 18.446 5.704 701 HH12 ARG 87 1HH1 ARG 87 -18.286 19.891 4.899 702 HH21 ARG 87 1HH2 ARG 87 -19.237 21.595 6.098 703 HH22 ARG 87 2HH2 ARG 87 -19.445 21.443 7.810 704 H VAL 88 H VAL 88 -17.394 14.139 6.168 705 HA VAL 88 HA VAL 88 -16.746 11.482 7.224 706 HB VAL 88 HB VAL 88 -18.624 11.071 5.762 707 HG11 VAL 88 1HG1 VAL 88 -17.828 13.264 4.375 708 HG12 VAL 88 2HG1 VAL 88 -17.313 11.968 3.293 709 HG13 VAL 88 3HG1 VAL 88 -19.002 12.084 3.791 710 HG21 VAL 88 3HG2 VAL 88 -15.908 10.221 4.902 711 HG22 VAL 88 1HG2 VAL 88 -17.241 9.265 5.549 712 HG23 VAL 88 2HG2 VAL 88 -17.277 9.807 3.871 713 H SER 89 H SER 89 -14.676 10.929 6.928 714 HA SER 89 HA SER 89 -13.094 12.481 4.985 715 HB2 SER 89 1HB SER 89 -12.190 11.501 7.711 716 HB3 SER 89 2HB SER 89 -11.199 12.393 6.543 717 HG SER 89 HG SER 89 -13.635 13.499 7.381 718 H TYR 90 H TYR 90 -11.245 11.401 4.089 719 HA TYR 90 HA TYR 90 -11.633 8.492 3.951 720 HB2 TYR 90 1HB TYR 90 -9.882 9.963 2.022 721 HB3 TYR 90 2HB TYR 90 -10.889 8.536 1.764 722 HD1 TYR 90 1HD TYR 90 -13.326 8.760 1.416 723 HD2 TYR 90 2HD TYR 90 -10.795 12.166 1.705 724 HE1 TYR 90 1HE TYR 90 -15.098 10.151 0.431 725 HE2 TYR 90 2HE TYR 90 -12.560 13.569 0.721 726 HH TYR 90 HH TYR 90 -15.408 12.216 -0.689 727 HA PRO 91 HA PRO 91 -7.814 8.648 6.421 728 HB2 PRO 91 2HB PRO 91 -8.948 7.603 8.122 729 HB3 PRO 91 1HB PRO 91 -8.161 6.154 7.496 730 HG2 PRO 91 1HG PRO 91 -10.017 5.515 6.253 731 HG3 PRO 91 2HG PRO 91 -10.804 6.272 7.686 732 HD2 PRO 91 1HD PRO 91 -11.369 7.020 5.139 733 HD3 PRO 91 2HD PRO 91 -11.382 8.159 6.496 734 H LEU 92 H LEU 92 -6.389 8.563 4.668 735 HA LEU 92 HA LEU 92 -6.088 6.247 3.033 736 HB2 LEU 92 1HB LEU 92 -4.882 8.896 3.275 737 HB3 LEU 92 2HB LEU 92 -3.717 7.637 2.834 738 HG LEU 92 HG LEU 92 -5.928 7.246 1.152 739 HD11 LEU 92 1HD1 LEU 92 -5.662 9.662 0.073 740 HD12 LEU 92 2HD1 LEU 92 -5.447 10.102 1.767 741 HD13 LEU 92 3HD1 LEU 92 -6.920 9.284 1.249 742 HD21 LEU 92 3HD2 LEU 92 -4.099 8.467 -0.420 743 HD22 LEU 92 1HD2 LEU 92 -4.000 6.781 0.090 744 HD23 LEU 92 2HD2 LEU 92 -3.096 8.019 0.961 745 H CYS 93 H CYS 93 -4.682 4.567 3.181 746 HA CYS 93 HA CYS 93 -2.713 4.564 5.347 747 HB2 CYS 93 1HB CYS 93 -4.803 2.431 4.886 748 HB3 CYS 93 2HB CYS 93 -3.409 2.239 5.962 749 HG CYS 93 HG CYS 93 -6.080 4.320 6.395 750 H PHE 94 H PHE 94 -1.078 2.895 5.119 751 HA PHE 94 HA PHE 94 -0.597 2.278 2.292 752 HB2 PHE 94 1HB PHE 94 1.114 3.605 3.513 753 HB3 PHE 94 2HB PHE 94 1.347 2.241 4.610 754 HD1 PHE 94 1HD PHE 94 1.745 3.345 1.115 755 HD2 PHE 94 2HD PHE 94 2.676 0.377 4.020 756 HE1 PHE 94 1HE PHE 94 3.414 2.377 -0.413 757 HE2 PHE 94 2HE PHE 94 4.347 -0.595 2.499 758 HZ PHE 94 HZ PHE 94 4.719 0.406 0.279 759 H ILE 95 H ILE 95 -1.393 0.335 1.776 760 HA ILE 95 HA ILE 95 -1.230 -1.866 3.685 761 HB ILE 95 HB ILE 95 -2.565 -1.702 0.981 762 HG12 ILE 95 1HG1 ILE 95 -3.731 -1.811 3.774 763 HG13 ILE 95 2HG1 ILE 95 -3.614 -0.351 2.777 764 HG21 ILE 95 1HG2 ILE 95 -2.035 -3.959 2.800 765 HG22 ILE 95 2HG2 ILE 95 -3.673 -3.852 2.157 766 HG23 ILE 95 3HG2 ILE 95 -2.299 -3.941 1.056 767 HD11 ILE 95 3HD1 ILE 95 -5.799 -1.005 2.453 768 HD12 ILE 95 1HD1 ILE 95 -4.983 -1.695 1.050 769 HD13 ILE 95 2HD1 ILE 95 -5.392 -2.721 2.425 770 H PHE 96 H PHE 96 0.543 -3.068 3.698 771 HA PHE 96 HA PHE 96 2.146 -3.314 1.267 772 HB2 PHE 96 1HB PHE 96 3.328 -2.661 3.300 773 HB3 PHE 96 2HB PHE 96 2.740 -4.106 4.125 774 HD1 PHE 96 2HD PHE 96 3.572 -4.634 0.686 775 HD2 PHE 96 1HD PHE 96 5.184 -4.493 4.623 776 HE1 PHE 96 2HE PHE 96 5.539 -5.900 -0.078 777 HE2 PHE 96 1HE PHE 96 7.154 -5.758 3.866 778 HZ PHE 96 HZ PHE 96 7.333 -6.465 1.513 779 H SER 97 H SER 97 1.338 -4.867 -0.022 780 HA SER 97 HA SER 97 0.196 -7.290 1.025 781 HB2 SER 97 1HB SER 97 -0.686 -6.278 -1.032 782 HB3 SER 97 2HB SER 97 0.883 -6.515 -1.822 783 HG SER 97 HG SER 97 -0.269 -8.768 -0.682 784 H SER 98 H SER 98 1.833 -8.321 2.165 785 HA SER 98 HA SER 98 3.943 -9.502 0.485 786 HB2 SER 98 1HB SER 98 4.599 -7.642 2.250 787 HB3 SER 98 2HB SER 98 4.464 -8.995 3.387 788 HG SER 98 HG SER 98 5.850 -10.048 1.566 789 HA PRO 99 HA PRO 99 1.693 -13.057 2.143 790 HB2 PRO 99 2HB PRO 99 1.310 -13.702 -0.029 791 HB3 PRO 99 1HB PRO 99 2.650 -14.809 0.267 792 HG2 PRO 99 1HG PRO 99 4.212 -13.406 -0.727 793 HG3 PRO 99 2HG PRO 99 2.757 -13.078 -1.740 794 HD2 PRO 99 1HD PRO 99 4.162 -11.107 -0.511 795 HD3 PRO 99 2HD PRO 99 2.408 -11.028 -0.745 796 H VAL 100 H VAL 100 2.720 -15.511 2.191 797 HA VAL 100 HA VAL 100 5.183 -15.203 3.767 798 HB VAL 100 HB VAL 100 3.185 -16.109 4.951 799 HG11 VAL 100 1HG1 VAL 100 2.076 -17.348 3.269 800 HG12 VAL 100 2HG1 VAL 100 3.511 -18.319 2.935 801 HG13 VAL 100 3HG1 VAL 100 2.638 -18.526 4.455 802 HG21 VAL 100 3HG2 VAL 100 4.369 -17.980 6.011 803 HG22 VAL 100 1HG2 VAL 100 5.521 -18.001 4.676 804 HG23 VAL 100 2HG2 VAL 100 5.436 -16.601 5.746 805 H GLY 101 H GLY 101 3.767 -16.802 1.030 806 HA2 GLY 101 1HA GLY 101 5.896 -18.742 0.764 807 HA3 GLY 101 2HA GLY 101 4.581 -18.470 -0.369 808 H CYS 102 H CYS 102 5.634 -15.479 0.078 809 HA CYS 102 HA CYS 102 6.816 -15.189 -2.419 810 HB2 CYS 102 1HB CYS 102 7.781 -13.024 -1.339 811 HB3 CYS 102 2HB CYS 102 6.029 -13.196 -1.538 812 HG CYS 102 HG CYS 102 5.745 -12.328 0.885 813 H LYS 103 H LYS 103 9.070 -14.283 -2.783 814 HA LYS 103 HA LYS 103 10.977 -16.119 -1.546 815 HB2 LYS 103 1HB LYS 103 11.619 -14.255 -3.815 816 HB3 LYS 103 2HB LYS 103 12.335 -15.828 -3.427 817 HG2 LYS 103 1HG LYS 103 10.911 -16.893 -4.752 818 HG3 LYS 103 2HG LYS 103 9.526 -16.115 -3.967 819 HD2 LYS 103 1HD LYS 103 9.573 -15.600 -6.356 820 HD3 LYS 103 2HD LYS 103 9.820 -14.140 -5.381 821 HE2 LYS 103 1HE LYS 103 11.517 -13.820 -6.864 822 HE3 LYS 103 2HE LYS 103 12.372 -14.844 -5.702 823 HZ1 LYS 103 3HZ LYS 103 12.214 -15.351 -8.325 824 HZ2 LYS 103 1HZ LYS 103 10.928 -16.288 -7.750 825 HZ3 LYS 103 2HZ LYS 103 12.489 -16.534 -7.147 826 HA PRO 104 HA PRO 104 12.935 -13.051 0.914 827 HB2 PRO 104 2HB PRO 104 14.156 -14.763 1.841 828 HB3 PRO 104 1HB PRO 104 15.497 -14.020 0.971 829 HG2 PRO 104 1HG PRO 104 15.332 -15.489 -0.821 830 HG3 PRO 104 2HG PRO 104 14.869 -16.562 0.553 831 HD2 PRO 104 1HD PRO 104 13.314 -16.248 -1.650 832 HD3 PRO 104 2HD PRO 104 12.641 -16.514 -0.032 833 H GLU 105 H GLU 105 14.064 -13.726 -2.301 834 HA GLU 105 HA GLU 105 16.003 -11.638 -2.435 835 HB2 GLU 105 1HB GLU 105 14.704 -13.498 -4.365 836 HB3 GLU 105 2HB GLU 105 15.454 -12.032 -5.015 837 HG2 GLU 105 1HG GLU 105 17.368 -13.017 -3.279 838 HG3 GLU 105 2HG GLU 105 16.682 -14.465 -4.030 839 H GLN 106 H GLN 106 12.568 -11.860 -3.001 840 HA GLN 106 HA GLN 106 12.478 -9.183 -4.157 841 HB2 GLN 106 1HB GLN 106 10.037 -10.807 -3.529 842 HB3 GLN 106 2HB GLN 106 10.310 -9.653 -4.844 843 HG2 GLN 106 1HG GLN 106 11.807 -12.253 -4.724 844 HG3 GLN 106 2HG GLN 106 10.184 -12.144 -5.419 845 HE21 GLN 106 2HE2 GLN 106 11.327 -9.896 -8.052 846 HE22 GLN 106 1HE2 GLN 106 10.115 -9.925 -6.822 847 H GLN 107 H GLN 107 11.004 -10.936 -1.426 848 HA GLN 107 HA GLN 107 9.634 -8.939 -0.186 849 HB2 GLN 107 1HB GLN 107 10.569 -11.489 0.519 850 HB3 GLN 107 2HB GLN 107 11.134 -10.406 1.801 851 HG2 GLN 107 1HG GLN 107 8.352 -9.936 1.054 852 HG3 GLN 107 2HG GLN 107 8.659 -11.571 1.657 853 HE21 GLN 107 2HE2 GLN 107 8.803 -8.368 4.139 854 HE22 GLN 107 1HE2 GLN 107 8.654 -8.190 2.427 855 H MET 108 H MET 108 13.097 -9.332 -0.351 856 HA MET 108 HA MET 108 13.707 -7.413 1.682 857 HB2 MET 108 1HB MET 108 15.251 -8.926 -0.380 858 HB3 MET 108 2HB MET 108 15.998 -7.498 0.351 859 HG2 MET 108 1HG MET 108 15.200 -8.697 2.591 860 HG3 MET 108 2HG MET 108 15.344 -10.120 1.555 861 HE1 MET 108 3HE MET 108 17.233 -9.846 -0.299 862 HE2 MET 108 1HE MET 108 18.375 -8.509 -0.160 863 HE3 MET 108 2HE MET 108 18.861 -10.135 0.319 864 H MET 109 H MET 109 13.270 -7.324 -1.799 865 HA MET 109 HA MET 109 14.348 -4.785 -2.301 866 HB2 MET 109 1HB MET 109 12.151 -6.330 -3.690 867 HB3 MET 109 2HB MET 109 12.818 -4.811 -4.308 868 HG2 MET 109 1HG MET 109 14.922 -5.756 -4.735 869 HG3 MET 109 2HG MET 109 14.580 -7.159 -3.719 870 HE1 MET 109 3HE MET 109 11.942 -5.963 -6.880 871 HE2 MET 109 1HE MET 109 13.448 -5.100 -6.567 872 HE3 MET 109 2HE MET 109 13.338 -6.211 -7.931 873 H TYR 110 H TYR 110 11.151 -5.796 -1.222 874 HA TYR 110 HA TYR 110 10.200 -3.039 -1.233 875 HB2 TYR 110 1HB TYR 110 8.716 -5.522 -0.345 876 HB3 TYR 110 2HB TYR 110 8.026 -3.947 -0.742 877 HD1 TYR 110 1HD TYR 110 9.569 -6.969 -2.170 878 HD2 TYR 110 2HD TYR 110 7.617 -3.283 -3.009 879 HE1 TYR 110 1HE TYR 110 9.255 -7.674 -4.505 880 HE2 TYR 110 2HE TYR 110 7.297 -3.978 -5.346 881 HH TYR 110 HH TYR 110 8.925 -6.521 -6.747 882 H ALA 111 H ALA 111 10.850 -5.671 1.042 883 HA ALA 111 HA ALA 111 10.002 -4.382 3.381 884 HB1 ALA 111 3HB ALA 111 12.171 -6.453 3.059 885 HB2 ALA 111 1HB ALA 111 11.382 -6.011 4.574 886 HB3 ALA 111 2HB ALA 111 10.452 -6.776 3.285 887 H GLY 112 H GLY 112 12.874 -4.010 1.471 888 HA2 GLY 112 1HA GLY 112 14.232 -2.520 3.591 889 HA3 GLY 112 2HA GLY 112 14.923 -2.981 2.042 890 H SER 113 H SER 113 12.386 -1.963 0.724 891 HA SER 113 HA SER 113 13.132 0.885 0.789 892 HB2 SER 113 1HB SER 113 11.639 -0.302 -1.522 893 HB3 SER 113 2HB SER 113 12.811 1.027 -1.496 894 HG SER 113 HG SER 113 13.754 -1.488 -0.778 895 H LYS 114 H LYS 114 10.921 -1.013 2.077 896 HA LYS 114 HA LYS 114 8.427 0.012 1.290 897 HB2 LYS 114 1HB LYS 114 8.515 -2.011 2.564 898 HB3 LYS 114 2HB LYS 114 9.361 -1.200 3.892 899 HG2 LYS 114 1HG LYS 114 7.415 0.045 4.491 900 HG3 LYS 114 2HG LYS 114 6.563 -0.501 3.035 901 HD2 LYS 114 1HD LYS 114 5.668 -2.002 4.484 902 HD3 LYS 114 2HD LYS 114 7.155 -2.886 4.101 903 HE2 LYS 114 1HE LYS 114 8.247 -2.023 6.086 904 HE3 LYS 114 2HE LYS 114 6.843 -1.004 6.437 905 HZ1 LYS 114 3HZ LYS 114 6.160 -3.775 6.147 906 HZ2 LYS 114 1HZ LYS 114 5.778 -2.693 7.390 907 HZ3 LYS 114 2HZ LYS 114 7.261 -3.504 7.403 908 H ASN 115 H ASN 115 10.098 0.732 4.359 909 HA ASN 115 HA ASN 115 8.601 2.901 5.125 910 HB2 ASN 115 1HB ASN 115 10.407 3.535 6.570 911 HB3 ASN 115 2HB ASN 115 10.389 1.770 6.477 912 HD21 ASN 115 2HD2 ASN 115 13.473 1.471 4.841 913 HD22 ASN 115 1HD2 ASN 115 11.963 0.709 5.192 914 H ARG 116 H ARG 116 11.418 2.858 2.983 915 HA ARG 116 HA ARG 116 11.743 5.612 2.670 916 HB2 ARG 116 1HB ARG 116 13.473 4.236 1.860 917 HB3 ARG 116 2HB ARG 116 12.356 3.274 0.880 918 HG2 ARG 116 1HG ARG 116 13.558 4.611 -0.642 919 HG3 ARG 116 2HG ARG 116 11.955 5.351 -0.495 920 HD2 ARG 116 1HD ARG 116 13.273 7.221 -0.305 921 HD3 ARG 116 2HD ARG 116 13.131 6.752 1.395 922 HE ARG 116 HE ARG 116 15.372 6.302 1.422 923 HH11 ARG 116 2HH1 ARG 116 14.287 6.460 -1.882 924 HH12 ARG 116 1HH1 ARG 116 15.884 6.359 -2.547 925 HH21 ARG 116 1HH2 ARG 116 17.698 6.193 -1.158 926 HH22 ARG 116 2HH2 ARG 116 17.478 6.169 0.558 927 H LEU 117 H LEU 117 9.876 3.330 0.672 928 HA LEU 117 HA LEU 117 8.843 5.289 -1.083 929 HB2 LEU 117 1HB LEU 117 8.915 2.913 -1.644 930 HB3 LEU 117 2HB LEU 117 7.751 2.574 -0.352 931 HG LEU 117 HG LEU 117 6.736 2.527 -2.596 932 HD11 LEU 117 1HD1 LEU 117 4.786 3.354 -1.833 933 HD12 LEU 117 2HD1 LEU 117 5.488 4.912 -1.398 934 HD13 LEU 117 3HD1 LEU 117 5.690 3.525 -0.329 935 HD21 LEU 117 3HD2 LEU 117 7.621 5.403 -2.644 936 HD22 LEU 117 1HD2 LEU 117 6.370 4.759 -3.706 937 HD23 LEU 117 2HD2 LEU 117 8.014 4.125 -3.795 938 H VAL 118 H VAL 118 7.290 3.575 1.635 939 HA VAL 118 HA VAL 118 4.846 4.802 1.658 940 HB VAL 118 HB VAL 118 6.510 4.069 4.072 941 HG11 VAL 118 1HG1 VAL 118 4.355 5.622 4.217 942 HG12 VAL 118 2HG1 VAL 118 3.544 4.056 4.142 943 HG13 VAL 118 3HG1 VAL 118 4.709 4.387 5.425 944 HG21 VAL 118 3HG2 VAL 118 4.432 2.508 2.539 945 HG22 VAL 118 1HG2 VAL 118 6.168 2.197 2.561 946 HG23 VAL 118 2HG2 VAL 118 5.215 1.981 4.028 947 H GLN 119 H GLN 119 7.710 5.926 3.467 948 HA GLN 119 HA GLN 119 6.729 8.201 4.603 949 HB2 GLN 119 1HB GLN 119 9.418 7.502 3.481 950 HB3 GLN 119 2HB GLN 119 9.125 9.143 4.076 951 HG2 GLN 119 1HG GLN 119 8.142 7.574 6.113 952 HG3 GLN 119 2HG GLN 119 9.556 6.673 5.547 953 HE21 GLN 119 2HE2 GLN 119 10.125 10.466 6.994 954 HE22 GLN 119 1HE2 GLN 119 8.680 10.066 6.137 955 H THR 120 H THR 120 8.003 7.900 1.302 956 HA THR 120 HA THR 120 7.770 10.550 0.510 957 HB THR 120 HB THR 120 7.444 8.032 -1.128 958 HG1 THR 120 1HG THR 120 9.640 8.994 -1.799 959 HG21 THR 120 3HG2 THR 120 7.538 10.921 -1.948 960 HG22 THR 120 1HG2 THR 120 6.407 9.666 -2.452 961 HG23 THR 120 2HG2 THR 120 8.071 9.637 -3.033 962 H ALA 121 H ALA 121 5.363 7.944 0.323 963 HA ALA 121 HA ALA 121 3.348 9.551 -0.877 964 HB1 ALA 121 3HB ALA 121 2.500 7.528 -1.207 965 HB2 ALA 121 1HB ALA 121 3.656 6.822 -0.078 966 HB3 ALA 121 2HB ALA 121 2.112 7.439 0.511 967 H GLU 122 H GLU 122 4.657 9.654 2.166 968 HA GLU 122 HA GLU 122 4.050 10.604 4.143 969 HB2 GLU 122 1HB GLU 122 3.331 12.345 2.251 970 HB3 GLU 122 2HB GLU 122 1.725 11.985 2.903 971 HG2 GLU 122 1HG GLU 122 2.456 13.884 4.068 972 HG3 GLU 122 2HG GLU 122 2.670 12.526 5.184 973 H LEU 123 H LEU 123 3.265 8.195 4.327 974 HA LEU 123 HA LEU 123 0.447 8.276 5.184 975 HB2 LEU 123 1HB LEU 123 1.917 5.845 4.156 976 HB3 LEU 123 2HB LEU 123 0.198 5.969 4.572 977 HG LEU 123 HG LEU 123 1.342 7.646 2.370 978 HD11 LEU 123 1HD1 LEU 123 2.015 5.310 1.940 979 HD12 LEU 123 2HD1 LEU 123 0.844 5.914 0.769 980 HD13 LEU 123 3HD1 LEU 123 0.323 4.826 2.056 981 HD21 LEU 123 3HD2 LEU 123 -0.789 8.346 2.566 982 HD22 LEU 123 1HD2 LEU 123 -1.307 6.879 3.397 983 HD23 LEU 123 2HD2 LEU 123 -1.146 6.886 1.640 984 H THR 124 H THR 124 0.614 8.525 7.337 985 HA THR 124 HA THR 124 2.691 7.368 8.909 986 HB THR 124 HB THR 124 1.619 9.418 9.650 987 HG1 THR 124 1HG THR 124 1.291 8.787 11.803 988 HG21 THR 124 3HG2 THR 124 -0.629 9.678 10.086 989 HG22 THR 124 1HG2 THR 124 -0.884 7.956 10.371 990 HG23 THR 124 2HG2 THR 124 -0.682 8.558 8.726 991 H LYS 125 H LYS 125 -0.490 6.355 7.932 992 HA LYS 125 HA LYS 125 -0.609 4.208 9.879 993 HB2 LYS 125 1HB LYS 125 -2.436 4.604 7.509 994 HB3 LYS 125 2HB LYS 125 -2.773 3.737 9.017 995 HG2 LYS 125 1HG LYS 125 -2.091 6.576 9.366 996 HG3 LYS 125 2HG LYS 125 -3.590 6.263 8.472 997 HD2 LYS 125 1HD LYS 125 -3.621 4.481 10.647 998 HD3 LYS 125 2HD LYS 125 -3.071 6.038 11.294 999 HE2 LYS 125 1HE LYS 125 -5.115 6.858 9.704 1000 HE3 LYS 125 2HE LYS 125 -5.694 5.261 10.201 1001 HZ1 LYS 125 3HZ LYS 125 -6.380 6.264 12.047 1002 HZ2 LYS 125 1HZ LYS 125 -5.497 7.671 11.727 1003 HZ3 LYS 125 2HZ LYS 125 -4.755 6.368 12.510 1004 H VAL 126 H VAL 126 1.190 2.941 9.358 1005 HA VAL 126 HA VAL 126 1.208 1.694 6.701 1006 HB VAL 126 HB VAL 126 3.339 1.414 8.813 1007 HG11 VAL 126 1HG1 VAL 126 4.303 1.357 6.141 1008 HG12 VAL 126 2HG1 VAL 126 4.295 0.059 7.338 1009 HG13 VAL 126 3HG1 VAL 126 2.920 0.268 6.253 1010 HG21 VAL 126 3HG2 VAL 126 4.560 3.201 7.634 1011 HG22 VAL 126 1HG2 VAL 126 3.135 3.492 6.636 1012 HG23 VAL 126 2HG2 VAL 126 3.069 3.784 8.375 1013 H PHE 127 H PHE 127 -0.054 -0.058 6.637 1014 HA PHE 127 HA PHE 127 -0.018 -1.903 8.927 1015 HB2 PHE 127 1HB PHE 127 -2.010 -1.783 6.647 1016 HB3 PHE 127 2HB PHE 127 -2.136 -2.767 8.107 1017 HD1 PHE 127 2HD PHE 127 -1.008 -0.430 9.894 1018 HD2 PHE 127 1HD PHE 127 -4.185 -0.767 7.081 1019 HE1 PHE 127 2HE PHE 127 -2.212 1.382 11.042 1020 HE2 PHE 127 1HE PHE 127 -5.393 1.046 8.225 1021 HZ PHE 127 HZ PHE 127 -4.408 2.123 10.209 1022 H GLU 128 H GLU 128 0.430 -4.069 8.653 1023 HA GLU 128 HA GLU 128 1.484 -4.834 6.009 1024 HB2 GLU 128 1HB GLU 128 3.208 -4.505 7.813 1025 HB3 GLU 128 2HB GLU 128 2.467 -5.866 8.670 1026 HG2 GLU 128 1HG GLU 128 2.849 -7.080 6.348 1027 HG3 GLU 128 2HG GLU 128 4.110 -5.848 6.202 1028 H ILE 129 H ILE 129 0.124 -6.219 5.090 1029 HA ILE 129 HA ILE 129 -1.512 -7.988 6.718 1030 HB ILE 129 HB ILE 129 -2.342 -8.699 4.358 1031 HG12 ILE 129 1HG1 ILE 129 -1.319 -5.968 3.618 1032 HG13 ILE 129 2HG1 ILE 129 -0.325 -7.408 3.341 1033 HG21 ILE 129 1HG2 ILE 129 -3.425 -7.187 6.146 1034 HG22 ILE 129 2HG2 ILE 129 -2.957 -5.860 5.083 1035 HG23 ILE 129 3HG2 ILE 129 -4.041 -7.120 4.495 1036 HD11 ILE 129 3HD1 ILE 129 -1.757 -8.266 1.747 1037 HD12 ILE 129 1HD1 ILE 129 -3.124 -7.303 2.308 1038 HD13 ILE 129 2HD1 ILE 129 -1.805 -6.532 1.426 1039 H ARG 130 H ARG 130 -1.069 -10.059 7.091 1040 HA ARG 130 HA ARG 130 1.348 -11.233 6.146 1041 HB2 ARG 130 1HB ARG 130 0.639 -11.826 8.334 1042 HB3 ARG 130 2HB ARG 130 -0.966 -12.300 7.756 1043 HG2 ARG 130 1HG ARG 130 0.341 -14.265 8.292 1044 HG3 ARG 130 2HG ARG 130 0.030 -14.187 6.550 1045 HD2 ARG 130 1HD ARG 130 2.275 -14.730 6.581 1046 HD3 ARG 130 2HD ARG 130 2.330 -12.966 6.466 1047 HE ARG 130 HE ARG 130 2.372 -13.485 9.152 1048 HH11 ARG 130 2HH1 ARG 130 4.310 -14.415 6.414 1049 HH12 ARG 130 1HH1 ARG 130 5.771 -14.562 7.333 1050 HH21 ARG 130 1HH2 ARG 130 5.758 -14.144 9.585 1051 HH22 ARG 130 2HH2 ARG 130 4.289 -13.677 10.373 1052 H THR 131 H THR 131 -1.744 -10.981 4.829 1053 HA THR 131 HA THR 131 -1.097 -12.435 2.509 1054 HB THR 131 HB THR 131 -1.392 -14.475 3.640 1055 HG1 THR 131 1HG THR 131 -2.571 -14.733 1.833 1056 HG21 THR 131 3HG2 THR 131 -4.081 -13.848 4.732 1057 HG22 THR 131 1HG2 THR 131 -2.687 -13.148 5.553 1058 HG23 THR 131 2HG2 THR 131 -2.818 -14.897 5.372 1059 H THR 132 H THR 132 -2.520 -12.014 0.863 1060 HA THR 132 HA THR 132 -4.034 -9.827 0.731 1061 HB THR 132 HB THR 132 -5.512 -11.005 -0.966 1062 HG1 THR 132 1HG THR 132 -4.390 -13.166 -1.481 1063 HG21 THR 132 3HG2 THR 132 -3.125 -9.963 -1.288 1064 HG22 THR 132 1HG2 THR 132 -3.874 -10.893 -2.584 1065 HG23 THR 132 2HG2 THR 132 -2.655 -11.642 -1.554 1066 H ASP 133 H ASP 133 -5.318 -12.984 1.757 1067 HA ASP 133 HA ASP 133 -7.941 -12.492 2.141 1068 HB2 ASP 133 1HB ASP 133 -6.017 -14.300 3.250 1069 HB3 ASP 133 2HB ASP 133 -7.088 -13.748 4.545 1070 H ASP 134 H ASP 134 -5.422 -11.678 4.526 1071 HA ASP 134 HA ASP 134 -6.848 -10.578 6.537 1072 HB2 ASP 134 1HB ASP 134 -4.216 -9.889 5.316 1073 HB3 ASP 134 2HB ASP 134 -4.896 -8.754 6.490 1074 H LEU 135 H LEU 135 -5.980 -8.900 3.527 1075 HA LEU 135 HA LEU 135 -7.115 -6.425 4.110 1076 HB2 LEU 135 1HB LEU 135 -5.707 -6.582 2.225 1077 HB3 LEU 135 2HB LEU 135 -6.675 -7.891 1.526 1078 HG LEU 135 HG LEU 135 -8.326 -6.433 0.763 1079 HD11 LEU 135 1HD1 LEU 135 -8.992 -5.044 2.431 1080 HD12 LEU 135 2HD1 LEU 135 -8.029 -3.898 1.499 1081 HD13 LEU 135 3HD1 LEU 135 -7.342 -4.667 2.930 1082 HD21 LEU 135 3HD2 LEU 135 -6.839 -4.381 -0.092 1083 HD22 LEU 135 1HD2 LEU 135 -6.730 -6.001 -0.783 1084 HD23 LEU 135 2HD2 LEU 135 -5.550 -5.473 0.417 1085 H THR 136 H THR 136 -9.056 -7.002 5.272 1086 HA THR 136 HA THR 136 -11.307 -7.592 3.462 1087 HB THR 136 HB THR 136 -12.375 -8.347 5.787 1088 HG1 THR 136 1HG THR 136 -10.913 -9.114 7.193 1089 HG21 THR 136 3HG2 THR 136 -10.948 -9.754 3.640 1090 HG22 THR 136 1HG2 THR 136 -12.558 -10.034 4.302 1091 HG23 THR 136 2HG2 THR 136 -11.140 -10.682 5.127 1092 H GLU 137 H GLU 137 -13.192 -6.413 3.736 1093 HA GLU 137 HA GLU 137 -13.160 -3.791 4.264 1094 HB2 GLU 137 1HB GLU 137 -15.128 -4.927 3.383 1095 HB3 GLU 137 2HB GLU 137 -15.431 -5.658 4.966 1096 HG2 GLU 137 1HG GLU 137 -15.377 -3.036 5.639 1097 HG3 GLU 137 2HG GLU 137 -16.019 -2.952 3.992 1098 H THR 138 H THR 138 -13.618 -6.305 6.708 1099 HA THR 138 HA THR 138 -13.950 -4.459 8.870 1100 HB THR 138 HB THR 138 -13.144 -7.356 9.122 1101 HG1 THR 138 1HG THR 138 -15.598 -7.493 9.359 1102 HG21 THR 138 3HG2 THR 138 -14.490 -5.358 10.920 1103 HG22 THR 138 1HG2 THR 138 -13.037 -6.307 11.225 1104 HG23 THR 138 2HG2 THR 138 -14.615 -7.094 11.198 1105 H TRP 139 H TRP 139 -11.334 -6.762 8.090 1106 HA TRP 139 HA TRP 139 -9.496 -6.012 9.978 1107 HB2 TRP 139 1HB TRP 139 -8.891 -7.871 8.711 1108 HB3 TRP 139 2HB TRP 139 -9.209 -7.052 7.180 1109 HD1 TRP 139 HD TRP 139 -6.418 -7.885 9.499 1110 HE1 TRP 139 1HE TRP 139 -4.237 -6.785 8.692 1111 HE3 TRP 139 3HE TRP 139 -8.359 -4.722 5.984 1112 HZ2 TRP 139 2HZ TRP 139 -3.443 -4.833 6.813 1113 HZ3 TRP 139 3HZ TRP 139 -6.821 -3.271 4.725 1114 HH2 TRP 139 HH TRP 139 -4.414 -3.326 5.134 1115 H LEU 140 H LEU 140 -10.618 -4.172 7.318 1116 HA LEU 140 HA LEU 140 -8.333 -2.366 7.349 1117 HB2 LEU 140 1HB LEU 140 -9.129 -2.765 5.178 1118 HB3 LEU 140 2HB LEU 140 -10.817 -2.576 5.683 1119 HG LEU 140 HG LEU 140 -9.574 -0.721 4.279 1120 HD11 LEU 140 1HD1 LEU 140 -11.930 -0.818 5.357 1121 HD12 LEU 140 2HD1 LEU 140 -11.260 0.741 4.877 1122 HD13 LEU 140 3HD1 LEU 140 -11.228 0.252 6.571 1123 HD21 LEU 140 3HD2 LEU 140 -9.125 0.506 6.939 1124 HD22 LEU 140 1HD2 LEU 140 -8.310 0.795 5.402 1125 HD23 LEU 140 2HD2 LEU 140 -7.913 -0.636 6.355 1126 H LYS 141 H LYS 141 -11.871 -1.980 7.633 1127 HA LYS 141 HA LYS 141 -11.830 0.612 8.663 1128 HB2 LYS 141 1HB LYS 141 -13.789 -1.610 8.550 1129 HB3 LYS 141 2HB LYS 141 -14.093 -0.362 9.770 1130 HG2 LYS 141 1HG LYS 141 -14.540 1.256 8.231 1131 HG3 LYS 141 2HG LYS 141 -13.471 0.536 7.012 1132 HD2 LYS 141 1HD LYS 141 -15.372 -0.147 6.028 1133 HD3 LYS 141 2HD LYS 141 -15.374 -1.401 7.281 1134 HE2 LYS 141 1HE LYS 141 -16.585 1.253 7.929 1135 HE3 LYS 141 2HE LYS 141 -17.476 0.147 6.873 1136 HZ1 LYS 141 3HZ LYS 141 -16.476 -0.511 9.592 1137 HZ2 LYS 141 1HZ LYS 141 -17.349 -1.551 8.583 1138 HZ3 LYS 141 2HZ LYS 141 -18.082 -0.155 9.194 1139 H GLU 142 H GLU 142 -11.119 -2.400 10.172 1140 HA GLU 142 HA GLU 142 -11.620 -1.623 12.863 1141 HB2 GLU 142 1HB GLU 142 -10.191 -3.871 11.511 1142 HB3 GLU 142 2HB GLU 142 -9.869 -3.579 13.227 1143 HG2 GLU 142 1HG GLU 142 -12.525 -3.537 13.334 1144 HG3 GLU 142 2HG GLU 142 -12.330 -4.551 11.897 1145 H LYS 143 H LYS 143 -8.679 -1.775 10.877 1146 HA LYS 143 HA LYS 143 -6.873 -0.910 12.834 1147 HB2 LYS 143 1HB LYS 143 -6.797 -0.552 9.829 1148 HB3 LYS 143 2HB LYS 143 -5.426 -0.263 10.913 1149 HG2 LYS 143 1HG LYS 143 -6.669 -2.912 11.198 1150 HG3 LYS 143 2HG LYS 143 -5.915 -2.599 9.626 1151 HD2 LYS 143 1HD LYS 143 -4.022 -1.616 11.332 1152 HD3 LYS 143 2HD LYS 143 -4.684 -2.971 12.264 1153 HE2 LYS 143 1HE LYS 143 -4.203 -4.528 10.504 1154 HE3 LYS 143 2HE LYS 143 -3.775 -3.212 9.401 1155 HZ1 LYS 143 3HZ LYS 143 -2.278 -3.456 11.907 1156 HZ2 LYS 143 1HZ LYS 143 -1.764 -2.898 10.395 1157 HZ3 LYS 143 2HZ LYS 143 -1.945 -4.557 10.667 1158 H LEU 144 H LEU 144 -8.954 0.885 10.638 1159 HA LEU 144 HA LEU 144 -7.832 3.441 11.260 1160 HB2 LEU 144 1HB LEU 144 -10.596 2.983 10.168 1161 HB3 LEU 144 2HB LEU 144 -9.509 4.357 9.901 1162 HG LEU 144 HG LEU 144 -8.948 1.595 8.840 1163 HD11 LEU 144 1HD1 LEU 144 -10.304 3.901 7.448 1164 HD12 LEU 144 2HD1 LEU 144 -11.061 2.377 7.913 1165 HD13 LEU 144 3HD1 LEU 144 -9.790 2.392 6.691 1166 HD21 LEU 144 3HD2 LEU 144 -7.800 4.331 8.362 1167 HD22 LEU 144 1HD2 LEU 144 -7.562 2.994 7.236 1168 HD23 LEU 144 2HD2 LEU 144 -6.970 2.868 8.894 1169 H ALA 145 H ALA 145 -10.873 1.814 12.150 1170 HA ALA 145 HA ALA 145 -11.952 3.749 13.794 1171 HB1 ALA 145 3HB ALA 145 -12.211 0.930 14.679 1172 HB2 ALA 145 1HB ALA 145 -13.447 2.169 14.460 1173 HB3 ALA 145 2HB ALA 145 -12.774 1.336 13.058 1174 H SER 146 H SER 146 -10.030 0.952 14.904 1175 HA SER 146 HA SER 146 -9.589 2.238 17.465 1176 HB2 SER 146 1HB SER 146 -8.602 0.164 18.171 1177 HB3 SER 146 2HB SER 146 -10.052 -0.228 17.230 1178 HG SER 146 HG SER 146 -7.344 -0.427 16.446 1179 H GLY 147 H GLY 147 -8.451 3.481 15.097 1180 HA2 GLY 147 1HA GLY 147 -6.446 4.281 14.273 1181 HA3 GLY 147 2HA GLY 147 -6.057 4.407 15.981 1182 HA PRO 148 HA PRO 148 -2.911 1.638 14.032 1183 HB2 PRO 148 2HB PRO 148 -1.437 3.387 13.806 1184 HB3 PRO 148 1HB PRO 148 -0.775 2.769 15.320 1185 HG2 PRO 148 1HG PRO 148 -1.947 4.299 16.618 1186 HG3 PRO 148 2HG PRO 148 -1.610 5.281 15.143 1187 HD2 PRO 148 1HD PRO 148 -4.111 4.958 16.149 1188 HD3 PRO 148 2HD PRO 148 -3.790 5.110 14.413 1189 H SER 149 H SER 149 -0.952 0.608 15.399 1190 HA SER 149 HA SER 149 -0.551 -1.086 16.886 1191 HB2 SER 149 1HB SER 149 -1.567 1.041 18.799 1192 HB3 SER 149 2HB SER 149 -0.577 -0.362 19.239 1193 HG SER 149 HG SER 149 0.159 2.003 18.026 1194 H SER 150 H SER 150 -2.067 -2.625 16.281 1195 HA SER 150 HA SER 150 -4.073 -3.205 18.256 1196 HB2 SER 150 1HB SER 150 -5.953 -3.339 16.605 1197 HB3 SER 150 2HB SER 150 -5.387 -1.687 16.909 1198 HG SER 150 HG SER 150 -5.628 -2.788 14.590 1199 H GLY 151 H GLY 151 -4.143 -5.339 18.525 1200 HA2 GLY 151 1HA GLY 151 -4.425 -7.566 17.684 1201 HA3 GLY 151 2HA GLY 151 -3.585 -7.079 16.219 Start of MODEL 16 1 H1 GLY 1 H GLY 1 16.251 -5.859 22.902 2 HA2 GLY 1 1HA GLY 1 16.156 -7.772 25.153 3 HA3 GLY 1 2HA GLY 1 15.371 -8.075 23.611 4 H SER 2 H SER 2 16.429 -9.767 22.776 5 HA SER 2 HA SER 2 19.205 -9.414 22.040 6 HB2 SER 2 1HB SER 2 19.255 -10.441 24.340 7 HB3 SER 2 2HB SER 2 18.417 -11.846 23.657 8 HG SER 2 HG SER 2 20.883 -10.860 22.663 9 H SER 3 H SER 3 16.509 -11.727 22.187 10 HA SER 3 HA SER 3 17.097 -12.445 19.390 11 HB2 SER 3 1HB SER 3 16.284 -14.695 19.826 12 HB3 SER 3 2HB SER 3 17.566 -14.297 20.983 13 HG SER 3 HG SER 3 15.527 -13.539 22.256 14 H GLY 4 H GLY 4 15.281 -12.952 18.049 15 HA2 GLY 4 1HA GLY 4 12.670 -13.087 18.410 16 HA3 GLY 4 2HA GLY 4 12.925 -11.389 18.785 17 H SER 5 H SER 5 13.826 -10.016 17.113 18 HA SER 5 HA SER 5 12.585 -10.476 14.601 19 HB2 SER 5 1HB SER 5 13.468 -8.254 15.935 20 HB3 SER 5 2HB SER 5 14.703 -8.429 14.675 21 HG SER 5 HG SER 5 11.938 -7.997 14.397 22 H SER 6 H SER 6 13.830 -10.221 12.507 23 HA SER 6 HA SER 6 15.649 -12.371 12.255 24 HB2 SER 6 1HB SER 6 15.133 -10.137 10.269 25 HB3 SER 6 2HB SER 6 15.808 -11.738 9.917 26 HG SER 6 HG SER 6 13.329 -11.645 11.187 27 H GLY 7 H GLY 7 17.762 -11.931 10.893 28 HA2 GLY 7 1HA GLY 7 19.494 -10.448 12.639 29 HA3 GLY 7 2HA GLY 7 19.976 -11.340 11.204 30 H SER 8 H SER 8 21.414 -9.420 10.994 31 HA SER 8 HA SER 8 20.058 -7.379 9.378 32 HB2 SER 8 1HB SER 8 21.613 -5.654 10.373 33 HB3 SER 8 2HB SER 8 20.382 -6.278 11.484 34 HG SER 8 HG SER 8 23.144 -6.798 11.429 35 H ASP 9 H ASP 9 21.135 -6.762 7.571 36 HA ASP 9 HA ASP 9 23.923 -7.046 7.180 37 HB2 ASP 9 1HB ASP 9 22.163 -9.305 6.379 38 HB3 ASP 9 2HB ASP 9 23.396 -8.805 5.213 39 H SER 10 H SER 10 22.246 -4.938 6.804 40 HA SER 10 HA SER 10 21.607 -3.338 5.316 41 HB2 SER 10 1HB SER 10 24.089 -4.265 4.513 42 HB3 SER 10 2HB SER 10 23.124 -4.359 3.028 43 HG SER 10 HG SER 10 22.465 -2.115 3.628 44 H LEU 11 H LEU 11 20.506 -2.930 3.218 45 HA LEU 11 HA LEU 11 19.223 -5.318 2.098 46 HB2 LEU 11 1HB LEU 11 17.741 -2.815 2.919 47 HB3 LEU 11 2HB LEU 11 17.044 -4.267 2.180 48 HG LEU 11 HG LEU 11 18.446 -4.510 4.804 49 HD11 LEU 11 1HD1 LEU 11 17.095 -2.959 5.690 50 HD12 LEU 11 2HD1 LEU 11 15.849 -4.197 5.542 51 HD13 LEU 11 3HD1 LEU 11 16.014 -2.960 4.296 52 HD21 LEU 11 3HD2 LEU 11 15.910 -5.855 3.989 53 HD22 LEU 11 1HD2 LEU 11 17.203 -6.431 5.042 54 HD23 LEU 11 2HD2 LEU 11 17.441 -6.390 3.295 55 H VAL 12 H VAL 12 17.734 -4.519 0.177 56 HA VAL 12 HA VAL 12 19.499 -2.979 -1.565 57 HB VAL 12 HB VAL 12 18.617 -5.194 -2.307 58 HG11 VAL 12 1HG1 VAL 12 16.131 -3.990 -1.547 59 HG12 VAL 12 2HG1 VAL 12 16.074 -4.455 -3.249 60 HG13 VAL 12 3HG1 VAL 12 16.465 -5.656 -2.017 61 HG21 VAL 12 3HG2 VAL 12 19.305 -4.117 -4.169 62 HG22 VAL 12 1HG2 VAL 12 17.577 -4.055 -4.519 63 HG23 VAL 12 2HG2 VAL 12 18.383 -2.661 -3.798 64 H VAL 13 H VAL 13 18.246 -1.408 0.328 65 HA VAL 13 HA VAL 13 15.835 -0.269 -0.072 66 HB VAL 13 HB VAL 13 18.396 1.276 0.367 67 HG11 VAL 13 1HG1 VAL 13 15.501 2.015 0.637 68 HG12 VAL 13 2HG1 VAL 13 16.752 2.833 1.576 69 HG13 VAL 13 3HG1 VAL 13 16.796 2.883 -0.187 70 HG21 VAL 13 3HG2 VAL 13 17.419 1.154 2.792 71 HG22 VAL 13 1HG2 VAL 13 16.593 -0.274 2.170 72 HG23 VAL 13 2HG2 VAL 13 18.354 -0.192 2.142 73 H CYS 14 H CYS 14 14.787 0.481 -1.782 74 HA CYS 14 HA CYS 14 16.327 1.450 -4.083 75 HB2 CYS 14 1HB CYS 14 13.469 0.508 -3.824 76 HB3 CYS 14 2HB CYS 14 14.156 1.170 -5.317 77 HG CYS 14 HG CYS 14 16.286 -0.938 -5.057 78 H GLU 15 H GLU 15 15.188 3.217 -5.370 79 HA GLU 15 HA GLU 15 14.574 5.385 -3.516 80 HB2 GLU 15 1HB GLU 15 15.725 5.162 -6.212 81 HB3 GLU 15 2HB GLU 15 14.604 6.516 -6.012 82 HG2 GLU 15 1HG GLU 15 16.444 6.328 -3.784 83 HG3 GLU 15 2HG GLU 15 17.289 6.463 -5.332 84 H VAL 16 H VAL 16 12.959 7.060 -4.486 85 HA VAL 16 HA VAL 16 10.503 5.576 -5.124 86 HB VAL 16 HB VAL 16 10.443 6.904 -3.054 87 HG11 VAL 16 1HG1 VAL 16 10.263 9.516 -4.266 88 HG12 VAL 16 2HG1 VAL 16 11.247 8.973 -2.905 89 HG13 VAL 16 3HG1 VAL 16 11.843 8.788 -4.555 90 HG21 VAL 16 3HG2 VAL 16 8.307 6.675 -3.847 91 HG22 VAL 16 1HG2 VAL 16 8.453 8.432 -3.859 92 HG23 VAL 16 2HG2 VAL 16 8.658 7.521 -5.355 93 H ASP 17 H ASP 17 10.538 5.459 -7.333 94 HA ASP 17 HA ASP 17 11.410 7.054 -9.271 95 HB2 ASP 17 1HB ASP 17 9.933 4.980 -9.488 96 HB3 ASP 17 2HB ASP 17 8.557 6.085 -9.381 97 HA PRO 18 HA PRO 18 9.723 11.094 -8.772 98 HB2 PRO 18 2HB PRO 18 11.463 11.813 -10.088 99 HB3 PRO 18 1HB PRO 18 10.199 12.049 -11.294 100 HG2 PRO 18 1HG PRO 18 10.623 10.018 -12.340 101 HG3 PRO 18 2HG PRO 18 12.283 10.493 -11.819 102 HD2 PRO 18 1HD PRO 18 11.178 8.096 -11.187 103 HD3 PRO 18 2HD PRO 18 12.292 8.951 -10.105 104 H GLU 19 H GLU 19 8.716 9.078 -11.491 105 HA GLU 19 HA GLU 19 6.459 10.651 -12.206 106 HB2 GLU 19 1HB GLU 19 6.037 9.075 -13.811 107 HB3 GLU 19 2HB GLU 19 7.747 8.742 -13.502 108 HG2 GLU 19 1HG GLU 19 7.134 6.621 -13.230 109 HG3 GLU 19 2HG GLU 19 6.497 7.145 -11.664 110 H LEU 20 H LEU 20 7.042 8.216 -9.812 111 HA LEU 20 HA LEU 20 4.210 7.782 -9.316 112 HB2 LEU 20 1HB LEU 20 6.240 6.088 -9.138 113 HB3 LEU 20 2HB LEU 20 6.328 6.755 -7.498 114 HG LEU 20 HG LEU 20 3.855 5.481 -8.662 115 HD11 LEU 20 1HD1 LEU 20 4.530 3.450 -7.996 116 HD12 LEU 20 2HD1 LEU 20 5.336 4.074 -6.558 117 HD13 LEU 20 3HD1 LEU 20 6.150 4.137 -8.121 118 HD21 LEU 20 3HD2 LEU 20 4.627 6.514 -5.952 119 HD22 LEU 20 1HD2 LEU 20 3.367 5.294 -6.151 120 HD23 LEU 20 2HD2 LEU 20 3.190 6.876 -6.911 121 H LYS 21 H LYS 21 7.021 9.163 -7.648 122 HA LYS 21 HA LYS 21 6.111 9.823 -5.214 123 HB2 LYS 21 1HB LYS 21 8.308 10.496 -6.294 124 HB3 LYS 21 2HB LYS 21 7.446 11.894 -6.956 125 HG2 LYS 21 1HG LYS 21 6.771 12.108 -4.347 126 HG3 LYS 21 2HG LYS 21 8.378 11.371 -4.218 127 HD2 LYS 21 1HD LYS 21 8.231 13.558 -6.171 128 HD3 LYS 21 2HD LYS 21 7.889 14.048 -4.503 129 HE2 LYS 21 1HE LYS 21 10.051 12.513 -4.059 130 HE3 LYS 21 2HE LYS 21 10.397 13.042 -5.712 131 HZ1 LYS 21 3HZ LYS 21 10.697 14.487 -3.323 132 HZ2 LYS 21 1HZ LYS 21 9.550 15.279 -4.282 133 HZ3 LYS 21 2HZ LYS 21 11.093 14.962 -4.898 134 H GLU 22 H GLU 22 5.287 11.572 -8.188 135 HA GLU 22 HA GLU 22 3.691 13.544 -6.940 136 HB2 GLU 22 1HB GLU 22 3.265 12.569 -9.757 137 HB3 GLU 22 2HB GLU 22 3.043 14.200 -9.105 138 HG2 GLU 22 1HG GLU 22 5.606 14.095 -8.663 139 HG3 GLU 22 2HG GLU 22 5.564 12.800 -9.866 140 H THR 23 H THR 23 2.908 10.443 -8.468 141 HA THR 23 HA THR 23 0.174 10.489 -8.460 142 HB THR 23 HB THR 23 2.061 8.215 -7.878 143 HG1 THR 23 1HG THR 23 0.483 9.012 -10.110 144 HG21 THR 23 3HG2 THR 23 0.323 7.119 -6.971 145 HG22 THR 23 1HG2 THR 23 -0.293 7.026 -8.620 146 HG23 THR 23 2HG2 THR 23 -0.845 8.309 -7.544 147 H LEU 24 H LEU 24 2.306 9.798 -5.721 148 HA LEU 24 HA LEU 24 0.214 9.174 -3.899 149 HB2 LEU 24 1HB LEU 24 2.933 10.226 -3.146 150 HB3 LEU 24 2HB LEU 24 1.871 9.151 -2.220 151 HG LEU 24 HG LEU 24 3.421 8.439 -4.709 152 HD11 LEU 24 1HD1 LEU 24 5.032 7.724 -3.362 153 HD12 LEU 24 2HD1 LEU 24 3.884 6.827 -2.370 154 HD13 LEU 24 3HD1 LEU 24 4.200 8.529 -2.031 155 HD21 LEU 24 3HD2 LEU 24 2.586 6.152 -4.296 156 HD22 LEU 24 1HD2 LEU 24 1.301 7.282 -4.725 157 HD23 LEU 24 2HD2 LEU 24 1.519 6.792 -3.045 158 H ARG 25 H ARG 25 2.197 12.089 -4.390 159 HA ARG 25 HA ARG 25 1.005 13.664 -2.410 160 HB2 ARG 25 1HB ARG 25 3.129 14.097 -3.802 161 HB3 ARG 25 2HB ARG 25 2.030 14.786 -5.006 162 HG2 ARG 25 1HG ARG 25 1.698 16.669 -3.835 163 HG3 ARG 25 2HG ARG 25 1.628 15.804 -2.290 164 HD2 ARG 25 1HD ARG 25 3.712 16.427 -1.815 165 HD3 ARG 25 2HD ARG 25 4.286 15.629 -3.287 166 HE ARG 25 HE ARG 25 3.229 18.065 -4.071 167 HH11 ARG 25 2HH1 ARG 25 5.811 16.911 -2.042 168 HH12 ARG 25 1HH1 ARG 25 6.817 18.297 -2.309 169 HH21 ARG 25 1HH2 ARG 25 6.093 19.995 -3.667 170 HH22 ARG 25 2HH2 ARG 25 4.542 19.896 -4.431 171 H LYS 26 H LYS 26 -0.137 12.693 -5.510 172 HA LYS 26 HA LYS 26 -2.161 14.778 -5.635 173 HB2 LYS 26 1HB LYS 26 -1.968 12.390 -7.462 174 HB3 LYS 26 2HB LYS 26 -2.676 13.978 -7.794 175 HG2 LYS 26 1HG LYS 26 0.082 14.327 -7.133 176 HG3 LYS 26 2HG LYS 26 -0.071 13.073 -8.376 177 HD2 LYS 26 1HD LYS 26 -1.805 14.907 -9.347 178 HD3 LYS 26 2HD LYS 26 -0.648 15.964 -8.519 179 HE2 LYS 26 1HE LYS 26 0.942 15.627 -10.065 180 HE3 LYS 26 2HE LYS 26 0.664 13.878 -10.064 181 HZ1 LYS 26 3HZ LYS 26 0.168 15.253 -12.181 182 HZ2 LYS 26 1HZ LYS 26 -1.275 15.649 -11.392 183 HZ3 LYS 26 2HZ LYS 26 -0.905 14.031 -11.718 184 H PHE 27 H PHE 27 -1.933 11.296 -5.090 185 HA PHE 27 HA PHE 27 -4.657 10.696 -5.021 186 HB2 PHE 27 1HB PHE 27 -2.608 9.121 -4.959 187 HB3 PHE 27 2HB PHE 27 -2.654 9.365 -3.212 188 HD1 PHE 27 2HD PHE 27 -5.449 8.974 -5.637 189 HD2 PHE 27 1HD PHE 27 -3.368 7.372 -2.288 190 HE1 PHE 27 2HE PHE 27 -7.160 7.221 -5.417 191 HE2 PHE 27 1HE PHE 27 -5.075 5.615 -2.064 192 HZ PHE 27 HZ PHE 27 -6.975 5.538 -3.629 193 H ARG 28 H ARG 28 -2.547 12.075 -2.585 194 HA ARG 28 HA ARG 28 -4.397 11.817 -0.425 195 HB2 ARG 28 1HB ARG 28 -2.198 13.868 -0.539 196 HB3 ARG 28 2HB ARG 28 -2.839 13.006 0.867 197 HG2 ARG 28 1HG ARG 28 -1.868 10.980 -0.757 198 HG3 ARG 28 2HG ARG 28 -0.678 12.283 -0.915 199 HD2 ARG 28 1HD ARG 28 -1.675 11.080 1.678 200 HD3 ARG 28 2HD ARG 28 -0.097 10.801 0.928 201 HE ARG 28 HE ARG 28 -0.081 13.457 1.211 202 HH11 ARG 28 2HH1 ARG 28 -0.946 10.915 3.427 203 HH12 ARG 28 1HH1 ARG 28 -0.466 11.802 4.836 204 HH21 ARG 28 1HH2 ARG 28 0.386 13.919 4.625 205 HH22 ARG 28 2HH2 ARG 28 0.553 14.635 3.058 206 H PHE 29 H PHE 29 -3.604 14.356 -2.740 207 HA PHE 29 HA PHE 29 -5.902 15.899 -1.728 208 HB2 PHE 29 1HB PHE 29 -3.854 17.303 -3.349 209 HB3 PHE 29 2HB PHE 29 -4.759 17.861 -1.940 210 HD1 PHE 29 2HD PHE 29 -4.135 16.058 0.170 211 HD2 PHE 29 1HD PHE 29 -1.598 17.508 -2.925 212 HE1 PHE 29 2HE PHE 29 -2.174 15.687 1.609 213 HE2 PHE 29 1HE PHE 29 0.367 17.138 -1.491 214 HZ PHE 29 HZ PHE 29 0.081 16.227 0.779 215 H ARG 30 H ARG 30 -6.137 13.810 -3.622 216 HA ARG 30 HA ARG 30 -6.136 14.741 -6.289 217 HB2 ARG 30 1HB ARG 30 -7.623 12.799 -6.737 218 HB3 ARG 30 2HB ARG 30 -6.157 12.374 -5.841 219 HG2 ARG 30 1HG ARG 30 -7.667 12.668 -3.737 220 HG3 ARG 30 2HG ARG 30 -8.986 12.450 -4.900 221 HD2 ARG 30 1HD ARG 30 -6.769 10.505 -5.116 222 HD3 ARG 30 2HD ARG 30 -7.730 10.418 -3.632 223 HE ARG 30 HE ARG 30 -9.123 10.422 -6.207 224 HH11 ARG 30 2HH1 ARG 30 -8.132 8.743 -3.324 225 HH12 ARG 30 1HH1 ARG 30 -9.235 7.426 -3.554 226 HH21 ARG 30 1HH2 ARG 30 -10.626 7.400 -5.375 227 HH22 ARG 30 2HH2 ARG 30 -10.579 8.696 -6.522 228 H LYS 31 H LYS 31 -8.271 14.728 -7.590 229 HA LYS 31 HA LYS 31 -10.053 16.660 -6.301 230 HB2 LYS 31 1HB LYS 31 -9.375 15.994 -9.147 231 HB3 LYS 31 2HB LYS 31 -10.901 16.812 -8.777 232 HG2 LYS 31 1HG LYS 31 -8.270 17.873 -7.783 233 HG3 LYS 31 2HG LYS 31 -8.893 18.259 -9.397 234 HD2 LYS 31 1HD LYS 31 -10.927 18.603 -7.347 235 HD3 LYS 31 2HD LYS 31 -9.487 19.587 -7.032 236 HE2 LYS 31 1HE LYS 31 -9.722 20.134 -9.621 237 HE3 LYS 31 2HE LYS 31 -11.409 19.707 -9.299 238 HZ1 LYS 31 3HZ LYS 31 -9.934 22.045 -8.509 239 HZ2 LYS 31 1HZ LYS 31 -10.812 21.351 -7.241 240 HZ3 LYS 31 2HZ LYS 31 -11.604 21.820 -8.659 241 H GLU 32 H GLU 32 -10.203 13.809 -5.714 242 HA GLU 32 HA GLU 32 -12.934 13.293 -6.692 243 HB2 GLU 32 1HB GLU 32 -10.802 11.245 -6.033 244 HB3 GLU 32 2HB GLU 32 -12.459 10.887 -6.543 245 HG2 GLU 32 1HG GLU 32 -12.015 11.227 -8.709 246 HG3 GLU 32 2HG GLU 32 -11.007 12.642 -8.373 247 H THR 33 H THR 33 -14.089 11.678 -5.196 248 HA THR 33 HA THR 33 -13.361 12.071 -2.386 249 HB THR 33 HB THR 33 -15.715 12.621 -1.813 250 HG1 THR 33 1HG THR 33 -16.576 11.781 -3.856 251 HG21 THR 33 3HG2 THR 33 -13.791 14.324 -3.108 252 HG22 THR 33 1HG2 THR 33 -14.885 14.690 -1.773 253 HG23 THR 33 2HG2 THR 33 -15.429 14.890 -3.439 254 H ASN 34 H ASN 34 -13.148 9.754 -4.021 255 HA ASN 34 HA ASN 34 -15.044 7.999 -2.619 256 HB2 ASN 34 1HB ASN 34 -15.957 7.338 -4.545 257 HB3 ASN 34 2HB ASN 34 -14.876 8.411 -5.443 258 HD21 ASN 34 2HD2 ASN 34 -12.771 5.906 -6.593 259 HD22 ASN 34 1HD2 ASN 34 -13.104 7.597 -6.464 260 H ASN 35 H ASN 35 -14.248 5.614 -2.893 261 HA ASN 35 HA ASN 35 -11.603 5.530 -1.777 262 HB2 ASN 35 1HB ASN 35 -13.560 3.321 -2.470 263 HB3 ASN 35 2HB ASN 35 -12.034 3.077 -1.612 264 HD21 ASN 35 2HD2 ASN 35 -14.477 3.237 1.034 265 HD22 ASN 35 1HD2 ASN 35 -13.944 2.170 -0.216 266 H ALA 36 H ALA 36 -9.800 4.434 -2.607 267 HA ALA 36 HA ALA 36 -9.848 3.300 -5.251 268 HB1 ALA 36 3HB ALA 36 -7.834 5.175 -5.603 269 HB2 ALA 36 1HB ALA 36 -9.418 5.169 -6.377 270 HB3 ALA 36 2HB ALA 36 -9.164 6.087 -4.892 271 H ALA 37 H ALA 37 -7.716 2.472 -5.901 272 HA ALA 37 HA ALA 37 -5.861 2.137 -3.643 273 HB1 ALA 37 3HB ALA 37 -6.287 -0.192 -5.429 274 HB2 ALA 37 1HB ALA 37 -5.875 -0.135 -3.715 275 HB3 ALA 37 2HB ALA 37 -7.534 0.164 -4.234 276 H ILE 38 H ILE 38 -3.692 1.874 -4.184 277 HA ILE 38 HA ILE 38 -3.013 2.156 -7.033 278 HB ILE 38 HB ILE 38 -1.601 3.639 -4.817 279 HG12 ILE 38 1HG1 ILE 38 -3.790 4.483 -6.709 280 HG13 ILE 38 2HG1 ILE 38 -3.723 4.671 -4.949 281 HG21 ILE 38 1HG2 ILE 38 -1.401 3.803 -7.821 282 HG22 ILE 38 2HG2 ILE 38 -0.580 4.878 -6.689 283 HG23 ILE 38 3HG2 ILE 38 -0.185 3.159 -6.718 284 HD11 ILE 38 3HD1 ILE 38 -1.808 6.262 -5.294 285 HD12 ILE 38 1HD1 ILE 38 -2.190 6.216 -7.014 286 HD13 ILE 38 2HD1 ILE 38 -3.382 6.816 -5.862 287 H ILE 39 H ILE 39 -2.030 0.299 -7.517 288 HA ILE 39 HA ILE 39 -0.296 -0.997 -5.562 289 HB ILE 39 HB ILE 39 -1.176 -1.927 -8.299 290 HG12 ILE 39 1HG1 ILE 39 -2.044 -3.422 -5.933 291 HG13 ILE 39 2HG1 ILE 39 -2.666 -1.765 -5.982 292 HG21 ILE 39 1HG2 ILE 39 0.941 -2.819 -6.627 293 HG22 ILE 39 2HG2 ILE 39 -0.316 -4.055 -6.638 294 HG23 ILE 39 3HG2 ILE 39 0.384 -3.498 -8.157 295 HD11 ILE 39 3HD1 ILE 39 -3.346 -2.329 -8.406 296 HD12 ILE 39 1HD1 ILE 39 -3.155 -4.005 -7.892 297 HD13 ILE 39 2HD1 ILE 39 -4.312 -2.957 -7.071 298 H MET 40 H MET 40 1.791 -0.523 -5.515 299 HA MET 40 HA MET 40 3.110 0.284 -8.022 300 HB2 MET 40 1HB MET 40 4.170 0.936 -5.283 301 HB3 MET 40 2HB MET 40 4.517 1.729 -6.827 302 HG2 MET 40 1HG MET 40 2.642 3.019 -6.769 303 HG3 MET 40 2HG MET 40 1.722 1.814 -5.862 304 HE1 MET 40 3HE MET 40 1.697 3.093 -2.419 305 HE2 MET 40 1HE MET 40 0.688 2.967 -3.859 306 HE3 MET 40 2HE MET 40 1.642 1.582 -3.327 307 H LYS 41 H LYS 41 5.248 -0.457 -8.403 308 HA LYS 41 HA LYS 41 6.061 -2.776 -6.784 309 HB2 LYS 41 1HB LYS 41 6.647 -4.021 -8.742 310 HB3 LYS 41 2HB LYS 41 4.981 -3.453 -8.941 311 HG2 LYS 41 1HG LYS 41 5.598 -1.815 -10.514 312 HG3 LYS 41 2HG LYS 41 7.316 -1.967 -10.103 313 HD2 LYS 41 1HD LYS 41 7.623 -3.699 -11.495 314 HD3 LYS 41 2HD LYS 41 6.118 -4.481 -10.979 315 HE2 LYS 41 1HE LYS 41 4.894 -2.735 -12.380 316 HE3 LYS 41 2HE LYS 41 6.480 -2.337 -13.058 317 HZ1 LYS 41 3HZ LYS 41 5.397 -3.904 -14.479 318 HZ2 LYS 41 1HZ LYS 41 5.108 -4.967 -13.194 319 HZ3 LYS 41 2HZ LYS 41 6.690 -4.692 -13.723 320 H VAL 42 H VAL 42 8.403 -3.448 -7.570 321 HA VAL 42 HA VAL 42 10.017 -1.004 -7.870 322 HB VAL 42 HB VAL 42 10.377 -1.403 -5.624 323 HG11 VAL 42 1HG1 VAL 42 9.645 -4.136 -6.319 324 HG12 VAL 42 2HG1 VAL 42 10.948 -4.048 -5.131 325 HG13 VAL 42 3HG1 VAL 42 9.409 -3.247 -4.814 326 HG21 VAL 42 3HG2 VAL 42 12.467 -3.242 -6.757 327 HG22 VAL 42 1HG2 VAL 42 12.487 -1.501 -7.037 328 HG23 VAL 42 2HG2 VAL 42 12.605 -2.132 -5.394 329 H ASP 43 H ASP 43 11.042 -1.156 -9.750 330 HA ASP 43 HA ASP 43 11.574 -3.658 -11.030 331 HB2 ASP 43 1HB ASP 43 11.996 -0.777 -11.664 332 HB3 ASP 43 2HB ASP 43 13.010 -1.952 -12.512 333 H LYS 44 H LYS 44 13.225 -4.959 -10.640 334 HA LYS 44 HA LYS 44 15.355 -4.279 -8.906 335 HB2 LYS 44 1HB LYS 44 14.560 -6.570 -9.108 336 HB3 LYS 44 2HB LYS 44 15.046 -6.608 -10.810 337 HG2 LYS 44 1HG LYS 44 17.191 -5.917 -8.913 338 HG3 LYS 44 2HG LYS 44 16.545 -7.563 -8.782 339 HD2 LYS 44 1HD LYS 44 16.797 -7.489 -11.425 340 HD3 LYS 44 2HD LYS 44 18.021 -6.274 -11.019 341 HE2 LYS 44 1HE LYS 44 18.010 -8.893 -9.563 342 HE3 LYS 44 2HE LYS 44 18.672 -8.803 -11.201 343 HZ1 LYS 44 3HZ LYS 44 20.347 -7.371 -10.540 344 HZ2 LYS 44 1HZ LYS 44 20.236 -8.428 -9.224 345 HZ3 LYS 44 2HZ LYS 44 19.542 -6.888 -9.134 346 H ASP 45 H ASP 45 14.907 -3.972 -12.309 347 HA ASP 45 HA ASP 45 17.651 -3.905 -13.065 348 HB2 ASP 45 1HB ASP 45 15.451 -4.187 -14.501 349 HB3 ASP 45 2HB ASP 45 15.563 -2.425 -14.611 350 H ARG 46 H ARG 46 15.279 -1.425 -12.204 351 HA ARG 46 HA ARG 46 17.395 0.607 -12.328 352 HB2 ARG 46 1HB ARG 46 14.409 1.003 -12.030 353 HB3 ARG 46 2HB ARG 46 15.620 2.258 -12.326 354 HG2 ARG 46 1HG ARG 46 15.991 1.568 -14.533 355 HG3 ARG 46 2HG ARG 46 15.207 0.003 -14.255 356 HD2 ARG 46 1HD ARG 46 13.474 1.024 -15.313 357 HD3 ARG 46 2HD ARG 46 13.149 1.603 -13.673 358 HE ARG 46 HE ARG 46 14.844 3.463 -14.785 359 HH11 ARG 46 2HH1 ARG 46 11.702 2.154 -15.515 360 HH12 ARG 46 1HH1 ARG 46 11.130 3.603 -16.273 361 HH21 ARG 46 1HH2 ARG 46 12.496 5.436 -16.425 362 HH22 ARG 46 2HH2 ARG 46 14.102 5.378 -15.781 363 H GLN 47 H GLN 47 15.977 -1.426 -10.148 364 HA GLN 47 HA GLN 47 15.719 -1.463 -7.879 365 HB2 GLN 47 1HB GLN 47 18.029 0.484 -7.881 366 HB3 GLN 47 2HB GLN 47 17.614 -0.706 -6.638 367 HG2 GLN 47 1HG GLN 47 18.086 -1.880 -9.276 368 HG3 GLN 47 2HG GLN 47 19.486 -1.044 -8.591 369 HE21 GLN 47 2HE2 GLN 47 18.167 -4.541 -7.020 370 HE22 GLN 47 1HE2 GLN 47 17.274 -3.692 -8.231 371 H MET 48 H MET 48 13.935 0.284 -9.014 372 HA MET 48 HA MET 48 13.693 2.292 -6.895 373 HB2 MET 48 1HB MET 48 13.527 4.092 -8.262 374 HB3 MET 48 2HB MET 48 14.539 3.092 -9.315 375 HG2 MET 48 1HG MET 48 12.105 2.239 -10.092 376 HG3 MET 48 2HG MET 48 11.720 3.891 -9.604 377 HE1 MET 48 3HE MET 48 12.996 6.183 -11.019 378 HE2 MET 48 1HE MET 48 14.182 5.388 -9.983 379 HE3 MET 48 2HE MET 48 14.585 5.760 -11.660 380 H VAL 49 H VAL 49 11.524 2.989 -6.494 381 HA VAL 49 HA VAL 49 9.585 0.900 -7.043 382 HB VAL 49 HB VAL 49 9.238 3.398 -5.381 383 HG11 VAL 49 1HG1 VAL 49 7.698 0.811 -5.270 384 HG12 VAL 49 2HG1 VAL 49 7.333 2.323 -4.436 385 HG13 VAL 49 3HG1 VAL 49 7.173 2.222 -6.190 386 HG21 VAL 49 3HG2 VAL 49 9.601 1.823 -3.454 387 HG22 VAL 49 1HG2 VAL 49 10.187 0.642 -4.624 388 HG23 VAL 49 2HG2 VAL 49 11.036 2.173 -4.417 389 H VAL 50 H VAL 50 8.402 0.992 -8.829 390 HA VAL 50 HA VAL 50 7.468 3.629 -9.762 391 HB VAL 50 HB VAL 50 7.402 2.672 -12.052 392 HG11 VAL 50 1HG1 VAL 50 10.000 2.861 -10.565 393 HG12 VAL 50 2HG1 VAL 50 9.954 2.558 -12.303 394 HG13 VAL 50 3HG1 VAL 50 9.253 4.037 -11.646 395 HG21 VAL 50 3HG2 VAL 50 8.007 0.552 -12.565 396 HG22 VAL 50 1HG2 VAL 50 9.237 0.482 -11.303 397 HG23 VAL 50 2HG2 VAL 50 7.538 0.253 -10.892 398 H LEU 51 H LEU 51 5.350 3.804 -10.471 399 HA LEU 51 HA LEU 51 3.407 2.303 -9.193 400 HB2 LEU 51 1HB LEU 51 3.242 4.592 -10.352 401 HB3 LEU 51 2HB LEU 51 2.918 3.661 -11.824 402 HG LEU 51 HG LEU 51 1.238 3.190 -9.399 403 HD11 LEU 51 1HD1 LEU 51 0.962 5.501 -11.312 404 HD12 LEU 51 2HD1 LEU 51 1.202 5.579 -9.566 405 HD13 LEU 51 3HD1 LEU 51 -0.310 4.949 -10.220 406 HD21 LEU 51 3HD2 LEU 51 0.005 3.339 -12.029 407 HD22 LEU 51 1HD2 LEU 51 -0.054 2.056 -10.821 408 HD23 LEU 51 2HD2 LEU 51 1.300 2.146 -11.947 409 H GLU 52 H GLU 52 1.983 0.680 -9.846 410 HA GLU 52 HA GLU 52 2.863 -0.866 -12.195 411 HB2 GLU 52 1HB GLU 52 3.382 -1.993 -10.075 412 HB3 GLU 52 2HB GLU 52 1.673 -1.906 -9.617 413 HG2 GLU 52 1HG GLU 52 1.024 -3.458 -11.249 414 HG3 GLU 52 2HG GLU 52 2.558 -3.299 -12.118 415 H ASP 53 H ASP 53 0.114 0.146 -10.231 416 HA ASP 53 HA ASP 53 -1.594 0.281 -12.512 417 HB2 ASP 53 1HB ASP 53 -1.824 -2.038 -10.622 418 HB3 ASP 53 2HB ASP 53 -3.286 -1.360 -11.349 419 H GLU 54 H GLU 54 -3.897 0.829 -11.817 420 HA GLU 54 HA GLU 54 -4.142 1.951 -9.156 421 HB2 GLU 54 1HB GLU 54 -3.609 3.581 -11.559 422 HB3 GLU 54 2HB GLU 54 -4.962 4.134 -10.560 423 HG2 GLU 54 1HG GLU 54 -3.361 3.978 -8.580 424 HG3 GLU 54 2HG GLU 54 -2.080 3.845 -9.793 425 H LEU 55 H LEU 55 -6.085 1.331 -8.511 426 HA LEU 55 HA LEU 55 -8.255 1.182 -10.496 427 HB2 LEU 55 1HB LEU 55 -8.154 -0.247 -7.842 428 HB3 LEU 55 2HB LEU 55 -9.263 -0.530 -9.194 429 HG LEU 55 HG LEU 55 -6.364 -0.959 -9.683 430 HD11 LEU 55 1HD1 LEU 55 -6.440 -2.094 -7.641 431 HD12 LEU 55 2HD1 LEU 55 -6.734 -3.345 -8.848 432 HD13 LEU 55 3HD1 LEU 55 -8.080 -2.679 -7.922 433 HD21 LEU 55 3HD2 LEU 55 -7.656 -3.040 -10.760 434 HD22 LEU 55 1HD2 LEU 55 -7.479 -1.489 -11.581 435 HD23 LEU 55 2HD2 LEU 55 -8.975 -1.869 -10.729 436 H GLN 56 H GLN 56 -10.258 2.059 -10.022 437 HA GLN 56 HA GLN 56 -10.407 3.698 -7.580 438 HB2 GLN 56 1HB GLN 56 -11.324 4.425 -10.372 439 HB3 GLN 56 2HB GLN 56 -11.691 5.368 -8.919 440 HG2 GLN 56 1HG GLN 56 -9.885 6.508 -9.762 441 HG3 GLN 56 2HG GLN 56 -9.117 5.411 -8.606 442 HE21 GLN 56 2HE2 GLN 56 -6.941 4.281 -11.022 443 HE22 GLN 56 1HE2 GLN 56 -7.233 4.825 -9.409 444 H ASN 57 H ASN 57 -12.555 4.122 -6.788 445 HA ASN 57 HA ASN 57 -14.605 3.428 -6.089 446 HB2 ASN 57 1HB ASN 57 -15.556 2.235 -8.554 447 HB3 ASN 57 2HB ASN 57 -16.110 3.698 -7.730 448 HD21 ASN 57 2HD2 ASN 57 -13.793 5.821 -9.515 449 HD22 ASN 57 1HD2 ASN 57 -14.311 5.510 -7.897 450 H ILE 58 H ILE 58 -12.721 1.653 -5.402 451 HA ILE 58 HA ILE 58 -14.044 -0.942 -5.843 452 HB ILE 58 HB ILE 58 -12.172 -1.691 -6.788 453 HG12 ILE 58 1HG1 ILE 58 -11.924 -2.436 -4.369 454 HG13 ILE 58 2HG1 ILE 58 -10.450 -2.463 -5.351 455 HG21 ILE 58 1HG2 ILE 58 -11.327 0.326 -7.532 456 HG22 ILE 58 2HG2 ILE 58 -11.047 0.930 -5.899 457 HG23 ILE 58 3HG2 ILE 58 -9.985 -0.305 -6.577 458 HD11 ILE 58 3HD1 ILE 58 -9.421 -1.160 -3.900 459 HD12 ILE 58 1HD1 ILE 58 -10.652 0.086 -4.108 460 HD13 ILE 58 2HD1 ILE 58 -10.865 -1.169 -2.887 461 H SER 59 H SER 59 -14.286 -2.259 -4.077 462 HA SER 59 HA SER 59 -14.065 -0.971 -1.501 463 HB2 SER 59 1HB SER 59 -15.615 -3.120 -2.660 464 HB3 SER 59 2HB SER 59 -14.874 -3.645 -1.137 465 HG SER 59 HG SER 59 -16.425 -1.291 -1.489 466 HA PRO 60 HA PRO 60 -10.492 -2.928 0.127 467 HB2 PRO 60 2HB PRO 60 -11.080 -2.171 2.216 468 HB3 PRO 60 1HB PRO 60 -11.278 -3.887 2.570 469 HG2 PRO 60 1HG PRO 60 -13.574 -3.837 2.219 470 HG3 PRO 60 2HG PRO 60 -13.296 -2.200 2.922 471 HD2 PRO 60 1HD PRO 60 -14.570 -2.580 0.555 472 HD3 PRO 60 2HD PRO 60 -13.545 -1.170 0.875 473 H GLU 61 H GLU 61 -13.144 -4.792 -0.730 474 HA GLU 61 HA GLU 61 -11.857 -7.330 -0.038 475 HB2 GLU 61 1HB GLU 61 -14.624 -6.484 -0.720 476 HB3 GLU 61 2HB GLU 61 -14.135 -8.109 -1.221 477 HG2 GLU 61 1HG GLU 61 -13.948 -8.886 0.921 478 HG3 GLU 61 2HG GLU 61 -13.597 -7.281 1.580 479 H GLU 62 H GLU 62 -12.658 -5.294 -2.747 480 HA GLU 62 HA GLU 62 -12.139 -7.283 -4.750 481 HB2 GLU 62 1HB GLU 62 -13.224 -4.659 -4.664 482 HB3 GLU 62 2HB GLU 62 -11.854 -4.632 -5.786 483 HG2 GLU 62 1HG GLU 62 -13.437 -6.975 -6.265 484 HG3 GLU 62 2HG GLU 62 -14.464 -5.536 -6.272 485 H LEU 63 H LEU 63 -10.351 -4.546 -3.385 486 HA LEU 63 HA LEU 63 -8.138 -4.482 -4.995 487 HB2 LEU 63 1HB LEU 63 -8.865 -3.356 -2.592 488 HB3 LEU 63 2HB LEU 63 -7.453 -4.334 -2.160 489 HG LEU 63 HG LEU 63 -7.611 -1.980 -4.011 490 HD11 LEU 63 1HD1 LEU 63 -6.947 -1.093 -2.055 491 HD12 LEU 63 2HD1 LEU 63 -5.371 -1.722 -2.533 492 HD13 LEU 63 3HD1 LEU 63 -6.385 -2.639 -1.421 493 HD21 LEU 63 3HD2 LEU 63 -6.059 -4.339 -4.441 494 HD22 LEU 63 1HD2 LEU 63 -4.986 -3.007 -4.014 495 HD23 LEU 63 2HD2 LEU 63 -6.093 -2.845 -5.378 496 H LYS 64 H LYS 64 -8.650 -6.591 -2.181 497 HA LYS 64 HA LYS 64 -6.191 -7.917 -2.260 498 HB2 LYS 64 1HB LYS 64 -7.096 -8.680 -0.370 499 HB3 LYS 64 2HB LYS 64 -8.721 -8.220 -0.903 500 HG2 LYS 64 1HG LYS 64 -9.145 -10.302 -1.862 501 HG3 LYS 64 2HG LYS 64 -7.424 -10.725 -1.908 502 HD2 LYS 64 1HD LYS 64 -7.681 -11.802 0.025 503 HD3 LYS 64 2HD LYS 64 -8.018 -10.239 0.791 504 HE2 LYS 64 1HE LYS 64 -10.035 -11.076 1.293 505 HE3 LYS 64 2HE LYS 64 -10.409 -10.858 -0.422 506 HZ1 LYS 64 3HZ LYS 64 -10.487 -13.041 -0.726 507 HZ2 LYS 64 1HZ LYS 64 -10.417 -13.224 0.955 508 HZ3 LYS 64 2HZ LYS 64 -8.998 -13.291 0.037 509 H LEU 65 H LEU 65 -9.118 -8.384 -4.109 510 HA LEU 65 HA LEU 65 -8.353 -10.927 -5.188 511 HB2 LEU 65 1HB LEU 65 -10.543 -8.956 -5.661 512 HB3 LEU 65 2HB LEU 65 -10.204 -10.164 -6.913 513 HG LEU 65 HG LEU 65 -11.953 -11.060 -5.627 514 HD11 LEU 65 1HD1 LEU 65 -9.745 -12.430 -4.204 515 HD12 LEU 65 2HD1 LEU 65 -9.704 -12.429 -5.967 516 HD13 LEU 65 3HD1 LEU 65 -11.096 -13.100 -5.118 517 HD21 LEU 65 3HD2 LEU 65 -10.448 -9.910 -3.337 518 HD22 LEU 65 1HD2 LEU 65 -11.434 -11.344 -3.053 519 HD23 LEU 65 2HD2 LEU 65 -12.177 -9.877 -3.689 520 H GLU 66 H GLU 66 -7.509 -7.700 -5.839 521 HA GLU 66 HA GLU 66 -6.828 -8.177 -8.624 522 HB2 GLU 66 1HB GLU 66 -6.437 -5.762 -6.840 523 HB3 GLU 66 2HB GLU 66 -6.019 -5.823 -8.560 524 HG2 GLU 66 1HG GLU 66 -8.792 -6.204 -7.432 525 HG3 GLU 66 2HG GLU 66 -8.166 -4.710 -8.145 526 H LEU 67 H LEU 67 -5.327 -8.220 -5.514 527 HA LEU 67 HA LEU 67 -2.632 -7.978 -6.490 528 HB2 LEU 67 1HB LEU 67 -3.636 -8.965 -3.814 529 HB3 LEU 67 2HB LEU 67 -1.973 -8.497 -4.209 530 HG LEU 67 HG LEU 67 -4.355 -6.646 -4.122 531 HD11 LEU 67 1HD1 LEU 67 -3.926 -6.941 -1.907 532 HD12 LEU 67 2HD1 LEU 67 -2.734 -5.691 -2.259 533 HD13 LEU 67 3HD1 LEU 67 -2.239 -7.381 -2.175 534 HD21 LEU 67 3HD2 LEU 67 -3.068 -5.508 -5.591 535 HD22 LEU 67 1HD2 LEU 67 -1.593 -6.355 -5.124 536 HD23 LEU 67 2HD2 LEU 67 -2.206 -5.037 -4.125 537 HA PRO 68 HA PRO 68 -1.821 -12.163 -7.549 538 HB2 PRO 68 2HB PRO 68 0.231 -11.446 -8.292 539 HB3 PRO 68 1HB PRO 68 0.834 -12.352 -6.906 540 HG2 PRO 68 1HG PRO 68 0.982 -10.466 -5.558 541 HG3 PRO 68 2HG PRO 68 1.395 -9.773 -7.171 542 HD2 PRO 68 1HD PRO 68 -0.573 -8.758 -5.603 543 HD3 PRO 68 2HD PRO 68 -0.664 -8.756 -7.372 544 H GLU 69 H GLU 69 -0.205 -14.015 -6.476 545 HA GLU 69 HA GLU 69 -1.171 -14.319 -3.708 546 HB2 GLU 69 1HB GLU 69 -0.933 -16.857 -4.316 547 HB3 GLU 69 2HB GLU 69 -2.377 -15.954 -4.798 548 HG2 GLU 69 1HG GLU 69 -1.324 -15.584 -7.032 549 HG3 GLU 69 2HG GLU 69 -0.027 -16.676 -6.528 550 H ARG 70 H ARG 70 1.503 -14.334 -5.837 551 HA ARG 70 HA ARG 70 3.284 -14.933 -3.601 552 HB2 ARG 70 1HB ARG 70 3.725 -16.213 -6.300 553 HB3 ARG 70 2HB ARG 70 4.575 -16.543 -4.783 554 HG2 ARG 70 1HG ARG 70 1.630 -17.041 -4.962 555 HG3 ARG 70 2HG ARG 70 2.775 -18.202 -5.656 556 HD2 ARG 70 1HD ARG 70 3.967 -18.101 -3.372 557 HD3 ARG 70 2HD ARG 70 2.472 -17.349 -2.797 558 HE ARG 70 HE ARG 70 2.875 -20.113 -3.430 559 HH11 ARG 70 2HH1 ARG 70 0.517 -17.560 -3.231 560 HH12 ARG 70 1HH1 ARG 70 -0.820 -18.636 -2.995 561 HH21 ARG 70 1HH2 ARG 70 -0.475 -20.900 -2.931 562 HH22 ARG 70 2HH2 ARG 70 1.122 -21.541 -3.120 563 H GLN 71 H GLN 71 2.716 -12.446 -4.660 564 HA GLN 71 HA GLN 71 5.335 -11.704 -5.710 565 HB2 GLN 71 1HB GLN 71 2.786 -11.498 -7.174 566 HB3 GLN 71 2HB GLN 71 3.752 -10.014 -7.154 567 HG2 GLN 71 1HG GLN 71 5.480 -10.937 -8.353 568 HG3 GLN 71 2HG GLN 71 5.077 -12.585 -7.852 569 HE21 GLN 71 2HE2 GLN 71 2.471 -12.958 -10.278 570 HE22 GLN 71 1HE2 GLN 71 2.841 -13.307 -8.627 571 HA PRO 72 HA PRO 72 4.346 -8.854 -2.348 572 HB2 PRO 72 2HB PRO 72 6.251 -9.595 -1.297 573 HB3 PRO 72 1HB PRO 72 6.947 -8.103 -1.927 574 HG2 PRO 72 1HG PRO 72 7.896 -9.159 -3.766 575 HG3 PRO 72 2HG PRO 72 8.039 -10.448 -2.514 576 HD2 PRO 72 1HD PRO 72 6.852 -10.868 -4.918 577 HD3 PRO 72 2HD PRO 72 6.313 -11.669 -3.433 578 H ARG 73 H ARG 73 3.782 -6.778 -2.555 579 HA ARG 73 HA ARG 73 5.348 -4.912 -4.087 580 HB2 ARG 73 1HB ARG 73 3.908 -4.455 -5.836 581 HB3 ARG 73 2HB ARG 73 3.757 -6.212 -5.695 582 HG2 ARG 73 1HG ARG 73 1.813 -5.222 -3.970 583 HG3 ARG 73 2HG ARG 73 1.749 -4.159 -5.387 584 HD2 ARG 73 1HD ARG 73 0.317 -5.822 -6.069 585 HD3 ARG 73 2HD ARG 73 1.853 -6.432 -6.703 586 HE ARG 73 HE ARG 73 1.558 -8.244 -5.367 587 HH11 ARG 73 2HH1 ARG 73 -0.041 -5.532 -3.881 588 HH12 ARG 73 1HH1 ARG 73 -0.628 -6.449 -2.534 589 HH21 ARG 73 1HH2 ARG 73 -0.154 -8.684 -2.373 590 HH22 ARG 73 2HH2 ARG 73 0.791 -9.462 -3.598 591 H PHE 74 H PHE 74 4.036 -2.735 -4.213 592 HA PHE 74 HA PHE 74 3.048 -2.261 -1.499 593 HB2 PHE 74 1HB PHE 74 3.853 -0.255 -3.622 594 HB3 PHE 74 2HB PHE 74 3.496 0.097 -1.930 595 HD1 PHE 74 1HD PHE 74 4.919 -1.630 -0.301 596 HD2 PHE 74 2HD PHE 74 6.095 -0.119 -4.102 597 HE1 PHE 74 1HE PHE 74 7.281 -1.975 0.296 598 HE2 PHE 74 2HE PHE 74 8.458 -0.463 -3.512 599 HZ PHE 74 HZ PHE 74 9.054 -1.392 -1.311 600 H VAL 75 H VAL 75 1.082 -1.303 -1.066 601 HA VAL 75 HA VAL 75 -0.689 -0.659 -3.298 602 HB VAL 75 HB VAL 75 -1.608 -2.525 -1.114 603 HG11 VAL 75 1HG1 VAL 75 -2.840 -1.913 -3.795 604 HG12 VAL 75 2HG1 VAL 75 -3.551 -2.835 -2.469 605 HG13 VAL 75 3HG1 VAL 75 -3.288 -1.099 -2.297 606 HG21 VAL 75 3HG2 VAL 75 0.208 -3.441 -2.687 607 HG22 VAL 75 1HG2 VAL 75 -1.273 -4.378 -2.493 608 HG23 VAL 75 2HG2 VAL 75 -1.040 -3.385 -3.932 609 H VAL 76 H VAL 76 -1.620 1.226 -2.894 610 HA VAL 76 HA VAL 76 -1.969 2.056 -0.088 611 HB VAL 76 HB VAL 76 -1.446 3.647 -2.584 612 HG11 VAL 76 1HG1 VAL 76 -3.326 4.731 -1.511 613 HG12 VAL 76 2HG1 VAL 76 -2.493 4.697 0.044 614 HG13 VAL 76 3HG1 VAL 76 -1.866 5.691 -1.272 615 HG21 VAL 76 3HG2 VAL 76 0.354 2.698 -0.979 616 HG22 VAL 76 1HG2 VAL 76 0.475 4.375 -1.509 617 HG23 VAL 76 2HG2 VAL 76 -0.156 4.000 0.095 618 H TYR 77 H TYR 77 -4.007 1.518 0.458 619 HA TYR 77 HA TYR 77 -6.183 2.065 -1.423 620 HB2 TYR 77 1HB TYR 77 -6.025 -0.175 -0.330 621 HB3 TYR 77 2HB TYR 77 -6.287 0.611 1.228 622 HD1 TYR 77 2HD TYR 77 -7.959 1.187 -2.058 623 HD2 TYR 77 1HD TYR 77 -8.373 -0.070 1.986 624 HE1 TYR 77 2HE TYR 77 -10.394 1.028 -2.363 625 HE2 TYR 77 1HE TYR 77 -10.809 -0.234 1.692 626 HH TYR 77 HH TYR 77 -12.365 0.746 -1.332 627 H SER 78 H SER 78 -7.777 3.526 -1.037 628 HA SER 78 HA SER 78 -7.469 5.202 1.368 629 HB2 SER 78 1HB SER 78 -6.909 6.403 -0.702 630 HB3 SER 78 2HB SER 78 -8.499 5.994 -1.368 631 HG SER 78 HG SER 78 -8.165 7.442 1.043 632 H TYR 79 H TYR 79 -8.935 4.249 2.714 633 HA TYR 79 HA TYR 79 -11.582 3.555 1.797 634 HB2 TYR 79 1HB TYR 79 -10.548 2.147 3.466 635 HB3 TYR 79 2HB TYR 79 -10.321 3.527 4.544 636 HD1 TYR 79 1HD TYR 79 -12.853 1.278 3.080 637 HD2 TYR 79 2HD TYR 79 -12.081 4.332 5.940 638 HE1 TYR 79 1HE TYR 79 -15.040 0.848 4.121 639 HE2 TYR 79 2HE TYR 79 -14.265 3.910 6.989 640 HH TYR 79 HH TYR 79 -16.705 2.320 5.577 641 H LYS 80 H LYS 80 -13.534 4.392 2.826 642 HA LYS 80 HA LYS 80 -13.261 7.245 3.513 643 HB2 LYS 80 1HB LYS 80 -14.391 7.182 1.458 644 HB3 LYS 80 2HB LYS 80 -15.347 5.768 1.931 645 HG2 LYS 80 1HG LYS 80 -16.450 7.251 3.668 646 HG3 LYS 80 2HG LYS 80 -15.677 8.612 2.835 647 HD2 LYS 80 1HD LYS 80 -17.171 8.581 1.171 648 HD3 LYS 80 2HD LYS 80 -17.025 6.825 0.983 649 HE2 LYS 80 1HE LYS 80 -18.423 7.530 3.435 650 HE3 LYS 80 2HE LYS 80 -19.207 8.209 2.001 651 HZ1 LYS 80 3HZ LYS 80 -20.124 6.077 2.342 652 HZ2 LYS 80 1HZ LYS 80 -18.607 5.359 2.543 653 HZ3 LYS 80 2HZ LYS 80 -19.079 5.924 1.021 654 H TYR 81 H TYR 81 -13.342 7.292 5.690 655 HA TYR 81 HA TYR 81 -15.332 5.670 7.088 656 HB2 TYR 81 1HB TYR 81 -12.734 6.218 7.697 657 HB3 TYR 81 2HB TYR 81 -13.567 7.441 8.657 658 HD1 TYR 81 2HD TYR 81 -15.823 6.363 9.831 659 HD2 TYR 81 1HD TYR 81 -12.214 4.312 8.897 660 HE1 TYR 81 2HE TYR 81 -16.325 4.698 11.571 661 HE2 TYR 81 1HE TYR 81 -12.707 2.640 10.633 662 HH TYR 81 HH TYR 81 -14.331 1.831 12.002 663 H VAL 82 H VAL 82 -17.125 6.486 7.986 664 HA VAL 82 HA VAL 82 -17.566 9.381 7.754 665 HB VAL 82 HB VAL 82 -19.156 7.763 6.627 666 HG11 VAL 82 1HG1 VAL 82 -20.468 7.357 9.263 667 HG12 VAL 82 2HG1 VAL 82 -20.527 6.365 7.803 668 HG13 VAL 82 3HG1 VAL 82 -19.102 6.325 8.842 669 HG21 VAL 82 3HG2 VAL 82 -20.884 9.230 8.473 670 HG22 VAL 82 1HG2 VAL 82 -19.583 10.202 7.784 671 HG23 VAL 82 2HG2 VAL 82 -20.718 9.367 6.723 672 H HIS 83 H HIS 83 -18.679 10.497 9.461 673 HA HIS 83 HA HIS 83 -17.899 9.497 12.093 674 HB2 HIS 83 1HB HIS 83 -18.805 12.219 11.131 675 HB3 HIS 83 2HB HIS 83 -18.484 11.842 12.827 676 HD1 HIS 83 1HD HIS 83 -16.241 12.550 13.548 677 HD2 HIS 83 2HD HIS 83 -16.284 11.456 9.540 678 HE1 HIS 83 1HE HIS 83 -13.891 12.907 12.727 679 HE2 HIS 83 2HE HIS 83 -13.917 12.238 10.278 680 H ASP 84 H ASP 84 -20.611 11.633 11.358 681 HA ASP 84 HA ASP 84 -22.766 9.986 11.515 682 HB2 ASP 84 1HB ASP 84 -21.370 10.031 14.040 683 HB3 ASP 84 2HB ASP 84 -22.993 10.709 14.229 684 H ASP 85 H ASP 85 -21.497 12.886 13.123 685 HA ASP 85 HA ASP 85 -23.935 14.297 13.195 686 HB2 ASP 85 1HB ASP 85 -21.421 14.716 14.193 687 HB3 ASP 85 2HB ASP 85 -21.502 15.929 12.908 688 H GLY 86 H GLY 86 -21.967 13.449 10.593 689 HA2 GLY 86 1HA GLY 86 -23.086 13.925 8.407 690 HA3 GLY 86 2HA GLY 86 -23.138 15.599 8.938 691 H ARG 87 H ARG 87 -20.333 13.822 9.791 692 HA ARG 87 HA ARG 87 -18.846 15.126 7.607 693 HB2 ARG 87 1HB ARG 87 -18.006 14.637 10.472 694 HB3 ARG 87 2HB ARG 87 -16.921 15.221 9.200 695 HG2 ARG 87 1HG ARG 87 -19.451 16.671 9.953 696 HG3 ARG 87 2HG ARG 87 -17.895 16.967 10.747 697 HD2 ARG 87 1HD ARG 87 -16.898 17.777 8.774 698 HD3 ARG 87 2HD ARG 87 -18.180 17.095 7.763 699 HE ARG 87 HE ARG 87 -19.160 19.060 9.597 700 HH11 ARG 87 2HH1 ARG 87 -17.606 18.590 6.517 701 HH12 ARG 87 1HH1 ARG 87 -18.159 20.094 5.861 702 HH21 ARG 87 1HH2 ARG 87 -19.460 21.491 7.128 703 HH22 ARG 87 2HH2 ARG 87 -19.894 21.044 8.744 704 H VAL 88 H VAL 88 -17.518 13.896 6.404 705 HA VAL 88 HA VAL 88 -16.828 11.206 7.355 706 HB VAL 88 HB VAL 88 -18.767 10.900 5.921 707 HG11 VAL 88 1HG1 VAL 88 -18.004 13.087 4.585 708 HG12 VAL 88 2HG1 VAL 88 -17.377 11.852 3.491 709 HG13 VAL 88 3HG1 VAL 88 -19.091 11.879 3.904 710 HG21 VAL 88 3HG2 VAL 88 -17.501 9.600 4.015 711 HG22 VAL 88 1HG2 VAL 88 -16.090 9.977 5.002 712 HG23 VAL 88 2HG2 VAL 88 -17.426 9.054 5.690 713 H SER 89 H SER 89 -14.751 10.720 7.050 714 HA SER 89 HA SER 89 -13.232 12.274 5.059 715 HB2 SER 89 1HB SER 89 -12.327 11.390 7.818 716 HB3 SER 89 2HB SER 89 -11.287 12.157 6.605 717 HG SER 89 HG SER 89 -13.658 13.469 7.238 718 H TYR 90 H TYR 90 -11.343 11.210 4.188 719 HA TYR 90 HA TYR 90 -11.656 8.282 4.148 720 HB2 TYR 90 1HB TYR 90 -10.073 9.587 2.013 721 HB3 TYR 90 2HB TYR 90 -11.243 8.270 1.910 722 HD1 TYR 90 1HD TYR 90 -13.760 9.030 2.460 723 HD2 TYR 90 2HD TYR 90 -10.683 11.577 0.996 724 HE1 TYR 90 1HE TYR 90 -15.463 10.571 1.578 725 HE2 TYR 90 2HE TYR 90 -12.376 13.125 0.110 726 HH TYR 90 HH TYR 90 -15.847 12.488 0.532 727 HA PRO 91 HA PRO 91 -7.671 8.742 6.299 728 HB2 PRO 91 2HB PRO 91 -8.618 7.743 8.138 729 HB3 PRO 91 1HB PRO 91 -7.814 6.298 7.525 730 HG2 PRO 91 1HG PRO 91 -9.728 5.511 6.468 731 HG3 PRO 91 2HG PRO 91 -10.437 6.311 7.920 732 HD2 PRO 91 1HD PRO 91 -11.233 6.893 5.391 733 HD3 PRO 91 2HD PRO 91 -11.194 8.103 6.685 734 H LEU 92 H LEU 92 -6.333 8.615 4.500 735 HA LEU 92 HA LEU 92 -6.070 6.257 2.920 736 HB2 LEU 92 1HB LEU 92 -4.941 8.942 2.998 737 HB3 LEU 92 2HB LEU 92 -3.745 7.710 2.564 738 HG LEU 92 HG LEU 92 -6.034 7.188 1.003 739 HD11 LEU 92 1HD1 LEU 92 -7.021 9.227 1.013 740 HD12 LEU 92 2HD1 LEU 92 -5.800 9.545 -0.219 741 HD13 LEU 92 3HD1 LEU 92 -5.534 10.072 1.444 742 HD21 LEU 92 3HD2 LEU 92 -4.272 8.311 -0.711 743 HD22 LEU 92 1HD2 LEU 92 -4.151 6.658 -0.108 744 HD23 LEU 92 2HD2 LEU 92 -3.213 7.944 0.651 745 H CYS 93 H CYS 93 -4.900 4.492 3.289 746 HA CYS 93 HA CYS 93 -2.763 4.625 5.312 747 HB2 CYS 93 1HB CYS 93 -4.781 2.428 4.839 748 HB3 CYS 93 2HB CYS 93 -3.359 2.251 5.881 749 HG CYS 93 HG CYS 93 -6.020 4.330 6.415 750 H PHE 94 H PHE 94 -1.219 2.732 5.115 751 HA PHE 94 HA PHE 94 -0.701 2.209 2.262 752 HB2 PHE 94 1HB PHE 94 0.958 3.690 3.368 753 HB3 PHE 94 2HB PHE 94 1.314 2.394 4.511 754 HD1 PHE 94 2HD PHE 94 1.711 3.529 1.061 755 HD2 PHE 94 1HD PHE 94 2.565 0.435 3.857 756 HE1 PHE 94 2HE PHE 94 3.392 2.605 -0.479 757 HE2 PHE 94 1HE PHE 94 4.248 -0.493 2.322 758 HZ PHE 94 HZ PHE 94 4.663 0.591 0.150 759 H ILE 95 H ILE 95 -1.352 0.197 1.830 760 HA ILE 95 HA ILE 95 -1.011 -1.910 3.820 761 HB ILE 95 HB ILE 95 -2.339 -2.041 1.110 762 HG12 ILE 95 1HG1 ILE 95 -3.690 -1.975 3.808 763 HG13 ILE 95 2HG1 ILE 95 -3.363 -0.500 2.883 764 HG21 ILE 95 1HG2 ILE 95 -2.857 -3.965 3.324 765 HG22 ILE 95 2HG2 ILE 95 -2.988 -4.190 1.580 766 HG23 ILE 95 3HG2 ILE 95 -1.400 -4.155 2.348 767 HD11 ILE 95 3HD1 ILE 95 -5.560 -1.023 2.344 768 HD12 ILE 95 1HD1 ILE 95 -4.633 -1.633 0.975 769 HD13 ILE 95 2HD1 ILE 95 -5.218 -2.747 2.211 770 H PHE 96 H PHE 96 0.560 -3.381 3.745 771 HA PHE 96 HA PHE 96 2.209 -3.522 1.309 772 HB2 PHE 96 1HB PHE 96 3.431 -2.639 3.229 773 HB3 PHE 96 2HB PHE 96 2.981 -4.052 4.185 774 HD1 PHE 96 1HD PHE 96 3.713 -4.733 0.739 775 HD2 PHE 96 2HD PHE 96 5.444 -4.292 4.602 776 HE1 PHE 96 1HE PHE 96 5.725 -5.922 -0.031 777 HE2 PHE 96 2HE PHE 96 7.459 -5.480 3.839 778 HZ PHE 96 HZ PHE 96 7.601 -6.296 1.519 779 H SER 97 H SER 97 1.215 -5.178 0.232 780 HA SER 97 HA SER 97 0.481 -7.621 1.568 781 HB2 SER 97 1HB SER 97 -0.669 -6.554 -0.485 782 HB3 SER 97 2HB SER 97 0.659 -7.264 -1.419 783 HG SER 97 HG SER 97 0.052 -9.312 -0.519 784 H SER 98 H SER 98 2.253 -8.644 2.379 785 HA SER 98 HA SER 98 4.275 -9.508 0.417 786 HB2 SER 98 1HB SER 98 6.009 -9.303 2.002 787 HB3 SER 98 2HB SER 98 5.039 -7.834 2.215 788 HG SER 98 HG SER 98 3.914 -9.122 3.908 789 HA PRO 99 HA PRO 99 2.304 -13.351 1.861 790 HB2 PRO 99 2HB PRO 99 1.529 -13.685 -0.276 791 HB3 PRO 99 1HB PRO 99 2.918 -14.764 -0.403 792 HG2 PRO 99 1HG PRO 99 4.243 -13.161 -1.441 793 HG3 PRO 99 2HG PRO 99 2.618 -12.752 -2.107 794 HD2 PRO 99 1HD PRO 99 4.199 -10.924 -0.870 795 HD3 PRO 99 2HD PRO 99 2.430 -10.887 -0.764 796 H VAL 100 H VAL 100 3.192 -15.561 2.111 797 HA VAL 100 HA VAL 100 6.086 -15.445 2.621 798 HB VAL 100 HB VAL 100 4.757 -15.883 4.610 799 HG11 VAL 100 1HG1 VAL 100 3.456 -17.988 4.792 800 HG12 VAL 100 2HG1 VAL 100 2.782 -16.845 3.629 801 HG13 VAL 100 3HG1 VAL 100 3.697 -18.244 3.064 802 HG21 VAL 100 3HG2 VAL 100 6.133 -17.491 5.449 803 HG22 VAL 100 1HG2 VAL 100 5.902 -18.564 4.068 804 HG23 VAL 100 2HG2 VAL 100 6.980 -17.174 3.935 805 H GLY 101 H GLY 101 4.408 -16.258 0.125 806 HA2 GLY 101 1HA GLY 101 5.566 -18.943 -0.240 807 HA3 GLY 101 2HA GLY 101 4.217 -18.291 -1.159 808 H CYS 102 H CYS 102 6.234 -15.772 -0.953 809 HA CYS 102 HA CYS 102 7.323 -16.287 -3.605 810 HB2 CYS 102 1HB CYS 102 6.118 -14.116 -2.673 811 HB3 CYS 102 2HB CYS 102 7.772 -13.703 -2.189 812 HG CYS 102 HG CYS 102 8.719 -13.095 -4.528 813 H LYS 103 H LYS 103 9.568 -14.925 -3.814 814 HA LYS 103 HA LYS 103 11.421 -16.446 -2.171 815 HB2 LYS 103 1HB LYS 103 12.192 -14.502 -4.337 816 HB3 LYS 103 2HB LYS 103 13.071 -15.929 -3.766 817 HG2 LYS 103 1HG LYS 103 12.030 -17.294 -5.191 818 HG3 LYS 103 2HG LYS 103 10.447 -16.579 -4.841 819 HD2 LYS 103 1HD LYS 103 11.091 -16.275 -7.197 820 HD3 LYS 103 2HD LYS 103 10.914 -14.729 -6.348 821 HE2 LYS 103 1HE LYS 103 12.954 -14.193 -7.085 822 HE3 LYS 103 2HE LYS 103 13.578 -15.416 -5.969 823 HZ1 LYS 103 3HZ LYS 103 12.628 -16.304 -8.594 824 HZ2 LYS 103 1HZ LYS 103 13.872 -16.926 -7.630 825 HZ3 LYS 103 2HZ LYS 103 14.118 -15.506 -8.515 826 HA PRO 104 HA PRO 104 12.512 -13.185 0.563 827 HB2 PRO 104 2HB PRO 104 13.747 -14.742 1.717 828 HB3 PRO 104 1HB PRO 104 15.121 -13.829 1.093 829 HG2 PRO 104 1HG PRO 104 15.465 -15.292 -0.680 830 HG3 PRO 104 2HG PRO 104 14.897 -16.428 0.602 831 HD2 PRO 104 1HD PRO 104 13.739 -16.285 -1.849 832 HD3 PRO 104 2HD PRO 104 12.822 -16.648 -0.377 833 H GLU 105 H GLU 105 14.165 -13.638 -2.432 834 HA GLU 105 HA GLU 105 15.913 -11.394 -2.253 835 HB2 GLU 105 1HB GLU 105 14.910 -13.069 -4.554 836 HB3 GLU 105 2HB GLU 105 15.986 -11.683 -4.795 837 HG2 GLU 105 1HG GLU 105 16.641 -14.022 -3.008 838 HG3 GLU 105 2HG GLU 105 17.128 -13.899 -4.704 839 H GLN 106 H GLN 106 12.601 -11.856 -3.225 840 HA GLN 106 HA GLN 106 12.424 -9.177 -4.354 841 HB2 GLN 106 1HB GLN 106 10.094 -11.036 -3.957 842 HB3 GLN 106 2HB GLN 106 10.319 -9.780 -5.184 843 HG2 GLN 106 1HG GLN 106 11.956 -12.309 -5.068 844 HG3 GLN 106 2HG GLN 106 10.477 -12.127 -6.023 845 HE21 GLN 106 2HE2 GLN 106 12.016 -9.642 -8.191 846 HE22 GLN 106 1HE2 GLN 106 10.602 -9.807 -7.212 847 H GLN 107 H GLN 107 10.592 -11.024 -1.909 848 HA GLN 107 HA GLN 107 9.088 -9.100 -0.770 849 HB2 GLN 107 1HB GLN 107 10.091 -11.633 0.031 850 HB3 GLN 107 2HB GLN 107 10.298 -10.524 1.397 851 HG2 GLN 107 1HG GLN 107 7.695 -10.164 0.230 852 HG3 GLN 107 2HG GLN 107 7.970 -11.869 0.618 853 HE21 GLN 107 2HE2 GLN 107 8.195 -9.171 3.697 854 HE22 GLN 107 1HE2 GLN 107 8.791 -8.759 2.129 855 H MET 108 H MET 108 12.546 -9.573 -0.236 856 HA MET 108 HA MET 108 12.852 -7.655 1.807 857 HB2 MET 108 1HB MET 108 14.690 -9.007 -0.130 858 HB3 MET 108 2HB MET 108 15.290 -7.625 0.800 859 HG2 MET 108 1HG MET 108 14.105 -9.130 2.751 860 HG3 MET 108 2HG MET 108 14.733 -10.362 1.654 861 HE1 MET 108 3HE MET 108 16.922 -10.258 0.614 862 HE2 MET 108 1HE MET 108 17.840 -8.756 0.724 863 HE3 MET 108 2HE MET 108 18.359 -10.175 1.632 864 H MET 109 H MET 109 13.167 -7.431 -1.718 865 HA MET 109 HA MET 109 14.118 -4.849 -1.953 866 HB2 MET 109 1HB MET 109 12.327 -6.541 -3.668 867 HB3 MET 109 2HB MET 109 12.656 -4.862 -4.121 868 HG2 MET 109 1HG MET 109 15.114 -6.208 -3.458 869 HG3 MET 109 2HG MET 109 14.212 -7.117 -4.673 870 HE1 MET 109 3HE MET 109 13.799 -4.578 -7.575 871 HE2 MET 109 1HE MET 109 13.838 -6.299 -7.190 872 HE3 MET 109 2HE MET 109 12.693 -5.238 -6.370 873 H TYR 110 H TYR 110 10.902 -5.959 -1.161 874 HA TYR 110 HA TYR 110 9.832 -3.246 -1.319 875 HB2 TYR 110 1HB TYR 110 8.371 -5.772 -0.524 876 HB3 TYR 110 2HB TYR 110 7.662 -4.235 -1.022 877 HD1 TYR 110 2HD TYR 110 9.392 -7.248 -2.216 878 HD2 TYR 110 1HD TYR 110 7.497 -3.609 -3.342 879 HE1 TYR 110 2HE TYR 110 9.326 -8.012 -4.554 880 HE2 TYR 110 1HE TYR 110 7.426 -4.362 -5.682 881 HH TYR 110 HH TYR 110 8.098 -7.588 -6.594 882 H ALA 111 H ALA 111 10.620 -5.744 1.018 883 HA ALA 111 HA ALA 111 9.437 -4.515 3.275 884 HB1 ALA 111 3HB ALA 111 10.880 -6.881 2.737 885 HB2 ALA 111 1HB ALA 111 11.717 -6.046 4.047 886 HB3 ALA 111 2HB ALA 111 10.006 -6.446 4.207 887 H GLY 112 H GLY 112 12.461 -4.043 1.614 888 HA2 GLY 112 1HA GLY 112 13.519 -2.403 3.795 889 HA3 GLY 112 2HA GLY 112 14.387 -2.886 2.347 890 H SER 113 H SER 113 12.173 -2.077 0.583 891 HA SER 113 HA SER 113 12.854 0.750 0.464 892 HB2 SER 113 1HB SER 113 11.215 -0.877 -1.501 893 HB3 SER 113 2HB SER 113 11.963 0.704 -1.779 894 HG SER 113 HG SER 113 13.637 -1.373 -0.974 895 H LYS 114 H LYS 114 10.348 -1.196 1.621 896 HA LYS 114 HA LYS 114 8.016 0.150 1.097 897 HB2 LYS 114 1HB LYS 114 7.847 -1.843 2.332 898 HB3 LYS 114 2HB LYS 114 8.975 -1.269 3.571 899 HG2 LYS 114 1HG LYS 114 7.347 0.294 4.418 900 HG3 LYS 114 2HG LYS 114 6.227 -0.128 3.109 901 HD2 LYS 114 1HD LYS 114 5.381 -1.436 4.794 902 HD3 LYS 114 2HD LYS 114 6.539 -2.562 4.065 903 HE2 LYS 114 1HE LYS 114 8.198 -2.041 5.752 904 HE3 LYS 114 2HE LYS 114 7.146 -0.788 6.427 905 HZ1 LYS 114 3HZ LYS 114 6.515 -2.416 7.808 906 HZ2 LYS 114 1HZ LYS 114 7.062 -3.653 6.791 907 HZ3 LYS 114 2HZ LYS 114 5.551 -2.944 6.521 908 H ASN 115 H ASN 115 10.141 0.765 3.901 909 HA ASN 115 HA ASN 115 8.824 2.982 4.906 910 HB2 ASN 115 1HB ASN 115 10.728 3.407 6.200 911 HB3 ASN 115 2HB ASN 115 10.826 1.672 5.875 912 HD21 ASN 115 2HD2 ASN 115 13.839 1.817 4.192 913 HD22 ASN 115 1HD2 ASN 115 12.540 0.868 4.821 914 H ARG 116 H ARG 116 11.401 2.855 2.470 915 HA ARG 116 HA ARG 116 11.789 5.579 2.105 916 HB2 ARG 116 1HB ARG 116 13.299 4.035 1.089 917 HB3 ARG 116 2HB ARG 116 11.993 3.281 0.162 918 HG2 ARG 116 1HG ARG 116 12.946 4.560 -1.469 919 HG3 ARG 116 2HG ARG 116 11.740 5.696 -0.840 920 HD2 ARG 116 1HD ARG 116 13.539 7.086 -0.771 921 HD3 ARG 116 2HD ARG 116 13.757 6.300 0.798 922 HE ARG 116 HE ARG 116 15.145 4.709 -0.913 923 HH11 ARG 116 2HH1 ARG 116 15.173 8.117 -0.203 924 HH12 ARG 116 1HH1 ARG 116 16.855 8.313 -0.573 925 HH21 ARG 116 1HH2 ARG 116 18.096 6.514 -1.256 926 HH22 ARG 116 2HH2 ARG 116 17.359 4.955 -1.403 927 H LEU 117 H LEU 117 9.665 3.436 0.200 928 HA LEU 117 HA LEU 117 8.484 5.461 -1.334 929 HB2 LEU 117 1HB LEU 117 8.304 3.188 -2.036 930 HB3 LEU 117 2HB LEU 117 7.499 2.736 -0.524 931 HG LEU 117 HG LEU 117 5.634 4.359 -1.319 932 HD11 LEU 117 1HD1 LEU 117 6.175 5.418 -3.216 933 HD12 LEU 117 2HD1 LEU 117 5.722 3.904 -4.000 934 HD13 LEU 117 3HD1 LEU 117 7.416 4.237 -3.640 935 HD21 LEU 117 3HD2 LEU 117 4.488 2.550 -2.349 936 HD22 LEU 117 1HD2 LEU 117 5.543 1.855 -1.119 937 HD23 LEU 117 2HD2 LEU 117 6.001 1.774 -2.821 938 H VAL 118 H VAL 118 7.145 3.763 1.504 939 HA VAL 118 HA VAL 118 4.811 5.162 1.830 940 HB VAL 118 HB VAL 118 6.649 4.176 4.016 941 HG11 VAL 118 1HG1 VAL 118 5.160 4.804 5.554 942 HG12 VAL 118 2HG1 VAL 118 4.461 5.833 4.303 943 HG13 VAL 118 3HG1 VAL 118 3.802 4.222 4.592 944 HG21 VAL 118 3HG2 VAL 118 5.401 2.708 2.086 945 HG22 VAL 118 1HG2 VAL 118 5.847 2.108 3.683 946 HG23 VAL 118 2HG2 VAL 118 4.208 2.686 3.385 947 H GLN 119 H GLN 119 7.987 6.015 3.198 948 HA GLN 119 HA GLN 119 7.245 8.321 4.548 949 HB2 GLN 119 1HB GLN 119 9.806 7.421 3.262 950 HB3 GLN 119 2HB GLN 119 9.689 9.034 3.982 951 HG2 GLN 119 1HG GLN 119 8.635 7.269 5.894 952 HG3 GLN 119 2HG GLN 119 10.096 6.501 5.258 953 HE21 GLN 119 2HE2 GLN 119 12.215 9.243 6.299 954 HE22 GLN 119 1HE2 GLN 119 11.905 8.276 4.901 955 H THR 120 H THR 120 7.998 7.847 1.146 956 HA THR 120 HA THR 120 8.123 10.568 0.410 957 HB THR 120 HB THR 120 7.168 8.385 -1.431 958 HG1 THR 120 1HG THR 120 9.130 7.539 -1.458 959 HG21 THR 120 3HG2 THR 120 7.278 10.099 -2.866 960 HG22 THR 120 1HG2 THR 120 9.030 9.981 -2.710 961 HG23 THR 120 2HG2 THR 120 8.128 11.117 -1.706 962 H ALA 121 H ALA 121 5.452 8.236 0.431 963 HA ALA 121 HA ALA 121 3.534 10.032 -0.661 964 HB1 ALA 121 3HB ALA 121 3.506 7.433 -0.510 965 HB2 ALA 121 1HB ALA 121 2.754 7.719 1.059 966 HB3 ALA 121 2HB ALA 121 1.994 8.334 -0.408 967 H GLU 122 H GLU 122 4.926 9.708 2.429 968 HA GLU 122 HA GLU 122 4.614 10.850 4.375 969 HB2 GLU 122 1HB GLU 122 3.743 12.591 2.429 970 HB3 GLU 122 2HB GLU 122 2.348 12.494 3.514 971 HG2 GLU 122 1HG GLU 122 3.614 13.244 5.376 972 HG3 GLU 122 2HG GLU 122 5.132 13.075 4.482 973 H LEU 123 H LEU 123 3.165 8.430 3.783 974 HA LEU 123 HA LEU 123 0.558 8.795 5.032 975 HB2 LEU 123 1HB LEU 123 1.891 6.279 4.017 976 HB3 LEU 123 2HB LEU 123 0.204 6.441 4.536 977 HG LEU 123 HG LEU 123 1.200 8.114 2.270 978 HD11 LEU 123 1HD1 LEU 123 0.252 5.270 1.970 979 HD12 LEU 123 2HD1 LEU 123 1.930 5.788 1.819 980 HD13 LEU 123 3HD1 LEU 123 0.719 6.381 0.682 981 HD21 LEU 123 3HD2 LEU 123 -1.091 8.295 3.403 982 HD22 LEU 123 1HD2 LEU 123 -1.458 6.764 2.606 983 HD23 LEU 123 2HD2 LEU 123 -1.049 8.184 1.642 984 H THR 124 H THR 124 0.910 9.224 7.169 985 HA THR 124 HA THR 124 2.830 7.984 8.802 986 HB THR 124 HB THR 124 1.846 10.046 9.533 987 HG1 THR 124 1HG THR 124 2.334 9.036 11.367 988 HG21 THR 124 3HG2 THR 124 -0.743 8.533 9.356 989 HG22 THR 124 1HG2 THR 124 -0.314 10.075 8.616 990 HG23 THR 124 2HG2 THR 124 -0.585 9.976 10.356 991 H LYS 125 H LYS 125 -0.261 6.929 7.693 992 HA LYS 125 HA LYS 125 -0.331 4.760 9.667 993 HB2 LYS 125 1HB LYS 125 -2.417 5.602 7.638 994 HB3 LYS 125 2HB LYS 125 -2.618 4.361 8.885 995 HG2 LYS 125 1HG LYS 125 -1.768 6.869 10.048 996 HG3 LYS 125 2HG LYS 125 -3.246 7.060 9.090 997 HD2 LYS 125 1HD LYS 125 -3.660 4.695 10.496 998 HD3 LYS 125 2HD LYS 125 -2.860 5.769 11.659 999 HE2 LYS 125 1HE LYS 125 -5.144 6.787 9.996 1000 HE3 LYS 125 2HE LYS 125 -5.452 5.809 11.438 1001 HZ1 LYS 125 3HZ LYS 125 -5.126 8.475 11.445 1002 HZ2 LYS 125 1HZ LYS 125 -3.565 7.956 11.842 1003 HZ3 LYS 125 2HZ LYS 125 -4.882 7.479 12.791 1004 H VAL 126 H VAL 126 1.036 3.197 8.989 1005 HA VAL 126 HA VAL 126 0.525 2.054 6.323 1006 HB VAL 126 HB VAL 126 2.609 2.951 5.923 1007 HG11 VAL 126 1HG1 VAL 126 2.876 3.805 8.251 1008 HG12 VAL 126 2HG1 VAL 126 3.528 2.228 8.703 1009 HG13 VAL 126 3HG1 VAL 126 4.373 3.227 7.520 1010 HG21 VAL 126 3HG2 VAL 126 4.060 1.166 5.670 1011 HG22 VAL 126 1HG2 VAL 126 3.614 0.451 7.219 1012 HG23 VAL 126 2HG2 VAL 126 2.504 0.354 5.851 1013 H PHE 127 H PHE 127 -0.292 0.086 6.534 1014 HA PHE 127 HA PHE 127 0.462 -1.519 8.880 1015 HB2 PHE 127 1HB PHE 127 -1.903 -1.989 7.057 1016 HB3 PHE 127 2HB PHE 127 -1.615 -2.685 8.654 1017 HD1 PHE 127 2HD PHE 127 -0.881 -0.422 10.293 1018 HD2 PHE 127 1HD PHE 127 -3.819 -0.701 7.227 1019 HE1 PHE 127 2HE PHE 127 -2.149 1.405 11.346 1020 HE2 PHE 127 1HE PHE 127 -5.091 1.125 8.275 1021 HZ PHE 127 HZ PHE 127 -4.257 2.180 10.337 1022 H GLU 128 H GLU 128 0.668 -3.857 8.555 1023 HA GLU 128 HA GLU 128 1.592 -4.554 5.848 1024 HB2 GLU 128 1HB GLU 128 3.513 -4.127 7.341 1025 HB3 GLU 128 2HB GLU 128 2.907 -5.373 8.444 1026 HG2 GLU 128 1HG GLU 128 3.032 -6.642 5.970 1027 HG3 GLU 128 2HG GLU 128 4.492 -5.645 6.048 1028 H ILE 129 H ILE 129 0.608 -6.277 5.034 1029 HA ILE 129 HA ILE 129 -0.833 -8.064 6.868 1030 HB ILE 129 HB ILE 129 -2.230 -8.698 5.008 1031 HG12 ILE 129 1HG1 ILE 129 -0.479 -6.858 3.356 1032 HG13 ILE 129 2HG1 ILE 129 -0.532 -8.626 3.237 1033 HG21 ILE 129 1HG2 ILE 129 -3.148 -6.843 6.035 1034 HG22 ILE 129 2HG2 ILE 129 -1.846 -5.777 5.508 1035 HG23 ILE 129 3HG2 ILE 129 -3.060 -6.326 4.352 1036 HD11 ILE 129 3HD1 ILE 129 -1.902 -8.129 1.510 1037 HD12 ILE 129 1HD1 ILE 129 -3.103 -8.141 2.802 1038 HD13 ILE 129 2HD1 ILE 129 -2.441 -6.610 2.226 1039 H ARG 130 H ARG 130 -0.595 -10.279 6.764 1040 HA ARG 130 HA ARG 130 1.913 -11.206 5.666 1041 HB2 ARG 130 1HB ARG 130 1.401 -11.991 7.851 1042 HB3 ARG 130 2HB ARG 130 -0.215 -12.512 7.353 1043 HG2 ARG 130 1HG ARG 130 1.147 -14.457 7.611 1044 HG3 ARG 130 2HG ARG 130 0.842 -14.212 5.882 1045 HD2 ARG 130 1HD ARG 130 3.082 -14.547 5.734 1046 HD3 ARG 130 2HD ARG 130 3.117 -12.821 6.118 1047 HE ARG 130 HE ARG 130 3.129 -14.411 8.479 1048 HH11 ARG 130 2HH1 ARG 130 5.142 -13.252 5.887 1049 HH12 ARG 130 1HH1 ARG 130 6.607 -13.336 6.812 1050 HH21 ARG 130 1HH2 ARG 130 6.551 -14.063 8.983 1051 HH22 ARG 130 2HH2 ARG 130 5.047 -14.528 9.707 1052 H THR 131 H THR 131 -1.348 -11.118 4.694 1053 HA THR 131 HA THR 131 -0.768 -12.419 2.220 1054 HB THR 131 HB THR 131 -1.071 -14.484 3.310 1055 HG1 THR 131 1HG THR 131 -2.538 -15.153 1.937 1056 HG21 THR 131 3HG2 THR 131 -2.666 -14.983 4.956 1057 HG22 THR 131 1HG2 THR 131 -3.657 -13.584 4.548 1058 HG23 THR 131 2HG2 THR 131 -2.112 -13.360 5.369 1059 H THR 132 H THR 132 -2.261 -11.933 0.650 1060 HA THR 132 HA THR 132 -3.760 -9.685 0.751 1061 HB THR 132 HB THR 132 -5.175 -10.652 -1.100 1062 HG1 THR 132 1HG THR 132 -3.705 -12.945 -0.339 1063 HG21 THR 132 3HG2 THR 132 -3.420 -10.621 -2.696 1064 HG22 THR 132 1HG2 THR 132 -2.234 -11.162 -1.508 1065 HG23 THR 132 2HG2 THR 132 -2.917 -9.540 -1.397 1066 H ASP 133 H ASP 133 -4.942 -12.953 1.481 1067 HA ASP 133 HA ASP 133 -7.590 -12.608 1.846 1068 HB2 ASP 133 1HB ASP 133 -5.566 -14.181 3.404 1069 HB3 ASP 133 2HB ASP 133 -7.245 -14.136 3.960 1070 H ASP 134 H ASP 134 -5.061 -11.506 4.045 1071 HA ASP 134 HA ASP 134 -6.609 -10.715 6.205 1072 HB2 ASP 134 1HB ASP 134 -4.012 -9.727 5.060 1073 HB3 ASP 134 2HB ASP 134 -4.751 -8.892 6.433 1074 H LEU 135 H LEU 135 -5.704 -8.829 3.329 1075 HA LEU 135 HA LEU 135 -6.899 -6.423 3.977 1076 HB2 LEU 135 1HB LEU 135 -5.532 -6.486 2.065 1077 HB3 LEU 135 2HB LEU 135 -6.471 -7.808 1.350 1078 HG LEU 135 HG LEU 135 -8.218 -6.365 0.708 1079 HD11 LEU 135 1HD1 LEU 135 -6.920 -4.180 2.328 1080 HD12 LEU 135 2HD1 LEU 135 -8.340 -5.102 2.820 1081 HD13 LEU 135 3HD1 LEU 135 -8.416 -4.060 1.400 1082 HD21 LEU 135 3HD2 LEU 135 -6.775 -5.930 -0.963 1083 HD22 LEU 135 1HD2 LEU 135 -5.461 -5.513 0.137 1084 HD23 LEU 135 2HD2 LEU 135 -6.713 -4.325 -0.231 1085 H THR 136 H THR 136 -8.838 -6.827 5.094 1086 HA THR 136 HA THR 136 -11.105 -7.459 3.328 1087 HB THR 136 HB THR 136 -12.191 -8.360 5.530 1088 HG1 THR 136 1HG THR 136 -10.844 -8.812 7.114 1089 HG21 THR 136 3HG2 THR 136 -10.701 -9.581 3.405 1090 HG22 THR 136 1HG2 THR 136 -12.113 -10.193 4.265 1091 HG23 THR 136 2HG2 THR 136 -10.494 -10.512 4.887 1092 H GLU 137 H GLU 137 -13.015 -6.327 3.718 1093 HA GLU 137 HA GLU 137 -12.961 -3.711 4.336 1094 HB2 GLU 137 1HB GLU 137 -14.942 -4.735 3.417 1095 HB3 GLU 137 2HB GLU 137 -15.210 -5.643 4.913 1096 HG2 GLU 137 1HG GLU 137 -15.172 -3.089 5.850 1097 HG3 GLU 137 2HG GLU 137 -15.883 -2.874 4.245 1098 H THR 138 H THR 138 -13.268 -6.342 6.658 1099 HA THR 138 HA THR 138 -13.651 -4.611 8.913 1100 HB THR 138 HB THR 138 -12.723 -7.474 9.061 1101 HG1 THR 138 1HG THR 138 -15.199 -6.425 8.274 1102 HG21 THR 138 3HG2 THR 138 -14.134 -7.424 11.124 1103 HG22 THR 138 1HG2 THR 138 -14.362 -5.695 10.867 1104 HG23 THR 138 2HG2 THR 138 -12.748 -6.335 11.177 1105 H TRP 139 H TRP 139 -11.027 -6.940 8.273 1106 HA TRP 139 HA TRP 139 -9.188 -6.122 10.079 1107 HB2 TRP 139 1HB TRP 139 -8.536 -7.967 8.827 1108 HB3 TRP 139 2HB TRP 139 -8.895 -7.176 7.292 1109 HD1 TRP 139 HD TRP 139 -6.056 -7.876 9.612 1110 HE1 TRP 139 1HE TRP 139 -3.913 -6.744 8.748 1111 HE3 TRP 139 3HE TRP 139 -8.112 -4.887 6.009 1112 HZ2 TRP 139 2HZ TRP 139 -3.189 -4.836 6.797 1113 HZ3 TRP 139 3HZ TRP 139 -6.625 -3.438 4.689 1114 HH2 TRP 139 HH TRP 139 -4.215 -3.414 5.077 1115 H LEU 140 H LEU 140 -10.243 -4.358 7.306 1116 HA LEU 140 HA LEU 140 -8.009 -2.517 7.341 1117 HB2 LEU 140 1HB LEU 140 -8.872 -2.903 5.195 1118 HB3 LEU 140 2HB LEU 140 -10.543 -2.721 5.753 1119 HG LEU 140 HG LEU 140 -9.498 -0.861 4.305 1120 HD11 LEU 140 1HD1 LEU 140 -11.175 0.437 5.021 1121 HD12 LEU 140 2HD1 LEU 140 -10.600 0.433 6.688 1122 HD13 LEU 140 3HD1 LEU 140 -11.556 -0.919 6.083 1123 HD21 LEU 140 3HD2 LEU 140 -8.507 0.198 6.917 1124 HD22 LEU 140 1HD2 LEU 140 -8.083 0.681 5.274 1125 HD23 LEU 140 2HD2 LEU 140 -7.468 -0.834 5.934 1126 H LYS 141 H LYS 141 -11.536 -2.132 7.744 1127 HA LYS 141 HA LYS 141 -11.483 0.457 8.760 1128 HB2 LYS 141 1HB LYS 141 -13.407 -1.761 8.656 1129 HB3 LYS 141 2HB LYS 141 -13.652 -0.657 10.020 1130 HG2 LYS 141 1HG LYS 141 -14.337 1.046 8.713 1131 HG3 LYS 141 2HG LYS 141 -13.216 0.626 7.406 1132 HD2 LYS 141 1HD LYS 141 -15.030 -0.108 6.309 1133 HD3 LYS 141 2HD LYS 141 -14.942 -1.504 7.398 1134 HE2 LYS 141 1HE LYS 141 -16.554 -0.589 8.880 1135 HE3 LYS 141 2HE LYS 141 -16.445 1.002 8.110 1136 HZ1 LYS 141 3HZ LYS 141 -17.932 0.428 6.578 1137 HZ2 LYS 141 1HZ LYS 141 -18.291 -0.911 7.547 1138 HZ3 LYS 141 2HZ LYS 141 -17.193 -1.062 6.269 1139 H GLU 142 H GLU 142 -10.756 -2.565 10.294 1140 HA GLU 142 HA GLU 142 -11.115 -1.799 12.984 1141 HB2 GLU 142 1HB GLU 142 -9.610 -3.949 11.560 1142 HB3 GLU 142 2HB GLU 142 -9.226 -3.644 13.261 1143 HG2 GLU 142 1HG GLU 142 -11.869 -3.766 13.497 1144 HG3 GLU 142 2HG GLU 142 -11.686 -4.756 12.043 1145 H LYS 143 H LYS 143 -8.266 -1.728 10.869 1146 HA LYS 143 HA LYS 143 -6.469 -0.724 12.800 1147 HB2 LYS 143 1HB LYS 143 -6.329 -0.291 9.810 1148 HB3 LYS 143 2HB LYS 143 -4.984 -0.280 10.962 1149 HG2 LYS 143 1HG LYS 143 -6.630 -2.754 10.735 1150 HG3 LYS 143 2HG LYS 143 -5.475 -2.372 9.446 1151 HD2 LYS 143 1HD LYS 143 -4.050 -1.915 11.797 1152 HD3 LYS 143 2HD LYS 143 -4.992 -3.382 12.120 1153 HE2 LYS 143 1HE LYS 143 -3.980 -4.585 10.413 1154 HE3 LYS 143 2HE LYS 143 -3.511 -3.119 9.539 1155 HZ1 LYS 143 3HZ LYS 143 -2.251 -3.084 12.038 1156 HZ2 LYS 143 1HZ LYS 143 -1.541 -3.211 10.507 1157 HZ3 LYS 143 2HZ LYS 143 -1.989 -4.607 11.350 1158 H LEU 144 H LEU 144 -8.719 0.829 10.603 1159 HA LEU 144 HA LEU 144 -7.720 3.476 11.012 1160 HB2 LEU 144 1HB LEU 144 -10.502 2.758 10.107 1161 HB3 LEU 144 2HB LEU 144 -9.563 4.215 9.738 1162 HG LEU 144 HG LEU 144 -8.908 1.454 8.713 1163 HD11 LEU 144 1HD1 LEU 144 -10.266 3.760 7.325 1164 HD12 LEU 144 2HD1 LEU 144 -11.025 2.241 7.800 1165 HD13 LEU 144 3HD1 LEU 144 -9.762 2.248 6.569 1166 HD21 LEU 144 3HD2 LEU 144 -7.534 2.857 7.094 1167 HD22 LEU 144 1HD2 LEU 144 -6.925 2.715 8.744 1168 HD23 LEU 144 2HD2 LEU 144 -7.752 4.186 8.234 1169 H ALA 145 H ALA 145 -10.455 1.622 12.303 1170 HA ALA 145 HA ALA 145 -11.648 3.594 13.846 1171 HB1 ALA 145 3HB ALA 145 -13.016 1.892 14.227 1172 HB2 ALA 145 1HB ALA 145 -11.820 0.759 13.597 1173 HB3 ALA 145 2HB ALA 145 -11.816 1.185 15.308 1174 H SER 146 H SER 146 -11.709 3.162 16.422 1175 HA SER 146 HA SER 146 -9.133 2.737 17.611 1176 HB2 SER 146 1HB SER 146 -9.219 5.160 16.561 1177 HB3 SER 146 2HB SER 146 -10.160 5.520 18.019 1178 HG SER 146 HG SER 146 -7.582 5.472 17.858 1179 H GLY 147 H GLY 147 -10.350 1.254 18.838 1180 HA2 GLY 147 1HA GLY 147 -12.060 2.534 20.881 1181 HA3 GLY 147 2HA GLY 147 -12.454 0.971 20.178 1182 HA PRO 148 HA PRO 148 -10.209 0.142 24.116 1183 HB2 PRO 148 2HB PRO 148 -12.197 -0.253 25.199 1184 HB3 PRO 148 1HB PRO 148 -11.825 -1.941 24.862 1185 HG2 PRO 148 1HG PRO 148 -13.171 -2.005 22.968 1186 HG3 PRO 148 2HG PRO 148 -14.103 -0.875 24.021 1187 HD2 PRO 148 1HD PRO 148 -13.354 -0.240 21.489 1188 HD3 PRO 148 2HD PRO 148 -13.455 0.961 22.787 1189 H SER 149 H SER 149 -9.659 -2.258 24.928 1190 HA SER 149 HA SER 149 -8.704 -3.744 22.568 1191 HB2 SER 149 1HB SER 149 -7.037 -2.445 24.184 1192 HB3 SER 149 2HB SER 149 -7.229 -3.912 25.159 1193 HG SER 149 HG SER 149 -5.570 -3.668 23.247 1194 H SER 150 H SER 150 -9.718 -5.619 22.385 1195 HA SER 150 HA SER 150 -10.438 -7.075 24.845 1196 HB2 SER 150 1HB SER 150 -12.168 -6.147 22.889 1197 HB3 SER 150 2HB SER 150 -11.929 -7.847 22.451 1198 HG SER 150 HG SER 150 -13.209 -8.333 24.028 1199 H GLY 151 H GLY 151 -9.346 -8.896 25.135 1200 HA2 GLY 151 1HA GLY 151 -8.802 -11.117 24.345 1201 HA3 GLY 151 2HA GLY 151 -8.507 -10.426 22.758 Start of MODEL 17 1 H1 GLY 1 H GLY 1 8.280 -23.868 13.942 2 HA2 GLY 1 1HA GLY 1 10.521 -24.394 15.162 3 HA3 GLY 1 2HA GLY 1 10.106 -25.357 13.751 4 H SER 2 H SER 2 12.707 -24.360 14.975 5 HA SER 2 HA SER 2 14.778 -23.836 14.184 6 HB2 SER 2 1HB SER 2 13.319 -24.720 11.845 7 HB3 SER 2 2HB SER 2 14.462 -23.436 11.417 8 HG SER 2 HG SER 2 15.206 -25.763 11.499 9 H SER 3 H SER 3 15.481 -21.886 14.719 10 HA SER 3 HA SER 3 14.166 -19.497 14.559 11 HB2 SER 3 1HB SER 3 16.400 -18.396 14.723 12 HB3 SER 3 2HB SER 3 16.194 -19.735 15.867 13 HG SER 3 HG SER 3 18.077 -19.443 14.021 14 H GLY 4 H GLY 4 13.773 -17.968 13.058 15 HA2 GLY 4 1HA GLY 4 14.401 -18.615 10.296 16 HA3 GLY 4 2HA GLY 4 13.335 -17.334 10.853 17 H SER 5 H SER 5 14.916 -15.846 12.476 18 HA SER 5 HA SER 5 16.414 -14.324 10.637 19 HB2 SER 5 1HB SER 5 15.403 -13.262 12.566 20 HB3 SER 5 2HB SER 5 16.364 -14.269 13.664 21 HG SER 5 HG SER 5 17.027 -11.930 12.748 22 H SER 6 H SER 6 18.512 -14.325 10.087 23 HA SER 6 HA SER 6 20.399 -15.919 11.668 24 HB2 SER 6 1HB SER 6 19.356 -16.680 9.118 25 HB3 SER 6 2HB SER 6 21.065 -16.256 8.915 26 HG SER 6 HG SER 6 21.218 -17.648 10.982 27 H GLY 7 H GLY 7 20.041 -13.707 8.902 28 HA2 GLY 7 1HA GLY 7 21.691 -11.704 9.874 29 HA3 GLY 7 2HA GLY 7 22.733 -12.795 8.972 30 H SER 8 H SER 8 19.721 -10.934 8.674 31 HA SER 8 HA SER 8 19.268 -11.053 5.991 32 HB2 SER 8 1HB SER 8 18.811 -8.982 8.074 33 HB3 SER 8 2HB SER 8 18.685 -8.450 6.387 34 HG SER 8 HG SER 8 17.186 -10.445 7.715 35 H ASP 9 H ASP 9 21.255 -8.522 7.535 36 HA ASP 9 HA ASP 9 23.110 -7.412 6.811 37 HB2 ASP 9 1HB ASP 9 23.202 -9.915 5.387 38 HB3 ASP 9 2HB ASP 9 23.777 -8.610 4.343 39 H SER 10 H SER 10 21.734 -5.612 6.423 40 HA SER 10 HA SER 10 20.730 -3.973 5.193 41 HB2 SER 10 1HB SER 10 22.018 -3.123 3.428 42 HB3 SER 10 2HB SER 10 23.197 -4.022 4.400 43 HG SER 10 HG SER 10 22.407 -4.447 1.842 44 H LEU 11 H LEU 11 19.863 -3.492 2.809 45 HA LEU 11 HA LEU 11 18.636 -5.902 1.689 46 HB2 LEU 11 1HB LEU 11 17.019 -3.435 2.328 47 HB3 LEU 11 2HB LEU 11 16.433 -5.001 1.742 48 HG LEU 11 HG LEU 11 17.808 -4.914 4.381 49 HD11 LEU 11 1HD1 LEU 11 15.139 -4.592 4.998 50 HD12 LEU 11 2HD1 LEU 11 15.420 -3.398 3.732 51 HD13 LEU 11 3HD1 LEU 11 16.409 -3.386 5.193 52 HD21 LEU 11 3HD2 LEU 11 16.240 -6.697 4.877 53 HD22 LEU 11 1HD2 LEU 11 17.089 -7.035 3.370 54 HD23 LEU 11 2HD2 LEU 11 15.429 -6.443 3.332 55 H VAL 12 H VAL 12 17.008 -4.854 -0.176 56 HA VAL 12 HA VAL 12 18.899 -3.553 -1.977 57 HB VAL 12 HB VAL 12 16.153 -4.443 -2.787 58 HG11 VAL 12 1HG1 VAL 12 18.075 -3.201 -4.180 59 HG12 VAL 12 2HG1 VAL 12 18.555 -4.877 -4.451 60 HG13 VAL 12 3HG1 VAL 12 16.939 -4.337 -4.907 61 HG21 VAL 12 3HG2 VAL 12 17.258 -6.265 -1.465 62 HG22 VAL 12 1HG2 VAL 12 16.892 -6.683 -3.138 63 HG23 VAL 12 2HG2 VAL 12 18.544 -6.275 -2.672 64 H VAL 13 H VAL 13 18.035 -1.834 -0.018 65 HA VAL 13 HA VAL 13 15.817 -0.326 -0.228 66 HB VAL 13 HB VAL 13 18.611 0.807 -0.030 67 HG11 VAL 13 1HG1 VAL 13 17.196 2.627 -0.459 68 HG12 VAL 13 2HG1 VAL 13 15.902 1.969 0.543 69 HG13 VAL 13 3HG1 VAL 13 17.369 2.598 1.295 70 HG21 VAL 13 3HG2 VAL 13 17.557 0.804 2.489 71 HG22 VAL 13 1HG2 VAL 13 16.922 -0.701 1.823 72 HG23 VAL 13 2HG2 VAL 13 18.662 -0.415 1.852 73 H CYS 14 H CYS 14 14.748 0.415 -1.932 74 HA CYS 14 HA CYS 14 16.267 1.355 -4.266 75 HB2 CYS 14 1HB CYS 14 13.418 0.392 -3.986 76 HB3 CYS 14 2HB CYS 14 14.071 1.096 -5.475 77 HG CYS 14 HG CYS 14 14.439 -1.993 -4.267 78 H GLU 15 H GLU 15 15.365 3.217 -5.445 79 HA GLU 15 HA GLU 15 14.696 5.329 -3.581 80 HB2 GLU 15 1HB GLU 15 15.271 5.348 -6.552 81 HB3 GLU 15 2HB GLU 15 14.936 6.798 -5.594 82 HG2 GLU 15 1HG GLU 15 17.290 6.647 -5.842 83 HG3 GLU 15 2HG GLU 15 16.899 6.227 -4.169 84 H VAL 16 H VAL 16 13.081 7.036 -4.502 85 HA VAL 16 HA VAL 16 10.596 5.587 -5.105 86 HB VAL 16 HB VAL 16 10.511 6.855 -3.038 87 HG11 VAL 16 1HG1 VAL 16 12.099 8.692 -4.404 88 HG12 VAL 16 2HG1 VAL 16 10.571 9.528 -4.123 89 HG13 VAL 16 3HG1 VAL 16 11.466 8.844 -2.765 90 HG21 VAL 16 3HG2 VAL 16 8.628 6.882 -4.961 91 HG22 VAL 16 1HG2 VAL 16 8.412 7.620 -3.373 92 HG23 VAL 16 2HG2 VAL 16 8.878 8.616 -4.752 93 H ASP 17 H ASP 17 10.562 5.491 -7.310 94 HA ASP 17 HA ASP 17 11.420 7.086 -9.257 95 HB2 ASP 17 1HB ASP 17 9.979 5.051 -9.547 96 HB3 ASP 17 2HB ASP 17 8.572 6.075 -9.233 97 HA PRO 18 HA PRO 18 9.810 11.147 -8.695 98 HB2 PRO 18 2HB PRO 18 11.526 11.847 -10.055 99 HB3 PRO 18 1HB PRO 18 10.233 12.110 -11.223 100 HG2 PRO 18 1HG PRO 18 10.595 10.078 -12.292 101 HG3 PRO 18 2HG PRO 18 12.276 10.523 -11.814 102 HD2 PRO 18 1HD PRO 18 11.151 8.140 -11.164 103 HD3 PRO 18 2HD PRO 18 12.307 8.972 -10.110 104 H GLU 19 H GLU 19 8.732 9.238 -11.478 105 HA GLU 19 HA GLU 19 6.462 10.832 -12.069 106 HB2 GLU 19 1HB GLU 19 5.993 9.314 -13.716 107 HB3 GLU 19 2HB GLU 19 7.705 8.955 -13.454 108 HG2 GLU 19 1HG GLU 19 7.083 6.833 -13.232 109 HG3 GLU 19 2HG GLU 19 6.473 7.312 -11.642 110 H LEU 20 H LEU 20 7.088 8.332 -9.759 111 HA LEU 20 HA LEU 20 4.279 7.842 -9.228 112 HB2 LEU 20 1HB LEU 20 6.455 6.269 -9.008 113 HB3 LEU 20 2HB LEU 20 6.347 6.880 -7.348 114 HG LEU 20 HG LEU 20 4.153 5.410 -8.808 115 HD11 LEU 20 1HD1 LEU 20 6.022 3.943 -8.324 116 HD12 LEU 20 2HD1 LEU 20 4.666 3.577 -7.259 117 HD13 LEU 20 3HD1 LEU 20 6.045 4.491 -6.648 118 HD21 LEU 20 3HD2 LEU 20 4.363 6.668 -6.104 119 HD22 LEU 20 1HD2 LEU 20 3.346 5.247 -6.344 120 HD23 LEU 20 2HD2 LEU 20 3.035 6.719 -7.266 121 H LYS 21 H LYS 21 7.027 9.434 -7.676 122 HA LYS 21 HA LYS 21 6.063 10.044 -5.206 123 HB2 LYS 21 1HB LYS 21 8.292 10.697 -6.205 124 HB3 LYS 21 2HB LYS 21 7.464 12.076 -6.945 125 HG2 LYS 21 1HG LYS 21 6.677 12.443 -4.417 126 HG3 LYS 21 2HG LYS 21 8.211 11.603 -4.124 127 HD2 LYS 21 1HD LYS 21 8.305 13.752 -6.153 128 HD3 LYS 21 2HD LYS 21 7.996 14.273 -4.487 129 HE2 LYS 21 1HE LYS 21 10.000 12.774 -3.853 130 HE3 LYS 21 2HE LYS 21 10.370 12.800 -5.583 131 HZ1 LYS 21 3HZ LYS 21 10.246 15.313 -5.365 132 HZ2 LYS 21 1HZ LYS 21 11.592 14.550 -4.681 133 HZ3 LYS 21 2HZ LYS 21 10.323 15.071 -3.692 134 H GLU 22 H GLU 22 5.276 11.692 -8.238 135 HA GLU 22 HA GLU 22 3.625 13.671 -7.011 136 HB2 GLU 22 1HB GLU 22 3.364 12.816 -9.882 137 HB3 GLU 22 2HB GLU 22 3.157 14.427 -9.177 138 HG2 GLU 22 1HG GLU 22 5.702 14.182 -8.602 139 HG3 GLU 22 2HG GLU 22 5.659 12.989 -9.908 140 H THR 23 H THR 23 3.038 10.557 -8.563 141 HA THR 23 HA THR 23 0.309 10.558 -8.830 142 HB THR 23 HB THR 23 2.196 8.341 -8.071 143 HG1 THR 23 1HG THR 23 0.603 8.679 -10.401 144 HG21 THR 23 3HG2 THR 23 -0.031 7.025 -8.897 145 HG22 THR 23 1HG2 THR 23 -0.745 8.345 -7.971 146 HG23 THR 23 2HG2 THR 23 0.414 7.258 -7.207 147 H LEU 24 H LEU 24 2.170 9.801 -5.901 148 HA LEU 24 HA LEU 24 -0.113 9.261 -4.293 149 HB2 LEU 24 1HB LEU 24 2.440 10.218 -3.082 150 HB3 LEU 24 2HB LEU 24 1.351 8.920 -2.563 151 HG LEU 24 HG LEU 24 3.391 8.816 -4.779 152 HD11 LEU 24 1HD1 LEU 24 4.043 8.563 -2.316 153 HD12 LEU 24 2HD1 LEU 24 4.560 7.306 -3.439 154 HD13 LEU 24 3HD1 LEU 24 3.176 7.028 -2.382 155 HD21 LEU 24 3HD2 LEU 24 2.603 6.339 -4.771 156 HD22 LEU 24 1HD2 LEU 24 1.691 7.541 -5.686 157 HD23 LEU 24 2HD2 LEU 24 1.108 7.005 -4.110 158 H ARG 25 H ARG 25 2.048 12.077 -4.552 159 HA ARG 25 HA ARG 25 0.927 13.721 -2.656 160 HB2 ARG 25 1HB ARG 25 2.946 14.328 -3.847 161 HB3 ARG 25 2HB ARG 25 2.043 14.472 -5.362 162 HG2 ARG 25 1HG ARG 25 0.684 16.194 -3.715 163 HG3 ARG 25 2HG ARG 25 2.364 16.388 -3.191 164 HD2 ARG 25 1HD ARG 25 1.748 16.378 -6.120 165 HD3 ARG 25 2HD ARG 25 1.398 17.825 -5.163 166 HE ARG 25 HE ARG 25 4.003 17.056 -4.567 167 HH11 ARG 25 2HH1 ARG 25 2.179 18.183 -7.309 168 HH12 ARG 25 1HH1 ARG 25 3.537 18.954 -8.061 169 HH21 ARG 25 1HH2 ARG 25 5.595 18.887 -7.057 170 HH22 ARG 25 2HH2 ARG 25 5.798 18.067 -5.545 171 H LYS 26 H LYS 26 -0.274 12.936 -5.848 172 HA LYS 26 HA LYS 26 -2.373 14.928 -5.732 173 HB2 LYS 26 1HB LYS 26 -2.329 12.693 -7.729 174 HB3 LYS 26 2HB LYS 26 -2.858 14.371 -7.931 175 HG2 LYS 26 1HG LYS 26 -0.102 14.452 -7.307 176 HG3 LYS 26 2HG LYS 26 -0.332 13.203 -8.544 177 HD2 LYS 26 1HD LYS 26 -1.844 15.028 -9.682 178 HD3 LYS 26 2HD LYS 26 -0.884 16.134 -8.684 179 HE2 LYS 26 1HE LYS 26 0.904 15.945 -10.016 180 HE3 LYS 26 2HE LYS 26 0.789 14.179 -10.011 181 HZ1 LYS 26 3HZ LYS 26 -1.251 14.799 -11.604 182 HZ2 LYS 26 1HZ LYS 26 0.314 14.494 -12.170 183 HZ3 LYS 26 2HZ LYS 26 -0.211 16.088 -11.952 184 H PHE 27 H PHE 27 -1.963 11.513 -5.133 185 HA PHE 27 HA PHE 27 -4.671 10.748 -5.144 186 HB2 PHE 27 1HB PHE 27 -2.569 9.266 -5.105 187 HB3 PHE 27 2HB PHE 27 -2.578 9.520 -3.358 188 HD1 PHE 27 1HD PHE 27 -5.376 8.938 -5.747 189 HD2 PHE 27 2HD PHE 27 -3.213 7.547 -2.355 190 HE1 PHE 27 1HE PHE 27 -6.996 7.107 -5.469 191 HE2 PHE 27 2HE PHE 27 -4.829 5.712 -2.074 192 HZ PHE 27 HZ PHE 27 -6.723 5.490 -3.632 193 H ARG 28 H ARG 28 -2.571 11.947 -2.557 194 HA ARG 28 HA ARG 28 -4.494 11.686 -0.488 195 HB2 ARG 28 1HB ARG 28 -2.356 13.771 -0.355 196 HB3 ARG 28 2HB ARG 28 -2.926 12.658 0.897 197 HG2 ARG 28 1HG ARG 28 -1.874 10.869 -0.794 198 HG3 ARG 28 2HG ARG 28 -0.864 12.273 -1.179 199 HD2 ARG 28 1HD ARG 28 -1.278 11.034 1.550 200 HD3 ARG 28 2HD ARG 28 0.189 10.974 0.563 201 HE ARG 28 HE ARG 28 0.610 13.224 1.076 202 HH11 ARG 28 2HH1 ARG 28 -2.308 12.049 2.568 203 HH12 ARG 28 1HH1 ARG 28 -2.412 13.359 3.697 204 HH21 ARG 28 1HH2 ARG 28 -0.825 15.011 3.689 205 HH22 ARG 28 2HH2 ARG 28 0.483 14.954 2.557 206 H PHE 29 H PHE 29 -3.939 14.050 -2.945 207 HA PHE 29 HA PHE 29 -6.085 15.704 -1.795 208 HB2 PHE 29 1HB PHE 29 -4.063 17.039 -3.517 209 HB3 PHE 29 2HB PHE 29 -4.947 17.662 -2.123 210 HD1 PHE 29 2HD PHE 29 -4.325 15.996 0.071 211 HD2 PHE 29 1HD PHE 29 -1.796 17.176 -3.143 212 HE1 PHE 29 2HE PHE 29 -2.354 15.660 1.504 213 HE2 PHE 29 1HE PHE 29 0.180 16.841 -1.715 214 HZ PHE 29 HZ PHE 29 -0.098 16.083 0.612 215 H ARG 30 H ARG 30 -6.350 13.571 -3.675 216 HA ARG 30 HA ARG 30 -6.508 14.541 -6.335 217 HB2 ARG 30 1HB ARG 30 -7.861 12.513 -6.767 218 HB3 ARG 30 2HB ARG 30 -6.355 12.165 -5.906 219 HG2 ARG 30 1HG ARG 30 -7.991 12.458 -3.799 220 HG3 ARG 30 2HG ARG 30 -9.151 11.889 -5.012 221 HD2 ARG 30 1HD ARG 30 -6.623 10.392 -4.988 222 HD3 ARG 30 2HD ARG 30 -7.550 10.283 -3.484 223 HE ARG 30 HE ARG 30 -8.265 9.175 -6.050 224 HH11 ARG 30 2HH1 ARG 30 -9.397 10.168 -2.911 225 HH12 ARG 30 1HH1 ARG 30 -10.804 9.157 -2.954 226 HH21 ARG 30 1HH2 ARG 30 -11.210 7.833 -4.780 227 HH22 ARG 30 2HH2 ARG 30 -10.114 7.840 -6.119 228 H LYS 31 H LYS 31 -8.589 14.622 -7.574 229 HA LYS 31 HA LYS 31 -10.465 16.329 -6.134 230 HB2 LYS 31 1HB LYS 31 -9.932 15.766 -9.042 231 HB3 LYS 31 2HB LYS 31 -11.417 16.584 -8.530 232 HG2 LYS 31 1HG LYS 31 -9.164 17.827 -7.264 233 HG3 LYS 31 2HG LYS 31 -8.900 17.726 -9.015 234 HD2 LYS 31 1HD LYS 31 -11.574 18.629 -8.047 235 HD3 LYS 31 2HD LYS 31 -10.208 19.752 -7.924 236 HE2 LYS 31 1HE LYS 31 -9.816 18.960 -10.439 237 HE3 LYS 31 2HE LYS 31 -11.556 18.653 -10.332 238 HZ1 LYS 31 3HZ LYS 31 -10.697 21.223 -9.308 239 HZ2 LYS 31 1HZ LYS 31 -12.028 20.832 -10.276 240 HZ3 LYS 31 2HZ LYS 31 -10.499 21.016 -10.975 241 H GLU 32 H GLU 32 -10.302 13.293 -5.964 242 HA GLU 32 HA GLU 32 -12.998 12.616 -6.904 243 HB2 GLU 32 1HB GLU 32 -10.779 10.833 -5.869 244 HB3 GLU 32 2HB GLU 32 -12.350 10.276 -6.463 245 HG2 GLU 32 1HG GLU 32 -11.232 9.981 -8.386 246 HG3 GLU 32 2HG GLU 32 -11.551 11.710 -8.585 247 H THR 33 H THR 33 -14.225 11.098 -5.404 248 HA THR 33 HA THR 33 -13.799 11.715 -2.575 249 HB THR 33 HB THR 33 -16.268 12.152 -2.319 250 HG1 THR 33 1HG THR 33 -17.087 13.046 -4.487 251 HG21 THR 33 3HG2 THR 33 -16.099 14.502 -3.333 252 HG22 THR 33 1HG2 THR 33 -14.482 14.024 -3.850 253 HG23 THR 33 2HG2 THR 33 -14.889 14.045 -2.134 254 H ASN 34 H ASN 34 -13.367 9.303 -4.035 255 HA ASN 34 HA ASN 34 -15.250 7.567 -2.609 256 HB2 ASN 34 1HB ASN 34 -15.341 6.034 -4.566 257 HB3 ASN 34 2HB ASN 34 -16.088 7.605 -4.880 258 HD21 ASN 34 2HD2 ASN 34 -12.791 6.427 -6.929 259 HD22 ASN 34 1HD2 ASN 34 -13.371 5.548 -5.560 260 H ASN 35 H ASN 35 -14.416 5.207 -2.743 261 HA ASN 35 HA ASN 35 -11.778 5.197 -1.652 262 HB2 ASN 35 1HB ASN 35 -13.766 3.016 -2.300 263 HB3 ASN 35 2HB ASN 35 -12.161 2.666 -1.648 264 HD21 ASN 35 2HD2 ASN 35 -14.294 2.749 1.267 265 HD22 ASN 35 1HD2 ASN 35 -13.977 1.749 -0.105 266 H ALA 36 H ALA 36 -9.883 4.507 -2.523 267 HA ALA 36 HA ALA 36 -9.850 3.259 -5.150 268 HB1 ALA 36 3HB ALA 36 -9.310 5.066 -6.315 269 HB2 ALA 36 1HB ALA 36 -9.487 6.050 -4.861 270 HB3 ALA 36 2HB ALA 36 -7.920 5.347 -5.266 271 H ALA 37 H ALA 37 -7.726 2.454 -5.746 272 HA ALA 37 HA ALA 37 -5.835 2.263 -3.504 273 HB1 ALA 37 3HB ALA 37 -6.566 -0.108 -5.205 274 HB2 ALA 37 1HB ALA 37 -5.601 -0.082 -3.729 275 HB3 ALA 37 2HB ALA 37 -7.334 0.240 -3.656 276 H ILE 38 H ILE 38 -3.677 2.091 -4.063 277 HA ILE 38 HA ILE 38 -3.058 2.258 -6.938 278 HB ILE 38 HB ILE 38 -1.669 3.820 -4.758 279 HG12 ILE 38 1HG1 ILE 38 -3.760 4.583 -6.795 280 HG13 ILE 38 2HG1 ILE 38 -3.791 4.837 -5.041 281 HG21 ILE 38 1HG2 ILE 38 -1.343 4.469 -7.626 282 HG22 ILE 38 2HG2 ILE 38 -0.185 4.565 -6.301 283 HG23 ILE 38 3HG2 ILE 38 -0.550 3.007 -7.040 284 HD11 ILE 38 3HD1 ILE 38 -3.343 6.950 -5.811 285 HD12 ILE 38 1HD1 ILE 38 -1.722 6.340 -5.480 286 HD13 ILE 38 2HD1 ILE 38 -2.332 6.371 -7.135 287 H ILE 39 H ILE 39 -2.099 0.375 -7.387 288 HA ILE 39 HA ILE 39 -0.342 -0.893 -5.448 289 HB ILE 39 HB ILE 39 -1.227 -1.792 -8.192 290 HG12 ILE 39 1HG1 ILE 39 -1.965 -3.306 -5.766 291 HG13 ILE 39 2HG1 ILE 39 -2.707 -1.703 -5.909 292 HG21 ILE 39 1HG2 ILE 39 0.533 -3.158 -8.112 293 HG22 ILE 39 2HG2 ILE 39 0.869 -2.755 -6.429 294 HG23 ILE 39 3HG2 ILE 39 -0.316 -4.003 -6.817 295 HD11 ILE 39 3HD1 ILE 39 -3.090 -4.115 -7.593 296 HD12 ILE 39 1HD1 ILE 39 -4.275 -2.966 -6.973 297 HD13 ILE 39 2HD1 ILE 39 -3.253 -2.528 -8.343 298 H MET 40 H MET 40 1.773 -0.560 -5.405 299 HA MET 40 HA MET 40 3.099 0.375 -7.864 300 HB2 MET 40 1HB MET 40 4.098 0.893 -5.066 301 HB3 MET 40 2HB MET 40 4.575 1.698 -6.569 302 HG2 MET 40 1HG MET 40 2.718 3.043 -6.623 303 HG3 MET 40 2HG MET 40 1.744 1.899 -5.695 304 HE1 MET 40 3HE MET 40 0.782 3.387 -3.558 305 HE2 MET 40 1HE MET 40 1.449 1.761 -3.398 306 HE3 MET 40 2HE MET 40 1.872 3.006 -2.223 307 H LYS 41 H LYS 41 5.287 -0.323 -8.208 308 HA LYS 41 HA LYS 41 6.081 -2.712 -6.695 309 HB2 LYS 41 1HB LYS 41 6.474 -4.002 -8.619 310 HB3 LYS 41 2HB LYS 41 4.899 -3.245 -8.902 311 HG2 LYS 41 1HG LYS 41 5.829 -1.650 -10.406 312 HG3 LYS 41 2HG LYS 41 7.479 -2.138 -9.980 313 HD2 LYS 41 1HD LYS 41 7.445 -3.605 -11.655 314 HD3 LYS 41 2HD LYS 41 6.158 -4.480 -10.805 315 HE2 LYS 41 1HE LYS 41 4.537 -2.802 -11.866 316 HE3 LYS 41 2HE LYS 41 5.891 -2.357 -12.916 317 HZ1 LYS 41 3HZ LYS 41 5.975 -4.948 -13.260 318 HZ2 LYS 41 1HZ LYS 41 4.935 -3.973 -14.170 319 HZ3 LYS 41 2HZ LYS 41 4.339 -4.835 -12.842 320 H VAL 42 H VAL 42 8.387 -3.401 -7.574 321 HA VAL 42 HA VAL 42 10.015 -0.965 -7.884 322 HB VAL 42 HB VAL 42 10.509 -1.408 -5.687 323 HG11 VAL 42 1HG1 VAL 42 9.352 -3.199 -4.947 324 HG12 VAL 42 2HG1 VAL 42 9.718 -4.165 -6.378 325 HG13 VAL 42 3HG1 VAL 42 10.917 -3.999 -5.095 326 HG21 VAL 42 3HG2 VAL 42 12.556 -1.564 -7.112 327 HG22 VAL 42 1HG2 VAL 42 12.687 -2.388 -5.558 328 HG23 VAL 42 2HG2 VAL 42 12.414 -3.320 -7.030 329 H ASP 43 H ASP 43 11.155 -1.039 -9.693 330 HA ASP 43 HA ASP 43 11.516 -3.490 -11.146 331 HB2 ASP 43 1HB ASP 43 12.204 -0.606 -11.615 332 HB3 ASP 43 2HB ASP 43 12.952 -1.857 -12.618 333 H LYS 44 H LYS 44 13.148 -4.864 -10.957 334 HA LYS 44 HA LYS 44 15.316 -4.386 -9.176 335 HB2 LYS 44 1HB LYS 44 14.236 -6.623 -9.711 336 HB3 LYS 44 2HB LYS 44 15.148 -6.592 -11.228 337 HG2 LYS 44 1HG LYS 44 16.844 -6.073 -8.924 338 HG3 LYS 44 2HG LYS 44 16.007 -7.632 -8.822 339 HD2 LYS 44 1HD LYS 44 16.795 -7.738 -11.390 340 HD3 LYS 44 2HD LYS 44 18.077 -6.709 -10.727 341 HE2 LYS 44 1HE LYS 44 17.393 -9.109 -9.130 342 HE3 LYS 44 2HE LYS 44 18.155 -9.403 -10.700 343 HZ1 LYS 44 3HZ LYS 44 19.292 -8.319 -8.291 344 HZ2 LYS 44 1HZ LYS 44 19.668 -7.414 -9.670 345 HZ3 LYS 44 2HZ LYS 44 20.054 -9.060 -9.608 346 H ASP 45 H ASP 45 14.795 -3.620 -12.435 347 HA ASP 45 HA ASP 45 17.575 -3.684 -13.226 348 HB2 ASP 45 1HB ASP 45 15.149 -3.698 -14.589 349 HB3 ASP 45 2HB ASP 45 15.820 -2.095 -14.921 350 H ARG 46 H ARG 46 15.165 -1.235 -12.375 351 HA ARG 46 HA ARG 46 17.256 0.822 -12.448 352 HB2 ARG 46 1HB ARG 46 14.255 1.116 -12.192 353 HB3 ARG 46 2HB ARG 46 15.418 2.441 -12.345 354 HG2 ARG 46 1HG ARG 46 15.947 1.872 -14.577 355 HG3 ARG 46 2HG ARG 46 15.119 0.313 -14.441 356 HD2 ARG 46 1HD ARG 46 13.358 1.334 -15.378 357 HD3 ARG 46 2HD ARG 46 13.135 2.094 -13.797 358 HE ARG 46 HE ARG 46 14.944 3.676 -15.156 359 HH11 ARG 46 2HH1 ARG 46 11.655 2.617 -15.580 360 HH12 ARG 46 1HH1 ARG 46 11.170 4.039 -16.442 361 HH21 ARG 46 1HH2 ARG 46 12.686 5.709 -16.845 362 HH22 ARG 46 2HH2 ARG 46 14.318 5.554 -16.290 363 H GLN 47 H GLN 47 16.148 -1.315 -10.303 364 HA GLN 47 HA GLN 47 15.806 -1.378 -8.029 365 HB2 GLN 47 1HB GLN 47 18.139 0.548 -8.136 366 HB3 GLN 47 2HB GLN 47 17.705 -0.514 -6.787 367 HG2 GLN 47 1HG GLN 47 18.044 -2.028 -9.225 368 HG3 GLN 47 2HG GLN 47 19.479 -1.064 -8.854 369 HE21 GLN 47 2HE2 GLN 47 18.500 -4.289 -6.618 370 HE22 GLN 47 1HE2 GLN 47 17.477 -3.699 -7.877 371 H MET 48 H MET 48 14.044 0.446 -9.175 372 HA MET 48 HA MET 48 13.790 2.376 -6.982 373 HB2 MET 48 1HB MET 48 13.668 4.211 -8.294 374 HB3 MET 48 2HB MET 48 14.620 3.219 -9.409 375 HG2 MET 48 1HG MET 48 12.186 2.446 -10.182 376 HG3 MET 48 2HG MET 48 11.785 4.048 -9.559 377 HE1 MET 48 3HE MET 48 12.586 6.443 -11.011 378 HE2 MET 48 1HE MET 48 13.831 5.850 -9.911 379 HE3 MET 48 2HE MET 48 14.256 6.306 -11.561 380 H VAL 49 H VAL 49 11.662 2.935 -6.433 381 HA VAL 49 HA VAL 49 9.713 0.905 -7.061 382 HB VAL 49 HB VAL 49 9.233 3.388 -5.423 383 HG11 VAL 49 1HG1 VAL 49 7.707 1.718 -4.223 384 HG12 VAL 49 2HG1 VAL 49 7.200 2.292 -5.812 385 HG13 VAL 49 3HG1 VAL 49 7.928 0.693 -5.641 386 HG21 VAL 49 3HG2 VAL 49 10.344 0.757 -4.450 387 HG22 VAL 49 1HG2 VAL 49 11.272 2.246 -4.635 388 HG23 VAL 49 2HG2 VAL 49 9.956 2.166 -3.462 389 H VAL 50 H VAL 50 8.457 0.999 -8.794 390 HA VAL 50 HA VAL 50 7.537 3.641 -9.725 391 HB VAL 50 HB VAL 50 7.474 2.737 -12.015 392 HG11 VAL 50 1HG1 VAL 50 9.392 4.006 -11.534 393 HG12 VAL 50 2HG1 VAL 50 10.096 2.723 -10.549 394 HG13 VAL 50 3HG1 VAL 50 9.998 2.538 -12.300 395 HG21 VAL 50 3HG2 VAL 50 8.384 0.625 -12.592 396 HG22 VAL 50 1HG2 VAL 50 9.008 0.372 -10.962 397 HG23 VAL 50 2HG2 VAL 50 7.269 0.338 -11.255 398 H LEU 51 H LEU 51 5.410 3.828 -10.374 399 HA LEU 51 HA LEU 51 3.466 2.382 -9.085 400 HB2 LEU 51 1HB LEU 51 3.353 4.602 -10.438 401 HB3 LEU 51 2HB LEU 51 2.923 3.540 -11.789 402 HG LEU 51 HG LEU 51 1.350 3.239 -9.295 403 HD11 LEU 51 1HD1 LEU 51 0.014 5.142 -9.632 404 HD12 LEU 51 2HD1 LEU 51 0.766 5.500 -11.185 405 HD13 LEU 51 3HD1 LEU 51 1.678 5.725 -9.693 406 HD21 LEU 51 3HD2 LEU 51 -0.175 3.515 -11.676 407 HD22 LEU 51 1HD2 LEU 51 0.092 2.072 -10.697 408 HD23 LEU 51 2HD2 LEU 51 1.197 2.459 -12.017 409 H GLU 52 H GLU 52 2.120 0.672 -9.582 410 HA GLU 52 HA GLU 52 3.001 -1.003 -11.839 411 HB2 GLU 52 1HB GLU 52 3.467 -2.045 -9.699 412 HB3 GLU 52 2HB GLU 52 1.787 -1.810 -9.193 413 HG2 GLU 52 1HG GLU 52 0.991 -3.519 -10.482 414 HG3 GLU 52 2HG GLU 52 2.295 -3.365 -11.669 415 H ASP 53 H ASP 53 0.188 0.077 -9.988 416 HA ASP 53 HA ASP 53 -1.448 0.153 -12.324 417 HB2 ASP 53 1HB ASP 53 -1.777 -2.103 -10.357 418 HB3 ASP 53 2HB ASP 53 -3.168 -1.478 -11.256 419 H GLU 54 H GLU 54 -3.703 0.832 -11.796 420 HA GLU 54 HA GLU 54 -4.076 1.952 -9.138 421 HB2 GLU 54 1HB GLU 54 -3.406 3.535 -11.528 422 HB3 GLU 54 2HB GLU 54 -4.828 4.107 -10.642 423 HG2 GLU 54 1HG GLU 54 -3.222 3.827 -8.562 424 HG3 GLU 54 2HG GLU 54 -1.981 4.022 -9.807 425 H LEU 55 H LEU 55 -6.020 1.232 -8.591 426 HA LEU 55 HA LEU 55 -8.163 1.305 -10.615 427 HB2 LEU 55 1HB LEU 55 -8.056 -0.583 -8.266 428 HB3 LEU 55 2HB LEU 55 -9.134 -0.639 -9.671 429 HG LEU 55 HG LEU 55 -6.217 -0.915 -10.165 430 HD11 LEU 55 1HD1 LEU 55 -7.890 -3.200 -9.141 431 HD12 LEU 55 2HD1 LEU 55 -6.691 -2.338 -8.177 432 HD13 LEU 55 3HD1 LEU 55 -6.189 -3.239 -9.607 433 HD21 LEU 55 3HD2 LEU 55 -6.959 -1.561 -12.153 434 HD22 LEU 55 1HD2 LEU 55 -8.600 -1.197 -11.619 435 HD23 LEU 55 2HD2 LEU 55 -7.949 -2.825 -11.422 436 H GLN 56 H GLN 56 -9.892 2.500 -10.143 437 HA GLN 56 HA GLN 56 -10.121 3.574 -7.418 438 HB2 GLN 56 1HB GLN 56 -11.306 4.618 -10.002 439 HB3 GLN 56 2HB GLN 56 -11.418 5.397 -8.415 440 HG2 GLN 56 1HG GLN 56 -9.737 6.539 -9.639 441 HG3 GLN 56 2HG GLN 56 -8.931 5.567 -8.402 442 HE21 GLN 56 2HE2 GLN 56 -6.913 3.943 -10.665 443 HE22 GLN 56 1HE2 GLN 56 -7.229 4.480 -9.054 444 H ASN 57 H ASN 57 -12.487 4.189 -6.869 445 HA ASN 57 HA ASN 57 -14.452 3.301 -6.104 446 HB2 ASN 57 1HB ASN 57 -14.744 2.539 -9.022 447 HB3 ASN 57 2HB ASN 57 -16.053 2.789 -7.860 448 HD21 ASN 57 2HD2 ASN 57 -14.173 5.966 -9.574 449 HD22 ASN 57 1HD2 ASN 57 -13.499 4.376 -9.652 450 H ILE 58 H ILE 58 -12.797 1.602 -5.191 451 HA ILE 58 HA ILE 58 -13.934 -1.025 -5.817 452 HB ILE 58 HB ILE 58 -12.033 -1.669 -6.794 453 HG12 ILE 58 1HG1 ILE 58 -11.870 -2.504 -4.357 454 HG13 ILE 58 2HG1 ILE 58 -10.421 -2.604 -5.372 455 HG21 ILE 58 1HG2 ILE 58 -10.991 0.911 -5.734 456 HG22 ILE 58 2HG2 ILE 58 -9.851 -0.278 -6.359 457 HG23 ILE 58 3HG2 ILE 58 -11.129 0.349 -7.400 458 HD11 ILE 58 3HD1 ILE 58 -10.524 -0.078 -3.996 459 HD12 ILE 58 1HD1 ILE 58 -10.621 -1.429 -2.866 460 HD13 ILE 58 2HD1 ILE 58 -9.268 -1.315 -3.993 461 H SER 59 H SER 59 -14.326 -2.277 -4.070 462 HA SER 59 HA SER 59 -14.081 -1.072 -1.474 463 HB2 SER 59 1HB SER 59 -15.604 -3.219 -2.688 464 HB3 SER 59 2HB SER 59 -14.907 -3.734 -1.142 465 HG SER 59 HG SER 59 -16.884 -1.887 -1.650 466 HA PRO 60 HA PRO 60 -10.529 -3.065 0.158 467 HB2 PRO 60 2HB PRO 60 -11.132 -2.332 2.251 468 HB3 PRO 60 1HB PRO 60 -11.343 -4.051 2.581 469 HG2 PRO 60 1HG PRO 60 -13.635 -3.985 2.209 470 HG3 PRO 60 2HG PRO 60 -13.354 -2.359 2.935 471 HD2 PRO 60 1HD PRO 60 -14.609 -2.702 0.554 472 HD3 PRO 60 2HD PRO 60 -13.580 -1.302 0.901 473 H GLU 61 H GLU 61 -13.209 -4.914 -0.698 474 HA GLU 61 HA GLU 61 -11.943 -7.464 -0.034 475 HB2 GLU 61 1HB GLU 61 -14.666 -6.548 -0.485 476 HB3 GLU 61 2HB GLU 61 -14.292 -7.997 -1.432 477 HG2 GLU 61 1HG GLU 61 -13.744 -9.248 0.509 478 HG3 GLU 61 2HG GLU 61 -13.772 -7.796 1.519 479 H GLU 62 H GLU 62 -12.661 -5.393 -2.738 480 HA GLU 62 HA GLU 62 -12.104 -7.373 -4.744 481 HB2 GLU 62 1HB GLU 62 -13.354 -4.903 -4.716 482 HB3 GLU 62 2HB GLU 62 -11.847 -4.594 -5.593 483 HG2 GLU 62 1HG GLU 62 -13.126 -7.041 -6.481 484 HG3 GLU 62 2HG GLU 62 -14.185 -5.632 -6.639 485 H LEU 63 H LEU 63 -10.382 -4.546 -3.448 486 HA LEU 63 HA LEU 63 -8.136 -4.496 -4.978 487 HB2 LEU 63 1HB LEU 63 -8.893 -3.263 -2.708 488 HB3 LEU 63 2HB LEU 63 -7.641 -4.342 -2.069 489 HG LEU 63 HG LEU 63 -7.389 -1.946 -3.787 490 HD11 LEU 63 1HD1 LEU 63 -6.697 -1.711 -1.551 491 HD12 LEU 63 2HD1 LEU 63 -5.212 -1.868 -2.491 492 HD13 LEU 63 3HD1 LEU 63 -5.825 -3.245 -1.574 493 HD21 LEU 63 3HD2 LEU 63 -6.507 -3.403 -5.384 494 HD22 LEU 63 1HD2 LEU 63 -5.772 -4.445 -4.166 495 HD23 LEU 63 2HD2 LEU 63 -5.093 -2.849 -4.488 496 H LYS 64 H LYS 64 -8.694 -6.620 -2.186 497 HA LYS 64 HA LYS 64 -6.214 -7.912 -2.199 498 HB2 LYS 64 1HB LYS 64 -7.168 -8.681 -0.334 499 HB3 LYS 64 2HB LYS 64 -8.783 -8.260 -0.922 500 HG2 LYS 64 1HG LYS 64 -9.134 -10.352 -1.881 501 HG3 LYS 64 2HG LYS 64 -7.402 -10.733 -1.887 502 HD2 LYS 64 1HD LYS 64 -7.552 -11.697 0.114 503 HD3 LYS 64 2HD LYS 64 -8.254 -10.222 0.801 504 HE2 LYS 64 1HE LYS 64 -9.920 -11.795 1.190 505 HE3 LYS 64 2HE LYS 64 -10.448 -11.022 -0.310 506 HZ1 LYS 64 3HZ LYS 64 -8.764 -13.426 -0.461 507 HZ2 LYS 64 1HZ LYS 64 -9.919 -12.854 -1.557 508 HZ3 LYS 64 2HZ LYS 64 -10.413 -13.595 -0.119 509 H LEU 65 H LEU 65 -9.141 -8.501 -4.049 510 HA LEU 65 HA LEU 65 -8.288 -10.997 -5.139 511 HB2 LEU 65 1HB LEU 65 -10.499 -9.062 -5.665 512 HB3 LEU 65 2HB LEU 65 -10.114 -10.269 -6.904 513 HG LEU 65 HG LEU 65 -11.864 -11.211 -5.670 514 HD11 LEU 65 1HD1 LEU 65 -10.970 -13.210 -5.017 515 HD12 LEU 65 2HD1 LEU 65 -9.628 -12.458 -4.154 516 HD13 LEU 65 3HD1 LEU 65 -9.607 -12.542 -5.915 517 HD21 LEU 65 3HD2 LEU 65 -11.465 -11.425 -3.075 518 HD22 LEU 65 1HD2 LEU 65 -12.192 -9.978 -3.773 519 HD23 LEU 65 2HD2 LEU 65 -10.483 -9.983 -3.337 520 H GLU 66 H GLU 66 -7.810 -7.660 -5.977 521 HA GLU 66 HA GLU 66 -6.954 -8.172 -8.672 522 HB2 GLU 66 1HB GLU 66 -6.528 -5.714 -6.958 523 HB3 GLU 66 2HB GLU 66 -6.337 -5.816 -8.715 524 HG2 GLU 66 1HG GLU 66 -8.526 -5.590 -9.106 525 HG3 GLU 66 2HG GLU 66 -8.966 -6.659 -7.767 526 H LEU 67 H LEU 67 -5.513 -8.313 -5.575 527 HA LEU 67 HA LEU 67 -2.806 -7.893 -6.474 528 HB2 LEU 67 1HB LEU 67 -3.938 -8.926 -3.870 529 HB3 LEU 67 2HB LEU 67 -2.216 -8.642 -4.174 530 HG LEU 67 HG LEU 67 -4.411 -6.586 -4.013 531 HD11 LEU 67 1HD1 LEU 67 -2.205 -7.491 -2.261 532 HD12 LEU 67 2HD1 LEU 67 -3.804 -6.870 -1.849 533 HD13 LEU 67 3HD1 LEU 67 -2.522 -5.757 -2.328 534 HD21 LEU 67 3HD2 LEU 67 -2.398 -5.002 -4.306 535 HD22 LEU 67 1HD2 LEU 67 -3.106 -5.743 -5.741 536 HD23 LEU 67 2HD2 LEU 67 -1.612 -6.389 -5.062 537 HA PRO 68 HA PRO 68 -1.779 -11.986 -7.683 538 HB2 PRO 68 2HB PRO 68 0.281 -11.165 -8.281 539 HB3 PRO 68 1HB PRO 68 0.846 -12.125 -6.915 540 HG2 PRO 68 1HG PRO 68 0.861 -10.309 -5.466 541 HG3 PRO 68 2HG PRO 68 1.331 -9.519 -7.018 542 HD2 PRO 68 1HD PRO 68 -0.747 -8.652 -5.501 543 HD3 PRO 68 2HD PRO 68 -0.750 -8.559 -7.271 544 H GLU 69 H GLU 69 -0.169 -13.848 -6.634 545 HA GLU 69 HA GLU 69 -1.306 -14.357 -3.962 546 HB2 GLU 69 1HB GLU 69 -1.167 -16.760 -4.492 547 HB3 GLU 69 2HB GLU 69 -2.215 -15.884 -5.619 548 HG2 GLU 69 1HG GLU 69 0.645 -16.268 -6.357 549 HG3 GLU 69 2HG GLU 69 -0.459 -17.647 -6.463 550 H ARG 70 H ARG 70 1.545 -14.479 -5.984 551 HA ARG 70 HA ARG 70 3.176 -14.831 -3.571 552 HB2 ARG 70 1HB ARG 70 3.918 -16.166 -6.169 553 HB3 ARG 70 2HB ARG 70 4.570 -16.462 -4.550 554 HG2 ARG 70 1HG ARG 70 1.690 -16.963 -4.784 555 HG3 ARG 70 2HG ARG 70 2.708 -18.007 -5.788 556 HD2 ARG 70 1HD ARG 70 4.085 -18.039 -3.432 557 HD3 ARG 70 2HD ARG 70 2.413 -17.903 -2.869 558 HE ARG 70 HE ARG 70 3.642 -20.194 -4.043 559 HH11 ARG 70 2HH1 ARG 70 0.619 -18.503 -3.686 560 HH12 ARG 70 1HH1 ARG 70 -0.351 -19.922 -3.905 561 HH21 ARG 70 1HH2 ARG 70 0.650 -21.951 -4.273 562 HH22 ARG 70 2HH2 ARG 70 2.375 -22.069 -4.334 563 H GLN 71 H GLN 71 2.665 -12.388 -4.644 564 HA GLN 71 HA GLN 71 5.299 -11.638 -5.669 565 HB2 GLN 71 1HB GLN 71 2.662 -11.107 -6.998 566 HB3 GLN 71 2HB GLN 71 3.985 -9.945 -7.169 567 HG2 GLN 71 1HG GLN 71 4.920 -11.162 -8.758 568 HG3 GLN 71 2HG GLN 71 4.995 -12.558 -7.675 569 HE21 GLN 71 2HE2 GLN 71 2.288 -12.389 -10.650 570 HE22 GLN 71 1HE2 GLN 71 3.427 -11.126 -10.345 571 HA PRO 72 HA PRO 72 4.333 -8.869 -2.222 572 HB2 PRO 72 2HB PRO 72 6.208 -9.681 -1.170 573 HB3 PRO 72 1HB PRO 72 6.945 -8.190 -1.755 574 HG2 PRO 72 1HG PRO 72 7.891 -9.220 -3.611 575 HG3 PRO 72 2HG PRO 72 7.989 -10.544 -2.390 576 HD2 PRO 72 1HD PRO 72 6.820 -10.873 -4.818 577 HD3 PRO 72 2HD PRO 72 6.247 -11.701 -3.360 578 H ARG 73 H ARG 73 3.671 -6.848 -2.547 579 HA ARG 73 HA ARG 73 5.345 -4.954 -3.968 580 HB2 ARG 73 1HB ARG 73 3.938 -4.455 -5.724 581 HB3 ARG 73 2HB ARG 73 3.710 -6.205 -5.590 582 HG2 ARG 73 1HG ARG 73 1.803 -5.155 -3.869 583 HG3 ARG 73 2HG ARG 73 1.793 -4.066 -5.267 584 HD2 ARG 73 1HD ARG 73 0.278 -5.667 -5.951 585 HD3 ARG 73 2HD ARG 73 1.785 -6.288 -6.640 586 HE ARG 73 HE ARG 73 1.486 -8.139 -5.360 587 HH11 ARG 73 2HH1 ARG 73 -0.055 -5.458 -3.763 588 HH12 ARG 73 1HH1 ARG 73 -0.644 -6.413 -2.443 589 HH21 ARG 73 1HH2 ARG 73 -0.204 -8.659 -2.367 590 HH22 ARG 73 2HH2 ARG 73 0.717 -9.408 -3.628 591 H PHE 74 H PHE 74 3.962 -2.771 -4.112 592 HA PHE 74 HA PHE 74 2.976 -2.330 -1.381 593 HB2 PHE 74 1HB PHE 74 4.003 -0.348 -3.433 594 HB3 PHE 74 2HB PHE 74 3.469 0.058 -1.800 595 HD1 PHE 74 2HD PHE 74 4.646 -2.043 -0.167 596 HD2 PHE 74 1HD PHE 74 6.282 0.079 -3.473 597 HE1 PHE 74 2HE PHE 74 6.912 -2.446 0.700 598 HE2 PHE 74 1HE PHE 74 8.552 -0.321 -2.611 599 HZ PHE 74 HZ PHE 74 8.869 -1.584 -0.522 600 H VAL 75 H VAL 75 1.093 -1.110 -1.005 601 HA VAL 75 HA VAL 75 -0.589 -0.381 -3.256 602 HB VAL 75 HB VAL 75 -1.690 -2.306 -1.214 603 HG11 VAL 75 1HG1 VAL 75 -3.425 -2.585 -3.032 604 HG12 VAL 75 2HG1 VAL 75 -3.411 -1.025 -2.208 605 HG13 VAL 75 3HG1 VAL 75 -2.699 -1.181 -3.815 606 HG21 VAL 75 3HG2 VAL 75 -1.462 -4.086 -2.802 607 HG22 VAL 75 1HG2 VAL 75 -0.814 -2.985 -4.017 608 HG23 VAL 75 2HG2 VAL 75 0.125 -3.353 -2.569 609 H VAL 76 H VAL 76 -1.678 1.420 -2.799 610 HA VAL 76 HA VAL 76 -1.960 2.190 0.033 611 HB VAL 76 HB VAL 76 -1.676 3.925 -2.422 612 HG11 VAL 76 1HG1 VAL 76 -2.143 4.778 0.434 613 HG12 VAL 76 2HG1 VAL 76 -1.862 5.845 -0.944 614 HG13 VAL 76 3HG1 VAL 76 -3.329 4.868 -0.869 615 HG21 VAL 76 3HG2 VAL 76 0.079 4.207 -0.060 616 HG22 VAL 76 1HG2 VAL 76 0.292 2.753 -1.035 617 HG23 VAL 76 2HG2 VAL 76 0.456 4.344 -1.777 618 H TYR 77 H TYR 77 -3.975 1.384 0.478 619 HA TYR 77 HA TYR 77 -6.195 1.953 -1.307 620 HB2 TYR 77 1HB TYR 77 -5.961 -0.252 -0.158 621 HB3 TYR 77 2HB TYR 77 -6.218 0.570 1.383 622 HD1 TYR 77 2HD TYR 77 -7.953 0.971 -1.898 623 HD2 TYR 77 1HD TYR 77 -8.278 -0.102 2.206 624 HE1 TYR 77 2HE TYR 77 -10.388 0.740 -2.158 625 HE2 TYR 77 1HE TYR 77 -10.714 -0.337 1.958 626 HH TYR 77 HH TYR 77 -12.337 0.471 -1.078 627 H SER 78 H SER 78 -7.776 3.424 -0.969 628 HA SER 78 HA SER 78 -7.506 5.142 1.410 629 HB2 SER 78 1HB SER 78 -6.963 6.232 -0.781 630 HB3 SER 78 2HB SER 78 -8.634 5.925 -1.286 631 HG SER 78 HG SER 78 -9.306 7.508 -0.062 632 H TYR 79 H TYR 79 -8.971 4.192 2.763 633 HA TYR 79 HA TYR 79 -11.601 3.446 1.845 634 HB2 TYR 79 1HB TYR 79 -10.574 2.089 3.554 635 HB3 TYR 79 2HB TYR 79 -10.348 3.496 4.595 636 HD1 TYR 79 2HD TYR 79 -12.900 1.239 3.166 637 HD2 TYR 79 1HD TYR 79 -12.084 4.301 6.006 638 HE1 TYR 79 2HE TYR 79 -15.084 0.833 4.221 639 HE2 TYR 79 1HE TYR 79 -14.266 3.902 7.070 640 HH TYR 79 HH TYR 79 -16.282 2.889 6.815 641 H LYS 80 H LYS 80 -13.547 4.229 3.075 642 HA LYS 80 HA LYS 80 -13.334 7.125 3.576 643 HB2 LYS 80 1HB LYS 80 -14.506 6.797 1.508 644 HB3 LYS 80 2HB LYS 80 -15.545 5.562 2.238 645 HG2 LYS 80 1HG LYS 80 -16.487 7.308 3.740 646 HG3 LYS 80 2HG LYS 80 -15.542 8.511 2.844 647 HD2 LYS 80 1HD LYS 80 -17.356 8.695 1.534 648 HD3 LYS 80 2HD LYS 80 -16.801 7.170 0.822 649 HE2 LYS 80 1HE LYS 80 -18.463 7.008 3.289 650 HE3 LYS 80 2HE LYS 80 -19.263 7.479 1.784 651 HZ1 LYS 80 3HZ LYS 80 -18.730 4.929 2.584 652 HZ2 LYS 80 1HZ LYS 80 -17.533 5.231 1.427 653 HZ3 LYS 80 2HZ LYS 80 -19.165 5.407 1.021 654 H TYR 81 H TYR 81 -13.461 7.397 5.713 655 HA TYR 81 HA TYR 81 -15.347 5.751 7.248 656 HB2 TYR 81 1HB TYR 81 -12.731 6.322 7.757 657 HB3 TYR 81 2HB TYR 81 -13.538 7.577 8.699 658 HD1 TYR 81 2HD TYR 81 -15.745 6.551 9.990 659 HD2 TYR 81 1HD TYR 81 -12.184 4.447 8.994 660 HE1 TYR 81 2HE TYR 81 -16.192 4.948 11.801 661 HE2 TYR 81 1HE TYR 81 -12.622 2.837 10.801 662 HH TYR 81 HH TYR 81 -14.453 2.012 12.127 663 H VAL 82 H VAL 82 -17.094 6.603 8.212 664 HA VAL 82 HA VAL 82 -17.649 9.434 7.746 665 HB VAL 82 HB VAL 82 -19.544 7.337 8.804 666 HG11 VAL 82 1HG1 VAL 82 -19.909 10.107 7.687 667 HG12 VAL 82 2HG1 VAL 82 -21.235 8.954 7.850 668 HG13 VAL 82 3HG1 VAL 82 -20.364 9.506 9.281 669 HG21 VAL 82 3HG2 VAL 82 -18.430 7.585 6.191 670 HG22 VAL 82 1HG2 VAL 82 -19.643 6.444 6.774 671 HG23 VAL 82 2HG2 VAL 82 -20.142 8.005 6.122 672 H HIS 83 H HIS 83 -18.640 10.725 9.442 673 HA HIS 83 HA HIS 83 -17.419 10.154 12.040 674 HB2 HIS 83 1HB HIS 83 -18.518 12.671 10.786 675 HB3 HIS 83 2HB HIS 83 -18.077 12.582 12.494 676 HD1 HIS 83 1HD HIS 83 -15.796 13.379 12.967 677 HD2 HIS 83 2HD HIS 83 -16.103 11.791 9.140 678 HE1 HIS 83 1HE HIS 83 -13.521 13.669 11.934 679 HE2 HIS 83 2HE HIS 83 -13.708 12.700 9.595 680 H ASP 84 H ASP 84 -20.176 12.253 11.697 681 HA ASP 84 HA ASP 84 -22.215 10.456 12.400 682 HB2 ASP 84 1HB ASP 84 -20.552 10.756 14.523 683 HB3 ASP 84 2HB ASP 84 -21.686 12.081 14.814 684 H ASP 85 H ASP 85 -21.091 13.747 13.176 685 HA ASP 85 HA ASP 85 -23.631 14.950 13.139 686 HB2 ASP 85 1HB ASP 85 -20.834 15.832 13.212 687 HB3 ASP 85 2HB ASP 85 -21.907 16.963 12.379 688 H GLY 86 H GLY 86 -21.663 13.793 10.606 689 HA2 GLY 86 1HA GLY 86 -23.049 13.633 8.487 690 HA3 GLY 86 2HA GLY 86 -23.182 15.379 8.632 691 H ARG 87 H ARG 87 -20.183 14.193 9.664 692 HA ARG 87 HA ARG 87 -18.955 15.128 7.166 693 HB2 ARG 87 1HB ARG 87 -17.913 14.927 9.995 694 HB3 ARG 87 2HB ARG 87 -16.866 15.264 8.608 695 HG2 ARG 87 1HG ARG 87 -19.257 16.953 9.336 696 HG3 ARG 87 2HG ARG 87 -17.606 17.277 9.891 697 HD2 ARG 87 1HD ARG 87 -16.927 17.252 7.429 698 HD3 ARG 87 2HD ARG 87 -18.660 17.313 7.077 699 HE ARG 87 HE ARG 87 -18.229 19.379 8.822 700 HH11 ARG 87 2HH1 ARG 87 -16.960 18.432 5.722 701 HH12 ARG 87 1HH1 ARG 87 -16.642 20.057 5.211 702 HH21 ARG 87 1HH2 ARG 87 -17.127 21.813 6.599 703 HH22 ARG 87 2HH2 ARG 87 -17.814 21.522 8.161 704 H VAL 88 H VAL 88 -17.483 13.896 6.054 705 HA VAL 88 HA VAL 88 -16.798 11.249 7.091 706 HB VAL 88 HB VAL 88 -18.713 10.685 5.823 707 HG11 VAL 88 1HG1 VAL 88 -19.508 12.042 4.259 708 HG12 VAL 88 2HG1 VAL 88 -18.015 12.980 4.295 709 HG13 VAL 88 3HG1 VAL 88 -18.166 11.604 3.202 710 HG21 VAL 88 3HG2 VAL 88 -16.489 9.453 5.376 711 HG22 VAL 88 1HG2 VAL 88 -17.849 9.163 4.291 712 HG23 VAL 88 2HG2 VAL 88 -16.546 10.245 3.801 713 H SER 89 H SER 89 -14.688 10.953 6.876 714 HA SER 89 HA SER 89 -13.295 12.314 4.663 715 HB2 SER 89 1HB SER 89 -12.239 11.631 7.425 716 HB3 SER 89 2HB SER 89 -11.300 12.381 6.122 717 HG SER 89 HG SER 89 -12.138 14.231 6.632 718 H TYR 90 H TYR 90 -11.463 11.223 3.751 719 HA TYR 90 HA TYR 90 -11.746 8.302 3.881 720 HB2 TYR 90 1HB TYR 90 -10.151 9.645 1.741 721 HB3 TYR 90 2HB TYR 90 -11.136 8.183 1.659 722 HD1 TYR 90 2HD TYR 90 -13.734 8.568 1.999 723 HD2 TYR 90 1HD TYR 90 -10.991 11.564 0.733 724 HE1 TYR 90 2HE TYR 90 -15.590 9.839 1.004 725 HE2 TYR 90 1HE TYR 90 -12.840 12.844 -0.264 726 HH TYR 90 HH TYR 90 -15.076 13.032 -0.419 727 HA PRO 91 HA PRO 91 -7.806 8.797 6.109 728 HB2 PRO 91 2HB PRO 91 -8.809 7.871 7.957 729 HB3 PRO 91 1HB PRO 91 -8.007 6.398 7.415 730 HG2 PRO 91 1HG PRO 91 -9.903 5.594 6.339 731 HG3 PRO 91 2HG PRO 91 -10.639 6.450 7.745 732 HD2 PRO 91 1HD PRO 91 -11.365 6.951 5.178 733 HD3 PRO 91 2HD PRO 91 -11.345 8.206 6.430 734 H LEU 92 H LEU 92 -6.433 8.595 4.344 735 HA LEU 92 HA LEU 92 -6.155 6.182 2.854 736 HB2 LEU 92 1HB LEU 92 -4.966 8.852 2.890 737 HB3 LEU 92 2HB LEU 92 -3.811 7.573 2.478 738 HG LEU 92 HG LEU 92 -6.095 7.084 0.916 739 HD11 LEU 92 1HD1 LEU 92 -5.896 9.403 -0.334 740 HD12 LEU 92 2HD1 LEU 92 -5.539 9.975 1.294 741 HD13 LEU 92 3HD1 LEU 92 -7.060 9.147 0.965 742 HD21 LEU 92 3HD2 LEU 92 -4.309 8.204 -0.792 743 HD22 LEU 92 1HD2 LEU 92 -4.231 6.541 -0.212 744 HD23 LEU 92 2HD2 LEU 92 -3.267 7.794 0.571 745 H CYS 93 H CYS 93 -4.801 4.495 3.119 746 HA CYS 93 HA CYS 93 -2.782 4.652 5.249 747 HB2 CYS 93 1HB CYS 93 -4.808 2.455 4.815 748 HB3 CYS 93 2HB CYS 93 -3.395 2.289 5.871 749 HG CYS 93 HG CYS 93 -5.983 4.479 6.337 750 H PHE 94 H PHE 94 -1.229 2.770 5.128 751 HA PHE 94 HA PHE 94 -0.625 2.225 2.300 752 HB2 PHE 94 1HB PHE 94 1.025 3.593 3.613 753 HB3 PHE 94 2HB PHE 94 1.296 2.181 4.635 754 HD1 PHE 94 1HD PHE 94 1.652 3.469 1.198 755 HD2 PHE 94 2HD PHE 94 2.683 0.396 3.955 756 HE1 PHE 94 1HE PHE 94 3.345 2.629 -0.377 757 HE2 PHE 94 2HE PHE 94 4.379 -0.448 2.386 758 HZ PHE 94 HZ PHE 94 4.712 0.669 0.216 759 H ILE 95 H ILE 95 -1.460 0.277 1.829 760 HA ILE 95 HA ILE 95 -1.241 -1.905 3.753 761 HB ILE 95 HB ILE 95 -2.646 -1.749 1.085 762 HG12 ILE 95 1HG1 ILE 95 -3.710 -1.900 3.918 763 HG13 ILE 95 2HG1 ILE 95 -3.682 -0.445 2.908 764 HG21 ILE 95 1HG2 ILE 95 -2.381 -4.010 3.050 765 HG22 ILE 95 2HG2 ILE 95 -3.671 -3.933 1.850 766 HG23 ILE 95 3HG2 ILE 95 -1.987 -4.004 1.331 767 HD11 ILE 95 3HD1 ILE 95 -5.400 -2.868 2.658 768 HD12 ILE 95 1HD1 ILE 95 -5.853 -1.165 2.664 769 HD13 ILE 95 2HD1 ILE 95 -5.069 -1.864 1.246 770 H PHE 96 H PHE 96 0.542 -3.092 3.739 771 HA PHE 96 HA PHE 96 2.007 -3.441 1.219 772 HB2 PHE 96 1HB PHE 96 3.314 -2.494 3.052 773 HB3 PHE 96 2HB PHE 96 2.895 -3.867 4.080 774 HD1 PHE 96 1HD PHE 96 3.498 -4.649 0.621 775 HD2 PHE 96 2HD PHE 96 5.356 -4.143 4.417 776 HE1 PHE 96 1HE PHE 96 5.469 -5.881 -0.183 777 HE2 PHE 96 2HE PHE 96 7.331 -5.373 3.618 778 HZ PHE 96 HZ PHE 96 7.390 -6.244 1.314 779 H SER 97 H SER 97 1.211 -5.178 0.187 780 HA SER 97 HA SER 97 0.368 -7.535 1.630 781 HB2 SER 97 1HB SER 97 -0.729 -6.596 -0.490 782 HB3 SER 97 2HB SER 97 0.648 -7.293 -1.364 783 HG SER 97 HG SER 97 0.070 -9.333 -0.433 784 H SER 98 H SER 98 1.844 -8.897 2.387 785 HA SER 98 HA SER 98 4.047 -9.695 0.613 786 HB2 SER 98 1HB SER 98 4.699 -8.048 2.507 787 HB3 SER 98 2HB SER 98 4.464 -9.437 3.583 788 HG SER 98 HG SER 98 6.065 -9.719 1.293 789 HA PRO 99 HA PRO 99 1.866 -13.487 1.883 790 HB2 PRO 99 2HB PRO 99 1.226 -13.779 -0.304 791 HB3 PRO 99 1HB PRO 99 2.588 -14.899 -0.351 792 HG2 PRO 99 1HG PRO 99 4.026 -13.329 -1.281 793 HG3 PRO 99 2HG PRO 99 2.462 -12.864 -2.049 794 HD2 PRO 99 1HD PRO 99 4.012 -11.095 -0.691 795 HD3 PRO 99 2HD PRO 99 2.242 -11.006 -0.701 796 H VAL 100 H VAL 100 2.769 -15.859 1.732 797 HA VAL 100 HA VAL 100 5.489 -15.774 2.838 798 HB VAL 100 HB VAL 100 3.688 -16.704 4.277 799 HG11 VAL 100 1HG1 VAL 100 2.176 -17.789 2.914 800 HG12 VAL 100 2HG1 VAL 100 3.436 -18.587 1.971 801 HG13 VAL 100 3HG1 VAL 100 3.067 -19.144 3.603 802 HG21 VAL 100 3HG2 VAL 100 6.084 -18.264 3.451 803 HG22 VAL 100 1HG2 VAL 100 5.723 -17.472 4.985 804 HG23 VAL 100 2HG2 VAL 100 4.949 -19.003 4.580 805 H GLY 101 H GLY 101 3.580 -17.055 0.245 806 HA2 GLY 101 1HA GLY 101 5.378 -19.146 -0.512 807 HA3 GLY 101 2HA GLY 101 4.076 -18.488 -1.491 808 H CYS 102 H CYS 102 5.379 -15.746 -0.968 809 HA CYS 102 HA CYS 102 6.701 -15.513 -3.418 810 HB2 CYS 102 1HB CYS 102 7.523 -13.325 -2.528 811 HB3 CYS 102 2HB CYS 102 5.771 -13.556 -2.401 812 HG CYS 102 HG CYS 102 6.198 -14.514 0.381 813 H LYS 103 H LYS 103 9.035 -14.274 -3.229 814 HA LYS 103 HA LYS 103 10.802 -16.298 -2.028 815 HB2 LYS 103 1HB LYS 103 11.642 -14.356 -4.167 816 HB3 LYS 103 2HB LYS 103 12.348 -15.926 -3.752 817 HG2 LYS 103 1HG LYS 103 11.096 -16.959 -5.260 818 HG3 LYS 103 2HG LYS 103 9.621 -16.278 -4.553 819 HD2 LYS 103 1HD LYS 103 9.836 -15.644 -6.906 820 HD3 LYS 103 2HD LYS 103 9.934 -14.226 -5.848 821 HE2 LYS 103 1HE LYS 103 11.736 -13.749 -7.144 822 HE3 LYS 103 2HE LYS 103 12.538 -14.829 -5.995 823 HZ1 LYS 103 3HZ LYS 103 11.705 -15.369 -8.764 824 HZ2 LYS 103 1HZ LYS 103 11.834 -16.652 -7.668 825 HZ3 LYS 103 2HZ LYS 103 13.185 -15.692 -8.008 826 HA PRO 104 HA PRO 104 12.548 -13.341 0.711 827 HB2 PRO 104 2HB PRO 104 13.716 -15.085 1.646 828 HB3 PRO 104 1HB PRO 104 15.110 -14.286 0.921 829 HG2 PRO 104 1HG PRO 104 15.103 -15.667 -0.949 830 HG3 PRO 104 2HG PRO 104 14.551 -16.812 0.330 831 HD2 PRO 104 1HD PRO 104 13.167 -16.404 -1.968 832 HD3 PRO 104 2HD PRO 104 12.374 -16.756 -0.423 833 H GLU 105 H GLU 105 14.000 -13.881 -2.412 834 HA GLU 105 HA GLU 105 15.875 -11.735 -2.287 835 HB2 GLU 105 1HB GLU 105 15.187 -13.812 -4.114 836 HB3 GLU 105 2HB GLU 105 15.136 -12.272 -4.987 837 HG2 GLU 105 1HG GLU 105 17.478 -13.089 -3.282 838 HG3 GLU 105 2HG GLU 105 17.338 -13.513 -4.995 839 H GLN 106 H GLN 106 12.509 -12.003 -3.100 840 HA GLN 106 HA GLN 106 12.446 -9.322 -4.247 841 HB2 GLN 106 1HB GLN 106 10.024 -11.041 -3.787 842 HB3 GLN 106 2HB GLN 106 10.301 -9.811 -5.031 843 HG2 GLN 106 1HG GLN 106 11.839 -12.398 -4.941 844 HG3 GLN 106 2HG GLN 106 10.298 -12.219 -5.795 845 HE21 GLN 106 2HE2 GLN 106 11.708 -9.847 -8.158 846 HE22 GLN 106 1HE2 GLN 106 10.359 -9.967 -7.087 847 H GLN 107 H GLN 107 10.627 -11.087 -1.733 848 HA GLN 107 HA GLN 107 9.207 -9.159 -0.540 849 HB2 GLN 107 1HB GLN 107 10.201 -11.664 0.241 850 HB3 GLN 107 2HB GLN 107 10.639 -10.553 1.548 851 HG2 GLN 107 1HG GLN 107 7.901 -10.164 0.653 852 HG3 GLN 107 2HG GLN 107 8.209 -11.814 1.209 853 HE21 GLN 107 2HE2 GLN 107 8.872 -8.789 3.893 854 HE22 GLN 107 1HE2 GLN 107 9.297 -8.592 2.231 855 H MET 108 H MET 108 12.692 -9.616 -0.101 856 HA MET 108 HA MET 108 13.060 -7.585 1.816 857 HB2 MET 108 1HB MET 108 14.867 -8.992 -0.127 858 HB3 MET 108 2HB MET 108 15.470 -7.622 0.819 859 HG2 MET 108 1HG MET 108 14.445 -8.990 2.833 860 HG3 MET 108 2HG MET 108 14.671 -10.338 1.714 861 HE1 MET 108 3HE MET 108 17.840 -8.472 0.517 862 HE2 MET 108 1HE MET 108 18.363 -10.133 0.802 863 HE3 MET 108 2HE MET 108 16.792 -9.817 0.063 864 H MET 109 H MET 109 13.366 -7.560 -1.724 865 HA MET 109 HA MET 109 14.300 -5.018 -2.146 866 HB2 MET 109 1HB MET 109 12.375 -6.740 -3.682 867 HB3 MET 109 2HB MET 109 12.762 -5.108 -4.246 868 HG2 MET 109 1HG MET 109 15.107 -5.661 -4.422 869 HG3 MET 109 2HG MET 109 14.804 -7.255 -3.725 870 HE1 MET 109 3HE MET 109 13.720 -4.836 -6.472 871 HE2 MET 109 1HE MET 109 13.272 -5.866 -7.833 872 HE3 MET 109 2HE MET 109 12.204 -5.736 -6.435 873 H TYR 110 H TYR 110 11.080 -6.007 -1.196 874 HA TYR 110 HA TYR 110 10.094 -3.264 -1.415 875 HB2 TYR 110 1HB TYR 110 8.564 -5.710 -0.505 876 HB3 TYR 110 2HB TYR 110 7.901 -4.167 -1.048 877 HD1 TYR 110 1HD TYR 110 9.540 -7.268 -2.165 878 HD2 TYR 110 2HD TYR 110 7.676 -3.641 -3.379 879 HE1 TYR 110 1HE TYR 110 9.401 -8.118 -4.469 880 HE2 TYR 110 2HE TYR 110 7.531 -4.481 -5.686 881 HH TYR 110 HH TYR 110 8.981 -7.561 -6.614 882 H ALA 111 H ALA 111 10.874 -5.715 0.973 883 HA ALA 111 HA ALA 111 9.765 -4.458 3.232 884 HB1 ALA 111 3HB ALA 111 12.122 -5.881 3.968 885 HB2 ALA 111 1HB ALA 111 10.434 -6.344 4.184 886 HB3 ALA 111 2HB ALA 111 11.285 -6.777 2.700 887 H GLY 112 H GLY 112 12.681 -3.872 1.439 888 HA2 GLY 112 1HA GLY 112 13.762 -2.162 3.555 889 HA3 GLY 112 2HA GLY 112 14.592 -2.631 2.079 890 H SER 113 H SER 113 12.110 -1.937 0.516 891 HA SER 113 HA SER 113 12.698 0.923 0.311 892 HB2 SER 113 1HB SER 113 11.037 -0.689 -1.630 893 HB3 SER 113 2HB SER 113 11.912 0.825 -1.919 894 HG SER 113 HG SER 113 13.273 -1.537 -1.183 895 H LYS 114 H LYS 114 10.445 -1.075 1.714 896 HA LYS 114 HA LYS 114 7.979 0.078 1.186 897 HB2 LYS 114 1HB LYS 114 8.076 -1.936 2.460 898 HB3 LYS 114 2HB LYS 114 9.075 -1.170 3.705 899 HG2 LYS 114 1HG LYS 114 7.248 0.176 4.463 900 HG3 LYS 114 2HG LYS 114 6.240 -0.360 3.108 901 HD2 LYS 114 1HD LYS 114 5.441 -1.774 4.710 902 HD3 LYS 114 2HD LYS 114 6.800 -2.751 4.123 903 HE2 LYS 114 1HE LYS 114 8.131 -2.266 5.970 904 HE3 LYS 114 2HE LYS 114 7.211 -0.804 6.358 905 HZ1 LYS 114 3HZ LYS 114 5.432 -2.923 6.529 906 HZ2 LYS 114 1HZ LYS 114 6.065 -2.006 7.801 907 HZ3 LYS 114 2HZ LYS 114 6.837 -3.431 7.321 908 H ASN 115 H ASN 115 10.091 0.835 3.965 909 HA ASN 115 HA ASN 115 8.662 3.031 4.894 910 HB2 ASN 115 1HB ASN 115 11.580 2.287 5.082 911 HB3 ASN 115 2HB ASN 115 10.941 3.746 5.849 912 HD21 ASN 115 2HD2 ASN 115 10.072 0.067 7.359 913 HD22 ASN 115 1HD2 ASN 115 10.729 0.250 5.772 914 H ARG 116 H ARG 116 11.284 2.881 2.519 915 HA ARG 116 HA ARG 116 11.708 5.595 2.132 916 HB2 ARG 116 1HB ARG 116 13.245 4.194 1.084 917 HB3 ARG 116 2HB ARG 116 11.980 3.204 0.344 918 HG2 ARG 116 1HG ARG 116 13.003 4.461 -1.395 919 HG3 ARG 116 2HG ARG 116 11.400 5.155 -1.102 920 HD2 ARG 116 1HD ARG 116 12.312 7.152 -0.729 921 HD3 ARG 116 2HD ARG 116 13.238 6.468 0.614 922 HE ARG 116 HE ARG 116 14.194 7.003 -2.065 923 HH11 ARG 116 2HH1 ARG 116 14.744 5.367 0.959 924 HH12 ARG 116 1HH1 ARG 116 16.451 5.203 0.709 925 HH21 ARG 116 1HH2 ARG 116 17.413 6.015 -1.205 926 HH22 ARG 116 2HH2 ARG 116 16.439 6.792 -2.406 927 H LEU 117 H LEU 117 9.575 3.471 0.213 928 HA LEU 117 HA LEU 117 8.433 5.478 -1.353 929 HB2 LEU 117 1HB LEU 117 8.164 3.217 -2.015 930 HB3 LEU 117 2HB LEU 117 7.411 2.793 -0.467 931 HG LEU 117 HG LEU 117 5.505 4.351 -1.171 932 HD11 LEU 117 1HD1 LEU 117 6.865 5.360 -3.040 933 HD12 LEU 117 2HD1 LEU 117 5.235 4.840 -3.466 934 HD13 LEU 117 3HD1 LEU 117 6.622 3.850 -3.917 935 HD21 LEU 117 3HD2 LEU 117 4.352 2.573 -2.143 936 HD22 LEU 117 1HD2 LEU 117 5.609 1.782 -1.191 937 HD23 LEU 117 2HD2 LEU 117 5.796 1.945 -2.938 938 H VAL 118 H VAL 118 7.020 3.892 1.517 939 HA VAL 118 HA VAL 118 4.743 5.379 1.805 940 HB VAL 118 HB VAL 118 6.548 4.354 3.998 941 HG11 VAL 118 1HG1 VAL 118 3.633 5.030 4.276 942 HG12 VAL 118 2HG1 VAL 118 4.803 4.668 5.547 943 HG13 VAL 118 3HG1 VAL 118 4.911 6.185 4.654 944 HG21 VAL 118 3HG2 VAL 118 5.873 2.404 3.091 945 HG22 VAL 118 1HG2 VAL 118 4.377 2.740 3.964 946 HG23 VAL 118 2HG2 VAL 118 4.510 3.145 2.252 947 H GLN 119 H GLN 119 7.904 6.139 3.271 948 HA GLN 119 HA GLN 119 7.238 8.510 4.516 949 HB2 GLN 119 1HB GLN 119 9.793 7.526 3.269 950 HB3 GLN 119 2HB GLN 119 9.703 9.126 4.021 951 HG2 GLN 119 1HG GLN 119 8.569 7.252 5.831 952 HG3 GLN 119 2HG GLN 119 10.113 6.609 5.256 953 HE21 GLN 119 2HE2 GLN 119 10.100 10.176 7.275 954 HE22 GLN 119 1HE2 GLN 119 8.749 9.717 6.302 955 H THR 120 H THR 120 7.981 7.913 1.136 956 HA THR 120 HA THR 120 8.265 10.592 0.314 957 HB THR 120 HB THR 120 7.142 8.413 -1.438 958 HG1 THR 120 1HG THR 120 9.696 8.681 -0.314 959 HG21 THR 120 3HG2 THR 120 8.235 11.077 -1.829 960 HG22 THR 120 1HG2 THR 120 7.320 10.061 -2.941 961 HG23 THR 120 2HG2 THR 120 9.068 9.864 -2.801 962 H ALA 121 H ALA 121 5.440 8.444 0.396 963 HA ALA 121 HA ALA 121 3.661 10.444 -0.639 964 HB1 ALA 121 3HB ALA 121 2.110 8.801 -0.735 965 HB2 ALA 121 1HB ALA 121 3.530 7.768 -0.569 966 HB3 ALA 121 2HB ALA 121 2.544 8.147 0.844 967 H GLU 122 H GLU 122 4.827 9.543 2.485 968 HA GLU 122 HA GLU 122 4.558 10.515 4.531 969 HB2 GLU 122 1HB GLU 122 3.897 12.552 2.721 970 HB3 GLU 122 2HB GLU 122 2.585 12.537 3.912 971 HG2 GLU 122 1HG GLU 122 5.280 12.371 5.067 972 HG3 GLU 122 2HG GLU 122 4.928 13.872 4.200 973 H LEU 123 H LEU 123 2.987 8.328 3.792 974 HA LEU 123 HA LEU 123 0.243 8.747 4.469 975 HB2 LEU 123 1HB LEU 123 1.833 6.175 4.432 976 HB3 LEU 123 2HB LEU 123 0.068 6.324 4.441 977 HG LEU 123 HG LEU 123 1.161 7.748 2.195 978 HD11 LEU 123 1HD1 LEU 123 3.024 6.365 2.078 979 HD12 LEU 123 2HD1 LEU 123 1.862 5.567 1.019 980 HD13 LEU 123 3HD1 LEU 123 2.134 4.953 2.649 981 HD21 LEU 123 3HD2 LEU 123 -0.790 5.553 2.718 982 HD22 LEU 123 1HD2 LEU 123 -0.266 5.869 1.064 983 HD23 LEU 123 2HD2 LEU 123 -1.047 7.144 1.998 984 H THR 124 H THR 124 3.120 7.725 6.214 985 HA THR 124 HA THR 124 3.567 7.693 8.456 986 HB THR 124 HB THR 124 0.735 8.583 8.989 987 HG1 THR 124 1HG THR 124 1.579 10.094 7.571 988 HG21 THR 124 3HG2 THR 124 1.555 8.250 11.073 989 HG22 THR 124 1HG2 THR 124 2.305 9.822 10.802 990 HG23 THR 124 2HG2 THR 124 3.233 8.346 10.543 991 H LYS 125 H LYS 125 0.122 6.796 8.153 992 HA LYS 125 HA LYS 125 0.384 4.611 9.968 993 HB2 LYS 125 1HB LYS 125 -1.736 5.975 8.558 994 HB3 LYS 125 2HB LYS 125 -1.937 4.220 8.430 995 HG2 LYS 125 1HG LYS 125 -1.901 3.988 10.837 996 HG3 LYS 125 2HG LYS 125 -1.582 5.722 11.016 997 HD2 LYS 125 1HD LYS 125 -4.035 4.636 9.632 998 HD3 LYS 125 2HD LYS 125 -3.978 5.003 11.365 999 HE2 LYS 125 1HE LYS 125 -3.025 7.138 9.539 1000 HE3 LYS 125 2HE LYS 125 -4.755 6.776 9.501 1001 HZ1 LYS 125 3HZ LYS 125 -4.940 7.228 11.811 1002 HZ2 LYS 125 1HZ LYS 125 -4.097 8.522 11.121 1003 HZ3 LYS 125 2HZ LYS 125 -3.264 7.343 12.001 1004 H VAL 126 H VAL 126 1.684 2.970 9.390 1005 HA VAL 126 HA VAL 126 1.385 1.838 6.690 1006 HB VAL 126 HB VAL 126 3.646 1.318 8.617 1007 HG11 VAL 126 1HG1 VAL 126 2.924 0.376 5.941 1008 HG12 VAL 126 2HG1 VAL 126 4.590 0.941 6.087 1009 HG13 VAL 126 3HG1 VAL 126 3.995 -0.338 7.146 1010 HG21 VAL 126 3HG2 VAL 126 4.488 3.317 8.144 1011 HG22 VAL 126 1HG2 VAL 126 4.500 2.897 6.432 1012 HG23 VAL 126 2HG2 VAL 126 3.089 3.687 7.135 1013 H PHE 127 H PHE 127 0.639 -0.180 6.422 1014 HA PHE 127 HA PHE 127 0.346 -1.880 8.808 1015 HB2 PHE 127 1HB PHE 127 -1.669 -1.502 6.576 1016 HB3 PHE 127 2HB PHE 127 -1.817 -2.674 7.886 1017 HD1 PHE 127 2HD PHE 127 -0.853 -1.031 10.173 1018 HD2 PHE 127 1HD PHE 127 -3.501 -0.095 6.975 1019 HE1 PHE 127 2HE PHE 127 -1.960 0.651 11.588 1020 HE2 PHE 127 1HE PHE 127 -4.611 1.589 8.384 1021 HZ PHE 127 HZ PHE 127 -3.843 1.962 10.694 1022 H GLU 128 H GLU 128 0.137 -4.192 8.325 1023 HA GLU 128 HA GLU 128 1.236 -4.990 5.729 1024 HB2 GLU 128 1HB GLU 128 3.024 -4.739 7.571 1025 HB3 GLU 128 2HB GLU 128 2.298 -6.194 8.272 1026 HG2 GLU 128 1HG GLU 128 2.673 -7.329 6.054 1027 HG3 GLU 128 2HG GLU 128 3.630 -5.912 5.594 1028 H ILE 129 H ILE 129 0.758 -7.124 5.102 1029 HA ILE 129 HA ILE 129 -1.180 -8.543 6.801 1030 HB ILE 129 HB ILE 129 -2.430 -9.181 4.747 1031 HG12 ILE 129 1HG1 ILE 129 -1.068 -6.893 3.355 1032 HG13 ILE 129 2HG1 ILE 129 -0.376 -8.521 3.280 1033 HG21 ILE 129 1HG2 ILE 129 -3.611 -7.051 4.510 1034 HG22 ILE 129 2HG2 ILE 129 -3.230 -7.394 6.197 1035 HG23 ILE 129 3HG2 ILE 129 -2.269 -6.220 5.297 1036 HD11 ILE 129 3HD1 ILE 129 -1.809 -7.950 1.343 1037 HD12 ILE 129 1HD1 ILE 129 -2.334 -9.386 2.220 1038 HD13 ILE 129 2HD1 ILE 129 -3.185 -7.858 2.441 1039 H ARG 130 H ARG 130 -1.008 -10.737 6.849 1040 HA ARG 130 HA ARG 130 1.426 -11.883 5.844 1041 HB2 ARG 130 1HB ARG 130 0.746 -12.618 7.992 1042 HB3 ARG 130 2HB ARG 130 -0.890 -12.984 7.427 1043 HG2 ARG 130 1HG ARG 130 0.363 -15.030 7.793 1044 HG3 ARG 130 2HG ARG 130 -0.019 -14.823 6.075 1045 HD2 ARG 130 1HD ARG 130 2.191 -15.412 5.910 1046 HD3 ARG 130 2HD ARG 130 2.339 -13.653 6.028 1047 HE ARG 130 HE ARG 130 2.417 -14.714 8.616 1048 HH11 ARG 130 2HH1 ARG 130 4.320 -14.682 5.701 1049 HH12 ARG 130 1HH1 ARG 130 5.831 -14.865 6.529 1050 HH21 ARG 130 1HH2 ARG 130 5.874 -15.020 8.815 1051 HH22 ARG 130 2HH2 ARG 130 4.400 -14.953 9.718 1052 H THR 131 H THR 131 -1.695 -11.478 4.616 1053 HA THR 131 HA THR 131 -1.110 -12.798 2.190 1054 HB THR 131 HB THR 131 -1.482 -14.883 3.238 1055 HG1 THR 131 1HG THR 131 -2.640 -14.701 1.289 1056 HG21 THR 131 3HG2 THR 131 -4.127 -13.978 4.339 1057 HG22 THR 131 1HG2 THR 131 -2.633 -13.779 5.253 1058 HG23 THR 131 2HG2 THR 131 -3.171 -15.391 4.784 1059 H THR 132 H THR 132 -2.524 -12.219 0.586 1060 HA THR 132 HA THR 132 -3.960 -9.961 0.634 1061 HB THR 132 HB THR 132 -5.465 -10.971 -1.164 1062 HG1 THR 132 1HG THR 132 -3.769 -13.203 -0.635 1063 HG21 THR 132 3HG2 THR 132 -2.588 -11.523 -1.772 1064 HG22 THR 132 1HG2 THR 132 -3.108 -9.879 -1.407 1065 HG23 THR 132 2HG2 THR 132 -3.814 -10.744 -2.772 1066 H ASP 133 H ASP 133 -5.258 -13.147 1.502 1067 HA ASP 133 HA ASP 133 -7.899 -12.663 1.854 1068 HB2 ASP 133 1HB ASP 133 -5.936 -14.324 3.383 1069 HB3 ASP 133 2HB ASP 133 -7.578 -14.156 4.019 1070 H ASP 134 H ASP 134 -5.343 -11.843 4.178 1071 HA ASP 134 HA ASP 134 -6.797 -10.887 6.281 1072 HB2 ASP 134 1HB ASP 134 -4.122 -10.633 5.344 1073 HB3 ASP 134 2HB ASP 134 -4.680 -9.022 5.813 1074 H LEU 135 H LEU 135 -5.838 -9.018 3.406 1075 HA LEU 135 HA LEU 135 -6.976 -6.589 4.067 1076 HB2 LEU 135 1HB LEU 135 -5.592 -6.690 2.161 1077 HB3 LEU 135 2HB LEU 135 -6.586 -7.959 1.424 1078 HG LEU 135 HG LEU 135 -8.181 -6.464 0.676 1079 HD11 LEU 135 1HD1 LEU 135 -8.143 -4.034 1.567 1080 HD12 LEU 135 2HD1 LEU 135 -7.250 -4.724 2.922 1081 HD13 LEU 135 3HD1 LEU 135 -8.875 -5.302 2.551 1082 HD21 LEU 135 3HD2 LEU 135 -6.719 -4.314 0.043 1083 HD22 LEU 135 1HD2 LEU 135 -6.541 -5.870 -0.768 1084 HD23 LEU 135 2HD2 LEU 135 -5.422 -5.412 0.515 1085 H THR 136 H THR 136 -8.931 -6.958 5.170 1086 HA THR 136 HA THR 136 -11.203 -7.517 3.384 1087 HB THR 136 HB THR 136 -12.349 -8.431 5.515 1088 HG1 THR 136 1HG THR 136 -10.733 -9.470 6.902 1089 HG21 THR 136 3HG2 THR 136 -12.138 -10.376 4.448 1090 HG22 THR 136 1HG2 THR 136 -10.443 -10.499 4.919 1091 HG23 THR 136 2HG2 THR 136 -10.888 -9.643 3.442 1092 H GLU 137 H GLU 137 -13.094 -6.348 3.781 1093 HA GLU 137 HA GLU 137 -12.993 -3.736 4.386 1094 HB2 GLU 137 1HB GLU 137 -14.998 -4.811 3.509 1095 HB3 GLU 137 2HB GLU 137 -15.282 -5.585 5.076 1096 HG2 GLU 137 1HG GLU 137 -15.135 -2.949 5.780 1097 HG3 GLU 137 2HG GLU 137 -15.896 -2.873 4.184 1098 H THR 138 H THR 138 -13.380 -6.337 6.742 1099 HA THR 138 HA THR 138 -13.669 -4.576 8.982 1100 HB THR 138 HB THR 138 -12.830 -7.469 9.126 1101 HG1 THR 138 1HG THR 138 -15.526 -6.592 9.137 1102 HG21 THR 138 3HG2 THR 138 -12.738 -6.417 11.251 1103 HG22 THR 138 1HG2 THR 138 -14.248 -7.326 11.220 1104 HG23 THR 138 2HG2 THR 138 -14.265 -5.578 10.981 1105 H TRP 139 H TRP 139 -11.080 -6.882 8.125 1106 HA TRP 139 HA TRP 139 -9.200 -6.135 9.974 1107 HB2 TRP 139 1HB TRP 139 -8.624 -8.003 8.713 1108 HB3 TRP 139 2HB TRP 139 -8.981 -7.202 7.182 1109 HD1 TRP 139 HD TRP 139 -6.131 -8.017 9.433 1110 HE1 TRP 139 1HE TRP 139 -3.969 -6.930 8.557 1111 HE3 TRP 139 3HE TRP 139 -8.158 -4.884 5.938 1112 HZ2 TRP 139 2HZ TRP 139 -3.222 -5.001 6.636 1113 HZ3 TRP 139 3HZ TRP 139 -6.651 -3.451 4.623 1114 HH2 TRP 139 HH TRP 139 -4.234 -3.509 4.967 1115 H LEU 140 H LEU 140 -10.363 -4.298 7.333 1116 HA LEU 140 HA LEU 140 -8.062 -2.519 7.279 1117 HB2 LEU 140 1HB LEU 140 -8.951 -2.892 5.144 1118 HB3 LEU 140 2HB LEU 140 -10.616 -2.699 5.720 1119 HG LEU 140 HG LEU 140 -9.663 -0.845 4.261 1120 HD11 LEU 140 1HD1 LEU 140 -11.136 0.607 5.182 1121 HD12 LEU 140 2HD1 LEU 140 -10.522 0.370 6.817 1122 HD13 LEU 140 3HD1 LEU 140 -11.599 -0.827 6.098 1123 HD21 LEU 140 3HD2 LEU 140 -7.486 -0.885 5.680 1124 HD22 LEU 140 1HD2 LEU 140 -8.392 0.164 6.770 1125 HD23 LEU 140 2HD2 LEU 140 -8.120 0.657 5.099 1126 H LYS 141 H LYS 141 -11.575 -2.127 7.776 1127 HA LYS 141 HA LYS 141 -11.479 0.479 8.766 1128 HB2 LYS 141 1HB LYS 141 -13.427 -1.724 8.713 1129 HB3 LYS 141 2HB LYS 141 -13.641 -0.598 10.061 1130 HG2 LYS 141 1HG LYS 141 -14.273 1.123 8.729 1131 HG3 LYS 141 2HG LYS 141 -13.246 0.594 7.384 1132 HD2 LYS 141 1HD LYS 141 -15.176 -0.059 6.431 1133 HD3 LYS 141 2HD LYS 141 -15.044 -1.448 7.523 1134 HE2 LYS 141 1HE LYS 141 -16.315 1.024 8.595 1135 HE3 LYS 141 2HE LYS 141 -17.225 0.074 7.411 1136 HZ1 LYS 141 3HZ LYS 141 -17.026 -0.415 10.108 1137 HZ2 LYS 141 1HZ LYS 141 -16.068 -1.609 9.387 1138 HZ3 LYS 141 2HZ LYS 141 -17.691 -1.443 8.940 1139 H GLU 142 H GLU 142 -10.828 -2.566 10.315 1140 HA GLU 142 HA GLU 142 -11.110 -1.776 13.000 1141 HB2 GLU 142 1HB GLU 142 -9.712 -3.974 11.554 1142 HB3 GLU 142 2HB GLU 142 -9.226 -3.656 13.226 1143 HG2 GLU 142 1HG GLU 142 -11.863 -3.700 13.594 1144 HG3 GLU 142 2HG GLU 142 -11.766 -4.735 12.162 1145 H LYS 143 H LYS 143 -8.303 -1.753 10.831 1146 HA LYS 143 HA LYS 143 -6.431 -0.816 12.712 1147 HB2 LYS 143 1HB LYS 143 -6.450 -0.386 9.714 1148 HB3 LYS 143 2HB LYS 143 -5.045 -0.241 10.783 1149 HG2 LYS 143 1HG LYS 143 -6.388 -2.830 10.985 1150 HG3 LYS 143 2HG LYS 143 -5.747 -2.475 9.371 1151 HD2 LYS 143 1HD LYS 143 -3.649 -1.684 10.865 1152 HD3 LYS 143 2HD LYS 143 -4.320 -2.944 11.915 1153 HE2 LYS 143 1HE LYS 143 -4.190 -4.579 10.134 1154 HE3 LYS 143 2HE LYS 143 -3.667 -3.329 8.996 1155 HZ1 LYS 143 3HZ LYS 143 -2.131 -4.046 11.429 1156 HZ2 LYS 143 1HZ LYS 143 -1.620 -3.085 10.132 1157 HZ3 LYS 143 2HZ LYS 143 -1.851 -4.747 9.915 1158 H LEU 144 H LEU 144 -8.622 0.869 10.520 1159 HA LEU 144 HA LEU 144 -7.603 3.471 11.035 1160 HB2 LEU 144 1HB LEU 144 -10.422 2.872 10.175 1161 HB3 LEU 144 2HB LEU 144 -9.422 4.284 9.795 1162 HG LEU 144 HG LEU 144 -8.924 1.505 8.732 1163 HD11 LEU 144 1HD1 LEU 144 -10.216 3.882 7.400 1164 HD12 LEU 144 2HD1 LEU 144 -11.027 2.391 7.881 1165 HD13 LEU 144 3HD1 LEU 144 -9.798 2.358 6.617 1166 HD21 LEU 144 3HD2 LEU 144 -6.882 2.516 8.547 1167 HD22 LEU 144 1HD2 LEU 144 -7.568 4.138 8.450 1168 HD23 LEU 144 2HD2 LEU 144 -7.630 3.068 7.048 1169 H ALA 145 H ALA 145 -10.377 1.653 12.300 1170 HA ALA 145 HA ALA 145 -11.516 3.577 13.918 1171 HB1 ALA 145 3HB ALA 145 -11.500 0.649 13.832 1172 HB2 ALA 145 1HB ALA 145 -11.849 1.330 15.421 1173 HB3 ALA 145 2HB ALA 145 -12.844 1.773 14.033 1174 H SER 146 H SER 146 -11.511 2.959 16.511 1175 HA SER 146 HA SER 146 -8.881 2.619 17.596 1176 HB2 SER 146 1HB SER 146 -8.521 4.881 16.927 1177 HB3 SER 146 2HB SER 146 -10.118 5.374 17.517 1178 HG SER 146 HG SER 146 -8.177 5.816 18.891 1179 H GLY 147 H GLY 147 -9.943 1.022 18.807 1180 HA2 GLY 147 1HA GLY 147 -11.808 2.062 20.850 1181 HA3 GLY 147 2HA GLY 147 -11.873 0.425 20.213 1182 HA PRO 148 HA PRO 148 -9.530 0.343 24.215 1183 HB2 PRO 148 2HB PRO 148 -11.433 -0.145 25.407 1184 HB3 PRO 148 1HB PRO 148 -10.875 -1.809 25.241 1185 HG2 PRO 148 1HG PRO 148 -12.252 -2.236 23.419 1186 HG3 PRO 148 2HG PRO 148 -13.281 -1.104 24.374 1187 HD2 PRO 148 1HD PRO 148 -12.674 -0.680 21.764 1188 HD3 PRO 148 2HD PRO 148 -12.880 0.642 22.924 1189 H SER 149 H SER 149 -9.648 -1.341 21.418 1190 HA SER 149 HA SER 149 -8.588 -3.863 22.029 1191 HB2 SER 149 1HB SER 149 -8.027 -4.049 19.721 1192 HB3 SER 149 2HB SER 149 -9.500 -3.068 19.792 1193 HG SER 149 HG SER 149 -8.377 -1.687 18.676 1194 H SER 150 H SER 150 -6.394 -4.637 21.668 1195 HA SER 150 HA SER 150 -4.367 -2.609 22.359 1196 HB2 SER 150 1HB SER 150 -5.125 -5.051 23.728 1197 HB3 SER 150 2HB SER 150 -3.418 -5.096 23.252 1198 HG SER 150 HG SER 150 -2.989 -3.407 24.515 1199 H GLY 151 H GLY 151 -2.205 -3.021 21.612 1200 HA2 GLY 151 1HA GLY 151 -0.617 -4.147 20.259 1201 HA3 GLY 151 2HA GLY 151 -1.931 -5.039 19.506 Start of MODEL 18 1 H1 GLY 1 H GLY 1 11.676 -12.092 12.054 2 HA2 GLY 1 1HA GLY 1 9.846 -14.185 11.306 3 HA3 GLY 1 2HA GLY 1 10.188 -13.067 9.993 4 H SER 2 H SER 2 11.082 -14.926 8.890 5 HA SER 2 HA SER 2 13.901 -15.298 9.584 6 HB2 SER 2 1HB SER 2 13.821 -17.689 9.299 7 HB3 SER 2 2HB SER 2 12.582 -17.239 10.483 8 HG SER 2 HG SER 2 11.193 -18.151 9.218 9 H SER 3 H SER 3 15.262 -15.608 7.842 10 HA SER 3 HA SER 3 14.015 -15.226 5.202 11 HB2 SER 3 1HB SER 3 15.807 -13.583 6.397 12 HB3 SER 3 2HB SER 3 16.907 -14.669 5.529 13 HG SER 3 HG SER 3 16.458 -13.228 4.005 14 H GLY 4 H GLY 4 16.894 -16.704 6.710 15 HA2 GLY 4 1HA GLY 4 17.212 -19.119 6.356 16 HA3 GLY 4 2HA GLY 4 16.684 -18.859 4.699 17 H SER 5 H SER 5 18.941 -16.902 6.597 18 HA SER 5 HA SER 5 21.109 -16.313 6.245 19 HB2 SER 5 1HB SER 5 21.007 -19.169 5.393 20 HB3 SER 5 2HB SER 5 22.441 -18.234 4.935 21 HG SER 5 HG SER 5 23.067 -18.192 6.948 22 H SER 6 H SER 6 21.313 -14.647 4.899 23 HA SER 6 HA SER 6 21.897 -15.098 2.127 24 HB2 SER 6 1HB SER 6 19.291 -13.816 2.952 25 HB3 SER 6 2HB SER 6 20.062 -13.431 1.402 26 HG SER 6 HG SER 6 18.544 -15.164 1.249 27 H GLY 7 H GLY 7 21.003 -12.692 4.581 28 HA2 GLY 7 1HA GLY 7 23.129 -10.949 3.493 29 HA3 GLY 7 2HA GLY 7 21.651 -10.331 4.214 30 H SER 8 H SER 8 23.792 -9.263 5.245 31 HA SER 8 HA SER 8 24.345 -10.762 7.722 32 HB2 SER 8 1HB SER 8 26.101 -9.413 5.869 33 HB3 SER 8 2HB SER 8 26.224 -8.673 7.474 34 HG SER 8 HG SER 8 27.557 -10.659 6.892 35 H ASP 9 H ASP 9 24.250 -7.392 6.552 36 HA ASP 9 HA ASP 9 22.374 -6.632 8.588 37 HB2 ASP 9 1HB ASP 9 24.959 -6.654 9.450 38 HB3 ASP 9 2HB ASP 9 24.823 -5.003 8.830 39 H SER 10 H SER 10 22.270 -6.517 5.819 40 HA SER 10 HA SER 10 21.782 -3.702 5.434 41 HB2 SER 10 1HB SER 10 24.097 -5.082 4.179 42 HB3 SER 10 2HB SER 10 23.132 -4.036 3.121 43 HG SER 10 HG SER 10 23.633 -2.302 4.333 44 H LEU 11 H LEU 11 20.571 -3.259 3.483 45 HA LEU 11 HA LEU 11 19.350 -5.652 2.280 46 HB2 LEU 11 1HB LEU 11 17.909 -3.122 3.093 47 HB3 LEU 11 2HB LEU 11 17.187 -4.529 2.294 48 HG LEU 11 HG LEU 11 18.509 -4.888 4.947 49 HD11 LEU 11 1HD1 LEU 11 17.175 -3.337 5.853 50 HD12 LEU 11 2HD1 LEU 11 15.889 -4.518 5.606 51 HD13 LEU 11 3HD1 LEU 11 16.152 -3.240 4.420 52 HD21 LEU 11 3HD2 LEU 11 15.947 -6.143 4.137 53 HD22 LEU 11 1HD2 LEU 11 17.300 -6.812 5.048 54 HD23 LEU 11 2HD2 LEU 11 17.410 -6.654 3.295 55 H VAL 12 H VAL 12 17.850 -4.775 0.356 56 HA VAL 12 HA VAL 12 19.671 -3.245 -1.358 57 HB VAL 12 HB VAL 12 19.025 -5.429 -2.218 58 HG11 VAL 12 1HG1 VAL 12 16.697 -5.908 -2.829 59 HG12 VAL 12 2HG1 VAL 12 16.884 -5.674 -1.090 60 HG13 VAL 12 3HG1 VAL 12 16.196 -4.390 -2.085 61 HG21 VAL 12 3HG2 VAL 12 17.445 -3.947 -4.118 62 HG22 VAL 12 1HG2 VAL 12 18.830 -2.998 -3.578 63 HG23 VAL 12 2HG2 VAL 12 19.076 -4.597 -4.281 64 H VAL 13 H VAL 13 18.213 -1.763 0.507 65 HA VAL 13 HA VAL 13 15.791 -0.724 -0.036 66 HB VAL 13 HB VAL 13 18.234 0.957 0.548 67 HG11 VAL 13 1HG1 VAL 13 16.341 2.305 -0.169 68 HG12 VAL 13 2HG1 VAL 13 15.303 1.506 1.012 69 HG13 VAL 13 3HG1 VAL 13 16.636 2.525 1.555 70 HG21 VAL 13 3HG2 VAL 13 16.577 -0.852 2.200 71 HG22 VAL 13 1HG2 VAL 13 18.277 -0.409 2.356 72 HG23 VAL 13 2HG2 VAL 13 17.023 0.695 2.922 73 H CYS 14 H CYS 14 14.786 0.239 -1.676 74 HA CYS 14 HA CYS 14 16.413 1.172 -3.941 75 HB2 CYS 14 1HB CYS 14 13.604 0.109 -3.745 76 HB3 CYS 14 2HB CYS 14 14.168 0.978 -5.180 77 HG CYS 14 HG CYS 14 14.315 -1.649 -5.908 78 H GLU 15 H GLU 15 15.283 2.950 -5.250 79 HA GLU 15 HA GLU 15 14.638 5.101 -3.387 80 HB2 GLU 15 1HB GLU 15 15.834 4.906 -6.070 81 HB3 GLU 15 2HB GLU 15 14.724 6.268 -5.859 82 HG2 GLU 15 1HG GLU 15 16.562 5.991 -3.623 83 HG3 GLU 15 2HG GLU 15 17.391 6.208 -5.170 84 H VAL 16 H VAL 16 13.049 6.790 -4.385 85 HA VAL 16 HA VAL 16 10.610 5.314 -5.108 86 HB VAL 16 HB VAL 16 10.438 6.548 -3.014 87 HG11 VAL 16 1HG1 VAL 16 12.053 8.411 -4.216 88 HG12 VAL 16 2HG1 VAL 16 10.485 9.220 -4.184 89 HG13 VAL 16 3HG1 VAL 16 11.201 8.624 -2.686 90 HG21 VAL 16 3HG2 VAL 16 8.344 7.425 -3.397 91 HG22 VAL 16 1HG2 VAL 16 8.819 8.172 -4.923 92 HG23 VAL 16 2HG2 VAL 16 8.561 6.429 -4.837 93 H ASP 17 H ASP 17 10.658 5.269 -7.312 94 HA ASP 17 HA ASP 17 11.584 6.899 -9.192 95 HB2 ASP 17 1HB ASP 17 10.055 4.861 -9.472 96 HB3 ASP 17 2HB ASP 17 8.711 6.007 -9.378 97 HA PRO 18 HA PRO 18 9.977 10.958 -8.597 98 HB2 PRO 18 2HB PRO 18 11.757 11.677 -9.860 99 HB3 PRO 18 1HB PRO 18 10.520 11.977 -11.079 100 HG2 PRO 18 1HG PRO 18 10.919 9.970 -12.179 101 HG3 PRO 18 2HG PRO 18 12.579 10.393 -11.615 102 HD2 PRO 18 1HD PRO 18 11.413 8.001 -11.075 103 HD3 PRO 18 2HD PRO 18 12.524 8.800 -9.949 104 H GLU 19 H GLU 19 8.965 9.023 -11.366 105 HA GLU 19 HA GLU 19 6.762 10.670 -12.092 106 HB2 GLU 19 1HB GLU 19 6.318 9.130 -13.731 107 HB3 GLU 19 2HB GLU 19 8.022 8.767 -13.412 108 HG2 GLU 19 1HG GLU 19 7.369 6.651 -13.200 109 HG3 GLU 19 2HG GLU 19 6.745 7.147 -11.620 110 H LEU 20 H LEU 20 7.239 8.157 -9.751 111 HA LEU 20 HA LEU 20 4.406 7.734 -9.322 112 HB2 LEU 20 1HB LEU 20 6.367 6.030 -9.072 113 HB3 LEU 20 2HB LEU 20 6.548 6.771 -7.473 114 HG LEU 20 HG LEU 20 4.019 5.463 -8.469 115 HD11 LEU 20 1HD1 LEU 20 5.251 4.080 -6.307 116 HD12 LEU 20 2HD1 LEU 20 6.429 4.267 -7.606 117 HD13 LEU 20 3HD1 LEU 20 4.877 3.494 -7.929 118 HD21 LEU 20 3HD2 LEU 20 4.841 6.787 -5.921 119 HD22 LEU 20 1HD2 LEU 20 3.680 5.460 -5.883 120 HD23 LEU 20 2HD2 LEU 20 3.327 6.913 -6.818 121 H LYS 21 H LYS 21 7.128 9.214 -7.599 122 HA LYS 21 HA LYS 21 6.124 9.888 -5.200 123 HB2 LYS 21 1HB LYS 21 8.345 10.584 -6.168 124 HB3 LYS 21 2HB LYS 21 7.499 11.921 -6.964 125 HG2 LYS 21 1HG LYS 21 6.659 12.295 -4.430 126 HG3 LYS 21 2HG LYS 21 8.251 11.571 -4.138 127 HD2 LYS 21 1HD LYS 21 8.203 13.656 -6.223 128 HD3 LYS 21 2HD LYS 21 7.825 14.217 -4.585 129 HE2 LYS 21 1HE LYS 21 9.973 12.617 -4.094 130 HE3 LYS 21 2HE LYS 21 10.359 13.231 -5.708 131 HZ1 LYS 21 3HZ LYS 21 10.255 15.452 -4.941 132 HZ2 LYS 21 1HZ LYS 21 11.196 14.606 -3.817 133 HZ3 LYS 21 2HZ LYS 21 9.590 14.997 -3.454 134 H GLU 22 H GLU 22 5.329 11.516 -8.243 135 HA GLU 22 HA GLU 22 3.656 13.489 -7.075 136 HB2 GLU 22 1HB GLU 22 3.307 12.496 -9.889 137 HB3 GLU 22 2HB GLU 22 3.126 14.139 -9.255 138 HG2 GLU 22 1HG GLU 22 5.690 13.918 -8.761 139 HG3 GLU 22 2HG GLU 22 5.599 12.662 -10.004 140 H THR 23 H THR 23 3.027 10.334 -8.551 141 HA THR 23 HA THR 23 0.286 10.319 -8.659 142 HB THR 23 HB THR 23 2.239 8.120 -8.040 143 HG1 THR 23 1HG THR 23 0.643 8.901 -10.251 144 HG21 THR 23 3HG2 THR 23 0.562 6.985 -7.059 145 HG22 THR 23 1HG2 THR 23 -0.059 6.800 -8.698 146 HG23 THR 23 2HG2 THR 23 -0.669 8.092 -7.664 147 H LEU 24 H LEU 24 2.301 9.456 -5.857 148 HA LEU 24 HA LEU 24 0.152 8.904 -4.114 149 HB2 LEU 24 1HB LEU 24 2.821 9.940 -3.198 150 HB3 LEU 24 2HB LEU 24 1.739 8.788 -2.397 151 HG LEU 24 HG LEU 24 3.433 8.259 -4.838 152 HD11 LEU 24 1HD1 LEU 24 4.238 8.325 -2.254 153 HD12 LEU 24 2HD1 LEU 24 4.948 7.291 -3.493 154 HD13 LEU 24 3HD1 LEU 24 3.723 6.646 -2.402 155 HD21 LEU 24 3HD2 LEU 24 1.043 6.980 -3.917 156 HD22 LEU 24 1HD2 LEU 24 2.410 5.878 -3.743 157 HD23 LEU 24 2HD2 LEU 24 2.048 6.592 -5.314 158 H ARG 25 H ARG 25 2.221 11.791 -4.411 159 HA ARG 25 HA ARG 25 1.063 13.377 -2.481 160 HB2 ARG 25 1HB ARG 25 3.054 14.105 -3.590 161 HB3 ARG 25 2HB ARG 25 2.233 14.134 -5.158 162 HG2 ARG 25 1HG ARG 25 0.671 15.875 -3.886 163 HG3 ARG 25 2HG ARG 25 2.155 16.097 -2.944 164 HD2 ARG 25 1HD ARG 25 3.074 16.071 -5.552 165 HD3 ARG 25 2HD ARG 25 1.531 16.928 -5.665 166 HE ARG 25 HE ARG 25 3.934 17.927 -4.549 167 HH11 ARG 25 2HH1 ARG 25 0.479 17.963 -4.115 168 HH12 ARG 25 1HH1 ARG 25 0.462 19.512 -3.338 169 HH21 ARG 25 1HH2 ARG 25 2.422 20.651 -3.006 170 HH22 ARG 25 2HH2 ARG 25 3.924 19.966 -3.528 171 H LYS 26 H LYS 26 -0.080 12.671 -5.723 172 HA LYS 26 HA LYS 26 -2.197 14.616 -5.641 173 HB2 LYS 26 1HB LYS 26 -2.074 12.258 -7.511 174 HB3 LYS 26 2HB LYS 26 -2.792 13.854 -7.789 175 HG2 LYS 26 1HG LYS 26 -0.006 14.185 -7.239 176 HG3 LYS 26 2HG LYS 26 -0.217 12.953 -8.496 177 HD2 LYS 26 1HD LYS 26 -1.962 14.766 -9.410 178 HD3 LYS 26 2HD LYS 26 -0.854 15.847 -8.547 179 HE2 LYS 26 1HE LYS 26 0.697 15.671 -10.144 180 HE3 LYS 26 2HE LYS 26 0.613 13.905 -10.093 181 HZ1 LYS 26 3HZ LYS 26 -0.621 13.854 -11.927 182 HZ2 LYS 26 1HZ LYS 26 -0.216 15.482 -12.149 183 HZ3 LYS 26 2HZ LYS 26 -1.664 15.068 -11.380 184 H PHE 27 H PHE 27 -1.905 11.132 -5.154 185 HA PHE 27 HA PHE 27 -4.631 10.522 -4.959 186 HB2 PHE 27 1HB PHE 27 -2.657 8.913 -5.117 187 HB3 PHE 27 2HB PHE 27 -2.457 9.150 -3.380 188 HD1 PHE 27 1HD PHE 27 -5.427 8.616 -5.578 189 HD2 PHE 27 2HD PHE 27 -3.197 7.344 -2.184 190 HE1 PHE 27 1HE PHE 27 -7.110 6.879 -5.128 191 HE2 PHE 27 2HE PHE 27 -4.876 5.604 -1.729 192 HZ PHE 27 HZ PHE 27 -6.835 5.370 -3.202 193 H ARG 28 H ARG 28 -2.350 11.760 -2.590 194 HA ARG 28 HA ARG 28 -4.112 11.464 -0.355 195 HB2 ARG 28 1HB ARG 28 -1.842 13.431 -0.440 196 HB3 ARG 28 2HB ARG 28 -2.437 12.473 0.923 197 HG2 ARG 28 1HG ARG 28 -1.625 10.530 -0.834 198 HG3 ARG 28 2HG ARG 28 -0.437 11.817 -1.092 199 HD2 ARG 28 1HD ARG 28 -1.160 10.536 1.553 200 HD3 ARG 28 2HD ARG 28 0.338 10.310 0.639 201 HE ARG 28 HE ARG 28 1.017 12.480 1.246 202 HH11 ARG 28 2HH1 ARG 28 -2.069 11.608 2.601 203 HH12 ARG 28 1HH1 ARG 28 -2.050 12.869 3.789 204 HH21 ARG 28 1HH2 ARG 28 -0.274 14.311 3.905 205 HH22 ARG 28 2HH2 ARG 28 1.054 14.143 2.807 206 H PHE 29 H PHE 29 -3.680 13.817 -2.837 207 HA PHE 29 HA PHE 29 -5.715 15.504 -1.552 208 HB2 PHE 29 1HB PHE 29 -3.685 16.857 -3.256 209 HB3 PHE 29 2HB PHE 29 -4.541 17.452 -1.831 210 HD1 PHE 29 1HD PHE 29 -3.939 15.786 0.328 211 HD2 PHE 29 2HD PHE 29 -1.411 16.843 -2.929 212 HE1 PHE 29 1HE PHE 29 -1.962 15.356 1.728 213 HE2 PHE 29 2HE PHE 29 0.570 16.414 -1.534 214 HZ PHE 29 HZ PHE 29 0.296 15.669 0.797 215 H ARG 30 H ARG 30 -6.212 13.499 -3.435 216 HA ARG 30 HA ARG 30 -6.373 14.610 -6.071 217 HB2 ARG 30 1HB ARG 30 -7.656 12.590 -6.620 218 HB3 ARG 30 2HB ARG 30 -6.165 12.202 -5.749 219 HG2 ARG 30 1HG ARG 30 -7.780 12.312 -3.650 220 HG3 ARG 30 2HG ARG 30 -8.988 11.928 -4.887 221 HD2 ARG 30 1HD ARG 30 -6.727 10.252 -5.326 222 HD3 ARG 30 2HD ARG 30 -7.145 10.184 -3.609 223 HE ARG 30 HE ARG 30 -8.682 9.148 -5.808 224 HH11 ARG 30 2HH1 ARG 30 -8.780 10.269 -2.513 225 HH12 ARG 30 1HH1 ARG 30 -10.220 9.388 -2.119 226 HH21 ARG 30 1HH2 ARG 30 -11.242 8.089 -3.705 227 HH22 ARG 30 2HH2 ARG 30 -10.579 7.984 -5.302 228 H LYS 31 H LYS 31 -8.621 14.476 -7.195 229 HA LYS 31 HA LYS 31 -10.459 16.098 -5.579 230 HB2 LYS 31 1HB LYS 31 -9.839 15.927 -8.500 231 HB3 LYS 31 2HB LYS 31 -11.453 16.460 -8.002 232 HG2 LYS 31 1HG LYS 31 -9.243 17.791 -6.595 233 HG3 LYS 31 2HG LYS 31 -9.318 18.097 -8.340 234 HD2 LYS 31 1HD LYS 31 -11.968 18.252 -7.274 235 HD3 LYS 31 2HD LYS 31 -10.890 19.256 -6.289 236 HE2 LYS 31 1HE LYS 31 -10.146 20.485 -8.218 237 HE3 LYS 31 2HE LYS 31 -11.015 19.383 -9.297 238 HZ1 LYS 31 3HZ LYS 31 -12.906 20.492 -9.004 239 HZ2 LYS 31 1HZ LYS 31 -11.976 21.724 -8.310 240 HZ3 LYS 31 2HZ LYS 31 -12.721 20.570 -7.324 241 H GLU 32 H GLU 32 -10.452 13.319 -5.165 242 HA GLU 32 HA GLU 32 -12.958 12.467 -6.454 243 HB2 GLU 32 1HB GLU 32 -10.645 10.917 -5.302 244 HB3 GLU 32 2HB GLU 32 -12.223 10.163 -5.576 245 HG2 GLU 32 1HG GLU 32 -10.740 11.597 -7.763 246 HG3 GLU 32 2HG GLU 32 -10.469 9.888 -7.391 247 H THR 33 H THR 33 -14.145 10.800 -4.946 248 HA THR 33 HA THR 33 -14.102 11.637 -2.152 249 HB THR 33 HB THR 33 -16.568 11.978 -2.130 250 HG1 THR 33 1HG THR 33 -17.476 11.211 -3.907 251 HG21 THR 33 3HG2 THR 33 -15.451 14.001 -2.078 252 HG22 THR 33 1HG2 THR 33 -16.441 14.187 -3.526 253 HG23 THR 33 2HG2 THR 33 -14.735 13.766 -3.672 254 H ASN 34 H ASN 34 -13.905 9.201 -4.153 255 HA ASN 34 HA ASN 34 -15.592 7.403 -2.538 256 HB2 ASN 34 1HB ASN 34 -15.397 5.840 -4.546 257 HB3 ASN 34 2HB ASN 34 -16.407 7.276 -4.754 258 HD21 ASN 34 2HD2 ASN 34 -13.352 6.617 -7.213 259 HD22 ASN 34 1HD2 ASN 34 -13.957 5.467 -6.074 260 H ASN 35 H ASN 35 -14.612 5.005 -2.942 261 HA ASN 35 HA ASN 35 -12.013 5.111 -1.669 262 HB2 ASN 35 1HB ASN 35 -13.959 2.880 -2.270 263 HB3 ASN 35 2HB ASN 35 -12.347 2.570 -1.614 264 HD21 ASN 35 2HD2 ASN 35 -14.489 2.683 1.297 265 HD22 ASN 35 1HD2 ASN 35 -14.165 1.660 -0.057 266 H ALA 36 H ALA 36 -10.098 4.523 -2.540 267 HA ALA 36 HA ALA 36 -10.020 3.178 -5.123 268 HB1 ALA 36 3HB ALA 36 -10.002 5.292 -6.037 269 HB2 ALA 36 1HB ALA 36 -9.141 5.995 -4.667 270 HB3 ALA 36 2HB ALA 36 -8.277 4.987 -5.829 271 H ALA 37 H ALA 37 -7.799 2.539 -5.728 272 HA ALA 37 HA ALA 37 -5.944 2.415 -3.458 273 HB1 ALA 37 3HB ALA 37 -6.034 0.198 -3.230 274 HB2 ALA 37 1HB ALA 37 -7.523 0.271 -4.174 275 HB3 ALA 37 2HB ALA 37 -5.986 -0.065 -4.972 276 H ILE 38 H ILE 38 -3.744 1.878 -4.065 277 HA ILE 38 HA ILE 38 -3.129 2.198 -6.913 278 HB ILE 38 HB ILE 38 -1.651 3.746 -4.792 279 HG12 ILE 38 1HG1 ILE 38 -3.912 4.597 -6.610 280 HG13 ILE 38 2HG1 ILE 38 -3.871 4.658 -4.839 281 HG21 ILE 38 1HG2 ILE 38 -0.795 3.050 -7.234 282 HG22 ILE 38 2HG2 ILE 38 -1.648 4.539 -7.636 283 HG23 ILE 38 3HG2 ILE 38 -0.345 4.563 -6.448 284 HD11 ILE 38 3HD1 ILE 38 -2.350 6.452 -4.824 285 HD12 ILE 38 1HD1 ILE 38 -1.990 6.261 -6.541 286 HD13 ILE 38 2HD1 ILE 38 -3.570 6.856 -6.032 287 H ILE 39 H ILE 39 -1.983 0.470 -7.457 288 HA ILE 39 HA ILE 39 -0.271 -0.822 -5.468 289 HB ILE 39 HB ILE 39 -1.028 -1.775 -8.233 290 HG12 ILE 39 1HG1 ILE 39 -2.052 -3.194 -5.863 291 HG13 ILE 39 2HG1 ILE 39 -2.701 -1.560 -6.076 292 HG21 ILE 39 1HG2 ILE 39 -0.260 -3.987 -7.293 293 HG22 ILE 39 2HG2 ILE 39 1.009 -2.803 -7.603 294 HG23 ILE 39 3HG2 ILE 39 0.445 -3.078 -5.956 295 HD11 ILE 39 3HD1 ILE 39 -3.214 -3.989 -7.615 296 HD12 ILE 39 1HD1 ILE 39 -4.214 -2.556 -7.379 297 HD13 ILE 39 2HD1 ILE 39 -2.933 -2.549 -8.593 298 H MET 40 H MET 40 1.815 -0.352 -5.404 299 HA MET 40 HA MET 40 3.130 0.557 -7.880 300 HB2 MET 40 1HB MET 40 4.069 1.143 -5.070 301 HB3 MET 40 2HB MET 40 4.591 1.912 -6.577 302 HG2 MET 40 1HG MET 40 2.884 3.368 -6.594 303 HG3 MET 40 2HG MET 40 1.727 2.153 -6.041 304 HE1 MET 40 3HE MET 40 0.435 3.005 -3.683 305 HE2 MET 40 1HE MET 40 1.266 1.457 -3.845 306 HE3 MET 40 2HE MET 40 1.480 2.424 -2.386 307 H LYS 41 H LYS 41 5.004 -0.402 -8.523 308 HA LYS 41 HA LYS 41 5.919 -2.697 -6.916 309 HB2 LYS 41 1HB LYS 41 6.509 -3.835 -8.930 310 HB3 LYS 41 2HB LYS 41 4.856 -3.229 -9.128 311 HG2 LYS 41 1HG LYS 41 5.593 -1.434 -10.529 312 HG3 LYS 41 2HG LYS 41 7.291 -1.822 -10.199 313 HD2 LYS 41 1HD LYS 41 7.343 -3.325 -11.844 314 HD3 LYS 41 2HD LYS 41 5.916 -4.147 -11.191 315 HE2 LYS 41 1HE LYS 41 4.454 -3.019 -12.547 316 HE3 LYS 41 2HE LYS 41 5.489 -1.586 -12.631 317 HZ1 LYS 41 3HZ LYS 41 5.768 -4.120 -14.131 318 HZ2 LYS 41 1HZ LYS 41 7.036 -3.007 -14.010 319 HZ3 LYS 41 2HZ LYS 41 5.581 -2.555 -14.745 320 H VAL 42 H VAL 42 8.266 -3.334 -7.721 321 HA VAL 42 HA VAL 42 9.898 -0.894 -7.915 322 HB VAL 42 HB VAL 42 10.118 -1.361 -5.636 323 HG11 VAL 42 1HG1 VAL 42 9.026 -3.699 -6.008 324 HG12 VAL 42 2HG1 VAL 42 10.698 -4.264 -6.036 325 HG13 VAL 42 3HG1 VAL 42 10.072 -3.429 -4.614 326 HG21 VAL 42 3HG2 VAL 42 12.419 -3.047 -6.220 327 HG22 VAL 42 1HG2 VAL 42 12.291 -1.660 -7.301 328 HG23 VAL 42 2HG2 VAL 42 12.351 -1.415 -5.555 329 H ASP 43 H ASP 43 10.814 -1.085 -9.862 330 HA ASP 43 HA ASP 43 11.410 -3.561 -11.113 331 HB2 ASP 43 1HB ASP 43 12.110 -0.692 -11.705 332 HB3 ASP 43 2HB ASP 43 12.783 -2.012 -12.669 333 H LYS 44 H LYS 44 12.962 -4.904 -10.504 334 HA LYS 44 HA LYS 44 15.069 -4.285 -8.776 335 HB2 LYS 44 1HB LYS 44 14.226 -6.565 -9.137 336 HB3 LYS 44 2HB LYS 44 14.890 -6.543 -10.779 337 HG2 LYS 44 1HG LYS 44 17.137 -6.454 -9.955 338 HG3 LYS 44 2HG LYS 44 16.559 -6.246 -8.292 339 HD2 LYS 44 1HD LYS 44 15.281 -8.533 -8.922 340 HD3 LYS 44 2HD LYS 44 16.715 -8.687 -9.954 341 HE2 LYS 44 1HE LYS 44 17.291 -7.795 -7.209 342 HE3 LYS 44 2HE LYS 44 16.591 -9.416 -7.329 343 HZ1 LYS 44 3HZ LYS 44 18.635 -10.107 -7.791 344 HZ2 LYS 44 1HZ LYS 44 19.217 -8.532 -8.000 345 HZ3 LYS 44 2HZ LYS 44 18.493 -9.344 -9.295 346 H ASP 45 H ASP 45 14.864 -4.219 -12.276 347 HA ASP 45 HA ASP 45 17.622 -3.983 -12.821 348 HB2 ASP 45 1HB ASP 45 15.100 -3.670 -14.291 349 HB3 ASP 45 2HB ASP 45 16.393 -2.608 -14.867 350 H ARG 46 H ARG 46 15.148 -1.635 -11.991 351 HA ARG 46 HA ARG 46 17.137 0.521 -12.188 352 HB2 ARG 46 1HB ARG 46 14.135 0.747 -11.879 353 HB3 ARG 46 2HB ARG 46 15.269 2.068 -12.192 354 HG2 ARG 46 1HG ARG 46 15.774 1.210 -14.384 355 HG3 ARG 46 2HG ARG 46 14.789 -0.231 -14.075 356 HD2 ARG 46 1HD ARG 46 13.288 1.031 -15.271 357 HD3 ARG 46 2HD ARG 46 12.904 1.544 -13.623 358 HE ARG 46 HE ARG 46 14.801 3.319 -14.433 359 HH11 ARG 46 2HH1 ARG 46 11.740 2.263 -15.710 360 HH12 ARG 46 1HH1 ARG 46 11.388 3.779 -16.474 361 HH21 ARG 46 1HH2 ARG 46 12.875 5.515 -16.316 362 HH22 ARG 46 2HH2 ARG 46 14.351 5.319 -15.433 363 H GLN 47 H GLN 47 16.139 -1.595 -9.975 364 HA GLN 47 HA GLN 47 15.756 -1.581 -7.699 365 HB2 GLN 47 1HB GLN 47 18.054 0.377 -7.758 366 HB3 GLN 47 2HB GLN 47 17.671 -0.811 -6.503 367 HG2 GLN 47 1HG GLN 47 18.067 -2.056 -9.098 368 HG3 GLN 47 2HG GLN 47 19.474 -1.124 -8.567 369 HE21 GLN 47 2HE2 GLN 47 18.463 -4.597 -6.750 370 HE22 GLN 47 1HE2 GLN 47 17.464 -3.868 -7.955 371 H MET 48 H MET 48 13.953 0.155 -8.835 372 HA MET 48 HA MET 48 13.710 2.156 -6.715 373 HB2 MET 48 1HB MET 48 13.561 3.975 -8.065 374 HB3 MET 48 2HB MET 48 14.601 2.985 -9.102 375 HG2 MET 48 1HG MET 48 12.162 2.144 -9.923 376 HG3 MET 48 2HG MET 48 11.807 3.813 -9.469 377 HE1 MET 48 3HE MET 48 12.876 5.939 -10.592 378 HE2 MET 48 1HE MET 48 14.456 5.362 -10.062 379 HE3 MET 48 2HE MET 48 14.220 5.867 -11.734 380 H VAL 49 H VAL 49 11.521 2.936 -6.417 381 HA VAL 49 HA VAL 49 9.577 0.848 -6.994 382 HB VAL 49 HB VAL 49 9.248 3.319 -5.290 383 HG11 VAL 49 1HG1 VAL 49 7.546 1.366 -4.361 384 HG12 VAL 49 2HG1 VAL 49 7.093 2.739 -5.374 385 HG13 VAL 49 3HG1 VAL 49 7.456 1.178 -6.113 386 HG21 VAL 49 3HG2 VAL 49 10.000 0.504 -4.509 387 HG22 VAL 49 1HG2 VAL 49 11.023 1.936 -4.399 388 HG23 VAL 49 2HG2 VAL 49 9.591 1.795 -3.379 389 H VAL 50 H VAL 50 8.408 0.980 -8.785 390 HA VAL 50 HA VAL 50 7.531 3.644 -9.698 391 HB VAL 50 HB VAL 50 7.507 2.763 -11.999 392 HG11 VAL 50 1HG1 VAL 50 10.102 2.398 -12.104 393 HG12 VAL 50 2HG1 VAL 50 9.433 3.965 -11.647 394 HG13 VAL 50 3HG1 VAL 50 10.024 2.861 -10.405 395 HG21 VAL 50 3HG2 VAL 50 7.623 0.284 -10.780 396 HG22 VAL 50 1HG2 VAL 50 7.790 0.608 -12.506 397 HG23 VAL 50 2HG2 VAL 50 9.226 0.475 -11.491 398 H LEU 51 H LEU 51 5.413 3.899 -10.279 399 HA LEU 51 HA LEU 51 3.429 2.447 -9.090 400 HB2 LEU 51 1HB LEU 51 3.125 4.662 -10.115 401 HB3 LEU 51 2HB LEU 51 3.227 3.912 -11.717 402 HG LEU 51 HG LEU 51 1.177 2.506 -10.638 403 HD11 LEU 51 1HD1 LEU 51 1.533 4.694 -8.889 404 HD12 LEU 51 2HD1 LEU 51 0.229 3.508 -8.906 405 HD13 LEU 51 3HD1 LEU 51 0.073 5.002 -9.828 406 HD21 LEU 51 3HD2 LEU 51 -0.043 3.472 -12.282 407 HD22 LEU 51 1HD2 LEU 51 1.537 4.086 -12.768 408 HD23 LEU 51 2HD2 LEU 51 0.443 5.108 -11.835 409 H GLU 52 H GLU 52 1.930 0.876 -9.771 410 HA GLU 52 HA GLU 52 2.842 -0.777 -12.036 411 HB2 GLU 52 1HB GLU 52 3.291 -1.846 -9.864 412 HB3 GLU 52 2HB GLU 52 1.573 -1.718 -9.458 413 HG2 GLU 52 1HG GLU 52 0.948 -3.400 -10.870 414 HG3 GLU 52 2HG GLU 52 2.312 -3.125 -11.963 415 H ASP 53 H ASP 53 0.018 0.037 -10.032 416 HA ASP 53 HA ASP 53 -1.634 0.265 -12.386 417 HB2 ASP 53 1HB ASP 53 -1.798 -2.079 -10.557 418 HB3 ASP 53 2HB ASP 53 -3.325 -1.365 -11.091 419 H GLU 54 H GLU 54 -3.960 0.797 -11.712 420 HA GLU 54 HA GLU 54 -4.227 1.971 -9.077 421 HB2 GLU 54 1HB GLU 54 -3.645 3.554 -11.485 422 HB3 GLU 54 2HB GLU 54 -5.060 4.108 -10.577 423 HG2 GLU 54 1HG GLU 54 -3.646 4.163 -8.521 424 HG3 GLU 54 2HG GLU 54 -2.251 3.802 -9.548 425 H LEU 55 H LEU 55 -6.136 1.205 -8.469 426 HA LEU 55 HA LEU 55 -8.324 1.144 -10.439 427 HB2 LEU 55 1HB LEU 55 -8.151 -0.474 -7.899 428 HB3 LEU 55 2HB LEU 55 -9.286 -0.676 -9.244 429 HG LEU 55 HG LEU 55 -6.351 -1.059 -9.693 430 HD11 LEU 55 1HD1 LEU 55 -8.253 -2.957 -8.359 431 HD12 LEU 55 2HD1 LEU 55 -6.620 -2.500 -7.875 432 HD13 LEU 55 3HD1 LEU 55 -6.865 -3.531 -9.284 433 HD21 LEU 55 3HD2 LEU 55 -8.849 -1.514 -11.126 434 HD22 LEU 55 1HD2 LEU 55 -7.783 -2.919 -11.117 435 HD23 LEU 55 2HD2 LEU 55 -7.200 -1.374 -11.735 436 H GLN 56 H GLN 56 -10.086 2.339 -10.071 437 HA GLN 56 HA GLN 56 -10.302 3.688 -7.464 438 HB2 GLN 56 1HB GLN 56 -11.105 4.508 -10.250 439 HB3 GLN 56 2HB GLN 56 -11.792 5.295 -8.821 440 HG2 GLN 56 1HG GLN 56 -10.072 6.716 -9.141 441 HG3 GLN 56 2HG GLN 56 -9.209 5.496 -8.196 442 HE21 GLN 56 2HE2 GLN 56 -6.818 5.370 -10.690 443 HE22 GLN 56 1HE2 GLN 56 -7.214 5.654 -9.033 444 H ASN 57 H ASN 57 -12.525 4.191 -6.740 445 HA ASN 57 HA ASN 57 -14.497 3.360 -5.937 446 HB2 ASN 57 1HB ASN 57 -15.911 2.452 -8.079 447 HB3 ASN 57 2HB ASN 57 -15.750 4.158 -7.644 448 HD21 ASN 57 2HD2 ASN 57 -13.527 4.960 -10.268 449 HD22 ASN 57 1HD2 ASN 57 -13.992 5.364 -8.654 450 H ILE 58 H ILE 58 -12.718 1.550 -5.321 451 HA ILE 58 HA ILE 58 -13.993 -1.010 -6.017 452 HB ILE 58 HB ILE 58 -12.086 -1.640 -6.991 453 HG12 ILE 58 1HG1 ILE 58 -11.952 -2.653 -4.658 454 HG13 ILE 58 2HG1 ILE 58 -10.440 -2.597 -5.580 455 HG21 ILE 58 1HG2 ILE 58 -11.170 0.413 -7.478 456 HG22 ILE 58 2HG2 ILE 58 -11.012 0.866 -5.782 457 HG23 ILE 58 3HG2 ILE 58 -9.896 -0.303 -6.490 458 HD11 ILE 58 3HD1 ILE 58 -9.496 -1.613 -3.842 459 HD12 ILE 58 1HD1 ILE 58 -10.504 -0.201 -4.161 460 HD13 ILE 58 2HD1 ILE 58 -11.050 -1.437 -3.028 461 H SER 59 H SER 59 -14.256 -2.474 -4.368 462 HA SER 59 HA SER 59 -14.108 -1.386 -1.692 463 HB2 SER 59 1HB SER 59 -15.588 -3.498 -3.053 464 HB3 SER 59 2HB SER 59 -14.954 -4.036 -1.488 465 HG SER 59 HG SER 59 -16.440 -2.888 -0.569 466 HA PRO 60 HA PRO 60 -10.564 -3.467 -0.159 467 HB2 PRO 60 2HB PRO 60 -11.165 -2.819 1.962 468 HB3 PRO 60 1HB PRO 60 -11.390 -4.549 2.218 469 HG2 PRO 60 1HG PRO 60 -13.681 -4.447 1.846 470 HG3 PRO 60 2HG PRO 60 -13.388 -2.856 2.643 471 HD2 PRO 60 1HD PRO 60 -14.642 -3.085 0.246 472 HD3 PRO 60 2HD PRO 60 -13.602 -1.711 0.655 473 H GLU 61 H GLU 61 -13.131 -5.208 -1.305 474 HA GLU 61 HA GLU 61 -11.929 -7.813 -0.683 475 HB2 GLU 61 1HB GLU 61 -14.662 -6.870 -1.239 476 HB3 GLU 61 2HB GLU 61 -14.228 -8.384 -2.048 477 HG2 GLU 61 1HG GLU 61 -13.973 -9.543 -0.076 478 HG3 GLU 61 2HG GLU 61 -13.662 -8.074 0.859 479 H GLU 62 H GLU 62 -12.567 -5.576 -3.258 480 HA GLU 62 HA GLU 62 -12.033 -7.455 -5.374 481 HB2 GLU 62 1HB GLU 62 -13.172 -4.886 -5.175 482 HB3 GLU 62 2HB GLU 62 -11.728 -4.708 -6.182 483 HG2 GLU 62 1HG GLU 62 -13.341 -7.037 -6.888 484 HG3 GLU 62 2HG GLU 62 -14.200 -5.498 -7.051 485 H LEU 63 H LEU 63 -10.271 -4.869 -3.730 486 HA LEU 63 HA LEU 63 -8.005 -4.745 -5.316 487 HB2 LEU 63 1HB LEU 63 -8.832 -3.722 -2.847 488 HB3 LEU 63 2HB LEU 63 -7.322 -4.589 -2.516 489 HG LEU 63 HG LEU 63 -7.731 -2.273 -4.399 490 HD11 LEU 63 1HD1 LEU 63 -5.631 -1.712 -2.752 491 HD12 LEU 63 2HD1 LEU 63 -6.703 -2.617 -1.684 492 HD13 LEU 63 3HD1 LEU 63 -7.290 -1.170 -2.504 493 HD21 LEU 63 3HD2 LEU 63 -6.086 -4.330 -4.976 494 HD22 LEU 63 1HD2 LEU 63 -5.022 -3.346 -3.972 495 HD23 LEU 63 2HD2 LEU 63 -5.758 -2.655 -5.418 496 H LYS 64 H LYS 64 -8.456 -6.728 -2.385 497 HA LYS 64 HA LYS 64 -6.056 -8.095 -2.434 498 HB2 LYS 64 1HB LYS 64 -7.075 -8.734 -0.540 499 HB3 LYS 64 2HB LYS 64 -8.688 -8.487 -1.228 500 HG2 LYS 64 1HG LYS 64 -8.841 -10.651 -2.029 501 HG3 LYS 64 2HG LYS 64 -7.083 -10.875 -2.025 502 HD2 LYS 64 1HD LYS 64 -7.285 -11.909 -0.062 503 HD3 LYS 64 2HD LYS 64 -7.751 -10.349 0.635 504 HE2 LYS 64 1HE LYS 64 -9.635 -11.455 1.217 505 HE3 LYS 64 2HE LYS 64 -10.102 -11.099 -0.453 506 HZ1 LYS 64 3HZ LYS 64 -10.275 -13.269 -0.775 507 HZ2 LYS 64 1HZ LYS 64 -9.663 -13.611 0.765 508 HZ3 LYS 64 2HZ LYS 64 -8.608 -13.427 -0.544 509 H LEU 65 H LEU 65 -8.879 -8.536 -4.423 510 HA LEU 65 HA LEU 65 -8.078 -11.103 -5.441 511 HB2 LEU 65 1HB LEU 65 -10.229 -9.121 -6.117 512 HB3 LEU 65 2HB LEU 65 -9.882 -10.482 -7.198 513 HG LEU 65 HG LEU 65 -10.700 -12.049 -5.712 514 HD11 LEU 65 1HD1 LEU 65 -11.163 -11.372 -3.271 515 HD12 LEU 65 2HD1 LEU 65 -10.060 -10.034 -3.593 516 HD13 LEU 65 3HD1 LEU 65 -9.500 -11.698 -3.756 517 HD21 LEU 65 3HD2 LEU 65 -12.809 -11.035 -4.704 518 HD22 LEU 65 1HD2 LEU 65 -12.594 -10.875 -6.448 519 HD23 LEU 65 2HD2 LEU 65 -12.262 -9.504 -5.388 520 H GLU 66 H GLU 66 -7.593 -7.768 -6.307 521 HA GLU 66 HA GLU 66 -6.666 -8.333 -8.973 522 HB2 GLU 66 1HB GLU 66 -6.442 -5.830 -7.282 523 HB3 GLU 66 2HB GLU 66 -6.026 -5.942 -8.999 524 HG2 GLU 66 1HG GLU 66 -8.761 -6.304 -7.779 525 HG3 GLU 66 2HG GLU 66 -8.197 -4.941 -8.754 526 H LEU 67 H LEU 67 -5.288 -8.199 -5.814 527 HA LEU 67 HA LEU 67 -2.580 -7.779 -6.652 528 HB2 LEU 67 1HB LEU 67 -3.786 -8.764 -4.064 529 HB3 LEU 67 2HB LEU 67 -2.051 -8.505 -4.311 530 HG LEU 67 HG LEU 67 -4.157 -6.352 -4.505 531 HD11 LEU 67 1HD1 LEU 67 -2.180 -6.256 -2.346 532 HD12 LEU 67 2HD1 LEU 67 -3.350 -7.568 -2.212 533 HD13 LEU 67 3HD1 LEU 67 -3.908 -5.899 -2.325 534 HD21 LEU 67 3HD2 LEU 67 -1.474 -5.458 -4.029 535 HD22 LEU 67 1HD2 LEU 67 -2.574 -5.043 -5.344 536 HD23 LEU 67 2HD2 LEU 67 -1.528 -6.457 -5.483 537 HA PRO 68 HA PRO 68 -1.379 -11.859 -7.741 538 HB2 PRO 68 2HB PRO 68 0.672 -10.981 -8.290 539 HB3 PRO 68 1HB PRO 68 1.223 -11.896 -6.888 540 HG2 PRO 68 1HG PRO 68 1.130 -10.053 -5.474 541 HG3 PRO 68 2HG PRO 68 1.625 -9.278 -7.025 542 HD2 PRO 68 1HD PRO 68 -0.529 -8.452 -5.595 543 HD3 PRO 68 2HD PRO 68 -0.476 -8.393 -7.365 544 H GLU 69 H GLU 69 0.368 -13.574 -6.538 545 HA GLU 69 HA GLU 69 -0.718 -14.007 -3.839 546 HB2 GLU 69 1HB GLU 69 -0.819 -16.443 -4.332 547 HB3 GLU 69 2HB GLU 69 -1.955 -15.479 -5.289 548 HG2 GLU 69 1HG GLU 69 0.551 -15.755 -6.686 549 HG3 GLU 69 2HG GLU 69 -0.096 -17.337 -6.225 550 H ARG 70 H ARG 70 1.892 -14.412 -6.120 551 HA ARG 70 HA ARG 70 3.680 -15.065 -3.874 552 HB2 ARG 70 1HB ARG 70 4.048 -16.090 -6.693 553 HB3 ARG 70 2HB ARG 70 4.944 -16.563 -5.242 554 HG2 ARG 70 1HG ARG 70 2.040 -16.999 -5.083 555 HG3 ARG 70 2HG ARG 70 2.886 -17.966 -6.302 556 HD2 ARG 70 1HD ARG 70 4.590 -18.371 -4.317 557 HD3 ARG 70 2HD ARG 70 3.171 -17.977 -3.338 558 HE ARG 70 HE ARG 70 2.233 -19.834 -5.074 559 HH11 ARG 70 2HH1 ARG 70 4.945 -19.726 -2.894 560 HH12 ARG 70 1HH1 ARG 70 4.947 -21.435 -2.605 561 HH21 ARG 70 1HH2 ARG 70 3.400 -22.775 -3.633 562 HH22 ARG 70 2HH2 ARG 70 2.225 -22.085 -4.701 563 H GLN 71 H GLN 71 3.145 -12.468 -4.751 564 HA GLN 71 HA GLN 71 5.813 -11.661 -5.565 565 HB2 GLN 71 1HB GLN 71 3.342 -10.828 -7.105 566 HB3 GLN 71 2HB GLN 71 4.960 -10.144 -7.325 567 HG2 GLN 71 1HG GLN 71 5.820 -12.191 -8.170 568 HG3 GLN 71 2HG GLN 71 4.351 -13.060 -7.705 569 HE21 GLN 71 2HE2 GLN 71 2.517 -12.178 -10.533 570 HE22 GLN 71 1HE2 GLN 71 2.495 -12.850 -8.943 571 HA PRO 72 HA PRO 72 4.587 -8.844 -2.302 572 HB2 PRO 72 2HB PRO 72 6.593 -9.349 -1.301 573 HB3 PRO 72 1HB PRO 72 7.086 -7.784 -1.943 574 HG2 PRO 72 1HG PRO 72 8.111 -8.714 -3.809 575 HG3 PRO 72 2HG PRO 72 8.441 -9.978 -2.566 576 HD2 PRO 72 1HD PRO 72 7.253 -10.536 -4.943 577 HD3 PRO 72 2HD PRO 72 6.854 -11.398 -3.448 578 H ARG 73 H ARG 73 3.746 -6.866 -2.512 579 HA ARG 73 HA ARG 73 5.041 -4.838 -4.111 580 HB2 ARG 73 1HB ARG 73 3.230 -4.428 -5.622 581 HB3 ARG 73 2HB ARG 73 3.661 -6.141 -5.743 582 HG2 ARG 73 1HG ARG 73 1.436 -5.229 -3.945 583 HG3 ARG 73 2HG ARG 73 1.177 -5.508 -5.676 584 HD2 ARG 73 1HD ARG 73 1.620 -7.791 -5.520 585 HD3 ARG 73 2HD ARG 73 2.505 -7.599 -3.999 586 HE ARG 73 HE ARG 73 -0.309 -6.947 -3.866 587 HH11 ARG 73 2HH1 ARG 73 2.133 -9.399 -3.486 588 HH12 ARG 73 1HH1 ARG 73 1.165 -10.386 -2.443 589 HH21 ARG 73 1HH2 ARG 73 -0.955 -9.725 -1.879 590 HH22 ARG 73 2HH2 ARG 73 -1.594 -8.238 -2.493 591 H PHE 74 H PHE 74 3.846 -2.738 -3.980 592 HA PHE 74 HA PHE 74 2.731 -2.456 -1.291 593 HB2 PHE 74 1HB PHE 74 3.628 -0.289 -3.208 594 HB3 PHE 74 2HB PHE 74 3.245 -0.093 -1.496 595 HD1 PHE 74 2HD PHE 74 4.629 -1.781 0.082 596 HD2 PHE 74 1HD PHE 74 5.866 -0.346 -3.729 597 HE1 PHE 74 2HE PHE 74 6.975 -2.213 0.684 598 HE2 PHE 74 1HE PHE 74 8.213 -0.777 -3.135 599 HZ PHE 74 HZ PHE 74 8.771 -1.712 -0.925 600 H VAL 75 H VAL 75 0.866 -1.128 -0.916 601 HA VAL 75 HA VAL 75 -0.825 -0.449 -3.169 602 HB VAL 75 HB VAL 75 -1.599 -2.602 -1.204 603 HG11 VAL 75 1HG1 VAL 75 -3.687 -1.846 -1.261 604 HG12 VAL 75 2HG1 VAL 75 -3.258 -0.589 -2.422 605 HG13 VAL 75 3HG1 VAL 75 -3.711 -2.196 -2.988 606 HG21 VAL 75 3HG2 VAL 75 -2.288 -3.622 -3.522 607 HG22 VAL 75 1HG2 VAL 75 -1.111 -2.464 -4.142 608 HG23 VAL 75 2HG2 VAL 75 -0.613 -3.688 -2.974 609 H VAL 76 H VAL 76 -1.871 1.378 -2.731 610 HA VAL 76 HA VAL 76 -2.178 2.164 0.092 611 HB VAL 76 HB VAL 76 -1.930 3.912 -2.360 612 HG11 VAL 76 1HG1 VAL 76 -3.355 4.521 -0.122 613 HG12 VAL 76 2HG1 VAL 76 -1.758 5.148 0.292 614 HG13 VAL 76 3HG1 VAL 76 -2.572 5.703 -1.171 615 HG21 VAL 76 3HG2 VAL 76 0.251 4.166 -1.888 616 HG22 VAL 76 1HG2 VAL 76 -0.032 4.210 -0.148 617 HG23 VAL 76 2HG2 VAL 76 0.065 2.661 -0.988 618 H TYR 77 H TYR 77 -4.202 1.373 0.530 619 HA TYR 77 HA TYR 77 -6.406 1.963 -1.274 620 HB2 TYR 77 1HB TYR 77 -6.132 -0.255 -0.086 621 HB3 TYR 77 2HB TYR 77 -6.530 0.587 1.414 622 HD1 TYR 77 2HD TYR 77 -8.041 1.040 -1.958 623 HD2 TYR 77 1HD TYR 77 -8.601 -0.285 2.046 624 HE1 TYR 77 2HE TYR 77 -10.442 0.739 -2.400 625 HE2 TYR 77 1HE TYR 77 -11.004 -0.592 1.615 626 HH TYR 77 HH TYR 77 -12.496 0.512 -1.332 627 H SER 78 H SER 78 -7.979 3.440 -0.931 628 HA SER 78 HA SER 78 -7.721 5.124 1.474 629 HB2 SER 78 1HB SER 78 -7.126 6.359 -0.538 630 HB3 SER 78 2HB SER 78 -8.651 5.881 -1.307 631 HG SER 78 HG SER 78 -8.163 7.891 0.469 632 H TYR 79 H TYR 79 -9.209 4.168 2.796 633 HA TYR 79 HA TYR 79 -11.845 3.487 1.825 634 HB2 TYR 79 1HB TYR 79 -10.913 2.017 3.462 635 HB3 TYR 79 2HB TYR 79 -10.557 3.359 4.552 636 HD1 TYR 79 1HD TYR 79 -13.256 1.259 3.191 637 HD2 TYR 79 2HD TYR 79 -12.238 4.304 5.982 638 HE1 TYR 79 1HE TYR 79 -15.428 0.955 4.304 639 HE2 TYR 79 2HE TYR 79 -14.407 4.008 7.105 640 HH TYR 79 HH TYR 79 -16.250 2.746 7.246 641 H LYS 80 H LYS 80 -13.784 4.254 3.073 642 HA LYS 80 HA LYS 80 -13.521 7.125 3.687 643 HB2 LYS 80 1HB LYS 80 -14.718 6.697 1.574 644 HB3 LYS 80 2HB LYS 80 -15.887 5.699 2.454 645 HG2 LYS 80 1HG LYS 80 -16.554 7.663 3.781 646 HG3 LYS 80 2HG LYS 80 -15.423 8.650 2.839 647 HD2 LYS 80 1HD LYS 80 -17.423 9.042 1.738 648 HD3 LYS 80 2HD LYS 80 -16.722 7.722 0.785 649 HE2 LYS 80 1HE LYS 80 -18.137 6.429 2.811 650 HE3 LYS 80 2HE LYS 80 -19.168 7.787 2.337 651 HZ1 LYS 80 3HZ LYS 80 -19.606 6.869 0.360 652 HZ2 LYS 80 1HZ LYS 80 -19.076 5.424 1.064 653 HZ3 LYS 80 2HZ LYS 80 -18.016 6.343 0.119 654 H TYR 81 H TYR 81 -13.732 7.440 5.799 655 HA TYR 81 HA TYR 81 -15.567 5.718 7.318 656 HB2 TYR 81 1HB TYR 81 -12.967 6.261 7.842 657 HB3 TYR 81 2HB TYR 81 -13.743 7.552 8.761 658 HD1 TYR 81 1HD TYR 81 -15.991 6.573 10.051 659 HD2 TYR 81 2HD TYR 81 -12.430 4.428 9.144 660 HE1 TYR 81 1HE TYR 81 -16.467 5.016 11.894 661 HE2 TYR 81 2HE TYR 81 -12.897 2.864 10.984 662 HH TYR 81 HH TYR 81 -15.905 3.017 12.809 663 H VAL 82 H VAL 82 -17.374 6.526 8.169 664 HA VAL 82 HA VAL 82 -17.880 9.394 7.874 665 HB VAL 82 HB VAL 82 -19.866 7.241 8.597 666 HG11 VAL 82 1HG1 VAL 82 -19.995 10.140 8.172 667 HG12 VAL 82 2HG1 VAL 82 -21.232 9.213 7.321 668 HG13 VAL 82 3HG1 VAL 82 -21.074 9.075 9.072 669 HG21 VAL 82 3HG2 VAL 82 -18.817 8.141 5.959 670 HG22 VAL 82 1HG2 VAL 82 -19.279 6.526 6.499 671 HG23 VAL 82 2HG2 VAL 82 -20.522 7.710 6.092 672 H HIS 83 H HIS 83 -18.800 10.629 9.576 673 HA HIS 83 HA HIS 83 -17.868 9.784 12.208 674 HB2 HIS 83 1HB HIS 83 -18.818 12.438 11.117 675 HB3 HIS 83 2HB HIS 83 -18.438 12.180 12.823 676 HD1 HIS 83 1HD HIS 83 -16.169 12.930 13.410 677 HD2 HIS 83 2HD HIS 83 -16.358 11.546 9.498 678 HE1 HIS 83 1HE HIS 83 -13.849 13.213 12.485 679 HE2 HIS 83 2HE HIS 83 -13.962 12.367 10.093 680 H ASP 84 H ASP 84 -20.509 12.017 11.862 681 HA ASP 84 HA ASP 84 -22.677 10.285 12.214 682 HB2 ASP 84 1HB ASP 84 -21.170 10.187 14.458 683 HB3 ASP 84 2HB ASP 84 -22.222 11.555 14.851 684 H ASP 85 H ASP 85 -21.333 13.402 13.237 685 HA ASP 85 HA ASP 85 -23.818 14.768 13.301 686 HB2 ASP 85 1HB ASP 85 -21.088 15.363 13.852 687 HB3 ASP 85 2HB ASP 85 -21.691 16.585 12.725 688 H GLY 86 H GLY 86 -22.091 13.531 10.737 689 HA2 GLY 86 1HA GLY 86 -23.250 13.731 8.564 690 HA3 GLY 86 2HA GLY 86 -23.347 15.458 8.880 691 H ARG 87 H ARG 87 -20.422 14.075 9.894 692 HA ARG 87 HA ARG 87 -19.084 15.149 7.503 693 HB2 ARG 87 1HB ARG 87 -18.097 14.842 10.348 694 HB3 ARG 87 2HB ARG 87 -17.083 15.360 8.993 695 HG2 ARG 87 1HG ARG 87 -19.590 16.818 9.810 696 HG3 ARG 87 2HG ARG 87 -17.983 17.196 10.457 697 HD2 ARG 87 1HD ARG 87 -17.160 17.871 8.352 698 HD3 ARG 87 2HD ARG 87 -18.515 17.113 7.503 699 HE ARG 87 HE ARG 87 -19.747 19.008 7.848 700 HH11 ARG 87 2HH1 ARG 87 -17.016 19.021 10.008 701 HH12 ARG 87 1HH1 ARG 87 -17.302 20.635 10.569 702 HH21 ARG 87 1HH2 ARG 87 -19.075 21.836 9.755 703 HH22 ARG 87 2HH2 ARG 87 -20.132 21.135 8.578 704 H VAL 88 H VAL 88 -17.809 13.869 6.298 705 HA VAL 88 HA VAL 88 -17.025 11.247 7.364 706 HB VAL 88 HB VAL 88 -18.907 10.645 6.086 707 HG11 VAL 88 1HG1 VAL 88 -19.515 11.515 3.979 708 HG12 VAL 88 2HG1 VAL 88 -19.035 12.909 4.949 709 HG13 VAL 88 3HG1 VAL 88 -17.930 12.252 3.740 710 HG21 VAL 88 3HG2 VAL 88 -16.594 10.350 4.176 711 HG22 VAL 88 1HG2 VAL 88 -16.819 9.361 5.618 712 HG23 VAL 88 2HG2 VAL 88 -18.007 9.305 4.317 713 H SER 89 H SER 89 -14.923 10.905 7.110 714 HA SER 89 HA SER 89 -13.519 12.343 4.953 715 HB2 SER 89 1HB SER 89 -12.368 11.495 7.628 716 HB3 SER 89 2HB SER 89 -11.561 12.461 6.380 717 HG SER 89 HG SER 89 -14.005 13.375 7.387 718 H TYR 90 H TYR 90 -11.647 11.274 4.050 719 HA TYR 90 HA TYR 90 -11.977 8.354 4.037 720 HB2 TYR 90 1HB TYR 90 -10.339 9.813 1.995 721 HB3 TYR 90 2HB TYR 90 -11.274 8.324 1.826 722 HD1 TYR 90 2HD TYR 90 -13.787 8.449 1.717 723 HD2 TYR 90 1HD TYR 90 -11.320 11.905 1.451 724 HE1 TYR 90 2HE TYR 90 -15.659 9.702 0.731 725 HE2 TYR 90 1HE TYR 90 -13.186 13.168 0.464 726 HH TYR 90 HH TYR 90 -16.396 11.721 0.103 727 HA PRO 91 HA PRO 91 -8.081 8.697 6.367 728 HB2 PRO 91 2HB PRO 91 -9.136 7.709 8.153 729 HB3 PRO 91 1HB PRO 91 -8.342 6.248 7.566 730 HG2 PRO 91 1HG PRO 91 -10.226 5.519 6.418 731 HG3 PRO 91 2HG PRO 91 -10.980 6.326 7.843 732 HD2 PRO 91 1HD PRO 91 -11.646 6.946 5.286 733 HD3 PRO 91 2HD PRO 91 -11.633 8.146 6.589 734 H LEU 92 H LEU 92 -6.692 8.552 4.599 735 HA LEU 92 HA LEU 92 -6.410 6.184 3.037 736 HB2 LEU 92 1HB LEU 92 -5.249 8.853 3.142 737 HB3 LEU 92 2HB LEU 92 -4.051 7.604 2.762 738 HG LEU 92 HG LEU 92 -6.274 7.088 1.113 739 HD11 LEU 92 1HD1 LEU 92 -6.392 9.246 -0.129 740 HD12 LEU 92 2HD1 LEU 92 -5.548 10.009 1.217 741 HD13 LEU 92 3HD1 LEU 92 -7.136 9.286 1.469 742 HD21 LEU 92 3HD2 LEU 92 -3.445 7.859 0.868 743 HD22 LEU 92 1HD2 LEU 92 -4.453 8.219 -0.534 744 HD23 LEU 92 2HD2 LEU 92 -4.347 6.566 0.074 745 H CYS 93 H CYS 93 -4.974 4.528 3.197 746 HA CYS 93 HA CYS 93 -3.002 4.601 5.367 747 HB2 CYS 93 1HB CYS 93 -5.027 2.416 4.869 748 HB3 CYS 93 2HB CYS 93 -3.622 2.231 5.932 749 HG CYS 93 HG CYS 93 -6.270 4.335 6.423 750 H PHE 94 H PHE 94 -1.304 2.992 5.150 751 HA PHE 94 HA PHE 94 -0.771 2.402 2.325 752 HB2 PHE 94 1HB PHE 94 0.877 3.805 3.520 753 HB3 PHE 94 2HB PHE 94 1.144 2.490 4.666 754 HD1 PHE 94 1HD PHE 94 1.440 3.365 1.079 755 HD2 PHE 94 2HD PHE 94 2.678 0.786 4.230 756 HE1 PHE 94 1HE PHE 94 3.172 2.414 -0.386 757 HE2 PHE 94 2HE PHE 94 4.413 -0.168 2.770 758 HZ PHE 94 HZ PHE 94 4.663 0.646 0.460 759 H ILE 95 H ILE 95 -1.582 0.434 1.868 760 HA ILE 95 HA ILE 95 -1.239 -1.756 3.764 761 HB ILE 95 HB ILE 95 -2.698 -1.670 1.121 762 HG12 ILE 95 1HG1 ILE 95 -3.695 -1.659 3.981 763 HG13 ILE 95 2HG1 ILE 95 -3.763 -0.301 2.845 764 HG21 ILE 95 1HG2 ILE 95 -3.127 -3.869 1.276 765 HG22 ILE 95 2HG2 ILE 95 -1.689 -3.896 2.296 766 HG23 ILE 95 3HG2 ILE 95 -3.290 -3.816 3.032 767 HD11 ILE 95 3HD1 ILE 95 -5.140 -2.909 2.302 768 HD12 ILE 95 1HD1 ILE 95 -5.907 -1.585 3.179 769 HD13 ILE 95 2HD1 ILE 95 -5.386 -1.354 1.509 770 H PHE 96 H PHE 96 0.799 -2.525 3.698 771 HA PHE 96 HA PHE 96 2.110 -2.939 1.127 772 HB2 PHE 96 1HB PHE 96 3.551 -1.958 2.725 773 HB3 PHE 96 2HB PHE 96 3.049 -3.087 3.984 774 HD1 PHE 96 1HD PHE 96 3.881 -4.105 0.548 775 HD2 PHE 96 2HD PHE 96 5.207 -3.873 4.586 776 HE1 PHE 96 1HE PHE 96 5.773 -5.583 0.008 777 HE2 PHE 96 2HE PHE 96 7.101 -5.350 4.053 778 HZ PHE 96 HZ PHE 96 7.387 -6.206 1.761 779 H SER 97 H SER 97 1.040 -4.678 0.231 780 HA SER 97 HA SER 97 0.630 -7.107 1.729 781 HB2 SER 97 1HB SER 97 -0.777 -6.099 -0.263 782 HB3 SER 97 2HB SER 97 0.394 -6.987 -1.254 783 HG SER 97 HG SER 97 -0.213 -8.889 -0.223 784 H SER 98 H SER 98 2.320 -8.346 2.201 785 HA SER 98 HA SER 98 4.199 -9.012 0.042 786 HB2 SER 98 1HB SER 98 4.950 -7.358 2.041 787 HB3 SER 98 2HB SER 98 5.306 -8.924 2.792 788 HG SER 98 HG SER 98 7.011 -9.019 1.587 789 HA PRO 99 HA PRO 99 2.553 -12.943 1.622 790 HB2 PRO 99 2HB PRO 99 1.608 -13.297 -0.442 791 HB3 PRO 99 1HB PRO 99 3.023 -14.316 -0.700 792 HG2 PRO 99 1HG PRO 99 4.185 -12.653 -1.834 793 HG3 PRO 99 2HG PRO 99 2.492 -12.308 -2.351 794 HD2 PRO 99 1HD PRO 99 4.099 -10.423 -1.240 795 HD3 PRO 99 2HD PRO 99 2.347 -10.462 -0.979 796 H VAL 100 H VAL 100 3.551 -15.138 1.719 797 HA VAL 100 HA VAL 100 6.470 -14.899 1.995 798 HB VAL 100 HB VAL 100 5.301 -15.409 4.082 799 HG11 VAL 100 1HG1 VAL 100 3.359 -16.531 3.650 800 HG12 VAL 100 2HG1 VAL 100 4.092 -17.553 2.413 801 HG13 VAL 100 3HG1 VAL 100 4.384 -17.886 4.121 802 HG21 VAL 100 3HG2 VAL 100 7.035 -16.655 4.721 803 HG22 VAL 100 1HG2 VAL 100 6.497 -18.021 3.743 804 HG23 VAL 100 2HG2 VAL 100 7.488 -16.754 3.020 805 H GLY 101 H GLY 101 4.613 -15.757 -0.354 806 HA2 GLY 101 1HA GLY 101 5.691 -18.443 -0.827 807 HA3 GLY 101 2HA GLY 101 4.412 -17.667 -1.749 808 H CYS 102 H CYS 102 6.298 -15.194 -1.672 809 HA CYS 102 HA CYS 102 7.481 -15.737 -4.237 810 HB2 CYS 102 1HB CYS 102 6.427 -13.528 -3.284 811 HB3 CYS 102 2HB CYS 102 8.068 -13.251 -2.678 812 HG CYS 102 HG CYS 102 7.909 -14.091 -5.925 813 H LYS 103 H LYS 103 9.812 -14.732 -4.520 814 HA LYS 103 HA LYS 103 11.559 -16.425 -3.003 815 HB2 LYS 103 1HB LYS 103 12.467 -14.253 -4.881 816 HB3 LYS 103 2HB LYS 103 13.250 -15.799 -4.514 817 HG2 LYS 103 1HG LYS 103 12.174 -16.850 -6.151 818 HG3 LYS 103 2HG LYS 103 10.614 -16.179 -5.646 819 HD2 LYS 103 1HD LYS 103 11.175 -15.488 -7.927 820 HD3 LYS 103 2HD LYS 103 11.109 -14.099 -6.828 821 HE2 LYS 103 1HE LYS 103 13.137 -13.533 -7.576 822 HE3 LYS 103 2HE LYS 103 13.748 -14.939 -6.691 823 HZ1 LYS 103 3HZ LYS 103 12.777 -15.951 -9.051 824 HZ2 LYS 103 1HZ LYS 103 14.404 -15.727 -8.642 825 HZ3 LYS 103 2HZ LYS 103 13.573 -14.527 -9.499 826 HA PRO 104 HA PRO 104 12.859 -13.653 0.146 827 HB2 PRO 104 2HB PRO 104 14.036 -15.414 1.035 828 HB3 PRO 104 1HB PRO 104 15.442 -14.480 0.525 829 HG2 PRO 104 1HG PRO 104 15.697 -15.679 -1.449 830 HG3 PRO 104 2HG PRO 104 15.095 -16.964 -0.337 831 HD2 PRO 104 1HD PRO 104 13.912 -16.414 -2.719 832 HD3 PRO 104 2HD PRO 104 12.999 -16.950 -1.297 833 H GLU 105 H GLU 105 14.275 -13.635 -2.957 834 HA GLU 105 HA GLU 105 16.172 -11.529 -2.466 835 HB2 GLU 105 1HB GLU 105 15.167 -12.974 -4.895 836 HB3 GLU 105 2HB GLU 105 16.083 -11.470 -5.083 837 HG2 GLU 105 1HG GLU 105 16.987 -14.094 -3.940 838 HG3 GLU 105 2HG GLU 105 17.678 -13.156 -5.272 839 H GLN 106 H GLN 106 12.842 -11.769 -3.448 840 HA GLN 106 HA GLN 106 12.736 -8.946 -4.178 841 HB2 GLN 106 1HB GLN 106 10.330 -10.734 -4.087 842 HB3 GLN 106 2HB GLN 106 10.678 -9.372 -5.166 843 HG2 GLN 106 1HG GLN 106 12.262 -11.923 -5.284 844 HG3 GLN 106 2HG GLN 106 10.737 -11.720 -6.156 845 HE21 GLN 106 2HE2 GLN 106 12.093 -9.103 -8.266 846 HE22 GLN 106 1HE2 GLN 106 10.719 -9.392 -7.259 847 H GLN 107 H GLN 107 10.956 -11.142 -2.000 848 HA GLN 107 HA GLN 107 9.366 -9.519 -0.605 849 HB2 GLN 107 1HB GLN 107 10.609 -11.996 -0.103 850 HB3 GLN 107 2HB GLN 107 10.865 -11.014 1.348 851 HG2 GLN 107 1HG GLN 107 8.181 -10.619 0.627 852 HG3 GLN 107 2HG GLN 107 8.493 -12.352 0.454 853 HE21 GLN 107 2HE2 GLN 107 9.053 -10.667 4.150 854 HE22 GLN 107 1HE2 GLN 107 9.433 -9.779 2.718 855 H MET 108 H MET 108 12.862 -9.508 -0.427 856 HA MET 108 HA MET 108 12.977 -7.706 1.808 857 HB2 MET 108 1HB MET 108 15.006 -8.822 -0.115 858 HB3 MET 108 2HB MET 108 15.436 -7.533 1.019 859 HG2 MET 108 1HG MET 108 14.345 -9.189 2.776 860 HG3 MET 108 2HG MET 108 14.781 -10.377 1.545 861 HE1 MET 108 3HE MET 108 18.515 -9.299 0.981 862 HE2 MET 108 1HE MET 108 17.813 -10.916 1.066 863 HE3 MET 108 2HE MET 108 16.980 -9.638 0.180 864 H MET 109 H MET 109 13.422 -7.438 -1.700 865 HA MET 109 HA MET 109 14.257 -4.852 -1.961 866 HB2 MET 109 1HB MET 109 12.319 -6.459 -3.621 867 HB3 MET 109 2HB MET 109 12.830 -4.831 -4.092 868 HG2 MET 109 1HG MET 109 15.111 -5.505 -4.298 869 HG3 MET 109 2HG MET 109 14.758 -7.076 -3.572 870 HE1 MET 109 3HE MET 109 14.260 -4.871 -6.914 871 HE2 MET 109 1HE MET 109 12.965 -5.833 -7.627 872 HE3 MET 109 2HE MET 109 12.712 -5.020 -6.083 873 H TYR 110 H TYR 110 11.041 -5.989 -1.147 874 HA TYR 110 HA TYR 110 9.977 -3.273 -1.198 875 HB2 TYR 110 1HB TYR 110 8.581 -5.869 -0.498 876 HB3 TYR 110 2HB TYR 110 7.810 -4.308 -0.785 877 HD1 TYR 110 2HD TYR 110 10.007 -6.778 -2.518 878 HD2 TYR 110 1HD TYR 110 6.984 -3.807 -2.892 879 HE1 TYR 110 2HE TYR 110 9.801 -7.298 -4.913 880 HE2 TYR 110 1HE TYR 110 6.768 -4.320 -5.287 881 HH TYR 110 HH TYR 110 8.440 -7.031 -6.744 882 H ALA 111 H ALA 111 10.831 -5.818 1.064 883 HA ALA 111 HA ALA 111 9.695 -4.636 3.373 884 HB1 ALA 111 3HB ALA 111 11.417 -6.908 2.765 885 HB2 ALA 111 1HB ALA 111 11.788 -6.144 4.311 886 HB3 ALA 111 2HB ALA 111 10.157 -6.734 3.986 887 H GLY 112 H GLY 112 12.590 -4.028 1.590 888 HA2 GLY 112 1HA GLY 112 13.737 -2.478 3.805 889 HA3 GLY 112 2HA GLY 112 14.576 -2.939 2.331 890 H SER 113 H SER 113 12.316 -2.098 0.634 891 HA SER 113 HA SER 113 12.965 0.750 0.600 892 HB2 SER 113 1HB SER 113 11.373 -0.746 -1.490 893 HB3 SER 113 2HB SER 113 12.288 0.760 -1.673 894 HG SER 113 HG SER 113 13.707 -1.491 -0.852 895 H LYS 114 H LYS 114 10.558 -1.237 1.765 896 HA LYS 114 HA LYS 114 8.161 -0.022 1.161 897 HB2 LYS 114 1HB LYS 114 7.943 -1.949 2.423 898 HB3 LYS 114 2HB LYS 114 9.183 -1.448 3.584 899 HG2 LYS 114 1HG LYS 114 7.663 0.199 4.542 900 HG3 LYS 114 2HG LYS 114 6.422 -0.264 3.363 901 HD2 LYS 114 1HD LYS 114 5.700 -1.743 4.874 902 HD3 LYS 114 2HD LYS 114 7.164 -2.671 4.509 903 HE2 LYS 114 1HE LYS 114 8.336 -1.788 6.351 904 HE3 LYS 114 2HE LYS 114 7.180 -0.462 6.541 905 HZ1 LYS 114 3HZ LYS 114 6.799 -2.068 8.247 906 HZ2 LYS 114 1HZ LYS 114 6.692 -3.331 7.124 907 HZ3 LYS 114 2HZ LYS 114 5.496 -2.136 7.171 908 H ASN 115 H ASN 115 10.342 0.797 3.859 909 HA ASN 115 HA ASN 115 8.866 2.963 4.836 910 HB2 ASN 115 1HB ASN 115 11.552 1.859 5.200 911 HB3 ASN 115 2HB ASN 115 11.498 3.617 5.384 912 HD21 ASN 115 2HD2 ASN 115 10.116 1.229 8.279 913 HD22 ASN 115 1HD2 ASN 115 10.916 0.652 6.860 914 H ARG 116 H ARG 116 11.431 2.821 2.403 915 HA ARG 116 HA ARG 116 11.842 5.528 1.990 916 HB2 ARG 116 1HB ARG 116 13.253 3.842 0.966 917 HB3 ARG 116 2HB ARG 116 11.897 3.274 -0.020 918 HG2 ARG 116 1HG ARG 116 13.270 4.588 -1.435 919 HG3 ARG 116 2HG ARG 116 11.826 5.546 -1.074 920 HD2 ARG 116 1HD ARG 116 13.454 7.132 -0.735 921 HD3 ARG 116 2HD ARG 116 13.305 6.460 0.894 922 HE ARG 116 HE ARG 116 15.533 6.109 -0.939 923 HH11 ARG 116 2HH1 ARG 116 13.991 5.191 2.044 924 HH12 ARG 116 1HH1 ARG 116 15.431 4.519 2.733 925 HH21 ARG 116 1HH2 ARG 116 17.390 4.541 1.545 926 HH22 ARG 116 2HH2 ARG 116 17.436 5.228 -0.043 927 H LEU 117 H LEU 117 9.629 3.408 0.163 928 HA LEU 117 HA LEU 117 8.438 5.425 -1.363 929 HB2 LEU 117 1HB LEU 117 8.171 3.148 -2.011 930 HB3 LEU 117 2HB LEU 117 7.423 2.742 -0.457 931 HG LEU 117 HG LEU 117 5.566 4.403 -1.213 932 HD11 LEU 117 1HD1 LEU 117 6.246 5.395 -3.146 933 HD12 LEU 117 2HD1 LEU 117 5.398 4.004 -3.822 934 HD13 LEU 117 3HD1 LEU 117 7.156 3.984 -3.685 935 HD21 LEU 117 3HD2 LEU 117 5.922 1.675 -2.449 936 HD22 LEU 117 1HD2 LEU 117 4.400 2.561 -2.353 937 HD23 LEU 117 2HD2 LEU 117 5.206 2.032 -0.877 938 H VAL 118 H VAL 118 7.120 3.809 1.535 939 HA VAL 118 HA VAL 118 4.839 5.229 1.933 940 HB VAL 118 HB VAL 118 6.793 4.406 4.084 941 HG11 VAL 118 1HG1 VAL 118 3.897 4.532 4.638 942 HG12 VAL 118 2HG1 VAL 118 5.272 4.915 5.676 943 HG13 VAL 118 3HG1 VAL 118 4.726 6.080 4.469 944 HG21 VAL 118 3HG2 VAL 118 4.368 2.824 3.632 945 HG22 VAL 118 1HG2 VAL 118 5.520 2.792 2.298 946 HG23 VAL 118 2HG2 VAL 118 6.028 2.301 3.914 947 H GLN 119 H GLN 119 8.038 6.170 3.197 948 HA GLN 119 HA GLN 119 7.308 8.567 4.380 949 HB2 GLN 119 1HB GLN 119 9.814 7.381 3.353 950 HB3 GLN 119 2HB GLN 119 9.811 9.145 3.507 951 HG2 GLN 119 1HG GLN 119 8.703 7.830 5.854 952 HG3 GLN 119 2HG GLN 119 10.366 7.332 5.504 953 HE21 GLN 119 2HE2 GLN 119 11.492 10.097 7.242 954 HE22 GLN 119 1HE2 GLN 119 11.474 8.383 7.037 955 H THR 120 H THR 120 7.943 7.827 1.016 956 HA THR 120 HA THR 120 8.145 10.479 0.066 957 HB THR 120 HB THR 120 7.050 8.197 -1.567 958 HG1 THR 120 1HG THR 120 9.677 8.634 -0.613 959 HG21 THR 120 3HG2 THR 120 8.811 9.517 -3.128 960 HG22 THR 120 1HG2 THR 120 8.276 10.834 -2.085 961 HG23 THR 120 2HG2 THR 120 7.097 9.924 -3.031 962 H ALA 121 H ALA 121 5.397 8.253 0.339 963 HA ALA 121 HA ALA 121 3.517 10.089 -0.787 964 HB1 ALA 121 3HB ALA 121 1.909 8.455 -0.440 965 HB2 ALA 121 1HB ALA 121 3.385 7.511 -0.639 966 HB3 ALA 121 2HB ALA 121 2.734 7.800 0.974 967 H GLU 122 H GLU 122 4.805 9.531 2.376 968 HA GLU 122 HA GLU 122 4.616 10.775 4.287 969 HB2 GLU 122 1HB GLU 122 3.834 12.559 2.367 970 HB3 GLU 122 2HB GLU 122 2.397 12.487 3.397 971 HG2 GLU 122 1HG GLU 122 5.200 13.131 4.312 972 HG3 GLU 122 2HG GLU 122 3.883 14.289 4.073 973 H LEU 123 H LEU 123 3.146 8.394 3.814 974 HA LEU 123 HA LEU 123 0.491 8.793 4.898 975 HB2 LEU 123 1HB LEU 123 2.015 6.261 4.263 976 HB3 LEU 123 2HB LEU 123 0.310 6.346 4.741 977 HG LEU 123 HG LEU 123 1.209 7.826 2.308 978 HD11 LEU 123 1HD1 LEU 123 0.280 5.039 1.952 979 HD12 LEU 123 2HD1 LEU 123 1.952 5.271 2.464 980 HD13 LEU 123 3HD1 LEU 123 1.378 6.008 0.968 981 HD21 LEU 123 3HD2 LEU 123 -0.977 8.221 2.270 982 HD22 LEU 123 1HD2 LEU 123 -1.263 7.092 3.595 983 HD23 LEU 123 2HD2 LEU 123 -1.221 6.507 1.931 984 H THR 124 H THR 124 0.275 9.178 6.999 985 HA THR 124 HA THR 124 2.230 8.483 8.943 986 HB THR 124 HB THR 124 0.876 10.415 9.359 987 HG1 THR 124 1HG THR 124 0.647 9.984 11.440 988 HG21 THR 124 3HG2 THR 124 -1.389 8.524 8.897 989 HG22 THR 124 1HG2 THR 124 -1.147 10.158 8.281 990 HG23 THR 124 2HG2 THR 124 -1.628 9.912 9.960 991 H LYS 125 H LYS 125 -0.401 6.796 7.553 992 HA LYS 125 HA LYS 125 -0.397 4.827 9.737 993 HB2 LYS 125 1HB LYS 125 -2.376 5.098 7.464 994 HB3 LYS 125 2HB LYS 125 -2.521 4.042 8.879 995 HG2 LYS 125 1HG LYS 125 -2.180 6.600 9.940 996 HG3 LYS 125 2HG LYS 125 -3.279 6.804 8.564 997 HD2 LYS 125 1HD LYS 125 -4.576 4.807 9.509 998 HD3 LYS 125 2HD LYS 125 -3.626 5.056 10.985 999 HE2 LYS 125 1HE LYS 125 -4.421 7.549 10.726 1000 HE3 LYS 125 2HE LYS 125 -5.698 6.812 9.745 1001 HZ1 LYS 125 3HZ LYS 125 -6.679 5.919 11.536 1002 HZ2 LYS 125 1HZ LYS 125 -5.824 7.097 12.399 1003 HZ3 LYS 125 2HZ LYS 125 -5.220 5.521 12.291 1004 H VAL 126 H VAL 126 0.755 3.048 9.439 1005 HA VAL 126 HA VAL 126 1.143 2.064 6.686 1006 HB VAL 126 HB VAL 126 3.156 1.602 8.867 1007 HG11 VAL 126 1HG1 VAL 126 3.902 1.877 6.024 1008 HG12 VAL 126 2HG1 VAL 126 4.472 0.737 7.244 1009 HG13 VAL 126 3HG1 VAL 126 2.923 0.471 6.442 1010 HG21 VAL 126 3HG2 VAL 126 2.911 4.013 8.707 1011 HG22 VAL 126 1HG2 VAL 126 4.442 3.508 7.991 1012 HG23 VAL 126 2HG2 VAL 126 3.081 3.934 6.953 1013 H PHE 127 H PHE 127 -0.016 0.271 6.449 1014 HA PHE 127 HA PHE 127 -0.035 -1.681 8.657 1015 HB2 PHE 127 1HB PHE 127 -2.208 -1.224 6.595 1016 HB3 PHE 127 2HB PHE 127 -2.255 -2.392 7.915 1017 HD1 PHE 127 1HD PHE 127 -1.002 -0.582 10.030 1018 HD2 PHE 127 2HD PHE 127 -4.141 0.018 7.218 1019 HE1 PHE 127 1HE PHE 127 -2.009 1.099 11.518 1020 HE2 PHE 127 2HE PHE 127 -5.152 1.701 8.701 1021 HZ PHE 127 HZ PHE 127 -4.085 2.244 10.854 1022 H GLU 128 H GLU 128 0.711 -3.660 8.220 1023 HA GLU 128 HA GLU 128 1.223 -4.339 5.400 1024 HB2 GLU 128 1HB GLU 128 3.289 -4.050 6.628 1025 HB3 GLU 128 2HB GLU 128 2.727 -5.158 7.889 1026 HG2 GLU 128 1HG GLU 128 2.594 -6.927 6.052 1027 HG3 GLU 128 2HG GLU 128 3.546 -5.797 5.078 1028 H ILE 129 H ILE 129 0.526 -6.258 4.605 1029 HA ILE 129 HA ILE 129 -0.943 -8.012 6.466 1030 HB ILE 129 HB ILE 129 -2.323 -8.667 4.471 1031 HG12 ILE 129 1HG1 ILE 129 -0.847 -6.310 3.286 1032 HG13 ILE 129 2HG1 ILE 129 -0.921 -7.965 2.659 1033 HG21 ILE 129 1HG2 ILE 129 -2.945 -6.964 6.259 1034 HG22 ILE 129 2HG2 ILE 129 -2.565 -5.732 5.057 1035 HG23 ILE 129 3HG2 ILE 129 -3.848 -6.901 4.745 1036 HD11 ILE 129 3HD1 ILE 129 -2.327 -6.637 1.293 1037 HD12 ILE 129 1HD1 ILE 129 -3.373 -7.636 2.302 1038 HD13 ILE 129 2HD1 ILE 129 -3.132 -5.934 2.696 1039 H ARG 130 H ARG 130 0.056 -9.882 6.765 1040 HA ARG 130 HA ARG 130 2.227 -10.849 5.359 1041 HB2 ARG 130 1HB ARG 130 1.774 -11.752 7.505 1042 HB3 ARG 130 2HB ARG 130 0.155 -12.276 7.018 1043 HG2 ARG 130 1HG ARG 130 1.543 -14.210 7.158 1044 HG3 ARG 130 2HG ARG 130 1.211 -13.888 5.448 1045 HD2 ARG 130 1HD ARG 130 3.456 -14.203 5.270 1046 HD3 ARG 130 2HD ARG 130 3.467 -12.485 5.690 1047 HE ARG 130 HE ARG 130 4.480 -13.025 7.661 1048 HH11 ARG 130 2HH1 ARG 130 2.939 -15.873 6.384 1049 HH12 ARG 130 1HH1 ARG 130 3.585 -16.926 7.598 1050 HH21 ARG 130 1HH2 ARG 130 4.949 -16.089 9.237 1051 HH22 ARG 130 2HH2 ARG 130 5.337 -14.402 9.265 1052 H THR 131 H THR 131 -1.178 -11.196 4.679 1053 HA THR 131 HA THR 131 -0.554 -12.244 2.048 1054 HB THR 131 HB THR 131 -0.747 -14.352 3.074 1055 HG1 THR 131 1HG THR 131 -2.897 -15.062 2.325 1056 HG21 THR 131 3HG2 THR 131 -1.733 -13.371 5.209 1057 HG22 THR 131 1HG2 THR 131 -2.303 -14.971 4.736 1058 HG23 THR 131 2HG2 THR 131 -3.308 -13.554 4.437 1059 H THR 132 H THR 132 -2.196 -11.919 0.536 1060 HA THR 132 HA THR 132 -3.749 -9.690 0.710 1061 HB THR 132 HB THR 132 -5.224 -10.761 -1.074 1062 HG1 THR 132 1HG THR 132 -4.090 -12.741 -1.918 1063 HG21 THR 132 3HG2 THR 132 -3.004 -9.458 -1.375 1064 HG22 THR 132 1HG2 THR 132 -3.640 -10.382 -2.734 1065 HG23 THR 132 2HG2 THR 132 -2.321 -11.036 -1.763 1066 H ASP 133 H ASP 133 -4.831 -13.017 1.364 1067 HA ASP 133 HA ASP 133 -7.454 -12.769 1.860 1068 HB2 ASP 133 1HB ASP 133 -5.303 -14.345 3.172 1069 HB3 ASP 133 2HB ASP 133 -6.854 -14.265 4.017 1070 H ASP 134 H ASP 134 -4.909 -11.345 3.758 1071 HA ASP 134 HA ASP 134 -6.418 -10.710 6.061 1072 HB2 ASP 134 1HB ASP 134 -3.793 -10.558 5.439 1073 HB3 ASP 134 2HB ASP 134 -4.248 -8.857 5.260 1074 H LEU 135 H LEU 135 -5.648 -8.839 3.141 1075 HA LEU 135 HA LEU 135 -6.834 -6.435 3.800 1076 HB2 LEU 135 1HB LEU 135 -5.578 -6.522 1.817 1077 HB3 LEU 135 2HB LEU 135 -6.535 -7.873 1.184 1078 HG LEU 135 HG LEU 135 -8.324 -6.474 0.585 1079 HD11 LEU 135 1HD1 LEU 135 -7.900 -3.896 1.239 1080 HD12 LEU 135 2HD1 LEU 135 -7.198 -4.697 2.645 1081 HD13 LEU 135 3HD1 LEU 135 -8.876 -5.006 2.201 1082 HD21 LEU 135 3HD2 LEU 135 -6.942 -6.033 -1.141 1083 HD22 LEU 135 1HD2 LEU 135 -5.614 -5.536 -0.092 1084 HD23 LEU 135 2HD2 LEU 135 -6.927 -4.412 -0.444 1085 H THR 136 H THR 136 -8.696 -6.883 5.050 1086 HA THR 136 HA THR 136 -11.050 -7.599 3.430 1087 HB THR 136 HB THR 136 -11.961 -8.297 5.828 1088 HG1 THR 136 1HG THR 136 -10.407 -8.467 7.242 1089 HG21 THR 136 3HG2 THR 136 -11.777 -9.698 3.757 1090 HG22 THR 136 1HG2 THR 136 -11.541 -10.584 5.262 1091 HG23 THR 136 2HG2 THR 136 -10.150 -10.141 4.273 1092 H GLU 137 H GLU 137 -12.945 -6.452 3.820 1093 HA GLU 137 HA GLU 137 -12.845 -3.789 4.314 1094 HB2 GLU 137 1HB GLU 137 -14.815 -4.978 3.418 1095 HB3 GLU 137 2HB GLU 137 -15.163 -5.587 5.044 1096 HG2 GLU 137 1HG GLU 137 -15.110 -3.000 5.629 1097 HG3 GLU 137 2HG GLU 137 -15.534 -2.873 3.916 1098 H THR 138 H THR 138 -13.471 -6.309 6.730 1099 HA THR 138 HA THR 138 -13.794 -4.524 8.912 1100 HB THR 138 HB THR 138 -12.941 -7.421 9.039 1101 HG1 THR 138 1HG THR 138 -15.054 -6.660 7.908 1102 HG21 THR 138 3HG2 THR 138 -12.897 -5.760 11.087 1103 HG22 THR 138 1HG2 THR 138 -13.506 -7.404 11.266 1104 HG23 THR 138 2HG2 THR 138 -14.634 -6.060 11.081 1105 H TRP 139 H TRP 139 -11.108 -6.769 8.203 1106 HA TRP 139 HA TRP 139 -9.306 -6.009 10.084 1107 HB2 TRP 139 1HB TRP 139 -8.657 -7.785 8.695 1108 HB3 TRP 139 2HB TRP 139 -8.921 -6.847 7.224 1109 HD1 TRP 139 HD TRP 139 -6.300 -7.489 9.907 1110 HE1 TRP 139 1HE TRP 139 -4.073 -6.431 9.169 1111 HE3 TRP 139 3HE TRP 139 -7.949 -4.892 5.824 1112 HZ2 TRP 139 2HZ TRP 139 -3.138 -4.722 7.126 1113 HZ3 TRP 139 3HZ TRP 139 -6.324 -3.570 4.532 1114 HH2 TRP 139 HH TRP 139 -3.970 -3.488 5.172 1115 H LEU 140 H LEU 140 -10.378 -4.138 7.382 1116 HA LEU 140 HA LEU 140 -8.201 -2.240 7.534 1117 HB2 LEU 140 1HB LEU 140 -9.060 -2.550 5.368 1118 HB3 LEU 140 2HB LEU 140 -10.733 -2.408 5.933 1119 HG LEU 140 HG LEU 140 -10.595 -0.067 6.103 1120 HD11 LEU 140 1HD1 LEU 140 -8.630 1.219 6.123 1121 HD12 LEU 140 2HD1 LEU 140 -7.644 -0.125 5.546 1122 HD13 LEU 140 3HD1 LEU 140 -8.298 -0.152 7.183 1123 HD21 LEU 140 3HD2 LEU 140 -9.229 0.412 3.810 1124 HD22 LEU 140 1HD2 LEU 140 -10.882 -0.202 3.879 1125 HD23 LEU 140 2HD2 LEU 140 -9.533 -1.320 3.667 1126 H LYS 141 H LYS 141 -11.737 -1.933 7.908 1127 HA LYS 141 HA LYS 141 -11.751 0.587 9.069 1128 HB2 LYS 141 1HB LYS 141 -13.620 -1.707 8.943 1129 HB3 LYS 141 2HB LYS 141 -13.912 -0.545 10.248 1130 HG2 LYS 141 1HG LYS 141 -14.554 1.111 8.838 1131 HG3 LYS 141 2HG LYS 141 -13.462 0.574 7.549 1132 HD2 LYS 141 1HD LYS 141 -15.314 -0.196 6.543 1133 HD3 LYS 141 2HD LYS 141 -15.213 -1.522 7.715 1134 HE2 LYS 141 1HE LYS 141 -16.559 0.947 8.654 1135 HE3 LYS 141 2HE LYS 141 -17.394 0.025 7.396 1136 HZ1 LYS 141 3HZ LYS 141 -16.500 -1.814 9.274 1137 HZ2 LYS 141 1HZ LYS 141 -18.096 -1.346 8.966 1138 HZ3 LYS 141 2HZ LYS 141 -17.192 -0.543 10.149 1139 H GLU 142 H GLU 142 -10.758 -2.409 10.399 1140 HA GLU 142 HA GLU 142 -11.232 -1.915 13.138 1141 HB2 GLU 142 1HB GLU 142 -9.562 -3.782 11.546 1142 HB3 GLU 142 2HB GLU 142 -9.068 -3.516 13.225 1143 HG2 GLU 142 1HG GLU 142 -11.698 -3.929 13.598 1144 HG3 GLU 142 2HG GLU 142 -11.431 -4.904 12.145 1145 H LYS 143 H LYS 143 -8.222 -1.600 11.246 1146 HA LYS 143 HA LYS 143 -6.691 -0.421 13.265 1147 HB2 LYS 143 1HB LYS 143 -6.423 0.062 10.290 1148 HB3 LYS 143 2HB LYS 143 -5.158 0.239 11.515 1149 HG2 LYS 143 1HG LYS 143 -6.269 -2.417 11.608 1150 HG3 LYS 143 2HG LYS 143 -5.725 -2.016 9.969 1151 HD2 LYS 143 1HD LYS 143 -3.629 -1.067 11.363 1152 HD3 LYS 143 2HD LYS 143 -4.161 -2.355 12.458 1153 HE2 LYS 143 1HE LYS 143 -3.921 -4.024 10.768 1154 HE3 LYS 143 2HE LYS 143 -3.696 -2.793 9.515 1155 HZ1 LYS 143 3HZ LYS 143 -1.663 -2.122 10.922 1156 HZ2 LYS 143 1HZ LYS 143 -1.556 -3.494 9.939 1157 HZ3 LYS 143 2HZ LYS 143 -1.809 -3.665 11.602 1158 H LEU 144 H LEU 144 -8.768 1.029 10.801 1159 HA LEU 144 HA LEU 144 -8.103 3.719 11.357 1160 HB2 LEU 144 1HB LEU 144 -10.748 2.737 10.293 1161 HB3 LEU 144 2HB LEU 144 -9.979 4.311 10.027 1162 HG LEU 144 HG LEU 144 -8.877 1.712 8.969 1163 HD11 LEU 144 1HD1 LEU 144 -10.972 3.516 7.934 1164 HD12 LEU 144 2HD1 LEU 144 -10.708 1.796 7.649 1165 HD13 LEU 144 3HD1 LEU 144 -9.745 2.992 6.781 1166 HD21 LEU 144 3HD2 LEU 144 -7.981 4.490 8.997 1167 HD22 LEU 144 1HD2 LEU 144 -8.000 3.769 7.389 1168 HD23 LEU 144 2HD2 LEU 144 -7.077 3.008 8.684 1169 H ALA 145 H ALA 145 -10.822 1.687 12.421 1170 HA ALA 145 HA ALA 145 -12.372 3.333 13.855 1171 HB1 ALA 145 3HB ALA 145 -11.720 1.059 15.524 1172 HB2 ALA 145 1HB ALA 145 -13.224 1.456 14.692 1173 HB3 ALA 145 2HB ALA 145 -11.942 0.597 13.836 1174 H SER 146 H SER 146 -9.629 1.701 15.453 1175 HA SER 146 HA SER 146 -9.379 4.062 17.200 1176 HB2 SER 146 1HB SER 146 -8.757 1.156 17.819 1177 HB3 SER 146 2HB SER 146 -8.468 2.518 18.916 1178 HG SER 146 HG SER 146 -10.537 2.628 19.354 1179 H GLY 147 H GLY 147 -8.093 4.108 14.776 1180 HA2 GLY 147 1HA GLY 147 -6.026 4.249 13.762 1181 HA3 GLY 147 2HA GLY 147 -5.525 4.835 15.341 1182 HA PRO 148 HA PRO 148 -2.954 1.129 14.489 1183 HB2 PRO 148 2HB PRO 148 -1.163 2.482 13.997 1184 HB3 PRO 148 1HB PRO 148 -0.702 2.151 15.667 1185 HG2 PRO 148 1HG PRO 148 -1.618 4.134 16.459 1186 HG3 PRO 148 2HG PRO 148 -1.030 4.648 14.833 1187 HD2 PRO 148 1HD PRO 148 -3.591 5.024 15.653 1188 HD3 PRO 148 2HD PRO 148 -3.167 4.685 13.966 1189 H SER 149 H SER 149 -3.422 -0.487 15.841 1190 HA SER 149 HA SER 149 -3.363 0.013 18.736 1191 HB2 SER 149 1HB SER 149 -4.838 -1.939 16.994 1192 HB3 SER 149 2HB SER 149 -4.527 -2.346 18.691 1193 HG SER 149 HG SER 149 -6.553 -1.207 18.241 1194 H SER 150 H SER 150 -2.362 -2.390 16.313 1195 HA SER 150 HA SER 150 -0.614 -3.690 18.229 1196 HB2 SER 150 1HB SER 150 -1.897 -5.048 16.614 1197 HB3 SER 150 2HB SER 150 -1.039 -4.251 15.283 1198 HG SER 150 HG SER 150 0.244 -5.923 15.560 1199 H GLY 151 H GLY 151 0.873 -2.006 18.657 1200 HA2 GLY 151 1HA GLY 151 3.172 -2.028 16.997 1201 HA3 GLY 151 2HA GLY 151 2.292 -0.522 16.784 Start of MODEL 19 1 H1 GLY 1 H GLY 1 10.333 -17.911 23.182 2 HA2 GLY 1 1HA GLY 1 7.531 -18.555 22.599 3 HA3 GLY 1 2HA GLY 1 7.906 -16.944 23.195 4 H SER 2 H SER 2 8.031 -15.472 21.653 5 HA SER 2 HA SER 2 9.212 -16.235 19.068 6 HB2 SER 2 1HB SER 2 6.828 -16.172 18.699 7 HB3 SER 2 2HB SER 2 6.702 -14.606 19.520 8 HG SER 2 HG SER 2 8.065 -15.126 17.083 9 H SER 3 H SER 3 10.801 -14.938 18.423 10 HA SER 3 HA SER 3 10.922 -12.202 19.499 11 HB2 SER 3 1HB SER 3 12.894 -14.390 19.758 12 HB3 SER 3 2HB SER 3 13.564 -12.828 19.256 13 HG SER 3 HG SER 3 13.114 -13.467 21.667 14 H GLY 4 H GLY 4 10.911 -10.778 17.899 15 HA2 GLY 4 1HA GLY 4 11.558 -11.612 15.195 16 HA3 GLY 4 2HA GLY 4 10.887 -10.062 15.678 17 H SER 5 H SER 5 13.846 -11.966 15.501 18 HA SER 5 HA SER 5 15.359 -9.553 14.969 19 HB2 SER 5 1HB SER 5 15.360 -9.795 17.471 20 HB3 SER 5 2HB SER 5 16.192 -11.346 17.260 21 HG SER 5 HG SER 5 17.388 -9.129 17.513 22 H SER 6 H SER 6 17.350 -9.942 13.953 23 HA SER 6 HA SER 6 18.368 -12.588 13.575 24 HB2 SER 6 1HB SER 6 16.276 -11.865 11.869 25 HB3 SER 6 2HB SER 6 17.743 -11.598 10.912 26 HG SER 6 HG SER 6 18.218 -13.690 10.995 27 H GLY 7 H GLY 7 20.147 -12.558 11.839 28 HA2 GLY 7 1HA GLY 7 21.679 -10.091 12.250 29 HA3 GLY 7 2HA GLY 7 22.341 -11.651 11.783 30 H SER 8 H SER 8 20.554 -8.842 10.645 31 HA SER 8 HA SER 8 20.749 -9.687 7.879 32 HB2 SER 8 1HB SER 8 19.468 -7.407 9.337 33 HB3 SER 8 2HB SER 8 19.813 -7.224 7.608 34 HG SER 8 HG SER 8 17.746 -8.089 7.898 35 H ASP 9 H ASP 9 21.825 -8.463 6.244 36 HA ASP 9 HA ASP 9 23.957 -6.683 7.203 37 HB2 ASP 9 1HB ASP 9 24.842 -9.004 6.877 38 HB3 ASP 9 2HB ASP 9 24.392 -8.880 5.171 39 H SER 10 H SER 10 22.814 -4.913 6.393 40 HA SER 10 HA SER 10 22.135 -3.379 4.854 41 HB2 SER 10 1HB SER 10 24.611 -3.867 4.211 42 HB3 SER 10 2HB SER 10 23.905 -4.713 2.823 43 HG SER 10 HG SER 10 23.460 -1.998 3.526 44 H LEU 11 H LEU 11 21.049 -3.070 2.718 45 HA LEU 11 HA LEU 11 19.829 -5.517 1.666 46 HB2 LEU 11 1HB LEU 11 18.253 -3.059 2.450 47 HB3 LEU 11 2HB LEU 11 17.612 -4.555 1.747 48 HG LEU 11 HG LEU 11 19.040 -4.689 4.364 49 HD11 LEU 11 1HD1 LEU 11 16.578 -4.425 5.274 50 HD12 LEU 11 2HD1 LEU 11 16.416 -3.394 3.852 51 HD13 LEU 11 3HD1 LEU 11 17.641 -3.032 5.068 52 HD21 LEU 11 3HD2 LEU 11 17.635 -6.571 4.722 53 HD22 LEU 11 1HD2 LEU 11 18.257 -6.700 3.077 54 HD23 LEU 11 2HD2 LEU 11 16.606 -6.145 3.354 55 H VAL 12 H VAL 12 18.094 -4.503 -0.129 56 HA VAL 12 HA VAL 12 19.861 -3.018 -1.951 57 HB VAL 12 HB VAL 12 19.052 -5.270 -2.678 58 HG11 VAL 12 1HG1 VAL 12 16.855 -5.795 -2.964 59 HG12 VAL 12 2HG1 VAL 12 16.693 -4.655 -1.627 60 HG13 VAL 12 3HG1 VAL 12 16.382 -4.127 -3.282 61 HG21 VAL 12 3HG2 VAL 12 18.892 -2.764 -4.142 62 HG22 VAL 12 1HG2 VAL 12 19.600 -4.307 -4.616 63 HG23 VAL 12 2HG2 VAL 12 17.875 -4.024 -4.841 64 H VAL 13 H VAL 13 18.617 -1.464 -0.071 65 HA VAL 13 HA VAL 13 16.156 -0.424 -0.375 66 HB VAL 13 HB VAL 13 18.683 1.212 -0.118 67 HG11 VAL 13 1HG1 VAL 13 17.275 2.933 -0.421 68 HG12 VAL 13 2HG1 VAL 13 15.842 1.940 -0.147 69 HG13 VAL 13 3HG1 VAL 13 16.751 2.575 1.225 70 HG21 VAL 13 3HG2 VAL 13 17.968 1.172 2.333 71 HG22 VAL 13 1HG2 VAL 13 16.912 -0.166 1.879 72 HG23 VAL 13 2HG2 VAL 13 18.658 -0.310 1.672 73 H CYS 14 H CYS 14 14.983 0.630 -1.860 74 HA CYS 14 HA CYS 14 16.348 1.457 -4.338 75 HB2 CYS 14 1HB CYS 14 13.445 0.675 -4.064 76 HB3 CYS 14 2HB CYS 14 14.360 0.906 -5.563 77 HG CYS 14 HG CYS 14 15.409 -1.461 -5.746 78 H GLU 15 H GLU 15 15.403 3.282 -5.487 79 HA GLU 15 HA GLU 15 14.666 5.385 -3.634 80 HB2 GLU 15 1HB GLU 15 15.831 5.206 -6.312 81 HB3 GLU 15 2HB GLU 15 14.628 6.496 -6.163 82 HG2 GLU 15 1HG GLU 15 16.463 6.441 -3.910 83 HG3 GLU 15 2HG GLU 15 17.288 6.648 -5.461 84 H VAL 16 H VAL 16 12.994 7.026 -4.534 85 HA VAL 16 HA VAL 16 10.559 5.501 -5.128 86 HB VAL 16 HB VAL 16 10.272 6.750 -3.144 87 HG11 VAL 16 1HG1 VAL 16 10.712 9.173 -3.005 88 HG12 VAL 16 2HG1 VAL 16 12.171 8.239 -3.338 89 HG13 VAL 16 3HG1 VAL 16 11.376 9.127 -4.637 90 HG21 VAL 16 3HG2 VAL 16 8.998 8.765 -4.863 91 HG22 VAL 16 1HG2 VAL 16 8.633 7.089 -5.276 92 HG23 VAL 16 2HG2 VAL 16 8.293 7.693 -3.654 93 H ASP 17 H ASP 17 10.473 5.347 -7.321 94 HA ASP 17 HA ASP 17 11.302 6.883 -9.326 95 HB2 ASP 17 1HB ASP 17 9.791 4.823 -9.438 96 HB3 ASP 17 2HB ASP 17 8.434 5.951 -9.318 97 HA PRO 18 HA PRO 18 9.680 10.954 -8.868 98 HB2 PRO 18 2HB PRO 18 11.380 11.619 -10.264 99 HB3 PRO 18 1HB PRO 18 10.076 11.842 -11.429 100 HG2 PRO 18 1HG PRO 18 10.437 9.781 -12.439 101 HG3 PRO 18 2HG PRO 18 12.121 10.247 -11.990 102 HD2 PRO 18 1HD PRO 18 11.011 7.880 -11.259 103 HD3 PRO 18 2HD PRO 18 12.174 8.747 -10.241 104 H GLU 19 H GLU 19 8.593 8.975 -11.601 105 HA GLU 19 HA GLU 19 6.313 10.534 -12.219 106 HB2 GLU 19 1HB GLU 19 5.813 8.943 -13.795 107 HB3 GLU 19 2HB GLU 19 7.539 8.627 -13.560 108 HG2 GLU 19 1HG GLU 19 6.956 6.502 -13.255 109 HG3 GLU 19 2HG GLU 19 6.388 7.026 -11.663 110 H LEU 20 H LEU 20 6.952 8.090 -9.846 111 HA LEU 20 HA LEU 20 4.146 7.643 -9.265 112 HB2 LEU 20 1HB LEU 20 6.221 6.002 -9.073 113 HB3 LEU 20 2HB LEU 20 6.314 6.715 -7.453 114 HG LEU 20 HG LEU 20 3.860 5.348 -8.550 115 HD11 LEU 20 1HD1 LEU 20 4.620 3.358 -7.880 116 HD12 LEU 20 2HD1 LEU 20 5.345 4.021 -6.417 117 HD13 LEU 20 3HD1 LEU 20 6.218 4.100 -7.947 118 HD21 LEU 20 3HD2 LEU 20 4.636 6.276 -5.788 119 HD22 LEU 20 1HD2 LEU 20 3.223 5.288 -6.158 120 HD23 LEU 20 2HD2 LEU 20 3.347 6.924 -6.804 121 H LYS 21 H LYS 21 6.961 9.073 -7.632 122 HA LYS 21 HA LYS 21 6.067 9.799 -5.221 123 HB2 LYS 21 1HB LYS 21 8.240 10.478 -6.347 124 HB3 LYS 21 2HB LYS 21 7.347 11.847 -7.030 125 HG2 LYS 21 1HG LYS 21 6.706 12.094 -4.407 126 HG3 LYS 21 2HG LYS 21 8.338 11.411 -4.301 127 HD2 LYS 21 1HD LYS 21 8.049 13.565 -6.286 128 HD3 LYS 21 2HD LYS 21 7.778 14.061 -4.606 129 HE2 LYS 21 1HE LYS 21 10.021 12.486 -4.388 130 HE3 LYS 21 2HE LYS 21 10.251 13.274 -5.956 131 HZ1 LYS 21 3HZ LYS 21 11.207 14.565 -4.142 132 HZ2 LYS 21 1HZ LYS 21 9.690 14.686 -3.404 133 HZ3 LYS 21 2HZ LYS 21 9.961 15.419 -4.904 134 H GLU 22 H GLU 22 5.149 11.419 -8.235 135 HA GLU 22 HA GLU 22 3.541 13.406 -7.008 136 HB2 GLU 22 1HB GLU 22 3.205 12.336 -9.812 137 HB3 GLU 22 2HB GLU 22 2.792 13.948 -9.206 138 HG2 GLU 22 1HG GLU 22 5.373 14.050 -8.675 139 HG3 GLU 22 2HG GLU 22 5.437 12.824 -9.950 140 H THR 23 H THR 23 2.819 10.248 -8.439 141 HA THR 23 HA THR 23 0.083 10.240 -8.426 142 HB THR 23 HB THR 23 2.045 8.039 -7.831 143 HG1 THR 23 1HG THR 23 2.001 8.376 -9.964 144 HG21 THR 23 3HG2 THR 23 -0.266 6.713 -8.393 145 HG22 THR 23 1HG2 THR 23 -0.861 8.038 -7.395 146 HG23 THR 23 2HG2 THR 23 0.380 6.952 -6.770 147 H LEU 24 H LEU 24 2.245 9.757 -5.677 148 HA LEU 24 HA LEU 24 0.152 9.133 -3.832 149 HB2 LEU 24 1HB LEU 24 2.873 10.193 -3.102 150 HB3 LEU 24 2HB LEU 24 1.814 9.125 -2.166 151 HG LEU 24 HG LEU 24 3.359 8.386 -4.649 152 HD11 LEU 24 1HD1 LEU 24 4.998 7.782 -3.289 153 HD12 LEU 24 2HD1 LEU 24 3.892 6.784 -2.347 154 HD13 LEU 24 3HD1 LEU 24 4.110 8.485 -1.937 155 HD21 LEU 24 3HD2 LEU 24 2.292 6.391 -4.735 156 HD22 LEU 24 1HD2 LEU 24 0.979 7.335 -4.030 157 HD23 LEU 24 2HD2 LEU 24 2.006 6.342 -2.994 158 H ARG 25 H ARG 25 2.189 12.012 -4.340 159 HA ARG 25 HA ARG 25 1.122 13.673 -2.421 160 HB2 ARG 25 1HB ARG 25 3.074 14.131 -3.965 161 HB3 ARG 25 2HB ARG 25 1.884 14.600 -5.189 162 HG2 ARG 25 1HG ARG 25 1.067 16.395 -3.786 163 HG3 ARG 25 2HG ARG 25 2.161 15.893 -2.486 164 HD2 ARG 25 1HD ARG 25 3.404 17.584 -3.413 165 HD3 ARG 25 2HD ARG 25 3.996 16.201 -4.345 166 HE ARG 25 HE ARG 25 2.355 18.380 -5.314 167 HH11 ARG 25 2HH1 ARG 25 3.584 15.173 -5.883 168 HH12 ARG 25 1HH1 ARG 25 3.340 15.242 -7.597 169 HH21 ARG 25 1HH2 ARG 25 2.458 17.127 -8.555 170 HH22 ARG 25 2HH2 ARG 25 2.030 18.484 -7.570 171 H LYS 26 H LYS 26 -0.218 12.759 -5.518 172 HA LYS 26 HA LYS 26 -2.363 14.701 -5.356 173 HB2 LYS 26 1HB LYS 26 -2.354 12.408 -7.285 174 HB3 LYS 26 2HB LYS 26 -2.944 14.062 -7.509 175 HG2 LYS 26 1HG LYS 26 -0.173 14.265 -7.037 176 HG3 LYS 26 2HG LYS 26 -0.408 12.946 -8.197 177 HD2 LYS 26 1HD LYS 26 -2.016 14.617 -9.389 178 HD3 LYS 26 2HD LYS 26 -1.139 15.837 -8.450 179 HE2 LYS 26 1HE LYS 26 0.639 15.738 -9.803 180 HE3 LYS 26 2HE LYS 26 0.683 13.972 -9.698 181 HZ1 LYS 26 3HZ LYS 26 -0.407 13.743 -11.629 182 HZ2 LYS 26 1HZ LYS 26 0.109 15.326 -11.928 183 HZ3 LYS 26 2HZ LYS 26 -1.450 15.042 -11.337 184 H PHE 27 H PHE 27 -1.931 11.215 -4.978 185 HA PHE 27 HA PHE 27 -4.599 10.465 -4.711 186 HB2 PHE 27 1HB PHE 27 -2.437 9.025 -4.822 187 HB3 PHE 27 2HB PHE 27 -2.427 9.195 -3.065 188 HD1 PHE 27 1HD PHE 27 -4.983 8.440 -5.684 189 HD2 PHE 27 2HD PHE 27 -3.291 7.421 -1.914 190 HE1 PHE 27 1HE PHE 27 -6.578 6.577 -5.476 191 HE2 PHE 27 2HE PHE 27 -4.882 5.557 -1.700 192 HZ PHE 27 HZ PHE 27 -6.527 5.132 -3.482 193 H ARG 28 H ARG 28 -2.564 12.227 -2.568 194 HA ARG 28 HA ARG 28 -4.233 11.737 -0.242 195 HB2 ARG 28 1HB ARG 28 -2.178 13.885 -0.218 196 HB3 ARG 28 2HB ARG 28 -2.563 12.669 1.008 197 HG2 ARG 28 1HG ARG 28 -1.560 11.132 -1.030 198 HG3 ARG 28 2HG ARG 28 -0.582 12.606 -1.127 199 HD2 ARG 28 1HD ARG 28 -1.052 11.097 1.449 200 HD3 ARG 28 2HD ARG 28 0.323 10.800 0.376 201 HE ARG 28 HE ARG 28 0.016 12.970 2.200 202 HH11 ARG 28 2HH1 ARG 28 1.418 12.049 -0.849 203 HH12 ARG 28 1HH1 ARG 28 2.679 13.235 -0.776 204 HH21 ARG 28 1HH2 ARG 28 2.822 14.649 1.021 205 HH22 ARG 28 2HH2 ARG 28 1.670 14.536 2.309 206 H PHE 29 H PHE 29 -3.669 14.230 -2.637 207 HA PHE 29 HA PHE 29 -5.789 15.850 -1.388 208 HB2 PHE 29 1HB PHE 29 -3.974 17.096 -3.385 209 HB3 PHE 29 2HB PHE 29 -4.691 17.784 -1.928 210 HD1 PHE 29 1HD PHE 29 -3.823 16.049 0.201 211 HD2 PHE 29 2HD PHE 29 -1.685 17.387 -3.227 212 HE1 PHE 29 1HE PHE 29 -1.703 15.755 1.414 213 HE2 PHE 29 2HE PHE 29 0.438 17.096 -2.019 214 HZ PHE 29 HZ PHE 29 0.433 16.278 0.304 215 H ARG 30 H ARG 30 -6.195 13.624 -3.190 216 HA ARG 30 HA ARG 30 -6.907 14.807 -5.744 217 HB2 ARG 30 1HB ARG 30 -7.727 12.481 -6.259 218 HB3 ARG 30 2HB ARG 30 -6.004 12.606 -5.874 219 HG2 ARG 30 1HG ARG 30 -6.408 11.798 -3.618 220 HG3 ARG 30 2HG ARG 30 -8.147 11.729 -3.949 221 HD2 ARG 30 1HD ARG 30 -6.531 10.289 -5.924 222 HD3 ARG 30 2HD ARG 30 -6.372 9.661 -4.278 223 HE ARG 30 HE ARG 30 -8.731 9.580 -5.953 224 HH11 ARG 30 2HH1 ARG 30 -7.420 9.266 -2.743 225 HH12 ARG 30 1HH1 ARG 30 -8.745 8.319 -2.154 226 HH21 ARG 30 1HH2 ARG 30 -10.485 7.788 -3.545 227 HH22 ARG 30 2HH2 ARG 30 -10.481 8.334 -5.189 228 H LYS 31 H LYS 31 -9.189 13.722 -6.520 229 HA LYS 31 HA LYS 31 -11.165 15.241 -5.184 230 HB2 LYS 31 1HB LYS 31 -11.312 13.098 -7.306 231 HB3 LYS 31 2HB LYS 31 -12.749 13.933 -6.692 232 HG2 LYS 31 1HG LYS 31 -12.308 15.208 -8.530 233 HG3 LYS 31 2HG LYS 31 -11.367 16.082 -7.309 234 HD2 LYS 31 1HD LYS 31 -9.339 15.325 -8.110 235 HD3 LYS 31 2HD LYS 31 -10.058 13.873 -8.829 236 HE2 LYS 31 1HE LYS 31 -10.946 16.484 -9.934 237 HE3 LYS 31 2HE LYS 31 -9.280 15.990 -10.275 238 HZ1 LYS 31 3HZ LYS 31 -10.008 14.578 -11.796 239 HZ2 LYS 31 1HZ LYS 31 -11.587 15.137 -11.554 240 HZ3 LYS 31 2HZ LYS 31 -11.019 13.804 -10.682 241 H GLU 32 H GLU 32 -9.883 12.151 -4.581 242 HA GLU 32 HA GLU 32 -10.659 10.322 -3.398 243 HB2 GLU 32 1HB GLU 32 -11.479 12.515 -1.486 244 HB3 GLU 32 2HB GLU 32 -10.964 10.868 -1.085 245 HG2 GLU 32 1HG GLU 32 -8.717 11.400 -2.020 246 HG3 GLU 32 2HG GLU 32 -9.258 13.074 -2.211 247 H THR 33 H THR 33 -12.836 10.994 -1.279 248 HA THR 33 HA THR 33 -15.065 10.601 -1.028 249 HB THR 33 HB THR 33 -16.576 11.772 -2.371 250 HG1 THR 33 1HG THR 33 -14.739 11.943 -4.522 251 HG21 THR 33 3HG2 THR 33 -14.043 12.997 -1.821 252 HG22 THR 33 1HG2 THR 33 -15.653 13.717 -1.799 253 HG23 THR 33 2HG2 THR 33 -14.722 13.682 -3.297 254 H ASN 34 H ASN 34 -13.200 8.827 -2.851 255 HA ASN 34 HA ASN 34 -15.255 6.849 -3.357 256 HB2 ASN 34 1HB ASN 34 -14.921 6.577 -5.663 257 HB3 ASN 34 2HB ASN 34 -14.986 8.330 -5.449 258 HD21 ASN 34 2HD2 ASN 34 -11.497 6.516 -6.521 259 HD22 ASN 34 1HD2 ASN 34 -12.801 5.608 -5.841 260 H ASN 35 H ASN 35 -14.498 5.032 -2.518 261 HA ASN 35 HA ASN 35 -11.946 4.584 -1.587 262 HB2 ASN 35 1HB ASN 35 -14.090 2.651 -2.479 263 HB3 ASN 35 2HB ASN 35 -12.573 2.109 -1.751 264 HD21 ASN 35 2HD2 ASN 35 -14.993 2.309 0.971 265 HD22 ASN 35 1HD2 ASN 35 -14.757 1.386 -0.470 266 H ALA 36 H ALA 36 -10.064 4.411 -2.591 267 HA ALA 36 HA ALA 36 -9.944 3.000 -5.163 268 HB1 ALA 36 3HB ALA 36 -9.112 4.725 -6.320 269 HB2 ALA 36 1HB ALA 36 -9.785 5.725 -5.030 270 HB3 ALA 36 2HB ALA 36 -8.086 5.250 -4.983 271 H ALA 37 H ALA 37 -7.713 2.342 -5.739 272 HA ALA 37 HA ALA 37 -5.889 2.124 -3.459 273 HB1 ALA 37 3HB ALA 37 -7.538 0.075 -3.875 274 HB2 ALA 37 1HB ALA 37 -6.279 -0.357 -5.030 275 HB3 ALA 37 2HB ALA 37 -5.877 -0.142 -3.326 276 H ILE 38 H ILE 38 -3.758 2.119 -4.005 277 HA ILE 38 HA ILE 38 -3.122 2.122 -6.883 278 HB ILE 38 HB ILE 38 -1.674 3.721 -4.774 279 HG12 ILE 38 1HG1 ILE 38 -3.797 4.567 -6.761 280 HG13 ILE 38 2HG1 ILE 38 -3.921 4.606 -4.994 281 HG21 ILE 38 1HG2 ILE 38 -0.244 4.372 -6.377 282 HG22 ILE 38 2HG2 ILE 38 -0.789 2.919 -7.212 283 HG23 ILE 38 3HG2 ILE 38 -1.510 4.481 -7.601 284 HD11 ILE 38 3HD1 ILE 38 -1.778 6.171 -6.354 285 HD12 ILE 38 1HD1 ILE 38 -3.426 6.793 -6.286 286 HD13 ILE 38 2HD1 ILE 38 -2.552 6.445 -4.793 287 H ILE 39 H ILE 39 -2.106 0.274 -7.318 288 HA ILE 39 HA ILE 39 -0.365 -0.953 -5.328 289 HB ILE 39 HB ILE 39 -0.976 -2.014 -8.081 290 HG12 ILE 39 1HG1 ILE 39 -2.442 -3.199 -5.838 291 HG13 ILE 39 2HG1 ILE 39 -2.885 -1.512 -6.152 292 HG21 ILE 39 1HG2 ILE 39 0.637 -3.420 -7.377 293 HG22 ILE 39 2HG2 ILE 39 0.405 -3.003 -5.679 294 HG23 ILE 39 3HG2 ILE 39 -0.680 -4.153 -6.462 295 HD11 ILE 39 3HD1 ILE 39 -3.070 -3.838 -8.038 296 HD12 ILE 39 1HD1 ILE 39 -4.376 -2.836 -7.407 297 HD13 ILE 39 2HD1 ILE 39 -3.224 -2.160 -8.558 298 H MET 40 H MET 40 1.721 -0.476 -5.270 299 HA MET 40 HA MET 40 3.049 0.350 -7.767 300 HB2 MET 40 1HB MET 40 4.084 0.952 -5.002 301 HB3 MET 40 2HB MET 40 4.478 1.754 -6.531 302 HG2 MET 40 1HG MET 40 2.655 3.099 -6.476 303 HG3 MET 40 2HG MET 40 1.658 1.882 -5.676 304 HE1 MET 40 3HE MET 40 1.353 1.522 -3.343 305 HE2 MET 40 1HE MET 40 1.616 2.768 -2.123 306 HE3 MET 40 2HE MET 40 0.572 3.096 -3.506 307 H LYS 41 H LYS 41 5.145 -0.427 -8.201 308 HA LYS 41 HA LYS 41 5.979 -2.754 -6.600 309 HB2 LYS 41 1HB LYS 41 6.541 -3.980 -8.586 310 HB3 LYS 41 2HB LYS 41 4.865 -3.431 -8.730 311 HG2 LYS 41 1HG LYS 41 5.456 -1.714 -10.268 312 HG3 LYS 41 2HG LYS 41 7.183 -1.977 -9.973 313 HD2 LYS 41 1HD LYS 41 7.283 -3.570 -11.529 314 HD3 LYS 41 2HD LYS 41 5.926 -4.436 -10.786 315 HE2 LYS 41 1HE LYS 41 4.394 -2.757 -11.930 316 HE3 LYS 41 2HE LYS 41 5.819 -2.241 -12.843 317 HZ1 LYS 41 3HZ LYS 41 5.956 -4.843 -13.255 318 HZ2 LYS 41 1HZ LYS 41 5.057 -3.814 -14.253 319 HZ3 LYS 41 2HZ LYS 41 4.284 -4.710 -13.044 320 H VAL 42 H VAL 42 8.303 -3.435 -7.432 321 HA VAL 42 HA VAL 42 9.926 -0.998 -7.751 322 HB VAL 42 HB VAL 42 10.324 -1.401 -5.513 323 HG11 VAL 42 1HG1 VAL 42 9.565 -4.133 -6.195 324 HG12 VAL 42 2HG1 VAL 42 10.871 -4.043 -5.012 325 HG13 VAL 42 3HG1 VAL 42 9.336 -3.234 -4.696 326 HG21 VAL 42 3HG2 VAL 42 12.418 -1.479 -6.899 327 HG22 VAL 42 1HG2 VAL 42 12.545 -2.234 -5.310 328 HG23 VAL 42 2HG2 VAL 42 12.368 -3.236 -6.751 329 H ASP 43 H ASP 43 11.106 -1.116 -9.531 330 HA ASP 43 HA ASP 43 11.549 -3.634 -10.865 331 HB2 ASP 43 1HB ASP 43 12.097 -0.753 -11.499 332 HB3 ASP 43 2HB ASP 43 12.911 -2.021 -12.427 333 H LYS 44 H LYS 44 13.209 -4.932 -10.497 334 HA LYS 44 HA LYS 44 15.358 -4.233 -8.784 335 HB2 LYS 44 1HB LYS 44 14.308 -6.559 -9.331 336 HB3 LYS 44 2HB LYS 44 15.474 -6.568 -10.663 337 HG2 LYS 44 1HG LYS 44 16.685 -5.836 -8.114 338 HG3 LYS 44 2HG LYS 44 15.939 -7.443 -8.100 339 HD2 LYS 44 1HD LYS 44 17.175 -7.825 -10.330 340 HD3 LYS 44 2HD LYS 44 18.138 -6.412 -9.864 341 HE2 LYS 44 1HE LYS 44 19.393 -7.661 -8.512 342 HE3 LYS 44 2HE LYS 44 17.949 -8.167 -7.623 343 HZ1 LYS 44 3HZ LYS 44 19.521 -9.643 -9.476 344 HZ2 LYS 44 1HZ LYS 44 17.896 -9.620 -9.952 345 HZ3 LYS 44 2HZ LYS 44 18.320 -10.190 -8.417 346 H ASP 45 H ASP 45 14.846 -3.892 -12.156 347 HA ASP 45 HA ASP 45 17.601 -3.863 -12.941 348 HB2 ASP 45 1HB ASP 45 15.985 -4.419 -14.616 349 HB3 ASP 45 2HB ASP 45 15.072 -2.935 -14.307 350 H ARG 46 H ARG 46 15.201 -1.420 -12.081 351 HA ARG 46 HA ARG 46 17.286 0.645 -12.276 352 HB2 ARG 46 1HB ARG 46 14.309 1.088 -12.011 353 HB3 ARG 46 2HB ARG 46 15.543 2.272 -12.465 354 HG2 ARG 46 1HG ARG 46 15.870 1.283 -14.590 355 HG3 ARG 46 2HG ARG 46 14.938 -0.153 -14.131 356 HD2 ARG 46 1HD ARG 46 13.257 0.887 -15.226 357 HD3 ARG 46 2HD ARG 46 13.097 1.774 -13.703 358 HE ARG 46 HE ARG 46 14.961 3.124 -15.275 359 HH11 ARG 46 2HH1 ARG 46 11.569 2.339 -15.308 360 HH12 ARG 46 1HH1 ARG 46 11.117 3.751 -16.207 361 HH21 ARG 46 1HH2 ARG 46 12.717 5.254 -16.862 362 HH22 ARG 46 2HH2 ARG 46 14.379 4.985 -16.459 363 H GLN 47 H GLN 47 16.311 -1.385 -10.055 364 HA GLN 47 HA GLN 47 15.840 -1.330 -7.790 365 HB2 GLN 47 1HB GLN 47 18.085 0.678 -7.757 366 HB3 GLN 47 2HB GLN 47 17.728 -0.597 -6.582 367 HG2 GLN 47 1HG GLN 47 18.272 -1.571 -9.298 368 HG3 GLN 47 2HG GLN 47 19.628 -0.748 -8.514 369 HE21 GLN 47 2HE2 GLN 47 18.168 -4.207 -6.875 370 HE22 GLN 47 1HE2 GLN 47 17.140 -3.173 -7.802 371 H MET 48 H MET 48 13.923 0.191 -8.778 372 HA MET 48 HA MET 48 13.682 2.313 -6.797 373 HB2 MET 48 1HB MET 48 13.485 4.072 -8.208 374 HB3 MET 48 2HB MET 48 14.489 3.059 -9.256 375 HG2 MET 48 1HG MET 48 12.088 2.148 -10.000 376 HG3 MET 48 2HG MET 48 11.632 3.775 -9.487 377 HE1 MET 48 3HE MET 48 14.226 5.286 -9.940 378 HE2 MET 48 1HE MET 48 14.376 5.789 -11.624 379 HE3 MET 48 2HE MET 48 12.884 6.109 -10.739 380 H VAL 49 H VAL 49 11.493 2.977 -6.420 381 HA VAL 49 HA VAL 49 9.604 0.824 -6.920 382 HB VAL 49 HB VAL 49 9.051 3.321 -5.332 383 HG11 VAL 49 1HG1 VAL 49 7.580 1.707 -4.080 384 HG12 VAL 49 2HG1 VAL 49 7.094 2.040 -5.744 385 HG13 VAL 49 3HG1 VAL 49 7.919 0.531 -5.351 386 HG21 VAL 49 3HG2 VAL 49 9.925 2.293 -3.369 387 HG22 VAL 49 1HG2 VAL 49 10.227 0.779 -4.222 388 HG23 VAL 49 2HG2 VAL 49 11.184 2.212 -4.600 389 H VAL 50 H VAL 50 8.454 0.880 -8.733 390 HA VAL 50 HA VAL 50 7.453 3.488 -9.679 391 HB VAL 50 HB VAL 50 7.380 2.512 -11.949 392 HG11 VAL 50 1HG1 VAL 50 9.973 2.277 -12.142 393 HG12 VAL 50 2HG1 VAL 50 9.257 3.822 -11.678 394 HG13 VAL 50 3HG1 VAL 50 9.948 2.764 -10.447 395 HG21 VAL 50 3HG2 VAL 50 7.417 0.106 -10.841 396 HG22 VAL 50 1HG2 VAL 50 8.037 0.389 -12.468 397 HG23 VAL 50 2HG2 VAL 50 9.152 0.280 -11.106 398 H LEU 51 H LEU 51 5.321 3.650 -10.303 399 HA LEU 51 HA LEU 51 3.413 2.146 -8.993 400 HB2 LEU 51 1HB LEU 51 3.223 4.420 -10.192 401 HB3 LEU 51 2HB LEU 51 2.850 3.455 -11.630 402 HG LEU 51 HG LEU 51 1.233 2.874 -9.226 403 HD11 LEU 51 1HD1 LEU 51 -0.267 4.824 -9.815 404 HD12 LEU 51 2HD1 LEU 51 1.109 5.495 -10.691 405 HD13 LEU 51 3HD1 LEU 51 1.222 5.215 -8.954 406 HD21 LEU 51 3HD2 LEU 51 -0.250 2.131 -10.746 407 HD22 LEU 51 1HD2 LEU 51 1.142 2.140 -11.830 408 HD23 LEU 51 2HD2 LEU 51 0.015 3.498 -11.828 409 H GLU 52 H GLU 52 2.179 0.380 -9.462 410 HA GLU 52 HA GLU 52 2.995 -1.167 -11.827 411 HB2 GLU 52 1HB GLU 52 3.467 -2.237 -9.669 412 HB3 GLU 52 2HB GLU 52 1.752 -2.123 -9.243 413 HG2 GLU 52 1HG GLU 52 1.123 -3.796 -10.680 414 HG3 GLU 52 2HG GLU 52 2.512 -3.539 -11.746 415 H ASP 53 H ASP 53 0.207 -0.110 -9.940 416 HA ASP 53 HA ASP 53 -1.451 -0.074 -12.276 417 HB2 ASP 53 1HB ASP 53 -1.655 -2.299 -10.307 418 HB3 ASP 53 2HB ASP 53 -3.169 -1.594 -10.887 419 H GLU 54 H GLU 54 -3.745 0.582 -11.679 420 HA GLU 54 HA GLU 54 -4.014 1.900 -9.110 421 HB2 GLU 54 1HB GLU 54 -3.394 3.326 -11.610 422 HB3 GLU 54 2HB GLU 54 -4.785 3.968 -10.723 423 HG2 GLU 54 1HG GLU 54 -3.360 4.111 -8.688 424 HG3 GLU 54 2HG GLU 54 -1.982 3.633 -9.687 425 H LEU 55 H LEU 55 -5.932 1.162 -8.487 426 HA LEU 55 HA LEU 55 -8.109 1.050 -10.466 427 HB2 LEU 55 1HB LEU 55 -8.062 -0.405 -7.829 428 HB3 LEU 55 2HB LEU 55 -9.093 -0.705 -9.239 429 HG LEU 55 HG LEU 55 -6.173 -1.066 -9.609 430 HD11 LEU 55 1HD1 LEU 55 -7.880 -2.807 -7.863 431 HD12 LEU 55 2HD1 LEU 55 -6.266 -2.168 -7.551 432 HD13 LEU 55 3HD1 LEU 55 -6.492 -3.448 -8.743 433 HD21 LEU 55 3HD2 LEU 55 -8.717 -2.035 -10.735 434 HD22 LEU 55 1HD2 LEU 55 -7.411 -3.217 -10.661 435 HD23 LEU 55 2HD2 LEU 55 -7.177 -1.698 -11.526 436 H GLN 56 H GLN 56 -10.053 2.015 -10.035 437 HA GLN 56 HA GLN 56 -10.207 3.600 -7.556 438 HB2 GLN 56 1HB GLN 56 -11.176 4.328 -10.330 439 HB3 GLN 56 2HB GLN 56 -11.501 5.274 -8.868 440 HG2 GLN 56 1HG GLN 56 -9.713 6.387 -9.830 441 HG3 GLN 56 2HG GLN 56 -8.954 5.367 -8.599 442 HE21 GLN 56 2HE2 GLN 56 -6.910 3.721 -10.829 443 HE22 GLN 56 1HE2 GLN 56 -7.322 4.129 -9.201 444 H ASN 57 H ASN 57 -12.439 4.163 -6.898 445 HA ASN 57 HA ASN 57 -14.414 3.350 -6.072 446 HB2 ASN 57 1HB ASN 57 -15.725 2.414 -8.348 447 HB3 ASN 57 2HB ASN 57 -15.769 4.061 -7.710 448 HD21 ASN 57 2HD2 ASN 57 -13.365 5.317 -10.038 449 HD22 ASN 57 1HD2 ASN 57 -13.828 5.422 -8.376 450 H ILE 58 H ILE 58 -12.615 1.491 -5.523 451 HA ILE 58 HA ILE 58 -13.967 -1.037 -6.198 452 HB ILE 58 HB ILE 58 -12.075 -1.693 -7.184 453 HG12 ILE 58 1HG1 ILE 58 -11.971 -2.722 -4.849 454 HG13 ILE 58 2HG1 ILE 58 -10.469 -2.720 -5.790 455 HG21 ILE 58 1HG2 ILE 58 -9.856 -0.421 -6.687 456 HG22 ILE 58 2HG2 ILE 58 -11.121 0.355 -7.640 457 HG23 ILE 58 3HG2 ILE 58 -10.926 0.763 -5.935 458 HD11 ILE 58 3HD1 ILE 58 -9.447 -1.732 -4.103 459 HD12 ILE 58 1HD1 ILE 58 -10.482 -0.323 -4.330 460 HD13 ILE 58 2HD1 ILE 58 -10.966 -1.602 -3.217 461 H SER 59 H SER 59 -14.343 -2.441 -4.543 462 HA SER 59 HA SER 59 -14.129 -1.385 -1.870 463 HB2 SER 59 1HB SER 59 -15.729 -3.361 -3.232 464 HB3 SER 59 2HB SER 59 -15.029 -4.060 -1.762 465 HG SER 59 HG SER 59 -16.759 -3.090 -0.956 466 HA PRO 60 HA PRO 60 -10.629 -3.555 -0.358 467 HB2 PRO 60 2HB PRO 60 -11.183 -2.854 1.758 468 HB3 PRO 60 1HB PRO 60 -11.465 -4.570 2.044 469 HG2 PRO 60 1HG PRO 60 -13.755 -4.395 1.697 470 HG3 PRO 60 2HG PRO 60 -13.398 -2.803 2.465 471 HD2 PRO 60 1HD PRO 60 -14.687 -3.024 0.085 472 HD3 PRO 60 2HD PRO 60 -13.593 -1.681 0.461 473 H GLU 61 H GLU 61 -13.219 -5.209 -1.516 474 HA GLU 61 HA GLU 61 -12.161 -7.855 -0.813 475 HB2 GLU 61 1HB GLU 61 -14.820 -6.793 -1.458 476 HB3 GLU 61 2HB GLU 61 -14.436 -8.312 -2.283 477 HG2 GLU 61 1HG GLU 61 -14.266 -9.511 -0.315 478 HG3 GLU 61 2HG GLU 61 -13.972 -8.060 0.653 479 H GLU 62 H GLU 62 -12.632 -5.650 -3.461 480 HA GLU 62 HA GLU 62 -12.037 -7.606 -5.498 481 HB2 GLU 62 1HB GLU 62 -12.805 -4.757 -5.399 482 HB3 GLU 62 2HB GLU 62 -11.745 -5.206 -6.743 483 HG2 GLU 62 1HG GLU 62 -14.296 -6.674 -6.107 484 HG3 GLU 62 2HG GLU 62 -14.214 -5.291 -7.209 485 H LEU 63 H LEU 63 -10.352 -4.940 -3.897 486 HA LEU 63 HA LEU 63 -8.031 -4.862 -5.402 487 HB2 LEU 63 1HB LEU 63 -8.940 -3.638 -3.129 488 HB3 LEU 63 2HB LEU 63 -7.600 -4.621 -2.514 489 HG LEU 63 HG LEU 63 -7.545 -2.280 -4.363 490 HD11 LEU 63 1HD1 LEU 63 -5.383 -2.025 -2.901 491 HD12 LEU 63 2HD1 LEU 63 -6.223 -3.158 -1.843 492 HD13 LEU 63 3HD1 LEU 63 -6.970 -1.613 -2.249 493 HD21 LEU 63 3HD2 LEU 63 -6.244 -3.437 -5.787 494 HD22 LEU 63 1HD2 LEU 63 -5.908 -4.710 -4.613 495 HD23 LEU 63 2HD2 LEU 63 -5.005 -3.197 -4.554 496 H LYS 64 H LYS 64 -8.530 -6.703 -2.385 497 HA LYS 64 HA LYS 64 -6.161 -8.046 -2.228 498 HB2 LYS 64 1HB LYS 64 -7.307 -8.792 -0.461 499 HB3 LYS 64 2HB LYS 64 -8.857 -8.457 -1.247 500 HG2 LYS 64 1HG LYS 64 -9.001 -10.584 -2.184 501 HG3 LYS 64 2HG LYS 64 -7.267 -10.887 -1.973 502 HD2 LYS 64 1HD LYS 64 -7.706 -11.919 -0.050 503 HD3 LYS 64 2HD LYS 64 -8.306 -10.380 0.596 504 HE2 LYS 64 1HE LYS 64 -10.304 -11.367 0.791 505 HE3 LYS 64 2HE LYS 64 -10.394 -11.289 -0.975 506 HZ1 LYS 64 3HZ LYS 64 -10.656 -13.500 -0.745 507 HZ2 LYS 64 1HZ LYS 64 -9.866 -13.568 0.749 508 HZ3 LYS 64 2HZ LYS 64 -8.966 -13.501 -0.682 509 H LEU 65 H LEU 65 -8.687 -8.506 -4.553 510 HA LEU 65 HA LEU 65 -7.670 -11.057 -5.471 511 HB2 LEU 65 1HB LEU 65 -9.740 -9.270 -6.755 512 HB3 LEU 65 2HB LEU 65 -9.441 -10.983 -7.098 513 HG LEU 65 HG LEU 65 -10.478 -9.926 -4.468 514 HD11 LEU 65 1HD1 LEU 65 -11.999 -11.300 -6.676 515 HD12 LEU 65 2HD1 LEU 65 -12.049 -9.568 -6.351 516 HD13 LEU 65 3HD1 LEU 65 -12.645 -10.709 -5.145 517 HD21 LEU 65 3HD2 LEU 65 -9.243 -12.320 -5.025 518 HD22 LEU 65 1HD2 LEU 65 -10.956 -12.710 -5.178 519 HD23 LEU 65 2HD2 LEU 65 -10.342 -12.011 -3.680 520 H GLU 66 H GLU 66 -7.526 -7.680 -6.402 521 HA GLU 66 HA GLU 66 -6.408 -8.081 -8.977 522 HB2 GLU 66 1HB GLU 66 -6.212 -5.686 -7.135 523 HB3 GLU 66 2HB GLU 66 -5.806 -5.696 -8.858 524 HG2 GLU 66 1HG GLU 66 -8.541 -6.259 -7.713 525 HG3 GLU 66 2HG GLU 66 -8.013 -4.721 -8.409 526 H LEU 67 H LEU 67 -5.107 -8.197 -5.797 527 HA LEU 67 HA LEU 67 -2.366 -7.799 -6.656 528 HB2 LEU 67 1HB LEU 67 -3.405 -8.712 -3.969 529 HB3 LEU 67 2HB LEU 67 -1.780 -8.109 -4.339 530 HG LEU 67 HG LEU 67 -4.267 -6.424 -4.576 531 HD11 LEU 67 1HD1 LEU 67 -3.697 -7.325 -2.238 532 HD12 LEU 67 2HD1 LEU 67 -3.924 -5.589 -2.433 533 HD13 LEU 67 3HD1 LEU 67 -2.295 -6.258 -2.326 534 HD21 LEU 67 3HD2 LEU 67 -1.317 -5.812 -4.600 535 HD22 LEU 67 1HD2 LEU 67 -2.577 -4.587 -4.446 536 HD23 LEU 67 2HD2 LEU 67 -2.478 -5.572 -5.906 537 HA PRO 68 HA PRO 68 -1.360 -12.001 -7.441 538 HB2 PRO 68 2HB PRO 68 0.696 -11.248 -8.137 539 HB3 PRO 68 1HB PRO 68 1.269 -12.054 -6.677 540 HG2 PRO 68 1HG PRO 68 1.290 -10.090 -5.434 541 HG3 PRO 68 2HG PRO 68 1.749 -9.473 -7.064 542 HD2 PRO 68 1HD PRO 68 -0.323 -8.449 -5.640 543 HD3 PRO 68 2HD PRO 68 -0.334 -8.549 -7.409 544 H GLU 69 H GLU 69 0.379 -13.660 -6.147 545 HA GLU 69 HA GLU 69 -0.595 -13.804 -3.377 546 HB2 GLU 69 1HB GLU 69 -0.986 -16.190 -3.583 547 HB3 GLU 69 2HB GLU 69 -1.947 -15.314 -4.784 548 HG2 GLU 69 1HG GLU 69 0.530 -15.952 -5.999 549 HG3 GLU 69 2HG GLU 69 -0.062 -17.405 -5.183 550 H ARG 70 H ARG 70 1.862 -14.548 -5.741 551 HA ARG 70 HA ARG 70 3.711 -15.206 -3.542 552 HB2 ARG 70 1HB ARG 70 4.009 -16.202 -6.376 553 HB3 ARG 70 2HB ARG 70 4.854 -16.761 -4.924 554 HG2 ARG 70 1HG ARG 70 1.890 -17.022 -4.992 555 HG3 ARG 70 2HG ARG 70 2.860 -18.124 -5.985 556 HD2 ARG 70 1HD ARG 70 4.235 -18.558 -3.862 557 HD3 ARG 70 2HD ARG 70 2.904 -17.767 -3.003 558 HE ARG 70 HE ARG 70 2.887 -20.394 -4.182 559 HH11 ARG 70 2HH1 ARG 70 0.947 -17.719 -3.086 560 HH12 ARG 70 1HH1 ARG 70 -0.469 -18.682 -2.827 561 HH21 ARG 70 1HH2 ARG 70 -0.422 -20.931 -3.260 562 HH22 ARG 70 2HH2 ARG 70 1.029 -21.673 -3.847 563 H GLN 71 H GLN 71 3.158 -12.586 -4.541 564 HA GLN 71 HA GLN 71 5.858 -11.843 -5.329 565 HB2 GLN 71 1HB GLN 71 5.101 -11.831 -7.496 566 HB3 GLN 71 2HB GLN 71 3.435 -11.458 -7.021 567 HG2 GLN 71 1HG GLN 71 4.161 -9.147 -6.456 568 HG3 GLN 71 2HG GLN 71 5.757 -9.547 -7.108 569 HE21 GLN 71 2HE2 GLN 71 4.252 -10.045 -10.454 570 HE22 GLN 71 1HE2 GLN 71 5.067 -11.049 -9.307 571 HA PRO 72 HA PRO 72 4.763 -8.884 -2.173 572 HB2 PRO 72 2HB PRO 72 6.854 -9.269 -1.300 573 HB3 PRO 72 1HB PRO 72 7.235 -7.713 -2.033 574 HG2 PRO 72 1HG PRO 72 8.164 -8.680 -3.932 575 HG3 PRO 72 2HG PRO 72 8.632 -9.877 -2.668 576 HD2 PRO 72 1HD PRO 72 7.306 -10.578 -4.930 577 HD3 PRO 72 2HD PRO 72 7.048 -11.394 -3.379 578 H ARG 73 H ARG 73 3.839 -6.943 -2.386 579 HA ARG 73 HA ARG 73 4.932 -4.930 -4.143 580 HB2 ARG 73 1HB ARG 73 3.028 -4.661 -5.563 581 HB3 ARG 73 2HB ARG 73 3.509 -6.364 -5.632 582 HG2 ARG 73 1HG ARG 73 1.353 -5.423 -3.763 583 HG3 ARG 73 2HG ARG 73 1.018 -5.831 -5.455 584 HD2 ARG 73 1HD ARG 73 1.733 -8.084 -5.158 585 HD3 ARG 73 2HD ARG 73 2.425 -7.711 -3.573 586 HE ARG 73 HE ARG 73 -0.345 -7.152 -3.575 587 HH11 ARG 73 2HH1 ARG 73 1.908 -9.806 -3.554 588 HH12 ARG 73 1HH1 ARG 73 0.829 -10.886 -2.735 589 HH21 ARG 73 1HH2 ARG 73 -1.267 -10.180 -2.136 590 HH22 ARG 73 2HH2 ARG 73 -1.776 -8.565 -2.498 591 H PHE 74 H PHE 74 3.860 -2.853 -3.902 592 HA PHE 74 HA PHE 74 2.707 -2.580 -1.226 593 HB2 PHE 74 1HB PHE 74 3.790 -0.449 -3.088 594 HB3 PHE 74 2HB PHE 74 3.292 -0.210 -1.413 595 HD1 PHE 74 2HD PHE 74 4.455 -2.285 0.109 596 HD2 PHE 74 1HD PHE 74 6.077 -0.264 -3.267 597 HE1 PHE 74 2HE PHE 74 6.727 -2.815 0.889 598 HE2 PHE 74 1HE PHE 74 8.352 -0.792 -2.494 599 HZ PHE 74 HZ PHE 74 8.680 -2.067 -0.413 600 H VAL 75 H VAL 75 0.895 -1.173 -0.866 601 HA VAL 75 HA VAL 75 -0.714 -0.383 -3.143 602 HB VAL 75 HB VAL 75 -1.960 -2.247 -1.132 603 HG11 VAL 75 1HG1 VAL 75 -3.476 -2.463 -3.304 604 HG12 VAL 75 2HG1 VAL 75 -3.718 -1.183 -2.113 605 HG13 VAL 75 3HG1 VAL 75 -2.829 -0.849 -3.601 606 HG21 VAL 75 3HG2 VAL 75 -0.974 -2.992 -3.883 607 HG22 VAL 75 1HG2 VAL 75 -0.154 -3.408 -2.378 608 HG23 VAL 75 2HG2 VAL 75 -1.762 -4.051 -2.714 609 H VAL 76 H VAL 76 -2.019 1.318 -2.691 610 HA VAL 76 HA VAL 76 -2.192 2.160 0.130 611 HB VAL 76 HB VAL 76 -1.961 3.891 -2.335 612 HG11 VAL 76 1HG1 VAL 76 -3.528 4.690 -0.473 613 HG12 VAL 76 2HG1 VAL 76 -2.064 4.888 0.493 614 HG13 VAL 76 3HG1 VAL 76 -2.261 5.794 -1.008 615 HG21 VAL 76 3HG2 VAL 76 -0.080 4.240 -0.118 616 HG22 VAL 76 1HG2 VAL 76 0.031 2.676 -0.924 617 HG23 VAL 76 2HG2 VAL 76 0.215 4.162 -1.855 618 H TYR 77 H TYR 77 -4.206 1.471 0.664 619 HA TYR 77 HA TYR 77 -6.440 1.997 -1.131 620 HB2 TYR 77 1HB TYR 77 -6.116 -0.190 0.144 621 HB3 TYR 77 2HB TYR 77 -6.571 0.709 1.594 622 HD1 TYR 77 1HD TYR 77 -7.944 0.741 -1.883 623 HD2 TYR 77 2HD TYR 77 -8.694 0.076 2.252 624 HE1 TYR 77 1HE TYR 77 -10.324 0.373 -2.380 625 HE2 TYR 77 2HE TYR 77 -11.076 -0.295 1.767 626 HH TYR 77 HH TYR 77 -12.377 0.144 -1.488 627 H SER 78 H SER 78 -7.961 3.524 -0.822 628 HA SER 78 HA SER 78 -7.706 5.214 1.579 629 HB2 SER 78 1HB SER 78 -7.050 6.264 -0.636 630 HB3 SER 78 2HB SER 78 -8.751 6.115 -1.111 631 HG SER 78 HG SER 78 -9.169 7.309 0.935 632 H TYR 79 H TYR 79 -9.259 4.300 2.855 633 HA TYR 79 HA TYR 79 -11.898 3.745 1.793 634 HB2 TYR 79 1HB TYR 79 -10.971 2.189 3.406 635 HB3 TYR 79 2HB TYR 79 -10.753 3.489 4.581 636 HD1 TYR 79 1HD TYR 79 -13.267 1.400 2.879 637 HD2 TYR 79 2HD TYR 79 -12.567 4.293 5.920 638 HE1 TYR 79 1HE TYR 79 -15.514 0.980 3.787 639 HE2 TYR 79 2HE TYR 79 -14.811 3.879 6.838 640 HH TYR 79 HH TYR 79 -16.680 2.698 6.672 641 H LYS 80 H LYS 80 -13.836 4.671 2.653 642 HA LYS 80 HA LYS 80 -13.459 7.461 3.501 643 HB2 LYS 80 1HB LYS 80 -14.633 7.281 1.409 644 HB3 LYS 80 2HB LYS 80 -15.758 6.097 2.094 645 HG2 LYS 80 1HG LYS 80 -16.516 7.890 3.696 646 HG3 LYS 80 2HG LYS 80 -15.567 9.029 2.726 647 HD2 LYS 80 1HD LYS 80 -16.898 8.050 0.714 648 HD3 LYS 80 2HD LYS 80 -18.021 7.488 1.965 649 HE2 LYS 80 1HE LYS 80 -18.779 9.572 2.424 650 HE3 LYS 80 2HE LYS 80 -17.181 10.300 2.204 651 HZ1 LYS 80 3HZ LYS 80 -17.813 10.985 0.212 652 HZ2 LYS 80 1HZ LYS 80 -19.329 10.260 0.407 653 HZ3 LYS 80 2HZ LYS 80 -18.058 9.387 -0.288 654 H TYR 81 H TYR 81 -13.560 7.602 5.655 655 HA TYR 81 HA TYR 81 -15.506 5.968 7.111 656 HB2 TYR 81 1HB TYR 81 -12.904 6.451 7.668 657 HB3 TYR 81 2HB TYR 81 -13.660 7.751 8.593 658 HD1 TYR 81 2HD TYR 81 -15.961 6.787 9.828 659 HD2 TYR 81 1HD TYR 81 -12.401 4.615 8.981 660 HE1 TYR 81 2HE TYR 81 -16.488 5.223 11.652 661 HE2 TYR 81 1HE TYR 81 -12.919 3.045 10.802 662 HH TYR 81 HH TYR 81 -14.397 3.280 13.070 663 H VAL 82 H VAL 82 -17.307 6.796 7.957 664 HA VAL 82 HA VAL 82 -17.746 9.683 7.717 665 HB VAL 82 HB VAL 82 -19.788 7.539 8.306 666 HG11 VAL 82 1HG1 VAL 82 -21.265 9.426 7.287 667 HG12 VAL 82 2HG1 VAL 82 -20.760 9.525 8.976 668 HG13 VAL 82 3HG1 VAL 82 -19.920 10.471 7.746 669 HG21 VAL 82 3HG2 VAL 82 -18.460 7.541 6.027 670 HG22 VAL 82 1HG2 VAL 82 -20.201 7.259 6.072 671 HG23 VAL 82 2HG2 VAL 82 -19.576 8.851 5.643 672 H HIS 83 H HIS 83 -19.048 10.730 9.447 673 HA HIS 83 HA HIS 83 -18.070 9.855 12.073 674 HB2 HIS 83 1HB HIS 83 -18.994 12.544 11.044 675 HB3 HIS 83 2HB HIS 83 -18.679 12.226 12.752 676 HD1 HIS 83 1HD HIS 83 -16.387 12.742 13.511 677 HD2 HIS 83 2HD HIS 83 -16.520 11.943 9.436 678 HE1 HIS 83 1HE HIS 83 -14.047 13.125 12.673 679 HE2 HIS 83 2HE HIS 83 -14.126 12.637 10.184 680 H ASP 84 H ASP 84 -20.737 12.064 11.630 681 HA ASP 84 HA ASP 84 -22.907 10.353 11.835 682 HB2 ASP 84 1HB ASP 84 -21.402 10.392 14.238 683 HB3 ASP 84 2HB ASP 84 -22.888 11.302 14.543 684 H ASP 85 H ASP 85 -21.591 13.353 13.201 685 HA ASP 85 HA ASP 85 -24.068 14.733 13.259 686 HB2 ASP 85 1HB ASP 85 -21.191 15.473 13.542 687 HB3 ASP 85 2HB ASP 85 -22.344 16.767 13.196 688 H GLY 86 H GLY 86 -22.168 13.748 10.690 689 HA2 GLY 86 1HA GLY 86 -23.259 14.167 8.491 690 HA3 GLY 86 2HA GLY 86 -23.297 15.861 8.958 691 H ARG 87 H ARG 87 -20.487 14.246 9.963 692 HA ARG 87 HA ARG 87 -18.992 15.465 7.739 693 HB2 ARG 87 1HB ARG 87 -18.211 14.917 10.607 694 HB3 ARG 87 2HB ARG 87 -17.049 15.397 9.360 695 HG2 ARG 87 1HG ARG 87 -19.466 17.030 10.142 696 HG3 ARG 87 2HG ARG 87 -17.833 17.269 10.788 697 HD2 ARG 87 1HD ARG 87 -17.132 18.345 8.948 698 HD3 ARG 87 2HD ARG 87 -17.891 17.158 7.879 699 HE ARG 87 HE ARG 87 -19.766 18.496 7.739 700 HH11 ARG 87 2HH1 ARG 87 -17.605 19.702 10.188 701 HH12 ARG 87 1HH1 ARG 87 -18.443 21.208 10.371 702 HH21 ARG 87 1HH2 ARG 87 -20.305 21.645 9.109 703 HH22 ARG 87 2HH2 ARG 87 -20.878 20.473 7.970 704 H VAL 88 H VAL 88 -17.518 14.282 6.603 705 HA VAL 88 HA VAL 88 -17.009 11.515 7.425 706 HB VAL 88 HB VAL 88 -18.845 11.281 5.894 707 HG11 VAL 88 1HG1 VAL 88 -19.075 12.345 3.860 708 HG12 VAL 88 2HG1 VAL 88 -18.279 13.591 4.823 709 HG13 VAL 88 3HG1 VAL 88 -17.342 12.619 3.688 710 HG21 VAL 88 3HG2 VAL 88 -16.924 9.700 5.720 711 HG22 VAL 88 1HG2 VAL 88 -17.870 9.848 4.238 712 HG23 VAL 88 2HG2 VAL 88 -16.313 10.665 4.377 713 H SER 89 H SER 89 -14.941 10.953 7.192 714 HA SER 89 HA SER 89 -13.259 12.540 5.367 715 HB2 SER 89 1HB SER 89 -12.411 11.450 8.067 716 HB3 SER 89 2HB SER 89 -11.441 12.453 6.975 717 HG SER 89 HG SER 89 -13.056 13.284 8.867 718 H TYR 90 H TYR 90 -11.523 11.456 4.374 719 HA TYR 90 HA TYR 90 -11.856 8.537 4.297 720 HB2 TYR 90 1HB TYR 90 -10.219 9.897 2.228 721 HB3 TYR 90 2HB TYR 90 -11.374 8.573 2.066 722 HD1 TYR 90 1HD TYR 90 -13.785 9.018 1.853 723 HD2 TYR 90 2HD TYR 90 -10.950 12.187 1.992 724 HE1 TYR 90 1HE TYR 90 -15.483 10.567 0.981 725 HE2 TYR 90 2HE TYR 90 -12.641 13.746 1.121 726 HH TYR 90 HH TYR 90 -15.775 12.628 0.018 727 HA PRO 91 HA PRO 91 -7.892 8.866 6.522 728 HB2 PRO 91 2HB PRO 91 -8.895 7.884 8.340 729 HB3 PRO 91 1HB PRO 91 -8.128 6.420 7.729 730 HG2 PRO 91 1HG PRO 91 -10.051 5.701 6.639 731 HG3 PRO 91 2HG PRO 91 -10.755 6.511 8.089 732 HD2 PRO 91 1HD PRO 91 -11.499 7.137 5.554 733 HD3 PRO 91 2HD PRO 91 -11.438 8.336 6.858 734 H LEU 92 H LEU 92 -6.583 8.719 4.686 735 HA LEU 92 HA LEU 92 -6.356 6.341 3.131 736 HB2 LEU 92 1HB LEU 92 -5.229 9.016 3.154 737 HB3 LEU 92 2HB LEU 92 -4.006 7.787 2.786 738 HG LEU 92 HG LEU 92 -6.263 7.199 1.190 739 HD11 LEU 92 1HD1 LEU 92 -7.206 9.307 1.285 740 HD12 LEU 92 2HD1 LEU 92 -6.168 9.421 -0.135 741 HD13 LEU 92 3HD1 LEU 92 -5.642 10.117 1.398 742 HD21 LEU 92 3HD2 LEU 92 -4.350 6.632 0.147 743 HD22 LEU 92 1HD2 LEU 92 -3.434 7.950 0.877 744 HD23 LEU 92 2HD2 LEU 92 -4.463 8.261 -0.522 745 H CYS 93 H CYS 93 -4.951 4.668 3.278 746 HA CYS 93 HA CYS 93 -2.852 4.769 5.321 747 HB2 CYS 93 1HB CYS 93 -4.909 2.573 5.028 748 HB3 CYS 93 2HB CYS 93 -3.475 2.474 6.063 749 HG CYS 93 HG CYS 93 -6.173 4.524 6.490 750 H PHE 94 H PHE 94 -1.182 3.166 5.040 751 HA PHE 94 HA PHE 94 -0.864 2.435 2.218 752 HB2 PHE 94 1HB PHE 94 0.895 3.849 3.174 753 HB3 PHE 94 2HB PHE 94 1.191 2.644 4.429 754 HD1 PHE 94 2HD PHE 94 1.381 3.219 0.782 755 HD2 PHE 94 1HD PHE 94 2.608 0.809 4.070 756 HE1 PHE 94 2HE PHE 94 3.017 2.086 -0.663 757 HE2 PHE 94 1HE PHE 94 4.246 -0.328 2.630 758 HZ PHE 94 HZ PHE 94 4.452 0.309 0.260 759 H ILE 95 H ILE 95 -1.647 0.450 1.848 760 HA ILE 95 HA ILE 95 -1.287 -1.656 3.832 761 HB ILE 95 HB ILE 95 -2.870 -1.508 1.275 762 HG12 ILE 95 1HG1 ILE 95 -3.774 -2.143 4.087 763 HG13 ILE 95 2HG1 ILE 95 -3.711 -0.491 3.452 764 HG21 ILE 95 1HG2 ILE 95 -2.184 -3.898 2.951 765 HG22 ILE 95 2HG2 ILE 95 -3.668 -3.835 2.003 766 HG23 ILE 95 3HG2 ILE 95 -2.104 -3.712 1.199 767 HD11 ILE 95 3HD1 ILE 95 -5.362 -0.949 1.820 768 HD12 ILE 95 1HD1 ILE 95 -5.293 -2.681 2.141 769 HD13 ILE 95 2HD1 ILE 95 -5.958 -1.587 3.353 770 H PHE 96 H PHE 96 0.757 -2.420 3.773 771 HA PHE 96 HA PHE 96 2.169 -2.809 1.295 772 HB2 PHE 96 1HB PHE 96 3.438 -2.146 3.238 773 HB3 PHE 96 2HB PHE 96 2.845 -3.535 4.150 774 HD1 PHE 96 1HD PHE 96 3.608 -4.201 0.707 775 HD2 PHE 96 2HD PHE 96 5.266 -3.994 4.623 776 HE1 PHE 96 1HE PHE 96 5.532 -5.541 -0.040 777 HE2 PHE 96 2HE PHE 96 7.192 -5.333 3.881 778 HZ PHE 96 HZ PHE 96 7.328 -6.108 1.548 779 H SER 97 H SER 97 1.155 -4.333 0.061 780 HA SER 97 HA SER 97 0.264 -6.836 1.155 781 HB2 SER 97 1HB SER 97 -0.476 -5.418 -1.028 782 HB3 SER 97 2HB SER 97 0.629 -6.585 -1.776 783 HG SER 97 HG SER 97 -0.635 -8.215 -0.554 784 H SER 98 H SER 98 1.811 -8.163 1.896 785 HA SER 98 HA SER 98 3.897 -8.989 0.002 786 HB2 SER 98 1HB SER 98 5.641 -8.752 1.504 787 HB3 SER 98 2HB SER 98 4.626 -7.368 1.951 788 HG SER 98 HG SER 98 4.695 -9.901 3.232 789 HA PRO 99 HA PRO 99 1.879 -12.823 1.235 790 HB2 PRO 99 2HB PRO 99 1.557 -13.237 -1.001 791 HB3 PRO 99 1HB PRO 99 2.946 -14.306 -0.805 792 HG2 PRO 99 1HG PRO 99 4.450 -12.726 -1.607 793 HG3 PRO 99 2HG PRO 99 2.994 -12.355 -2.603 794 HD2 PRO 99 1HD PRO 99 4.283 -10.471 -1.136 795 HD3 PRO 99 2HD PRO 99 2.530 -10.449 -1.393 796 H VAL 100 H VAL 100 3.065 -15.220 0.961 797 HA VAL 100 HA VAL 100 5.611 -14.970 2.427 798 HB VAL 100 HB VAL 100 3.701 -15.696 3.870 799 HG11 VAL 100 1HG1 VAL 100 3.770 -18.154 2.122 800 HG12 VAL 100 2HG1 VAL 100 2.832 -17.967 3.605 801 HG13 VAL 100 3HG1 VAL 100 2.464 -16.972 2.196 802 HG21 VAL 100 3HG2 VAL 100 6.140 -17.356 3.422 803 HG22 VAL 100 1HG2 VAL 100 5.728 -16.301 4.774 804 HG23 VAL 100 2HG2 VAL 100 4.948 -17.875 4.615 805 H GLY 101 H GLY 101 3.811 -16.530 -0.081 806 HA2 GLY 101 1HA GLY 101 5.624 -18.717 -0.477 807 HA3 GLY 101 2HA GLY 101 4.353 -18.203 -1.577 808 H CYS 102 H CYS 102 5.659 -15.409 -1.356 809 HA CYS 102 HA CYS 102 7.027 -15.469 -3.785 810 HB2 CYS 102 1HB CYS 102 7.930 -13.212 -3.041 811 HB3 CYS 102 2HB CYS 102 6.167 -13.382 -3.089 812 HG CYS 102 HG CYS 102 6.592 -14.205 -0.131 813 H LYS 103 H LYS 103 9.379 -14.324 -3.769 814 HA LYS 103 HA LYS 103 11.095 -16.250 -2.373 815 HB2 LYS 103 1HB LYS 103 12.058 -14.388 -4.522 816 HB3 LYS 103 2HB LYS 103 12.663 -15.992 -4.076 817 HG2 LYS 103 1HG LYS 103 11.429 -16.940 -5.650 818 HG3 LYS 103 2HG LYS 103 9.960 -16.244 -4.943 819 HD2 LYS 103 1HD LYS 103 10.199 -15.564 -7.276 820 HD3 LYS 103 2HD LYS 103 10.333 -14.170 -6.190 821 HE2 LYS 103 1HE LYS 103 12.169 -13.700 -7.423 822 HE3 LYS 103 2HE LYS 103 12.927 -14.893 -6.357 823 HZ1 LYS 103 3HZ LYS 103 13.372 -16.118 -8.129 824 HZ2 LYS 103 1HZ LYS 103 12.589 -15.010 -9.141 825 HZ3 LYS 103 2HZ LYS 103 11.719 -16.286 -8.449 826 HA PRO 104 HA PRO 104 12.761 -13.212 0.328 827 HB2 PRO 104 2HB PRO 104 13.833 -14.940 1.397 828 HB3 PRO 104 1HB PRO 104 15.283 -14.213 0.705 829 HG2 PRO 104 1HG PRO 104 15.326 -15.678 -1.098 830 HG3 PRO 104 2HG PRO 104 14.681 -16.748 0.202 831 HD2 PRO 104 1HD PRO 104 13.420 -16.410 -2.178 832 HD3 PRO 104 2HD PRO 104 12.545 -16.668 -0.660 833 H GLU 105 H GLU 105 13.974 -13.710 -2.813 834 HA GLU 105 HA GLU 105 16.095 -11.776 -2.706 835 HB2 GLU 105 1HB GLU 105 14.750 -13.344 -4.884 836 HB3 GLU 105 2HB GLU 105 15.818 -11.993 -5.295 837 HG2 GLU 105 1HG GLU 105 17.076 -13.712 -3.353 838 HG3 GLU 105 2HG GLU 105 16.542 -14.636 -4.764 839 H GLN 106 H GLN 106 12.708 -11.792 -3.628 840 HA GLN 106 HA GLN 106 12.849 -9.029 -4.543 841 HB2 GLN 106 1HB GLN 106 10.291 -10.576 -4.297 842 HB3 GLN 106 2HB GLN 106 10.743 -9.334 -5.475 843 HG2 GLN 106 1HG GLN 106 12.078 -12.026 -5.419 844 HG3 GLN 106 2HG GLN 106 10.572 -11.734 -6.300 845 HE21 GLN 106 2HE2 GLN 106 12.235 -9.305 -8.488 846 HE22 GLN 106 1HE2 GLN 106 10.896 -9.316 -7.397 847 H GLN 107 H GLN 107 10.981 -10.901 -2.150 848 HA GLN 107 HA GLN 107 9.564 -8.994 -0.881 849 HB2 GLN 107 1HB GLN 107 10.564 -11.569 -0.208 850 HB3 GLN 107 2HB GLN 107 10.820 -10.510 1.187 851 HG2 GLN 107 1HG GLN 107 8.162 -10.344 -0.091 852 HG3 GLN 107 2HG GLN 107 8.546 -11.859 0.737 853 HE21 GLN 107 2HE2 GLN 107 8.371 -8.400 2.925 854 HE22 GLN 107 1HE2 GLN 107 8.844 -8.362 1.263 855 H MET 108 H MET 108 13.033 -9.533 -0.531 856 HA MET 108 HA MET 108 13.474 -7.723 1.579 857 HB2 MET 108 1HB MET 108 15.155 -9.065 -0.479 858 HB3 MET 108 2HB MET 108 15.843 -7.654 0.340 859 HG2 MET 108 1HG MET 108 14.962 -8.971 2.491 860 HG3 MET 108 2HG MET 108 15.208 -10.338 1.402 861 HE1 MET 108 3HE MET 108 18.863 -10.055 0.364 862 HE2 MET 108 1HE MET 108 17.231 -10.024 -0.306 863 HE3 MET 108 2HE MET 108 18.138 -8.523 -0.124 864 H MET 109 H MET 109 13.436 -7.314 -1.928 865 HA MET 109 HA MET 109 14.450 -4.731 -2.102 866 HB2 MET 109 1HB MET 109 12.377 -6.158 -3.777 867 HB3 MET 109 2HB MET 109 13.044 -4.573 -4.201 868 HG2 MET 109 1HG MET 109 15.198 -5.436 -4.566 869 HG3 MET 109 2HG MET 109 14.814 -6.943 -3.731 870 HE1 MET 109 3HE MET 109 12.914 -5.848 -7.791 871 HE2 MET 109 1HE MET 109 12.362 -5.201 -6.245 872 HE3 MET 109 2HE MET 109 13.945 -4.745 -6.876 873 H TYR 110 H TYR 110 11.180 -5.842 -1.385 874 HA TYR 110 HA TYR 110 10.141 -3.143 -1.285 875 HB2 TYR 110 1HB TYR 110 8.810 -5.733 -0.450 876 HB3 TYR 110 2HB TYR 110 8.014 -4.183 -0.736 877 HD1 TYR 110 2HD TYR 110 9.966 -6.835 -2.462 878 HD2 TYR 110 1HD TYR 110 7.229 -3.602 -2.865 879 HE1 TYR 110 2HE TYR 110 9.629 -7.422 -4.826 880 HE2 TYR 110 1HE TYR 110 6.883 -4.182 -5.230 881 HH TYR 110 HH TYR 110 8.193 -7.106 -6.615 882 H ALA 111 H ALA 111 10.960 -5.725 0.986 883 HA ALA 111 HA ALA 111 10.022 -4.509 3.329 884 HB1 ALA 111 3HB ALA 111 11.323 -6.876 2.678 885 HB2 ALA 111 1HB ALA 111 12.424 -6.053 3.784 886 HB3 ALA 111 2HB ALA 111 10.762 -6.381 4.276 887 H GLY 112 H GLY 112 12.898 -3.968 1.443 888 HA2 GLY 112 1HA GLY 112 14.074 -2.315 3.559 889 HA3 GLY 112 2HA GLY 112 14.872 -2.815 2.076 890 H SER 113 H SER 113 12.385 -2.029 0.550 891 HA SER 113 HA SER 113 13.062 0.819 0.363 892 HB2 SER 113 1HB SER 113 11.480 -0.850 -1.613 893 HB3 SER 113 2HB SER 113 12.193 0.751 -1.881 894 HG SER 113 HG SER 113 13.762 -1.504 -1.208 895 H LYS 114 H LYS 114 10.747 -1.150 1.702 896 HA LYS 114 HA LYS 114 8.312 0.051 1.136 897 HB2 LYS 114 1HB LYS 114 8.371 -1.982 2.395 898 HB3 LYS 114 2HB LYS 114 9.327 -1.221 3.678 899 HG2 LYS 114 1HG LYS 114 7.441 0.203 4.276 900 HG3 LYS 114 2HG LYS 114 6.481 -0.526 2.975 901 HD2 LYS 114 1HD LYS 114 5.756 -1.927 4.581 902 HD3 LYS 114 2HD LYS 114 7.310 -2.740 4.321 903 HE2 LYS 114 1HE LYS 114 8.323 -1.438 6.128 904 HE3 LYS 114 2HE LYS 114 6.794 -0.582 6.366 905 HZ1 LYS 114 3HZ LYS 114 7.514 -3.321 7.092 906 HZ2 LYS 114 1HZ LYS 114 5.909 -3.025 6.647 907 HZ3 LYS 114 2HZ LYS 114 6.595 -2.184 7.943 908 H ASN 115 H ASN 115 10.233 0.688 4.077 909 HA ASN 115 HA ASN 115 8.886 2.886 4.995 910 HB2 ASN 115 1HB ASN 115 11.698 1.932 5.221 911 HB3 ASN 115 2HB ASN 115 11.371 3.596 5.720 912 HD21 ASN 115 2HD2 ASN 115 10.318 0.511 8.059 913 HD22 ASN 115 1HD2 ASN 115 11.157 0.320 6.561 914 H ARG 116 H ARG 116 11.186 2.717 2.366 915 HA ARG 116 HA ARG 116 11.576 5.521 2.087 916 HB2 ARG 116 1HB ARG 116 13.241 4.124 1.154 917 HB3 ARG 116 2HB ARG 116 12.045 3.176 0.257 918 HG2 ARG 116 1HG ARG 116 13.069 4.496 -1.373 919 HG3 ARG 116 2HG ARG 116 11.544 5.328 -1.019 920 HD2 ARG 116 1HD ARG 116 12.760 7.177 -0.691 921 HD3 ARG 116 2HD ARG 116 13.312 6.412 0.807 922 HE ARG 116 HE ARG 116 14.873 5.581 -1.424 923 HH11 ARG 116 2HH1 ARG 116 14.384 8.198 0.820 924 HH12 ARG 116 1HH1 ARG 116 16.009 8.783 0.695 925 HH21 ARG 116 1HH2 ARG 116 17.506 7.727 -0.682 926 HH22 ARG 116 2HH2 ARG 116 17.016 6.342 -1.598 927 H LEU 117 H LEU 117 9.581 3.179 0.291 928 HA LEU 117 HA LEU 117 8.370 5.059 -1.416 929 HB2 LEU 117 1HB LEU 117 8.395 2.616 -1.796 930 HB3 LEU 117 2HB LEU 117 7.260 2.428 -0.448 931 HG LEU 117 HG LEU 117 6.232 2.284 -2.722 932 HD11 LEU 117 1HD1 LEU 117 4.935 4.642 -1.563 933 HD12 LEU 117 2HD1 LEU 117 5.246 3.335 -0.420 934 HD13 LEU 117 3HD1 LEU 117 4.296 3.027 -1.874 935 HD21 LEU 117 3HD2 LEU 117 6.930 5.217 -2.795 936 HD22 LEU 117 1HD2 LEU 117 5.849 4.399 -3.922 937 HD23 LEU 117 2HD2 LEU 117 7.555 3.960 -3.863 938 H VAL 118 H VAL 118 7.301 3.675 1.674 939 HA VAL 118 HA VAL 118 4.814 4.974 1.798 940 HB VAL 118 HB VAL 118 6.614 3.958 3.996 941 HG11 VAL 118 1HG1 VAL 118 5.341 4.977 5.501 942 HG12 VAL 118 2HG1 VAL 118 4.380 5.709 4.214 943 HG13 VAL 118 3HG1 VAL 118 3.927 4.134 4.866 944 HG21 VAL 118 3HG2 VAL 118 5.867 2.104 2.833 945 HG22 VAL 118 1HG2 VAL 118 4.635 2.275 4.084 946 HG23 VAL 118 2HG2 VAL 118 4.312 2.843 2.445 947 H GLN 119 H GLN 119 7.932 5.856 3.282 948 HA GLN 119 HA GLN 119 7.179 8.186 4.548 949 HB2 GLN 119 1HB GLN 119 9.730 7.187 3.366 950 HB3 GLN 119 2HB GLN 119 9.647 8.889 3.848 951 HG2 GLN 119 1HG GLN 119 8.645 7.780 6.068 952 HG3 GLN 119 2HG GLN 119 9.667 6.449 5.509 953 HE21 GLN 119 2HE2 GLN 119 12.196 7.983 7.355 954 HE22 GLN 119 1HE2 GLN 119 11.075 6.674 7.242 955 H THR 120 H THR 120 7.987 7.679 1.157 956 HA THR 120 HA THR 120 8.094 10.371 0.365 957 HB THR 120 HB THR 120 7.108 8.134 -1.400 958 HG1 THR 120 1HG THR 120 9.527 8.059 -1.844 959 HG21 THR 120 3HG2 THR 120 7.042 9.957 -2.753 960 HG22 THR 120 1HG2 THR 120 8.761 9.607 -2.914 961 HG23 THR 120 2HG2 THR 120 8.215 10.850 -1.789 962 H ALA 121 H ALA 121 5.396 8.079 0.502 963 HA ALA 121 HA ALA 121 3.490 9.913 -0.586 964 HB1 ALA 121 3HB ALA 121 1.946 8.222 -0.390 965 HB2 ALA 121 1HB ALA 121 3.449 7.301 -0.473 966 HB3 ALA 121 2HB ALA 121 2.671 7.583 1.085 967 H GLU 122 H GLU 122 4.833 9.389 2.530 968 HA GLU 122 HA GLU 122 4.566 10.521 4.492 969 HB2 GLU 122 1HB GLU 122 3.770 12.347 2.626 970 HB3 GLU 122 2HB GLU 122 2.313 12.203 3.621 971 HG2 GLU 122 1HG GLU 122 3.933 12.525 5.621 972 HG3 GLU 122 2HG GLU 122 5.030 13.169 4.391 973 H LEU 123 H LEU 123 3.068 8.141 3.803 974 HA LEU 123 HA LEU 123 0.454 8.476 5.011 975 HB2 LEU 123 1HB LEU 123 1.870 5.967 4.097 976 HB3 LEU 123 2HB LEU 123 0.166 6.100 4.562 977 HG LEU 123 HG LEU 123 1.119 7.806 2.322 978 HD11 LEU 123 1HD1 LEU 123 0.299 5.022 1.677 979 HD12 LEU 123 2HD1 LEU 123 1.971 5.319 2.154 980 HD13 LEU 123 3HD1 LEU 123 1.292 6.154 0.757 981 HD21 LEU 123 3HD2 LEU 123 -1.109 7.461 1.516 982 HD22 LEU 123 1HD2 LEU 123 -1.201 7.857 3.232 983 HD23 LEU 123 2HD2 LEU 123 -1.395 6.186 2.701 984 H THR 124 H THR 124 0.985 9.107 7.125 985 HA THR 124 HA THR 124 2.779 7.918 8.855 986 HB THR 124 HB THR 124 0.156 9.300 9.357 987 HG1 THR 124 1HG THR 124 2.360 10.286 8.760 988 HG21 THR 124 3HG2 THR 124 0.289 7.775 11.184 989 HG22 THR 124 1HG2 THR 124 0.842 9.339 11.781 990 HG23 THR 124 2HG2 THR 124 2.013 8.077 11.393 991 H LYS 125 H LYS 125 -0.397 6.833 7.877 992 HA LYS 125 HA LYS 125 -0.321 4.639 9.813 993 HB2 LYS 125 1HB LYS 125 -2.456 5.753 8.002 994 HB3 LYS 125 2HB LYS 125 -2.636 4.169 8.774 995 HG2 LYS 125 1HG LYS 125 -2.232 5.332 10.986 996 HG3 LYS 125 2HG LYS 125 -2.413 6.856 10.099 997 HD2 LYS 125 1HD LYS 125 -4.582 5.189 9.347 998 HD3 LYS 125 2HD LYS 125 -4.444 5.122 11.113 999 HE2 LYS 125 1HE LYS 125 -5.818 6.961 10.832 1000 HE3 LYS 125 2HE LYS 125 -4.217 7.710 10.927 1001 HZ1 LYS 125 3HZ LYS 125 -6.051 7.985 8.893 1002 HZ2 LYS 125 1HZ LYS 125 -4.833 7.003 8.249 1003 HZ3 LYS 125 2HZ LYS 125 -4.445 8.519 8.891 1004 H VAL 126 H VAL 126 1.168 3.209 9.018 1005 HA VAL 126 HA VAL 126 0.604 2.079 6.354 1006 HB VAL 126 HB VAL 126 2.730 2.953 6.082 1007 HG11 VAL 126 1HG1 VAL 126 4.506 2.852 7.791 1008 HG12 VAL 126 2HG1 VAL 126 3.077 3.725 8.351 1009 HG13 VAL 126 3HG1 VAL 126 3.372 2.074 8.896 1010 HG21 VAL 126 3HG2 VAL 126 2.480 0.287 5.998 1011 HG22 VAL 126 1HG2 VAL 126 3.974 1.127 5.585 1012 HG23 VAL 126 2HG2 VAL 126 3.776 0.417 7.187 1013 H PHE 127 H PHE 127 -0.144 0.072 6.381 1014 HA PHE 127 HA PHE 127 0.447 -1.619 8.717 1015 HB2 PHE 127 1HB PHE 127 -1.885 -1.989 6.835 1016 HB3 PHE 127 2HB PHE 127 -1.660 -2.687 8.440 1017 HD1 PHE 127 2HD PHE 127 -0.920 -0.446 10.101 1018 HD2 PHE 127 1HD PHE 127 -3.764 -0.644 6.939 1019 HE1 PHE 127 2HE PHE 127 -2.169 1.416 11.113 1020 HE2 PHE 127 1HE PHE 127 -5.016 1.219 7.947 1021 HZ PHE 127 HZ PHE 127 -4.221 2.251 10.036 1022 H GLU 128 H GLU 128 0.561 -3.956 8.292 1023 HA GLU 128 HA GLU 128 1.525 -4.570 5.579 1024 HB2 GLU 128 1HB GLU 128 3.428 -4.250 7.132 1025 HB3 GLU 128 2HB GLU 128 2.776 -5.542 8.154 1026 HG2 GLU 128 1HG GLU 128 2.919 -6.678 5.619 1027 HG3 GLU 128 2HG GLU 128 4.397 -5.716 5.772 1028 H ILE 129 H ILE 129 0.469 -6.206 4.687 1029 HA ILE 129 HA ILE 129 -1.085 -7.995 6.412 1030 HB ILE 129 HB ILE 129 -2.174 -8.685 4.232 1031 HG12 ILE 129 1HG1 ILE 129 -0.984 -6.131 3.160 1032 HG13 ILE 129 2HG1 ILE 129 -0.213 -7.702 2.885 1033 HG21 ILE 129 1HG2 ILE 129 -3.121 -7.069 5.888 1034 HG22 ILE 129 2HG2 ILE 129 -2.449 -5.765 4.911 1035 HG23 ILE 129 3HG2 ILE 129 -3.676 -6.831 4.231 1036 HD11 ILE 129 3HD1 ILE 129 -3.075 -7.553 2.216 1037 HD12 ILE 129 1HD1 ILE 129 -1.983 -6.616 1.197 1038 HD13 ILE 129 2HD1 ILE 129 -1.748 -8.355 1.377 1039 H ARG 130 H ARG 130 -0.625 -10.099 6.616 1040 HA ARG 130 HA ARG 130 1.812 -11.122 5.521 1041 HB2 ARG 130 1HB ARG 130 1.216 -11.801 7.731 1042 HB3 ARG 130 2HB ARG 130 -0.367 -12.378 7.188 1043 HG2 ARG 130 1HG ARG 130 1.021 -14.281 7.581 1044 HG3 ARG 130 2HG ARG 130 0.789 -14.110 5.833 1045 HD2 ARG 130 1HD ARG 130 3.041 -14.417 5.814 1046 HD3 ARG 130 2HD ARG 130 3.021 -12.670 6.090 1047 HE ARG 130 HE ARG 130 3.875 -13.026 8.181 1048 HH11 ARG 130 2HH1 ARG 130 2.580 -16.018 6.961 1049 HH12 ARG 130 1HH1 ARG 130 3.194 -16.970 8.272 1050 HH21 ARG 130 1HH2 ARG 130 4.392 -15.973 9.951 1051 HH22 ARG 130 2HH2 ARG 130 4.688 -14.268 9.913 1052 H THR 131 H THR 131 -1.409 -11.025 4.450 1053 HA THR 131 HA THR 131 -0.815 -12.359 2.025 1054 HB THR 131 HB THR 131 -0.991 -14.425 3.174 1055 HG1 THR 131 1HG THR 131 -2.702 -13.753 1.314 1056 HG21 THR 131 3HG2 THR 131 -3.703 -13.835 4.268 1057 HG22 THR 131 1HG2 THR 131 -2.290 -13.220 5.122 1058 HG23 THR 131 2HG2 THR 131 -2.473 -14.953 4.855 1059 H THR 132 H THR 132 -2.331 -11.939 0.465 1060 HA THR 132 HA THR 132 -3.906 -9.793 0.462 1061 HB THR 132 HB THR 132 -5.447 -10.974 -1.175 1062 HG1 THR 132 1HG THR 132 -4.391 -13.093 -1.812 1063 HG21 THR 132 3HG2 THR 132 -3.894 -10.822 -2.884 1064 HG22 THR 132 1HG2 THR 132 -2.596 -11.509 -1.907 1065 HG23 THR 132 2HG2 THR 132 -3.132 -9.851 -1.623 1066 H ASP 133 H ASP 133 -5.103 -13.009 1.423 1067 HA ASP 133 HA ASP 133 -7.689 -12.615 1.975 1068 HB2 ASP 133 1HB ASP 133 -5.642 -14.338 3.003 1069 HB3 ASP 133 2HB ASP 133 -6.688 -13.834 4.337 1070 H ASP 134 H ASP 134 -5.058 -11.573 4.124 1071 HA ASP 134 HA ASP 134 -6.447 -10.562 6.242 1072 HB2 ASP 134 1HB ASP 134 -3.832 -10.339 5.252 1073 HB3 ASP 134 2HB ASP 134 -4.393 -8.675 5.464 1074 H LEU 135 H LEU 135 -5.736 -8.842 3.210 1075 HA LEU 135 HA LEU 135 -6.934 -6.416 3.810 1076 HB2 LEU 135 1HB LEU 135 -5.601 -6.636 1.845 1077 HB3 LEU 135 2HB LEU 135 -6.675 -7.888 1.199 1078 HG LEU 135 HG LEU 135 -8.275 -6.360 0.525 1079 HD11 LEU 135 1HD1 LEU 135 -8.879 -5.044 2.271 1080 HD12 LEU 135 2HD1 LEU 135 -7.921 -3.866 1.375 1081 HD13 LEU 135 3HD1 LEU 135 -7.213 -4.716 2.748 1082 HD21 LEU 135 3HD2 LEU 135 -6.645 -5.928 -1.018 1083 HD22 LEU 135 1HD2 LEU 135 -5.507 -5.323 0.186 1084 HD23 LEU 135 2HD2 LEU 135 -6.855 -4.313 -0.339 1085 H THR 136 H THR 136 -8.824 -6.791 5.009 1086 HA THR 136 HA THR 136 -11.140 -7.568 3.365 1087 HB THR 136 HB THR 136 -12.061 -8.241 5.791 1088 HG1 THR 136 1HG THR 136 -9.385 -9.158 5.931 1089 HG21 THR 136 3HG2 THR 136 -11.784 -10.511 5.168 1090 HG22 THR 136 1HG2 THR 136 -10.334 -10.155 4.232 1091 HG23 THR 136 2HG2 THR 136 -11.911 -9.607 3.660 1092 H GLU 137 H GLU 137 -13.008 -6.385 3.650 1093 HA GLU 137 HA GLU 137 -12.952 -3.742 4.152 1094 HB2 GLU 137 1HB GLU 137 -14.904 -5.023 3.272 1095 HB3 GLU 137 2HB GLU 137 -15.279 -5.504 4.935 1096 HG2 GLU 137 1HG GLU 137 -15.294 -2.944 5.403 1097 HG3 GLU 137 2HG GLU 137 -15.505 -2.820 3.651 1098 H THR 138 H THR 138 -13.623 -6.229 6.595 1099 HA THR 138 HA THR 138 -13.931 -4.398 8.746 1100 HB THR 138 HB THR 138 -13.132 -7.299 8.994 1101 HG1 THR 138 1HG THR 138 -15.279 -7.808 8.796 1102 HG21 THR 138 3HG2 THR 138 -14.736 -5.494 10.807 1103 HG22 THR 138 1HG2 THR 138 -13.051 -5.946 11.053 1104 HG23 THR 138 2HG2 THR 138 -14.312 -7.176 11.120 1105 H TRP 139 H TRP 139 -11.306 -6.732 8.093 1106 HA TRP 139 HA TRP 139 -9.502 -6.022 9.987 1107 HB2 TRP 139 1HB TRP 139 -8.925 -7.816 8.567 1108 HB3 TRP 139 2HB TRP 139 -9.079 -6.824 7.117 1109 HD1 TRP 139 HD TRP 139 -6.606 -7.688 9.873 1110 HE1 TRP 139 1HE TRP 139 -4.300 -6.721 9.263 1111 HE3 TRP 139 3HE TRP 139 -7.954 -4.865 5.829 1112 HZ2 TRP 139 2HZ TRP 139 -3.199 -4.990 7.324 1113 HZ3 TRP 139 3HZ TRP 139 -6.215 -3.583 4.653 1114 HH2 TRP 139 HH TRP 139 -3.887 -3.646 5.387 1115 H LEU 140 H LEU 140 -10.524 -4.096 7.315 1116 HA LEU 140 HA LEU 140 -8.291 -2.256 7.508 1117 HB2 LEU 140 1HB LEU 140 -9.045 -2.490 5.317 1118 HB3 LEU 140 2HB LEU 140 -10.748 -2.436 5.807 1119 HG LEU 140 HG LEU 140 -10.601 -0.049 6.194 1120 HD11 LEU 140 1HD1 LEU 140 -8.217 -0.076 6.938 1121 HD12 LEU 140 2HD1 LEU 140 -8.620 1.224 5.818 1122 HD13 LEU 140 3HD1 LEU 140 -7.748 -0.197 5.242 1123 HD21 LEU 140 3HD2 LEU 140 -11.249 -0.428 4.011 1124 HD22 LEU 140 1HD2 LEU 140 -9.698 -1.137 3.562 1125 HD23 LEU 140 2HD2 LEU 140 -9.837 0.606 3.794 1126 H LYS 141 H LYS 141 -11.822 -1.762 7.656 1127 HA LYS 141 HA LYS 141 -11.827 0.716 8.846 1128 HB2 LYS 141 1HB LYS 141 -13.736 -1.545 8.695 1129 HB3 LYS 141 2HB LYS 141 -14.046 -0.349 9.963 1130 HG2 LYS 141 1HG LYS 141 -14.600 1.291 8.498 1131 HG3 LYS 141 2HG LYS 141 -13.484 0.698 7.256 1132 HD2 LYS 141 1HD LYS 141 -15.311 -0.071 6.208 1133 HD3 LYS 141 2HD LYS 141 -15.304 -1.349 7.436 1134 HE2 LYS 141 1HE LYS 141 -16.586 1.176 8.270 1135 HE3 LYS 141 2HE LYS 141 -17.396 0.312 6.956 1136 HZ1 LYS 141 3HZ LYS 141 -16.658 -1.528 8.955 1137 HZ2 LYS 141 1HZ LYS 141 -18.208 -1.125 8.408 1138 HZ3 LYS 141 2HZ LYS 141 -17.503 -0.251 9.673 1139 H GLU 142 H GLU 142 -10.872 -2.257 10.219 1140 HA GLU 142 HA GLU 142 -11.429 -1.698 12.948 1141 HB2 GLU 142 1HB GLU 142 -9.715 -3.656 11.473 1142 HB3 GLU 142 2HB GLU 142 -9.456 -3.437 13.210 1143 HG2 GLU 142 1HG GLU 142 -12.058 -3.769 13.333 1144 HG3 GLU 142 2HG GLU 142 -11.802 -4.568 11.774 1145 H LYS 143 H LYS 143 -8.384 -1.576 11.094 1146 HA LYS 143 HA LYS 143 -6.811 -0.456 13.117 1147 HB2 LYS 143 1HB LYS 143 -6.495 -0.036 10.137 1148 HB3 LYS 143 2HB LYS 143 -5.233 0.115 11.368 1149 HG2 LYS 143 1HG LYS 143 -6.453 -2.490 11.514 1150 HG3 LYS 143 2HG LYS 143 -5.886 -2.149 9.869 1151 HD2 LYS 143 1HD LYS 143 -3.745 -1.271 11.191 1152 HD3 LYS 143 2HD LYS 143 -4.340 -2.436 12.389 1153 HE2 LYS 143 1HE LYS 143 -4.239 -4.238 10.805 1154 HE3 LYS 143 2HE LYS 143 -3.890 -3.111 9.487 1155 HZ1 LYS 143 3HZ LYS 143 -1.904 -4.279 10.287 1156 HZ2 LYS 143 1HZ LYS 143 -2.107 -3.582 11.815 1157 HZ3 LYS 143 2HZ LYS 143 -1.772 -2.603 10.476 1158 H LEU 144 H LEU 144 -8.870 1.051 10.688 1159 HA LEU 144 HA LEU 144 -8.042 3.721 11.239 1160 HB2 LEU 144 1HB LEU 144 -10.709 2.947 10.083 1161 HB3 LEU 144 2HB LEU 144 -9.751 4.407 9.783 1162 HG LEU 144 HG LEU 144 -8.985 1.642 8.850 1163 HD11 LEU 144 1HD1 LEU 144 -9.522 3.007 6.601 1164 HD12 LEU 144 2HD1 LEU 144 -10.715 3.723 7.682 1165 HD13 LEU 144 3HD1 LEU 144 -10.697 1.980 7.422 1166 HD21 LEU 144 3HD2 LEU 144 -6.987 2.616 8.626 1167 HD22 LEU 144 1HD2 LEU 144 -7.645 4.231 8.894 1168 HD23 LEU 144 2HD2 LEU 144 -7.713 3.506 7.287 1169 H ALA 145 H ALA 145 -10.831 1.763 12.232 1170 HA ALA 145 HA ALA 145 -12.428 3.440 13.569 1171 HB1 ALA 145 3HB ALA 145 -13.299 1.544 14.324 1172 HB2 ALA 145 1HB ALA 145 -11.881 0.685 13.721 1173 HB3 ALA 145 2HB ALA 145 -11.910 1.285 15.380 1174 H SER 146 H SER 146 -9.860 1.813 15.428 1175 HA SER 146 HA SER 146 -8.802 4.217 16.511 1176 HB2 SER 146 1HB SER 146 -11.184 3.613 17.670 1177 HB3 SER 146 2HB SER 146 -10.075 2.704 18.713 1178 HG SER 146 HG SER 146 -10.436 5.413 18.485 1179 H GLY 147 H GLY 147 -7.794 1.852 15.301 1180 HA2 GLY 147 1HA GLY 147 -6.832 -0.123 16.966 1181 HA3 GLY 147 2HA GLY 147 -5.977 0.469 15.549 1182 HA PRO 148 HA PRO 148 -3.796 1.535 19.653 1183 HB2 PRO 148 2HB PRO 148 -3.405 -0.608 20.386 1184 HB3 PRO 148 1HB PRO 148 -1.842 -0.383 19.603 1185 HG2 PRO 148 1HG PRO 148 -2.503 -1.473 17.661 1186 HG3 PRO 148 2HG PRO 148 -3.417 -2.402 18.907 1187 HD2 PRO 148 1HD PRO 148 -4.617 -1.266 16.752 1188 HD3 PRO 148 2HD PRO 148 -5.411 -1.400 18.331 1189 H SER 149 H SER 149 -2.869 3.372 18.906 1190 HA SER 149 HA SER 149 -0.468 3.070 17.237 1191 HB2 SER 149 1HB SER 149 -1.032 5.059 15.957 1192 HB3 SER 149 2HB SER 149 -2.357 3.889 15.842 1193 HG SER 149 HG SER 149 -2.348 5.958 17.769 1194 H SER 150 H SER 150 1.274 4.125 17.970 1195 HA SER 150 HA SER 150 0.878 6.128 20.096 1196 HB2 SER 150 1HB SER 150 2.924 5.332 21.171 1197 HB3 SER 150 2HB SER 150 1.769 4.000 20.991 1198 HG SER 150 HG SER 150 3.054 3.750 18.859 1199 H GLY 151 H GLY 151 1.284 8.038 19.166 1200 HA2 GLY 151 1HA GLY 151 2.687 8.656 16.924 1201 HA3 GLY 151 2HA GLY 151 2.590 9.737 18.306 Start of MODEL 20 1 H1 GLY 1 H GLY 1 10.876 -7.128 6.749 2 HA2 GLY 1 1HA GLY 1 9.840 -4.762 7.106 3 HA3 GLY 1 2HA GLY 1 8.574 -5.702 7.884 4 H SER 2 H SER 2 8.833 -6.352 9.952 5 HA SER 2 HA SER 2 11.475 -5.944 11.186 6 HB2 SER 2 1HB SER 2 9.171 -4.391 11.659 7 HB3 SER 2 2HB SER 2 9.339 -5.453 13.068 8 HG SER 2 HG SER 2 10.569 -3.651 13.462 9 H SER 3 H SER 3 8.264 -7.412 11.606 10 HA SER 3 HA SER 3 9.335 -9.382 13.449 11 HB2 SER 3 1HB SER 3 6.932 -8.197 13.379 12 HB3 SER 3 2HB SER 3 6.562 -9.617 12.386 13 HG SER 3 HG SER 3 6.219 -10.390 14.357 14 H GLY 4 H GLY 4 10.030 -11.343 12.899 15 HA2 GLY 4 1HA GLY 4 9.314 -13.355 11.509 16 HA3 GLY 4 2HA GLY 4 9.501 -12.262 10.146 17 H SER 5 H SER 5 11.379 -12.340 9.117 18 HA SER 5 HA SER 5 13.639 -13.651 10.451 19 HB2 SER 5 1HB SER 5 14.559 -13.958 8.177 20 HB3 SER 5 2HB SER 5 12.933 -14.648 8.329 21 HG SER 5 HG SER 5 13.168 -12.002 7.452 22 H SER 6 H SER 6 15.834 -12.815 9.437 23 HA SER 6 HA SER 6 16.102 -10.098 8.767 24 HB2 SER 6 1HB SER 6 15.465 -10.397 11.444 25 HB3 SER 6 2HB SER 6 17.233 -10.271 11.461 26 HG SER 6 HG SER 6 15.331 -8.375 10.793 27 H GLY 7 H GLY 7 18.453 -9.345 9.131 28 HA2 GLY 7 1HA GLY 7 20.447 -11.354 9.535 29 HA3 GLY 7 2HA GLY 7 20.194 -11.029 7.826 30 H SER 8 H SER 8 22.347 -10.256 7.672 31 HA SER 8 HA SER 8 23.558 -8.317 9.206 32 HB2 SER 8 1HB SER 8 23.887 -9.377 6.489 33 HB3 SER 8 2HB SER 8 24.432 -7.699 6.661 34 HG SER 8 HG SER 8 26.150 -8.517 7.534 35 H ASP 9 H ASP 9 24.157 -6.055 8.166 36 HA ASP 9 HA ASP 9 21.608 -4.647 7.886 37 HB2 ASP 9 1HB ASP 9 23.815 -4.126 9.441 38 HB3 ASP 9 2HB ASP 9 24.050 -3.029 8.074 39 H SER 10 H SER 10 21.324 -5.311 5.664 40 HA SER 10 HA SER 10 22.124 -3.351 3.816 41 HB2 SER 10 1HB SER 10 23.844 -5.752 4.019 42 HB3 SER 10 2HB SER 10 23.340 -5.313 2.378 43 HG SER 10 HG SER 10 24.981 -3.989 2.547 44 H LEU 11 H LEU 11 20.581 -3.269 2.322 45 HA LEU 11 HA LEU 11 19.258 -5.746 1.482 46 HB2 LEU 11 1HB LEU 11 17.780 -3.230 2.270 47 HB3 LEU 11 2HB LEU 11 17.064 -4.741 1.679 48 HG LEU 11 HG LEU 11 18.675 -4.760 4.198 49 HD11 LEU 11 1HD1 LEU 11 15.794 -3.907 3.967 50 HD12 LEU 11 2HD1 LEU 11 17.143 -2.913 4.513 51 HD13 LEU 11 3HD1 LEU 11 16.626 -4.300 5.472 52 HD21 LEU 11 3HD2 LEU 11 17.001 -6.538 4.738 53 HD22 LEU 11 1HD2 LEU 11 18.027 -6.893 3.348 54 HD23 LEU 11 2HD2 LEU 11 16.365 -6.356 3.103 55 H VAL 12 H VAL 12 17.500 -4.965 -0.298 56 HA VAL 12 HA VAL 12 19.123 -3.699 -2.352 57 HB VAL 12 HB VAL 12 16.350 -4.822 -2.704 58 HG11 VAL 12 1HG1 VAL 12 17.919 -5.293 -4.952 59 HG12 VAL 12 2HG1 VAL 12 16.663 -4.066 -4.774 60 HG13 VAL 12 3HG1 VAL 12 18.347 -3.662 -4.439 61 HG21 VAL 12 3HG2 VAL 12 17.766 -6.526 -1.652 62 HG22 VAL 12 1HG2 VAL 12 17.376 -6.944 -3.320 63 HG23 VAL 12 2HG2 VAL 12 18.971 -6.304 -2.922 64 H VAL 13 H VAL 13 18.175 -1.998 -0.261 65 HA VAL 13 HA VAL 13 15.932 -0.559 -0.492 66 HB VAL 13 HB VAL 13 17.888 0.000 0.980 67 HG11 VAL 13 1HG1 VAL 13 19.792 0.890 0.204 68 HG12 VAL 13 2HG1 VAL 13 19.264 0.279 -1.364 69 HG13 VAL 13 3HG1 VAL 13 18.948 1.957 -0.918 70 HG21 VAL 13 3HG2 VAL 13 15.822 1.450 0.562 71 HG22 VAL 13 1HG2 VAL 13 17.231 2.229 1.280 72 HG23 VAL 13 2HG2 VAL 13 16.880 2.450 -0.433 73 H CYS 14 H CYS 14 14.918 0.757 -1.899 74 HA CYS 14 HA CYS 14 16.314 1.378 -4.419 75 HB2 CYS 14 1HB CYS 14 14.467 0.864 -5.654 76 HB3 CYS 14 2HB CYS 14 14.248 -0.274 -4.315 77 HG CYS 14 HG CYS 14 12.727 2.783 -4.321 78 H GLU 15 H GLU 15 14.624 3.129 -5.569 79 HA GLU 15 HA GLU 15 14.435 5.336 -3.624 80 HB2 GLU 15 1HB GLU 15 15.349 6.853 -5.120 81 HB3 GLU 15 2HB GLU 15 16.310 5.397 -5.422 82 HG2 GLU 15 1HG GLU 15 14.543 4.919 -7.270 83 HG3 GLU 15 2HG GLU 15 14.197 6.647 -7.116 84 H VAL 16 H VAL 16 12.657 6.653 -3.721 85 HA VAL 16 HA VAL 16 10.292 5.580 -4.854 86 HB VAL 16 HB VAL 16 10.105 6.867 -2.845 87 HG11 VAL 16 1HG1 VAL 16 11.457 8.589 -2.482 88 HG12 VAL 16 2HG1 VAL 16 11.921 8.630 -4.184 89 HG13 VAL 16 3HG1 VAL 16 10.511 9.535 -3.630 90 HG21 VAL 16 3HG2 VAL 16 8.126 7.759 -3.395 91 HG22 VAL 16 1HG2 VAL 16 8.851 8.882 -4.543 92 HG23 VAL 16 2HG2 VAL 16 8.494 7.227 -5.035 93 H ASP 17 H ASP 17 10.458 5.419 -7.071 94 HA ASP 17 HA ASP 17 11.469 6.980 -8.975 95 HB2 ASP 17 1HB ASP 17 10.039 4.940 -9.327 96 HB3 ASP 17 2HB ASP 17 8.621 5.984 -9.154 97 HA PRO 18 HA PRO 18 9.829 11.052 -8.596 98 HB2 PRO 18 2HB PRO 18 11.645 11.729 -9.830 99 HB3 PRO 18 1HB PRO 18 10.446 11.976 -11.098 100 HG2 PRO 18 1HG PRO 18 10.887 9.929 -12.106 101 HG3 PRO 18 2HG PRO 18 12.526 10.380 -11.506 102 HD2 PRO 18 1HD PRO 18 11.349 8.007 -10.909 103 HD3 PRO 18 2HD PRO 18 12.423 8.854 -9.782 104 H GLU 19 H GLU 19 8.881 8.963 -11.262 105 HA GLU 19 HA GLU 19 6.708 10.585 -12.145 106 HB2 GLU 19 1HB GLU 19 6.319 8.974 -13.727 107 HB3 GLU 19 2HB GLU 19 8.010 8.622 -13.337 108 HG2 GLU 19 1HG GLU 19 7.340 6.518 -13.054 109 HG3 GLU 19 2HG GLU 19 6.672 7.087 -11.517 110 H LEU 20 H LEU 20 7.123 8.184 -9.679 111 HA LEU 20 HA LEU 20 4.260 7.843 -9.298 112 HB2 LEU 20 1HB LEU 20 6.226 6.089 -9.012 113 HB3 LEU 20 2HB LEU 20 6.268 6.776 -7.379 114 HG LEU 20 HG LEU 20 3.802 5.569 -8.625 115 HD11 LEU 20 1HD1 LEU 20 5.003 4.074 -6.462 116 HD12 LEU 20 2HD1 LEU 20 6.088 4.207 -7.846 117 HD13 LEU 20 3HD1 LEU 20 4.473 3.530 -8.054 118 HD21 LEU 20 3HD2 LEU 20 3.271 5.412 -6.093 119 HD22 LEU 20 1HD2 LEU 20 3.070 6.955 -6.922 120 HD23 LEU 20 2HD2 LEU 20 4.501 6.666 -5.931 121 H LYS 21 H LYS 21 7.044 9.099 -7.481 122 HA LYS 21 HA LYS 21 6.078 9.839 -5.113 123 HB2 LYS 21 1HB LYS 21 8.313 10.466 -6.158 124 HB3 LYS 21 2HB LYS 21 7.486 11.881 -6.829 125 HG2 LYS 21 1HG LYS 21 6.763 12.125 -4.248 126 HG3 LYS 21 2HG LYS 21 8.330 11.317 -4.063 127 HD2 LYS 21 1HD LYS 21 8.360 13.499 -6.023 128 HD3 LYS 21 2HD LYS 21 7.962 14.016 -4.376 129 HE2 LYS 21 1HE LYS 21 10.051 12.327 -3.901 130 HE3 LYS 21 2HE LYS 21 10.490 13.000 -5.478 131 HZ1 LYS 21 3HZ LYS 21 10.894 15.007 -4.601 132 HZ2 LYS 21 1HZ LYS 21 11.011 14.181 -3.129 133 HZ3 LYS 21 2HZ LYS 21 9.566 14.951 -3.555 134 H GLU 22 H GLU 22 5.400 11.615 -8.114 135 HA GLU 22 HA GLU 22 3.799 13.615 -6.941 136 HB2 GLU 22 1HB GLU 22 3.454 12.575 -9.753 137 HB3 GLU 22 2HB GLU 22 3.168 14.213 -9.145 138 HG2 GLU 22 1HG GLU 22 5.733 14.128 -8.590 139 HG3 GLU 22 2HG GLU 22 5.731 12.873 -9.838 140 H THR 23 H THR 23 2.955 10.535 -8.492 141 HA THR 23 HA THR 23 0.224 10.651 -8.489 142 HB THR 23 HB THR 23 2.072 8.336 -7.970 143 HG1 THR 23 1HG THR 23 0.269 8.723 -10.123 144 HG21 THR 23 3HG2 THR 23 -0.197 7.060 -8.557 145 HG22 THR 23 1HG2 THR 23 -0.881 8.440 -7.700 146 HG23 THR 23 2HG2 THR 23 0.292 7.397 -6.898 147 H LEU 24 H LEU 24 2.321 9.812 -5.757 148 HA LEU 24 HA LEU 24 0.240 9.202 -3.945 149 HB2 LEU 24 1HB LEU 24 2.968 10.274 -3.228 150 HB3 LEU 24 2HB LEU 24 1.903 9.258 -2.242 151 HG LEU 24 HG LEU 24 3.354 8.396 -4.744 152 HD11 LEU 24 1HD1 LEU 24 3.956 6.958 -2.319 153 HD12 LEU 24 2HD1 LEU 24 4.301 8.678 -2.141 154 HD13 LEU 24 3HD1 LEU 24 5.043 7.761 -3.451 155 HD21 LEU 24 3HD2 LEU 24 1.585 6.978 -4.817 156 HD22 LEU 24 1HD2 LEU 24 1.225 7.157 -3.099 157 HD23 LEU 24 2HD2 LEU 24 2.549 6.114 -3.619 158 H ARG 25 H ARG 25 2.231 12.137 -4.310 159 HA ARG 25 HA ARG 25 1.022 13.689 -2.358 160 HB2 ARG 25 1HB ARG 25 3.061 14.396 -3.442 161 HB3 ARG 25 2HB ARG 25 2.229 14.526 -4.998 162 HG2 ARG 25 1HG ARG 25 1.164 16.486 -4.443 163 HG3 ARG 25 2HG ARG 25 1.252 16.155 -2.705 164 HD2 ARG 25 1HD ARG 25 2.876 17.753 -2.832 165 HD3 ARG 25 2HD ARG 25 3.856 16.321 -3.182 166 HE ARG 25 HE ARG 25 2.927 17.224 -5.620 167 HH11 ARG 25 2HH1 ARG 25 4.888 18.456 -3.022 168 HH12 ARG 25 1HH1 ARG 25 5.837 19.479 -4.049 169 HH21 ARG 25 1HH2 ARG 25 5.426 19.542 -6.302 170 HH22 ARG 25 2HH2 ARG 25 4.169 18.566 -6.983 171 H LYS 26 H LYS 26 -0.069 12.894 -5.575 172 HA LYS 26 HA LYS 26 -2.177 14.868 -5.577 173 HB2 LYS 26 1HB LYS 26 -2.050 12.518 -7.447 174 HB3 LYS 26 2HB LYS 26 -2.671 14.149 -7.747 175 HG2 LYS 26 1HG LYS 26 0.089 14.375 -7.101 176 HG3 LYS 26 2HG LYS 26 -0.101 13.102 -8.320 177 HD2 LYS 26 1HD LYS 26 -1.731 14.928 -9.397 178 HD3 LYS 26 2HD LYS 26 -0.646 16.013 -8.509 179 HE2 LYS 26 1HE LYS 26 1.025 15.706 -9.967 180 HE3 LYS 26 2HE LYS 26 0.814 13.949 -9.932 181 HZ1 LYS 26 3HZ LYS 26 -0.335 15.916 -11.762 182 HZ2 LYS 26 1HZ LYS 26 -1.279 14.567 -11.378 183 HZ3 LYS 26 2HZ LYS 26 0.248 14.359 -12.076 184 H PHE 27 H PHE 27 -1.838 11.423 -4.959 185 HA PHE 27 HA PHE 27 -4.540 10.712 -4.915 186 HB2 PHE 27 1HB PHE 27 -2.392 9.246 -4.762 187 HB3 PHE 27 2HB PHE 27 -2.549 9.497 -3.023 188 HD1 PHE 27 1HD PHE 27 -5.084 8.871 -5.683 189 HD2 PHE 27 2HD PHE 27 -3.315 7.568 -2.038 190 HE1 PHE 27 1HE PHE 27 -6.721 7.038 -5.548 191 HE2 PHE 27 2HE PHE 27 -4.948 5.733 -1.897 192 HZ PHE 27 HZ PHE 27 -6.653 5.466 -3.653 193 H ARG 28 H ARG 28 -2.504 12.204 -2.474 194 HA ARG 28 HA ARG 28 -4.372 11.942 -0.336 195 HB2 ARG 28 1HB ARG 28 -2.213 14.041 -0.521 196 HB3 ARG 28 2HB ARG 28 -2.890 13.285 0.929 197 HG2 ARG 28 1HG ARG 28 -1.846 11.169 -0.572 198 HG3 ARG 28 2HG ARG 28 -0.649 12.471 -0.674 199 HD2 ARG 28 1HD ARG 28 -1.845 11.367 1.878 200 HD3 ARG 28 2HD ARG 28 -0.230 11.014 1.248 201 HE ARG 28 HE ARG 28 -0.163 13.683 1.433 202 HH11 ARG 28 2HH1 ARG 28 -1.205 11.234 3.677 203 HH12 ARG 28 1HH1 ARG 28 -0.782 12.156 5.081 204 HH21 ARG 28 1HH2 ARG 28 0.128 14.245 4.851 205 HH22 ARG 28 2HH2 ARG 28 0.397 14.907 3.274 206 H PHE 29 H PHE 29 -3.797 14.318 -2.836 207 HA PHE 29 HA PHE 29 -6.127 15.827 -1.857 208 HB2 PHE 29 1HB PHE 29 -4.144 17.322 -3.462 209 HB3 PHE 29 2HB PHE 29 -5.069 17.830 -2.047 210 HD1 PHE 29 1HD PHE 29 -4.335 16.058 0.056 211 HD2 PHE 29 2HD PHE 29 -1.901 17.655 -3.048 212 HE1 PHE 29 1HE PHE 29 -2.349 15.792 1.483 213 HE2 PHE 29 2HE PHE 29 0.090 17.391 -1.626 214 HZ PHE 29 HZ PHE 29 -0.132 16.459 0.642 215 H ARG 30 H ARG 30 -6.455 13.760 -3.608 216 HA ARG 30 HA ARG 30 -6.483 14.802 -6.315 217 HB2 ARG 30 1HB ARG 30 -7.384 12.597 -6.928 218 HB3 ARG 30 2HB ARG 30 -5.896 12.464 -5.980 219 HG2 ARG 30 1HG ARG 30 -7.477 12.206 -3.946 220 HG3 ARG 30 2HG ARG 30 -8.702 11.834 -5.171 221 HD2 ARG 30 1HD ARG 30 -6.412 10.338 -5.868 222 HD3 ARG 30 2HD ARG 30 -6.622 10.161 -4.120 223 HE ARG 30 HE ARG 30 -8.354 9.142 -6.189 224 HH11 ARG 30 2HH1 ARG 30 -8.062 10.010 -2.830 225 HH12 ARG 30 1HH1 ARG 30 -9.366 8.989 -2.318 226 HH21 ARG 30 1HH2 ARG 30 -10.507 7.728 -3.853 227 HH22 ARG 30 2HH2 ARG 30 -10.071 7.794 -5.527 228 H LYS 31 H LYS 31 -8.620 14.230 -7.565 229 HA LYS 31 HA LYS 31 -10.838 15.422 -6.036 230 HB2 LYS 31 1HB LYS 31 -10.046 15.637 -8.936 231 HB3 LYS 31 2HB LYS 31 -11.682 16.039 -8.389 232 HG2 LYS 31 1HG LYS 31 -9.434 17.304 -6.925 233 HG3 LYS 31 2HG LYS 31 -9.739 17.849 -8.585 234 HD2 LYS 31 1HD LYS 31 -11.941 18.539 -8.080 235 HD3 LYS 31 2HD LYS 31 -11.939 17.656 -6.544 236 HE2 LYS 31 1HE LYS 31 -9.810 19.318 -6.182 237 HE3 LYS 31 2HE LYS 31 -10.865 20.314 -7.195 238 HZ1 LYS 31 3HZ LYS 31 -12.050 18.935 -4.897 239 HZ2 LYS 31 1HZ LYS 31 -12.470 20.417 -5.599 240 HZ3 LYS 31 2HZ LYS 31 -11.104 20.308 -4.607 241 H GLU 32 H GLU 32 -10.317 12.642 -5.966 242 HA GLU 32 HA GLU 32 -12.388 11.492 -7.696 243 HB2 GLU 32 1HB GLU 32 -10.263 10.189 -5.978 244 HB3 GLU 32 2HB GLU 32 -11.480 9.301 -6.908 245 HG2 GLU 32 1HG GLU 32 -9.902 11.270 -8.436 246 HG3 GLU 32 2HG GLU 32 -9.010 9.875 -7.811 247 H THR 33 H THR 33 -11.426 11.716 -4.293 248 HA THR 33 HA THR 33 -12.552 11.267 -2.354 249 HB THR 33 HB THR 33 -14.664 12.366 -2.109 250 HG1 THR 33 1HG THR 33 -15.872 13.008 -3.948 251 HG21 THR 33 3HG2 THR 33 -12.704 13.828 -2.460 252 HG22 THR 33 1HG2 THR 33 -14.201 14.567 -3.029 253 HG23 THR 33 2HG2 THR 33 -13.066 13.870 -4.185 254 H ASN 34 H ASN 34 -12.431 9.056 -4.193 255 HA ASN 34 HA ASN 34 -14.744 7.557 -3.206 256 HB2 ASN 34 1HB ASN 34 -15.225 6.556 -5.319 257 HB3 ASN 34 2HB ASN 34 -15.163 8.304 -5.581 258 HD21 ASN 34 2HD2 ASN 34 -12.165 5.947 -7.070 259 HD22 ASN 34 1HD2 ASN 34 -13.065 5.449 -5.681 260 H ASN 35 H ASN 35 -14.248 5.564 -2.485 261 HA ASN 35 HA ASN 35 -11.818 4.732 -1.731 262 HB2 ASN 35 1HB ASN 35 -14.155 3.095 -2.708 263 HB3 ASN 35 2HB ASN 35 -12.692 2.330 -2.076 264 HD21 ASN 35 2HD2 ASN 35 -14.701 2.438 0.862 265 HD22 ASN 35 1HD2 ASN 35 -14.420 1.515 -0.572 266 H ALA 36 H ALA 36 -9.950 4.471 -2.743 267 HA ALA 36 HA ALA 36 -9.873 3.032 -5.282 268 HB1 ALA 36 3HB ALA 36 -8.798 4.663 -6.509 269 HB2 ALA 36 1HB ALA 36 -9.954 5.616 -5.578 270 HB3 ALA 36 2HB ALA 36 -8.264 5.541 -5.076 271 H ALA 37 H ALA 37 -7.624 2.437 -5.895 272 HA ALA 37 HA ALA 37 -5.770 2.355 -3.625 273 HB1 ALA 37 3HB ALA 37 -7.209 0.255 -3.770 274 HB2 ALA 37 1HB ALA 37 -6.312 -0.115 -5.242 275 HB3 ALA 37 2HB ALA 37 -5.460 0.032 -3.704 276 H ILE 38 H ILE 38 -3.570 1.902 -4.215 277 HA ILE 38 HA ILE 38 -2.965 2.122 -7.077 278 HB ILE 38 HB ILE 38 -1.446 3.738 -5.045 279 HG12 ILE 38 1HG1 ILE 38 -3.779 4.617 -6.764 280 HG13 ILE 38 2HG1 ILE 38 -3.768 4.508 -4.997 281 HG21 ILE 38 1HG2 ILE 38 -1.392 4.936 -7.561 282 HG22 ILE 38 2HG2 ILE 38 -0.097 4.027 -6.786 283 HG23 ILE 38 3HG2 ILE 38 -1.221 3.209 -7.868 284 HD11 ILE 38 3HD1 ILE 38 -3.226 6.758 -6.473 285 HD12 ILE 38 1HD1 ILE 38 -2.835 6.510 -4.771 286 HD13 ILE 38 2HD1 ILE 38 -1.625 6.181 -6.010 287 H ILE 39 H ILE 39 -2.075 0.149 -7.351 288 HA ILE 39 HA ILE 39 -0.209 -0.922 -5.403 289 HB ILE 39 HB ILE 39 -1.015 -2.098 -8.064 290 HG12 ILE 39 1HG1 ILE 39 -2.108 -3.270 -5.599 291 HG13 ILE 39 2HG1 ILE 39 -2.698 -1.637 -5.946 292 HG21 ILE 39 1HG2 ILE 39 0.549 -3.089 -5.722 293 HG22 ILE 39 2HG2 ILE 39 -0.378 -4.226 -6.701 294 HG23 ILE 39 3HG2 ILE 39 0.885 -3.247 -7.446 295 HD11 ILE 39 3HD1 ILE 39 -3.203 -2.511 -8.295 296 HD12 ILE 39 1HD1 ILE 39 -3.013 -4.115 -7.590 297 HD13 ILE 39 2HD1 ILE 39 -4.253 -3.023 -6.973 298 H MET 40 H MET 40 1.856 -0.352 -5.440 299 HA MET 40 HA MET 40 3.084 0.351 -8.021 300 HB2 MET 40 1HB MET 40 4.193 1.043 -5.302 301 HB3 MET 40 2HB MET 40 4.592 1.766 -6.868 302 HG2 MET 40 1HG MET 40 2.821 3.168 -6.847 303 HG3 MET 40 2HG MET 40 1.779 1.994 -6.038 304 HE1 MET 40 3HE MET 40 1.914 2.506 -2.505 305 HE2 MET 40 1HE MET 40 0.811 3.411 -3.542 306 HE3 MET 40 2HE MET 40 1.261 1.759 -3.964 307 H LYS 41 H LYS 41 4.999 -0.585 -8.651 308 HA LYS 41 HA LYS 41 5.882 -2.888 -7.039 309 HB2 LYS 41 1HB LYS 41 6.501 -4.014 -9.060 310 HB3 LYS 41 2HB LYS 41 4.846 -3.416 -9.257 311 HG2 LYS 41 1HG LYS 41 5.389 -2.081 -10.968 312 HG3 LYS 41 2HG LYS 41 6.888 -1.547 -10.187 313 HD2 LYS 41 1HD LYS 41 8.153 -3.173 -11.157 314 HD3 LYS 41 2HD LYS 41 6.822 -4.343 -11.161 315 HE2 LYS 41 1HE LYS 41 5.758 -3.133 -13.024 316 HE3 LYS 41 2HE LYS 41 7.103 -1.984 -13.021 317 HZ1 LYS 41 3HZ LYS 41 8.412 -4.303 -13.227 318 HZ2 LYS 41 1HZ LYS 41 7.934 -3.370 -14.556 319 HZ3 LYS 41 2HZ LYS 41 6.989 -4.683 -14.060 320 H VAL 42 H VAL 42 8.234 -3.542 -7.827 321 HA VAL 42 HA VAL 42 9.887 -1.111 -7.961 322 HB VAL 42 HB VAL 42 10.038 -1.683 -5.680 323 HG11 VAL 42 1HG1 VAL 42 10.039 -3.789 -4.771 324 HG12 VAL 42 2HG1 VAL 42 9.100 -4.074 -6.238 325 HG13 VAL 42 3HG1 VAL 42 10.806 -4.517 -6.182 326 HG21 VAL 42 3HG2 VAL 42 12.270 -1.626 -5.566 327 HG22 VAL 42 1HG2 VAL 42 12.431 -3.213 -6.318 328 HG23 VAL 42 2HG2 VAL 42 12.247 -1.775 -7.323 329 H ASP 43 H ASP 43 10.674 -1.304 -9.984 330 HA ASP 43 HA ASP 43 11.293 -3.727 -11.277 331 HB2 ASP 43 1HB ASP 43 12.152 -0.874 -11.786 332 HB3 ASP 43 2HB ASP 43 12.628 -2.216 -12.836 333 H LYS 44 H LYS 44 12.825 -5.116 -10.726 334 HA LYS 44 HA LYS 44 14.987 -4.495 -9.014 335 HB2 LYS 44 1HB LYS 44 13.932 -6.754 -9.300 336 HB3 LYS 44 2HB LYS 44 14.755 -6.874 -10.863 337 HG2 LYS 44 1HG LYS 44 16.516 -6.201 -8.609 338 HG3 LYS 44 2HG LYS 44 15.750 -7.797 -8.516 339 HD2 LYS 44 1HD LYS 44 16.538 -7.726 -11.133 340 HD3 LYS 44 2HD LYS 44 17.828 -6.809 -10.336 341 HE2 LYS 44 1HE LYS 44 18.394 -8.614 -8.916 342 HE3 LYS 44 2HE LYS 44 16.898 -9.475 -9.305 343 HZ1 LYS 44 3HZ LYS 44 18.808 -10.435 -10.439 344 HZ2 LYS 44 1HZ LYS 44 19.120 -8.960 -11.207 345 HZ3 LYS 44 2HZ LYS 44 17.699 -9.810 -11.553 346 H ASP 45 H ASP 45 14.546 -4.097 -12.369 347 HA ASP 45 HA ASP 45 17.347 -4.215 -13.063 348 HB2 ASP 45 1HB ASP 45 14.852 -4.176 -14.470 349 HB3 ASP 45 2HB ASP 45 15.861 -2.851 -15.065 350 H ARG 46 H ARG 46 14.960 -1.760 -12.298 351 HA ARG 46 HA ARG 46 16.990 0.330 -12.686 352 HB2 ARG 46 1HB ARG 46 14.014 0.672 -12.260 353 HB3 ARG 46 2HB ARG 46 15.173 1.920 -12.738 354 HG2 ARG 46 1HG ARG 46 15.562 0.778 -14.862 355 HG3 ARG 46 2HG ARG 46 14.411 -0.482 -14.385 356 HD2 ARG 46 1HD ARG 46 12.915 0.782 -15.506 357 HD3 ARG 46 2HD ARG 46 12.900 1.729 -14.011 358 HE ARG 46 HE ARG 46 14.916 2.853 -15.418 359 HH11 ARG 46 2HH1 ARG 46 11.601 2.103 -16.174 360 HH12 ARG 46 1HH1 ARG 46 11.422 3.416 -17.290 361 HH21 ARG 46 1HH2 ARG 46 13.181 4.827 -17.694 362 HH22 ARG 46 2HH2 ARG 46 14.693 4.586 -16.884 363 H GLN 47 H GLN 47 15.779 -1.597 -10.310 364 HA GLN 47 HA GLN 47 15.568 -1.461 -8.033 365 HB2 GLN 47 1HB GLN 47 17.924 0.413 -8.343 366 HB3 GLN 47 2HB GLN 47 17.523 -0.572 -6.927 367 HG2 GLN 47 1HG GLN 47 17.780 -2.207 -9.301 368 HG3 GLN 47 2HG GLN 47 19.235 -1.248 -9.003 369 HE21 GLN 47 2HE2 GLN 47 18.540 -4.520 -6.864 370 HE22 GLN 47 1HE2 GLN 47 17.676 -4.076 -8.294 371 H MET 48 H MET 48 13.673 0.116 -9.036 372 HA MET 48 HA MET 48 13.543 2.266 -7.083 373 HB2 MET 48 1HB MET 48 13.291 4.033 -8.524 374 HB3 MET 48 2HB MET 48 14.446 3.047 -9.435 375 HG2 MET 48 1HG MET 48 12.204 2.019 -10.436 376 HG3 MET 48 2HG MET 48 11.591 3.610 -9.979 377 HE1 MET 48 3HE MET 48 14.394 5.750 -11.196 378 HE2 MET 48 1HE MET 48 12.856 6.107 -11.980 379 HE3 MET 48 2HE MET 48 12.890 5.628 -10.283 380 H VAL 49 H VAL 49 11.507 2.633 -6.341 381 HA VAL 49 HA VAL 49 9.488 0.714 -6.999 382 HB VAL 49 HB VAL 49 9.574 3.059 -5.118 383 HG11 VAL 49 1HG1 VAL 49 7.326 3.062 -5.943 384 HG12 VAL 49 2HG1 VAL 49 7.204 1.311 -5.764 385 HG13 VAL 49 3HG1 VAL 49 7.321 2.339 -4.335 386 HG21 VAL 49 3HG2 VAL 49 8.822 0.465 -4.069 387 HG22 VAL 49 1HG2 VAL 49 10.371 0.413 -4.908 388 HG23 VAL 49 2HG2 VAL 49 10.127 1.544 -3.578 389 H VAL 50 H VAL 50 8.474 0.901 -8.903 390 HA VAL 50 HA VAL 50 7.433 3.552 -9.663 391 HB VAL 50 HB VAL 50 7.416 2.766 -11.991 392 HG11 VAL 50 1HG1 VAL 50 9.746 2.987 -12.401 393 HG12 VAL 50 2HG1 VAL 50 9.389 3.945 -10.963 394 HG13 VAL 50 3HG1 VAL 50 10.152 2.363 -10.802 395 HG21 VAL 50 3HG2 VAL 50 9.181 0.492 -11.591 396 HG22 VAL 50 1HG2 VAL 50 7.586 0.244 -10.882 397 HG23 VAL 50 2HG2 VAL 50 7.737 0.640 -12.594 398 H LEU 51 H LEU 51 5.307 3.741 -10.298 399 HA LEU 51 HA LEU 51 3.376 2.205 -9.107 400 HB2 LEU 51 1HB LEU 51 3.021 4.437 -10.108 401 HB3 LEU 51 2HB LEU 51 3.089 3.691 -11.715 402 HG LEU 51 HG LEU 51 1.085 2.279 -10.909 403 HD11 LEU 51 1HD1 LEU 51 -0.090 4.205 -9.280 404 HD12 LEU 51 2HD1 LEU 51 1.532 3.983 -8.624 405 HD13 LEU 51 3HD1 LEU 51 0.457 2.597 -8.804 406 HD21 LEU 51 3HD2 LEU 51 1.244 4.403 -12.475 407 HD22 LEU 51 1HD2 LEU 51 0.330 5.142 -11.160 408 HD23 LEU 51 2HD2 LEU 51 -0.311 3.724 -11.991 409 H GLU 52 H GLU 52 1.833 0.679 -9.917 410 HA GLU 52 HA GLU 52 2.770 -0.884 -12.229 411 HB2 GLU 52 1HB GLU 52 3.457 -2.069 -10.233 412 HB3 GLU 52 2HB GLU 52 1.823 -1.950 -9.564 413 HG2 GLU 52 1HG GLU 52 0.943 -3.482 -11.113 414 HG3 GLU 52 2HG GLU 52 2.375 -3.370 -12.146 415 H ASP 53 H ASP 53 0.087 0.062 -10.160 416 HA ASP 53 HA ASP 53 -1.726 0.036 -12.377 417 HB2 ASP 53 1HB ASP 53 -1.783 -2.154 -10.340 418 HB3 ASP 53 2HB ASP 53 -3.321 -1.526 -10.949 419 H GLU 54 H GLU 54 -3.902 0.796 -11.749 420 HA GLU 54 HA GLU 54 -4.130 2.008 -9.118 421 HB2 GLU 54 1HB GLU 54 -3.496 3.510 -11.568 422 HB3 GLU 54 2HB GLU 54 -4.873 4.148 -10.655 423 HG2 GLU 54 1HG GLU 54 -3.349 4.044 -8.605 424 HG3 GLU 54 2HG GLU 54 -2.030 3.837 -9.765 425 H LEU 55 H LEU 55 -6.028 1.143 -8.553 426 HA LEU 55 HA LEU 55 -8.226 1.153 -10.505 427 HB2 LEU 55 1HB LEU 55 -8.160 -0.301 -7.864 428 HB3 LEU 55 2HB LEU 55 -9.253 -0.564 -9.233 429 HG LEU 55 HG LEU 55 -6.320 -1.048 -9.564 430 HD11 LEU 55 1HD1 LEU 55 -6.806 -2.281 -7.574 431 HD12 LEU 55 2HD1 LEU 55 -6.748 -3.418 -8.921 432 HD13 LEU 55 3HD1 LEU 55 -8.303 -2.908 -8.265 433 HD21 LEU 55 3HD2 LEU 55 -7.401 -2.896 -11.026 434 HD22 LEU 55 1HD2 LEU 55 -7.416 -1.227 -11.595 435 HD23 LEU 55 2HD2 LEU 55 -8.866 -1.924 -10.871 436 H GLN 56 H GLN 56 -10.129 2.188 -10.102 437 HA GLN 56 HA GLN 56 -10.259 3.787 -7.631 438 HB2 GLN 56 1HB GLN 56 -11.238 4.482 -10.410 439 HB3 GLN 56 2HB GLN 56 -11.554 5.450 -8.960 440 HG2 GLN 56 1HG GLN 56 -9.760 6.542 -9.930 441 HG3 GLN 56 2HG GLN 56 -9.000 5.522 -8.701 442 HE21 GLN 56 2HE2 GLN 56 -6.951 3.911 -10.948 443 HE22 GLN 56 1HE2 GLN 56 -7.325 4.368 -9.324 444 H ASN 57 H ASN 57 -12.353 4.189 -6.749 445 HA ASN 57 HA ASN 57 -14.371 3.482 -5.968 446 HB2 ASN 57 1HB ASN 57 -14.861 2.823 -8.886 447 HB3 ASN 57 2HB ASN 57 -16.098 3.064 -7.647 448 HD21 ASN 57 2HD2 ASN 57 -14.104 6.278 -9.191 449 HD22 ASN 57 1HD2 ASN 57 -13.425 4.692 -9.280 450 H ILE 58 H ILE 58 -12.601 1.650 -5.348 451 HA ILE 58 HA ILE 58 -13.948 -0.899 -5.943 452 HB ILE 58 HB ILE 58 -12.078 -1.578 -6.958 453 HG12 ILE 58 1HG1 ILE 58 -11.935 -2.549 -4.596 454 HG13 ILE 58 2HG1 ILE 58 -10.458 -2.589 -5.573 455 HG21 ILE 58 1HG2 ILE 58 -9.843 -0.302 -6.515 456 HG22 ILE 58 2HG2 ILE 58 -11.114 0.443 -7.482 457 HG23 ILE 58 3HG2 ILE 58 -10.906 0.905 -5.793 458 HD11 ILE 58 3HD1 ILE 58 -10.426 -0.152 -4.166 459 HD12 ILE 58 1HD1 ILE 58 -10.869 -1.413 -3.016 460 HD13 ILE 58 2HD1 ILE 58 -9.379 -1.554 -3.950 461 H SER 59 H SER 59 -14.303 -2.242 -4.238 462 HA SER 59 HA SER 59 -13.997 -1.109 -1.601 463 HB2 SER 59 1HB SER 59 -15.641 -3.150 -2.862 464 HB3 SER 59 2HB SER 59 -14.973 -3.715 -1.320 465 HG SER 59 HG SER 59 -16.097 -1.149 -1.453 466 HA PRO 60 HA PRO 60 -10.531 -3.346 -0.106 467 HB2 PRO 60 2HB PRO 60 -11.044 -2.626 2.015 468 HB3 PRO 60 1HB PRO 60 -11.351 -4.337 2.312 469 HG2 PRO 60 1HG PRO 60 -13.643 -4.123 1.993 470 HG3 PRO 60 2HG PRO 60 -13.248 -2.535 2.751 471 HD2 PRO 60 1HD PRO 60 -14.572 -2.744 0.390 472 HD3 PRO 60 2HD PRO 60 -13.452 -1.418 0.745 473 H GLU 61 H GLU 61 -13.212 -4.972 -1.154 474 HA GLU 61 HA GLU 61 -12.171 -7.627 -0.476 475 HB2 GLU 61 1HB GLU 61 -14.825 -6.530 -1.158 476 HB3 GLU 61 2HB GLU 61 -14.461 -8.114 -1.858 477 HG2 GLU 61 1HG GLU 61 -14.379 -9.169 0.173 478 HG3 GLU 61 2HG GLU 61 -13.942 -7.688 1.037 479 H GLU 62 H GLU 62 -12.597 -5.418 -3.115 480 HA GLU 62 HA GLU 62 -12.095 -7.402 -5.156 481 HB2 GLU 62 1HB GLU 62 -13.037 -4.679 -5.050 482 HB3 GLU 62 2HB GLU 62 -11.724 -4.824 -6.230 483 HG2 GLU 62 1HG GLU 62 -13.653 -6.994 -6.441 484 HG3 GLU 62 2HG GLU 62 -14.381 -5.396 -6.668 485 H LEU 63 H LEU 63 -10.328 -4.772 -3.587 486 HA LEU 63 HA LEU 63 -8.032 -4.727 -5.125 487 HB2 LEU 63 1HB LEU 63 -8.870 -3.516 -2.822 488 HB3 LEU 63 2HB LEU 63 -7.551 -4.546 -2.237 489 HG LEU 63 HG LEU 63 -7.460 -2.137 -3.967 490 HD11 LEU 63 1HD1 LEU 63 -6.828 -2.118 -1.581 491 HD12 LEU 63 2HD1 LEU 63 -5.499 -1.665 -2.647 492 HD13 LEU 63 3HD1 LEU 63 -5.547 -3.278 -1.935 493 HD21 LEU 63 3HD2 LEU 63 -5.036 -3.061 -4.517 494 HD22 LEU 63 1HD2 LEU 63 -6.415 -3.366 -5.574 495 HD23 LEU 63 2HD2 LEU 63 -5.882 -4.607 -4.439 496 H LYS 64 H LYS 64 -8.688 -6.740 -2.263 497 HA LYS 64 HA LYS 64 -6.283 -8.107 -2.141 498 HB2 LYS 64 1HB LYS 64 -7.382 -8.884 -0.363 499 HB3 LYS 64 2HB LYS 64 -8.942 -8.419 -1.061 500 HG2 LYS 64 1HG LYS 64 -9.252 -10.493 -2.090 501 HG3 LYS 64 2HG LYS 64 -7.539 -10.921 -1.927 502 HD2 LYS 64 1HD LYS 64 -7.947 -11.926 0.015 503 HD3 LYS 64 2HD LYS 64 -8.580 -10.406 0.673 504 HE2 LYS 64 1HE LYS 64 -10.701 -11.148 -0.805 505 HE3 LYS 64 2HE LYS 64 -10.020 -12.741 -0.440 506 HZ1 LYS 64 3HZ LYS 64 -11.713 -11.574 1.172 507 HZ2 LYS 64 1HZ LYS 64 -10.307 -10.846 1.771 508 HZ3 LYS 64 2HZ LYS 64 -10.451 -12.531 1.769 509 H LEU 65 H LEU 65 -9.056 -8.642 -4.227 510 HA LEU 65 HA LEU 65 -8.194 -11.155 -5.247 511 HB2 LEU 65 1HB LEU 65 -10.239 -9.116 -6.017 512 HB3 LEU 65 2HB LEU 65 -9.796 -10.375 -7.183 513 HG LEU 65 HG LEU 65 -10.706 -12.078 -5.886 514 HD11 LEU 65 1HD1 LEU 65 -9.693 -11.697 -3.783 515 HD12 LEU 65 2HD1 LEU 65 -11.433 -11.674 -3.506 516 HD13 LEU 65 3HD1 LEU 65 -10.533 -10.160 -3.575 517 HD21 LEU 65 3HD2 LEU 65 -12.549 -10.970 -6.768 518 HD22 LEU 65 1HD2 LEU 65 -12.349 -9.580 -5.701 519 HD23 LEU 65 2HD2 LEU 65 -12.945 -11.109 -5.054 520 H GLU 66 H GLU 66 -7.683 -7.810 -6.191 521 HA GLU 66 HA GLU 66 -6.546 -8.346 -8.731 522 HB2 GLU 66 1HB GLU 66 -6.041 -5.959 -6.941 523 HB3 GLU 66 2HB GLU 66 -5.799 -6.044 -8.693 524 HG2 GLU 66 1HG GLU 66 -8.504 -6.498 -7.475 525 HG3 GLU 66 2HG GLU 66 -7.896 -4.870 -7.804 526 H LEU 67 H LEU 67 -5.255 -8.210 -5.483 527 HA LEU 67 HA LEU 67 -2.511 -8.119 -6.205 528 HB2 LEU 67 1HB LEU 67 -3.815 -9.150 -3.679 529 HB3 LEU 67 2HB LEU 67 -2.092 -8.791 -3.885 530 HG LEU 67 HG LEU 67 -4.300 -6.743 -4.061 531 HD11 LEU 67 1HD1 LEU 67 -3.554 -7.984 -1.787 532 HD12 LEU 67 2HD1 LEU 67 -4.096 -6.307 -1.863 533 HD13 LEU 67 3HD1 LEU 67 -2.371 -6.676 -1.840 534 HD21 LEU 67 3HD2 LEU 67 -1.349 -6.274 -3.748 535 HD22 LEU 67 1HD2 LEU 67 -2.609 -5.116 -4.177 536 HD23 LEU 67 2HD2 LEU 67 -2.129 -6.362 -5.329 537 HA PRO 68 HA PRO 68 -1.663 -12.271 -7.356 538 HB2 PRO 68 2HB PRO 68 0.455 -11.557 -7.889 539 HB3 PRO 68 1HB PRO 68 0.923 -12.526 -6.493 540 HG2 PRO 68 1HG PRO 68 0.973 -10.693 -5.065 541 HG3 PRO 68 2HG PRO 68 1.535 -9.947 -6.608 542 HD2 PRO 68 1HD PRO 68 -0.551 -8.961 -5.179 543 HD3 PRO 68 2HD PRO 68 -0.486 -8.893 -6.947 544 H GLU 69 H GLU 69 -0.091 -14.145 -6.174 545 HA GLU 69 HA GLU 69 -1.414 -14.601 -3.581 546 HB2 GLU 69 1HB GLU 69 -1.167 -17.040 -4.086 547 HB3 GLU 69 2HB GLU 69 -2.260 -16.174 -5.176 548 HG2 GLU 69 1HG GLU 69 -1.133 -16.998 -6.892 549 HG3 GLU 69 2HG GLU 69 0.255 -16.029 -6.380 550 H ARG 70 H ARG 70 1.563 -14.465 -5.305 551 HA ARG 70 HA ARG 70 3.033 -14.800 -2.825 552 HB2 ARG 70 1HB ARG 70 4.674 -16.351 -4.073 553 HB3 ARG 70 2HB ARG 70 3.172 -17.046 -3.445 554 HG2 ARG 70 1HG ARG 70 3.199 -17.971 -5.532 555 HG3 ARG 70 2HG ARG 70 2.275 -16.492 -5.846 556 HD2 ARG 70 1HD ARG 70 3.972 -15.499 -7.019 557 HD3 ARG 70 2HD ARG 70 5.228 -16.337 -6.096 558 HE ARG 70 HE ARG 70 3.697 -18.090 -7.776 559 HH11 ARG 70 2HH1 ARG 70 6.401 -15.900 -7.647 560 HH12 ARG 70 1HH1 ARG 70 7.221 -16.629 -8.988 561 HH21 ARG 70 1HH2 ARG 70 6.291 -18.423 -10.067 562 HH22 ARG 70 2HH2 ARG 70 4.768 -19.057 -9.543 563 H GLN 71 H GLN 71 2.698 -12.459 -4.076 564 HA GLN 71 HA GLN 71 5.384 -11.897 -5.085 565 HB2 GLN 71 1HB GLN 71 2.822 -11.485 -6.549 566 HB3 GLN 71 2HB GLN 71 4.056 -10.222 -6.684 567 HG2 GLN 71 1HG GLN 71 5.653 -12.197 -7.250 568 HG3 GLN 71 2HG GLN 71 4.149 -13.055 -7.610 569 HE21 GLN 71 2HE2 GLN 71 3.292 -10.725 -10.271 570 HE22 GLN 71 1HE2 GLN 71 2.574 -11.374 -8.841 571 HA PRO 72 HA PRO 72 4.631 -8.800 -1.921 572 HB2 PRO 72 2HB PRO 72 6.640 -9.436 -1.005 573 HB3 PRO 72 1HB PRO 72 7.237 -7.969 -1.779 574 HG2 PRO 72 1HG PRO 72 8.047 -9.111 -3.634 575 HG3 PRO 72 2HG PRO 72 8.335 -10.321 -2.328 576 HD2 PRO 72 1HD PRO 72 6.952 -10.907 -4.590 577 HD3 PRO 72 2HD PRO 72 6.570 -11.631 -3.018 578 H ARG 73 H ARG 73 4.049 -6.726 -2.154 579 HA ARG 73 HA ARG 73 5.408 -4.920 -3.915 580 HB2 ARG 73 1HB ARG 73 3.375 -4.397 -5.288 581 HB3 ARG 73 2HB ARG 73 4.104 -5.976 -5.618 582 HG2 ARG 73 1HG ARG 73 2.396 -7.030 -4.153 583 HG3 ARG 73 2HG ARG 73 1.628 -5.440 -3.994 584 HD2 ARG 73 1HD ARG 73 0.477 -6.696 -5.706 585 HD3 ARG 73 2HD ARG 73 1.363 -5.358 -6.452 586 HE ARG 73 HE ARG 73 2.967 -7.676 -6.468 587 HH11 ARG 73 2HH1 ARG 73 0.142 -6.320 -7.985 588 HH12 ARG 73 1HH1 ARG 73 0.354 -7.201 -9.462 589 HH21 ARG 73 1HH2 ARG 73 2.125 -8.635 -9.700 590 HH22 ARG 73 2HH2 ARG 73 3.256 -8.840 -8.407 591 H PHE 74 H PHE 74 3.989 -2.801 -4.077 592 HA PHE 74 HA PHE 74 2.998 -2.279 -1.355 593 HB2 PHE 74 1HB PHE 74 4.186 -0.370 -3.387 594 HB3 PHE 74 2HB PHE 74 3.583 0.093 -1.794 595 HD1 PHE 74 2HD PHE 74 4.589 -1.774 0.063 596 HD2 PHE 74 1HD PHE 74 6.484 -0.259 -3.434 597 HE1 PHE 74 2HE PHE 74 6.791 -2.236 1.060 598 HE2 PHE 74 1HE PHE 74 8.688 -0.720 -2.444 599 HZ PHE 74 HZ PHE 74 8.844 -1.709 -0.194 600 H VAL 75 H VAL 75 1.155 -0.965 -1.067 601 HA VAL 75 HA VAL 75 -0.416 -0.206 -3.383 602 HB VAL 75 HB VAL 75 -1.597 -2.129 -1.378 603 HG11 VAL 75 1HG1 VAL 75 -2.729 -0.362 -3.311 604 HG12 VAL 75 2HG1 VAL 75 -3.042 -2.027 -3.801 605 HG13 VAL 75 3HG1 VAL 75 -3.546 -1.467 -2.206 606 HG21 VAL 75 3HG2 VAL 75 0.118 -3.213 -2.793 607 HG22 VAL 75 1HG2 VAL 75 -1.507 -3.825 -3.094 608 HG23 VAL 75 2HG2 VAL 75 -0.769 -2.691 -4.224 609 H VAL 76 H VAL 76 -1.740 1.491 -2.974 610 HA VAL 76 HA VAL 76 -1.950 2.373 -0.168 611 HB VAL 76 HB VAL 76 -1.620 3.998 -2.684 612 HG11 VAL 76 1HG1 VAL 76 -2.948 5.553 -1.804 613 HG12 VAL 76 2HG1 VAL 76 -3.084 4.672 -0.280 614 HG13 VAL 76 3HG1 VAL 76 -1.729 5.769 -0.549 615 HG21 VAL 76 3HG2 VAL 76 0.299 3.011 -1.156 616 HG22 VAL 76 1HG2 VAL 76 0.417 4.624 -1.859 617 HG23 VAL 76 2HG2 VAL 76 -0.078 4.428 -0.177 618 H TYR 77 H TYR 77 -3.951 1.566 0.323 619 HA TYR 77 HA TYR 77 -6.190 2.113 -1.463 620 HB2 TYR 77 1HB TYR 77 -5.871 -0.129 -0.358 621 HB3 TYR 77 2HB TYR 77 -6.226 0.655 1.185 622 HD1 TYR 77 1HD TYR 77 -7.863 1.227 -2.107 623 HD2 TYR 77 2HD TYR 77 -8.260 -0.284 1.851 624 HE1 TYR 77 1HE TYR 77 -10.275 0.909 -2.476 625 HE2 TYR 77 2HE TYR 77 -10.671 -0.607 1.492 626 HH TYR 77 HH TYR 77 -12.246 0.464 -1.480 627 H SER 78 H SER 78 -7.701 3.628 -1.119 628 HA SER 78 HA SER 78 -7.499 5.204 1.362 629 HB2 SER 78 1HB SER 78 -6.903 6.363 -0.808 630 HB3 SER 78 2HB SER 78 -8.598 6.166 -1.286 631 HG SER 78 HG SER 78 -8.894 7.212 0.972 632 H TYR 79 H TYR 79 -9.011 4.231 2.633 633 HA TYR 79 HA TYR 79 -11.627 3.566 1.596 634 HB2 TYR 79 1HB TYR 79 -10.739 2.047 3.205 635 HB3 TYR 79 2HB TYR 79 -10.373 3.354 4.333 636 HD1 TYR 79 2HD TYR 79 -13.089 1.326 2.902 637 HD2 TYR 79 1HD TYR 79 -12.049 4.281 5.781 638 HE1 TYR 79 2HE TYR 79 -15.270 1.019 3.995 639 HE2 TYR 79 1HE TYR 79 -14.228 3.982 6.883 640 HH TYR 79 HH TYR 79 -16.027 2.553 7.046 641 H LYS 80 H LYS 80 -13.605 4.346 2.650 642 HA LYS 80 HA LYS 80 -13.360 7.190 3.375 643 HB2 LYS 80 1HB LYS 80 -14.554 6.757 1.262 644 HB3 LYS 80 2HB LYS 80 -15.713 5.747 2.140 645 HG2 LYS 80 1HG LYS 80 -16.461 7.665 3.432 646 HG3 LYS 80 2HG LYS 80 -15.266 8.688 2.616 647 HD2 LYS 80 1HD LYS 80 -17.126 9.164 1.359 648 HD3 LYS 80 2HD LYS 80 -16.460 7.798 0.446 649 HE2 LYS 80 1HE LYS 80 -18.036 6.554 2.342 650 HE3 LYS 80 2HE LYS 80 -18.958 8.010 1.937 651 HZ1 LYS 80 3HZ LYS 80 -18.139 7.063 -0.482 652 HZ2 LYS 80 1HZ LYS 80 -19.680 6.865 0.191 653 HZ3 LYS 80 2HZ LYS 80 -18.513 5.654 0.377 654 H TYR 81 H TYR 81 -13.549 7.473 5.497 655 HA TYR 81 HA TYR 81 -15.377 5.738 7.006 656 HB2 TYR 81 1HB TYR 81 -12.787 6.258 7.534 657 HB3 TYR 81 2HB TYR 81 -13.537 7.579 8.434 658 HD1 TYR 81 2HD TYR 81 -15.700 6.759 9.855 659 HD2 TYR 81 1HD TYR 81 -12.375 4.339 8.758 660 HE1 TYR 81 2HE TYR 81 -16.193 5.242 11.727 661 HE2 TYR 81 1HE TYR 81 -12.861 2.815 10.625 662 HH TYR 81 HH TYR 81 -15.383 2.364 12.023 663 H VAL 82 H VAL 82 -17.171 6.532 7.912 664 HA VAL 82 HA VAL 82 -17.706 9.396 7.610 665 HB VAL 82 HB VAL 82 -19.651 7.207 8.347 666 HG11 VAL 82 1HG1 VAL 82 -20.749 9.105 8.971 667 HG12 VAL 82 2HG1 VAL 82 -19.871 10.123 7.827 668 HG13 VAL 82 3HG1 VAL 82 -21.176 9.080 7.260 669 HG21 VAL 82 3HG2 VAL 82 -18.539 6.952 6.089 670 HG22 VAL 82 1HG2 VAL 82 -20.299 7.069 6.075 671 HG23 VAL 82 2HG2 VAL 82 -19.317 8.467 5.634 672 H HIS 83 H HIS 83 -18.703 10.591 9.331 673 HA HIS 83 HA HIS 83 -17.656 9.815 11.939 674 HB2 HIS 83 1HB HIS 83 -18.827 12.401 10.893 675 HB3 HIS 83 2HB HIS 83 -18.336 12.164 12.573 676 HD1 HIS 83 1HD HIS 83 -16.159 13.245 12.969 677 HD2 HIS 83 2HD HIS 83 -16.342 11.502 9.202 678 HE1 HIS 83 1HE HIS 83 -13.902 13.642 11.934 679 HE2 HIS 83 2HE HIS 83 -14.012 12.577 9.631 680 H ASP 84 H ASP 84 -20.537 11.762 11.406 681 HA ASP 84 HA ASP 84 -22.579 10.015 11.819 682 HB2 ASP 84 1HB ASP 84 -20.968 10.330 14.238 683 HB3 ASP 84 2HB ASP 84 -22.672 10.727 14.498 684 H ASP 85 H ASP 85 -21.207 13.081 12.841 685 HA ASP 85 HA ASP 85 -23.755 14.357 13.207 686 HB2 ASP 85 1HB ASP 85 -20.988 14.986 13.695 687 HB3 ASP 85 2HB ASP 85 -21.755 16.317 12.819 688 H GLY 86 H GLY 86 -21.891 13.526 10.521 689 HA2 GLY 86 1HA GLY 86 -23.194 13.909 8.400 690 HA3 GLY 86 2HA GLY 86 -23.212 15.600 8.881 691 H ARG 87 H ARG 87 -20.328 14.003 9.683 692 HA ARG 87 HA ARG 87 -19.011 15.159 7.313 693 HB2 ARG 87 1HB ARG 87 -17.992 14.864 10.147 694 HB3 ARG 87 2HB ARG 87 -16.995 15.381 8.780 695 HG2 ARG 87 1HG ARG 87 -19.397 16.821 9.907 696 HG3 ARG 87 2HG ARG 87 -17.698 17.309 10.030 697 HD2 ARG 87 1HD ARG 87 -17.675 17.350 7.477 698 HD3 ARG 87 2HD ARG 87 -19.438 17.237 7.580 699 HE ARG 87 HE ARG 87 -19.511 19.434 8.215 700 HH11 ARG 87 2HH1 ARG 87 -16.256 18.253 8.568 701 HH12 ARG 87 1HH1 ARG 87 -15.587 19.815 8.911 702 HH21 ARG 87 1HH2 ARG 87 -16.947 21.657 8.968 703 HH22 ARG 87 2HH2 ARG 87 -18.644 21.495 8.666 704 H VAL 88 H VAL 88 -17.682 13.900 6.130 705 HA VAL 88 HA VAL 88 -16.976 11.244 7.176 706 HB VAL 88 HB VAL 88 -18.782 10.704 5.773 707 HG11 VAL 88 1HG1 VAL 88 -19.476 12.400 4.472 708 HG12 VAL 88 2HG1 VAL 88 -17.839 13.003 4.209 709 HG13 VAL 88 3HG1 VAL 88 -18.448 11.652 3.251 710 HG21 VAL 88 3HG2 VAL 88 -16.360 9.699 5.276 711 HG22 VAL 88 1HG2 VAL 88 -17.797 9.202 4.381 712 HG23 VAL 88 2HG2 VAL 88 -16.696 10.395 3.691 713 H SER 89 H SER 89 -14.873 10.850 7.020 714 HA SER 89 HA SER 89 -13.314 12.336 5.006 715 HB2 SER 89 1HB SER 89 -12.274 11.335 7.670 716 HB3 SER 89 2HB SER 89 -11.467 12.431 6.534 717 HG SER 89 HG SER 89 -13.671 13.640 7.008 718 H TYR 90 H TYR 90 -11.552 11.260 4.026 719 HA TYR 90 HA TYR 90 -11.853 8.338 4.010 720 HB2 TYR 90 1HB TYR 90 -10.238 9.754 1.938 721 HB3 TYR 90 2HB TYR 90 -11.268 8.329 1.784 722 HD1 TYR 90 2HD TYR 90 -13.667 8.531 1.425 723 HD2 TYR 90 1HD TYR 90 -11.207 11.987 1.753 724 HE1 TYR 90 2HE TYR 90 -15.484 9.905 0.497 725 HE2 TYR 90 1HE TYR 90 -13.017 13.370 0.828 726 HH TYR 90 HH TYR 90 -16.042 11.924 -0.301 727 HA PRO 91 HA PRO 91 -7.912 8.697 6.260 728 HB2 PRO 91 2HB PRO 91 -8.922 7.690 8.061 729 HB3 PRO 91 1HB PRO 91 -8.128 6.240 7.450 730 HG2 PRO 91 1HG PRO 91 -10.029 5.502 6.336 731 HG3 PRO 91 2HG PRO 91 -10.759 6.294 7.781 732 HD2 PRO 91 1HD PRO 91 -11.484 6.925 5.242 733 HD3 PRO 91 2HD PRO 91 -11.455 8.117 6.553 734 H LEU 92 H LEU 92 -6.512 8.565 4.519 735 HA LEU 92 HA LEU 92 -6.262 6.242 2.889 736 HB2 LEU 92 1HB LEU 92 -5.028 8.883 3.098 737 HB3 LEU 92 2HB LEU 92 -3.885 7.610 2.630 738 HG LEU 92 HG LEU 92 -6.134 7.234 1.000 739 HD11 LEU 92 1HD1 LEU 92 -5.867 9.669 -0.070 740 HD12 LEU 92 2HD1 LEU 92 -5.661 10.082 1.633 741 HD13 LEU 92 3HD1 LEU 92 -7.128 9.263 1.095 742 HD21 LEU 92 3HD2 LEU 92 -3.306 7.944 0.761 743 HD22 LEU 92 1HD2 LEU 92 -4.307 8.506 -0.578 744 HD23 LEU 92 2HD2 LEU 92 -4.272 6.792 -0.163 745 H CYS 93 H CYS 93 -4.934 4.518 3.063 746 HA CYS 93 HA CYS 93 -2.925 4.510 5.202 747 HB2 CYS 93 1HB CYS 93 -4.969 2.348 4.670 748 HB3 CYS 93 2HB CYS 93 -3.602 2.185 5.783 749 HG CYS 93 HG CYS 93 -6.248 4.322 6.153 750 H PHE 94 H PHE 94 -1.355 2.713 4.975 751 HA PHE 94 HA PHE 94 -0.847 2.177 2.128 752 HB2 PHE 94 1HB PHE 94 0.839 3.564 3.336 753 HB3 PHE 94 2HB PHE 94 1.139 2.196 4.409 754 HD1 PHE 94 1HD PHE 94 1.293 3.227 0.852 755 HD2 PHE 94 2HD PHE 94 2.645 0.509 3.836 756 HE1 PHE 94 1HE PHE 94 2.957 2.331 -0.722 757 HE2 PHE 94 2HE PHE 94 4.312 -0.390 2.267 758 HZ PHE 94 HZ PHE 94 4.471 0.521 -0.016 759 H ILE 95 H ILE 95 -1.552 0.203 1.618 760 HA ILE 95 HA ILE 95 -1.336 -1.971 3.552 761 HB ILE 95 HB ILE 95 -2.633 -1.928 0.825 762 HG12 ILE 95 1HG1 ILE 95 -3.946 -1.977 3.549 763 HG13 ILE 95 2HG1 ILE 95 -3.668 -0.485 2.632 764 HG21 ILE 95 1HG2 ILE 95 -2.508 -4.032 2.970 765 HG22 ILE 95 2HG2 ILE 95 -3.728 -4.035 1.698 766 HG23 ILE 95 3HG2 ILE 95 -2.019 -4.163 1.280 767 HD11 ILE 95 3HD1 ILE 95 -4.988 -1.562 0.753 768 HD12 ILE 95 1HD1 ILE 95 -5.482 -2.768 1.940 769 HD13 ILE 95 2HD1 ILE 95 -5.888 -1.070 2.187 770 H PHE 96 H PHE 96 0.371 -3.262 3.555 771 HA PHE 96 HA PHE 96 2.044 -3.421 1.155 772 HB2 PHE 96 1HB PHE 96 3.150 -2.770 3.254 773 HB3 PHE 96 2HB PHE 96 2.625 -4.282 3.996 774 HD1 PHE 96 2HD PHE 96 3.385 -4.891 0.629 775 HD2 PHE 96 1HD PHE 96 5.214 -4.273 4.422 776 HE1 PHE 96 2HE PHE 96 5.420 -6.018 -0.172 777 HE2 PHE 96 1HE PHE 96 7.253 -5.400 3.627 778 HZ PHE 96 HZ PHE 96 7.357 -6.275 1.327 779 H SER 97 H SER 97 1.374 -4.996 -0.168 780 HA SER 97 HA SER 97 0.181 -7.421 0.814 781 HB2 SER 97 1HB SER 97 -0.391 -6.218 -1.378 782 HB3 SER 97 2HB SER 97 1.104 -6.925 -2.016 783 HG SER 97 HG SER 97 -0.008 -8.663 -2.346 784 H SER 98 H SER 98 1.594 -8.658 1.944 785 HA SER 98 HA SER 98 3.907 -9.692 0.453 786 HB2 SER 98 1HB SER 98 4.459 -7.970 2.311 787 HB3 SER 98 2HB SER 98 4.027 -9.273 3.432 788 HG SER 98 HG SER 98 6.092 -9.259 1.496 789 HA PRO 99 HA PRO 99 1.387 -13.279 1.689 790 HB2 PRO 99 2HB PRO 99 0.956 -13.667 -0.533 791 HB3 PRO 99 1HB PRO 99 2.245 -14.858 -0.377 792 HG2 PRO 99 1HG PRO 99 3.862 -13.427 -1.234 793 HG3 PRO 99 2HG PRO 99 2.415 -12.926 -2.186 794 HD2 PRO 99 1HD PRO 99 3.920 -11.164 -0.771 795 HD3 PRO 99 2HD PRO 99 2.168 -10.981 -0.972 796 H VAL 100 H VAL 100 2.296 -15.766 1.466 797 HA VAL 100 HA VAL 100 4.756 -15.745 3.073 798 HB VAL 100 HB VAL 100 2.603 -16.784 3.970 799 HG11 VAL 100 1HG1 VAL 100 2.353 -17.994 1.637 800 HG12 VAL 100 2HG1 VAL 100 3.315 -19.234 2.444 801 HG13 VAL 100 3HG1 VAL 100 1.766 -18.735 3.126 802 HG21 VAL 100 3HG2 VAL 100 4.571 -17.227 5.161 803 HG22 VAL 100 1HG2 VAL 100 3.892 -18.822 4.833 804 HG23 VAL 100 2HG2 VAL 100 5.237 -18.220 3.865 805 H GLY 101 H GLY 101 3.362 -16.913 0.113 806 HA2 GLY 101 1HA GLY 101 5.400 -18.880 -0.397 807 HA3 GLY 101 2HA GLY 101 4.179 -18.323 -1.531 808 H CYS 102 H CYS 102 5.418 -15.546 -0.489 809 HA CYS 102 HA CYS 102 6.820 -14.987 -2.855 810 HB2 CYS 102 1HB CYS 102 7.588 -12.933 -1.653 811 HB3 CYS 102 2HB CYS 102 5.834 -13.181 -1.628 812 HG CYS 102 HG CYS 102 6.622 -14.644 1.033 813 H LYS 103 H LYS 103 9.117 -14.143 -2.879 814 HA LYS 103 HA LYS 103 10.834 -16.094 -1.508 815 HB2 LYS 103 1HB LYS 103 11.728 -14.384 -3.810 816 HB3 LYS 103 2HB LYS 103 12.326 -15.971 -3.300 817 HG2 LYS 103 1HG LYS 103 10.972 -17.000 -4.719 818 HG3 LYS 103 2HG LYS 103 9.565 -16.189 -4.010 819 HD2 LYS 103 1HD LYS 103 9.750 -15.716 -6.409 820 HD3 LYS 103 2HD LYS 103 9.943 -14.245 -5.437 821 HE2 LYS 103 1HE LYS 103 11.739 -13.926 -6.785 822 HE3 LYS 103 2HE LYS 103 12.513 -14.998 -5.608 823 HZ1 LYS 103 3HZ LYS 103 12.872 -15.619 -7.975 824 HZ2 LYS 103 1HZ LYS 103 11.222 -15.970 -8.096 825 HZ3 LYS 103 2HZ LYS 103 12.199 -16.853 -7.035 826 HA PRO 104 HA PRO 104 12.800 -13.003 0.912 827 HB2 PRO 104 2HB PRO 104 13.952 -14.708 1.934 828 HB3 PRO 104 1HB PRO 104 15.338 -14.015 1.094 829 HG2 PRO 104 1HG PRO 104 15.212 -15.534 -0.659 830 HG3 PRO 104 2HG PRO 104 14.677 -16.558 0.725 831 HD2 PRO 104 1HD PRO 104 13.211 -16.281 -1.542 832 HD3 PRO 104 2HD PRO 104 12.473 -16.485 0.055 833 H GLU 105 H GLU 105 13.928 -13.734 -2.266 834 HA GLU 105 HA GLU 105 15.953 -11.712 -2.385 835 HB2 GLU 105 1HB GLU 105 14.577 -13.446 -4.423 836 HB3 GLU 105 2HB GLU 105 15.656 -12.135 -4.924 837 HG2 GLU 105 1HG GLU 105 17.519 -13.124 -3.798 838 HG3 GLU 105 2HG GLU 105 16.474 -14.347 -3.059 839 H GLN 106 H GLN 106 12.559 -11.938 -3.311 840 HA GLN 106 HA GLN 106 12.562 -9.258 -4.419 841 HB2 GLN 106 1HB GLN 106 10.107 -10.921 -3.900 842 HB3 GLN 106 2HB GLN 106 10.368 -9.686 -5.141 843 HG2 GLN 106 1HG GLN 106 11.679 -12.405 -5.061 844 HG3 GLN 106 2HG GLN 106 10.320 -11.930 -6.092 845 HE21 GLN 106 2HE2 GLN 106 12.425 -9.650 -8.013 846 HE22 GLN 106 1HE2 GLN 106 10.954 -9.585 -7.111 847 H GLN 107 H GLN 107 10.999 -10.948 -1.705 848 HA GLN 107 HA GLN 107 9.594 -8.865 -0.591 849 HB2 GLN 107 1HB GLN 107 10.335 -11.463 0.175 850 HB3 GLN 107 2HB GLN 107 10.870 -10.408 1.493 851 HG2 GLN 107 1HG GLN 107 8.185 -9.763 0.573 852 HG3 GLN 107 2HG GLN 107 8.339 -11.430 1.146 853 HE21 GLN 107 2HE2 GLN 107 8.165 -8.400 3.743 854 HE22 GLN 107 1HE2 GLN 107 7.929 -8.225 2.040 855 H MET 108 H MET 108 13.035 -9.527 -0.404 856 HA MET 108 HA MET 108 13.637 -7.666 1.645 857 HB2 MET 108 1HB MET 108 15.124 -9.328 -0.272 858 HB3 MET 108 2HB MET 108 15.938 -7.818 0.162 859 HG2 MET 108 1HG MET 108 15.192 -8.674 2.615 860 HG3 MET 108 2HG MET 108 15.411 -10.215 1.780 861 HE1 MET 108 3HE MET 108 17.273 -10.197 -0.077 862 HE2 MET 108 1HE MET 108 18.280 -8.756 -0.227 863 HE3 MET 108 2HE MET 108 18.932 -10.213 0.526 864 H MET 109 H MET 109 13.155 -7.379 -1.792 865 HA MET 109 HA MET 109 14.422 -4.887 -2.184 866 HB2 MET 109 1HB MET 109 12.162 -6.246 -3.665 867 HB3 MET 109 2HB MET 109 12.931 -4.748 -4.210 868 HG2 MET 109 1HG MET 109 14.968 -5.799 -4.668 869 HG3 MET 109 2HG MET 109 14.551 -7.207 -3.689 870 HE1 MET 109 3HE MET 109 13.197 -5.050 -6.492 871 HE2 MET 109 1HE MET 109 14.444 -5.826 -7.468 872 HE3 MET 109 2HE MET 109 12.742 -6.173 -7.773 873 H TYR 110 H TYR 110 11.172 -5.787 -1.173 874 HA TYR 110 HA TYR 110 10.311 -3.010 -1.122 875 HB2 TYR 110 1HB TYR 110 8.766 -5.412 -0.139 876 HB3 TYR 110 2HB TYR 110 8.130 -3.841 -0.630 877 HD1 TYR 110 2HD TYR 110 9.735 -6.916 -1.927 878 HD2 TYR 110 1HD TYR 110 7.567 -3.380 -2.878 879 HE1 TYR 110 2HE TYR 110 9.393 -7.749 -4.216 880 HE2 TYR 110 1HE TYR 110 7.218 -4.203 -5.169 881 HH TYR 110 HH TYR 110 8.919 -6.835 -6.456 882 H ALA 111 H ALA 111 10.994 -5.641 1.137 883 HA ALA 111 HA ALA 111 10.212 -4.387 3.506 884 HB1 ALA 111 3HB ALA 111 11.154 -6.154 4.582 885 HB2 ALA 111 1HB ALA 111 11.110 -6.827 2.953 886 HB3 ALA 111 2HB ALA 111 12.606 -6.135 3.582 887 H GLY 112 H GLY 112 12.936 -3.821 1.466 888 HA2 GLY 112 1HA GLY 112 14.302 -2.286 3.566 889 HA3 GLY 112 2HA GLY 112 15.004 -2.774 2.030 890 H SER 113 H SER 113 12.472 -1.886 0.652 891 HA SER 113 HA SER 113 13.145 0.976 0.595 892 HB2 SER 113 1HB SER 113 11.613 -0.452 -1.573 893 HB3 SER 113 2HB SER 113 12.589 1.023 -1.684 894 HG SER 113 HG SER 113 13.738 -1.475 -1.033 895 H LYS 114 H LYS 114 10.970 -0.942 1.991 896 HA LYS 114 HA LYS 114 8.451 0.041 1.295 897 HB2 LYS 114 1HB LYS 114 8.706 -1.928 2.685 898 HB3 LYS 114 2HB LYS 114 9.466 -0.963 3.960 899 HG2 LYS 114 1HG LYS 114 7.479 0.020 4.610 900 HG3 LYS 114 2HG LYS 114 6.706 -0.291 3.045 901 HD2 LYS 114 1HD LYS 114 5.715 -2.034 4.039 902 HD3 LYS 114 2HD LYS 114 7.299 -2.824 3.948 903 HE2 LYS 114 1HE LYS 114 7.873 -2.080 6.173 904 HE3 LYS 114 2HE LYS 114 6.396 -1.109 6.258 905 HZ1 LYS 114 3HZ LYS 114 6.280 -3.273 7.443 906 HZ2 LYS 114 1HZ LYS 114 6.397 -4.060 5.950 907 HZ3 LYS 114 2HZ LYS 114 5.070 -3.065 6.280 908 H ASN 115 H ASN 115 10.253 0.944 4.240 909 HA ASN 115 HA ASN 115 8.771 3.105 5.011 910 HB2 ASN 115 1HB ASN 115 11.634 2.345 5.322 911 HB3 ASN 115 2HB ASN 115 11.192 4.008 5.730 912 HD21 ASN 115 2HD2 ASN 115 10.839 1.556 8.615 913 HD22 ASN 115 1HD2 ASN 115 12.053 1.703 7.395 914 H ARG 116 H ARG 116 11.336 3.033 2.583 915 HA ARG 116 HA ARG 116 11.531 5.784 2.112 916 HB2 ARG 116 1HB ARG 116 13.203 4.313 1.235 917 HB3 ARG 116 2HB ARG 116 11.999 3.420 0.294 918 HG2 ARG 116 1HG ARG 116 12.918 4.707 -1.352 919 HG3 ARG 116 2HG ARG 116 11.596 5.761 -0.824 920 HD2 ARG 116 1HD ARG 116 13.076 7.091 0.515 921 HD3 ARG 116 2HD ARG 116 14.400 5.945 0.260 922 HE ARG 116 HE ARG 116 13.700 6.775 -2.255 923 HH11 ARG 116 2HH1 ARG 116 14.732 8.330 0.684 924 HH12 ARG 116 1HH1 ARG 116 15.509 9.646 -0.132 925 HH21 ARG 116 1HH2 ARG 116 15.500 9.744 -2.421 926 HH22 ARG 116 2HH2 ARG 116 14.719 8.502 -3.340 927 H LEU 117 H LEU 117 9.561 3.331 0.443 928 HA LEU 117 HA LEU 117 8.296 5.111 -1.332 929 HB2 LEU 117 1HB LEU 117 8.367 2.644 -1.583 930 HB3 LEU 117 2HB LEU 117 7.227 2.515 -0.233 931 HG LEU 117 HG LEU 117 6.298 2.284 -2.601 932 HD11 LEU 117 1HD1 LEU 117 4.230 3.295 -1.985 933 HD12 LEU 117 2HD1 LEU 117 5.034 4.398 -0.869 934 HD13 LEU 117 3HD1 LEU 117 4.977 2.671 -0.514 935 HD21 LEU 117 3HD2 LEU 117 6.267 5.274 -2.609 936 HD22 LEU 117 1HD2 LEU 117 6.013 4.146 -3.941 937 HD23 LEU 117 2HD2 LEU 117 7.636 4.398 -3.296 938 H VAL 118 H VAL 118 7.083 3.671 1.699 939 HA VAL 118 HA VAL 118 4.655 5.013 1.821 940 HB VAL 118 HB VAL 118 6.443 4.039 4.045 941 HG11 VAL 118 1HG1 VAL 118 3.795 4.217 4.960 942 HG12 VAL 118 2HG1 VAL 118 5.189 5.155 5.501 943 HG13 VAL 118 3HG1 VAL 118 4.160 5.768 4.207 944 HG21 VAL 118 3HG2 VAL 118 4.033 2.920 2.636 945 HG22 VAL 118 1HG2 VAL 118 5.647 2.222 2.768 946 HG23 VAL 118 2HG2 VAL 118 4.601 2.299 4.186 947 H GLN 119 H GLN 119 7.732 5.934 3.369 948 HA GLN 119 HA GLN 119 6.952 8.287 4.560 949 HB2 GLN 119 1HB GLN 119 9.539 7.332 3.397 950 HB3 GLN 119 2HB GLN 119 9.411 9.007 3.955 951 HG2 GLN 119 1HG GLN 119 8.325 7.291 5.962 952 HG3 GLN 119 2HG GLN 119 9.919 6.692 5.481 953 HE21 GLN 119 2HE2 GLN 119 10.830 8.934 8.090 954 HE22 GLN 119 1HE2 GLN 119 10.286 7.322 7.792 955 H THR 120 H THR 120 7.780 7.707 1.192 956 HA THR 120 HA THR 120 7.881 10.400 0.361 957 HB THR 120 HB THR 120 7.053 8.052 -1.350 958 HG1 THR 120 1HG THR 120 9.198 8.075 -0.025 959 HG21 THR 120 3HG2 THR 120 8.721 9.872 -2.712 960 HG22 THR 120 1HG2 THR 120 7.509 10.835 -1.867 961 HG23 THR 120 2HG2 THR 120 7.005 9.565 -2.984 962 H ALA 121 H ALA 121 5.240 8.037 0.428 963 HA ALA 121 HA ALA 121 3.324 9.811 -0.737 964 HB1 ALA 121 3HB ALA 121 3.332 7.079 0.347 965 HB2 ALA 121 1HB ALA 121 1.804 7.946 0.504 966 HB3 ALA 121 2HB ALA 121 2.538 7.734 -1.086 967 H GLU 122 H GLU 122 4.610 9.413 2.406 968 HA GLU 122 HA GLU 122 4.238 10.540 4.351 969 HB2 GLU 122 1HB GLU 122 3.765 12.440 2.690 970 HB3 GLU 122 2HB GLU 122 2.053 12.095 2.985 971 HG2 GLU 122 1HG GLU 122 2.157 13.503 4.692 972 HG3 GLU 122 2HG GLU 122 3.138 12.286 5.522 973 H LEU 123 H LEU 123 3.026 8.094 3.992 974 HA LEU 123 HA LEU 123 0.310 8.396 5.054 975 HB2 LEU 123 1HB LEU 123 1.742 5.915 4.088 976 HB3 LEU 123 2HB LEU 123 0.040 6.026 4.571 977 HG LEU 123 HG LEU 123 1.018 7.726 2.321 978 HD11 LEU 123 1HD1 LEU 123 0.835 6.022 0.728 979 HD12 LEU 123 2HD1 LEU 123 0.098 4.906 1.877 980 HD13 LEU 123 3HD1 LEU 123 1.806 5.319 2.021 981 HD21 LEU 123 3HD2 LEU 123 -1.436 7.239 3.559 982 HD22 LEU 123 1HD2 LEU 123 -1.516 6.390 2.016 983 HD23 LEU 123 2HD2 LEU 123 -1.153 8.116 2.055 984 H THR 124 H THR 124 0.800 8.971 7.178 985 HA THR 124 HA THR 124 2.645 7.739 8.860 986 HB THR 124 HB THR 124 1.502 9.846 9.428 987 HG1 THR 124 1HG THR 124 1.417 7.659 11.219 988 HG21 THR 124 3HG2 THR 124 -0.800 9.525 10.557 989 HG22 THR 124 1HG2 THR 124 -0.882 8.034 9.618 990 HG23 THR 124 2HG2 THR 124 -0.729 9.587 8.796 991 H LYS 125 H LYS 125 -0.429 6.638 7.742 992 HA LYS 125 HA LYS 125 -0.444 4.469 9.723 993 HB2 LYS 125 1HB LYS 125 -2.626 5.329 7.808 994 HB3 LYS 125 2HB LYS 125 -2.768 4.095 9.069 995 HG2 LYS 125 1HG LYS 125 -1.862 6.416 10.368 996 HG3 LYS 125 2HG LYS 125 -3.144 6.926 9.255 997 HD2 LYS 125 1HD LYS 125 -4.199 4.635 10.347 998 HD3 LYS 125 2HD LYS 125 -3.310 5.342 11.707 999 HE2 LYS 125 1HE LYS 125 -5.032 7.143 10.061 1000 HE3 LYS 125 2HE LYS 125 -5.814 6.017 11.181 1001 HZ1 LYS 125 3HZ LYS 125 -3.799 7.130 12.649 1002 HZ2 LYS 125 1HZ LYS 125 -5.438 7.542 12.733 1003 HZ3 LYS 125 2HZ LYS 125 -4.393 8.430 11.743 1004 H VAL 126 H VAL 126 0.984 2.999 8.900 1005 HA VAL 126 HA VAL 126 0.353 1.916 6.232 1006 HB VAL 126 HB VAL 126 2.480 2.750 5.899 1007 HG11 VAL 126 1HG1 VAL 126 2.818 3.485 8.226 1008 HG12 VAL 126 2HG1 VAL 126 3.279 1.838 8.662 1009 HG13 VAL 126 3HG1 VAL 126 4.270 2.763 7.532 1010 HG21 VAL 126 3HG2 VAL 126 3.774 0.912 5.463 1011 HG22 VAL 126 1HG2 VAL 126 3.438 0.169 7.027 1012 HG23 VAL 126 2HG2 VAL 126 2.220 0.128 5.751 1013 H PHE 127 H PHE 127 -0.821 0.134 6.616 1014 HA PHE 127 HA PHE 127 -0.120 -1.625 8.834 1015 HB2 PHE 127 1HB PHE 127 -2.362 -2.149 6.903 1016 HB3 PHE 127 2HB PHE 127 -2.236 -2.590 8.606 1017 HD1 PHE 127 2HD PHE 127 -1.434 0.028 9.772 1018 HD2 PHE 127 1HD PHE 127 -4.377 -0.954 6.859 1019 HE1 PHE 127 2HE PHE 127 -2.726 2.024 10.409 1020 HE2 PHE 127 1HE PHE 127 -5.674 1.039 7.491 1021 HZ PHE 127 HZ PHE 127 -4.849 2.531 9.269 1022 H GLU 128 H GLU 128 -0.131 -4.006 8.416 1023 HA GLU 128 HA GLU 128 1.033 -4.651 5.790 1024 HB2 GLU 128 1HB GLU 128 2.671 -4.425 7.791 1025 HB3 GLU 128 2HB GLU 128 1.990 -5.975 8.309 1026 HG2 GLU 128 1HG GLU 128 2.628 -6.964 6.141 1027 HG3 GLU 128 2HG GLU 128 3.382 -5.425 5.699 1028 H ILE 129 H ILE 129 0.434 -6.572 4.890 1029 HA ILE 129 HA ILE 129 -1.456 -8.223 6.437 1030 HB ILE 129 HB ILE 129 -2.436 -8.801 4.144 1031 HG12 ILE 129 1HG1 ILE 129 -1.315 -6.121 3.351 1032 HG13 ILE 129 2HG1 ILE 129 -0.437 -7.618 2.999 1033 HG21 ILE 129 1HG2 ILE 129 -3.345 -7.228 5.988 1034 HG22 ILE 129 2HG2 ILE 129 -2.901 -5.936 4.873 1035 HG23 ILE 129 3HG2 ILE 129 -4.064 -7.166 4.378 1036 HD11 ILE 129 3HD1 ILE 129 -3.283 -7.251 2.143 1037 HD12 ILE 129 1HD1 ILE 129 -1.934 -6.668 1.168 1038 HD13 ILE 129 2HD1 ILE 129 -2.080 -8.387 1.536 1039 H ARG 130 H ARG 130 -0.837 -10.254 6.731 1040 HA ARG 130 HA ARG 130 1.536 -11.291 5.565 1041 HB2 ARG 130 1HB ARG 130 1.063 -12.075 7.723 1042 HB3 ARG 130 2HB ARG 130 -0.616 -12.454 7.311 1043 HG2 ARG 130 1HG ARG 130 0.624 -14.500 7.564 1044 HG3 ARG 130 2HG ARG 130 0.174 -14.285 5.864 1045 HD2 ARG 130 1HD ARG 130 2.355 -14.816 5.526 1046 HD3 ARG 130 2HD ARG 130 2.563 -13.084 5.820 1047 HE ARG 130 HE ARG 130 2.694 -14.377 8.285 1048 HH11 ARG 130 2HH1 ARG 130 4.485 -14.219 5.305 1049 HH12 ARG 130 1HH1 ARG 130 6.011 -14.558 6.051 1050 HH21 ARG 130 1HH2 ARG 130 6.130 -14.904 8.314 1051 HH22 ARG 130 2HH2 ARG 130 4.697 -14.826 9.281 1052 H THR 131 H THR 131 -1.821 -11.434 4.721 1053 HA THR 131 HA THR 131 -1.178 -12.729 2.222 1054 HB THR 131 HB THR 131 -1.498 -14.725 3.506 1055 HG1 THR 131 1HG THR 131 -4.047 -14.470 2.357 1056 HG21 THR 131 3HG2 THR 131 -4.150 -13.595 4.407 1057 HG22 THR 131 1HG2 THR 131 -2.698 -13.667 5.403 1058 HG23 THR 131 2HG2 THR 131 -3.464 -15.157 4.850 1059 H THR 132 H THR 132 -2.608 -12.227 0.619 1060 HA THR 132 HA THR 132 -4.079 -9.999 0.564 1061 HB THR 132 HB THR 132 -5.589 -11.096 -1.153 1062 HG1 THR 132 1HG THR 132 -5.472 -13.209 -1.435 1063 HG21 THR 132 3HG2 THR 132 -3.153 -10.124 -1.444 1064 HG22 THR 132 1HG2 THR 132 -3.967 -10.946 -2.773 1065 HG23 THR 132 2HG2 THR 132 -2.768 -11.806 -1.807 1066 H ASP 133 H ASP 133 -5.324 -13.142 1.642 1067 HA ASP 133 HA ASP 133 -7.963 -12.647 2.026 1068 HB2 ASP 133 1HB ASP 133 -6.021 -14.142 3.790 1069 HB3 ASP 133 2HB ASP 133 -7.761 -14.124 4.102 1070 H ASP 134 H ASP 134 -5.366 -11.764 4.286 1071 HA ASP 134 HA ASP 134 -6.779 -10.702 6.360 1072 HB2 ASP 134 1HB ASP 134 -4.148 -10.727 5.655 1073 HB3 ASP 134 2HB ASP 134 -4.525 -9.007 5.492 1074 H LEU 135 H LEU 135 -5.918 -9.025 3.349 1075 HA LEU 135 HA LEU 135 -6.959 -6.526 3.913 1076 HB2 LEU 135 1HB LEU 135 -5.676 -6.795 1.948 1077 HB3 LEU 135 2HB LEU 135 -6.753 -8.065 1.342 1078 HG LEU 135 HG LEU 135 -8.301 -6.570 0.547 1079 HD11 LEU 135 1HD1 LEU 135 -7.394 -4.866 2.802 1080 HD12 LEU 135 2HD1 LEU 135 -9.025 -5.291 2.286 1081 HD13 LEU 135 3HD1 LEU 135 -8.108 -4.074 1.397 1082 HD21 LEU 135 3HD2 LEU 135 -5.543 -5.516 0.324 1083 HD22 LEU 135 1HD2 LEU 135 -6.854 -4.455 -0.190 1084 HD23 LEU 135 2HD2 LEU 135 -6.664 -6.043 -0.933 1085 H THR 136 H THR 136 -8.856 -6.831 5.157 1086 HA THR 136 HA THR 136 -11.231 -7.455 3.529 1087 HB THR 136 HB THR 136 -12.201 -8.049 5.935 1088 HG1 THR 136 1HG THR 136 -10.647 -8.213 7.354 1089 HG21 THR 136 3HG2 THR 136 -10.488 -10.050 4.470 1090 HG22 THR 136 1HG2 THR 136 -12.047 -9.491 3.865 1091 HG23 THR 136 2HG2 THR 136 -11.956 -10.354 5.400 1092 H GLU 137 H GLU 137 -13.135 -6.281 4.028 1093 HA GLU 137 HA GLU 137 -12.868 -3.582 4.426 1094 HB2 GLU 137 1HB GLU 137 -14.891 -4.716 3.535 1095 HB3 GLU 137 2HB GLU 137 -15.291 -5.223 5.183 1096 HG2 GLU 137 1HG GLU 137 -15.302 -2.769 5.808 1097 HG3 GLU 137 2HG GLU 137 -15.240 -2.436 4.071 1098 H THR 138 H THR 138 -13.384 -6.085 6.850 1099 HA THR 138 HA THR 138 -13.734 -4.259 9.024 1100 HB THR 138 HB THR 138 -12.983 -7.185 9.149 1101 HG1 THR 138 1HG THR 138 -15.053 -6.455 8.038 1102 HG21 THR 138 3HG2 THR 138 -13.729 -7.149 11.393 1103 HG22 THR 138 1HG2 THR 138 -14.435 -5.543 11.214 1104 HG23 THR 138 2HG2 THR 138 -12.683 -5.741 11.217 1105 H TRP 139 H TRP 139 -11.134 -6.623 8.394 1106 HA TRP 139 HA TRP 139 -9.296 -5.917 10.228 1107 HB2 TRP 139 1HB TRP 139 -8.617 -7.660 8.860 1108 HB3 TRP 139 2HB TRP 139 -9.003 -6.781 7.380 1109 HD1 TRP 139 HD TRP 139 -6.211 -7.182 9.953 1110 HE1 TRP 139 1HE TRP 139 -4.061 -6.128 9.010 1111 HE3 TRP 139 3HE TRP 139 -8.156 -4.967 5.776 1112 HZ2 TRP 139 2HZ TRP 139 -3.290 -4.564 6.790 1113 HZ3 TRP 139 3HZ TRP 139 -6.645 -3.709 4.296 1114 HH2 TRP 139 HH TRP 139 -4.264 -3.513 4.794 1115 H LEU 140 H LEU 140 -10.043 -4.120 7.296 1116 HA LEU 140 HA LEU 140 -7.919 -2.230 7.609 1117 HB2 LEU 140 1HB LEU 140 -8.573 -2.326 5.422 1118 HB3 LEU 140 2HB LEU 140 -10.282 -2.539 5.840 1119 HG LEU 140 HG LEU 140 -10.518 -0.181 6.292 1120 HD11 LEU 140 1HD1 LEU 140 -7.546 -0.146 5.902 1121 HD12 LEU 140 2HD1 LEU 140 -8.499 0.493 7.242 1122 HD13 LEU 140 3HD1 LEU 140 -8.523 1.306 5.676 1123 HD21 LEU 140 3HD2 LEU 140 -9.497 0.596 3.919 1124 HD22 LEU 140 1HD2 LEU 140 -10.995 -0.317 4.094 1125 HD23 LEU 140 2HD2 LEU 140 -9.493 -1.156 3.708 1126 H LYS 141 H LYS 141 -11.448 -1.719 7.740 1127 HA LYS 141 HA LYS 141 -11.479 0.769 8.879 1128 HB2 LYS 141 1HB LYS 141 -13.342 -1.524 8.808 1129 HB3 LYS 141 2HB LYS 141 -13.643 -0.339 10.090 1130 HG2 LYS 141 1HG LYS 141 -14.326 1.264 8.657 1131 HG3 LYS 141 2HG LYS 141 -13.175 0.772 7.402 1132 HD2 LYS 141 1HD LYS 141 -15.015 0.004 6.347 1133 HD3 LYS 141 2HD LYS 141 -14.815 -1.381 7.435 1134 HE2 LYS 141 1HE LYS 141 -16.416 1.021 8.284 1135 HE3 LYS 141 2HE LYS 141 -17.132 -0.242 7.271 1136 HZ1 LYS 141 3HZ LYS 141 -17.548 -0.647 9.615 1137 HZ2 LYS 141 1HZ LYS 141 -15.886 -0.676 9.933 1138 HZ3 LYS 141 2HZ LYS 141 -16.584 -1.875 8.965 1139 H GLU 142 H GLU 142 -10.485 -2.168 10.332 1140 HA GLU 142 HA GLU 142 -10.985 -1.576 13.045 1141 HB2 GLU 142 1HB GLU 142 -9.221 -3.462 11.553 1142 HB3 GLU 142 2HB GLU 142 -8.855 -3.165 13.260 1143 HG2 GLU 142 1HG GLU 142 -11.444 -3.633 13.539 1144 HG3 GLU 142 2HG GLU 142 -11.187 -4.522 12.030 1145 H LYS 143 H LYS 143 -7.954 -1.317 11.179 1146 HA LYS 143 HA LYS 143 -6.383 -0.120 13.109 1147 HB2 LYS 143 1HB LYS 143 -6.380 0.256 10.107 1148 HB3 LYS 143 2HB LYS 143 -5.106 0.866 11.176 1149 HG2 LYS 143 1HG LYS 143 -4.264 -1.146 10.330 1150 HG3 LYS 143 2HG LYS 143 -4.826 -1.533 11.965 1151 HD2 LYS 143 1HD LYS 143 -6.516 -2.862 11.232 1152 HD3 LYS 143 2HD LYS 143 -6.807 -1.865 9.795 1153 HE2 LYS 143 1HE LYS 143 -5.876 -4.210 9.401 1154 HE3 LYS 143 2HE LYS 143 -5.047 -2.865 8.605 1155 HZ1 LYS 143 3HZ LYS 143 -4.180 -4.315 11.041 1156 HZ2 LYS 143 1HZ LYS 143 -3.460 -2.878 10.512 1157 HZ3 LYS 143 2HZ LYS 143 -3.401 -4.261 9.541 1158 H LEU 144 H LEU 144 -8.742 1.344 10.949 1159 HA LEU 144 HA LEU 144 -8.082 4.038 11.663 1160 HB2 LEU 144 1HB LEU 144 -10.761 3.320 10.566 1161 HB3 LEU 144 2HB LEU 144 -9.704 4.690 10.184 1162 HG LEU 144 HG LEU 144 -9.373 1.850 9.223 1163 HD11 LEU 144 1HD1 LEU 144 -9.576 3.268 7.001 1164 HD12 LEU 144 2HD1 LEU 144 -10.502 4.335 8.056 1165 HD13 LEU 144 3HD1 LEU 144 -10.998 2.655 7.847 1166 HD21 LEU 144 3HD2 LEU 144 -7.189 2.512 9.312 1167 HD22 LEU 144 1HD2 LEU 144 -7.583 4.223 9.150 1168 HD23 LEU 144 2HD2 LEU 144 -7.637 3.169 7.737 1169 H ALA 145 H ALA 145 -10.671 1.777 12.542 1170 HA ALA 145 HA ALA 145 -12.267 3.356 14.107 1171 HB1 ALA 145 3HB ALA 145 -11.547 0.475 14.184 1172 HB2 ALA 145 1HB ALA 145 -12.448 1.147 15.544 1173 HB3 ALA 145 2HB ALA 145 -13.110 1.245 13.912 1174 H SER 146 H SER 146 -10.199 1.098 15.851 1175 HA SER 146 HA SER 146 -8.748 3.126 17.255 1176 HB2 SER 146 1HB SER 146 -11.052 3.241 18.297 1177 HB3 SER 146 2HB SER 146 -10.786 1.587 18.873 1178 HG SER 146 HG SER 146 -10.076 2.811 20.517 1179 H GLY 147 H GLY 147 -7.621 1.186 15.908 1180 HA2 GLY 147 1HA GLY 147 -7.203 -1.177 17.535 1181 HA3 GLY 147 2HA GLY 147 -6.459 -0.831 15.981 1182 HA PRO 148 HA PRO 148 -3.134 -0.423 19.128 1183 HB2 PRO 148 2HB PRO 148 -2.313 -2.489 18.550 1184 HB3 PRO 148 1HB PRO 148 -1.199 -1.554 17.554 1185 HG2 PRO 148 1HG PRO 148 -2.466 -1.834 15.626 1186 HG3 PRO 148 2HG PRO 148 -2.747 -3.409 16.458 1187 HD2 PRO 148 1HD PRO 148 -4.777 -1.813 15.621 1188 HD3 PRO 148 2HD PRO 148 -4.885 -2.812 17.080 1189 H SER 149 H SER 149 -4.017 1.129 16.405 1190 HA SER 149 HA SER 149 -1.951 2.308 15.153 1191 HB2 SER 149 1HB SER 149 -3.293 4.332 14.904 1192 HB3 SER 149 2HB SER 149 -4.330 2.900 14.783 1193 HG SER 149 HG SER 149 -5.206 3.332 16.709 1194 H SER 150 H SER 150 -3.121 3.224 18.377 1195 HA SER 150 HA SER 150 -1.644 5.403 18.982 1196 HB2 SER 150 1HB SER 150 -3.206 3.906 20.471 1197 HB3 SER 150 2HB SER 150 -1.675 3.176 20.990 1198 HG SER 150 HG SER 150 -2.751 5.554 21.691 1199 H GLY 151 H GLY 151 0.387 5.719 20.142 1200 HA2 GLY 151 1HA GLY 151 2.548 4.883 20.815 1201 HA3 GLY 151 2HA GLY 151 2.393 3.633 19.590
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