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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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7043 |
1jwd ![]() ![]() |
4430 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 H1 MET 1 -13.813 1.308 -5.299 2 2H MET 1 H2 MET 1 -13.981 1.655 -6.903 3 3H MET 1 H3 MET 1 -12.499 1.796 -6.167 4 HA MET 1 HA MET 1 -13.979 -0.682 -6.355 5 1HB MET 1 HB2 MET 1 -13.373 0.183 -8.608 6 2HB MET 1 HB3 MET 1 -11.670 0.240 -8.132 7 1HG MET 1 HG2 MET 1 -12.271 -1.741 -9.506 8 2HG MET 1 HG3 MET 1 -11.604 -2.191 -7.940 9 1HE MET 1 HE1 MET 1 -14.126 -5.097 -8.745 10 2HE MET 1 HE2 MET 1 -13.058 -4.223 -9.868 11 3HE MET 1 HE3 MET 1 -12.463 -4.706 -8.258 12 H ALA 2 H ALA 2 -12.768 -2.530 -5.669 13 HA ALA 2 HA ALA 2 -11.154 -1.955 -3.363 14 1HB ALA 2 HB1 ALA 2 -12.810 -3.798 -3.502 15 2HB ALA 2 HB2 ALA 2 -11.783 -4.629 -4.689 16 3HB ALA 2 HB3 ALA 2 -11.202 -4.375 -3.029 17 H SER 3 H SER 3 -10.453 -3.504 -6.524 18 HA SER 3 HA SER 3 -8.090 -4.601 -6.102 19 1HB SER 3 HB2 SER 3 -8.597 -3.201 -8.729 20 2HB SER 3 HB3 SER 3 -7.841 -4.761 -8.405 21 HG SER 3 HG SER 3 -9.862 -5.534 -7.721 22 HA PRO 4 HA PRO 4 -5.552 -0.525 -7.077 23 1HB PRO 4 HB2 PRO 4 -7.477 1.367 -5.715 24 2HB PRO 4 HB3 PRO 4 -6.300 1.711 -7.017 25 1HG PRO 4 HG2 PRO 4 -8.909 1.390 -7.639 26 2HG PRO 4 HG3 PRO 4 -7.674 0.552 -8.632 27 1HD PRO 4 HD2 PRO 4 -9.261 -0.553 -6.312 28 2HD PRO 4 HD3 PRO 4 -9.087 -1.246 -7.941 29 H LEU 5 H LEU 5 -7.643 -0.772 -4.100 30 HA LEU 5 HA LEU 5 -5.370 0.007 -2.435 31 1HB LEU 5 HB2 LEU 5 -7.631 0.529 -1.667 32 2HB LEU 5 HB3 LEU 5 -8.060 -1.189 -1.674 33 HG LEU 5 HG LEU 5 -6.389 -1.661 0.076 34 1HD1 LEU 5 HD11 LEU 5 -4.637 0.010 -0.373 35 2HD1 LEU 5 HD12 LEU 5 -5.776 1.335 -0.024 36 3HD1 LEU 5 HD13 LEU 5 -5.270 0.213 1.256 37 1HD2 LEU 5 HD21 LEU 5 -8.063 0.748 0.831 38 2HD2 LEU 5 HD22 LEU 5 -8.657 -0.935 0.745 39 3HD2 LEU 5 HD23 LEU 5 -7.398 -0.495 1.919 40 H ASP 6 H ASP 6 -7.165 -2.962 -3.261 41 HA ASP 6 HA ASP 6 -5.877 -4.772 -1.582 42 1HB ASP 6 HB2 ASP 6 -6.716 -5.355 -4.456 43 2HB ASP 6 HB3 ASP 6 -6.474 -6.538 -3.172 44 H GLN 7 H GLN 7 -4.812 -3.825 -4.910 45 HA GLN 7 HA GLN 7 -2.492 -5.501 -4.824 46 1HB GLN 7 HB2 GLN 7 -1.717 -4.314 -6.761 47 2HB GLN 7 HB3 GLN 7 -3.451 -4.624 -6.885 48 1HG GLN 7 HG2 GLN 7 -3.753 -2.216 -5.979 49 2HG GLN 7 HG3 GLN 7 -2.040 -1.973 -6.311 50 1HE2 GLN 7 HE22 GLN 7 -5.106 -3.063 -7.741 51 2HE2 GLN 7 HE21 GLN 7 -4.770 -2.496 -9.389 52 H ALA 8 H ALA 8 -3.046 -2.155 -3.663 53 HA ALA 8 HA ALA 8 -0.263 -1.571 -3.249 54 1HB ALA 8 HB1 ALA 8 -2.767 -0.334 -2.069 55 2HB ALA 8 HB2 ALA 8 -1.108 0.242 -1.803 56 3HB ALA 8 HB3 ALA 8 -1.772 0.206 -3.447 57 H ILE 9 H ILE 9 -2.873 -2.677 -0.953 58 HA ILE 9 HA ILE 9 -0.984 -3.014 1.205 59 HB ILE 9 HB ILE 9 -2.649 -4.433 2.300 60 1HG1 ILE 9 HG12 ILE 9 -4.356 -4.098 -0.148 61 2HG1 ILE 9 HG13 ILE 9 -3.660 -5.616 0.458 62 1HG2 ILE 9 HG21 ILE 9 -4.196 -2.651 2.735 63 2HG2 ILE 9 HG22 ILE 9 -2.599 -1.974 2.463 64 3HG2 ILE 9 HG23 ILE 9 -3.823 -1.888 1.172 65 1HD1 ILE 9 HD11 ILE 9 -4.959 -5.294 2.597 66 2HD1 ILE 9 HD12 ILE 9 -5.799 -3.934 1.817 67 3HD1 ILE 9 HD13 ILE 9 -5.945 -5.561 1.146 68 H GLY 10 H GLY 10 -2.172 -5.239 -1.322 69 1HA GLY 10 HA2 GLY 10 -0.773 -7.556 -0.919 70 2HA GLY 10 HA3 GLY 10 -1.038 -6.810 -2.502 71 H LEU 11 H LEU 11 0.549 -4.549 -2.400 72 HA LEU 11 HA LEU 11 3.105 -5.492 -2.996 73 1HB LEU 11 HB2 LEU 11 1.881 -3.228 -3.537 74 2HB LEU 11 HB3 LEU 11 2.568 -2.666 -2.020 75 HG LEU 11 HG LEU 11 3.926 -1.881 -3.762 76 1HD1 LEU 11 HD11 LEU 11 5.478 -4.225 -2.679 77 2HD1 LEU 11 HD12 LEU 11 6.088 -2.662 -3.251 78 3HD1 LEU 11 HD13 LEU 11 5.121 -2.732 -1.764 79 1HD2 LEU 11 HD21 LEU 11 4.204 -4.698 -4.857 80 2HD2 LEU 11 HD22 LEU 11 3.204 -3.390 -5.536 81 3HD2 LEU 11 HD23 LEU 11 4.967 -3.220 -5.481 82 H LEU 12 H LEU 12 2.179 -3.620 -0.059 83 HA LEU 12 HA LEU 12 4.618 -3.902 1.386 84 1HB LEU 12 HB2 LEU 12 1.693 -3.657 2.279 85 2HB LEU 12 HB3 LEU 12 3.028 -3.777 3.420 86 HG LEU 12 HG LEU 12 4.054 -1.757 2.491 87 1HD1 LEU 12 HD11 LEU 12 1.443 -1.492 0.929 88 2HD1 LEU 12 HD12 LEU 12 2.640 -0.202 1.126 89 3HD1 LEU 12 HD13 LEU 12 3.072 -1.652 0.222 90 1HD2 LEU 12 HD21 LEU 12 2.424 -0.191 3.524 91 2HD2 LEU 12 HD22 LEU 12 1.187 -1.465 3.480 92 3HD2 LEU 12 HD23 LEU 12 2.638 -1.656 4.487 93 H ILE 13 H ILE 13 1.746 -6.018 1.289 94 HA ILE 13 HA ILE 13 2.692 -7.790 3.317 95 HB ILE 13 HB ILE 13 0.499 -7.895 1.207 96 1HG1 ILE 13 HG12 ILE 13 -0.844 -8.367 3.303 97 2HG1 ILE 13 HG13 ILE 13 0.629 -8.132 4.247 98 1HG2 ILE 13 HG21 ILE 13 1.294 -10.168 1.097 99 2HG2 ILE 13 HG22 ILE 13 1.395 -10.246 2.871 100 3HG2 ILE 13 HG23 ILE 13 -0.182 -10.116 2.054 101 1HD1 ILE 13 HD11 ILE 13 -0.672 -6.094 4.351 102 2HD1 ILE 13 HD12 ILE 13 0.673 -5.735 3.290 103 3HD1 ILE 13 HD13 ILE 13 -0.946 -6.123 2.627 104 H GLY 14 H GLY 14 2.895 -7.949 -0.226 105 1HA GLY 14 HA2 GLY 14 4.247 -10.418 -0.486 106 2HA GLY 14 HA3 GLY 14 4.273 -9.064 -1.637 107 H ILE 15 H ILE 15 5.517 -7.035 -0.403 108 HA ILE 15 HA ILE 15 8.257 -7.630 -0.497 109 HB ILE 15 HB ILE 15 6.604 -5.340 0.519 110 1HG1 ILE 15 HG12 ILE 15 8.890 -5.705 -1.481 111 2HG1 ILE 15 HG13 ILE 15 7.168 -5.606 -1.857 112 1HG2 ILE 15 HG21 ILE 15 9.576 -5.563 1.071 113 2HG2 ILE 15 HG22 ILE 15 8.587 -4.094 1.263 114 3HG2 ILE 15 HG23 ILE 15 8.263 -5.482 2.270 115 1HD1 ILE 15 HD11 ILE 15 8.977 -3.392 -0.801 116 2HD1 ILE 15 HD12 ILE 15 8.145 -3.474 -2.354 117 3HD1 ILE 15 HD13 ILE 15 7.208 -3.257 -0.856 118 H PHE 16 H PHE 16 6.137 -7.438 2.402 119 HA PHE 16 HA PHE 16 8.215 -8.095 4.238 120 1HB PHE 16 HB2 PHE 16 5.955 -7.196 4.810 121 2HB PHE 16 HB3 PHE 16 5.249 -8.760 4.474 122 HD1 PHE 16 HD1 PHE 16 5.967 -10.786 5.926 123 HD2 PHE 16 HD2 PHE 16 7.198 -6.764 6.848 124 HE1 PHE 16 HE1 PHE 16 6.355 -11.439 8.254 125 HE2 PHE 16 HE2 PHE 16 7.486 -7.402 9.228 126 HZ PHE 16 HZ PHE 16 6.979 -9.715 9.959 127 H HIS 17 H HIS 17 5.718 -10.272 2.794 128 HA HIS 17 HA HIS 17 6.828 -12.504 4.159 129 1HB HIS 17 HB2 HIS 17 4.712 -12.337 2.021 130 2HB HIS 17 HB3 HIS 17 5.206 -13.847 2.805 131 HD1 HIS 17 HD1 HIS 17 3.595 -10.494 3.712 132 HD2 HIS 17 HD2 HIS 17 4.698 -14.162 5.435 133 HE1 HIS 17 HE1 HIS 17 2.740 -10.466 6.138 134 H LYS 18 H LYS 18 7.542 -11.203 1.013 135 HA LYS 18 HA LYS 18 8.962 -13.376 -0.129 136 1HB LYS 18 HB2 LYS 18 8.450 -11.192 -1.211 137 2HB LYS 18 HB3 LYS 18 9.635 -10.399 -0.154 138 1HG LYS 18 HG2 LYS 18 11.370 -12.037 -1.160 139 2HG LYS 18 HG3 LYS 18 10.123 -12.468 -2.336 140 1HD LYS 18 HD2 LYS 18 11.363 -9.716 -1.852 141 2HD LYS 18 HD3 LYS 18 11.625 -10.780 -3.248 142 1HE LYS 18 HE2 LYS 18 9.185 -10.536 -3.831 143 2HE LYS 18 HE3 LYS 18 9.020 -9.367 -2.503 144 1HZ LYS 18 HZ1 LYS 18 10.661 -8.004 -3.571 145 2HZ LYS 18 HZ2 LYS 18 10.785 -9.071 -4.822 146 3HZ LYS 18 HZ3 LYS 18 9.369 -8.272 -4.560 147 H TYR 19 H TYR 19 9.892 -10.929 2.329 148 HA TYR 19 HA TYR 19 12.596 -12.063 2.560 149 1HB TYR 19 HB2 TYR 19 11.216 -9.622 3.555 150 2HB TYR 19 HB3 TYR 19 12.608 -10.230 4.450 151 HD1 TYR 19 HD1 TYR 19 11.487 -8.958 1.138 152 HD2 TYR 19 HD2 TYR 19 14.847 -10.225 3.522 153 HE1 TYR 19 HE1 TYR 19 13.031 -8.032 -0.544 154 HE2 TYR 19 HE2 TYR 19 16.393 -9.401 1.767 155 HH TYR 19 HH TYR 19 16.338 -7.516 0.164 156 H SER 20 H SER 20 9.649 -11.881 4.715 157 HA SER 20 HA SER 20 10.967 -13.288 6.812 158 1HB SER 20 HB2 SER 20 8.856 -13.937 7.683 159 2HB SER 20 HB3 SER 20 8.821 -12.223 7.230 160 HG SER 20 HG SER 20 6.988 -13.675 6.653 161 H GLY 21 H GLY 21 9.214 -14.515 3.951 162 1HA GLY 21 HA2 GLY 21 9.264 -17.202 4.082 163 2HA GLY 21 HA3 GLY 21 9.767 -16.303 2.648 164 H LYS 22 H LYS 22 12.226 -15.195 3.820 165 HA LYS 22 HA LYS 22 14.089 -17.202 3.109 166 1HB LYS 22 HB2 LYS 22 14.345 -14.707 3.115 167 2HB LYS 22 HB3 LYS 22 14.496 -14.765 4.875 168 1HG LYS 22 HG2 LYS 22 16.489 -16.261 4.622 169 2HG LYS 22 HG3 LYS 22 16.379 -16.061 2.865 170 1HD LYS 22 HD2 LYS 22 16.846 -13.863 4.946 171 2HD LYS 22 HD3 LYS 22 18.051 -14.535 3.838 172 1HE LYS 22 HE2 LYS 22 16.651 -13.693 1.901 173 2HE LYS 22 HE3 LYS 22 15.599 -12.876 3.076 174 1HZ LYS 22 HZ1 LYS 22 18.466 -12.394 2.746 175 2HZ LYS 22 HZ2 LYS 22 17.244 -11.420 2.221 176 3HZ LYS 22 HZ3 LYS 22 17.480 -11.647 3.837 177 H GLU 23 H GLU 23 12.825 -16.167 6.290 178 HA GLU 23 HA GLU 23 14.408 -18.262 7.692 179 1HB GLU 23 HB2 GLU 23 13.399 -17.274 9.750 180 2HB GLU 23 HB3 GLU 23 14.536 -16.252 8.862 181 1HG GLU 23 HG2 GLU 23 12.738 -14.909 7.935 182 2HG GLU 23 HG3 GLU 23 11.515 -15.970 8.674 183 H GLY 24 H GLY 24 11.068 -17.417 6.752 184 1HA GLY 24 HA2 GLY 24 10.237 -19.918 6.148 185 2HA GLY 24 HA3 GLY 24 9.890 -19.831 7.892 186 H ASP 25 H ASP 25 7.698 -20.101 6.311 187 HA ASP 25 HA ASP 25 6.555 -17.557 5.509 188 1HB ASP 25 HB2 ASP 25 5.831 -19.647 4.472 189 2HB ASP 25 HB3 ASP 25 5.271 -20.264 6.038 190 H LYS 26 H LYS 26 7.227 -16.478 7.524 191 HA LYS 26 HA LYS 26 5.338 -16.836 9.822 192 1HB LYS 26 HB2 LYS 26 8.119 -15.595 9.752 193 2HB LYS 26 HB3 LYS 26 7.110 -15.859 11.184 194 1HG LYS 26 HG2 LYS 26 7.253 -18.327 10.795 195 2HG LYS 26 HG3 LYS 26 8.313 -18.023 9.404 196 1HD LYS 26 HD2 LYS 26 9.859 -16.739 10.955 197 2HD LYS 26 HD3 LYS 26 8.908 -17.351 12.314 198 1HE LYS 26 HE2 LYS 26 10.443 -19.004 10.241 199 2HE LYS 26 HE3 LYS 26 10.914 -18.730 11.922 200 1HZ LYS 26 HZ1 LYS 26 9.878 -20.843 11.643 201 2HZ LYS 26 HZ2 LYS 26 8.936 -19.890 12.604 202 3HZ LYS 26 HZ3 LYS 26 8.508 -20.160 11.035 203 H HIS 27 H HIS 27 4.468 -14.937 10.733 204 HA HIS 27 HA HIS 27 4.430 -12.521 9.001 205 1HB HIS 27 HB2 HIS 27 2.801 -13.183 11.462 206 2HB HIS 27 HB3 HIS 27 2.527 -11.861 10.318 207 HD1 HIS 27 HD1 HIS 27 2.818 -13.528 7.586 208 HD2 HIS 27 HD2 HIS 27 0.754 -14.765 11.047 209 HE1 HIS 27 HE1 HIS 27 1.236 -15.397 6.874 210 H THR 28 H THR 28 6.893 -13.153 10.156 211 HA THR 28 HA THR 28 7.474 -10.944 11.955 212 HB THR 28 HB THR 28 8.118 -13.845 12.587 213 HG1 THR 28 HG1 THR 28 6.425 -12.135 14.078 214 1HG2 THR 28 HG21 THR 28 8.948 -12.969 14.758 215 2HG2 THR 28 HG22 THR 28 9.868 -12.316 13.394 216 3HG2 THR 28 HG23 THR 28 8.653 -11.307 14.202 217 H LEU 29 H LEU 29 9.704 -10.348 11.631 218 HA LEU 29 HA LEU 29 11.192 -11.757 9.462 219 1HB LEU 29 HB2 LEU 29 9.352 -10.163 8.697 220 2HB LEU 29 HB3 LEU 29 10.304 -8.833 9.341 221 HG LEU 29 HG LEU 29 11.210 -10.782 7.164 222 1HD1 LEU 29 HD11 LEU 29 9.868 -8.056 6.949 223 2HD1 LEU 29 HD12 LEU 29 10.581 -8.950 5.597 224 3HD1 LEU 29 HD13 LEU 29 9.188 -9.622 6.452 225 1HD2 LEU 29 HD21 LEU 29 13.078 -9.519 8.218 226 2HD2 LEU 29 HD22 LEU 29 12.779 -8.948 6.566 227 3HD2 LEU 29 HD23 LEU 29 12.191 -8.001 7.948 228 H SER 30 H SER 30 13.373 -11.706 10.021 229 HA SER 30 HA SER 30 14.055 -10.465 12.505 230 1HB SER 30 HB2 SER 30 15.803 -11.827 10.413 231 2HB SER 30 HB3 SER 30 16.342 -11.375 12.041 232 HG SER 30 HG SER 30 14.139 -13.091 11.498 233 H LYS 31 H LYS 31 15.853 -8.959 12.963 234 HA LYS 31 HA LYS 31 15.323 -6.583 11.613 235 1HB LYS 31 HB2 LYS 31 17.056 -5.589 13.056 236 2HB LYS 31 HB3 LYS 31 15.827 -6.577 13.848 237 1HG LYS 31 HG2 LYS 31 17.498 -8.459 14.021 238 2HG LYS 31 HG3 LYS 31 18.744 -7.334 13.425 239 1HD LYS 31 HD2 LYS 31 18.351 -5.839 15.319 240 2HD LYS 31 HD3 LYS 31 16.899 -6.738 15.776 241 1HE LYS 31 HE2 LYS 31 18.266 -8.746 16.275 242 2HE LYS 31 HE3 LYS 31 19.738 -7.793 15.980 243 1HZ LYS 31 HZ1 LYS 31 19.065 -6.341 17.744 244 2HZ LYS 31 HZ2 LYS 31 17.643 -7.148 17.945 245 3HZ LYS 31 HZ3 LYS 31 19.075 -7.892 18.307 246 H LYS 32 H LYS 32 18.384 -8.481 11.352 247 HA LYS 32 HA LYS 32 19.476 -6.646 9.403 248 1HB LYS 32 HB2 LYS 32 20.915 -8.124 10.638 249 2HB LYS 32 HB3 LYS 32 20.163 -9.562 9.899 250 1HG LYS 32 HG2 LYS 32 20.945 -8.799 7.662 251 2HG LYS 32 HG3 LYS 32 21.649 -7.348 8.402 252 1HD LYS 32 HD2 LYS 32 23.142 -8.821 9.775 253 2HD LYS 32 HD3 LYS 32 22.469 -10.242 8.960 254 1HE LYS 32 HE2 LYS 32 23.973 -7.939 7.614 255 2HE LYS 32 HE3 LYS 32 24.630 -9.544 7.969 256 1HZ LYS 32 HZ1 LYS 32 22.411 -8.968 6.130 257 2HZ LYS 32 HZ2 LYS 32 23.943 -9.395 5.718 258 3HZ LYS 32 HZ3 LYS 32 22.975 -10.472 6.501 259 H GLU 33 H GLU 33 17.291 -9.412 9.173 260 HA GLU 33 HA GLU 33 17.346 -9.694 6.316 261 1HB GLU 33 HB2 GLU 33 16.594 -11.411 7.914 262 2HB GLU 33 HB3 GLU 33 15.197 -10.419 8.337 263 1HG GLU 33 HG2 GLU 33 14.373 -10.603 6.001 264 2HG GLU 33 HG3 GLU 33 15.758 -11.643 5.617 265 H LEU 34 H LEU 34 15.367 -7.727 8.578 266 HA LEU 34 HA LEU 34 13.754 -6.418 6.644 267 1HB LEU 34 HB2 LEU 34 13.204 -6.235 8.960 268 2HB LEU 34 HB3 LEU 34 14.751 -5.551 9.385 269 HG LEU 34 HG LEU 34 12.925 -3.958 9.421 270 1HD1 LEU 34 HD11 LEU 34 14.814 -2.942 7.314 271 2HD1 LEU 34 HD12 LEU 34 14.107 -2.113 8.687 272 3HD1 LEU 34 HD13 LEU 34 15.373 -3.308 8.946 273 1HD2 LEU 34 HD21 LEU 34 11.579 -4.792 7.549 274 2HD2 LEU 34 HD22 LEU 34 11.941 -3.069 7.331 275 3HD2 LEU 34 HD23 LEU 34 12.822 -4.272 6.395 276 H LYS 35 H LYS 35 17.018 -5.552 8.008 277 HA LYS 35 HA LYS 35 17.314 -3.277 6.362 278 1HB LYS 35 HB2 LYS 35 18.821 -3.957 8.242 279 2HB LYS 35 HB3 LYS 35 19.615 -5.111 7.147 280 1HG LYS 35 HG2 LYS 35 20.193 -3.276 5.606 281 2HG LYS 35 HG3 LYS 35 19.279 -2.130 6.606 282 1HD LYS 35 HD2 LYS 35 20.835 -2.710 8.533 283 2HD LYS 35 HD3 LYS 35 21.839 -3.590 7.368 284 1HE LYS 35 HE2 LYS 35 21.083 -0.620 7.278 285 2HE LYS 35 HE3 LYS 35 22.673 -1.295 7.690 286 1HZ LYS 35 HZ1 LYS 35 22.710 -0.580 5.491 287 2HZ LYS 35 HZ2 LYS 35 22.750 -2.224 5.460 288 3HZ LYS 35 HZ3 LYS 35 21.354 -1.430 5.076 289 H GLU 36 H GLU 36 18.049 -6.692 5.632 290 HA GLU 36 HA GLU 36 19.035 -6.305 3.015 291 1HB GLU 36 HB2 GLU 36 18.922 -8.421 4.647 292 2HB GLU 36 HB3 GLU 36 17.452 -8.779 3.745 293 1HG GLU 36 HG2 GLU 36 19.278 -9.941 2.690 294 2HG GLU 36 HG3 GLU 36 18.890 -8.588 1.615 295 H LEU 37 H LEU 37 15.688 -6.640 4.180 296 HA LEU 37 HA LEU 37 14.378 -6.499 1.618 297 1HB LEU 37 HB2 LEU 37 13.221 -7.206 3.629 298 2HB LEU 37 HB3 LEU 37 13.497 -5.689 4.430 299 HG LEU 37 HG LEU 37 11.758 -5.879 1.978 300 1HD1 LEU 37 HD11 LEU 37 9.881 -5.865 3.684 301 2HD1 LEU 37 HD12 LEU 37 10.866 -7.335 3.718 302 3HD1 LEU 37 HD13 LEU 37 11.085 -6.074 4.959 303 1HD2 LEU 37 HD21 LEU 37 12.379 -3.536 2.474 304 2HD2 LEU 37 HD22 LEU 37 10.737 -3.801 3.024 305 3HD2 LEU 37 HD23 LEU 37 12.049 -3.779 4.207 306 H ILE 38 H ILE 38 15.204 -3.927 3.926 307 HA ILE 38 HA ILE 38 14.254 -1.861 2.259 308 HB ILE 38 HB ILE 38 16.284 -1.917 4.510 309 1HG1 ILE 38 HG12 ILE 38 13.343 -1.125 4.174 310 2HG1 ILE 38 HG13 ILE 38 13.989 -2.491 5.083 311 1HG2 ILE 38 HG21 ILE 38 15.124 0.611 3.278 312 2HG2 ILE 38 HG22 ILE 38 16.230 0.482 4.645 313 3HG2 ILE 38 HG23 ILE 38 16.799 0.059 3.041 314 1HD1 ILE 38 HD11 ILE 38 13.375 -0.866 6.634 315 2HD1 ILE 38 HD12 ILE 38 15.157 -0.779 6.574 316 3HD1 ILE 38 HD13 ILE 38 14.166 0.450 5.738 317 H GLN 39 H GLN 39 17.626 -3.074 2.536 318 HA GLN 39 HA GLN 39 18.695 -1.250 0.694 319 1HB GLN 39 HB2 GLN 39 19.493 -4.141 1.268 320 2HB GLN 39 HB3 GLN 39 20.487 -3.023 0.326 321 1HG GLN 39 HG2 GLN 39 19.685 -2.515 3.231 322 2HG GLN 39 HG3 GLN 39 21.187 -3.276 2.712 323 1HE2 GLN 39 HE22 GLN 39 19.325 -0.231 2.703 324 2HE2 GLN 39 HE21 GLN 39 20.714 0.784 2.357 325 H LYS 40 H LYS 40 16.946 -4.304 -0.067 326 HA LYS 40 HA LYS 40 17.616 -3.927 -2.914 327 1HB LYS 40 HB2 LYS 40 17.329 -6.170 -1.765 328 2HB LYS 40 HB3 LYS 40 15.595 -5.816 -1.689 329 1HG LYS 40 HG2 LYS 40 15.637 -5.546 -4.236 330 2HG LYS 40 HG3 LYS 40 17.354 -5.969 -4.186 331 1HD LYS 40 HD2 LYS 40 16.271 -7.987 -4.755 332 2HD LYS 40 HD3 LYS 40 16.657 -8.155 -3.032 333 1HE LYS 40 HE2 LYS 40 14.285 -7.401 -2.515 334 2HE LYS 40 HE3 LYS 40 13.954 -7.393 -4.253 335 1HZ LYS 40 HZ1 LYS 40 14.784 -9.707 -2.649 336 2HZ LYS 40 HZ2 LYS 40 13.264 -9.403 -3.208 337 3HZ LYS 40 HZ3 LYS 40 14.481 -9.732 -4.272 338 H GLU 41 H GLU 41 14.652 -3.776 -0.891 339 HA GLU 41 HA GLU 41 12.997 -3.086 -3.167 340 1HB GLU 41 HB2 GLU 41 12.421 -3.042 -0.174 341 2HB GLU 41 HB3 GLU 41 11.211 -2.906 -1.449 342 1HG GLU 41 HG2 GLU 41 13.033 -5.333 -1.011 343 2HG GLU 41 HG3 GLU 41 11.379 -5.183 -0.429 344 H LEU 42 H LEU 42 14.294 -1.287 -0.369 345 HA LEU 42 HA LEU 42 13.212 1.282 -1.447 346 1HB LEU 42 HB2 LEU 42 14.268 0.480 1.280 347 2HB LEU 42 HB3 LEU 42 13.984 2.147 0.778 348 HG LEU 42 HG LEU 42 11.575 1.681 0.511 349 1HD1 LEU 42 HD11 LEU 42 10.691 -0.423 1.664 350 2HD1 LEU 42 HD12 LEU 42 11.375 -0.654 0.055 351 3HD1 LEU 42 HD13 LEU 42 12.312 -1.095 1.503 352 1HD2 LEU 42 HD21 LEU 42 12.694 0.946 3.235 353 2HD2 LEU 42 HD22 LEU 42 12.495 2.592 2.602 354 3HD2 LEU 42 HD23 LEU 42 11.072 1.582 2.897 355 H THR 43 H THR 43 14.872 0.689 -3.197 356 HA THR 43 HA THR 43 17.577 0.391 -2.624 357 HB THR 43 HB THR 43 16.671 1.545 -5.254 358 HG1 THR 43 HG1 THR 43 15.843 -1.008 -4.364 359 1HG2 THR 43 HG21 THR 43 18.256 -0.949 -4.489 360 2HG2 THR 43 HG22 THR 43 18.007 -0.314 -6.129 361 3HG2 THR 43 HG23 THR 43 18.962 0.616 -4.956 362 H ILE 44 H ILE 44 17.749 2.195 -0.980 363 HA ILE 44 HA ILE 44 17.921 4.915 -1.775 364 HB ILE 44 HB ILE 44 19.586 3.667 0.438 365 1HG1 ILE 44 HG12 ILE 44 17.291 4.747 1.636 366 2HG1 ILE 44 HG13 ILE 44 16.647 3.816 0.292 367 1HG2 ILE 44 HG21 ILE 44 18.369 6.436 0.116 368 2HG2 ILE 44 HG22 ILE 44 19.355 5.867 1.480 369 3HG2 ILE 44 HG23 ILE 44 20.075 6.015 -0.124 370 1HD1 ILE 44 HD11 ILE 44 18.584 2.860 2.461 371 2HD1 ILE 44 HD12 ILE 44 16.872 2.411 2.295 372 3HD1 ILE 44 HD13 ILE 44 18.072 1.849 1.108 373 H GLY 45 H GLY 45 19.183 5.397 -3.594 374 1HA GLY 45 HA2 GLY 45 21.694 4.350 -4.302 375 2HA GLY 45 HA3 GLY 45 21.161 6.010 -4.636 376 H SER 46 H SER 46 20.965 7.187 -2.221 377 HA SER 46 HA SER 46 23.612 7.735 -1.413 378 1HB SER 46 HB2 SER 46 21.008 8.426 -0.008 379 2HB SER 46 HB3 SER 46 22.527 9.340 0.029 380 HG SER 46 HG SER 46 20.976 10.179 -1.484 381 H LYS 47 H LYS 47 23.889 5.198 -0.935 382 HA LYS 47 HA LYS 47 22.967 4.073 1.459 383 1HB LYS 47 HB2 LYS 47 25.600 3.632 -0.002 384 2HB LYS 47 HB3 LYS 47 25.015 2.604 1.309 385 1HG LYS 47 HG2 LYS 47 23.579 3.018 -1.356 386 2HG LYS 47 HG3 LYS 47 24.569 1.630 -0.891 387 1HD LYS 47 HD2 LYS 47 22.958 1.267 1.076 388 2HD LYS 47 HD3 LYS 47 21.926 2.508 0.344 389 1HE LYS 47 HE2 LYS 47 21.027 0.478 -0.419 390 2HE LYS 47 HE3 LYS 47 21.925 1.125 -1.798 391 1HZ LYS 47 HZ1 LYS 47 22.848 -0.926 0.097 392 2HZ LYS 47 HZ2 LYS 47 22.338 -1.202 -1.448 393 3HZ LYS 47 HZ3 LYS 47 23.731 -0.360 -1.180 394 H LEU 48 H LEU 48 25.157 6.705 1.251 395 HA LEU 48 HA LEU 48 26.555 6.535 3.692 396 1HB LEU 48 HB2 LEU 48 25.144 8.955 2.492 397 2HB LEU 48 HB3 LEU 48 26.428 9.001 3.706 398 HG LEU 48 HG LEU 48 26.728 8.006 0.829 399 1HD1 LEU 48 HD11 LEU 48 28.080 10.032 0.533 400 2HD1 LEU 48 HD12 LEU 48 26.431 10.447 1.030 401 3HD1 LEU 48 HD13 LEU 48 27.757 10.517 2.211 402 1HD2 LEU 48 HD21 LEU 48 29.173 8.013 1.359 403 2HD2 LEU 48 HD22 LEU 48 28.784 8.291 3.069 404 3HD2 LEU 48 HD23 LEU 48 28.293 6.782 2.266 405 H GLN 49 H GLN 49 23.112 7.014 3.093 406 HA GLN 49 HA GLN 49 22.414 7.821 5.775 407 1HB GLN 49 HB2 GLN 49 20.775 6.561 3.544 408 2HB GLN 49 HB3 GLN 49 20.107 7.217 5.044 409 1HG GLN 49 HG2 GLN 49 21.037 9.456 4.502 410 2HG GLN 49 HG3 GLN 49 21.680 8.820 2.982 411 1HE2 GLN 49 HE22 GLN 49 18.566 9.118 4.814 412 2HE2 GLN 49 HE21 GLN 49 17.592 9.326 3.364 413 H ASP 50 H ASP 50 23.835 4.910 4.969 414 HA ASP 50 HA ASP 50 22.367 2.852 5.944 415 1HB ASP 50 HB2 ASP 50 24.658 2.627 5.095 416 2HB ASP 50 HB3 ASP 50 25.303 3.454 6.522 417 H ALA 51 H ALA 51 24.130 5.189 7.971 418 HA ALA 51 HA ALA 51 23.613 4.110 10.530 419 1HB ALA 51 HB1 ALA 51 23.751 7.035 9.686 420 2HB ALA 51 HB2 ALA 51 23.901 6.417 11.345 421 3HB ALA 51 HB3 ALA 51 25.126 5.999 10.131 422 H GLU 52 H GLU 52 21.567 6.156 8.450 423 HA GLU 52 HA GLU 52 19.481 6.587 10.424 424 1HB GLU 52 HB2 GLU 52 19.300 6.815 7.391 425 2HB GLU 52 HB3 GLU 52 18.217 7.518 8.589 426 1HG GLU 52 HG2 GLU 52 20.020 8.985 9.418 427 2HG GLU 52 HG3 GLU 52 21.169 8.272 8.275 428 H ILE 53 H ILE 53 20.111 4.370 7.677 429 HA ILE 53 HA ILE 53 17.649 2.954 7.882 430 HB ILE 53 HB ILE 53 20.300 1.811 6.951 431 1HG1 ILE 53 HG12 ILE 53 19.834 3.743 5.591 432 2HG1 ILE 53 HG13 ILE 53 19.455 2.295 4.674 433 1HG2 ILE 53 HG21 ILE 53 17.424 0.885 6.609 434 2HG2 ILE 53 HG22 ILE 53 18.801 0.246 5.683 435 3HG2 ILE 53 HG23 ILE 53 18.727 0.037 7.438 436 1HD1 ILE 53 HD11 ILE 53 17.019 2.653 5.169 437 2HD1 ILE 53 HD12 ILE 53 17.438 4.152 6.032 438 3HD1 ILE 53 HD13 ILE 53 17.757 4.015 4.309 439 H VAL 54 H VAL 54 20.775 2.334 9.638 440 HA VAL 54 HA VAL 54 19.513 0.080 10.947 441 HB VAL 54 HB VAL 54 21.407 0.058 12.521 442 1HG1 VAL 54 HG11 VAL 54 21.236 -1.343 10.503 443 2HG1 VAL 54 HG12 VAL 54 21.982 -0.044 9.544 444 3HG1 VAL 54 HG13 VAL 54 22.916 -0.872 10.810 445 1HG2 VAL 54 HG21 VAL 54 22.098 2.445 12.361 446 2HG2 VAL 54 HG22 VAL 54 23.410 1.294 12.054 447 3HG2 VAL 54 HG23 VAL 54 22.644 2.122 10.696 448 H LYS 55 H LYS 55 19.703 3.544 11.848 449 HA LYS 55 HA LYS 55 18.506 3.124 14.425 450 1HB LYS 55 HB2 LYS 55 19.464 5.263 13.853 451 2HB LYS 55 HB3 LYS 55 18.346 5.471 12.507 452 1HG LYS 55 HG2 LYS 55 17.764 6.824 14.514 453 2HG LYS 55 HG3 LYS 55 16.467 5.780 13.945 454 1HD LYS 55 HD2 LYS 55 16.567 5.819 16.376 455 2HD LYS 55 HD3 LYS 55 16.843 4.195 15.779 456 1HE LYS 55 HE2 LYS 55 19.316 4.510 16.118 457 2HE LYS 55 HE3 LYS 55 18.993 6.133 16.753 458 1HZ LYS 55 HZ1 LYS 55 17.711 5.127 18.489 459 2HZ LYS 55 HZ2 LYS 55 17.945 3.618 17.872 460 3HZ LYS 55 HZ3 LYS 55 19.223 4.474 18.469 461 H LEU 56 H LEU 56 17.054 3.648 11.187 462 HA LEU 56 HA LEU 56 14.338 3.376 11.946 463 1HB LEU 56 HB2 LEU 56 14.841 4.303 9.895 464 2HB LEU 56 HB3 LEU 56 15.897 2.994 9.391 465 HG LEU 56 HG LEU 56 13.022 2.274 9.864 466 1HD1 LEU 56 HD11 LEU 56 14.057 3.824 7.436 467 2HD1 LEU 56 HD12 LEU 56 12.485 3.012 7.527 468 3HD1 LEU 56 HD13 LEU 56 12.833 4.391 8.591 469 1HD2 LEU 56 HD21 LEU 56 14.766 0.580 9.120 470 2HD2 LEU 56 HD22 LEU 56 13.447 0.847 7.978 471 3HD2 LEU 56 HD23 LEU 56 15.054 1.569 7.688 472 H MET 57 H MET 57 16.719 0.873 11.010 473 HA MET 57 HA MET 57 15.051 -1.392 11.124 474 1HB MET 57 HB2 MET 57 17.410 -1.338 10.246 475 2HB MET 57 HB3 MET 57 17.975 -1.144 11.911 476 1HG MET 57 HG2 MET 57 16.867 -3.357 12.458 477 2HG MET 57 HG3 MET 57 16.594 -3.542 10.728 478 1HE MET 57 HE1 MET 57 19.143 -3.505 13.653 479 2HE MET 57 HE2 MET 57 20.706 -3.672 12.821 480 3HE MET 57 HE3 MET 57 19.810 -2.145 12.715 481 H ASP 58 H ASP 58 17.112 0.096 13.666 482 HA ASP 58 HA ASP 58 16.329 -1.470 15.866 483 1HB ASP 58 HB2 ASP 58 18.143 0.004 16.146 484 2HB ASP 58 HB3 ASP 58 17.218 1.413 15.646 485 H ASP 59 H ASP 59 14.778 1.591 14.680 486 HA ASP 59 HA ASP 59 12.683 1.525 16.561 487 1HB ASP 59 HB2 ASP 59 12.924 2.776 13.811 488 2HB ASP 59 HB3 ASP 59 11.394 2.814 14.685 489 H LEU 60 H LEU 60 12.798 -0.080 13.363 490 HA LEU 60 HA LEU 60 10.113 -1.138 13.490 491 1HB LEU 60 HB2 LEU 60 12.638 -1.794 11.956 492 2HB LEU 60 HB3 LEU 60 11.283 -2.916 11.893 493 HG LEU 60 HG LEU 60 10.755 -0.013 11.337 494 1HD1 LEU 60 HD11 LEU 60 11.854 -1.932 9.259 495 2HD1 LEU 60 HD12 LEU 60 11.267 -0.298 8.956 496 3HD1 LEU 60 HD13 LEU 60 12.728 -0.538 9.939 497 1HD2 LEU 60 HD21 LEU 60 8.867 -1.691 11.370 498 2HD2 LEU 60 HD22 LEU 60 9.107 -1.035 9.731 499 3HD2 LEU 60 HD23 LEU 60 9.711 -2.637 10.117 500 H ASP 61 H ASP 61 13.266 -2.704 14.276 501 HA ASP 61 HA ASP 61 11.957 -5.084 15.177 502 1HB ASP 61 HB2 ASP 61 14.086 -5.931 15.777 503 2HB ASP 61 HB3 ASP 61 14.176 -5.095 14.221 504 H ARG 62 H ARG 62 12.865 -2.167 16.870 505 HA ARG 62 HA ARG 62 13.088 -2.924 19.475 506 1HB ARG 62 HB2 ARG 62 13.546 -0.755 18.934 507 2HB ARG 62 HB3 ARG 62 12.014 -0.460 18.137 508 1HG ARG 62 HG2 ARG 62 12.233 -0.913 21.157 509 2HG ARG 62 HG3 ARG 62 12.557 0.647 20.411 510 1HD ARG 62 HD2 ARG 62 9.888 -0.804 20.461 511 2HD ARG 62 HD3 ARG 62 10.290 0.742 21.170 512 HE ARG 62 HE ARG 62 9.608 0.143 18.398 513 1HH1 ARG 62 HH21 ARG 62 11.167 2.557 20.467 514 2HH1 ARG 62 HH22 ARG 62 11.339 3.724 19.180 515 1HH2 ARG 62 HH12 ARG 62 10.059 1.554 16.716 516 2HH2 ARG 62 HH11 ARG 62 10.640 3.179 17.041 517 H ASN 63 H ASN 63 10.075 -2.948 17.643 518 HA ASN 63 HA ASN 63 8.193 -3.177 19.653 519 1HB ASN 63 HB2 ASN 63 6.821 -4.371 18.221 520 2HB ASN 63 HB3 ASN 63 7.800 -3.378 17.133 521 1HD2 ASN 63 HD22 ASN 63 9.704 -4.516 16.044 522 2HD2 ASN 63 HD21 ASN 63 9.764 -6.277 16.029 523 H LYS 64 H LYS 64 10.607 -5.636 18.799 524 HA LYS 64 HA LYS 64 10.394 -6.587 21.551 525 1HB LYS 64 HB2 LYS 64 10.168 -8.950 21.086 526 2HB LYS 64 HB3 LYS 64 8.750 -8.050 20.541 527 1HG LYS 64 HG2 LYS 64 9.397 -8.245 18.229 528 2HG LYS 64 HG3 LYS 64 11.009 -8.823 18.645 529 1HD LYS 64 HD2 LYS 64 9.567 -10.669 17.888 530 2HD LYS 64 HD3 LYS 64 10.161 -10.906 19.531 531 1HE LYS 64 HE2 LYS 64 8.065 -10.380 20.532 532 2HE LYS 64 HE3 LYS 64 7.414 -9.670 19.055 533 1HZ LYS 64 HZ1 LYS 64 8.061 -12.508 19.452 534 2HZ LYS 64 HZ2 LYS 64 6.553 -11.845 19.466 535 3HZ LYS 64 HZ3 LYS 64 7.431 -11.855 18.075 536 H ASP 65 H ASP 65 12.314 -5.323 19.577 537 HA ASP 65 HA ASP 65 14.417 -5.042 19.312 538 1HB ASP 65 HB2 ASP 65 16.010 -5.449 20.926 539 2HB ASP 65 HB3 ASP 65 14.489 -5.213 21.787 540 H GLN 66 H GLN 66 13.824 -8.526 19.514 541 HA GLN 66 HA GLN 66 16.151 -9.213 17.941 542 1HB GLN 66 HB2 GLN 66 13.604 -10.763 18.588 543 2HB GLN 66 HB3 GLN 66 15.028 -11.451 17.795 544 1HG GLN 66 HG2 GLN 66 15.012 -10.246 20.601 545 2HG GLN 66 HG3 GLN 66 14.936 -11.961 20.205 546 1HE2 GLN 66 HE22 GLN 66 17.081 -9.243 20.606 547 2HE2 GLN 66 HE21 GLN 66 18.553 -10.117 20.187 548 H GLU 67 H GLU 67 12.652 -8.979 17.130 549 HA GLU 67 HA GLU 67 13.353 -8.938 14.238 550 1HB GLU 67 HB2 GLU 67 11.196 -10.709 15.470 551 2HB GLU 67 HB3 GLU 67 11.650 -10.579 13.771 552 1HG GLU 67 HG2 GLU 67 13.998 -11.435 14.503 553 2HG GLU 67 HG3 GLU 67 13.233 -11.832 16.044 554 H VAL 68 H VAL 68 11.687 -8.236 12.886 555 HA VAL 68 HA VAL 68 9.862 -6.199 13.967 556 HB VAL 68 HB VAL 68 10.242 -7.127 11.101 557 1HG1 VAL 68 HG11 VAL 68 9.405 -4.887 10.581 558 2HG1 VAL 68 HG12 VAL 68 8.233 -5.745 11.590 559 3HG1 VAL 68 HG13 VAL 68 9.271 -4.497 12.310 560 1HG2 VAL 68 HG21 VAL 68 11.760 -5.139 10.884 561 2HG2 VAL 68 HG22 VAL 68 11.833 -5.053 12.656 562 3HG2 VAL 68 HG23 VAL 68 12.464 -6.473 11.795 563 H ASN 69 H ASN 69 7.568 -6.560 13.904 564 HA ASN 69 HA ASN 69 6.655 -9.278 13.035 565 1HB ASN 69 HB2 ASN 69 5.715 -7.587 15.367 566 2HB ASN 69 HB3 ASN 69 4.732 -8.865 14.632 567 1HD2 ASN 69 HD21 ASN 69 7.512 -8.229 16.680 568 2HD2 ASN 69 HD22 ASN 69 7.896 -9.915 16.977 569 H PHE 70 H PHE 70 4.918 -9.391 11.738 570 HA PHE 70 HA PHE 70 4.741 -7.604 9.728 571 1HB PHE 70 HB2 PHE 70 3.868 -9.821 9.559 572 2HB PHE 70 HB3 PHE 70 2.618 -9.495 10.764 573 HD1 PHE 70 HD1 PHE 70 3.886 -8.186 7.469 574 HD2 PHE 70 HD2 PHE 70 0.459 -8.911 9.997 575 HE1 PHE 70 HE1 PHE 70 2.418 -7.077 5.810 576 HE2 PHE 70 HE2 PHE 70 -0.996 -7.809 8.337 577 HZ PHE 70 HZ PHE 70 -0.012 -6.814 6.294 578 H GLN 71 H GLN 71 2.240 -7.610 12.337 579 HA GLN 71 HA GLN 71 0.805 -5.401 11.381 580 1HB GLN 71 HB2 GLN 71 -0.018 -6.838 13.174 581 2HB GLN 71 HB3 GLN 71 1.300 -6.329 14.243 582 1HG GLN 71 HG2 GLN 71 -0.781 -5.235 14.852 583 2HG GLN 71 HG3 GLN 71 0.386 -4.030 14.328 584 1HE2 GLN 71 HE22 GLN 71 0.073 -3.025 12.157 585 2HE2 GLN 71 HE21 GLN 71 -1.585 -3.013 11.513 586 H GLU 72 H GLU 72 3.740 -5.505 13.378 587 HA GLU 72 HA GLU 72 3.714 -2.694 14.063 588 1HB GLU 72 HB2 GLU 72 6.024 -4.674 14.230 589 2HB GLU 72 HB3 GLU 72 5.859 -3.132 15.074 590 1HG GLU 72 HG2 GLU 72 4.086 -5.598 15.485 591 2HG GLU 72 HG3 GLU 72 5.324 -5.005 16.580 592 H TYR 73 H TYR 73 5.265 -4.742 11.610 593 HA TYR 73 HA TYR 73 6.838 -2.756 10.304 594 1HB TYR 73 HB2 TYR 73 7.270 -4.892 9.595 595 2HB TYR 73 HB3 TYR 73 5.601 -5.374 9.527 596 HD1 TYR 73 HD1 TYR 73 4.260 -5.127 7.544 597 HD2 TYR 73 HD2 TYR 73 8.311 -3.648 7.711 598 HE1 TYR 73 HE1 TYR 73 4.338 -5.070 5.080 599 HE2 TYR 73 HE2 TYR 73 8.427 -3.722 5.235 600 HH TYR 73 HH TYR 73 5.780 -4.980 3.239 601 H ILE 74 H ILE 74 3.388 -3.728 9.718 602 HA ILE 74 HA ILE 74 2.963 -1.703 7.761 603 HB ILE 74 HB ILE 74 0.910 -2.916 9.636 604 1HG1 ILE 74 HG12 ILE 74 2.139 -4.602 8.200 605 2HG1 ILE 74 HG13 ILE 74 0.406 -4.538 8.021 606 1HG2 ILE 74 HG21 ILE 74 -0.644 -2.250 7.668 607 2HG2 ILE 74 HG22 ILE 74 -0.063 -0.966 8.728 608 3HG2 ILE 74 HG23 ILE 74 0.672 -1.209 7.130 609 1HD1 ILE 74 HD11 ILE 74 1.502 -4.799 5.852 610 2HD1 ILE 74 HD12 ILE 74 0.624 -3.279 5.903 611 3HD1 ILE 74 HD13 ILE 74 2.399 -3.293 6.096 612 H THR 75 H THR 75 2.180 -1.586 11.306 613 HA THR 75 HA THR 75 1.323 1.062 11.452 614 HB THR 75 HB THR 75 2.932 -0.626 13.409 615 HG1 THR 75 HG1 THR 75 0.162 -0.065 13.201 616 1HG2 THR 75 HG21 THR 75 3.057 1.670 14.219 617 2HG2 THR 75 HG22 THR 75 1.311 1.895 13.961 618 3HG2 THR 75 HG23 THR 75 1.898 0.751 15.187 619 H PHE 76 H PHE 76 4.696 -0.148 11.542 620 HA PHE 76 HA PHE 76 5.900 2.407 11.984 621 1HB PHE 76 HB2 PHE 76 7.080 0.300 12.425 622 2HB PHE 76 HB3 PHE 76 7.039 -0.097 10.708 623 HD1 PHE 76 HD1 PHE 76 8.466 2.218 13.255 624 HD2 PHE 76 HD2 PHE 76 8.471 1.101 9.086 625 HE1 PHE 76 HE1 PHE 76 10.321 3.807 12.813 626 HE2 PHE 76 HE2 PHE 76 10.442 2.524 8.707 627 HZ PHE 76 HZ PHE 76 11.317 3.961 10.545 628 H LEU 77 H LEU 77 5.189 0.540 8.947 629 HA LEU 77 HA LEU 77 6.208 2.575 7.209 630 1HB LEU 77 HB2 LEU 77 4.069 0.453 6.829 631 2HB LEU 77 HB3 LEU 77 4.531 1.575 5.548 632 HG LEU 77 HG LEU 77 6.520 -0.264 6.963 633 1HD1 LEU 77 HD11 LEU 77 4.893 -1.607 5.728 634 2HD1 LEU 77 HD12 LEU 77 5.100 -0.575 4.288 635 3HD1 LEU 77 HD13 LEU 77 6.444 -1.576 4.865 636 1HD2 LEU 77 HD21 LEU 77 7.673 1.634 5.960 637 2HD2 LEU 77 HD22 LEU 77 7.888 0.254 4.896 638 3HD2 LEU 77 HD23 LEU 77 6.690 1.503 4.478 639 H GLY 78 H GLY 78 3.104 2.270 8.904 640 1HA GLY 78 HA2 GLY 78 1.852 4.587 7.863 641 2HA GLY 78 HA3 GLY 78 1.654 3.966 9.514 642 H ALA 79 H ALA 79 4.167 4.309 10.620 643 HA ALA 79 HA ALA 79 4.334 7.111 11.138 644 1HB ALA 79 HB1 ALA 79 6.559 5.059 11.535 645 2HB ALA 79 HB2 ALA 79 5.243 5.370 12.680 646 3HB ALA 79 HB3 ALA 79 6.408 6.645 12.297 647 H LEU 80 H LEU 80 6.259 5.026 8.958 648 HA LEU 80 HA LEU 80 8.064 6.982 8.061 649 1HB LEU 80 HB2 LEU 80 7.925 4.357 7.664 650 2HB LEU 80 HB3 LEU 80 6.996 4.809 6.239 651 HG LEU 80 HG LEU 80 8.987 6.317 5.607 652 1HD1 LEU 80 HD11 LEU 80 10.311 4.611 7.770 653 2HD1 LEU 80 HD12 LEU 80 11.183 5.600 6.584 654 3HD1 LEU 80 HD13 LEU 80 10.163 6.378 7.797 655 1HD2 LEU 80 HD21 LEU 80 8.513 4.134 4.520 656 2HD2 LEU 80 HD22 LEU 80 10.259 4.396 4.686 657 3HD2 LEU 80 HD23 LEU 80 9.423 3.303 5.804 658 H ALA 81 H ALA 81 4.882 6.030 6.784 659 HA ALA 81 HA ALA 81 4.734 7.870 4.618 660 1HB ALA 81 HB1 ALA 81 2.622 6.487 6.289 661 2HB ALA 81 HB2 ALA 81 2.263 7.533 4.898 662 3HB ALA 81 HB3 ALA 81 3.221 6.047 4.686 663 H MET 82 H MET 82 3.643 8.163 8.051 664 HA MET 82 HA MET 82 2.664 10.805 7.852 665 1HB MET 82 HB2 MET 82 2.226 9.332 9.729 666 2HB MET 82 HB3 MET 82 3.916 9.383 10.240 667 1HG MET 82 HG2 MET 82 2.254 11.905 10.007 668 2HG MET 82 HG3 MET 82 2.215 10.882 11.448 669 1HE MET 82 HE1 MET 82 2.781 13.026 12.883 670 2HE MET 82 HE2 MET 82 2.921 14.009 11.401 671 3HE MET 82 HE3 MET 82 4.227 14.028 12.611 672 H ILE 83 H ILE 83 5.986 9.655 8.569 673 HA ILE 83 HA ILE 83 7.185 12.226 8.835 674 HB ILE 83 HB ILE 83 8.315 9.542 7.982 675 1HG1 ILE 83 HG12 ILE 83 8.743 11.168 10.525 676 2HG1 ILE 83 HG13 ILE 83 7.441 9.993 10.370 677 1HG2 ILE 83 HG21 ILE 83 9.810 12.149 8.493 678 2HG2 ILE 83 HG22 ILE 83 9.732 11.266 6.953 679 3HG2 ILE 83 HG23 ILE 83 10.569 10.554 8.322 680 1HD1 ILE 83 HD11 ILE 83 9.282 8.942 11.493 681 2HD1 ILE 83 HD12 ILE 83 10.410 9.357 10.196 682 3HD1 ILE 83 HD13 ILE 83 9.094 8.198 9.896 683 H TYR 84 H TYR 84 6.628 10.184 5.917 684 HA TYR 84 HA TYR 84 7.459 12.267 4.062 685 1HB TYR 84 HB2 TYR 84 5.598 9.942 3.527 686 2HB TYR 84 HB3 TYR 84 6.534 10.856 2.352 687 HD1 TYR 84 HD1 TYR 84 9.201 10.751 4.138 688 HD2 TYR 84 HD2 TYR 84 6.372 7.858 2.638 689 HE1 TYR 84 HE1 TYR 84 10.998 9.063 3.996 690 HE2 TYR 84 HE2 TYR 84 8.185 6.175 2.484 691 HH TYR 84 HH TYR 84 10.439 5.780 2.708 692 H ASN 85 H ASN 85 5.629 13.287 6.039 693 HA ASN 85 HA ASN 85 3.097 13.765 5.666 694 1HB ASN 85 HB2 ASN 85 3.416 15.985 6.518 695 2HB ASN 85 HB3 ASN 85 4.586 14.914 7.288 696 1HD2 ASN 85 HD22 ASN 85 6.898 14.897 6.214 697 2HD2 ASN 85 HD21 ASN 85 7.422 16.459 5.611 698 H GLU 86 H GLU 86 5.532 15.176 3.444 699 HA GLU 86 HA GLU 86 3.997 16.872 1.897 700 1HB GLU 86 HB2 GLU 86 6.424 16.443 1.626 701 2HB GLU 86 HB3 GLU 86 6.069 14.859 0.909 702 1HG GLU 86 HG2 GLU 86 4.882 15.982 -0.967 703 2HG GLU 86 HG3 GLU 86 5.178 17.557 -0.213 704 H ALA 87 H ALA 87 4.178 13.300 1.619 705 HA ALA 87 HA ALA 87 2.512 12.982 -0.673 706 1HB ALA 87 HB1 ALA 87 2.985 11.120 1.698 707 2HB ALA 87 HB2 ALA 87 2.322 10.656 0.118 708 3HB ALA 87 HB3 ALA 87 4.000 11.225 0.242 709 H LEU 88 H LEU 88 1.803 13.349 2.791 710 HA LEU 88 HA LEU 88 -0.999 12.546 2.562 711 1HB LEU 88 HB2 LEU 88 0.629 13.808 4.810 712 2HB LEU 88 HB3 LEU 88 -1.077 13.413 4.900 713 HG LEU 88 HG LEU 88 -0.643 11.037 4.612 714 1HD1 LEU 88 HD11 LEU 88 2.302 11.765 4.502 715 2HD1 LEU 88 HD12 LEU 88 1.650 10.138 4.809 716 3HD1 LEU 88 HD13 LEU 88 1.345 10.910 3.267 717 1HD2 LEU 88 HD21 LEU 88 -0.648 12.060 6.864 718 2HD2 LEU 88 HD22 LEU 88 0.466 10.682 6.771 719 3HD2 LEU 88 HD23 LEU 88 1.107 12.337 6.727 720 H LYS 89 H LYS 89 0.893 15.567 2.724 721 HA LYS 89 HA LYS 89 -1.364 17.360 2.700 722 1HB LYS 89 HB2 LYS 89 1.464 17.737 1.631 723 2HB LYS 89 HB3 LYS 89 0.280 19.024 1.848 724 1HG LYS 89 HG2 LYS 89 1.372 17.287 4.108 725 2HG LYS 89 HG3 LYS 89 1.995 18.874 3.655 726 1HD LYS 89 HD2 LYS 89 -0.279 19.858 4.091 727 2HD LYS 89 HD3 LYS 89 -0.818 18.283 4.697 728 1HE LYS 89 HE2 LYS 89 1.483 19.930 5.844 729 2HE LYS 89 HE3 LYS 89 -0.144 19.793 6.532 730 1HZ LYS 89 HZ1 LYS 89 0.219 17.456 6.822 731 2HZ LYS 89 HZ2 LYS 89 1.739 17.571 6.183 732 3HZ LYS 89 HZ3 LYS 89 1.382 18.327 7.601 733 H GLY 90 H GLY 90 0.584 15.849 0.072 734 1HA GLY 90 HA2 GLY 90 -1.768 15.871 -1.665 735 2HA GLY 90 HA3 GLY 90 -0.465 16.955 -2.193 736 1H MET 1 H1 MET 1 16.328 6.434 -4.172 737 2H MET 1 H2 MET 1 16.406 4.794 -3.918 738 3H MET 1 H3 MET 1 15.848 5.781 -2.730 739 HA MET 1 HA MET 1 13.954 6.393 -3.998 740 1HB MET 1 HB2 MET 1 15.155 4.408 -5.981 741 2HB MET 1 HB3 MET 1 13.492 4.981 -6.080 742 1HG MET 1 HG2 MET 1 15.983 6.709 -6.277 743 2HG MET 1 HG3 MET 1 14.941 6.218 -7.607 744 1HE MET 1 HE1 MET 1 11.958 6.679 -6.288 745 2HE MET 1 HE2 MET 1 11.683 8.306 -6.937 746 3HE MET 1 HE3 MET 1 12.453 7.069 -7.956 747 H ALA 2 H ALA 2 12.010 4.922 -4.257 748 HA ALA 2 HA ALA 2 12.228 2.180 -3.302 749 1HB ALA 2 HB1 ALA 2 12.319 3.393 -1.135 750 2HB ALA 2 HB2 ALA 2 10.892 4.329 -1.579 751 3HB ALA 2 HB3 ALA 2 10.747 2.583 -1.319 752 H SER 3 H SER 3 11.295 3.604 -5.712 753 HA SER 3 HA SER 3 8.840 4.454 -5.864 754 1HB SER 3 HB2 SER 3 9.760 2.694 -8.115 755 2HB SER 3 HB3 SER 3 9.012 4.290 -8.124 756 HG SER 3 HG SER 3 11.300 4.366 -8.512 757 HA PRO 4 HA PRO 4 6.796 0.140 -6.693 758 1HB PRO 4 HB2 PRO 4 8.524 -1.588 -4.917 759 2HB PRO 4 HB3 PRO 4 7.675 -2.033 -6.425 760 1HG PRO 4 HG2 PRO 4 10.345 -1.572 -6.469 761 2HG PRO 4 HG3 PRO 4 9.313 -0.863 -7.751 762 1HD PRO 4 HD2 PRO 4 10.299 0.459 -5.211 763 2HD PRO 4 HD3 PRO 4 10.438 1.052 -6.881 764 H LEU 5 H LEU 5 8.337 0.797 -3.506 765 HA LEU 5 HA LEU 5 5.917 -0.103 -2.107 766 1HB LEU 5 HB2 LEU 5 8.109 -0.536 -1.105 767 2HB LEU 5 HB3 LEU 5 8.454 1.202 -1.065 768 HG LEU 5 HG LEU 5 6.575 1.572 0.496 769 1HD1 LEU 5 HD11 LEU 5 4.998 -0.215 -0.135 770 2HD1 LEU 5 HD12 LEU 5 6.179 -1.462 0.343 771 3HD1 LEU 5 HD13 LEU 5 5.465 -0.378 1.554 772 1HD2 LEU 5 HD21 LEU 5 8.801 1.003 1.395 773 2HD2 LEU 5 HD22 LEU 5 7.488 0.413 2.434 774 3HD2 LEU 5 HD23 LEU 5 8.347 -0.728 1.379 775 H ASP 6 H ASP 6 7.660 2.905 -2.896 776 HA ASP 6 HA ASP 6 6.126 4.791 -1.534 777 1HB ASP 6 HB2 ASP 6 7.333 5.060 -4.316 778 2HB ASP 6 HB3 ASP 6 6.720 6.393 -3.341 779 H GLN 7 H GLN 7 5.454 3.449 -4.841 780 HA GLN 7 HA GLN 7 3.066 4.976 -5.151 781 1HB GLN 7 HB2 GLN 7 2.437 3.442 -6.910 782 2HB GLN 7 HB3 GLN 7 4.135 3.920 -7.036 783 1HG GLN 7 HG2 GLN 7 4.800 1.761 -6.010 784 2HG GLN 7 HG3 GLN 7 3.115 1.235 -5.977 785 1HE2 GLN 7 HE21 GLN 7 1.970 1.325 -8.206 786 2HE2 GLN 7 HE22 GLN 7 2.955 0.836 -9.574 787 H ALA 8 H ALA 8 3.609 1.866 -3.473 788 HA ALA 8 HA ALA 8 0.799 1.250 -3.241 789 1HB ALA 8 HB1 ALA 8 2.335 -0.518 -3.173 790 2HB ALA 8 HB2 ALA 8 3.228 0.163 -1.789 791 3HB ALA 8 HB3 ALA 8 1.563 -0.417 -1.580 792 H ILE 9 H ILE 9 3.243 2.545 -0.868 793 HA ILE 9 HA ILE 9 1.251 3.014 1.161 794 HB ILE 9 HB ILE 9 2.826 4.480 2.251 795 1HG1 ILE 9 HG12 ILE 9 4.627 4.084 -0.139 796 2HG1 ILE 9 HG13 ILE 9 3.872 5.611 0.346 797 1HG2 ILE 9 HG21 ILE 9 2.891 1.988 2.441 798 2HG2 ILE 9 HG22 ILE 9 4.171 1.960 1.212 799 3HG2 ILE 9 HG23 ILE 9 4.439 2.755 2.778 800 1HD1 ILE 9 HD11 ILE 9 6.016 4.086 1.873 801 2HD1 ILE 9 HD12 ILE 9 6.134 5.666 1.092 802 3HD1 ILE 9 HD13 ILE 9 5.115 5.472 2.533 803 H GLY 10 H GLY 10 2.533 5.008 -1.491 804 1HA GLY 10 HA2 GLY 10 1.140 7.384 -1.319 805 2HA GLY 10 HA3 GLY 10 1.530 6.528 -2.817 806 H LEU 11 H LEU 11 -0.045 4.256 -2.692 807 HA LEU 11 HA LEU 11 -2.562 5.159 -3.501 808 1HB LEU 11 HB2 LEU 11 -1.312 2.883 -3.865 809 2HB LEU 11 HB3 LEU 11 -2.074 2.391 -2.359 810 HG LEU 11 HG LEU 11 -3.342 1.535 -4.116 811 1HD1 LEU 11 HD11 LEU 11 -5.525 2.320 -3.750 812 2HD1 LEU 11 HD12 LEU 11 -4.635 2.486 -2.223 813 3HD1 LEU 11 HD13 LEU 11 -4.962 3.919 -3.240 814 1HD2 LEU 11 HD21 LEU 11 -4.283 2.776 -5.959 815 2HD2 LEU 11 HD22 LEU 11 -3.554 4.285 -5.373 816 3HD2 LEU 11 HD23 LEU 11 -2.520 2.942 -5.921 817 H LEU 12 H LEU 12 -1.815 3.419 -0.428 818 HA LEU 12 HA LEU 12 -4.327 3.720 0.843 819 1HB LEU 12 HB2 LEU 12 -1.467 3.599 1.936 820 2HB LEU 12 HB3 LEU 12 -2.878 3.741 2.979 821 HG LEU 12 HG LEU 12 -3.813 1.660 2.057 822 1HD1 LEU 12 HD11 LEU 12 -2.637 1.467 -0.110 823 2HD1 LEU 12 HD12 LEU 12 -1.075 1.363 0.745 824 3HD1 LEU 12 HD13 LEU 12 -2.271 0.069 0.896 825 1HD2 LEU 12 HD21 LEU 12 -1.053 1.498 3.330 826 2HD2 LEU 12 HD22 LEU 12 -2.616 1.640 4.167 827 3HD2 LEU 12 HD23 LEU 12 -2.228 0.169 3.282 828 H ILE 13 H ILE 13 -1.522 5.932 0.837 829 HA ILE 13 HA ILE 13 -2.654 7.874 2.592 830 HB ILE 13 HB ILE 13 -0.533 8.006 0.407 831 1HG1 ILE 13 HG12 ILE 13 -0.110 8.190 3.409 832 2HG1 ILE 13 HG13 ILE 13 -0.209 6.626 2.605 833 1HG2 ILE 13 HG21 ILE 13 -1.177 10.156 2.451 834 2HG2 ILE 13 HG22 ILE 13 0.237 10.136 1.378 835 3HG2 ILE 13 HG23 ILE 13 -1.371 10.300 0.689 836 1HD1 ILE 13 HD11 ILE 13 2.088 7.071 2.683 837 2HD1 ILE 13 HD12 ILE 13 1.650 7.475 1.025 838 3HD1 ILE 13 HD13 ILE 13 1.895 8.769 2.213 839 H GLY 14 H GLY 14 -2.653 7.631 -0.964 840 1HA GLY 14 HA2 GLY 14 -3.988 10.044 -1.562 841 2HA GLY 14 HA3 GLY 14 -3.933 8.587 -2.576 842 H ILE 15 H ILE 15 -5.272 6.678 -1.238 843 HA ILE 15 HA ILE 15 -8.021 7.277 -1.544 844 HB ILE 15 HB ILE 15 -6.402 5.069 -0.306 845 1HG1 ILE 15 HG12 ILE 15 -8.657 5.197 -2.365 846 2HG1 ILE 15 HG13 ILE 15 -6.926 5.194 -2.725 847 1HG2 ILE 15 HG21 ILE 15 -9.390 5.350 0.157 848 2HG2 ILE 15 HG22 ILE 15 -8.426 3.879 0.451 849 3HG2 ILE 15 HG23 ILE 15 -8.090 5.323 1.378 850 1HD1 ILE 15 HD11 ILE 15 -7.697 2.962 -3.094 851 2HD1 ILE 15 HD12 ILE 15 -6.812 2.915 -1.557 852 3HD1 ILE 15 HD13 ILE 15 -8.586 2.918 -1.570 853 H PHE 16 H PHE 16 -6.003 7.208 1.425 854 HA PHE 16 HA PHE 16 -8.082 7.914 3.180 855 1HB PHE 16 HB2 PHE 16 -5.807 7.097 3.805 856 2HB PHE 16 HB3 PHE 16 -5.131 8.660 3.403 857 HD1 PHE 16 HD1 PHE 16 -5.967 10.743 4.736 858 HD2 PHE 16 HD2 PHE 16 -7.030 6.740 5.870 859 HE1 PHE 16 HE1 PHE 16 -6.297 11.481 7.025 860 HE2 PHE 16 HE2 PHE 16 -7.214 7.465 8.242 861 HZ PHE 16 HZ PHE 16 -6.715 9.799 8.851 862 H HIS 17 H HIS 17 -5.681 10.145 1.655 863 HA HIS 17 HA HIS 17 -6.918 12.404 2.921 864 1HB HIS 17 HB2 HIS 17 -4.792 12.198 0.773 865 2HB HIS 17 HB3 HIS 17 -5.355 13.731 1.461 866 HD1 HIS 17 HD1 HIS 17 -3.626 10.500 2.605 867 HD2 HIS 17 HD2 HIS 17 -4.836 14.251 4.039 868 HE1 HIS 17 HE1 HIS 17 -2.830 10.651 5.041 869 H LYS 18 H LYS 18 -7.381 10.872 -0.208 870 HA LYS 18 HA LYS 18 -8.974 12.840 -1.522 871 1HB LYS 18 HB2 LYS 18 -8.236 10.685 -2.547 872 2HB LYS 18 HB3 LYS 18 -9.274 9.809 -1.414 873 1HG LYS 18 HG2 LYS 18 -11.187 11.339 -2.501 874 2HG LYS 18 HG3 LYS 18 -10.023 11.463 -3.821 875 1HD LYS 18 HD2 LYS 18 -11.173 8.905 -2.590 876 2HD LYS 18 HD3 LYS 18 -11.639 9.613 -4.142 877 1HE LYS 18 HE2 LYS 18 -9.333 9.230 -5.008 878 2HE LYS 18 HE3 LYS 18 -8.874 8.497 -3.462 879 1HZ LYS 18 HZ1 LYS 18 -10.945 7.499 -5.281 880 2HZ LYS 18 HZ2 LYS 18 -9.453 6.845 -5.045 881 3HZ LYS 18 HZ3 LYS 18 -10.564 6.827 -3.828 882 H TYR 19 H TYR 19 -9.757 10.245 0.856 883 HA TYR 19 HA TYR 19 -12.476 11.113 1.124 884 1HB TYR 19 HB2 TYR 19 -10.749 9.069 2.418 885 2HB TYR 19 HB3 TYR 19 -12.091 9.688 3.384 886 HD1 TYR 19 HD1 TYR 19 -11.292 7.902 0.222 887 HD2 TYR 19 HD2 TYR 19 -14.390 9.487 2.766 888 HE1 TYR 19 HE1 TYR 19 -12.997 7.217 -1.421 889 HE2 TYR 19 HE2 TYR 19 -16.061 8.960 1.055 890 HH TYR 19 HH TYR 19 -16.465 8.089 -1.027 891 H SER 20 H SER 20 -9.631 11.711 3.338 892 HA SER 20 HA SER 20 -10.942 13.251 5.202 893 1HB SER 20 HB2 SER 20 -8.246 13.924 3.972 894 2HB SER 20 HB3 SER 20 -8.835 14.459 5.547 895 HG SER 20 HG SER 20 -8.778 12.370 6.300 896 H GLY 21 H GLY 21 -9.857 14.326 1.981 897 1HA GLY 21 HA2 GLY 21 -10.501 16.931 1.669 898 2HA GLY 21 HA3 GLY 21 -10.985 15.659 0.520 899 H LYS 22 H LYS 22 -12.908 14.315 1.776 900 HA LYS 22 HA LYS 22 -15.265 15.474 1.042 901 1HB LYS 22 HB2 LYS 22 -14.784 13.089 1.675 902 2HB LYS 22 HB3 LYS 22 -14.754 13.597 3.363 903 1HG LYS 22 HG2 LYS 22 -16.772 12.513 2.952 904 2HG LYS 22 HG3 LYS 22 -17.072 14.215 3.311 905 1HD LYS 22 HD2 LYS 22 -18.509 13.190 1.511 906 2HD LYS 22 HD3 LYS 22 -17.687 14.695 1.057 907 1HE LYS 22 HE2 LYS 22 -17.653 13.037 -0.772 908 2HE LYS 22 HE3 LYS 22 -16.014 13.415 -0.238 909 1HZ LYS 22 HZ1 LYS 22 -16.053 11.394 1.054 910 2HZ LYS 22 HZ2 LYS 22 -17.582 11.050 0.540 911 3HZ LYS 22 HZ3 LYS 22 -16.336 11.078 -0.536 912 H GLU 23 H GLU 23 -13.648 15.842 4.220 913 HA GLU 23 HA GLU 23 -15.272 18.260 4.687 914 1HB GLU 23 HB2 GLU 23 -15.669 17.548 7.097 915 2HB GLU 23 HB3 GLU 23 -16.685 16.794 5.866 916 1HG GLU 23 HG2 GLU 23 -15.427 14.745 5.908 917 2HG GLU 23 HG3 GLU 23 -14.184 15.462 6.947 918 H GLY 24 H GLY 24 -12.682 17.936 3.779 919 1HA GLY 24 HA2 GLY 24 -10.478 18.427 4.176 920 2HA GLY 24 HA3 GLY 24 -11.174 19.781 5.078 921 H ASP 25 H ASP 25 -11.143 16.292 5.855 922 HA ASP 25 HA ASP 25 -10.620 16.898 8.604 923 1HB ASP 25 HB2 ASP 25 -12.149 15.122 7.603 924 2HB ASP 25 HB3 ASP 25 -10.717 14.127 7.360 925 H LYS 26 H LYS 26 -8.389 17.823 7.392 926 HA LYS 26 HA LYS 26 -6.103 17.673 7.191 927 1HB LYS 26 HB2 LYS 26 -6.618 16.868 10.088 928 2HB LYS 26 HB3 LYS 26 -5.111 17.525 9.425 929 1HG LYS 26 HG2 LYS 26 -6.021 19.444 10.231 930 2HG LYS 26 HG3 LYS 26 -6.667 19.499 8.587 931 1HD LYS 26 HD2 LYS 26 -8.821 18.473 9.508 932 2HD LYS 26 HD3 LYS 26 -8.104 18.548 11.122 933 1HE LYS 26 HE2 LYS 26 -7.926 21.018 10.912 934 2HE LYS 26 HE3 LYS 26 -8.567 20.928 9.257 935 1HZ LYS 26 HZ1 LYS 26 -10.010 20.111 11.676 936 2HZ LYS 26 HZ2 LYS 26 -10.254 21.499 10.822 937 3HZ LYS 26 HZ3 LYS 26 -10.585 20.040 10.133 938 H HIS 27 H HIS 27 -5.598 15.207 9.562 939 HA HIS 27 HA HIS 27 -4.813 13.214 7.486 940 1HB HIS 27 HB2 HIS 27 -3.185 14.013 9.925 941 2HB HIS 27 HB3 HIS 27 -2.807 12.698 8.801 942 HD1 HIS 27 HD1 HIS 27 -3.233 14.116 6.041 943 HD2 HIS 27 HD2 HIS 27 -1.361 15.848 9.393 944 HE1 HIS 27 HE1 HIS 27 -1.808 16.048 5.169 945 H THR 28 H THR 28 -7.245 13.446 8.749 946 HA THR 28 HA THR 28 -7.409 11.081 10.515 947 HB THR 28 HB THR 28 -9.208 12.686 11.669 948 HG1 THR 28 HG1 THR 28 -8.661 14.479 10.242 949 1HG2 THR 28 HG21 THR 28 -7.250 11.707 12.858 950 2HG2 THR 28 HG22 THR 28 -6.205 12.965 12.171 951 3HG2 THR 28 HG23 THR 28 -7.500 13.396 13.304 952 H LEU 29 H LEU 29 -9.561 10.138 10.427 953 HA LEU 29 HA LEU 29 -11.391 11.180 8.287 954 1HB LEU 29 HB2 LEU 29 -10.566 8.290 8.798 955 2HB LEU 29 HB3 LEU 29 -12.008 8.737 7.886 956 HG LEU 29 HG LEU 29 -9.179 9.504 7.083 957 1HD1 LEU 29 HD11 LEU 29 -11.076 7.351 6.032 958 2HD1 LEU 29 HD12 LEU 29 -9.492 7.758 5.339 959 3HD1 LEU 29 HD13 LEU 29 -9.595 7.048 6.963 960 1HD2 LEU 29 HD21 LEU 29 -11.844 9.751 5.653 961 2HD2 LEU 29 HD22 LEU 29 -10.799 11.090 6.175 962 3HD2 LEU 29 HD23 LEU 29 -10.249 9.996 4.904 963 H SER 30 H SER 30 -13.451 11.437 9.065 964 HA SER 30 HA SER 30 -13.922 10.668 11.848 965 1HB SER 30 HB2 SER 30 -15.753 11.945 9.759 966 2HB SER 30 HB3 SER 30 -16.097 11.811 11.497 967 HG SER 30 HG SER 30 -13.790 13.112 10.417 968 H LYS 31 H LYS 31 -15.696 9.265 12.577 969 HA LYS 31 HA LYS 31 -15.320 6.770 11.577 970 1HB LYS 31 HB2 LYS 31 -17.176 6.078 13.029 971 2HB LYS 31 HB3 LYS 31 -16.015 7.146 13.794 972 1HG LYS 31 HG2 LYS 31 -17.591 9.048 13.573 973 2HG LYS 31 HG3 LYS 31 -18.758 7.963 12.773 974 1HD LYS 31 HD2 LYS 31 -18.860 6.550 14.791 975 2HD LYS 31 HD3 LYS 31 -17.622 7.542 15.570 976 1HE LYS 31 HE2 LYS 31 -19.838 8.144 16.410 977 2HE LYS 31 HE3 LYS 31 -19.114 9.507 15.546 978 1HZ LYS 31 HZ1 LYS 31 -21.410 9.177 14.993 979 2HZ LYS 31 HZ2 LYS 31 -20.469 8.946 13.662 980 3HZ LYS 31 HZ3 LYS 31 -21.113 7.648 14.454 981 H LYS 32 H LYS 32 -18.092 8.819 10.684 982 HA LYS 32 HA LYS 32 -19.169 6.636 8.991 983 1HB LYS 32 HB2 LYS 32 -20.177 9.467 8.968 984 2HB LYS 32 HB3 LYS 32 -20.981 7.976 8.448 985 1HG LYS 32 HG2 LYS 32 -20.323 8.792 11.304 986 2HG LYS 32 HG3 LYS 32 -21.906 8.768 10.551 987 1HD LYS 32 HD2 LYS 32 -20.192 6.291 11.100 988 2HD LYS 32 HD3 LYS 32 -21.588 6.840 12.032 989 1HE LYS 32 HE2 LYS 32 -23.005 6.637 9.943 990 2HE LYS 32 HE3 LYS 32 -21.618 5.879 9.135 991 1HZ LYS 32 HZ1 LYS 32 -22.933 4.885 11.561 992 2HZ LYS 32 HZ2 LYS 32 -23.120 4.281 10.040 993 3HZ LYS 32 HZ3 LYS 32 -21.659 4.176 10.792 994 H GLU 33 H GLU 33 -17.097 9.426 8.555 995 HA GLU 33 HA GLU 33 -17.212 9.623 5.679 996 1HB GLU 33 HB2 GLU 33 -16.324 11.372 7.165 997 2HB GLU 33 HB3 GLU 33 -15.038 10.273 7.691 998 1HG GLU 33 HG2 GLU 33 -14.109 10.285 5.382 999 2HG GLU 33 HG3 GLU 33 -15.367 11.443 4.914 1000 H LEU 34 H LEU 34 -15.240 7.777 8.031 1001 HA LEU 34 HA LEU 34 -13.732 6.248 6.202 1002 1HB LEU 34 HB2 LEU 34 -13.176 6.256 8.508 1003 2HB LEU 34 HB3 LEU 34 -14.742 5.645 9.001 1004 HG LEU 34 HG LEU 34 -12.916 4.014 9.149 1005 1HD1 LEU 34 HD11 LEU 34 -14.161 2.144 8.595 1006 2HD1 LEU 34 HD12 LEU 34 -15.392 3.389 8.790 1007 3HD1 LEU 34 HD13 LEU 34 -14.886 2.871 7.176 1008 1HD2 LEU 34 HD21 LEU 34 -12.865 4.094 6.099 1009 2HD2 LEU 34 HD22 LEU 34 -11.610 4.704 7.189 1010 3HD2 LEU 34 HD23 LEU 34 -11.967 2.974 7.103 1011 H LYS 35 H LYS 35 -17.038 5.500 7.609 1012 HA LYS 35 HA LYS 35 -17.371 3.129 6.107 1013 1HB LYS 35 HB2 LYS 35 -19.021 3.766 7.777 1014 2HB LYS 35 HB3 LYS 35 -19.562 5.131 6.776 1015 1HG LYS 35 HG2 LYS 35 -20.155 3.561 4.934 1016 2HG LYS 35 HG3 LYS 35 -19.649 2.191 5.932 1017 1HD LYS 35 HD2 LYS 35 -21.882 4.171 6.598 1018 2HD LYS 35 HD3 LYS 35 -22.115 2.642 5.736 1019 1HE LYS 35 HE2 LYS 35 -21.150 1.405 7.696 1020 2HE LYS 35 HE3 LYS 35 -21.085 2.937 8.581 1021 1HZ LYS 35 HZ1 LYS 35 -23.487 1.634 7.484 1022 2HZ LYS 35 HZ2 LYS 35 -23.124 1.828 9.071 1023 3HZ LYS 35 HZ3 LYS 35 -23.488 3.142 8.152 1024 H GLU 36 H GLU 36 -18.043 6.527 5.077 1025 HA GLU 36 HA GLU 36 -18.959 5.828 2.510 1026 1HB GLU 36 HB2 GLU 36 -18.780 8.168 3.811 1027 2HB GLU 36 HB3 GLU 36 -17.394 8.392 2.755 1028 1HG GLU 36 HG2 GLU 36 -20.300 7.843 2.008 1029 2HG GLU 36 HG3 GLU 36 -19.384 9.321 1.712 1030 H LEU 37 H LEU 37 -15.589 6.445 3.601 1031 HA LEU 37 HA LEU 37 -14.233 5.977 1.169 1032 1HB LEU 37 HB2 LEU 37 -13.136 6.703 3.260 1033 2HB LEU 37 HB3 LEU 37 -13.364 5.130 3.976 1034 HG LEU 37 HG LEU 37 -11.798 5.367 1.408 1035 1HD1 LEU 37 HD11 LEU 37 -10.753 5.675 4.256 1036 2HD1 LEU 37 HD12 LEU 37 -9.759 5.566 2.791 1037 3HD1 LEU 37 HD13 LEU 37 -10.825 6.954 3.019 1038 1HD2 LEU 37 HD21 LEU 37 -10.588 3.404 2.445 1039 2HD2 LEU 37 HD22 LEU 37 -11.776 3.390 3.761 1040 3HD2 LEU 37 HD23 LEU 37 -12.266 3.040 2.085 1041 H ILE 38 H ILE 38 -15.216 3.560 3.615 1042 HA ILE 38 HA ILE 38 -14.202 1.389 2.067 1043 HB ILE 38 HB ILE 38 -16.264 1.449 4.293 1044 1HG1 ILE 38 HG12 ILE 38 -13.257 0.852 4.119 1045 2HG1 ILE 38 HG13 ILE 38 -14.002 2.266 4.877 1046 1HG2 ILE 38 HG21 ILE 38 -14.769 -0.962 3.168 1047 2HG2 ILE 38 HG22 ILE 38 -15.925 -0.957 4.511 1048 3HG2 ILE 38 HG23 ILE 38 -16.496 -0.639 2.884 1049 1HD1 ILE 38 HD11 ILE 38 -14.096 -0.602 5.766 1050 2HD1 ILE 38 HD12 ILE 38 -13.411 0.807 6.606 1051 3HD1 ILE 38 HD13 ILE 38 -15.182 0.643 6.450 1052 H GLN 39 H GLN 39 -17.557 2.667 2.301 1053 HA GLN 39 HA GLN 39 -18.729 0.798 0.527 1054 1HB GLN 39 HB2 GLN 39 -19.388 3.722 1.059 1055 2HB GLN 39 HB3 GLN 39 -20.422 2.643 0.120 1056 1HG GLN 39 HG2 GLN 39 -19.606 2.129 3.018 1057 2HG GLN 39 HG3 GLN 39 -21.113 2.911 2.522 1058 1HE2 GLN 39 HE22 GLN 39 -20.996 0.519 4.122 1059 2HE2 GLN 39 HE21 GLN 39 -21.700 -0.755 3.158 1060 H LYS 40 H LYS 40 -16.989 3.883 -0.205 1061 HA LYS 40 HA LYS 40 -17.528 3.615 -3.007 1062 1HB LYS 40 HB2 LYS 40 -17.044 5.802 -1.941 1063 2HB LYS 40 HB3 LYS 40 -15.438 5.219 -1.502 1064 1HG LYS 40 HG2 LYS 40 -14.944 6.515 -3.301 1065 2HG LYS 40 HG3 LYS 40 -15.016 4.963 -4.087 1066 1HD LYS 40 HD2 LYS 40 -17.190 7.120 -4.023 1067 2HD LYS 40 HD3 LYS 40 -16.092 6.790 -5.361 1068 1HE LYS 40 HE2 LYS 40 -18.378 5.033 -4.393 1069 2HE LYS 40 HE3 LYS 40 -18.224 5.877 -5.925 1070 1HZ LYS 40 HZ1 LYS 40 -16.526 3.635 -5.063 1071 2HZ LYS 40 HZ2 LYS 40 -17.718 3.591 -6.195 1072 3HZ LYS 40 HZ3 LYS 40 -16.358 4.479 -6.469 1073 H GLU 41 H GLU 41 -14.568 2.946 -1.102 1074 HA GLU 41 HA GLU 41 -13.150 2.047 -3.480 1075 1HB GLU 41 HB2 GLU 41 -12.476 1.705 -0.531 1076 2HB GLU 41 HB3 GLU 41 -11.388 1.408 -1.897 1077 1HG GLU 41 HG2 GLU 41 -12.613 4.104 -1.111 1078 2HG GLU 41 HG3 GLU 41 -10.957 3.583 -0.816 1079 H LEU 42 H LEU 42 -14.451 0.381 -0.592 1080 HA LEU 42 HA LEU 42 -14.040 -2.281 -1.882 1081 1HB LEU 42 HB2 LEU 42 -14.859 -1.501 0.940 1082 2HB LEU 42 HB3 LEU 42 -14.831 -3.142 0.320 1083 HG LEU 42 HG LEU 42 -12.927 -2.746 1.696 1084 1HD1 LEU 42 HD11 LEU 42 -12.695 -4.263 -0.275 1085 2HD1 LEU 42 HD12 LEU 42 -11.960 -2.917 -1.178 1086 3HD1 LEU 42 HD13 LEU 42 -11.162 -3.554 0.267 1087 1HD2 LEU 42 HD21 LEU 42 -11.867 -0.656 -0.230 1088 2HD2 LEU 42 HD22 LEU 42 -12.690 -0.271 1.303 1089 3HD2 LEU 42 HD23 LEU 42 -11.175 -1.190 1.306 1090 H THR 43 H THR 43 -15.584 -1.565 -3.533 1091 HA THR 43 HA THR 43 -18.315 -1.001 -3.000 1092 HB THR 43 HB THR 43 -18.602 -1.713 -5.391 1093 HG1 THR 43 HG1 THR 43 -17.018 -3.362 -5.285 1094 1HG2 THR 43 HG21 THR 43 -17.194 0.007 -6.373 1095 2HG2 THR 43 HG22 THR 43 -17.787 0.594 -4.804 1096 3HG2 THR 43 HG23 THR 43 -16.119 0.006 -4.968 1097 H ILE 44 H ILE 44 -18.602 -2.587 -1.215 1098 HA ILE 44 HA ILE 44 -18.549 -5.295 -1.355 1099 HB ILE 44 HB ILE 44 -20.803 -3.781 0.024 1100 1HG1 ILE 44 HG12 ILE 44 -18.876 -4.275 1.969 1101 2HG1 ILE 44 HG13 ILE 44 -17.887 -3.794 0.600 1102 1HG2 ILE 44 HG21 ILE 44 -20.737 -5.605 1.646 1103 2HG2 ILE 44 HG22 ILE 44 -21.077 -6.237 0.040 1104 3HG2 ILE 44 HG23 ILE 44 -19.449 -6.413 0.724 1105 1HD1 ILE 44 HD11 ILE 44 -18.508 -1.841 1.955 1106 2HD1 ILE 44 HD12 ILE 44 -19.375 -1.709 0.412 1107 3HD1 ILE 44 HD13 ILE 44 -20.226 -2.274 1.862 1108 H GLY 45 H GLY 45 -21.222 -3.288 -2.502 1109 1HA GLY 45 HA2 GLY 45 -22.985 -3.763 -3.946 1110 2HA GLY 45 HA3 GLY 45 -22.306 -5.370 -4.253 1111 H SER 46 H SER 46 -22.324 -6.788 -2.116 1112 HA SER 46 HA SER 46 -25.034 -7.165 -1.235 1113 1HB SER 46 HB2 SER 46 -22.444 -8.337 -0.139 1114 2HB SER 46 HB3 SER 46 -24.084 -8.986 0.069 1115 HG SER 46 HG SER 46 -22.902 -9.972 -1.684 1116 H LYS 47 H LYS 47 -25.150 -4.781 -0.502 1117 HA LYS 47 HA LYS 47 -23.801 -3.841 1.753 1118 1HB LYS 47 HB2 LYS 47 -26.639 -3.081 0.973 1119 2HB LYS 47 HB3 LYS 47 -25.505 -2.143 1.950 1120 1HG LYS 47 HG2 LYS 47 -25.397 -2.684 -1.031 1121 2HG LYS 47 HG3 LYS 47 -25.495 -1.150 -0.175 1122 1HD LYS 47 HD2 LYS 47 -23.155 -1.615 0.760 1123 2HD LYS 47 HD3 LYS 47 -23.098 -3.034 -0.301 1124 1HE LYS 47 HE2 LYS 47 -21.950 -1.302 -1.444 1125 2HE LYS 47 HE3 LYS 47 -23.509 -1.494 -2.273 1126 1HZ LYS 47 HZ1 LYS 47 -24.272 0.418 -0.981 1127 2HZ LYS 47 HZ2 LYS 47 -22.776 0.540 -0.283 1128 3HZ LYS 47 HZ3 LYS 47 -22.956 0.792 -1.902 1129 H LEU 48 H LEU 48 -26.069 -6.374 1.832 1130 HA LEU 48 HA LEU 48 -27.133 -6.242 4.433 1131 1HB LEU 48 HB2 LEU 48 -25.877 -8.636 3.023 1132 2HB LEU 48 HB3 LEU 48 -26.992 -8.711 4.390 1133 HG LEU 48 HG LEU 48 -27.673 -7.671 1.595 1134 1HD1 LEU 48 HD11 LEU 48 -28.467 -10.231 3.038 1135 2HD1 LEU 48 HD12 LEU 48 -29.015 -9.718 1.428 1136 3HD1 LEU 48 HD13 LEU 48 -27.307 -10.108 1.698 1137 1HD2 LEU 48 HD21 LEU 48 -29.056 -6.512 3.260 1138 2HD2 LEU 48 HD22 LEU 48 -30.027 -7.733 2.434 1139 3HD2 LEU 48 HD23 LEU 48 -29.420 -8.053 4.071 1140 H GLN 49 H GLN 49 -23.817 -6.863 3.352 1141 HA GLN 49 HA GLN 49 -22.875 -7.708 5.958 1142 1HB GLN 49 HB2 GLN 49 -21.213 -6.554 3.695 1143 2HB GLN 49 HB3 GLN 49 -20.661 -7.559 5.034 1144 1HG GLN 49 HG2 GLN 49 -22.334 -8.387 2.640 1145 2HG GLN 49 HG3 GLN 49 -20.758 -8.990 3.136 1146 1HE2 GLN 49 HE22 GLN 49 -20.898 -9.861 5.634 1147 2HE2 GLN 49 HE21 GLN 49 -22.231 -10.988 5.850 1148 H ASP 50 H ASP 50 -23.980 -4.632 5.100 1149 HA ASP 50 HA ASP 50 -22.030 -2.912 6.011 1150 1HB ASP 50 HB2 ASP 50 -24.103 -2.166 4.953 1151 2HB ASP 50 HB3 ASP 50 -25.012 -2.577 6.421 1152 H ALA 51 H ALA 51 -24.146 -4.970 7.976 1153 HA ALA 51 HA ALA 51 -23.683 -3.925 10.562 1154 1HB ALA 51 HB1 ALA 51 -23.867 -6.829 9.659 1155 2HB ALA 51 HB2 ALA 51 -24.040 -6.240 11.327 1156 3HB ALA 51 HB3 ALA 51 -25.227 -5.770 10.093 1157 H GLU 52 H GLU 52 -21.644 -6.139 8.589 1158 HA GLU 52 HA GLU 52 -19.579 -6.446 10.606 1159 1HB GLU 52 HB2 GLU 52 -19.422 -6.847 7.583 1160 2HB GLU 52 HB3 GLU 52 -18.259 -7.394 8.794 1161 1HG GLU 52 HG2 GLU 52 -20.047 -8.805 9.844 1162 2HG GLU 52 HG3 GLU 52 -21.153 -8.343 8.538 1163 H ILE 53 H ILE 53 -20.146 -4.364 7.749 1164 HA ILE 53 HA ILE 53 -17.682 -2.970 7.868 1165 HB ILE 53 HB ILE 53 -20.322 -1.800 6.951 1166 1HG1 ILE 53 HG12 ILE 53 -19.956 -3.850 5.692 1167 2HG1 ILE 53 HG13 ILE 53 -19.601 -2.464 4.671 1168 1HG2 ILE 53 HG21 ILE 53 -18.725 -0.051 7.235 1169 2HG2 ILE 53 HG22 ILE 53 -17.449 -0.985 6.440 1170 3HG2 ILE 53 HG23 ILE 53 -18.840 -0.393 5.507 1171 1HD1 ILE 53 HD11 ILE 53 -17.587 -4.308 6.032 1172 2HD1 ILE 53 HD12 ILE 53 -17.961 -4.205 4.310 1173 3HD1 ILE 53 HD13 ILE 53 -17.148 -2.847 5.110 1174 H VAL 54 H VAL 54 -20.752 -2.254 9.679 1175 HA VAL 54 HA VAL 54 -19.516 0.041 10.855 1176 HB VAL 54 HB VAL 54 -21.320 0.069 12.531 1177 1HG1 VAL 54 HG11 VAL 54 -21.251 1.417 10.463 1178 2HG1 VAL 54 HG12 VAL 54 -22.035 0.084 9.586 1179 3HG1 VAL 54 HG13 VAL 54 -22.904 0.940 10.885 1180 1HG2 VAL 54 HG21 VAL 54 -23.327 -1.187 12.184 1181 2HG2 VAL 54 HG22 VAL 54 -22.593 -2.066 10.840 1182 3HG2 VAL 54 HG23 VAL 54 -21.990 -2.307 12.500 1183 H LYS 55 H LYS 55 -19.663 -3.371 11.950 1184 HA LYS 55 HA LYS 55 -18.440 -2.856 14.483 1185 1HB LYS 55 HB2 LYS 55 -19.380 -5.026 13.988 1186 2HB LYS 55 HB3 LYS 55 -18.276 -5.265 12.631 1187 1HG LYS 55 HG2 LYS 55 -17.624 -6.574 14.584 1188 2HG LYS 55 HG3 LYS 55 -16.355 -5.440 14.118 1189 1HD LYS 55 HD2 LYS 55 -17.022 -3.894 15.938 1190 2HD LYS 55 HD3 LYS 55 -18.347 -4.977 16.399 1191 1HE LYS 55 HE2 LYS 55 -15.362 -5.660 16.431 1192 2HE LYS 55 HE3 LYS 55 -16.308 -5.162 17.838 1193 1HZ LYS 55 HZ1 LYS 55 -16.102 -7.512 17.745 1194 2HZ LYS 55 HZ2 LYS 55 -17.682 -7.099 17.526 1195 3HZ LYS 55 HZ3 LYS 55 -16.768 -7.581 16.241 1196 H LEU 56 H LEU 56 -17.000 -3.619 11.303 1197 HA LEU 56 HA LEU 56 -14.272 -3.325 11.975 1198 1HB LEU 56 HB2 LEU 56 -14.854 -4.368 9.989 1199 2HB LEU 56 HB3 LEU 56 -15.906 -3.070 9.444 1200 HG LEU 56 HG LEU 56 -13.013 -2.371 9.790 1201 1HD1 LEU 56 HD11 LEU 56 -12.516 -3.231 7.505 1202 2HD1 LEU 56 HD12 LEU 56 -12.843 -4.545 8.654 1203 3HD1 LEU 56 HD13 LEU 56 -14.088 -4.053 7.483 1204 1HD2 LEU 56 HD21 LEU 56 -15.070 -1.785 7.598 1205 2HD2 LEU 56 HD22 LEU 56 -14.793 -0.712 8.964 1206 3HD2 LEU 56 HD23 LEU 56 -13.464 -1.045 7.852 1207 H MET 57 H MET 57 -16.618 -0.843 10.887 1208 HA MET 57 HA MET 57 -14.817 1.342 10.815 1209 1HB MET 57 HB2 MET 57 -16.900 1.476 9.691 1210 2HB MET 57 HB3 MET 57 -17.793 1.119 11.168 1211 1HG MET 57 HG2 MET 57 -16.139 3.617 11.022 1212 2HG MET 57 HG3 MET 57 -17.738 3.550 10.278 1213 1HE MET 57 HE1 MET 57 -20.154 3.193 13.300 1214 2HE MET 57 HE2 MET 57 -19.978 3.234 11.527 1215 3HE MET 57 HE3 MET 57 -19.501 1.784 12.453 1216 H ASP 58 H ASP 58 -16.929 0.114 13.454 1217 HA ASP 58 HA ASP 58 -16.185 1.986 15.439 1218 1HB ASP 58 HB2 ASP 58 -17.991 0.414 15.812 1219 2HB ASP 58 HB3 ASP 58 -16.879 -0.958 15.759 1220 H ASP 59 H ASP 59 -14.698 -1.187 14.614 1221 HA ASP 59 HA ASP 59 -12.569 -0.991 16.455 1222 1HB ASP 59 HB2 ASP 59 -12.497 -2.357 13.724 1223 2HB ASP 59 HB3 ASP 59 -11.415 -2.674 15.084 1224 H LEU 60 H LEU 60 -12.737 0.269 13.123 1225 HA LEU 60 HA LEU 60 -10.063 1.318 13.068 1226 1HB LEU 60 HB2 LEU 60 -12.620 1.826 11.546 1227 2HB LEU 60 HB3 LEU 60 -11.300 2.969 11.366 1228 HG LEU 60 HG LEU 60 -10.671 0.057 11.044 1229 1HD1 LEU 60 HD11 LEU 60 -11.920 1.768 8.876 1230 2HD1 LEU 60 HD12 LEU 60 -11.202 0.178 8.623 1231 3HD1 LEU 60 HD13 LEU 60 -12.661 0.341 9.634 1232 1HD2 LEU 60 HD21 LEU 60 -9.769 2.605 9.588 1233 2HD2 LEU 60 HD22 LEU 60 -8.868 1.830 10.916 1234 3HD2 LEU 60 HD23 LEU 60 -9.082 1.011 9.345 1235 H ASP 61 H ASP 61 -13.174 2.992 13.897 1236 HA ASP 61 HA ASP 61 -11.680 5.413 14.426 1237 1HB ASP 61 HB2 ASP 61 -13.653 6.513 14.722 1238 2HB ASP 61 HB3 ASP 61 -14.053 5.283 13.526 1239 H ARG 62 H ARG 62 -12.662 2.748 16.475 1240 HA ARG 62 HA ARG 62 -12.894 4.002 18.910 1241 1HB ARG 62 HB2 ARG 62 -13.314 1.588 18.456 1242 2HB ARG 62 HB3 ARG 62 -11.580 1.302 18.327 1243 1HG ARG 62 HG2 ARG 62 -12.555 0.564 20.468 1244 2HG ARG 62 HG3 ARG 62 -11.292 1.774 20.713 1245 1HD ARG 62 HD2 ARG 62 -13.392 2.040 22.138 1246 2HD ARG 62 HD3 ARG 62 -12.842 3.458 21.246 1247 HE ARG 62 HE ARG 62 -14.975 1.637 20.159 1248 1HH1 ARG 62 HH21 ARG 62 -14.224 4.873 21.376 1249 2HH1 ARG 62 HH22 ARG 62 -15.188 5.685 20.165 1250 1HH2 ARG 62 HH12 ARG 62 -16.492 2.693 18.804 1251 2HH2 ARG 62 HH11 ARG 62 -16.597 4.435 18.815 1252 H ASN 63 H ASN 63 -9.953 3.077 17.235 1253 HA ASN 63 HA ASN 63 -8.024 3.498 19.189 1254 1HB ASN 63 HB2 ASN 63 -7.705 4.201 16.250 1255 2HB ASN 63 HB3 ASN 63 -6.425 3.815 17.414 1256 1HD2 ASN 63 HD22 ASN 63 -8.864 2.531 15.282 1257 2HD2 ASN 63 HD21 ASN 63 -8.758 0.853 15.729 1258 H LYS 64 H LYS 64 -9.910 5.968 17.520 1259 HA LYS 64 HA LYS 64 -8.899 7.810 19.506 1260 1HB LYS 64 HB2 LYS 64 -7.360 8.222 17.588 1261 2HB LYS 64 HB3 LYS 64 -8.741 8.652 16.595 1262 1HG LYS 64 HG2 LYS 64 -7.585 10.622 17.427 1263 2HG LYS 64 HG3 LYS 64 -9.242 10.572 18.005 1264 1HD LYS 64 HD2 LYS 64 -7.758 11.391 19.702 1265 2HD LYS 64 HD3 LYS 64 -8.468 9.892 20.265 1266 1HE LYS 64 HE2 LYS 64 -5.735 9.922 18.892 1267 2HE LYS 64 HE3 LYS 64 -5.896 10.387 20.590 1268 1HZ LYS 64 HZ1 LYS 64 -6.715 7.778 19.517 1269 2HZ LYS 64 HZ2 LYS 64 -5.358 8.103 20.383 1270 3HZ LYS 64 HZ3 LYS 64 -6.838 8.282 21.076 1271 H ASP 65 H ASP 65 -10.990 6.585 19.816 1272 HA ASP 65 HA ASP 65 -13.021 6.784 20.542 1273 1HB ASP 65 HB2 ASP 65 -13.794 8.886 21.433 1274 2HB ASP 65 HB3 ASP 65 -12.092 8.583 21.783 1275 H GLN 66 H GLN 66 -13.019 9.233 17.976 1276 HA GLN 66 HA GLN 66 -15.572 8.108 16.897 1277 1HB GLN 66 HB2 GLN 66 -14.980 11.033 17.518 1278 2HB GLN 66 HB3 GLN 66 -16.378 10.479 16.595 1279 1HG GLN 66 HG2 GLN 66 -15.875 9.686 19.502 1280 2HG GLN 66 HG3 GLN 66 -16.840 11.059 18.978 1281 1HE2 GLN 66 HE22 GLN 66 -16.654 7.479 18.764 1282 2HE2 GLN 66 HE21 GLN 66 -18.385 7.274 18.507 1283 H GLU 67 H GLU 67 -12.360 8.816 16.247 1284 HA GLU 67 HA GLU 67 -12.964 8.945 13.388 1285 1HB GLU 67 HB2 GLU 67 -11.536 10.902 12.997 1286 2HB GLU 67 HB3 GLU 67 -12.912 11.277 14.016 1287 1HG GLU 67 HG2 GLU 67 -11.260 12.441 15.079 1288 2HG GLU 67 HG3 GLU 67 -11.275 10.967 16.044 1289 H VAL 68 H VAL 68 -11.220 8.372 12.111 1290 HA VAL 68 HA VAL 68 -9.282 6.527 13.391 1291 HB VAL 68 HB VAL 68 -9.707 6.851 10.404 1292 1HG1 VAL 68 HG11 VAL 68 -7.821 5.509 11.311 1293 2HG1 VAL 68 HG12 VAL 68 -8.987 4.458 12.141 1294 3HG1 VAL 68 HG13 VAL 68 -8.972 4.551 10.369 1295 1HG2 VAL 68 HG21 VAL 68 -11.495 5.173 12.175 1296 2HG2 VAL 68 HG22 VAL 68 -11.994 6.541 11.158 1297 3HG2 VAL 68 HG23 VAL 68 -11.366 5.077 10.407 1298 H ASN 69 H ASN 69 -7.279 7.504 13.775 1299 HA ASN 69 HA ASN 69 -6.447 9.813 12.143 1300 1HB ASN 69 HB2 ASN 69 -5.724 9.836 14.464 1301 2HB ASN 69 HB3 ASN 69 -5.071 8.199 14.327 1302 1HD2 ASN 69 HD21 ASN 69 -4.534 11.602 13.418 1303 2HD2 ASN 69 HD22 ASN 69 -2.877 11.368 12.903 1304 H PHE 70 H PHE 70 -4.774 9.794 10.613 1305 HA PHE 70 HA PHE 70 -4.604 7.839 8.762 1306 1HB PHE 70 HB2 PHE 70 -3.657 10.028 8.464 1307 2HB PHE 70 HB3 PHE 70 -2.433 9.730 9.699 1308 HD1 PHE 70 HD1 PHE 70 -0.323 8.853 9.059 1309 HD2 PHE 70 HD2 PHE 70 -3.719 8.351 6.441 1310 HE1 PHE 70 HE1 PHE 70 1.096 7.656 7.454 1311 HE2 PHE 70 HE2 PHE 70 -2.291 7.106 4.842 1312 HZ PHE 70 HZ PHE 70 0.111 6.727 5.354 1313 H GLN 71 H GLN 71 -2.281 7.875 11.590 1314 HA GLN 71 HA GLN 71 -0.955 5.551 10.504 1315 1HB GLN 71 HB2 GLN 71 0.148 7.139 12.052 1316 2HB GLN 71 HB3 GLN 71 -0.871 6.537 13.380 1317 1HG GLN 71 HG2 GLN 71 0.064 4.265 13.089 1318 2HG GLN 71 HG3 GLN 71 0.950 4.793 11.647 1319 1HE2 GLN 71 HE21 GLN 71 2.864 3.894 12.739 1320 2HE2 GLN 71 HE22 GLN 71 3.618 4.851 14.010 1321 H GLU 72 H GLU 72 -3.777 5.988 12.576 1322 HA GLU 72 HA GLU 72 -3.832 3.233 13.530 1323 1HB GLU 72 HB2 GLU 72 -6.057 5.314 13.487 1324 2HB GLU 72 HB3 GLU 72 -6.037 3.788 14.375 1325 1HG GLU 72 HG2 GLU 72 -4.157 6.158 14.822 1326 2HG GLU 72 HG3 GLU 72 -5.465 5.640 15.888 1327 H TYR 73 H TYR 73 -5.302 5.118 10.896 1328 HA TYR 73 HA TYR 73 -6.844 3.032 9.706 1329 1HB TYR 73 HB2 TYR 73 -7.272 5.128 8.859 1330 2HB TYR 73 HB3 TYR 73 -5.594 5.591 8.775 1331 HD1 TYR 73 HD1 TYR 73 -4.230 5.185 6.851 1332 HD2 TYR 73 HD2 TYR 73 -8.306 3.790 7.024 1333 HE1 TYR 73 HE1 TYR 73 -4.274 5.032 4.393 1334 HE2 TYR 73 HE2 TYR 73 -8.377 3.731 4.543 1335 HH TYR 73 HH TYR 73 -5.685 4.879 2.536 1336 H ILE 74 H ILE 74 -3.419 4.021 9.034 1337 HA ILE 74 HA ILE 74 -2.882 1.891 7.244 1338 HB ILE 74 HB ILE 74 -0.996 3.311 9.160 1339 1HG1 ILE 74 HG12 ILE 74 -2.053 4.830 7.493 1340 2HG1 ILE 74 HG13 ILE 74 -0.317 4.691 7.347 1341 1HG2 ILE 74 HG21 ILE 74 0.139 1.336 8.606 1342 2HG2 ILE 74 HG22 ILE 74 -0.458 1.326 6.933 1343 3HG2 ILE 74 HG23 ILE 74 0.759 2.505 7.442 1344 1HD1 ILE 74 HD11 ILE 74 -2.378 3.382 5.551 1345 2HD1 ILE 74 HD12 ILE 74 -1.302 4.725 5.142 1346 3HD1 ILE 74 HD13 ILE 74 -0.614 3.127 5.410 1347 H THR 75 H THR 75 -2.260 2.001 10.779 1348 HA THR 75 HA THR 75 -1.306 -0.588 11.182 1349 HB THR 75 HB THR 75 -3.106 1.132 12.941 1350 HG1 THR 75 HG1 THR 75 -1.219 2.133 12.534 1351 1HG2 THR 75 HG21 THR 75 -2.130 -0.137 14.844 1352 2HG2 THR 75 HG22 THR 75 -3.243 -1.094 13.858 1353 3HG2 THR 75 HG23 THR 75 -1.498 -1.335 13.701 1354 H PHE 76 H PHE 76 -4.738 0.493 11.218 1355 HA PHE 76 HA PHE 76 -5.818 -2.086 11.698 1356 1HB PHE 76 HB2 PHE 76 -7.057 0.018 12.069 1357 2HB PHE 76 HB3 PHE 76 -7.092 0.289 10.326 1358 HD1 PHE 76 HD1 PHE 76 -8.482 -1.193 8.842 1359 HD2 PHE 76 HD2 PHE 76 -8.409 -1.765 13.123 1360 HE1 PHE 76 HE1 PHE 76 -10.429 -2.683 8.676 1361 HE2 PHE 76 HE2 PHE 76 -10.268 -3.392 12.920 1362 HZ PHE 76 HZ PHE 76 -11.269 -3.873 10.691 1363 H LEU 77 H LEU 77 -5.124 -0.340 8.580 1364 HA LEU 77 HA LEU 77 -6.175 -2.455 6.948 1365 1HB LEU 77 HB2 LEU 77 -4.049 -0.352 6.439 1366 2HB LEU 77 HB3 LEU 77 -4.507 -1.546 5.223 1367 HG LEU 77 HG LEU 77 -6.528 0.316 6.554 1368 1HD1 LEU 77 HD11 LEU 77 -4.937 1.678 5.302 1369 2HD1 LEU 77 HD12 LEU 77 -5.093 0.609 3.881 1370 3HD1 LEU 77 HD13 LEU 77 -6.478 1.567 4.427 1371 1HD2 LEU 77 HD21 LEU 77 -7.874 -0.253 4.508 1372 2HD2 LEU 77 HD22 LEU 77 -6.641 -1.451 4.066 1373 3HD2 LEU 77 HD23 LEU 77 -7.611 -1.648 5.549 1374 H GLY 78 H GLY 78 -3.059 -2.074 8.617 1375 1HA GLY 78 HA2 GLY 78 -1.830 -4.467 7.681 1376 2HA GLY 78 HA3 GLY 78 -1.587 -3.733 9.283 1377 H ALA 79 H ALA 79 -3.966 -3.952 10.555 1378 HA ALA 79 HA ALA 79 -4.183 -6.665 11.296 1379 1HB ALA 79 HB1 ALA 79 -5.025 -4.755 12.660 1380 2HB ALA 79 HB2 ALA 79 -6.210 -6.061 12.476 1381 3HB ALA 79 HB3 ALA 79 -6.389 -4.572 11.537 1382 H LEU 80 H LEU 80 -6.083 -4.829 8.909 1383 HA LEU 80 HA LEU 80 -7.919 -6.858 8.241 1384 1HB LEU 80 HB2 LEU 80 -7.848 -4.283 7.651 1385 2HB LEU 80 HB3 LEU 80 -6.903 -4.802 6.260 1386 HG LEU 80 HG LEU 80 -8.817 -6.327 5.628 1387 1HD1 LEU 80 HD11 LEU 80 -11.064 -5.712 6.623 1388 2HD1 LEU 80 HD12 LEU 80 -10.023 -6.576 7.754 1389 3HD1 LEU 80 HD13 LEU 80 -10.205 -4.815 7.888 1390 1HD2 LEU 80 HD21 LEU 80 -10.206 -4.472 4.753 1391 2HD2 LEU 80 HD22 LEU 80 -9.466 -3.359 5.921 1392 3HD2 LEU 80 HD23 LEU 80 -8.484 -4.074 4.618 1393 H ALA 81 H ALA 81 -4.735 -5.996 6.869 1394 HA ALA 81 HA ALA 81 -4.573 -7.994 4.866 1395 1HB ALA 81 HB1 ALA 81 -2.357 -6.729 6.495 1396 2HB ALA 81 HB2 ALA 81 -2.178 -7.706 5.033 1397 3HB ALA 81 HB3 ALA 81 -3.034 -6.149 4.961 1398 H MET 82 H MET 82 -3.650 -8.078 8.356 1399 HA MET 82 HA MET 82 -2.763 -10.794 8.333 1400 1HB MET 82 HB2 MET 82 -2.176 -9.268 10.144 1401 2HB MET 82 HB3 MET 82 -3.873 -9.105 10.609 1402 1HG MET 82 HG2 MET 82 -2.719 -10.622 12.111 1403 2HG MET 82 HG3 MET 82 -3.981 -11.469 11.226 1404 1HE MET 82 HE1 MET 82 -3.197 -13.806 11.828 1405 2HE MET 82 HE2 MET 82 -1.967 -13.078 12.893 1406 3HE MET 82 HE3 MET 82 -1.513 -14.362 11.747 1407 H ILE 83 H ILE 83 -6.000 -9.402 8.912 1408 HA ILE 83 HA ILE 83 -7.309 -11.888 9.455 1409 HB ILE 83 HB ILE 83 -8.313 -9.242 8.366 1410 1HG1 ILE 83 HG12 ILE 83 -8.835 -10.635 11.029 1411 2HG1 ILE 83 HG13 ILE 83 -7.472 -9.544 10.791 1412 1HG2 ILE 83 HG21 ILE 83 -10.618 -10.107 8.776 1413 2HG2 ILE 83 HG22 ILE 83 -9.940 -11.720 9.072 1414 3HG2 ILE 83 HG23 ILE 83 -9.816 -10.963 7.470 1415 1HD1 ILE 83 HD11 ILE 83 -10.405 -8.773 10.546 1416 2HD1 ILE 83 HD12 ILE 83 -9.031 -7.707 10.173 1417 3HD1 ILE 83 HD13 ILE 83 -9.265 -8.319 11.819 1418 H TYR 84 H TYR 84 -6.655 -10.170 6.367 1419 HA TYR 84 HA TYR 84 -7.586 -12.405 4.718 1420 1HB TYR 84 HB2 TYR 84 -5.692 -10.143 4.010 1421 2HB TYR 84 HB3 TYR 84 -6.584 -11.169 2.889 1422 HD1 TYR 84 HD1 TYR 84 -9.311 -10.906 4.562 1423 HD2 TYR 84 HD2 TYR 84 -6.424 -8.131 2.946 1424 HE1 TYR 84 HE1 TYR 84 -11.083 -9.220 4.296 1425 HE2 TYR 84 HE2 TYR 84 -8.225 -6.447 2.654 1426 HH TYR 84 HH TYR 84 -11.617 -7.104 3.563 1427 H ASN 85 H ASN 85 -6.136 -13.683 6.543 1428 HA ASN 85 HA ASN 85 -3.387 -13.561 6.455 1429 1HB ASN 85 HB2 ASN 85 -4.797 -14.785 8.154 1430 2HB ASN 85 HB3 ASN 85 -4.950 -16.109 6.991 1431 1HD2 ASN 85 HD22 ASN 85 -2.500 -14.045 8.658 1432 2HD2 ASN 85 HD21 ASN 85 -1.232 -15.269 8.685 1433 H GLU 86 H GLU 86 -5.484 -15.323 4.245 1434 HA GLU 86 HA GLU 86 -3.583 -16.949 2.933 1435 1HB GLU 86 HB2 GLU 86 -5.049 -16.762 0.955 1436 2HB GLU 86 HB3 GLU 86 -5.864 -17.307 2.415 1437 1HG GLU 86 HG2 GLU 86 -6.013 -14.359 1.682 1438 2HG GLU 86 HG3 GLU 86 -6.956 -15.538 0.781 1439 H ALA 87 H ALA 87 -4.188 -13.440 2.604 1440 HA ALA 87 HA ALA 87 -2.515 -13.037 0.278 1441 1HB ALA 87 HB1 ALA 87 -3.221 -11.079 2.498 1442 2HB ALA 87 HB2 ALA 87 -2.621 -10.702 0.876 1443 3HB ALA 87 HB3 ALA 87 -4.236 -11.411 1.074 1444 H LEU 88 H LEU 88 -1.959 -13.156 3.814 1445 HA LEU 88 HA LEU 88 0.771 -12.198 3.651 1446 1HB LEU 88 HB2 LEU 88 -0.489 -13.915 5.826 1447 2HB LEU 88 HB3 LEU 88 1.038 -13.055 5.860 1448 HG LEU 88 HG LEU 88 -1.754 -11.973 6.106 1449 1HD1 LEU 88 HD11 LEU 88 -0.420 -12.529 8.099 1450 2HD1 LEU 88 HD12 LEU 88 0.907 -11.491 7.539 1451 3HD1 LEU 88 HD13 LEU 88 -0.628 -10.768 7.997 1452 1HD2 LEU 88 HD21 LEU 88 -0.902 -9.668 5.882 1453 2HD2 LEU 88 HD22 LEU 88 0.622 -10.297 5.233 1454 3HD2 LEU 88 HD23 LEU 88 -0.905 -10.541 4.350 1455 H LYS 89 H LYS 89 -0.686 -15.463 3.948 1456 HA LYS 89 HA LYS 89 1.897 -16.741 3.808 1457 1HB LYS 89 HB2 LYS 89 -0.920 -17.846 3.481 1458 2HB LYS 89 HB3 LYS 89 0.562 -18.826 3.486 1459 1HG LYS 89 HG2 LYS 89 1.176 -17.835 5.707 1460 2HG LYS 89 HG3 LYS 89 -0.401 -17.023 5.759 1461 1HD LYS 89 HD2 LYS 89 -1.576 -19.086 5.916 1462 2HD LYS 89 HD3 LYS 89 -0.185 -20.030 5.348 1463 1HE LYS 89 HE2 LYS 89 -0.553 -20.301 7.779 1464 2HE LYS 89 HE3 LYS 89 1.046 -19.639 7.400 1465 1HZ LYS 89 HZ1 LYS 89 0.280 -17.492 8.008 1466 2HZ LYS 89 HZ2 LYS 89 -1.266 -18.012 8.195 1467 3HZ LYS 89 HZ3 LYS 89 -0.086 -18.527 9.232 1468 H GLY 90 H GLY 90 -0.512 -15.957 1.300 1469 1HA GLY 90 HA2 GLY 90 1.316 -15.689 -0.764 1470 2HA GLY 90 HA3 GLY 90 0.818 -17.393 -0.820 Start of MODEL 2 1 1H MET 1 H1 MET 1 -14.850 -1.906 -6.254 2 2H MET 1 H2 MET 1 -14.956 -0.292 -6.585 3 3H MET 1 H3 MET 1 -14.120 -0.807 -5.257 4 HA MET 1 HA MET 1 -13.420 -1.263 -8.060 5 1HB MET 1 HB2 MET 1 -11.831 0.273 -5.962 6 2HB MET 1 HB3 MET 1 -11.544 0.177 -7.702 7 1HG MET 1 HG2 MET 1 -13.813 1.585 -6.244 8 2HG MET 1 HG3 MET 1 -12.497 2.329 -7.140 9 1HE MET 1 HE1 MET 1 -12.278 2.269 -9.786 10 2HE MET 1 HE2 MET 1 -12.476 0.498 -9.850 11 3HE MET 1 HE3 MET 1 -13.496 1.542 -10.860 12 H ALA 2 H ALA 2 -12.327 -1.573 -4.737 13 HA ALA 2 HA ALA 2 -11.352 -3.071 -3.452 14 1HB ALA 2 HB1 ALA 2 -11.949 -5.112 -5.640 15 2HB ALA 2 HB2 ALA 2 -11.544 -5.445 -3.948 16 3HB ALA 2 HB3 ALA 2 -13.054 -4.612 -4.344 17 H SER 3 H SER 3 -10.435 -3.918 -6.693 18 HA SER 3 HA SER 3 -7.940 -4.868 -6.498 19 1HB SER 3 HB2 SER 3 -8.426 -3.013 -8.818 20 2HB SER 3 HB3 SER 3 -7.755 -4.631 -8.750 21 HG SER 3 HG SER 3 -10.507 -3.892 -8.458 22 HA PRO 4 HA PRO 4 -5.863 -0.532 -6.940 23 1HB PRO 4 HB2 PRO 4 -7.836 1.192 -5.427 24 2HB PRO 4 HB3 PRO 4 -6.758 1.643 -6.776 25 1HG PRO 4 HG2 PRO 4 -9.378 1.183 -7.245 26 2HG PRO 4 HG3 PRO 4 -8.156 0.483 -8.353 27 1HD PRO 4 HD2 PRO 4 -9.547 -0.873 -6.031 28 2HD PRO 4 HD3 PRO 4 -9.390 -1.446 -7.702 29 H LEU 5 H LEU 5 -7.863 -0.668 -3.880 30 HA LEU 5 HA LEU 5 -5.512 -0.083 -2.319 31 1HB LEU 5 HB2 LEU 5 -7.745 0.460 -1.511 32 2HB LEU 5 HB3 LEU 5 -8.180 -1.261 -1.471 33 HG LEU 5 HG LEU 5 -6.444 -1.675 0.247 34 1HD1 LEU 5 HD11 LEU 5 -4.748 0.033 -0.281 35 2HD1 LEU 5 HD12 LEU 5 -5.916 1.337 0.053 36 3HD1 LEU 5 HD13 LEU 5 -5.359 0.261 1.354 37 1HD2 LEU 5 HD21 LEU 5 -8.171 0.715 0.951 38 2HD2 LEU 5 HD22 LEU 5 -8.716 -0.988 0.942 39 3HD2 LEU 5 HD23 LEU 5 -7.448 -0.466 2.072 40 H ASP 6 H ASP 6 -7.286 -3.074 -3.171 41 HA ASP 6 HA ASP 6 -5.930 -4.874 -1.507 42 1HB ASP 6 HB2 ASP 6 -7.048 -5.320 -4.306 43 2HB ASP 6 HB3 ASP 6 -6.513 -6.607 -3.220 44 H GLN 7 H GLN 7 -4.963 -3.849 -4.848 45 HA GLN 7 HA GLN 7 -2.664 -5.551 -4.871 46 1HB GLN 7 HB2 GLN 7 -1.911 -4.325 -6.783 47 2HB GLN 7 HB3 GLN 7 -3.650 -4.621 -6.900 48 1HG GLN 7 HG2 GLN 7 -4.028 -2.262 -6.092 49 2HG GLN 7 HG3 GLN 7 -2.302 -1.963 -6.199 50 1HE2 GLN 7 HE22 GLN 7 -1.305 -2.428 -8.435 51 2HE2 GLN 7 HE21 GLN 7 -2.312 -2.045 -9.821 52 H ALA 8 H ALA 8 -3.163 -2.231 -3.631 53 HA ALA 8 HA ALA 8 -0.369 -1.702 -3.240 54 1HB ALA 8 HB1 ALA 8 -1.183 0.097 -1.740 55 2HB ALA 8 HB2 ALA 8 -1.851 0.106 -3.384 56 3HB ALA 8 HB3 ALA 8 -2.849 -0.453 -2.015 57 H ILE 9 H ILE 9 -2.957 -2.750 -0.885 58 HA ILE 9 HA ILE 9 -1.036 -3.146 1.229 59 HB ILE 9 HB ILE 9 -2.725 -4.468 2.378 60 1HG1 ILE 9 HG12 ILE 9 -4.368 -4.282 -0.128 61 2HG1 ILE 9 HG13 ILE 9 -3.706 -5.758 0.603 62 1HG2 ILE 9 HG21 ILE 9 -2.701 -1.999 2.412 63 2HG2 ILE 9 HG22 ILE 9 -3.930 -1.994 1.123 64 3HG2 ILE 9 HG23 ILE 9 -4.287 -2.685 2.722 65 1HD1 ILE 9 HD11 ILE 9 -5.881 -3.982 1.765 66 2HD1 ILE 9 HD12 ILE 9 -6.018 -5.647 1.191 67 3HD1 ILE 9 HD13 ILE 9 -5.082 -5.299 2.658 68 H GLY 10 H GLY 10 -2.275 -5.281 -1.324 69 1HA GLY 10 HA2 GLY 10 -0.928 -7.656 -0.959 70 2HA GLY 10 HA3 GLY 10 -1.220 -6.878 -2.519 71 H LEU 11 H LEU 11 0.410 -4.617 -2.389 72 HA LEU 11 HA LEU 11 2.946 -5.621 -3.035 73 1HB LEU 11 HB2 LEU 11 1.783 -3.350 -3.598 74 2HB LEU 11 HB3 LEU 11 2.429 -2.788 -2.064 75 HG LEU 11 HG LEU 11 3.842 -2.012 -3.766 76 1HD1 LEU 11 HD11 LEU 11 5.368 -4.332 -2.612 77 2HD1 LEU 11 HD12 LEU 11 5.972 -2.762 -3.159 78 3HD1 LEU 11 HD13 LEU 11 4.956 -2.847 -1.707 79 1HD2 LEU 11 HD21 LEU 11 4.925 -3.357 -5.444 80 2HD2 LEU 11 HD22 LEU 11 4.166 -4.837 -4.820 81 3HD2 LEU 11 HD23 LEU 11 3.163 -3.551 -5.537 82 H LEU 12 H LEU 12 2.047 -3.728 -0.108 83 HA LEU 12 HA LEU 12 4.489 -3.958 1.284 84 1HB LEU 12 HB2 LEU 12 1.582 -3.764 2.238 85 2HB LEU 12 HB3 LEU 12 2.936 -3.836 3.362 86 HG LEU 12 HG LEU 12 3.906 -1.806 2.424 87 1HD1 LEU 12 HD11 LEU 12 2.506 -0.313 0.992 88 2HD1 LEU 12 HD12 LEU 12 2.961 -1.777 0.132 89 3HD1 LEU 12 HD13 LEU 12 1.321 -1.612 0.816 90 1HD2 LEU 12 HD21 LEU 12 2.176 -0.261 3.374 91 2HD2 LEU 12 HD22 LEU 12 1.024 -1.610 3.387 92 3HD2 LEU 12 HD23 LEU 12 2.495 -1.663 4.387 93 H ILE 13 H ILE 13 1.673 -6.116 1.289 94 HA ILE 13 HA ILE 13 2.617 -7.964 3.248 95 HB ILE 13 HB ILE 13 0.632 -8.139 0.934 96 1HG1 ILE 13 HG12 ILE 13 0.074 -8.157 3.923 97 2HG1 ILE 13 HG13 ILE 13 0.260 -6.643 3.041 98 1HG2 ILE 13 HG21 ILE 13 -0.261 -10.204 2.053 99 2HG2 ILE 13 HG22 ILE 13 1.315 -10.429 1.294 100 3HG2 ILE 13 HG23 ILE 13 1.206 -10.211 3.050 101 1HD1 ILE 13 HD11 ILE 13 -1.922 -8.704 2.742 102 2HD1 ILE 13 HD12 ILE 13 -2.024 -6.945 2.986 103 3HD1 ILE 13 HD13 ILE 13 -1.552 -7.582 1.413 104 H GLY 14 H GLY 14 2.667 -8.102 -0.311 105 1HA GLY 14 HA2 GLY 14 4.018 -10.499 -0.719 106 2HA GLY 14 HA3 GLY 14 4.063 -9.090 -1.800 107 H ILE 15 H ILE 15 5.411 -7.152 -0.485 108 HA ILE 15 HA ILE 15 8.130 -7.884 -0.702 109 HB ILE 15 HB ILE 15 6.586 -5.565 0.434 110 1HG1 ILE 15 HG12 ILE 15 8.845 -5.869 -1.602 111 2HG1 ILE 15 HG13 ILE 15 7.118 -5.810 -1.974 112 1HG2 ILE 15 HG21 ILE 15 8.238 -5.801 2.143 113 2HG2 ILE 15 HG22 ILE 15 9.544 -5.991 0.947 114 3HG2 ILE 15 HG23 ILE 15 8.686 -4.440 1.150 115 1HD1 ILE 15 HD11 ILE 15 7.070 -3.505 -0.888 116 2HD1 ILE 15 HD12 ILE 15 8.838 -3.559 -0.852 117 3HD1 ILE 15 HD13 ILE 15 7.998 -3.627 -2.400 118 H PHE 16 H PHE 16 6.121 -7.478 2.237 119 HA PHE 16 HA PHE 16 8.167 -8.070 4.057 120 1HB PHE 16 HB2 PHE 16 5.965 -7.073 4.611 121 2HB PHE 16 HB3 PHE 16 5.169 -8.606 4.327 122 HD1 PHE 16 HD1 PHE 16 7.220 -6.654 6.662 123 HD2 PHE 16 HD2 PHE 16 5.641 -10.573 5.846 124 HE1 PHE 16 HE1 PHE 16 7.511 -7.270 9.053 125 HE2 PHE 16 HE2 PHE 16 6.234 -11.270 8.121 126 HZ PHE 16 HZ PHE 16 6.980 -9.559 9.803 127 H HIS 17 H HIS 17 5.628 -10.316 2.815 128 HA HIS 17 HA HIS 17 6.788 -12.455 4.336 129 1HB HIS 17 HB2 HIS 17 4.313 -12.030 3.164 130 2HB HIS 17 HB3 HIS 17 4.991 -13.320 2.173 131 HD1 HIS 17 HD1 HIS 17 5.010 -15.721 3.344 132 HD2 HIS 17 HD2 HIS 17 4.241 -12.475 5.913 133 HE1 HIS 17 HE1 HIS 17 4.210 -16.698 5.557 134 H LYS 18 H LYS 18 7.238 -11.319 1.016 135 HA LYS 18 HA LYS 18 8.630 -13.614 0.022 136 1HB LYS 18 HB2 LYS 18 7.781 -11.845 -1.388 137 2HB LYS 18 HB3 LYS 18 8.882 -10.660 -0.698 138 1HG LYS 18 HG2 LYS 18 9.756 -13.192 -2.171 139 2HG LYS 18 HG3 LYS 18 9.404 -11.681 -2.993 140 1HD LYS 18 HD2 LYS 18 11.692 -12.194 -1.047 141 2HD LYS 18 HD3 LYS 18 11.778 -11.890 -2.770 142 1HE LYS 18 HE2 LYS 18 10.936 -9.879 -0.638 143 2HE LYS 18 HE3 LYS 18 12.442 -9.898 -1.556 144 1HZ LYS 18 HZ1 LYS 18 9.760 -9.490 -2.669 145 2HZ LYS 18 HZ2 LYS 18 10.916 -8.335 -2.451 146 3HZ LYS 18 HZ3 LYS 18 11.157 -9.543 -3.546 147 H TYR 19 H TYR 19 9.785 -10.607 1.698 148 HA TYR 19 HA TYR 19 12.484 -11.552 1.896 149 1HB TYR 19 HB2 TYR 19 10.891 -9.348 3.131 150 2HB TYR 19 HB3 TYR 19 12.279 -9.908 4.052 151 HD1 TYR 19 HD1 TYR 19 11.296 -8.124 1.002 152 HD2 TYR 19 HD2 TYR 19 14.549 -9.956 3.147 153 HE1 TYR 19 HE1 TYR 19 12.908 -7.111 -0.568 154 HE2 TYR 19 HE2 TYR 19 16.163 -8.924 1.591 155 HH TYR 19 HH TYR 19 16.169 -6.774 0.240 156 H SER 20 H SER 20 9.736 -11.873 4.195 157 HA SER 20 HA SER 20 11.157 -13.303 6.164 158 1HB SER 20 HB2 SER 20 8.766 -12.482 6.368 159 2HB SER 20 HB3 SER 20 8.283 -13.901 5.412 160 HG SER 20 HG SER 20 9.254 -13.725 8.018 161 H GLY 21 H GLY 21 9.813 -14.437 3.065 162 1HA GLY 21 HA2 GLY 21 10.072 -17.150 3.079 163 2HA GLY 21 HA3 GLY 21 10.572 -16.121 1.734 164 H LYS 22 H LYS 22 12.800 -14.802 3.094 165 HA LYS 22 HA LYS 22 14.821 -16.741 2.510 166 1HB LYS 22 HB2 LYS 22 14.960 -14.254 2.237 167 2HB LYS 22 HB3 LYS 22 15.114 -14.106 3.996 168 1HG LYS 22 HG2 LYS 22 17.138 -15.587 3.901 169 2HG LYS 22 HG3 LYS 22 16.995 -15.645 2.142 170 1HD LYS 22 HD2 LYS 22 17.628 -13.256 3.923 171 2HD LYS 22 HD3 LYS 22 18.700 -14.037 2.768 172 1HE LYS 22 HE2 LYS 22 16.230 -12.358 2.116 173 2HE LYS 22 HE3 LYS 22 17.918 -11.917 1.863 174 1HZ LYS 22 HZ1 LYS 22 16.521 -14.126 0.528 175 2HZ LYS 22 HZ2 LYS 22 16.911 -12.675 -0.147 176 3HZ LYS 22 HZ3 LYS 22 18.104 -13.721 0.302 177 H GLU 23 H GLU 23 13.261 -15.727 5.542 178 HA GLU 23 HA GLU 23 15.287 -17.228 7.141 179 1HB GLU 23 HB2 GLU 23 14.121 -16.151 9.095 180 2HB GLU 23 HB3 GLU 23 15.112 -15.132 8.046 181 1HG GLU 23 HG2 GLU 23 13.169 -14.192 6.961 182 2HG GLU 23 HG3 GLU 23 12.077 -15.266 7.874 183 H GLY 24 H GLY 24 11.750 -17.067 6.593 184 1HA GLY 24 HA2 GLY 24 11.440 -19.799 6.366 185 2HA GLY 24 HA3 GLY 24 11.222 -19.506 8.097 186 H ASP 25 H ASP 25 10.191 -17.328 5.454 187 HA ASP 25 HA ASP 25 8.136 -16.527 4.861 188 1HB ASP 25 HB2 ASP 25 8.437 -18.629 3.548 189 2HB ASP 25 HB3 ASP 25 7.561 -19.516 4.799 190 H LYS 26 H LYS 26 7.792 -15.617 7.164 191 HA LYS 26 HA LYS 26 5.188 -16.599 8.168 192 1HB LYS 26 HB2 LYS 26 6.148 -16.606 10.517 193 2HB LYS 26 HB3 LYS 26 6.618 -17.948 9.465 194 1HG LYS 26 HG2 LYS 26 8.813 -16.995 9.064 195 2HG LYS 26 HG3 LYS 26 8.352 -15.483 9.830 196 1HD LYS 26 HD2 LYS 26 9.755 -16.802 11.335 197 2HD LYS 26 HD3 LYS 26 8.141 -16.599 12.015 198 1HE LYS 26 HE2 LYS 26 8.986 -18.887 12.354 199 2HE LYS 26 HE3 LYS 26 7.527 -18.900 11.358 200 1HZ LYS 26 HZ1 LYS 26 9.242 -20.336 10.513 201 2HZ LYS 26 HZ2 LYS 26 8.917 -19.146 9.425 202 3HZ LYS 26 HZ3 LYS 26 10.283 -19.071 10.347 203 H HIS 27 H HIS 27 4.483 -15.092 10.042 204 HA HIS 27 HA HIS 27 4.420 -12.468 8.819 205 1HB HIS 27 HB2 HIS 27 3.144 -13.479 11.372 206 2HB HIS 27 HB3 HIS 27 2.753 -11.974 10.532 207 HD1 HIS 27 HD1 HIS 27 3.083 -14.260 7.740 208 HD2 HIS 27 HD2 HIS 27 0.299 -13.697 10.860 209 HE1 HIS 27 HE1 HIS 27 0.933 -15.370 7.008 210 H THR 28 H THR 28 7.088 -13.037 9.682 211 HA THR 28 HA THR 28 7.623 -10.859 11.570 212 HB THR 28 HB THR 28 9.187 -12.318 12.844 213 HG1 THR 28 HG1 THR 28 9.224 -13.969 11.186 214 1HG2 THR 28 HG21 THR 28 6.916 -11.838 13.774 215 2HG2 THR 28 HG22 THR 28 6.311 -13.331 13.013 216 3HG2 THR 28 HG23 THR 28 7.553 -13.418 14.267 217 H LEU 29 H LEU 29 9.468 -9.833 10.996 218 HA LEU 29 HA LEU 29 11.428 -11.163 9.118 219 1HB LEU 29 HB2 LEU 29 10.666 -8.233 9.518 220 2HB LEU 29 HB3 LEU 29 12.121 -8.739 8.663 221 HG LEU 29 HG LEU 29 9.308 -9.486 7.778 222 1HD1 LEU 29 HD11 LEU 29 11.226 -7.331 6.772 223 2HD1 LEU 29 HD12 LEU 29 9.642 -7.727 6.069 224 3HD1 LEU 29 HD13 LEU 29 9.744 -7.015 7.690 225 1HD2 LEU 29 HD21 LEU 29 12.021 -9.678 6.416 226 2HD2 LEU 29 HD22 LEU 29 11.002 -11.045 6.928 227 3HD2 LEU 29 HD23 LEU 29 10.453 -9.964 5.636 228 H SER 30 H SER 30 13.594 -11.225 9.986 229 HA SER 30 HA SER 30 13.910 -10.167 12.720 230 1HB SER 30 HB2 SER 30 15.049 -12.235 12.128 231 2HB SER 30 HB3 SER 30 16.010 -11.371 10.908 232 HG SER 30 HG SER 30 15.905 -10.594 13.663 233 H LYS 31 H LYS 31 15.449 -8.454 13.229 234 HA LYS 31 HA LYS 31 14.924 -6.140 11.825 235 1HB LYS 31 HB2 LYS 31 16.563 -5.072 13.261 236 2HB LYS 31 HB3 LYS 31 15.545 -6.213 14.131 237 1HG LYS 31 HG2 LYS 31 17.406 -7.891 14.076 238 2HG LYS 31 HG3 LYS 31 18.432 -6.674 13.277 239 1HD LYS 31 HD2 LYS 31 18.188 -5.161 15.207 240 2HD LYS 31 HD3 LYS 31 17.047 -6.265 15.968 241 1HE LYS 31 HE2 LYS 31 19.220 -6.520 17.013 242 2HE LYS 31 HE3 LYS 31 18.814 -8.007 16.143 243 1HZ LYS 31 HZ1 LYS 31 21.072 -7.322 15.776 244 2HZ LYS 31 HZ2 LYS 31 20.229 -7.275 14.362 245 3HZ LYS 31 HZ3 LYS 31 20.583 -5.875 15.158 246 H LYS 32 H LYS 32 17.831 -8.193 11.410 247 HA LYS 32 HA LYS 32 19.026 -6.375 9.481 248 1HB LYS 32 HB2 LYS 32 20.393 -7.848 10.788 249 2HB LYS 32 HB3 LYS 32 19.609 -9.287 10.092 250 1HG LYS 32 HG2 LYS 32 20.485 -8.679 7.852 251 2HG LYS 32 HG3 LYS 32 21.188 -7.193 8.520 252 1HD LYS 32 HD2 LYS 32 22.651 -8.557 9.998 253 2HD LYS 32 HD3 LYS 32 21.917 -10.042 9.356 254 1HE LYS 32 HE2 LYS 32 22.719 -9.449 7.072 255 2HE LYS 32 HE3 LYS 32 23.457 -7.971 7.715 256 1HZ LYS 32 HZ1 LYS 32 24.856 -9.341 9.083 257 2HZ LYS 32 HZ2 LYS 32 24.166 -10.714 8.485 258 3HZ LYS 32 HZ3 LYS 32 25.038 -9.728 7.492 259 H GLU 33 H GLU 33 16.627 -8.979 9.283 260 HA GLU 33 HA GLU 33 16.838 -9.339 6.415 261 1HB GLU 33 HB2 GLU 33 15.733 -10.952 8.130 262 2HB GLU 33 HB3 GLU 33 14.360 -9.831 8.120 263 1HG GLU 33 HG2 GLU 33 13.856 -11.554 6.543 264 2HG GLU 33 HG3 GLU 33 14.266 -10.123 5.592 265 H LEU 34 H LEU 34 14.883 -7.396 8.677 266 HA LEU 34 HA LEU 34 13.418 -5.912 6.770 267 1HB LEU 34 HB2 LEU 34 12.773 -5.805 9.028 268 2HB LEU 34 HB3 LEU 34 14.347 -5.285 9.586 269 HG LEU 34 HG LEU 34 12.658 -3.552 9.669 270 1HD1 LEU 34 HD11 LEU 34 15.198 -3.096 9.258 271 2HD1 LEU 34 HD12 LEU 34 14.661 -2.502 7.682 272 3HD1 LEU 34 HD13 LEU 34 14.047 -1.772 9.150 273 1HD2 LEU 34 HD21 LEU 34 12.618 -3.712 6.625 274 2HD2 LEU 34 HD22 LEU 34 11.305 -4.138 7.731 275 3HD2 LEU 34 HD23 LEU 34 11.835 -2.456 7.570 276 H LYS 35 H LYS 35 16.697 -5.181 8.206 277 HA LYS 35 HA LYS 35 17.135 -2.880 6.664 278 1HB LYS 35 HB2 LYS 35 18.655 -3.617 8.399 279 2HB LYS 35 HB3 LYS 35 19.239 -4.961 7.388 280 1HG LYS 35 HG2 LYS 35 19.992 -3.328 5.658 281 2HG LYS 35 HG3 LYS 35 19.421 -2.003 6.674 282 1HD LYS 35 HD2 LYS 35 21.709 -3.938 7.272 283 2HD LYS 35 HD3 LYS 35 21.819 -2.245 6.783 284 1HE LYS 35 HE2 LYS 35 22.101 -1.986 9.031 285 2HE LYS 35 HE3 LYS 35 20.340 -1.795 8.942 286 1HZ LYS 35 HZ1 LYS 35 20.981 -3.280 10.683 287 2HZ LYS 35 HZ2 LYS 35 20.195 -4.150 9.533 288 3HZ LYS 35 HZ3 LYS 35 21.836 -4.239 9.649 289 H GLU 36 H GLU 36 17.819 -6.268 5.729 290 HA GLU 36 HA GLU 36 18.792 -5.775 3.147 291 1HB GLU 36 HB2 GLU 36 18.649 -7.970 4.614 292 2HB GLU 36 HB3 GLU 36 17.107 -8.216 3.799 293 1HG GLU 36 HG2 GLU 36 18.801 -9.410 2.571 294 2HG GLU 36 HG3 GLU 36 18.358 -8.012 1.579 295 H LEU 37 H LEU 37 15.439 -6.187 4.250 296 HA LEU 37 HA LEU 37 14.147 -5.917 1.710 297 1HB LEU 37 HB2 LEU 37 13.025 -6.751 3.693 298 2HB LEU 37 HB3 LEU 37 13.261 -5.253 4.556 299 HG LEU 37 HG LEU 37 11.534 -5.392 2.083 300 1HD1 LEU 37 HD11 LEU 37 9.656 -5.544 3.766 301 2HD1 LEU 37 HD12 LEU 37 10.705 -6.971 3.769 302 3HD1 LEU 37 HD13 LEU 37 10.855 -5.722 5.043 303 1HD2 LEU 37 HD21 LEU 37 10.423 -3.423 3.220 304 2HD2 LEU 37 HD22 LEU 37 11.716 -3.411 4.428 305 3HD2 LEU 37 HD23 LEU 37 12.065 -3.052 2.720 306 H ILE 38 H ILE 38 14.931 -3.416 4.129 307 HA ILE 38 HA ILE 38 13.980 -1.313 2.492 308 HB ILE 38 HB ILE 38 16.052 -1.365 4.713 309 1HG1 ILE 38 HG12 ILE 38 13.100 -0.568 4.484 310 2HG1 ILE 38 HG13 ILE 38 13.753 -1.984 5.318 311 1HG2 ILE 38 HG21 ILE 38 15.836 1.087 4.817 312 2HG2 ILE 38 HG22 ILE 38 16.531 0.608 3.280 313 3HG2 ILE 38 HG23 ILE 38 14.817 1.068 3.369 314 1HD1 ILE 38 HD11 ILE 38 15.047 -0.336 6.798 315 2HD1 ILE 38 HD12 ILE 38 14.002 0.918 6.073 316 3HD1 ILE 38 HD13 ILE 38 13.275 -0.426 6.984 317 H GLN 39 H GLN 39 17.223 -2.824 2.592 318 HA GLN 39 HA GLN 39 18.489 -0.903 1.005 319 1HB GLN 39 HB2 GLN 39 19.074 -3.897 0.914 320 2HB GLN 39 HB3 GLN 39 20.113 -2.597 0.340 321 1HG GLN 39 HG2 GLN 39 19.627 -3.511 3.140 322 2HG GLN 39 HG3 GLN 39 21.117 -3.102 2.327 323 1HE2 GLN 39 HE22 GLN 39 18.317 -1.820 4.051 324 2HE2 GLN 39 HE21 GLN 39 18.983 -0.200 4.293 325 H LYS 40 H LYS 40 16.671 -3.776 -0.064 326 HA LYS 40 HA LYS 40 17.107 -3.165 -2.883 327 1HB LYS 40 HB2 LYS 40 16.788 -5.452 -1.933 328 2HB LYS 40 HB3 LYS 40 15.117 -5.036 -1.539 329 1HG LYS 40 HG2 LYS 40 14.648 -4.598 -3.943 330 2HG LYS 40 HG3 LYS 40 16.305 -5.061 -4.357 331 1HD LYS 40 HD2 LYS 40 14.304 -6.875 -2.922 332 2HD LYS 40 HD3 LYS 40 14.514 -6.837 -4.679 333 1HE LYS 40 HE2 LYS 40 16.893 -7.500 -4.432 334 2HE LYS 40 HE3 LYS 40 16.701 -7.566 -2.671 335 1HZ LYS 40 HZ1 LYS 40 15.233 -9.213 -4.595 336 2HZ LYS 40 HZ2 LYS 40 16.489 -9.704 -3.648 337 3HZ LYS 40 HZ3 LYS 40 15.064 -9.256 -2.954 338 H GLU 41 H GLU 41 14.276 -3.106 -0.676 339 HA GLU 41 HA GLU 41 12.532 -2.259 -2.776 340 1HB GLU 41 HB2 GLU 41 12.054 -2.272 0.227 341 2HB GLU 41 HB3 GLU 41 10.815 -2.138 -1.027 342 1HG GLU 41 HG2 GLU 41 12.657 -4.545 -0.569 343 2HG GLU 41 HG3 GLU 41 10.952 -4.440 -0.166 344 H LEU 42 H LEU 42 14.217 -0.374 -0.240 345 HA LEU 42 HA LEU 42 12.928 2.081 -1.329 346 1HB LEU 42 HB2 LEU 42 14.584 1.600 1.141 347 2HB LEU 42 HB3 LEU 42 14.362 3.197 0.444 348 HG LEU 42 HG LEU 42 11.875 2.909 0.542 349 1HD1 LEU 42 HD11 LEU 42 11.620 0.492 0.776 350 2HD1 LEU 42 HD12 LEU 42 12.596 0.504 2.263 351 3HD1 LEU 42 HD13 LEU 42 11.007 1.282 2.230 352 1HD2 LEU 42 HD21 LEU 42 11.741 3.474 2.913 353 2HD2 LEU 42 HD22 LEU 42 13.374 2.837 3.186 354 3HD2 LEU 42 HD23 LEU 42 13.131 4.263 2.155 355 H THR 43 H THR 43 15.247 0.087 -2.468 356 HA THR 43 HA THR 43 17.158 0.308 -3.661 357 HB THR 43 HB THR 43 16.986 2.075 -5.419 358 HG1 THR 43 HG1 THR 43 15.727 3.414 -3.703 359 1HG2 THR 43 HG21 THR 43 14.898 1.269 -6.423 360 2HG2 THR 43 HG22 THR 43 15.756 -0.082 -5.654 361 3HG2 THR 43 HG23 THR 43 14.344 0.645 -4.857 362 H ILE 44 H ILE 44 18.167 0.727 -1.438 363 HA ILE 44 HA ILE 44 18.554 3.187 -0.374 364 HB ILE 44 HB ILE 44 19.085 1.167 0.786 365 1HG1 ILE 44 HG12 ILE 44 21.173 1.791 1.959 366 2HG1 ILE 44 HG13 ILE 44 21.492 3.036 0.750 367 1HG2 ILE 44 HG21 ILE 44 20.309 -0.001 -1.143 368 2HG2 ILE 44 HG22 ILE 44 21.744 0.940 -0.671 369 3HG2 ILE 44 HG23 ILE 44 21.011 -0.190 0.461 370 1HD1 ILE 44 HD11 ILE 44 20.409 3.866 2.860 371 2HD1 ILE 44 HD12 ILE 44 19.448 4.233 1.422 372 3HD1 ILE 44 HD13 ILE 44 18.980 2.879 2.482 373 H GLY 45 H GLY 45 21.023 1.742 -2.478 374 1HA GLY 45 HA2 GLY 45 22.719 2.680 -3.725 375 2HA GLY 45 HA3 GLY 45 21.835 4.213 -3.705 376 H SER 46 H SER 46 21.928 5.395 -1.458 377 HA SER 46 HA SER 46 24.729 5.930 -0.936 378 1HB SER 46 HB2 SER 46 23.474 7.651 0.620 379 2HB SER 46 HB3 SER 46 23.397 7.825 -1.140 380 HG SER 46 HG SER 46 21.336 7.774 0.256 381 H LYS 47 H LYS 47 24.923 3.596 -0.141 382 HA LYS 47 HA LYS 47 24.056 2.627 2.299 383 1HB LYS 47 HB2 LYS 47 26.825 2.452 1.046 384 2HB LYS 47 HB3 LYS 47 26.316 1.469 2.420 385 1HG LYS 47 HG2 LYS 47 24.942 1.418 -0.311 386 2HG LYS 47 HG3 LYS 47 26.203 0.309 0.237 387 1HD LYS 47 HD2 LYS 47 24.702 -0.321 2.205 388 2HD LYS 47 HD3 LYS 47 23.426 0.651 1.466 389 1HE LYS 47 HE2 LYS 47 23.056 -1.637 0.864 390 2HE LYS 47 HE3 LYS 47 23.562 -0.769 -0.597 391 1HZ LYS 47 HZ1 LYS 47 25.754 -1.670 -0.286 392 2HZ LYS 47 HZ2 LYS 47 25.293 -2.438 1.098 393 3HZ LYS 47 HZ3 LYS 47 24.646 -2.886 -0.350 394 H LEU 48 H LEU 48 26.268 5.313 1.893 395 HA LEU 48 HA LEU 48 27.451 5.501 4.432 396 1HB LEU 48 HB2 LEU 48 26.321 7.665 2.599 397 2HB LEU 48 HB3 LEU 48 27.251 8.006 4.052 398 HG LEU 48 HG LEU 48 28.628 8.251 2.130 399 1HD1 LEU 48 HD11 LEU 48 29.534 5.739 3.592 400 2HD1 LEU 48 HD12 LEU 48 30.543 6.942 2.776 401 3HD1 LEU 48 HD13 LEU 48 29.646 7.394 4.237 402 1HD2 LEU 48 HD21 LEU 48 29.251 6.551 0.584 403 2HD2 LEU 48 HD22 LEU 48 28.341 5.306 1.443 404 3HD2 LEU 48 HD23 LEU 48 27.482 6.625 0.604 405 H GLN 49 H GLN 49 24.098 6.111 3.500 406 HA GLN 49 HA GLN 49 23.364 7.396 6.006 407 1HB GLN 49 HB2 GLN 49 21.693 6.221 3.753 408 2HB GLN 49 HB3 GLN 49 21.061 7.141 5.125 409 1HG GLN 49 HG2 GLN 49 22.485 9.088 4.480 410 2HG GLN 49 HG3 GLN 49 23.068 8.184 3.075 411 1HE2 GLN 49 HE22 GLN 49 19.964 9.207 4.626 412 2HE2 GLN 49 HE21 GLN 49 19.152 9.528 3.096 413 H ASP 50 H ASP 50 24.324 4.235 5.570 414 HA ASP 50 HA ASP 50 22.407 2.614 6.619 415 1HB ASP 50 HB2 ASP 50 24.554 1.756 5.905 416 2HB ASP 50 HB3 ASP 50 25.377 2.570 7.250 417 H ALA 51 H ALA 51 24.411 4.897 8.501 418 HA ALA 51 HA ALA 51 23.692 4.167 11.125 419 1HB ALA 51 HB1 ALA 51 24.081 6.536 11.685 420 2HB ALA 51 HB2 ALA 51 25.336 5.909 10.596 421 3HB ALA 51 HB3 ALA 51 24.051 6.960 9.959 422 H GLU 52 H GLU 52 21.879 6.188 8.779 423 HA GLU 52 HA GLU 52 19.714 6.833 10.607 424 1HB GLU 52 HB2 GLU 52 19.769 6.897 7.555 425 2HB GLU 52 HB3 GLU 52 18.580 7.654 8.621 426 1HG GLU 52 HG2 GLU 52 20.397 9.066 9.613 427 2HG GLU 52 HG3 GLU 52 21.545 8.379 8.450 428 H ILE 53 H ILE 53 20.367 4.417 8.056 429 HA ILE 53 HA ILE 53 17.825 3.144 8.146 430 HB ILE 53 HB ILE 53 20.488 1.794 7.571 431 1HG1 ILE 53 HG12 ILE 53 20.167 3.764 6.088 432 2HG1 ILE 53 HG13 ILE 53 20.112 2.236 5.222 433 1HG2 ILE 53 HG21 ILE 53 19.090 0.258 6.225 434 2HG2 ILE 53 HG22 ILE 53 18.791 0.144 7.958 435 3HG2 ILE 53 HG23 ILE 53 17.632 0.996 6.923 436 1HD1 ILE 53 HD11 ILE 53 17.617 3.765 6.098 437 2HD1 ILE 53 HD12 ILE 53 18.383 3.901 4.514 438 3HD1 ILE 53 HD13 ILE 53 17.713 2.343 5.028 439 H VAL 54 H VAL 54 20.746 2.501 10.160 440 HA VAL 54 HA VAL 54 19.329 0.397 11.517 441 HB VAL 54 HB VAL 54 21.134 0.336 13.165 442 1HG1 VAL 54 HG11 VAL 54 22.691 -0.700 11.555 443 2HG1 VAL 54 HG12 VAL 54 21.003 -1.102 11.192 444 3HG1 VAL 54 HG13 VAL 54 21.851 0.120 10.218 445 1HG2 VAL 54 HG21 VAL 54 22.586 2.290 11.396 446 2HG2 VAL 54 HG22 VAL 54 21.935 2.685 13.005 447 3HG2 VAL 54 HG23 VAL 54 23.205 1.462 12.823 448 H LYS 55 H LYS 55 19.658 3.886 12.226 449 HA LYS 55 HA LYS 55 18.343 3.743 14.773 450 1HB LYS 55 HB2 LYS 55 19.337 5.803 14.101 451 2HB LYS 55 HB3 LYS 55 18.396 5.873 12.609 452 1HG LYS 55 HG2 LYS 55 17.608 7.463 14.320 453 2HG LYS 55 HG3 LYS 55 16.351 6.341 13.793 454 1HD LYS 55 HD2 LYS 55 16.622 5.008 15.852 455 2HD LYS 55 HD3 LYS 55 17.974 6.035 16.371 456 1HE LYS 55 HE2 LYS 55 16.496 7.946 16.615 457 2HE LYS 55 HE3 LYS 55 15.167 7.097 15.799 458 1HZ LYS 55 HZ1 LYS 55 14.918 7.118 18.169 459 2HZ LYS 55 HZ2 LYS 55 15.033 5.587 17.576 460 3HZ LYS 55 HZ3 LYS 55 16.319 6.268 18.362 461 H LEU 56 H LEU 56 17.009 4.172 11.467 462 HA LEU 56 HA LEU 56 14.268 3.971 12.122 463 1HB LEU 56 HB2 LEU 56 14.914 4.822 10.053 464 2HB LEU 56 HB3 LEU 56 15.887 3.419 9.626 465 HG LEU 56 HG LEU 56 12.987 2.877 10.105 466 1HD1 LEU 56 HD11 LEU 56 12.365 3.593 7.832 467 2HD1 LEU 56 HD12 LEU 56 12.817 4.974 8.847 468 3HD1 LEU 56 HD13 LEU 56 13.956 4.355 7.630 469 1HD2 LEU 56 HD21 LEU 56 14.937 2.068 7.906 470 2HD2 LEU 56 HD22 LEU 56 14.655 1.114 9.364 471 3HD2 LEU 56 HD23 LEU 56 13.316 1.399 8.241 472 H MET 57 H MET 57 16.609 1.374 11.368 473 HA MET 57 HA MET 57 14.840 -0.820 11.463 474 1HB MET 57 HB2 MET 57 17.231 -0.913 10.666 475 2HB MET 57 HB3 MET 57 17.730 -0.701 12.358 476 1HG MET 57 HG2 MET 57 16.536 -2.816 12.942 477 2HG MET 57 HG3 MET 57 16.221 -3.057 11.230 478 1HE MET 57 HE1 MET 57 20.335 -3.344 13.314 479 2HE MET 57 HE2 MET 57 19.541 -1.769 13.127 480 3HE MET 57 HE3 MET 57 18.786 -3.027 14.130 481 H ASP 58 H ASP 58 16.783 0.763 14.067 482 HA ASP 58 HA ASP 58 15.954 -0.905 16.189 483 1HB ASP 58 HB2 ASP 58 17.785 0.781 16.303 484 2HB ASP 58 HB3 ASP 58 16.571 2.068 16.369 485 H ASP 59 H ASP 59 14.535 2.126 14.908 486 HA ASP 59 HA ASP 59 12.359 2.258 16.710 487 1HB ASP 59 HB2 ASP 59 12.382 3.219 13.818 488 2HB ASP 59 HB3 ASP 59 11.286 3.744 15.102 489 H LEU 60 H LEU 60 12.475 0.668 13.484 490 HA LEU 60 HA LEU 60 9.840 -0.465 13.556 491 1HB LEU 60 HB2 LEU 60 12.459 -1.145 12.196 492 2HB LEU 60 HB3 LEU 60 11.155 -2.326 12.147 493 HG LEU 60 HG LEU 60 10.519 0.496 11.391 494 1HD1 LEU 60 HD11 LEU 60 11.835 -1.451 9.496 495 2HD1 LEU 60 HD12 LEU 60 11.126 0.092 9.036 496 3HD1 LEU 60 HD13 LEU 60 12.559 0.058 10.098 497 1HD2 LEU 60 HD21 LEU 60 9.004 -0.696 9.774 498 2HD2 LEU 60 HD22 LEU 60 9.711 -2.236 10.226 499 3HD2 LEU 60 HD23 LEU 60 8.745 -1.337 11.421 500 H ASP 61 H ASP 61 12.939 -2.038 14.374 501 HA ASP 61 HA ASP 61 11.717 -4.388 15.286 502 1HB ASP 61 HB2 ASP 61 13.791 -5.246 15.782 503 2HB ASP 61 HB3 ASP 61 13.972 -4.255 14.338 504 H ARG 62 H ARG 62 12.282 -1.443 17.060 505 HA ARG 62 HA ARG 62 12.353 -2.137 19.644 506 1HB ARG 62 HB2 ARG 62 12.072 0.174 18.750 507 2HB ARG 62 HB3 ARG 62 10.374 -0.158 18.421 508 1HG ARG 62 HG2 ARG 62 10.743 1.166 20.482 509 2HG ARG 62 HG3 ARG 62 9.868 -0.336 20.790 510 1HD ARG 62 HD2 ARG 62 11.635 0.200 22.496 511 2HD ARG 62 HD3 ARG 62 11.810 -1.386 21.734 512 HE ARG 62 HE ARG 62 13.302 0.733 20.386 513 1HH1 ARG 62 HH12 ARG 62 13.449 -1.565 23.065 514 2HH1 ARG 62 HH11 ARG 62 15.185 -1.722 23.014 515 1HH2 ARG 62 HH22 ARG 62 15.539 0.530 20.288 516 2HH2 ARG 62 HH21 ARG 62 16.404 -0.493 21.402 517 H ASN 63 H ASN 63 9.472 -2.464 17.587 518 HA ASN 63 HA ASN 63 7.528 -3.236 19.375 519 1HB ASN 63 HB2 ASN 63 6.399 -4.319 17.656 520 2HB ASN 63 HB3 ASN 63 7.319 -3.055 16.829 521 1HD2 ASN 63 HD22 ASN 63 9.626 -3.866 16.097 522 2HD2 ASN 63 HD21 ASN 63 9.850 -5.576 15.745 523 H LYS 64 H LYS 64 10.221 -5.270 18.290 524 HA LYS 64 HA LYS 64 9.920 -7.079 20.516 525 1HB LYS 64 HB2 LYS 64 8.111 -7.868 18.951 526 2HB LYS 64 HB3 LYS 64 9.350 -8.217 17.747 527 1HG LYS 64 HG2 LYS 64 10.379 -9.855 19.322 528 2HG LYS 64 HG3 LYS 64 9.196 -9.404 20.566 529 1HD LYS 64 HD2 LYS 64 7.348 -10.158 19.071 530 2HD LYS 64 HD3 LYS 64 8.531 -10.667 17.863 531 1HE LYS 64 HE2 LYS 64 8.232 -11.766 20.703 532 2HE LYS 64 HE3 LYS 64 7.751 -12.582 19.205 533 1HZ LYS 64 HZ1 LYS 64 10.497 -11.875 19.968 534 2HZ LYS 64 HZ2 LYS 64 9.836 -13.380 19.988 535 3HZ LYS 64 HZ3 LYS 64 10.064 -12.603 18.555 536 H ASP 65 H ASP 65 11.891 -5.617 20.221 537 HA ASP 65 HA ASP 65 14.022 -5.224 19.648 538 1HB ASP 65 HB2 ASP 65 15.506 -6.511 21.031 539 2HB ASP 65 HB3 ASP 65 13.999 -6.098 21.850 540 H GLN 66 H GLN 66 14.059 -8.718 18.982 541 HA GLN 66 HA GLN 66 16.287 -8.289 17.069 542 1HB GLN 66 HB2 GLN 66 14.929 -10.751 18.204 543 2HB GLN 66 HB3 GLN 66 15.975 -10.854 16.784 544 1HG GLN 66 HG2 GLN 66 17.336 -11.331 18.679 545 2HG GLN 66 HG3 GLN 66 17.823 -9.772 18.007 546 1HE2 GLN 66 HE22 GLN 66 15.972 -11.331 20.665 547 2HE2 GLN 66 HE21 GLN 66 16.046 -9.934 21.731 548 H GLU 67 H GLU 67 12.875 -8.233 16.830 549 HA GLU 67 HA GLU 67 13.001 -8.575 13.909 550 1HB GLU 67 HB2 GLU 67 11.134 -10.279 14.052 551 2HB GLU 67 HB3 GLU 67 12.670 -10.861 14.700 552 1HG GLU 67 HG2 GLU 67 11.913 -10.484 16.996 553 2HG GLU 67 HG3 GLU 67 10.437 -9.702 16.411 554 H VAL 68 H VAL 68 10.949 -8.300 12.870 555 HA VAL 68 HA VAL 68 9.204 -6.205 14.045 556 HB VAL 68 HB VAL 68 9.922 -6.508 11.113 557 1HG1 VAL 68 HG11 VAL 68 8.962 -4.265 10.970 558 2HG1 VAL 68 HG12 VAL 68 7.791 -5.347 11.740 559 3HG1 VAL 68 HG13 VAL 68 8.724 -4.207 12.728 560 1HG2 VAL 68 HG21 VAL 68 11.196 -4.607 13.109 561 2HG2 VAL 68 HG22 VAL 68 12.028 -5.918 12.241 562 3HG2 VAL 68 HG23 VAL 68 11.376 -4.546 11.347 563 H ASN 69 H ASN 69 7.264 -7.167 14.447 564 HA ASN 69 HA ASN 69 6.429 -9.486 12.841 565 1HB ASN 69 HB2 ASN 69 5.677 -9.580 15.093 566 2HB ASN 69 HB3 ASN 69 5.192 -7.880 15.089 567 1HD2 ASN 69 HD22 ASN 69 4.353 -10.880 13.115 568 2HD2 ASN 69 HD21 ASN 69 2.636 -10.553 13.241 569 H PHE 70 H PHE 70 4.742 -9.497 11.348 570 HA PHE 70 HA PHE 70 4.657 -7.579 9.420 571 1HB PHE 70 HB2 PHE 70 3.784 -9.800 9.100 572 2HB PHE 70 HB3 PHE 70 2.489 -9.516 10.267 573 HD1 PHE 70 HD1 PHE 70 3.897 -8.007 7.113 574 HD2 PHE 70 HD2 PHE 70 0.385 -8.827 9.477 575 HE1 PHE 70 HE1 PHE 70 2.494 -6.848 5.434 576 HE2 PHE 70 HE2 PHE 70 -1.001 -7.655 7.823 577 HZ PHE 70 HZ PHE 70 0.043 -6.632 5.804 578 H GLN 71 H GLN 71 2.142 -7.746 12.026 579 HA GLN 71 HA GLN 71 0.641 -5.536 11.141 580 1HB GLN 71 HB2 GLN 71 -0.179 -7.029 12.871 581 2HB GLN 71 HB3 GLN 71 1.171 -6.613 13.937 582 1HG GLN 71 HG2 GLN 71 -0.814 -5.550 14.724 583 2HG GLN 71 HG3 GLN 71 0.309 -4.307 14.198 584 1HE2 GLN 71 HE22 GLN 71 -0.122 -3.321 11.965 585 2HE2 GLN 71 HE21 GLN 71 -1.835 -3.188 11.531 586 H GLU 72 H GLU 72 3.594 -5.689 13.098 587 HA GLU 72 HA GLU 72 3.520 -2.915 13.929 588 1HB GLU 72 HB2 GLU 72 5.800 -4.931 14.071 589 2HB GLU 72 HB3 GLU 72 5.639 -3.423 14.976 590 1HG GLU 72 HG2 GLU 72 3.738 -5.829 15.202 591 2HG GLU 72 HG3 GLU 72 4.990 -5.419 16.345 592 H TYR 73 H TYR 73 5.197 -4.835 11.447 593 HA TYR 73 HA TYR 73 6.751 -2.769 10.249 594 1HB TYR 73 HB2 TYR 73 7.224 -4.877 9.461 595 2HB TYR 73 HB3 TYR 73 5.556 -5.365 9.354 596 HD1 TYR 73 HD1 TYR 73 4.229 -5.027 7.393 597 HD2 TYR 73 HD2 TYR 73 8.304 -3.641 7.597 598 HE1 TYR 73 HE1 TYR 73 4.339 -5.012 4.931 599 HE2 TYR 73 HE2 TYR 73 8.456 -3.771 5.123 600 HH TYR 73 HH TYR 73 5.801 -5.026 3.116 601 H ILE 74 H ILE 74 3.338 -3.781 9.530 602 HA ILE 74 HA ILE 74 2.879 -1.668 7.681 603 HB ILE 74 HB ILE 74 0.861 -3.026 9.495 604 1HG1 ILE 74 HG12 ILE 74 2.080 -4.608 7.959 605 2HG1 ILE 74 HG13 ILE 74 0.350 -4.535 7.774 606 1HG2 ILE 74 HG21 ILE 74 0.562 -1.145 7.130 607 2HG2 ILE 74 HG22 ILE 74 -0.721 -2.270 7.570 608 3HG2 ILE 74 HG23 ILE 74 -0.186 -1.061 8.739 609 1HD1 ILE 74 HD11 ILE 74 0.623 -3.079 5.748 610 2HD1 ILE 74 HD12 ILE 74 2.392 -3.252 5.941 611 3HD1 ILE 74 HD13 ILE 74 1.371 -4.654 5.581 612 H THR 75 H THR 75 2.203 -1.762 11.217 613 HA THR 75 HA THR 75 1.184 0.804 11.580 614 HB THR 75 HB THR 75 3.132 -0.624 13.449 615 HG1 THR 75 HG1 THR 75 1.438 -1.983 12.978 616 1HG2 THR 75 HG21 THR 75 1.847 0.510 15.229 617 2HG2 THR 75 HG22 THR 75 2.727 1.656 14.208 618 3HG2 THR 75 HG23 THR 75 0.974 1.444 14.002 619 H PHE 76 H PHE 76 4.636 -0.183 11.515 620 HA PHE 76 HA PHE 76 5.658 2.453 11.962 621 1HB PHE 76 HB2 PHE 76 6.979 0.413 12.378 622 2HB PHE 76 HB3 PHE 76 6.983 0.078 10.645 623 HD1 PHE 76 HD1 PHE 76 8.220 2.370 13.309 624 HD2 PHE 76 HD2 PHE 76 8.369 1.466 9.083 625 HE1 PHE 76 HE1 PHE 76 10.029 4.035 12.993 626 HE2 PHE 76 HE2 PHE 76 10.280 2.973 8.829 627 HZ PHE 76 HZ PHE 76 11.061 4.349 10.750 628 H LEU 77 H LEU 77 5.052 0.567 8.905 629 HA LEU 77 HA LEU 77 6.045 2.628 7.190 630 1HB LEU 77 HB2 LEU 77 3.928 0.493 6.777 631 2HB LEU 77 HB3 LEU 77 4.414 1.608 5.496 632 HG LEU 77 HG LEU 77 6.418 -0.152 6.981 633 1HD1 LEU 77 HD11 LEU 77 4.829 -1.615 5.832 634 2HD1 LEU 77 HD12 LEU 77 5.031 -0.686 4.321 635 3HD1 LEU 77 HD13 LEU 77 6.395 -1.591 4.999 636 1HD2 LEU 77 HD21 LEU 77 7.485 1.743 5.823 637 2HD2 LEU 77 HD22 LEU 77 7.790 0.256 4.928 638 3HD2 LEU 77 HD23 LEU 77 6.550 1.387 4.349 639 H GLY 78 H GLY 78 2.900 2.241 8.808 640 1HA GLY 78 HA2 GLY 78 1.636 4.566 7.800 641 2HA GLY 78 HA3 GLY 78 1.405 3.893 9.430 642 H ALA 79 H ALA 79 3.794 4.259 10.688 643 HA ALA 79 HA ALA 79 3.921 7.025 11.284 644 1HB ALA 79 HB1 ALA 79 4.869 5.244 12.765 645 2HB ALA 79 HB2 ALA 79 6.205 5.026 11.621 646 3HB ALA 79 HB3 ALA 79 5.997 6.570 12.453 647 H LEU 80 H LEU 80 5.941 5.106 9.051 648 HA LEU 80 HA LEU 80 7.726 7.123 8.299 649 1HB LEU 80 HB2 LEU 80 7.722 4.546 7.811 650 2HB LEU 80 HB3 LEU 80 6.734 4.962 6.412 651 HG LEU 80 HG LEU 80 8.612 6.537 5.685 652 1HD1 LEU 80 HD11 LEU 80 10.879 5.979 6.647 653 2HD1 LEU 80 HD12 LEU 80 9.841 6.790 7.823 654 3HD1 LEU 80 HD13 LEU 80 10.074 5.034 7.913 655 1HD2 LEU 80 HD21 LEU 80 9.286 3.579 5.998 656 2HD2 LEU 80 HD22 LEU 80 8.264 4.273 4.716 657 3HD2 LEU 80 HD23 LEU 80 9.985 4.690 4.801 658 H ALA 81 H ALA 81 4.571 6.197 6.888 659 HA ALA 81 HA ALA 81 4.511 8.146 4.795 660 1HB ALA 81 HB1 ALA 81 2.298 6.742 6.304 661 2HB ALA 81 HB2 ALA 81 2.068 7.794 4.888 662 3HB ALA 81 HB3 ALA 81 3.026 6.297 4.753 663 H MET 82 H MET 82 3.366 8.250 8.202 664 HA MET 82 HA MET 82 2.298 10.877 8.122 665 1HB MET 82 HB2 MET 82 2.236 8.970 9.956 666 2HB MET 82 HB3 MET 82 3.639 9.810 10.611 667 1HG MET 82 HG2 MET 82 0.857 10.939 10.078 668 2HG MET 82 HG3 MET 82 1.527 10.524 11.653 669 1HE MET 82 HE1 MET 82 4.516 11.855 11.385 670 2HE MET 82 HE2 MET 82 4.157 13.409 12.163 671 3HE MET 82 HE3 MET 82 3.480 11.906 12.835 672 H ILE 83 H ILE 83 5.570 9.725 8.877 673 HA ILE 83 HA ILE 83 6.752 12.263 9.394 674 HB ILE 83 HB ILE 83 7.893 9.562 8.623 675 1HG1 ILE 83 HG12 ILE 83 8.078 11.082 11.260 676 2HG1 ILE 83 HG13 ILE 83 6.718 10.023 10.902 677 1HG2 ILE 83 HG21 ILE 83 9.525 11.225 7.865 678 2HG2 ILE 83 HG22 ILE 83 9.404 12.090 9.413 679 3HG2 ILE 83 HG23 ILE 83 10.118 10.467 9.335 680 1HD1 ILE 83 HD11 ILE 83 8.275 8.111 10.562 681 2HD1 ILE 83 HD12 ILE 83 9.627 9.150 11.067 682 3HD1 ILE 83 HD13 ILE 83 8.317 8.789 12.199 683 H TYR 84 H TYR 84 6.544 10.342 6.336 684 HA TYR 84 HA TYR 84 7.947 12.125 4.627 685 1HB TYR 84 HB2 TYR 84 5.399 10.511 4.113 686 2HB TYR 84 HB3 TYR 84 6.219 11.468 2.902 687 HD1 TYR 84 HD1 TYR 84 5.780 9.153 1.834 688 HD2 TYR 84 HD2 TYR 84 8.789 9.879 4.844 689 HE1 TYR 84 HE1 TYR 84 7.229 7.457 0.790 690 HE2 TYR 84 HE2 TYR 84 10.207 8.124 3.827 691 HH TYR 84 HH TYR 84 9.366 6.583 0.710 692 H ASN 85 H ASN 85 4.512 12.061 5.516 693 HA ASN 85 HA ASN 85 2.965 13.539 5.863 694 1HB ASN 85 HB2 ASN 85 4.963 14.597 7.254 695 2HB ASN 85 HB3 ASN 85 4.830 15.896 6.071 696 1HD2 ASN 85 HD22 ASN 85 3.005 13.903 8.400 697 2HD2 ASN 85 HD21 ASN 85 1.628 15.009 8.590 698 H GLU 86 H GLU 86 5.282 15.213 3.704 699 HA GLU 86 HA GLU 86 3.472 16.789 2.245 700 1HB GLU 86 HB2 GLU 86 5.876 15.294 1.096 701 2HB GLU 86 HB3 GLU 86 5.107 16.754 0.458 702 1HG GLU 86 HG2 GLU 86 6.734 16.493 3.029 703 2HG GLU 86 HG3 GLU 86 7.139 17.401 1.579 704 H ALA 87 H ALA 87 4.319 13.359 1.858 705 HA ALA 87 HA ALA 87 2.757 12.670 -0.374 706 1HB ALA 87 HB1 ALA 87 3.262 11.063 2.171 707 2HB ALA 87 HB2 ALA 87 2.723 10.411 0.608 708 3HB ALA 87 HB3 ALA 87 4.332 11.143 0.752 709 H LEU 88 H LEU 88 1.750 13.141 3.041 710 HA LEU 88 HA LEU 88 -0.983 12.240 2.623 711 1HB LEU 88 HB2 LEU 88 0.077 14.023 4.855 712 2HB LEU 88 HB3 LEU 88 -1.414 13.111 4.800 713 HG LEU 88 HG LEU 88 1.395 11.981 5.050 714 1HD1 LEU 88 HD11 LEU 88 -1.081 12.001 6.837 715 2HD1 LEU 88 HD12 LEU 88 0.352 11.026 7.151 716 3HD1 LEU 88 HD13 LEU 88 0.487 12.793 7.146 717 1HD2 LEU 88 HD21 LEU 88 0.296 9.762 5.202 718 2HD2 LEU 88 HD22 LEU 88 -1.232 10.492 4.651 719 3HD2 LEU 88 HD23 LEU 88 0.210 10.479 3.597 720 H LYS 89 H LYS 89 0.700 15.397 2.813 721 HA LYS 89 HA LYS 89 -1.578 17.038 2.432 722 1HB LYS 89 HB2 LYS 89 1.235 17.564 1.391 723 2HB LYS 89 HB3 LYS 89 -0.054 18.751 1.613 724 1HG LYS 89 HG2 LYS 89 -0.077 18.243 4.063 725 2HG LYS 89 HG3 LYS 89 1.298 17.151 3.830 726 1HD LYS 89 HD2 LYS 89 2.535 19.126 2.749 727 2HD LYS 89 HD3 LYS 89 1.235 20.158 3.361 728 1HE LYS 89 HE2 LYS 89 3.104 18.373 5.002 729 2HE LYS 89 HE3 LYS 89 3.164 20.138 4.901 730 1HZ LYS 89 HZ1 LYS 89 0.987 18.528 6.035 731 2HZ LYS 89 HZ2 LYS 89 2.079 19.420 6.875 732 3HZ LYS 89 HZ3 LYS 89 0.971 20.177 5.911 733 H GLY 90 H GLY 90 0.532 15.471 -0.024 734 1HA GLY 90 HA2 GLY 90 -1.689 15.035 -1.774 735 2HA GLY 90 HA3 GLY 90 -0.702 16.384 -2.373 736 1H MET 1 H1 MET 1 15.041 6.283 -4.388 737 2H MET 1 H2 MET 1 15.884 6.177 -5.801 738 3H MET 1 H3 MET 1 15.370 4.803 -5.043 739 HA MET 1 HA MET 1 13.679 6.847 -6.281 740 1HB MET 1 HB2 MET 1 14.203 3.935 -7.037 741 2HB MET 1 HB3 MET 1 12.971 4.983 -7.754 742 1HG MET 1 HG2 MET 1 14.747 6.549 -8.512 743 2HG MET 1 HG3 MET 1 15.970 5.475 -7.821 744 1HE MET 1 HE1 MET 1 13.432 4.427 -11.540 745 2HE MET 1 HE2 MET 1 12.712 4.388 -9.919 746 3HE MET 1 HE3 MET 1 13.263 5.935 -10.613 747 H ALA 2 H ALA 2 13.692 3.640 -4.708 748 HA ALA 2 HA ALA 2 12.247 2.540 -3.414 749 1HB ALA 2 HB1 ALA 2 11.341 5.308 -2.504 750 2HB ALA 2 HB2 ALA 2 11.232 3.792 -1.592 751 3HB ALA 2 HB3 ALA 2 12.819 4.494 -1.950 752 H SER 3 H SER 3 11.064 3.931 -6.068 753 HA SER 3 HA SER 3 8.499 4.544 -5.752 754 1HB SER 3 HB2 SER 3 9.410 3.092 -8.239 755 2HB SER 3 HB3 SER 3 8.333 4.483 -8.066 756 HG SER 3 HG SER 3 10.224 5.620 -7.202 757 HA PRO 4 HA PRO 4 6.987 0.128 -6.782 758 1HB PRO 4 HB2 PRO 4 8.975 -1.528 -5.190 759 2HB PRO 4 HB3 PRO 4 8.104 -1.984 -6.682 760 1HG PRO 4 HG2 PRO 4 10.695 -1.202 -6.826 761 2HG PRO 4 HG3 PRO 4 9.517 -0.549 -8.007 762 1HD PRO 4 HD2 PRO 4 10.519 0.750 -5.461 763 2HD PRO 4 HD3 PRO 4 10.424 1.442 -7.101 764 H LEU 5 H LEU 5 8.495 0.558 -3.544 765 HA LEU 5 HA LEU 5 6.042 -0.436 -2.255 766 1HB LEU 5 HB2 LEU 5 8.155 -0.874 -1.134 767 2HB LEU 5 HB3 LEU 5 8.542 0.856 -1.109 768 HG LEU 5 HG LEU 5 6.610 1.306 0.366 769 1HD1 LEU 5 HD11 LEU 5 5.393 -0.559 1.417 770 2HD1 LEU 5 HD12 LEU 5 5.031 -0.484 -0.303 771 3HD1 LEU 5 HD13 LEU 5 6.157 -1.720 0.313 772 1HD2 LEU 5 HD21 LEU 5 7.395 0.215 2.369 773 2HD2 LEU 5 HD22 LEU 5 8.301 -0.982 1.413 774 3HD2 LEU 5 HD23 LEU 5 8.773 0.740 1.380 775 H ASP 6 H ASP 6 7.791 2.670 -2.784 776 HA ASP 6 HA ASP 6 6.125 4.212 -1.207 777 1HB ASP 6 HB2 ASP 6 7.907 4.989 -3.488 778 2HB ASP 6 HB3 ASP 6 6.920 6.164 -2.611 779 H GLN 7 H GLN 7 5.559 3.259 -4.617 780 HA GLN 7 HA GLN 7 3.262 4.935 -4.967 781 1HB GLN 7 HB2 GLN 7 2.705 3.536 -6.854 782 2HB GLN 7 HB3 GLN 7 4.421 3.925 -6.813 783 1HG GLN 7 HG2 GLN 7 4.480 1.694 -7.404 784 2HG GLN 7 HG3 GLN 7 4.741 1.631 -5.661 785 1HE2 GLN 7 HE21 GLN 7 4.080 -0.519 -5.488 786 2HE2 GLN 7 HE22 GLN 7 2.398 -0.997 -5.725 787 H ALA 8 H ALA 8 3.648 1.731 -3.412 788 HA ALA 8 HA ALA 8 0.798 1.182 -3.393 789 1HB ALA 8 HB1 ALA 8 3.142 -0.088 -1.945 790 2HB ALA 8 HB2 ALA 8 1.450 -0.580 -1.733 791 3HB ALA 8 HB3 ALA 8 2.191 -0.683 -3.334 792 H ILE 9 H ILE 9 3.175 2.279 -0.875 793 HA ILE 9 HA ILE 9 1.087 2.760 1.062 794 HB ILE 9 HB ILE 9 2.609 4.107 2.316 795 1HG1 ILE 9 HG12 ILE 9 4.378 4.014 -0.110 796 2HG1 ILE 9 HG13 ILE 9 3.653 5.469 0.596 797 1HG2 ILE 9 HG21 ILE 9 4.276 2.451 2.763 798 2HG2 ILE 9 HG22 ILE 9 2.789 1.636 2.295 799 3HG2 ILE 9 HG23 ILE 9 4.126 1.765 1.130 800 1HD1 ILE 9 HD11 ILE 9 5.860 3.770 1.823 801 2HD1 ILE 9 HD12 ILE 9 5.953 5.436 1.253 802 3HD1 ILE 9 HD13 ILE 9 4.990 5.058 2.694 803 H GLY 10 H GLY 10 2.549 4.819 -1.493 804 1HA GLY 10 HA2 GLY 10 1.166 7.168 -1.358 805 2HA GLY 10 HA3 GLY 10 1.543 6.316 -2.862 806 H LEU 11 H LEU 11 -0.099 4.085 -2.728 807 HA LEU 11 HA LEU 11 -2.609 5.031 -3.540 808 1HB LEU 11 HB2 LEU 11 -1.412 2.732 -3.898 809 2HB LEU 11 HB3 LEU 11 -2.156 2.268 -2.374 810 HG LEU 11 HG LEU 11 -3.479 1.389 -4.075 811 1HD1 LEU 11 HD11 LEU 11 -4.719 2.399 -2.192 812 2HD1 LEU 11 HD12 LEU 11 -5.041 3.817 -3.235 813 3HD1 LEU 11 HD13 LEU 11 -5.632 2.213 -3.702 814 1HD2 LEU 11 HD21 LEU 11 -2.674 2.756 -5.939 815 2HD2 LEU 11 HD22 LEU 11 -4.441 2.615 -5.930 816 3HD2 LEU 11 HD23 LEU 11 -3.673 4.122 -5.387 817 H LEU 12 H LEU 12 -1.897 3.300 -0.465 818 HA LEU 12 HA LEU 12 -4.392 3.630 0.843 819 1HB LEU 12 HB2 LEU 12 -1.510 3.517 1.888 820 2HB LEU 12 HB3 LEU 12 -2.898 3.679 2.953 821 HG LEU 12 HG LEU 12 -3.834 1.577 2.117 822 1HD1 LEU 12 HD11 LEU 12 -1.143 1.271 0.709 823 2HD1 LEU 12 HD12 LEU 12 -2.328 -0.025 0.919 824 3HD1 LEU 12 HD13 LEU 12 -2.732 1.359 -0.094 825 1HD2 LEU 12 HD21 LEU 12 -2.553 1.615 4.178 826 2HD2 LEU 12 HD22 LEU 12 -2.194 0.122 3.313 827 3HD2 LEU 12 HD23 LEU 12 -1.025 1.457 3.283 828 H ILE 13 H ILE 13 -1.536 5.753 0.806 829 HA ILE 13 HA ILE 13 -2.597 7.693 2.611 830 HB ILE 13 HB ILE 13 -0.299 7.596 0.622 831 1HG1 ILE 13 HG12 ILE 13 0.923 8.352 2.753 832 2HG1 ILE 13 HG13 ILE 13 -0.598 8.088 3.612 833 1HG2 ILE 13 HG21 ILE 13 -1.332 10.131 1.904 834 2HG2 ILE 13 HG22 ILE 13 0.317 9.934 1.259 835 3HG2 ILE 13 HG23 ILE 13 -1.059 9.821 0.176 836 1HD1 ILE 13 HD11 ILE 13 1.148 6.080 2.169 837 2HD1 ILE 13 HD12 ILE 13 0.830 6.136 3.886 838 3HD1 ILE 13 HD13 ILE 13 -0.471 5.655 2.816 839 H GLY 14 H GLY 14 -2.528 7.603 -0.956 840 1HA GLY 14 HA2 GLY 14 -3.841 10.028 -1.478 841 2HA GLY 14 HA3 GLY 14 -3.863 8.586 -2.514 842 H ILE 15 H ILE 15 -5.220 6.694 -1.142 843 HA ILE 15 HA ILE 15 -7.942 7.379 -1.475 844 HB ILE 15 HB ILE 15 -6.421 5.124 -0.200 845 1HG1 ILE 15 HG12 ILE 15 -8.607 5.329 -2.322 846 2HG1 ILE 15 HG13 ILE 15 -6.865 5.292 -2.636 847 1HG2 ILE 15 HG21 ILE 15 -8.142 5.396 1.430 848 2HG2 ILE 15 HG22 ILE 15 -9.411 5.514 0.179 849 3HG2 ILE 15 HG23 ILE 15 -8.535 3.993 0.461 850 1HD1 ILE 15 HD11 ILE 15 -7.676 3.086 -3.049 851 2HD1 ILE 15 HD12 ILE 15 -6.839 2.999 -1.485 852 3HD1 ILE 15 HD13 ILE 15 -8.610 3.058 -1.552 853 H PHE 16 H PHE 16 -6.037 7.124 1.549 854 HA PHE 16 HA PHE 16 -8.111 7.952 3.253 855 1HB PHE 16 HB2 PHE 16 -5.973 6.897 3.944 856 2HB PHE 16 HB3 PHE 16 -5.100 8.367 3.560 857 HD1 PHE 16 HD1 PHE 16 -7.228 6.680 6.009 858 HD2 PHE 16 HD2 PHE 16 -5.581 10.494 4.896 859 HE1 PHE 16 HE1 PHE 16 -7.499 7.487 8.347 860 HE2 PHE 16 HE2 PHE 16 -6.179 11.388 7.101 861 HZ PHE 16 HZ PHE 16 -6.969 9.828 8.906 862 H HIS 17 H HIS 17 -5.431 10.046 2.016 863 HA HIS 17 HA HIS 17 -6.616 12.238 3.394 864 1HB HIS 17 HB2 HIS 17 -4.097 11.734 2.297 865 2HB HIS 17 HB3 HIS 17 -4.709 13.099 1.366 866 HD1 HIS 17 HD1 HIS 17 -4.749 15.416 2.653 867 HD2 HIS 17 HD2 HIS 17 -3.885 12.053 5.029 868 HE1 HIS 17 HE1 HIS 17 -3.925 16.292 4.905 869 H LYS 18 H LYS 18 -7.055 11.056 0.078 870 HA LYS 18 HA LYS 18 -8.382 13.460 -0.871 871 1HB LYS 18 HB2 LYS 18 -8.668 10.541 -1.682 872 2HB LYS 18 HB3 LYS 18 -9.603 11.865 -2.394 873 1HG LYS 18 HG2 LYS 18 -7.413 13.038 -2.932 874 2HG LYS 18 HG3 LYS 18 -6.584 11.541 -2.531 875 1HD LYS 18 HD2 LYS 18 -8.666 12.041 -4.715 876 2HD LYS 18 HD3 LYS 18 -6.956 11.660 -4.941 877 1HE LYS 18 HE2 LYS 18 -9.128 9.783 -3.884 878 2HE LYS 18 HE3 LYS 18 -8.309 9.695 -5.448 879 1HZ LYS 18 HZ1 LYS 18 -6.262 9.283 -4.286 880 2HZ LYS 18 HZ2 LYS 18 -7.037 9.377 -2.830 881 3HZ LYS 18 HZ3 LYS 18 -7.399 8.156 -3.880 882 H TYR 19 H TYR 19 -9.535 10.473 0.828 883 HA TYR 19 HA TYR 19 -12.225 11.422 1.005 884 1HB TYR 19 HB2 TYR 19 -10.652 9.250 2.312 885 2HB TYR 19 HB3 TYR 19 -12.030 9.870 3.215 886 HD1 TYR 19 HD1 TYR 19 -11.092 8.015 0.168 887 HD2 TYR 19 HD2 TYR 19 -14.302 9.861 2.369 888 HE1 TYR 19 HE1 TYR 19 -12.719 7.181 -1.494 889 HE2 TYR 19 HE2 TYR 19 -15.914 9.095 0.675 890 HH TYR 19 HH TYR 19 -16.196 8.031 -1.347 891 H SER 20 H SER 20 -9.465 11.853 3.292 892 HA SER 20 HA SER 20 -10.887 13.298 5.222 893 1HB SER 20 HB2 SER 20 -8.954 14.158 6.073 894 2HB SER 20 HB3 SER 20 -8.418 12.645 5.346 895 HG SER 20 HG SER 20 -7.803 14.054 3.483 896 H GLY 21 H GLY 21 -9.391 14.552 2.245 897 1HA GLY 21 HA2 GLY 21 -9.856 17.197 2.169 898 2HA GLY 21 HA3 GLY 21 -10.150 16.134 0.789 899 H LYS 22 H LYS 22 -12.496 14.759 1.947 900 HA LYS 22 HA LYS 22 -14.541 16.491 1.008 901 1HB LYS 22 HB2 LYS 22 -14.653 14.015 1.096 902 2HB LYS 22 HB3 LYS 22 -14.719 14.089 2.859 903 1HG LYS 22 HG2 LYS 22 -16.870 15.248 2.809 904 2HG LYS 22 HG3 LYS 22 -16.750 15.463 1.062 905 1HD LYS 22 HD2 LYS 22 -18.302 13.668 1.573 906 2HD LYS 22 HD3 LYS 22 -16.888 13.052 0.695 907 1HE LYS 22 HE2 LYS 22 -17.578 11.510 2.466 908 2HE LYS 22 HE3 LYS 22 -15.953 12.142 2.757 909 1HZ LYS 22 HZ1 LYS 22 -17.361 12.118 4.720 910 2HZ LYS 22 HZ2 LYS 22 -16.860 13.635 4.346 911 3HZ LYS 22 HZ3 LYS 22 -18.413 13.174 4.012 912 H GLU 23 H GLU 23 -13.394 15.773 4.308 913 HA GLU 23 HA GLU 23 -15.371 17.677 5.478 914 1HB GLU 23 HB2 GLU 23 -14.514 16.812 7.661 915 2HB GLU 23 HB3 GLU 23 -15.384 15.650 6.650 916 1HG GLU 23 HG2 GLU 23 -13.286 14.612 5.941 917 2HG GLU 23 HG3 GLU 23 -12.348 15.777 6.881 918 H GLY 24 H GLY 24 -11.895 17.073 5.121 919 1HA GLY 24 HA2 GLY 24 -11.073 19.677 4.699 920 2HA GLY 24 HA3 GLY 24 -10.899 19.392 6.452 921 H ASP 25 H ASP 25 -8.875 19.515 4.068 922 HA ASP 25 HA ASP 25 -7.779 16.873 3.782 923 1HB ASP 25 HB2 ASP 25 -7.396 18.684 2.159 924 2HB ASP 25 HB3 ASP 25 -6.491 19.604 3.375 925 H LYS 26 H LYS 26 -7.231 15.797 5.720 926 HA LYS 26 HA LYS 26 -4.962 16.743 7.222 927 1HB LYS 26 HB2 LYS 26 -6.173 16.837 9.450 928 2HB LYS 26 HB3 LYS 26 -6.409 18.225 8.393 929 1HG LYS 26 HG2 LYS 26 -8.591 17.569 7.794 930 2HG LYS 26 HG3 LYS 26 -8.400 15.929 8.439 931 1HD LYS 26 HD2 LYS 26 -8.267 16.891 10.737 932 2HD LYS 26 HD3 LYS 26 -8.462 18.522 10.059 933 1HE LYS 26 HE2 LYS 26 -10.681 17.908 9.150 934 2HE LYS 26 HE3 LYS 26 -10.480 16.244 9.721 935 1HZ LYS 26 HZ1 LYS 26 -11.814 17.516 11.201 936 2HZ LYS 26 HZ2 LYS 26 -10.419 17.058 11.950 937 3HZ LYS 26 HZ3 LYS 26 -10.608 18.616 11.438 938 H HIS 27 H HIS 27 -4.516 15.261 9.101 939 HA HIS 27 HA HIS 27 -4.461 12.642 7.964 940 1HB HIS 27 HB2 HIS 27 -3.502 13.584 10.679 941 2HB HIS 27 HB3 HIS 27 -2.969 12.142 9.818 942 HD1 HIS 27 HD1 HIS 27 -2.830 14.327 7.038 943 HD2 HIS 27 HD2 HIS 27 -0.756 14.089 10.704 944 HE1 HIS 27 HE1 HIS 27 -0.643 15.602 6.736 945 H THR 28 H THR 28 -7.250 13.292 8.679 946 HA THR 28 HA THR 28 -7.894 11.143 10.613 947 HB THR 28 HB THR 28 -9.427 12.746 11.793 948 HG1 THR 28 HG1 THR 28 -9.230 14.282 9.984 949 1HG2 THR 28 HG21 THR 28 -7.779 13.802 13.220 950 2HG2 THR 28 HG22 THR 28 -7.217 12.171 12.811 951 3HG2 THR 28 HG23 THR 28 -6.503 13.591 12.014 952 H LEU 29 H LEU 29 -9.722 10.088 9.976 953 HA LEU 29 HA LEU 29 -11.629 11.448 8.073 954 1HB LEU 29 HB2 LEU 29 -11.363 8.478 8.694 955 2HB LEU 29 HB3 LEU 29 -12.414 9.215 7.486 956 HG LEU 29 HG LEU 29 -9.382 9.201 7.414 957 1HD1 LEU 29 HD11 LEU 29 -10.311 6.938 7.133 958 2HD1 LEU 29 HD12 LEU 29 -11.431 7.538 5.890 959 3HD1 LEU 29 HD13 LEU 29 -9.681 7.535 5.586 960 1HD2 LEU 29 HD21 LEU 29 -11.410 10.039 5.327 961 2HD2 LEU 29 HD22 LEU 29 -10.291 11.121 6.195 962 3HD2 LEU 29 HD23 LEU 29 -9.660 9.907 5.072 963 H SER 30 H SER 30 -13.863 11.489 8.787 964 HA SER 30 HA SER 30 -14.318 10.761 11.615 965 1HB SER 30 HB2 SER 30 -16.666 11.466 11.087 966 2HB SER 30 HB3 SER 30 -15.454 12.724 10.798 967 HG SER 30 HG SER 30 -15.664 12.481 8.657 968 H LYS 31 H LYS 31 -15.859 9.107 12.263 969 HA LYS 31 HA LYS 31 -15.291 6.680 11.073 970 1HB LYS 31 HB2 LYS 31 -16.892 5.724 12.605 971 2HB LYS 31 HB3 LYS 31 -15.901 6.947 13.373 972 1HG LYS 31 HG2 LYS 31 -17.774 8.579 13.244 973 2HG LYS 31 HG3 LYS 31 -18.783 7.337 12.455 974 1HD LYS 31 HD2 LYS 31 -18.523 5.875 14.435 975 2HD LYS 31 HD3 LYS 31 -17.538 7.112 15.232 976 1HE LYS 31 HE2 LYS 31 -19.420 8.684 15.231 977 2HE LYS 31 HE3 LYS 31 -20.415 7.552 14.290 978 1HZ LYS 31 HZ1 LYS 31 -19.385 7.046 16.995 979 2HZ LYS 31 HZ2 LYS 31 -20.927 7.482 16.612 980 3HZ LYS 31 HZ3 LYS 31 -20.331 6.032 16.108 981 H LYS 32 H LYS 32 -18.235 8.656 10.489 982 HA LYS 32 HA LYS 32 -19.426 6.699 8.725 983 1HB LYS 32 HB2 LYS 32 -20.747 8.377 9.849 984 2HB LYS 32 HB3 LYS 32 -19.911 9.685 8.975 985 1HG LYS 32 HG2 LYS 32 -20.787 8.788 6.827 986 2HG LYS 32 HG3 LYS 32 -21.579 7.462 7.701 987 1HD LYS 32 HD2 LYS 32 -22.921 9.146 8.980 988 2HD LYS 32 HD3 LYS 32 -22.168 10.446 8.044 989 1HE LYS 32 HE2 LYS 32 -23.875 8.173 6.907 990 2HE LYS 32 HE3 LYS 32 -24.411 9.838 7.173 991 1HZ LYS 32 HZ1 LYS 32 -22.751 10.556 5.603 992 2HZ LYS 32 HZ2 LYS 32 -22.290 8.999 5.326 993 3HZ LYS 32 HZ3 LYS 32 -23.804 9.492 4.917 994 H GLU 33 H GLU 33 -17.119 9.407 8.247 995 HA GLU 33 HA GLU 33 -17.185 9.348 5.385 996 1HB GLU 33 HB2 GLU 33 -16.249 11.202 6.626 997 2HB GLU 33 HB3 GLU 33 -14.963 10.179 7.297 998 1HG GLU 33 HG2 GLU 33 -13.973 9.841 5.119 999 2HG GLU 33 HG3 GLU 33 -15.362 10.602 4.325 1000 H LEU 34 H LEU 34 -15.279 7.530 7.833 1001 HA LEU 34 HA LEU 34 -13.779 5.983 5.999 1002 1HB LEU 34 HB2 LEU 34 -13.223 5.915 8.283 1003 2HB LEU 34 HB3 LEU 34 -14.807 5.358 8.782 1004 HG LEU 34 HG LEU 34 -13.064 3.665 8.907 1005 1HD1 LEU 34 HD11 LEU 34 -14.365 1.842 8.319 1006 2HD1 LEU 34 HD12 LEU 34 -15.552 3.124 8.559 1007 3HD1 LEU 34 HD13 LEU 34 -15.083 2.636 6.925 1008 1HD2 LEU 34 HD21 LEU 34 -11.697 4.255 6.979 1009 2HD2 LEU 34 HD22 LEU 34 -12.208 2.564 6.829 1010 3HD2 LEU 34 HD23 LEU 34 -12.991 3.797 5.860 1011 H LYS 35 H LYS 35 -17.123 5.351 7.299 1012 HA LYS 35 HA LYS 35 -17.534 2.969 5.817 1013 1HB LYS 35 HB2 LYS 35 -19.648 5.090 6.357 1014 2HB LYS 35 HB3 LYS 35 -19.888 3.428 5.835 1015 1HG LYS 35 HG2 LYS 35 -18.834 2.623 7.980 1016 2HG LYS 35 HG3 LYS 35 -18.702 4.311 8.486 1017 1HD LYS 35 HD2 LYS 35 -20.721 3.532 9.473 1018 2HD LYS 35 HD3 LYS 35 -21.220 4.531 8.108 1019 1HE LYS 35 HE2 LYS 35 -21.517 2.386 6.750 1020 2HE LYS 35 HE3 LYS 35 -21.071 1.475 8.195 1021 1HZ LYS 35 HZ1 LYS 35 -23.364 3.301 7.906 1022 2HZ LYS 35 HZ2 LYS 35 -23.421 1.653 7.898 1023 3HZ LYS 35 HZ3 LYS 35 -22.990 2.457 9.273 1024 H GLU 36 H GLU 36 -17.894 6.372 4.778 1025 HA GLU 36 HA GLU 36 -18.889 5.771 2.180 1026 1HB GLU 36 HB2 GLU 36 -18.800 8.048 3.427 1027 2HB GLU 36 HB3 GLU 36 -17.152 8.193 2.802 1028 1HG GLU 36 HG2 GLU 36 -18.636 9.341 1.290 1029 2HG GLU 36 HG3 GLU 36 -18.078 7.876 0.468 1030 H LEU 37 H LEU 37 -15.551 6.268 3.364 1031 HA LEU 37 HA LEU 37 -14.117 5.923 0.964 1032 1HB LEU 37 HB2 LEU 37 -13.128 6.683 3.029 1033 2HB LEU 37 HB3 LEU 37 -13.377 5.134 3.812 1034 HG LEU 37 HG LEU 37 -11.645 5.345 1.338 1035 1HD1 LEU 37 HD11 LEU 37 -9.716 5.565 2.912 1036 2HD1 LEU 37 HD12 LEU 37 -10.786 6.969 2.970 1037 3HD1 LEU 37 HD13 LEU 37 -10.853 5.737 4.255 1038 1HD2 LEU 37 HD21 LEU 37 -12.138 3.015 2.015 1039 2HD2 LEU 37 HD22 LEU 37 -10.487 3.401 2.459 1040 3HD2 LEU 37 HD23 LEU 37 -11.745 3.392 3.707 1041 H ILE 38 H ILE 38 -15.166 3.447 3.323 1042 HA ILE 38 HA ILE 38 -14.215 1.221 1.823 1043 HB ILE 38 HB ILE 38 -16.372 1.559 3.938 1044 1HG1 ILE 38 HG12 ILE 38 -13.554 0.365 3.875 1045 2HG1 ILE 38 HG13 ILE 38 -14.030 1.915 4.580 1046 1HG2 ILE 38 HG21 ILE 38 -15.460 -1.079 2.727 1047 2HG2 ILE 38 HG22 ILE 38 -16.484 -0.890 4.162 1048 3HG2 ILE 38 HG23 ILE 38 -17.087 -0.385 2.597 1049 1HD1 ILE 38 HD11 ILE 38 -13.838 0.463 6.374 1050 2HD1 ILE 38 HD12 ILE 38 -15.598 0.557 6.110 1051 3HD1 ILE 38 HD13 ILE 38 -14.681 -0.864 5.545 1052 H GLN 39 H GLN 39 -17.514 2.694 1.897 1053 HA GLN 39 HA GLN 39 -18.572 0.837 0.024 1054 1HB GLN 39 HB2 GLN 39 -19.448 3.555 0.992 1055 2HB GLN 39 HB3 GLN 39 -20.344 2.717 -0.290 1056 1HG GLN 39 HG2 GLN 39 -20.791 0.817 1.036 1057 2HG GLN 39 HG3 GLN 39 -19.601 1.258 2.270 1058 1HE2 GLN 39 HE22 GLN 39 -19.976 3.253 3.470 1059 2HE2 GLN 39 HE21 GLN 39 -21.642 3.649 3.923 1060 H LYS 40 H LYS 40 -16.713 3.813 -0.557 1061 HA LYS 40 HA LYS 40 -17.159 3.608 -3.431 1062 1HB LYS 40 HB2 LYS 40 -16.620 5.747 -2.400 1063 2HB LYS 40 HB3 LYS 40 -15.095 5.114 -1.785 1064 1HG LYS 40 HG2 LYS 40 -14.775 6.530 -3.777 1065 2HG LYS 40 HG3 LYS 40 -14.172 4.895 -4.014 1066 1HD LYS 40 HD2 LYS 40 -15.311 5.731 -6.009 1067 2HD LYS 40 HD3 LYS 40 -16.148 4.315 -5.378 1068 1HE LYS 40 HE2 LYS 40 -17.869 5.785 -4.335 1069 2HE LYS 40 HE3 LYS 40 -16.975 7.221 -4.873 1070 1HZ LYS 40 HZ1 LYS 40 -18.785 6.686 -6.317 1071 2HZ LYS 40 HZ2 LYS 40 -17.358 6.522 -7.125 1072 3HZ LYS 40 HZ3 LYS 40 -18.177 5.185 -6.615 1073 H GLU 41 H GLU 41 -14.276 2.978 -1.377 1074 HA GLU 41 HA GLU 41 -12.789 1.982 -3.589 1075 1HB GLU 41 HB2 GLU 41 -11.663 2.953 -1.688 1076 2HB GLU 41 HB3 GLU 41 -12.367 1.767 -0.582 1077 1HG GLU 41 HG2 GLU 41 -10.011 1.274 -1.057 1078 2HG GLU 41 HG3 GLU 41 -11.058 -0.040 -1.560 1079 H LEU 42 H LEU 42 -14.376 0.243 -0.881 1080 HA LEU 42 HA LEU 42 -13.528 -2.358 -2.082 1081 1HB LEU 42 HB2 LEU 42 -14.838 -1.739 0.586 1082 2HB LEU 42 HB3 LEU 42 -14.330 -3.333 0.030 1083 HG LEU 42 HG LEU 42 -12.470 -0.969 0.565 1084 1HD1 LEU 42 HD11 LEU 42 -13.386 -1.974 2.625 1085 2HD1 LEU 42 HD12 LEU 42 -12.888 -3.586 2.074 1086 3HD1 LEU 42 HD13 LEU 42 -11.668 -2.351 2.450 1087 1HD2 LEU 42 HD21 LEU 42 -11.487 -2.351 -1.202 1088 2HD2 LEU 42 HD22 LEU 42 -10.650 -2.688 0.310 1089 3HD2 LEU 42 HD23 LEU 42 -11.859 -3.836 -0.299 1090 H THR 43 H THR 43 -16.404 -0.490 -1.242 1091 HA THR 43 HA THR 43 -18.542 -0.615 -1.825 1092 HB THR 43 HB THR 43 -19.356 -1.518 -3.790 1093 HG1 THR 43 HG1 THR 43 -17.194 -3.327 -3.750 1094 1HG2 THR 43 HG21 THR 43 -17.793 -0.921 -5.538 1095 2HG2 THR 43 HG22 THR 43 -17.684 0.248 -4.212 1096 3HG2 THR 43 HG23 THR 43 -16.427 -0.985 -4.416 1097 H ILE 44 H ILE 44 -20.383 -2.469 -2.122 1098 HA ILE 44 HA ILE 44 -19.910 -4.630 -0.171 1099 HB ILE 44 HB ILE 44 -22.212 -2.688 0.247 1100 1HG1 ILE 44 HG12 ILE 44 -19.680 -2.834 1.932 1101 2HG1 ILE 44 HG13 ILE 44 -20.072 -1.524 0.806 1102 1HG2 ILE 44 HG21 ILE 44 -22.413 -5.135 0.965 1103 2HG2 ILE 44 HG22 ILE 44 -21.071 -4.846 2.076 1104 3HG2 ILE 44 HG23 ILE 44 -22.608 -3.978 2.269 1105 1HD1 ILE 44 HD11 ILE 44 -21.724 -2.237 3.248 1106 2HD1 ILE 44 HD12 ILE 44 -20.657 -0.843 3.036 1107 3HD1 ILE 44 HD13 ILE 44 -22.124 -0.994 2.049 1108 H GLY 45 H GLY 45 -22.488 -2.917 -1.913 1109 1HA GLY 45 HA2 GLY 45 -24.118 -3.674 -3.384 1110 2HA GLY 45 HA3 GLY 45 -23.322 -5.256 -3.475 1111 H SER 46 H SER 46 -23.365 -6.487 -1.299 1112 HA SER 46 HA SER 46 -26.084 -6.887 -0.427 1113 1HB SER 46 HB2 SER 46 -23.461 -7.955 0.697 1114 2HB SER 46 HB3 SER 46 -25.085 -8.625 0.968 1115 HG SER 46 HG SER 46 -23.920 -9.682 -0.749 1116 H LYS 47 H LYS 47 -26.269 -4.495 0.215 1117 HA LYS 47 HA LYS 47 -25.018 -3.311 2.374 1118 1HB LYS 47 HB2 LYS 47 -27.949 -3.079 1.593 1119 2HB LYS 47 HB3 LYS 47 -27.103 -1.969 2.674 1120 1HG LYS 47 HG2 LYS 47 -26.456 -2.403 -0.278 1121 2HG LYS 47 HG3 LYS 47 -27.305 -1.036 0.442 1122 1HD LYS 47 HD2 LYS 47 -25.231 -0.546 1.826 1123 2HD LYS 47 HD3 LYS 47 -24.387 -1.796 0.886 1124 1HE LYS 47 HE2 LYS 47 -24.922 -0.553 -1.211 1125 2HE LYS 47 HE3 LYS 47 -25.688 0.721 -0.241 1126 1HZ LYS 47 HZ1 LYS 47 -23.449 1.266 -0.806 1127 2HZ LYS 47 HZ2 LYS 47 -23.573 1.095 0.827 1128 3HZ LYS 47 HZ3 LYS 47 -22.872 -0.092 -0.076 1129 H LEU 48 H LEU 48 -27.197 -5.995 2.658 1130 HA LEU 48 HA LEU 48 -28.008 -5.890 5.337 1131 1HB LEU 48 HB2 LEU 48 -26.929 -8.222 3.686 1132 2HB LEU 48 HB3 LEU 48 -27.661 -8.398 5.275 1133 HG LEU 48 HG LEU 48 -29.228 -9.020 3.612 1134 1HD1 LEU 48 HD11 LEU 48 -30.145 -6.346 4.742 1135 2HD1 LEU 48 HD12 LEU 48 -31.150 -7.721 4.260 1136 3HD1 LEU 48 HD13 LEU 48 -30.068 -7.870 5.657 1137 1HD2 LEU 48 HD21 LEU 48 -30.135 -7.658 1.891 1138 2HD2 LEU 48 HD22 LEU 48 -29.249 -6.226 2.420 1139 3HD2 LEU 48 HD23 LEU 48 -28.373 -7.614 1.715 1140 H GLN 49 H GLN 49 -24.780 -6.494 4.019 1141 HA GLN 49 HA GLN 49 -23.647 -7.358 6.538 1142 1HB GLN 49 HB2 GLN 49 -22.190 -6.250 4.107 1143 2HB GLN 49 HB3 GLN 49 -21.512 -7.230 5.411 1144 1HG GLN 49 HG2 GLN 49 -23.441 -8.102 3.232 1145 2HG GLN 49 HG3 GLN 49 -21.815 -8.693 3.549 1146 1HE2 GLN 49 HE22 GLN 49 -21.644 -9.540 6.034 1147 2HE2 GLN 49 HE21 GLN 49 -22.945 -10.653 6.441 1148 H ASP 50 H ASP 50 -24.777 -4.285 5.768 1149 HA ASP 50 HA ASP 50 -22.844 -2.498 6.523 1150 1HB ASP 50 HB2 ASP 50 -25.072 -1.829 5.795 1151 2HB ASP 50 HB3 ASP 50 -25.785 -2.453 7.296 1152 H ALA 51 H ALA 51 -24.733 -4.581 8.724 1153 HA ALA 51 HA ALA 51 -23.940 -3.570 11.226 1154 1HB ALA 51 HB1 ALA 51 -24.279 -5.872 12.038 1155 2HB ALA 51 HB2 ALA 51 -25.576 -5.374 10.933 1156 3HB ALA 51 HB3 ALA 51 -24.298 -6.471 10.365 1157 H GLU 52 H GLU 52 -22.176 -5.806 9.035 1158 HA GLU 52 HA GLU 52 -19.946 -6.215 10.850 1159 1HB GLU 52 HB2 GLU 52 -20.095 -6.617 7.829 1160 2HB GLU 52 HB3 GLU 52 -18.841 -7.209 8.923 1161 1HG GLU 52 HG2 GLU 52 -20.583 -8.540 10.154 1162 2HG GLU 52 HG3 GLU 52 -21.779 -8.050 8.940 1163 H ILE 53 H ILE 53 -20.723 -4.043 8.112 1164 HA ILE 53 HA ILE 53 -18.169 -2.780 8.007 1165 HB ILE 53 HB ILE 53 -20.831 -1.481 7.353 1166 1HG1 ILE 53 HG12 ILE 53 -20.656 -3.532 6.053 1167 2HG1 ILE 53 HG13 ILE 53 -20.381 -2.125 5.041 1168 1HG2 ILE 53 HG21 ILE 53 -17.980 -0.790 6.557 1169 2HG2 ILE 53 HG22 ILE 53 -19.439 -0.089 5.825 1170 3HG2 ILE 53 HG23 ILE 53 -19.090 0.177 7.535 1171 1HD1 ILE 53 HD11 ILE 53 -18.843 -3.916 4.460 1172 2HD1 ILE 53 HD12 ILE 53 -17.933 -2.543 5.113 1173 3HD1 ILE 53 HD13 ILE 53 -18.220 -3.990 6.114 1174 H VAL 54 H VAL 54 -21.062 -1.928 10.029 1175 HA VAL 54 HA VAL 54 -19.606 0.280 11.170 1176 HB VAL 54 HB VAL 54 -21.348 0.413 12.895 1177 1HG1 VAL 54 HG11 VAL 54 -22.991 1.308 11.313 1178 2HG1 VAL 54 HG12 VAL 54 -21.341 1.690 10.788 1179 3HG1 VAL 54 HG13 VAL 54 -22.244 0.376 9.996 1180 1HG2 VAL 54 HG21 VAL 54 -23.412 -0.787 12.689 1181 2HG2 VAL 54 HG22 VAL 54 -22.788 -1.714 11.322 1182 3HG2 VAL 54 HG23 VAL 54 -22.100 -1.950 12.948 1183 H LYS 55 H LYS 55 -19.926 -3.147 12.168 1184 HA LYS 55 HA LYS 55 -18.538 -2.814 14.633 1185 1HB LYS 55 HB2 LYS 55 -19.650 -4.900 14.029 1186 2HB LYS 55 HB3 LYS 55 -18.543 -5.150 12.677 1187 1HG LYS 55 HG2 LYS 55 -17.994 -6.565 14.580 1188 2HG LYS 55 HG3 LYS 55 -16.656 -5.479 14.195 1189 1HD LYS 55 HD2 LYS 55 -17.215 -4.006 16.059 1190 2HD LYS 55 HD3 LYS 55 -18.691 -4.926 16.414 1191 1HE LYS 55 HE2 LYS 55 -15.830 -6.006 16.576 1192 2HE LYS 55 HE3 LYS 55 -16.773 -5.410 17.950 1193 1HZ LYS 55 HZ1 LYS 55 -18.382 -7.127 17.515 1194 2HZ LYS 55 HZ2 LYS 55 -17.477 -7.707 16.264 1195 3HZ LYS 55 HZ3 LYS 55 -16.889 -7.762 17.801 1196 H LEU 56 H LEU 56 -17.285 -3.529 11.354 1197 HA LEU 56 HA LEU 56 -14.527 -3.387 11.924 1198 1HB LEU 56 HB2 LEU 56 -15.274 -4.366 9.939 1199 2HB LEU 56 HB3 LEU 56 -16.185 -2.950 9.432 1200 HG LEU 56 HG LEU 56 -13.257 -2.499 9.803 1201 1HD1 LEU 56 HD11 LEU 56 -14.300 -4.150 7.473 1202 2HD1 LEU 56 HD12 LEU 56 -12.670 -3.458 7.631 1203 3HD1 LEU 56 HD13 LEU 56 -13.204 -4.724 8.751 1204 1HD2 LEU 56 HD21 LEU 56 -14.840 -0.750 8.913 1205 2HD2 LEU 56 HD22 LEU 56 -13.582 -1.221 7.756 1206 3HD2 LEU 56 HD23 LEU 56 -15.245 -1.841 7.583 1207 H MET 57 H MET 57 -16.799 -0.782 10.998 1208 HA MET 57 HA MET 57 -14.993 1.376 10.845 1209 1HB MET 57 HB2 MET 57 -17.388 1.469 10.143 1210 2HB MET 57 HB3 MET 57 -17.846 1.292 11.841 1211 1HG MET 57 HG2 MET 57 -16.584 3.473 12.289 1212 2HG MET 57 HG3 MET 57 -16.549 3.665 10.540 1213 1HE MET 57 HE1 MET 57 -20.308 3.798 13.236 1214 2HE MET 57 HE2 MET 57 -19.515 2.245 12.928 1215 3HE MET 57 HE3 MET 57 -18.643 3.525 13.801 1216 H ASP 58 H ASP 58 -16.910 0.146 13.658 1217 HA ASP 58 HA ASP 58 -15.818 1.892 15.599 1218 1HB ASP 58 HB2 ASP 58 -17.754 0.476 16.059 1219 2HB ASP 58 HB3 ASP 58 -16.750 -0.980 15.967 1220 H ASP 59 H ASP 59 -14.701 -1.379 14.562 1221 HA ASP 59 HA ASP 59 -12.418 -1.370 16.232 1222 1HB ASP 59 HB2 ASP 59 -13.016 -2.878 13.657 1223 2HB ASP 59 HB3 ASP 59 -11.499 -3.071 14.540 1224 H LEU 60 H LEU 60 -12.841 0.192 13.114 1225 HA LEU 60 HA LEU 60 -10.017 0.919 12.899 1226 1HB LEU 60 HB2 LEU 60 -12.599 1.677 11.514 1227 2HB LEU 60 HB3 LEU 60 -11.240 2.783 11.376 1228 HG LEU 60 HG LEU 60 -10.736 -0.122 10.868 1229 1HD1 LEU 60 HD11 LEU 60 -11.988 1.685 8.798 1230 2HD1 LEU 60 HD12 LEU 60 -11.334 0.073 8.496 1231 3HD1 LEU 60 HD13 LEU 60 -12.759 0.267 9.547 1232 1HD2 LEU 60 HD21 LEU 60 -9.821 2.474 9.502 1233 2HD2 LEU 60 HD22 LEU 60 -8.911 1.649 10.785 1234 3HD2 LEU 60 HD23 LEU 60 -9.156 0.882 9.188 1235 H ASP 61 H ASP 61 -12.930 2.797 13.836 1236 HA ASP 61 HA ASP 61 -11.309 5.059 14.457 1237 1HB ASP 61 HB2 ASP 61 -13.288 6.132 15.274 1238 2HB ASP 61 HB3 ASP 61 -13.576 5.357 13.717 1239 H ARG 62 H ARG 62 -12.345 2.372 16.526 1240 HA ARG 62 HA ARG 62 -12.319 3.769 18.949 1241 1HB ARG 62 HB2 ARG 62 -12.176 1.660 20.080 1242 2HB ARG 62 HB3 ARG 62 -13.265 1.517 18.696 1243 1HG ARG 62 HG2 ARG 62 -11.489 0.382 17.405 1244 2HG ARG 62 HG3 ARG 62 -10.347 0.636 18.721 1245 1HD ARG 62 HD2 ARG 62 -11.498 -0.880 20.192 1246 2HD ARG 62 HD3 ARG 62 -12.916 -0.908 19.134 1247 HE ARG 62 HE ARG 62 -12.028 -2.680 18.088 1248 1HH1 ARG 62 HH12 ARG 62 -9.246 -0.887 19.290 1249 2HH1 ARG 62 HH11 ARG 62 -8.146 -1.473 18.081 1250 1HH2 ARG 62 HH22 ARG 62 -10.615 -3.764 16.812 1251 2HH2 ARG 62 HH21 ARG 62 -8.894 -3.415 16.822 1252 H ASN 63 H ASN 63 -9.609 2.523 17.116 1253 HA ASN 63 HA ASN 63 -7.661 2.508 19.195 1254 1HB ASN 63 HB2 ASN 63 -7.132 3.091 16.270 1255 2HB ASN 63 HB3 ASN 63 -6.001 2.428 17.461 1256 1HD2 ASN 63 HD22 ASN 63 -8.663 1.769 15.266 1257 2HD2 ASN 63 HD21 ASN 63 -8.798 0.060 15.560 1258 H LYS 64 H LYS 64 -9.175 5.141 17.486 1259 HA LYS 64 HA LYS 64 -7.271 7.114 18.675 1260 1HB LYS 64 HB2 LYS 64 -7.326 7.355 16.306 1261 2HB LYS 64 HB3 LYS 64 -9.077 7.204 16.261 1262 1HG LYS 64 HG2 LYS 64 -8.345 9.520 15.906 1263 2HG LYS 64 HG3 LYS 64 -9.357 9.374 17.336 1264 1HD LYS 64 HD2 LYS 64 -7.417 9.505 18.820 1265 2HD LYS 64 HD3 LYS 64 -6.302 9.375 17.447 1266 1HE LYS 64 HE2 LYS 64 -6.503 11.692 18.308 1267 2HE LYS 64 HE3 LYS 64 -6.998 11.570 16.612 1268 1HZ LYS 64 HZ1 LYS 64 -8.880 11.549 18.873 1269 2HZ LYS 64 HZ2 LYS 64 -8.482 12.891 17.993 1270 3HZ LYS 64 HZ3 LYS 64 -9.240 11.627 17.266 1271 H ASP 65 H ASP 65 -10.692 6.766 17.820 1272 HA ASP 65 HA ASP 65 -11.785 6.689 20.302 1273 1HB ASP 65 HB2 ASP 65 -12.808 9.061 20.531 1274 2HB ASP 65 HB3 ASP 65 -11.201 8.727 21.147 1275 H GLN 66 H GLN 66 -12.940 9.027 17.922 1276 HA GLN 66 HA GLN 66 -14.937 7.091 16.844 1277 1HB GLN 66 HB2 GLN 66 -15.549 9.798 18.093 1278 2HB GLN 66 HB3 GLN 66 -16.695 8.904 17.089 1279 1HG GLN 66 HG2 GLN 66 -15.538 7.808 19.694 1280 2HG GLN 66 HG3 GLN 66 -17.076 8.645 19.527 1281 1HE2 GLN 66 HE22 GLN 66 -15.331 5.644 18.608 1282 2HE2 GLN 66 HE21 GLN 66 -16.787 4.756 18.217 1283 H GLU 67 H GLU 67 -12.407 8.571 15.972 1284 HA GLU 67 HA GLU 67 -13.384 9.108 13.272 1285 1HB GLU 67 HB2 GLU 67 -11.587 10.907 13.097 1286 2HB GLU 67 HB3 GLU 67 -13.064 11.392 13.936 1287 1HG GLU 67 HG2 GLU 67 -12.016 11.380 16.050 1288 2HG GLU 67 HG3 GLU 67 -10.662 10.382 15.491 1289 H VAL 68 H VAL 68 -11.637 8.491 11.806 1290 HA VAL 68 HA VAL 68 -9.780 6.505 13.035 1291 HB VAL 68 HB VAL 68 -10.366 6.894 10.084 1292 1HG1 VAL 68 HG11 VAL 68 -8.297 5.654 10.834 1293 2HG1 VAL 68 HG12 VAL 68 -9.343 4.507 11.689 1294 3HG1 VAL 68 HG13 VAL 68 -9.451 4.665 9.921 1295 1HG2 VAL 68 HG21 VAL 68 -11.875 4.935 10.304 1296 2HG2 VAL 68 HG22 VAL 68 -11.791 5.079 12.068 1297 3HG2 VAL 68 HG23 VAL 68 -12.529 6.372 11.095 1298 H ASN 69 H ASN 69 -7.928 7.554 13.652 1299 HA ASN 69 HA ASN 69 -6.892 9.807 12.089 1300 1HB ASN 69 HB2 ASN 69 -6.606 9.901 14.467 1301 2HB ASN 69 HB3 ASN 69 -5.795 8.332 14.504 1302 1HD2 ASN 69 HD22 ASN 69 -3.533 8.301 14.141 1303 2HD2 ASN 69 HD21 ASN 69 -2.624 9.752 13.723 1304 H PHE 70 H PHE 70 -4.989 9.788 10.913 1305 HA PHE 70 HA PHE 70 -4.825 7.929 8.980 1306 1HB PHE 70 HB2 PHE 70 -3.863 10.111 8.782 1307 2HB PHE 70 HB3 PHE 70 -2.666 9.768 10.036 1308 HD1 PHE 70 HD1 PHE 70 -0.524 9.021 9.381 1309 HD2 PHE 70 HD2 PHE 70 -3.881 8.435 6.733 1310 HE1 PHE 70 HE1 PHE 70 0.922 7.803 7.815 1311 HE2 PHE 70 HE2 PHE 70 -2.431 7.174 5.178 1312 HZ PHE 70 HZ PHE 70 -0.045 6.772 5.771 1313 H GLN 71 H GLN 71 -2.389 7.882 11.683 1314 HA GLN 71 HA GLN 71 -1.158 5.572 10.577 1315 1HB GLN 71 HB2 GLN 71 -0.074 7.060 12.254 1316 2HB GLN 71 HB3 GLN 71 -1.107 6.351 13.518 1317 1HG GLN 71 HG2 GLN 71 -0.174 4.102 13.017 1318 2HG GLN 71 HG3 GLN 71 0.757 4.776 11.668 1319 1HE2 GLN 71 HE22 GLN 71 2.577 3.685 12.810 1320 2HE2 GLN 71 HE21 GLN 71 3.314 4.546 14.158 1321 H GLU 72 H GLU 72 -3.901 5.912 12.822 1322 HA GLU 72 HA GLU 72 -4.061 3.142 13.550 1323 1HB GLU 72 HB2 GLU 72 -6.057 5.434 13.656 1324 2HB GLU 72 HB3 GLU 72 -6.451 3.788 14.134 1325 1HG GLU 72 HG2 GLU 72 -5.773 5.164 16.081 1326 2HG GLU 72 HG3 GLU 72 -4.713 3.769 15.837 1327 H TYR 73 H TYR 73 -5.545 5.083 10.924 1328 HA TYR 73 HA TYR 73 -7.052 3.003 9.689 1329 1HB TYR 73 HB2 TYR 73 -7.408 5.118 8.811 1330 2HB TYR 73 HB3 TYR 73 -5.716 5.512 8.696 1331 HD1 TYR 73 HD1 TYR 73 -4.422 5.047 6.730 1332 HD2 TYR 73 HD2 TYR 73 -8.500 3.680 7.087 1333 HE1 TYR 73 HE1 TYR 73 -4.525 4.700 4.285 1334 HE2 TYR 73 HE2 TYR 73 -8.619 3.408 4.631 1335 HH TYR 73 HH TYR 73 -7.455 3.499 2.636 1336 H ILE 74 H ILE 74 -3.622 3.960 9.074 1337 HA ILE 74 HA ILE 74 -3.080 1.850 7.258 1338 HB ILE 74 HB ILE 74 -1.169 3.202 9.199 1339 1HG1 ILE 74 HG12 ILE 74 -2.308 4.791 7.617 1340 2HG1 ILE 74 HG13 ILE 74 -0.566 4.724 7.516 1341 1HG2 ILE 74 HG21 ILE 74 -0.072 1.242 8.494 1342 2HG2 ILE 74 HG22 ILE 74 -0.694 1.362 6.835 1343 3HG2 ILE 74 HG23 ILE 74 0.545 2.486 7.409 1344 1HD1 ILE 74 HD11 ILE 74 -1.545 4.862 5.289 1345 2HD1 ILE 74 HD12 ILE 74 -0.699 3.330 5.469 1346 3HD1 ILE 74 HD13 ILE 74 -2.483 3.390 5.579 1347 H THR 75 H THR 75 -2.566 1.949 10.788 1348 HA THR 75 HA THR 75 -1.501 -0.608 11.189 1349 HB THR 75 HB THR 75 -3.385 0.943 13.022 1350 HG1 THR 75 HG1 THR 75 -1.580 2.151 12.435 1351 1HG2 THR 75 HG21 THR 75 -3.107 -1.353 13.837 1352 2HG2 THR 75 HG22 THR 75 -1.350 -1.236 13.626 1353 3HG2 THR 75 HG23 THR 75 -2.164 -0.235 14.838 1354 H PHE 76 H PHE 76 -4.969 0.402 11.206 1355 HA PHE 76 HA PHE 76 -5.994 -2.208 11.691 1356 1HB PHE 76 HB2 PHE 76 -7.333 -0.169 11.999 1357 2HB PHE 76 HB3 PHE 76 -7.267 0.121 10.258 1358 HD1 PHE 76 HD1 PHE 76 -8.648 -2.083 12.927 1359 HD2 PHE 76 HD2 PHE 76 -8.605 -1.292 8.674 1360 HE1 PHE 76 HE1 PHE 76 -10.416 -3.784 12.562 1361 HE2 PHE 76 HE2 PHE 76 -10.497 -2.802 8.373 1362 HZ PHE 76 HZ PHE 76 -11.330 -4.166 10.279 1363 H LEU 77 H LEU 77 -5.320 -0.456 8.565 1364 HA LEU 77 HA LEU 77 -6.244 -2.627 6.932 1365 1HB LEU 77 HB2 LEU 77 -4.139 -0.490 6.463 1366 2HB LEU 77 HB3 LEU 77 -4.554 -1.697 5.244 1367 HG LEU 77 HG LEU 77 -6.634 0.141 6.517 1368 1HD1 LEU 77 HD11 LEU 77 -6.510 1.375 4.368 1369 2HD1 LEU 77 HD12 LEU 77 -5.031 1.534 5.340 1370 3HD1 LEU 77 HD13 LEU 77 -5.065 0.452 3.922 1371 1HD2 LEU 77 HD21 LEU 77 -7.632 -1.863 5.454 1372 2HD2 LEU 77 HD22 LEU 77 -7.920 -0.443 4.452 1373 3HD2 LEU 77 HD23 LEU 77 -6.645 -1.591 4.000 1374 H GLY 78 H GLY 78 -3.155 -2.091 8.615 1375 1HA GLY 78 HA2 GLY 78 -1.842 -4.453 7.759 1376 2HA GLY 78 HA3 GLY 78 -1.620 -3.664 9.335 1377 H ALA 79 H ALA 79 -4.084 -3.975 10.555 1378 HA ALA 79 HA ALA 79 -4.096 -6.669 11.407 1379 1HB ALA 79 HB1 ALA 79 -6.467 -4.746 11.537 1380 2HB ALA 79 HB2 ALA 79 -6.175 -6.168 12.546 1381 3HB ALA 79 HB3 ALA 79 -5.112 -4.757 12.682 1382 H LEU 80 H LEU 80 -6.239 -5.045 9.072 1383 HA LEU 80 HA LEU 80 -7.889 -7.183 8.341 1384 1HB LEU 80 HB2 LEU 80 -7.906 -4.619 7.707 1385 2HB LEU 80 HB3 LEU 80 -6.855 -5.106 6.385 1386 HG LEU 80 HG LEU 80 -8.711 -6.820 5.795 1387 1HD1 LEU 80 HD11 LEU 80 -10.995 -6.116 6.478 1388 2HD1 LEU 80 HD12 LEU 80 -10.049 -6.593 7.901 1389 3HD1 LEU 80 HD13 LEU 80 -10.305 -4.875 7.534 1390 1HD2 LEU 80 HD21 LEU 80 -9.248 -3.825 5.562 1391 2HD2 LEU 80 HD22 LEU 80 -8.204 -4.774 4.475 1392 3HD2 LEU 80 HD23 LEU 80 -9.949 -5.087 4.526 1393 H ALA 81 H ALA 81 -4.763 -6.126 6.965 1394 HA ALA 81 HA ALA 81 -4.451 -8.158 5.007 1395 1HB ALA 81 HB1 ALA 81 -2.045 -7.572 5.181 1396 2HB ALA 81 HB2 ALA 81 -3.134 -6.184 4.917 1397 3HB ALA 81 HB3 ALA 81 -2.439 -6.472 6.513 1398 H MET 82 H MET 82 -3.466 -8.043 8.466 1399 HA MET 82 HA MET 82 -2.115 -10.551 8.452 1400 1HB MET 82 HB2 MET 82 -1.906 -8.675 10.140 1401 2HB MET 82 HB3 MET 82 -3.426 -9.227 10.855 1402 1HG MET 82 HG2 MET 82 -2.441 -11.400 11.359 1403 2HG MET 82 HG3 MET 82 -0.981 -11.000 10.441 1404 1HE MET 82 HE1 MET 82 0.543 -11.797 12.442 1405 2HE MET 82 HE2 MET 82 0.338 -11.213 14.112 1406 3HE MET 82 HE3 MET 82 -0.930 -12.208 13.359 1407 H ILE 83 H ILE 83 -5.480 -9.642 9.147 1408 HA ILE 83 HA ILE 83 -6.440 -12.262 9.815 1409 HB ILE 83 HB ILE 83 -7.804 -9.788 8.699 1410 1HG1 ILE 83 HG12 ILE 83 -8.057 -11.102 11.437 1411 2HG1 ILE 83 HG13 ILE 83 -6.824 -9.892 11.096 1412 1HG2 ILE 83 HG21 ILE 83 -9.963 -10.914 9.261 1413 2HG2 ILE 83 HG22 ILE 83 -9.120 -11.718 7.946 1414 3HG2 ILE 83 HG23 ILE 83 -9.074 -12.416 9.579 1415 1HD1 ILE 83 HD11 ILE 83 -8.576 -8.254 10.453 1416 2HD1 ILE 83 HD12 ILE 83 -9.825 -9.431 10.923 1417 3HD1 ILE 83 HD13 ILE 83 -8.698 -8.804 12.134 1418 H TYR 84 H TYR 84 -6.084 -10.517 6.686 1419 HA TYR 84 HA TYR 84 -6.821 -12.865 5.109 1420 1HB TYR 84 HB2 TYR 84 -5.252 -10.415 4.270 1421 2HB TYR 84 HB3 TYR 84 -6.050 -11.575 3.215 1422 HD1 TYR 84 HD1 TYR 84 -6.354 -8.597 3.081 1423 HD2 TYR 84 HD2 TYR 84 -8.684 -11.591 5.145 1424 HE1 TYR 84 HE1 TYR 84 -8.380 -7.184 2.871 1425 HE2 TYR 84 HE2 TYR 84 -10.674 -10.164 4.970 1426 HH TYR 84 HH TYR 84 -11.546 -8.182 4.192 1427 H ASN 85 H ASN 85 -5.222 -13.969 6.853 1428 HA ASN 85 HA ASN 85 -2.482 -14.162 6.543 1429 1HB ASN 85 HB2 ASN 85 -3.610 -15.399 8.251 1430 2HB ASN 85 HB3 ASN 85 -4.595 -16.268 7.066 1431 1HD2 ASN 85 HD22 ASN 85 -1.162 -15.924 8.254 1432 2HD2 ASN 85 HD21 ASN 85 -0.748 -17.548 7.737 1433 H GLU 86 H GLU 86 -4.982 -15.565 4.455 1434 HA GLU 86 HA GLU 86 -3.493 -17.160 2.734 1435 1HB GLU 86 HB2 GLU 86 -5.947 -16.894 2.756 1436 2HB GLU 86 HB3 GLU 86 -5.806 -15.292 2.024 1437 1HG GLU 86 HG2 GLU 86 -4.782 -17.879 0.746 1438 2HG GLU 86 HG3 GLU 86 -6.399 -17.221 0.473 1439 H ALA 87 H ALA 87 -3.823 -13.566 2.667 1440 HA ALA 87 HA ALA 87 -2.473 -13.226 0.143 1441 1HB ALA 87 HB1 ALA 87 -3.998 -11.537 1.129 1442 2HB ALA 87 HB2 ALA 87 -2.828 -11.253 2.439 1443 3HB ALA 87 HB3 ALA 87 -2.395 -10.871 0.762 1444 H LEU 88 H LEU 88 -1.443 -13.269 3.548 1445 HA LEU 88 HA LEU 88 1.311 -12.525 3.047 1446 1HB LEU 88 HB2 LEU 88 -0.154 -13.825 5.361 1447 2HB LEU 88 HB3 LEU 88 1.588 -13.562 5.392 1448 HG LEU 88 HG LEU 88 -0.173 -11.232 4.649 1449 1HD1 LEU 88 HD11 LEU 88 -1.316 -12.090 6.620 1450 2HD1 LEU 88 HD12 LEU 88 0.221 -12.149 7.517 1451 3HD1 LEU 88 HD13 LEU 88 -0.436 -10.592 6.976 1452 1HD2 LEU 88 HD21 LEU 88 2.418 -11.200 4.699 1453 2HD2 LEU 88 HD22 LEU 88 1.586 -9.947 5.635 1454 3HD2 LEU 88 HD23 LEU 88 2.274 -11.354 6.461 1455 H LYS 89 H LYS 89 -0.325 -15.688 3.521 1456 HA LYS 89 HA LYS 89 1.969 -17.318 3.112 1457 1HB LYS 89 HB2 LYS 89 -0.991 -17.723 2.561 1458 2HB LYS 89 HB3 LYS 89 0.181 -19.010 2.309 1459 1HG LYS 89 HG2 LYS 89 0.314 -17.666 4.994 1460 2HG LYS 89 HG3 LYS 89 -1.169 -18.541 4.643 1461 1HD LYS 89 HD2 LYS 89 0.398 -20.029 5.770 1462 2HD LYS 89 HD3 LYS 89 0.021 -20.592 4.144 1463 1HE LYS 89 HE2 LYS 89 2.388 -20.914 4.571 1464 2HE LYS 89 HE3 LYS 89 2.210 -19.684 3.322 1465 1HZ LYS 89 HZ1 LYS 89 2.764 -19.226 6.174 1466 2HZ LYS 89 HZ2 LYS 89 3.812 -19.035 4.912 1467 3HZ LYS 89 HZ3 LYS 89 2.513 -18.033 5.063 1468 H GLY 90 H GLY 90 -0.412 -16.051 0.741 1469 1HA GLY 90 HA2 GLY 90 -0.278 -15.747 -1.516 1470 2HA GLY 90 HA3 GLY 90 1.483 -15.667 -1.335 Start of MODEL 3 1 1H MET 1 H1 MET 1 -14.238 0.793 -5.569 2 2H MET 1 H2 MET 1 -14.713 0.800 -7.154 3 3H MET 1 H3 MET 1 -13.170 1.245 -6.736 4 HA MET 1 HA MET 1 -14.289 -1.410 -6.321 5 1HB MET 1 HB2 MET 1 -12.475 -0.394 -8.552 6 2HB MET 1 HB3 MET 1 -12.701 -2.104 -8.156 7 1HG MET 1 HG2 MET 1 -14.170 -1.631 -9.952 8 2HG MET 1 HG3 MET 1 -15.159 -1.846 -8.505 9 1HE MET 1 HE1 MET 1 -16.357 -0.741 -11.159 10 2HE MET 1 HE2 MET 1 -17.280 -0.872 -9.639 11 3HE MET 1 HE3 MET 1 -17.302 0.646 -10.567 12 H ALA 2 H ALA 2 -12.799 -2.953 -5.577 13 HA ALA 2 HA ALA 2 -11.202 -1.869 -3.485 14 1HB ALA 2 HB1 ALA 2 -10.962 -4.187 -2.798 15 2HB ALA 2 HB2 ALA 2 -12.623 -3.917 -3.351 16 3HB ALA 2 HB3 ALA 2 -11.470 -4.759 -4.403 17 H SER 3 H SER 3 -10.343 -3.121 -6.662 18 HA SER 3 HA SER 3 -7.987 -4.281 -6.273 19 1HB SER 3 HB2 SER 3 -8.355 -2.534 -8.709 20 2HB SER 3 HB3 SER 3 -7.621 -4.127 -8.556 21 HG SER 3 HG SER 3 -9.688 -4.968 -8.097 22 HA PRO 4 HA PRO 4 -5.449 -0.131 -6.777 23 1HB PRO 4 HB2 PRO 4 -7.350 1.686 -5.285 24 2HB PRO 4 HB3 PRO 4 -6.182 2.093 -6.576 25 1HG PRO 4 HG2 PRO 4 -8.802 1.838 -7.181 26 2HG PRO 4 HG3 PRO 4 -7.579 1.070 -8.244 27 1HD PRO 4 HD2 PRO 4 -9.152 -0.201 -5.999 28 2HD PRO 4 HD3 PRO 4 -9.004 -0.763 -7.677 29 H LEU 5 H LEU 5 -7.563 -0.182 -3.784 30 HA LEU 5 HA LEU 5 -5.283 0.216 -2.101 31 1HB LEU 5 HB2 LEU 5 -7.544 0.764 -1.345 32 2HB LEU 5 HB3 LEU 5 -8.004 -0.947 -1.405 33 HG LEU 5 HG LEU 5 -6.352 -1.482 0.354 34 1HD1 LEU 5 HD11 LEU 5 -5.240 0.367 1.592 35 2HD1 LEU 5 HD12 LEU 5 -4.586 0.192 -0.033 36 3HD1 LEU 5 HD13 LEU 5 -5.724 1.515 0.327 37 1HD2 LEU 5 HD21 LEU 5 -7.385 -0.350 2.210 38 2HD2 LEU 5 HD22 LEU 5 -8.012 0.929 1.141 39 3HD2 LEU 5 HD23 LEU 5 -8.631 -0.743 1.005 40 H ASP 6 H ASP 6 -7.106 -2.701 -3.121 41 HA ASP 6 HA ASP 6 -5.817 -4.593 -1.502 42 1HB ASP 6 HB2 ASP 6 -6.746 -4.950 -4.390 43 2HB ASP 6 HB3 ASP 6 -6.349 -6.258 -3.276 44 H GLN 7 H GLN 7 -4.767 -3.506 -4.792 45 HA GLN 7 HA GLN 7 -2.440 -5.163 -4.766 46 1HB GLN 7 HB2 GLN 7 -1.622 -3.886 -6.621 47 2HB GLN 7 HB3 GLN 7 -3.339 -4.249 -6.826 48 1HG GLN 7 HG2 GLN 7 -3.883 -1.937 -6.085 49 2HG GLN 7 HG3 GLN 7 -2.173 -1.541 -5.990 50 1HE2 GLN 7 HE21 GLN 7 -0.928 -2.061 -8.149 51 2HE2 GLN 7 HE22 GLN 7 -1.796 -1.626 -9.613 52 H ALA 8 H ALA 8 -3.000 -1.848 -3.504 53 HA ALA 8 HA ALA 8 -0.233 -1.329 -2.986 54 1HB ALA 8 HB1 ALA 8 -1.719 0.463 -3.106 55 2HB ALA 8 HB2 ALA 8 -2.739 -0.139 -1.771 56 3HB ALA 8 HB3 ALA 8 -1.079 0.409 -1.453 57 H ILE 9 H ILE 9 -2.859 -2.484 -0.723 58 HA ILE 9 HA ILE 9 -0.994 -2.923 1.429 59 HB ILE 9 HB ILE 9 -2.675 -4.349 2.459 60 1HG1 ILE 9 HG12 ILE 9 -4.432 -3.873 0.065 61 2HG1 ILE 9 HG13 ILE 9 -3.685 -5.419 0.499 62 1HG2 ILE 9 HG21 ILE 9 -3.811 -1.753 1.393 63 2HG2 ILE 9 HG22 ILE 9 -4.214 -2.551 2.929 64 3HG2 ILE 9 HG23 ILE 9 -2.605 -1.886 2.695 65 1HD1 ILE 9 HD11 ILE 9 -5.786 -3.907 2.107 66 2HD1 ILE 9 HD12 ILE 9 -5.944 -5.463 1.286 67 3HD1 ILE 9 HD13 ILE 9 -4.899 -5.323 2.712 68 H GLY 10 H GLY 10 -2.150 -4.977 -1.222 69 1HA GLY 10 HA2 GLY 10 -0.813 -7.363 -0.897 70 2HA GLY 10 HA3 GLY 10 -1.089 -6.548 -2.441 71 H LEU 11 H LEU 11 0.557 -4.290 -2.224 72 HA LEU 11 HA LEU 11 3.061 -5.314 -2.936 73 1HB LEU 11 HB2 LEU 11 1.934 -2.994 -3.392 74 2HB LEU 11 HB3 LEU 11 2.612 -2.503 -1.851 75 HG LEU 11 HG LEU 11 4.026 -1.678 -3.541 76 1HD1 LEU 11 HD11 LEU 11 5.502 -4.118 -2.575 77 2HD1 LEU 11 HD12 LEU 11 6.154 -2.541 -3.054 78 3HD1 LEU 11 HD13 LEU 11 5.182 -2.672 -1.576 79 1HD2 LEU 11 HD21 LEU 11 3.261 -3.084 -5.384 80 2HD2 LEU 11 HD22 LEU 11 5.030 -2.982 -5.314 81 3HD2 LEU 11 HD23 LEU 11 4.209 -4.455 -4.754 82 H LEU 12 H LEU 12 2.254 -3.516 0.061 83 HA LEU 12 HA LEU 12 4.671 -3.909 1.459 84 1HB LEU 12 HB2 LEU 12 1.762 -3.605 2.366 85 2HB LEU 12 HB3 LEU 12 3.086 -3.780 3.511 86 HG LEU 12 HG LEU 12 4.181 -1.777 2.645 87 1HD1 LEU 12 HD11 LEU 12 3.318 -1.621 0.340 88 2HD1 LEU 12 HD12 LEU 12 1.659 -1.426 0.967 89 3HD1 LEU 12 HD13 LEU 12 2.877 -0.172 1.237 90 1HD2 LEU 12 HD21 LEU 12 2.541 -0.157 3.590 91 2HD2 LEU 12 HD22 LEU 12 1.284 -1.410 3.518 92 3HD2 LEU 12 HD23 LEU 12 2.700 -1.608 4.575 93 H ILE 13 H ILE 13 1.743 -5.960 1.365 94 HA ILE 13 HA ILE 13 2.675 -7.867 3.278 95 HB ILE 13 HB ILE 13 0.659 -8.055 1.006 96 1HG1 ILE 13 HG12 ILE 13 0.096 -7.954 3.989 97 2HG1 ILE 13 HG13 ILE 13 0.323 -6.467 3.077 98 1HG2 ILE 13 HG21 ILE 13 1.380 -10.354 1.574 99 2HG2 ILE 13 HG22 ILE 13 1.079 -10.022 3.296 100 3HG2 ILE 13 HG23 ILE 13 -0.260 -10.051 2.142 101 1HD1 ILE 13 HD11 ILE 13 -1.990 -6.774 3.077 102 2HD1 ILE 13 HD12 ILE 13 -1.513 -7.341 1.477 103 3HD1 ILE 13 HD13 ILE 13 -1.882 -8.517 2.757 104 H GLY 14 H GLY 14 2.775 -7.900 -0.293 105 1HA GLY 14 HA2 GLY 14 4.027 -10.388 -0.679 106 2HA GLY 14 HA3 GLY 14 4.085 -8.998 -1.785 107 H ILE 15 H ILE 15 5.453 -7.065 -0.414 108 HA ILE 15 HA ILE 15 8.168 -7.829 -0.657 109 HB ILE 15 HB ILE 15 6.665 -5.492 0.506 110 1HG1 ILE 15 HG12 ILE 15 8.859 -5.876 -1.588 111 2HG1 ILE 15 HG13 ILE 15 7.131 -5.658 -1.895 112 1HG2 ILE 15 HG21 ILE 15 8.798 -4.417 1.211 113 2HG2 ILE 15 HG22 ILE 15 8.321 -5.772 2.201 114 3HG2 ILE 15 HG23 ILE 15 9.611 -5.989 0.986 115 1HD1 ILE 15 HD11 ILE 15 9.084 -3.602 -0.792 116 2HD1 ILE 15 HD12 ILE 15 8.205 -3.571 -2.320 117 3HD1 ILE 15 HD13 ILE 15 7.321 -3.389 -0.785 118 H PHE 16 H PHE 16 6.212 -7.352 2.314 119 HA PHE 16 HA PHE 16 8.225 -8.078 4.106 120 1HB PHE 16 HB2 PHE 16 6.064 -7.015 4.673 121 2HB PHE 16 HB3 PHE 16 5.221 -8.523 4.368 122 HD1 PHE 16 HD1 PHE 16 7.434 -6.706 6.689 123 HD2 PHE 16 HD2 PHE 16 5.654 -10.529 5.839 124 HE1 PHE 16 HE1 PHE 16 7.832 -7.423 9.042 125 HE2 PHE 16 HE2 PHE 16 6.241 -11.300 8.077 126 HZ PHE 16 HZ PHE 16 7.205 -9.704 9.743 127 H HIS 17 H HIS 17 5.704 -10.213 2.678 128 HA HIS 17 HA HIS 17 6.714 -12.485 4.153 129 1HB HIS 17 HB2 HIS 17 4.604 -12.278 1.999 130 2HB HIS 17 HB3 HIS 17 5.010 -13.759 2.881 131 HD1 HIS 17 HD1 HIS 17 3.352 -10.391 3.426 132 HD2 HIS 17 HD2 HIS 17 4.578 -13.761 5.599 133 HE1 HIS 17 HE1 HIS 17 2.349 -10.149 5.767 134 H LYS 18 H LYS 18 7.430 -11.190 0.927 135 HA LYS 18 HA LYS 18 8.772 -13.531 -0.051 136 1HB LYS 18 HB2 LYS 18 8.266 -11.601 -1.462 137 2HB LYS 18 HB3 LYS 18 9.325 -10.570 -0.488 138 1HG LYS 18 HG2 LYS 18 11.304 -11.865 -1.210 139 2HG LYS 18 HG3 LYS 18 10.244 -13.050 -1.981 140 1HD LYS 18 HD2 LYS 18 11.049 -11.816 -3.757 141 2HD LYS 18 HD3 LYS 18 9.429 -11.167 -3.527 142 1HE LYS 18 HE2 LYS 18 12.018 -9.875 -2.486 143 2HE LYS 18 HE3 LYS 18 11.237 -9.477 -4.020 144 1HZ LYS 18 HZ1 LYS 18 10.116 -9.045 -1.362 145 2HZ LYS 18 HZ2 LYS 18 10.607 -7.920 -2.460 146 3HZ LYS 18 HZ3 LYS 18 9.277 -8.845 -2.771 147 H TYR 19 H TYR 19 9.995 -10.642 1.726 148 HA TYR 19 HA TYR 19 12.615 -11.746 2.086 149 1HB TYR 19 HB2 TYR 19 11.117 -9.428 3.288 150 2HB TYR 19 HB3 TYR 19 12.670 -9.929 3.961 151 HD1 TYR 19 HD1 TYR 19 11.062 -8.363 1.046 152 HD2 TYR 19 HD2 TYR 19 14.755 -9.814 2.711 153 HE1 TYR 19 HE1 TYR 19 12.265 -7.573 -0.938 154 HE2 TYR 19 HE2 TYR 19 15.969 -8.988 0.724 155 HH TYR 19 HH TYR 19 15.775 -8.070 -1.372 156 H SER 20 H SER 20 9.728 -11.850 4.212 157 HA SER 20 HA SER 20 11.096 -13.185 6.357 158 1HB SER 20 HB2 SER 20 8.169 -13.567 5.625 159 2HB SER 20 HB3 SER 20 8.987 -13.835 7.173 160 HG SER 20 HG SER 20 8.687 -11.322 5.856 161 H GLY 21 H GLY 21 9.146 -14.494 3.631 162 1HA GLY 21 HA2 GLY 21 9.335 -17.197 3.964 163 2HA GLY 21 HA3 GLY 21 9.359 -16.375 2.395 164 H LYS 22 H LYS 22 11.796 -15.076 2.427 165 HA LYS 22 HA LYS 22 13.678 -16.915 1.622 166 1HB LYS 22 HB2 LYS 22 13.734 -14.390 1.426 167 2HB LYS 22 HB3 LYS 22 14.384 -14.342 3.079 168 1HG LYS 22 HG2 LYS 22 16.243 -15.877 2.308 169 2HG LYS 22 HG3 LYS 22 15.652 -15.674 0.650 170 1HD LYS 22 HD2 LYS 22 16.726 -13.525 2.536 171 2HD LYS 22 HD3 LYS 22 17.540 -14.182 1.117 172 1HE LYS 22 HE2 LYS 22 15.732 -13.233 -0.337 173 2HE LYS 22 HE3 LYS 22 14.978 -12.515 1.104 174 1HZ LYS 22 HZ1 LYS 22 17.690 -11.932 0.172 175 2HZ LYS 22 HZ2 LYS 22 16.366 -10.971 -0.032 176 3HZ LYS 22 HZ3 LYS 22 16.938 -11.273 1.486 177 H GLU 23 H GLU 23 13.216 -15.749 4.988 178 HA GLU 23 HA GLU 23 15.410 -17.533 5.930 179 1HB GLU 23 HB2 GLU 23 15.056 -16.422 8.113 180 2HB GLU 23 HB3 GLU 23 15.683 -15.399 6.816 181 1HG GLU 23 HG2 GLU 23 13.536 -14.338 6.482 182 2HG GLU 23 HG3 GLU 23 12.762 -15.422 7.665 183 H GLY 24 H GLY 24 11.859 -17.142 6.117 184 1HA GLY 24 HA2 GLY 24 11.418 -19.884 6.352 185 2HA GLY 24 HA3 GLY 24 11.369 -19.232 8.006 186 H ASP 25 H ASP 25 9.112 -20.381 6.597 187 HA ASP 25 HA ASP 25 7.380 -18.230 5.667 188 1HB ASP 25 HB2 ASP 25 5.700 -19.978 5.489 189 2HB ASP 25 HB3 ASP 25 7.206 -20.451 4.695 190 H LYS 26 H LYS 26 7.990 -17.047 7.746 191 HA LYS 26 HA LYS 26 5.857 -17.456 9.793 192 1HB LYS 26 HB2 LYS 26 7.546 -16.676 11.489 193 2HB LYS 26 HB3 LYS 26 7.835 -18.297 10.841 194 1HG LYS 26 HG2 LYS 26 9.582 -17.429 9.336 195 2HG LYS 26 HG3 LYS 26 9.282 -15.780 9.899 196 1HD LYS 26 HD2 LYS 26 9.968 -16.520 12.219 197 2HD LYS 26 HD3 LYS 26 10.234 -18.149 11.582 198 1HE LYS 26 HE2 LYS 26 12.376 -17.047 11.689 199 2HE LYS 26 HE3 LYS 26 11.944 -17.208 9.979 200 1HZ LYS 26 HZ1 LYS 26 11.676 -14.804 11.649 201 2HZ LYS 26 HZ2 LYS 26 12.799 -15.056 10.474 202 3HZ LYS 26 HZ3 LYS 26 11.210 -14.888 10.068 203 H HIS 27 H HIS 27 4.977 -15.472 10.551 204 HA HIS 27 HA HIS 27 5.210 -13.329 8.593 205 1HB HIS 27 HB2 HIS 27 3.541 -13.439 11.118 206 2HB HIS 27 HB3 HIS 27 3.315 -12.368 9.730 207 HD1 HIS 27 HD1 HIS 27 1.157 -14.568 10.881 208 HD2 HIS 27 HD2 HIS 27 3.644 -14.868 7.499 209 HE1 HIS 27 HE1 HIS 27 0.071 -16.264 9.319 210 H THR 28 H THR 28 7.682 -13.451 9.663 211 HA THR 28 HA THR 28 8.010 -11.049 11.361 212 HB THR 28 HB THR 28 9.484 -12.391 12.855 213 HG1 THR 28 HG1 THR 28 9.526 -14.198 11.369 214 1HG2 THR 28 HG21 THR 28 6.575 -13.256 12.993 215 2HG2 THR 28 HG22 THR 28 7.769 -13.296 14.299 216 3HG2 THR 28 HG23 THR 28 7.251 -11.735 13.638 217 H LEU 29 H LEU 29 9.692 -9.920 10.619 218 HA LEU 29 HA LEU 29 11.738 -11.267 8.915 219 1HB LEU 29 HB2 LEU 29 11.022 -8.366 9.464 220 2HB LEU 29 HB3 LEU 29 12.468 -8.822 8.562 221 HG LEU 29 HG LEU 29 9.649 -9.579 7.703 222 1HD1 LEU 29 HD11 LEU 29 9.856 -7.700 6.110 223 2HD1 LEU 29 HD12 LEU 29 9.957 -7.092 7.775 224 3HD1 LEU 29 HD13 LEU 29 11.432 -7.268 6.810 225 1HD2 LEU 29 HD21 LEU 29 12.321 -9.472 6.224 226 2HD2 LEU 29 HD22 LEU 29 11.496 -10.958 6.733 227 3HD2 LEU 29 HD23 LEU 29 10.738 -9.901 5.529 228 H SER 30 H SER 30 13.854 -11.516 9.653 229 HA SER 30 HA SER 30 14.513 -10.540 12.374 230 1HB SER 30 HB2 SER 30 16.228 -11.939 10.255 231 2HB SER 30 HB3 SER 30 16.727 -11.551 11.913 232 HG SER 30 HG SER 30 14.803 -13.420 11.048 233 H LYS 31 H LYS 31 16.231 -8.947 12.720 234 HA LYS 31 HA LYS 31 15.622 -6.612 11.390 235 1HB LYS 31 HB2 LYS 31 18.069 -7.285 13.081 236 2HB LYS 31 HB3 LYS 31 17.660 -5.679 12.491 237 1HG LYS 31 HG2 LYS 31 16.805 -5.671 14.636 238 2HG LYS 31 HG3 LYS 31 15.404 -5.850 13.594 239 1HD LYS 31 HD2 LYS 31 15.264 -7.159 15.644 240 2HD LYS 31 HD3 LYS 31 15.221 -8.245 14.273 241 1HE LYS 31 HE2 LYS 31 17.586 -8.874 14.669 242 2HE LYS 31 HE3 LYS 31 17.759 -7.561 15.853 243 1HZ LYS 31 HZ1 LYS 31 17.459 -9.634 16.932 244 2HZ LYS 31 HZ2 LYS 31 16.148 -8.668 17.219 245 3HZ LYS 31 HZ3 LYS 31 16.026 -9.910 16.159 246 H LYS 32 H LYS 32 18.553 -8.618 10.806 247 HA LYS 32 HA LYS 32 19.548 -6.768 8.821 248 1HB LYS 32 HB2 LYS 32 21.017 -8.156 10.045 249 2HB LYS 32 HB3 LYS 32 20.296 -9.646 9.378 250 1HG LYS 32 HG2 LYS 32 21.022 -8.924 7.090 251 2HG LYS 32 HG3 LYS 32 21.760 -7.478 7.785 252 1HD LYS 32 HD2 LYS 32 22.530 -10.371 8.422 253 2HD LYS 32 HD3 LYS 32 23.373 -9.305 7.289 254 1HE LYS 32 HE2 LYS 32 23.841 -7.711 9.181 255 2HE LYS 32 HE3 LYS 32 23.133 -8.887 10.306 256 1HZ LYS 32 HZ1 LYS 32 24.782 -10.457 9.616 257 2HZ LYS 32 HZ2 LYS 32 25.450 -9.363 8.578 258 3HZ LYS 32 HZ3 LYS 32 25.484 -9.086 10.202 259 H GLU 33 H GLU 33 17.223 -9.443 8.673 260 HA GLU 33 HA GLU 33 17.300 -9.688 5.783 261 1HB GLU 33 HB2 GLU 33 16.335 -11.431 7.399 262 2HB GLU 33 HB3 GLU 33 14.966 -10.329 7.634 263 1HG GLU 33 HG2 GLU 33 14.307 -11.898 5.960 264 2HG GLU 33 HG3 GLU 33 14.608 -10.383 5.118 265 H LEU 34 H LEU 34 15.393 -7.876 8.203 266 HA LEU 34 HA LEU 34 13.815 -6.372 6.397 267 1HB LEU 34 HB2 LEU 34 13.222 -6.391 8.658 268 2HB LEU 34 HB3 LEU 34 14.795 -5.887 9.218 269 HG LEU 34 HG LEU 34 13.086 -4.199 9.484 270 1HD1 LEU 34 HD11 LEU 34 15.074 -3.044 7.519 271 2HD1 LEU 34 HD12 LEU 34 14.410 -2.343 8.985 272 3HD1 LEU 34 HD13 LEU 34 15.579 -3.665 9.099 273 1HD2 LEU 34 HD21 LEU 34 12.171 -2.958 7.541 274 2HD2 LEU 34 HD22 LEU 34 12.955 -4.095 6.443 275 3HD2 LEU 34 HD23 LEU 34 11.689 -4.662 7.542 276 H LYS 35 H LYS 35 17.133 -5.621 7.711 277 HA LYS 35 HA LYS 35 17.440 -3.228 6.244 278 1HB LYS 35 HB2 LYS 35 19.564 -5.297 6.901 279 2HB LYS 35 HB3 LYS 35 19.838 -3.721 6.171 280 1HG LYS 35 HG2 LYS 35 18.756 -2.630 8.183 281 2HG LYS 35 HG3 LYS 35 18.610 -4.233 8.898 282 1HD LYS 35 HD2 LYS 35 20.560 -3.463 9.859 283 2HD LYS 35 HD3 LYS 35 21.191 -4.442 8.538 284 1HE LYS 35 HE2 LYS 35 20.841 -1.390 8.513 285 2HE LYS 35 HE3 LYS 35 22.355 -2.264 8.847 286 1HZ LYS 35 HZ1 LYS 35 22.427 -1.560 6.689 287 2HZ LYS 35 HZ2 LYS 35 22.193 -3.190 6.626 288 3HZ LYS 35 HZ3 LYS 35 20.943 -2.157 6.306 289 H GLU 36 H GLU 36 18.024 -6.608 5.176 290 HA GLU 36 HA GLU 36 18.968 -5.969 2.587 291 1HB GLU 36 HB2 GLU 36 18.938 -8.248 3.844 292 2HB GLU 36 HB3 GLU 36 17.302 -8.450 3.216 293 1HG GLU 36 HG2 GLU 36 18.852 -9.565 1.737 294 2HG GLU 36 HG3 GLU 36 18.181 -8.164 0.888 295 H LEU 37 H LEU 37 15.661 -6.538 3.796 296 HA LEU 37 HA LEU 37 14.237 -6.243 1.368 297 1HB LEU 37 HB2 LEU 37 13.183 -7.025 3.433 298 2HB LEU 37 HB3 LEU 37 13.514 -5.537 4.265 299 HG LEU 37 HG LEU 37 11.619 -5.616 1.934 300 1HD1 LEU 37 HD11 LEU 37 11.141 -5.895 4.940 301 2HD1 LEU 37 HD12 LEU 37 9.859 -5.696 3.752 302 3HD1 LEU 37 HD13 LEU 37 10.858 -7.154 3.700 303 1HD2 LEU 37 HD21 LEU 37 12.058 -3.617 4.228 304 2HD2 LEU 37 HD22 LEU 37 12.211 -3.286 2.483 305 3HD2 LEU 37 HD23 LEU 37 10.641 -3.610 3.176 306 H ILE 38 H ILE 38 15.145 -3.732 3.749 307 HA ILE 38 HA ILE 38 13.971 -1.681 2.174 308 HB ILE 38 HB ILE 38 16.216 -1.521 4.223 309 1HG1 ILE 38 HG12 ILE 38 13.194 -1.036 4.397 310 2HG1 ILE 38 HG13 ILE 38 14.033 -2.462 5.014 311 1HG2 ILE 38 HG21 ILE 38 15.645 0.901 4.361 312 2HG2 ILE 38 HG22 ILE 38 16.225 0.499 2.758 313 3HG2 ILE 38 HG23 ILE 38 14.483 0.700 3.039 314 1HD1 ILE 38 HD11 ILE 38 14.289 0.357 5.972 315 2HD1 ILE 38 HD12 ILE 38 13.698 -1.055 6.867 316 3HD1 ILE 38 HD13 ILE 38 15.432 -0.928 6.464 317 H GLN 39 H GLN 39 17.402 -2.689 2.407 318 HA GLN 39 HA GLN 39 18.375 -0.810 0.561 319 1HB GLN 39 HB2 GLN 39 19.332 -3.577 1.349 320 2HB GLN 39 HB3 GLN 39 20.242 -2.558 0.221 321 1HG GLN 39 HG2 GLN 39 20.555 -0.812 1.815 322 2HG GLN 39 HG3 GLN 39 19.392 -1.508 2.953 323 1HE2 GLN 39 HE22 GLN 39 19.887 -3.780 3.650 324 2HE2 GLN 39 HE21 GLN 39 21.572 -4.157 4.047 325 H LYS 40 H LYS 40 16.948 -4.075 -0.123 326 HA LYS 40 HA LYS 40 17.542 -3.740 -2.947 327 1HB LYS 40 HB2 LYS 40 17.356 -5.959 -1.879 328 2HB LYS 40 HB3 LYS 40 15.666 -5.632 -1.503 329 1HG LYS 40 HG2 LYS 40 15.922 -7.081 -3.515 330 2HG LYS 40 HG3 LYS 40 15.047 -5.603 -3.846 331 1HD LYS 40 HD2 LYS 40 16.623 -6.193 -5.647 332 2HD LYS 40 HD3 LYS 40 16.984 -4.617 -4.963 333 1HE LYS 40 HE2 LYS 40 19.035 -5.920 -5.383 334 2HE LYS 40 HE3 LYS 40 18.866 -5.593 -3.656 335 1HZ LYS 40 HZ1 LYS 40 18.005 -7.803 -3.384 336 2HZ LYS 40 HZ2 LYS 40 18.140 -8.103 -5.000 337 3HZ LYS 40 HZ3 LYS 40 19.491 -7.848 -4.091 338 H GLU 41 H GLU 41 14.491 -3.587 -1.005 339 HA GLU 41 HA GLU 41 12.921 -3.130 -3.377 340 1HB GLU 41 HB2 GLU 41 12.221 -2.848 -0.425 341 2HB GLU 41 HB3 GLU 41 11.064 -2.752 -1.754 342 1HG GLU 41 HG2 GLU 41 12.835 -5.178 -1.169 343 2HG GLU 41 HG3 GLU 41 11.150 -5.016 -0.681 344 H LEU 42 H LEU 42 14.075 -0.932 -0.763 345 HA LEU 42 HA LEU 42 12.755 1.350 -2.080 346 1HB LEU 42 HB2 LEU 42 14.649 1.161 0.275 347 2HB LEU 42 HB3 LEU 42 14.079 2.675 -0.388 348 HG LEU 42 HG LEU 42 12.912 1.835 1.669 349 1HD1 LEU 42 HD11 LEU 42 11.049 2.367 -0.661 350 2HD1 LEU 42 HD12 LEU 42 10.742 2.655 1.055 351 3HD1 LEU 42 HD13 LEU 42 11.976 3.611 0.225 352 1HD2 LEU 42 HD21 LEU 42 11.358 -0.005 -0.191 353 2HD2 LEU 42 HD22 LEU 42 12.606 -0.565 0.939 354 3HD2 LEU 42 HD23 LEU 42 11.148 0.222 1.553 355 H THR 43 H THR 43 15.536 -0.537 -2.666 356 HA THR 43 HA THR 43 17.475 -0.243 -3.765 357 HB THR 43 HB THR 43 16.019 -0.641 -5.513 358 HG1 THR 43 HG1 THR 43 17.677 1.568 -6.103 359 1HG2 THR 43 HG21 THR 43 15.331 2.312 -5.601 360 2HG2 THR 43 HG22 THR 43 14.906 1.134 -6.856 361 3HG2 THR 43 HG23 THR 43 14.218 0.971 -5.237 362 H ILE 44 H ILE 44 17.782 1.218 -1.763 363 HA ILE 44 HA ILE 44 17.845 4.006 -2.051 364 HB ILE 44 HB ILE 44 19.072 4.123 -0.005 365 1HG1 ILE 44 HG12 ILE 44 19.689 1.149 -0.305 366 2HG1 ILE 44 HG13 ILE 44 20.848 2.487 -0.390 367 1HG2 ILE 44 HG21 ILE 44 17.214 1.718 0.195 368 2HG2 ILE 44 HG22 ILE 44 17.535 2.957 1.423 369 3HG2 ILE 44 HG23 ILE 44 16.656 3.387 -0.045 370 1HD1 ILE 44 HD11 ILE 44 20.255 3.124 1.956 371 2HD1 ILE 44 HD12 ILE 44 19.305 1.619 2.066 372 3HD1 ILE 44 HD13 ILE 44 21.052 1.551 1.778 373 H GLY 45 H GLY 45 20.339 1.669 -2.864 374 1HA GLY 45 HA2 GLY 45 22.236 1.889 -4.157 375 2HA GLY 45 HA3 GLY 45 21.787 3.563 -4.513 376 H SER 46 H SER 46 21.932 5.014 -2.432 377 HA SER 46 HA SER 46 24.648 5.286 -1.745 378 1HB SER 46 HB2 SER 46 22.169 6.542 -0.516 379 2HB SER 46 HB3 SER 46 23.815 7.208 -0.464 380 HG SER 46 HG SER 46 22.389 8.023 -2.184 381 H LYS 47 H LYS 47 24.819 2.969 -0.840 382 HA LYS 47 HA LYS 47 23.925 2.184 1.669 383 1HB LYS 47 HB2 LYS 47 26.736 1.697 0.606 384 2HB LYS 47 HB3 LYS 47 25.869 0.737 1.809 385 1HG LYS 47 HG2 LYS 47 25.268 0.962 -1.161 386 2HG LYS 47 HG3 LYS 47 25.823 -0.444 -0.261 387 1HD LYS 47 HD2 LYS 47 23.674 -0.443 1.046 388 2HD LYS 47 HD3 LYS 47 23.078 0.874 0.016 389 1HE LYS 47 HE2 LYS 47 23.897 -1.900 -0.948 390 2HE LYS 47 HE3 LYS 47 22.242 -1.309 -0.739 391 1HZ LYS 47 HZ1 LYS 47 22.906 -1.134 -2.997 392 2HZ LYS 47 HZ2 LYS 47 22.718 0.384 -2.378 393 3HZ LYS 47 HZ3 LYS 47 24.226 -0.225 -2.611 394 H LEU 48 H LEU 48 26.193 4.754 1.069 395 HA LEU 48 HA LEU 48 27.458 5.077 3.548 396 1HB LEU 48 HB2 LEU 48 26.145 7.227 1.836 397 2HB LEU 48 HB3 LEU 48 27.389 7.495 3.061 398 HG LEU 48 HG LEU 48 27.764 5.939 0.455 399 1HD1 LEU 48 HD11 LEU 48 27.509 8.374 0.151 400 2HD1 LEU 48 HD12 LEU 48 28.796 8.662 1.342 401 3HD1 LEU 48 HD13 LEU 48 29.165 7.844 -0.192 402 1HD2 LEU 48 HD21 LEU 48 29.252 5.008 2.167 403 2HD2 LEU 48 HD22 LEU 48 30.188 6.017 1.064 404 3HD2 LEU 48 HD23 LEU 48 29.748 6.642 2.667 405 H GLN 49 H GLN 49 24.056 5.563 2.730 406 HA GLN 49 HA GLN 49 23.377 6.924 5.205 407 1HB GLN 49 HB2 GLN 49 21.636 5.540 3.125 408 2HB GLN 49 HB3 GLN 49 21.057 6.562 4.447 409 1HG GLN 49 HG2 GLN 49 22.420 8.468 3.541 410 2HG GLN 49 HG3 GLN 49 22.872 7.455 2.163 411 1HE2 GLN 49 HE22 GLN 49 19.986 8.711 3.917 412 2HE2 GLN 49 HE21 GLN 49 18.990 8.850 2.470 413 H ASP 50 H ASP 50 24.468 3.802 4.913 414 HA ASP 50 HA ASP 50 22.680 2.111 6.065 415 1HB ASP 50 HB2 ASP 50 24.889 1.377 5.380 416 2HB ASP 50 HB3 ASP 50 25.655 2.333 6.665 417 H ALA 51 H ALA 51 24.603 4.549 7.829 418 HA ALA 51 HA ALA 51 23.924 3.908 10.486 419 1HB ALA 51 HB1 ALA 51 24.282 6.301 10.950 420 2HB ALA 51 HB2 ALA 51 25.534 5.654 9.871 421 3HB ALA 51 HB3 ALA 51 24.225 6.659 9.211 422 H GLU 52 H GLU 52 22.048 5.768 8.060 423 HA GLU 52 HA GLU 52 19.902 6.456 9.899 424 1HB GLU 52 HB2 GLU 52 19.913 6.433 6.846 425 2HB GLU 52 HB3 GLU 52 18.721 7.191 7.905 426 1HG GLU 52 HG2 GLU 52 20.510 8.677 8.832 427 2HG GLU 52 HG3 GLU 52 21.665 7.980 7.681 428 H ILE 53 H ILE 53 20.560 3.939 7.441 429 HA ILE 53 HA ILE 53 18.023 2.655 7.655 430 HB ILE 53 HB ILE 53 20.671 1.309 7.027 431 1HG1 ILE 53 HG12 ILE 53 20.358 3.139 5.453 432 2HG1 ILE 53 HG13 ILE 53 20.048 1.605 4.659 433 1HG2 ILE 53 HG21 ILE 53 19.228 -0.318 5.812 434 2HG2 ILE 53 HG22 ILE 53 18.972 -0.325 7.559 435 3HG2 ILE 53 HG23 ILE 53 17.794 0.464 6.511 436 1HD1 ILE 53 HD11 ILE 53 17.591 2.000 4.891 437 2HD1 ILE 53 HD12 ILE 53 17.924 3.575 5.644 438 3HD1 ILE 53 HD13 ILE 53 18.406 3.271 3.971 439 H VAL 54 H VAL 54 21.020 2.090 9.630 440 HA VAL 54 HA VAL 54 19.629 0.081 11.169 441 HB VAL 54 HB VAL 54 21.423 0.216 12.823 442 1HG1 VAL 54 HG11 VAL 54 22.260 -0.239 9.951 443 2HG1 VAL 54 HG12 VAL 54 22.989 -0.982 11.390 444 3HG1 VAL 54 HG13 VAL 54 21.326 -1.393 10.943 445 1HG2 VAL 54 HG21 VAL 54 22.830 2.034 10.873 446 2HG2 VAL 54 HG22 VAL 54 22.200 2.541 12.460 447 3HG2 VAL 54 HG23 VAL 54 23.493 1.334 12.352 448 H LYS 55 H LYS 55 19.990 3.630 11.650 449 HA LYS 55 HA LYS 55 18.704 3.614 14.190 450 1HB LYS 55 HB2 LYS 55 19.749 5.627 13.306 451 2HB LYS 55 HB3 LYS 55 18.625 5.673 11.951 452 1HG LYS 55 HG2 LYS 55 18.081 7.322 13.720 453 2HG LYS 55 HG3 LYS 55 16.760 6.218 13.352 454 1HD LYS 55 HD2 LYS 55 16.920 6.630 15.747 455 2HD LYS 55 HD3 LYS 55 17.190 4.928 15.406 456 1HE LYS 55 HE2 LYS 55 19.665 5.289 15.624 457 2HE LYS 55 HE3 LYS 55 19.367 7.006 15.953 458 1HZ LYS 55 HZ1 LYS 55 18.407 4.748 17.570 459 2HZ LYS 55 HZ2 LYS 55 19.669 5.740 17.945 460 3HZ LYS 55 HZ3 LYS 55 18.135 6.342 17.891 461 H LEU 56 H LEU 56 17.293 3.826 10.901 462 HA LEU 56 HA LEU 56 14.568 3.758 11.673 463 1HB LEU 56 HB2 LEU 56 15.131 4.471 9.537 464 2HB LEU 56 HB3 LEU 56 16.068 3.030 9.156 465 HG LEU 56 HG LEU 56 13.192 2.529 9.805 466 1HD1 LEU 56 HD11 LEU 56 14.025 3.913 7.226 467 2HD1 LEU 56 HD12 LEU 56 12.446 3.158 7.545 468 3HD1 LEU 56 HD13 LEU 56 12.953 4.578 8.480 469 1HD2 LEU 56 HD21 LEU 56 13.435 0.983 7.954 470 2HD2 LEU 56 HD22 LEU 56 15.060 1.639 7.581 471 3HD2 LEU 56 HD23 LEU 56 14.787 0.731 9.068 472 H MET 57 H MET 57 16.820 1.051 10.984 473 HA MET 57 HA MET 57 14.858 -1.000 11.319 474 1HB MET 57 HB2 MET 57 16.528 -1.926 10.224 475 2HB MET 57 HB3 MET 57 17.743 -0.859 10.860 476 1HG MET 57 HG2 MET 57 16.711 -3.166 12.516 477 2HG MET 57 HG3 MET 57 17.999 -3.311 11.315 478 1HE MET 57 HE1 MET 57 18.471 -4.112 14.388 479 2HE MET 57 HE2 MET 57 19.689 -4.274 13.092 480 3HE MET 57 HE3 MET 57 20.096 -3.437 14.609 481 H ASP 58 H ASP 58 17.040 0.628 13.623 482 HA ASP 58 HA ASP 58 16.271 -0.882 15.908 483 1HB ASP 58 HB2 ASP 58 18.223 0.601 15.873 484 2HB ASP 58 HB3 ASP 58 17.167 2.018 15.776 485 H ASP 59 H ASP 59 14.907 2.122 14.453 486 HA ASP 59 HA ASP 59 12.824 2.472 16.345 487 1HB ASP 59 HB2 ASP 59 12.724 3.161 13.379 488 2HB ASP 59 HB3 ASP 59 11.644 3.754 14.643 489 H LEU 60 H LEU 60 12.757 0.617 13.268 490 HA LEU 60 HA LEU 60 10.155 -0.489 13.500 491 1HB LEU 60 HB2 LEU 60 12.737 -1.339 12.203 492 2HB LEU 60 HB3 LEU 60 11.448 -2.532 12.315 493 HG LEU 60 HG LEU 60 10.785 0.177 11.237 494 1HD1 LEU 60 HD11 LEU 60 12.150 -1.961 9.579 495 2HD1 LEU 60 HD12 LEU 60 11.371 -0.510 8.929 496 3HD1 LEU 60 HD13 LEU 60 12.801 -0.352 9.972 497 1HD2 LEU 60 HD21 LEU 60 9.012 -1.618 11.496 498 2HD2 LEU 60 HD22 LEU 60 9.247 -1.162 9.789 499 3HD2 LEU 60 HD23 LEU 60 9.947 -2.662 10.397 500 H ASP 61 H ASP 61 13.258 -1.996 14.590 501 HA ASP 61 HA ASP 61 11.806 -4.107 15.840 502 1HB ASP 61 HB2 ASP 61 13.840 -5.082 16.470 503 2HB ASP 61 HB3 ASP 61 14.038 -4.397 14.856 504 H ARG 62 H ARG 62 12.675 -1.012 17.153 505 HA ARG 62 HA ARG 62 12.555 -1.578 19.879 506 1HB ARG 62 HB2 ARG 62 12.931 0.634 18.754 507 2HB ARG 62 HB3 ARG 62 11.182 0.770 18.503 508 1HG ARG 62 HG2 ARG 62 10.859 0.650 20.990 509 2HG ARG 62 HG3 ARG 62 12.615 0.506 21.195 510 1HD ARG 62 HD2 ARG 62 11.090 2.841 19.998 511 2HD ARG 62 HD3 ARG 62 11.904 2.825 21.565 512 HE ARG 62 HE ARG 62 14.049 2.403 20.304 513 1HH1 ARG 62 HH11 ARG 62 11.469 4.370 18.803 514 2HH1 ARG 62 HH12 ARG 62 12.523 4.888 17.505 515 1HH2 ARG 62 HH22 ARG 62 15.345 3.123 18.549 516 2HH2 ARG 62 HH21 ARG 62 14.651 4.245 17.398 517 H ASN 63 H ASN 63 9.947 -1.663 17.460 518 HA ASN 63 HA ASN 63 7.836 -1.837 19.448 519 1HB ASN 63 HB2 ASN 63 7.790 -1.031 16.945 520 2HB ASN 63 HB3 ASN 63 7.532 -2.738 16.584 521 1HD2 ASN 63 HD22 ASN 63 5.850 -3.274 19.044 522 2HD2 ASN 63 HD21 ASN 63 4.366 -2.376 18.767 523 H LYS 64 H LYS 64 10.089 -4.138 18.075 524 HA LYS 64 HA LYS 64 9.075 -6.331 19.575 525 1HB LYS 64 HB2 LYS 64 7.358 -6.421 17.808 526 2HB LYS 64 HB3 LYS 64 8.611 -6.409 16.567 527 1HG LYS 64 HG2 LYS 64 7.732 -8.638 16.857 528 2HG LYS 64 HG3 LYS 64 9.419 -8.613 17.368 529 1HD LYS 64 HD2 LYS 64 8.802 -8.658 19.716 530 2HD LYS 64 HD3 LYS 64 7.087 -8.407 19.319 531 1HE LYS 64 HE2 LYS 64 6.982 -10.571 18.185 532 2HE LYS 64 HE3 LYS 64 8.724 -10.823 18.396 533 1HZ LYS 64 HZ1 LYS 64 8.418 -10.972 20.715 534 2HZ LYS 64 HZ2 LYS 64 6.817 -10.561 20.613 535 3HZ LYS 64 HZ3 LYS 64 7.353 -11.991 19.995 536 H ASP 65 H ASP 65 11.195 -6.350 20.284 537 HA ASP 65 HA ASP 65 13.448 -5.862 18.742 538 1HB ASP 65 HB2 ASP 65 14.734 -6.539 20.650 539 2HB ASP 65 HB3 ASP 65 13.300 -5.675 21.212 540 H GLN 66 H GLN 66 11.948 -8.981 19.372 541 HA GLN 66 HA GLN 66 14.217 -10.605 18.895 542 1HB GLN 66 HB2 GLN 66 11.256 -11.258 18.575 543 2HB GLN 66 HB3 GLN 66 12.566 -12.447 18.658 544 1HG GLN 66 HG2 GLN 66 13.123 -11.730 20.945 545 2HG GLN 66 HG3 GLN 66 11.916 -10.440 20.875 546 1HE2 GLN 66 HE22 GLN 66 12.231 -14.024 20.691 547 2HE2 GLN 66 HE21 GLN 66 10.621 -14.318 21.326 548 H GLU 67 H GLU 67 11.454 -9.962 16.721 549 HA GLU 67 HA GLU 67 13.022 -9.784 14.310 550 1HB GLU 67 HB2 GLU 67 11.723 -11.674 13.219 551 2HB GLU 67 HB3 GLU 67 13.071 -12.132 14.258 552 1HG GLU 67 HG2 GLU 67 11.553 -12.718 16.099 553 2HG GLU 67 HG3 GLU 67 10.152 -12.207 15.149 554 H VAL 68 H VAL 68 11.717 -8.485 12.929 555 HA VAL 68 HA VAL 68 9.573 -7.220 14.446 556 HB VAL 68 HB VAL 68 9.622 -5.456 12.885 557 1HG1 VAL 68 HG11 VAL 68 11.459 -5.826 14.614 558 2HG1 VAL 68 HG12 VAL 68 12.513 -6.343 13.293 559 3HG1 VAL 68 HG13 VAL 68 11.855 -4.697 13.298 560 1HG2 VAL 68 HG21 VAL 68 9.903 -6.587 10.704 561 2HG2 VAL 68 HG22 VAL 68 11.141 -5.354 10.953 562 3HG2 VAL 68 HG23 VAL 68 11.561 -7.059 11.173 563 H ASN 69 H ASN 69 7.536 -7.799 14.368 564 HA ASN 69 HA ASN 69 6.667 -9.797 12.465 565 1HB ASN 69 HB2 ASN 69 5.854 -10.081 14.697 566 2HB ASN 69 HB3 ASN 69 5.371 -8.389 14.797 567 1HD2 ASN 69 HD22 ASN 69 4.619 -11.311 12.711 568 2HD2 ASN 69 HD21 ASN 69 2.900 -10.973 12.723 569 H PHE 70 H PHE 70 5.037 -9.678 11.012 570 HA PHE 70 HA PHE 70 4.815 -7.641 9.240 571 1HB PHE 70 HB2 PHE 70 3.907 -9.856 8.861 572 2HB PHE 70 HB3 PHE 70 2.684 -9.616 10.108 573 HD1 PHE 70 HD1 PHE 70 3.967 -7.971 6.986 574 HD2 PHE 70 HD2 PHE 70 0.586 -8.759 9.513 575 HE1 PHE 70 HE1 PHE 70 2.497 -6.751 5.395 576 HE2 PHE 70 HE2 PHE 70 -0.891 -7.574 7.933 577 HZ PHE 70 HZ PHE 70 0.062 -6.534 5.877 578 H GLN 71 H GLN 71 2.584 -7.909 12.112 579 HA GLN 71 HA GLN 71 0.976 -5.696 11.315 580 1HB GLN 71 HB2 GLN 71 0.355 -7.365 13.054 581 2HB GLN 71 HB3 GLN 71 1.591 -6.698 14.124 582 1HG GLN 71 HG2 GLN 71 0.402 -4.464 14.031 583 2HG GLN 71 HG3 GLN 71 -0.836 -5.214 13.011 584 1HE2 GLN 71 HE22 GLN 71 0.861 -5.689 16.173 585 2HE2 GLN 71 HE21 GLN 71 -0.583 -6.238 17.021 586 H GLU 72 H GLU 72 3.916 -5.935 13.321 587 HA GLU 72 HA GLU 72 3.907 -3.141 14.093 588 1HB GLU 72 HB2 GLU 72 5.943 -5.387 14.317 589 2HB GLU 72 HB3 GLU 72 6.330 -3.711 14.723 590 1HG GLU 72 HG2 GLU 72 5.641 -4.833 16.754 591 2HG GLU 72 HG3 GLU 72 4.439 -3.614 16.310 592 H TYR 73 H TYR 73 5.442 -5.036 11.504 593 HA TYR 73 HA TYR 73 6.951 -2.952 10.296 594 1HB TYR 73 HB2 TYR 73 7.355 -5.088 9.528 595 2HB TYR 73 HB3 TYR 73 5.670 -5.490 9.334 596 HD1 TYR 73 HD1 TYR 73 8.538 -3.784 7.768 597 HD2 TYR 73 HD2 TYR 73 4.422 -5.015 7.322 598 HE1 TYR 73 HE1 TYR 73 8.761 -3.656 5.309 599 HE2 TYR 73 HE2 TYR 73 4.632 -4.798 4.872 600 HH TYR 73 HH TYR 73 7.656 -3.763 3.279 601 H ILE 74 H ILE 74 3.497 -3.913 9.620 602 HA ILE 74 HA ILE 74 3.045 -1.733 7.843 603 HB ILE 74 HB ILE 74 1.036 -3.126 9.641 604 1HG1 ILE 74 HG12 ILE 74 2.184 -4.664 8.016 605 2HG1 ILE 74 HG13 ILE 74 0.450 -4.528 7.842 606 1HG2 ILE 74 HG21 ILE 74 0.718 -1.139 7.363 607 2HG2 ILE 74 HG22 ILE 74 -0.576 -2.258 7.793 608 3HG2 ILE 74 HG23 ILE 74 0.009 -1.097 8.988 609 1HD1 ILE 74 HD11 ILE 74 0.782 -2.966 5.897 610 2HD1 ILE 74 HD12 ILE 74 2.540 -3.241 6.068 611 3HD1 ILE 74 HD13 ILE 74 1.446 -4.567 5.642 612 H THR 75 H THR 75 2.493 -1.952 11.377 613 HA THR 75 HA THR 75 1.443 0.593 11.855 614 HB THR 75 HB THR 75 3.460 -0.848 13.639 615 HG1 THR 75 HG1 THR 75 1.728 -2.218 13.068 616 1HG2 THR 75 HG21 THR 75 2.912 1.456 14.394 617 2HG2 THR 75 HG22 THR 75 1.182 1.044 14.332 618 3HG2 THR 75 HG23 THR 75 2.254 0.217 15.474 619 H PHE 76 H PHE 76 4.899 -0.380 11.782 620 HA PHE 76 HA PHE 76 5.971 2.218 12.185 621 1HB PHE 76 HB2 PHE 76 7.297 0.172 12.485 622 2HB PHE 76 HB3 PHE 76 7.170 -0.177 10.760 623 HD1 PHE 76 HD1 PHE 76 8.512 2.272 13.253 624 HD2 PHE 76 HD2 PHE 76 8.568 1.018 9.115 625 HE1 PHE 76 HE1 PHE 76 10.280 3.932 12.747 626 HE2 PHE 76 HE2 PHE 76 10.492 2.471 8.702 627 HZ PHE 76 HZ PHE 76 11.307 4.016 10.486 628 H LEU 77 H LEU 77 5.160 0.429 9.126 629 HA LEU 77 HA LEU 77 6.115 2.531 7.438 630 1HB LEU 77 HB2 LEU 77 4.007 0.399 7.002 631 2HB LEU 77 HB3 LEU 77 4.478 1.551 5.749 632 HG LEU 77 HG LEU 77 6.481 -0.269 7.171 633 1HD1 LEU 77 HD11 LEU 77 4.903 -1.648 5.920 634 2HD1 LEU 77 HD12 LEU 77 5.112 -0.613 4.480 635 3HD1 LEU 77 HD13 LEU 77 6.472 -1.569 5.092 636 1HD2 LEU 77 HD21 LEU 77 6.648 1.480 4.677 637 2HD2 LEU 77 HD22 LEU 77 7.609 1.642 6.171 638 3HD2 LEU 77 HD23 LEU 77 7.857 0.254 5.121 639 H GLY 78 H GLY 78 3.056 2.193 9.216 640 1HA GLY 78 HA2 GLY 78 1.782 4.540 8.204 641 2HA GLY 78 HA3 GLY 78 1.606 3.890 9.847 642 H ALA 79 H ALA 79 4.105 4.146 10.925 643 HA ALA 79 HA ALA 79 4.312 6.883 11.590 644 1HB ALA 79 HB1 ALA 79 6.369 6.352 12.712 645 2HB ALA 79 HB2 ALA 79 5.196 5.050 12.987 646 3HB ALA 79 HB3 ALA 79 6.535 4.823 11.840 647 H LEU 80 H LEU 80 6.338 4.950 9.373 648 HA LEU 80 HA LEU 80 8.068 6.916 8.432 649 1HB LEU 80 HB2 LEU 80 8.015 4.345 8.029 650 2HB LEU 80 HB3 LEU 80 6.915 4.716 6.698 651 HG LEU 80 HG LEU 80 8.794 6.383 5.925 652 1HD1 LEU 80 HD11 LEU 80 10.188 6.222 7.998 653 2HD1 LEU 80 HD12 LEU 80 10.384 4.482 7.710 654 3HD1 LEU 80 HD13 LEU 80 11.076 5.653 6.573 655 1HD2 LEU 80 HD21 LEU 80 9.928 4.542 4.705 656 2HD2 LEU 80 HD22 LEU 80 9.215 3.362 5.817 657 3HD2 LEU 80 HD23 LEU 80 8.171 4.299 4.723 658 H ALA 81 H ALA 81 4.837 5.959 7.205 659 HA ALA 81 HA ALA 81 4.690 7.737 5.014 660 1HB ALA 81 HB1 ALA 81 2.520 6.518 6.747 661 2HB ALA 81 HB2 ALA 81 2.222 7.485 5.299 662 3HB ALA 81 HB3 ALA 81 3.121 5.953 5.182 663 H MET 82 H MET 82 3.507 8.246 8.435 664 HA MET 82 HA MET 82 2.865 10.990 7.759 665 1HB MET 82 HB2 MET 82 2.334 11.407 10.028 666 2HB MET 82 HB3 MET 82 1.602 9.925 9.435 667 1HG MET 82 HG2 MET 82 2.280 9.526 11.664 668 2HG MET 82 HG3 MET 82 3.311 8.593 10.595 669 1HE MET 82 HE1 MET 82 3.014 11.720 12.942 670 2HE MET 82 HE2 MET 82 4.685 12.334 12.957 671 3HE MET 82 HE3 MET 82 3.705 12.494 11.488 672 H ILE 83 H ILE 83 5.864 9.489 8.816 673 HA ILE 83 HA ILE 83 7.287 11.928 9.297 674 HB ILE 83 HB ILE 83 7.969 9.110 8.871 675 1HG1 ILE 83 HG12 ILE 83 9.881 9.691 10.325 676 2HG1 ILE 83 HG13 ILE 83 9.419 11.398 10.248 677 1HG2 ILE 83 HG21 ILE 83 9.094 9.814 6.813 678 2HG2 ILE 83 HG22 ILE 83 9.935 11.111 7.701 679 3HG2 ILE 83 HG23 ILE 83 10.263 9.408 8.059 680 1HD1 ILE 83 HD11 ILE 83 7.278 10.862 11.354 681 2HD1 ILE 83 HD12 ILE 83 7.678 9.125 11.314 682 3HD1 ILE 83 HD13 ILE 83 8.632 10.242 12.312 683 H TYR 84 H TYR 84 6.512 10.177 6.257 684 HA TYR 84 HA TYR 84 7.535 12.368 4.589 685 1HB TYR 84 HB2 TYR 84 5.589 10.175 3.822 686 2HB TYR 84 HB3 TYR 84 6.563 11.167 2.749 687 HD1 TYR 84 HD1 TYR 84 6.260 8.038 3.091 688 HD2 TYR 84 HD2 TYR 84 9.269 10.926 4.202 689 HE1 TYR 84 HE1 TYR 84 8.019 6.315 2.835 690 HE2 TYR 84 HE2 TYR 84 11.013 9.193 3.964 691 HH TYR 84 HH TYR 84 10.276 5.903 2.793 692 H ASN 85 H ASN 85 6.117 13.608 6.449 693 HA ASN 85 HA ASN 85 3.434 13.884 6.522 694 1HB ASN 85 HB2 ASN 85 4.883 15.098 8.000 695 2HB ASN 85 HB3 ASN 85 5.601 16.013 6.667 696 1HD2 ASN 85 HD21 ASN 85 4.674 17.977 6.082 697 2HD2 ASN 85 HD22 ASN 85 3.172 18.554 6.787 698 H GLU 86 H GLU 86 5.520 15.443 4.106 699 HA GLU 86 HA GLU 86 3.647 17.132 2.901 700 1HB GLU 86 HB2 GLU 86 5.847 15.658 1.401 701 2HB GLU 86 HB3 GLU 86 5.111 17.220 1.020 702 1HG GLU 86 HG2 GLU 86 7.017 16.562 3.306 703 2HG GLU 86 HG3 GLU 86 7.245 17.693 1.980 704 H ALA 87 H ALA 87 4.079 13.624 2.440 705 HA ALA 87 HA ALA 87 2.430 13.348 0.099 706 1HB ALA 87 HB1 ALA 87 4.013 11.609 0.914 707 2HB ALA 87 HB2 ALA 87 2.995 11.370 2.353 708 3HB ALA 87 HB3 ALA 87 2.358 10.986 0.744 709 H LEU 88 H LEU 88 1.757 13.627 3.574 710 HA LEU 88 HA LEU 88 -1.039 12.737 3.287 711 1HB LEU 88 HB2 LEU 88 0.653 13.704 5.621 712 2HB LEU 88 HB3 LEU 88 -1.081 13.425 5.724 713 HG LEU 88 HG LEU 88 -0.782 11.051 5.084 714 1HD1 LEU 88 HD11 LEU 88 1.530 10.072 5.247 715 2HD1 LEU 88 HD12 LEU 88 1.265 11.030 3.805 716 3HD1 LEU 88 HD13 LEU 88 2.193 11.719 5.161 717 1HD2 LEU 88 HD21 LEU 88 0.792 12.109 7.453 718 2HD2 LEU 88 HD22 LEU 88 -0.906 11.553 7.410 719 3HD2 LEU 88 HD23 LEU 88 0.413 10.394 7.205 720 H LYS 89 H LYS 89 0.808 15.749 3.923 721 HA LYS 89 HA LYS 89 -1.457 17.496 4.039 722 1HB LYS 89 HB2 LYS 89 1.407 17.955 3.115 723 2HB LYS 89 HB3 LYS 89 0.226 19.249 3.306 724 1HG LYS 89 HG2 LYS 89 1.124 17.402 5.570 725 2HG LYS 89 HG3 LYS 89 1.778 19.012 5.208 726 1HD LYS 89 HD2 LYS 89 -0.577 19.941 5.442 727 2HD LYS 89 HD3 LYS 89 -1.077 18.368 6.084 728 1HE LYS 89 HE2 LYS 89 1.121 20.123 7.284 729 2HE LYS 89 HE3 LYS 89 -0.557 20.056 7.841 730 1HZ LYS 89 HZ1 LYS 89 0.823 18.652 9.147 731 2HZ LYS 89 HZ2 LYS 89 -0.285 17.752 8.323 732 3HZ LYS 89 HZ3 LYS 89 1.289 17.767 7.838 733 H GLY 90 H GLY 90 0.523 16.399 1.252 734 1HA GLY 90 HA2 GLY 90 -1.642 16.404 -0.571 735 2HA GLY 90 HA3 GLY 90 -0.767 17.937 -0.746 736 1H MET 1 H1 MET 1 16.622 4.808 -4.856 737 2H MET 1 H2 MET 1 15.461 3.910 -4.126 738 3H MET 1 H3 MET 1 15.859 5.380 -3.513 739 HA MET 1 HA MET 1 15.050 6.544 -5.344 740 1HB MET 1 HB2 MET 1 15.621 4.582 -6.940 741 2HB MET 1 HB3 MET 1 14.007 3.962 -6.536 742 1HG MET 1 HG2 MET 1 13.058 6.189 -7.265 743 2HG MET 1 HG3 MET 1 14.688 6.662 -7.760 744 1HE MET 1 HE1 MET 1 12.854 6.244 -11.161 745 2HE MET 1 HE2 MET 1 12.194 6.896 -9.642 746 3HE MET 1 HE3 MET 1 13.855 7.306 -10.142 747 H ALA 2 H ALA 2 13.744 3.810 -3.567 748 HA ALA 2 HA ALA 2 12.068 3.610 -2.180 749 1HB ALA 2 HB1 ALA 2 11.499 6.577 -2.452 750 2HB ALA 2 HB2 ALA 2 11.113 5.508 -1.092 751 3HB ALA 2 HB3 ALA 2 12.800 5.879 -1.463 752 H SER 3 H SER 3 11.225 5.085 -5.213 753 HA SER 3 HA SER 3 8.627 5.391 -5.405 754 1HB SER 3 HB2 SER 3 9.043 4.250 -7.801 755 2HB SER 3 HB3 SER 3 9.680 5.834 -7.325 756 HG SER 3 HG SER 3 11.329 4.470 -8.192 757 HA PRO 4 HA PRO 4 7.329 1.017 -6.479 758 1HB PRO 4 HB2 PRO 4 8.708 -1.244 -5.644 759 2HB PRO 4 HB3 PRO 4 8.998 -0.402 -7.194 760 1HG PRO 4 HG2 PRO 4 10.456 0.008 -4.573 761 2HG PRO 4 HG3 PRO 4 11.188 -0.311 -6.175 762 1HD PRO 4 HD2 PRO 4 11.033 2.186 -5.284 763 2HD PRO 4 HD3 PRO 4 10.535 1.861 -6.966 764 H LEU 5 H LEU 5 8.773 1.388 -3.243 765 HA LEU 5 HA LEU 5 6.415 0.046 -2.074 766 1HB LEU 5 HB2 LEU 5 8.538 -0.236 -0.900 767 2HB LEU 5 HB3 LEU 5 8.680 1.521 -0.702 768 HG LEU 5 HG LEU 5 6.593 1.555 0.650 769 1HD1 LEU 5 HD11 LEU 5 5.651 -0.607 1.465 770 2HD1 LEU 5 HD12 LEU 5 5.331 -0.356 -0.244 771 3HD1 LEU 5 HD13 LEU 5 6.619 -1.478 0.266 772 1HD2 LEU 5 HD21 LEU 5 8.552 -0.536 1.638 773 2HD2 LEU 5 HD22 LEU 5 8.739 1.235 1.799 774 3HD2 LEU 5 HD23 LEU 5 7.399 0.403 2.614 775 H ASP 6 H ASP 6 7.898 3.298 -2.402 776 HA ASP 6 HA ASP 6 6.148 4.809 -0.900 777 1HB ASP 6 HB2 ASP 6 7.709 5.520 -3.375 778 2HB ASP 6 HB3 ASP 6 6.682 6.688 -2.543 779 H GLN 7 H GLN 7 5.656 3.848 -4.325 780 HA GLN 7 HA GLN 7 3.255 5.261 -4.740 781 1HB GLN 7 HB2 GLN 7 2.773 3.656 -6.505 782 2HB GLN 7 HB3 GLN 7 4.504 4.035 -6.496 783 1HG GLN 7 HG2 GLN 7 4.860 1.945 -5.125 784 2HG GLN 7 HG3 GLN 7 3.162 1.513 -5.409 785 1HE2 GLN 7 HE22 GLN 7 5.255 -0.160 -6.100 786 2HE2 GLN 7 HE21 GLN 7 5.211 -0.326 -7.861 787 H ALA 8 H ALA 8 3.738 2.123 -3.074 788 HA ALA 8 HA ALA 8 0.909 1.518 -3.000 789 1HB ALA 8 HB1 ALA 8 3.248 0.339 -1.460 790 2HB ALA 8 HB2 ALA 8 1.580 -0.262 -1.422 791 3HB ALA 8 HB3 ALA 8 2.476 -0.258 -2.951 792 H ILE 9 H ILE 9 3.241 2.649 -0.471 793 HA ILE 9 HA ILE 9 1.174 3.095 1.494 794 HB ILE 9 HB ILE 9 2.766 4.559 2.650 795 1HG1 ILE 9 HG12 ILE 9 4.648 3.938 0.358 796 2HG1 ILE 9 HG13 ILE 9 3.923 5.531 0.664 797 1HG2 ILE 9 HG21 ILE 9 4.020 1.951 1.714 798 2HG2 ILE 9 HG22 ILE 9 4.275 2.777 3.266 799 3HG2 ILE 9 HG23 ILE 9 2.701 2.079 2.899 800 1HD1 ILE 9 HD11 ILE 9 5.038 5.560 2.910 801 2HD1 ILE 9 HD12 ILE 9 5.921 4.085 2.438 802 3HD1 ILE 9 HD13 ILE 9 6.140 5.580 1.519 803 H GLY 10 H GLY 10 2.534 5.111 -1.098 804 1HA GLY 10 HA2 GLY 10 1.169 7.509 -0.882 805 2HA GLY 10 HA3 GLY 10 1.600 6.693 -2.388 806 H LEU 11 H LEU 11 -0.008 4.400 -2.283 807 HA LEU 11 HA LEU 11 -2.519 5.345 -3.132 808 1HB LEU 11 HB2 LEU 11 -1.276 3.065 -3.527 809 2HB LEU 11 HB3 LEU 11 -2.054 2.559 -2.032 810 HG LEU 11 HG LEU 11 -3.318 1.733 -3.832 811 1HD1 LEU 11 HD11 LEU 11 -4.588 2.628 -1.884 812 2HD1 LEU 11 HD12 LEU 11 -4.934 4.081 -2.866 813 3HD1 LEU 11 HD13 LEU 11 -5.490 2.492 -3.408 814 1HD2 LEU 11 HD21 LEU 11 -2.485 3.236 -5.573 815 2HD2 LEU 11 HD22 LEU 11 -4.245 3.034 -5.631 816 3HD2 LEU 11 HD23 LEU 11 -3.553 4.532 -4.979 817 H LEU 12 H LEU 12 -1.757 3.572 -0.083 818 HA LEU 12 HA LEU 12 -4.265 3.800 1.166 819 1HB LEU 12 HB2 LEU 12 -1.425 3.738 2.301 820 2HB LEU 12 HB3 LEU 12 -2.850 3.847 3.330 821 HG LEU 12 HG LEU 12 -3.733 1.754 2.406 822 1HD1 LEU 12 HD11 LEU 12 -2.179 0.204 1.212 823 2HD1 LEU 12 HD12 LEU 12 -2.577 1.608 0.226 824 3HD1 LEU 12 HD13 LEU 12 -1.004 1.519 1.063 825 1HD2 LEU 12 HD21 LEU 12 -0.956 1.617 3.643 826 2HD2 LEU 12 HD22 LEU 12 -2.506 1.745 4.506 827 3HD2 LEU 12 HD23 LEU 12 -2.123 0.280 3.605 828 H ILE 13 H ILE 13 -1.531 6.080 1.221 829 HA ILE 13 HA ILE 13 -2.733 8.019 2.943 830 HB ILE 13 HB ILE 13 -0.572 8.191 0.801 831 1HG1 ILE 13 HG12 ILE 13 -0.187 8.332 3.812 832 2HG1 ILE 13 HG13 ILE 13 -0.283 6.774 2.996 833 1HG2 ILE 13 HG21 ILE 13 -1.285 10.292 2.878 834 2HG2 ILE 13 HG22 ILE 13 0.144 10.315 1.826 835 3HG2 ILE 13 HG23 ILE 13 -1.461 10.462 1.119 836 1HD1 ILE 13 HD11 ILE 13 2.005 7.210 3.105 837 2HD1 ILE 13 HD12 ILE 13 1.589 7.612 1.443 838 3HD1 ILE 13 HD13 ILE 13 1.827 8.912 2.628 839 H GLY 14 H GLY 14 -2.530 7.860 -0.622 840 1HA GLY 14 HA2 GLY 14 -3.916 10.181 -1.293 841 2HA GLY 14 HA3 GLY 14 -3.847 8.700 -2.270 842 H ILE 15 H ILE 15 -5.217 6.836 -0.809 843 HA ILE 15 HA ILE 15 -7.960 7.468 -1.206 844 HB ILE 15 HB ILE 15 -6.402 5.276 0.148 845 1HG1 ILE 15 HG12 ILE 15 -8.579 5.367 -1.995 846 2HG1 ILE 15 HG13 ILE 15 -6.836 5.381 -2.311 847 1HG2 ILE 15 HG21 ILE 15 -8.425 4.104 0.857 848 2HG2 ILE 15 HG22 ILE 15 -8.248 5.618 1.712 849 3HG2 ILE 15 HG23 ILE 15 -9.424 5.489 0.378 850 1HD1 ILE 15 HD11 ILE 15 -8.498 3.112 -1.149 851 2HD1 ILE 15 HD12 ILE 15 -7.595 3.137 -2.667 852 3HD1 ILE 15 HD13 ILE 15 -6.723 3.124 -1.121 853 H PHE 16 H PHE 16 -6.104 7.226 1.876 854 HA PHE 16 HA PHE 16 -8.157 7.977 3.566 855 1HB PHE 16 HB2 PHE 16 -5.880 7.184 4.218 856 2HB PHE 16 HB3 PHE 16 -5.216 8.760 3.850 857 HD1 PHE 16 HD1 PHE 16 -5.915 10.781 5.242 858 HD2 PHE 16 HD2 PHE 16 -7.260 6.811 6.205 859 HE1 PHE 16 HE1 PHE 16 -6.475 11.515 7.507 860 HE2 PHE 16 HE2 PHE 16 -7.605 7.501 8.566 861 HZ PHE 16 HZ PHE 16 -7.138 9.827 9.241 862 H HIS 17 H HIS 17 -5.740 10.179 2.077 863 HA HIS 17 HA HIS 17 -6.951 12.513 3.245 864 1HB HIS 17 HB2 HIS 17 -4.642 12.067 1.355 865 2HB HIS 17 HB3 HIS 17 -5.269 13.685 1.692 866 HD1 HIS 17 HD1 HIS 17 -4.985 14.669 4.134 867 HD2 HIS 17 HD2 HIS 17 -3.550 10.752 3.581 868 HE1 HIS 17 HE1 HIS 17 -3.768 14.023 6.279 869 H LYS 18 H LYS 18 -7.476 10.850 0.147 870 HA LYS 18 HA LYS 18 -8.923 13.057 -1.031 871 1HB LYS 18 HB2 LYS 18 -8.168 11.025 -2.275 872 2HB LYS 18 HB3 LYS 18 -9.376 10.069 -1.396 873 1HG LYS 18 HG2 LYS 18 -11.170 11.586 -2.365 874 2HG LYS 18 HG3 LYS 18 -9.896 12.470 -3.205 875 1HD LYS 18 HD2 LYS 18 -10.847 10.976 -4.804 876 2HD LYS 18 HD3 LYS 18 -9.241 10.367 -4.403 877 1HE LYS 18 HE2 LYS 18 -10.853 8.533 -4.567 878 2HE LYS 18 HE3 LYS 18 -10.271 8.649 -2.904 879 1HZ LYS 18 HZ1 LYS 18 -12.656 8.354 -3.077 880 2HZ LYS 18 HZ2 LYS 18 -12.283 9.773 -2.330 881 3HZ LYS 18 HZ3 LYS 18 -12.801 9.776 -3.897 882 H TYR 19 H TYR 19 -9.863 10.238 1.005 883 HA TYR 19 HA TYR 19 -12.620 11.033 1.149 884 1HB TYR 19 HB2 TYR 19 -10.947 9.076 2.717 885 2HB TYR 19 HB3 TYR 19 -12.625 9.411 3.144 886 HD1 TYR 19 HD1 TYR 19 -10.531 7.491 0.917 887 HD2 TYR 19 HD2 TYR 19 -14.486 9.045 1.491 888 HE1 TYR 19 HE1 TYR 19 -11.236 6.408 -1.185 889 HE2 TYR 19 HE2 TYR 19 -15.259 7.746 -0.462 890 HH TYR 19 HH TYR 19 -12.989 6.006 -2.620 891 H SER 20 H SER 20 -9.867 11.727 3.418 892 HA SER 20 HA SER 20 -11.606 13.209 5.179 893 1HB SER 20 HB2 SER 20 -9.734 14.066 6.256 894 2HB SER 20 HB3 SER 20 -9.339 12.398 5.836 895 HG SER 20 HG SER 20 -7.597 13.665 5.378 896 H GLY 21 H GLY 21 -9.591 14.137 2.388 897 1HA GLY 21 HA2 GLY 21 -10.030 16.757 1.886 898 2HA GLY 21 HA3 GLY 21 -10.124 15.510 0.646 899 H LYS 22 H LYS 22 -12.376 14.205 1.009 900 HA LYS 22 HA LYS 22 -14.423 15.735 -0.009 901 1HB LYS 22 HB2 LYS 22 -14.186 13.191 0.229 902 2HB LYS 22 HB3 LYS 22 -14.937 13.378 1.827 903 1HG LYS 22 HG2 LYS 22 -16.863 14.574 0.642 904 2HG LYS 22 HG3 LYS 22 -16.133 14.078 -0.889 905 1HD LYS 22 HD2 LYS 22 -17.202 12.318 1.362 906 2HD LYS 22 HD3 LYS 22 -17.901 12.510 -0.246 907 1HE LYS 22 HE2 LYS 22 -15.243 11.157 0.431 908 2HE LYS 22 HE3 LYS 22 -16.740 10.359 -0.048 909 1HZ LYS 22 HZ1 LYS 22 -15.248 10.558 -1.872 910 2HZ LYS 22 HZ2 LYS 22 -16.591 11.467 -2.161 911 3HZ LYS 22 HZ3 LYS 22 -15.180 12.197 -1.718 912 H GLU 23 H GLU 23 -13.612 15.357 3.429 913 HA GLU 23 HA GLU 23 -15.779 17.274 4.191 914 1HB GLU 23 HB2 GLU 23 -15.730 16.188 6.409 915 2HB GLU 23 HB3 GLU 23 -16.303 15.120 5.120 916 1HG GLU 23 HG2 GLU 23 -14.176 13.949 5.030 917 2HG GLU 23 HG3 GLU 23 -13.439 15.088 6.163 918 H GLY 24 H GLY 24 -13.044 17.864 3.176 919 1HA GLY 24 HA2 GLY 24 -11.664 19.684 3.741 920 2HA GLY 24 HA3 GLY 24 -12.135 19.570 5.439 921 H ASP 25 H ASP 25 -9.694 18.872 3.229 922 HA ASP 25 HA ASP 25 -8.736 16.358 3.960 923 1HB ASP 25 HB2 ASP 25 -8.001 17.853 2.013 924 2HB ASP 25 HB3 ASP 25 -6.943 18.675 3.165 925 H LYS 26 H LYS 26 -7.800 15.532 5.729 926 HA LYS 26 HA LYS 26 -5.995 17.042 7.394 927 1HB LYS 26 HB2 LYS 26 -7.312 16.805 9.511 928 2HB LYS 26 HB3 LYS 26 -8.024 17.929 8.355 929 1HG LYS 26 HG2 LYS 26 -9.581 16.105 7.602 930 2HG LYS 26 HG3 LYS 26 -8.963 15.078 8.896 931 1HD LYS 26 HD2 LYS 26 -9.702 16.667 10.586 932 2HD LYS 26 HD3 LYS 26 -10.220 17.823 9.341 933 1HE LYS 26 HE2 LYS 26 -11.357 15.003 9.627 934 2HE LYS 26 HE3 LYS 26 -12.095 16.449 10.337 935 1HZ LYS 26 HZ1 LYS 26 -11.617 16.071 7.460 936 2HZ LYS 26 HZ2 LYS 26 -13.063 15.884 8.227 937 3HZ LYS 26 HZ3 LYS 26 -12.348 17.359 8.155 938 H HIS 27 H HIS 27 -5.455 15.565 9.387 939 HA HIS 27 HA HIS 27 -4.734 12.960 8.239 940 1HB HIS 27 HB2 HIS 27 -3.931 14.251 10.868 941 2HB HIS 27 HB3 HIS 27 -3.191 12.833 10.120 942 HD1 HIS 27 HD1 HIS 27 -1.406 13.298 8.194 943 HD2 HIS 27 HD2 HIS 27 -3.432 16.682 9.661 944 HE1 HIS 27 HE1 HIS 27 -0.207 15.345 7.242 945 H THR 28 H THR 28 -7.549 13.584 9.184 946 HA THR 28 HA THR 28 -7.932 11.149 10.737 947 HB THR 28 HB THR 28 -9.619 12.160 12.150 948 HG1 THR 28 HG1 THR 28 -10.024 14.273 12.164 949 1HG2 THR 28 HG21 THR 28 -7.293 12.050 13.018 950 2HG2 THR 28 HG22 THR 28 -6.997 13.694 12.413 951 3HG2 THR 28 HG23 THR 28 -8.196 13.418 13.686 952 H LEU 29 H LEU 29 -10.074 10.303 10.499 953 HA LEU 29 HA LEU 29 -11.695 11.393 8.213 954 1HB LEU 29 HB2 LEU 29 -11.038 8.499 8.936 955 2HB LEU 29 HB3 LEU 29 -12.429 8.926 7.945 956 HG LEU 29 HG LEU 29 -9.580 9.646 7.163 957 1HD1 LEU 29 HD11 LEU 29 -11.321 7.275 6.327 958 2HD1 LEU 29 HD12 LEU 29 -9.737 7.691 5.641 959 3HD1 LEU 29 HD13 LEU 29 -9.865 7.171 7.333 960 1HD2 LEU 29 HD21 LEU 29 -11.379 10.983 6.065 961 2HD2 LEU 29 HD22 LEU 29 -10.598 9.870 4.932 962 3HD2 LEU 29 HD23 LEU 29 -12.196 9.480 5.594 963 H SER 30 H SER 30 -13.906 11.564 8.762 964 HA SER 30 HA SER 30 -14.644 10.900 11.535 965 1HB SER 30 HB2 SER 30 -15.770 12.822 10.468 966 2HB SER 30 HB3 SER 30 -16.256 11.807 9.098 967 HG SER 30 HG SER 30 -17.265 11.755 11.735 968 H LYS 31 H LYS 31 -16.015 9.163 12.139 969 HA LYS 31 HA LYS 31 -15.353 6.781 10.946 970 1HB LYS 31 HB2 LYS 31 -16.632 5.721 12.492 971 2HB LYS 31 HB3 LYS 31 -16.167 7.205 13.284 972 1HG LYS 31 HG2 LYS 31 -18.918 6.670 12.049 973 2HG LYS 31 HG3 LYS 31 -18.472 6.482 13.743 974 1HD LYS 31 HD2 LYS 31 -17.969 8.861 13.963 975 2HD LYS 31 HD3 LYS 31 -18.320 9.151 12.256 976 1HE LYS 31 HE2 LYS 31 -20.220 9.830 13.571 977 2HE LYS 31 HE3 LYS 31 -20.674 8.401 12.627 978 1HZ LYS 31 HZ1 LYS 31 -21.412 8.283 14.904 979 2HZ LYS 31 HZ2 LYS 31 -20.329 7.082 14.592 980 3HZ LYS 31 HZ3 LYS 31 -19.863 8.404 15.457 981 H LYS 32 H LYS 32 -18.223 8.718 10.159 982 HA LYS 32 HA LYS 32 -19.345 6.632 8.428 983 1HB LYS 32 HB2 LYS 32 -20.781 8.075 9.623 984 2HB LYS 32 HB3 LYS 32 -20.102 9.530 8.833 985 1HG LYS 32 HG2 LYS 32 -20.900 8.531 6.617 986 2HG LYS 32 HG3 LYS 32 -21.700 7.263 7.551 987 1HD LYS 32 HD2 LYS 32 -22.270 10.273 7.608 988 2HD LYS 32 HD3 LYS 32 -23.253 9.005 6.881 989 1HE LYS 32 HE2 LYS 32 -24.398 9.390 8.852 990 2HE LYS 32 HE3 LYS 32 -23.403 7.998 9.297 991 1HZ LYS 32 HZ1 LYS 32 -23.378 9.714 10.955 992 2HZ LYS 32 HZ2 LYS 32 -21.868 9.581 10.312 993 3HZ LYS 32 HZ3 LYS 32 -22.841 10.833 9.874 994 H GLU 33 H GLU 33 -17.060 9.321 8.070 995 HA GLU 33 HA GLU 33 -17.178 9.368 5.165 996 1HB GLU 33 HB2 GLU 33 -16.240 11.241 6.556 997 2HB GLU 33 HB3 GLU 33 -14.886 10.184 7.010 998 1HG GLU 33 HG2 GLU 33 -14.150 11.573 5.196 999 2HG GLU 33 HG3 GLU 33 -14.325 9.938 4.572 1000 H LEU 34 H LEU 34 -15.284 7.722 7.699 1001 HA LEU 34 HA LEU 34 -13.717 6.066 6.028 1002 1HB LEU 34 HB2 LEU 34 -13.171 6.217 8.299 1003 2HB LEU 34 HB3 LEU 34 -14.758 5.731 8.848 1004 HG LEU 34 HG LEU 34 -13.037 4.040 9.182 1005 1HD1 LEU 34 HD11 LEU 34 -15.531 3.488 8.811 1006 2HD1 LEU 34 HD12 LEU 34 -15.017 2.841 7.245 1007 3HD1 LEU 34 HD13 LEU 34 -14.353 2.176 8.731 1008 1HD2 LEU 34 HD21 LEU 34 -12.891 3.879 6.140 1009 2HD2 LEU 34 HD22 LEU 34 -11.622 4.426 7.244 1010 3HD2 LEU 34 HD23 LEU 34 -12.149 2.733 7.243 1011 H LYS 35 H LYS 35 -17.074 5.420 7.379 1012 HA LYS 35 HA LYS 35 -17.437 2.993 5.990 1013 1HB LYS 35 HB2 LYS 35 -19.545 5.160 6.387 1014 2HB LYS 35 HB3 LYS 35 -19.811 3.547 5.750 1015 1HG LYS 35 HG2 LYS 35 -18.792 2.646 7.955 1016 2HG LYS 35 HG3 LYS 35 -18.921 4.317 8.531 1017 1HD LYS 35 HD2 LYS 35 -20.950 3.321 9.235 1018 2HD LYS 35 HD3 LYS 35 -21.395 4.228 7.789 1019 1HE LYS 35 HE2 LYS 35 -21.162 2.046 6.456 1020 2HE LYS 35 HE3 LYS 35 -20.844 1.220 7.980 1021 1HZ LYS 35 HZ1 LYS 35 -23.124 1.067 7.323 1022 2HZ LYS 35 HZ2 LYS 35 -23.030 1.965 8.700 1023 3HZ LYS 35 HZ3 LYS 35 -23.282 2.705 7.251 1024 H GLU 36 H GLU 36 -17.927 6.320 4.701 1025 HA GLU 36 HA GLU 36 -18.767 5.530 2.137 1026 1HB GLU 36 HB2 GLU 36 -18.364 7.951 3.355 1027 2HB GLU 36 HB3 GLU 36 -16.985 7.937 2.255 1028 1HG GLU 36 HG2 GLU 36 -19.940 7.650 1.564 1029 2HG GLU 36 HG3 GLU 36 -18.900 9.033 1.223 1030 H LEU 37 H LEU 37 -15.440 6.159 3.319 1031 HA LEU 37 HA LEU 37 -13.975 5.513 1.011 1032 1HB LEU 37 HB2 LEU 37 -13.044 6.502 3.069 1033 2HB LEU 37 HB3 LEU 37 -13.300 5.021 3.958 1034 HG LEU 37 HG LEU 37 -11.421 5.100 1.596 1035 1HD1 LEU 37 HD11 LEU 37 -10.701 6.798 3.258 1036 2HD1 LEU 37 HD12 LEU 37 -10.882 5.604 4.564 1037 3HD1 LEU 37 HD13 LEU 37 -9.630 5.400 3.336 1038 1HD2 LEU 37 HD21 LEU 37 -11.670 3.248 4.018 1039 2HD2 LEU 37 HD22 LEU 37 -11.920 2.797 2.314 1040 3HD2 LEU 37 HD23 LEU 37 -10.316 3.250 2.879 1041 H ILE 38 H ILE 38 -15.019 3.283 3.598 1042 HA ILE 38 HA ILE 38 -13.941 0.989 2.307 1043 HB ILE 38 HB ILE 38 -16.230 1.313 4.296 1044 1HG1 ILE 38 HG12 ILE 38 -13.318 0.393 4.548 1045 2HG1 ILE 38 HG13 ILE 38 -13.961 1.959 5.060 1046 1HG2 ILE 38 HG21 ILE 38 -14.901 -1.296 3.444 1047 2HG2 ILE 38 HG22 ILE 38 -16.149 -1.095 4.685 1048 3HG2 ILE 38 HG23 ILE 38 -16.557 -0.827 3.012 1049 1HD1 ILE 38 HD11 ILE 38 -15.555 0.672 6.590 1050 2HD1 ILE 38 HD12 ILE 38 -14.581 -0.763 6.180 1051 3HD1 ILE 38 HD13 ILE 38 -13.816 0.618 6.996 1052 H GLN 39 H GLN 39 -17.360 2.196 2.296 1053 HA GLN 39 HA GLN 39 -18.289 0.131 0.595 1054 1HB GLN 39 HB2 GLN 39 -19.296 2.974 0.988 1055 2HB GLN 39 HB3 GLN 39 -20.201 1.719 0.133 1056 1HG GLN 39 HG2 GLN 39 -19.294 1.456 3.043 1057 2HG GLN 39 HG3 GLN 39 -20.861 2.091 2.541 1058 1HE2 GLN 39 HE22 GLN 39 -20.962 0.037 4.238 1059 2HE2 GLN 39 HE21 GLN 39 -21.520 -1.402 3.406 1060 H LYS 40 H LYS 40 -16.721 3.255 -0.219 1061 HA LYS 40 HA LYS 40 -17.373 2.930 -3.009 1062 1HB LYS 40 HB2 LYS 40 -17.152 5.129 -1.772 1063 2HB LYS 40 HB3 LYS 40 -15.426 4.832 -1.651 1064 1HG LYS 40 HG2 LYS 40 -15.934 6.384 -3.469 1065 2HG LYS 40 HG3 LYS 40 -15.204 4.914 -4.103 1066 1HD LYS 40 HD2 LYS 40 -17.078 5.757 -5.496 1067 2HD LYS 40 HD3 LYS 40 -17.337 4.110 -4.939 1068 1HE LYS 40 HE2 LYS 40 -19.392 5.498 -4.806 1069 2HE LYS 40 HE3 LYS 40 -18.922 4.895 -3.216 1070 1HZ LYS 40 HZ1 LYS 40 -18.340 7.586 -4.244 1071 2HZ LYS 40 HZ2 LYS 40 -19.539 7.198 -3.180 1072 3HZ LYS 40 HZ3 LYS 40 -17.966 7.021 -2.738 1073 H GLU 41 H GLU 41 -14.405 2.476 -1.067 1074 HA GLU 41 HA GLU 41 -12.866 1.636 -3.429 1075 1HB GLU 41 HB2 GLU 41 -11.817 2.765 -1.474 1076 2HB GLU 41 HB3 GLU 41 -12.307 1.436 -0.431 1077 1HG GLU 41 HG2 GLU 41 -10.001 1.142 -0.958 1078 2HG GLU 41 HG3 GLU 41 -10.891 -0.133 -1.782 1079 H LEU 42 H LEU 42 -14.042 0.041 -0.465 1080 HA LEU 42 HA LEU 42 -13.593 -2.650 -1.648 1081 1HB LEU 42 HB2 LEU 42 -14.430 -1.886 1.168 1082 2HB LEU 42 HB3 LEU 42 -14.012 -3.497 0.581 1083 HG LEU 42 HG LEU 42 -12.122 -1.103 0.804 1084 1HD1 LEU 42 HD11 LEU 42 -12.725 -2.109 2.970 1085 2HD1 LEU 42 HD12 LEU 42 -12.263 -3.714 2.367 1086 3HD1 LEU 42 HD13 LEU 42 -11.037 -2.445 2.561 1087 1HD2 LEU 42 HD21 LEU 42 -10.328 -2.774 0.275 1088 2HD2 LEU 42 HD22 LEU 42 -11.585 -3.958 -0.136 1089 3HD2 LEU 42 HD23 LEU 42 -11.401 -2.467 -1.089 1090 H THR 43 H THR 43 -15.227 -2.026 -3.261 1091 HA THR 43 HA THR 43 -17.989 -1.719 -2.615 1092 HB THR 43 HB THR 43 -18.280 -2.388 -5.020 1093 HG1 THR 43 HG1 THR 43 -16.549 -3.866 -5.029 1094 1HG2 THR 43 HG21 THR 43 -17.050 -0.508 -5.992 1095 2HG2 THR 43 HG22 THR 43 -17.728 -0.030 -4.423 1096 3HG2 THR 43 HG23 THR 43 -16.003 -0.412 -4.569 1097 H ILE 44 H ILE 44 -17.936 -3.408 -0.842 1098 HA ILE 44 HA ILE 44 -17.756 -6.143 -1.295 1099 HB ILE 44 HB ILE 44 -19.165 -6.427 0.726 1100 1HG1 ILE 44 HG12 ILE 44 -19.616 -3.415 0.472 1101 2HG1 ILE 44 HG13 ILE 44 -20.827 -4.708 0.511 1102 1HG2 ILE 44 HG21 ILE 44 -16.696 -5.888 0.760 1103 2HG2 ILE 44 HG22 ILE 44 -17.135 -4.207 1.124 1104 3HG2 ILE 44 HG23 ILE 44 -17.577 -5.510 2.239 1105 1HD1 ILE 44 HD11 ILE 44 -20.090 -5.225 2.868 1106 2HD1 ILE 44 HD12 ILE 44 -19.056 -3.774 2.791 1107 3HD1 ILE 44 HD13 ILE 44 -20.809 -3.617 2.640 1108 H GLY 45 H GLY 45 -20.567 -4.091 -1.883 1109 1HA GLY 45 HA2 GLY 45 -22.399 -4.491 -3.256 1110 2HA GLY 45 HA3 GLY 45 -21.739 -6.078 -3.677 1111 H SER 46 H SER 46 -21.554 -7.371 -1.209 1112 HA SER 46 HA SER 46 -24.249 -8.085 -0.545 1113 1HB SER 46 HB2 SER 46 -22.848 -9.375 1.254 1114 2HB SER 46 HB3 SER 46 -22.617 -9.771 -0.457 1115 HG SER 46 HG SER 46 -20.674 -9.302 0.924 1116 H LYS 47 H LYS 47 -24.787 -5.702 -0.100 1117 HA LYS 47 HA LYS 47 -23.940 -4.251 2.086 1118 1HB LYS 47 HB2 LYS 47 -26.752 -4.462 0.948 1119 2HB LYS 47 HB3 LYS 47 -26.231 -3.196 2.062 1120 1HG LYS 47 HG2 LYS 47 -24.999 -3.653 -0.695 1121 2HG LYS 47 HG3 LYS 47 -26.273 -2.497 -0.315 1122 1HD LYS 47 HD2 LYS 47 -24.770 -1.350 1.304 1123 2HD LYS 47 HD3 LYS 47 -23.453 -2.457 0.868 1124 1HE LYS 47 HE2 LYS 47 -23.540 -1.711 -1.473 1125 2HE LYS 47 HE3 LYS 47 -24.897 -0.629 -1.103 1126 1HZ LYS 47 HZ1 LYS 47 -22.210 -0.436 0.071 1127 2HZ LYS 47 HZ2 LYS 47 -22.807 0.515 -1.136 1128 3HZ LYS 47 HZ3 LYS 47 -23.477 0.573 0.369 1129 H LEU 48 H LEU 48 -25.830 -7.176 2.317 1130 HA LEU 48 HA LEU 48 -26.939 -6.908 4.905 1131 1HB LEU 48 HB2 LEU 48 -25.614 -9.299 3.547 1132 2HB LEU 48 HB3 LEU 48 -26.476 -9.388 5.078 1133 HG LEU 48 HG LEU 48 -27.861 -10.216 3.341 1134 1HD1 LEU 48 HD11 LEU 48 -29.886 -8.970 3.717 1135 2HD1 LEU 48 HD12 LEU 48 -28.929 -8.953 5.208 1136 3HD1 LEU 48 HD13 LEU 48 -28.991 -7.512 4.165 1137 1HD2 LEU 48 HD21 LEU 48 -28.668 -9.031 1.446 1138 2HD2 LEU 48 HD22 LEU 48 -27.888 -7.524 1.931 1139 3HD2 LEU 48 HD23 LEU 48 -26.900 -8.919 1.418 1140 H GLN 49 H GLN 49 -23.595 -7.422 3.888 1141 HA GLN 49 HA GLN 49 -22.582 -7.981 6.545 1142 1HB GLN 49 HB2 GLN 49 -21.168 -7.160 3.979 1143 2HB GLN 49 HB3 GLN 49 -20.370 -7.673 5.471 1144 1HG GLN 49 HG2 GLN 49 -21.508 -9.875 5.345 1145 2HG GLN 49 HG3 GLN 49 -22.325 -9.377 3.857 1146 1HE2 GLN 49 HE22 GLN 49 -18.910 -9.297 5.113 1147 2HE2 GLN 49 HE21 GLN 49 -18.236 -9.984 3.646 1148 H ASP 50 H ASP 50 -23.823 -5.068 5.316 1149 HA ASP 50 HA ASP 50 -21.980 -3.150 6.178 1150 1HB ASP 50 HB2 ASP 50 -25.018 -3.099 6.194 1151 2HB ASP 50 HB3 ASP 50 -24.014 -1.715 6.633 1152 H ALA 51 H ALA 51 -24.113 -5.197 8.136 1153 HA ALA 51 HA ALA 51 -23.798 -3.969 10.675 1154 1HB ALA 51 HB1 ALA 51 -24.127 -6.247 11.562 1155 2HB ALA 51 HB2 ALA 51 -25.280 -5.878 10.263 1156 3HB ALA 51 HB3 ALA 51 -23.881 -6.927 9.940 1157 H GLU 52 H GLU 52 -21.663 -6.252 8.915 1158 HA GLU 52 HA GLU 52 -19.675 -6.414 11.016 1159 1HB GLU 52 HB2 GLU 52 -19.284 -7.007 8.052 1160 2HB GLU 52 HB3 GLU 52 -18.354 -7.609 9.427 1161 1HG GLU 52 HG2 GLU 52 -21.224 -8.336 8.681 1162 2HG GLU 52 HG3 GLU 52 -19.806 -9.381 8.659 1163 H ILE 53 H ILE 53 -20.137 -4.513 8.016 1164 HA ILE 53 HA ILE 53 -17.688 -3.081 8.193 1165 HB ILE 53 HB ILE 53 -20.300 -2.007 7.090 1166 1HG1 ILE 53 HG12 ILE 53 -19.802 -4.049 5.887 1167 2HG1 ILE 53 HG13 ILE 53 -19.366 -2.677 4.881 1168 1HG2 ILE 53 HG21 ILE 53 -17.429 -1.103 6.749 1169 2HG2 ILE 53 HG22 ILE 53 -18.769 -0.582 5.706 1170 3HG2 ILE 53 HG23 ILE 53 -18.783 -0.192 7.427 1171 1HD1 ILE 53 HD11 ILE 53 -17.476 -4.501 6.436 1172 2HD1 ILE 53 HD12 ILE 53 -17.658 -4.376 4.686 1173 3HD1 ILE 53 HD13 ILE 53 -16.950 -3.030 5.589 1174 H VAL 54 H VAL 54 -20.867 -2.303 9.805 1175 HA VAL 54 HA VAL 54 -19.686 0.042 10.921 1176 HB VAL 54 HB VAL 54 -21.547 0.138 12.537 1177 1HG1 VAL 54 HG11 VAL 54 -21.413 1.379 10.412 1178 2HG1 VAL 54 HG12 VAL 54 -22.173 0.007 9.574 1179 3HG1 VAL 54 HG13 VAL 54 -23.080 0.929 10.796 1180 1HG2 VAL 54 HG21 VAL 54 -22.201 -2.234 12.610 1181 2HG2 VAL 54 HG22 VAL 54 -23.533 -1.146 12.189 1182 3HG2 VAL 54 HG23 VAL 54 -22.749 -2.089 10.920 1183 H LYS 55 H LYS 55 -19.840 -3.313 12.171 1184 HA LYS 55 HA LYS 55 -18.674 -2.679 14.701 1185 1HB LYS 55 HB2 LYS 55 -19.590 -4.863 14.301 1186 2HB LYS 55 HB3 LYS 55 -18.469 -5.170 12.971 1187 1HG LYS 55 HG2 LYS 55 -17.871 -6.364 15.055 1188 2HG LYS 55 HG3 LYS 55 -16.581 -5.314 14.462 1189 1HD LYS 55 HD2 LYS 55 -17.119 -3.612 16.160 1190 2HD LYS 55 HD3 LYS 55 -18.517 -4.559 16.708 1191 1HE LYS 55 HE2 LYS 55 -17.063 -6.319 17.530 1192 2HE LYS 55 HE3 LYS 55 -15.650 -5.612 16.722 1193 1HZ LYS 55 HZ1 LYS 55 -17.132 -4.311 18.889 1194 2HZ LYS 55 HZ2 LYS 55 -15.704 -5.121 19.053 1195 3HZ LYS 55 HZ3 LYS 55 -15.770 -3.752 18.137 1196 H LEU 56 H LEU 56 -17.116 -3.546 11.585 1197 HA LEU 56 HA LEU 56 -14.429 -3.203 12.408 1198 1HB LEU 56 HB2 LEU 56 -14.906 -4.364 10.456 1199 2HB LEU 56 HB3 LEU 56 -15.876 -3.075 9.760 1200 HG LEU 56 HG LEU 56 -13.002 -2.388 10.301 1201 1HD1 LEU 56 HD11 LEU 56 -12.770 -4.665 9.359 1202 2HD1 LEU 56 HD12 LEU 56 -13.914 -4.261 8.060 1203 3HD1 LEU 56 HD13 LEU 56 -12.337 -3.457 8.131 1204 1HD2 LEU 56 HD21 LEU 56 -14.594 -0.776 9.223 1205 2HD2 LEU 56 HD22 LEU 56 -13.292 -1.277 8.128 1206 3HD2 LEU 56 HD23 LEU 56 -14.925 -1.981 7.974 1207 H MET 57 H MET 57 -16.733 -0.805 11.091 1208 HA MET 57 HA MET 57 -14.980 1.426 11.022 1209 1HB MET 57 HB2 MET 57 -17.028 1.512 9.835 1210 2HB MET 57 HB3 MET 57 -17.963 1.124 11.279 1211 1HG MET 57 HG2 MET 57 -16.368 3.660 11.209 1212 2HG MET 57 HG3 MET 57 -17.928 3.571 10.401 1213 1HE MET 57 HE1 MET 57 -20.487 3.167 13.307 1214 2HE MET 57 HE2 MET 57 -20.268 3.354 11.551 1215 3HE MET 57 HE3 MET 57 -19.822 1.828 12.364 1216 H ASP 58 H ASP 58 -17.138 0.203 13.625 1217 HA ASP 58 HA ASP 58 -16.468 2.148 15.583 1218 1HB ASP 58 HB2 ASP 58 -18.312 0.777 16.032 1219 2HB ASP 58 HB3 ASP 58 -17.424 -0.715 15.740 1220 H ASP 59 H ASP 59 -14.938 -1.010 14.834 1221 HA ASP 59 HA ASP 59 -12.910 -0.840 16.808 1222 1HB ASP 59 HB2 ASP 59 -12.765 -2.246 14.112 1223 2HB ASP 59 HB3 ASP 59 -11.704 -2.523 15.497 1224 H LEU 60 H LEU 60 -12.827 0.308 13.400 1225 HA LEU 60 HA LEU 60 -10.198 1.458 13.503 1226 1HB LEU 60 HB2 LEU 60 -12.699 1.906 11.875 1227 2HB LEU 60 HB3 LEU 60 -11.389 3.076 11.743 1228 HG LEU 60 HG LEU 60 -10.747 0.147 11.419 1229 1HD1 LEU 60 HD11 LEU 60 -12.678 0.455 9.941 1230 2HD1 LEU 60 HD12 LEU 60 -11.926 1.912 9.256 1231 3HD1 LEU 60 HD13 LEU 60 -11.188 0.329 8.976 1232 1HD2 LEU 60 HD21 LEU 60 -9.739 2.720 10.082 1233 2HD2 LEU 60 HD22 LEU 60 -8.886 1.807 11.348 1234 3HD2 LEU 60 HD23 LEU 60 -9.130 1.108 9.728 1235 H ASP 61 H ASP 61 -13.413 2.981 14.084 1236 HA ASP 61 HA ASP 61 -12.240 5.484 14.738 1237 1HB ASP 61 HB2 ASP 61 -14.311 6.373 15.023 1238 2HB ASP 61 HB3 ASP 61 -14.530 5.149 13.778 1239 H ARG 62 H ARG 62 -12.730 2.731 16.746 1240 HA ARG 62 HA ARG 62 -12.704 3.416 19.305 1241 1HB ARG 62 HB2 ARG 62 -11.940 1.211 18.291 1242 2HB ARG 62 HB3 ARG 62 -10.369 1.948 18.003 1243 1HG ARG 62 HG2 ARG 62 -10.135 0.655 19.960 1244 2HG ARG 62 HG3 ARG 62 -10.147 2.332 20.502 1245 1HD ARG 62 HD2 ARG 62 -11.467 0.936 21.986 1246 2HD ARG 62 HD3 ARG 62 -12.536 2.074 21.197 1247 HE ARG 62 HE ARG 62 -12.225 -0.862 20.697 1248 1HH1 ARG 62 HH12 ARG 62 -14.106 2.068 19.993 1249 2HH1 ARG 62 HH11 ARG 62 -15.369 1.216 19.164 1250 1HH2 ARG 62 HH22 ARG 62 -13.824 -1.960 19.540 1251 2HH2 ARG 62 HH21 ARG 62 -15.225 -1.118 18.937 1252 H ASN 63 H ASN 63 -10.082 4.175 17.097 1253 HA ASN 63 HA ASN 63 -8.135 5.571 18.304 1254 1HB ASN 63 HB2 ASN 63 -8.424 5.439 15.892 1255 2HB ASN 63 HB3 ASN 63 -9.912 6.367 15.973 1256 1HD2 ASN 63 HD22 ASN 63 -9.801 8.611 15.878 1257 2HD2 ASN 63 HD21 ASN 63 -8.287 9.498 15.836 1258 H LYS 64 H LYS 64 -11.180 7.229 17.478 1259 HA LYS 64 HA LYS 64 -11.238 8.815 19.909 1260 1HB LYS 64 HB2 LYS 64 -10.609 10.246 17.291 1261 2HB LYS 64 HB3 LYS 64 -11.115 11.026 18.792 1262 1HG LYS 64 HG2 LYS 64 -9.082 10.174 19.931 1263 2HG LYS 64 HG3 LYS 64 -8.519 9.523 18.384 1264 1HD LYS 64 HD2 LYS 64 -8.618 11.806 17.378 1265 2HD LYS 64 HD3 LYS 64 -9.153 12.450 18.935 1266 1HE LYS 64 HE2 LYS 64 -6.756 12.835 18.668 1267 2HE LYS 64 HE3 LYS 64 -7.036 11.697 19.996 1268 1HZ LYS 64 HZ1 LYS 64 -5.252 11.012 18.566 1269 2HZ LYS 64 HZ2 LYS 64 -6.477 9.916 18.506 1270 3HZ LYS 64 HZ3 LYS 64 -6.251 10.968 17.257 1271 H ASP 65 H ASP 65 -12.984 6.989 18.773 1272 HA ASP 65 HA ASP 65 -15.143 6.625 18.467 1273 1HB ASP 65 HB2 ASP 65 -16.722 8.040 19.779 1274 2HB ASP 65 HB3 ASP 65 -15.347 7.372 20.659 1275 H GLN 66 H GLN 66 -15.336 10.137 18.068 1276 HA GLN 66 HA GLN 66 -17.206 10.084 15.890 1277 1HB GLN 66 HB2 GLN 66 -16.909 12.051 17.295 1278 2HB GLN 66 HB3 GLN 66 -15.194 12.149 16.886 1279 1HG GLN 66 HG2 GLN 66 -16.560 13.839 15.694 1280 2HG GLN 66 HG3 GLN 66 -15.671 12.781 14.601 1281 1HE2 GLN 66 HE22 GLN 66 -18.862 12.554 16.328 1282 2HE2 GLN 66 HE21 GLN 66 -19.768 12.189 14.871 1283 H GLU 67 H GLU 67 -13.618 10.052 16.126 1284 HA GLU 67 HA GLU 67 -13.529 9.672 13.177 1285 1HB GLU 67 HB2 GLU 67 -11.753 11.317 12.965 1286 2HB GLU 67 HB3 GLU 67 -13.228 12.049 13.601 1287 1HG GLU 67 HG2 GLU 67 -12.242 11.938 15.912 1288 2HG GLU 67 HG3 GLU 67 -10.760 11.261 15.211 1289 H VAL 68 H VAL 68 -11.801 8.866 12.270 1290 HA VAL 68 HA VAL 68 -10.047 7.017 13.806 1291 HB VAL 68 HB VAL 68 -10.291 7.304 10.786 1292 1HG1 VAL 68 HG11 VAL 68 -9.518 4.961 12.563 1293 2HG1 VAL 68 HG12 VAL 68 -9.519 4.972 10.790 1294 3HG1 VAL 68 HG13 VAL 68 -8.375 5.988 11.670 1295 1HG2 VAL 68 HG21 VAL 68 -12.595 6.847 11.509 1296 2HG2 VAL 68 HG22 VAL 68 -11.879 5.432 10.742 1297 3HG2 VAL 68 HG23 VAL 68 -12.022 5.490 12.503 1298 H ASN 69 H ASN 69 -7.682 7.346 13.492 1299 HA ASN 69 HA ASN 69 -6.943 9.880 12.121 1300 1HB ASN 69 HB2 ASN 69 -5.507 10.521 13.661 1301 2HB ASN 69 HB3 ASN 69 -6.403 9.507 14.777 1302 1HD2 ASN 69 HD22 ASN 69 -5.314 7.587 15.566 1303 2HD2 ASN 69 HD21 ASN 69 -3.621 7.280 15.209 1304 H PHE 70 H PHE 70 -5.081 9.863 10.877 1305 HA PHE 70 HA PHE 70 -4.764 7.896 9.042 1306 1HB PHE 70 HB2 PHE 70 -3.821 10.123 8.837 1307 2HB PHE 70 HB3 PHE 70 -2.665 9.804 10.130 1308 HD1 PHE 70 HD1 PHE 70 -3.697 8.782 6.688 1309 HD2 PHE 70 HD2 PHE 70 -0.602 8.614 9.694 1310 HE1 PHE 70 HE1 PHE 70 -2.236 7.530 5.130 1311 HE2 PHE 70 HE2 PHE 70 0.867 7.426 8.117 1312 HZ PHE 70 HZ PHE 70 0.046 6.851 5.832 1313 H GLN 71 H GLN 71 -2.662 8.075 11.996 1314 HA GLN 71 HA GLN 71 -1.081 5.828 11.206 1315 1HB GLN 71 HB2 GLN 71 -0.326 7.386 12.938 1316 2HB GLN 71 HB3 GLN 71 -1.680 6.934 13.983 1317 1HG GLN 71 HG2 GLN 71 0.376 5.831 14.704 1318 2HG GLN 71 HG3 GLN 71 -0.804 4.630 14.195 1319 1HE2 GLN 71 HE22 GLN 71 0.366 2.907 13.218 1320 2HE2 GLN 71 HE21 GLN 71 1.755 3.186 12.177 1321 H GLU 72 H GLU 72 -4.090 6.099 13.142 1322 HA GLU 72 HA GLU 72 -4.042 3.327 13.939 1323 1HB GLU 72 HB2 GLU 72 -5.254 5.158 15.148 1324 2HB GLU 72 HB3 GLU 72 -6.481 5.150 13.874 1325 1HG GLU 72 HG2 GLU 72 -5.639 2.709 15.538 1326 2HG GLU 72 HG3 GLU 72 -6.966 3.764 15.991 1327 H TYR 73 H TYR 73 -5.577 5.178 11.292 1328 HA TYR 73 HA TYR 73 -6.940 3.065 10.011 1329 1HB TYR 73 HB2 TYR 73 -7.419 5.159 9.214 1330 2HB TYR 73 HB3 TYR 73 -5.752 5.672 9.139 1331 HD1 TYR 73 HD1 TYR 73 -4.359 5.314 7.216 1332 HD2 TYR 73 HD2 TYR 73 -8.395 3.802 7.349 1333 HE1 TYR 73 HE1 TYR 73 -4.375 5.157 4.756 1334 HE2 TYR 73 HE2 TYR 73 -8.439 3.733 4.867 1335 HH TYR 73 HH TYR 73 -5.745 4.975 2.886 1336 H ILE 74 H ILE 74 -3.500 4.126 9.405 1337 HA ILE 74 HA ILE 74 -2.988 1.999 7.575 1338 HB ILE 74 HB ILE 74 -1.025 3.393 9.433 1339 1HG1 ILE 74 HG12 ILE 74 -2.142 4.982 7.886 1340 2HG1 ILE 74 HG13 ILE 74 -0.419 4.814 7.626 1341 1HG2 ILE 74 HG21 ILE 74 -0.625 1.496 7.093 1342 2HG2 ILE 74 HG22 ILE 74 0.635 2.625 7.605 1343 3HG2 ILE 74 HG23 ILE 74 0.051 1.401 8.731 1344 1HD1 ILE 74 HD11 ILE 74 -1.591 4.951 5.493 1345 2HD1 ILE 74 HD12 ILE 74 -0.830 3.371 5.651 1346 3HD1 ILE 74 HD13 ILE 74 -2.587 3.550 5.916 1347 H THR 75 H THR 75 -2.388 2.156 11.093 1348 HA THR 75 HA THR 75 -1.239 -0.389 11.448 1349 HB THR 75 HB THR 75 -3.081 1.119 13.358 1350 HG1 THR 75 HG1 THR 75 -1.427 2.424 12.667 1351 1HG2 THR 75 HG21 THR 75 -2.637 -1.140 14.180 1352 2HG2 THR 75 HG22 THR 75 -0.903 -0.941 13.869 1353 3HG2 THR 75 HG23 THR 75 -1.698 0.035 15.119 1354 H PHE 76 H PHE 76 -4.671 0.586 11.528 1355 HA PHE 76 HA PHE 76 -5.764 -1.987 12.046 1356 1HB PHE 76 HB2 PHE 76 -6.976 0.144 12.386 1357 2HB PHE 76 HB3 PHE 76 -7.015 0.395 10.644 1358 HD1 PHE 76 HD1 PHE 76 -8.414 -1.496 13.486 1359 HD2 PHE 76 HD2 PHE 76 -8.400 -1.124 9.182 1360 HE1 PHE 76 HE1 PHE 76 -10.283 -3.118 13.326 1361 HE2 PHE 76 HE2 PHE 76 -10.330 -2.637 9.045 1362 HZ PHE 76 HZ PHE 76 -11.198 -3.749 11.095 1363 H LEU 77 H LEU 77 -5.080 -0.229 8.932 1364 HA LEU 77 HA LEU 77 -6.098 -2.329 7.283 1365 1HB LEU 77 HB2 LEU 77 -3.989 -0.207 6.792 1366 2HB LEU 77 HB3 LEU 77 -4.441 -1.390 5.565 1367 HG LEU 77 HG LEU 77 -6.469 0.449 6.917 1368 1HD1 LEU 77 HD11 LEU 77 -5.054 0.765 4.232 1369 2HD1 LEU 77 HD12 LEU 77 -6.446 1.703 4.798 1370 3HD1 LEU 77 HD13 LEU 77 -4.899 1.829 5.658 1371 1HD2 LEU 77 HD21 LEU 77 -7.817 -0.122 4.871 1372 2HD2 LEU 77 HD22 LEU 77 -6.585 -1.333 4.445 1373 3HD2 LEU 77 HD23 LEU 77 -7.559 -1.494 5.937 1374 H GLY 78 H GLY 78 -2.994 -1.999 8.984 1375 1HA GLY 78 HA2 GLY 78 -1.773 -4.363 7.958 1376 2HA GLY 78 HA3 GLY 78 -1.527 -3.691 9.588 1377 H ALA 79 H ALA 79 -3.968 -3.933 10.788 1378 HA ALA 79 HA ALA 79 -4.206 -6.708 11.407 1379 1HB ALA 79 HB1 ALA 79 -6.222 -6.134 12.611 1380 2HB ALA 79 HB2 ALA 79 -4.988 -4.893 12.901 1381 3HB ALA 79 HB3 ALA 79 -6.340 -4.570 11.794 1382 H LEU 80 H LEU 80 -6.034 -4.686 9.099 1383 HA LEU 80 HA LEU 80 -7.895 -6.648 8.340 1384 1HB LEU 80 HB2 LEU 80 -7.780 -4.054 7.842 1385 2HB LEU 80 HB3 LEU 80 -6.878 -4.547 6.414 1386 HG LEU 80 HG LEU 80 -8.819 -5.971 5.727 1387 1HD1 LEU 80 HD11 LEU 80 -9.986 -6.472 7.795 1388 2HD1 LEU 80 HD12 LEU 80 -10.104 -4.747 8.205 1389 3HD1 LEU 80 HD13 LEU 80 -11.045 -5.421 6.863 1390 1HD2 LEU 80 HD21 LEU 80 -8.550 -3.627 4.926 1391 2HD2 LEU 80 HD22 LEU 80 -10.258 -4.070 5.071 1392 3HD2 LEU 80 HD23 LEU 80 -9.504 -3.058 6.319 1393 H ALA 81 H ALA 81 -4.689 -5.822 7.014 1394 HA ALA 81 HA ALA 81 -4.543 -7.752 4.945 1395 1HB ALA 81 HB1 ALA 81 -2.387 -6.530 6.685 1396 2HB ALA 81 HB2 ALA 81 -2.084 -7.591 5.303 1397 3HB ALA 81 HB3 ALA 81 -2.913 -6.029 5.086 1398 H MET 82 H MET 82 -3.794 -8.050 8.482 1399 HA MET 82 HA MET 82 -3.120 -10.840 8.263 1400 1HB MET 82 HB2 MET 82 -4.071 -9.279 10.697 1401 2HB MET 82 HB3 MET 82 -3.468 -10.943 10.704 1402 1HG MET 82 HG2 MET 82 -1.363 -10.076 9.574 1403 2HG MET 82 HG3 MET 82 -1.917 -8.445 9.986 1404 1HE MET 82 HE1 MET 82 -1.851 -8.637 13.932 1405 2HE MET 82 HE2 MET 82 -2.223 -7.613 12.525 1406 3HE MET 82 HE3 MET 82 -3.245 -9.024 12.905 1407 H ILE 83 H ILE 83 -6.239 -9.216 8.833 1408 HA ILE 83 HA ILE 83 -7.747 -11.614 9.264 1409 HB ILE 83 HB ILE 83 -8.547 -8.874 8.240 1410 1HG1 ILE 83 HG12 ILE 83 -9.147 -10.320 10.863 1411 2HG1 ILE 83 HG13 ILE 83 -7.764 -9.250 10.657 1412 1HG2 ILE 83 HG21 ILE 83 -10.906 -9.588 8.583 1413 2HG2 ILE 83 HG22 ILE 83 -10.139 -10.478 7.280 1414 3HG2 ILE 83 HG23 ILE 83 -10.347 -11.249 8.868 1415 1HD1 ILE 83 HD11 ILE 83 -9.296 -7.367 10.098 1416 2HD1 ILE 83 HD12 ILE 83 -10.683 -8.421 10.458 1417 3HD1 ILE 83 HD13 ILE 83 -9.520 -8.021 11.727 1418 H TYR 84 H TYR 84 -6.838 -9.880 6.253 1419 HA TYR 84 HA TYR 84 -7.896 -12.001 4.510 1420 1HB TYR 84 HB2 TYR 84 -5.830 -9.851 3.931 1421 2HB TYR 84 HB3 TYR 84 -6.755 -10.776 2.749 1422 HD1 TYR 84 HD1 TYR 84 -6.396 -7.700 3.077 1423 HD2 TYR 84 HD2 TYR 84 -9.532 -10.446 4.208 1424 HE1 TYR 84 HE1 TYR 84 -8.082 -5.899 2.824 1425 HE2 TYR 84 HE2 TYR 84 -11.191 -8.645 3.982 1426 HH TYR 84 HH TYR 84 -11.561 -6.443 3.418 1427 H ASN 85 H ASN 85 -6.655 -13.355 6.364 1428 HA ASN 85 HA ASN 85 -3.977 -13.457 6.613 1429 1HB ASN 85 HB2 ASN 85 -5.954 -14.752 7.819 1430 2HB ASN 85 HB3 ASN 85 -5.482 -16.076 6.749 1431 1HD2 ASN 85 HD22 ASN 85 -4.259 -13.672 9.086 1432 2HD2 ASN 85 HD21 ASN 85 -2.978 -14.692 9.755 1433 H GLU 86 H GLU 86 -5.803 -15.172 4.148 1434 HA GLU 86 HA GLU 86 -3.939 -16.874 2.987 1435 1HB GLU 86 HB2 GLU 86 -5.924 -15.019 1.591 1436 2HB GLU 86 HB3 GLU 86 -5.116 -16.409 0.852 1437 1HG GLU 86 HG2 GLU 86 -6.183 -17.930 2.492 1438 2HG GLU 86 HG3 GLU 86 -7.030 -16.564 3.234 1439 H ALA 87 H ALA 87 -4.199 -13.313 2.610 1440 HA ALA 87 HA ALA 87 -2.335 -13.018 0.499 1441 1HB ALA 87 HB1 ALA 87 -2.319 -10.677 1.109 1442 2HB ALA 87 HB2 ALA 87 -3.974 -11.295 1.256 1443 3HB ALA 87 HB3 ALA 87 -2.989 -11.036 2.714 1444 H LEU 88 H LEU 88 -1.845 -13.460 4.006 1445 HA LEU 88 HA LEU 88 0.865 -12.470 4.076 1446 1HB LEU 88 HB2 LEU 88 -0.360 -14.613 5.837 1447 2HB LEU 88 HB3 LEU 88 1.044 -13.615 6.191 1448 HG LEU 88 HG LEU 88 -1.851 -12.661 6.007 1449 1HD1 LEU 88 HD11 LEU 88 0.046 -12.989 8.373 1450 2HD1 LEU 88 HD12 LEU 88 -1.643 -12.464 8.456 1451 3HD1 LEU 88 HD13 LEU 88 -1.259 -14.116 7.951 1452 1HD2 LEU 88 HD21 LEU 88 -0.240 -10.851 5.360 1453 2HD2 LEU 88 HD22 LEU 88 -1.080 -10.528 6.880 1454 3HD2 LEU 88 HD23 LEU 88 0.594 -11.098 6.917 1455 H LYS 89 H LYS 89 -0.647 -15.620 3.351 1456 HA LYS 89 HA LYS 89 1.943 -17.009 3.176 1457 1HB LYS 89 HB2 LYS 89 -0.938 -17.812 2.605 1458 2HB LYS 89 HB3 LYS 89 0.448 -18.827 2.201 1459 1HG LYS 89 HG2 LYS 89 -0.436 -19.554 4.295 1460 2HG LYS 89 HG3 LYS 89 1.176 -18.873 4.544 1461 1HD LYS 89 HD2 LYS 89 0.201 -16.821 5.491 1462 2HD LYS 89 HD3 LYS 89 -1.437 -17.366 5.069 1463 1HE LYS 89 HE2 LYS 89 -1.086 -17.732 7.417 1464 2HE LYS 89 HE3 LYS 89 -1.089 -19.323 6.643 1465 1HZ LYS 89 HZ1 LYS 89 0.694 -19.092 8.210 1466 2HZ LYS 89 HZ2 LYS 89 1.329 -19.232 6.697 1467 3HZ LYS 89 HZ3 LYS 89 1.277 -17.757 7.439 1468 H GLY 90 H GLY 90 -0.596 -15.816 0.963 1469 1HA GLY 90 HA2 GLY 90 1.182 -14.871 -1.011 1470 2HA GLY 90 HA3 GLY 90 0.645 -16.494 -1.502 Start of MODEL 4 1 1H MET 1 H1 MET 1 -12.018 0.066 -6.294 2 2H MET 1 H2 MET 1 -13.339 -0.015 -5.301 3 3H MET 1 H3 MET 1 -13.497 0.597 -6.812 4 HA MET 1 HA MET 1 -14.408 -1.592 -6.729 5 1HB MET 1 HB2 MET 1 -11.832 -1.453 -8.325 6 2HB MET 1 HB3 MET 1 -13.181 -2.569 -8.608 7 1HG MET 1 HG2 MET 1 -14.684 -0.582 -8.936 8 2HG MET 1 HG3 MET 1 -13.253 0.455 -8.903 9 1HE MET 1 HE1 MET 1 -11.125 -1.415 -10.549 10 2HE MET 1 HE2 MET 1 -11.368 -0.690 -12.151 11 3HE MET 1 HE3 MET 1 -11.316 0.351 -10.710 12 H ALA 2 H ALA 2 -12.402 -1.286 -4.384 13 HA ALA 2 HA ALA 2 -11.387 -2.524 -2.857 14 1HB ALA 2 HB1 ALA 2 -12.220 -5.066 -4.322 15 2HB ALA 2 HB2 ALA 2 -11.692 -4.895 -2.644 16 3HB ALA 2 HB3 ALA 2 -13.233 -4.194 -3.155 17 H SER 3 H SER 3 -10.824 -4.054 -6.021 18 HA SER 3 HA SER 3 -8.403 -5.119 -5.715 19 1HB SER 3 HB2 SER 3 -9.028 -3.647 -8.282 20 2HB SER 3 HB3 SER 3 -8.135 -5.147 -8.023 21 HG SER 3 HG SER 3 -10.359 -5.468 -8.677 22 HA PRO 4 HA PRO 4 -6.053 -0.956 -6.729 23 1HB PRO 4 HB2 PRO 4 -7.948 0.906 -5.288 24 2HB PRO 4 HB3 PRO 4 -6.853 1.260 -6.656 25 1HG PRO 4 HG2 PRO 4 -9.485 0.874 -7.135 26 2HG PRO 4 HG3 PRO 4 -8.285 0.049 -8.179 27 1HD PRO 4 HD2 PRO 4 -9.738 -1.065 -5.773 28 2HD PRO 4 HD3 PRO 4 -9.612 -1.772 -7.401 29 H LEU 5 H LEU 5 -7.998 -1.241 -3.677 30 HA LEU 5 HA LEU 5 -5.687 -0.389 -2.096 31 1HB LEU 5 HB2 LEU 5 -7.921 0.133 -1.272 32 2HB LEU 5 HB3 LEU 5 -8.349 -1.585 -1.244 33 HG LEU 5 HG LEU 5 -6.666 -2.038 0.483 34 1HD1 LEU 5 HD11 LEU 5 -5.988 0.940 0.302 35 2HD1 LEU 5 HD12 LEU 5 -5.473 -0.164 1.594 36 3HD1 LEU 5 HD13 LEU 5 -4.890 -0.417 -0.045 37 1HD2 LEU 5 HD21 LEU 5 -8.280 0.427 1.197 38 2HD2 LEU 5 HD22 LEU 5 -8.901 -1.249 1.181 39 3HD2 LEU 5 HD23 LEU 5 -7.617 -0.787 2.319 40 H ASP 6 H ASP 6 -7.461 -3.391 -2.863 41 HA ASP 6 HA ASP 6 -6.108 -5.179 -1.208 42 1HB ASP 6 HB2 ASP 6 -7.077 -5.759 -4.031 43 2HB ASP 6 HB3 ASP 6 -6.730 -6.951 -2.780 44 H GLN 7 H GLN 7 -5.157 -4.209 -4.561 45 HA GLN 7 HA GLN 7 -2.802 -5.824 -4.564 46 1HB GLN 7 HB2 GLN 7 -2.070 -4.572 -6.473 47 2HB GLN 7 HB3 GLN 7 -3.794 -4.943 -6.609 48 1HG GLN 7 HG2 GLN 7 -4.304 -2.619 -5.840 49 2HG GLN 7 HG3 GLN 7 -2.589 -2.228 -5.860 50 1HE2 GLN 7 HE22 GLN 7 -1.453 -2.483 -8.015 51 2HE2 GLN 7 HE21 GLN 7 -2.408 -2.188 -9.458 52 H ALA 8 H ALA 8 -3.402 -2.526 -3.300 53 HA ALA 8 HA ALA 8 -0.618 -1.895 -2.963 54 1HB ALA 8 HB1 ALA 8 -1.434 -0.082 -1.527 55 2HB ALA 8 HB2 ALA 8 -2.192 -0.154 -3.128 56 3HB ALA 8 HB3 ALA 8 -3.091 -0.696 -1.690 57 H ILE 9 H ILE 9 -3.159 -3.006 -0.597 58 HA ILE 9 HA ILE 9 -1.264 -3.326 1.549 59 HB ILE 9 HB ILE 9 -2.896 -4.755 2.645 60 1HG1 ILE 9 HG12 ILE 9 -4.609 -4.429 0.186 61 2HG1 ILE 9 HG13 ILE 9 -3.871 -5.944 0.732 62 1HG2 ILE 9 HG21 ILE 9 -2.919 -2.277 2.761 63 2HG2 ILE 9 HG22 ILE 9 -4.132 -2.258 1.462 64 3HG2 ILE 9 HG23 ILE 9 -4.500 -2.997 3.036 65 1HD1 ILE 9 HD11 ILE 9 -5.167 -5.746 2.878 66 2HD1 ILE 9 HD12 ILE 9 -6.045 -4.374 2.161 67 3HD1 ILE 9 HD13 ILE 9 -6.148 -5.974 1.416 68 H GLY 10 H GLY 10 -2.447 -5.537 -0.984 69 1HA GLY 10 HA2 GLY 10 -1.049 -7.878 -0.569 70 2HA GLY 10 HA3 GLY 10 -1.404 -7.162 -2.147 71 H LEU 11 H LEU 11 0.178 -4.854 -2.096 72 HA LEU 11 HA LEU 11 2.702 -5.827 -2.832 73 1HB LEU 11 HB2 LEU 11 1.429 -3.595 -3.383 74 2HB LEU 11 HB3 LEU 11 2.182 -2.978 -1.921 75 HG LEU 11 HG LEU 11 3.426 -2.252 -3.719 76 1HD1 LEU 11 HD11 LEU 11 4.748 -3.041 -1.788 77 2HD1 LEU 11 HD12 LEU 11 5.071 -4.556 -2.682 78 3HD1 LEU 11 HD13 LEU 11 5.632 -3.004 -3.327 79 1HD2 LEU 11 HD21 LEU 11 4.394 -3.604 -5.482 80 2HD2 LEU 11 HD22 LEU 11 3.671 -5.075 -4.797 81 3HD2 LEU 11 HD23 LEU 11 2.632 -3.778 -5.437 82 H LEU 12 H LEU 12 1.889 -3.845 0.070 83 HA LEU 12 HA LEU 12 4.386 -4.016 1.373 84 1HB LEU 12 HB2 LEU 12 1.517 -3.803 2.433 85 2HB LEU 12 HB3 LEU 12 2.909 -3.866 3.508 86 HG LEU 12 HG LEU 12 3.869 -1.870 2.449 87 1HD1 LEU 12 HD11 LEU 12 2.730 -1.861 0.250 88 2HD1 LEU 12 HD12 LEU 12 1.157 -1.659 1.066 89 3HD1 LEU 12 HD13 LEU 12 2.374 -0.373 1.125 90 1HD2 LEU 12 HD21 LEU 12 2.629 -1.678 4.527 91 2HD2 LEU 12 HD22 LEU 12 2.273 -0.276 3.518 92 3HD2 LEU 12 HD23 LEU 12 1.086 -1.590 3.646 93 H ILE 13 H ILE 13 1.592 -6.208 1.541 94 HA ILE 13 HA ILE 13 2.676 -7.983 3.487 95 HB ILE 13 HB ILE 13 0.626 -8.341 1.252 96 1HG1 ILE 13 HG12 ILE 13 0.102 -8.179 4.241 97 2HG1 ILE 13 HG13 ILE 13 0.202 -6.720 3.265 98 1HG2 ILE 13 HG21 ILE 13 -0.155 -10.350 2.490 99 2HG2 ILE 13 HG22 ILE 13 1.464 -10.580 1.838 100 3HG2 ILE 13 HG23 ILE 13 1.252 -10.196 3.562 101 1HD1 ILE 13 HD11 ILE 13 -1.581 -7.828 1.725 102 2HD1 ILE 13 HD12 ILE 13 -1.853 -8.936 3.086 103 3HD1 ILE 13 HD13 ILE 13 -2.088 -7.190 3.285 104 H GLY 14 H GLY 14 2.625 -8.174 -0.079 105 1HA GLY 14 HA2 GLY 14 3.960 -10.601 -0.440 106 2HA GLY 14 HA3 GLY 14 3.928 -9.250 -1.592 107 H ILE 15 H ILE 15 5.290 -7.236 -0.326 108 HA ILE 15 HA ILE 15 8.028 -7.900 -0.606 109 HB ILE 15 HB ILE 15 6.474 -5.603 0.561 110 1HG1 ILE 15 HG12 ILE 15 8.631 -5.868 -1.589 111 2HG1 ILE 15 HG13 ILE 15 6.887 -5.888 -1.878 112 1HG2 ILE 15 HG21 ILE 15 8.560 -4.413 1.143 113 2HG2 ILE 15 HG22 ILE 15 8.263 -5.807 2.156 114 3HG2 ILE 15 HG23 ILE 15 9.482 -5.905 0.856 115 1HD1 ILE 15 HD11 ILE 15 6.790 -3.550 -0.878 116 2HD1 ILE 15 HD12 ILE 15 8.564 -3.535 -0.908 117 3HD1 ILE 15 HD13 ILE 15 7.663 -3.681 -2.416 118 H PHE 16 H PHE 16 6.160 -7.392 2.440 119 HA PHE 16 HA PHE 16 8.199 -8.061 4.187 120 1HB PHE 16 HB2 PHE 16 5.964 -7.158 4.795 121 2HB PHE 16 HB3 PHE 16 5.234 -8.722 4.515 122 HD1 PHE 16 HD1 PHE 16 5.937 -10.711 6.006 123 HD2 PHE 16 HD2 PHE 16 7.205 -6.690 6.825 124 HE1 PHE 16 HE1 PHE 16 6.462 -11.345 8.302 125 HE2 PHE 16 HE2 PHE 16 7.512 -7.281 9.226 126 HZ PHE 16 HZ PHE 16 7.065 -9.583 9.986 127 H HIS 17 H HIS 17 5.755 -10.323 2.816 128 HA HIS 17 HA HIS 17 6.881 -12.542 4.286 129 1HB HIS 17 HB2 HIS 17 4.689 -12.430 2.213 130 2HB HIS 17 HB3 HIS 17 5.167 -13.883 3.102 131 HD1 HIS 17 HD1 HIS 17 3.560 -10.479 3.698 132 HD2 HIS 17 HD2 HIS 17 4.715 -13.911 5.819 133 HE1 HIS 17 HE1 HIS 17 2.678 -10.207 6.087 134 H LYS 18 H LYS 18 7.492 -11.233 1.045 135 HA LYS 18 HA LYS 18 8.862 -13.571 0.070 136 1HB LYS 18 HB2 LYS 18 8.192 -11.620 -1.328 137 2HB LYS 18 HB3 LYS 18 9.422 -10.635 -0.519 138 1HG LYS 18 HG2 LYS 18 11.182 -12.244 -1.367 139 2HG LYS 18 HG3 LYS 18 9.896 -13.187 -2.121 140 1HD LYS 18 HD2 LYS 18 10.829 -11.864 -3.862 141 2HD LYS 18 HD3 LYS 18 9.252 -11.170 -3.483 142 1HE LYS 18 HE2 LYS 18 10.880 -9.394 -3.831 143 2HE LYS 18 HE3 LYS 18 10.393 -9.377 -2.134 144 1HZ LYS 18 HZ1 LYS 18 12.768 -9.159 -2.461 145 2HZ LYS 18 HZ2 LYS 18 12.412 -10.518 -1.602 146 3HZ LYS 18 HZ3 LYS 18 12.836 -10.633 -3.192 147 H TYR 19 H TYR 19 9.986 -10.605 1.790 148 HA TYR 19 HA TYR 19 12.683 -11.556 2.073 149 1HB TYR 19 HB2 TYR 19 11.116 -9.386 3.478 150 2HB TYR 19 HB3 TYR 19 12.799 -9.749 3.864 151 HD1 TYR 19 HD1 TYR 19 10.656 -7.969 1.567 152 HD2 TYR 19 HD2 TYR 19 14.602 -9.551 2.127 153 HE1 TYR 19 HE1 TYR 19 11.281 -7.116 -0.653 154 HE2 TYR 19 HE2 TYR 19 15.335 -8.347 0.110 155 HH TYR 19 HH TYR 19 12.985 -6.861 -2.190 156 H SER 20 H SER 20 9.845 -11.843 4.248 157 HA SER 20 HA SER 20 11.250 -13.205 6.338 158 1HB SER 20 HB2 SER 20 8.374 -13.726 5.497 159 2HB SER 20 HB3 SER 20 9.130 -14.013 7.072 160 HG SER 20 HG SER 20 8.763 -11.463 5.844 161 H GLY 21 H GLY 21 9.573 -14.429 3.418 162 1HA GLY 21 HA2 GLY 21 9.927 -17.142 3.474 163 2HA GLY 21 HA3 GLY 21 10.053 -16.141 2.025 164 H LYS 22 H LYS 22 12.351 -14.732 2.389 165 HA LYS 22 HA LYS 22 14.409 -16.429 1.647 166 1HB LYS 22 HB2 LYS 22 14.281 -13.897 1.518 167 2HB LYS 22 HB3 LYS 22 14.849 -13.861 3.200 168 1HG LYS 22 HG2 LYS 22 16.850 -15.222 2.473 169 2HG LYS 22 HG3 LYS 22 16.319 -15.025 0.798 170 1HD LYS 22 HD2 LYS 22 17.176 -12.882 2.794 171 2HD LYS 22 HD3 LYS 22 18.039 -13.373 1.338 172 1HE LYS 22 HE2 LYS 22 15.369 -11.885 1.461 173 2HE LYS 22 HE3 LYS 22 16.933 -11.222 0.997 174 1HZ LYS 22 HZ1 LYS 22 16.957 -12.714 -0.871 175 2HZ LYS 22 HZ2 LYS 22 15.484 -13.323 -0.447 176 3HZ LYS 22 HZ3 LYS 22 15.624 -11.746 -0.904 177 H GLU 23 H GLU 23 13.447 -15.588 4.979 178 HA GLU 23 HA GLU 23 15.546 -17.435 6.056 179 1HB GLU 23 HB2 GLU 23 15.349 -16.181 8.157 180 2HB GLU 23 HB3 GLU 23 15.977 -15.208 6.821 181 1HG GLU 23 HG2 GLU 23 13.812 -14.114 6.520 182 2HG GLU 23 HG3 GLU 23 13.078 -15.135 7.771 183 H GLY 24 H GLY 24 12.892 -18.136 4.890 184 1HA GLY 24 HA2 GLY 24 11.418 -19.853 5.436 185 2HA GLY 24 HA3 GLY 24 11.864 -19.753 7.145 186 H ASP 25 H ASP 25 9.363 -19.104 5.013 187 HA ASP 25 HA ASP 25 8.615 -16.489 5.719 188 1HB ASP 25 HB2 ASP 25 7.681 -17.682 3.751 189 2HB ASP 25 HB3 ASP 25 6.783 -18.756 4.842 190 H LYS 26 H LYS 26 7.438 -15.571 7.327 191 HA LYS 26 HA LYS 26 5.675 -16.869 9.114 192 1HB LYS 26 HB2 LYS 26 7.043 -16.513 11.185 193 2HB LYS 26 HB3 LYS 26 7.664 -17.805 10.156 194 1HG LYS 26 HG2 LYS 26 9.399 -16.224 9.249 195 2HG LYS 26 HG3 LYS 26 8.737 -14.954 10.249 196 1HD LYS 26 HD2 LYS 26 10.637 -15.743 11.419 197 2HD LYS 26 HD3 LYS 26 9.237 -16.379 12.291 198 1HE LYS 26 HE2 LYS 26 10.916 -18.112 12.130 199 2HE LYS 26 HE3 LYS 26 9.573 -18.587 11.083 200 1HZ LYS 26 HZ1 LYS 26 11.694 -18.899 10.035 201 2HZ LYS 26 HZ2 LYS 26 10.847 -17.754 9.214 202 3HZ LYS 26 HZ3 LYS 26 12.079 -17.311 10.206 203 H HIS 27 H HIS 27 4.879 -15.108 10.676 204 HA HIS 27 HA HIS 27 4.721 -12.632 9.157 205 1HB HIS 27 HB2 HIS 27 3.515 -13.319 11.847 206 2HB HIS 27 HB3 HIS 27 3.036 -12.001 10.773 207 HD1 HIS 27 HD1 HIS 27 0.953 -14.194 11.694 208 HD2 HIS 27 HD2 HIS 27 3.166 -14.223 8.113 209 HE1 HIS 27 HE1 HIS 27 -0.343 -15.639 10.042 210 H THR 28 H THR 28 7.409 -13.071 10.159 211 HA THR 28 HA THR 28 7.872 -10.681 11.811 212 HB THR 28 HB THR 28 9.378 -11.997 13.316 213 HG1 THR 28 HG1 THR 28 9.388 -13.833 11.906 214 1HG2 THR 28 HG21 THR 28 6.455 -12.825 13.527 215 2HG2 THR 28 HG22 THR 28 7.666 -12.829 14.822 216 3HG2 THR 28 HG23 THR 28 7.144 -11.289 14.112 217 H LEU 29 H LEU 29 9.440 -9.606 10.756 218 HA LEU 29 HA LEU 29 11.460 -11.139 9.178 219 1HB LEU 29 HB2 LEU 29 10.832 -8.185 9.506 220 2HB LEU 29 HB3 LEU 29 12.274 -8.746 8.665 221 HG LEU 29 HG LEU 29 9.466 -9.527 7.790 222 1HD1 LEU 29 HD11 LEU 29 11.231 -7.220 6.841 223 2HD1 LEU 29 HD12 LEU 29 9.685 -7.712 6.118 224 3HD1 LEU 29 HD13 LEU 29 9.726 -7.038 7.759 225 1HD2 LEU 29 HD21 LEU 29 12.149 -9.423 6.344 226 2HD2 LEU 29 HD22 LEU 29 11.376 -10.912 6.933 227 3HD2 LEU 29 HD23 LEU 29 10.603 -9.950 5.661 228 H SER 30 H SER 30 13.646 -11.198 9.910 229 HA SER 30 HA SER 30 14.153 -10.207 12.641 230 1HB SER 30 HB2 SER 30 16.368 -11.137 12.349 231 2HB SER 30 HB3 SER 30 15.175 -12.328 11.811 232 HG SER 30 HG SER 30 16.075 -12.245 9.904 233 H LYS 31 H LYS 31 15.765 -8.571 13.107 234 HA LYS 31 HA LYS 31 15.395 -6.211 11.791 235 1HB LYS 31 HB2 LYS 31 17.291 -5.348 13.041 236 2HB LYS 31 HB3 LYS 31 16.290 -6.406 14.023 237 1HG LYS 31 HG2 LYS 31 17.959 -8.234 13.740 238 2HG LYS 31 HG3 LYS 31 18.973 -7.119 12.779 239 1HD LYS 31 HD2 LYS 31 19.110 -5.558 14.671 240 2HD LYS 31 HD3 LYS 31 18.174 -6.665 15.672 241 1HE LYS 31 HE2 LYS 31 20.888 -7.270 14.396 242 2HE LYS 31 HE3 LYS 31 20.614 -6.845 16.091 243 1HZ LYS 31 HZ1 LYS 31 19.567 -9.239 14.754 244 2HZ LYS 31 HZ2 LYS 31 20.828 -9.184 15.813 245 3HZ LYS 31 HZ3 LYS 31 19.310 -8.828 16.329 246 H LYS 32 H LYS 32 18.076 -8.495 11.145 247 HA LYS 32 HA LYS 32 19.260 -6.685 9.197 248 1HB LYS 32 HB2 LYS 32 19.908 -9.619 9.427 249 2HB LYS 32 HB3 LYS 32 20.876 -8.274 8.764 250 1HG LYS 32 HG2 LYS 32 20.876 -7.254 11.087 251 2HG LYS 32 HG3 LYS 32 20.217 -8.784 11.692 252 1HD LYS 32 HD2 LYS 32 22.869 -8.365 10.241 253 2HD LYS 32 HD3 LYS 32 22.657 -8.709 11.958 254 1HE LYS 32 HE2 LYS 32 22.030 -10.593 9.633 255 2HE LYS 32 HE3 LYS 32 23.364 -10.724 10.780 256 1HZ LYS 32 HZ1 LYS 32 20.515 -10.939 11.449 257 2HZ LYS 32 HZ2 LYS 32 21.595 -12.178 11.363 258 3HZ LYS 32 HZ3 LYS 32 21.759 -11.026 12.530 259 H GLU 33 H GLU 33 16.942 -9.417 9.031 260 HA GLU 33 HA GLU 33 17.013 -9.644 6.172 261 1HB GLU 33 HB2 GLU 33 16.027 -11.343 7.707 262 2HB GLU 33 HB3 GLU 33 14.709 -10.214 8.084 263 1HG GLU 33 HG2 GLU 33 13.916 -11.749 6.387 264 2HG GLU 33 HG3 GLU 33 14.141 -10.185 5.618 265 H LEU 34 H LEU 34 15.049 -7.699 8.454 266 HA LEU 34 HA LEU 34 13.545 -6.236 6.548 267 1HB LEU 34 HB2 LEU 34 12.984 -6.118 8.852 268 2HB LEU 34 HB3 LEU 34 14.569 -5.539 9.322 269 HG LEU 34 HG LEU 34 12.831 -3.837 9.425 270 1HD1 LEU 34 HD11 LEU 34 14.708 -2.852 7.279 271 2HD1 LEU 34 HD12 LEU 34 14.129 -2.038 8.722 272 3HD1 LEU 34 HD13 LEU 34 15.333 -3.322 8.864 273 1HD2 LEU 34 HD21 LEU 34 12.707 -4.038 6.385 274 2HD2 LEU 34 HD22 LEU 34 11.435 -4.533 7.520 275 3HD2 LEU 34 HD23 LEU 34 11.892 -2.825 7.365 276 H LYS 35 H LYS 35 16.836 -5.544 7.965 277 HA LYS 35 HA LYS 35 17.223 -3.237 6.427 278 1HB LYS 35 HB2 LYS 35 18.719 -4.010 8.247 279 2HB LYS 35 HB3 LYS 35 19.447 -5.194 7.132 280 1HG LYS 35 HG2 LYS 35 20.089 -3.375 5.596 281 2HG LYS 35 HG3 LYS 35 19.249 -2.197 6.623 282 1HD LYS 35 HD2 LYS 35 20.832 -2.880 8.504 283 2HD LYS 35 HD3 LYS 35 21.769 -3.767 7.289 284 1HE LYS 35 HE2 LYS 35 21.105 -0.776 7.290 285 2HE LYS 35 HE3 LYS 35 22.696 -1.507 7.595 286 1HZ LYS 35 HZ1 LYS 35 22.636 -0.748 5.411 287 2HZ LYS 35 HZ2 LYS 35 22.602 -2.390 5.343 288 3HZ LYS 35 HZ3 LYS 35 21.221 -1.528 5.065 289 H GLU 36 H GLU 36 17.876 -6.631 5.497 290 HA GLU 36 HA GLU 36 18.885 -6.151 2.924 291 1HB GLU 36 HB2 GLU 36 18.419 -8.396 4.391 292 2HB GLU 36 HB3 GLU 36 17.074 -8.524 3.255 293 1HG GLU 36 HG2 GLU 36 20.050 -8.272 2.606 294 2HG GLU 36 HG3 GLU 36 19.056 -9.723 2.448 295 H LEU 37 H LEU 37 15.461 -6.696 3.895 296 HA LEU 37 HA LEU 37 14.129 -6.170 1.505 297 1HB LEU 37 HB2 LEU 37 13.057 -6.904 3.566 298 2HB LEU 37 HB3 LEU 37 13.360 -5.386 4.352 299 HG LEU 37 HG LEU 37 11.557 -5.539 1.949 300 1HD1 LEU 37 HD11 LEU 37 10.698 -7.025 3.747 301 2HD1 LEU 37 HD12 LEU 37 10.970 -5.742 4.944 302 3HD1 LEU 37 HD13 LEU 37 9.732 -5.545 3.707 303 1HD2 LEU 37 HD21 LEU 37 11.866 -3.495 4.208 304 2HD2 LEU 37 HD22 LEU 37 12.217 -3.214 2.486 305 3HD2 LEU 37 HD23 LEU 37 10.564 -3.506 3.014 306 H ILE 38 H ILE 38 15.255 -3.709 3.864 307 HA ILE 38 HA ILE 38 14.330 -1.588 2.179 308 HB ILE 38 HB ILE 38 16.297 -1.656 4.494 309 1HG1 ILE 38 HG12 ILE 38 13.384 -0.767 4.115 310 2HG1 ILE 38 HG13 ILE 38 13.934 -2.228 4.951 311 1HG2 ILE 38 HG21 ILE 38 15.210 0.748 2.984 312 2HG2 ILE 38 HG22 ILE 38 16.059 0.826 4.537 313 3HG2 ILE 38 HG23 ILE 38 16.916 0.280 3.105 314 1HD1 ILE 38 HD11 ILE 38 13.415 -0.700 6.623 315 2HD1 ILE 38 HD12 ILE 38 15.196 -0.673 6.544 316 3HD1 ILE 38 HD13 ILE 38 14.239 0.640 5.801 317 H GLN 39 H GLN 39 17.579 -3.136 2.409 318 HA GLN 39 HA GLN 39 18.810 -1.281 0.574 319 1HB GLN 39 HB2 GLN 39 19.524 -4.206 1.074 320 2HB GLN 39 HB3 GLN 39 20.503 -3.017 0.210 321 1HG GLN 39 HG2 GLN 39 19.897 -3.091 3.174 322 2HG GLN 39 HG3 GLN 39 21.450 -3.209 2.365 323 1HE2 GLN 39 HE22 GLN 39 18.859 -1.048 3.390 324 2HE2 GLN 39 HE21 GLN 39 19.779 0.437 3.198 325 H LYS 40 H LYS 40 17.040 -4.366 0.035 326 HA LYS 40 HA LYS 40 17.655 -4.232 -2.788 327 1HB LYS 40 HB2 LYS 40 17.507 -6.309 -1.481 328 2HB LYS 40 HB3 LYS 40 15.772 -6.074 -1.279 329 1HG LYS 40 HG2 LYS 40 15.369 -6.304 -3.638 330 2HG LYS 40 HG3 LYS 40 17.075 -6.163 -4.046 331 1HD LYS 40 HD2 LYS 40 15.884 -8.461 -2.420 332 2HD LYS 40 HD3 LYS 40 16.095 -8.506 -4.171 333 1HE LYS 40 HE2 LYS 40 18.346 -8.251 -2.114 334 2HE LYS 40 HE3 LYS 40 17.906 -9.696 -3.022 335 1HZ LYS 40 HZ1 LYS 40 18.443 -8.514 -5.038 336 2HZ LYS 40 HZ2 LYS 40 18.898 -7.186 -4.170 337 3HZ LYS 40 HZ3 LYS 40 19.736 -8.595 -4.016 338 H GLU 41 H GLU 41 14.780 -3.460 -0.834 339 HA GLU 41 HA GLU 41 13.204 -2.800 -3.218 340 1HB GLU 41 HB2 GLU 41 12.653 -2.278 -0.267 341 2HB GLU 41 HB3 GLU 41 11.528 -2.009 -1.599 342 1HG GLU 41 HG2 GLU 41 12.692 -4.718 -0.800 343 2HG GLU 41 HG3 GLU 41 11.074 -4.129 -0.414 344 H LEU 42 H LEU 42 14.663 -0.854 -0.502 345 HA LEU 42 HA LEU 42 13.700 1.563 -1.923 346 1HB LEU 42 HB2 LEU 42 15.220 1.462 0.695 347 2HB LEU 42 HB3 LEU 42 14.409 2.838 -0.044 348 HG LEU 42 HG LEU 42 13.138 0.400 1.240 349 1HD1 LEU 42 HD11 LEU 42 12.705 3.394 1.651 350 2HD1 LEU 42 HD12 LEU 42 12.050 2.074 2.641 351 3HD1 LEU 42 HD13 LEU 42 13.789 2.412 2.644 352 1HD2 LEU 42 HD21 LEU 42 11.826 0.743 -0.801 353 2HD2 LEU 42 HD22 LEU 42 10.930 1.351 0.590 354 3HD2 LEU 42 HD23 LEU 42 11.753 2.495 -0.485 355 H THR 43 H THR 43 16.781 0.088 -0.934 356 HA THR 43 HA THR 43 18.893 0.324 -1.782 357 HB THR 43 HB THR 43 17.615 1.208 -4.395 358 HG1 THR 43 HG1 THR 43 17.481 -1.330 -3.155 359 1HG2 THR 43 HG21 THR 43 19.250 -0.365 -5.353 360 2HG2 THR 43 HG22 THR 43 20.081 0.844 -4.359 361 3HG2 THR 43 HG23 THR 43 19.824 -0.798 -3.730 362 H ILE 44 H ILE 44 18.606 2.398 -0.237 363 HA ILE 44 HA ILE 44 18.932 4.930 -1.495 364 HB ILE 44 HB ILE 44 19.697 5.789 0.539 365 1HG1 ILE 44 HG12 ILE 44 21.377 4.300 1.352 366 2HG1 ILE 44 HG13 ILE 44 20.154 4.551 2.574 367 1HG2 ILE 44 HG21 ILE 44 17.871 5.222 2.019 368 2HG2 ILE 44 HG22 ILE 44 17.315 5.254 0.339 369 3HG2 ILE 44 HG23 ILE 44 17.571 3.702 1.156 370 1HD1 ILE 44 HD11 ILE 44 19.172 2.324 2.107 371 2HD1 ILE 44 HD12 ILE 44 20.401 2.042 0.852 372 3HD1 ILE 44 HD13 ILE 44 20.895 2.232 2.530 373 H GLY 45 H GLY 45 20.512 5.544 -2.855 374 1HA GLY 45 HA2 GLY 45 22.978 4.117 -3.218 375 2HA GLY 45 HA3 GLY 45 22.552 5.695 -3.899 376 H SER 46 H SER 46 22.023 6.900 -1.280 377 HA SER 46 HA SER 46 24.667 7.890 -0.662 378 1HB SER 46 HB2 SER 46 22.566 9.244 -0.605 379 2HB SER 46 HB3 SER 46 22.010 8.274 0.772 380 HG SER 46 HG SER 46 22.938 10.075 1.571 381 H LYS 47 H LYS 47 25.520 5.627 -0.189 382 HA LYS 47 HA LYS 47 24.570 4.171 1.985 383 1HB LYS 47 HB2 LYS 47 27.515 4.177 1.176 384 2HB LYS 47 HB3 LYS 47 26.612 2.853 1.906 385 1HG LYS 47 HG2 LYS 47 26.485 3.885 -0.943 386 2HG LYS 47 HG3 LYS 47 26.962 2.291 -0.379 387 1HD LYS 47 HD2 LYS 47 24.148 3.455 -0.306 388 2HD LYS 47 HD3 LYS 47 24.753 2.264 -1.450 389 1HE LYS 47 HE2 LYS 47 25.099 0.654 0.450 390 2HE LYS 47 HE3 LYS 47 24.407 1.855 1.557 391 1HZ LYS 47 HZ1 LYS 47 22.435 1.837 0.129 392 2HZ LYS 47 HZ2 LYS 47 23.060 0.561 -0.695 393 3HZ LYS 47 HZ3 LYS 47 22.706 0.402 0.910 394 H LEU 48 H LEU 48 26.451 7.000 2.216 395 HA LEU 48 HA LEU 48 27.470 6.871 4.829 396 1HB LEU 48 HB2 LEU 48 27.871 8.755 3.512 397 2HB LEU 48 HB3 LEU 48 26.176 9.020 3.124 398 HG LEU 48 HG LEU 48 27.098 9.319 5.998 399 1HD1 LEU 48 HD11 LEU 48 27.567 11.703 5.531 400 2HD1 LEU 48 HD12 LEU 48 28.687 10.644 4.661 401 3HD1 LEU 48 HD13 LEU 48 27.340 11.412 3.793 402 1HD2 LEU 48 HD21 LEU 48 25.267 11.087 5.896 403 2HD2 LEU 48 HD22 LEU 48 24.928 10.568 4.229 404 3HD2 LEU 48 HD23 LEU 48 24.661 9.466 5.580 405 H GLN 49 H GLN 49 24.120 7.137 3.703 406 HA GLN 49 HA GLN 49 23.050 7.625 6.367 407 1HB GLN 49 HB2 GLN 49 21.665 7.024 3.728 408 2HB GLN 49 HB3 GLN 49 20.863 7.506 5.226 409 1HG GLN 49 HG2 GLN 49 22.133 9.638 5.258 410 2HG GLN 49 HG3 GLN 49 22.980 9.160 3.781 411 1HE2 GLN 49 HE22 GLN 49 19.545 9.451 4.932 412 2HE2 GLN 49 HE21 GLN 49 18.996 10.182 3.430 413 H ASP 50 H ASP 50 24.384 4.815 5.208 414 HA ASP 50 HA ASP 50 22.622 2.759 5.871 415 1HB ASP 50 HB2 ASP 50 24.892 2.404 5.009 416 2HB ASP 50 HB3 ASP 50 25.591 3.014 6.519 417 H ALA 51 H ALA 51 24.538 4.852 8.035 418 HA ALA 51 HA ALA 51 23.908 3.776 10.552 419 1HB ALA 51 HB1 ALA 51 24.180 6.696 9.730 420 2HB ALA 51 HB2 ALA 51 24.264 6.065 11.390 421 3HB ALA 51 HB3 ALA 51 25.500 5.603 10.202 422 H GLU 52 H GLU 52 21.989 5.991 8.485 423 HA GLU 52 HA GLU 52 19.886 6.406 10.429 424 1HB GLU 52 HB2 GLU 52 19.794 6.785 7.408 425 2HB GLU 52 HB3 GLU 52 18.672 7.434 8.602 426 1HG GLU 52 HG2 GLU 52 20.467 8.801 9.606 427 2HG GLU 52 HG3 GLU 52 21.644 8.156 8.451 428 H ILE 53 H ILE 53 20.452 4.219 7.634 429 HA ILE 53 HA ILE 53 17.918 2.924 7.780 430 HB ILE 53 HB ILE 53 20.517 1.583 6.974 431 1HG1 ILE 53 HG12 ILE 53 20.263 3.559 5.585 432 2HG1 ILE 53 HG13 ILE 53 19.921 2.101 4.670 433 1HG2 ILE 53 HG21 ILE 53 18.959 0.132 5.646 434 2HG2 ILE 53 HG22 ILE 53 18.753 -0.031 7.391 435 3HG2 ILE 53 HG23 ILE 53 17.588 0.908 6.463 436 1HD1 ILE 53 HD11 ILE 53 17.482 2.541 4.882 437 2HD1 ILE 53 HD12 ILE 53 17.837 4.028 5.795 438 3HD1 ILE 53 HD13 ILE 53 18.340 3.875 4.107 439 H VAL 54 H VAL 54 20.999 2.118 9.548 440 HA VAL 54 HA VAL 54 19.619 -0.052 10.853 441 HB VAL 54 HB VAL 54 21.500 -0.198 12.436 442 1HG1 VAL 54 HG11 VAL 54 22.956 -1.215 10.732 443 2HG1 VAL 54 HG12 VAL 54 21.256 -1.577 10.402 444 3HG1 VAL 54 HG13 VAL 54 22.093 -0.318 9.466 445 1HG2 VAL 54 HG21 VAL 54 22.859 1.804 10.624 446 2HG2 VAL 54 HG22 VAL 54 22.334 2.143 12.293 447 3HG2 VAL 54 HG23 VAL 54 23.577 0.921 11.974 448 H LYS 55 H LYS 55 20.009 3.380 11.764 449 HA LYS 55 HA LYS 55 18.843 3.102 14.354 450 1HB LYS 55 HB2 LYS 55 19.843 5.187 13.666 451 2HB LYS 55 HB3 LYS 55 18.713 5.359 12.321 452 1HG LYS 55 HG2 LYS 55 18.159 6.849 14.159 453 2HG LYS 55 HG3 LYS 55 16.840 5.726 13.830 454 1HD LYS 55 HD2 LYS 55 17.516 4.321 15.763 455 2HD LYS 55 HD3 LYS 55 18.882 5.404 16.090 456 1HE LYS 55 HE2 LYS 55 15.916 6.169 16.142 457 2HE LYS 55 HE3 LYS 55 16.899 5.789 17.563 458 1HZ LYS 55 HZ1 LYS 55 16.740 8.122 17.244 459 2HZ LYS 55 HZ2 LYS 55 18.302 7.650 17.016 460 3HZ LYS 55 HZ3 LYS 55 17.354 8.026 15.720 461 H LEU 56 H LEU 56 17.310 3.710 11.173 462 HA LEU 56 HA LEU 56 14.604 3.552 11.960 463 1HB LEU 56 HB2 LEU 56 15.118 4.477 9.905 464 2HB LEU 56 HB3 LEU 56 16.109 3.126 9.377 465 HG LEU 56 HG LEU 56 13.213 2.531 9.883 466 1HD1 LEU 56 HD11 LEU 56 14.223 4.042 7.434 467 2HD1 LEU 56 HD12 LEU 56 12.622 3.295 7.603 468 3HD1 LEU 56 HD13 LEU 56 13.076 4.658 8.644 469 1HD2 LEU 56 HD21 LEU 56 15.188 1.769 7.666 470 2HD2 LEU 56 HD22 LEU 56 14.874 0.767 9.079 471 3HD2 LEU 56 HD23 LEU 56 13.556 1.103 7.956 472 H MET 57 H MET 57 16.830 0.950 10.947 473 HA MET 57 HA MET 57 15.039 -1.230 11.026 474 1HB MET 57 HB2 MET 57 17.364 -1.308 10.104 475 2HB MET 57 HB3 MET 57 17.976 -1.071 11.745 476 1HG MET 57 HG2 MET 57 16.883 -3.240 12.408 477 2HG MET 57 HG3 MET 57 16.557 -3.498 10.698 478 1HE MET 57 HE1 MET 57 19.809 -2.011 12.581 479 2HE MET 57 HE2 MET 57 19.163 -3.342 13.561 480 3HE MET 57 HE3 MET 57 20.718 -3.525 12.717 481 H ASP 58 H ASP 58 17.177 0.154 13.577 482 HA ASP 58 HA ASP 58 16.360 -1.554 15.670 483 1HB ASP 58 HB2 ASP 58 18.322 -0.038 15.743 484 2HB ASP 58 HB3 ASP 58 17.230 1.341 15.942 485 H ASP 59 H ASP 59 15.021 1.616 14.639 486 HA ASP 59 HA ASP 59 12.947 1.770 16.567 487 1HB ASP 59 HB2 ASP 59 12.898 2.811 13.703 488 2HB ASP 59 HB3 ASP 59 11.793 3.271 14.996 489 H LEU 60 H LEU 60 12.845 0.256 13.304 490 HA LEU 60 HA LEU 60 10.159 -0.739 13.499 491 1HB LEU 60 HB2 LEU 60 12.659 -1.502 11.952 492 2HB LEU 60 HB3 LEU 60 11.291 -2.599 11.918 493 HG LEU 60 HG LEU 60 10.799 0.303 11.303 494 1HD1 LEU 60 HD11 LEU 60 12.760 -0.231 9.908 495 2HD1 LEU 60 HD12 LEU 60 11.898 -1.647 9.260 496 3HD1 LEU 60 HD13 LEU 60 11.294 -0.023 8.923 497 1HD2 LEU 60 HD21 LEU 60 9.749 -2.336 10.128 498 2HD2 LEU 60 HD22 LEU 60 8.902 -1.360 11.356 499 3HD2 LEU 60 HD23 LEU 60 9.152 -0.749 9.698 500 H ASP 61 H ASP 61 13.226 -2.499 14.148 501 HA ASP 61 HA ASP 61 11.772 -4.764 15.062 502 1HB ASP 61 HB2 ASP 61 13.749 -5.854 15.382 503 2HB ASP 61 HB3 ASP 61 14.039 -4.800 14.004 504 H ARG 62 H ARG 62 12.766 -1.927 16.780 505 HA ARG 62 HA ARG 62 12.969 -2.391 19.374 506 1HB ARG 62 HB2 ARG 62 12.478 -0.171 18.186 507 2HB ARG 62 HB3 ARG 62 10.782 -0.591 18.246 508 1HG ARG 62 HG2 ARG 62 11.062 0.836 20.035 509 2HG ARG 62 HG3 ARG 62 11.007 -0.741 20.798 510 1HD ARG 62 HD2 ARG 62 12.797 0.745 21.751 511 2HD ARG 62 HD3 ARG 62 13.418 -0.770 21.101 512 HE ARG 62 HE ARG 62 14.717 0.394 19.665 513 1HH1 ARG 62 HH12 ARG 62 12.045 2.553 20.516 514 2HH1 ARG 62 HH11 ARG 62 12.557 3.818 19.427 515 1HH2 ARG 62 HH22 ARG 62 15.426 2.041 18.353 516 2HH2 ARG 62 HH21 ARG 62 14.433 3.448 18.038 517 H ASN 63 H ASN 63 9.836 -2.516 17.689 518 HA ASN 63 HA ASN 63 8.055 -3.055 19.661 519 1HB ASN 63 HB2 ASN 63 6.615 -4.005 18.101 520 2HB ASN 63 HB3 ASN 63 7.599 -2.893 17.132 521 1HD2 ASN 63 HD22 ASN 63 9.675 -4.008 16.158 522 2HD2 ASN 63 HD21 ASN 63 9.704 -5.759 16.013 523 H LYS 64 H LYS 64 10.323 -5.438 18.361 524 HA LYS 64 HA LYS 64 9.894 -7.124 20.686 525 1HB LYS 64 HB2 LYS 64 8.185 -7.965 19.079 526 2HB LYS 64 HB3 LYS 64 9.445 -8.235 17.876 527 1HG LYS 64 HG2 LYS 64 8.742 -10.293 18.973 528 2HG LYS 64 HG3 LYS 64 10.452 -9.993 19.281 529 1HD LYS 64 HD2 LYS 64 9.968 -9.168 21.539 530 2HD LYS 64 HD3 LYS 64 8.223 -9.303 21.258 531 1HE LYS 64 HE2 LYS 64 10.234 -11.612 21.256 532 2HE LYS 64 HE3 LYS 64 9.186 -11.170 22.611 533 1HZ LYS 64 HZ1 LYS 64 8.273 -12.075 19.973 534 2HZ LYS 64 HZ2 LYS 64 8.251 -12.945 21.370 535 3HZ LYS 64 HZ3 LYS 64 7.293 -11.614 21.216 536 H ASP 65 H ASP 65 11.831 -5.567 20.418 537 HA ASP 65 HA ASP 65 14.116 -5.333 19.862 538 1HB ASP 65 HB2 ASP 65 15.242 -6.302 21.761 539 2HB ASP 65 HB3 ASP 65 13.662 -5.665 22.223 540 H GLN 66 H GLN 66 14.428 -6.045 17.773 541 HA GLN 66 HA GLN 66 16.076 -6.904 16.453 542 1HB GLN 66 HB2 GLN 66 16.051 -9.512 17.982 543 2HB GLN 66 HB3 GLN 66 17.093 -9.100 16.646 544 1HG GLN 66 HG2 GLN 66 18.397 -7.584 17.831 545 2HG GLN 66 HG3 GLN 66 17.177 -7.253 19.045 546 1HE2 GLN 66 HE22 GLN 66 16.446 -9.266 20.329 547 2HE2 GLN 66 HE21 GLN 66 17.771 -10.260 20.945 548 H GLU 67 H GLU 67 12.959 -8.186 17.112 549 HA GLU 67 HA GLU 67 12.791 -9.164 14.281 550 1HB GLU 67 HB2 GLU 67 11.171 -9.925 16.743 551 2HB GLU 67 HB3 GLU 67 10.800 -10.438 15.093 552 1HG GLU 67 HG2 GLU 67 13.376 -11.104 16.599 553 2HG GLU 67 HG3 GLU 67 11.994 -12.185 16.397 554 H VAL 68 H VAL 68 11.296 -8.173 12.988 555 HA VAL 68 HA VAL 68 9.399 -6.264 14.263 556 HB VAL 68 HB VAL 68 10.939 -5.020 12.915 557 1HG1 VAL 68 HG11 VAL 68 11.448 -6.695 11.151 558 2HG1 VAL 68 HG12 VAL 68 9.801 -6.451 10.495 559 3HG1 VAL 68 HG13 VAL 68 10.958 -5.116 10.515 560 1HG2 VAL 68 HG21 VAL 68 9.179 -3.794 11.704 561 2HG2 VAL 68 HG22 VAL 68 8.078 -5.165 11.869 562 3HG2 VAL 68 HG23 VAL 68 8.624 -4.280 13.307 563 H ASN 69 H ASN 69 7.517 -7.082 14.537 564 HA ASN 69 HA ASN 69 6.662 -9.332 12.895 565 1HB ASN 69 HB2 ASN 69 4.988 -9.715 14.368 566 2HB ASN 69 HB3 ASN 69 6.199 -9.007 15.437 567 1HD2 ASN 69 HD22 ASN 69 5.718 -6.882 16.375 568 2HD2 ASN 69 HD21 ASN 69 4.089 -6.247 16.246 569 H PHE 70 H PHE 70 4.849 -9.384 11.598 570 HA PHE 70 HA PHE 70 4.667 -7.534 9.640 571 1HB PHE 70 HB2 PHE 70 3.775 -9.758 9.457 572 2HB PHE 70 HB3 PHE 70 2.528 -9.416 10.660 573 HD1 PHE 70 HD1 PHE 70 0.379 -8.868 9.870 574 HD2 PHE 70 HD2 PHE 70 3.825 -8.019 7.407 575 HE1 PHE 70 HE1 PHE 70 -1.075 -7.804 8.209 576 HE2 PHE 70 HE2 PHE 70 2.356 -6.970 5.720 577 HZ PHE 70 HZ PHE 70 -0.097 -6.792 6.143 578 H GLN 71 H GLN 71 2.451 -7.479 12.508 579 HA GLN 71 HA GLN 71 0.795 -5.403 11.440 580 1HB GLN 71 HB2 GLN 71 0.016 -6.859 13.226 581 2HB GLN 71 HB3 GLN 71 1.324 -6.333 14.291 582 1HG GLN 71 HG2 GLN 71 -0.726 -5.314 14.978 583 2HG GLN 71 HG3 GLN 71 0.370 -4.059 14.421 584 1HE2 GLN 71 HE22 GLN 71 -0.029 -3.216 12.117 585 2HE2 GLN 71 HE21 GLN 71 -1.740 -3.133 11.660 586 H GLU 72 H GLU 72 3.740 -5.408 13.414 587 HA GLU 72 HA GLU 72 3.660 -2.533 13.891 588 1HB GLU 72 HB2 GLU 72 5.668 -4.703 14.525 589 2HB GLU 72 HB3 GLU 72 5.990 -2.991 14.838 590 1HG GLU 72 HG2 GLU 72 3.430 -4.321 15.841 591 2HG GLU 72 HG3 GLU 72 4.919 -4.322 16.783 592 H TYR 73 H TYR 73 5.253 -4.724 11.591 593 HA TYR 73 HA TYR 73 6.854 -2.772 10.253 594 1HB TYR 73 HB2 TYR 73 7.256 -4.931 9.582 595 2HB TYR 73 HB3 TYR 73 5.567 -5.375 9.507 596 HD1 TYR 73 HD1 TYR 73 4.244 -5.132 7.508 597 HD2 TYR 73 HD2 TYR 73 8.306 -3.673 7.683 598 HE1 TYR 73 HE1 TYR 73 4.335 -5.095 5.050 599 HE2 TYR 73 HE2 TYR 73 8.427 -3.762 5.206 600 HH TYR 73 HH TYR 73 5.768 -5.051 3.218 601 H ILE 74 H ILE 74 3.428 -3.779 9.601 602 HA ILE 74 HA ILE 74 2.951 -1.790 7.638 603 HB ILE 74 HB ILE 74 0.992 -3.012 9.615 604 1HG1 ILE 74 HG12 ILE 74 2.098 -4.664 8.074 605 2HG1 ILE 74 HG13 ILE 74 0.358 -4.563 7.962 606 1HG2 ILE 74 HG21 ILE 74 -0.685 -2.303 7.757 607 2HG2 ILE 74 HG22 ILE 74 -0.075 -1.061 8.852 608 3HG2 ILE 74 HG23 ILE 74 0.585 -1.208 7.209 609 1HD1 ILE 74 HD11 ILE 74 0.567 -3.180 5.883 610 2HD1 ILE 74 HD12 ILE 74 2.340 -3.368 6.000 611 3HD1 ILE 74 HD13 ILE 74 1.293 -4.772 5.737 612 H THR 75 H THR 75 2.307 -1.631 11.183 613 HA THR 75 HA THR 75 1.381 0.993 11.332 614 HB THR 75 HB THR 75 3.185 -0.480 13.290 615 HG1 THR 75 HG1 THR 75 1.355 -1.625 12.971 616 1HG2 THR 75 HG21 THR 75 2.125 0.919 15.026 617 2HG2 THR 75 HG22 THR 75 3.170 1.848 13.942 618 3HG2 THR 75 HG23 THR 75 1.412 1.940 13.767 619 H PHE 76 H PHE 76 4.823 -0.073 11.472 620 HA PHE 76 HA PHE 76 5.903 2.539 11.734 621 1HB PHE 76 HB2 PHE 76 7.160 0.486 12.253 622 2HB PHE 76 HB3 PHE 76 7.144 0.053 10.543 623 HD1 PHE 76 HD1 PHE 76 8.573 2.338 13.096 624 HD2 PHE 76 HD2 PHE 76 8.516 1.360 8.885 625 HE1 PHE 76 HE1 PHE 76 10.471 3.882 12.692 626 HE2 PHE 76 HE2 PHE 76 10.472 2.791 8.526 627 HZ PHE 76 HZ PHE 76 11.383 4.159 10.387 628 H LEU 77 H LEU 77 5.218 0.541 8.773 629 HA LEU 77 HA LEU 77 6.233 2.532 6.968 630 1HB LEU 77 HB2 LEU 77 4.121 0.376 6.651 631 2HB LEU 77 HB3 LEU 77 4.571 1.463 5.332 632 HG LEU 77 HG LEU 77 6.592 -0.281 6.820 633 1HD1 LEU 77 HD11 LEU 77 5.010 -1.725 5.658 634 2HD1 LEU 77 HD12 LEU 77 5.172 -0.757 4.168 635 3HD1 LEU 77 HD13 LEU 77 6.556 -1.677 4.783 636 1HD2 LEU 77 HD21 LEU 77 6.724 1.353 4.242 637 2HD2 LEU 77 HD22 LEU 77 7.707 1.589 5.714 638 3HD2 LEU 77 HD23 LEU 77 7.947 0.157 4.726 639 H GLY 78 H GLY 78 3.112 2.221 8.641 640 1HA GLY 78 HA2 GLY 78 1.861 4.519 7.535 641 2HA GLY 78 HA3 GLY 78 1.608 3.898 9.180 642 H ALA 79 H ALA 79 4.031 4.259 10.421 643 HA ALA 79 HA ALA 79 4.165 7.023 10.951 644 1HB ALA 79 HB1 ALA 79 6.437 5.029 11.356 645 2HB ALA 79 HB2 ALA 79 6.203 6.577 12.179 646 3HB ALA 79 HB3 ALA 79 5.062 5.249 12.459 647 H LEU 80 H LEU 80 6.167 5.080 8.731 648 HA LEU 80 HA LEU 80 7.932 7.109 7.884 649 1HB LEU 80 HB2 LEU 80 7.857 4.484 7.456 650 2HB LEU 80 HB3 LEU 80 6.913 4.930 6.041 651 HG LEU 80 HG LEU 80 8.859 6.443 5.371 652 1HD1 LEU 80 HD11 LEU 80 10.266 4.837 7.562 653 2HD1 LEU 80 HD12 LEU 80 11.086 5.809 6.331 654 3HD1 LEU 80 HD13 LEU 80 10.067 6.602 7.540 655 1HD2 LEU 80 HD21 LEU 80 9.400 3.455 5.682 656 2HD2 LEU 80 HD22 LEU 80 8.441 4.192 4.375 657 3HD2 LEU 80 HD23 LEU 80 10.179 4.528 4.504 658 H ALA 81 H ALA 81 4.781 6.049 6.579 659 HA ALA 81 HA ALA 81 4.560 7.942 4.463 660 1HB ALA 81 HB1 ALA 81 3.141 6.039 4.484 661 2HB ALA 81 HB2 ALA 81 2.487 6.435 6.075 662 3HB ALA 81 HB3 ALA 81 2.112 7.480 4.694 663 H MET 82 H MET 82 3.596 8.126 7.913 664 HA MET 82 HA MET 82 2.400 10.696 7.760 665 1HB MET 82 HB2 MET 82 2.055 9.130 9.596 666 2HB MET 82 HB3 MET 82 3.725 9.290 10.114 667 1HG MET 82 HG2 MET 82 1.814 11.645 9.950 668 2HG MET 82 HG3 MET 82 1.939 10.625 11.381 669 1HE MET 82 HE1 MET 82 5.483 11.432 12.772 670 2HE MET 82 HE2 MET 82 3.981 10.508 13.004 671 3HE MET 82 HE3 MET 82 5.103 10.083 11.687 672 H ILE 83 H ILE 83 5.752 9.686 8.464 673 HA ILE 83 HA ILE 83 6.839 12.292 8.856 674 HB ILE 83 HB ILE 83 8.073 9.677 7.936 675 1HG1 ILE 83 HG12 ILE 83 8.457 11.245 10.521 676 2HG1 ILE 83 HG13 ILE 83 7.167 10.062 10.330 677 1HG2 ILE 83 HG21 ILE 83 9.456 11.453 6.963 678 2HG2 ILE 83 HG22 ILE 83 9.483 12.316 8.517 679 3HG2 ILE 83 HG23 ILE 83 10.295 10.748 8.335 680 1HD1 ILE 83 HD11 ILE 83 8.834 8.294 9.821 681 2HD1 ILE 83 HD12 ILE 83 10.141 9.455 10.146 682 3HD1 ILE 83 HD13 ILE 83 9.019 9.001 11.435 683 H TYR 84 H TYR 84 6.370 10.348 5.865 684 HA TYR 84 HA TYR 84 7.183 12.541 4.106 685 1HB TYR 84 HB2 TYR 84 5.396 10.170 3.488 686 2HB TYR 84 HB3 TYR 84 6.275 11.170 2.335 687 HD1 TYR 84 HD1 TYR 84 8.971 11.087 4.091 688 HD2 TYR 84 HD2 TYR 84 6.227 8.142 2.529 689 HE1 TYR 84 HE1 TYR 84 10.809 9.443 3.944 690 HE2 TYR 84 HE2 TYR 84 8.076 6.509 2.369 691 HH TYR 84 HH TYR 84 10.331 6.147 2.653 692 H ASN 85 H ASN 85 5.655 13.887 5.817 693 HA ASN 85 HA ASN 85 2.916 13.686 5.686 694 1HB ASN 85 HB2 ASN 85 4.420 15.149 7.191 695 2HB ASN 85 HB3 ASN 85 4.204 16.408 5.970 696 1HD2 ASN 85 HD22 ASN 85 1.338 15.711 5.313 697 2HD2 ASN 85 HD21 ASN 85 0.432 16.072 6.773 698 H GLU 86 H GLU 86 5.046 15.387 3.457 699 HA GLU 86 HA GLU 86 3.279 16.842 1.859 700 1HB GLU 86 HB2 GLU 86 5.597 15.152 0.802 701 2HB GLU 86 HB3 GLU 86 4.858 16.578 0.075 702 1HG GLU 86 HG2 GLU 86 6.668 17.598 0.999 703 2HG GLU 86 HG3 GLU 86 5.600 17.725 2.398 704 H ALA 87 H ALA 87 3.936 13.314 1.831 705 HA ALA 87 HA ALA 87 2.437 12.724 -0.545 706 1HB ALA 87 HB1 ALA 87 3.075 10.897 1.807 707 2HB ALA 87 HB2 ALA 87 2.603 10.418 0.169 708 3HB ALA 87 HB3 ALA 87 4.166 11.216 0.437 709 H LEU 88 H LEU 88 1.575 13.088 2.910 710 HA LEU 88 HA LEU 88 -1.048 11.921 2.696 711 1HB LEU 88 HB2 LEU 88 -0.217 14.128 4.605 712 2HB LEU 88 HB3 LEU 88 -1.587 13.039 4.727 713 HG LEU 88 HG LEU 88 1.331 12.279 5.042 714 1HD1 LEU 88 HD11 LEU 88 -1.086 12.304 6.918 715 2HD1 LEU 88 HD12 LEU 88 0.523 11.725 7.353 716 3HD1 LEU 88 HD13 LEU 88 0.286 13.434 6.965 717 1HD2 LEU 88 HD21 LEU 88 -1.125 10.480 5.046 718 2HD2 LEU 88 HD22 LEU 88 0.269 10.414 3.932 719 3HD2 LEU 88 HD23 LEU 88 0.492 10.029 5.633 720 H LYS 89 H LYS 89 0.133 15.283 2.408 721 HA LYS 89 HA LYS 89 -2.510 16.295 1.752 722 1HB LYS 89 HB2 LYS 89 0.200 17.575 1.211 723 2HB LYS 89 HB3 LYS 89 -1.378 18.374 1.237 724 1HG LYS 89 HG2 LYS 89 0.148 17.196 3.593 725 2HG LYS 89 HG3 LYS 89 -0.276 18.881 3.285 726 1HD LYS 89 HD2 LYS 89 -2.761 18.138 3.454 727 2HD LYS 89 HD3 LYS 89 -2.142 16.586 4.037 728 1HE LYS 89 HE2 LYS 89 -2.629 17.798 5.988 729 2HE LYS 89 HE3 LYS 89 -0.867 17.889 5.833 730 1HZ LYS 89 HZ1 LYS 89 -1.816 19.996 6.371 731 2HZ LYS 89 HZ2 LYS 89 -1.166 20.077 4.857 732 3HZ LYS 89 HZ3 LYS 89 -2.801 19.956 5.054 733 H GLY 90 H GLY 90 0.214 15.105 -0.152 734 1HA GLY 90 HA2 GLY 90 -0.222 16.031 -2.662 735 2HA GLY 90 HA3 GLY 90 0.327 14.385 -2.314 736 1H MET 1 H1 MET 1 15.909 0.997 -6.048 737 2H MET 1 H2 MET 1 15.056 0.560 -4.699 738 3H MET 1 H3 MET 1 14.977 2.105 -5.262 739 HA MET 1 HA MET 1 13.880 1.352 -7.247 740 1HB MET 1 HB2 MET 1 13.837 -1.420 -5.998 741 2HB MET 1 HB3 MET 1 13.376 -0.941 -7.639 742 1HG MET 1 HG2 MET 1 16.160 -1.099 -6.430 743 2HG MET 1 HG3 MET 1 15.477 -2.098 -7.708 744 1HE MET 1 HE1 MET 1 18.386 -0.188 -9.492 745 2HE MET 1 HE2 MET 1 18.352 -0.744 -7.802 746 3HE MET 1 HE3 MET 1 17.693 -1.780 -9.096 747 H ALA 2 H ALA 2 13.221 2.631 -4.816 748 HA ALA 2 HA ALA 2 11.377 1.395 -3.187 749 1HB ALA 2 HB1 ALA 2 11.580 4.352 -3.878 750 2HB ALA 2 HB2 ALA 2 10.831 3.667 -2.416 751 3HB ALA 2 HB3 ALA 2 12.575 3.496 -2.687 752 H SER 3 H SER 3 10.693 2.842 -6.338 753 HA SER 3 HA SER 3 8.301 3.833 -6.227 754 1HB SER 3 HB2 SER 3 8.875 2.026 -8.563 755 2HB SER 3 HB3 SER 3 8.218 3.664 -8.508 756 HG SER 3 HG SER 3 10.437 3.655 -9.126 757 HA PRO 4 HA PRO 4 5.842 -0.292 -6.878 758 1HB PRO 4 HB2 PRO 4 7.603 -2.240 -5.411 759 2HB PRO 4 HB3 PRO 4 6.569 -2.518 -6.841 760 1HG PRO 4 HG2 PRO 4 9.251 -2.270 -7.145 761 2HG PRO 4 HG3 PRO 4 8.165 -1.393 -8.271 762 1HD PRO 4 HD2 PRO 4 9.387 -0.362 -5.702 763 2HD PRO 4 HD3 PRO 4 9.586 0.343 -7.336 764 H LEU 5 H LEU 5 7.793 0.264 -3.884 765 HA LEU 5 HA LEU 5 5.500 -0.531 -2.220 766 1HB LEU 5 HB2 LEU 5 7.744 -1.001 -1.381 767 2HB LEU 5 HB3 LEU 5 8.160 0.719 -1.459 768 HG LEU 5 HG LEU 5 6.428 1.251 0.221 769 1HD1 LEU 5 HD11 LEU 5 4.737 -0.504 -0.181 770 2HD1 LEU 5 HD12 LEU 5 5.904 -1.764 0.294 771 3HD1 LEU 5 HD13 LEU 5 5.326 -0.572 1.475 772 1HD2 LEU 5 HD21 LEU 5 7.424 0.190 2.151 773 2HD2 LEU 5 HD22 LEU 5 8.168 -1.062 1.126 774 3HD2 LEU 5 HD23 LEU 5 8.689 0.641 0.990 775 H ASP 6 H ASP 6 7.280 2.408 -3.209 776 HA ASP 6 HA ASP 6 5.913 4.343 -1.745 777 1HB ASP 6 HB2 ASP 6 6.837 4.604 -4.636 778 2HB ASP 6 HB3 ASP 6 6.424 5.937 -3.560 779 H GLN 7 H GLN 7 4.963 3.068 -4.981 780 HA GLN 7 HA GLN 7 2.596 4.615 -5.164 781 1HB GLN 7 HB2 GLN 7 1.915 3.157 -6.949 782 2HB GLN 7 HB3 GLN 7 3.637 3.512 -7.047 783 1HG GLN 7 HG2 GLN 7 3.620 1.248 -7.524 784 2HG GLN 7 HG3 GLN 7 4.006 1.277 -5.810 785 1HE2 GLN 7 HE21 GLN 7 3.205 -0.790 -5.322 786 2HE2 GLN 7 HE22 GLN 7 1.509 -1.231 -5.507 787 H ALA 8 H ALA 8 3.172 1.511 -3.483 788 HA ALA 8 HA ALA 8 0.370 0.925 -3.115 789 1HB ALA 8 HB1 ALA 8 2.848 -0.149 -1.734 790 2HB ALA 8 HB2 ALA 8 1.186 -0.694 -1.431 791 3HB ALA 8 HB3 ALA 8 1.884 -0.868 -3.046 792 H ILE 9 H ILE 9 2.946 2.262 -0.925 793 HA ILE 9 HA ILE 9 1.095 2.784 1.214 794 HB ILE 9 HB ILE 9 2.752 4.250 2.180 795 1HG1 ILE 9 HG12 ILE 9 4.415 3.805 -0.290 796 2HG1 ILE 9 HG13 ILE 9 3.672 5.346 0.187 797 1HG2 ILE 9 HG21 ILE 9 4.002 1.708 1.095 798 2HG2 ILE 9 HG22 ILE 9 4.376 2.526 2.627 799 3HG2 ILE 9 HG23 ILE 9 2.803 1.772 2.404 800 1HD1 ILE 9 HD11 ILE 9 5.891 3.874 1.660 801 2HD1 ILE 9 HD12 ILE 9 5.967 5.437 0.839 802 3HD1 ILE 9 HD13 ILE 9 5.009 5.271 2.323 803 H GLY 10 H GLY 10 2.205 4.747 -1.542 804 1HA GLY 10 HA2 GLY 10 0.788 7.107 -1.339 805 2HA GLY 10 HA3 GLY 10 1.093 6.223 -2.837 806 H LEU 11 H LEU 11 -0.439 3.967 -2.628 807 HA LEU 11 HA LEU 11 -2.985 4.823 -3.354 808 1HB LEU 11 HB2 LEU 11 -1.705 2.545 -3.693 809 2HB LEU 11 HB3 LEU 11 -2.457 2.076 -2.178 810 HG LEU 11 HG LEU 11 -3.745 1.186 -3.898 811 1HD1 LEU 11 HD11 LEU 11 -5.050 2.218 -2.069 812 2HD1 LEU 11 HD12 LEU 11 -5.327 3.634 -3.126 813 3HD1 LEU 11 HD13 LEU 11 -5.926 2.036 -3.602 814 1HD2 LEU 11 HD21 LEU 11 -4.662 2.390 -5.790 815 2HD2 LEU 11 HD22 LEU 11 -3.904 3.900 -5.245 816 3HD2 LEU 11 HD23 LEU 11 -2.896 2.521 -5.751 817 H LEU 12 H LEU 12 -2.125 3.134 -0.290 818 HA LEU 12 HA LEU 12 -4.597 3.456 1.076 819 1HB LEU 12 HB2 LEU 12 -1.689 3.318 2.046 820 2HB LEU 12 HB3 LEU 12 -3.050 3.495 3.149 821 HG LEU 12 HG LEU 12 -4.049 1.409 2.307 822 1HD1 LEU 12 HD11 LEU 12 -1.370 1.056 0.891 823 2HD1 LEU 12 HD12 LEU 12 -2.576 -0.219 1.115 824 3HD1 LEU 12 HD13 LEU 12 -2.965 1.170 0.100 825 1HD2 LEU 12 HD21 LEU 12 -2.731 1.442 4.368 826 2HD2 LEU 12 HD22 LEU 12 -2.444 -0.071 3.510 827 3HD2 LEU 12 HD23 LEU 12 -1.227 1.221 3.448 828 H ILE 13 H ILE 13 -1.766 5.650 0.919 829 HA ILE 13 HA ILE 13 -2.804 7.559 2.742 830 HB ILE 13 HB ILE 13 -0.816 7.773 0.438 831 1HG1 ILE 13 HG12 ILE 13 -0.246 7.922 3.418 832 2HG1 ILE 13 HG13 ILE 13 -0.352 6.365 2.609 833 1HG2 ILE 13 HG21 ILE 13 -1.592 9.817 2.524 834 2HG2 ILE 13 HG22 ILE 13 -0.081 9.908 1.578 835 3HG2 ILE 13 HG23 ILE 13 -1.639 10.022 0.757 836 1HD1 ILE 13 HD11 ILE 13 1.682 8.562 2.150 837 2HD1 ILE 13 HD12 ILE 13 1.936 6.847 2.531 838 3HD1 ILE 13 HD13 ILE 13 1.393 7.313 0.924 839 H GLY 14 H GLY 14 -2.982 7.502 -0.843 840 1HA GLY 14 HA2 GLY 14 -4.501 9.852 -1.206 841 2HA GLY 14 HA3 GLY 14 -4.490 8.441 -2.284 842 H ILE 15 H ILE 15 -5.588 6.423 -0.931 843 HA ILE 15 HA ILE 15 -8.365 6.880 -0.946 844 HB ILE 15 HB ILE 15 -6.579 4.700 0.096 845 1HG1 ILE 15 HG12 ILE 15 -8.892 4.889 -1.902 846 2HG1 ILE 15 HG13 ILE 15 -7.166 4.847 -2.281 847 1HG2 ILE 15 HG21 ILE 15 -8.484 3.392 0.907 848 2HG2 ILE 15 HG22 ILE 15 -8.241 4.839 1.855 849 3HG2 ILE 15 HG23 ILE 15 -9.561 4.791 0.658 850 1HD1 ILE 15 HD11 ILE 15 -8.035 2.655 -2.697 851 2HD1 ILE 15 HD12 ILE 15 -7.125 2.530 -1.177 852 3HD1 ILE 15 HD13 ILE 15 -8.900 2.606 -1.161 853 H PHE 16 H PHE 16 -6.105 7.089 1.837 854 HA PHE 16 HA PHE 16 -8.208 7.688 3.707 855 1HB PHE 16 HB2 PHE 16 -5.943 6.915 4.303 856 2HB PHE 16 HB3 PHE 16 -5.246 8.426 3.779 857 HD1 PHE 16 HD1 PHE 16 -5.548 10.507 5.104 858 HD2 PHE 16 HD2 PHE 16 -7.302 6.780 6.369 859 HE1 PHE 16 HE1 PHE 16 -5.853 11.413 7.366 860 HE2 PHE 16 HE2 PHE 16 -7.453 7.646 8.695 861 HZ PHE 16 HZ PHE 16 -6.699 9.944 9.205 862 H HIS 17 H HIS 17 -5.778 9.915 2.247 863 HA HIS 17 HA HIS 17 -7.025 12.086 3.506 864 1HB HIS 17 HB2 HIS 17 -4.583 11.818 2.787 865 2HB HIS 17 HB3 HIS 17 -5.099 12.491 1.236 866 HD1 HIS 17 HD1 HIS 17 -6.904 14.839 2.025 867 HD2 HIS 17 HD2 HIS 17 -3.682 13.604 4.405 868 HE1 HIS 17 HE1 HIS 17 -6.273 16.828 3.506 869 H LYS 18 H LYS 18 -7.723 10.699 0.354 870 HA LYS 18 HA LYS 18 -9.101 12.909 -0.834 871 1HB LYS 18 HB2 LYS 18 -9.580 9.912 -0.827 872 2HB LYS 18 HB3 LYS 18 -10.684 11.022 -1.653 873 1HG LYS 18 HG2 LYS 18 -8.786 11.935 -2.979 874 2HG LYS 18 HG3 LYS 18 -7.724 10.706 -2.296 875 1HD LYS 18 HD2 LYS 18 -10.265 10.214 -3.934 876 2HD LYS 18 HD3 LYS 18 -8.606 10.082 -4.534 877 1HE LYS 18 HE2 LYS 18 -8.166 8.234 -2.929 878 2HE LYS 18 HE3 LYS 18 -9.845 8.329 -2.356 879 1HZ LYS 18 HZ1 LYS 18 -9.015 7.671 -5.084 880 2HZ LYS 18 HZ2 LYS 18 -9.604 6.623 -3.955 881 3HZ LYS 18 HZ3 LYS 18 -10.573 7.808 -4.558 882 H TYR 19 H TYR 19 -10.077 10.584 1.710 883 HA TYR 19 HA TYR 19 -12.770 11.759 1.853 884 1HB TYR 19 HB2 TYR 19 -11.415 9.408 3.143 885 2HB TYR 19 HB3 TYR 19 -12.993 9.965 3.677 886 HD1 TYR 19 HD1 TYR 19 -11.117 8.727 0.722 887 HD2 TYR 19 HD2 TYR 19 -14.999 9.624 2.333 888 HE1 TYR 19 HE1 TYR 19 -12.151 7.599 -1.202 889 HE2 TYR 19 HE2 TYR 19 -16.047 8.660 0.298 890 HH TYR 19 HH TYR 19 -14.125 7.078 -2.271 891 H SER 20 H SER 20 -9.769 11.673 3.909 892 HA SER 20 HA SER 20 -10.689 13.304 5.982 893 1HB SER 20 HB2 SER 20 -8.001 13.696 4.637 894 2HB SER 20 HB3 SER 20 -8.431 13.979 6.321 895 HG SER 20 HG SER 20 -8.615 11.861 6.692 896 H GLY 21 H GLY 21 -9.646 14.269 2.691 897 1HA GLY 21 HA2 GLY 21 -9.774 17.004 2.698 898 2HA GLY 21 HA3 GLY 21 -10.366 15.983 1.378 899 H LYS 22 H LYS 22 -12.618 14.794 2.956 900 HA LYS 22 HA LYS 22 -14.606 16.768 2.402 901 1HB LYS 22 HB2 LYS 22 -14.969 14.264 2.533 902 2HB LYS 22 HB3 LYS 22 -14.858 14.392 4.295 903 1HG LYS 22 HG2 LYS 22 -16.737 16.071 4.257 904 2HG LYS 22 HG3 LYS 22 -16.823 15.873 2.504 905 1HD LYS 22 HD2 LYS 22 -18.526 14.466 3.185 906 2HD LYS 22 HD3 LYS 22 -17.172 13.338 3.011 907 1HE LYS 22 HE2 LYS 22 -18.350 12.819 5.055 908 2HE LYS 22 HE3 LYS 22 -16.793 13.528 5.500 909 1HZ LYS 22 HZ1 LYS 22 -18.591 14.403 6.788 910 2HZ LYS 22 HZ2 LYS 22 -17.901 15.597 5.891 911 3HZ LYS 22 HZ3 LYS 22 -19.353 14.960 5.436 912 H GLU 23 H GLU 23 -12.925 15.775 5.399 913 HA GLU 23 HA GLU 23 -14.393 17.809 6.976 914 1HB GLU 23 HB2 GLU 23 -13.084 16.871 8.900 915 2HB GLU 23 HB3 GLU 23 -14.265 15.796 8.142 916 1HG GLU 23 HG2 GLU 23 -12.492 14.618 6.932 917 2HG GLU 23 HG3 GLU 23 -11.265 15.693 7.642 918 H GLY 24 H GLY 24 -13.191 19.019 5.000 919 1HA GLY 24 HA2 GLY 24 -11.926 20.870 4.606 920 2HA GLY 24 HA3 GLY 24 -11.313 20.811 6.264 921 H ASP 25 H ASP 25 -9.853 18.675 6.547 922 HA ASP 25 HA ASP 25 -8.028 18.037 4.441 923 1HB ASP 25 HB2 ASP 25 -7.405 20.422 4.638 924 2HB ASP 25 HB3 ASP 25 -7.154 20.248 6.370 925 H LYS 26 H LYS 26 -6.214 18.530 7.249 926 HA LYS 26 HA LYS 26 -5.754 17.490 9.139 927 1HB LYS 26 HB2 LYS 26 -8.381 15.975 8.979 928 2HB LYS 26 HB3 LYS 26 -7.373 16.276 10.398 929 1HG LYS 26 HG2 LYS 26 -7.859 18.684 10.293 930 2HG LYS 26 HG3 LYS 26 -8.841 18.443 8.829 931 1HD LYS 26 HD2 LYS 26 -10.347 16.926 10.031 932 2HD LYS 26 HD3 LYS 26 -9.408 17.136 11.522 933 1HE LYS 26 HE2 LYS 26 -9.947 19.573 11.495 934 2HE LYS 26 HE3 LYS 26 -10.862 19.350 9.989 935 1HZ LYS 26 HZ1 LYS 26 -11.486 18.086 12.564 936 2HZ LYS 26 HZ2 LYS 26 -12.284 19.363 11.892 937 3HZ LYS 26 HZ3 LYS 26 -12.328 17.886 11.161 938 H HIS 27 H HIS 27 -4.981 15.505 10.058 939 HA HIS 27 HA HIS 27 -4.511 13.323 8.075 940 1HB HIS 27 HB2 HIS 27 -3.203 13.763 10.775 941 2HB HIS 27 HB3 HIS 27 -2.711 12.627 9.513 942 HD1 HIS 27 HD1 HIS 27 -1.184 15.388 10.849 943 HD2 HIS 27 HD2 HIS 27 -2.663 14.619 6.980 944 HE1 HIS 27 HE1 HIS 27 0.028 16.982 9.273 945 H THR 28 H THR 28 -7.129 13.748 9.246 946 HA THR 28 HA THR 28 -7.479 11.319 10.893 947 HB THR 28 HB THR 28 -9.261 12.551 12.120 948 HG1 THR 28 HG1 THR 28 -9.613 14.285 10.703 949 1HG2 THR 28 HG21 THR 28 -7.006 12.282 13.121 950 2HG2 THR 28 HG22 THR 28 -6.508 13.828 12.396 951 3HG2 THR 28 HG23 THR 28 -7.793 13.794 13.616 952 H LEU 29 H LEU 29 -9.651 10.441 10.707 953 HA LEU 29 HA LEU 29 -11.234 11.386 8.386 954 1HB LEU 29 HB2 LEU 29 -9.326 9.650 7.930 955 2HB LEU 29 HB3 LEU 29 -10.414 8.466 8.645 956 HG LEU 29 HG LEU 29 -11.083 10.309 6.283 957 1HD1 LEU 29 HD11 LEU 29 -9.171 8.985 5.696 958 2HD1 LEU 29 HD12 LEU 29 -9.932 7.495 6.314 959 3HD1 LEU 29 HD13 LEU 29 -10.589 8.320 4.888 960 1HD2 LEU 29 HD21 LEU 29 -13.068 9.291 7.421 961 2HD2 LEU 29 HD22 LEU 29 -12.814 8.579 5.814 962 3HD2 LEU 29 HD23 LEU 29 -12.300 7.698 7.266 963 H SER 30 H SER 30 -13.345 11.501 9.116 964 HA SER 30 HA SER 30 -13.893 10.524 11.756 965 1HB SER 30 HB2 SER 30 -16.170 11.612 11.282 966 2HB SER 30 HB3 SER 30 -14.727 12.634 11.283 967 HG SER 30 HG SER 30 -14.798 12.836 9.150 968 H LYS 31 H LYS 31 -16.022 9.441 12.339 969 HA LYS 31 HA LYS 31 -15.704 6.829 11.605 970 1HB LYS 31 HB2 LYS 31 -17.812 6.441 12.900 971 2HB LYS 31 HB3 LYS 31 -16.551 7.390 13.688 972 1HG LYS 31 HG2 LYS 31 -17.775 9.463 13.368 973 2HG LYS 31 HG3 LYS 31 -19.043 8.598 12.470 974 1HD LYS 31 HD2 LYS 31 -19.548 7.236 14.465 975 2HD LYS 31 HD3 LYS 31 -18.227 8.012 15.342 976 1HE LYS 31 HE2 LYS 31 -20.384 8.973 15.991 977 2HE LYS 31 HE3 LYS 31 -19.346 10.191 15.236 978 1HZ LYS 31 HZ1 LYS 31 -21.598 10.291 14.463 979 2HZ LYS 31 HZ2 LYS 31 -20.592 9.904 13.218 980 3HZ LYS 31 HZ3 LYS 31 -21.535 8.739 13.912 981 H LYS 32 H LYS 32 -18.454 8.848 10.514 982 HA LYS 32 HA LYS 32 -19.339 6.572 8.810 983 1HB LYS 32 HB2 LYS 32 -20.595 9.305 8.800 984 2HB LYS 32 HB3 LYS 32 -21.230 7.756 8.205 985 1HG LYS 32 HG2 LYS 32 -20.813 8.533 11.110 986 2HG LYS 32 HG3 LYS 32 -22.330 8.338 10.239 987 1HD LYS 32 HD2 LYS 32 -21.793 5.903 9.880 988 2HD LYS 32 HD3 LYS 32 -20.313 6.111 10.832 989 1HE LYS 32 HE2 LYS 32 -22.031 5.145 12.232 990 2HE LYS 32 HE3 LYS 32 -21.639 6.769 12.811 991 1HZ LYS 32 HZ1 LYS 32 -23.951 6.053 11.136 992 2HZ LYS 32 HZ2 LYS 32 -23.992 6.340 12.757 993 3HZ LYS 32 HZ3 LYS 32 -23.615 7.558 11.717 994 H GLU 33 H GLU 33 -17.407 9.442 8.472 995 HA GLU 33 HA GLU 33 -17.351 9.628 5.614 996 1HB GLU 33 HB2 GLU 33 -16.559 11.340 7.225 997 2HB GLU 33 HB3 GLU 33 -15.253 10.260 7.725 998 1HG GLU 33 HG2 GLU 33 -14.349 10.343 5.403 999 2HG GLU 33 HG3 GLU 33 -15.594 11.526 4.980 1000 H LEU 34 H LEU 34 -15.428 7.759 8.025 1001 HA LEU 34 HA LEU 34 -13.856 6.283 6.195 1002 1HB LEU 34 HB2 LEU 34 -13.360 6.266 8.572 1003 2HB LEU 34 HB3 LEU 34 -14.927 5.625 8.978 1004 HG LEU 34 HG LEU 34 -13.071 4.043 9.178 1005 1HD1 LEU 34 HD11 LEU 34 -14.293 2.151 8.580 1006 2HD1 LEU 34 HD12 LEU 34 -15.545 3.379 8.728 1007 3HD1 LEU 34 HD13 LEU 34 -14.969 2.878 7.135 1008 1HD2 LEU 34 HD21 LEU 34 -12.074 3.005 7.152 1009 2HD2 LEU 34 HD22 LEU 34 -12.964 4.121 6.128 1010 3HD2 LEU 34 HD23 LEU 34 -11.734 4.741 7.242 1011 H LYS 35 H LYS 35 -17.098 5.534 7.621 1012 HA LYS 35 HA LYS 35 -17.423 3.143 6.197 1013 1HB LYS 35 HB2 LYS 35 -18.979 4.129 7.975 1014 2HB LYS 35 HB3 LYS 35 -19.750 5.045 6.658 1015 1HG LYS 35 HG2 LYS 35 -20.063 2.867 5.421 1016 2HG LYS 35 HG3 LYS 35 -19.345 2.028 6.810 1017 1HD LYS 35 HD2 LYS 35 -21.207 2.928 8.244 1018 2HD LYS 35 HD3 LYS 35 -21.933 3.635 6.780 1019 1HE LYS 35 HE2 LYS 35 -21.928 1.339 5.735 1020 2HE LYS 35 HE3 LYS 35 -21.290 0.676 7.244 1021 1HZ LYS 35 HZ1 LYS 35 -23.331 1.532 8.298 1022 2HZ LYS 35 HZ2 LYS 35 -23.875 2.062 6.837 1023 3HZ LYS 35 HZ3 LYS 35 -23.670 0.450 7.104 1024 H GLU 36 H GLU 36 -18.163 6.480 5.078 1025 HA GLU 36 HA GLU 36 -19.130 5.797 2.535 1026 1HB GLU 36 HB2 GLU 36 -19.051 8.100 3.731 1027 2HB GLU 36 HB3 GLU 36 -17.421 8.263 3.075 1028 1HG GLU 36 HG2 GLU 36 -18.959 9.373 1.583 1029 2HG GLU 36 HG3 GLU 36 -18.343 7.934 0.761 1030 H LEU 37 H LEU 37 -15.759 6.460 3.565 1031 HA LEU 37 HA LEU 37 -14.450 6.012 1.100 1032 1HB LEU 37 HB2 LEU 37 -13.290 6.889 3.044 1033 2HB LEU 37 HB3 LEU 37 -13.569 5.445 3.978 1034 HG LEU 37 HG LEU 37 -11.827 5.420 1.502 1035 1HD1 LEU 37 HD11 LEU 37 -9.919 5.552 3.130 1036 2HD1 LEU 37 HD12 LEU 37 -10.911 7.012 3.114 1037 3HD1 LEU 37 HD13 LEU 37 -11.078 5.827 4.438 1038 1HD2 LEU 37 HD21 LEU 37 -12.159 3.537 3.900 1039 2HD2 LEU 37 HD22 LEU 37 -12.402 3.133 2.180 1040 3HD2 LEU 37 HD23 LEU 37 -10.790 3.462 2.779 1041 H ILE 38 H ILE 38 -15.315 3.579 3.606 1042 HA ILE 38 HA ILE 38 -14.316 1.425 2.013 1043 HB ILE 38 HB ILE 38 -16.433 1.468 4.194 1044 1HG1 ILE 38 HG12 ILE 38 -13.449 0.770 4.103 1045 2HG1 ILE 38 HG13 ILE 38 -14.160 2.213 4.839 1046 1HG2 ILE 38 HG21 ILE 38 -16.140 -0.958 4.338 1047 2HG2 ILE 38 HG22 ILE 38 -16.719 -0.561 2.737 1048 3HG2 ILE 38 HG23 ILE 38 -14.999 -0.937 2.982 1049 1HD1 ILE 38 HD11 ILE 38 -14.434 -0.645 5.741 1050 2HD1 ILE 38 HD12 ILE 38 -13.709 0.749 6.583 1051 3HD1 ILE 38 HD13 ILE 38 -15.477 0.664 6.365 1052 H GLN 39 H GLN 39 -17.652 2.683 2.332 1053 HA GLN 39 HA GLN 39 -18.876 0.840 0.649 1054 1HB GLN 39 HB2 GLN 39 -19.488 3.787 1.121 1055 2HB GLN 39 HB3 GLN 39 -20.565 2.738 0.204 1056 1HG GLN 39 HG2 GLN 39 -19.706 2.101 3.058 1057 2HG GLN 39 HG3 GLN 39 -21.122 3.088 2.679 1058 1HE2 GLN 39 HE22 GLN 39 -20.840 0.408 4.050 1059 2HE2 GLN 39 HE21 GLN 39 -21.992 -0.585 3.190 1060 H LYS 40 H LYS 40 -17.244 3.926 -0.328 1061 HA LYS 40 HA LYS 40 -17.914 3.321 -3.116 1062 1HB LYS 40 HB2 LYS 40 -17.679 5.630 -2.019 1063 2HB LYS 40 HB3 LYS 40 -15.928 5.398 -2.190 1064 1HG LYS 40 HG2 LYS 40 -16.337 4.934 -4.669 1065 2HG LYS 40 HG3 LYS 40 -18.035 5.357 -4.412 1066 1HD LYS 40 HD2 LYS 40 -15.611 7.177 -4.082 1067 2HD LYS 40 HD3 LYS 40 -16.817 7.233 -5.369 1068 1HE LYS 40 HE2 LYS 40 -18.582 7.786 -3.673 1069 2HE LYS 40 HE3 LYS 40 -17.332 7.823 -2.413 1070 1HZ LYS 40 HZ1 LYS 40 -16.248 9.565 -3.587 1071 2HZ LYS 40 HZ2 LYS 40 -17.398 9.557 -4.769 1072 3HZ LYS 40 HZ3 LYS 40 -17.800 9.986 -3.229 1073 H GLU 41 H GLU 41 -14.876 3.268 -1.159 1074 HA GLU 41 HA GLU 41 -13.308 2.638 -3.509 1075 1HB GLU 41 HB2 GLU 41 -12.470 2.513 -0.594 1076 2HB GLU 41 HB3 GLU 41 -11.415 2.543 -2.009 1077 1HG GLU 41 HG2 GLU 41 -13.231 4.821 -1.075 1078 2HG GLU 41 HG3 GLU 41 -11.479 4.740 -0.950 1079 H LEU 42 H LEU 42 -14.559 0.673 -0.757 1080 HA LEU 42 HA LEU 42 -13.285 -1.763 -1.867 1081 1HB LEU 42 HB2 LEU 42 -15.020 -1.269 0.557 1082 2HB LEU 42 HB3 LEU 42 -14.757 -2.873 -0.077 1083 HG LEU 42 HG LEU 42 -13.298 -2.202 1.850 1084 1HD1 LEU 42 HD11 LEU 42 -11.326 -3.346 1.023 1085 2HD1 LEU 42 HD12 LEU 42 -12.788 -4.131 0.402 1086 3HD1 LEU 42 HD13 LEU 42 -11.821 -3.085 -0.656 1087 1HD2 LEU 42 HD21 LEU 42 -11.333 -0.857 1.503 1088 2HD2 LEU 42 HD22 LEU 42 -11.720 -0.606 -0.208 1089 3HD2 LEU 42 HD23 LEU 42 -12.742 0.114 1.055 1090 H THR 43 H THR 43 -16.289 0.064 -2.088 1091 HA THR 43 HA THR 43 -18.024 -0.170 -3.542 1092 HB THR 43 HB THR 43 -16.373 -2.161 -5.104 1093 HG1 THR 43 HG1 THR 43 -15.973 0.615 -4.738 1094 1HG2 THR 43 HG21 THR 43 -18.216 0.129 -5.932 1095 2HG2 THR 43 HG22 THR 43 -17.356 -0.978 -7.021 1096 3HG2 THR 43 HG23 THR 43 -18.641 -1.598 -5.967 1097 H ILE 44 H ILE 44 -18.587 -1.366 -1.369 1098 HA ILE 44 HA ILE 44 -18.818 -4.209 -1.447 1099 HB ILE 44 HB ILE 44 -18.467 -3.002 0.574 1100 1HG1 ILE 44 HG12 ILE 44 -21.091 -4.556 0.634 1101 2HG1 ILE 44 HG13 ILE 44 -19.465 -5.252 0.599 1102 1HG2 ILE 44 HG21 ILE 44 -21.337 -2.042 0.675 1103 2HG2 ILE 44 HG22 ILE 44 -19.951 -1.586 1.676 1104 3HG2 ILE 44 HG23 ILE 44 -20.053 -1.033 0.005 1105 1HD1 ILE 44 HD11 ILE 44 -20.324 -5.243 2.874 1106 2HD1 ILE 44 HD12 ILE 44 -18.929 -4.156 2.731 1107 3HD1 ILE 44 HD13 ILE 44 -20.583 -3.496 2.823 1108 H GLY 45 H GLY 45 -19.811 -4.463 -3.479 1109 1HA GLY 45 HA2 GLY 45 -22.165 -3.993 -4.573 1110 2HA GLY 45 HA3 GLY 45 -21.576 -5.654 -4.434 1111 H SER 46 H SER 46 -24.163 -3.674 -3.801 1112 HA SER 46 HA SER 46 -26.096 -3.835 -2.687 1113 1HB SER 46 HB2 SER 46 -25.483 -6.811 -2.639 1114 2HB SER 46 HB3 SER 46 -27.078 -6.042 -2.557 1115 HG SER 46 HG SER 46 -26.509 -6.715 -4.704 1116 H LYS 47 H LYS 47 -23.522 -3.709 -0.943 1117 HA LYS 47 HA LYS 47 -23.065 -3.506 1.255 1118 1HB LYS 47 HB2 LYS 47 -26.063 -3.047 1.450 1119 2HB LYS 47 HB3 LYS 47 -24.827 -2.477 2.576 1120 1HG LYS 47 HG2 LYS 47 -23.774 -1.146 0.747 1121 2HG LYS 47 HG3 LYS 47 -25.092 -1.637 -0.333 1122 1HD LYS 47 HD2 LYS 47 -26.750 -0.597 1.198 1123 2HD LYS 47 HD3 LYS 47 -25.448 -0.154 2.313 1124 1HE LYS 47 HE2 LYS 47 -26.090 1.784 0.974 1125 2HE LYS 47 HE3 LYS 47 -24.428 1.305 0.595 1126 1HZ LYS 47 HZ1 LYS 47 -26.799 0.623 -1.002 1127 2HZ LYS 47 HZ2 LYS 47 -25.708 1.806 -1.355 1128 3HZ LYS 47 HZ3 LYS 47 -25.239 0.228 -1.365 1129 H LEU 48 H LEU 48 -23.640 -6.294 0.396 1130 HA LEU 48 HA LEU 48 -25.363 -7.617 2.114 1131 1HB LEU 48 HB2 LEU 48 -22.753 -8.697 0.970 1132 2HB LEU 48 HB3 LEU 48 -24.076 -9.684 1.603 1133 HG LEU 48 HG LEU 48 -24.252 -7.850 -0.829 1134 1HD1 LEU 48 HD11 LEU 48 -22.826 -9.825 -1.194 1135 2HD1 LEU 48 HD12 LEU 48 -24.136 -10.883 -0.622 1136 3HD1 LEU 48 HD13 LEU 48 -24.337 -9.938 -2.114 1137 1HD2 LEU 48 HD21 LEU 48 -26.462 -8.020 0.204 1138 2HD2 LEU 48 HD22 LEU 48 -26.419 -9.042 -1.233 1139 3HD2 LEU 48 HD23 LEU 48 -26.283 -9.782 0.374 1140 H GLN 49 H GLN 49 -21.949 -6.970 2.732 1141 HA GLN 49 HA GLN 49 -22.204 -8.171 5.453 1142 1HB GLN 49 HB2 GLN 49 -19.740 -7.217 3.950 1143 2HB GLN 49 HB3 GLN 49 -19.776 -8.036 5.516 1144 1HG GLN 49 HG2 GLN 49 -20.881 -10.003 4.463 1145 2HG GLN 49 HG3 GLN 49 -20.702 -9.241 2.875 1146 1HE2 GLN 49 HE22 GLN 49 -18.325 -8.471 2.388 1147 2HE2 GLN 49 HE21 GLN 49 -17.086 -9.621 2.861 1148 H ASP 50 H ASP 50 -23.469 -5.470 4.668 1149 HA ASP 50 HA ASP 50 -21.936 -3.369 5.572 1150 1HB ASP 50 HB2 ASP 50 -24.187 -3.186 4.536 1151 2HB ASP 50 HB3 ASP 50 -24.927 -3.623 6.083 1152 H ALA 51 H ALA 51 -23.826 -5.614 7.583 1153 HA ALA 51 HA ALA 51 -23.531 -4.409 10.123 1154 1HB ALA 51 HB1 ALA 51 -24.914 -6.400 9.711 1155 2HB ALA 51 HB2 ALA 51 -23.458 -7.369 9.387 1156 3HB ALA 51 HB3 ALA 51 -23.741 -6.703 11.008 1157 H GLU 52 H GLU 52 -21.271 -6.504 8.296 1158 HA GLU 52 HA GLU 52 -19.286 -6.635 10.395 1159 1HB GLU 52 HB2 GLU 52 -18.801 -7.014 7.415 1160 2HB GLU 52 HB3 GLU 52 -17.869 -7.645 8.772 1161 1HG GLU 52 HG2 GLU 52 -20.667 -8.514 7.908 1162 2HG GLU 52 HG3 GLU 52 -19.177 -9.455 7.848 1163 H ILE 53 H ILE 53 -19.842 -4.622 7.483 1164 HA ILE 53 HA ILE 53 -17.510 -3.026 7.779 1165 HB ILE 53 HB ILE 53 -20.177 -2.182 6.600 1166 1HG1 ILE 53 HG12 ILE 53 -19.408 -4.039 5.315 1167 2HG1 ILE 53 HG13 ILE 53 -18.964 -2.578 4.437 1168 1HG2 ILE 53 HG21 ILE 53 -18.894 -0.219 7.119 1169 2HG2 ILE 53 HG22 ILE 53 -17.429 -0.913 6.412 1170 3HG2 ILE 53 HG23 ILE 53 -18.814 -0.499 5.378 1171 1HD1 ILE 53 HD11 ILE 53 -17.096 -4.062 4.293 1172 2HD1 ILE 53 HD12 ILE 53 -16.618 -2.827 5.469 1173 3HD1 ILE 53 HD13 ILE 53 -17.142 -4.433 6.019 1174 H VAL 54 H VAL 54 -20.766 -2.519 9.336 1175 HA VAL 54 HA VAL 54 -19.713 -0.145 10.587 1176 HB VAL 54 HB VAL 54 -21.657 -0.176 12.098 1177 1HG1 VAL 54 HG11 VAL 54 -23.104 0.667 10.321 1178 2HG1 VAL 54 HG12 VAL 54 -21.430 1.148 9.991 1179 3HG1 VAL 54 HG13 VAL 54 -22.150 -0.226 9.117 1180 1HG2 VAL 54 HG21 VAL 54 -22.702 -2.360 10.293 1181 2HG2 VAL 54 HG22 VAL 54 -22.223 -2.594 11.994 1182 3HG2 VAL 54 HG23 VAL 54 -23.574 -1.523 11.581 1183 H LYS 55 H LYS 55 -19.770 -3.554 11.690 1184 HA LYS 55 HA LYS 55 -18.754 -2.965 14.300 1185 1HB LYS 55 HB2 LYS 55 -19.514 -5.187 13.766 1186 2HB LYS 55 HB3 LYS 55 -18.347 -5.346 12.452 1187 1HG LYS 55 HG2 LYS 55 -17.685 -6.638 14.401 1188 2HG LYS 55 HG3 LYS 55 -16.475 -5.412 14.014 1189 1HD LYS 55 HD2 LYS 55 -17.369 -3.947 15.831 1190 2HD LYS 55 HD3 LYS 55 -18.579 -5.178 16.227 1191 1HE LYS 55 HE2 LYS 55 -15.537 -5.516 16.342 1192 2HE LYS 55 HE3 LYS 55 -16.585 -5.195 17.729 1193 1HZ LYS 55 HZ1 LYS 55 -16.687 -7.583 16.024 1194 2HZ LYS 55 HZ2 LYS 55 -16.090 -7.498 17.556 1195 3HZ LYS 55 HZ3 LYS 55 -17.700 -7.271 17.288 1196 H LEU 56 H LEU 56 -17.064 -3.646 11.237 1197 HA LEU 56 HA LEU 56 -14.406 -3.207 12.064 1198 1HB LEU 56 HB2 LEU 56 -14.822 -4.300 10.066 1199 2HB LEU 56 HB3 LEU 56 -15.912 -3.065 9.452 1200 HG LEU 56 HG LEU 56 -13.086 -2.200 9.905 1201 1HD1 LEU 56 HD11 LEU 56 -13.966 -3.991 7.597 1202 2HD1 LEU 56 HD12 LEU 56 -12.433 -3.103 7.685 1203 3HD1 LEU 56 HD13 LEU 56 -12.770 -4.401 8.846 1204 1HD2 LEU 56 HD21 LEU 56 -15.135 -1.779 7.660 1205 2HD2 LEU 56 HD22 LEU 56 -14.868 -0.640 8.973 1206 3HD2 LEU 56 HD23 LEU 56 -13.542 -0.991 7.857 1207 H MET 57 H MET 57 -16.814 -0.857 10.820 1208 HA MET 57 HA MET 57 -15.132 1.428 10.882 1209 1HB MET 57 HB2 MET 57 -17.186 1.433 9.647 1210 2HB MET 57 HB3 MET 57 -18.130 1.136 11.108 1211 1HG MET 57 HG2 MET 57 -16.435 3.619 10.839 1212 2HG MET 57 HG3 MET 57 -18.054 3.531 10.148 1213 1HE MET 57 HE1 MET 57 -19.695 1.862 12.503 1214 2HE MET 57 HE2 MET 57 -20.339 3.297 13.311 1215 3HE MET 57 HE3 MET 57 -20.273 3.245 11.532 1216 H ASP 58 H ASP 58 -17.334 0.003 13.353 1217 HA ASP 58 HA ASP 58 -16.913 1.913 15.360 1218 1HB ASP 58 HB2 ASP 58 -18.607 0.182 15.576 1219 2HB ASP 58 HB3 ASP 58 -17.363 -1.064 15.741 1220 H ASP 59 H ASP 59 -15.062 -1.099 14.652 1221 HA ASP 59 HA ASP 59 -13.115 -0.703 16.681 1222 1HB ASP 59 HB2 ASP 59 -12.676 -1.998 13.945 1223 2HB ASP 59 HB3 ASP 59 -11.660 -2.204 15.375 1224 H LEU 60 H LEU 60 -12.972 0.307 13.247 1225 HA LEU 60 HA LEU 60 -10.493 1.630 13.340 1226 1HB LEU 60 HB2 LEU 60 -12.977 1.845 11.655 1227 2HB LEU 60 HB3 LEU 60 -11.787 3.114 11.484 1228 HG LEU 60 HG LEU 60 -10.876 0.250 11.289 1229 1HD1 LEU 60 HD11 LEU 60 -12.065 1.854 9.003 1230 2HD1 LEU 60 HD12 LEU 60 -11.261 0.297 8.842 1231 3HD1 LEU 60 HD13 LEU 60 -12.793 0.410 9.739 1232 1HD2 LEU 60 HD21 LEU 60 -9.262 1.299 9.649 1233 2HD2 LEU 60 HD22 LEU 60 -10.031 2.856 9.904 1234 3HD2 LEU 60 HD23 LEU 60 -9.156 2.072 11.249 1235 H ASP 61 H ASP 61 -13.742 3.148 13.858 1236 HA ASP 61 HA ASP 61 -12.454 5.675 14.367 1237 1HB ASP 61 HB2 ASP 61 -14.470 6.653 14.413 1238 2HB ASP 61 HB3 ASP 61 -14.828 5.256 13.392 1239 H ARG 62 H ARG 62 -13.533 3.012 16.438 1240 HA ARG 62 HA ARG 62 -13.667 4.464 18.879 1241 1HB ARG 62 HB2 ARG 62 -14.540 2.229 18.614 1242 2HB ARG 62 HB3 ARG 62 -12.912 1.564 18.342 1243 1HG ARG 62 HG2 ARG 62 -12.304 2.101 20.663 1244 2HG ARG 62 HG3 ARG 62 -13.861 2.929 20.904 1245 1HD ARG 62 HD2 ARG 62 -15.065 0.822 20.439 1246 2HD ARG 62 HD3 ARG 62 -13.519 -0.017 20.180 1247 HE ARG 62 HE ARG 62 -13.404 1.166 22.731 1248 1HH1 ARG 62 HH22 ARG 62 -15.279 -1.302 21.047 1249 2HH1 ARG 62 HH21 ARG 62 -15.608 -2.249 22.472 1250 1HH2 ARG 62 HH12 ARG 62 -13.819 -0.055 24.622 1251 2HH2 ARG 62 HH11 ARG 62 -14.759 -1.521 24.549 1252 H ASN 63 H ASN 63 -10.960 3.150 17.020 1253 HA ASN 63 HA ASN 63 -8.900 3.285 18.826 1254 1HB ASN 63 HB2 ASN 63 -8.944 2.634 16.294 1255 2HB ASN 63 HB3 ASN 63 -8.485 4.316 16.010 1256 1HD2 ASN 63 HD22 ASN 63 -6.750 4.470 18.537 1257 2HD2 ASN 63 HD21 ASN 63 -5.389 3.428 18.169 1258 H LYS 64 H LYS 64 -10.503 6.038 17.264 1259 HA LYS 64 HA LYS 64 -9.352 7.705 19.378 1260 1HB LYS 64 HB2 LYS 64 -7.933 8.113 17.280 1261 2HB LYS 64 HB3 LYS 64 -9.376 8.793 16.546 1262 1HG LYS 64 HG2 LYS 64 -8.608 10.728 17.376 1263 2HG LYS 64 HG3 LYS 64 -9.358 10.215 18.882 1264 1HD LYS 64 HD2 LYS 64 -6.432 9.861 18.055 1265 2HD LYS 64 HD3 LYS 64 -7.062 11.027 19.230 1266 1HE LYS 64 HE2 LYS 64 -7.817 9.106 20.671 1267 2HE LYS 64 HE3 LYS 64 -7.051 7.986 19.520 1268 1HZ LYS 64 HZ1 LYS 64 -5.636 8.461 21.344 1269 2HZ LYS 64 HZ2 LYS 64 -4.972 9.032 19.949 1270 3HZ LYS 64 HZ3 LYS 64 -5.662 10.078 21.025 1271 H ASP 65 H ASP 65 -11.530 6.548 19.669 1272 HA ASP 65 HA ASP 65 -13.610 6.741 20.290 1273 1HB ASP 65 HB2 ASP 65 -14.432 8.857 21.172 1274 2HB ASP 65 HB3 ASP 65 -12.800 8.449 21.700 1275 H GLN 66 H GLN 66 -13.452 9.413 17.963 1276 HA GLN 66 HA GLN 66 -15.920 8.366 16.613 1277 1HB GLN 66 HB2 GLN 66 -15.253 11.244 17.304 1278 2HB GLN 66 HB3 GLN 66 -16.638 10.726 16.336 1279 1HG GLN 66 HG2 GLN 66 -16.208 9.896 19.253 1280 2HG GLN 66 HG3 GLN 66 -17.158 11.274 18.721 1281 1HE2 GLN 66 HE22 GLN 66 -16.974 7.660 18.396 1282 2HE2 GLN 66 HE21 GLN 66 -18.702 7.495 18.152 1283 H GLU 67 H GLU 67 -12.644 8.958 16.216 1284 HA GLU 67 HA GLU 67 -13.026 9.126 13.294 1285 1HB GLU 67 HB2 GLU 67 -10.954 10.814 14.768 1286 2HB GLU 67 HB3 GLU 67 -11.307 10.789 13.035 1287 1HG GLU 67 HG2 GLU 67 -13.666 11.667 13.680 1288 2HG GLU 67 HG3 GLU 67 -12.978 11.974 15.279 1289 H VAL 68 H VAL 68 -11.017 8.594 12.173 1290 HA VAL 68 HA VAL 68 -9.238 6.718 13.662 1291 HB VAL 68 HB VAL 68 -9.431 6.861 10.640 1292 1HG1 VAL 68 HG11 VAL 68 -8.738 4.538 10.821 1293 2HG1 VAL 68 HG12 VAL 68 -7.676 5.543 11.816 1294 3HG1 VAL 68 HG13 VAL 68 -8.942 4.565 12.584 1295 1HG2 VAL 68 HG21 VAL 68 -11.121 5.099 10.572 1296 2HG2 VAL 68 HG22 VAL 68 -11.408 5.303 12.317 1297 3HG2 VAL 68 HG23 VAL 68 -11.791 6.609 11.178 1298 H ASN 69 H ASN 69 -7.144 7.616 13.898 1299 HA ASN 69 HA ASN 69 -6.484 9.959 12.199 1300 1HB ASN 69 HB2 ASN 69 -4.733 10.493 13.494 1301 2HB ASN 69 HB3 ASN 69 -5.927 9.925 14.658 1302 1HD2 ASN 69 HD21 ASN 69 -4.507 9.311 16.310 1303 2HD2 ASN 69 HD22 ASN 69 -3.245 8.116 16.104 1304 H PHE 70 H PHE 70 -4.556 9.947 10.867 1305 HA PHE 70 HA PHE 70 -4.541 7.922 9.025 1306 1HB PHE 70 HB2 PHE 70 -3.577 10.098 8.610 1307 2HB PHE 70 HB3 PHE 70 -2.292 9.809 9.783 1308 HD1 PHE 70 HD1 PHE 70 -3.774 8.289 6.668 1309 HD2 PHE 70 HD2 PHE 70 -0.229 8.951 9.033 1310 HE1 PHE 70 HE1 PHE 70 -2.440 6.989 5.038 1311 HE2 PHE 70 HE2 PHE 70 1.093 7.662 7.411 1312 HZ PHE 70 HZ PHE 70 -0.008 6.632 5.427 1313 H GLN 71 H GLN 71 -2.260 8.029 11.803 1314 HA GLN 71 HA GLN 71 -0.720 5.773 10.940 1315 1HB GLN 71 HB2 GLN 71 0.155 7.322 12.592 1316 2HB GLN 71 HB3 GLN 71 -1.190 6.999 13.692 1317 1HG GLN 71 HG2 GLN 71 0.792 5.875 14.465 1318 2HG GLN 71 HG3 GLN 71 -0.410 4.670 14.023 1319 1HE2 GLN 71 HE22 GLN 71 -0.084 3.478 11.922 1320 2HE2 GLN 71 HE21 GLN 71 1.596 3.350 11.354 1321 H GLU 72 H GLU 72 -3.544 6.151 13.062 1322 HA GLU 72 HA GLU 72 -3.800 3.431 13.921 1323 1HB GLU 72 HB2 GLU 72 -5.865 5.619 13.537 1324 2HB GLU 72 HB3 GLU 72 -6.186 4.092 14.358 1325 1HG GLU 72 HG2 GLU 72 -4.615 4.576 16.114 1326 2HG GLU 72 HG3 GLU 72 -3.967 5.974 15.276 1327 H TYR 73 H TYR 73 -5.227 5.244 11.182 1328 HA TYR 73 HA TYR 73 -6.764 3.156 10.047 1329 1HB TYR 73 HB2 TYR 73 -7.172 5.259 9.186 1330 2HB TYR 73 HB3 TYR 73 -5.482 5.676 9.042 1331 HD1 TYR 73 HD1 TYR 73 -4.236 5.312 7.065 1332 HD2 TYR 73 HD2 TYR 73 -8.229 3.731 7.452 1333 HE1 TYR 73 HE1 TYR 73 -4.302 4.900 4.633 1334 HE2 TYR 73 HE2 TYR 73 -8.336 3.432 4.987 1335 HH TYR 73 HH TYR 73 -5.788 4.582 2.833 1336 H ILE 74 H ILE 74 -3.326 4.058 9.311 1337 HA ILE 74 HA ILE 74 -2.935 1.898 7.501 1338 HB ILE 74 HB ILE 74 -0.904 3.290 9.280 1339 1HG1 ILE 74 HG12 ILE 74 -2.090 4.782 7.633 1340 2HG1 ILE 74 HG13 ILE 74 -0.354 4.681 7.458 1341 1HG2 ILE 74 HG21 ILE 74 0.703 2.403 7.443 1342 2HG2 ILE 74 HG22 ILE 74 0.125 1.265 8.661 1343 3HG2 ILE 74 HG23 ILE 74 -0.589 1.271 7.035 1344 1HD1 ILE 74 HD11 ILE 74 -2.385 3.248 5.711 1345 2HD1 ILE 74 HD12 ILE 74 -1.430 4.668 5.269 1346 3HD1 ILE 74 HD13 ILE 74 -0.613 3.134 5.526 1347 H THR 75 H THR 75 -2.162 2.021 11.045 1348 HA THR 75 HA THR 75 -1.303 -0.616 11.360 1349 HB THR 75 HB THR 75 -2.932 1.166 13.216 1350 HG1 THR 75 HG1 THR 75 -0.167 0.562 13.175 1351 1HG2 THR 75 HG21 THR 75 -3.084 -1.130 14.080 1352 2HG2 THR 75 HG22 THR 75 -1.334 -1.348 13.877 1353 3HG2 THR 75 HG23 THR 75 -1.956 -0.182 15.058 1354 H PHE 76 H PHE 76 -4.686 0.605 11.473 1355 HA PHE 76 HA PHE 76 -5.901 -1.895 11.995 1356 1HB PHE 76 HB2 PHE 76 -7.072 0.254 12.258 1357 2HB PHE 76 HB3 PHE 76 -7.043 0.495 10.512 1358 HD1 PHE 76 HD1 PHE 76 -8.486 -1.532 13.277 1359 HD2 PHE 76 HD2 PHE 76 -8.497 -0.860 9.007 1360 HE1 PHE 76 HE1 PHE 76 -10.364 -3.130 13.012 1361 HE2 PHE 76 HE2 PHE 76 -10.422 -2.354 8.777 1362 HZ PHE 76 HZ PHE 76 -11.286 -3.603 10.746 1363 H LEU 77 H LEU 77 -5.125 -0.287 8.825 1364 HA LEU 77 HA LEU 77 -6.220 -2.457 7.289 1365 1HB LEU 77 HB2 LEU 77 -4.099 -0.383 6.658 1366 2HB LEU 77 HB3 LEU 77 -4.611 -1.610 5.494 1367 HG LEU 77 HG LEU 77 -6.529 0.363 6.830 1368 1HD1 LEU 77 HD11 LEU 77 -5.233 0.372 4.079 1369 2HD1 LEU 77 HD12 LEU 77 -6.580 1.410 4.575 1370 3HD1 LEU 77 HD13 LEU 77 -5.003 1.571 5.381 1371 1HD2 LEU 77 HD21 LEU 77 -8.005 -0.347 4.881 1372 2HD2 LEU 77 HD22 LEU 77 -6.848 -1.662 4.567 1373 3HD2 LEU 77 HD23 LEU 77 -7.773 -1.591 6.096 1374 H GLY 78 H GLY 78 -3.052 -2.058 8.854 1375 1HA GLY 78 HA2 GLY 78 -1.893 -4.490 7.907 1376 2HA GLY 78 HA3 GLY 78 -1.567 -3.732 9.482 1377 H ALA 79 H ALA 79 -4.010 -3.854 10.761 1378 HA ALA 79 HA ALA 79 -4.231 -6.550 11.589 1379 1HB ALA 79 HB1 ALA 79 -6.448 -4.469 11.807 1380 2HB ALA 79 HB2 ALA 79 -6.212 -5.918 12.787 1381 3HB ALA 79 HB3 ALA 79 -5.057 -4.579 12.904 1382 H LEU 80 H LEU 80 -6.181 -4.730 9.194 1383 HA LEU 80 HA LEU 80 -7.999 -6.776 8.583 1384 1HB LEU 80 HB2 LEU 80 -7.958 -4.235 7.924 1385 2HB LEU 80 HB3 LEU 80 -7.025 -4.787 6.533 1386 HG LEU 80 HG LEU 80 -8.993 -6.463 6.137 1387 1HD1 LEU 80 HD11 LEU 80 -10.182 -6.213 8.278 1388 2HD1 LEU 80 HD12 LEU 80 -10.352 -4.468 7.990 1389 3HD1 LEU 80 HD13 LEU 80 -11.189 -5.624 6.941 1390 1HD2 LEU 80 HD21 LEU 80 -10.283 -4.654 4.962 1391 2HD2 LEU 80 HD22 LEU 80 -9.425 -3.435 5.921 1392 3HD2 LEU 80 HD23 LEU 80 -8.538 -4.428 4.738 1393 H ALA 81 H ALA 81 -4.810 -6.013 7.143 1394 HA ALA 81 HA ALA 81 -4.685 -8.048 5.166 1395 1HB ALA 81 HB1 ALA 81 -2.510 -6.786 6.847 1396 2HB ALA 81 HB2 ALA 81 -2.230 -7.899 5.504 1397 3HB ALA 81 HB3 ALA 81 -3.039 -6.334 5.233 1398 H MET 82 H MET 82 -3.806 -8.120 8.651 1399 HA MET 82 HA MET 82 -3.160 -10.903 8.643 1400 1HB MET 82 HB2 MET 82 -2.338 -9.227 10.270 1401 2HB MET 82 HB3 MET 82 -3.948 -9.165 11.008 1402 1HG MET 82 HG2 MET 82 -3.781 -11.441 11.746 1403 2HG MET 82 HG3 MET 82 -2.399 -11.762 10.692 1404 1HE MET 82 HE1 MET 82 -2.051 -9.127 14.471 1405 2HE MET 82 HE2 MET 82 -2.748 -8.513 12.958 1406 3HE MET 82 HE3 MET 82 -3.594 -9.787 13.877 1407 H ILE 83 H ILE 83 -6.249 -9.224 9.211 1408 HA ILE 83 HA ILE 83 -7.779 -11.486 10.044 1409 HB ILE 83 HB ILE 83 -8.536 -9.000 8.479 1410 1HG1 ILE 83 HG12 ILE 83 -7.807 -8.874 10.971 1411 2HG1 ILE 83 HG13 ILE 83 -9.265 -8.034 10.438 1412 1HG2 ILE 83 HG21 ILE 83 -10.174 -10.580 7.800 1413 2HG2 ILE 83 HG22 ILE 83 -10.395 -11.169 9.459 1414 3HG2 ILE 83 HG23 ILE 83 -10.904 -9.523 9.005 1415 1HD1 ILE 83 HD11 ILE 83 -9.517 -9.217 12.598 1416 2HD1 ILE 83 HD12 ILE 83 -10.678 -9.755 11.377 1417 3HD1 ILE 83 HD13 ILE 83 -9.261 -10.769 11.769 1418 H TYR 84 H TYR 84 -7.119 -10.163 6.743 1419 HA TYR 84 HA TYR 84 -8.471 -12.251 5.363 1420 1HB TYR 84 HB2 TYR 84 -6.029 -10.681 4.459 1421 2HB TYR 84 HB3 TYR 84 -7.076 -11.643 3.421 1422 HD1 TYR 84 HD1 TYR 84 -9.816 -10.914 4.223 1423 HD2 TYR 84 HD2 TYR 84 -6.309 -8.465 3.663 1424 HE1 TYR 84 HE1 TYR 84 -11.247 -8.981 3.731 1425 HE2 TYR 84 HE2 TYR 84 -7.762 -6.510 3.211 1426 HH TYR 84 HH TYR 84 -11.321 -6.765 3.112 1427 H ASN 85 H ASN 85 -5.105 -12.054 6.482 1428 HA ASN 85 HA ASN 85 -3.697 -13.623 7.243 1429 1HB ASN 85 HB2 ASN 85 -5.509 -14.542 8.531 1430 2HB ASN 85 HB3 ASN 85 -6.099 -15.488 7.167 1431 1HD2 ASN 85 HD22 ASN 85 -5.178 -17.500 6.732 1432 2HD2 ASN 85 HD21 ASN 85 -3.832 -18.140 7.657 1433 H GLU 86 H GLU 86 -5.663 -15.344 4.805 1434 HA GLU 86 HA GLU 86 -3.679 -17.049 3.744 1435 1HB GLU 86 HB2 GLU 86 -6.017 -15.692 2.319 1436 2HB GLU 86 HB3 GLU 86 -5.074 -17.059 1.702 1437 1HG GLU 86 HG2 GLU 86 -5.763 -18.410 3.692 1438 2HG GLU 86 HG3 GLU 86 -6.781 -17.065 4.240 1439 H ALA 87 H ALA 87 -4.568 -13.721 2.893 1440 HA ALA 87 HA ALA 87 -2.883 -13.069 0.818 1441 1HB ALA 87 HB1 ALA 87 -2.923 -10.782 1.717 1442 2HB ALA 87 HB2 ALA 87 -4.522 -11.538 1.837 1443 3HB ALA 87 HB3 ALA 87 -3.499 -11.388 3.286 1444 H LEU 88 H LEU 88 -1.957 -13.410 4.285 1445 HA LEU 88 HA LEU 88 0.691 -12.306 3.941 1446 1HB LEU 88 HB2 LEU 88 -0.248 -14.194 6.110 1447 2HB LEU 88 HB3 LEU 88 1.126 -13.110 6.136 1448 HG LEU 88 HG LEU 88 -1.826 -12.413 6.324 1449 1HD1 LEU 88 HD11 LEU 88 0.620 -11.942 8.090 1450 2HD1 LEU 88 HD12 LEU 88 -0.989 -11.306 8.435 1451 3HD1 LEU 88 HD13 LEU 88 -0.729 -13.059 8.396 1452 1HD2 LEU 88 HD21 LEU 88 0.439 -10.421 5.953 1453 2HD2 LEU 88 HD22 LEU 88 -0.903 -10.713 4.821 1454 3HD2 LEU 88 HD23 LEU 88 -1.224 -10.038 6.417 1455 H LYS 89 H LYS 89 -0.748 -15.500 3.544 1456 HA LYS 89 HA LYS 89 1.830 -16.895 3.436 1457 1HB LYS 89 HB2 LYS 89 -0.818 -17.937 2.396 1458 2HB LYS 89 HB3 LYS 89 0.570 -18.842 2.999 1459 1HG LYS 89 HG2 LYS 89 -1.386 -17.148 4.621 1460 2HG LYS 89 HG3 LYS 89 -1.289 -18.902 4.579 1461 1HD LYS 89 HD2 LYS 89 0.894 -18.896 5.656 1462 2HD LYS 89 HD3 LYS 89 0.984 -17.129 5.618 1463 1HE LYS 89 HE2 LYS 89 -1.239 -18.641 7.054 1464 2HE LYS 89 HE3 LYS 89 0.258 -18.113 7.842 1465 1HZ LYS 89 HZ1 LYS 89 -1.536 -16.242 6.460 1466 2HZ LYS 89 HZ2 LYS 89 -1.612 -16.566 8.070 1467 3HZ LYS 89 HZ3 LYS 89 -0.245 -15.907 7.433 1468 H GLY 90 H GLY 90 -0.690 -15.699 1.197 1469 1HA GLY 90 HA2 GLY 90 1.225 -14.917 -0.782 1470 2HA GLY 90 HA3 GLY 90 0.394 -16.407 -1.284 Start of MODEL 5 1 1H MET 1 H1 MET 1 -15.883 -4.398 -5.529 2 2H MET 1 H2 MET 1 -16.042 -5.997 -5.903 3 3H MET 1 H3 MET 1 -14.853 -5.087 -6.617 4 HA MET 1 HA MET 1 -15.013 -5.583 -3.751 5 1HB MET 1 HB2 MET 1 -13.177 -6.922 -5.774 6 2HB MET 1 HB3 MET 1 -13.138 -7.152 -4.024 7 1HG MET 1 HG2 MET 1 -15.343 -7.971 -5.944 8 2HG MET 1 HG3 MET 1 -14.280 -9.023 -5.024 9 1HE MET 1 HE1 MET 1 -14.490 -9.446 -2.407 10 2HE MET 1 HE2 MET 1 -14.374 -7.699 -2.079 11 3HE MET 1 HE3 MET 1 -15.703 -8.648 -1.379 12 H ALA 2 H ALA 2 -12.813 -5.219 -2.744 13 HA ALA 2 HA ALA 2 -12.213 -2.437 -3.259 14 1HB ALA 2 HB1 ALA 2 -10.867 -2.694 -1.189 15 2HB ALA 2 HB2 ALA 2 -12.498 -3.379 -0.988 16 3HB ALA 2 HB3 ALA 2 -11.110 -4.447 -1.241 17 H SER 3 H SER 3 -11.313 -4.039 -5.509 18 HA SER 3 HA SER 3 -8.881 -5.129 -5.402 19 1HB SER 3 HB2 SER 3 -9.663 -3.561 -7.859 20 2HB SER 3 HB3 SER 3 -8.859 -5.125 -7.707 21 HG SER 3 HG SER 3 -11.132 -5.296 -8.197 22 HA PRO 4 HA PRO 4 -6.616 -0.982 -6.556 23 1HB PRO 4 HB2 PRO 4 -8.325 0.938 -4.965 24 2HB PRO 4 HB3 PRO 4 -7.404 1.239 -6.466 25 1HG PRO 4 HG2 PRO 4 -10.086 0.877 -6.585 26 2HG PRO 4 HG3 PRO 4 -9.037 0.034 -7.768 27 1HD PRO 4 HD2 PRO 4 -10.180 -1.053 -5.184 28 2HD PRO 4 HD3 PRO 4 -10.267 -1.765 -6.811 29 H LEU 5 H LEU 5 -8.284 -1.173 -3.355 30 HA LEU 5 HA LEU 5 -5.851 -0.331 -1.982 31 1HB LEU 5 HB2 LEU 5 -8.026 0.228 -1.021 32 2HB LEU 5 HB3 LEU 5 -8.443 -1.489 -0.895 33 HG LEU 5 HG LEU 5 -6.623 -1.864 0.716 34 1HD1 LEU 5 HD11 LEU 5 -4.919 -0.234 -0.003 35 2HD1 LEU 5 HD12 LEU 5 -6.017 1.118 0.376 36 3HD1 LEU 5 HD13 LEU 5 -5.388 0.071 1.666 37 1HD2 LEU 5 HD21 LEU 5 -8.825 -1.062 1.529 38 2HD2 LEU 5 HD22 LEU 5 -7.473 -0.570 2.571 39 3HD2 LEU 5 HD23 LEU 5 -8.200 0.613 1.461 40 H ASP 6 H ASP 6 -7.680 -3.352 -2.539 41 HA ASP 6 HA ASP 6 -6.199 -5.122 -0.974 42 1HB ASP 6 HB2 ASP 6 -7.443 -5.652 -3.703 43 2HB ASP 6 HB3 ASP 6 -6.884 -6.893 -2.581 44 H GLN 7 H GLN 7 -5.492 -4.176 -4.405 45 HA GLN 7 HA GLN 7 -3.136 -5.794 -4.509 46 1HB GLN 7 HB2 GLN 7 -2.517 -4.597 -6.490 47 2HB GLN 7 HB3 GLN 7 -4.242 -4.989 -6.510 48 1HG GLN 7 HG2 GLN 7 -4.736 -2.650 -5.783 49 2HG GLN 7 HG3 GLN 7 -3.025 -2.243 -5.935 50 1HE2 GLN 7 HE22 GLN 7 -2.061 -2.894 -8.200 51 2HE2 GLN 7 HE21 GLN 7 -3.100 -2.519 -9.564 52 H ALA 8 H ALA 8 -3.629 -2.459 -3.299 53 HA ALA 8 HA ALA 8 -0.817 -1.862 -3.119 54 1HB ALA 8 HB1 ALA 8 -3.222 -0.602 -1.775 55 2HB ALA 8 HB2 ALA 8 -1.548 -0.025 -1.628 56 3HB ALA 8 HB3 ALA 8 -2.322 -0.079 -3.222 57 H ILE 9 H ILE 9 -3.237 -2.912 -0.602 58 HA ILE 9 HA ILE 9 -1.197 -3.206 1.416 59 HB ILE 9 HB ILE 9 -2.770 -4.552 2.675 60 1HG1 ILE 9 HG12 ILE 9 -4.632 -4.355 0.313 61 2HG1 ILE 9 HG13 ILE 9 -3.857 -5.839 0.890 62 1HG2 ILE 9 HG21 ILE 9 -4.351 -2.776 3.082 63 2HG2 ILE 9 HG22 ILE 9 -2.810 -2.052 2.631 64 3HG2 ILE 9 HG23 ILE 9 -4.125 -2.135 1.440 65 1HD1 ILE 9 HD11 ILE 9 -6.101 -5.825 1.714 66 2HD1 ILE 9 HD12 ILE 9 -5.029 -5.537 3.099 67 3HD1 ILE 9 HD13 ILE 9 -5.945 -4.195 2.374 68 H GLY 10 H GLY 10 -2.537 -5.424 -1.018 69 1HA GLY 10 HA2 GLY 10 -1.132 -7.768 -0.688 70 2HA GLY 10 HA3 GLY 10 -1.515 -7.019 -2.244 71 H LEU 11 H LEU 11 0.069 -4.737 -2.244 72 HA LEU 11 HA LEU 11 2.594 -5.696 -2.976 73 1HB LEU 11 HB2 LEU 11 1.344 -3.442 -3.497 74 2HB LEU 11 HB3 LEU 11 2.116 -2.855 -2.030 75 HG LEU 11 HG LEU 11 3.410 -2.121 -3.834 76 1HD1 LEU 11 HD11 LEU 11 5.564 -2.923 -3.422 77 2HD1 LEU 11 HD12 LEU 11 4.673 -2.974 -1.887 78 3HD1 LEU 11 HD13 LEU 11 4.973 -4.476 -2.811 79 1HD2 LEU 11 HD21 LEU 11 3.572 -4.964 -4.900 80 2HD2 LEU 11 HD22 LEU 11 2.546 -3.660 -5.544 81 3HD2 LEU 11 HD23 LEU 11 4.309 -3.512 -5.600 82 H LEU 12 H LEU 12 1.822 -3.746 -0.041 83 HA LEU 12 HA LEU 12 4.328 -3.948 1.253 84 1HB LEU 12 HB2 LEU 12 1.464 -3.768 2.343 85 2HB LEU 12 HB3 LEU 12 2.887 -3.782 3.381 86 HG LEU 12 HG LEU 12 3.752 -1.766 2.338 87 1HD1 LEU 12 HD11 LEU 12 2.232 -0.320 0.978 88 2HD1 LEU 12 HD12 LEU 12 2.672 -1.791 0.115 89 3HD1 LEU 12 HD13 LEU 12 1.071 -1.654 0.890 90 1HD2 LEU 12 HD21 LEU 12 2.063 -0.210 3.339 91 2HD2 LEU 12 HD22 LEU 12 0.935 -1.572 3.473 92 3HD2 LEU 12 HD23 LEU 12 2.466 -1.569 4.380 93 H ILE 13 H ILE 13 1.528 -6.133 1.402 94 HA ILE 13 HA ILE 13 2.601 -7.924 3.348 95 HB ILE 13 HB ILE 13 0.505 -8.231 1.153 96 1HG1 ILE 13 HG12 ILE 13 0.030 -8.077 4.147 97 2HG1 ILE 13 HG13 ILE 13 0.186 -6.606 3.192 98 1HG2 ILE 13 HG21 ILE 13 -0.329 -10.209 2.454 99 2HG2 ILE 13 HG22 ILE 13 1.235 -10.492 1.683 100 3HG2 ILE 13 HG23 ILE 13 1.154 -10.138 3.422 101 1HD1 ILE 13 HD11 ILE 13 -2.106 -6.929 3.198 102 2HD1 ILE 13 HD12 ILE 13 -1.664 -7.659 1.657 103 3HD1 ILE 13 HD13 ILE 13 -1.985 -8.695 3.063 104 H GLY 14 H GLY 14 2.549 -8.078 -0.219 105 1HA GLY 14 HA2 GLY 14 3.916 -10.503 -0.585 106 2HA GLY 14 HA3 GLY 14 3.878 -9.142 -1.724 107 H ILE 15 H ILE 15 5.209 -7.120 -0.560 108 HA ILE 15 HA ILE 15 7.946 -7.737 -0.841 109 HB ILE 15 HB ILE 15 6.354 -5.437 0.249 110 1HG1 ILE 15 HG12 ILE 15 8.575 -5.749 -1.833 111 2HG1 ILE 15 HG13 ILE 15 6.837 -5.729 -2.159 112 1HG2 ILE 15 HG21 ILE 15 8.383 -4.196 0.894 113 2HG2 ILE 15 HG22 ILE 15 8.076 -5.570 1.926 114 3HG2 ILE 15 HG23 ILE 15 9.349 -5.676 0.681 115 1HD1 ILE 15 HD11 ILE 15 8.582 -3.431 -1.185 116 2HD1 ILE 15 HD12 ILE 15 7.670 -3.546 -2.691 117 3HD1 ILE 15 HD13 ILE 15 6.810 -3.369 -1.147 118 H PHE 16 H PHE 16 5.991 -7.397 2.148 119 HA PHE 16 HA PHE 16 8.115 -7.978 3.914 120 1HB PHE 16 HB2 PHE 16 5.937 -6.978 4.513 121 2HB PHE 16 HB3 PHE 16 5.135 -8.515 4.282 122 HD1 PHE 16 HD1 PHE 16 5.616 -10.426 5.824 123 HD2 PHE 16 HD2 PHE 16 7.354 -6.549 6.469 124 HE1 PHE 16 HE1 PHE 16 6.280 -11.092 8.088 125 HE2 PHE 16 HE2 PHE 16 7.725 -7.108 8.860 126 HZ PHE 16 HZ PHE 16 7.186 -9.378 9.684 127 H HIS 17 H HIS 17 5.475 -10.264 2.961 128 HA HIS 17 HA HIS 17 6.775 -12.317 4.394 129 1HB HIS 17 HB2 HIS 17 4.225 -11.956 3.456 130 2HB HIS 17 HB3 HIS 17 4.796 -13.256 2.419 131 HD1 HIS 17 HD1 HIS 17 3.690 -15.350 3.522 132 HD2 HIS 17 HD2 HIS 17 5.216 -12.594 6.300 133 HE1 HIS 17 HE1 HIS 17 3.262 -16.324 5.832 134 H LYS 18 H LYS 18 7.095 -11.319 1.039 135 HA LYS 18 HA LYS 18 8.428 -13.636 0.036 136 1HB LYS 18 HB2 LYS 18 7.710 -11.796 -1.392 137 2HB LYS 18 HB3 LYS 18 8.823 -10.682 -0.564 138 1HG LYS 18 HG2 LYS 18 10.759 -11.908 -1.437 139 2HG LYS 18 HG3 LYS 18 9.710 -13.175 -2.077 140 1HD LYS 18 HD2 LYS 18 10.498 -11.613 -3.839 141 2HD LYS 18 HD3 LYS 18 8.738 -11.686 -3.712 142 1HE LYS 18 HE2 LYS 18 9.596 -9.371 -4.042 143 2HE LYS 18 HE3 LYS 18 8.648 -9.543 -2.564 144 1HZ LYS 18 HZ1 LYS 18 10.693 -9.688 -1.338 145 2HZ LYS 18 HZ2 LYS 18 11.586 -9.554 -2.717 146 3HZ LYS 18 HZ3 LYS 18 10.648 -8.295 -2.212 147 H TYR 19 H TYR 19 9.659 -10.728 1.818 148 HA TYR 19 HA TYR 19 12.360 -11.781 1.937 149 1HB TYR 19 HB2 TYR 19 10.936 -9.429 3.116 150 2HB TYR 19 HB3 TYR 19 12.390 -10.001 3.922 151 HD1 TYR 19 HD1 TYR 19 11.148 -8.408 0.841 152 HD2 TYR 19 HD2 TYR 19 14.580 -10.042 2.873 153 HE1 TYR 19 HE1 TYR 19 12.622 -7.548 -0.947 154 HE2 TYR 19 HE2 TYR 19 16.040 -9.247 1.045 155 HH TYR 19 HH TYR 19 16.146 -8.097 -0.957 156 H SER 20 H SER 20 9.578 -11.824 4.265 157 HA SER 20 HA SER 20 10.791 -13.210 6.334 158 1HB SER 20 HB2 SER 20 8.027 -13.911 5.309 159 2HB SER 20 HB3 SER 20 8.674 -14.069 6.940 160 HG SER 20 HG SER 20 8.741 -11.884 7.162 161 H GLY 21 H GLY 21 9.491 -14.619 3.301 162 1HA GLY 21 HA2 GLY 21 9.754 -17.294 3.585 163 2HA GLY 21 HA3 GLY 21 10.247 -16.430 2.121 164 H LYS 22 H LYS 22 12.531 -15.042 3.404 165 HA LYS 22 HA LYS 22 14.600 -16.921 2.920 166 1HB LYS 22 HB2 LYS 22 14.671 -14.420 2.791 167 2HB LYS 22 HB3 LYS 22 14.676 -14.362 4.552 168 1HG LYS 22 HG2 LYS 22 16.789 -15.739 4.542 169 2HG LYS 22 HG3 LYS 22 16.808 -15.634 2.780 170 1HD LYS 22 HD2 LYS 22 17.019 -13.357 4.807 171 2HD LYS 22 HD3 LYS 22 18.303 -13.952 3.755 172 1HE LYS 22 HE2 LYS 22 15.786 -12.446 2.894 173 2HE LYS 22 HE3 LYS 22 17.447 -11.847 2.887 174 1HZ LYS 22 HZ1 LYS 22 16.763 -12.533 0.723 175 2HZ LYS 22 HZ2 LYS 22 17.981 -13.510 1.253 176 3HZ LYS 22 HZ3 LYS 22 16.426 -14.056 1.250 177 H GLU 23 H GLU 23 13.023 -15.869 5.942 178 HA GLU 23 HA GLU 23 14.708 -17.698 7.578 179 1HB GLU 23 HB2 GLU 23 13.535 -16.638 9.507 180 2HB GLU 23 HB3 GLU 23 14.585 -15.577 8.560 181 1HG GLU 23 HG2 GLU 23 12.669 -14.564 7.449 182 2HG GLU 23 HG3 GLU 23 11.548 -15.650 8.297 183 H GLY 24 H GLY 24 11.323 -17.160 6.551 184 1HA GLY 24 HA2 GLY 24 10.574 -19.742 6.174 185 2HA GLY 24 HA3 GLY 24 10.276 -19.502 7.914 186 H ASP 25 H ASP 25 8.082 -19.986 6.328 187 HA ASP 25 HA ASP 25 6.837 -17.514 5.419 188 1HB ASP 25 HB2 ASP 25 6.373 -19.759 4.426 189 2HB ASP 25 HB3 ASP 25 5.590 -20.245 5.941 190 H LYS 26 H LYS 26 7.509 -16.554 7.598 191 HA LYS 26 HA LYS 26 5.446 -16.939 9.736 192 1HB LYS 26 HB2 LYS 26 8.367 -16.099 9.930 193 2HB LYS 26 HB3 LYS 26 7.241 -16.265 11.292 194 1HG LYS 26 HG2 LYS 26 6.991 -18.700 10.716 195 2HG LYS 26 HG3 LYS 26 8.224 -18.511 9.468 196 1HD LYS 26 HD2 LYS 26 8.622 -18.140 12.473 197 2HD LYS 26 HD3 LYS 26 9.181 -19.475 11.465 198 1HE LYS 26 HE2 LYS 26 11.128 -18.271 11.552 199 2HE LYS 26 HE3 LYS 26 10.429 -17.546 10.100 200 1HZ LYS 26 HZ1 LYS 26 9.599 -15.766 11.564 201 2HZ LYS 26 HZ2 LYS 26 10.337 -16.482 12.848 202 3HZ LYS 26 HZ3 LYS 26 11.235 -15.893 11.601 203 H HIS 27 H HIS 27 4.648 -14.987 10.651 204 HA HIS 27 HA HIS 27 4.694 -12.694 8.861 205 1HB HIS 27 HB2 HIS 27 3.408 -13.028 11.589 206 2HB HIS 27 HB3 HIS 27 3.043 -11.776 10.396 207 HD1 HIS 27 HD1 HIS 27 3.149 -14.382 8.060 208 HD2 HIS 27 HD2 HIS 27 0.719 -13.606 11.424 209 HE1 HIS 27 HE1 HIS 27 0.998 -15.719 7.744 210 H THR 28 H THR 28 7.301 -12.981 9.555 211 HA THR 28 HA THR 28 7.892 -10.747 11.366 212 HB THR 28 HB THR 28 9.663 -12.190 12.425 213 HG1 THR 28 HG1 THR 28 9.729 -13.871 10.927 214 1HG2 THR 28 HG21 THR 28 6.843 -13.235 12.901 215 2HG2 THR 28 HG22 THR 28 8.220 -13.307 14.008 216 3HG2 THR 28 HG23 THR 28 7.508 -11.734 13.591 217 H LEU 29 H LEU 29 9.987 -9.909 11.070 218 HA LEU 29 HA LEU 29 11.652 -11.065 8.843 219 1HB LEU 29 HB2 LEU 29 11.067 -8.106 9.319 220 2HB LEU 29 HB3 LEU 29 12.375 -8.703 8.303 221 HG LEU 29 HG LEU 29 9.436 -9.244 7.764 222 1HD1 LEU 29 HD11 LEU 29 9.721 -7.546 5.971 223 2HD1 LEU 29 HD12 LEU 29 10.013 -6.820 7.566 224 3HD1 LEU 29 HD13 LEU 29 11.383 -7.249 6.518 225 1HD2 LEU 29 HD21 LEU 29 10.293 -9.802 5.493 226 2HD2 LEU 29 HD22 LEU 29 11.950 -9.709 6.137 227 3HD2 LEU 29 HD23 LEU 29 10.811 -10.934 6.747 228 H SER 30 H SER 30 13.777 -11.375 9.583 229 HA SER 30 HA SER 30 14.463 -10.385 12.240 230 1HB SER 30 HB2 SER 30 16.114 -11.728 10.060 231 2HB SER 30 HB3 SER 30 16.738 -11.295 11.661 232 HG SER 30 HG SER 30 14.546 -13.027 11.097 233 H LYS 31 H LYS 31 16.014 -8.756 12.775 234 HA LYS 31 HA LYS 31 15.484 -6.385 11.565 235 1HB LYS 31 HB2 LYS 31 17.299 -5.457 12.926 236 2HB LYS 31 HB3 LYS 31 16.286 -6.607 13.788 237 1HG LYS 31 HG2 LYS 31 18.081 -8.363 13.438 238 2HG LYS 31 HG3 LYS 31 19.116 -7.076 12.763 239 1HD LYS 31 HD2 LYS 31 18.874 -5.796 14.878 240 2HD LYS 31 HD3 LYS 31 17.825 -7.064 15.527 241 1HE LYS 31 HE2 LYS 31 19.683 -8.713 15.325 242 2HE LYS 31 HE3 LYS 31 20.749 -7.425 14.724 243 1HZ LYS 31 HZ1 LYS 31 19.431 -7.480 17.348 244 2HZ LYS 31 HZ2 LYS 31 21.021 -7.801 17.060 245 3HZ LYS 31 HZ3 LYS 31 20.425 -6.287 16.799 246 H LYS 32 H LYS 32 18.403 -8.314 10.903 247 HA LYS 32 HA LYS 32 19.405 -6.397 8.965 248 1HB LYS 32 HB2 LYS 32 20.831 -7.904 10.245 249 2HB LYS 32 HB3 LYS 32 20.219 -9.299 9.338 250 1HG LYS 32 HG2 LYS 32 21.181 -7.146 7.542 251 2HG LYS 32 HG3 LYS 32 22.391 -7.564 8.745 252 1HD LYS 32 HD2 LYS 32 22.826 -8.896 6.839 253 2HD LYS 32 HD3 LYS 32 22.204 -9.980 8.091 254 1HE LYS 32 HE2 LYS 32 19.984 -9.995 6.971 255 2HE LYS 32 HE3 LYS 32 20.566 -8.803 5.784 256 1HZ LYS 32 HZ1 LYS 32 21.626 -11.512 6.128 257 2HZ LYS 32 HZ2 LYS 32 20.618 -11.002 4.926 258 3HZ LYS 32 HZ3 LYS 32 22.142 -10.395 5.028 259 H GLU 33 H GLU 33 17.103 -9.041 8.794 260 HA GLU 33 HA GLU 33 17.223 -9.438 5.910 261 1HB GLU 33 HB2 GLU 33 16.419 -11.116 7.600 262 2HB GLU 33 HB3 GLU 33 14.996 -10.095 7.880 263 1HG GLU 33 HG2 GLU 33 14.296 -10.365 5.553 264 2HG GLU 33 HG3 GLU 33 15.725 -11.368 5.231 265 H LEU 34 H LEU 34 15.299 -7.547 8.264 266 HA LEU 34 HA LEU 34 13.681 -6.156 6.380 267 1HB LEU 34 HB2 LEU 34 13.118 -6.091 8.679 268 2HB LEU 34 HB3 LEU 34 14.667 -5.434 9.162 269 HG LEU 34 HG LEU 34 12.812 -3.837 9.247 270 1HD1 LEU 34 HD11 LEU 34 14.011 -1.956 8.598 271 2HD1 LEU 34 HD12 LEU 34 15.269 -3.160 8.872 272 3HD1 LEU 34 HD13 LEU 34 14.771 -2.751 7.228 273 1HD2 LEU 34 HD21 LEU 34 11.517 -4.579 7.304 274 2HD2 LEU 34 HD22 LEU 34 11.885 -2.852 7.163 275 3HD2 LEU 34 HD23 LEU 34 12.788 -4.015 6.204 276 H LYS 35 H LYS 35 16.951 -5.317 7.784 277 HA LYS 35 HA LYS 35 17.307 -3.036 6.192 278 1HB LYS 35 HB2 LYS 35 18.882 -3.685 7.954 279 2HB LYS 35 HB3 LYS 35 19.510 -4.992 6.930 280 1HG LYS 35 HG2 LYS 35 20.131 -3.325 5.184 281 2HG LYS 35 HG3 LYS 35 19.560 -2.018 6.227 282 1HD LYS 35 HD2 LYS 35 21.791 -3.986 6.930 283 2HD LYS 35 HD3 LYS 35 22.048 -2.412 6.158 284 1HE LYS 35 HE2 LYS 35 21.013 -1.262 8.098 285 2HE LYS 35 HE3 LYS 35 20.816 -2.827 8.915 286 1HZ LYS 35 HZ1 LYS 35 22.804 -1.784 9.630 287 2HZ LYS 35 HZ2 LYS 35 23.228 -3.088 8.720 288 3HZ LYS 35 HZ3 LYS 35 23.330 -1.563 8.088 289 H GLU 36 H GLU 36 17.939 -6.452 5.263 290 HA GLU 36 HA GLU 36 18.886 -5.957 2.670 291 1HB GLU 36 HB2 GLU 36 18.639 -8.191 4.066 292 2HB GLU 36 HB3 GLU 36 17.081 -8.326 3.250 293 1HG GLU 36 HG2 GLU 36 18.630 -9.549 1.928 294 2HG GLU 36 HG3 GLU 36 18.374 -8.038 1.040 295 H LEU 37 H LEU 37 15.508 -6.429 3.759 296 HA LEU 37 HA LEU 37 14.146 -6.106 1.306 297 1HB LEU 37 HB2 LEU 37 13.100 -6.863 3.336 298 2HB LEU 37 HB3 LEU 37 13.363 -5.339 4.150 299 HG LEU 37 HG LEU 37 11.574 -5.542 1.719 300 1HD1 LEU 37 HD11 LEU 37 10.776 -7.078 3.497 301 2HD1 LEU 37 HD12 LEU 37 10.902 -5.760 4.691 302 3HD1 LEU 37 HD13 LEU 37 9.712 -5.667 3.390 303 1HD2 LEU 37 HD21 LEU 37 12.134 -3.191 2.290 304 2HD2 LEU 37 HD22 LEU 37 10.502 -3.533 2.834 305 3HD2 LEU 37 HD23 LEU 37 11.820 -3.510 4.012 306 H ILE 38 H ILE 38 15.141 -3.624 3.675 307 HA ILE 38 HA ILE 38 14.166 -1.440 2.111 308 HB ILE 38 HB ILE 38 16.183 -1.599 4.378 309 1HG1 ILE 38 HG12 ILE 38 13.231 -0.824 4.084 310 2HG1 ILE 38 HG13 ILE 38 13.886 -2.234 4.923 311 1HG2 ILE 38 HG21 ILE 38 16.034 0.821 4.596 312 2HG2 ILE 38 HG22 ILE 38 16.655 0.454 2.999 313 3HG2 ILE 38 HG23 ILE 38 14.951 0.920 3.198 314 1HD1 ILE 38 HD11 ILE 38 14.053 0.670 5.732 315 2HD1 ILE 38 HD12 ILE 38 13.296 -0.699 6.574 316 3HD1 ILE 38 HD13 ILE 38 15.075 -0.586 6.480 317 H GLN 39 H GLN 39 17.477 -2.860 2.300 318 HA GLN 39 HA GLN 39 18.695 -1.012 0.518 319 1HB GLN 39 HB2 GLN 39 19.226 -3.970 1.019 320 2HB GLN 39 HB3 GLN 39 20.251 -2.964 -0.007 321 1HG GLN 39 HG2 GLN 39 19.715 -2.322 2.927 322 2HG GLN 39 HG3 GLN 39 21.073 -3.288 2.348 323 1HE2 GLN 39 HE22 GLN 39 19.646 -0.023 2.376 324 2HE2 GLN 39 HE21 GLN 39 21.125 0.785 1.888 325 H LYS 40 H LYS 40 16.828 -4.018 -0.187 326 HA LYS 40 HA LYS 40 17.262 -3.728 -3.003 327 1HB LYS 40 HB2 LYS 40 16.661 -5.846 -1.835 328 2HB LYS 40 HB3 LYS 40 15.019 -5.247 -1.598 329 1HG LYS 40 HG2 LYS 40 15.827 -4.989 -4.425 330 2HG LYS 40 HG3 LYS 40 16.149 -6.617 -3.842 331 1HD LYS 40 HD2 LYS 40 13.969 -6.543 -4.851 332 2HD LYS 40 HD3 LYS 40 13.801 -6.867 -3.118 333 1HE LYS 40 HE2 LYS 40 13.097 -4.560 -2.707 334 2HE LYS 40 HE3 LYS 40 13.480 -4.097 -4.381 335 1HZ LYS 40 HZ1 LYS 40 11.167 -4.432 -3.994 336 2HZ LYS 40 HZ2 LYS 40 11.743 -5.482 -5.128 337 3HZ LYS 40 HZ3 LYS 40 11.412 -6.015 -3.598 338 H GLU 41 H GLU 41 14.454 -2.838 -0.962 339 HA GLU 41 HA GLU 41 12.984 -1.846 -3.261 340 1HB GLU 41 HB2 GLU 41 11.990 -2.809 -1.144 341 2HB GLU 41 HB3 GLU 41 12.506 -1.364 -0.288 342 1HG GLU 41 HG2 GLU 41 10.196 -1.103 -0.812 343 2HG GLU 41 HG3 GLU 41 11.074 0.013 -1.855 344 H LEU 42 H LEU 42 14.545 -0.248 -0.484 345 HA LEU 42 HA LEU 42 14.206 2.429 -1.786 346 1HB LEU 42 HB2 LEU 42 14.791 1.764 1.111 347 2HB LEU 42 HB3 LEU 42 14.489 3.363 0.427 348 HG LEU 42 HG LEU 42 12.486 1.063 0.652 349 1HD1 LEU 42 HD11 LEU 42 12.989 2.206 2.783 350 2HD1 LEU 42 HD12 LEU 42 12.613 3.773 2.037 351 3HD1 LEU 42 HD13 LEU 42 11.340 2.553 2.237 352 1HD2 LEU 42 HD21 LEU 42 12.124 3.866 -0.503 353 2HD2 LEU 42 HD22 LEU 42 11.972 2.325 -1.380 354 3HD2 LEU 42 HD23 LEU 42 10.803 2.741 -0.127 355 H THR 43 H THR 43 15.940 1.800 -3.240 356 HA THR 43 HA THR 43 18.547 1.107 -2.321 357 HB THR 43 HB THR 43 19.110 1.644 -4.745 358 HG1 THR 43 HG1 THR 43 17.555 3.264 -5.004 359 1HG2 THR 43 HG21 THR 43 18.381 -0.609 -4.145 360 2HG2 THR 43 HG22 THR 43 16.680 -0.117 -4.229 361 3HG2 THR 43 HG23 THR 43 17.674 -0.137 -5.698 362 H ILE 44 H ILE 44 18.430 3.016 -0.615 363 HA ILE 44 HA ILE 44 19.461 5.562 -1.628 364 HB ILE 44 HB ILE 44 20.211 5.761 0.887 365 1HG1 ILE 44 HG12 ILE 44 18.673 4.768 2.447 366 2HG1 ILE 44 HG13 ILE 44 17.859 3.841 1.196 367 1HG2 ILE 44 HG21 ILE 44 18.603 7.179 -0.258 368 2HG2 ILE 44 HG22 ILE 44 17.342 5.938 -0.085 369 3HG2 ILE 44 HG23 ILE 44 18.006 6.752 1.348 370 1HD1 ILE 44 HD11 ILE 44 19.954 2.500 0.882 371 2HD1 ILE 44 HD12 ILE 44 20.738 3.478 2.150 372 3HD1 ILE 44 HD13 ILE 44 19.349 2.445 2.546 373 H GLY 45 H GLY 45 20.901 4.650 -3.113 374 1HA GLY 45 HA2 GLY 45 23.264 3.286 -2.752 375 2HA GLY 45 HA3 GLY 45 23.105 4.698 -3.812 376 H SER 46 H SER 46 22.527 6.570 -1.558 377 HA SER 46 HA SER 46 25.140 7.254 -0.567 378 1HB SER 46 HB2 SER 46 23.449 8.839 0.756 379 2HB SER 46 HB3 SER 46 23.691 9.033 -0.985 380 HG SER 46 HG SER 46 21.433 8.263 0.323 381 H LYS 47 H LYS 47 25.216 4.795 0.190 382 HA LYS 47 HA LYS 47 23.712 3.974 2.411 383 1HB LYS 47 HB2 LYS 47 26.434 3.012 1.467 384 2HB LYS 47 HB3 LYS 47 25.418 2.201 2.673 385 1HG LYS 47 HG2 LYS 47 23.541 2.206 0.914 386 2HG LYS 47 HG3 LYS 47 24.777 2.620 -0.273 387 1HD LYS 47 HD2 LYS 47 24.750 0.150 1.528 388 2HD LYS 47 HD3 LYS 47 24.311 0.196 -0.181 389 1HE LYS 47 HE2 LYS 47 26.637 0.959 -0.742 390 2HE LYS 47 HE3 LYS 47 27.079 0.803 0.971 391 1HZ LYS 47 HZ1 LYS 47 26.527 -1.510 0.844 392 2HZ LYS 47 HZ2 LYS 47 26.125 -1.372 -0.749 393 3HZ LYS 47 HZ3 LYS 47 27.682 -1.124 -0.267 394 H LEU 48 H LEU 48 25.986 6.442 2.537 395 HA LEU 48 HA LEU 48 27.039 6.150 5.183 396 1HB LEU 48 HB2 LEU 48 26.085 8.618 3.648 397 2HB LEU 48 HB3 LEU 48 26.936 8.661 5.188 398 HG LEU 48 HG LEU 48 28.452 9.205 3.460 399 1HD1 LEU 48 HD11 LEU 48 29.150 6.384 4.364 400 2HD1 LEU 48 HD12 LEU 48 30.263 7.674 3.883 401 3HD1 LEU 48 HD13 LEU 48 29.305 7.847 5.365 402 1HD2 LEU 48 HD21 LEU 48 27.312 8.015 1.562 403 2HD2 LEU 48 HD22 LEU 48 29.077 7.874 1.597 404 3HD2 LEU 48 HD23 LEU 48 28.089 6.507 2.113 405 H GLN 49 H GLN 49 23.843 6.884 3.893 406 HA GLN 49 HA GLN 49 22.586 7.735 6.320 407 1HB GLN 49 HB2 GLN 49 21.481 6.378 3.827 408 2HB GLN 49 HB3 GLN 49 20.497 7.070 5.122 409 1HG GLN 49 HG2 GLN 49 21.553 9.302 4.731 410 2HG GLN 49 HG3 GLN 49 22.469 8.621 3.382 411 1HE2 GLN 49 HE22 GLN 49 19.123 9.061 4.613 412 2HE2 GLN 49 HE21 GLN 49 18.388 9.191 3.015 413 H ASP 50 H ASP 50 23.966 4.653 5.693 414 HA ASP 50 HA ASP 50 22.136 2.836 6.606 415 1HB ASP 50 HB2 ASP 50 24.329 2.165 5.841 416 2HB ASP 50 HB3 ASP 50 25.102 2.926 7.247 417 H ALA 51 H ALA 51 23.979 5.141 8.620 418 HA ALA 51 HA ALA 51 23.282 4.250 11.202 419 1HB ALA 51 HB1 ALA 51 24.825 6.102 10.768 420 2HB ALA 51 HB2 ALA 51 23.491 7.102 10.150 421 3HB ALA 51 HB3 ALA 51 23.521 6.614 11.858 422 H GLU 52 H GLU 52 21.391 6.272 8.923 423 HA GLU 52 HA GLU 52 19.148 6.728 10.700 424 1HB GLU 52 HB2 GLU 52 19.187 6.783 7.647 425 2HB GLU 52 HB3 GLU 52 18.007 7.522 8.728 426 1HG GLU 52 HG2 GLU 52 19.797 9.022 9.625 427 2HG GLU 52 HG3 GLU 52 20.941 8.338 8.458 428 H ILE 53 H ILE 53 19.968 4.461 8.056 429 HA ILE 53 HA ILE 53 17.519 3.033 8.094 430 HB ILE 53 HB ILE 53 20.229 1.891 7.363 431 1HG1 ILE 53 HG12 ILE 53 19.897 3.857 5.993 432 2HG1 ILE 53 HG13 ILE 53 19.577 2.433 5.022 433 1HG2 ILE 53 HG21 ILE 53 18.655 0.111 7.635 434 2HG2 ILE 53 HG22 ILE 53 17.402 0.985 6.738 435 3HG2 ILE 53 HG23 ILE 53 18.852 0.391 5.904 436 1HD1 ILE 53 HD11 ILE 53 17.927 4.136 4.534 437 2HD1 ILE 53 HD12 ILE 53 17.101 2.816 5.369 438 3HD1 ILE 53 HD13 ILE 53 17.503 4.318 6.234 439 H VAL 54 H VAL 54 20.462 2.495 10.147 440 HA VAL 54 HA VAL 54 19.170 0.208 11.336 441 HB VAL 54 HB VAL 54 20.947 0.162 12.997 442 1HG1 VAL 54 HG11 VAL 54 22.594 -0.665 11.390 443 2HG1 VAL 54 HG12 VAL 54 20.956 -1.138 10.901 444 3HG1 VAL 54 HG13 VAL 54 21.774 0.205 10.073 445 1HG2 VAL 54 HG21 VAL 54 21.584 2.567 13.011 446 2HG2 VAL 54 HG22 VAL 54 22.941 1.449 12.779 447 3HG2 VAL 54 HG23 VAL 54 22.288 2.326 11.395 448 H LYS 55 H LYS 55 19.255 3.673 12.220 449 HA LYS 55 HA LYS 55 17.961 3.284 14.756 450 1HB LYS 55 HB2 LYS 55 18.859 5.471 14.112 451 2HB LYS 55 HB3 LYS 55 17.774 5.553 12.736 452 1HG LYS 55 HG2 LYS 55 17.016 6.970 14.601 453 2HG LYS 55 HG3 LYS 55 15.830 5.776 14.103 454 1HD LYS 55 HD2 LYS 55 15.779 5.972 16.464 455 2HD LYS 55 HD3 LYS 55 16.372 4.366 16.099 456 1HE LYS 55 HE2 LYS 55 18.222 6.723 16.752 457 2HE LYS 55 HE3 LYS 55 17.502 5.692 17.997 458 1HZ LYS 55 HZ1 LYS 55 18.561 3.811 17.025 459 2HZ LYS 55 HZ2 LYS 55 19.278 4.743 15.872 460 3HZ LYS 55 HZ3 LYS 55 19.666 4.953 17.457 461 H LEU 56 H LEU 56 16.646 3.799 11.476 462 HA LEU 56 HA LEU 56 13.906 3.385 12.038 463 1HB LEU 56 HB2 LEU 56 14.603 4.364 10.038 464 2HB LEU 56 HB3 LEU 56 15.662 3.034 9.595 465 HG LEU 56 HG LEU 56 12.760 2.351 9.887 466 1HD1 LEU 56 HD11 LEU 56 13.941 3.969 7.565 467 2HD1 LEU 56 HD12 LEU 56 12.357 3.178 7.536 468 3HD1 LEU 56 HD13 LEU 56 12.660 4.515 8.664 469 1HD2 LEU 56 HD21 LEU 56 14.877 1.680 7.791 470 2HD2 LEU 56 HD22 LEU 56 14.518 0.667 9.193 471 3HD2 LEU 56 HD23 LEU 56 13.255 0.963 7.992 472 H MET 57 H MET 57 16.442 1.003 11.184 473 HA MET 57 HA MET 57 14.869 -1.318 11.154 474 1HB MET 57 HB2 MET 57 17.294 -1.130 10.442 475 2HB MET 57 HB3 MET 57 17.708 -1.054 12.173 476 1HG MET 57 HG2 MET 57 16.723 -3.302 12.485 477 2HG MET 57 HG3 MET 57 16.422 -3.381 10.753 478 1HE MET 57 HE1 MET 57 20.576 -3.538 12.772 479 2HE MET 57 HE2 MET 57 19.609 -2.051 12.827 480 3HE MET 57 HE3 MET 57 19.016 -3.523 13.629 481 H ASP 58 H ASP 58 16.612 0.257 13.904 482 HA ASP 58 HA ASP 58 15.788 -1.551 15.919 483 1HB ASP 58 HB2 ASP 58 17.529 0.105 16.290 484 2HB ASP 58 HB3 ASP 58 16.359 1.423 16.150 485 H ASP 59 H ASP 59 14.239 1.470 14.741 486 HA ASP 59 HA ASP 59 12.024 1.343 16.505 487 1HB ASP 59 HB2 ASP 59 12.070 2.517 13.684 488 2HB ASP 59 HB3 ASP 59 10.909 2.905 14.959 489 H LEU 60 H LEU 60 12.471 -0.227 13.364 490 HA LEU 60 HA LEU 60 9.796 -1.405 13.312 491 1HB LEU 60 HB2 LEU 60 12.411 -1.805 11.830 492 2HB LEU 60 HB3 LEU 60 11.104 -2.969 11.619 493 HG LEU 60 HG LEU 60 10.544 -0.025 11.280 494 1HD1 LEU 60 HD11 LEU 60 11.632 -1.815 9.086 495 2HD1 LEU 60 HD12 LEU 60 11.050 -0.160 8.886 496 3HD1 LEU 60 HD13 LEU 60 12.509 -0.470 9.854 497 1HD2 LEU 60 HD21 LEU 60 8.898 -0.940 9.607 498 2HD2 LEU 60 HD22 LEU 60 9.473 -2.567 9.926 499 3HD2 LEU 60 HD23 LEU 60 8.645 -1.662 11.219 500 H ASP 61 H ASP 61 13.011 -2.787 14.074 501 HA ASP 61 HA ASP 61 11.912 -5.291 14.828 502 1HB ASP 61 HB2 ASP 61 14.071 -6.037 15.321 503 2HB ASP 61 HB3 ASP 61 14.166 -5.031 13.877 504 H ARG 62 H ARG 62 12.241 -2.401 16.668 505 HA ARG 62 HA ARG 62 12.220 -2.931 19.283 506 1HB ARG 62 HB2 ARG 62 11.583 -0.798 18.338 507 2HB ARG 62 HB3 ARG 62 10.172 -1.543 17.577 508 1HG ARG 62 HG2 ARG 62 9.145 -1.865 19.842 509 2HG ARG 62 HG3 ARG 62 10.572 -1.127 20.585 510 1HD ARG 62 HD2 ARG 62 8.576 0.450 20.253 511 2HD ARG 62 HD3 ARG 62 10.104 0.998 19.556 512 HE ARG 62 HE ARG 62 9.280 0.841 17.448 513 1HH1 ARG 62 HH12 ARG 62 6.987 -0.903 19.502 514 2HH1 ARG 62 HH11 ARG 62 6.235 -1.728 18.153 515 1HH2 ARG 62 HH22 ARG 62 8.411 -0.279 15.777 516 2HH2 ARG 62 HH21 ARG 62 6.923 -1.199 15.964 517 H ASN 63 H ASN 63 9.660 -3.994 17.045 518 HA ASN 63 HA ASN 63 7.753 -5.249 18.496 519 1HB ASN 63 HB2 ASN 63 7.780 -5.477 16.110 520 2HB ASN 63 HB3 ASN 63 9.373 -6.240 16.159 521 1HD2 ASN 63 HD22 ASN 63 6.153 -6.873 17.735 522 2HD2 ASN 63 HD21 ASN 63 6.207 -8.599 17.413 523 H LYS 64 H LYS 64 10.914 -6.845 17.939 524 HA LYS 64 HA LYS 64 10.834 -7.861 20.665 525 1HB LYS 64 HB2 LYS 64 10.874 -10.221 20.256 526 2HB LYS 64 HB3 LYS 64 9.384 -9.531 19.617 527 1HG LYS 64 HG2 LYS 64 10.329 -9.619 17.311 528 2HG LYS 64 HG3 LYS 64 11.836 -10.266 17.964 529 1HD LYS 64 HD2 LYS 64 10.756 -12.198 17.232 530 2HD LYS 64 HD3 LYS 64 10.502 -12.183 18.972 531 1HE LYS 64 HE2 LYS 64 8.441 -12.824 17.902 532 2HE LYS 64 HE3 LYS 64 8.191 -11.200 18.560 533 1HZ LYS 64 HZ1 LYS 64 8.886 -11.819 15.768 534 2HZ LYS 64 HZ2 LYS 64 7.369 -11.476 16.315 535 3HZ LYS 64 HZ3 LYS 64 8.540 -10.321 16.375 536 H ASP 65 H ASP 65 12.549 -6.218 19.028 537 HA ASP 65 HA ASP 65 14.607 -5.645 18.802 538 1HB ASP 65 HB2 ASP 65 16.340 -6.214 20.265 539 2HB ASP 65 HB3 ASP 65 14.834 -6.116 21.176 540 H GLN 66 H GLN 66 14.738 -9.195 18.716 541 HA GLN 66 HA GLN 66 16.821 -9.231 16.725 542 1HB GLN 66 HB2 GLN 66 16.210 -11.024 18.403 543 2HB GLN 66 HB3 GLN 66 14.858 -11.486 17.371 544 1HG GLN 66 HG2 GLN 66 17.706 -11.353 16.270 545 2HG GLN 66 HG3 GLN 66 17.197 -12.699 17.280 546 1HE2 GLN 66 HE22 GLN 66 16.299 -11.014 14.214 547 2HE2 GLN 66 HE21 GLN 66 15.749 -12.494 13.432 548 H GLU 67 H GLU 67 13.271 -9.357 16.650 549 HA GLU 67 HA GLU 67 13.316 -9.211 13.691 550 1HB GLU 67 HB2 GLU 67 11.286 -10.759 15.354 551 2HB GLU 67 HB3 GLU 67 11.342 -10.632 13.600 552 1HG GLU 67 HG2 GLU 67 13.551 -11.834 13.633 553 2HG GLU 67 HG3 GLU 67 13.319 -12.118 15.368 554 H VAL 68 H VAL 68 11.614 -8.355 12.718 555 HA VAL 68 HA VAL 68 9.900 -6.319 14.017 556 HB VAL 68 HB VAL 68 10.176 -7.031 11.072 557 1HG1 VAL 68 HG11 VAL 68 8.258 -5.625 11.635 558 2HG1 VAL 68 HG12 VAL 68 9.317 -4.467 12.462 559 3HG1 VAL 68 HG13 VAL 68 9.449 -4.718 10.708 560 1HG2 VAL 68 HG21 VAL 68 11.928 -5.027 12.519 561 2HG2 VAL 68 HG22 VAL 68 12.468 -6.515 11.720 562 3HG2 VAL 68 HG23 VAL 68 11.781 -5.207 10.765 563 H ASN 69 H ASN 69 7.558 -6.647 13.624 564 HA ASN 69 HA ASN 69 6.781 -9.344 12.613 565 1HB ASN 69 HB2 ASN 69 6.024 -9.331 14.885 566 2HB ASN 69 HB3 ASN 69 5.589 -7.613 14.800 567 1HD2 ASN 69 HD22 ASN 69 4.644 -10.711 13.072 568 2HD2 ASN 69 HD21 ASN 69 2.939 -10.320 13.159 569 H PHE 70 H PHE 70 5.070 -9.390 11.188 570 HA PHE 70 HA PHE 70 4.806 -7.514 9.223 571 1HB PHE 70 HB2 PHE 70 3.929 -9.775 9.045 572 2HB PHE 70 HB3 PHE 70 2.720 -9.441 10.289 573 HD1 PHE 70 HD1 PHE 70 3.911 -8.064 6.995 574 HD2 PHE 70 HD2 PHE 70 0.566 -8.754 9.625 575 HE1 PHE 70 HE1 PHE 70 2.429 -6.877 5.418 576 HE2 PHE 70 HE2 PHE 70 -0.907 -7.546 8.060 577 HZ PHE 70 HZ PHE 70 0.031 -6.553 5.977 578 H GLN 71 H GLN 71 2.457 -7.648 12.000 579 HA GLN 71 HA GLN 71 0.911 -5.512 10.919 580 1HB GLN 71 HB2 GLN 71 0.193 -7.188 12.648 581 2HB GLN 71 HB3 GLN 71 1.139 -6.313 13.857 582 1HG GLN 71 HG2 GLN 71 -1.133 -5.149 12.179 583 2HG GLN 71 HG3 GLN 71 -1.312 -5.755 13.838 584 1HE2 GLN 71 HE22 GLN 71 -1.661 -2.883 12.566 585 2HE2 GLN 71 HE21 GLN 71 -0.478 -1.954 13.474 586 H GLU 72 H GLU 72 3.669 -5.617 13.174 587 HA GLU 72 HA GLU 72 3.510 -2.813 13.764 588 1HB GLU 72 HB2 GLU 72 5.848 -4.736 14.165 589 2HB GLU 72 HB3 GLU 72 5.735 -3.073 14.765 590 1HG GLU 72 HG2 GLU 72 3.454 -3.840 15.828 591 2HG GLU 72 HG3 GLU 72 4.056 -5.482 15.561 592 H TYR 73 H TYR 73 5.233 -4.738 11.330 593 HA TYR 73 HA TYR 73 6.792 -2.653 10.166 594 1HB TYR 73 HB2 TYR 73 7.406 -4.689 9.381 595 2HB TYR 73 HB3 TYR 73 5.785 -5.325 9.326 596 HD1 TYR 73 HD1 TYR 73 4.341 -5.075 7.407 597 HD2 TYR 73 HD2 TYR 73 8.349 -3.490 7.426 598 HE1 TYR 73 HE1 TYR 73 4.322 -5.020 4.945 599 HE2 TYR 73 HE2 TYR 73 8.383 -3.591 4.945 600 HH TYR 73 HH TYR 73 5.691 -4.950 3.062 601 H ILE 74 H ILE 74 3.417 -3.740 9.406 602 HA ILE 74 HA ILE 74 2.968 -1.680 7.486 603 HB ILE 74 HB ILE 74 0.953 -3.013 9.327 604 1HG1 ILE 74 HG12 ILE 74 2.142 -4.628 7.848 605 2HG1 ILE 74 HG13 ILE 74 0.426 -4.506 7.552 606 1HG2 ILE 74 HG21 ILE 74 -0.102 -1.050 8.549 607 2HG2 ILE 74 HG22 ILE 74 0.634 -1.163 6.940 608 3HG2 ILE 74 HG23 ILE 74 -0.647 -2.286 7.413 609 1HD1 ILE 74 HD11 ILE 74 2.600 -3.267 5.849 610 2HD1 ILE 74 HD12 ILE 74 1.581 -4.655 5.436 611 3HD1 ILE 74 HD13 ILE 74 0.846 -3.065 5.565 612 H THR 75 H THR 75 2.241 -1.702 11.001 613 HA THR 75 HA THR 75 1.234 0.886 11.290 614 HB THR 75 HB THR 75 3.119 -0.572 13.202 615 HG1 THR 75 HG1 THR 75 1.422 -1.899 12.722 616 1HG2 THR 75 HG21 THR 75 2.795 1.715 13.946 617 2HG2 THR 75 HG22 THR 75 1.047 1.593 13.680 618 3HG2 THR 75 HG23 THR 75 1.822 0.629 14.952 619 H PHE 76 H PHE 76 4.662 -0.151 11.381 620 HA PHE 76 HA PHE 76 5.750 2.439 11.792 621 1HB PHE 76 HB2 PHE 76 6.975 0.361 12.257 622 2HB PHE 76 HB3 PHE 76 6.982 -0.020 10.535 623 HD1 PHE 76 HD1 PHE 76 8.427 1.221 8.964 624 HD2 PHE 76 HD2 PHE 76 8.298 2.297 13.142 625 HE1 PHE 76 HE1 PHE 76 10.351 2.709 8.639 626 HE2 PHE 76 HE2 PHE 76 10.107 3.951 12.756 627 HZ PHE 76 HZ PHE 76 11.113 4.188 10.495 628 H LEU 77 H LEU 77 5.119 0.578 8.738 629 HA LEU 77 HA LEU 77 6.116 2.625 7.000 630 1HB LEU 77 HB2 LEU 77 3.975 0.505 6.614 631 2HB LEU 77 HB3 LEU 77 4.457 1.620 5.337 632 HG LEU 77 HG LEU 77 6.415 -0.252 6.748 633 1HD1 LEU 77 HD11 LEU 77 4.951 -0.542 4.089 634 2HD1 LEU 77 HD12 LEU 77 6.315 -1.539 4.615 635 3HD1 LEU 77 HD13 LEU 77 4.789 -1.591 5.522 636 1HD2 LEU 77 HD21 LEU 77 6.613 1.442 4.217 637 2HD2 LEU 77 HD22 LEU 77 7.571 1.645 5.709 638 3HD2 LEU 77 HD23 LEU 77 7.798 0.214 4.709 639 H GLY 78 H GLY 78 2.986 2.249 8.663 640 1HA GLY 78 HA2 GLY 78 1.708 4.549 7.594 641 2HA GLY 78 HA3 GLY 78 1.454 3.880 9.227 642 H ALA 79 H ALA 79 3.827 4.252 10.496 643 HA ALA 79 HA ALA 79 3.900 7.032 11.083 644 1HB ALA 79 HB1 ALA 79 5.930 6.575 12.344 645 2HB ALA 79 HB2 ALA 79 4.747 5.281 12.617 646 3HB ALA 79 HB3 ALA 79 6.136 5.011 11.542 647 H LEU 80 H LEU 80 5.979 5.115 8.913 648 HA LEU 80 HA LEU 80 7.735 7.137 8.089 649 1HB LEU 80 HB2 LEU 80 7.626 4.511 7.603 650 2HB LEU 80 HB3 LEU 80 6.731 5.017 6.177 651 HG LEU 80 HG LEU 80 8.723 6.554 5.653 652 1HD1 LEU 80 HD11 LEU 80 10.898 5.812 6.633 653 2HD1 LEU 80 HD12 LEU 80 9.848 6.505 7.879 654 3HD1 LEU 80 HD13 LEU 80 10.022 4.745 7.743 655 1HD2 LEU 80 HD21 LEU 80 9.160 3.535 5.748 656 2HD2 LEU 80 HD22 LEU 80 8.272 4.408 4.474 657 3HD2 LEU 80 HD23 LEU 80 10.014 4.666 4.683 658 H ALA 81 H ALA 81 4.602 6.121 6.708 659 HA ALA 81 HA ALA 81 4.429 8.004 4.590 660 1HB ALA 81 HB1 ALA 81 2.956 6.121 4.668 661 2HB ALA 81 HB2 ALA 81 2.279 6.622 6.223 662 3HB ALA 81 HB3 ALA 81 1.983 7.610 4.786 663 H MET 82 H MET 82 3.374 8.209 8.029 664 HA MET 82 HA MET 82 2.282 10.827 7.762 665 1HB MET 82 HB2 MET 82 1.794 9.161 9.584 666 2HB MET 82 HB3 MET 82 3.359 9.553 10.312 667 1HG MET 82 HG2 MET 82 2.671 11.861 10.654 668 2HG MET 82 HG3 MET 82 1.202 11.616 9.695 669 1HE MET 82 HE1 MET 82 1.227 13.012 12.528 670 2HE MET 82 HE2 MET 82 -0.240 12.769 11.543 671 3HE MET 82 HE3 MET 82 -0.221 12.275 13.254 672 H ILE 83 H ILE 83 5.534 9.704 8.622 673 HA ILE 83 HA ILE 83 6.679 12.277 9.159 674 HB ILE 83 HB ILE 83 7.860 9.623 8.285 675 1HG1 ILE 83 HG12 ILE 83 8.175 11.151 10.902 676 2HG1 ILE 83 HG13 ILE 83 6.837 10.037 10.636 677 1HG2 ILE 83 HG21 ILE 83 9.336 12.202 8.965 678 2HG2 ILE 83 HG22 ILE 83 10.097 10.605 8.821 679 3HG2 ILE 83 HG23 ILE 83 9.365 11.345 7.406 680 1HD1 ILE 83 HD11 ILE 83 9.784 9.279 10.590 681 2HD1 ILE 83 HD12 ILE 83 8.579 8.877 11.821 682 3HD1 ILE 83 HD13 ILE 83 8.436 8.188 10.194 683 H TYR 84 H TYR 84 6.276 10.383 6.127 684 HA TYR 84 HA TYR 84 7.269 12.548 4.424 685 1HB TYR 84 HB2 TYR 84 5.422 10.243 3.723 686 2HB TYR 84 HB3 TYR 84 6.356 11.230 2.604 687 HD1 TYR 84 HD1 TYR 84 6.222 8.207 2.752 688 HD2 TYR 84 HD2 TYR 84 9.003 11.056 4.424 689 HE1 TYR 84 HE1 TYR 84 8.055 6.542 2.572 690 HE2 TYR 84 HE2 TYR 84 10.810 9.397 4.250 691 HH TYR 84 HH TYR 84 11.409 7.284 3.561 692 H ASN 85 H ASN 85 5.747 13.921 6.093 693 HA ASN 85 HA ASN 85 3.011 13.825 5.908 694 1HB ASN 85 HB2 ASN 85 4.355 15.171 7.550 695 2HB ASN 85 HB3 ASN 85 4.603 16.392 6.288 696 1HD2 ASN 85 HD22 ASN 85 2.068 14.562 8.049 697 2HD2 ASN 85 HD21 ASN 85 0.820 15.802 7.928 698 H GLU 86 H GLU 86 5.206 15.469 3.707 699 HA GLU 86 HA GLU 86 3.494 17.004 2.119 700 1HB GLU 86 HB2 GLU 86 5.830 15.235 1.263 701 2HB GLU 86 HB3 GLU 86 5.084 16.503 0.279 702 1HG GLU 86 HG2 GLU 86 5.700 18.209 1.961 703 2HG GLU 86 HG3 GLU 86 6.464 16.973 2.970 704 H ALA 87 H ALA 87 4.016 13.444 2.047 705 HA ALA 87 HA ALA 87 2.463 12.940 -0.318 706 1HB ALA 87 HB1 ALA 87 4.127 11.348 0.630 707 2HB ALA 87 HB2 ALA 87 3.051 11.079 2.021 708 3HB ALA 87 HB3 ALA 87 2.524 10.624 0.392 709 H LEU 88 H LEU 88 1.688 13.126 3.179 710 HA LEU 88 HA LEU 88 -1.069 12.281 2.887 711 1HB LEU 88 HB2 LEU 88 0.100 14.116 5.024 712 2HB LEU 88 HB3 LEU 88 -1.432 13.264 5.038 713 HG LEU 88 HG LEU 88 1.343 12.138 5.411 714 1HD1 LEU 88 HD11 LEU 88 0.172 11.197 7.444 715 2HD1 LEU 88 HD12 LEU 88 0.131 12.970 7.384 716 3HD1 LEU 88 HD13 LEU 88 -1.304 12.012 6.947 717 1HD2 LEU 88 HD21 LEU 88 -1.169 10.520 4.817 718 2HD2 LEU 88 HD22 LEU 88 0.324 10.584 3.837 719 3HD2 LEU 88 HD23 LEU 88 0.367 9.879 5.447 720 H LYS 89 H LYS 89 0.533 15.462 3.089 721 HA LYS 89 HA LYS 89 -1.785 17.026 2.851 722 1HB LYS 89 HB2 LYS 89 0.521 17.684 3.588 723 2HB LYS 89 HB3 LYS 89 1.006 17.769 1.884 724 1HG LYS 89 HG2 LYS 89 -0.772 19.477 1.491 725 2HG LYS 89 HG3 LYS 89 -1.245 19.384 3.192 726 1HD LYS 89 HD2 LYS 89 1.499 20.254 2.152 727 2HD LYS 89 HD3 LYS 89 0.201 21.336 2.687 728 1HE LYS 89 HE2 LYS 89 0.297 20.238 4.967 729 2HE LYS 89 HE3 LYS 89 1.726 19.336 4.430 730 1HZ LYS 89 HZ1 LYS 89 1.502 22.253 4.544 731 2HZ LYS 89 HZ2 LYS 89 2.329 21.289 5.595 732 3HZ LYS 89 HZ3 LYS 89 2.820 21.406 4.028 733 H GLY 90 H GLY 90 0.319 15.669 0.284 734 1HA GLY 90 HA2 GLY 90 -1.916 15.863 -1.620 735 2HA GLY 90 HA3 GLY 90 -0.461 16.787 -2.037 736 1H MET 1 H1 MET 1 15.423 0.002 -6.655 737 2H MET 1 H2 MET 1 14.711 0.181 -5.171 738 3H MET 1 H3 MET 1 14.699 1.425 -6.241 739 HA MET 1 HA MET 1 13.204 0.330 -7.658 740 1HB MET 1 HB2 MET 1 14.378 -1.887 -7.293 741 2HB MET 1 HB3 MET 1 13.442 -2.072 -5.806 742 1HG MET 1 HG2 MET 1 11.342 -1.796 -7.299 743 2HG MET 1 HG3 MET 1 12.434 -1.948 -8.672 744 1HE MET 1 HE1 MET 1 13.721 -5.655 -8.157 745 2HE MET 1 HE2 MET 1 13.900 -4.160 -9.104 746 3HE MET 1 HE3 MET 1 14.489 -4.234 -7.422 747 H ALA 2 H ALA 2 12.798 2.287 -5.915 748 HA ALA 2 HA ALA 2 11.282 1.547 -3.589 749 1HB ALA 2 HB1 ALA 2 12.797 3.505 -3.726 750 2HB ALA 2 HB2 ALA 2 11.665 4.284 -4.856 751 3HB ALA 2 HB3 ALA 2 11.165 3.933 -3.185 752 H SER 3 H SER 3 10.406 2.586 -6.861 753 HA SER 3 HA SER 3 8.071 3.767 -6.584 754 1HB SER 3 HB2 SER 3 8.196 1.834 -8.858 755 2HB SER 3 HB3 SER 3 7.889 3.569 -8.821 756 HG SER 3 HG SER 3 9.971 3.121 -9.669 757 HA PRO 4 HA PRO 4 5.519 -0.397 -6.795 758 1HB PRO 4 HB2 PRO 4 7.409 -2.129 -5.191 759 2HB PRO 4 HB3 PRO 4 6.246 -2.608 -6.459 760 1HG PRO 4 HG2 PRO 4 8.861 -2.399 -7.071 761 2HG PRO 4 HG3 PRO 4 7.648 -1.683 -8.180 762 1HD PRO 4 HD2 PRO 4 9.215 -0.296 -5.996 763 2HD PRO 4 HD3 PRO 4 9.079 0.178 -7.706 764 H LEU 5 H LEU 5 7.618 -0.207 -3.794 765 HA LEU 5 HA LEU 5 5.328 -0.476 -2.113 766 1HB LEU 5 HB2 LEU 5 7.585 -1.011 -1.327 767 2HB LEU 5 HB3 LEU 5 8.060 0.694 -1.471 768 HG LEU 5 HG LEU 5 6.400 1.322 0.255 769 1HD1 LEU 5 HD11 LEU 5 5.301 -0.470 1.575 770 2HD1 LEU 5 HD12 LEU 5 4.640 -0.374 -0.053 771 3HD1 LEU 5 HD13 LEU 5 5.782 -1.678 0.363 772 1HD2 LEU 5 HD21 LEU 5 7.429 0.277 2.160 773 2HD2 LEU 5 HD22 LEU 5 8.055 -1.051 1.149 774 3HD2 LEU 5 HD23 LEU 5 8.678 0.613 0.939 775 H ASP 6 H ASP 6 7.176 2.367 -3.292 776 HA ASP 6 HA ASP 6 5.898 4.354 -1.773 777 1HB ASP 6 HB2 ASP 6 6.859 4.544 -4.667 778 2HB ASP 6 HB3 ASP 6 6.459 5.916 -3.631 779 H GLN 7 H GLN 7 4.870 3.108 -5.009 780 HA GLN 7 HA GLN 7 2.554 4.777 -5.097 781 1HB GLN 7 HB2 GLN 7 1.772 3.443 -6.918 782 2HB GLN 7 HB3 GLN 7 3.502 3.760 -7.095 783 1HG GLN 7 HG2 GLN 7 3.964 1.462 -6.227 784 2HG GLN 7 HG3 GLN 7 2.241 1.117 -6.190 785 1HE2 GLN 7 HE22 GLN 7 1.105 1.612 -8.422 786 2HE2 GLN 7 HE21 GLN 7 2.014 1.087 -9.829 787 H ALA 8 H ALA 8 3.078 1.509 -3.698 788 HA ALA 8 HA ALA 8 0.312 1.023 -3.180 789 1HB ALA 8 HB1 ALA 8 2.790 -0.082 -1.831 790 2HB ALA 8 HB2 ALA 8 1.123 -0.640 -1.563 791 3HB ALA 8 HB3 ALA 8 1.843 -0.761 -3.179 792 H ILE 9 H ILE 9 2.900 2.325 -0.957 793 HA ILE 9 HA ILE 9 1.018 2.859 1.149 794 HB ILE 9 HB ILE 9 2.697 4.271 2.165 795 1HG1 ILE 9 HG12 ILE 9 4.374 3.929 -0.294 796 2HG1 ILE 9 HG13 ILE 9 3.641 5.442 0.274 797 1HG2 ILE 9 HG21 ILE 9 2.707 1.800 2.344 798 2HG2 ILE 9 HG22 ILE 9 3.931 1.744 1.055 799 3HG2 ILE 9 HG23 ILE 9 4.283 2.531 2.609 800 1HD1 ILE 9 HD11 ILE 9 5.936 5.469 0.950 801 2HD1 ILE 9 HD12 ILE 9 4.967 5.220 2.414 802 3HD1 ILE 9 HD13 ILE 9 5.837 3.861 1.670 803 H GLY 10 H GLY 10 2.174 4.802 -1.591 804 1HA GLY 10 HA2 GLY 10 0.779 7.177 -1.380 805 2HA GLY 10 HA3 GLY 10 1.079 6.296 -2.883 806 H LEU 11 H LEU 11 -0.492 4.025 -2.610 807 HA LEU 11 HA LEU 11 -3.033 4.920 -3.357 808 1HB LEU 11 HB2 LEU 11 -1.823 2.628 -3.716 809 2HB LEU 11 HB3 LEU 11 -2.507 2.177 -2.161 810 HG LEU 11 HG LEU 11 -3.882 1.266 -3.835 811 1HD1 LEU 11 HD11 LEU 11 -6.027 2.062 -3.373 812 2HD1 LEU 11 HD12 LEU 11 -5.060 2.273 -1.899 813 3HD1 LEU 11 HD13 LEU 11 -5.437 3.675 -2.942 814 1HD2 LEU 11 HD21 LEU 11 -4.914 2.477 -5.650 815 2HD2 LEU 11 HD22 LEU 11 -4.160 3.998 -5.130 816 3HD2 LEU 11 HD23 LEU 11 -3.151 2.653 -5.715 817 H LEU 12 H LEU 12 -2.119 3.325 -0.261 818 HA LEU 12 HA LEU 12 -4.593 3.661 1.119 819 1HB LEU 12 HB2 LEU 12 -1.677 3.560 2.067 820 2HB LEU 12 HB3 LEU 12 -3.035 3.726 3.176 821 HG LEU 12 HG LEU 12 -3.993 1.619 2.420 822 1HD1 LEU 12 HD11 LEU 12 -3.053 1.371 0.143 823 2HD1 LEU 12 HD12 LEU 12 -1.411 1.282 0.835 824 3HD1 LEU 12 HD13 LEU 12 -2.587 -0.002 1.143 825 1HD2 LEU 12 HD21 LEU 12 -2.526 1.678 4.386 826 2HD2 LEU 12 HD22 LEU 12 -2.299 0.160 3.516 827 3HD2 LEU 12 HD23 LEU 12 -1.096 1.457 3.357 828 H ILE 13 H ILE 13 -1.774 5.852 0.886 829 HA ILE 13 HA ILE 13 -2.820 7.815 2.663 830 HB ILE 13 HB ILE 13 -0.783 7.933 0.402 831 1HG1 ILE 13 HG12 ILE 13 -0.314 8.101 3.405 832 2HG1 ILE 13 HG13 ILE 13 -0.438 6.544 2.599 833 1HG2 ILE 13 HG21 ILE 13 -1.529 10.081 2.404 834 2HG2 ILE 13 HG22 ILE 13 -0.007 10.072 1.476 835 3HG2 ILE 13 HG23 ILE 13 -1.551 10.206 0.633 836 1HD1 ILE 13 HD11 ILE 13 1.397 7.378 0.987 837 2HD1 ILE 13 HD12 ILE 13 1.690 8.649 2.197 838 3HD1 ILE 13 HD13 ILE 13 1.844 6.932 2.633 839 H GLY 14 H GLY 14 -2.954 7.638 -0.908 840 1HA GLY 14 HA2 GLY 14 -4.464 9.958 -1.418 841 2HA GLY 14 HA3 GLY 14 -4.447 8.482 -2.409 842 H ILE 15 H ILE 15 -5.588 6.555 -0.992 843 HA ILE 15 HA ILE 15 -8.353 7.044 -1.075 844 HB ILE 15 HB ILE 15 -6.612 4.879 0.056 845 1HG1 ILE 15 HG12 ILE 15 -8.971 5.027 -1.896 846 2HG1 ILE 15 HG13 ILE 15 -7.257 4.948 -2.318 847 1HG2 ILE 15 HG21 ILE 15 -8.511 3.636 0.957 848 2HG2 ILE 15 HG22 ILE 15 -8.261 5.122 1.834 849 3HG2 ILE 15 HG23 ILE 15 -9.586 5.022 0.647 850 1HD1 ILE 15 HD11 ILE 15 -8.170 2.754 -2.614 851 2HD1 ILE 15 HD12 ILE 15 -7.206 2.685 -1.119 852 3HD1 ILE 15 HD13 ILE 15 -8.975 2.775 -1.043 853 H PHE 16 H PHE 16 -6.133 7.301 1.754 854 HA PHE 16 HA PHE 16 -8.265 7.991 3.551 855 1HB PHE 16 HB2 PHE 16 -5.953 7.259 4.173 856 2HB PHE 16 HB3 PHE 16 -5.341 8.831 3.707 857 HD1 PHE 16 HD1 PHE 16 -6.162 10.913 4.968 858 HD2 PHE 16 HD2 PHE 16 -7.184 6.929 6.234 859 HE1 PHE 16 HE1 PHE 16 -6.608 11.748 7.229 860 HE2 PHE 16 HE2 PHE 16 -7.474 7.741 8.558 861 HZ PHE 16 HZ PHE 16 -7.118 10.132 9.080 862 H HIS 17 H HIS 17 -5.857 10.136 1.942 863 HA HIS 17 HA HIS 17 -7.100 12.409 3.064 864 1HB HIS 17 HB2 HIS 17 -4.730 11.926 1.388 865 2HB HIS 17 HB3 HIS 17 -5.524 13.467 1.066 866 HD1 HIS 17 HD1 HIS 17 -5.358 15.338 2.866 867 HD2 HIS 17 HD2 HIS 17 -3.985 11.561 4.111 868 HE1 HIS 17 HE1 HIS 17 -4.330 15.658 5.180 869 H LYS 18 H LYS 18 -7.813 10.813 0.045 870 HA LYS 18 HA LYS 18 -9.304 12.881 -1.224 871 1HB LYS 18 HB2 LYS 18 -9.686 9.874 -1.009 872 2HB LYS 18 HB3 LYS 18 -10.798 10.893 -1.938 873 1HG LYS 18 HG2 LYS 18 -9.059 11.668 -3.397 874 2HG LYS 18 HG3 LYS 18 -7.796 10.897 -2.429 875 1HD LYS 18 HD2 LYS 18 -8.837 8.659 -2.895 876 2HD LYS 18 HD3 LYS 18 -10.014 9.442 -3.958 877 1HE LYS 18 HE2 LYS 18 -6.972 9.448 -4.315 878 2HE LYS 18 HE3 LYS 18 -8.119 8.440 -5.213 879 1HZ LYS 18 HZ1 LYS 18 -8.012 11.372 -5.270 880 2HZ LYS 18 HZ2 LYS 18 -7.504 10.355 -6.459 881 3HZ LYS 18 HZ3 LYS 18 -9.105 10.440 -6.078 882 H TYR 19 H TYR 19 -10.153 10.730 1.524 883 HA TYR 19 HA TYR 19 -12.857 11.892 1.664 884 1HB TYR 19 HB2 TYR 19 -11.500 9.666 3.158 885 2HB TYR 19 HB3 TYR 19 -13.079 10.312 3.613 886 HD1 TYR 19 HD1 TYR 19 -11.212 8.816 0.786 887 HD2 TYR 19 HD2 TYR 19 -15.076 9.859 2.327 888 HE1 TYR 19 HE1 TYR 19 -12.213 8.000 -1.278 889 HE2 TYR 19 HE2 TYR 19 -16.113 9.023 0.239 890 HH TYR 19 HH TYR 19 -14.170 7.732 -2.475 891 H SER 20 H SER 20 -9.814 11.962 3.618 892 HA SER 20 HA SER 20 -10.955 13.612 5.634 893 1HB SER 20 HB2 SER 20 -8.877 14.151 6.393 894 2HB SER 20 HB3 SER 20 -8.694 12.506 5.772 895 HG SER 20 HG SER 20 -7.044 14.130 5.220 896 H GLY 21 H GLY 21 -9.669 14.435 2.438 897 1HA GLY 21 HA2 GLY 21 -9.720 17.140 2.200 898 2HA GLY 21 HA3 GLY 21 -10.472 16.049 1.031 899 H LYS 22 H LYS 22 -12.662 15.047 2.409 900 HA LYS 22 HA LYS 22 -14.593 17.045 1.949 901 1HB LYS 22 HB2 LYS 22 -14.940 14.524 2.005 902 2HB LYS 22 HB3 LYS 22 -14.889 14.630 3.772 903 1HG LYS 22 HG2 LYS 22 -16.813 16.278 3.673 904 2HG LYS 22 HG3 LYS 22 -16.835 16.071 1.924 905 1HD LYS 22 HD2 LYS 22 -18.580 14.734 2.902 906 2HD LYS 22 HD3 LYS 22 -17.358 13.653 2.204 907 1HE LYS 22 HE2 LYS 22 -18.256 12.875 4.383 908 2HE LYS 22 HE3 LYS 22 -16.509 13.099 4.353 909 1HZ LYS 22 HZ1 LYS 22 -17.517 13.964 6.346 910 2HZ LYS 22 HZ2 LYS 22 -16.793 15.164 5.491 911 3HZ LYS 22 HZ3 LYS 22 -18.438 15.018 5.470 912 H GLU 23 H GLU 23 -12.910 16.068 4.940 913 HA GLU 23 HA GLU 23 -14.462 18.093 6.474 914 1HB GLU 23 HB2 GLU 23 -13.595 16.961 8.489 915 2HB GLU 23 HB3 GLU 23 -14.645 15.958 7.481 916 1HG GLU 23 HG2 GLU 23 -12.760 14.773 6.557 917 2HG GLU 23 HG3 GLU 23 -11.605 15.824 7.391 918 H GLY 24 H GLY 24 -12.231 18.669 4.500 919 1HA GLY 24 HA2 GLY 24 -10.955 20.577 4.521 920 2HA GLY 24 HA3 GLY 24 -10.920 20.602 6.284 921 H ASP 25 H ASP 25 -10.013 17.719 4.432 922 HA ASP 25 HA ASP 25 -8.045 16.723 3.921 923 1HB ASP 25 HB2 ASP 25 -7.886 18.802 2.510 924 2HB ASP 25 HB3 ASP 25 -6.917 19.548 3.788 925 H LYS 26 H LYS 26 -8.601 16.760 6.632 926 HA LYS 26 HA LYS 26 -6.160 17.434 8.118 927 1HB LYS 26 HB2 LYS 26 -8.767 16.040 8.845 928 2HB LYS 26 HB3 LYS 26 -7.486 16.430 10.007 929 1HG LYS 26 HG2 LYS 26 -7.724 18.814 9.574 930 2HG LYS 26 HG3 LYS 26 -8.913 18.510 8.292 931 1HD LYS 26 HD2 LYS 26 -10.500 17.569 9.868 932 2HD LYS 26 HD3 LYS 26 -9.319 17.632 11.184 933 1HE LYS 26 HE2 LYS 26 -10.973 19.484 11.303 934 2HE LYS 26 HE3 LYS 26 -9.314 20.086 11.137 935 1HZ LYS 26 HZ1 LYS 26 -10.919 21.200 9.706 936 2HZ LYS 26 HZ2 LYS 26 -9.711 20.477 8.848 937 3HZ LYS 26 HZ3 LYS 26 -11.200 19.780 8.904 938 H HIS 27 H HIS 27 -5.399 15.584 9.636 939 HA HIS 27 HA HIS 27 -4.889 13.098 8.045 940 1HB HIS 27 HB2 HIS 27 -3.630 14.049 10.627 941 2HB HIS 27 HB3 HIS 27 -3.179 12.615 9.693 942 HD1 HIS 27 HD1 HIS 27 -3.228 14.111 6.760 943 HD2 HIS 27 HD2 HIS 27 -1.360 15.392 10.322 944 HE1 HIS 27 HE1 HIS 27 -1.421 15.770 6.090 945 H THR 28 H THR 28 -7.556 13.567 8.891 946 HA THR 28 HA THR 28 -7.999 11.365 10.780 947 HB THR 28 HB THR 28 -9.748 12.754 11.912 948 HG1 THR 28 HG1 THR 28 -10.018 14.386 10.358 949 1HG2 THR 28 HG21 THR 28 -8.260 14.034 13.340 950 2HG2 THR 28 HG22 THR 28 -7.505 12.476 12.951 951 3HG2 THR 28 HG23 THR 28 -6.959 13.966 12.143 952 H LEU 29 H LEU 29 -10.094 10.471 10.589 953 HA LEU 29 HA LEU 29 -11.831 11.491 8.371 954 1HB LEU 29 HB2 LEU 29 -11.336 8.547 8.995 955 2HB LEU 29 HB3 LEU 29 -12.523 9.173 7.851 956 HG LEU 29 HG LEU 29 -9.518 9.471 7.574 957 1HD1 LEU 29 HD11 LEU 29 -10.253 7.108 7.373 958 2HD1 LEU 29 HD12 LEU 29 -11.484 7.606 6.185 959 3HD1 LEU 29 HD13 LEU 29 -9.759 7.754 5.794 960 1HD2 LEU 29 HD21 LEU 29 -10.680 11.234 6.352 961 2HD2 LEU 29 HD22 LEU 29 -10.019 10.042 5.227 962 3HD2 LEU 29 HD23 LEU 29 -11.753 10.028 5.596 963 H SER 30 H SER 30 -13.960 11.782 9.177 964 HA SER 30 HA SER 30 -14.478 10.981 11.943 965 1HB SER 30 HB2 SER 30 -16.840 11.838 11.238 966 2HB SER 30 HB3 SER 30 -15.506 12.992 11.383 967 HG SER 30 HG SER 30 -15.324 13.132 9.221 968 H LYS 31 H LYS 31 -16.112 9.397 12.594 969 HA LYS 31 HA LYS 31 -15.529 6.995 11.424 970 1HB LYS 31 HB2 LYS 31 -17.176 6.017 12.870 971 2HB LYS 31 HB3 LYS 31 -16.227 7.251 13.690 972 1HG LYS 31 HG2 LYS 31 -18.131 8.856 13.459 973 2HG LYS 31 HG3 LYS 31 -19.090 7.562 12.691 974 1HD LYS 31 HD2 LYS 31 -18.826 6.161 14.729 975 2HD LYS 31 HD3 LYS 31 -17.830 7.416 15.466 976 1HE LYS 31 HE2 LYS 31 -20.077 7.553 16.367 977 2HE LYS 31 HE3 LYS 31 -19.739 9.005 15.411 978 1HZ LYS 31 HZ1 LYS 31 -21.909 8.098 14.977 979 2HZ LYS 31 HZ2 LYS 31 -20.984 8.029 13.617 980 3HZ LYS 31 HZ3 LYS 31 -21.263 6.662 14.494 981 H LYS 32 H LYS 32 -18.452 8.891 10.703 982 HA LYS 32 HA LYS 32 -19.441 6.799 8.875 983 1HB LYS 32 HB2 LYS 32 -21.058 7.972 10.069 984 2HB LYS 32 HB3 LYS 32 -20.473 9.562 9.506 985 1HG LYS 32 HG2 LYS 32 -21.160 9.016 7.205 986 2HG LYS 32 HG3 LYS 32 -21.597 7.369 7.705 987 1HD LYS 32 HD2 LYS 32 -23.377 8.269 9.171 988 2HD LYS 32 HD3 LYS 32 -22.864 9.925 8.807 989 1HE LYS 32 HE2 LYS 32 -24.848 9.352 7.495 990 2HE LYS 32 HE3 LYS 32 -23.462 9.625 6.426 991 1HZ LYS 32 HZ1 LYS 32 -23.201 7.260 6.259 992 2HZ LYS 32 HZ2 LYS 32 -24.465 6.998 7.287 993 3HZ LYS 32 HZ3 LYS 32 -24.726 7.694 5.817 994 H GLU 33 H GLU 33 -17.313 9.594 8.610 995 HA GLU 33 HA GLU 33 -17.438 9.777 5.704 996 1HB GLU 33 HB2 GLU 33 -16.637 11.655 6.967 997 2HB GLU 33 HB3 GLU 33 -15.392 10.680 7.756 998 1HG GLU 33 HG2 GLU 33 -14.230 10.307 5.662 999 2HG GLU 33 HG3 GLU 33 -15.454 11.214 4.769 1000 H LEU 34 H LEU 34 -15.549 7.960 8.154 1001 HA LEU 34 HA LEU 34 -13.917 6.554 6.308 1002 1HB LEU 34 HB2 LEU 34 -13.357 6.504 8.587 1003 2HB LEU 34 HB3 LEU 34 -14.905 5.862 9.086 1004 HG LEU 34 HG LEU 34 -13.055 4.253 9.187 1005 1HD1 LEU 34 HD11 LEU 34 -14.289 2.383 8.556 1006 2HD1 LEU 34 HD12 LEU 34 -15.513 3.615 8.877 1007 3HD1 LEU 34 HD13 LEU 34 -15.079 3.202 7.212 1008 1HD2 LEU 34 HD21 LEU 34 -13.039 4.422 6.139 1009 2HD2 LEU 34 HD22 LEU 34 -11.750 4.927 7.242 1010 3HD2 LEU 34 HD23 LEU 34 -12.186 3.218 7.081 1011 H LYS 35 H LYS 35 -17.250 5.727 7.588 1012 HA LYS 35 HA LYS 35 -17.550 3.437 5.945 1013 1HB LYS 35 HB2 LYS 35 -19.734 5.441 6.646 1014 2HB LYS 35 HB3 LYS 35 -19.941 3.878 5.870 1015 1HG LYS 35 HG2 LYS 35 -18.780 2.840 7.938 1016 2HG LYS 35 HG3 LYS 35 -18.957 4.441 8.675 1017 1HD LYS 35 HD2 LYS 35 -20.886 3.257 9.382 1018 2HD LYS 35 HD3 LYS 35 -21.463 4.284 8.067 1019 1HE LYS 35 HE2 LYS 35 -21.223 2.265 6.501 1020 2HE LYS 35 HE3 LYS 35 -20.767 1.303 7.906 1021 1HZ LYS 35 HZ1 LYS 35 -23.314 2.714 7.500 1022 2HZ LYS 35 HZ2 LYS 35 -23.054 1.092 7.360 1023 3HZ LYS 35 HZ3 LYS 35 -22.925 1.824 8.832 1024 H GLU 36 H GLU 36 -18.212 6.860 5.090 1025 HA GLU 36 HA GLU 36 -19.057 6.512 2.448 1026 1HB GLU 36 HB2 GLU 36 -18.795 8.648 3.948 1027 2HB GLU 36 HB3 GLU 36 -17.169 8.749 3.262 1028 1HG GLU 36 HG2 GLU 36 -18.225 8.855 0.974 1029 2HG GLU 36 HG3 GLU 36 -19.805 8.929 1.772 1030 H LEU 37 H LEU 37 -15.693 6.837 3.648 1031 HA LEU 37 HA LEU 37 -14.337 6.469 1.185 1032 1HB LEU 37 HB2 LEU 37 -13.244 7.247 3.265 1033 2HB LEU 37 HB3 LEU 37 -13.511 5.713 4.045 1034 HG LEU 37 HG LEU 37 -11.789 5.912 1.560 1035 1HD1 LEU 37 HD11 LEU 37 -10.918 6.071 4.473 1036 2HD1 LEU 37 HD12 LEU 37 -9.840 6.027 3.074 1037 3HD1 LEU 37 HD13 LEU 37 -10.883 7.431 3.323 1038 1HD2 LEU 37 HD21 LEU 37 -12.032 3.886 3.860 1039 2HD2 LEU 37 HD22 LEU 37 -12.323 3.588 2.127 1040 3HD2 LEU 37 HD23 LEU 37 -10.698 3.894 2.699 1041 H ILE 38 H ILE 38 -15.323 4.010 3.607 1042 HA ILE 38 HA ILE 38 -14.238 1.881 2.071 1043 HB ILE 38 HB ILE 38 -16.442 1.937 4.165 1044 1HG1 ILE 38 HG12 ILE 38 -13.474 1.166 4.197 1045 2HG1 ILE 38 HG13 ILE 38 -14.176 2.621 4.899 1046 1HG2 ILE 38 HG21 ILE 38 -15.021 -0.564 3.159 1047 2HG2 ILE 38 HG22 ILE 38 -16.323 -0.448 4.348 1048 3HG2 ILE 38 HG23 ILE 38 -16.666 -0.118 2.666 1049 1HD1 ILE 38 HD11 ILE 38 -14.572 -0.232 5.778 1050 2HD1 ILE 38 HD12 ILE 38 -13.786 1.103 6.651 1051 3HD1 ILE 38 HD13 ILE 38 -15.555 1.120 6.406 1052 H GLN 39 H GLN 39 -17.631 3.086 2.167 1053 HA GLN 39 HA GLN 39 -18.558 1.110 0.351 1054 1HB GLN 39 HB2 GLN 39 -19.609 3.929 0.874 1055 2HB GLN 39 HB3 GLN 39 -20.485 2.675 -0.017 1056 1HG GLN 39 HG2 GLN 39 -19.676 2.490 2.927 1057 2HG GLN 39 HG3 GLN 39 -21.276 2.869 2.298 1058 1HE2 GLN 39 HE22 GLN 39 -18.850 0.299 2.691 1059 2HE2 GLN 39 HE21 GLN 39 -19.969 -1.016 2.370 1060 H LYS 40 H LYS 40 -17.032 4.311 -0.330 1061 HA LYS 40 HA LYS 40 -17.588 3.901 -3.176 1062 1HB LYS 40 HB2 LYS 40 -17.470 6.158 -2.038 1063 2HB LYS 40 HB3 LYS 40 -15.747 5.889 -1.825 1064 1HG LYS 40 HG2 LYS 40 -16.189 7.306 -3.793 1065 2HG LYS 40 HG3 LYS 40 -15.403 5.806 -4.263 1066 1HD LYS 40 HD2 LYS 40 -17.194 6.510 -5.819 1067 2HD LYS 40 HD3 LYS 40 -17.468 4.905 -5.163 1068 1HE LYS 40 HE2 LYS 40 -19.545 6.257 -5.250 1069 2HE LYS 40 HE3 LYS 40 -19.158 5.792 -3.592 1070 1HZ LYS 40 HZ1 LYS 40 -19.797 8.081 -3.756 1071 2HZ LYS 40 HZ2 LYS 40 -18.229 7.970 -3.263 1072 3HZ LYS 40 HZ3 LYS 40 -18.575 8.400 -4.817 1073 H GLU 41 H GLU 41 -14.622 3.792 -1.127 1074 HA GLU 41 HA GLU 41 -12.995 3.161 -3.470 1075 1HB GLU 41 HB2 GLU 41 -12.169 3.272 -0.545 1076 2HB GLU 41 HB3 GLU 41 -11.126 3.319 -1.972 1077 1HG GLU 41 HG2 GLU 41 -13.115 5.463 -1.093 1078 2HG GLU 41 HG3 GLU 41 -11.359 5.555 -1.032 1079 H LEU 42 H LEU 42 -14.130 1.417 -0.544 1080 HA LEU 42 HA LEU 42 -12.764 -1.065 -1.490 1081 1HB LEU 42 HB2 LEU 42 -14.067 -0.318 1.141 1082 2HB LEU 42 HB3 LEU 42 -13.667 -1.971 0.691 1083 HG LEU 42 HG LEU 42 -11.276 -1.394 0.522 1084 1HD1 LEU 42 HD11 LEU 42 -10.534 0.773 1.627 1085 2HD1 LEU 42 HD12 LEU 42 -11.201 0.936 0.002 1086 3HD1 LEU 42 HD13 LEU 42 -12.187 1.356 1.420 1087 1HD2 LEU 42 HD21 LEU 42 -10.895 -1.203 2.937 1088 2HD2 LEU 42 HD22 LEU 42 -12.570 -0.673 3.172 1089 3HD2 LEU 42 HD23 LEU 42 -12.229 -2.313 2.588 1090 H THR 43 H THR 43 -14.332 -0.561 -3.369 1091 HA THR 43 HA THR 43 -17.082 -0.572 -2.989 1092 HB THR 43 HB THR 43 -15.930 -1.346 -5.656 1093 HG1 THR 43 HG1 THR 43 -15.323 1.169 -4.586 1094 1HG2 THR 43 HG21 THR 43 -18.272 -0.542 -5.405 1095 2HG2 THR 43 HG22 THR 43 -17.665 0.982 -4.716 1096 3HG2 THR 43 HG23 THR 43 -17.287 0.552 -6.398 1097 H ILE 44 H ILE 44 -16.919 -2.684 -1.532 1098 HA ILE 44 HA ILE 44 -17.061 -5.210 -2.922 1099 HB ILE 44 HB ILE 44 -17.920 -6.117 -0.854 1100 1HG1 ILE 44 HG12 ILE 44 -18.059 -3.238 0.159 1101 2HG1 ILE 44 HG13 ILE 44 -19.408 -4.364 -0.059 1102 1HG2 ILE 44 HG21 ILE 44 -15.931 -5.789 0.447 1103 2HG2 ILE 44 HG22 ILE 44 -15.469 -5.630 -1.247 1104 3HG2 ILE 44 HG23 ILE 44 -15.654 -4.178 -0.246 1105 1HD1 ILE 44 HD11 ILE 44 -18.889 -4.296 2.265 1106 2HD1 ILE 44 HD12 ILE 44 -18.382 -5.881 1.641 1107 3HD1 ILE 44 HD13 ILE 44 -17.174 -4.613 1.973 1108 H GLY 45 H GLY 45 -18.682 -6.078 -4.076 1109 1HA GLY 45 HA2 GLY 45 -21.124 -4.665 -4.631 1110 2HA GLY 45 HA3 GLY 45 -20.761 -6.356 -5.026 1111 H SER 46 H SER 46 -20.168 -7.183 -2.280 1112 HA SER 46 HA SER 46 -22.789 -7.939 -1.426 1113 1HB SER 46 HB2 SER 46 -21.132 -8.999 0.373 1114 2HB SER 46 HB3 SER 46 -21.166 -9.581 -1.294 1115 HG SER 46 HG SER 46 -19.089 -8.588 -0.054 1116 H LYS 47 H LYS 47 -23.204 -5.416 -1.224 1117 HA LYS 47 HA LYS 47 -22.399 -3.926 1.002 1118 1HB LYS 47 HB2 LYS 47 -25.160 -4.027 -0.288 1119 2HB LYS 47 HB3 LYS 47 -24.567 -2.739 0.765 1120 1HG LYS 47 HG2 LYS 47 -23.452 -3.454 -1.986 1121 2HG LYS 47 HG3 LYS 47 -24.460 -2.069 -1.564 1122 1HD LYS 47 HD2 LYS 47 -22.645 -1.336 0.061 1123 2HD LYS 47 HD3 LYS 47 -21.599 -2.591 -0.634 1124 1HE LYS 47 HE2 LYS 47 -22.848 -0.261 -2.157 1125 2HE LYS 47 HE3 LYS 47 -21.159 -0.406 -1.646 1126 1HZ LYS 47 HZ1 LYS 47 -21.390 -1.040 -3.905 1127 2HZ LYS 47 HZ2 LYS 47 -20.982 -2.367 -3.009 1128 3HZ LYS 47 HZ3 LYS 47 -22.530 -2.177 -3.543 1129 H LEU 48 H LEU 48 -24.514 -6.698 0.983 1130 HA LEU 48 HA LEU 48 -25.833 -6.525 3.439 1131 1HB LEU 48 HB2 LEU 48 -24.416 -8.953 2.266 1132 2HB LEU 48 HB3 LEU 48 -25.692 -8.987 3.486 1133 HG LEU 48 HG LEU 48 -26.014 -8.043 0.595 1134 1HD1 LEU 48 HD11 LEU 48 -27.360 -10.076 0.344 1135 2HD1 LEU 48 HD12 LEU 48 -25.709 -10.479 0.843 1136 3HD1 LEU 48 HD13 LEU 48 -27.029 -10.528 2.030 1137 1HD2 LEU 48 HD21 LEU 48 -27.572 -6.794 2.018 1138 2HD2 LEU 48 HD22 LEU 48 -28.455 -8.045 1.140 1139 3HD2 LEU 48 HD23 LEU 48 -28.055 -8.289 2.852 1140 H GLN 49 H GLN 49 -22.377 -6.960 2.866 1141 HA GLN 49 HA GLN 49 -21.718 -7.814 5.545 1142 1HB GLN 49 HB2 GLN 49 -20.048 -6.501 3.370 1143 2HB GLN 49 HB3 GLN 49 -19.406 -7.171 4.875 1144 1HG GLN 49 HG2 GLN 49 -20.328 -9.408 4.284 1145 2HG GLN 49 HG3 GLN 49 -20.912 -8.753 2.750 1146 1HE2 GLN 49 HE21 GLN 49 -17.917 -9.160 4.706 1147 2HE2 GLN 49 HE22 GLN 49 -16.851 -9.322 3.312 1148 H ASP 50 H ASP 50 -23.087 -4.859 4.676 1149 HA ASP 50 HA ASP 50 -21.628 -2.885 5.820 1150 1HB ASP 50 HB2 ASP 50 -23.780 -2.481 4.780 1151 2HB ASP 50 HB3 ASP 50 -24.620 -3.313 6.103 1152 H ALA 51 H ALA 51 -23.475 -5.334 7.632 1153 HA ALA 51 HA ALA 51 -23.193 -4.303 10.261 1154 1HB ALA 51 HB1 ALA 51 -23.127 -7.200 9.314 1155 2HB ALA 51 HB2 ALA 51 -23.410 -6.651 10.979 1156 3HB ALA 51 HB3 ALA 51 -24.580 -6.252 9.705 1157 H GLU 52 H GLU 52 -20.908 -6.230 8.284 1158 HA GLU 52 HA GLU 52 -18.901 -6.468 10.384 1159 1HB GLU 52 HB2 GLU 52 -18.586 -6.763 7.363 1160 2HB GLU 52 HB3 GLU 52 -17.452 -7.271 8.616 1161 1HG GLU 52 HG2 GLU 52 -19.192 -8.836 9.523 1162 2HG GLU 52 HG3 GLU 52 -20.255 -8.407 8.172 1163 H ILE 53 H ILE 53 -19.560 -4.354 7.562 1164 HA ILE 53 HA ILE 53 -17.238 -2.755 7.812 1165 HB ILE 53 HB ILE 53 -19.949 -1.826 6.821 1166 1HG1 ILE 53 HG12 ILE 53 -19.312 -3.699 5.450 1167 2HG1 ILE 53 HG13 ILE 53 -18.948 -2.236 4.553 1168 1HG2 ILE 53 HG21 ILE 53 -18.607 0.088 7.290 1169 2HG2 ILE 53 HG22 ILE 53 -17.183 -0.644 6.537 1170 3HG2 ILE 53 HG23 ILE 53 -18.581 -0.165 5.546 1171 1HD1 ILE 53 HD11 ILE 53 -17.129 -3.759 4.239 1172 2HD1 ILE 53 HD12 ILE 53 -16.516 -2.500 5.321 1173 3HD1 ILE 53 HD13 ILE 53 -16.984 -4.087 5.968 1174 H VAL 54 H VAL 54 -20.413 -2.333 9.544 1175 HA VAL 54 HA VAL 54 -19.405 0.022 10.800 1176 HB VAL 54 HB VAL 54 -21.222 -0.219 12.482 1177 1HG1 VAL 54 HG11 VAL 54 -22.881 0.566 10.852 1178 2HG1 VAL 54 HG12 VAL 54 -21.283 1.241 10.505 1179 3HG1 VAL 54 HG13 VAL 54 -21.903 -0.112 9.530 1180 1HG2 VAL 54 HG21 VAL 54 -23.084 -1.656 12.031 1181 2HG2 VAL 54 HG22 VAL 54 -22.238 -2.388 10.665 1182 3HG2 VAL 54 HG23 VAL 54 -21.640 -2.639 12.327 1183 H LYS 55 H LYS 55 -19.264 -3.408 11.835 1184 HA LYS 55 HA LYS 55 -18.088 -2.866 14.387 1185 1HB LYS 55 HB2 LYS 55 -18.951 -5.034 13.779 1186 2HB LYS 55 HB3 LYS 55 -17.744 -5.245 12.511 1187 1HG LYS 55 HG2 LYS 55 -16.693 -4.677 15.280 1188 2HG LYS 55 HG3 LYS 55 -17.516 -6.229 15.040 1189 1HD LYS 55 HD2 LYS 55 -16.006 -6.743 13.127 1190 2HD LYS 55 HD3 LYS 55 -15.150 -5.216 13.412 1191 1HE LYS 55 HE2 LYS 55 -14.663 -5.997 15.768 1192 2HE LYS 55 HE3 LYS 55 -15.391 -7.564 15.354 1193 1HZ LYS 55 HZ1 LYS 55 -13.066 -6.314 14.081 1194 2HZ LYS 55 HZ2 LYS 55 -13.034 -7.602 15.110 1195 3HZ LYS 55 HZ3 LYS 55 -13.724 -7.760 13.619 1196 H LEU 56 H LEU 56 -16.592 -3.424 11.191 1197 HA LEU 56 HA LEU 56 -13.885 -2.998 11.920 1198 1HB LEU 56 HB2 LEU 56 -14.404 -4.058 9.921 1199 2HB LEU 56 HB3 LEU 56 -15.490 -2.792 9.370 1200 HG LEU 56 HG LEU 56 -12.627 -1.977 9.755 1201 1HD1 LEU 56 HD11 LEU 56 -13.637 -3.719 7.446 1202 2HD1 LEU 56 HD12 LEU 56 -12.084 -2.870 7.475 1203 3HD1 LEU 56 HD13 LEU 56 -12.400 -4.186 8.632 1204 1HD2 LEU 56 HD21 LEU 56 -13.133 -0.742 7.699 1205 2HD2 LEU 56 HD22 LEU 56 -14.725 -1.534 7.583 1206 3HD2 LEU 56 HD23 LEU 56 -14.399 -0.396 8.894 1207 H MET 57 H MET 57 -16.381 -0.663 10.851 1208 HA MET 57 HA MET 57 -14.777 1.669 10.865 1209 1HB MET 57 HB2 MET 57 -16.876 1.715 9.780 1210 2HB MET 57 HB3 MET 57 -17.722 1.171 11.227 1211 1HG MET 57 HG2 MET 57 -16.284 3.801 11.294 1212 2HG MET 57 HG3 MET 57 -17.861 3.674 10.527 1213 1HE MET 57 HE1 MET 57 -19.585 1.676 12.403 1214 2HE MET 57 HE2 MET 57 -20.290 2.902 13.464 1215 3HE MET 57 HE3 MET 57 -20.138 3.232 11.723 1216 H ASP 58 H ASP 58 -16.703 0.133 13.505 1217 HA ASP 58 HA ASP 58 -15.996 2.024 15.504 1218 1HB ASP 58 HB2 ASP 58 -17.746 0.346 15.818 1219 2HB ASP 58 HB3 ASP 58 -16.542 -0.949 15.834 1220 H ASP 59 H ASP 59 -14.391 -1.047 14.547 1221 HA ASP 59 HA ASP 59 -12.239 -0.860 16.366 1222 1HB ASP 59 HB2 ASP 59 -12.135 -2.060 13.560 1223 2HB ASP 59 HB3 ASP 59 -11.048 -2.421 14.905 1224 H LEU 60 H LEU 60 -12.582 0.630 13.170 1225 HA LEU 60 HA LEU 60 -9.916 1.787 13.119 1226 1HB LEU 60 HB2 LEU 60 -12.522 2.222 11.641 1227 2HB LEU 60 HB3 LEU 60 -11.196 3.364 11.432 1228 HG LEU 60 HG LEU 60 -10.628 0.420 11.124 1229 1HD1 LEU 60 HD11 LEU 60 -11.803 2.161 8.930 1230 2HD1 LEU 60 HD12 LEU 60 -11.183 0.516 8.733 1231 3HD1 LEU 60 HD13 LEU 60 -12.627 0.804 9.726 1232 1HD2 LEU 60 HD21 LEU 60 -9.009 1.318 9.446 1233 2HD2 LEU 60 HD22 LEU 60 -9.632 2.943 9.701 1234 3HD2 LEU 60 HD23 LEU 60 -8.776 2.113 11.025 1235 H ASP 61 H ASP 61 -13.147 3.184 13.892 1236 HA ASP 61 HA ASP 61 -12.032 5.709 14.555 1237 1HB ASP 61 HB2 ASP 61 -14.147 6.472 15.081 1238 2HB ASP 61 HB3 ASP 61 -14.345 5.360 13.730 1239 H ARG 62 H ARG 62 -12.447 2.879 16.515 1240 HA ARG 62 HA ARG 62 -12.279 3.362 19.096 1241 1HB ARG 62 HB2 ARG 62 -11.652 1.251 18.092 1242 2HB ARG 62 HB3 ARG 62 -10.262 2.023 17.317 1243 1HG ARG 62 HG2 ARG 62 -9.164 2.294 19.538 1244 2HG ARG 62 HG3 ARG 62 -10.567 1.554 20.325 1245 1HD ARG 62 HD2 ARG 62 -8.593 -0.027 19.895 1246 2HD ARG 62 HD3 ARG 62 -10.146 -0.558 19.246 1247 HE ARG 62 HE ARG 62 -9.445 -0.273 17.092 1248 1HH1 ARG 62 HH12 ARG 62 -6.934 1.189 19.134 1249 2HH1 ARG 62 HH11 ARG 62 -6.137 1.939 17.762 1250 1HH2 ARG 62 HH22 ARG 62 -8.531 0.785 15.447 1251 2HH2 ARG 62 HH21 ARG 62 -6.977 1.609 15.614 1252 H ASN 63 H ASN 63 -9.659 4.268 16.881 1253 HA ASN 63 HA ASN 63 -7.694 5.556 18.163 1254 1HB ASN 63 HB2 ASN 63 -7.881 5.681 15.793 1255 2HB ASN 63 HB3 ASN 63 -9.455 6.465 15.884 1256 1HD2 ASN 63 HD22 ASN 63 -9.534 8.663 15.702 1257 2HD2 ASN 63 HD21 ASN 63 -8.133 9.714 15.831 1258 H LYS 64 H LYS 64 -10.768 7.275 17.590 1259 HA LYS 64 HA LYS 64 -10.546 8.687 20.177 1260 1HB LYS 64 HB2 LYS 64 -10.491 10.179 17.523 1261 2HB LYS 64 HB3 LYS 64 -10.806 10.939 19.090 1262 1HG LYS 64 HG2 LYS 64 -8.599 10.258 19.924 1263 2HG LYS 64 HG3 LYS 64 -8.228 9.520 18.367 1264 1HD LYS 64 HD2 LYS 64 -8.590 11.766 17.255 1265 2HD LYS 64 HD3 LYS 64 -8.797 12.462 18.868 1266 1HE LYS 64 HE2 LYS 64 -6.503 12.827 18.177 1267 2HE LYS 64 HE3 LYS 64 -6.502 11.638 19.488 1268 1HZ LYS 64 HZ1 LYS 64 -5.058 10.996 17.719 1269 2HZ LYS 64 HZ2 LYS 64 -6.296 9.916 17.802 1270 3HZ LYS 64 HZ3 LYS 64 -6.276 11.056 16.614 1271 H ASP 65 H ASP 65 -12.351 6.765 18.770 1272 HA ASP 65 HA ASP 65 -14.429 6.192 18.649 1273 1HB ASP 65 HB2 ASP 65 -16.082 6.924 20.204 1274 2HB ASP 65 HB3 ASP 65 -14.522 6.673 20.987 1275 H GLN 66 H GLN 66 -14.685 9.729 18.527 1276 HA GLN 66 HA GLN 66 -16.853 9.816 16.651 1277 1HB GLN 66 HB2 GLN 66 -16.209 11.676 18.131 1278 2HB GLN 66 HB3 GLN 66 -14.641 11.814 17.321 1279 1HG GLN 66 HG2 GLN 66 -15.772 12.488 15.214 1280 2HG GLN 66 HG3 GLN 66 -17.346 12.262 15.993 1281 1HE2 GLN 66 HE22 GLN 66 -14.259 14.181 16.199 1282 2HE2 GLN 66 HE21 GLN 66 -15.049 15.560 16.939 1283 H GLU 67 H GLU 67 -13.328 9.510 16.309 1284 HA GLU 67 HA GLU 67 -13.564 9.379 13.377 1285 1HB GLU 67 HB2 GLU 67 -11.883 11.226 13.144 1286 2HB GLU 67 HB3 GLU 67 -13.398 11.763 13.878 1287 1HG GLU 67 HG2 GLU 67 -12.230 11.475 16.170 1288 2HG GLU 67 HG3 GLU 67 -10.731 11.265 15.253 1289 H VAL 68 H VAL 68 -11.774 8.746 12.314 1290 HA VAL 68 HA VAL 68 -9.823 6.999 13.681 1291 HB VAL 68 HB VAL 68 -10.094 7.448 10.692 1292 1HG1 VAL 68 HG11 VAL 68 -8.182 6.112 11.487 1293 2HG1 VAL 68 HG12 VAL 68 -9.282 5.024 12.354 1294 3HG1 VAL 68 HG13 VAL 68 -9.319 5.113 10.584 1295 1HG2 VAL 68 HG21 VAL 68 -11.650 5.557 10.512 1296 2HG2 VAL 68 HG22 VAL 68 -11.863 5.555 12.272 1297 3HG2 VAL 68 HG23 VAL 68 -12.400 6.940 11.299 1298 H ASN 69 H ASN 69 -7.542 7.420 13.222 1299 HA ASN 69 HA ASN 69 -6.866 10.092 12.085 1300 1HB ASN 69 HB2 ASN 69 -6.115 10.209 14.364 1301 2HB ASN 69 HB3 ASN 69 -5.603 8.513 14.344 1302 1HD2 ASN 69 HD22 ASN 69 -4.808 11.555 12.440 1303 2HD2 ASN 69 HD21 ASN 69 -3.090 11.234 12.528 1304 H PHE 70 H PHE 70 -5.104 10.070 10.646 1305 HA PHE 70 HA PHE 70 -4.832 8.028 8.833 1306 1HB PHE 70 HB2 PHE 70 -3.979 10.275 8.462 1307 2HB PHE 70 HB3 PHE 70 -2.753 10.059 9.713 1308 HD1 PHE 70 HD1 PHE 70 -0.644 9.062 9.190 1309 HD2 PHE 70 HD2 PHE 70 -3.949 8.661 6.447 1310 HE1 PHE 70 HE1 PHE 70 0.777 7.739 7.670 1311 HE2 PHE 70 HE2 PHE 70 -2.527 7.304 4.940 1312 HZ PHE 70 HZ PHE 70 -0.168 6.820 5.556 1313 H GLN 71 H GLN 71 -2.596 8.369 11.688 1314 HA GLN 71 HA GLN 71 -1.045 6.153 10.738 1315 1HB GLN 71 HB2 GLN 71 -0.264 7.951 12.299 1316 2HB GLN 71 HB3 GLN 71 -1.185 7.175 13.602 1317 1HG GLN 71 HG2 GLN 71 0.130 5.109 13.336 1318 2HG GLN 71 HG3 GLN 71 0.962 5.774 11.923 1319 1HE2 GLN 71 HE22 GLN 71 2.045 8.063 12.416 1320 2HE2 GLN 71 HE21 GLN 71 2.962 8.081 13.911 1321 H GLU 72 H GLU 72 -3.801 6.450 12.963 1322 HA GLU 72 HA GLU 72 -3.763 3.687 13.823 1323 1HB GLU 72 HB2 GLU 72 -5.842 5.895 13.934 1324 2HB GLU 72 HB3 GLU 72 -6.231 4.241 14.416 1325 1HG GLU 72 HG2 GLU 72 -3.904 5.832 15.590 1326 2HG GLU 72 HG3 GLU 72 -5.496 5.687 16.340 1327 H TYR 73 H TYR 73 -5.336 5.416 11.149 1328 HA TYR 73 HA TYR 73 -6.859 3.255 10.105 1329 1HB TYR 73 HB2 TYR 73 -7.376 5.270 9.166 1330 2HB TYR 73 HB3 TYR 73 -5.725 5.812 9.056 1331 HD1 TYR 73 HD1 TYR 73 -4.358 5.444 7.132 1332 HD2 TYR 73 HD2 TYR 73 -8.345 3.819 7.381 1333 HE1 TYR 73 HE1 TYR 73 -4.398 5.183 4.680 1334 HE2 TYR 73 HE2 TYR 73 -8.417 3.655 4.904 1335 HH TYR 73 HH TYR 73 -5.809 4.847 2.838 1336 H ILE 74 H ILE 74 -3.436 4.231 9.347 1337 HA ILE 74 HA ILE 74 -3.007 1.955 7.677 1338 HB ILE 74 HB ILE 74 -0.920 3.424 9.306 1339 1HG1 ILE 74 HG12 ILE 74 -2.199 4.948 7.757 1340 2HG1 ILE 74 HG13 ILE 74 -0.480 4.842 7.484 1341 1HG2 ILE 74 HG21 ILE 74 0.553 2.534 7.347 1342 2HG2 ILE 74 HG22 ILE 74 0.034 1.378 8.577 1343 3HG2 ILE 74 HG23 ILE 74 -0.782 1.438 7.002 1344 1HD1 ILE 74 HD11 ILE 74 -1.684 4.882 5.363 1345 2HD1 ILE 74 HD12 ILE 74 -0.832 3.356 5.537 1346 3HD1 ILE 74 HD13 ILE 74 -2.595 3.435 5.828 1347 H THR 75 H THR 75 -2.334 2.395 11.171 1348 HA THR 75 HA THR 75 -1.230 -0.085 11.819 1349 HB THR 75 HB THR 75 -3.288 1.444 13.477 1350 HG1 THR 75 HG1 THR 75 -1.577 2.798 12.837 1351 1HG2 THR 75 HG21 THR 75 -2.668 -0.808 14.410 1352 2HG2 THR 75 HG22 THR 75 -0.972 -0.254 14.442 1353 3HG2 THR 75 HG23 THR 75 -2.191 0.570 15.418 1354 H PHE 76 H PHE 76 -4.696 0.799 11.703 1355 HA PHE 76 HA PHE 76 -5.730 -1.779 12.291 1356 1HB PHE 76 HB2 PHE 76 -7.066 0.261 12.512 1357 2HB PHE 76 HB3 PHE 76 -6.964 0.539 10.773 1358 HD1 PHE 76 HD1 PHE 76 -8.351 -1.721 13.403 1359 HD2 PHE 76 HD2 PHE 76 -8.257 -0.819 9.184 1360 HE1 PHE 76 HE1 PHE 76 -10.061 -3.468 12.971 1361 HE2 PHE 76 HE2 PHE 76 -10.116 -2.382 8.806 1362 HZ PHE 76 HZ PHE 76 -10.975 -3.781 10.684 1363 H LEU 77 H LEU 77 -5.093 -0.141 9.101 1364 HA LEU 77 HA LEU 77 -5.986 -2.336 7.531 1365 1HB LEU 77 HB2 LEU 77 -3.884 -0.216 6.985 1366 2HB LEU 77 HB3 LEU 77 -4.332 -1.444 5.804 1367 HG LEU 77 HG LEU 77 -6.317 0.530 7.022 1368 1HD1 LEU 77 HD11 LEU 77 -4.688 1.703 5.621 1369 2HD1 LEU 77 HD12 LEU 77 -4.908 0.502 4.322 1370 3HD1 LEU 77 HD13 LEU 77 -6.239 1.581 4.769 1371 1HD2 LEU 77 HD21 LEU 77 -7.717 -0.203 5.054 1372 2HD2 LEU 77 HD22 LEU 77 -6.540 -1.500 4.754 1373 3HD2 LEU 77 HD23 LEU 77 -7.490 -1.460 6.261 1374 H GLY 78 H GLY 78 -2.897 -1.849 9.229 1375 1HA GLY 78 HA2 GLY 78 -1.580 -4.183 8.296 1376 2HA GLY 78 HA3 GLY 78 -1.393 -3.474 9.916 1377 H ALA 79 H ALA 79 -3.912 -3.819 11.004 1378 HA ALA 79 HA ALA 79 -3.909 -6.605 11.708 1379 1HB ALA 79 HB1 ALA 79 -4.758 -4.830 13.213 1380 2HB ALA 79 HB2 ALA 79 -6.133 -4.556 12.120 1381 3HB ALA 79 HB3 ALA 79 -5.951 -6.115 12.942 1382 H LEU 80 H LEU 80 -6.060 -4.684 9.587 1383 HA LEU 80 HA LEU 80 -7.818 -6.667 8.737 1384 1HB LEU 80 HB2 LEU 80 -7.790 -4.129 8.196 1385 2HB LEU 80 HB3 LEU 80 -6.631 -4.526 6.934 1386 HG LEU 80 HG LEU 80 -8.395 -6.185 6.045 1387 1HD1 LEU 80 HD11 LEU 80 -9.922 -6.191 8.010 1388 2HD1 LEU 80 HD12 LEU 80 -10.140 -4.437 7.839 1389 3HD1 LEU 80 HD13 LEU 80 -10.752 -5.533 6.588 1390 1HD2 LEU 80 HD21 LEU 80 -9.005 -3.202 5.993 1391 2HD2 LEU 80 HD22 LEU 80 -7.811 -4.024 4.958 1392 3HD2 LEU 80 HD23 LEU 80 -9.535 -4.396 4.796 1393 H ALA 81 H ALA 81 -4.658 -5.751 7.331 1394 HA ALA 81 HA ALA 81 -4.568 -7.675 5.248 1395 1HB ALA 81 HB1 ALA 81 -3.075 -5.805 5.226 1396 2HB ALA 81 HB2 ALA 81 -2.395 -6.230 6.805 1397 3HB ALA 81 HB3 ALA 81 -2.094 -7.282 5.411 1398 H MET 82 H MET 82 -3.331 -7.822 8.643 1399 HA MET 82 HA MET 82 -2.240 -10.427 8.342 1400 1HB MET 82 HB2 MET 82 -1.737 -8.723 10.144 1401 2HB MET 82 HB3 MET 82 -3.244 -9.200 10.938 1402 1HG MET 82 HG2 MET 82 -2.415 -11.429 11.322 1403 2HG MET 82 HG3 MET 82 -1.096 -11.220 10.165 1404 1HE MET 82 HE1 MET 82 -2.444 -10.155 13.697 1405 2HE MET 82 HE2 MET 82 -1.093 -9.161 14.293 1406 3HE MET 82 HE3 MET 82 -2.095 -8.575 12.949 1407 H ILE 83 H ILE 83 -5.464 -9.325 9.287 1408 HA ILE 83 HA ILE 83 -6.592 -11.897 9.879 1409 HB ILE 83 HB ILE 83 -7.802 -9.228 9.089 1410 1HG1 ILE 83 HG12 ILE 83 -7.946 -10.736 11.732 1411 2HG1 ILE 83 HG13 ILE 83 -6.624 -9.631 11.368 1412 1HG2 ILE 83 HG21 ILE 83 -9.241 -11.794 9.886 1413 2HG2 ILE 83 HG22 ILE 83 -10.001 -10.193 9.782 1414 3HG2 ILE 83 HG23 ILE 83 -9.373 -10.950 8.328 1415 1HD1 ILE 83 HD11 ILE 83 -9.565 -8.865 11.522 1416 2HD1 ILE 83 HD12 ILE 83 -8.270 -8.444 12.651 1417 3HD1 ILE 83 HD13 ILE 83 -8.253 -7.782 11.007 1418 H TYR 84 H TYR 84 -6.322 -9.993 6.829 1419 HA TYR 84 HA TYR 84 -7.471 -12.124 5.172 1420 1HB TYR 84 HB2 TYR 84 -5.625 -9.829 4.419 1421 2HB TYR 84 HB3 TYR 84 -6.568 -10.821 3.313 1422 HD1 TYR 84 HD1 TYR 84 -9.087 -10.518 5.499 1423 HD2 TYR 84 HD2 TYR 84 -6.558 -7.954 3.122 1424 HE1 TYR 84 HE1 TYR 84 -10.929 -8.904 5.289 1425 HE2 TYR 84 HE2 TYR 84 -8.444 -6.346 2.875 1426 HH TYR 84 HH TYR 84 -11.645 -6.930 4.351 1427 H ASN 85 H ASN 85 -5.879 -13.489 6.777 1428 HA ASN 85 HA ASN 85 -3.163 -13.396 6.392 1429 1HB ASN 85 HB2 ASN 85 -4.684 -14.649 8.163 1430 2HB ASN 85 HB3 ASN 85 -4.459 -16.035 7.088 1431 1HD2 ASN 85 HD22 ASN 85 -2.815 -13.499 8.982 1432 2HD2 ASN 85 HD21 ASN 85 -1.305 -14.418 9.221 1433 H GLU 86 H GLU 86 -5.491 -15.060 4.408 1434 HA GLU 86 HA GLU 86 -3.941 -16.832 2.914 1435 1HB GLU 86 HB2 GLU 86 -6.398 -16.418 2.731 1436 2HB GLU 86 HB3 GLU 86 -6.073 -14.923 1.846 1437 1HG GLU 86 HG2 GLU 86 -5.157 -17.713 0.974 1438 2HG GLU 86 HG3 GLU 86 -6.663 -16.953 0.448 1439 H ALA 87 H ALA 87 -4.073 -13.241 2.726 1440 HA ALA 87 HA ALA 87 -2.523 -12.984 0.342 1441 1HB ALA 87 HB1 ALA 87 -2.811 -11.049 2.675 1442 2HB ALA 87 HB2 ALA 87 -2.272 -10.657 1.026 1443 3HB ALA 87 HB3 ALA 87 -3.941 -11.191 1.309 1444 H LEU 88 H LEU 88 -1.624 -13.457 3.753 1445 HA LEU 88 HA LEU 88 1.225 -12.880 3.299 1446 1HB LEU 88 HB2 LEU 88 -0.358 -14.013 5.637 1447 2HB LEU 88 HB3 LEU 88 1.398 -13.944 5.632 1448 HG LEU 88 HG LEU 88 -0.158 -11.425 5.023 1449 1HD1 LEU 88 HD11 LEU 88 0.411 -12.489 7.815 1450 2HD1 LEU 88 HD12 LEU 88 -0.147 -10.857 7.413 1451 3HD1 LEU 88 HD13 LEU 88 -1.188 -12.254 7.078 1452 1HD2 LEU 88 HD21 LEU 88 2.455 -11.912 6.536 1453 2HD2 LEU 88 HD22 LEU 88 2.377 -11.546 4.803 1454 3HD2 LEU 88 HD23 LEU 88 1.810 -10.355 5.984 1455 H LYS 89 H LYS 89 -0.846 -15.776 3.854 1456 HA LYS 89 HA LYS 89 1.211 -17.705 3.628 1457 1HB LYS 89 HB2 LYS 89 -1.731 -17.899 2.846 1458 2HB LYS 89 HB3 LYS 89 -0.606 -19.261 2.920 1459 1HG LYS 89 HG2 LYS 89 -0.172 -18.730 5.340 1460 2HG LYS 89 HG3 LYS 89 -1.461 -17.512 5.268 1461 1HD LYS 89 HD2 LYS 89 -3.083 -19.279 4.572 1462 2HD LYS 89 HD3 LYS 89 -1.776 -20.471 4.551 1463 1HE LYS 89 HE2 LYS 89 -2.995 -20.786 6.588 1464 2HE LYS 89 HE3 LYS 89 -1.416 -20.103 7.007 1465 1HZ LYS 89 HZ1 LYS 89 -3.216 -19.070 8.188 1466 2HZ LYS 89 HZ2 LYS 89 -2.473 -17.967 7.221 1467 3HZ LYS 89 HZ3 LYS 89 -3.933 -18.598 6.781 1468 H GLY 90 H GLY 90 -0.835 -16.294 1.042 1469 1HA GLY 90 HA2 GLY 90 -0.601 -16.259 -1.231 1470 2HA GLY 90 HA3 GLY 90 1.135 -16.558 -1.015 Start of MODEL 6 1 1H MET 1 H1 MET 1 -12.727 -4.612 -7.380 2 2H MET 1 H2 MET 1 -13.044 -3.068 -7.839 3 3H MET 1 H3 MET 1 -14.152 -4.250 -8.149 4 HA MET 1 HA MET 1 -14.821 -2.848 -6.334 5 1HB MET 1 HB2 MET 1 -14.093 -5.699 -5.536 6 2HB MET 1 HB3 MET 1 -15.175 -4.621 -4.622 7 1HG MET 1 HG2 MET 1 -16.707 -4.495 -6.537 8 2HG MET 1 HG3 MET 1 -15.618 -5.502 -7.498 9 1HE MET 1 HE1 MET 1 -18.228 -5.427 -4.600 10 2HE MET 1 HE2 MET 1 -18.149 -7.096 -3.991 11 3HE MET 1 HE3 MET 1 -16.789 -5.988 -3.708 12 H ALA 2 H ALA 2 -13.089 -4.656 -4.018 13 HA ALA 2 HA ALA 2 -11.593 -2.366 -3.080 14 1HB ALA 2 HB1 ALA 2 -10.737 -3.991 -1.400 15 2HB ALA 2 HB2 ALA 2 -12.507 -4.036 -1.536 16 3HB ALA 2 HB3 ALA 2 -11.526 -5.309 -2.289 17 H SER 3 H SER 3 -10.953 -4.424 -5.679 18 HA SER 3 HA SER 3 -8.490 -5.275 -5.660 19 1HB SER 3 HB2 SER 3 -9.328 -3.761 -8.108 20 2HB SER 3 HB3 SER 3 -8.678 -5.392 -7.920 21 HG SER 3 HG SER 3 -10.895 -5.510 -8.357 22 HA PRO 4 HA PRO 4 -6.510 -0.989 -6.805 23 1HB PRO 4 HB2 PRO 4 -8.344 0.839 -5.260 24 2HB PRO 4 HB3 PRO 4 -7.448 1.172 -6.769 25 1HG PRO 4 HG2 PRO 4 -10.102 0.637 -6.875 26 2HG PRO 4 HG3 PRO 4 -9.006 -0.167 -8.045 27 1HD PRO 4 HD2 PRO 4 -10.033 -1.237 -5.410 28 2HD PRO 4 HD3 PRO 4 -10.135 -2.012 -7.012 29 H LEU 5 H LEU 5 -8.118 -1.449 -3.615 30 HA LEU 5 HA LEU 5 -5.737 -0.391 -2.248 31 1HB LEU 5 HB2 LEU 5 -7.946 0.057 -1.281 32 2HB LEU 5 HB3 LEU 5 -8.259 -1.681 -1.141 33 HG LEU 5 HG LEU 5 -6.351 -1.919 0.431 34 1HD1 LEU 5 HD11 LEU 5 -5.309 0.090 1.386 35 2HD1 LEU 5 HD12 LEU 5 -4.858 -0.093 -0.302 36 3HD1 LEU 5 HD13 LEU 5 -6.082 1.118 0.162 37 1HD2 LEU 5 HD21 LEU 5 -7.283 -0.628 2.311 38 2HD2 LEU 5 HD22 LEU 5 -8.286 0.296 1.177 39 3HD2 LEU 5 HD23 LEU 5 -8.533 -1.468 1.380 40 H ASP 6 H ASP 6 -7.446 -3.462 -2.804 41 HA ASP 6 HA ASP 6 -5.939 -5.208 -1.269 42 1HB ASP 6 HB2 ASP 6 -7.046 -5.768 -4.045 43 2HB ASP 6 HB3 ASP 6 -6.537 -6.982 -2.874 44 H GLN 7 H GLN 7 -5.183 -4.141 -4.654 45 HA GLN 7 HA GLN 7 -2.812 -5.729 -4.804 46 1HB GLN 7 HB2 GLN 7 -2.204 -4.398 -6.720 47 2HB GLN 7 HB3 GLN 7 -3.925 -4.798 -6.744 48 1HG GLN 7 HG2 GLN 7 -4.286 -2.454 -5.682 49 2HG GLN 7 HG3 GLN 7 -2.617 -2.107 -6.132 50 1HE2 GLN 7 HE22 GLN 7 -5.718 -3.323 -7.412 51 2HE2 GLN 7 HE21 GLN 7 -5.520 -2.656 -9.043 52 H ALA 8 H ALA 8 -3.359 -2.505 -3.362 53 HA ALA 8 HA ALA 8 -0.540 -1.855 -3.204 54 1HB ALA 8 HB1 ALA 8 -2.085 -0.084 -3.275 55 2HB ALA 8 HB2 ALA 8 -2.972 -0.658 -1.840 56 3HB ALA 8 HB3 ALA 8 -1.308 -0.062 -1.682 57 H ILE 9 H ILE 9 -3.007 -2.984 -0.775 58 HA ILE 9 HA ILE 9 -1.015 -3.336 1.287 59 HB ILE 9 HB ILE 9 -2.599 -4.720 2.468 60 1HG1 ILE 9 HG12 ILE 9 -4.368 -4.499 0.035 61 2HG1 ILE 9 HG13 ILE 9 -3.633 -5.987 0.663 62 1HG2 ILE 9 HG21 ILE 9 -4.212 -2.966 2.878 63 2HG2 ILE 9 HG22 ILE 9 -2.670 -2.216 2.480 64 3HG2 ILE 9 HG23 ILE 9 -3.957 -2.282 1.258 65 1HD1 ILE 9 HD11 ILE 9 -5.795 -4.329 2.013 66 2HD1 ILE 9 HD12 ILE 9 -5.911 -5.966 1.361 67 3HD1 ILE 9 HD13 ILE 9 -4.919 -5.664 2.800 68 H GLY 10 H GLY 10 -2.279 -5.471 -1.259 69 1HA GLY 10 HA2 GLY 10 -0.877 -7.824 -0.942 70 2HA GLY 10 HA3 GLY 10 -1.236 -7.049 -2.493 71 H LEU 11 H LEU 11 0.334 -4.780 -2.478 72 HA LEU 11 HA LEU 11 2.881 -5.704 -3.153 73 1HB LEU 11 HB2 LEU 11 1.643 -3.450 -3.672 74 2HB LEU 11 HB3 LEU 11 2.339 -2.884 -2.161 75 HG LEU 11 HG LEU 11 3.672 -2.078 -3.905 76 1HD1 LEU 11 HD11 LEU 11 5.283 -4.409 -2.867 77 2HD1 LEU 11 HD12 LEU 11 5.850 -2.827 -3.419 78 3HD1 LEU 11 HD13 LEU 11 4.909 -2.941 -1.920 79 1HD2 LEU 11 HD21 LEU 11 2.934 -3.563 -5.673 80 2HD2 LEU 11 HD22 LEU 11 4.700 -3.390 -5.648 81 3HD2 LEU 11 HD23 LEU 11 3.950 -4.878 -5.028 82 H LEU 12 H LEU 12 1.997 -3.854 -0.198 83 HA LEU 12 HA LEU 12 4.472 -4.037 1.147 84 1HB LEU 12 HB2 LEU 12 1.574 -3.912 2.143 85 2HB LEU 12 HB3 LEU 12 2.934 -4.016 3.254 86 HG LEU 12 HG LEU 12 3.897 -1.962 2.348 87 1HD1 LEU 12 HD11 LEU 12 2.859 -1.872 0.087 88 2HD1 LEU 12 HD12 LEU 12 1.255 -1.696 0.845 89 3HD1 LEU 12 HD13 LEU 12 2.470 -0.420 1.009 90 1HD2 LEU 12 HD21 LEU 12 2.227 -0.433 3.394 91 2HD2 LEU 12 HD22 LEU 12 1.050 -1.763 3.402 92 3HD2 LEU 12 HD23 LEU 12 2.545 -1.873 4.360 93 H ILE 13 H ILE 13 1.717 -6.299 1.201 94 HA ILE 13 HA ILE 13 2.852 -8.078 3.138 95 HB ILE 13 HB ILE 13 0.744 -8.479 0.970 96 1HG1 ILE 13 HG12 ILE 13 0.268 -8.249 3.962 97 2HG1 ILE 13 HG13 ILE 13 0.375 -6.800 2.972 98 1HG2 ILE 13 HG21 ILE 13 1.621 -10.693 1.626 99 2HG2 ILE 13 HG22 ILE 13 1.416 -10.265 3.342 100 3HG2 ILE 13 HG23 ILE 13 0.006 -10.457 2.286 101 1HD1 ILE 13 HD11 ILE 13 -1.931 -7.295 3.097 102 2HD1 ILE 13 HD12 ILE 13 -1.452 -7.825 1.481 103 3HD1 ILE 13 HD13 ILE 13 -1.685 -9.019 2.776 104 H GLY 14 H GLY 14 2.834 -8.104 -0.419 105 1HA GLY 14 HA2 GLY 14 4.159 -10.544 -0.877 106 2HA GLY 14 HA3 GLY 14 4.114 -9.146 -1.971 107 H ILE 15 H ILE 15 5.477 -7.158 -0.699 108 HA ILE 15 HA ILE 15 8.211 -7.834 -1.046 109 HB ILE 15 HB ILE 15 6.668 -5.523 0.100 110 1HG1 ILE 15 HG12 ILE 15 8.963 -5.820 -1.890 111 2HG1 ILE 15 HG13 ILE 15 7.241 -5.782 -2.305 112 1HG2 ILE 15 HG21 ILE 15 8.334 -5.740 1.819 113 2HG2 ILE 15 HG22 ILE 15 9.638 -5.915 0.618 114 3HG2 ILE 15 HG23 ILE 15 8.759 -4.379 0.813 115 1HD1 ILE 15 HD11 ILE 15 8.945 -3.505 -1.220 116 2HD1 ILE 15 HD12 ILE 15 8.083 -3.601 -2.757 117 3HD1 ILE 15 HD13 ILE 15 7.170 -3.451 -1.241 118 H PHE 16 H PHE 16 6.294 -7.413 1.949 119 HA PHE 16 HA PHE 16 8.310 -8.052 3.740 120 1HB PHE 16 HB2 PHE 16 6.030 -7.186 4.255 121 2HB PHE 16 HB3 PHE 16 5.352 -8.776 3.972 122 HD1 PHE 16 HD1 PHE 16 5.994 -10.702 5.491 123 HD2 PHE 16 HD2 PHE 16 7.379 -6.704 6.243 124 HE1 PHE 16 HE1 PHE 16 6.438 -11.300 7.798 125 HE2 PHE 16 HE2 PHE 16 7.712 -7.272 8.641 126 HZ PHE 16 HZ PHE 16 7.177 -9.533 9.446 127 H HIS 17 H HIS 17 5.910 -10.393 2.378 128 HA HIS 17 HA HIS 17 7.117 -12.549 3.804 129 1HB HIS 17 HB2 HIS 17 5.065 -12.511 1.583 130 2HB HIS 17 HB3 HIS 17 5.631 -13.995 2.370 131 HD1 HIS 17 HD1 HIS 17 3.750 -10.780 3.236 132 HD2 HIS 17 HD2 HIS 17 5.109 -14.331 5.005 133 HE1 HIS 17 HE1 HIS 17 2.863 -10.791 5.639 134 H LYS 18 H LYS 18 7.791 -11.244 0.566 135 HA LYS 18 HA LYS 18 9.403 -13.465 -0.313 136 1HB LYS 18 HB2 LYS 18 9.552 -10.486 -0.875 137 2HB LYS 18 HB3 LYS 18 10.683 -11.657 -1.572 138 1HG LYS 18 HG2 LYS 18 8.799 -12.944 -2.537 139 2HG LYS 18 HG3 LYS 18 7.657 -11.736 -1.950 140 1HD LYS 18 HD2 LYS 18 9.939 -11.257 -3.933 141 2HD LYS 18 HD3 LYS 18 8.226 -11.437 -4.342 142 1HE LYS 18 HE2 LYS 18 7.715 -9.407 -2.950 143 2HE LYS 18 HE3 LYS 18 9.459 -9.178 -2.696 144 1HZ LYS 18 HZ1 LYS 18 8.101 -9.173 -5.291 145 2HZ LYS 18 HZ2 LYS 18 8.658 -7.852 -4.477 146 3HZ LYS 18 HZ3 LYS 18 9.720 -8.974 -5.048 147 H TYR 19 H TYR 19 10.162 -10.594 1.750 148 HA TYR 19 HA TYR 19 12.887 -11.515 2.153 149 1HB TYR 19 HB2 TYR 19 11.248 -9.402 3.554 150 2HB TYR 19 HB3 TYR 19 12.883 -9.850 4.054 151 HD1 TYR 19 HD1 TYR 19 10.975 -8.035 1.520 152 HD2 TYR 19 HD2 TYR 19 14.855 -9.488 2.617 153 HE1 TYR 19 HE1 TYR 19 11.823 -7.363 -0.691 154 HE2 TYR 19 HE2 TYR 19 15.783 -8.575 0.510 155 HH TYR 19 HH TYR 19 13.669 -7.240 -2.071 156 H SER 20 H SER 20 9.879 -11.858 4.180 157 HA SER 20 HA SER 20 11.020 -13.288 6.275 158 1HB SER 20 HB2 SER 20 8.383 -13.998 4.942 159 2HB SER 20 HB3 SER 20 8.902 -14.398 6.582 160 HG SER 20 HG SER 20 8.930 -12.235 7.108 161 H GLY 21 H GLY 21 10.012 -14.617 3.088 162 1HA GLY 21 HA2 GLY 21 10.502 -17.298 3.351 163 2HA GLY 21 HA3 GLY 21 10.876 -16.363 1.896 164 H LYS 22 H LYS 22 12.999 -14.761 3.275 165 HA LYS 22 HA LYS 22 15.274 -16.340 2.657 166 1HB LYS 22 HB2 LYS 22 14.969 -13.859 2.646 167 2HB LYS 22 HB3 LYS 22 15.051 -13.885 4.421 168 1HG LYS 22 HG2 LYS 22 17.342 -14.881 4.236 169 2HG LYS 22 HG3 LYS 22 17.263 -14.619 2.482 170 1HD LYS 22 HD2 LYS 22 17.260 -12.575 4.739 171 2HD LYS 22 HD3 LYS 22 18.430 -12.707 3.426 172 1HE LYS 22 HE2 LYS 22 15.519 -11.794 3.150 173 2HE LYS 22 HE3 LYS 22 16.941 -10.766 3.144 174 1HZ LYS 22 HZ1 LYS 22 16.431 -12.875 1.171 175 2HZ LYS 22 HZ2 LYS 22 16.148 -11.267 0.942 176 3HZ LYS 22 HZ3 LYS 22 17.690 -11.801 1.169 177 H GLU 23 H GLU 23 13.533 -15.749 5.704 178 HA GLU 23 HA GLU 23 15.474 -17.444 7.222 179 1HB GLU 23 HB2 GLU 23 14.328 -16.558 9.240 180 2HB GLU 23 HB3 GLU 23 15.242 -15.377 8.295 181 1HG GLU 23 HG2 GLU 23 13.177 -14.496 7.315 182 2HG GLU 23 HG3 GLU 23 12.208 -15.675 8.212 183 H GLY 24 H GLY 24 11.970 -17.047 6.522 184 1HA GLY 24 HA2 GLY 24 11.325 -19.680 6.087 185 2HA GLY 24 HA3 GLY 24 11.164 -19.474 7.850 186 H ASP 25 H ASP 25 8.864 -20.001 6.301 187 HA ASP 25 HA ASP 25 7.568 -17.518 5.507 188 1HB ASP 25 HB2 ASP 25 5.700 -18.931 4.918 189 2HB ASP 25 HB3 ASP 25 7.201 -19.611 4.282 190 H LYS 26 H LYS 26 8.276 -17.002 7.997 191 HA LYS 26 HA LYS 26 5.872 -17.290 9.740 192 1HB LYS 26 HB2 LYS 26 8.093 -17.901 10.693 193 2HB LYS 26 HB3 LYS 26 8.683 -16.266 10.350 194 1HG LYS 26 HG2 LYS 26 7.064 -15.315 11.935 195 2HG LYS 26 HG3 LYS 26 6.309 -16.907 12.164 196 1HD LYS 26 HD2 LYS 26 8.377 -17.810 13.102 197 2HD LYS 26 HD3 LYS 26 9.228 -16.284 12.834 198 1HE LYS 26 HE2 LYS 26 6.736 -16.505 14.590 199 2HE LYS 26 HE3 LYS 26 8.376 -16.742 15.212 200 1HZ LYS 26 HZ1 LYS 26 8.947 -14.564 14.575 201 2HZ LYS 26 HZ2 LYS 26 7.483 -14.278 13.883 202 3HZ LYS 26 HZ3 LYS 26 7.600 -14.504 15.512 203 H HIS 27 H HIS 27 4.839 -15.302 10.353 204 HA HIS 27 HA HIS 27 5.063 -13.168 8.376 205 1HB HIS 27 HB2 HIS 27 3.302 -13.411 10.840 206 2HB HIS 27 HB3 HIS 27 3.095 -12.275 9.497 207 HD1 HIS 27 HD1 HIS 27 3.311 -14.003 6.990 208 HD2 HIS 27 HD2 HIS 27 1.611 -15.394 10.582 209 HE1 HIS 27 HE1 HIS 27 2.005 -16.114 6.411 210 H THR 28 H THR 28 7.464 -13.092 9.217 211 HA THR 28 HA THR 28 7.826 -10.824 11.035 212 HB THR 28 HB THR 28 8.841 -13.624 11.641 213 HG1 THR 28 HG1 THR 28 6.618 -12.198 12.377 214 1HG2 THR 28 HG21 THR 28 9.630 -12.636 13.757 215 2HG2 THR 28 HG22 THR 28 10.492 -11.976 12.375 216 3HG2 THR 28 HG23 THR 28 9.209 -11.013 13.162 217 H LEU 29 H LEU 29 9.967 -10.013 10.917 218 HA LEU 29 HA LEU 29 11.892 -11.298 9.035 219 1HB LEU 29 HB2 LEU 29 11.589 -8.293 9.367 220 2HB LEU 29 HB3 LEU 29 12.672 -9.124 8.267 221 HG LEU 29 HG LEU 29 9.641 -9.205 8.048 222 1HD1 LEU 29 HD11 LEU 29 9.937 -7.550 6.217 223 2HD1 LEU 29 HD12 LEU 29 10.422 -6.894 7.791 224 3HD1 LEU 29 HD13 LEU 29 11.660 -7.420 6.626 225 1HD2 LEU 29 HD21 LEU 29 11.833 -9.896 6.062 226 2HD2 LEU 29 HD22 LEU 29 10.805 -11.060 6.917 227 3HD2 LEU 29 HD23 LEU 29 10.084 -9.941 5.752 228 H SER 30 H SER 30 14.111 -10.858 9.699 229 HA SER 30 HA SER 30 14.432 -10.014 12.559 230 1HB SER 30 HB2 SER 30 16.422 -11.354 10.660 231 2HB SER 30 HB3 SER 30 16.623 -11.084 12.403 232 HG SER 30 HG SER 30 14.693 -12.739 11.133 233 H LYS 31 H LYS 31 16.699 -8.861 12.817 234 HA LYS 31 HA LYS 31 16.252 -6.240 12.022 235 1HB LYS 31 HB2 LYS 31 18.779 -7.666 13.030 236 2HB LYS 31 HB3 LYS 31 18.619 -5.917 12.944 237 1HG LYS 31 HG2 LYS 31 16.609 -6.095 14.473 238 2HG LYS 31 HG3 LYS 31 16.926 -7.829 14.622 239 1HD LYS 31 HD2 LYS 31 19.234 -7.302 15.469 240 2HD LYS 31 HD3 LYS 31 18.816 -5.574 15.420 241 1HE LYS 31 HE2 LYS 31 16.941 -5.990 17.000 242 2HE LYS 31 HE3 LYS 31 17.358 -7.713 17.047 243 1HZ LYS 31 HZ1 LYS 31 18.243 -6.520 18.898 244 2HZ LYS 31 HZ2 LYS 31 19.474 -7.102 17.969 245 3HZ LYS 31 HZ3 LYS 31 19.082 -5.500 17.913 246 H LYS 32 H LYS 32 19.060 -8.191 11.015 247 HA LYS 32 HA LYS 32 19.906 -6.323 9.031 248 1HB LYS 32 HB2 LYS 32 21.365 -7.853 10.133 249 2HB LYS 32 HB3 LYS 32 20.589 -9.267 9.420 250 1HG LYS 32 HG2 LYS 32 22.036 -7.057 7.866 251 2HG LYS 32 HG3 LYS 32 22.818 -8.513 8.471 252 1HD LYS 32 HD2 LYS 32 20.763 -8.362 6.234 253 2HD LYS 32 HD3 LYS 32 22.449 -8.832 6.172 254 1HE LYS 32 HE2 LYS 32 21.897 -10.808 7.675 255 2HE LYS 32 HE3 LYS 32 20.180 -10.393 7.477 256 1HZ LYS 32 HZ1 LYS 32 22.042 -11.074 5.322 257 2HZ LYS 32 HZ2 LYS 32 20.844 -12.030 5.920 258 3HZ LYS 32 HZ3 LYS 32 20.467 -10.645 5.109 259 H GLU 33 H GLU 33 17.747 -9.134 8.907 260 HA GLU 33 HA GLU 33 17.455 -9.299 6.086 261 1HB GLU 33 HB2 GLU 33 16.724 -11.016 7.695 262 2HB GLU 33 HB3 GLU 33 15.436 -9.938 8.274 263 1HG GLU 33 HG2 GLU 33 14.354 -9.964 6.090 264 2HG GLU 33 HG3 GLU 33 15.709 -10.860 5.387 265 H LEU 34 H LEU 34 15.615 -7.367 8.546 266 HA LEU 34 HA LEU 34 13.907 -6.084 6.684 267 1HB LEU 34 HB2 LEU 34 13.508 -5.972 9.052 268 2HB LEU 34 HB3 LEU 34 15.031 -5.155 9.362 269 HG LEU 34 HG LEU 34 13.058 -3.702 9.504 270 1HD1 LEU 34 HD11 LEU 34 14.032 -1.793 8.662 271 2HD1 LEU 34 HD12 LEU 34 15.422 -2.877 8.792 272 3HD1 LEU 34 HD13 LEU 34 14.656 -2.581 7.223 273 1HD2 LEU 34 HD21 LEU 34 12.819 -4.059 6.488 274 2HD2 LEU 34 HD22 LEU 34 11.715 -4.738 7.707 275 3HD2 LEU 34 HD23 LEU 34 11.848 -2.982 7.490 276 H LYS 35 H LYS 35 17.187 -5.136 7.914 277 HA LYS 35 HA LYS 35 17.272 -2.803 6.319 278 1HB LYS 35 HB2 LYS 35 18.836 -3.231 8.138 279 2HB LYS 35 HB3 LYS 35 19.665 -4.480 7.184 280 1HG LYS 35 HG2 LYS 35 20.442 -2.907 5.584 281 2HG LYS 35 HG3 LYS 35 19.247 -1.690 6.062 282 1HD LYS 35 HD2 LYS 35 20.375 -1.443 8.271 283 2HD LYS 35 HD3 LYS 35 21.658 -2.540 7.723 284 1HE LYS 35 HE2 LYS 35 20.836 0.090 6.384 285 2HE LYS 35 HE3 LYS 35 22.232 -0.110 7.446 286 1HZ LYS 35 HZ1 LYS 35 21.874 -1.486 4.880 287 2HZ LYS 35 HZ2 LYS 35 22.916 -0.246 5.182 288 3HZ LYS 35 HZ3 LYS 35 23.136 -1.700 5.914 289 H GLU 36 H GLU 36 18.078 -6.157 5.467 290 HA GLU 36 HA GLU 36 19.080 -5.683 2.863 291 1HB GLU 36 HB2 GLU 36 19.129 -7.809 4.263 292 2HB GLU 36 HB3 GLU 36 17.483 -8.135 3.700 293 1HG GLU 36 HG2 GLU 36 18.252 -8.143 1.366 294 2HG GLU 36 HG3 GLU 36 19.899 -7.727 1.883 295 H LEU 37 H LEU 37 15.713 -6.385 3.953 296 HA LEU 37 HA LEU 37 14.342 -6.019 1.536 297 1HB LEU 37 HB2 LEU 37 13.271 -6.741 3.609 298 2HB LEU 37 HB3 LEU 37 13.502 -5.190 4.362 299 HG LEU 37 HG LEU 37 11.806 -5.436 1.878 300 1HD1 LEU 37 HD11 LEU 37 10.914 -5.635 4.796 301 2HD1 LEU 37 HD12 LEU 37 9.853 -5.605 3.378 302 3HD1 LEU 37 HD13 LEU 37 10.919 -6.986 3.642 303 1HD2 LEU 37 HD21 LEU 37 12.318 -3.089 2.497 304 2HD2 LEU 37 HD22 LEU 37 10.657 -3.457 2.935 305 3HD2 LEU 37 HD23 LEU 37 11.900 -3.424 4.194 306 H ILE 38 H ILE 38 15.280 -3.438 3.861 307 HA ILE 38 HA ILE 38 14.266 -1.376 2.164 308 HB ILE 38 HB ILE 38 16.227 -1.403 4.469 309 1HG1 ILE 38 HG12 ILE 38 13.369 -0.392 4.003 310 2HG1 ILE 38 HG13 ILE 38 13.831 -1.882 4.839 311 1HG2 ILE 38 HG21 ILE 38 16.091 1.095 4.460 312 2HG2 ILE 38 HG22 ILE 38 17.000 0.457 3.101 313 3HG2 ILE 38 HG23 ILE 38 15.335 1.019 2.859 314 1HD1 ILE 38 HD11 ILE 38 15.078 -0.425 6.508 315 2HD1 ILE 38 HD12 ILE 38 14.249 0.963 5.755 316 3HD1 ILE 38 HD13 ILE 38 13.300 -0.348 6.496 317 H GLN 39 H GLN 39 17.633 -2.616 2.418 318 HA GLN 39 HA GLN 39 18.652 -0.755 0.505 319 1HB GLN 39 HB2 GLN 39 19.642 -3.497 1.362 320 2HB GLN 39 HB3 GLN 39 20.555 -2.408 0.310 321 1HG GLN 39 HG2 GLN 39 19.623 -1.696 3.131 322 2HG GLN 39 HG3 GLN 39 21.233 -2.287 2.714 323 1HE2 GLN 39 HE22 GLN 39 20.623 0.222 4.027 324 2HE2 GLN 39 HE21 GLN 39 21.331 1.447 2.987 325 H LYS 40 H LYS 40 17.110 -3.985 0.053 326 HA LYS 40 HA LYS 40 17.796 -3.941 -2.770 327 1HB LYS 40 HB2 LYS 40 17.608 -6.020 -1.433 328 2HB LYS 40 HB3 LYS 40 15.890 -5.710 -1.220 329 1HG LYS 40 HG2 LYS 40 16.327 -7.373 -2.999 330 2HG LYS 40 HG3 LYS 40 15.475 -5.964 -3.611 331 1HD LYS 40 HD2 LYS 40 17.218 -6.773 -5.160 332 2HD LYS 40 HD3 LYS 40 17.494 -5.108 -4.675 333 1HE LYS 40 HE2 LYS 40 19.589 -6.427 -4.717 334 2HE LYS 40 HE3 LYS 40 19.259 -5.830 -3.089 335 1HZ LYS 40 HZ1 LYS 40 18.387 -7.984 -2.541 336 2HZ LYS 40 HZ2 LYS 40 18.673 -8.539 -4.066 337 3HZ LYS 40 HZ3 LYS 40 19.934 -8.115 -3.093 338 H GLU 41 H GLU 41 14.793 -3.372 -0.884 339 HA GLU 41 HA GLU 41 13.244 -2.911 -3.313 340 1HB GLU 41 HB2 GLU 41 12.480 -2.505 -0.395 341 2HB GLU 41 HB3 GLU 41 11.387 -2.487 -1.782 342 1HG GLU 41 HG2 GLU 41 13.016 -4.887 -0.819 343 2HG GLU 41 HG3 GLU 41 11.280 -4.643 -0.629 344 H LEU 42 H LEU 42 14.502 -0.803 -0.665 345 HA LEU 42 HA LEU 42 13.353 1.564 -2.040 346 1HB LEU 42 HB2 LEU 42 14.920 1.526 0.548 347 2HB LEU 42 HB3 LEU 42 14.028 2.857 -0.176 348 HG LEU 42 HG LEU 42 12.884 0.341 1.092 349 1HD1 LEU 42 HD11 LEU 42 11.783 1.940 2.581 350 2HD1 LEU 42 HD12 LEU 42 13.522 2.267 2.584 351 3HD1 LEU 42 HD13 LEU 42 12.433 3.308 1.654 352 1HD2 LEU 42 HD21 LEU 42 11.507 0.738 -0.888 353 2HD2 LEU 42 HD22 LEU 42 10.643 1.270 0.550 354 3HD2 LEU 42 HD23 LEU 42 11.403 2.478 -0.498 355 H THR 43 H THR 43 16.519 0.303 -0.975 356 HA THR 43 HA THR 43 18.631 0.689 -1.744 357 HB THR 43 HB THR 43 17.439 1.519 -4.417 358 HG1 THR 43 HG1 THR 43 17.610 -1.051 -3.237 359 1HG2 THR 43 HG21 THR 43 19.919 1.538 -4.218 360 2HG2 THR 43 HG22 THR 43 19.881 -0.146 -3.646 361 3HG2 THR 43 HG23 THR 43 19.355 0.248 -5.294 362 H ILE 44 H ILE 44 18.397 2.499 -0.150 363 HA ILE 44 HA ILE 44 18.442 5.221 -1.129 364 HB ILE 44 HB ILE 44 19.492 5.672 1.111 365 1HG1 ILE 44 HG12 ILE 44 18.630 2.926 2.018 366 2HG1 ILE 44 HG13 ILE 44 20.229 3.060 1.283 367 1HG2 ILE 44 HG21 ILE 44 17.096 5.922 0.684 368 2HG2 ILE 44 HG22 ILE 44 16.821 4.204 1.035 369 3HG2 ILE 44 HG23 ILE 44 17.363 5.303 2.319 370 1HD1 ILE 44 HD11 ILE 44 20.291 3.353 3.737 371 2HD1 ILE 44 HD12 ILE 44 20.918 4.756 2.857 372 3HD1 ILE 44 HD13 ILE 44 19.292 4.814 3.578 373 H GLY 45 H GLY 45 19.801 4.836 -2.978 374 1HA GLY 45 HA2 GLY 45 22.378 4.184 -3.308 375 2HA GLY 45 HA3 GLY 45 21.722 5.672 -4.011 376 H SER 46 H SER 46 21.404 7.298 -1.780 377 HA SER 46 HA SER 46 24.046 8.109 -0.986 378 1HB SER 46 HB2 SER 46 21.332 8.839 0.196 379 2HB SER 46 HB3 SER 46 22.827 9.784 0.287 380 HG SER 46 HG SER 46 22.716 9.900 -2.051 381 H LYS 47 H LYS 47 24.451 5.708 -0.299 382 HA LYS 47 HA LYS 47 23.205 4.571 1.890 383 1HB LYS 47 HB2 LYS 47 25.942 4.079 0.687 384 2HB LYS 47 HB3 LYS 47 25.283 3.090 2.003 385 1HG LYS 47 HG2 LYS 47 23.292 2.545 0.691 386 2HG LYS 47 HG3 LYS 47 23.872 3.543 -0.651 387 1HD LYS 47 HD2 LYS 47 25.793 2.076 -0.995 388 2HD LYS 47 HD3 LYS 47 25.404 1.157 0.471 389 1HE LYS 47 HE2 LYS 47 24.681 -0.043 -1.574 390 2HE LYS 47 HE3 LYS 47 23.320 0.339 -0.508 391 1HZ LYS 47 HZ1 LYS 47 22.794 2.181 -1.908 392 2HZ LYS 47 HZ2 LYS 47 24.081 1.875 -2.893 393 3HZ LYS 47 HZ3 LYS 47 22.837 0.796 -2.798 394 H LEU 48 H LEU 48 25.170 7.296 2.233 395 HA LEU 48 HA LEU 48 26.259 6.858 4.854 396 1HB LEU 48 HB2 LEU 48 25.031 9.349 3.574 397 2HB LEU 48 HB3 LEU 48 25.871 9.325 5.120 398 HG LEU 48 HG LEU 48 27.317 10.216 3.476 399 1HD1 LEU 48 HD11 LEU 48 28.328 7.410 4.082 400 2HD1 LEU 48 HD12 LEU 48 29.288 8.860 3.753 401 3HD1 LEU 48 HD13 LEU 48 28.320 8.764 5.236 402 1HD2 LEU 48 HD21 LEU 48 26.315 9.115 1.451 403 2HD2 LEU 48 HD22 LEU 48 28.085 9.170 1.489 404 3HD2 LEU 48 HD23 LEU 48 27.257 7.653 1.846 405 H GLN 49 H GLN 49 23.023 7.513 3.604 406 HA GLN 49 HA GLN 49 21.728 7.956 6.119 407 1HB GLN 49 HB2 GLN 49 20.617 6.997 3.453 408 2HB GLN 49 HB3 GLN 49 19.655 7.499 4.852 409 1HG GLN 49 HG2 GLN 49 20.809 9.752 4.754 410 2HG GLN 49 HG3 GLN 49 21.601 9.233 3.261 411 1HE2 GLN 49 HE22 GLN 49 18.371 9.660 4.775 412 2HE2 GLN 49 HE21 GLN 49 17.546 10.034 3.262 413 H ASP 50 H ASP 50 23.142 5.028 4.943 414 HA ASP 50 HA ASP 50 21.452 3.049 5.974 415 1HB ASP 50 HB2 ASP 50 24.486 3.282 5.984 416 2HB ASP 50 HB3 ASP 50 23.625 1.887 6.616 417 H ALA 51 H ALA 51 23.521 5.389 7.701 418 HA ALA 51 HA ALA 51 23.299 4.337 10.336 419 1HB ALA 51 HB1 ALA 51 23.387 7.237 9.388 420 2HB ALA 51 HB2 ALA 51 23.702 6.669 11.043 421 3HB ALA 51 HB3 ALA 51 24.790 6.197 9.719 422 H GLU 52 H GLU 52 21.059 6.422 8.450 423 HA GLU 52 HA GLU 52 19.159 6.765 10.619 424 1HB GLU 52 HB2 GLU 52 18.697 6.999 7.608 425 2HB GLU 52 HB3 GLU 52 17.655 7.585 8.903 426 1HG GLU 52 HG2 GLU 52 19.473 9.121 9.664 427 2HG GLU 52 HG3 GLU 52 20.476 8.595 8.302 428 H ILE 53 H ILE 53 19.532 4.585 7.794 429 HA ILE 53 HA ILE 53 17.144 3.141 8.214 430 HB ILE 53 HB ILE 53 19.699 2.097 6.994 431 1HG1 ILE 53 HG12 ILE 53 19.016 3.984 5.719 432 2HG1 ILE 53 HG13 ILE 53 18.459 2.556 4.845 433 1HG2 ILE 53 HG21 ILE 53 16.868 1.020 6.917 434 2HG2 ILE 53 HG22 ILE 53 18.170 0.495 5.833 435 3HG2 ILE 53 HG23 ILE 53 18.305 0.218 7.570 436 1HD1 ILE 53 HD11 ILE 53 16.739 4.202 4.720 437 2HD1 ILE 53 HD12 ILE 53 16.149 2.974 5.852 438 3HD1 ILE 53 HD13 ILE 53 16.785 4.520 6.456 439 H VAL 54 H VAL 54 20.378 2.511 9.746 440 HA VAL 54 HA VAL 54 19.320 0.170 11.042 441 HB VAL 54 HB VAL 54 21.217 0.336 12.634 442 1HG1 VAL 54 HG11 VAL 54 21.214 -1.091 10.634 443 2HG1 VAL 54 HG12 VAL 54 21.793 0.276 9.658 444 3HG1 VAL 54 HG13 VAL 54 22.824 -0.419 10.925 445 1HG2 VAL 54 HG21 VAL 54 21.668 2.754 12.517 446 2HG2 VAL 54 HG22 VAL 54 23.087 1.754 12.161 447 3HG2 VAL 54 HG23 VAL 54 22.212 2.527 10.836 448 H LYS 55 H LYS 55 19.279 3.612 12.051 449 HA LYS 55 HA LYS 55 18.177 3.037 14.651 450 1HB LYS 55 HB2 LYS 55 19.115 5.216 14.169 451 2HB LYS 55 HB3 LYS 55 17.969 5.485 12.860 452 1HG LYS 55 HG2 LYS 55 17.394 6.738 14.913 453 2HG LYS 55 HG3 LYS 55 16.107 5.674 14.361 454 1HD LYS 55 HD2 LYS 55 16.294 5.630 16.786 455 2HD LYS 55 HD3 LYS 55 16.622 4.036 16.128 456 1HE LYS 55 HE2 LYS 55 19.083 4.442 16.388 457 2HE LYS 55 HE3 LYS 55 18.734 6.061 17.023 458 1HZ LYS 55 HZ1 LYS 55 19.111 4.466 18.753 459 2HZ LYS 55 HZ2 LYS 55 17.560 5.019 18.824 460 3HZ LYS 55 HZ3 LYS 55 17.872 3.519 18.220 461 H LEU 56 H LEU 56 16.658 3.842 11.520 462 HA LEU 56 HA LEU 56 13.945 3.554 12.233 463 1HB LEU 56 HB2 LEU 56 14.457 4.577 10.239 464 2HB LEU 56 HB3 LEU 56 15.566 3.325 9.712 465 HG LEU 56 HG LEU 56 12.694 2.524 9.968 466 1HD1 LEU 56 HD11 LEU 56 12.535 4.717 8.830 467 2HD1 LEU 56 HD12 LEU 56 13.826 4.241 7.707 468 3HD1 LEU 56 HD13 LEU 56 12.263 3.402 7.670 469 1HD2 LEU 56 HD21 LEU 56 14.517 0.911 9.206 470 2HD2 LEU 56 HD22 LEU 56 13.260 1.223 8.009 471 3HD2 LEU 56 HD23 LEU 56 14.857 2.000 7.864 472 H MET 57 H MET 57 16.281 1.061 11.196 473 HA MET 57 HA MET 57 14.490 -1.143 11.195 474 1HB MET 57 HB2 MET 57 16.591 -1.192 10.035 475 2HB MET 57 HB3 MET 57 17.495 -0.955 11.528 476 1HG MET 57 HG2 MET 57 15.699 -3.356 11.113 477 2HG MET 57 HG3 MET 57 17.374 -3.332 10.558 478 1HE MET 57 HE1 MET 57 18.964 -1.827 12.965 479 2HE MET 57 HE2 MET 57 19.416 -3.281 13.868 480 3HE MET 57 HE3 MET 57 19.481 -3.294 12.091 481 H ASP 58 H ASP 58 16.730 0.141 13.704 482 HA ASP 58 HA ASP 58 16.125 -1.650 15.775 483 1HB ASP 58 HB2 ASP 58 17.909 -0.007 15.956 484 2HB ASP 58 HB3 ASP 58 16.740 1.315 16.015 485 H ASP 59 H ASP 59 14.508 1.452 14.966 486 HA ASP 59 HA ASP 59 12.452 1.320 16.886 487 1HB ASP 59 HB2 ASP 59 12.230 2.485 14.076 488 2HB ASP 59 HB3 ASP 59 11.192 2.849 15.453 489 H LEU 60 H LEU 60 12.361 0.151 13.487 490 HA LEU 60 HA LEU 60 9.815 -0.997 13.484 491 1HB LEU 60 HB2 LEU 60 12.392 -1.552 12.020 492 2HB LEU 60 HB3 LEU 60 11.112 -2.735 11.858 493 HG LEU 60 HG LEU 60 10.475 0.159 11.340 494 1HD1 LEU 60 HD11 LEU 60 12.487 -0.243 9.978 495 2HD1 LEU 60 HD12 LEU 60 11.752 -1.724 9.325 496 3HD1 LEU 60 HD13 LEU 60 11.046 -0.154 8.942 497 1HD2 LEU 60 HD21 LEU 60 8.938 -0.906 9.657 498 2HD2 LEU 60 HD22 LEU 60 9.568 -2.491 10.070 499 3HD2 LEU 60 HD23 LEU 60 8.647 -1.576 11.290 500 H ASP 61 H ASP 61 12.885 -2.667 14.394 501 HA ASP 61 HA ASP 61 11.349 -5.049 14.995 502 1HB ASP 61 HB2 ASP 61 13.308 -6.161 15.334 503 2HB ASP 61 HB3 ASP 61 13.772 -4.946 14.148 504 H ARG 62 H ARG 62 12.496 -2.351 16.919 505 HA ARG 62 HA ARG 62 12.693 -3.639 19.400 506 1HB ARG 62 HB2 ARG 62 13.644 -1.495 18.966 507 2HB ARG 62 HB3 ARG 62 12.054 -0.729 18.777 508 1HG ARG 62 HG2 ARG 62 11.560 -1.041 21.128 509 2HG ARG 62 HG3 ARG 62 12.952 -2.116 21.340 510 1HD ARG 62 HD2 ARG 62 13.112 0.834 20.570 511 2HD ARG 62 HD3 ARG 62 13.358 0.230 22.207 512 HE ARG 62 HE ARG 62 15.208 0.166 19.959 513 1HH1 ARG 62 HH12 ARG 62 14.391 -1.448 22.994 514 2HH1 ARG 62 HH11 ARG 62 15.937 -2.235 23.162 515 1HH2 ARG 62 HH21 ARG 62 17.181 -0.958 20.093 516 2HH2 ARG 62 HH22 ARG 62 17.569 -1.912 21.501 517 H ASN 63 H ASN 63 9.832 -2.311 17.798 518 HA ASN 63 HA ASN 63 7.965 -2.392 19.888 519 1HB ASN 63 HB2 ASN 63 7.419 -1.573 17.636 520 2HB ASN 63 HB3 ASN 63 7.641 -3.208 16.995 521 1HD2 ASN 63 HD22 ASN 63 5.626 -1.293 19.296 522 2HD2 ASN 63 HD21 ASN 63 4.222 -2.335 19.144 523 H LYS 64 H LYS 64 9.373 -5.094 18.083 524 HA LYS 64 HA LYS 64 8.186 -6.983 20.064 525 1HB LYS 64 HB2 LYS 64 8.640 -7.563 17.123 526 2HB LYS 64 HB3 LYS 64 8.114 -8.724 18.344 527 1HG LYS 64 HG2 LYS 64 6.563 -6.260 17.420 528 2HG LYS 64 HG3 LYS 64 6.284 -7.927 16.914 529 1HD LYS 64 HD2 LYS 64 5.788 -8.555 19.291 530 2HD LYS 64 HD3 LYS 64 5.932 -6.842 19.737 531 1HE LYS 64 HE2 LYS 64 4.128 -6.263 18.128 532 2HE LYS 64 HE3 LYS 64 3.939 -7.983 17.729 533 1HZ LYS 64 HZ1 LYS 64 2.359 -7.262 19.352 534 2HZ LYS 64 HZ2 LYS 64 3.374 -8.378 20.018 535 3HZ LYS 64 HZ3 LYS 64 3.553 -6.777 20.378 536 H ASP 65 H ASP 65 10.345 -5.554 20.548 537 HA ASP 65 HA ASP 65 12.290 -5.673 21.465 538 1HB ASP 65 HB2 ASP 65 13.000 -7.671 22.597 539 2HB ASP 65 HB3 ASP 65 11.273 -7.372 22.780 540 H GLN 66 H GLN 66 12.470 -8.321 19.128 541 HA GLN 66 HA GLN 66 15.200 -7.389 18.301 542 1HB GLN 66 HB2 GLN 66 14.268 -10.192 19.000 543 2HB GLN 66 HB3 GLN 66 15.790 -9.841 18.174 544 1HG GLN 66 HG2 GLN 66 16.670 -8.619 20.039 545 2HG GLN 66 HG3 GLN 66 15.128 -8.635 20.897 546 1HE2 GLN 66 HE22 GLN 66 14.178 -10.837 21.380 547 2HE2 GLN 66 HE21 GLN 66 15.323 -12.080 21.891 548 H GLU 67 H GLU 67 12.028 -8.526 17.319 549 HA GLU 67 HA GLU 67 13.029 -9.098 14.534 550 1HB GLU 67 HB2 GLU 67 11.172 -10.684 14.410 551 2HB GLU 67 HB3 GLU 67 12.397 -11.171 15.579 552 1HG GLU 67 HG2 GLU 67 10.999 -10.518 17.458 553 2HG GLU 67 HG3 GLU 67 9.812 -9.756 16.389 554 H VAL 68 H VAL 68 11.569 -8.442 12.874 555 HA VAL 68 HA VAL 68 9.691 -6.236 13.613 556 HB VAL 68 HB VAL 68 10.716 -7.046 10.875 557 1HG1 VAL 68 HG11 VAL 68 9.914 -4.838 10.214 558 2HG1 VAL 68 HG12 VAL 68 8.589 -5.768 10.934 559 3HG1 VAL 68 HG13 VAL 68 9.387 -4.498 11.881 560 1HG2 VAL 68 HG21 VAL 68 12.224 -5.117 11.002 561 2HG2 VAL 68 HG22 VAL 68 11.790 -4.878 12.697 562 3HG2 VAL 68 HG23 VAL 68 12.666 -6.340 12.192 563 H ASN 69 H ASN 69 7.714 -7.212 14.094 564 HA ASN 69 HA ASN 69 6.878 -9.629 12.666 565 1HB ASN 69 HB2 ASN 69 6.191 -9.327 14.991 566 2HB ASN 69 HB3 ASN 69 5.415 -7.780 14.599 567 1HD2 ASN 69 HD22 ASN 69 5.156 -11.315 14.287 568 2HD2 ASN 69 HD21 ASN 69 3.493 -11.307 13.737 569 H PHE 70 H PHE 70 5.067 -9.742 11.197 570 HA PHE 70 HA PHE 70 4.886 -7.879 9.169 571 1HB PHE 70 HB2 PHE 70 4.015 -10.099 8.940 572 2HB PHE 70 HB3 PHE 70 2.833 -9.841 10.227 573 HD1 PHE 70 HD1 PHE 70 3.880 -8.492 6.881 574 HD2 PHE 70 HD2 PHE 70 0.666 -8.995 9.715 575 HE1 PHE 70 HE1 PHE 70 2.327 -7.347 5.334 576 HE2 PHE 70 HE2 PHE 70 -0.879 -7.857 8.174 577 HZ PHE 70 HZ PHE 70 -0.053 -7.004 5.982 578 H GLN 71 H GLN 71 2.594 -7.951 11.990 579 HA GLN 71 HA GLN 71 1.067 -5.806 10.828 580 1HB GLN 71 HB2 GLN 71 0.232 -7.463 12.529 581 2HB GLN 71 HB3 GLN 71 1.130 -6.568 13.772 582 1HG GLN 71 HG2 GLN 71 -0.145 -4.498 13.168 583 2HG GLN 71 HG3 GLN 71 -1.021 -5.401 11.925 584 1HE2 GLN 71 HE22 GLN 71 -1.956 -7.664 12.995 585 2HE2 GLN 71 HE21 GLN 71 -2.882 -7.321 14.445 586 H GLU 72 H GLU 72 3.773 -5.954 13.096 587 HA GLU 72 HA GLU 72 3.876 -3.190 13.811 588 1HB GLU 72 HB2 GLU 72 5.146 -4.626 15.153 589 2HB GLU 72 HB3 GLU 72 5.884 -5.454 13.782 590 1HG GLU 72 HG2 GLU 72 7.476 -4.037 14.953 591 2HG GLU 72 HG3 GLU 72 7.312 -3.586 13.268 592 H TYR 73 H TYR 73 5.454 -5.042 11.164 593 HA TYR 73 HA TYR 73 6.812 -2.909 9.927 594 1HB TYR 73 HB2 TYR 73 7.366 -4.967 9.122 595 2HB TYR 73 HB3 TYR 73 5.724 -5.551 9.034 596 HD1 TYR 73 HD1 TYR 73 8.336 -3.647 7.268 597 HD2 TYR 73 HD2 TYR 73 4.324 -5.235 7.083 598 HE1 TYR 73 HE1 TYR 73 8.450 -3.681 4.788 599 HE2 TYR 73 HE2 TYR 73 4.417 -5.186 4.627 600 HH TYR 73 HH TYR 73 5.858 -5.064 2.795 601 H ILE 74 H ILE 74 3.425 -4.028 9.273 602 HA ILE 74 HA ILE 74 2.870 -1.950 7.403 603 HB ILE 74 HB ILE 74 0.923 -3.287 9.320 604 1HG1 ILE 74 HG12 ILE 74 2.102 -4.927 7.840 605 2HG1 ILE 74 HG13 ILE 74 0.369 -4.843 7.632 606 1HG2 ILE 74 HG21 ILE 74 -0.716 -2.612 7.419 607 2HG2 ILE 74 HG22 ILE 74 -0.160 -1.347 8.517 608 3HG2 ILE 74 HG23 ILE 74 0.547 -1.496 6.896 609 1HD1 ILE 74 HD11 ILE 74 1.443 -5.047 5.469 610 2HD1 ILE 74 HD12 ILE 74 0.661 -3.475 5.571 611 3HD1 ILE 74 HD13 ILE 74 2.431 -3.612 5.782 612 H THR 75 H THR 75 2.252 -2.030 10.936 613 HA THR 75 HA THR 75 1.120 0.497 11.276 614 HB THR 75 HB THR 75 3.069 -0.916 13.162 615 HG1 THR 75 HG1 THR 75 1.379 -2.269 12.615 616 1HG2 THR 75 HG21 THR 75 0.884 1.130 13.695 617 2HG2 THR 75 HG22 THR 75 1.768 0.219 14.932 618 3HG2 THR 75 HG23 THR 75 2.629 1.379 13.908 619 H PHE 76 H PHE 76 4.589 -0.373 11.386 620 HA PHE 76 HA PHE 76 5.572 2.258 11.812 621 1HB PHE 76 HB2 PHE 76 6.876 0.230 12.263 622 2HB PHE 76 HB3 PHE 76 6.899 -0.149 10.542 623 HD1 PHE 76 HD1 PHE 76 8.264 1.224 8.961 624 HD2 PHE 76 HD2 PHE 76 8.212 2.094 13.191 625 HE1 PHE 76 HE1 PHE 76 10.154 2.761 8.668 626 HE2 PHE 76 HE2 PHE 76 10.029 3.752 12.857 627 HZ PHE 76 HZ PHE 76 10.942 4.151 10.574 628 H LEU 77 H LEU 77 5.030 0.374 8.742 629 HA LEU 77 HA LEU 77 6.029 2.448 7.047 630 1HB LEU 77 HB2 LEU 77 3.948 0.288 6.594 631 2HB LEU 77 HB3 LEU 77 4.418 1.433 5.335 632 HG LEU 77 HG LEU 77 6.432 -0.351 6.782 633 1HD1 LEU 77 HD11 LEU 77 6.413 -1.674 4.688 634 2HD1 LEU 77 HD12 LEU 77 4.879 -1.782 5.575 635 3HD1 LEU 77 HD13 LEU 77 5.010 -0.756 4.120 636 1HD2 LEU 77 HD21 LEU 77 6.584 1.317 4.231 637 2HD2 LEU 77 HD22 LEU 77 7.517 1.571 5.730 638 3HD2 LEU 77 HD23 LEU 77 7.815 0.143 4.746 639 H GLY 78 H GLY 78 2.917 2.089 8.725 640 1HA GLY 78 HA2 GLY 78 1.654 4.383 7.614 641 2HA GLY 78 HA3 GLY 78 1.384 3.747 9.255 642 H ALA 79 H ALA 79 3.829 4.112 10.480 643 HA ALA 79 HA ALA 79 3.900 6.892 11.066 644 1HB ALA 79 HB1 ALA 79 6.152 4.876 11.493 645 2HB ALA 79 HB2 ALA 79 5.938 6.435 12.304 646 3HB ALA 79 HB3 ALA 79 4.775 5.127 12.585 647 H LEU 80 H LEU 80 6.008 4.940 8.950 648 HA LEU 80 HA LEU 80 7.766 6.932 8.068 649 1HB LEU 80 HB2 LEU 80 7.723 4.331 7.673 650 2HB LEU 80 HB3 LEU 80 6.694 4.711 6.297 651 HG LEU 80 HG LEU 80 8.558 6.238 5.465 652 1HD1 LEU 80 HD11 LEU 80 10.101 4.739 7.634 653 2HD1 LEU 80 HD12 LEU 80 10.856 5.645 6.310 654 3HD1 LEU 80 HD13 LEU 80 9.898 6.501 7.531 655 1HD2 LEU 80 HD21 LEU 80 9.208 3.281 5.826 656 2HD2 LEU 80 HD22 LEU 80 8.122 3.941 4.576 657 3HD2 LEU 80 HD23 LEU 80 9.848 4.341 4.554 658 H ALA 81 H ALA 81 4.621 5.888 6.724 659 HA ALA 81 HA ALA 81 4.457 7.750 4.593 660 1HB ALA 81 HB1 ALA 81 2.000 7.330 4.791 661 2HB ALA 81 HB2 ALA 81 3.004 5.863 4.640 662 3HB ALA 81 HB3 ALA 81 2.325 6.315 6.206 663 H MET 82 H MET 82 3.344 8.022 8.025 664 HA MET 82 HA MET 82 2.233 10.624 7.727 665 1HB MET 82 HB2 MET 82 1.833 9.111 9.647 666 2HB MET 82 HB3 MET 82 3.477 9.404 10.228 667 1HG MET 82 HG2 MET 82 3.022 11.795 10.464 668 2HG MET 82 HG3 MET 82 1.403 11.593 9.790 669 1HE MET 82 HE1 MET 82 -0.504 9.825 12.687 670 2HE MET 82 HE2 MET 82 -0.619 10.574 11.076 671 3HE MET 82 HE3 MET 82 0.250 9.028 11.289 672 H ILE 83 H ILE 83 5.553 9.563 8.569 673 HA ILE 83 HA ILE 83 6.691 12.160 8.878 674 HB ILE 83 HB ILE 83 7.903 9.513 8.020 675 1HG1 ILE 83 HG12 ILE 83 8.227 11.116 10.592 676 2HG1 ILE 83 HG13 ILE 83 6.976 9.890 10.391 677 1HG2 ILE 83 HG21 ILE 83 10.123 10.577 8.408 678 2HG2 ILE 83 HG22 ILE 83 9.289 11.291 7.038 679 3HG2 ILE 83 HG23 ILE 83 9.320 12.150 8.593 680 1HD1 ILE 83 HD11 ILE 83 8.719 8.176 9.922 681 2HD1 ILE 83 HD12 ILE 83 9.973 9.385 10.283 682 3HD1 ILE 83 HD13 ILE 83 8.830 8.894 11.537 683 H TYR 84 H TYR 84 6.178 10.133 5.951 684 HA TYR 84 HA TYR 84 6.976 12.255 4.120 685 1HB TYR 84 HB2 TYR 84 5.236 9.849 3.543 686 2HB TYR 84 HB3 TYR 84 6.109 10.840 2.384 687 HD1 TYR 84 HD1 TYR 84 6.159 7.813 2.637 688 HD2 TYR 84 HD2 TYR 84 8.782 10.884 4.169 689 HE1 TYR 84 HE1 TYR 84 8.076 6.244 2.537 690 HE2 TYR 84 HE2 TYR 84 10.668 9.310 4.097 691 HH TYR 84 HH TYR 84 11.368 7.186 3.552 692 H ASN 85 H ASN 85 5.411 13.489 5.875 693 HA ASN 85 HA ASN 85 2.745 13.954 5.529 694 1HB ASN 85 HB2 ASN 85 3.214 16.201 6.307 695 2HB ASN 85 HB3 ASN 85 4.255 15.060 7.162 696 1HD2 ASN 85 HD22 ASN 85 6.635 14.896 6.384 697 2HD2 ASN 85 HD21 ASN 85 7.276 16.289 5.534 698 H GLU 86 H GLU 86 5.353 14.802 3.296 699 HA GLU 86 HA GLU 86 3.962 16.634 1.619 700 1HB GLU 86 HB2 GLU 86 6.145 14.645 0.824 701 2HB GLU 86 HB3 GLU 86 5.621 16.080 -0.051 702 1HG GLU 86 HG2 GLU 86 7.598 16.761 1.010 703 2HG GLU 86 HG3 GLU 86 6.305 17.477 1.981 704 H ALA 87 H ALA 87 4.103 13.062 1.718 705 HA ALA 87 HA ALA 87 2.634 12.639 -0.746 706 1HB ALA 87 HB1 ALA 87 4.179 10.950 0.246 707 2HB ALA 87 HB2 ALA 87 3.052 10.754 1.609 708 3HB ALA 87 HB3 ALA 87 2.539 10.329 -0.032 709 H LEU 88 H LEU 88 1.824 12.800 2.749 710 HA LEU 88 HA LEU 88 -0.957 12.190 2.519 711 1HB LEU 88 HB2 LEU 88 0.602 13.916 4.465 712 2HB LEU 88 HB3 LEU 88 -1.149 13.859 4.508 713 HG LEU 88 HG LEU 88 0.024 12.397 6.144 714 1HD1 LEU 88 HD11 LEU 88 -2.324 12.074 5.644 715 2HD1 LEU 88 HD12 LEU 88 -1.938 11.042 4.257 716 3HD1 LEU 88 HD13 LEU 88 -1.530 10.513 5.896 717 1HD2 LEU 88 HD21 LEU 88 0.645 10.616 3.760 718 2HD2 LEU 88 HD22 LEU 88 1.823 11.553 4.705 719 3HD2 LEU 88 HD23 LEU 88 0.902 10.247 5.472 720 H LYS 89 H LYS 89 0.661 15.419 2.433 721 HA LYS 89 HA LYS 89 -1.776 16.795 1.771 722 1HB LYS 89 HB2 LYS 89 1.147 17.509 1.408 723 2HB LYS 89 HB3 LYS 89 -0.174 18.593 0.922 724 1HG LYS 89 HG2 LYS 89 -1.127 18.532 3.190 725 2HG LYS 89 HG3 LYS 89 0.174 17.480 3.745 726 1HD LYS 89 HD2 LYS 89 0.485 20.318 2.619 727 2HD LYS 89 HD3 LYS 89 0.477 19.900 4.334 728 1HE LYS 89 HE2 LYS 89 2.583 19.060 2.285 729 2HE LYS 89 HE3 LYS 89 2.768 20.219 3.605 730 1HZ LYS 89 HZ1 LYS 89 3.670 18.144 4.249 731 2HZ LYS 89 HZ2 LYS 89 2.310 18.407 5.136 732 3HZ LYS 89 HZ3 LYS 89 2.282 17.337 3.879 733 H GLY 90 H GLY 90 0.903 15.723 -0.366 734 1HA GLY 90 HA2 GLY 90 0.978 15.315 -2.612 735 2HA GLY 90 HA3 GLY 90 -0.565 14.505 -2.303 736 1H MET 1 H1 MET 1 15.194 1.440 -4.650 737 2H MET 1 H2 MET 1 15.528 0.290 -5.786 738 3H MET 1 H3 MET 1 14.174 0.169 -4.854 739 HA MET 1 HA MET 1 14.745 2.236 -6.860 740 1HB MET 1 HB2 MET 1 14.067 -0.046 -7.687 741 2HB MET 1 HB3 MET 1 12.531 0.140 -6.825 742 1HG MET 1 HG2 MET 1 12.133 2.251 -8.193 743 2HG MET 1 HG3 MET 1 13.588 1.862 -9.107 744 1HE MET 1 HE1 MET 1 13.795 -0.349 -10.616 745 2HE MET 1 HE2 MET 1 13.195 -1.431 -9.330 746 3HE MET 1 HE3 MET 1 12.434 -1.450 -10.933 747 H ALA 2 H ALA 2 12.657 1.096 -4.264 748 HA ALA 2 HA ALA 2 11.297 2.101 -2.826 749 1HB ALA 2 HB1 ALA 2 12.957 3.986 -2.832 750 2HB ALA 2 HB2 ALA 2 11.940 4.819 -4.031 751 3HB ALA 2 HB3 ALA 2 11.296 4.449 -2.424 752 H SER 3 H SER 3 10.887 3.539 -6.076 753 HA SER 3 HA SER 3 8.381 4.402 -6.030 754 1HB SER 3 HB2 SER 3 9.138 2.770 -8.441 755 2HB SER 3 HB3 SER 3 8.340 4.333 -8.317 756 HG SER 3 HG SER 3 10.368 5.165 -7.510 757 HA PRO 4 HA PRO 4 6.398 0.053 -6.931 758 1HB PRO 4 HB2 PRO 4 8.300 -1.656 -5.319 759 2HB PRO 4 HB3 PRO 4 7.345 -2.103 -6.763 760 1HG PRO 4 HG2 PRO 4 9.980 -1.546 -7.036 761 2HG PRO 4 HG3 PRO 4 8.819 -0.824 -8.193 762 1HD PRO 4 HD2 PRO 4 9.980 0.425 -5.694 763 2HD PRO 4 HD3 PRO 4 9.958 1.094 -7.341 764 H LEU 5 H LEU 5 8.062 0.667 -3.786 765 HA LEU 5 HA LEU 5 5.703 -0.327 -2.333 766 1HB LEU 5 HB2 LEU 5 7.930 -0.732 -1.378 767 2HB LEU 5 HB3 LEU 5 8.229 1.013 -1.305 768 HG LEU 5 HG LEU 5 6.337 1.292 0.278 769 1HD1 LEU 5 HD11 LEU 5 6.069 -1.748 0.085 770 2HD1 LEU 5 HD12 LEU 5 5.323 -0.711 1.316 771 3HD1 LEU 5 HD13 LEU 5 4.833 -0.543 -0.362 772 1HD2 LEU 5 HD21 LEU 5 8.281 -0.893 1.102 773 2HD2 LEU 5 HD22 LEU 5 8.535 0.872 1.224 774 3HD2 LEU 5 HD23 LEU 5 7.286 0.088 2.201 775 H ASP 6 H ASP 6 7.389 2.717 -3.092 776 HA ASP 6 HA ASP 6 5.894 4.536 -1.613 777 1HB ASP 6 HB2 ASP 6 6.939 4.974 -4.434 778 2HB ASP 6 HB3 ASP 6 6.470 6.230 -3.289 779 H GLN 7 H GLN 7 5.108 3.290 -4.927 780 HA GLN 7 HA GLN 7 2.711 4.824 -5.136 781 1HB GLN 7 HB2 GLN 7 2.061 3.352 -6.931 782 2HB GLN 7 HB3 GLN 7 3.763 3.810 -7.067 783 1HG GLN 7 HG2 GLN 7 4.404 1.605 -6.096 784 2HG GLN 7 HG3 GLN 7 2.712 1.110 -6.078 785 1HE2 GLN 7 HE22 GLN 7 1.560 1.222 -8.275 786 2HE2 GLN 7 HE21 GLN 7 2.530 0.794 -9.672 787 H ALA 8 H ALA 8 3.326 1.686 -3.543 788 HA ALA 8 HA ALA 8 0.523 1.022 -3.274 789 1HB ALA 8 HB1 ALA 8 2.092 -0.724 -3.284 790 2HB ALA 8 HB2 ALA 8 2.990 -0.071 -1.891 791 3HB ALA 8 HB3 ALA 8 1.334 -0.676 -1.682 792 H ILE 9 H ILE 9 3.014 2.295 -0.937 793 HA ILE 9 HA ILE 9 1.029 2.751 1.112 794 HB ILE 9 HB ILE 9 2.623 4.223 2.197 795 1HG1 ILE 9 HG12 ILE 9 4.493 3.724 -0.123 796 2HG1 ILE 9 HG13 ILE 9 3.696 5.270 0.224 797 1HG2 ILE 9 HG21 ILE 9 2.636 1.745 2.439 798 2HG2 ILE 9 HG22 ILE 9 3.914 1.657 1.208 799 3HG2 ILE 9 HG23 ILE 9 4.202 2.478 2.757 800 1HD1 ILE 9 HD11 ILE 9 5.925 5.397 1.084 801 2HD1 ILE 9 HD12 ILE 9 4.826 5.297 2.473 802 3HD1 ILE 9 HD13 ILE 9 5.766 3.876 1.967 803 H GLY 10 H GLY 10 2.266 4.745 -1.544 804 1HA GLY 10 HA2 GLY 10 0.888 7.121 -1.350 805 2HA GLY 10 HA3 GLY 10 1.227 6.254 -2.854 806 H LEU 11 H LEU 11 -0.366 3.991 -2.652 807 HA LEU 11 HA LEU 11 -2.896 4.896 -3.416 808 1HB LEU 11 HB2 LEU 11 -1.672 2.606 -3.758 809 2HB LEU 11 HB3 LEU 11 -2.385 2.149 -2.218 810 HG LEU 11 HG LEU 11 -3.700 1.234 -3.921 811 1HD1 LEU 11 HD11 LEU 11 -4.939 2.218 -2.011 812 2HD1 LEU 11 HD12 LEU 11 -5.294 3.635 -3.040 813 3HD1 LEU 11 HD13 LEU 11 -5.877 2.030 -3.505 814 1HD2 LEU 11 HD21 LEU 11 -4.720 2.436 -5.752 815 2HD2 LEU 11 HD22 LEU 11 -3.981 3.962 -5.222 816 3HD2 LEU 11 HD23 LEU 11 -2.958 2.619 -5.787 817 H LEU 12 H LEU 12 -2.061 3.254 -0.327 818 HA LEU 12 HA LEU 12 -4.548 3.622 1.006 819 1HB LEU 12 HB2 LEU 12 -1.648 3.450 2.019 820 2HB LEU 12 HB3 LEU 12 -3.028 3.600 3.102 821 HG LEU 12 HG LEU 12 -3.986 1.529 2.262 822 1HD1 LEU 12 HD11 LEU 12 -1.343 1.206 0.768 823 2HD1 LEU 12 HD12 LEU 12 -2.537 -0.079 0.999 824 3HD1 LEU 12 HD13 LEU 12 -2.954 1.319 0.014 825 1HD2 LEU 12 HD21 LEU 12 -2.336 0.021 3.371 826 2HD2 LEU 12 HD22 LEU 12 -1.139 1.331 3.323 827 3HD2 LEU 12 HD23 LEU 12 -2.629 1.503 4.279 828 H ILE 13 H ILE 13 -1.693 5.729 0.872 829 HA ILE 13 HA ILE 13 -2.638 7.692 2.710 830 HB ILE 13 HB ILE 13 -0.618 7.725 0.434 831 1HG1 ILE 13 HG12 ILE 13 -0.140 7.938 3.430 832 2HG1 ILE 13 HG13 ILE 13 -0.329 6.366 2.655 833 1HG2 ILE 13 HG21 ILE 13 -1.228 9.924 2.418 834 2HG2 ILE 13 HG22 ILE 13 0.254 9.851 1.438 835 3HG2 ILE 13 HG23 ILE 13 -1.312 10.041 0.648 836 1HD1 ILE 13 HD11 ILE 13 1.951 6.619 2.651 837 2HD1 ILE 13 HD12 ILE 13 1.547 7.157 1.022 838 3HD1 ILE 13 HD13 ILE 13 1.898 8.360 2.281 839 H GLY 14 H GLY 14 -2.754 7.572 -0.860 840 1HA GLY 14 HA2 GLY 14 -4.130 9.972 -1.352 841 2HA GLY 14 HA3 GLY 14 -4.158 8.522 -2.377 842 H ILE 15 H ILE 15 -5.435 6.610 -1.065 843 HA ILE 15 HA ILE 15 -8.166 7.188 -1.225 844 HB ILE 15 HB ILE 15 -6.508 5.004 -0.005 845 1HG1 ILE 15 HG12 ILE 15 -8.788 5.145 -2.035 846 2HG1 ILE 15 HG13 ILE 15 -7.062 5.066 -2.399 847 1HG2 ILE 15 HG21 ILE 15 -9.478 5.257 0.540 848 2HG2 ILE 15 HG22 ILE 15 -8.493 3.800 0.819 849 3HG2 ILE 15 HG23 ILE 15 -8.155 5.253 1.724 850 1HD1 ILE 15 HD11 ILE 15 -7.959 2.868 -2.722 851 2HD1 ILE 15 HD12 ILE 15 -7.036 2.805 -1.205 852 3HD1 ILE 15 HD13 ILE 15 -8.807 2.886 -1.177 853 H PHE 16 H PHE 16 -6.100 7.165 1.698 854 HA PHE 16 HA PHE 16 -8.207 7.890 3.472 855 1HB PHE 16 HB2 PHE 16 -6.064 6.849 4.110 856 2HB PHE 16 HB3 PHE 16 -5.193 8.313 3.723 857 HD1 PHE 16 HD1 PHE 16 -5.509 10.381 5.131 858 HD2 PHE 16 HD2 PHE 16 -7.403 6.651 6.147 859 HE1 PHE 16 HE1 PHE 16 -6.049 11.243 7.351 860 HE2 PHE 16 HE2 PHE 16 -7.623 7.407 8.504 861 HZ PHE 16 HZ PHE 16 -6.920 9.690 9.130 862 H HIS 17 H HIS 17 -5.502 9.978 2.320 863 HA HIS 17 HA HIS 17 -6.685 12.173 3.678 864 1HB HIS 17 HB2 HIS 17 -4.168 11.608 3.024 865 2HB HIS 17 HB3 HIS 17 -4.532 12.656 1.653 866 HD1 HIS 17 HD1 HIS 17 -3.515 14.931 2.313 867 HD2 HIS 17 HD2 HIS 17 -5.134 12.816 5.547 868 HE1 HIS 17 HE1 HIS 17 -3.074 16.345 4.401 869 H LYS 18 H LYS 18 -7.046 11.011 0.389 870 HA LYS 18 HA LYS 18 -8.163 13.410 -0.734 871 1HB LYS 18 HB2 LYS 18 -7.487 11.485 -2.065 872 2HB LYS 18 HB3 LYS 18 -8.740 10.476 -1.336 873 1HG LYS 18 HG2 LYS 18 -9.490 13.062 -2.731 874 2HG LYS 18 HG3 LYS 18 -9.018 11.677 -3.708 875 1HD LYS 18 HD2 LYS 18 -11.341 11.652 -1.718 876 2HD LYS 18 HD3 LYS 18 -11.452 11.877 -3.463 877 1HE LYS 18 HE2 LYS 18 -10.292 9.610 -3.742 878 2HE LYS 18 HE3 LYS 18 -10.526 9.365 -2.002 879 1HZ LYS 18 HZ1 LYS 18 -12.275 8.398 -3.235 880 2HZ LYS 18 HZ2 LYS 18 -12.872 9.657 -2.354 881 3HZ LYS 18 HZ3 LYS 18 -12.640 9.826 -3.977 882 H TYR 19 H TYR 19 -9.505 10.690 1.208 883 HA TYR 19 HA TYR 19 -12.171 11.797 1.252 884 1HB TYR 19 HB2 TYR 19 -10.801 9.490 2.503 885 2HB TYR 19 HB3 TYR 19 -12.040 10.243 3.500 886 HD1 TYR 19 HD1 TYR 19 -14.352 10.393 2.864 887 HD2 TYR 19 HD2 TYR 19 -11.467 8.470 0.303 888 HE1 TYR 19 HE1 TYR 19 -16.159 9.716 1.337 889 HE2 TYR 19 HE2 TYR 19 -13.302 7.659 -1.136 890 HH TYR 19 HH TYR 19 -16.465 7.672 -0.305 891 H SER 20 H SER 20 -9.466 11.889 3.683 892 HA SER 20 HA SER 20 -10.669 13.513 5.559 893 1HB SER 20 HB2 SER 20 -7.827 13.966 4.572 894 2HB SER 20 HB3 SER 20 -8.500 14.319 6.168 895 HG SER 20 HG SER 20 -8.662 12.184 6.600 896 H GLY 21 H GLY 21 -9.077 14.622 2.555 897 1HA GLY 21 HA2 GLY 21 -9.227 17.322 2.582 898 2HA GLY 21 HA3 GLY 21 -9.577 16.339 1.155 899 H LYS 22 H LYS 22 -12.083 15.177 2.267 900 HA LYS 22 HA LYS 22 -14.017 17.014 1.356 901 1HB LYS 22 HB2 LYS 22 -14.302 14.546 1.666 902 2HB LYS 22 HB3 LYS 22 -14.272 14.805 3.420 903 1HG LYS 22 HG2 LYS 22 -16.339 16.198 3.239 904 2HG LYS 22 HG3 LYS 22 -16.323 15.984 1.489 905 1HD LYS 22 HD2 LYS 22 -17.940 14.478 2.637 906 2HD LYS 22 HD3 LYS 22 -16.741 13.593 1.692 907 1HE LYS 22 HE2 LYS 22 -17.208 12.554 3.900 908 2HE LYS 22 HE3 LYS 22 -15.508 12.972 3.672 909 1HZ LYS 22 HZ1 LYS 22 -15.873 14.924 4.997 910 2HZ LYS 22 HZ2 LYS 22 -17.472 14.564 5.178 911 3HZ LYS 22 HZ3 LYS 22 -16.322 13.583 5.839 912 H GLU 23 H GLU 23 -12.754 16.406 4.641 913 HA GLU 23 HA GLU 23 -14.373 18.659 5.718 914 1HB GLU 23 HB2 GLU 23 -13.766 17.800 7.949 915 2HB GLU 23 HB3 GLU 23 -14.787 16.771 6.957 916 1HG GLU 23 HG2 GLU 23 -13.347 15.313 8.072 917 2HG GLU 23 HG3 GLU 23 -12.790 15.327 6.411 918 H GLY 24 H GLY 24 -11.010 17.510 5.322 919 1HA GLY 24 HA2 GLY 24 -9.872 19.975 4.815 920 2HA GLY 24 HA3 GLY 24 -9.759 19.765 6.581 921 H ASP 25 H ASP 25 -7.471 19.784 4.755 922 HA ASP 25 HA ASP 25 -6.654 17.021 4.296 923 1HB ASP 25 HB2 ASP 25 -4.645 17.981 3.384 924 2HB ASP 25 HB3 ASP 25 -6.053 18.822 2.737 925 H LYS 26 H LYS 26 -7.237 16.804 6.750 926 HA LYS 26 HA LYS 26 -4.791 17.107 8.449 927 1HB LYS 26 HB2 LYS 26 -7.718 16.677 9.154 928 2HB LYS 26 HB3 LYS 26 -6.387 16.734 10.325 929 1HG LYS 26 HG2 LYS 26 -5.853 19.056 9.594 930 2HG LYS 26 HG3 LYS 26 -7.233 19.032 8.489 931 1HD LYS 26 HD2 LYS 26 -7.415 18.677 11.520 932 2HD LYS 26 HD3 LYS 26 -7.699 20.193 10.646 933 1HE LYS 26 HE2 LYS 26 -9.547 19.077 9.360 934 2HE LYS 26 HE3 LYS 26 -9.334 17.625 10.358 935 1HZ LYS 26 HZ1 LYS 26 -11.068 18.998 11.168 936 2HZ LYS 26 HZ2 LYS 26 -9.848 18.932 12.274 937 3HZ LYS 26 HZ3 LYS 26 -10.055 20.285 11.350 938 H HIS 27 H HIS 27 -4.124 15.183 9.555 939 HA HIS 27 HA HIS 27 -4.450 12.816 7.913 940 1HB HIS 27 HB2 HIS 27 -2.860 13.237 10.455 941 2HB HIS 27 HB3 HIS 27 -2.685 11.905 9.309 942 HD1 HIS 27 HD1 HIS 27 -2.992 14.501 6.907 943 HD2 HIS 27 HD2 HIS 27 -0.135 13.563 9.869 944 HE1 HIS 27 HE1 HIS 27 -0.835 15.675 6.249 945 H THR 28 H THR 28 -6.932 13.192 8.739 946 HA THR 28 HA THR 28 -7.571 11.179 10.819 947 HB THR 28 HB THR 28 -9.245 12.942 11.647 948 HG1 THR 28 HG1 THR 28 -8.799 14.340 9.772 949 1HG2 THR 28 HG21 THR 28 -6.299 13.575 12.109 950 2HG2 THR 28 HG22 THR 28 -7.665 14.057 13.130 951 3HG2 THR 28 HG23 THR 28 -7.256 12.339 12.962 952 H LEU 29 H LEU 29 -9.592 10.248 10.520 953 HA LEU 29 HA LEU 29 -11.452 11.409 8.486 954 1HB LEU 29 HB2 LEU 29 -10.861 8.455 8.981 955 2HB LEU 29 HB3 LEU 29 -12.222 9.054 8.034 956 HG LEU 29 HG LEU 29 -9.303 9.520 7.318 957 1HD1 LEU 29 HD11 LEU 29 -11.358 7.548 6.209 958 2HD1 LEU 29 HD12 LEU 29 -9.723 7.802 5.568 959 3HD1 LEU 29 HD13 LEU 29 -9.942 7.108 7.189 960 1HD2 LEU 29 HD21 LEU 29 -10.188 10.096 5.113 961 2HD2 LEU 29 HD22 LEU 29 -11.845 9.939 5.729 962 3HD2 LEU 29 HD23 LEU 29 -10.781 11.227 6.342 963 H SER 30 H SER 30 -13.665 11.180 9.163 964 HA SER 30 HA SER 30 -14.041 10.517 12.048 965 1HB SER 30 HB2 SER 30 -16.328 11.429 11.676 966 2HB SER 30 HB3 SER 30 -15.018 12.594 11.441 967 HG SER 30 HG SER 30 -15.225 12.363 9.214 968 H LYS 31 H LYS 31 -15.768 8.982 12.638 969 HA LYS 31 HA LYS 31 -15.286 6.587 11.367 970 1HB LYS 31 HB2 LYS 31 -16.907 5.605 12.847 971 2HB LYS 31 HB3 LYS 31 -15.878 6.769 13.673 972 1HG LYS 31 HG2 LYS 31 -17.709 8.433 13.648 973 2HG LYS 31 HG3 LYS 31 -18.759 7.253 12.817 974 1HD LYS 31 HD2 LYS 31 -18.474 5.660 14.684 975 2HD LYS 31 HD3 LYS 31 -17.473 6.818 15.552 976 1HE LYS 31 HE2 LYS 31 -20.397 7.244 14.748 977 2HE LYS 31 HE3 LYS 31 -19.826 6.770 16.356 978 1HZ LYS 31 HZ1 LYS 31 -20.235 9.097 16.246 979 2HZ LYS 31 HZ2 LYS 31 -18.630 8.824 16.490 980 3HZ LYS 31 HZ3 LYS 31 -19.172 9.289 15.004 981 H LYS 32 H LYS 32 -18.213 8.612 10.882 982 HA LYS 32 HA LYS 32 -19.354 6.606 9.073 983 1HB LYS 32 HB2 LYS 32 -20.248 9.475 9.298 984 2HB LYS 32 HB3 LYS 32 -21.120 8.052 8.667 985 1HG LYS 32 HG2 LYS 32 -20.908 7.020 10.983 986 2HG LYS 32 HG3 LYS 32 -20.385 8.609 11.569 987 1HD LYS 32 HD2 LYS 32 -23.037 7.983 10.189 988 2HD LYS 32 HD3 LYS 32 -22.795 8.224 11.925 989 1HE LYS 32 HE2 LYS 32 -21.995 10.562 11.466 990 2HE LYS 32 HE3 LYS 32 -22.362 10.323 9.746 991 1HZ LYS 32 HZ1 LYS 32 -24.634 9.944 10.337 992 2HZ LYS 32 HZ2 LYS 32 -24.303 10.172 11.936 993 3HZ LYS 32 HZ3 LYS 32 -24.129 11.418 10.873 994 H GLU 33 H GLU 33 -17.325 9.490 8.730 995 HA GLU 33 HA GLU 33 -17.341 9.687 5.874 996 1HB GLU 33 HB2 GLU 33 -16.465 11.421 7.298 997 2HB GLU 33 HB3 GLU 33 -15.276 10.298 7.990 998 1HG GLU 33 HG2 GLU 33 -14.095 10.158 5.856 999 2HG GLU 33 HG3 GLU 33 -15.288 11.229 5.116 1000 H LEU 34 H LEU 34 -15.420 7.689 8.181 1001 HA LEU 34 HA LEU 34 -13.877 6.340 6.236 1002 1HB LEU 34 HB2 LEU 34 -13.265 6.204 8.489 1003 2HB LEU 34 HB3 LEU 34 -14.802 5.555 9.009 1004 HG LEU 34 HG LEU 34 -12.968 3.963 9.044 1005 1HD1 LEU 34 HD11 LEU 34 -15.430 3.303 8.771 1006 2HD1 LEU 34 HD12 LEU 34 -15.038 2.923 7.093 1007 3HD1 LEU 34 HD13 LEU 34 -14.219 2.081 8.397 1008 1HD2 LEU 34 HD21 LEU 34 -13.018 4.130 5.999 1009 2HD2 LEU 34 HD22 LEU 34 -11.717 4.682 7.066 1010 3HD2 LEU 34 HD23 LEU 34 -12.106 2.957 6.936 1011 H LYS 35 H LYS 35 -17.237 5.579 7.448 1012 HA LYS 35 HA LYS 35 -17.539 3.311 5.729 1013 1HB LYS 35 HB2 LYS 35 -19.709 5.285 6.539 1014 2HB LYS 35 HB3 LYS 35 -19.927 3.747 5.727 1015 1HG LYS 35 HG2 LYS 35 -18.818 2.606 7.725 1016 2HG LYS 35 HG3 LYS 35 -18.759 4.191 8.496 1017 1HD LYS 35 HD2 LYS 35 -20.720 3.391 9.384 1018 2HD LYS 35 HD3 LYS 35 -21.361 4.265 7.999 1019 1HE LYS 35 HE2 LYS 35 -20.821 1.247 8.163 1020 2HE LYS 35 HE3 LYS 35 -22.402 2.035 8.329 1021 1HZ LYS 35 HZ1 LYS 35 -22.137 2.830 6.074 1022 2HZ LYS 35 HZ2 LYS 35 -20.759 1.930 5.920 1023 3HZ LYS 35 HZ3 LYS 35 -22.206 1.188 6.205 1024 H GLU 36 H GLU 36 -18.163 6.783 5.111 1025 HA GLU 36 HA GLU 36 -19.042 6.575 2.452 1026 1HB GLU 36 HB2 GLU 36 -18.919 8.613 4.059 1027 2HB GLU 36 HB3 GLU 36 -17.288 8.856 3.416 1028 1HG GLU 36 HG2 GLU 36 -18.305 8.970 1.097 1029 2HG GLU 36 HG3 GLU 36 -19.902 8.861 1.852 1030 H LEU 37 H LEU 37 -15.707 6.648 3.715 1031 HA LEU 37 HA LEU 37 -14.353 6.451 1.193 1032 1HB LEU 37 HB2 LEU 37 -13.210 7.101 3.197 1033 2HB LEU 37 HB3 LEU 37 -13.528 5.578 3.989 1034 HG LEU 37 HG LEU 37 -11.884 5.681 1.451 1035 1HD1 LEU 37 HD11 LEU 37 -10.967 5.977 4.345 1036 2HD1 LEU 37 HD12 LEU 37 -9.891 5.751 2.963 1037 3HD1 LEU 37 HD13 LEU 37 -10.872 7.219 3.065 1038 1HD2 LEU 37 HD21 LEU 37 -12.512 3.384 2.123 1039 2HD2 LEU 37 HD22 LEU 37 -10.826 3.647 2.531 1040 3HD2 LEU 37 HD23 LEU 37 -12.047 3.715 3.810 1041 H ILE 38 H ILE 38 -15.327 3.879 3.482 1042 HA ILE 38 HA ILE 38 -14.394 1.780 1.861 1043 HB ILE 38 HB ILE 38 -16.516 1.918 4.015 1044 1HG1 ILE 38 HG12 ILE 38 -13.642 0.865 3.828 1045 2HG1 ILE 38 HG13 ILE 38 -14.156 2.365 4.607 1046 1HG2 ILE 38 HG21 ILE 38 -17.127 -0.011 2.571 1047 2HG2 ILE 38 HG22 ILE 38 -15.471 -0.620 2.707 1048 3HG2 ILE 38 HG23 ILE 38 -16.517 -0.525 4.132 1049 1HD1 ILE 38 HD11 ILE 38 -14.673 -0.468 5.477 1050 2HD1 ILE 38 HD12 ILE 38 -13.821 0.843 6.326 1051 3HD1 ILE 38 HD13 ILE 38 -15.595 0.905 6.149 1052 H GLN 39 H GLN 39 -17.721 3.155 1.918 1053 HA GLN 39 HA GLN 39 -18.740 1.281 0.026 1054 1HB GLN 39 HB2 GLN 39 -19.657 4.146 0.536 1055 2HB GLN 39 HB3 GLN 39 -20.563 2.903 -0.336 1056 1HG GLN 39 HG2 GLN 39 -19.890 2.927 2.629 1057 2HG GLN 39 HG3 GLN 39 -21.470 3.063 1.871 1058 1HE2 GLN 39 HE22 GLN 39 -19.217 0.905 3.266 1059 2HE2 GLN 39 HE21 GLN 39 -20.018 -0.580 2.779 1060 H LYS 40 H LYS 40 -16.835 4.227 -0.477 1061 HA LYS 40 HA LYS 40 -17.377 4.260 -3.352 1062 1HB LYS 40 HB2 LYS 40 -16.991 6.293 -1.994 1063 2HB LYS 40 HB3 LYS 40 -15.363 5.743 -1.622 1064 1HG LYS 40 HG2 LYS 40 -15.155 7.364 -3.343 1065 2HG LYS 40 HG3 LYS 40 -14.782 5.809 -4.059 1066 1HD LYS 40 HD2 LYS 40 -16.161 7.211 -5.542 1067 2HD LYS 40 HD3 LYS 40 -16.973 5.699 -5.147 1068 1HE LYS 40 HE2 LYS 40 -18.468 7.722 -5.114 1069 2HE LYS 40 HE3 LYS 40 -18.476 6.822 -3.598 1070 1HZ LYS 40 HZ1 LYS 40 -18.310 9.175 -3.245 1071 2HZ LYS 40 HZ2 LYS 40 -16.945 8.432 -2.699 1072 3HZ LYS 40 HZ3 LYS 40 -16.919 9.261 -4.125 1073 H GLU 41 H GLU 41 -14.533 3.679 -1.278 1074 HA GLU 41 HA GLU 41 -12.893 2.972 -3.562 1075 1HB GLU 41 HB2 GLU 41 -12.253 2.889 -0.587 1076 2HB GLU 41 HB3 GLU 41 -11.097 2.830 -1.923 1077 1HG GLU 41 HG2 GLU 41 -12.920 5.186 -1.217 1078 2HG GLU 41 HG3 GLU 41 -11.190 5.078 -0.928 1079 H LEU 42 H LEU 42 -14.354 1.129 -0.850 1080 HA LEU 42 HA LEU 42 -13.033 -1.348 -1.870 1081 1HB LEU 42 HB2 LEU 42 -14.756 -1.051 0.589 1082 2HB LEU 42 HB3 LEU 42 -13.807 -2.447 0.085 1083 HG LEU 42 HG LEU 42 -12.785 0.221 1.123 1084 1HD1 LEU 42 HD11 LEU 42 -13.417 -1.543 2.780 1085 2HD1 LEU 42 HD12 LEU 42 -12.276 -2.654 2.002 1086 3HD1 LEU 42 HD13 LEU 42 -11.685 -1.183 2.801 1087 1HD2 LEU 42 HD21 LEU 42 -10.509 -0.570 0.764 1088 2HD2 LEU 42 HD22 LEU 42 -11.103 -1.983 -0.131 1089 3HD2 LEU 42 HD23 LEU 42 -11.313 -0.339 -0.778 1090 H THR 43 H THR 43 -16.172 0.131 -1.325 1091 HA THR 43 HA THR 43 -18.230 -0.347 -2.043 1092 HB THR 43 HB THR 43 -16.864 0.827 -3.800 1093 HG1 THR 43 HG1 THR 43 -18.940 1.125 -3.718 1094 1HG2 THR 43 HG21 THR 43 -17.428 -1.540 -5.596 1095 2HG2 THR 43 HG22 THR 43 -16.660 0.001 -5.987 1096 3HG2 THR 43 HG23 THR 43 -15.824 -1.141 -4.926 1097 H ILE 44 H ILE 44 -18.058 -2.251 -0.699 1098 HA ILE 44 HA ILE 44 -17.684 -4.832 -1.695 1099 HB ILE 44 HB ILE 44 -18.656 -5.676 0.270 1100 1HG1 ILE 44 HG12 ILE 44 -20.756 -4.533 0.473 1101 2HG1 ILE 44 HG13 ILE 44 -19.834 -4.418 1.962 1102 1HG2 ILE 44 HG21 ILE 44 -17.362 -4.561 1.973 1103 2HG2 ILE 44 HG22 ILE 44 -16.462 -4.618 0.452 1104 3HG2 ILE 44 HG23 ILE 44 -17.203 -3.099 0.985 1105 1HD1 ILE 44 HD11 ILE 44 -19.198 -2.063 1.360 1106 2HD1 ILE 44 HD12 ILE 44 -20.264 -2.182 -0.063 1107 3HD1 ILE 44 HD13 ILE 44 -20.938 -2.326 1.560 1108 H GLY 45 H GLY 45 -20.439 -2.792 -2.235 1109 1HA GLY 45 HA2 GLY 45 -22.234 -3.144 -3.634 1110 2HA GLY 45 HA3 GLY 45 -21.671 -4.789 -3.950 1111 H SER 46 H SER 46 -21.749 -6.174 -1.789 1112 HA SER 46 HA SER 46 -24.414 -6.698 -1.106 1113 1HB SER 46 HB2 SER 46 -21.838 -7.458 0.315 1114 2HB SER 46 HB3 SER 46 -23.373 -8.350 0.392 1115 HG SER 46 HG SER 46 -21.780 -9.135 -1.168 1116 H LYS 47 H LYS 47 -24.904 -4.330 -0.440 1117 HA LYS 47 HA LYS 47 -24.128 -3.145 1.921 1118 1HB LYS 47 HB2 LYS 47 -27.008 -3.170 0.938 1119 2HB LYS 47 HB3 LYS 47 -26.226 -1.950 1.946 1120 1HG LYS 47 HG2 LYS 47 -25.757 -2.520 -0.996 1121 2HG LYS 47 HG3 LYS 47 -26.396 -1.059 -0.248 1122 1HD LYS 47 HD2 LYS 47 -24.157 -0.696 0.881 1123 2HD LYS 47 HD3 LYS 47 -23.517 -2.070 -0.036 1124 1HE LYS 47 HE2 LYS 47 -24.615 0.523 -1.198 1125 2HE LYS 47 HE3 LYS 47 -22.926 -0.007 -1.148 1126 1HZ LYS 47 HZ1 LYS 47 -23.626 -1.918 -2.501 1127 2HZ LYS 47 HZ2 LYS 47 -25.112 -1.239 -2.665 1128 3HZ LYS 47 HZ3 LYS 47 -23.790 -0.462 -3.269 1129 H LEU 48 H LEU 48 -26.140 -5.998 1.710 1130 HA LEU 48 HA LEU 48 -27.297 -6.131 4.258 1131 1HB LEU 48 HB2 LEU 48 -25.876 -8.363 2.747 1132 2HB LEU 48 HB3 LEU 48 -27.059 -8.579 4.041 1133 HG LEU 48 HG LEU 48 -27.626 -7.359 1.293 1134 1HD1 LEU 48 HD11 LEU 48 -28.895 -9.424 0.914 1135 2HD1 LEU 48 HD12 LEU 48 -27.192 -9.787 1.249 1136 3HD1 LEU 48 HD13 LEU 48 -28.417 -10.034 2.513 1137 1HD2 LEU 48 HD21 LEU 48 -30.019 -7.546 1.996 1138 2HD2 LEU 48 HD22 LEU 48 -29.487 -7.956 3.640 1139 3HD2 LEU 48 HD23 LEU 48 -29.132 -6.355 2.950 1140 H GLN 49 H GLN 49 -23.899 -6.491 3.362 1141 HA GLN 49 HA GLN 49 -23.072 -7.512 5.962 1142 1HB GLN 49 HB2 GLN 49 -21.484 -6.427 3.603 1143 2HB GLN 49 HB3 GLN 49 -20.792 -7.194 5.037 1144 1HG GLN 49 HG2 GLN 49 -22.068 -9.277 4.557 1145 2HG GLN 49 HG3 GLN 49 -22.744 -8.527 3.104 1146 1HE2 GLN 49 HE22 GLN 49 -19.524 -9.171 4.635 1147 2HE2 GLN 49 HE21 GLN 49 -18.737 -9.562 3.108 1148 H ASP 50 H ASP 50 -24.270 -4.488 5.282 1149 HA ASP 50 HA ASP 50 -22.467 -2.634 6.168 1150 1HB ASP 50 HB2 ASP 50 -24.701 -2.038 5.411 1151 2HB ASP 50 HB3 ASP 50 -25.423 -2.764 6.860 1152 H ALA 51 H ALA 51 -24.305 -4.893 8.238 1153 HA ALA 51 HA ALA 51 -23.612 -3.951 10.797 1154 1HB ALA 51 HB1 ALA 51 -23.857 -6.296 11.510 1155 2HB ALA 51 HB2 ALA 51 -25.154 -5.813 10.399 1156 3HB ALA 51 HB3 ALA 51 -23.815 -6.827 9.815 1157 H GLU 52 H GLU 52 -21.709 -6.012 8.556 1158 HA GLU 52 HA GLU 52 -19.489 -6.395 10.386 1159 1HB GLU 52 HB2 GLU 52 -19.561 -6.690 7.351 1160 2HB GLU 52 HB3 GLU 52 -18.331 -7.299 8.462 1161 1HG GLU 52 HG2 GLU 52 -20.080 -8.713 9.584 1162 2HG GLU 52 HG3 GLU 52 -21.253 -8.195 8.360 1163 H ILE 53 H ILE 53 -20.317 -4.170 7.696 1164 HA ILE 53 HA ILE 53 -17.842 -2.763 7.717 1165 HB ILE 53 HB ILE 53 -20.539 -1.555 7.040 1166 1HG1 ILE 53 HG12 ILE 53 -20.280 -3.510 5.640 1167 2HG1 ILE 53 HG13 ILE 53 -19.964 -2.072 4.685 1168 1HG2 ILE 53 HG21 ILE 53 -19.162 -0.038 5.624 1169 2HG2 ILE 53 HG22 ILE 53 -18.847 0.150 7.351 1170 3HG2 ILE 53 HG23 ILE 53 -17.695 -0.733 6.347 1171 1HD1 ILE 53 HD11 ILE 53 -17.881 -4.005 5.802 1172 2HD1 ILE 53 HD12 ILE 53 -18.379 -3.812 4.118 1173 3HD1 ILE 53 HD13 ILE 53 -17.493 -2.510 4.923 1174 H VAL 54 H VAL 54 -20.807 -2.158 9.739 1175 HA VAL 54 HA VAL 54 -19.464 0.061 10.997 1176 HB VAL 54 HB VAL 54 -21.239 0.064 12.686 1177 1HG1 VAL 54 HG11 VAL 54 -22.876 1.011 11.136 1178 2HG1 VAL 54 HG12 VAL 54 -21.236 1.450 10.636 1179 3HG1 VAL 54 HG13 VAL 54 -22.113 0.153 9.783 1180 1HG2 VAL 54 HG21 VAL 54 -22.599 -2.013 10.979 1181 2HG2 VAL 54 HG22 VAL 54 -21.922 -2.321 12.598 1182 3HG2 VAL 54 HG23 VAL 54 -23.263 -1.181 12.387 1183 H LYS 55 H LYS 55 -19.601 -3.427 11.818 1184 HA LYS 55 HA LYS 55 -18.277 -3.100 14.343 1185 1HB LYS 55 HB2 LYS 55 -19.225 -5.236 13.726 1186 2HB LYS 55 HB3 LYS 55 -18.185 -5.356 12.309 1187 1HG LYS 55 HG2 LYS 55 -17.445 -6.793 14.191 1188 2HG LYS 55 HG3 LYS 55 -16.212 -5.677 13.620 1189 1HD LYS 55 HD2 LYS 55 -16.175 -5.846 16.044 1190 2HD LYS 55 HD3 LYS 55 -16.562 -4.204 15.564 1191 1HE LYS 55 HE2 LYS 55 -18.993 -4.662 16.005 1192 2HE LYS 55 HE3 LYS 55 -18.571 -6.313 16.491 1193 1HZ LYS 55 HZ1 LYS 55 -17.615 -3.847 17.771 1194 2HZ LYS 55 HZ2 LYS 55 -18.794 -4.840 18.353 1195 3HZ LYS 55 HZ3 LYS 55 -17.241 -5.381 18.240 1196 H LEU 56 H LEU 56 -16.965 -3.590 11.042 1197 HA LEU 56 HA LEU 56 -14.224 -3.285 11.660 1198 1HB LEU 56 HB2 LEU 56 -14.908 -4.221 9.632 1199 2HB LEU 56 HB3 LEU 56 -15.889 -2.836 9.173 1200 HG LEU 56 HG LEU 56 -12.979 -2.259 9.589 1201 1HD1 LEU 56 HD11 LEU 56 -14.032 -3.862 7.205 1202 2HD1 LEU 56 HD12 LEU 56 -12.429 -3.107 7.307 1203 3HD1 LEU 56 HD13 LEU 56 -12.853 -4.436 8.404 1204 1HD2 LEU 56 HD21 LEU 56 -14.641 -0.546 8.790 1205 2HD2 LEU 56 HD22 LEU 56 -13.370 -0.899 7.602 1206 3HD2 LEU 56 HD23 LEU 56 -15.003 -1.590 7.411 1207 H MET 57 H MET 57 -16.666 -0.798 10.826 1208 HA MET 57 HA MET 57 -15.024 1.484 10.907 1209 1HB MET 57 HB2 MET 57 -17.438 1.430 10.165 1210 2HB MET 57 HB3 MET 57 -17.882 1.204 11.866 1211 1HG MET 57 HG2 MET 57 -16.682 3.407 12.346 1212 2HG MET 57 HG3 MET 57 -16.647 3.630 10.601 1213 1HE MET 57 HE1 MET 57 -20.441 3.638 13.249 1214 2HE MET 57 HE2 MET 57 -19.623 2.107 12.893 1215 3HE MET 57 HE3 MET 57 -18.785 3.360 13.837 1216 H ASP 58 H ASP 58 -16.886 -0.105 13.568 1217 HA ASP 58 HA ASP 58 -16.050 1.581 15.671 1218 1HB ASP 58 HB2 ASP 58 -17.858 0.048 15.988 1219 2HB ASP 58 HB3 ASP 58 -16.824 -1.350 15.683 1220 H ASP 59 H ASP 59 -14.557 -1.422 14.411 1221 HA ASP 59 HA ASP 59 -12.370 -1.491 16.212 1222 1HB ASP 59 HB2 ASP 59 -12.402 -2.456 13.326 1223 2HB ASP 59 HB3 ASP 59 -11.261 -2.932 14.589 1224 H LEU 60 H LEU 60 -12.609 0.101 13.002 1225 HA LEU 60 HA LEU 60 -9.981 1.254 13.005 1226 1HB LEU 60 HB2 LEU 60 -12.615 1.838 11.629 1227 2HB LEU 60 HB3 LEU 60 -11.299 3.000 11.474 1228 HG LEU 60 HG LEU 60 -10.728 0.100 10.947 1229 1HD1 LEU 60 HD11 LEU 60 -11.959 1.918 8.866 1230 2HD1 LEU 60 HD12 LEU 60 -11.353 0.284 8.600 1231 3HD1 LEU 60 HD13 LEU 60 -12.774 0.539 9.639 1232 1HD2 LEU 60 HD21 LEU 60 -9.178 1.117 9.257 1233 2HD2 LEU 60 HD22 LEU 60 -9.827 2.713 9.601 1234 3HD2 LEU 60 HD23 LEU 60 -8.903 1.853 10.859 1235 H ASP 61 H ASP 61 -13.112 2.682 13.993 1236 HA ASP 61 HA ASP 61 -11.875 5.144 14.797 1237 1HB ASP 61 HB2 ASP 61 -13.993 5.957 15.317 1238 2HB ASP 61 HB3 ASP 61 -14.142 5.003 13.843 1239 H ARG 62 H ARG 62 -12.356 2.197 16.537 1240 HA ARG 62 HA ARG 62 -12.269 2.693 19.144 1241 1HB ARG 62 HB2 ARG 62 -11.599 0.503 18.027 1242 2HB ARG 62 HB3 ARG 62 -10.065 1.243 17.602 1243 1HG ARG 62 HG2 ARG 62 -9.431 0.028 19.422 1244 2HG ARG 62 HG3 ARG 62 -9.708 1.589 20.170 1245 1HD ARG 62 HD2 ARG 62 -11.247 -0.972 20.419 1246 2HD ARG 62 HD3 ARG 62 -10.692 0.151 21.647 1247 HE ARG 62 HE ARG 62 -12.520 1.576 21.295 1248 1HH1 ARG 62 HH21 ARG 62 -12.748 -1.285 19.194 1249 2HH1 ARG 62 HH22 ARG 62 -14.431 -1.040 18.833 1250 1HH2 ARG 62 HH11 ARG 62 -14.675 1.960 20.698 1251 2HH2 ARG 62 HH12 ARG 62 -15.496 0.900 19.583 1252 H ASN 63 H ASN 63 -9.615 3.417 16.959 1253 HA ASN 63 HA ASN 63 -7.596 4.519 18.312 1254 1HB ASN 63 HB2 ASN 63 -7.601 4.562 15.937 1255 2HB ASN 63 HB3 ASN 63 -9.126 5.445 15.863 1256 1HD2 ASN 63 HD22 ASN 63 -9.185 7.704 16.032 1257 2HD2 ASN 63 HD21 ASN 63 -7.713 8.669 16.046 1258 H LYS 64 H LYS 64 -10.594 6.357 17.694 1259 HA LYS 64 HA LYS 64 -10.255 7.926 20.110 1260 1HB LYS 64 HB2 LYS 64 -8.599 8.972 18.486 1261 2HB LYS 64 HB3 LYS 64 -9.977 9.442 17.483 1262 1HG LYS 64 HG2 LYS 64 -10.840 10.812 19.396 1263 2HG LYS 64 HG3 LYS 64 -9.484 10.239 20.388 1264 1HD LYS 64 HD2 LYS 64 -7.875 11.312 18.854 1265 2HD LYS 64 HD3 LYS 64 -9.184 11.757 17.750 1266 1HE LYS 64 HE2 LYS 64 -8.517 13.696 19.088 1267 2HE LYS 64 HE3 LYS 64 -10.183 13.230 19.467 1268 1HZ LYS 64 HZ1 LYS 64 -7.810 12.533 21.058 1269 2HZ LYS 64 HZ2 LYS 64 -8.900 13.715 21.422 1270 3HZ LYS 64 HZ3 LYS 64 -9.368 12.137 21.424 1271 H ASP 65 H ASP 65 -12.182 6.240 19.357 1272 HA ASP 65 HA ASP 65 -14.354 5.900 19.276 1273 1HB ASP 65 HB2 ASP 65 -15.823 7.431 20.536 1274 2HB ASP 65 HB3 ASP 65 -14.356 6.937 21.381 1275 H GLN 66 H GLN 66 -14.358 9.322 18.366 1276 HA GLN 66 HA GLN 66 -16.383 8.833 16.261 1277 1HB GLN 66 HB2 GLN 66 -16.576 10.748 17.827 1278 2HB GLN 66 HB3 GLN 66 -15.035 11.375 17.234 1279 1HG GLN 66 HG2 GLN 66 -16.076 11.575 14.931 1280 2HG GLN 66 HG3 GLN 66 -17.589 10.966 15.606 1281 1HE2 GLN 66 HE22 GLN 66 -15.108 13.516 16.332 1282 2HE2 GLN 66 HE21 GLN 66 -16.305 14.748 16.716 1283 H GLU 67 H GLU 67 -12.927 9.484 16.693 1284 HA GLU 67 HA GLU 67 -12.576 9.945 13.771 1285 1HB GLU 67 HB2 GLU 67 -11.301 11.054 16.240 1286 2HB GLU 67 HB3 GLU 67 -10.236 10.754 14.866 1287 1HG GLU 67 HG2 GLU 67 -11.082 13.046 14.821 1288 2HG GLU 67 HG3 GLU 67 -11.587 12.131 13.395 1289 H VAL 68 H VAL 68 -11.118 8.945 12.603 1290 HA VAL 68 HA VAL 68 -9.512 6.671 13.667 1291 HB VAL 68 HB VAL 68 -10.360 7.205 10.788 1292 1HG1 VAL 68 HG11 VAL 68 -8.308 5.833 11.161 1293 2HG1 VAL 68 HG12 VAL 68 -9.264 4.706 12.143 1294 3HG1 VAL 68 HG13 VAL 68 -9.627 4.914 10.416 1295 1HG2 VAL 68 HG21 VAL 68 -11.673 5.209 12.633 1296 2HG2 VAL 68 HG22 VAL 68 -12.427 6.719 12.076 1297 3HG2 VAL 68 HG23 VAL 68 -12.002 5.456 10.916 1298 H ASN 69 H ASN 69 -7.443 7.572 13.979 1299 HA ASN 69 HA ASN 69 -6.542 9.817 12.297 1300 1HB ASN 69 HB2 ASN 69 -5.273 8.298 14.605 1301 2HB ASN 69 HB3 ASN 69 -4.376 9.452 13.625 1302 1HD2 ASN 69 HD22 ASN 69 -4.587 11.665 13.989 1303 2HD2 ASN 69 HD21 ASN 69 -5.679 12.309 15.200 1304 H PHE 70 H PHE 70 -4.858 9.705 10.838 1305 HA PHE 70 HA PHE 70 -4.798 7.682 9.026 1306 1HB PHE 70 HB2 PHE 70 -3.857 9.862 8.598 1307 2HB PHE 70 HB3 PHE 70 -2.575 9.592 9.779 1308 HD1 PHE 70 HD1 PHE 70 -0.469 8.947 8.944 1309 HD2 PHE 70 HD2 PHE 70 -4.020 7.929 6.717 1310 HE1 PHE 70 HE1 PHE 70 0.903 7.725 7.318 1311 HE2 PHE 70 HE2 PHE 70 -2.626 6.772 5.032 1312 HZ PHE 70 HZ PHE 70 -0.170 6.587 5.373 1313 H GLN 71 H GLN 71 -2.339 7.953 11.644 1314 HA GLN 71 HA GLN 71 -0.848 5.692 10.993 1315 1HB GLN 71 HB2 GLN 71 -0.125 7.195 12.751 1316 2HB GLN 71 HB3 GLN 71 -1.557 6.830 13.728 1317 1HG GLN 71 HG2 GLN 71 0.422 5.707 14.598 1318 2HG GLN 71 HG3 GLN 71 -0.759 4.513 14.083 1319 1HE2 GLN 71 HE22 GLN 71 -0.299 3.236 12.099 1320 2HE2 GLN 71 HE21 GLN 71 1.393 3.130 11.580 1321 H GLU 72 H GLU 72 -3.841 5.835 13.018 1322 HA GLU 72 HA GLU 72 -3.704 2.964 13.460 1323 1HB GLU 72 HB2 GLU 72 -5.774 5.029 14.240 1324 2HB GLU 72 HB3 GLU 72 -5.903 3.299 14.614 1325 1HG GLU 72 HG2 GLU 72 -3.598 5.100 15.504 1326 2HG GLU 72 HG3 GLU 72 -4.933 4.550 16.520 1327 H TYR 73 H TYR 73 -5.291 5.036 11.117 1328 HA TYR 73 HA TYR 73 -6.960 2.976 9.989 1329 1HB TYR 73 HB2 TYR 73 -7.415 5.034 9.116 1330 2HB TYR 73 HB3 TYR 73 -5.744 5.529 9.026 1331 HD1 TYR 73 HD1 TYR 73 -4.355 5.078 7.123 1332 HD2 TYR 73 HD2 TYR 73 -8.461 3.781 7.257 1333 HE1 TYR 73 HE1 TYR 73 -4.358 4.860 4.666 1334 HE2 TYR 73 HE2 TYR 73 -8.517 3.768 4.775 1335 HH TYR 73 HH TYR 73 -5.756 4.746 2.795 1336 H ILE 74 H ILE 74 -3.502 3.872 9.372 1337 HA ILE 74 HA ILE 74 -3.050 1.692 7.581 1338 HB ILE 74 HB ILE 74 -1.045 3.118 9.350 1339 1HG1 ILE 74 HG12 ILE 74 -2.236 4.622 7.719 1340 2HG1 ILE 74 HG13 ILE 74 -0.508 4.528 7.547 1341 1HG2 ILE 74 HG21 ILE 74 -0.028 1.092 8.732 1342 2HG2 ILE 74 HG22 ILE 74 -0.742 1.101 7.106 1343 3HG2 ILE 74 HG23 ILE 74 0.553 2.229 7.513 1344 1HD1 ILE 74 HD11 ILE 74 -0.779 2.957 5.607 1345 2HD1 ILE 74 HD12 ILE 74 -2.546 3.162 5.773 1346 3HD1 ILE 74 HD13 ILE 74 -1.506 4.531 5.345 1347 H THR 75 H THR 75 -2.360 1.890 11.156 1348 HA THR 75 HA THR 75 -1.454 -0.672 11.604 1349 HB THR 75 HB THR 75 -3.485 0.762 13.364 1350 HG1 THR 75 HG1 THR 75 -1.732 1.918 14.163 1351 1HG2 THR 75 HG21 THR 75 -2.226 -0.204 15.223 1352 2HG2 THR 75 HG22 THR 75 -2.841 -1.483 14.163 1353 3HG2 THR 75 HG23 THR 75 -1.131 -1.015 14.091 1354 H PHE 76 H PHE 76 -4.878 0.417 11.484 1355 HA PHE 76 HA PHE 76 -6.034 -2.128 11.942 1356 1HB PHE 76 HB2 PHE 76 -7.310 -0.050 12.187 1357 2HB PHE 76 HB3 PHE 76 -7.157 0.261 10.456 1358 HD1 PHE 76 HD1 PHE 76 -8.640 -2.041 12.999 1359 HD2 PHE 76 HD2 PHE 76 -8.469 -1.016 8.808 1360 HE1 PHE 76 HE1 PHE 76 -10.355 -3.761 12.486 1361 HE2 PHE 76 HE2 PHE 76 -10.333 -2.548 8.356 1362 HZ PHE 76 HZ PHE 76 -11.208 -4.019 10.170 1363 H LEU 77 H LEU 77 -5.195 -0.441 8.819 1364 HA LEU 77 HA LEU 77 -6.147 -2.597 7.199 1365 1HB LEU 77 HB2 LEU 77 -4.016 -0.491 6.727 1366 2HB LEU 77 HB3 LEU 77 -4.444 -1.693 5.507 1367 HG LEU 77 HG LEU 77 -6.502 0.170 6.780 1368 1HD1 LEU 77 HD11 LEU 77 -5.020 0.454 4.139 1369 2HD1 LEU 77 HD12 LEU 77 -6.390 1.442 4.678 1370 3HD1 LEU 77 HD13 LEU 77 -4.855 1.515 5.563 1371 1HD2 LEU 77 HD21 LEU 77 -6.543 -1.659 4.335 1372 2HD2 LEU 77 HD22 LEU 77 -7.557 -1.790 5.789 1373 3HD2 LEU 77 HD23 LEU 77 -7.792 -0.441 4.689 1374 H GLY 78 H GLY 78 -3.064 -2.177 8.925 1375 1HA GLY 78 HA2 GLY 78 -1.802 -4.566 8.011 1376 2HA GLY 78 HA3 GLY 78 -1.580 -3.820 9.613 1377 H ALA 79 H ALA 79 -4.049 -4.045 10.771 1378 HA ALA 79 HA ALA 79 -4.235 -6.797 11.488 1379 1HB ALA 79 HB1 ALA 79 -6.384 -4.664 11.836 1380 2HB ALA 79 HB2 ALA 79 -6.244 -6.198 12.708 1381 3HB ALA 79 HB3 ALA 79 -5.013 -4.940 12.935 1382 H LEU 80 H LEU 80 -6.113 -4.905 9.112 1383 HA LEU 80 HA LEU 80 -8.027 -6.852 8.426 1384 1HB LEU 80 HB2 LEU 80 -7.912 -4.353 7.762 1385 2HB LEU 80 HB3 LEU 80 -6.760 -4.848 6.524 1386 HG LEU 80 HG LEU 80 -8.579 -6.474 5.693 1387 1HD1 LEU 80 HD11 LEU 80 -10.292 -4.568 7.363 1388 2HD1 LEU 80 HD12 LEU 80 -10.911 -5.730 6.180 1389 3HD1 LEU 80 HD13 LEU 80 -10.122 -6.311 7.660 1390 1HD2 LEU 80 HD21 LEU 80 -9.644 -4.684 4.370 1391 2HD2 LEU 80 HD22 LEU 80 -9.071 -3.473 5.525 1392 3HD2 LEU 80 HD23 LEU 80 -7.905 -4.379 4.527 1393 H ALA 81 H ALA 81 -4.797 -6.138 7.046 1394 HA ALA 81 HA ALA 81 -4.668 -8.215 5.118 1395 1HB ALA 81 HB1 ALA 81 -2.459 -6.907 6.740 1396 2HB ALA 81 HB2 ALA 81 -2.218 -7.975 5.351 1397 3HB ALA 81 HB3 ALA 81 -3.059 -6.423 5.152 1398 H MET 82 H MET 82 -3.546 -8.164 8.543 1399 HA MET 82 HA MET 82 -2.684 -10.827 8.685 1400 1HB MET 82 HB2 MET 82 -2.325 -8.962 10.368 1401 2HB MET 82 HB3 MET 82 -3.969 -9.266 10.951 1402 1HG MET 82 HG2 MET 82 -3.278 -11.655 11.425 1403 2HG MET 82 HG3 MET 82 -1.654 -11.240 10.874 1404 1HE MET 82 HE1 MET 82 -4.207 -9.217 13.223 1405 2HE MET 82 HE2 MET 82 -4.332 -10.937 13.667 1406 3HE MET 82 HE3 MET 82 -3.599 -9.776 14.796 1407 H ILE 83 H ILE 83 -5.947 -9.501 9.255 1408 HA ILE 83 HA ILE 83 -7.172 -11.965 10.056 1409 HB ILE 83 HB ILE 83 -8.249 -9.335 9.000 1410 1HG1 ILE 83 HG12 ILE 83 -8.584 -10.627 11.742 1411 2HG1 ILE 83 HG13 ILE 83 -7.177 -9.639 11.360 1412 1HG2 ILE 83 HG21 ILE 83 -10.518 -10.146 9.691 1413 2HG2 ILE 83 HG22 ILE 83 -9.882 -11.026 8.311 1414 3HG2 ILE 83 HG23 ILE 83 -9.838 -11.768 9.925 1415 1HD1 ILE 83 HD11 ILE 83 -8.797 -8.254 12.473 1416 2HD1 ILE 83 HD12 ILE 83 -8.667 -7.722 10.788 1417 3HD1 ILE 83 HD13 ILE 83 -10.067 -8.681 11.318 1418 H TYR 84 H TYR 84 -6.844 -10.345 6.845 1419 HA TYR 84 HA TYR 84 -8.273 -12.313 5.352 1420 1HB TYR 84 HB2 TYR 84 -5.843 -10.681 4.513 1421 2HB TYR 84 HB3 TYR 84 -6.873 -11.621 3.445 1422 HD1 TYR 84 HD1 TYR 84 -9.357 -10.380 5.485 1423 HD2 TYR 84 HD2 TYR 84 -6.385 -8.960 2.684 1424 HE1 TYR 84 HE1 TYR 84 -10.864 -8.581 4.801 1425 HE2 TYR 84 HE2 TYR 84 -7.930 -7.139 2.004 1426 HH TYR 84 HH TYR 84 -11.218 -6.824 3.355 1427 H ASN 85 H ASN 85 -4.886 -12.232 6.409 1428 HA ASN 85 HA ASN 85 -3.467 -13.854 7.015 1429 1HB ASN 85 HB2 ASN 85 -5.319 -14.692 8.325 1430 2HB ASN 85 HB3 ASN 85 -5.934 -15.638 6.974 1431 1HD2 ASN 85 HD22 ASN 85 -5.048 -17.672 6.547 1432 2HD2 ASN 85 HD21 ASN 85 -3.729 -18.339 7.501 1433 H GLU 86 H GLU 86 -5.567 -15.472 4.638 1434 HA GLU 86 HA GLU 86 -3.622 -17.146 3.420 1435 1HB GLU 86 HB2 GLU 86 -6.148 -15.844 2.295 1436 2HB GLU 86 HB3 GLU 86 -5.124 -16.965 1.387 1437 1HG GLU 86 HG2 GLU 86 -6.896 -18.264 2.262 1438 2HG GLU 86 HG3 GLU 86 -5.453 -18.696 3.180 1439 H ALA 87 H ALA 87 -4.475 -13.752 2.875 1440 HA ALA 87 HA ALA 87 -2.880 -13.085 0.677 1441 1HB ALA 87 HB1 ALA 87 -2.847 -10.824 1.656 1442 2HB ALA 87 HB2 ALA 87 -4.461 -11.549 1.791 1443 3HB ALA 87 HB3 ALA 87 -3.401 -11.474 3.218 1444 H LEU 88 H LEU 88 -1.899 -13.523 4.104 1445 HA LEU 88 HA LEU 88 0.810 -12.508 3.670 1446 1HB LEU 88 HB2 LEU 88 -0.546 -13.904 6.012 1447 2HB LEU 88 HB3 LEU 88 1.148 -13.447 5.965 1448 HG LEU 88 HG LEU 88 0.661 -11.103 5.855 1449 1HD1 LEU 88 HD11 LEU 88 -1.640 -10.252 6.135 1450 2HD1 LEU 88 HD12 LEU 88 -1.354 -10.946 4.545 1451 3HD1 LEU 88 HD13 LEU 88 -2.271 -11.875 5.764 1452 1HD2 LEU 88 HD21 LEU 88 -0.412 -10.882 8.072 1453 2HD2 LEU 88 HD22 LEU 88 -1.001 -12.552 7.958 1454 3HD2 LEU 88 HD23 LEU 88 0.744 -12.222 8.049 1455 H LYS 89 H LYS 89 -0.800 -15.690 4.065 1456 HA LYS 89 HA LYS 89 1.594 -17.265 3.875 1457 1HB LYS 89 HB2 LYS 89 -1.332 -17.826 3.267 1458 2HB LYS 89 HB3 LYS 89 -0.070 -18.979 2.842 1459 1HG LYS 89 HG2 LYS 89 -0.892 -19.669 4.926 1460 2HG LYS 89 HG3 LYS 89 0.733 -19.025 5.179 1461 1HD LYS 89 HD2 LYS 89 -0.282 -16.905 6.080 1462 2HD LYS 89 HD3 LYS 89 -1.890 -17.551 5.737 1463 1HE LYS 89 HE2 LYS 89 -1.368 -17.836 8.103 1464 2HE LYS 89 HE3 LYS 89 -1.460 -19.431 7.331 1465 1HZ LYS 89 HZ1 LYS 89 0.401 -19.261 8.779 1466 2HZ LYS 89 HZ2 LYS 89 0.964 -19.379 7.235 1467 3HZ LYS 89 HZ3 LYS 89 0.964 -17.918 8.012 1468 H GLY 90 H GLY 90 -0.595 -15.966 1.359 1469 1HA GLY 90 HA2 GLY 90 -0.255 -15.575 -0.869 1470 2HA GLY 90 HA3 GLY 90 1.492 -15.683 -0.580 Start of MODEL 7 1 1H MET 1 H1 MET 1 -12.550 1.569 -4.759 2 2H MET 1 H2 MET 1 -12.567 0.990 -6.291 3 3H MET 1 H3 MET 1 -12.342 2.600 -6.036 4 HA MET 1 HA MET 1 -10.346 1.294 -6.634 5 1HB MET 1 HB2 MET 1 -10.357 2.960 -4.093 6 2HB MET 1 HB3 MET 1 -8.896 2.436 -4.927 7 1HG MET 1 HG2 MET 1 -9.636 3.560 -6.992 8 2HG MET 1 HG3 MET 1 -11.023 4.226 -6.118 9 1HE MET 1 HE1 MET 1 -10.298 6.620 -6.975 10 2HE MET 1 HE2 MET 1 -8.677 7.313 -6.718 11 3HE MET 1 HE3 MET 1 -8.884 5.918 -7.802 12 H ALA 2 H ALA 2 -12.243 -0.481 -4.845 13 HA ALA 2 HA ALA 2 -11.013 -1.887 -2.947 14 1HB ALA 2 HB1 ALA 2 -12.182 -3.891 -3.766 15 2HB ALA 2 HB2 ALA 2 -13.216 -2.464 -3.973 16 3HB ALA 2 HB3 ALA 2 -12.390 -3.154 -5.368 17 H SER 3 H SER 3 -10.511 -2.875 -6.416 18 HA SER 3 HA SER 3 -8.456 -4.672 -5.908 19 1HB SER 3 HB2 SER 3 -8.068 -3.835 -8.518 20 2HB SER 3 HB3 SER 3 -9.180 -5.087 -7.957 21 HG SER 3 HG SER 3 -10.291 -3.526 -9.199 22 HA PRO 4 HA PRO 4 -5.339 -0.899 -6.946 23 1HB PRO 4 HB2 PRO 4 -7.275 1.086 -5.777 24 2HB PRO 4 HB3 PRO 4 -5.883 1.376 -6.857 25 1HG PRO 4 HG2 PRO 4 -8.341 1.192 -7.943 26 2HG PRO 4 HG3 PRO 4 -6.962 0.348 -8.699 27 1HD PRO 4 HD2 PRO 4 -9.157 -0.840 -7.032 28 2HD PRO 4 HD3 PRO 4 -8.291 -1.490 -8.444 29 H LEU 5 H LEU 5 -7.540 -0.641 -4.021 30 HA LEU 5 HA LEU 5 -5.316 -0.193 -2.293 31 1HB LEU 5 HB2 LEU 5 -7.587 0.410 -1.603 32 2HB LEU 5 HB3 LEU 5 -8.064 -1.292 -1.606 33 HG LEU 5 HG LEU 5 -6.415 -1.789 0.188 34 1HD1 LEU 5 HD11 LEU 5 -4.673 -0.087 -0.216 35 2HD1 LEU 5 HD12 LEU 5 -5.338 0.075 1.405 36 3HD1 LEU 5 HD13 LEU 5 -5.835 1.215 0.138 37 1HD2 LEU 5 HD21 LEU 5 -7.475 -0.626 2.009 38 2HD2 LEU 5 HD22 LEU 5 -8.163 0.575 0.884 39 3HD2 LEU 5 HD23 LEU 5 -8.680 -1.138 0.809 40 H ASP 6 H ASP 6 -7.154 -3.157 -3.134 41 HA ASP 6 HA ASP 6 -5.856 -4.935 -1.376 42 1HB ASP 6 HB2 ASP 6 -6.966 -5.504 -4.157 43 2HB ASP 6 HB3 ASP 6 -6.504 -6.727 -2.972 44 H GLN 7 H GLN 7 -4.909 -4.031 -4.734 45 HA GLN 7 HA GLN 7 -2.528 -5.642 -4.676 46 1HB GLN 7 HB2 GLN 7 -1.762 -4.413 -6.602 47 2HB GLN 7 HB3 GLN 7 -3.439 -4.941 -6.785 48 1HG GLN 7 HG2 GLN 7 -4.222 -2.682 -6.248 49 2HG GLN 7 HG3 GLN 7 -2.579 -2.080 -6.082 50 1HE2 GLN 7 HE21 GLN 7 -1.140 -2.510 -8.119 51 2HE2 GLN 7 HE22 GLN 7 -1.948 -2.271 -9.657 52 H ALA 8 H ALA 8 -3.137 -2.216 -3.689 53 HA ALA 8 HA ALA 8 -0.405 -1.605 -3.206 54 1HB ALA 8 HB1 ALA 8 -2.901 -0.484 -1.906 55 2HB ALA 8 HB2 ALA 8 -2.012 0.111 -3.331 56 3HB ALA 8 HB3 ALA 8 -1.256 0.158 -1.728 57 H ILE 9 H ILE 9 -2.901 -2.758 -0.815 58 HA ILE 9 HA ILE 9 -0.986 -3.073 1.297 59 HB ILE 9 HB ILE 9 -2.605 -4.417 2.454 60 1HG1 ILE 9 HG12 ILE 9 -4.285 -4.372 -0.033 61 2HG1 ILE 9 HG13 ILE 9 -3.505 -5.803 0.659 62 1HG2 ILE 9 HG21 ILE 9 -2.738 -1.932 2.345 63 2HG2 ILE 9 HG22 ILE 9 -3.976 -2.092 1.083 64 3HG2 ILE 9 HG23 ILE 9 -4.269 -2.712 2.722 65 1HD1 ILE 9 HD11 ILE 9 -5.791 -5.854 1.325 66 2HD1 ILE 9 HD12 ILE 9 -5.763 -4.188 1.909 67 3HD1 ILE 9 HD13 ILE 9 -4.848 -5.447 2.771 68 H GLY 10 H GLY 10 -2.157 -5.273 -1.253 69 1HA GLY 10 HA2 GLY 10 -0.746 -7.604 -0.878 70 2HA GLY 10 HA3 GLY 10 -1.077 -6.852 -2.440 71 H LEU 11 H LEU 11 0.507 -4.540 -2.307 72 HA LEU 11 HA LEU 11 3.021 -5.513 -3.085 73 1HB LEU 11 HB2 LEU 11 1.792 -3.254 -3.579 74 2HB LEU 11 HB3 LEU 11 2.517 -2.687 -2.083 75 HG LEU 11 HG LEU 11 3.822 -1.886 -3.849 76 1HD1 LEU 11 HD11 LEU 11 5.420 -4.242 -2.848 77 2HD1 LEU 11 HD12 LEU 11 6.005 -2.672 -3.425 78 3HD1 LEU 11 HD13 LEU 11 5.094 -2.761 -1.905 79 1HD2 LEU 11 HD21 LEU 11 4.068 -4.695 -4.979 80 2HD2 LEU 11 HD22 LEU 11 3.049 -3.381 -5.618 81 3HD2 LEU 11 HD23 LEU 11 4.812 -3.214 -5.616 82 H LEU 12 H LEU 12 2.226 -3.628 -0.137 83 HA LEU 12 HA LEU 12 4.672 -3.914 1.242 84 1HB LEU 12 HB2 LEU 12 1.776 -3.713 2.225 85 2HB LEU 12 HB3 LEU 12 3.153 -3.785 3.319 86 HG LEU 12 HG LEU 12 4.100 -1.756 2.338 87 1HD1 LEU 12 HD11 LEU 12 2.626 -0.251 0.979 88 2HD1 LEU 12 HD12 LEU 12 3.081 -1.698 0.087 89 3HD1 LEU 12 HD13 LEU 12 1.460 -1.572 0.820 90 1HD2 LEU 12 HD21 LEU 12 2.435 -0.189 3.337 91 2HD2 LEU 12 HD22 LEU 12 1.252 -1.513 3.387 92 3HD2 LEU 12 HD23 LEU 12 2.743 -1.595 4.351 93 H ILE 13 H ILE 13 1.804 -6.044 1.254 94 HA ILE 13 HA ILE 13 2.800 -7.876 3.186 95 HB ILE 13 HB ILE 13 0.770 -8.180 0.925 96 1HG1 ILE 13 HG12 ILE 13 0.251 -8.078 3.919 97 2HG1 ILE 13 HG13 ILE 13 0.397 -6.591 2.989 98 1HG2 ILE 13 HG21 ILE 13 -0.042 -10.204 2.125 99 2HG2 ILE 13 HG22 ILE 13 1.570 -10.433 1.455 100 3HG2 ILE 13 HG23 ILE 13 1.375 -10.099 3.191 101 1HD1 ILE 13 HD11 ILE 13 -1.721 -8.739 2.718 102 2HD1 ILE 13 HD12 ILE 13 -1.904 -7.001 3.027 103 3HD1 ILE 13 HD13 ILE 13 -1.421 -7.557 1.425 104 H GLY 14 H GLY 14 2.926 -7.994 -0.384 105 1HA GLY 14 HA2 GLY 14 4.293 -10.443 -0.673 106 2HA GLY 14 HA3 GLY 14 4.295 -9.092 -1.826 107 H ILE 15 H ILE 15 5.561 -7.056 -0.587 108 HA ILE 15 HA ILE 15 8.304 -7.648 -0.788 109 HB ILE 15 HB ILE 15 6.670 -5.368 0.258 110 1HG1 ILE 15 HG12 ILE 15 8.962 -5.712 -1.732 111 2HG1 ILE 15 HG13 ILE 15 7.232 -5.650 -2.123 112 1HG2 ILE 15 HG21 ILE 15 9.643 -5.609 0.806 113 2HG2 ILE 15 HG22 ILE 15 8.671 -4.126 0.963 114 3HG2 ILE 15 HG23 ILE 15 8.313 -5.494 1.994 115 1HD1 ILE 15 HD11 ILE 15 7.251 -3.285 -1.116 116 2HD1 ILE 15 HD12 ILE 15 9.026 -3.408 -1.150 117 3HD1 ILE 15 HD13 ILE 15 8.112 -3.517 -2.655 118 H PHE 16 H PHE 16 6.302 -7.365 2.174 119 HA PHE 16 HA PHE 16 8.366 -8.070 3.975 120 1HB PHE 16 HB2 PHE 16 6.138 -7.063 4.505 121 2HB PHE 16 HB3 PHE 16 5.384 -8.621 4.222 122 HD1 PHE 16 HD1 PHE 16 6.076 -10.617 5.729 123 HD2 PHE 16 HD2 PHE 16 7.405 -6.612 6.518 124 HE1 PHE 16 HE1 PHE 16 6.381 -11.194 8.083 125 HE2 PHE 16 HE2 PHE 16 7.648 -7.182 8.934 126 HZ PHE 16 HZ PHE 16 6.997 -9.405 9.737 127 H HIS 17 H HIS 17 5.916 -10.206 2.431 128 HA HIS 17 HA HIS 17 6.931 -12.451 3.910 129 1HB HIS 17 HB2 HIS 17 4.769 -12.240 1.827 130 2HB HIS 17 HB3 HIS 17 5.241 -13.759 2.607 131 HD1 HIS 17 HD1 HIS 17 3.697 -10.387 3.500 132 HD2 HIS 17 HD2 HIS 17 4.938 -13.963 5.305 133 HE1 HIS 17 HE1 HIS 17 2.973 -10.266 5.959 134 H LYS 18 H LYS 18 7.786 -11.200 0.751 135 HA LYS 18 HA LYS 18 9.074 -13.583 -0.245 136 1HB LYS 18 HB2 LYS 18 9.715 -10.616 -0.488 137 2HB LYS 18 HB3 LYS 18 10.649 -11.869 -1.320 138 1HG LYS 18 HG2 LYS 18 8.790 -12.557 -2.645 139 2HG LYS 18 HG3 LYS 18 7.640 -11.656 -1.650 140 1HD LYS 18 HD2 LYS 18 8.719 -9.511 -2.341 141 2HD LYS 18 HD3 LYS 18 9.873 -10.415 -3.332 142 1HE LYS 18 HE2 LYS 18 8.100 -9.480 -4.728 143 2HE LYS 18 HE3 LYS 18 8.009 -11.251 -4.748 144 1HZ LYS 18 HZ1 LYS 18 5.868 -10.234 -4.490 145 2HZ LYS 18 HZ2 LYS 18 6.240 -11.101 -3.140 146 3HZ LYS 18 HZ3 LYS 18 6.349 -9.455 -3.119 147 H TYR 19 H TYR 19 10.315 -10.855 1.714 148 HA TYR 19 HA TYR 19 12.851 -12.075 2.261 149 1HB TYR 19 HB2 TYR 19 11.327 -9.719 3.344 150 2HB TYR 19 HB3 TYR 19 12.794 -10.266 4.142 151 HD1 TYR 19 HD1 TYR 19 11.481 -8.837 0.975 152 HD2 TYR 19 HD2 TYR 19 14.980 -10.146 3.116 153 HE1 TYR 19 HE1 TYR 19 12.913 -7.693 -0.670 154 HE2 TYR 19 HE2 TYR 19 16.414 -9.120 1.383 155 HH TYR 19 HH TYR 19 16.226 -7.126 -0.019 156 H SER 20 H SER 20 9.775 -12.035 4.101 157 HA SER 20 HA SER 20 10.805 -13.444 6.366 158 1HB SER 20 HB2 SER 20 8.011 -13.818 5.239 159 2HB SER 20 HB3 SER 20 8.583 -14.059 6.889 160 HG SER 20 HG SER 20 8.603 -11.539 5.536 161 H GLY 21 H GLY 21 9.272 -14.705 3.364 162 1HA GLY 21 HA2 GLY 21 9.380 -17.415 3.740 163 2HA GLY 21 HA3 GLY 21 9.611 -16.606 2.181 164 H LYS 22 H LYS 22 12.061 -15.333 2.583 165 HA LYS 22 HA LYS 22 13.999 -17.241 2.056 166 1HB LYS 22 HB2 LYS 22 14.082 -14.679 1.874 167 2HB LYS 22 HB3 LYS 22 14.613 -14.687 3.570 168 1HG LYS 22 HG2 LYS 22 16.460 -16.321 2.819 169 2HG LYS 22 HG3 LYS 22 15.999 -15.930 1.156 170 1HD LYS 22 HD2 LYS 22 17.020 -14.023 3.311 171 2HD LYS 22 HD3 LYS 22 17.911 -14.575 1.891 172 1HE LYS 22 HE2 LYS 22 16.296 -13.399 0.408 173 2HE LYS 22 HE3 LYS 22 15.397 -12.832 1.832 174 1HZ LYS 22 HZ1 LYS 22 16.906 -11.198 1.030 175 2HZ LYS 22 HZ2 LYS 22 17.286 -11.672 2.565 176 3HZ LYS 22 HZ3 LYS 22 18.196 -12.192 1.285 177 H GLU 23 H GLU 23 12.926 -16.104 5.250 178 HA GLU 23 HA GLU 23 14.556 -18.215 6.593 179 1HB GLU 23 HB2 GLU 23 14.520 -16.776 8.591 180 2HB GLU 23 HB3 GLU 23 15.414 -16.067 7.239 181 1HG GLU 23 HG2 GLU 23 13.536 -14.573 6.711 182 2HG GLU 23 HG3 GLU 23 12.553 -15.312 7.986 183 H GLY 24 H GLY 24 11.972 -18.573 5.302 184 1HA GLY 24 HA2 GLY 24 10.291 -20.058 5.888 185 2HA GLY 24 HA3 GLY 24 10.535 -19.743 7.609 186 H ASP 25 H ASP 25 8.149 -19.583 5.567 187 HA ASP 25 HA ASP 25 7.334 -16.821 5.536 188 1HB ASP 25 HB2 ASP 25 5.762 -19.364 4.970 189 2HB ASP 25 HB3 ASP 25 5.213 -17.717 4.637 190 H LYS 26 H LYS 26 7.812 -16.766 7.989 191 HA LYS 26 HA LYS 26 5.288 -17.106 9.550 192 1HB LYS 26 HB2 LYS 26 6.697 -16.587 11.510 193 2HB LYS 26 HB3 LYS 26 7.194 -18.071 10.687 194 1HG LYS 26 HG2 LYS 26 9.090 -16.894 9.628 195 2HG LYS 26 HG3 LYS 26 8.577 -15.365 10.357 196 1HD LYS 26 HD2 LYS 26 8.918 -16.389 12.621 197 2HD LYS 26 HD3 LYS 26 9.483 -17.876 11.833 198 1HE LYS 26 HE2 LYS 26 11.329 -16.645 10.753 199 2HE LYS 26 HE3 LYS 26 10.746 -15.116 11.436 200 1HZ LYS 26 HZ1 LYS 26 11.695 -17.409 12.998 201 2HZ LYS 26 HZ2 LYS 26 12.535 -16.023 12.698 202 3HZ LYS 26 HZ3 LYS 26 11.165 -15.970 13.609 203 H HIS 27 H HIS 27 4.391 -15.157 10.447 204 HA HIS 27 HA HIS 27 4.769 -12.904 8.646 205 1HB HIS 27 HB2 HIS 27 2.918 -13.222 11.026 206 2HB HIS 27 HB3 HIS 27 2.807 -11.996 9.758 207 HD1 HIS 27 HD1 HIS 27 0.350 -13.874 10.195 208 HD2 HIS 27 HD2 HIS 27 3.505 -14.587 7.497 209 HE1 HIS 27 HE1 HIS 27 -0.555 -15.431 8.383 210 H THR 28 H THR 28 7.166 -13.138 9.922 211 HA THR 28 HA THR 28 7.462 -10.659 11.354 212 HB THR 28 HB THR 28 6.636 -11.851 13.205 213 HG1 THR 28 HG1 THR 28 9.378 -12.074 13.659 214 1HG2 THR 28 HG21 THR 28 8.660 -14.045 12.673 215 2HG2 THR 28 HG22 THR 28 7.605 -13.902 14.096 216 3HG2 THR 28 HG23 THR 28 6.891 -14.172 12.500 217 H LEU 29 H LEU 29 9.323 -9.805 10.705 218 HA LEU 29 HA LEU 29 11.309 -11.524 9.287 219 1HB LEU 29 HB2 LEU 29 10.903 -8.524 9.560 220 2HB LEU 29 HB3 LEU 29 12.309 -9.222 8.765 221 HG LEU 29 HG LEU 29 9.477 -9.799 7.822 222 1HD1 LEU 29 HD11 LEU 29 9.932 -7.316 7.799 223 2HD1 LEU 29 HD12 LEU 29 11.393 -7.632 6.843 224 3HD1 LEU 29 HD13 LEU 29 9.797 -8.022 6.173 225 1HD2 LEU 29 HD21 LEU 29 12.207 -9.864 6.451 226 2HD2 LEU 29 HD22 LEU 29 11.284 -11.293 6.971 227 3HD2 LEU 29 HD23 LEU 29 10.644 -10.227 5.695 228 H SER 30 H SER 30 13.477 -11.626 10.043 229 HA SER 30 HA SER 30 14.004 -10.638 12.799 230 1HB SER 30 HB2 SER 30 14.963 -12.813 12.068 231 2HB SER 30 HB3 SER 30 15.810 -12.008 10.730 232 HG SER 30 HG SER 30 17.086 -12.338 12.675 233 H LYS 31 H LYS 31 15.473 -8.898 13.215 234 HA LYS 31 HA LYS 31 14.948 -6.708 11.657 235 1HB LYS 31 HB2 LYS 31 16.458 -5.471 13.023 236 2HB LYS 31 HB3 LYS 31 15.549 -6.620 13.988 237 1HG LYS 31 HG2 LYS 31 17.567 -8.141 14.003 238 2HG LYS 31 HG3 LYS 31 18.458 -6.869 13.123 239 1HD LYS 31 HD2 LYS 31 17.865 -5.272 14.997 240 2HD LYS 31 HD3 LYS 31 17.189 -6.648 15.887 241 1HE LYS 31 HE2 LYS 31 19.430 -7.766 15.796 242 2HE LYS 31 HE3 LYS 31 20.080 -6.351 14.928 243 1HZ LYS 31 HZ1 LYS 31 20.579 -6.186 17.203 244 2HZ LYS 31 HZ2 LYS 31 19.435 -5.041 16.879 245 3HZ LYS 31 HZ3 LYS 31 19.020 -6.446 17.652 246 H LYS 32 H LYS 32 17.855 -8.756 11.369 247 HA LYS 32 HA LYS 32 19.123 -6.934 9.488 248 1HB LYS 32 HB2 LYS 32 19.832 -9.861 9.707 249 2HB LYS 32 HB3 LYS 32 20.781 -8.473 9.154 250 1HG LYS 32 HG2 LYS 32 21.734 -8.631 11.149 251 2HG LYS 32 HG3 LYS 32 20.379 -7.630 11.672 252 1HD LYS 32 HD2 LYS 32 19.185 -9.716 12.438 253 2HD LYS 32 HD3 LYS 32 20.510 -10.702 11.817 254 1HE LYS 32 HE2 LYS 32 20.808 -8.590 14.000 255 2HE LYS 32 HE3 LYS 32 20.565 -10.320 14.298 256 1HZ LYS 32 HZ1 LYS 32 22.852 -9.756 14.397 257 2HZ LYS 32 HZ2 LYS 32 22.593 -10.749 13.109 258 3HZ LYS 32 HZ3 LYS 32 22.839 -9.136 12.873 259 H GLU 33 H GLU 33 16.847 -9.643 9.217 260 HA GLU 33 HA GLU 33 17.138 -10.003 6.357 261 1HB GLU 33 HB2 GLU 33 16.072 -11.686 7.965 262 2HB GLU 33 HB3 GLU 33 14.690 -10.582 8.087 263 1HG GLU 33 HG2 GLU 33 14.086 -12.177 6.435 264 2HG GLU 33 HG3 GLU 33 14.503 -10.722 5.540 265 H LEU 34 H LEU 34 15.006 -8.168 8.551 266 HA LEU 34 HA LEU 34 13.591 -6.695 6.595 267 1HB LEU 34 HB2 LEU 34 12.796 -6.646 8.792 268 2HB LEU 34 HB3 LEU 34 14.325 -6.147 9.472 269 HG LEU 34 HG LEU 34 12.597 -4.399 9.495 270 1HD1 LEU 34 HD11 LEU 34 14.066 -2.651 9.201 271 2HD1 LEU 34 HD12 LEU 34 15.175 -4.009 9.325 272 3HD1 LEU 34 HD13 LEU 34 14.794 -3.340 7.753 273 1HD2 LEU 34 HD21 LEU 34 11.895 -3.236 7.467 274 2HD2 LEU 34 HD22 LEU 34 12.787 -4.376 6.469 275 3HD2 LEU 34 HD23 LEU 34 11.421 -4.939 7.441 276 H LYS 35 H LYS 35 16.841 -5.956 8.112 277 HA LYS 35 HA LYS 35 17.200 -3.603 6.643 278 1HB LYS 35 HB2 LYS 35 18.748 -4.585 8.438 279 2HB LYS 35 HB3 LYS 35 19.517 -5.511 7.125 280 1HG LYS 35 HG2 LYS 35 19.824 -3.339 5.874 281 2HG LYS 35 HG3 LYS 35 19.110 -2.510 7.266 282 1HD LYS 35 HD2 LYS 35 20.975 -3.372 8.691 283 2HD LYS 35 HD3 LYS 35 21.735 -4.057 7.240 284 1HE LYS 35 HE2 LYS 35 21.004 -1.107 7.651 285 2HE LYS 35 HE3 LYS 35 22.637 -1.791 7.830 286 1HZ LYS 35 HZ1 LYS 35 21.072 -1.732 5.352 287 2HZ LYS 35 HZ2 LYS 35 22.377 -0.797 5.711 288 3HZ LYS 35 HZ3 LYS 35 22.557 -2.423 5.522 289 H GLU 36 H GLU 36 17.883 -6.943 5.609 290 HA GLU 36 HA GLU 36 18.834 -6.255 2.997 291 1HB GLU 36 HB2 GLU 36 18.886 -8.521 4.411 292 2HB GLU 36 HB3 GLU 36 17.397 -8.859 3.540 293 1HG GLU 36 HG2 GLU 36 19.295 -9.804 2.332 294 2HG GLU 36 HG3 GLU 36 18.651 -8.460 1.375 295 H LEU 37 H LEU 37 15.573 -6.714 4.258 296 HA LEU 37 HA LEU 37 14.192 -6.397 1.766 297 1HB LEU 37 HB2 LEU 37 13.172 -7.258 3.806 298 2HB LEU 37 HB3 LEU 37 13.271 -5.687 4.575 299 HG LEU 37 HG LEU 37 11.709 -6.073 2.027 300 1HD1 LEU 37 HD11 LEU 37 9.740 -6.260 3.486 301 2HD1 LEU 37 HD12 LEU 37 10.869 -7.575 3.823 302 3HD1 LEU 37 HD13 LEU 37 10.766 -6.171 4.931 303 1HD2 LEU 37 HD21 LEU 37 11.634 -3.987 4.287 304 2HD2 LEU 37 HD22 LEU 37 12.133 -3.679 2.619 305 3HD2 LEU 37 HD23 LEU 37 10.466 -4.125 2.964 306 H ILE 38 H ILE 38 14.999 -3.912 4.249 307 HA ILE 38 HA ILE 38 13.900 -1.769 2.863 308 HB ILE 38 HB ILE 38 16.384 -1.642 4.593 309 1HG1 ILE 38 HG12 ILE 38 13.523 -0.915 5.348 310 2HG1 ILE 38 HG13 ILE 38 14.153 -2.540 5.618 311 1HG2 ILE 38 HG21 ILE 38 16.184 0.385 3.195 312 2HG2 ILE 38 HG22 ILE 38 14.441 0.452 3.509 313 3HG2 ILE 38 HG23 ILE 38 15.594 0.827 4.782 314 1HD1 ILE 38 HD11 ILE 38 14.433 -1.088 7.610 315 2HD1 ILE 38 HD12 ILE 38 16.005 -1.658 6.983 316 3HD1 ILE 38 HD13 ILE 38 15.474 -0.021 6.677 317 H GLN 39 H GLN 39 17.253 -3.028 2.663 318 HA GLN 39 HA GLN 39 18.258 -1.038 0.988 319 1HB GLN 39 HB2 GLN 39 18.981 -3.963 1.295 320 2HB GLN 39 HB3 GLN 39 19.905 -2.886 0.233 321 1HG GLN 39 HG2 GLN 39 20.565 -1.448 2.004 322 2HG GLN 39 HG3 GLN 39 19.381 -2.119 3.132 323 1HE2 GLN 39 HE22 GLN 39 19.611 -4.422 3.679 324 2HE2 GLN 39 HE21 GLN 39 21.228 -5.124 3.810 325 H LYS 40 H LYS 40 16.351 -3.902 0.044 326 HA LYS 40 HA LYS 40 16.585 -3.277 -2.811 327 1HB LYS 40 HB2 LYS 40 16.290 -5.577 -1.973 328 2HB LYS 40 HB3 LYS 40 14.735 -5.143 -1.273 329 1HG LYS 40 HG2 LYS 40 14.396 -6.331 -3.346 330 2HG LYS 40 HG3 LYS 40 13.800 -4.685 -3.499 331 1HD LYS 40 HD2 LYS 40 14.995 -5.455 -5.524 332 2HD LYS 40 HD3 LYS 40 15.732 -4.017 -4.828 333 1HE LYS 40 HE2 LYS 40 17.400 -5.708 -5.593 334 2HE LYS 40 HE3 LYS 40 17.562 -5.345 -3.874 335 1HZ LYS 40 HZ1 LYS 40 17.676 -7.682 -4.315 336 2HZ LYS 40 HZ2 LYS 40 16.353 -7.348 -3.394 337 3HZ LYS 40 HZ3 LYS 40 16.176 -7.681 -5.000 338 H GLU 41 H GLU 41 13.979 -3.234 -0.394 339 HA GLU 41 HA GLU 41 11.836 -2.230 -1.776 340 1HB GLU 41 HB2 GLU 41 11.807 -3.095 0.494 341 2HB GLU 41 HB3 GLU 41 12.765 -1.714 1.052 342 1HG GLU 41 HG2 GLU 41 10.805 -0.219 0.480 343 2HG GLU 41 HG3 GLU 41 9.871 -1.684 0.159 344 H LEU 42 H LEU 42 14.261 -0.235 -0.035 345 HA LEU 42 HA LEU 42 13.190 2.213 -1.346 346 1HB LEU 42 HB2 LEU 42 15.072 1.971 1.017 347 2HB LEU 42 HB3 LEU 42 14.329 3.450 0.397 348 HG LEU 42 HG LEU 42 12.901 1.134 1.762 349 1HD1 LEU 42 HD11 LEU 42 13.227 4.061 2.563 350 2HD1 LEU 42 HD12 LEU 42 12.471 2.768 3.518 351 3HD1 LEU 42 HD13 LEU 42 14.216 2.740 3.203 352 1HD2 LEU 42 HD21 LEU 42 11.740 3.696 0.573 353 2HD2 LEU 42 HD22 LEU 42 11.384 2.034 0.052 354 3HD2 LEU 42 HD23 LEU 42 10.871 2.583 1.648 355 H THR 43 H THR 43 15.171 0.059 -2.472 356 HA THR 43 HA THR 43 17.081 0.039 -3.719 357 HB THR 43 HB THR 43 17.060 1.887 -5.415 358 HG1 THR 43 HG1 THR 43 16.040 3.321 -3.598 359 1HG2 THR 43 HG21 THR 43 14.296 0.764 -4.760 360 2HG2 THR 43 HG22 THR 43 14.845 1.372 -6.329 361 3HG2 THR 43 HG23 THR 43 15.570 -0.099 -5.649 362 H ILE 44 H ILE 44 18.111 0.341 -1.462 363 HA ILE 44 HA ILE 44 18.968 2.062 0.046 364 HB ILE 44 HB ILE 44 19.988 -0.075 0.024 365 1HG1 ILE 44 HG12 ILE 44 22.210 0.399 0.884 366 2HG1 ILE 44 HG13 ILE 44 22.177 2.029 0.205 367 1HG2 ILE 44 HG21 ILE 44 21.870 -0.763 -1.257 368 2HG2 ILE 44 HG22 ILE 44 20.590 -0.263 -2.368 369 3HG2 ILE 44 HG23 ILE 44 21.987 0.795 -2.082 370 1HD1 ILE 44 HD11 ILE 44 20.366 2.672 1.723 371 2HD1 ILE 44 HD12 ILE 44 20.182 0.992 2.280 372 3HD1 ILE 44 HD13 ILE 44 21.655 1.909 2.657 373 H GLY 45 H GLY 45 18.623 4.170 -0.577 374 1HA GLY 45 HA2 GLY 45 19.956 5.474 -2.700 375 2HA GLY 45 HA3 GLY 45 19.023 6.236 -1.409 376 H SER 46 H SER 46 22.160 4.676 -1.909 377 HA SER 46 HA SER 46 24.280 5.547 -1.742 378 1HB SER 46 HB2 SER 46 23.471 7.619 0.318 379 2HB SER 46 HB3 SER 46 24.946 7.518 -0.643 380 HG SER 46 HG SER 46 22.330 8.154 -1.457 381 H LYS 47 H LYS 47 25.562 4.171 -0.649 382 HA LYS 47 HA LYS 47 24.685 2.585 1.484 383 1HB LYS 47 HB2 LYS 47 27.568 3.247 0.760 384 2HB LYS 47 HB3 LYS 47 27.003 1.838 1.662 385 1HG LYS 47 HG2 LYS 47 26.486 2.447 -1.286 386 2HG LYS 47 HG3 LYS 47 27.527 1.201 -0.603 387 1HD LYS 47 HD2 LYS 47 25.516 0.137 0.469 388 2HD LYS 47 HD3 LYS 47 24.480 1.304 -0.371 389 1HE LYS 47 HE2 LYS 47 26.358 -0.674 -1.737 390 2HE LYS 47 HE3 LYS 47 24.610 -0.871 -1.545 391 1HZ LYS 47 HZ1 LYS 47 25.135 -0.009 -3.680 392 2HZ LYS 47 HZ2 LYS 47 24.295 1.121 -2.826 393 3HZ LYS 47 HZ3 LYS 47 25.922 1.286 -3.039 394 H LEU 48 H LEU 48 26.268 5.710 1.597 395 HA LEU 48 HA LEU 48 27.086 5.839 4.277 396 1HB LEU 48 HB2 LEU 48 25.865 7.966 2.458 397 2HB LEU 48 HB3 LEU 48 26.547 8.312 4.041 398 HG LEU 48 HG LEU 48 28.097 8.921 2.348 399 1HD1 LEU 48 HD11 LEU 48 30.095 7.850 3.153 400 2HD1 LEU 48 HD12 LEU 48 28.966 8.032 4.507 401 3HD1 LEU 48 HD13 LEU 48 29.192 6.444 3.737 402 1HD2 LEU 48 HD21 LEU 48 29.162 7.476 0.785 403 2HD2 LEU 48 HD22 LEU 48 28.357 6.039 1.421 404 3HD2 LEU 48 HD23 LEU 48 27.414 7.293 0.569 405 H GLN 49 H GLN 49 23.793 5.791 3.011 406 HA GLN 49 HA GLN 49 22.607 6.899 5.415 407 1HB GLN 49 HB2 GLN 49 21.344 5.164 3.252 408 2HB GLN 49 HB3 GLN 49 20.490 6.118 4.471 409 1HG GLN 49 HG2 GLN 49 22.200 7.181 2.191 410 2HG GLN 49 HG3 GLN 49 20.455 7.321 2.364 411 1HE2 GLN 49 HE22 GLN 49 19.806 8.428 4.609 412 2HE2 GLN 49 HE21 GLN 49 20.749 9.864 4.976 413 H ASP 50 H ASP 50 24.186 3.911 4.942 414 HA ASP 50 HA ASP 50 22.576 2.002 6.039 415 1HB ASP 50 HB2 ASP 50 24.551 0.828 6.747 416 2HB ASP 50 HB3 ASP 50 24.835 1.560 5.168 417 H ALA 51 H ALA 51 24.517 4.314 7.919 418 HA ALA 51 HA ALA 51 23.880 3.475 10.535 419 1HB ALA 51 HB1 ALA 51 25.510 5.230 10.006 420 2HB ALA 51 HB2 ALA 51 24.204 6.315 9.477 421 3HB ALA 51 HB3 ALA 51 24.312 5.817 11.181 422 H GLU 52 H GLU 52 21.991 5.519 8.304 423 HA GLU 52 HA GLU 52 19.920 6.163 10.242 424 1HB GLU 52 HB2 GLU 52 19.737 6.341 7.203 425 2HB GLU 52 HB3 GLU 52 18.782 7.199 8.415 426 1HG GLU 52 HG2 GLU 52 21.744 7.610 7.784 427 2HG GLU 52 HG3 GLU 52 20.416 8.726 7.477 428 H ILE 53 H ILE 53 20.398 3.830 7.573 429 HA ILE 53 HA ILE 53 17.864 2.570 7.729 430 HB ILE 53 HB ILE 53 20.506 1.173 7.160 431 1HG1 ILE 53 HG12 ILE 53 20.089 3.115 5.604 432 2HG1 ILE 53 HG13 ILE 53 20.200 1.533 4.843 433 1HG2 ILE 53 HG21 ILE 53 18.698 -0.406 7.680 434 2HG2 ILE 53 HG22 ILE 53 17.629 0.401 6.555 435 3HG2 ILE 53 HG23 ILE 53 19.056 -0.452 5.943 436 1HD1 ILE 53 HD11 ILE 53 18.366 3.000 3.963 437 2HD1 ILE 53 HD12 ILE 53 17.834 1.414 4.538 438 3HD1 ILE 53 HD13 ILE 53 17.554 2.863 5.540 439 H VAL 54 H VAL 54 20.882 1.810 9.580 440 HA VAL 54 HA VAL 54 19.483 -0.240 11.000 441 HB VAL 54 HB VAL 54 21.339 -0.364 12.588 442 1HG1 VAL 54 HG11 VAL 54 21.118 -1.726 10.501 443 2HG1 VAL 54 HG12 VAL 54 22.066 -0.483 9.651 444 3HG1 VAL 54 HG13 VAL 54 22.802 -1.431 10.959 445 1HG2 VAL 54 HG21 VAL 54 23.418 0.752 12.178 446 2HG2 VAL 54 HG22 VAL 54 22.721 1.645 10.825 447 3HG2 VAL 54 HG23 VAL 54 22.161 1.965 12.482 448 H LYS 55 H LYS 55 19.868 3.231 11.798 449 HA LYS 55 HA LYS 55 18.642 2.966 14.386 450 1HB LYS 55 HB2 LYS 55 19.720 5.035 13.727 451 2HB LYS 55 HB3 LYS 55 18.604 5.251 12.382 452 1HG LYS 55 HG2 LYS 55 18.103 6.702 14.342 453 2HG LYS 55 HG3 LYS 55 16.752 5.702 13.820 454 1HD LYS 55 HD2 LYS 55 16.877 5.812 16.250 455 2HD LYS 55 HD3 LYS 55 17.083 4.157 15.703 456 1HE LYS 55 HE2 LYS 55 19.580 4.405 15.996 457 2HE LYS 55 HE3 LYS 55 19.309 6.053 16.591 458 1HZ LYS 55 HZ1 LYS 55 19.526 4.468 18.357 459 2HZ LYS 55 HZ2 LYS 55 18.010 5.114 18.366 460 3HZ LYS 55 HZ3 LYS 55 18.252 3.585 17.796 461 H LEU 56 H LEU 56 17.241 3.535 11.139 462 HA LEU 56 HA LEU 56 14.511 3.447 11.916 463 1HB LEU 56 HB2 LEU 56 15.058 4.440 9.921 464 2HB LEU 56 HB3 LEU 56 16.042 3.104 9.350 465 HG LEU 56 HG LEU 56 13.151 2.462 9.756 466 1HD1 LEU 56 HD11 LEU 56 12.550 3.446 7.563 467 2HD1 LEU 56 HD12 LEU 56 12.974 4.707 8.735 468 3HD1 LEU 56 HD13 LEU 56 14.138 4.238 7.478 469 1HD2 LEU 56 HD21 LEU 56 15.172 1.997 7.518 470 2HD2 LEU 56 HD22 LEU 56 14.914 0.881 8.863 471 3HD2 LEU 56 HD23 LEU 56 13.596 1.189 7.703 472 H MET 57 H MET 57 16.746 0.807 11.073 473 HA MET 57 HA MET 57 14.927 -1.373 11.131 474 1HB MET 57 HB2 MET 57 17.243 -1.551 10.279 475 2HB MET 57 HB3 MET 57 17.846 -1.208 11.909 476 1HG MET 57 HG2 MET 57 16.827 -3.275 12.765 477 2HG MET 57 HG3 MET 57 16.299 -3.657 11.128 478 1HE MET 57 HE1 MET 57 20.641 -3.760 12.693 479 2HE MET 57 HE2 MET 57 19.740 -2.233 12.601 480 3HE MET 57 HE3 MET 57 19.194 -3.519 13.699 481 H ASP 58 H ASP 58 17.042 0.034 13.678 482 HA ASP 58 HA ASP 58 16.212 -1.522 15.857 483 1HB ASP 58 HB2 ASP 58 18.116 -0.052 15.992 484 2HB ASP 58 HB3 ASP 58 17.110 1.377 15.766 485 H ASP 59 H ASP 59 14.844 1.599 14.705 486 HA ASP 59 HA ASP 59 12.657 1.716 16.494 487 1HB ASP 59 HB2 ASP 59 12.740 2.688 13.604 488 2HB ASP 59 HB3 ASP 59 11.554 3.148 14.828 489 H LEU 60 H LEU 60 12.705 0.235 13.201 490 HA LEU 60 HA LEU 60 10.074 -0.756 13.189 491 1HB LEU 60 HB2 LEU 60 12.647 -1.526 11.838 492 2HB LEU 60 HB3 LEU 60 11.334 -2.688 11.765 493 HG LEU 60 HG LEU 60 10.742 0.171 11.073 494 1HD1 LEU 60 HD11 LEU 60 12.767 -0.315 9.747 495 2HD1 LEU 60 HD12 LEU 60 11.976 -1.778 9.110 496 3HD1 LEU 60 HD13 LEU 60 11.322 -0.182 8.723 497 1HD2 LEU 60 HD21 LEU 60 9.808 -2.521 9.916 498 2HD2 LEU 60 HD22 LEU 60 8.912 -1.572 11.125 499 3HD2 LEU 60 HD23 LEU 60 9.160 -0.947 9.475 500 H ASP 61 H ASP 61 13.027 -2.484 14.334 501 HA ASP 61 HA ASP 61 11.415 -4.745 15.123 502 1HB ASP 61 HB2 ASP 61 13.354 -5.839 15.742 503 2HB ASP 61 HB3 ASP 61 13.754 -4.933 14.284 504 H ARG 62 H ARG 62 12.466 -1.893 16.853 505 HA ARG 62 HA ARG 62 12.413 -2.673 19.475 506 1HB ARG 62 HB2 ARG 62 12.728 -0.350 18.508 507 2HB ARG 62 HB3 ARG 62 10.967 -0.184 18.450 508 1HG ARG 62 HG2 ARG 62 10.970 -0.639 20.964 509 2HG ARG 62 HG3 ARG 62 12.731 -0.652 20.893 510 1HD ARG 62 HD2 ARG 62 10.789 1.634 20.455 511 2HD ARG 62 HD3 ARG 62 12.135 1.573 21.593 512 HE ARG 62 HE ARG 62 12.126 2.586 18.933 513 1HH1 ARG 62 HH12 ARG 62 14.249 0.675 21.017 514 2HH1 ARG 62 HH11 ARG 62 15.695 1.076 20.125 515 1HH2 ARG 62 HH22 ARG 62 14.042 3.220 17.849 516 2HH2 ARG 62 HH21 ARG 62 15.577 2.569 18.375 517 H ASN 63 H ASN 63 9.628 -2.031 17.402 518 HA ASN 63 HA ASN 63 7.513 -2.223 19.182 519 1HB ASN 63 HB2 ASN 63 7.575 -3.252 16.320 520 2HB ASN 63 HB3 ASN 63 6.130 -2.880 17.281 521 1HD2 ASN 63 HD22 ASN 63 8.750 -1.493 15.390 522 2HD2 ASN 63 HD21 ASN 63 8.224 0.169 15.542 523 H LYS 64 H LYS 64 9.490 -4.896 17.994 524 HA LYS 64 HA LYS 64 8.172 -6.568 20.005 525 1HB LYS 64 HB2 LYS 64 7.093 -7.108 17.759 526 2HB LYS 64 HB3 LYS 64 8.663 -7.748 17.251 527 1HG LYS 64 HG2 LYS 64 8.593 -9.331 19.212 528 2HG LYS 64 HG3 LYS 64 7.028 -8.639 19.677 529 1HD LYS 64 HD2 LYS 64 6.038 -9.406 17.551 530 2HD LYS 64 HD3 LYS 64 7.626 -9.990 17.007 531 1HE LYS 64 HE2 LYS 64 6.276 -11.864 17.793 532 2HE LYS 64 HE3 LYS 64 7.677 -11.637 18.850 533 1HZ LYS 64 HZ1 LYS 64 5.660 -12.017 20.072 534 2HZ LYS 64 HZ2 LYS 64 6.250 -10.516 20.401 535 3HZ LYS 64 HZ3 LYS 64 4.948 -10.689 19.403 536 H ASP 65 H ASP 65 10.356 -5.128 20.286 537 HA ASP 65 HA ASP 65 12.336 -5.147 21.190 538 1HB ASP 65 HB2 ASP 65 12.908 -6.941 22.657 539 2HB ASP 65 HB3 ASP 65 11.164 -6.670 22.684 540 H GLN 66 H GLN 66 12.271 -7.371 18.511 541 HA GLN 66 HA GLN 66 15.049 -6.996 17.936 542 1HB GLN 66 HB2 GLN 66 14.960 -8.720 19.988 543 2HB GLN 66 HB3 GLN 66 14.362 -9.837 18.778 544 1HG GLN 66 HG2 GLN 66 16.726 -10.136 19.000 545 2HG GLN 66 HG3 GLN 66 16.444 -9.399 17.423 546 1HE2 GLN 66 HE22 GLN 66 16.073 -6.980 19.923 547 2HE2 GLN 66 HE21 GLN 66 17.717 -6.395 19.843 548 H GLU 67 H GLU 67 12.074 -8.901 17.467 549 HA GLU 67 HA GLU 67 12.791 -9.259 14.573 550 1HB GLU 67 HB2 GLU 67 10.520 -10.435 16.232 551 2HB GLU 67 HB3 GLU 67 10.718 -10.547 14.477 552 1HG GLU 67 HG2 GLU 67 12.981 -11.620 14.849 553 2HG GLU 67 HG3 GLU 67 12.589 -11.704 16.574 554 H VAL 68 H VAL 68 11.087 -8.668 13.099 555 HA VAL 68 HA VAL 68 9.559 -6.204 13.842 556 HB VAL 68 HB VAL 68 10.691 -7.074 11.158 557 1HG1 VAL 68 HG11 VAL 68 9.482 -4.419 12.049 558 2HG1 VAL 68 HG12 VAL 68 10.117 -4.813 10.433 559 3HG1 VAL 68 HG13 VAL 68 8.670 -5.630 11.043 560 1HG2 VAL 68 HG21 VAL 68 11.750 -4.873 12.930 561 2HG2 VAL 68 HG22 VAL 68 12.524 -6.467 12.770 562 3HG2 VAL 68 HG23 VAL 68 12.394 -5.403 11.382 563 H ASN 69 H ASN 69 7.603 -7.208 14.396 564 HA ASN 69 HA ASN 69 6.577 -9.439 12.844 565 1HB ASN 69 HB2 ASN 69 6.228 -9.380 15.187 566 2HB ASN 69 HB3 ASN 69 5.331 -7.861 15.092 567 1HD2 ASN 69 HD22 ASN 69 3.107 -7.973 14.465 568 2HD2 ASN 69 HD21 ASN 69 2.313 -9.504 14.079 569 H PHE 70 H PHE 70 4.829 -9.475 11.436 570 HA PHE 70 HA PHE 70 4.831 -7.590 9.498 571 1HB PHE 70 HB2 PHE 70 3.965 -9.779 9.126 572 2HB PHE 70 HB3 PHE 70 2.658 -9.539 10.286 573 HD1 PHE 70 HD1 PHE 70 4.065 -8.032 7.136 574 HD2 PHE 70 HD2 PHE 70 0.564 -8.749 9.546 575 HE1 PHE 70 HE1 PHE 70 2.662 -6.909 5.433 576 HE2 PHE 70 HE2 PHE 70 -0.825 -7.608 7.876 577 HZ PHE 70 HZ PHE 70 0.215 -6.653 5.815 578 H GLN 71 H GLN 71 2.180 -7.675 11.958 579 HA GLN 71 HA GLN 71 0.795 -5.442 10.939 580 1HB GLN 71 HB2 GLN 71 -0.089 -6.946 12.675 581 2HB GLN 71 HB3 GLN 71 1.095 -6.332 13.835 582 1HG GLN 71 HG2 GLN 71 0.052 -4.031 13.586 583 2HG GLN 71 HG3 GLN 71 -1.144 -4.746 12.494 584 1HE2 GLN 71 HE22 GLN 71 0.263 -5.108 15.817 585 2HE2 GLN 71 HE21 GLN 71 -1.261 -5.603 16.545 586 H GLU 72 H GLU 72 3.633 -5.598 13.079 587 HA GLU 72 HA GLU 72 3.612 -2.786 13.758 588 1HB GLU 72 HB2 GLU 72 5.637 -5.013 14.172 589 2HB GLU 72 HB3 GLU 72 5.894 -3.340 14.653 590 1HG GLU 72 HG2 GLU 72 5.047 -4.787 16.506 591 2HG GLU 72 HG3 GLU 72 4.035 -3.368 16.180 592 H TYR 73 H TYR 73 5.254 -4.838 11.335 593 HA TYR 73 HA TYR 73 6.901 -2.829 10.147 594 1HB TYR 73 HB2 TYR 73 7.214 -5.036 9.464 595 2HB TYR 73 HB3 TYR 73 5.538 -5.306 9.068 596 HD1 TYR 73 HD1 TYR 73 8.705 -3.861 7.906 597 HD2 TYR 73 HD2 TYR 73 4.591 -4.758 6.903 598 HE1 TYR 73 HE1 TYR 73 9.257 -3.738 5.498 599 HE2 TYR 73 HE2 TYR 73 5.143 -4.493 4.505 600 HH TYR 73 HH TYR 73 8.255 -3.204 3.373 601 H ILE 74 H ILE 74 3.488 -3.754 9.391 602 HA ILE 74 HA ILE 74 3.106 -1.667 7.492 603 HB ILE 74 HB ILE 74 1.038 -2.962 9.292 604 1HG1 ILE 74 HG12 ILE 74 2.302 -4.591 7.827 605 2HG1 ILE 74 HG13 ILE 74 0.572 -4.527 7.600 606 1HG2 ILE 74 HG21 ILE 74 -0.498 -2.232 7.329 607 2HG2 ILE 74 HG22 ILE 74 0.045 -0.988 8.457 608 3HG2 ILE 74 HG23 ILE 74 0.817 -1.147 6.868 609 1HD1 ILE 74 HD11 ILE 74 1.645 -4.702 5.444 610 2HD1 ILE 74 HD12 ILE 74 0.889 -3.123 5.550 611 3HD1 ILE 74 HD13 ILE 74 2.654 -3.287 5.787 612 H THR 75 H THR 75 2.399 -1.704 11.009 613 HA THR 75 HA THR 75 1.399 0.892 11.333 614 HB THR 75 HB THR 75 3.302 -0.570 13.221 615 HG1 THR 75 HG1 THR 75 1.478 -1.831 12.640 616 1HG2 THR 75 HG21 THR 75 2.073 0.637 14.992 617 2HG2 THR 75 HG22 THR 75 2.969 1.742 13.936 618 3HG2 THR 75 HG23 THR 75 1.212 1.568 13.752 619 H PHE 76 H PHE 76 4.829 -0.175 11.424 620 HA PHE 76 HA PHE 76 5.952 2.400 11.796 621 1HB PHE 76 HB2 PHE 76 7.189 0.294 12.161 622 2HB PHE 76 HB3 PHE 76 7.142 -0.031 10.429 623 HD1 PHE 76 HD1 PHE 76 8.525 2.210 13.065 624 HD2 PHE 76 HD2 PHE 76 8.558 1.262 8.849 625 HE1 PHE 76 HE1 PHE 76 10.402 3.790 12.706 626 HE2 PHE 76 HE2 PHE 76 10.520 2.700 8.542 627 HZ PHE 76 HZ PHE 76 11.382 4.066 10.438 628 H LEU 77 H LEU 77 5.200 0.562 8.753 629 HA LEU 77 HA LEU 77 6.174 2.626 7.030 630 1HB LEU 77 HB2 LEU 77 4.074 0.474 6.640 631 2HB LEU 77 HB3 LEU 77 4.504 1.618 5.366 632 HG LEU 77 HG LEU 77 6.551 -0.171 6.766 633 1HD1 LEU 77 HD11 LEU 77 6.503 -1.471 4.677 634 2HD1 LEU 77 HD12 LEU 77 4.957 -1.558 5.546 635 3HD1 LEU 77 HD13 LEU 77 5.122 -0.519 4.103 636 1HD2 LEU 77 HD21 LEU 77 7.664 1.730 5.757 637 2HD2 LEU 77 HD22 LEU 77 7.858 0.382 4.644 638 3HD2 LEU 77 HD23 LEU 77 6.634 1.629 4.304 639 H GLY 78 H GLY 78 3.072 2.319 8.746 640 1HA GLY 78 HA2 GLY 78 1.814 4.613 7.622 641 2HA GLY 78 HA3 GLY 78 1.578 4.009 9.280 642 H ALA 79 H ALA 79 4.010 4.342 10.458 643 HA ALA 79 HA ALA 79 4.215 7.146 10.940 644 1HB ALA 79 HB1 ALA 79 6.375 5.052 11.435 645 2HB ALA 79 HB2 ALA 79 6.228 6.649 12.183 646 3HB ALA 79 HB3 ALA 79 5.012 5.403 12.520 647 H LEU 80 H LEU 80 6.084 5.023 8.749 648 HA LEU 80 HA LEU 80 7.942 6.950 7.901 649 1HB LEU 80 HB2 LEU 80 7.855 4.352 7.503 650 2HB LEU 80 HB3 LEU 80 6.908 4.773 6.075 651 HG LEU 80 HG LEU 80 8.845 6.283 5.370 652 1HD1 LEU 80 HD11 LEU 80 10.049 6.534 7.524 653 2HD1 LEU 80 HD12 LEU 80 10.232 4.773 7.642 654 3HD1 LEU 80 HD13 LEU 80 11.079 5.678 6.376 655 1HD2 LEU 80 HD21 LEU 80 9.473 3.323 5.734 656 2HD2 LEU 80 HD22 LEU 80 8.459 4.001 4.435 657 3HD2 LEU 80 HD23 LEU 80 10.181 4.407 4.521 658 H ALA 81 H ALA 81 4.729 6.094 6.588 659 HA ALA 81 HA ALA 81 4.642 7.967 4.443 660 1HB ALA 81 HB1 ALA 81 2.166 7.776 4.758 661 2HB ALA 81 HB2 ALA 81 3.032 6.233 4.549 662 3HB ALA 81 HB3 ALA 81 2.475 6.722 6.149 663 H MET 82 H MET 82 3.651 8.284 7.905 664 HA MET 82 HA MET 82 2.852 10.993 7.755 665 1HB MET 82 HB2 MET 82 2.581 9.272 9.652 666 2HB MET 82 HB3 MET 82 4.185 9.777 10.202 667 1HG MET 82 HG2 MET 82 1.792 11.620 9.796 668 2HG MET 82 HG3 MET 82 2.261 10.888 11.333 669 1HE MET 82 HE1 MET 82 1.680 13.978 10.943 670 2HE MET 82 HE2 MET 82 2.120 13.225 12.499 671 3HE MET 82 HE3 MET 82 2.998 14.662 11.925 672 H ILE 83 H ILE 83 6.081 9.564 8.281 673 HA ILE 83 HA ILE 83 7.477 12.041 8.602 674 HB ILE 83 HB ILE 83 8.386 9.235 7.937 675 1HG1 ILE 83 HG12 ILE 83 8.851 10.916 10.436 676 2HG1 ILE 83 HG13 ILE 83 7.409 9.924 10.249 677 1HG2 ILE 83 HG21 ILE 83 10.057 10.724 6.950 678 2HG2 ILE 83 HG22 ILE 83 10.106 11.698 8.435 679 3HG2 ILE 83 HG23 ILE 83 10.707 10.029 8.425 680 1HD1 ILE 83 HD11 ILE 83 8.815 7.896 9.961 681 2HD1 ILE 83 HD12 ILE 83 10.264 8.875 10.278 682 3HD1 ILE 83 HD13 ILE 83 9.028 8.692 11.528 683 H TYR 84 H TYR 84 6.794 10.079 5.647 684 HA TYR 84 HA TYR 84 8.199 11.712 3.756 685 1HB TYR 84 HB2 TYR 84 5.559 10.209 3.541 686 2HB TYR 84 HB3 TYR 84 6.190 11.223 2.264 687 HD1 TYR 84 HD1 TYR 84 8.606 9.146 4.207 688 HD2 TYR 84 HD2 TYR 84 6.066 9.403 0.725 689 HE1 TYR 84 HE1 TYR 84 9.765 7.209 3.203 690 HE2 TYR 84 HE2 TYR 84 7.253 7.498 -0.283 691 HH TYR 84 HH TYR 84 8.889 5.894 -0.013 692 H ASN 85 H ASN 85 4.963 11.973 5.169 693 HA ASN 85 HA ASN 85 3.750 13.656 5.892 694 1HB ASN 85 HB2 ASN 85 6.119 14.385 6.732 695 2HB ASN 85 HB3 ASN 85 6.015 15.642 5.503 696 1HD2 ASN 85 HD22 ASN 85 4.279 14.149 8.248 697 2HD2 ASN 85 HD21 ASN 85 3.461 15.625 8.774 698 H GLU 86 H GLU 86 5.663 15.086 3.230 699 HA GLU 86 HA GLU 86 3.767 16.935 2.268 700 1HB GLU 86 HB2 GLU 86 5.769 15.273 0.674 701 2HB GLU 86 HB3 GLU 86 4.940 16.734 0.112 702 1HG GLU 86 HG2 GLU 86 5.988 18.020 1.996 703 2HG GLU 86 HG3 GLU 86 6.910 16.574 2.446 704 H ALA 87 H ALA 87 4.161 13.494 1.598 705 HA ALA 87 HA ALA 87 2.196 12.992 -0.312 706 1HB ALA 87 HB1 ALA 87 2.992 11.284 2.091 707 2HB ALA 87 HB2 ALA 87 2.202 10.712 0.603 708 3HB ALA 87 HB3 ALA 87 3.852 11.355 0.542 709 H LEU 88 H LEU 88 1.794 13.467 3.220 710 HA LEU 88 HA LEU 88 -1.103 12.904 3.100 711 1HB LEU 88 HB2 LEU 88 0.823 13.698 5.338 712 2HB LEU 88 HB3 LEU 88 -0.920 13.662 5.540 713 HG LEU 88 HG LEU 88 0.222 11.682 6.428 714 1HD1 LEU 88 HD11 LEU 88 -1.906 11.298 4.283 715 2HD1 LEU 88 HD12 LEU 88 -1.371 10.040 5.386 716 3HD1 LEU 88 HD13 LEU 88 -2.112 11.520 6.026 717 1HD2 LEU 88 HD21 LEU 88 1.076 9.940 5.042 718 2HD2 LEU 88 HD22 LEU 88 0.662 10.809 3.557 719 3HD2 LEU 88 HD23 LEU 88 1.939 11.432 4.630 720 H LYS 89 H LYS 89 1.158 15.617 3.392 721 HA LYS 89 HA LYS 89 -0.662 17.655 3.999 722 1HB LYS 89 HB2 LYS 89 1.911 17.601 3.880 723 2HB LYS 89 HB3 LYS 89 1.722 18.065 2.176 724 1HG LYS 89 HG2 LYS 89 0.420 20.063 2.894 725 2HG LYS 89 HG3 LYS 89 0.601 19.585 4.582 726 1HD LYS 89 HD2 LYS 89 2.810 20.420 2.647 727 2HD LYS 89 HD3 LYS 89 2.227 21.317 4.051 728 1HE LYS 89 HE2 LYS 89 3.842 18.725 4.044 729 2HE LYS 89 HE3 LYS 89 4.342 20.306 4.636 730 1HZ LYS 89 HZ1 LYS 89 3.687 18.757 6.371 731 2HZ LYS 89 HZ2 LYS 89 2.762 20.130 6.386 732 3HZ LYS 89 HZ3 LYS 89 2.158 18.717 5.785 733 H GLY 90 H GLY 90 0.256 16.273 0.844 734 1HA GLY 90 HA2 GLY 90 -1.169 17.879 -0.939 735 2HA GLY 90 HA3 GLY 90 -0.946 16.129 -1.111 736 1H MET 1 H1 MET 1 15.957 5.326 -6.890 737 2H MET 1 H2 MET 1 15.031 4.065 -7.439 738 3H MET 1 H3 MET 1 15.562 4.067 -5.881 739 HA MET 1 HA MET 1 14.298 5.952 -5.367 740 1HB MET 1 HB2 MET 1 14.248 6.963 -7.605 741 2HB MET 1 HB3 MET 1 13.222 5.647 -8.204 742 1HG MET 1 HG2 MET 1 11.951 7.709 -7.711 743 2HG MET 1 HG3 MET 1 11.395 6.346 -6.742 744 1HE MET 1 HE1 MET 1 10.590 9.386 -6.190 745 2HE MET 1 HE2 MET 1 9.999 7.968 -5.292 746 3HE MET 1 HE3 MET 1 10.669 9.363 -4.412 747 H ALA 2 H ALA 2 12.522 5.432 -4.140 748 HA ALA 2 HA ALA 2 11.982 2.609 -3.953 749 1HB ALA 2 HB1 ALA 2 12.371 4.129 -2.028 750 2HB ALA 2 HB2 ALA 2 10.862 4.959 -2.373 751 3HB ALA 2 HB3 ALA 2 10.826 3.251 -1.895 752 H SER 3 H SER 3 10.831 3.873 -6.426 753 HA SER 3 HA SER 3 8.262 4.656 -6.332 754 1HB SER 3 HB2 SER 3 9.216 2.906 -8.596 755 2HB SER 3 HB3 SER 3 8.218 4.363 -8.622 756 HG SER 3 HG SER 3 10.449 4.727 -9.217 757 HA PRO 4 HA PRO 4 6.674 0.147 -6.911 758 1HB PRO 4 HB2 PRO 4 8.660 -1.373 -5.210 759 2HB PRO 4 HB3 PRO 4 7.799 -1.926 -6.674 760 1HG PRO 4 HG2 PRO 4 10.401 -1.180 -6.841 761 2HG PRO 4 HG3 PRO 4 9.245 -0.607 -8.083 762 1HD PRO 4 HD2 PRO 4 10.192 0.855 -5.607 763 2HD PRO 4 HD3 PRO 4 10.186 1.428 -7.291 764 H LEU 5 H LEU 5 8.262 0.958 -3.776 765 HA LEU 5 HA LEU 5 5.908 -0.074 -2.354 766 1HB LEU 5 HB2 LEU 5 8.119 -0.281 -1.301 767 2HB LEU 5 HB3 LEU 5 8.288 1.484 -1.299 768 HG LEU 5 HG LEU 5 6.242 1.671 0.148 769 1HD1 LEU 5 HD11 LEU 5 5.451 -0.419 1.275 770 2HD1 LEU 5 HD12 LEU 5 4.995 -0.376 -0.424 771 3HD1 LEU 5 HD13 LEU 5 6.356 -1.397 0.105 772 1HD2 LEU 5 HD21 LEU 5 7.223 0.834 2.176 773 2HD2 LEU 5 HD22 LEU 5 8.235 -0.277 1.244 774 3HD2 LEU 5 HD23 LEU 5 8.523 1.481 1.144 775 H ASP 6 H ASP 6 7.455 3.043 -3.169 776 HA ASP 6 HA ASP 6 5.858 4.818 -1.769 777 1HB ASP 6 HB2 ASP 6 7.010 5.167 -4.558 778 2HB ASP 6 HB3 ASP 6 6.316 6.467 -3.591 779 H GLN 7 H GLN 7 5.126 3.407 -5.034 780 HA GLN 7 HA GLN 7 2.712 4.904 -5.317 781 1HB GLN 7 HB2 GLN 7 2.106 3.337 -7.051 782 2HB GLN 7 HB3 GLN 7 3.815 3.769 -7.155 783 1HG GLN 7 HG2 GLN 7 4.246 1.574 -5.824 784 2HG GLN 7 HG3 GLN 7 2.578 1.144 -6.208 785 1HE2 GLN 7 HE22 GLN 7 5.623 2.284 -7.685 786 2HE2 GLN 7 HE21 GLN 7 5.420 1.412 -9.216 787 H ALA 8 H ALA 8 3.357 1.853 -3.573 788 HA ALA 8 HA ALA 8 0.564 1.168 -3.272 789 1HB ALA 8 HB1 ALA 8 2.175 -0.560 -3.225 790 2HB ALA 8 HB2 ALA 8 3.050 0.161 -1.851 791 3HB ALA 8 HB3 ALA 8 1.406 -0.466 -1.629 792 H ILE 9 H ILE 9 3.061 2.517 -0.991 793 HA ILE 9 HA ILE 9 1.102 2.997 1.072 794 HB ILE 9 HB ILE 9 2.684 4.528 2.099 795 1HG1 ILE 9 HG12 ILE 9 4.538 3.883 -0.215 796 2HG1 ILE 9 HG13 ILE 9 3.794 5.463 0.089 797 1HG2 ILE 9 HG21 ILE 9 2.656 2.050 2.439 798 2HG2 ILE 9 HG22 ILE 9 3.936 1.896 1.218 799 3HG2 ILE 9 HG23 ILE 9 4.232 2.767 2.739 800 1HD1 ILE 9 HD11 ILE 9 4.966 5.544 2.308 801 2HD1 ILE 9 HD12 ILE 9 5.828 4.051 1.867 802 3HD1 ILE 9 HD13 ILE 9 6.051 5.509 0.904 803 H GLY 10 H GLY 10 2.283 4.984 -1.635 804 1HA GLY 10 HA2 GLY 10 0.870 7.354 -1.384 805 2HA GLY 10 HA3 GLY 10 1.219 6.514 -2.901 806 H LEU 11 H LEU 11 -0.302 4.210 -2.721 807 HA LEU 11 HA LEU 11 -2.848 5.056 -3.465 808 1HB LEU 11 HB2 LEU 11 -1.526 2.777 -3.786 809 2HB LEU 11 HB3 LEU 11 -2.340 2.296 -2.305 810 HG LEU 11 HG LEU 11 -3.542 1.429 -4.151 811 1HD1 LEU 11 HD11 LEU 11 -5.726 2.195 -3.802 812 2HD1 LEU 11 HD12 LEU 11 -5.182 3.785 -3.235 813 3HD1 LEU 11 HD13 LEU 11 -4.860 2.327 -2.256 814 1HD2 LEU 11 HD21 LEU 11 -2.662 2.896 -5.885 815 2HD2 LEU 11 HD22 LEU 11 -4.423 2.760 -5.980 816 3HD2 LEU 11 HD23 LEU 11 -3.700 4.231 -5.327 817 H LEU 12 H LEU 12 -1.985 3.381 -0.403 818 HA LEU 12 HA LEU 12 -4.478 3.649 0.933 819 1HB LEU 12 HB2 LEU 12 -1.583 3.576 1.955 820 2HB LEU 12 HB3 LEU 12 -2.976 3.675 3.028 821 HG LEU 12 HG LEU 12 -3.866 1.568 2.127 822 1HD1 LEU 12 HD11 LEU 12 -2.314 0.024 0.927 823 2HD1 LEU 12 HD12 LEU 12 -2.735 1.414 -0.067 824 3HD1 LEU 12 HD13 LEU 12 -1.152 1.346 0.755 825 1HD2 LEU 12 HD21 LEU 12 -2.200 0.126 3.312 826 2HD2 LEU 12 HD22 LEU 12 -1.063 1.488 3.321 827 3HD2 LEU 12 HD23 LEU 12 -2.601 1.587 4.208 828 H ILE 13 H ILE 13 -1.700 5.898 0.826 829 HA ILE 13 HA ILE 13 -2.808 7.813 2.619 830 HB ILE 13 HB ILE 13 -0.772 7.992 0.362 831 1HG1 ILE 13 HG12 ILE 13 -0.292 8.232 3.352 832 2HG1 ILE 13 HG13 ILE 13 -0.350 6.658 2.561 833 1HG2 ILE 13 HG21 ILE 13 -0.070 10.186 1.332 834 2HG2 ILE 13 HG22 ILE 13 -1.654 10.249 0.578 835 3HG2 ILE 13 HG23 ILE 13 -1.526 10.165 2.346 836 1HD1 ILE 13 HD11 ILE 13 1.440 7.569 0.932 837 2HD1 ILE 13 HD12 ILE 13 1.671 8.866 2.125 838 3HD1 ILE 13 HD13 ILE 13 1.928 7.171 2.577 839 H GLY 14 H GLY 14 -2.891 7.684 -0.963 840 1HA GLY 14 HA2 GLY 14 -4.372 10.035 -1.417 841 2HA GLY 14 HA3 GLY 14 -4.330 8.609 -2.475 842 H ILE 15 H ILE 15 -5.501 6.618 -1.107 843 HA ILE 15 HA ILE 15 -8.276 7.097 -1.283 844 HB ILE 15 HB ILE 15 -6.534 4.951 -0.090 845 1HG1 ILE 15 HG12 ILE 15 -8.804 4.984 -2.140 846 2HG1 ILE 15 HG13 ILE 15 -7.075 5.061 -2.507 847 1HG2 ILE 15 HG21 ILE 15 -9.529 5.097 0.389 848 2HG2 ILE 15 HG22 ILE 15 -8.502 3.667 0.663 849 3HG2 ILE 15 HG23 ILE 15 -8.224 5.112 1.606 850 1HD1 ILE 15 HD11 ILE 15 -7.725 2.790 -2.879 851 2HD1 ILE 15 HD12 ILE 15 -6.861 2.784 -1.335 852 3HD1 ILE 15 HD13 ILE 15 -8.633 2.706 -1.369 853 H PHE 16 H PHE 16 -6.180 7.066 1.651 854 HA PHE 16 HA PHE 16 -8.268 7.686 3.461 855 1HB PHE 16 HB2 PHE 16 -6.032 6.870 4.063 856 2HB PHE 16 HB3 PHE 16 -5.304 8.396 3.622 857 HD1 PHE 16 HD1 PHE 16 -5.596 10.397 5.038 858 HD2 PHE 16 HD2 PHE 16 -7.574 6.699 6.023 859 HE1 PHE 16 HE1 PHE 16 -6.224 11.304 7.230 860 HE2 PHE 16 HE2 PHE 16 -7.993 7.536 8.323 861 HZ PHE 16 HZ PHE 16 -7.284 9.825 8.944 862 H HIS 17 H HIS 17 -5.798 9.956 2.129 863 HA HIS 17 HA HIS 17 -7.051 12.076 3.491 864 1HB HIS 17 HB2 HIS 17 -4.556 11.786 2.748 865 2HB HIS 17 HB3 HIS 17 -5.073 12.656 1.300 866 HD1 HIS 17 HD1 HIS 17 -4.393 15.192 1.730 867 HD2 HIS 17 HD2 HIS 17 -5.678 13.126 5.167 868 HE1 HIS 17 HE1 HIS 17 -4.425 16.879 3.631 869 H LYS 18 H LYS 18 -7.685 10.784 0.304 870 HA LYS 18 HA LYS 18 -9.111 13.005 -0.774 871 1HB LYS 18 HB2 LYS 18 -8.572 10.938 -1.993 872 2HB LYS 18 HB3 LYS 18 -9.661 10.014 -0.943 873 1HG LYS 18 HG2 LYS 18 -11.602 11.262 -1.836 874 2HG LYS 18 HG3 LYS 18 -10.511 12.328 -2.735 875 1HD LYS 18 HD2 LYS 18 -11.392 10.736 -4.295 876 2HD LYS 18 HD3 LYS 18 -9.685 10.345 -4.038 877 1HE LYS 18 HE2 LYS 18 -10.379 8.523 -2.441 878 2HE LYS 18 HE3 LYS 18 -12.076 8.951 -2.748 879 1HZ LYS 18 HZ1 LYS 18 -11.343 7.092 -4.059 880 2HZ LYS 18 HZ2 LYS 18 -11.734 8.363 -5.033 881 3HZ LYS 18 HZ3 LYS 18 -10.153 7.992 -4.747 882 H TYR 19 H TYR 19 -10.150 10.342 1.451 883 HA TYR 19 HA TYR 19 -12.824 11.445 1.734 884 1HB TYR 19 HB2 TYR 19 -11.316 9.162 2.977 885 2HB TYR 19 HB3 TYR 19 -12.814 9.738 3.711 886 HD1 TYR 19 HD1 TYR 19 -11.369 8.087 0.755 887 HD2 TYR 19 HD2 TYR 19 -14.977 9.587 2.546 888 HE1 TYR 19 HE1 TYR 19 -12.638 7.283 -1.165 889 HE2 TYR 19 HE2 TYR 19 -16.276 8.753 0.618 890 HH TYR 19 HH TYR 19 -14.741 7.137 -2.176 891 H SER 20 H SER 20 -9.764 11.728 3.619 892 HA SER 20 HA SER 20 -10.892 13.328 5.694 893 1HB SER 20 HB2 SER 20 -8.210 13.793 4.324 894 2HB SER 20 HB3 SER 20 -8.756 14.423 5.874 895 HG SER 20 HG SER 20 -8.799 12.406 6.716 896 H GLY 21 H GLY 21 -9.450 14.460 2.592 897 1HA GLY 21 HA2 GLY 21 -9.951 17.144 2.672 898 2HA GLY 21 HA3 GLY 21 -9.997 16.166 1.196 899 H LYS 22 H LYS 22 -12.256 14.606 1.631 900 HA LYS 22 HA LYS 22 -14.371 16.150 0.786 901 1HB LYS 22 HB2 LYS 22 -14.099 13.633 0.829 902 2HB LYS 22 HB3 LYS 22 -14.719 13.654 2.488 903 1HG LYS 22 HG2 LYS 22 -16.799 14.726 1.721 904 2HG LYS 22 HG3 LYS 22 -16.195 14.796 0.065 905 1HD LYS 22 HD2 LYS 22 -16.835 12.298 1.697 906 2HD LYS 22 HD3 LYS 22 -17.771 12.935 0.352 907 1HE LYS 22 HE2 LYS 22 -15.004 11.657 0.233 908 2HE LYS 22 HE3 LYS 22 -16.517 11.041 -0.431 909 1HZ LYS 22 HZ1 LYS 22 -16.558 12.900 -1.932 910 2HZ LYS 22 HZ2 LYS 22 -15.126 13.457 -1.333 911 3HZ LYS 22 HZ3 LYS 22 -15.183 12.011 -2.120 912 H GLU 23 H GLU 23 -13.489 15.527 4.191 913 HA GLU 23 HA GLU 23 -15.738 17.281 5.105 914 1HB GLU 23 HB2 GLU 23 -15.158 16.429 7.372 915 2HB GLU 23 HB3 GLU 23 -15.880 15.267 6.253 916 1HG GLU 23 HG2 GLU 23 -13.752 14.173 5.867 917 2HG GLU 23 HG3 GLU 23 -12.892 15.389 6.833 918 H GLY 24 H GLY 24 -12.204 16.813 5.478 919 1HA GLY 24 HA2 GLY 24 -11.589 19.576 5.320 920 2HA GLY 24 HA3 GLY 24 -11.557 19.048 7.019 921 H ASP 25 H ASP 25 -9.403 19.695 4.818 922 HA ASP 25 HA ASP 25 -8.020 17.211 4.309 923 1HB ASP 25 HB2 ASP 25 -6.442 18.608 3.134 924 2HB ASP 25 HB3 ASP 25 -8.083 19.100 2.713 925 H LYS 26 H LYS 26 -8.183 17.097 6.936 926 HA LYS 26 HA LYS 26 -5.422 17.659 7.975 927 1HB LYS 26 HB2 LYS 26 -8.123 17.476 9.371 928 2HB LYS 26 HB3 LYS 26 -6.645 17.018 10.201 929 1HG LYS 26 HG2 LYS 26 -7.243 19.316 10.730 930 2HG LYS 26 HG3 LYS 26 -5.659 19.176 9.970 931 1HD LYS 26 HD2 LYS 26 -6.804 21.141 9.149 932 2HD LYS 26 HD3 LYS 26 -6.563 20.004 7.833 933 1HE LYS 26 HE2 LYS 26 -8.971 19.249 8.134 934 2HE LYS 26 HE3 LYS 26 -9.150 20.470 9.400 935 1HZ LYS 26 HZ1 LYS 26 -9.935 21.241 7.288 936 2HZ LYS 26 HZ2 LYS 26 -8.644 22.141 7.771 937 3HZ LYS 26 HZ3 LYS 26 -8.459 21.009 6.589 938 H HIS 27 H HIS 27 -4.560 15.735 9.162 939 HA HIS 27 HA HIS 27 -5.023 13.423 7.460 940 1HB HIS 27 HB2 HIS 27 -3.065 13.750 9.734 941 2HB HIS 27 HB3 HIS 27 -3.008 12.555 8.430 942 HD1 HIS 27 HD1 HIS 27 -3.828 15.110 6.236 943 HD2 HIS 27 HD2 HIS 27 -0.654 14.744 8.999 944 HE1 HIS 27 HE1 HIS 27 -2.074 16.792 5.558 945 H THR 28 H THR 28 -7.317 13.612 8.540 946 HA THR 28 HA THR 28 -7.745 11.475 10.493 947 HB THR 28 HB THR 28 -9.272 13.197 11.690 948 HG1 THR 28 HG1 THR 28 -8.888 14.795 9.988 949 1HG2 THR 28 HG21 THR 28 -7.543 14.022 13.180 950 2HG2 THR 28 HG22 THR 28 -7.208 12.333 12.762 951 3HG2 THR 28 HG23 THR 28 -6.275 13.647 12.004 952 H LEU 29 H LEU 29 -9.899 10.676 10.252 953 HA LEU 29 HA LEU 29 -11.792 12.356 8.795 954 1HB LEU 29 HB2 LEU 29 -12.422 10.783 7.048 955 2HB LEU 29 HB3 LEU 29 -10.777 11.367 6.900 956 HG LEU 29 HG LEU 29 -10.116 9.109 8.113 957 1HD1 LEU 29 HD11 LEU 29 -12.456 8.333 8.524 958 2HD1 LEU 29 HD12 LEU 29 -12.777 8.428 6.777 959 3HD1 LEU 29 HD13 LEU 29 -11.596 7.262 7.405 960 1HD2 LEU 29 HD21 LEU 29 -9.430 9.755 5.839 961 2HD2 LEU 29 HD22 LEU 29 -9.980 8.069 5.825 962 3HD2 LEU 29 HD23 LEU 29 -11.042 9.350 5.221 963 H SER 30 H SER 30 -14.018 11.719 9.028 964 HA SER 30 HA SER 30 -14.296 10.769 11.738 965 1HB SER 30 HB2 SER 30 -16.629 11.426 11.514 966 2HB SER 30 HB3 SER 30 -15.531 12.705 10.976 967 HG SER 30 HG SER 30 -16.003 12.213 8.862 968 H LYS 31 H LYS 31 -15.893 9.157 12.434 969 HA LYS 31 HA LYS 31 -15.288 6.686 11.370 970 1HB LYS 31 HB2 LYS 31 -16.873 5.805 12.940 971 2HB LYS 31 HB3 LYS 31 -15.935 7.117 13.641 972 1HG LYS 31 HG2 LYS 31 -17.858 8.665 13.361 973 2HG LYS 31 HG3 LYS 31 -18.826 7.310 12.721 974 1HD LYS 31 HD2 LYS 31 -18.574 6.074 14.815 975 2HD LYS 31 HD3 LYS 31 -17.456 7.284 15.446 976 1HE LYS 31 HE2 LYS 31 -19.654 7.609 16.436 977 2HE LYS 31 HE3 LYS 31 -19.249 8.999 15.417 978 1HZ LYS 31 HZ1 LYS 31 -20.629 8.064 13.705 979 2HZ LYS 31 HZ2 LYS 31 -20.981 6.753 14.642 980 3HZ LYS 31 HZ3 LYS 31 -21.494 8.252 15.092 981 H LYS 32 H LYS 32 -18.306 8.539 10.748 982 HA LYS 32 HA LYS 32 -19.367 6.435 9.031 983 1HB LYS 32 HB2 LYS 32 -20.899 7.827 10.145 984 2HB LYS 32 HB3 LYS 32 -20.203 9.313 9.445 985 1HG LYS 32 HG2 LYS 32 -20.916 8.585 7.193 986 2HG LYS 32 HG3 LYS 32 -21.540 7.065 7.866 987 1HD LYS 32 HD2 LYS 32 -23.137 8.376 9.275 988 2HD LYS 32 HD3 LYS 32 -22.536 9.878 8.554 989 1HE LYS 32 HE2 LYS 32 -23.881 7.580 7.043 990 2HE LYS 32 HE3 LYS 32 -24.649 9.107 7.504 991 1HZ LYS 32 HZ1 LYS 32 -22.375 8.823 5.669 992 2HZ LYS 32 HZ2 LYS 32 -23.931 9.166 5.255 993 3HZ LYS 32 HZ3 LYS 32 -23.055 10.252 6.131 994 H GLU 33 H GLU 33 -17.269 9.295 8.543 995 HA GLU 33 HA GLU 33 -17.397 9.216 5.685 996 1HB GLU 33 HB2 GLU 33 -16.520 11.122 7.064 997 2HB GLU 33 HB3 GLU 33 -15.077 10.147 7.420 998 1HG GLU 33 HG2 GLU 33 -14.465 11.582 5.643 999 2HG GLU 33 HG3 GLU 33 -14.740 10.018 4.877 1000 H LEU 34 H LEU 34 -15.384 7.519 8.118 1001 HA LEU 34 HA LEU 34 -13.800 6.042 6.285 1002 1HB LEU 34 HB2 LEU 34 -13.235 6.059 8.614 1003 2HB LEU 34 HB3 LEU 34 -14.764 5.373 9.095 1004 HG LEU 34 HG LEU 34 -12.851 3.853 9.211 1005 1HD1 LEU 34 HD11 LEU 34 -14.023 1.913 8.646 1006 2HD1 LEU 34 HD12 LEU 34 -15.295 3.100 8.929 1007 3HD1 LEU 34 HD13 LEU 34 -14.842 2.644 7.281 1008 1HD2 LEU 34 HD21 LEU 34 -11.618 4.560 7.212 1009 2HD2 LEU 34 HD22 LEU 34 -11.933 2.819 7.140 1010 3HD2 LEU 34 HD23 LEU 34 -12.888 3.915 6.158 1011 H LYS 35 H LYS 35 -17.024 5.225 7.774 1012 HA LYS 35 HA LYS 35 -17.306 2.824 6.323 1013 1HB LYS 35 HB2 LYS 35 -18.861 3.664 8.147 1014 2HB LYS 35 HB3 LYS 35 -19.667 4.654 6.907 1015 1HG LYS 35 HG2 LYS 35 -20.004 2.563 5.538 1016 2HG LYS 35 HG3 LYS 35 -19.207 1.641 6.821 1017 1HD LYS 35 HD2 LYS 35 -21.066 2.397 8.381 1018 2HD LYS 35 HD3 LYS 35 -21.869 3.102 6.959 1019 1HE LYS 35 HE2 LYS 35 -21.678 0.807 5.839 1020 2HE LYS 35 HE3 LYS 35 -21.078 0.171 7.378 1021 1HZ LYS 35 HZ1 LYS 35 -23.702 1.429 6.897 1022 2HZ LYS 35 HZ2 LYS 35 -23.419 -0.178 7.124 1023 3HZ LYS 35 HZ3 LYS 35 -23.176 0.885 8.359 1024 H GLU 36 H GLU 36 -18.093 6.160 5.291 1025 HA GLU 36 HA GLU 36 -19.136 5.534 2.747 1026 1HB GLU 36 HB2 GLU 36 -19.074 7.792 4.001 1027 2HB GLU 36 HB3 GLU 36 -17.461 8.010 3.305 1028 1HG GLU 36 HG2 GLU 36 -18.437 7.707 1.019 1029 2HG GLU 36 HG3 GLU 36 -20.041 7.539 1.748 1030 H LEU 37 H LEU 37 -15.735 6.195 3.726 1031 HA LEU 37 HA LEU 37 -14.499 5.802 1.223 1032 1HB LEU 37 HB2 LEU 37 -13.296 6.655 3.184 1033 2HB LEU 37 HB3 LEU 37 -13.515 5.167 4.061 1034 HG LEU 37 HG LEU 37 -11.864 5.253 1.529 1035 1HD1 LEU 37 HD11 LEU 37 -10.907 6.857 3.145 1036 2HD1 LEU 37 HD12 LEU 37 -10.976 5.630 4.432 1037 3HD1 LEU 37 HD13 LEU 37 -9.888 5.419 3.051 1038 1HD2 LEU 37 HD21 LEU 37 -12.366 2.937 2.216 1039 2HD2 LEU 37 HD22 LEU 37 -10.720 3.298 2.685 1040 3HD2 LEU 37 HD23 LEU 37 -11.993 3.320 3.913 1041 H ILE 38 H ILE 38 -15.304 3.348 3.716 1042 HA ILE 38 HA ILE 38 -14.280 1.237 2.075 1043 HB ILE 38 HB ILE 38 -16.299 1.205 4.353 1044 1HG1 ILE 38 HG12 ILE 38 -13.301 0.598 4.127 1045 2HG1 ILE 38 HG13 ILE 38 -14.023 2.015 4.898 1046 1HG2 ILE 38 HG21 ILE 38 -15.967 -1.197 4.504 1047 2HG2 ILE 38 HG22 ILE 38 -16.564 -0.843 2.892 1048 3HG2 ILE 38 HG23 ILE 38 -14.839 -1.184 3.140 1049 1HD1 ILE 38 HD11 ILE 38 -14.144 -0.848 5.817 1050 2HD1 ILE 38 HD12 ILE 38 -13.423 0.570 6.611 1051 3HD1 ILE 38 HD13 ILE 38 -15.196 0.428 6.494 1052 H GLN 39 H GLN 39 -17.713 2.244 2.556 1053 HA GLN 39 HA GLN 39 -18.698 0.337 0.704 1054 1HB GLN 39 HB2 GLN 39 -19.831 3.039 1.556 1055 2HB GLN 39 HB3 GLN 39 -20.725 1.843 0.605 1056 1HG GLN 39 HG2 GLN 39 -19.629 1.371 3.417 1057 2HG GLN 39 HG3 GLN 39 -21.307 1.715 2.991 1058 1HE2 GLN 39 HE21 GLN 39 -18.823 -0.766 3.119 1059 2HE2 GLN 39 HE22 GLN 39 -19.854 -2.073 2.567 1060 H LYS 40 H LYS 40 -17.358 3.616 0.054 1061 HA LYS 40 HA LYS 40 -18.262 3.403 -2.706 1062 1HB LYS 40 HB2 LYS 40 -18.089 5.562 -1.444 1063 2HB LYS 40 HB3 LYS 40 -16.337 5.369 -1.450 1064 1HG LYS 40 HG2 LYS 40 -17.035 6.897 -3.188 1065 2HG LYS 40 HG3 LYS 40 -16.344 5.468 -3.953 1066 1HD LYS 40 HD2 LYS 40 -19.328 5.460 -3.527 1067 2HD LYS 40 HD3 LYS 40 -18.705 6.675 -4.645 1068 1HE LYS 40 HE2 LYS 40 -17.574 4.954 -5.992 1069 2HE LYS 40 HE3 LYS 40 -18.172 3.682 -4.921 1070 1HZ LYS 40 HZ1 LYS 40 -19.841 5.496 -6.499 1071 2HZ LYS 40 HZ2 LYS 40 -19.528 3.913 -6.834 1072 3HZ LYS 40 HZ3 LYS 40 -20.392 4.314 -5.491 1073 H GLU 41 H GLU 41 -15.065 3.226 -1.008 1074 HA GLU 41 HA GLU 41 -13.733 2.790 -3.570 1075 1HB GLU 41 HB2 GLU 41 -12.572 2.622 -0.760 1076 2HB GLU 41 HB3 GLU 41 -11.689 2.741 -2.277 1077 1HG GLU 41 HG2 GLU 41 -13.451 4.873 -0.997 1078 2HG GLU 41 HG3 GLU 41 -11.703 4.905 -1.211 1079 H LEU 42 H LEU 42 -14.429 0.861 -0.639 1080 HA LEU 42 HA LEU 42 -13.351 -1.620 -1.910 1081 1HB LEU 42 HB2 LEU 42 -14.230 -0.987 0.923 1082 2HB LEU 42 HB3 LEU 42 -13.917 -2.612 0.321 1083 HG LEU 42 HG LEU 42 -11.571 -2.068 -0.128 1084 1HD1 LEU 42 HD11 LEU 42 -10.657 0.083 0.916 1085 2HD1 LEU 42 HD12 LEU 42 -11.524 0.281 -0.605 1086 3HD1 LEU 42 HD13 LEU 42 -12.317 0.686 0.938 1087 1HD2 LEU 42 HD21 LEU 42 -12.441 -1.317 2.692 1088 2HD2 LEU 42 HD22 LEU 42 -12.287 -2.974 2.069 1089 3HD2 LEU 42 HD23 LEU 42 -10.853 -1.942 2.205 1090 H THR 43 H THR 43 -15.168 -0.985 -3.500 1091 HA THR 43 HA THR 43 -17.822 -0.884 -2.758 1092 HB THR 43 HB THR 43 -17.025 -1.743 -5.539 1093 HG1 THR 43 HG1 THR 43 -16.287 0.774 -4.505 1094 1HG2 THR 43 HG21 THR 43 -18.661 0.598 -4.451 1095 2HG2 THR 43 HG22 THR 43 -18.472 0.143 -6.159 1096 3HG2 THR 43 HG23 THR 43 -19.333 -0.939 -5.043 1097 H ILE 44 H ILE 44 -17.587 -3.016 -1.316 1098 HA ILE 44 HA ILE 44 -17.980 -5.520 -2.659 1099 HB ILE 44 HB ILE 44 -18.683 -6.377 -0.484 1100 1HG1 ILE 44 HG12 ILE 44 -18.462 -3.497 0.521 1101 2HG1 ILE 44 HG13 ILE 44 -19.930 -4.486 0.445 1102 1HG2 ILE 44 HG21 ILE 44 -16.280 -6.099 -1.175 1103 2HG2 ILE 44 HG22 ILE 44 -16.224 -4.603 -0.222 1104 3HG2 ILE 44 HG23 ILE 44 -16.529 -6.163 0.568 1105 1HD1 ILE 44 HD11 ILE 44 -19.178 -4.515 2.695 1106 2HD1 ILE 44 HD12 ILE 44 -18.870 -6.124 2.010 1107 3HD1 ILE 44 HD13 ILE 44 -17.531 -4.967 2.227 1108 H GLY 45 H GLY 45 -19.741 -6.358 -3.615 1109 1HA GLY 45 HA2 GLY 45 -22.260 -4.920 -3.763 1110 2HA GLY 45 HA3 GLY 45 -21.898 -6.531 -4.402 1111 H SER 46 H SER 46 -20.901 -7.498 -1.715 1112 HA SER 46 HA SER 46 -23.361 -8.607 -0.768 1113 1HB SER 46 HB2 SER 46 -21.485 -9.550 0.883 1114 2HB SER 46 HB3 SER 46 -21.567 -10.065 -0.805 1115 HG SER 46 HG SER 46 -19.500 -9.031 0.282 1116 H LYS 47 H LYS 47 -24.108 -6.214 -0.360 1117 HA LYS 47 HA LYS 47 -23.240 -4.774 1.890 1118 1HB LYS 47 HB2 LYS 47 -26.081 -4.952 0.800 1119 2HB LYS 47 HB3 LYS 47 -25.433 -3.682 1.842 1120 1HG LYS 47 HG2 LYS 47 -24.685 -4.237 -1.057 1121 2HG LYS 47 HG3 LYS 47 -25.485 -2.823 -0.372 1122 1HD LYS 47 HD2 LYS 47 -23.361 -2.398 0.989 1123 2HD LYS 47 HD3 LYS 47 -22.588 -3.680 0.029 1124 1HE LYS 47 HE2 LYS 47 -23.141 -2.402 -2.055 1125 2HE LYS 47 HE3 LYS 47 -23.756 -1.080 -1.034 1126 1HZ LYS 47 HZ1 LYS 47 -21.562 -1.014 -0.012 1127 2HZ LYS 47 HZ2 LYS 47 -21.037 -2.172 -1.077 1128 3HZ LYS 47 HZ3 LYS 47 -21.503 -0.690 -1.635 1129 H LEU 48 H LEU 48 -24.891 -7.797 1.949 1130 HA LEU 48 HA LEU 48 -26.072 -7.747 4.524 1131 1HB LEU 48 HB2 LEU 48 -24.537 -9.956 3.077 1132 2HB LEU 48 HB3 LEU 48 -25.449 -10.185 4.564 1133 HG LEU 48 HG LEU 48 -26.717 -11.017 2.757 1134 1HD1 LEU 48 HD11 LEU 48 -27.937 -9.876 4.608 1135 2HD1 LEU 48 HD12 LEU 48 -28.037 -8.409 3.605 1136 3HD1 LEU 48 HD13 LEU 48 -28.828 -9.901 3.075 1137 1HD2 LEU 48 HD21 LEU 48 -27.504 -9.838 0.857 1138 2HD2 LEU 48 HD22 LEU 48 -26.859 -8.296 1.418 1139 3HD2 LEU 48 HD23 LEU 48 -25.749 -9.601 0.918 1140 H GLN 49 H GLN 49 -22.681 -7.656 3.577 1141 HA GLN 49 HA GLN 49 -21.613 -8.377 6.167 1142 1HB GLN 49 HB2 GLN 49 -20.433 -6.859 3.810 1143 2HB GLN 49 HB3 GLN 49 -19.526 -7.343 5.250 1144 1HG GLN 49 HG2 GLN 49 -19.993 -9.717 4.811 1145 2HG GLN 49 HG3 GLN 49 -20.978 -9.291 3.404 1146 1HE2 GLN 49 HE22 GLN 49 -17.692 -8.275 4.599 1147 2HE2 GLN 49 HE21 GLN 49 -16.905 -8.612 3.070 1148 H ASP 50 H ASP 50 -23.432 -5.616 5.328 1149 HA ASP 50 HA ASP 50 -22.030 -3.450 6.190 1150 1HB ASP 50 HB2 ASP 50 -24.116 -2.375 6.727 1151 2HB ASP 50 HB3 ASP 50 -24.290 -3.303 5.241 1152 H ALA 51 H ALA 51 -23.806 -5.665 8.325 1153 HA ALA 51 HA ALA 51 -23.346 -4.455 10.823 1154 1HB ALA 51 HB1 ALA 51 -24.755 -6.430 10.481 1155 2HB ALA 51 HB2 ALA 51 -23.324 -7.419 10.122 1156 3HB ALA 51 HB3 ALA 51 -23.545 -6.732 11.747 1157 H GLU 52 H GLU 52 -21.170 -6.552 8.923 1158 HA GLU 52 HA GLU 52 -19.104 -6.692 10.970 1159 1HB GLU 52 HB2 GLU 52 -18.809 -7.264 7.992 1160 2HB GLU 52 HB3 GLU 52 -17.806 -7.835 9.328 1161 1HG GLU 52 HG2 GLU 52 -20.681 -8.657 8.701 1162 2HG GLU 52 HG3 GLU 52 -19.229 -9.654 8.603 1163 H ILE 53 H ILE 53 -19.777 -4.793 8.014 1164 HA ILE 53 HA ILE 53 -17.373 -3.262 8.089 1165 HB ILE 53 HB ILE 53 -20.079 -2.364 7.050 1166 1HG1 ILE 53 HG12 ILE 53 -19.473 -4.361 5.844 1167 2HG1 ILE 53 HG13 ILE 53 -19.153 -2.972 4.821 1168 1HG2 ILE 53 HG21 ILE 53 -17.278 -1.275 6.594 1169 2HG2 ILE 53 HG22 ILE 53 -18.718 -0.810 5.661 1170 3HG2 ILE 53 HG23 ILE 53 -18.629 -0.468 7.392 1171 1HD1 ILE 53 HD11 ILE 53 -17.340 -4.548 4.593 1172 2HD1 ILE 53 HD12 ILE 53 -16.706 -3.145 5.467 1173 3HD1 ILE 53 HD13 ILE 53 -17.101 -4.645 6.337 1174 H VAL 54 H VAL 54 -20.543 -2.623 9.770 1175 HA VAL 54 HA VAL 54 -19.423 -0.230 10.879 1176 HB VAL 54 HB VAL 54 -21.278 -0.184 12.495 1177 1HG1 VAL 54 HG11 VAL 54 -21.197 1.061 10.362 1178 2HG1 VAL 54 HG12 VAL 54 -21.900 -0.349 9.537 1179 3HG1 VAL 54 HG13 VAL 54 -22.847 0.547 10.750 1180 1HG2 VAL 54 HG21 VAL 54 -21.855 -2.588 12.561 1181 2HG2 VAL 54 HG22 VAL 54 -23.225 -1.541 12.155 1182 3HG2 VAL 54 HG23 VAL 54 -22.420 -2.455 10.877 1183 H LYS 55 H LYS 55 -19.476 -3.593 12.118 1184 HA LYS 55 HA LYS 55 -18.301 -2.976 14.637 1185 1HB LYS 55 HB2 LYS 55 -19.122 -5.212 14.094 1186 2HB LYS 55 HB3 LYS 55 -17.930 -5.386 12.813 1187 1HG LYS 55 HG2 LYS 55 -17.283 -6.646 14.810 1188 2HG LYS 55 HG3 LYS 55 -16.090 -5.436 14.377 1189 1HD LYS 55 HD2 LYS 55 -16.419 -5.541 16.805 1190 2HD LYS 55 HD3 LYS 55 -16.815 -3.949 16.176 1191 1HE LYS 55 HE2 LYS 55 -18.441 -4.695 17.877 1192 2HE LYS 55 HE3 LYS 55 -19.238 -4.458 16.320 1193 1HZ LYS 55 HZ1 LYS 55 -19.132 -6.817 15.973 1194 2HZ LYS 55 HZ2 LYS 55 -18.364 -7.043 17.414 1195 3HZ LYS 55 HZ3 LYS 55 -19.914 -6.480 17.383 1196 H LEU 56 H LEU 56 -16.737 -3.721 11.510 1197 HA LEU 56 HA LEU 56 -14.050 -3.256 12.226 1198 1HB LEU 56 HB2 LEU 56 -14.539 -4.385 10.265 1199 2HB LEU 56 HB3 LEU 56 -15.635 -3.155 9.658 1200 HG LEU 56 HG LEU 56 -12.777 -2.324 10.031 1201 1HD1 LEU 56 HD11 LEU 56 -12.229 -3.237 7.774 1202 2HD1 LEU 56 HD12 LEU 56 -12.551 -4.540 8.938 1203 3HD1 LEU 56 HD13 LEU 56 -13.786 -4.085 7.744 1204 1HD2 LEU 56 HD21 LEU 56 -14.873 -1.858 7.846 1205 2HD2 LEU 56 HD22 LEU 56 -14.536 -0.723 9.152 1206 3HD2 LEU 56 HD23 LEU 56 -13.261 -1.103 7.994 1207 H MET 57 H MET 57 -16.509 -0.937 11.039 1208 HA MET 57 HA MET 57 -14.823 1.349 10.970 1209 1HB MET 57 HB2 MET 57 -16.899 1.328 9.796 1210 2HB MET 57 HB3 MET 57 -17.797 0.986 11.276 1211 1HG MET 57 HG2 MET 57 -16.231 3.533 11.126 1212 2HG MET 57 HG3 MET 57 -17.767 3.410 10.272 1213 1HE MET 57 HE1 MET 57 -20.112 3.166 11.349 1214 2HE MET 57 HE2 MET 57 -19.684 1.686 12.252 1215 3HE MET 57 HE3 MET 57 -20.399 3.063 13.102 1216 H ASP 58 H ASP 58 -16.859 -0.036 13.595 1217 HA ASP 58 HA ASP 58 -16.246 1.951 15.528 1218 1HB ASP 58 HB2 ASP 58 -18.027 0.255 15.786 1219 2HB ASP 58 HB3 ASP 58 -16.796 -0.988 16.054 1220 H ASP 59 H ASP 59 -14.599 -1.150 14.746 1221 HA ASP 59 HA ASP 59 -12.506 -0.929 16.636 1222 1HB ASP 59 HB2 ASP 59 -12.354 -2.171 13.855 1223 2HB ASP 59 HB3 ASP 59 -11.187 -2.394 15.155 1224 H LEU 60 H LEU 60 -12.531 0.271 13.251 1225 HA LEU 60 HA LEU 60 -10.003 1.587 13.338 1226 1HB LEU 60 HB2 LEU 60 -12.539 1.920 11.734 1227 2HB LEU 60 HB3 LEU 60 -11.259 3.118 11.575 1228 HG LEU 60 HG LEU 60 -10.512 0.217 11.318 1229 1HD1 LEU 60 HD11 LEU 60 -12.470 0.415 9.833 1230 2HD1 LEU 60 HD12 LEU 60 -11.724 1.835 9.062 1231 3HD1 LEU 60 HD13 LEU 60 -10.970 0.257 8.888 1232 1HD2 LEU 60 HD21 LEU 60 -8.735 1.980 11.186 1233 2HD2 LEU 60 HD22 LEU 60 -8.945 1.191 9.599 1234 3HD2 LEU 60 HD23 LEU 60 -9.636 2.779 9.873 1235 H ASP 61 H ASP 61 -13.284 2.994 13.969 1236 HA ASP 61 HA ASP 61 -12.193 5.540 14.601 1237 1HB ASP 61 HB2 ASP 61 -14.297 6.306 15.076 1238 2HB ASP 61 HB3 ASP 61 -14.493 5.142 13.763 1239 H ARG 62 H ARG 62 -12.684 2.769 16.668 1240 HA ARG 62 HA ARG 62 -12.719 3.822 19.177 1241 1HB ARG 62 HB2 ARG 62 -12.617 1.412 18.479 1242 2HB ARG 62 HB3 ARG 62 -10.860 1.559 18.334 1243 1HG ARG 62 HG2 ARG 62 -10.707 2.126 20.745 1244 2HG ARG 62 HG3 ARG 62 -12.476 2.088 20.879 1245 1HD ARG 62 HD2 ARG 62 -10.676 -0.237 20.125 1246 2HD ARG 62 HD3 ARG 62 -11.470 -0.021 21.692 1247 HE ARG 62 HE ARG 62 -13.657 -0.023 20.366 1248 1HH1 ARG 62 HH12 ARG 62 -10.903 -2.103 19.445 1249 2HH1 ARG 62 HH11 ARG 62 -11.880 -3.026 18.323 1250 1HH2 ARG 62 HH22 ARG 62 -14.850 -1.269 18.869 1251 2HH2 ARG 62 HH21 ARG 62 -14.062 -2.607 18.056 1252 H ASN 63 H ASN 63 -10.024 3.886 16.923 1253 HA ASN 63 HA ASN 63 -7.811 4.754 18.247 1254 1HB ASN 63 HB2 ASN 63 -8.050 4.615 15.800 1255 2HB ASN 63 HB3 ASN 63 -9.169 5.966 15.805 1256 1HD2 ASN 63 HD22 ASN 63 -6.563 6.584 18.079 1257 2HD2 ASN 63 HD21 ASN 63 -5.590 7.502 16.953 1258 H LYS 64 H LYS 64 -10.608 6.803 17.433 1259 HA LYS 64 HA LYS 64 -10.077 8.650 19.623 1260 1HB LYS 64 HB2 LYS 64 -8.520 9.194 17.552 1261 2HB LYS 64 HB3 LYS 64 -9.974 9.884 16.855 1262 1HG LYS 64 HG2 LYS 64 -8.644 10.632 19.509 1263 2HG LYS 64 HG3 LYS 64 -8.522 11.528 17.988 1264 1HD LYS 64 HD2 LYS 64 -11.001 11.922 18.050 1265 2HD LYS 64 HD3 LYS 64 -11.051 11.149 19.649 1266 1HE LYS 64 HE2 LYS 64 -9.469 12.858 20.516 1267 2HE LYS 64 HE3 LYS 64 -9.446 13.638 18.920 1268 1HZ LYS 64 HZ1 LYS 64 -11.786 14.019 19.136 1269 2HZ LYS 64 HZ2 LYS 64 -11.817 13.290 20.614 1270 3HZ LYS 64 HZ3 LYS 64 -10.976 14.693 20.402 1271 H ASP 65 H ASP 65 -12.088 7.042 19.399 1272 HA ASP 65 HA ASP 65 -14.303 6.772 19.366 1273 1HB ASP 65 HB2 ASP 65 -15.594 8.686 20.390 1274 2HB ASP 65 HB3 ASP 65 -14.214 8.057 21.285 1275 H GLN 66 H GLN 66 -14.362 10.074 18.113 1276 HA GLN 66 HA GLN 66 -16.614 9.440 16.331 1277 1HB GLN 66 HB2 GLN 66 -15.031 11.950 16.965 1278 2HB GLN 66 HB3 GLN 66 -16.368 11.919 15.808 1279 1HG GLN 66 HG2 GLN 66 -17.988 11.434 17.443 1280 2HG GLN 66 HG3 GLN 66 -16.808 10.884 18.632 1281 1HE2 GLN 66 HE22 GLN 66 -15.284 12.494 19.541 1282 2HE2 GLN 66 HE21 GLN 66 -15.861 14.152 19.727 1283 H GLU 67 H GLU 67 -13.098 9.552 16.081 1284 HA GLU 67 HA GLU 67 -13.315 9.379 13.134 1285 1HB GLU 67 HB2 GLU 67 -11.674 11.186 12.834 1286 2HB GLU 67 HB3 GLU 67 -13.110 11.786 13.673 1287 1HG GLU 67 HG2 GLU 67 -11.879 11.535 15.855 1288 2HG GLU 67 HG3 GLU 67 -10.433 11.062 14.941 1289 H VAL 68 H VAL 68 -11.361 8.957 12.049 1290 HA VAL 68 HA VAL 68 -9.513 7.125 13.497 1291 HB VAL 68 HB VAL 68 -10.082 7.199 10.503 1292 1HG1 VAL 68 HG11 VAL 68 -9.165 4.926 10.582 1293 2HG1 VAL 68 HG12 VAL 68 -8.013 6.060 11.297 1294 3HG1 VAL 68 HG13 VAL 68 -8.998 5.019 12.346 1295 1HG2 VAL 68 HG21 VAL 68 -11.580 5.297 10.725 1296 2HG2 VAL 68 HG22 VAL 68 -11.509 5.416 12.491 1297 3HG2 VAL 68 HG23 VAL 68 -12.267 6.704 11.528 1298 H ASN 69 H ASN 69 -7.391 7.859 13.478 1299 HA ASN 69 HA ASN 69 -6.663 10.162 11.764 1300 1HB ASN 69 HB2 ASN 69 -5.816 10.511 13.969 1301 2HB ASN 69 HB3 ASN 69 -5.367 8.811 14.150 1302 1HD2 ASN 69 HD22 ASN 69 -4.486 11.619 11.940 1303 2HD2 ASN 69 HD21 ASN 69 -2.789 11.213 12.013 1304 H PHE 70 H PHE 70 -5.002 10.011 10.292 1305 HA PHE 70 HA PHE 70 -4.814 7.926 8.573 1306 1HB PHE 70 HB2 PHE 70 -3.895 10.114 8.114 1307 2HB PHE 70 HB3 PHE 70 -2.693 9.938 9.392 1308 HD1 PHE 70 HD1 PHE 70 -0.526 9.208 8.791 1309 HD2 PHE 70 HD2 PHE 70 -3.905 8.103 6.351 1310 HE1 PHE 70 HE1 PHE 70 0.966 7.918 7.328 1311 HE2 PHE 70 HE2 PHE 70 -2.391 6.841 4.836 1312 HZ PHE 70 HZ PHE 70 0.044 6.720 5.336 1313 H GLN 71 H GLN 71 -2.508 8.295 11.376 1314 HA GLN 71 HA GLN 71 -0.913 6.112 10.441 1315 1HB GLN 71 HB2 GLN 71 -0.156 7.921 11.992 1316 2HB GLN 71 HB3 GLN 71 -1.120 7.182 13.285 1317 1HG GLN 71 HG2 GLN 71 0.233 5.098 13.088 1318 2HG GLN 71 HG3 GLN 71 1.107 5.789 11.714 1319 1HE2 GLN 71 HE22 GLN 71 0.278 6.682 15.135 1320 2HE2 GLN 71 HE21 GLN 71 1.879 7.313 15.482 1321 H GLU 72 H GLU 72 -3.712 6.318 12.644 1322 HA GLU 72 HA GLU 72 -3.448 3.550 13.475 1323 1HB GLU 72 HB2 GLU 72 -4.613 5.459 14.759 1324 2HB GLU 72 HB3 GLU 72 -6.006 5.119 13.712 1325 1HG GLU 72 HG2 GLU 72 -4.525 3.040 15.420 1326 2HG GLU 72 HG3 GLU 72 -5.953 3.890 15.970 1327 H TYR 73 H TYR 73 -5.317 5.359 10.994 1328 HA TYR 73 HA TYR 73 -6.774 3.189 9.911 1329 1HB TYR 73 HB2 TYR 73 -7.352 5.185 8.981 1330 2HB TYR 73 HB3 TYR 73 -5.716 5.773 8.861 1331 HD1 TYR 73 HD1 TYR 73 -4.312 5.349 6.937 1332 HD2 TYR 73 HD2 TYR 73 -8.296 3.712 7.197 1333 HE1 TYR 73 HE1 TYR 73 -4.311 4.973 4.504 1334 HE2 TYR 73 HE2 TYR 73 -8.338 3.462 4.726 1335 HH TYR 73 HH TYR 73 -5.742 4.707 2.663 1336 H ILE 74 H ILE 74 -3.380 4.197 9.103 1337 HA ILE 74 HA ILE 74 -2.901 1.987 7.371 1338 HB ILE 74 HB ILE 74 -0.927 3.481 9.130 1339 1HG1 ILE 74 HG12 ILE 74 -2.093 4.907 7.425 1340 2HG1 ILE 74 HG13 ILE 74 -0.354 4.805 7.270 1341 1HG2 ILE 74 HG21 ILE 74 0.156 1.456 8.604 1342 2HG2 ILE 74 HG22 ILE 74 -0.546 1.378 6.976 1343 3HG2 ILE 74 HG23 ILE 74 0.720 2.553 7.342 1344 1HD1 ILE 74 HD11 ILE 74 -2.388 3.367 5.546 1345 2HD1 ILE 74 HD12 ILE 74 -1.335 4.706 5.064 1346 3HD1 ILE 74 HD13 ILE 74 -0.620 3.142 5.407 1347 H THR 75 H THR 75 -2.226 2.291 10.886 1348 HA THR 75 HA THR 75 -1.161 -0.233 11.411 1349 HB THR 75 HB THR 75 -3.161 1.282 13.155 1350 HG1 THR 75 HG1 THR 75 -1.404 2.593 12.532 1351 1HG2 THR 75 HG21 THR 75 -1.018 -0.728 13.895 1352 2HG2 THR 75 HG22 THR 75 -1.934 0.272 15.033 1353 3HG2 THR 75 HG23 THR 75 -2.771 -0.941 14.051 1354 H PHE 76 H PHE 76 -4.607 0.695 11.358 1355 HA PHE 76 HA PHE 76 -5.650 -1.888 11.904 1356 1HB PHE 76 HB2 PHE 76 -6.942 0.176 12.236 1357 2HB PHE 76 HB3 PHE 76 -6.921 0.473 10.498 1358 HD1 PHE 76 HD1 PHE 76 -8.267 -1.695 13.201 1359 HD2 PHE 76 HD2 PHE 76 -8.272 -0.941 8.949 1360 HE1 PHE 76 HE1 PHE 76 -10.040 -3.404 12.883 1361 HE2 PHE 76 HE2 PHE 76 -10.132 -2.513 8.671 1362 HZ PHE 76 HZ PHE 76 -10.919 -3.872 10.598 1363 H LEU 77 H LEU 77 -4.993 -0.174 8.747 1364 HA LEU 77 HA LEU 77 -5.974 -2.356 7.170 1365 1HB LEU 77 HB2 LEU 77 -3.919 -0.203 6.592 1366 2HB LEU 77 HB3 LEU 77 -4.347 -1.445 5.413 1367 HG LEU 77 HG LEU 77 -6.376 0.458 6.676 1368 1HD1 LEU 77 HD11 LEU 77 -5.026 0.510 3.942 1369 2HD1 LEU 77 HD12 LEU 77 -6.416 1.494 4.425 1370 3HD1 LEU 77 HD13 LEU 77 -4.857 1.715 5.250 1371 1HD2 LEU 77 HD21 LEU 77 -7.515 -1.536 5.921 1372 2HD2 LEU 77 HD22 LEU 77 -7.769 -0.305 4.695 1373 3HD2 LEU 77 HD23 LEU 77 -6.560 -1.575 4.406 1374 H GLY 78 H GLY 78 -2.857 -1.869 8.805 1375 1HA GLY 78 HA2 GLY 78 -1.581 -4.228 7.842 1376 2HA GLY 78 HA3 GLY 78 -1.320 -3.481 9.441 1377 H ALA 79 H ALA 79 -3.717 -3.755 10.699 1378 HA ALA 79 HA ALA 79 -3.848 -6.500 11.418 1379 1HB ALA 79 HB1 ALA 79 -4.676 -4.648 12.850 1380 2HB ALA 79 HB2 ALA 79 -5.859 -5.954 12.650 1381 3HB ALA 79 HB3 ALA 79 -6.067 -4.437 11.762 1382 H LEU 80 H LEU 80 -5.881 -4.658 9.129 1383 HA LEU 80 HA LEU 80 -7.716 -6.645 8.440 1384 1HB LEU 80 HB2 LEU 80 -7.641 -4.116 7.803 1385 2HB LEU 80 HB3 LEU 80 -6.575 -4.611 6.493 1386 HG LEU 80 HG LEU 80 -8.413 -6.177 5.705 1387 1HD1 LEU 80 HD11 LEU 80 -10.736 -5.518 6.435 1388 2HD1 LEU 80 HD12 LEU 80 -9.826 -6.291 7.746 1389 3HD1 LEU 80 HD13 LEU 80 -10.021 -4.524 7.714 1390 1HD2 LEU 80 HD21 LEU 80 -7.946 -3.934 4.691 1391 2HD2 LEU 80 HD22 LEU 80 -9.102 -3.215 5.844 1392 3HD2 LEU 80 HD23 LEU 80 -9.664 -4.367 4.619 1393 H ALA 81 H ALA 81 -4.538 -5.848 6.991 1394 HA ALA 81 HA ALA 81 -4.419 -7.894 5.024 1395 1HB ALA 81 HB1 ALA 81 -1.932 -7.620 5.290 1396 2HB ALA 81 HB2 ALA 81 -2.830 -6.114 4.987 1397 3HB ALA 81 HB3 ALA 81 -2.238 -6.473 6.599 1398 H MET 82 H MET 82 -3.242 -7.887 8.432 1399 HA MET 82 HA MET 82 -2.336 -10.562 8.374 1400 1HB MET 82 HB2 MET 82 -1.814 -8.658 10.025 1401 2HB MET 82 HB3 MET 82 -3.280 -9.137 10.888 1402 1HG MET 82 HG2 MET 82 -2.349 -11.376 11.252 1403 2HG MET 82 HG3 MET 82 -0.976 -11.012 10.191 1404 1HE MET 82 HE1 MET 82 -0.587 -12.316 12.999 1405 2HE MET 82 HE2 MET 82 0.785 -11.374 13.627 1406 3HE MET 82 HE3 MET 82 0.764 -11.876 11.921 1407 H ILE 83 H ILE 83 -5.526 -9.246 9.091 1408 HA ILE 83 HA ILE 83 -6.724 -11.702 10.013 1409 HB ILE 83 HB ILE 83 -7.817 -9.034 9.083 1410 1HG1 ILE 83 HG12 ILE 83 -7.968 -10.372 11.821 1411 2HG1 ILE 83 HG13 ILE 83 -6.586 -9.389 11.352 1412 1HG2 ILE 83 HG21 ILE 83 -9.532 -10.677 8.490 1413 2HG2 ILE 83 HG22 ILE 83 -9.388 -11.448 10.084 1414 3HG2 ILE 83 HG23 ILE 83 -10.047 -9.807 9.925 1415 1HD1 ILE 83 HD11 ILE 83 -8.110 -7.452 10.925 1416 2HD1 ILE 83 HD12 ILE 83 -8.091 -8.007 12.608 1417 3HD1 ILE 83 HD13 ILE 83 -9.461 -8.414 11.565 1418 H TYR 84 H TYR 84 -6.592 -10.048 6.795 1419 HA TYR 84 HA TYR 84 -8.102 -11.991 5.334 1420 1HB TYR 84 HB2 TYR 84 -5.642 -10.406 4.477 1421 2HB TYR 84 HB3 TYR 84 -6.638 -11.388 3.420 1422 HD1 TYR 84 HD1 TYR 84 -6.273 -8.972 2.337 1423 HD2 TYR 84 HD2 TYR 84 -9.025 -9.877 5.543 1424 HE1 TYR 84 HE1 TYR 84 -7.763 -7.145 1.590 1425 HE2 TYR 84 HE2 TYR 84 -10.478 -8.034 4.807 1426 HH TYR 84 HH TYR 84 -9.725 -6.014 1.957 1427 H ASN 85 H ASN 85 -4.665 -11.835 6.193 1428 HA ASN 85 HA ASN 85 -3.214 -13.362 6.863 1429 1HB ASN 85 HB2 ASN 85 -5.355 -14.182 8.093 1430 2HB ASN 85 HB3 ASN 85 -5.321 -15.536 6.965 1431 1HD2 ASN 85 HD22 ASN 85 -3.519 -13.758 9.443 1432 2HD2 ASN 85 HD21 ASN 85 -2.503 -15.120 9.944 1433 H GLU 86 H GLU 86 -5.378 -15.163 4.652 1434 HA GLU 86 HA GLU 86 -3.517 -16.940 3.533 1435 1HB GLU 86 HB2 GLU 86 -5.969 -16.988 3.151 1436 2HB GLU 86 HB3 GLU 86 -5.849 -15.542 2.133 1437 1HG GLU 86 HG2 GLU 86 -4.397 -16.787 0.541 1438 2HG GLU 86 HG3 GLU 86 -4.467 -18.213 1.590 1439 H ALA 87 H ALA 87 -4.355 -13.647 2.547 1440 HA ALA 87 HA ALA 87 -2.766 -13.023 0.409 1441 1HB ALA 87 HB1 ALA 87 -4.301 -11.470 1.509 1442 2HB ALA 87 HB2 ALA 87 -2.690 -10.742 1.362 1443 3HB ALA 87 HB3 ALA 87 -3.241 -11.379 2.929 1444 H LEU 88 H LEU 88 -1.612 -13.439 3.781 1445 HA LEU 88 HA LEU 88 1.033 -12.348 3.220 1446 1HB LEU 88 HB2 LEU 88 -0.173 -13.782 5.614 1447 2HB LEU 88 HB3 LEU 88 1.491 -13.265 5.514 1448 HG LEU 88 HG LEU 88 0.848 -10.917 5.309 1449 1HD1 LEU 88 HD11 LEU 88 -1.251 -10.904 4.166 1450 2HD1 LEU 88 HD12 LEU 88 -2.031 -11.841 5.467 1451 3HD1 LEU 88 HD13 LEU 88 -1.458 -10.181 5.750 1452 1HD2 LEU 88 HD21 LEU 88 1.176 -11.899 7.532 1453 2HD2 LEU 88 HD22 LEU 88 -0.065 -10.643 7.578 1454 3HD2 LEU 88 HD23 LEU 88 -0.547 -12.350 7.600 1455 H LYS 89 H LYS 89 -0.502 -15.524 3.106 1456 HA LYS 89 HA LYS 89 2.092 -16.923 2.889 1457 1HB LYS 89 HB2 LYS 89 -0.720 -17.962 2.360 1458 2HB LYS 89 HB3 LYS 89 0.766 -18.902 2.533 1459 1HG LYS 89 HG2 LYS 89 -0.694 -17.327 4.700 1460 2HG LYS 89 HG3 LYS 89 -0.491 -19.078 4.568 1461 1HD LYS 89 HD2 LYS 89 2.062 -18.643 4.758 1462 2HD LYS 89 HD3 LYS 89 1.620 -16.983 5.217 1463 1HE LYS 89 HE2 LYS 89 0.141 -18.005 7.035 1464 2HE LYS 89 HE3 LYS 89 0.906 -19.566 6.665 1465 1HZ LYS 89 HZ1 LYS 89 2.025 -18.496 8.443 1466 2HZ LYS 89 HZ2 LYS 89 2.202 -17.103 7.581 1467 3HZ LYS 89 HZ3 LYS 89 3.049 -18.450 7.148 1468 H GLY 90 H GLY 90 -0.639 -15.881 0.796 1469 1HA GLY 90 HA2 GLY 90 0.835 -15.051 -1.363 1470 2HA GLY 90 HA3 GLY 90 0.633 -16.792 -1.657 Start of MODEL 8 1 1H MET 1 H1 MET 1 -14.323 -0.436 -6.598 2 2H MET 1 H2 MET 1 -12.814 -0.767 -7.216 3 3H MET 1 H3 MET 1 -13.069 -0.682 -5.576 4 HA MET 1 HA MET 1 -14.582 -2.514 -5.680 5 1HB MET 1 HB2 MET 1 -14.966 -2.037 -8.208 6 2HB MET 1 HB3 MET 1 -13.595 -3.113 -8.480 7 1HG MET 1 HG2 MET 1 -16.194 -3.726 -6.999 8 2HG MET 1 HG3 MET 1 -15.760 -4.283 -8.612 9 1HE MET 1 HE1 MET 1 -16.939 -6.021 -6.146 10 2HE MET 1 HE2 MET 1 -16.667 -6.653 -7.790 11 3HE MET 1 HE3 MET 1 -16.003 -7.515 -6.381 12 H ALA 2 H ALA 2 -12.624 -2.157 -4.260 13 HA ALA 2 HA ALA 2 -11.262 -3.278 -2.902 14 1HB ALA 2 HB1 ALA 2 -11.430 -5.647 -4.810 15 2HB ALA 2 HB2 ALA 2 -10.841 -5.651 -3.142 16 3HB ALA 2 HB3 ALA 2 -12.543 -5.303 -3.472 17 H SER 3 H SER 3 -10.365 -4.219 -6.116 18 HA SER 3 HA SER 3 -7.796 -4.702 -6.091 19 1HB SER 3 HB2 SER 3 -8.857 -3.053 -8.396 20 2HB SER 3 HB3 SER 3 -7.743 -4.416 -8.381 21 HG SER 3 HG SER 3 -10.558 -4.456 -7.851 22 HA PRO 4 HA PRO 4 -6.299 -0.190 -6.698 23 1HB PRO 4 HB2 PRO 4 -8.363 1.339 -5.090 24 2HB PRO 4 HB3 PRO 4 -7.443 1.884 -6.519 25 1HG PRO 4 HG2 PRO 4 -10.031 1.123 -6.793 26 2HG PRO 4 HG3 PRO 4 -8.818 0.548 -7.981 27 1HD PRO 4 HD2 PRO 4 -9.865 -0.898 -5.538 28 2HD PRO 4 HD3 PRO 4 -9.783 -1.494 -7.212 29 H LEU 5 H LEU 5 -8.037 -0.848 -3.589 30 HA LEU 5 HA LEU 5 -5.685 0.158 -2.119 31 1HB LEU 5 HB2 LEU 5 -7.890 0.633 -1.203 32 2HB LEU 5 HB3 LEU 5 -8.261 -1.097 -1.117 33 HG LEU 5 HG LEU 5 -6.478 -1.451 0.533 34 1HD1 LEU 5 HD11 LEU 5 -5.295 0.482 1.537 35 2HD1 LEU 5 HD12 LEU 5 -4.787 0.220 -0.126 36 3HD1 LEU 5 HD13 LEU 5 -5.915 1.546 0.259 37 1HD2 LEU 5 HD21 LEU 5 -8.697 -0.716 1.347 38 2HD2 LEU 5 HD22 LEU 5 -7.367 -0.162 2.385 39 3HD2 LEU 5 HD23 LEU 5 -8.144 0.981 1.265 40 H ASP 6 H ASP 6 -7.398 -2.889 -2.805 41 HA ASP 6 HA ASP 6 -5.916 -4.669 -1.280 42 1HB ASP 6 HB2 ASP 6 -7.308 -5.029 -3.936 43 2HB ASP 6 HB3 ASP 6 -6.473 -6.349 -3.116 44 H GLN 7 H GLN 7 -5.056 -3.429 -4.606 45 HA GLN 7 HA GLN 7 -2.763 -5.112 -4.792 46 1HB GLN 7 HB2 GLN 7 -2.062 -3.864 -6.648 47 2HB GLN 7 HB3 GLN 7 -3.811 -3.904 -6.672 48 1HG GLN 7 HG2 GLN 7 -3.367 -1.715 -7.250 49 2HG GLN 7 HG3 GLN 7 -3.766 -1.617 -5.540 50 1HE2 GLN 7 HE22 GLN 7 -0.512 -2.835 -5.915 51 2HE2 GLN 7 HE21 GLN 7 0.288 -1.283 -5.787 52 H ALA 8 H ALA 8 -3.270 -1.997 -3.144 53 HA ALA 8 HA ALA 8 -0.440 -1.425 -2.919 54 1HB ALA 8 HB1 ALA 8 -1.210 0.366 -1.393 55 2HB ALA 8 HB2 ALA 8 -1.926 0.377 -3.015 56 3HB ALA 8 HB3 ALA 8 -2.881 -0.186 -1.620 57 H ILE 9 H ILE 9 -3.007 -2.490 -0.579 58 HA ILE 9 HA ILE 9 -1.095 -2.990 1.527 59 HB ILE 9 HB ILE 9 -2.783 -4.313 2.638 60 1HG1 ILE 9 HG12 ILE 9 -4.385 -4.071 0.099 61 2HG1 ILE 9 HG13 ILE 9 -3.785 -5.566 0.849 62 1HG2 ILE 9 HG21 ILE 9 -2.766 -1.831 2.693 63 2HG2 ILE 9 HG22 ILE 9 -4.011 -1.821 1.424 64 3HG2 ILE 9 HG23 ILE 9 -4.346 -2.532 3.018 65 1HD1 ILE 9 HD11 ILE 9 -6.114 -5.389 1.348 66 2HD1 ILE 9 HD12 ILE 9 -5.222 -5.089 2.853 67 3HD1 ILE 9 HD13 ILE 9 -5.950 -3.737 1.953 68 H GLY 10 H GLY 10 -2.390 -5.031 -1.109 69 1HA GLY 10 HA2 GLY 10 -1.045 -7.422 -0.799 70 2HA GLY 10 HA3 GLY 10 -1.372 -6.622 -2.341 71 H LEU 11 H LEU 11 0.252 -4.371 -2.228 72 HA LEU 11 HA LEU 11 2.768 -5.356 -2.958 73 1HB LEU 11 HB2 LEU 11 1.539 -3.073 -3.438 74 2HB LEU 11 HB3 LEU 11 2.311 -2.534 -1.954 75 HG LEU 11 HG LEU 11 3.608 -1.762 -3.705 76 1HD1 LEU 11 HD11 LEU 11 4.882 -2.729 -1.839 77 2HD1 LEU 11 HD12 LEU 11 5.119 -4.211 -2.814 78 3HD1 LEU 11 HD13 LEU 11 5.762 -2.661 -3.382 79 1HD2 LEU 11 HD21 LEU 11 4.500 -3.088 -5.545 80 2HD2 LEU 11 HD22 LEU 11 3.703 -4.548 -4.923 81 3HD2 LEU 11 HD23 LEU 11 2.732 -3.176 -5.510 82 H LEU 12 H LEU 12 1.956 -3.451 -0.004 83 HA LEU 12 HA LEU 12 4.437 -3.707 1.350 84 1HB LEU 12 HB2 LEU 12 1.543 -3.476 2.343 85 2HB LEU 12 HB3 LEU 12 2.904 -3.628 3.452 86 HG LEU 12 HG LEU 12 3.950 -1.617 2.491 87 1HD1 LEU 12 HD11 LEU 12 2.817 -1.480 0.290 88 2HD1 LEU 12 HD12 LEU 12 1.252 -1.250 1.113 89 3HD1 LEU 12 HD13 LEU 12 2.515 -0.016 1.224 90 1HD2 LEU 12 HD21 LEU 12 2.390 -0.028 3.623 91 2HD2 LEU 12 HD22 LEU 12 1.171 -1.317 3.693 92 3HD2 LEU 12 HD23 LEU 12 2.710 -1.482 4.568 93 H ILE 13 H ILE 13 1.597 -5.859 1.379 94 HA ILE 13 HA ILE 13 2.608 -7.726 3.268 95 HB ILE 13 HB ILE 13 0.580 -7.913 1.004 96 1HG1 ILE 13 HG12 ILE 13 0.107 -7.981 4.009 97 2HG1 ILE 13 HG13 ILE 13 0.170 -6.468 3.121 98 1HG2 ILE 13 HG21 ILE 13 -0.184 -10.034 2.156 99 2HG2 ILE 13 HG22 ILE 13 1.334 -10.179 1.277 100 3HG2 ILE 13 HG23 ILE 13 1.363 -10.002 3.043 101 1HD1 ILE 13 HD11 ILE 13 -1.874 -8.686 2.850 102 2HD1 ILE 13 HD12 ILE 13 -2.118 -6.959 3.161 103 3HD1 ILE 13 HD13 ILE 13 -1.636 -7.495 1.554 104 H GLY 14 H GLY 14 2.656 -7.833 -0.323 105 1HA GLY 14 HA2 GLY 14 4.020 -10.267 -0.628 106 2HA GLY 14 HA3 GLY 14 4.026 -8.921 -1.786 107 H ILE 15 H ILE 15 5.295 -6.896 -0.450 108 HA ILE 15 HA ILE 15 8.060 -7.509 -0.661 109 HB ILE 15 HB ILE 15 6.428 -5.237 0.447 110 1HG1 ILE 15 HG12 ILE 15 8.616 -5.529 -1.674 111 2HG1 ILE 15 HG13 ILE 15 6.874 -5.482 -1.969 112 1HG2 ILE 15 HG21 ILE 15 9.427 -5.491 0.843 113 2HG2 ILE 15 HG22 ILE 15 8.463 -4.015 1.104 114 3HG2 ILE 15 HG23 ILE 15 8.166 -5.414 2.104 115 1HD1 ILE 15 HD11 ILE 15 7.749 -3.301 -2.470 116 2HD1 ILE 15 HD12 ILE 15 6.887 -3.146 -0.920 117 3HD1 ILE 15 HD13 ILE 15 8.656 -3.239 -0.958 118 H PHE 16 H PHE 16 5.992 -7.223 2.270 119 HA PHE 16 HA PHE 16 8.063 -7.887 4.075 120 1HB PHE 16 HB2 PHE 16 5.849 -6.934 4.655 121 2HB PHE 16 HB3 PHE 16 5.065 -8.454 4.297 122 HD1 PHE 16 HD1 PHE 16 7.117 -6.609 6.708 123 HD2 PHE 16 HD2 PHE 16 5.548 -10.489 5.728 124 HE1 PHE 16 HE1 PHE 16 7.367 -7.308 9.082 125 HE2 PHE 16 HE2 PHE 16 6.097 -11.271 7.981 126 HZ PHE 16 HZ PHE 16 6.844 -9.624 9.733 127 H HIS 17 H HIS 17 5.491 -10.084 2.840 128 HA HIS 17 HA HIS 17 6.662 -12.204 4.266 129 1HB HIS 17 HB2 HIS 17 4.168 -11.768 3.074 130 2HB HIS 17 HB3 HIS 17 4.811 -13.195 2.266 131 HD1 HIS 17 HD1 HIS 17 5.163 -15.378 3.841 132 HD2 HIS 17 HD2 HIS 17 3.654 -11.925 5.719 133 HE1 HIS 17 HE1 HIS 17 4.281 -16.105 6.123 134 H LYS 18 H LYS 18 7.376 -11.138 0.978 135 HA LYS 18 HA LYS 18 8.621 -13.692 0.324 136 1HB LYS 18 HB2 LYS 18 9.632 -12.725 -1.504 137 2HB LYS 18 HB3 LYS 18 7.991 -12.095 -1.406 138 1HG LYS 18 HG2 LYS 18 8.943 -9.919 -0.530 139 2HG LYS 18 HG3 LYS 18 10.553 -10.636 -0.591 140 1HD LYS 18 HD2 LYS 18 10.609 -9.519 -2.560 141 2HD LYS 18 HD3 LYS 18 10.015 -11.076 -3.129 142 1HE LYS 18 HE2 LYS 18 8.437 -8.504 -2.658 143 2HE LYS 18 HE3 LYS 18 8.758 -9.306 -4.196 144 1HZ LYS 18 HZ1 LYS 18 7.074 -10.321 -2.023 145 2HZ LYS 18 HZ2 LYS 18 6.559 -9.732 -3.475 146 3HZ LYS 18 HZ3 LYS 18 7.409 -11.145 -3.415 147 H TYR 19 H TYR 19 9.705 -10.691 1.950 148 HA TYR 19 HA TYR 19 12.442 -11.639 2.165 149 1HB TYR 19 HB2 TYR 19 10.929 -9.264 3.185 150 2HB TYR 19 HB3 TYR 19 12.442 -9.729 3.965 151 HD1 TYR 19 HD1 TYR 19 11.040 -8.220 0.923 152 HD2 TYR 19 HD2 TYR 19 14.580 -9.809 2.782 153 HE1 TYR 19 HE1 TYR 19 12.387 -7.412 -0.964 154 HE2 TYR 19 HE2 TYR 19 15.931 -9.042 0.868 155 HH TYR 19 HH TYR 19 15.892 -8.088 -1.226 156 H SER 20 H SER 20 9.571 -11.753 4.386 157 HA SER 20 HA SER 20 11.132 -13.059 6.450 158 1HB SER 20 HB2 SER 20 9.127 -13.910 7.375 159 2HB SER 20 HB3 SER 20 8.884 -12.210 6.961 160 HG SER 20 HG SER 20 7.162 -13.702 6.417 161 H GLY 21 H GLY 21 8.988 -14.388 3.910 162 1HA GLY 21 HA2 GLY 21 9.349 -17.011 3.693 163 2HA GLY 21 HA3 GLY 21 9.500 -15.955 2.290 164 H LYS 22 H LYS 22 11.834 -14.800 2.390 165 HA LYS 22 HA LYS 22 13.733 -16.548 1.531 166 1HB LYS 22 HB2 LYS 22 13.655 -14.030 1.444 167 2HB LYS 22 HB3 LYS 22 14.391 -13.998 3.056 168 1HG LYS 22 HG2 LYS 22 16.343 -15.257 2.181 169 2HG LYS 22 HG3 LYS 22 15.608 -15.307 0.577 170 1HD LYS 22 HD2 LYS 22 16.526 -12.836 2.125 171 2HD LYS 22 HD3 LYS 22 17.295 -13.527 0.700 172 1HE LYS 22 HE2 LYS 22 14.604 -12.094 0.842 173 2HE LYS 22 HE3 LYS 22 16.068 -11.570 0.016 174 1HZ LYS 22 HZ1 LYS 22 15.854 -13.437 -1.457 175 2HZ LYS 22 HZ2 LYS 22 14.464 -13.912 -0.707 176 3HZ LYS 22 HZ3 LYS 22 14.515 -12.476 -1.513 177 H GLU 23 H GLU 23 13.285 -15.598 4.950 178 HA GLU 23 HA GLU 23 15.444 -17.498 5.785 179 1HB GLU 23 HB2 GLU 23 15.323 -16.352 7.960 180 2HB GLU 23 HB3 GLU 23 15.872 -15.335 6.623 181 1HG GLU 23 HG2 GLU 23 13.676 -14.244 6.481 182 2HG GLU 23 HG3 GLU 23 13.039 -15.296 7.762 183 H GLY 24 H GLY 24 11.994 -16.978 5.852 184 1HA GLY 24 HA2 GLY 24 11.170 -19.518 6.581 185 2HA GLY 24 HA3 GLY 24 11.366 -18.634 8.110 186 H ASP 25 H ASP 25 9.121 -19.357 5.776 187 HA ASP 25 HA ASP 25 7.833 -16.838 5.323 188 1HB ASP 25 HB2 ASP 25 7.669 -18.843 3.833 189 2HB ASP 25 HB3 ASP 25 6.680 -19.646 5.062 190 H LYS 26 H LYS 26 7.911 -16.120 7.559 191 HA LYS 26 HA LYS 26 5.462 -16.870 9.130 192 1HB LYS 26 HB2 LYS 26 8.207 -15.883 10.010 193 2HB LYS 26 HB3 LYS 26 6.816 -16.114 11.087 194 1HG LYS 26 HG2 LYS 26 6.833 -18.513 10.715 195 2HG LYS 26 HG3 LYS 26 8.024 -18.364 9.418 196 1HD LYS 26 HD2 LYS 26 9.121 -19.160 11.420 197 2HD LYS 26 HD3 LYS 26 9.732 -17.560 10.972 198 1HE LYS 26 HE2 LYS 26 8.348 -16.508 12.731 199 2HE LYS 26 HE3 LYS 26 7.628 -18.082 13.129 200 1HZ LYS 26 HZ1 LYS 26 9.381 -17.483 14.617 201 2HZ LYS 26 HZ2 LYS 26 9.809 -18.827 13.764 202 3HZ LYS 26 HZ3 LYS 26 10.463 -17.362 13.381 203 H HIS 27 H HIS 27 4.610 -15.017 10.405 204 HA HIS 27 HA HIS 27 4.455 -12.579 8.827 205 1HB HIS 27 HB2 HIS 27 3.359 -13.198 11.583 206 2HB HIS 27 HB3 HIS 27 2.879 -11.862 10.533 207 HD1 HIS 27 HD1 HIS 27 2.753 -14.105 7.914 208 HD2 HIS 27 HD2 HIS 27 0.742 -13.908 11.611 209 HE1 HIS 27 HE1 HIS 27 0.571 -15.398 7.638 210 H THR 28 H THR 28 7.186 -13.023 9.636 211 HA THR 28 HA THR 28 7.779 -10.774 11.448 212 HB THR 28 HB THR 28 9.290 -12.292 12.759 213 HG1 THR 28 HG1 THR 28 9.102 -13.968 11.071 214 1HG2 THR 28 HG21 THR 28 6.361 -13.102 13.007 215 2HG2 THR 28 HG22 THR 28 7.622 -13.224 14.241 216 3HG2 THR 28 HG23 THR 28 7.075 -11.626 13.700 217 H LEU 29 H LEU 29 9.625 -9.760 10.774 218 HA LEU 29 HA LEU 29 11.560 -11.289 9.017 219 1HB LEU 29 HB2 LEU 29 10.841 -8.336 9.079 220 2HB LEU 29 HB3 LEU 29 12.482 -8.851 8.709 221 HG LEU 29 HG LEU 29 11.511 -10.373 6.887 222 1HD1 LEU 29 HD11 LEU 29 9.363 -9.663 5.989 223 2HD1 LEU 29 HD12 LEU 29 9.112 -10.083 7.693 224 3HD1 LEU 29 HD13 LEU 29 9.258 -8.378 7.201 225 1HD2 LEU 29 HD21 LEU 29 11.322 -8.340 5.362 226 2HD2 LEU 29 HD22 LEU 29 11.471 -7.325 6.803 227 3HD2 LEU 29 HD23 LEU 29 12.800 -8.412 6.336 228 H SER 30 H SER 30 13.706 -11.368 9.780 229 HA SER 30 HA SER 30 14.164 -10.446 12.526 230 1HB SER 30 HB2 SER 30 16.407 -11.361 12.221 231 2HB SER 30 HB3 SER 30 15.195 -12.541 11.695 232 HG SER 30 HG SER 30 16.118 -12.481 9.801 233 H LYS 31 H LYS 31 15.769 -8.818 13.058 234 HA LYS 31 HA LYS 31 15.294 -6.445 11.786 235 1HB LYS 31 HB2 LYS 31 17.086 -5.528 13.142 236 2HB LYS 31 HB3 LYS 31 16.031 -6.615 14.042 237 1HG LYS 31 HG2 LYS 31 17.743 -8.411 13.895 238 2HG LYS 31 HG3 LYS 31 18.832 -7.288 13.044 239 1HD LYS 31 HD2 LYS 31 18.743 -5.732 14.963 240 2HD LYS 31 HD3 LYS 31 17.657 -6.821 15.826 241 1HE LYS 31 HE2 LYS 31 20.502 -7.525 14.947 242 2HE LYS 31 HE3 LYS 31 20.031 -6.996 16.571 243 1HZ LYS 31 HZ1 LYS 31 18.622 -8.902 16.745 244 2HZ LYS 31 HZ2 LYS 31 19.056 -9.422 15.243 245 3HZ LYS 31 HZ3 LYS 31 20.178 -9.356 16.446 246 H LYS 32 H LYS 32 18.052 -8.589 11.086 247 HA LYS 32 HA LYS 32 19.182 -6.642 9.196 248 1HB LYS 32 HB2 LYS 32 20.701 -7.877 10.464 249 2HB LYS 32 HB3 LYS 32 20.010 -9.439 9.932 250 1HG LYS 32 HG2 LYS 32 20.779 -8.980 7.615 251 2HG LYS 32 HG3 LYS 32 21.304 -7.367 8.096 252 1HD LYS 32 HD2 LYS 32 23.219 -8.873 7.925 253 2HD LYS 32 HD3 LYS 32 23.018 -8.295 9.580 254 1HE LYS 32 HE2 LYS 32 23.605 -10.701 9.478 255 2HE LYS 32 HE3 LYS 32 22.048 -10.448 10.267 256 1HZ LYS 32 HZ1 LYS 32 22.435 -11.254 7.465 257 2HZ LYS 32 HZ2 LYS 32 21.998 -12.250 8.702 258 3HZ LYS 32 HZ3 LYS 32 20.980 -11.052 8.215 259 H GLU 33 H GLU 33 16.950 -9.428 9.005 260 HA GLU 33 HA GLU 33 17.089 -9.645 6.129 261 1HB GLU 33 HB2 GLU 33 16.045 -11.349 7.659 262 2HB GLU 33 HB3 GLU 33 14.723 -10.209 7.964 263 1HG GLU 33 HG2 GLU 33 13.969 -11.727 6.289 264 2HG GLU 33 HG3 GLU 33 14.292 -10.219 5.440 265 H LEU 34 H LEU 34 15.197 -7.705 8.457 266 HA LEU 34 HA LEU 34 13.718 -6.170 6.595 267 1HB LEU 34 HB2 LEU 34 13.113 -6.100 8.850 268 2HB LEU 34 HB3 LEU 34 14.699 -5.624 9.404 269 HG LEU 34 HG LEU 34 13.001 -3.873 9.538 270 1HD1 LEU 34 HD11 LEU 34 15.162 -2.901 7.651 271 2HD1 LEU 34 HD12 LEU 34 14.393 -2.065 8.992 272 3HD1 LEU 34 HD13 LEU 34 15.508 -3.393 9.316 273 1HD2 LEU 34 HD21 LEU 34 12.268 -2.685 7.440 274 2HD2 LEU 34 HD22 LEU 34 13.008 -3.953 6.486 275 3HD2 LEU 34 HD23 LEU 34 11.670 -4.347 7.572 276 H LYS 35 H LYS 35 17.027 -5.482 7.977 277 HA LYS 35 HA LYS 35 17.516 -3.203 6.392 278 1HB LYS 35 HB2 LYS 35 19.488 -5.375 7.209 279 2HB LYS 35 HB3 LYS 35 19.910 -3.894 6.382 280 1HG LYS 35 HG2 LYS 35 18.765 -2.604 8.288 281 2HG LYS 35 HG3 LYS 35 18.609 -4.161 9.100 282 1HD LYS 35 HD2 LYS 35 20.548 -3.353 10.038 283 2HD LYS 35 HD3 LYS 35 21.209 -4.366 8.758 284 1HE LYS 35 HE2 LYS 35 20.775 -1.327 8.577 285 2HE LYS 35 HE3 LYS 35 22.300 -2.115 9.033 286 1HZ LYS 35 HZ1 LYS 35 21.001 -2.285 6.417 287 2HZ LYS 35 HZ2 LYS 35 22.408 -1.539 6.809 288 3HZ LYS 35 HZ3 LYS 35 22.307 -3.181 6.882 289 H GLU 36 H GLU 36 18.035 -6.631 5.440 290 HA GLU 36 HA GLU 36 18.941 -6.124 2.832 291 1HB GLU 36 HB2 GLU 36 18.758 -8.350 4.167 292 2HB GLU 36 HB3 GLU 36 17.134 -8.476 3.472 293 1HG GLU 36 HG2 GLU 36 18.178 -8.231 1.181 294 2HG GLU 36 HG3 GLU 36 19.770 -8.226 1.951 295 H LEU 37 H LEU 37 15.573 -6.477 4.004 296 HA LEU 37 HA LEU 37 14.218 -6.184 1.533 297 1HB LEU 37 HB2 LEU 37 13.095 -6.898 3.551 298 2HB LEU 37 HB3 LEU 37 13.413 -5.389 4.372 299 HG LEU 37 HG LEU 37 11.663 -5.473 1.906 300 1HD1 LEU 37 HD11 LEU 37 9.763 -5.501 3.598 301 2HD1 LEU 37 HD12 LEU 37 10.678 -7.005 3.508 302 3HD1 LEU 37 HD13 LEU 37 10.953 -5.863 4.848 303 1HD2 LEU 37 HD21 LEU 37 12.271 -3.166 2.532 304 2HD2 LEU 37 HD22 LEU 37 10.630 -3.463 3.059 305 3HD2 LEU 37 HD23 LEU 37 11.940 -3.505 4.248 306 H ILE 38 H ILE 38 15.208 -3.653 3.864 307 HA ILE 38 HA ILE 38 14.198 -1.503 2.255 308 HB ILE 38 HB ILE 38 16.398 -1.554 4.358 309 1HG1 ILE 38 HG12 ILE 38 13.432 -0.787 4.473 310 2HG1 ILE 38 HG13 ILE 38 14.121 -2.285 5.105 311 1HG2 ILE 38 HG21 ILE 38 16.086 0.892 4.484 312 2HG2 ILE 38 HG22 ILE 38 16.583 0.473 2.864 313 3HG2 ILE 38 HG23 ILE 38 14.874 0.808 3.190 314 1HD1 ILE 38 HD11 ILE 38 15.630 -0.895 6.579 315 2HD1 ILE 38 HD12 ILE 38 14.657 0.513 6.083 316 3HD1 ILE 38 HD13 ILE 38 13.885 -0.835 6.944 317 H GLN 39 H GLN 39 17.477 -2.898 2.544 318 HA GLN 39 HA GLN 39 18.759 -1.105 0.776 319 1HB GLN 39 HB2 GLN 39 19.379 -3.871 1.814 320 2HB GLN 39 HB3 GLN 39 20.301 -3.239 0.450 321 1HG GLN 39 HG2 GLN 39 21.480 -2.757 2.491 322 2HG GLN 39 HG3 GLN 39 20.986 -1.264 1.699 323 1HE2 GLN 39 HE22 GLN 39 18.810 -0.295 2.615 324 2HE2 GLN 39 HE21 GLN 39 18.645 -0.396 4.352 325 H LYS 40 H LYS 40 16.944 -4.126 -0.006 326 HA LYS 40 HA LYS 40 17.511 -3.668 -2.849 327 1HB LYS 40 HB2 LYS 40 16.986 -5.884 -1.708 328 2HB LYS 40 HB3 LYS 40 15.301 -5.386 -1.636 329 1HG LYS 40 HG2 LYS 40 17.014 -5.597 -4.173 330 2HG LYS 40 HG3 LYS 40 16.003 -6.897 -3.572 331 1HD LYS 40 HD2 LYS 40 15.027 -4.208 -4.646 332 2HD LYS 40 HD3 LYS 40 14.917 -5.773 -5.420 333 1HE LYS 40 HE2 LYS 40 13.446 -4.963 -2.868 334 2HE LYS 40 HE3 LYS 40 12.762 -5.155 -4.479 335 1HZ LYS 40 HZ1 LYS 40 12.361 -7.075 -3.190 336 2HZ LYS 40 HZ2 LYS 40 13.417 -7.475 -4.392 337 3HZ LYS 40 HZ3 LYS 40 13.960 -7.279 -2.844 338 H GLU 41 H GLU 41 14.543 -3.271 -0.835 339 HA GLU 41 HA GLU 41 13.014 -2.355 -2.995 340 1HB GLU 41 HB2 GLU 41 12.008 -3.257 -0.972 341 2HB GLU 41 HB3 GLU 41 12.635 -1.915 -0.007 342 1HG GLU 41 HG2 GLU 41 10.242 -1.642 -0.504 343 2HG GLU 41 HG3 GLU 41 11.191 -0.319 -1.158 344 H LEU 42 H LEU 42 14.610 -0.343 -0.456 345 HA LEU 42 HA LEU 42 13.729 2.106 -1.891 346 1HB LEU 42 HB2 LEU 42 15.343 1.820 0.662 347 2HB LEU 42 HB3 LEU 42 14.760 3.324 -0.060 348 HG LEU 42 HG LEU 42 13.085 1.112 1.189 349 1HD1 LEU 42 HD11 LEU 42 12.433 2.866 2.749 350 2HD1 LEU 42 HD12 LEU 42 14.205 2.863 2.662 351 3HD1 LEU 42 HD13 LEU 42 13.286 4.099 1.797 352 1HD2 LEU 42 HD21 LEU 42 11.810 1.873 -0.768 353 2HD2 LEU 42 HD22 LEU 42 11.106 2.575 0.687 354 3HD2 LEU 42 HD23 LEU 42 12.135 3.571 -0.359 355 H THR 43 H THR 43 16.524 0.024 -1.733 356 HA THR 43 HA THR 43 18.435 0.068 -2.977 357 HB THR 43 HB THR 43 17.128 2.051 -4.823 358 HG1 THR 43 HG1 THR 43 16.261 -0.563 -4.262 359 1HG2 THR 43 HG21 THR 43 18.675 -0.535 -5.298 360 2HG2 THR 43 HG22 THR 43 18.081 0.583 -6.541 361 3HG2 THR 43 HG23 THR 43 19.355 1.104 -5.424 362 H ILE 44 H ILE 44 19.068 1.359 -0.894 363 HA ILE 44 HA ILE 44 19.625 4.170 -1.190 364 HB ILE 44 HB ILE 44 20.835 3.899 0.958 365 1HG1 ILE 44 HG12 ILE 44 19.762 1.069 1.128 366 2HG1 ILE 44 HG13 ILE 44 21.373 1.342 0.470 367 1HG2 ILE 44 HG21 ILE 44 18.787 3.490 2.262 368 2HG2 ILE 44 HG22 ILE 44 18.439 4.456 0.825 369 3HG2 ILE 44 HG23 ILE 44 18.019 2.733 0.853 370 1HD1 ILE 44 HD11 ILE 44 21.511 0.872 2.864 371 2HD1 ILE 44 HD12 ILE 44 22.062 2.520 2.522 372 3HD1 ILE 44 HD13 ILE 44 20.450 2.243 3.222 373 H GLY 45 H GLY 45 20.715 3.713 -3.352 374 1HA GLY 45 HA2 GLY 45 23.208 2.621 -3.741 375 2HA GLY 45 HA3 GLY 45 22.596 4.029 -4.621 376 H SER 46 H SER 46 22.546 5.733 -2.102 377 HA SER 46 HA SER 46 25.208 6.794 -2.256 378 1HB SER 46 HB2 SER 46 24.152 8.195 -0.315 379 2HB SER 46 HB3 SER 46 23.489 8.353 -1.953 380 HG SER 46 HG SER 46 22.009 7.915 -0.063 381 H LYS 47 H LYS 47 23.696 4.370 -0.237 382 HA LYS 47 HA LYS 47 24.456 3.017 1.308 383 1HB LYS 47 HB2 LYS 47 27.277 4.040 0.882 384 2HB LYS 47 HB3 LYS 47 26.741 2.469 1.502 385 1HG LYS 47 HG2 LYS 47 25.516 2.168 -0.759 386 2HG LYS 47 HG3 LYS 47 26.435 3.593 -1.289 387 1HD LYS 47 HD2 LYS 47 28.558 2.439 -0.832 388 2HD LYS 47 HD3 LYS 47 27.665 1.014 -0.263 389 1HE LYS 47 HE2 LYS 47 28.423 0.723 -2.605 390 2HE LYS 47 HE3 LYS 47 26.656 0.700 -2.488 391 1HZ LYS 47 HZ1 LYS 47 27.444 2.026 -4.315 392 2HZ LYS 47 HZ2 LYS 47 26.619 2.963 -3.243 393 3HZ LYS 47 HZ3 LYS 47 28.267 3.023 -3.294 394 H LEU 48 H LEU 48 25.986 6.169 1.866 395 HA LEU 48 HA LEU 48 26.386 5.960 4.639 396 1HB LEU 48 HB2 LEU 48 25.809 8.330 2.830 397 2HB LEU 48 HB3 LEU 48 26.015 8.544 4.563 398 HG LEU 48 HG LEU 48 28.042 9.065 3.405 399 1HD1 LEU 48 HD11 LEU 48 29.606 7.868 4.764 400 2HD1 LEU 48 HD12 LEU 48 28.127 8.098 5.710 401 3HD1 LEU 48 HD13 LEU 48 28.498 6.512 4.998 402 1HD2 LEU 48 HD21 LEU 48 28.225 6.167 2.492 403 2HD2 LEU 48 HD22 LEU 48 27.872 7.576 1.458 404 3HD2 LEU 48 HD23 LEU 48 29.436 7.438 2.270 405 H GLN 49 H GLN 49 23.334 6.144 3.027 406 HA GLN 49 HA GLN 49 21.739 7.177 5.148 407 1HB GLN 49 HB2 GLN 49 20.841 4.878 3.400 408 2HB GLN 49 HB3 GLN 49 19.882 6.179 4.098 409 1HG GLN 49 HG2 GLN 49 21.729 6.231 1.699 410 2HG GLN 49 HG3 GLN 49 20.005 6.573 1.756 411 1HE2 GLN 49 HE21 GLN 49 20.011 8.470 4.031 412 2HE2 GLN 49 HE22 GLN 49 20.835 9.884 3.410 413 H ASP 50 H ASP 50 23.549 4.200 4.912 414 HA ASP 50 HA ASP 50 22.137 2.340 6.272 415 1HB ASP 50 HB2 ASP 50 24.189 1.317 6.916 416 2HB ASP 50 HB3 ASP 50 24.399 2.004 5.303 417 H ALA 51 H ALA 51 24.009 4.933 7.809 418 HA ALA 51 HA ALA 51 23.607 4.237 10.528 419 1HB ALA 51 HB1 ALA 51 23.736 7.011 9.263 420 2HB ALA 51 HB2 ALA 51 23.983 6.636 10.984 421 3HB ALA 51 HB3 ALA 51 25.122 6.019 9.768 422 H GLU 52 H GLU 52 21.446 5.989 8.295 423 HA GLU 52 HA GLU 52 19.435 6.664 10.296 424 1HB GLU 52 HB2 GLU 52 19.058 6.392 7.283 425 2HB GLU 52 HB3 GLU 52 18.063 7.287 8.424 426 1HG GLU 52 HG2 GLU 52 19.906 8.888 8.817 427 2HG GLU 52 HG3 GLU 52 20.956 7.990 7.707 428 H ILE 53 H ILE 53 19.961 4.190 7.767 429 HA ILE 53 HA ILE 53 17.581 2.745 8.163 430 HB ILE 53 HB ILE 53 20.246 1.558 7.331 431 1HG1 ILE 53 HG12 ILE 53 19.855 3.207 5.688 432 2HG1 ILE 53 HG13 ILE 53 19.176 1.736 5.014 433 1HG2 ILE 53 HG21 ILE 53 18.615 -0.153 8.011 434 2HG2 ILE 53 HG22 ILE 53 17.421 0.547 6.905 435 3HG2 ILE 53 HG23 ILE 53 18.915 -0.191 6.287 436 1HD1 ILE 53 HD11 ILE 53 17.669 4.098 6.200 437 2HD1 ILE 53 HD12 ILE 53 17.651 3.506 4.535 438 3HD1 ILE 53 HD13 ILE 53 16.885 2.551 5.818 439 H VAL 54 H VAL 54 20.722 2.364 9.967 440 HA VAL 54 HA VAL 54 19.609 0.155 11.373 441 HB VAL 54 HB VAL 54 21.450 0.400 13.023 442 1HG1 VAL 54 HG11 VAL 54 23.017 -0.602 11.414 443 2HG1 VAL 54 HG12 VAL 54 21.372 -1.179 11.110 444 3HG1 VAL 54 HG13 VAL 54 22.073 0.075 10.068 445 1HG2 VAL 54 HG21 VAL 54 22.568 2.389 11.066 446 2HG2 VAL 54 HG22 VAL 54 21.972 2.790 12.694 447 3HG2 VAL 54 HG23 VAL 54 23.365 1.713 12.489 448 H LYS 55 H LYS 55 19.545 3.639 12.165 449 HA LYS 55 HA LYS 55 18.346 3.289 14.751 450 1HB LYS 55 HB2 LYS 55 19.228 5.435 14.064 451 2HB LYS 55 HB3 LYS 55 18.116 5.524 12.696 452 1HG LYS 55 HG2 LYS 55 17.428 6.970 14.549 453 2HG LYS 55 HG3 LYS 55 16.196 5.764 14.163 454 1HD LYS 55 HD2 LYS 55 16.810 4.424 16.127 455 2HD LYS 55 HD3 LYS 55 18.236 5.438 16.417 456 1HE LYS 55 HE2 LYS 55 16.424 5.995 17.975 457 2HE LYS 55 HE3 LYS 55 16.783 7.370 16.920 458 1HZ LYS 55 HZ1 LYS 55 14.557 5.474 16.570 459 2HZ LYS 55 HZ2 LYS 55 14.442 7.008 17.157 460 3HZ LYS 55 HZ3 LYS 55 14.886 6.755 15.592 461 H LEU 56 H LEU 56 16.938 3.740 11.505 462 HA LEU 56 HA LEU 56 14.202 3.452 12.161 463 1HB LEU 56 HB2 LEU 56 14.872 4.392 10.144 464 2HB LEU 56 HB3 LEU 56 15.874 3.026 9.684 465 HG LEU 56 HG LEU 56 12.961 2.426 10.022 466 1HD1 LEU 56 HD11 LEU 56 12.885 4.612 8.839 467 2HD1 LEU 56 HD12 LEU 56 14.129 4.057 7.703 468 3HD1 LEU 56 HD13 LEU 56 12.527 3.303 7.696 469 1HD2 LEU 56 HD21 LEU 56 14.649 0.712 9.273 470 2HD2 LEU 56 HD22 LEU 56 13.418 1.069 8.047 471 3HD2 LEU 56 HD23 LEU 56 15.057 1.758 7.909 472 H MET 57 H MET 57 16.619 0.973 11.346 473 HA MET 57 HA MET 57 14.919 -1.306 11.396 474 1HB MET 57 HB2 MET 57 17.034 -1.470 10.341 475 2HB MET 57 HB3 MET 57 17.872 -0.874 11.775 476 1HG MET 57 HG2 MET 57 16.379 -3.461 11.932 477 2HG MET 57 HG3 MET 57 17.980 -3.405 11.205 478 1HE MET 57 HE1 MET 57 20.351 -2.566 14.175 479 2HE MET 57 HE2 MET 57 20.241 -2.989 12.453 480 3HE MET 57 HE3 MET 57 19.722 -1.380 13.026 481 H ASP 58 H ASP 58 16.878 0.310 13.976 482 HA ASP 58 HA ASP 58 16.119 -1.480 16.042 483 1HB ASP 58 HB2 ASP 58 17.898 0.196 16.295 484 2HB ASP 58 HB3 ASP 58 16.696 1.495 16.301 485 H ASP 59 H ASP 59 14.557 1.556 14.902 486 HA ASP 59 HA ASP 59 12.367 1.502 16.695 487 1HB ASP 59 HB2 ASP 59 12.325 2.496 13.812 488 2HB ASP 59 HB3 ASP 59 11.146 2.873 15.067 489 H LEU 60 H LEU 60 12.542 0.046 13.429 490 HA LEU 60 HA LEU 60 9.985 -1.215 13.479 491 1HB LEU 60 HB2 LEU 60 12.610 -1.682 12.045 492 2HB LEU 60 HB3 LEU 60 11.321 -2.869 11.860 493 HG LEU 60 HG LEU 60 10.707 0.056 11.422 494 1HD1 LEU 60 HD11 LEU 60 12.710 -0.325 10.063 495 2HD1 LEU 60 HD12 LEU 60 11.958 -1.770 9.358 496 3HD1 LEU 60 HD13 LEU 60 11.276 -0.175 9.020 497 1HD2 LEU 60 HD21 LEU 60 9.741 -2.548 10.111 498 2HD2 LEU 60 HD22 LEU 60 8.844 -1.609 11.332 499 3HD2 LEU 60 HD23 LEU 60 9.148 -0.942 9.708 500 H ASP 61 H ASP 61 13.186 -2.610 14.358 501 HA ASP 61 HA ASP 61 12.009 -5.106 15.064 502 1HB ASP 61 HB2 ASP 61 14.090 -5.914 15.592 503 2HB ASP 61 HB3 ASP 61 14.338 -4.811 14.239 504 H ARG 62 H ARG 62 12.477 -2.206 16.949 505 HA ARG 62 HA ARG 62 12.548 -2.895 19.514 506 1HB ARG 62 HB2 ARG 62 12.122 -0.634 18.560 507 2HB ARG 62 HB3 ARG 62 10.405 -1.030 18.405 508 1HG ARG 62 HG2 ARG 62 10.175 -1.257 20.819 509 2HG ARG 62 HG3 ARG 62 11.930 -1.146 21.053 510 1HD ARG 62 HD2 ARG 62 10.167 1.037 19.897 511 2HD ARG 62 HD3 ARG 62 10.760 0.998 21.568 512 HE ARG 62 HE ARG 62 13.100 0.875 20.478 513 1HH1 ARG 62 HH22 ARG 62 10.464 2.917 19.229 514 2HH1 ARG 62 HH21 ARG 62 11.534 3.810 18.172 515 1HH2 ARG 62 HH12 ARG 62 14.440 2.045 19.049 516 2HH2 ARG 62 HH11 ARG 62 13.748 3.338 18.098 517 H ASN 63 H ASN 63 9.797 -3.435 17.423 518 HA ASN 63 HA ASN 63 7.708 -4.544 18.644 519 1HB ASN 63 HB2 ASN 63 8.129 -4.730 16.260 520 2HB ASN 63 HB3 ASN 63 9.545 -5.729 16.535 521 1HD2 ASN 63 HD22 ASN 63 9.306 -7.949 16.611 522 2HD2 ASN 63 HD21 ASN 63 7.744 -8.755 16.603 523 H LYS 64 H LYS 64 10.687 -6.462 18.251 524 HA LYS 64 HA LYS 64 10.367 -7.723 20.892 525 1HB LYS 64 HB2 LYS 64 10.187 -9.341 18.323 526 2HB LYS 64 HB3 LYS 64 10.575 -10.033 19.909 527 1HG LYS 64 HG2 LYS 64 8.396 -9.252 20.796 528 2HG LYS 64 HG3 LYS 64 7.978 -8.628 19.202 529 1HD LYS 64 HD2 LYS 64 6.920 -10.751 19.468 530 2HD LYS 64 HD3 LYS 64 8.170 -10.895 18.221 531 1HE LYS 64 HE2 LYS 64 9.669 -12.043 19.794 532 2HE LYS 64 HE3 LYS 64 8.551 -11.731 21.138 533 1HZ LYS 64 HZ1 LYS 64 8.360 -13.941 20.294 534 2HZ LYS 64 HZ2 LYS 64 6.956 -13.119 20.034 535 3HZ LYS 64 HZ3 LYS 64 7.995 -13.395 18.784 536 H ASP 65 H ASP 65 12.275 -6.009 19.284 537 HA ASP 65 HA ASP 65 14.353 -5.549 19.157 538 1HB ASP 65 HB2 ASP 65 15.870 -5.998 20.764 539 2HB ASP 65 HB3 ASP 65 14.340 -6.269 21.597 540 H GLN 66 H GLN 66 14.194 -9.098 18.919 541 HA GLN 66 HA GLN 66 16.479 -9.131 17.085 542 1HB GLN 66 HB2 GLN 66 14.531 -11.384 17.652 543 2HB GLN 66 HB3 GLN 66 16.132 -11.498 16.924 544 1HG GLN 66 HG2 GLN 66 17.123 -10.659 19.073 545 2HG GLN 66 HG3 GLN 66 15.505 -10.687 19.801 546 1HE2 GLN 66 HE22 GLN 66 14.296 -12.934 19.255 547 2HE2 GLN 66 HE21 GLN 66 15.281 -14.331 19.656 548 H GLU 67 H GLU 67 12.938 -9.369 16.834 549 HA GLU 67 HA GLU 67 13.119 -9.096 13.892 550 1HB GLU 67 HB2 GLU 67 11.304 -10.748 13.670 551 2HB GLU 67 HB3 GLU 67 12.748 -11.475 14.371 552 1HG GLU 67 HG2 GLU 67 10.343 -10.552 16.024 553 2HG GLU 67 HG3 GLU 67 10.511 -12.169 15.343 554 H VAL 68 H VAL 68 11.370 -8.277 12.842 555 HA VAL 68 HA VAL 68 9.510 -6.588 14.458 556 HB VAL 68 HB VAL 68 10.888 -5.224 13.033 557 1HG1 VAL 68 HG11 VAL 68 10.843 -5.307 10.610 558 2HG1 VAL 68 HG12 VAL 68 11.481 -6.830 11.238 559 3HG1 VAL 68 HG13 VAL 68 9.813 -6.744 10.625 560 1HG2 VAL 68 HG21 VAL 68 8.488 -4.649 13.431 561 2HG2 VAL 68 HG22 VAL 68 9.117 -4.009 11.908 562 3HG2 VAL 68 HG23 VAL 68 8.070 -5.432 11.893 563 H ASN 69 H ASN 69 7.377 -7.139 14.374 564 HA ASN 69 HA ASN 69 6.638 -9.427 12.686 565 1HB ASN 69 HB2 ASN 69 5.101 -9.985 14.185 566 2HB ASN 69 HB3 ASN 69 5.967 -8.938 15.299 567 1HD2 ASN 69 HD22 ASN 69 4.938 -6.884 15.880 568 2HD2 ASN 69 HD21 ASN 69 3.267 -6.573 15.454 569 H PHE 70 H PHE 70 4.824 -9.395 11.357 570 HA PHE 70 HA PHE 70 4.611 -7.471 9.448 571 1HB PHE 70 HB2 PHE 70 3.693 -9.698 9.261 572 2HB PHE 70 HB3 PHE 70 2.477 -9.347 10.491 573 HD1 PHE 70 HD1 PHE 70 3.732 -8.089 7.171 574 HD2 PHE 70 HD2 PHE 70 0.360 -8.548 9.823 575 HE1 PHE 70 HE1 PHE 70 2.274 -6.955 5.520 576 HE2 PHE 70 HE2 PHE 70 -1.088 -7.470 8.169 577 HZ PHE 70 HZ PHE 70 -0.135 -6.598 6.029 578 H GLN 71 H GLN 71 2.421 -7.550 12.334 579 HA GLN 71 HA GLN 71 0.840 -5.365 11.435 580 1HB GLN 71 HB2 GLN 71 0.065 -6.909 13.148 581 2HB GLN 71 HB3 GLN 71 1.384 -6.443 14.227 582 1HG GLN 71 HG2 GLN 71 -0.672 -5.436 14.961 583 2HG GLN 71 HG3 GLN 71 0.432 -4.164 14.457 584 1HE2 GLN 71 HE22 GLN 71 0.043 -3.232 12.181 585 2HE2 GLN 71 HE21 GLN 71 -1.664 -3.130 11.716 586 H GLU 72 H GLU 72 3.843 -5.496 13.359 587 HA GLU 72 HA GLU 72 3.752 -2.662 13.983 588 1HB GLU 72 HB2 GLU 72 4.842 -4.208 15.534 589 2HB GLU 72 HB3 GLU 72 6.028 -4.659 14.294 590 1HG GLU 72 HG2 GLU 72 6.878 -2.958 15.952 591 2HG GLU 72 HG3 GLU 72 6.959 -2.397 14.284 592 H TYR 73 H TYR 73 5.325 -4.762 11.549 593 HA TYR 73 HA TYR 73 6.873 -2.779 10.230 594 1HB TYR 73 HB2 TYR 73 7.262 -4.917 9.496 595 2HB TYR 73 HB3 TYR 73 5.570 -5.355 9.429 596 HD1 TYR 73 HD1 TYR 73 4.230 -5.074 7.448 597 HD2 TYR 73 HD2 TYR 73 8.273 -3.563 7.629 598 HE1 TYR 73 HE1 TYR 73 4.266 -4.883 4.997 599 HE2 TYR 73 HE2 TYR 73 8.343 -3.501 5.148 600 HH TYR 73 HH TYR 73 5.705 -4.769 3.148 601 H ILE 74 H ILE 74 3.438 -3.740 9.596 602 HA ILE 74 HA ILE 74 2.956 -1.721 7.667 603 HB ILE 74 HB ILE 74 1.020 -2.973 9.651 604 1HG1 ILE 74 HG12 ILE 74 2.123 -4.571 8.028 605 2HG1 ILE 74 HG13 ILE 74 0.380 -4.506 8.000 606 1HG2 ILE 74 HG21 ILE 74 -0.694 -2.220 7.853 607 2HG2 ILE 74 HG22 ILE 74 -0.049 -0.994 8.942 608 3HG2 ILE 74 HG23 ILE 74 0.566 -1.127 7.280 609 1HD1 ILE 74 HD11 ILE 74 0.425 -3.123 5.941 610 2HD1 ILE 74 HD12 ILE 74 2.209 -3.158 5.986 611 3HD1 ILE 74 HD13 ILE 74 1.283 -4.640 5.727 612 H THR 75 H THR 75 2.342 -1.612 11.223 613 HA THR 75 HA THR 75 1.434 1.042 11.358 614 HB THR 75 HB THR 75 3.130 -0.479 13.387 615 HG1 THR 75 HG1 THR 75 1.332 -1.628 12.974 616 1HG2 THR 75 HG21 THR 75 1.381 1.998 13.670 617 2HG2 THR 75 HG22 THR 75 1.878 0.968 15.032 618 3HG2 THR 75 HG23 THR 75 3.096 1.817 14.070 619 H PHE 76 H PHE 76 4.830 -0.139 11.484 620 HA PHE 76 HA PHE 76 5.968 2.434 11.905 621 1HB PHE 76 HB2 PHE 76 7.161 0.342 12.382 622 2HB PHE 76 HB3 PHE 76 7.175 -0.044 10.659 623 HD1 PHE 76 HD1 PHE 76 8.493 2.267 13.269 624 HD2 PHE 76 HD2 PHE 76 8.622 1.206 9.087 625 HE1 PHE 76 HE1 PHE 76 10.291 3.936 12.884 626 HE2 PHE 76 HE2 PHE 76 10.528 2.717 8.761 627 HZ PHE 76 HZ PHE 76 11.278 4.200 10.616 628 H LEU 77 H LEU 77 5.294 0.573 8.859 629 HA LEU 77 HA LEU 77 6.317 2.646 7.141 630 1HB LEU 77 HB2 LEU 77 4.214 0.498 6.719 631 2HB LEU 77 HB3 LEU 77 4.672 1.645 5.457 632 HG LEU 77 HG LEU 77 6.660 -0.208 6.859 633 1HD1 LEU 77 HD11 LEU 77 5.099 -1.541 5.546 634 2HD1 LEU 77 HD12 LEU 77 5.287 -0.443 4.151 635 3HD1 LEU 77 HD13 LEU 77 6.656 -1.424 4.691 636 1HD2 LEU 77 HD21 LEU 77 7.819 1.727 5.898 637 2HD2 LEU 77 HD22 LEU 77 8.062 0.345 4.836 638 3HD2 LEU 77 HD23 LEU 77 6.865 1.581 4.394 639 H GLY 78 H GLY 78 3.191 2.241 8.795 640 1HA GLY 78 HA2 GLY 78 1.914 4.568 7.780 641 2HA GLY 78 HA3 GLY 78 1.653 3.841 9.378 642 H ALA 79 H ALA 79 4.196 4.179 10.542 643 HA ALA 79 HA ALA 79 4.192 6.932 11.303 644 1HB ALA 79 HB1 ALA 79 6.227 6.462 12.512 645 2HB ALA 79 HB2 ALA 79 5.104 5.102 12.711 646 3HB ALA 79 HB3 ALA 79 6.495 4.962 11.613 647 H LEU 80 H LEU 80 6.328 5.136 9.091 648 HA LEU 80 HA LEU 80 7.990 7.219 8.238 649 1HB LEU 80 HB2 LEU 80 7.876 4.581 7.716 650 2HB LEU 80 HB3 LEU 80 6.986 5.126 6.301 651 HG LEU 80 HG LEU 80 9.001 6.673 5.843 652 1HD1 LEU 80 HD11 LEU 80 10.112 6.509 8.076 653 2HD1 LEU 80 HD12 LEU 80 10.274 4.756 7.853 654 3HD1 LEU 80 HD13 LEU 80 11.162 5.870 6.800 655 1HD2 LEU 80 HD21 LEU 80 10.269 4.812 4.799 656 2HD2 LEU 80 HD22 LEU 80 9.403 3.647 5.821 657 3HD2 LEU 80 HD23 LEU 80 8.525 4.574 4.581 658 H ALA 81 H ALA 81 4.867 6.127 6.907 659 HA ALA 81 HA ALA 81 4.560 8.045 4.849 660 1HB ALA 81 HB1 ALA 81 2.504 6.560 6.526 661 2HB ALA 81 HB2 ALA 81 2.141 7.519 5.086 662 3HB ALA 81 HB3 ALA 81 3.173 6.071 4.959 663 H MET 82 H MET 82 3.477 8.129 8.292 664 HA MET 82 HA MET 82 2.218 10.671 8.104 665 1HB MET 82 HB2 MET 82 1.856 8.991 9.884 666 2HB MET 82 HB3 MET 82 3.459 9.355 10.551 667 1HG MET 82 HG2 MET 82 2.724 11.688 10.982 668 2HG MET 82 HG3 MET 82 1.186 11.352 10.182 669 1HE MET 82 HE1 MET 82 2.393 9.683 14.318 670 2HE MET 82 HE2 MET 82 3.168 9.094 12.833 671 3HE MET 82 HE3 MET 82 3.398 10.785 13.347 672 H ILE 83 H ILE 83 5.593 9.749 8.898 673 HA ILE 83 HA ILE 83 6.544 12.400 9.452 674 HB ILE 83 HB ILE 83 7.928 9.904 8.411 675 1HG1 ILE 83 HG12 ILE 83 8.189 11.331 11.091 676 2HG1 ILE 83 HG13 ILE 83 6.975 10.087 10.812 677 1HG2 ILE 83 HG21 ILE 83 9.201 11.830 7.567 678 2HG2 ILE 83 HG22 ILE 83 9.169 12.582 9.175 679 3HG2 ILE 83 HG23 ILE 83 10.076 11.083 8.895 680 1HD1 ILE 83 HD11 ILE 83 9.983 9.674 10.625 681 2HD1 ILE 83 HD12 ILE 83 8.881 9.074 11.872 682 3HD1 ILE 83 HD13 ILE 83 8.751 8.457 10.217 683 H TYR 84 H TYR 84 6.362 10.492 6.402 684 HA TYR 84 HA TYR 84 6.959 12.770 4.694 685 1HB TYR 84 HB2 TYR 84 5.523 10.203 3.979 686 2HB TYR 84 HB3 TYR 84 6.344 11.305 2.879 687 HD1 TYR 84 HD1 TYR 84 6.684 8.319 3.020 688 HD2 TYR 84 HD2 TYR 84 8.903 11.543 4.844 689 HE1 TYR 84 HE1 TYR 84 8.731 6.937 2.981 690 HE2 TYR 84 HE2 TYR 84 10.929 10.131 4.858 691 HH TYR 84 HH TYR 84 10.968 6.821 3.513 692 H ASN 85 H ASN 85 4.967 13.511 6.556 693 HA ASN 85 HA ASN 85 2.346 13.486 5.948 694 1HB ASN 85 HB2 ASN 85 2.168 15.586 7.078 695 2HB ASN 85 HB3 ASN 85 3.466 14.704 7.871 696 1HD2 ASN 85 HD22 ASN 85 5.809 15.237 7.066 697 2HD2 ASN 85 HD21 ASN 85 6.062 16.875 6.491 698 H GLU 86 H GLU 86 4.831 15.196 4.114 699 HA GLU 86 HA GLU 86 3.333 17.014 2.598 700 1HB GLU 86 HB2 GLU 86 5.667 15.253 1.701 701 2HB GLU 86 HB3 GLU 86 5.022 16.644 0.832 702 1HG GLU 86 HG2 GLU 86 6.950 17.427 1.974 703 2HG GLU 86 HG3 GLU 86 5.548 18.114 2.802 704 H ALA 87 H ALA 87 3.666 13.473 2.229 705 HA ALA 87 HA ALA 87 2.284 13.243 -0.263 706 1HB ALA 87 HB1 ALA 87 2.579 11.213 1.985 707 2HB ALA 87 HB2 ALA 87 2.160 10.879 0.286 708 3HB ALA 87 HB3 ALA 87 3.766 11.507 0.696 709 H LEU 88 H LEU 88 1.146 13.458 3.123 710 HA LEU 88 HA LEU 88 -1.635 12.806 2.465 711 1HB LEU 88 HB2 LEU 88 -0.381 14.168 4.887 712 2HB LEU 88 HB3 LEU 88 -2.095 13.857 4.715 713 HG LEU 88 HG LEU 88 -0.103 11.585 4.514 714 1HD1 LEU 88 HD11 LEU 88 0.298 12.776 6.680 715 2HD1 LEU 88 HD12 LEU 88 -1.416 12.555 7.080 716 3HD1 LEU 88 HD13 LEU 88 -0.362 11.145 6.882 717 1HD2 LEU 88 HD21 LEU 88 -3.006 11.700 5.498 718 2HD2 LEU 88 HD22 LEU 88 -2.548 11.231 3.857 719 3HD2 LEU 88 HD23 LEU 88 -2.027 10.246 5.228 720 H LYS 89 H LYS 89 0.313 15.782 3.045 721 HA LYS 89 HA LYS 89 -1.770 17.642 2.619 722 1HB LYS 89 HB2 LYS 89 1.146 18.016 1.825 723 2HB LYS 89 HB3 LYS 89 -0.053 19.278 2.083 724 1HG LYS 89 HG2 LYS 89 1.164 17.456 4.191 725 2HG LYS 89 HG3 LYS 89 1.398 19.187 3.981 726 1HD LYS 89 HD2 LYS 89 -1.101 19.487 4.415 727 2HD LYS 89 HD3 LYS 89 -1.156 17.775 4.868 728 1HE LYS 89 HE2 LYS 89 0.521 19.956 6.196 729 2HE LYS 89 HE3 LYS 89 -0.932 19.190 6.857 730 1HZ LYS 89 HZ1 LYS 89 1.007 18.244 7.793 731 2HZ LYS 89 HZ2 LYS 89 0.274 17.102 6.864 732 3HZ LYS 89 HZ3 LYS 89 1.639 17.861 6.326 733 H GLY 90 H GLY 90 0.386 16.126 0.178 734 1HA GLY 90 HA2 GLY 90 -1.753 16.373 -1.816 735 2HA GLY 90 HA3 GLY 90 -0.276 17.291 -2.175 736 1H MET 1 H1 MET 1 15.094 0.815 -6.086 737 2H MET 1 H2 MET 1 15.007 1.907 -7.323 738 3H MET 1 H3 MET 1 15.335 0.322 -7.636 739 HA MET 1 HA MET 1 13.142 0.738 -8.267 740 1HB MET 1 HB2 MET 1 13.262 -0.833 -5.656 741 2HB MET 1 HB3 MET 1 11.908 -0.835 -6.800 742 1HG MET 1 HG2 MET 1 13.481 -1.662 -8.564 743 2HG MET 1 HG3 MET 1 14.752 -1.764 -7.330 744 1HE MET 1 HE1 MET 1 15.208 -4.264 -7.986 745 2HE MET 1 HE2 MET 1 13.936 -5.506 -8.072 746 3HE MET 1 HE3 MET 1 13.938 -4.157 -9.232 747 H ALA 2 H ALA 2 12.658 0.881 -4.768 748 HA ALA 2 HA ALA 2 11.596 2.166 -3.341 749 1HB ALA 2 HB1 ALA 2 13.278 3.838 -4.063 750 2HB ALA 2 HB2 ALA 2 12.112 4.496 -5.232 751 3HB ALA 2 HB3 ALA 2 11.767 4.561 -3.492 752 H SER 3 H SER 3 10.631 3.263 -6.497 753 HA SER 3 HA SER 3 8.146 4.142 -6.331 754 1HB SER 3 HB2 SER 3 8.824 2.262 -8.604 755 2HB SER 3 HB3 SER 3 7.901 3.761 -8.595 756 HG SER 3 HG SER 3 10.724 3.453 -8.248 757 HA PRO 4 HA PRO 4 6.110 -0.247 -6.624 758 1HB PRO 4 HB2 PRO 4 8.085 -1.828 -4.961 759 2HB PRO 4 HB3 PRO 4 7.028 -2.395 -6.283 760 1HG PRO 4 HG2 PRO 4 9.650 -1.937 -6.766 761 2HG PRO 4 HG3 PRO 4 8.430 -1.335 -7.931 762 1HD PRO 4 HD2 PRO 4 9.778 0.187 -5.694 763 2HD PRO 4 HD3 PRO 4 9.639 0.651 -7.406 764 H LEU 5 H LEU 5 8.078 0.116 -3.544 765 HA LEU 5 HA LEU 5 5.695 -0.307 -1.987 766 1HB LEU 5 HB2 LEU 5 7.905 -0.775 -1.086 767 2HB LEU 5 HB3 LEU 5 8.355 0.935 -1.202 768 HG LEU 5 HG LEU 5 6.657 1.543 0.460 769 1HD1 LEU 5 HD11 LEU 5 5.943 -1.436 0.509 770 2HD1 LEU 5 HD12 LEU 5 5.421 -0.215 1.690 771 3HD1 LEU 5 HD13 LEU 5 4.863 -0.104 0.025 772 1HD2 LEU 5 HD21 LEU 5 7.571 0.407 2.392 773 2HD2 LEU 5 HD22 LEU 5 8.205 -0.903 1.369 774 3HD2 LEU 5 HD23 LEU 5 8.880 0.747 1.237 775 H ASP 6 H ASP 6 7.481 2.592 -3.076 776 HA ASP 6 HA ASP 6 6.136 4.544 -1.602 777 1HB ASP 6 HB2 ASP 6 7.134 4.773 -4.464 778 2HB ASP 6 HB3 ASP 6 6.692 6.127 -3.423 779 H GLN 7 H GLN 7 5.125 3.210 -4.829 780 HA GLN 7 HA GLN 7 2.877 4.934 -5.016 781 1HB GLN 7 HB2 GLN 7 2.128 3.704 -6.840 782 2HB GLN 7 HB3 GLN 7 3.876 3.665 -6.878 783 1HG GLN 7 HG2 GLN 7 3.268 1.495 -7.462 784 2HG GLN 7 HG3 GLN 7 3.794 1.400 -5.791 785 1HE2 GLN 7 HE22 GLN 7 0.509 2.654 -6.527 786 2HE2 GLN 7 HE21 GLN 7 -0.319 1.189 -6.041 787 H ALA 8 H ALA 8 3.300 1.807 -3.372 788 HA ALA 8 HA ALA 8 0.491 1.373 -2.954 789 1HB ALA 8 HB1 ALA 8 1.271 -0.336 -1.343 790 2HB ALA 8 HB2 ALA 8 1.965 -0.463 -2.972 791 3HB ALA 8 HB3 ALA 8 2.946 0.177 -1.630 792 H ILE 9 H ILE 9 3.132 2.553 -0.745 793 HA ILE 9 HA ILE 9 1.283 3.151 1.381 794 HB ILE 9 HB ILE 9 2.999 4.565 2.355 795 1HG1 ILE 9 HG12 ILE 9 4.608 4.079 -0.139 796 2HG1 ILE 9 HG13 ILE 9 3.969 5.640 0.417 797 1HG2 ILE 9 HG21 ILE 9 4.544 2.786 2.833 798 2HG2 ILE 9 HG22 ILE 9 2.943 2.094 2.612 799 3HG2 ILE 9 HG23 ILE 9 4.146 1.967 1.307 800 1HD1 ILE 9 HD11 ILE 9 6.134 3.985 1.765 801 2HD1 ILE 9 HD12 ILE 9 6.282 5.573 1.003 802 3HD1 ILE 9 HD13 ILE 9 5.354 5.403 2.507 803 H GLY 10 H GLY 10 2.490 5.084 -1.365 804 1HA GLY 10 HA2 GLY 10 1.141 7.486 -1.106 805 2HA GLY 10 HA3 GLY 10 1.446 6.639 -2.628 806 H LEU 11 H LEU 11 -0.161 4.394 -2.435 807 HA LEU 11 HA LEU 11 -2.688 5.335 -3.166 808 1HB LEU 11 HB2 LEU 11 -1.467 3.048 -3.589 809 2HB LEU 11 HB3 LEU 11 -2.175 2.553 -2.059 810 HG LEU 11 HG LEU 11 -3.498 1.685 -3.761 811 1HD1 LEU 11 HD11 LEU 11 -5.674 2.508 -3.352 812 2HD1 LEU 11 HD12 LEU 11 -4.742 2.655 -1.850 813 3HD1 LEU 11 HD13 LEU 11 -5.069 4.096 -2.858 814 1HD2 LEU 11 HD21 LEU 11 -4.503 2.924 -5.583 815 2HD2 LEU 11 HD22 LEU 11 -3.721 4.426 -5.041 816 3HD2 LEU 11 HD23 LEU 11 -2.737 3.054 -5.612 817 H LEU 12 H LEU 12 -1.839 3.568 -0.144 818 HA LEU 12 HA LEU 12 -4.307 3.846 1.195 819 1HB LEU 12 HB2 LEU 12 -1.417 3.673 2.182 820 2HB LEU 12 HB3 LEU 12 -2.762 3.869 3.300 821 HG LEU 12 HG LEU 12 -3.822 1.823 2.459 822 1HD1 LEU 12 HD11 LEU 12 -2.459 0.181 1.180 823 2HD1 LEU 12 HD12 LEU 12 -2.780 1.619 0.212 824 3HD1 LEU 12 HD13 LEU 12 -1.187 1.394 0.983 825 1HD2 LEU 12 HD21 LEU 12 -0.989 1.561 3.544 826 2HD2 LEU 12 HD22 LEU 12 -2.493 1.736 4.481 827 3HD2 LEU 12 HD23 LEU 12 -2.200 0.264 3.559 828 H ILE 13 H ILE 13 -1.513 6.051 1.152 829 HA ILE 13 HA ILE 13 -2.539 7.964 3.003 830 HB ILE 13 HB ILE 13 -0.500 8.042 0.743 831 1HG1 ILE 13 HG12 ILE 13 -0.022 8.182 3.746 832 2HG1 ILE 13 HG13 ILE 13 -0.161 6.641 2.907 833 1HG2 ILE 13 HG21 ILE 13 -0.923 10.215 2.803 834 2HG2 ILE 13 HG22 ILE 13 0.396 10.129 1.639 835 3HG2 ILE 13 HG23 ILE 13 -1.250 10.377 1.063 836 1HD1 ILE 13 HD11 ILE 13 1.693 7.573 1.308 837 2HD1 ILE 13 HD12 ILE 13 2.002 8.722 2.627 838 3HD1 ILE 13 HD13 ILE 13 2.123 6.970 2.908 839 H GLY 14 H GLY 14 -2.526 7.964 -0.565 840 1HA GLY 14 HA2 GLY 14 -3.895 10.362 -1.032 841 2HA GLY 14 HA3 GLY 14 -3.856 8.955 -2.115 842 H ILE 15 H ILE 15 -5.188 6.980 -0.694 843 HA ILE 15 HA ILE 15 -7.923 7.636 -1.055 844 HB ILE 15 HB ILE 15 -6.365 5.384 0.183 845 1HG1 ILE 15 HG12 ILE 15 -8.593 5.601 -1.905 846 2HG1 ILE 15 HG13 ILE 15 -6.858 5.524 -2.242 847 1HG2 ILE 15 HG21 ILE 15 -8.124 5.700 1.834 848 2HG2 ILE 15 HG22 ILE 15 -9.358 5.670 0.549 849 3HG2 ILE 15 HG23 ILE 15 -8.385 4.230 0.931 850 1HD1 ILE 15 HD11 ILE 15 -6.851 3.253 -1.086 851 2HD1 ILE 15 HD12 ILE 15 -8.619 3.322 -1.075 852 3HD1 ILE 15 HD13 ILE 15 -7.760 3.336 -2.614 853 H PHE 16 H PHE 16 -5.990 7.324 1.971 854 HA PHE 16 HA PHE 16 -8.077 7.995 3.673 855 1HB PHE 16 HB2 PHE 16 -5.835 7.138 4.341 856 2HB PHE 16 HB3 PHE 16 -5.118 8.700 4.008 857 HD1 PHE 16 HD1 PHE 16 -5.706 10.685 5.418 858 HD2 PHE 16 HD2 PHE 16 -7.242 6.768 6.311 859 HE1 PHE 16 HE1 PHE 16 -6.542 11.487 7.601 860 HE2 PHE 16 HE2 PHE 16 -7.735 7.492 8.640 861 HZ PHE 16 HZ PHE 16 -7.326 9.826 9.299 862 H HIS 17 H HIS 17 -5.598 10.291 2.376 863 HA HIS 17 HA HIS 17 -6.949 12.404 3.768 864 1HB HIS 17 HB2 HIS 17 -4.389 12.083 2.918 865 2HB HIS 17 HB3 HIS 17 -4.978 13.227 1.719 866 HD1 HIS 17 HD1 HIS 17 -4.073 15.497 2.603 867 HD2 HIS 17 HD2 HIS 17 -5.493 12.966 5.634 868 HE1 HIS 17 HE1 HIS 17 -3.850 16.785 4.797 869 H LYS 18 H LYS 18 -7.332 11.147 0.474 870 HA LYS 18 HA LYS 18 -8.667 13.571 -0.415 871 1HB LYS 18 HB2 LYS 18 -9.346 12.525 -2.317 872 2HB LYS 18 HB3 LYS 18 -7.772 11.806 -1.977 873 1HG LYS 18 HG2 LYS 18 -8.944 9.798 -1.083 874 2HG LYS 18 HG3 LYS 18 -10.513 10.538 -1.453 875 1HD LYS 18 HD2 LYS 18 -9.827 10.641 -3.868 876 2HD LYS 18 HD3 LYS 18 -8.335 9.774 -3.437 877 1HE LYS 18 HE2 LYS 18 -9.737 7.900 -2.518 878 2HE LYS 18 HE3 LYS 18 -11.198 8.767 -3.026 879 1HZ LYS 18 HZ1 LYS 18 -9.068 7.809 -4.803 880 2HZ LYS 18 HZ2 LYS 18 -10.537 7.098 -4.578 881 3HZ LYS 18 HZ3 LYS 18 -10.442 8.590 -5.277 882 H TYR 19 H TYR 19 -9.720 10.546 1.234 883 HA TYR 19 HA TYR 19 -12.486 11.343 1.278 884 1HB TYR 19 HB2 TYR 19 -10.942 9.318 2.877 885 2HB TYR 19 HB3 TYR 19 -12.625 9.728 3.241 886 HD1 TYR 19 HD1 TYR 19 -10.563 7.654 1.167 887 HD2 TYR 19 HD2 TYR 19 -14.430 9.478 1.477 888 HE1 TYR 19 HE1 TYR 19 -11.185 6.633 -0.980 889 HE2 TYR 19 HE2 TYR 19 -15.176 8.160 -0.477 890 HH TYR 19 HH TYR 19 -12.778 6.482 -2.610 891 H SER 20 H SER 20 -9.871 11.795 3.808 892 HA SER 20 HA SER 20 -11.672 13.168 5.546 893 1HB SER 20 HB2 SER 20 -9.805 14.115 6.679 894 2HB SER 20 HB3 SER 20 -9.480 12.409 6.340 895 HG SER 20 HG SER 20 -7.760 13.980 5.961 896 H GLY 21 H GLY 21 -9.571 14.404 2.977 897 1HA GLY 21 HA2 GLY 21 -9.970 17.036 2.709 898 2HA GLY 21 HA3 GLY 21 -10.079 15.916 1.348 899 H LYS 22 H LYS 22 -12.618 14.641 2.184 900 HA LYS 22 HA LYS 22 -14.502 16.267 0.895 901 1HB LYS 22 HB2 LYS 22 -14.677 13.801 1.429 902 2HB LYS 22 HB3 LYS 22 -15.008 14.251 3.100 903 1HG LYS 22 HG2 LYS 22 -17.048 15.495 2.368 904 2HG LYS 22 HG3 LYS 22 -16.681 15.093 0.692 905 1HD LYS 22 HD2 LYS 22 -18.447 13.643 1.670 906 2HD LYS 22 HD3 LYS 22 -17.055 12.727 1.085 907 1HE LYS 22 HE2 LYS 22 -17.943 11.911 3.270 908 2HE LYS 22 HE3 LYS 22 -16.237 12.363 3.308 909 1HZ LYS 22 HZ1 LYS 22 -18.462 14.041 4.253 910 2HZ LYS 22 HZ2 LYS 22 -17.430 13.177 5.209 911 3HZ LYS 22 HZ3 LYS 22 -16.859 14.430 4.314 912 H GLU 23 H GLU 23 -13.756 15.984 4.379 913 HA GLU 23 HA GLU 23 -15.657 18.209 4.990 914 1HB GLU 23 HB2 GLU 23 -15.418 17.557 7.335 915 2HB GLU 23 HB3 GLU 23 -16.106 16.297 6.303 916 1HG GLU 23 HG2 GLU 23 -13.895 15.151 6.248 917 2HG GLU 23 HG3 GLU 23 -13.239 16.368 7.342 918 H GLY 24 H GLY 24 -12.248 17.174 5.277 919 1HA GLY 24 HA2 GLY 24 -11.167 19.699 4.777 920 2HA GLY 24 HA3 GLY 24 -11.218 19.507 6.547 921 H ASP 25 H ASP 25 -8.887 19.436 4.526 922 HA ASP 25 HA ASP 25 -7.988 16.676 4.457 923 1HB ASP 25 HB2 ASP 25 -6.038 17.567 3.350 924 2HB ASP 25 HB3 ASP 25 -7.504 18.237 2.639 925 H LYS 26 H LYS 26 -8.394 16.591 6.867 926 HA LYS 26 HA LYS 26 -5.919 17.242 8.416 927 1HB LYS 26 HB2 LYS 26 -7.304 16.817 10.417 928 2HB LYS 26 HB3 LYS 26 -7.869 18.197 9.466 929 1HG LYS 26 HG2 LYS 26 -9.705 16.877 8.531 930 2HG LYS 26 HG3 LYS 26 -9.105 15.405 9.318 931 1HD LYS 26 HD2 LYS 26 -9.494 16.427 11.530 932 2HD LYS 26 HD3 LYS 26 -10.084 17.913 10.754 933 1HE LYS 26 HE2 LYS 26 -11.927 16.695 9.699 934 2HE LYS 26 HE3 LYS 26 -11.303 15.143 10.285 935 1HZ LYS 26 HZ1 LYS 26 -12.278 17.323 11.989 936 2HZ LYS 26 HZ2 LYS 26 -13.093 15.941 11.611 937 3HZ LYS 26 HZ3 LYS 26 -11.716 15.861 12.509 938 H HIS 27 H HIS 27 -5.133 15.512 9.788 939 HA HIS 27 HA HIS 27 -5.053 13.007 8.324 940 1HB HIS 27 HB2 HIS 27 -3.694 13.824 10.901 941 2HB HIS 27 HB3 HIS 27 -3.312 12.406 9.917 942 HD1 HIS 27 HD1 HIS 27 -3.748 14.776 7.271 943 HD2 HIS 27 HD2 HIS 27 -0.910 14.226 10.346 944 HE1 HIS 27 HE1 HIS 27 -1.633 15.953 6.532 945 H THR 28 H THR 28 -7.702 13.474 9.339 946 HA THR 28 HA THR 28 -8.057 11.043 10.890 947 HB THR 28 HB THR 28 -9.632 11.948 12.423 948 HG1 THR 28 HG1 THR 28 -10.162 14.004 12.528 949 1HG2 THR 28 HG21 THR 28 -7.262 11.860 13.164 950 2HG2 THR 28 HG22 THR 28 -7.054 13.550 12.643 951 3HG2 THR 28 HG23 THR 28 -8.182 13.153 13.952 952 H LEU 29 H LEU 29 -9.918 9.984 10.303 953 HA LEU 29 HA LEU 29 -11.728 11.301 8.306 954 1HB LEU 29 HB2 LEU 29 -11.212 8.359 8.895 955 2HB LEU 29 HB3 LEU 29 -12.499 8.923 7.841 956 HG LEU 29 HG LEU 29 -9.582 9.551 7.282 957 1HD1 LEU 29 HD11 LEU 29 -11.302 7.228 6.286 958 2HD1 LEU 29 HD12 LEU 29 -9.690 7.648 5.673 959 3HD1 LEU 29 HD13 LEU 29 -9.887 7.072 7.344 960 1HD2 LEU 29 HD21 LEU 29 -11.414 10.887 6.133 961 2HD2 LEU 29 HD22 LEU 29 -10.372 9.944 5.053 962 3HD2 LEU 29 HD23 LEU 29 -11.989 9.352 5.444 963 H SER 30 H SER 30 -13.995 11.298 8.837 964 HA SER 30 HA SER 30 -14.607 10.533 11.643 965 1HB SER 30 HB2 SER 30 -16.814 11.589 11.133 966 2HB SER 30 HB3 SER 30 -15.456 12.671 10.802 967 HG SER 30 HG SER 30 -16.138 12.763 8.819 968 H LYS 31 H LYS 31 -16.946 9.445 11.769 969 HA LYS 31 HA LYS 31 -16.330 6.759 11.213 970 1HB LYS 31 HB2 LYS 31 -19.034 7.927 12.036 971 2HB LYS 31 HB3 LYS 31 -18.453 6.269 12.263 972 1HG LYS 31 HG2 LYS 31 -16.523 7.316 13.605 973 2HG LYS 31 HG3 LYS 31 -17.442 8.805 13.645 974 1HD LYS 31 HD2 LYS 31 -18.457 6.096 14.637 975 2HD LYS 31 HD3 LYS 31 -17.758 7.345 15.662 976 1HE LYS 31 HE2 LYS 31 -20.312 7.648 14.007 977 2HE LYS 31 HE3 LYS 31 -20.224 7.347 15.746 978 1HZ LYS 31 HZ1 LYS 31 -19.067 9.423 15.999 979 2HZ LYS 31 HZ2 LYS 31 -19.193 9.731 14.385 980 3HZ LYS 31 HZ3 LYS 31 -20.550 9.642 15.314 981 H LYS 32 H LYS 32 -19.217 8.529 10.000 982 HA LYS 32 HA LYS 32 -19.859 6.522 8.076 983 1HB LYS 32 HB2 LYS 32 -21.509 8.034 8.952 984 2HB LYS 32 HB3 LYS 32 -20.681 9.442 8.242 985 1HG LYS 32 HG2 LYS 32 -21.130 8.563 5.974 986 2HG LYS 32 HG3 LYS 32 -21.895 7.121 6.670 987 1HD LYS 32 HD2 LYS 32 -23.603 8.575 7.761 988 2HD LYS 32 HD3 LYS 32 -22.850 10.006 7.041 989 1HE LYS 32 HE2 LYS 32 -24.080 7.669 5.494 990 2HE LYS 32 HE3 LYS 32 -24.844 9.242 5.772 991 1HZ LYS 32 HZ1 LYS 32 -23.843 9.153 3.637 992 2HZ LYS 32 HZ2 LYS 32 -23.048 10.261 4.562 993 3HZ LYS 32 HZ3 LYS 32 -22.367 8.790 4.265 994 H GLU 33 H GLU 33 -17.683 9.291 7.969 995 HA GLU 33 HA GLU 33 -17.257 9.379 5.141 996 1HB GLU 33 HB2 GLU 33 -16.675 11.171 6.651 997 2HB GLU 33 HB3 GLU 33 -15.527 10.132 7.519 998 1HG GLU 33 HG2 GLU 33 -14.055 10.029 5.637 999 2HG GLU 33 HG3 GLU 33 -15.231 10.816 4.578 1000 H LEU 34 H LEU 34 -15.522 7.602 7.804 1001 HA LEU 34 HA LEU 34 -13.793 6.145 6.080 1002 1HB LEU 34 HB2 LEU 34 -13.421 6.095 8.427 1003 2HB LEU 34 HB3 LEU 34 -15.027 5.486 8.785 1004 HG LEU 34 HG LEU 34 -13.262 3.824 9.071 1005 1HD1 LEU 34 HD11 LEU 34 -14.435 1.987 8.361 1006 2HD1 LEU 34 HD12 LEU 34 -15.695 3.223 8.379 1007 3HD1 LEU 34 HD13 LEU 34 -14.958 2.731 6.853 1008 1HD2 LEU 34 HD21 LEU 34 -12.205 2.758 7.074 1009 2HD2 LEU 34 HD22 LEU 34 -12.907 3.992 6.046 1010 3HD2 LEU 34 HD23 LEU 34 -11.724 4.456 7.284 1011 H LYS 35 H LYS 35 -17.142 5.435 7.235 1012 HA LYS 35 HA LYS 35 -17.351 3.002 5.864 1013 1HB LYS 35 HB2 LYS 35 -18.959 4.012 7.544 1014 2HB LYS 35 HB3 LYS 35 -19.720 4.870 6.182 1015 1HG LYS 35 HG2 LYS 35 -20.073 2.663 5.052 1016 2HG LYS 35 HG3 LYS 35 -19.284 1.863 6.425 1017 1HD LYS 35 HD2 LYS 35 -21.077 2.832 7.929 1018 2HD LYS 35 HD3 LYS 35 -21.891 3.429 6.464 1019 1HE LYS 35 HE2 LYS 35 -21.847 1.019 5.595 1020 2HE LYS 35 HE3 LYS 35 -21.248 0.527 7.186 1021 1HZ LYS 35 HZ1 LYS 35 -23.263 1.437 8.131 1022 2HZ LYS 35 HZ2 LYS 35 -23.790 1.921 6.646 1023 3HZ LYS 35 HZ3 LYS 35 -23.629 0.317 6.976 1024 H GLU 36 H GLU 36 -17.967 6.280 4.621 1025 HA GLU 36 HA GLU 36 -18.785 5.664 1.997 1026 1HB GLU 36 HB2 GLU 36 -18.749 7.931 3.175 1027 2HB GLU 36 HB3 GLU 36 -17.025 8.016 2.802 1028 1HG GLU 36 HG2 GLU 36 -17.568 7.784 0.365 1029 2HG GLU 36 HG3 GLU 36 -19.289 7.883 0.788 1030 H LEU 37 H LEU 37 -15.457 6.347 3.219 1031 HA LEU 37 HA LEU 37 -13.968 5.761 0.945 1032 1HB LEU 37 HB2 LEU 37 -13.049 6.661 3.022 1033 2HB LEU 37 HB3 LEU 37 -13.343 5.175 3.887 1034 HG LEU 37 HG LEU 37 -11.394 5.293 1.587 1035 1HD1 LEU 37 HD11 LEU 37 -9.653 5.525 3.360 1036 2HD1 LEU 37 HD12 LEU 37 -10.755 6.902 3.416 1037 3HD1 LEU 37 HD13 LEU 37 -10.913 5.580 4.595 1038 1HD2 LEU 37 HD21 LEU 37 -10.360 3.373 2.837 1039 2HD2 LEU 37 HD22 LEU 37 -11.774 3.328 3.900 1040 3HD2 LEU 37 HD23 LEU 37 -11.932 2.968 2.161 1041 H ILE 38 H ILE 38 -14.992 3.389 3.420 1042 HA ILE 38 HA ILE 38 -13.940 1.165 1.970 1043 HB ILE 38 HB ILE 38 -16.140 1.362 4.055 1044 1HG1 ILE 38 HG12 ILE 38 -13.201 0.507 4.098 1045 2HG1 ILE 38 HG13 ILE 38 -13.867 2.012 4.748 1046 1HG2 ILE 38 HG21 ILE 38 -14.803 -1.158 2.986 1047 2HG2 ILE 38 HG22 ILE 38 -15.979 -1.079 4.310 1048 3HG2 ILE 38 HG23 ILE 38 -16.486 -0.717 2.669 1049 1HD1 ILE 38 HD11 ILE 38 -15.320 0.549 6.275 1050 2HD1 ILE 38 HD12 ILE 38 -14.267 -0.800 5.765 1051 3HD1 ILE 38 HD13 ILE 38 -13.561 0.616 6.573 1052 H GLN 39 H GLN 39 -17.291 2.531 1.951 1053 HA GLN 39 HA GLN 39 -18.263 0.485 0.233 1054 1HB GLN 39 HB2 GLN 39 -19.277 3.349 0.558 1055 2HB GLN 39 HB3 GLN 39 -20.117 2.057 -0.292 1056 1HG GLN 39 HG2 GLN 39 -20.103 2.660 2.555 1057 2HG GLN 39 HG3 GLN 39 -21.219 1.700 1.605 1058 1HE2 GLN 39 HE22 GLN 39 -18.373 1.625 3.643 1059 2HE2 GLN 39 HE21 GLN 39 -18.337 -0.128 3.846 1060 H LYS 40 H LYS 40 -16.662 3.583 -0.510 1061 HA LYS 40 HA LYS 40 -17.248 3.343 -3.332 1062 1HB LYS 40 HB2 LYS 40 -16.682 5.437 -1.829 1063 2HB LYS 40 HB3 LYS 40 -15.018 5.028 -2.198 1064 1HG LYS 40 HG2 LYS 40 -17.312 5.770 -4.071 1065 2HG LYS 40 HG3 LYS 40 -15.871 6.728 -3.731 1066 1HD LYS 40 HD2 LYS 40 -15.965 4.110 -5.308 1067 2HD LYS 40 HD3 LYS 40 -15.818 5.728 -5.979 1068 1HE LYS 40 HE2 LYS 40 -13.645 6.077 -4.970 1069 2HE LYS 40 HE3 LYS 40 -13.763 4.565 -4.059 1070 1HZ LYS 40 HZ1 LYS 40 -13.779 3.364 -6.091 1071 2HZ LYS 40 HZ2 LYS 40 -13.654 4.753 -6.972 1072 3HZ LYS 40 HZ3 LYS 40 -12.424 4.294 -5.974 1073 H GLU 41 H GLU 41 -14.268 2.849 -1.324 1074 HA GLU 41 HA GLU 41 -12.739 2.058 -3.662 1075 1HB GLU 41 HB2 GLU 41 -12.099 1.812 -0.695 1076 2HB GLU 41 HB3 GLU 41 -10.947 1.629 -2.019 1077 1HG GLU 41 HG2 GLU 41 -12.505 4.188 -1.370 1078 2HG GLU 41 HG3 GLU 41 -10.842 3.867 -0.916 1079 H LEU 42 H LEU 42 -14.102 0.289 -0.862 1080 HA LEU 42 HA LEU 42 -13.420 -2.333 -2.124 1081 1HB LEU 42 HB2 LEU 42 -14.552 -1.823 0.645 1082 2HB LEU 42 HB3 LEU 42 -13.944 -3.333 -0.030 1083 HG LEU 42 HG LEU 42 -12.354 -0.871 0.790 1084 1HD1 LEU 42 HD11 LEU 42 -12.240 -3.779 1.713 1085 2HD1 LEU 42 HD12 LEU 42 -11.284 -2.430 2.358 1086 3HD1 LEU 42 HD13 LEU 42 -13.037 -2.464 2.594 1087 1HD2 LEU 42 HD21 LEU 42 -10.312 -2.163 0.157 1088 2HD2 LEU 42 HD22 LEU 42 -11.345 -3.374 -0.622 1089 3HD2 LEU 42 HD23 LEU 42 -11.281 -1.697 -1.243 1090 H THR 43 H THR 43 -15.066 -1.361 -3.811 1091 HA THR 43 HA THR 43 -17.755 -1.112 -3.099 1092 HB THR 43 HB THR 43 -17.085 -1.897 -5.912 1093 HG1 THR 43 HG1 THR 43 -16.030 0.469 -4.791 1094 1HG2 THR 43 HG21 THR 43 -18.353 0.118 -6.418 1095 2HG2 THR 43 HG22 THR 43 -19.272 -0.900 -5.290 1096 3HG2 THR 43 HG23 THR 43 -18.428 0.552 -4.698 1097 H ILE 44 H ILE 44 -17.915 -3.066 -1.717 1098 HA ILE 44 HA ILE 44 -17.986 -5.677 -2.622 1099 HB ILE 44 HB ILE 44 -20.055 -4.630 -0.658 1100 1HG1 ILE 44 HG12 ILE 44 -17.082 -5.068 -0.199 1101 2HG1 ILE 44 HG13 ILE 44 -18.061 -3.626 0.148 1102 1HG2 ILE 44 HG21 ILE 44 -18.549 -7.273 -0.754 1103 2HG2 ILE 44 HG22 ILE 44 -19.889 -6.844 0.333 1104 3HG2 ILE 44 HG23 ILE 44 -20.189 -7.034 -1.382 1105 1HD1 ILE 44 HD11 ILE 44 -19.301 -4.887 1.888 1106 2HD1 ILE 44 HD12 ILE 44 -18.153 -6.236 1.671 1107 3HD1 ILE 44 HD13 ILE 44 -17.569 -4.657 2.208 1108 H GLY 45 H GLY 45 -20.542 -3.258 -2.887 1109 1HA GLY 45 HA2 GLY 45 -22.445 -3.163 -4.216 1110 2HA GLY 45 HA3 GLY 45 -21.959 -4.662 -5.029 1111 H SER 46 H SER 46 -21.999 -6.645 -3.487 1112 HA SER 46 HA SER 46 -24.629 -6.974 -2.301 1113 1HB SER 46 HB2 SER 46 -22.176 -8.780 -2.202 1114 2HB SER 46 HB3 SER 46 -23.861 -9.245 -1.887 1115 HG SER 46 HG SER 46 -23.162 -9.700 -4.063 1116 H LYS 47 H LYS 47 -24.054 -4.967 -0.868 1117 HA LYS 47 HA LYS 47 -22.248 -5.339 1.364 1118 1HB LYS 47 HB2 LYS 47 -24.368 -3.246 0.755 1119 2HB LYS 47 HB3 LYS 47 -23.198 -3.135 2.083 1120 1HG LYS 47 HG2 LYS 47 -21.331 -3.129 0.574 1121 2HG LYS 47 HG3 LYS 47 -22.374 -3.409 -0.839 1122 1HD LYS 47 HD2 LYS 47 -23.546 -1.240 -0.347 1123 2HD LYS 47 HD3 LYS 47 -22.362 -0.939 0.936 1124 1HE LYS 47 HE2 LYS 47 -21.794 -1.254 -2.057 1125 2HE LYS 47 HE3 LYS 47 -21.707 0.237 -1.106 1126 1HZ LYS 47 HZ1 LYS 47 -19.974 -0.832 0.209 1127 2HZ LYS 47 HZ2 LYS 47 -19.971 -2.113 -0.823 1128 3HZ LYS 47 HZ3 LYS 47 -19.545 -0.616 -1.375 1129 H LEU 48 H LEU 48 -23.748 -7.540 1.553 1130 HA LEU 48 HA LEU 48 -26.049 -7.284 3.312 1131 1HB LEU 48 HB2 LEU 48 -24.211 -9.667 2.824 1132 2HB LEU 48 HB3 LEU 48 -25.823 -9.713 3.549 1133 HG LEU 48 HG LEU 48 -25.175 -8.948 0.659 1134 1HD1 LEU 48 HD11 LEU 48 -26.281 -11.067 0.106 1135 2HD1 LEU 48 HD12 LEU 48 -24.883 -11.344 1.160 1136 3HD1 LEU 48 HD13 LEU 48 -26.527 -11.410 1.832 1137 1HD2 LEU 48 HD21 LEU 48 -27.652 -9.058 0.337 1138 2HD2 LEU 48 HD22 LEU 48 -27.857 -9.192 2.096 1139 3HD2 LEU 48 HD23 LEU 48 -27.169 -7.717 1.379 1140 H GLN 49 H GLN 49 -22.582 -7.670 3.735 1141 HA GLN 49 HA GLN 49 -22.676 -8.346 6.538 1142 1HB GLN 49 HB2 GLN 49 -20.378 -7.337 4.810 1143 2HB GLN 49 HB3 GLN 49 -20.236 -8.132 6.382 1144 1HG GLN 49 HG2 GLN 49 -21.277 -10.190 5.435 1145 2HG GLN 49 HG3 GLN 49 -21.348 -9.415 3.846 1146 1HE2 GLN 49 HE22 GLN 49 -19.072 -10.444 6.417 1147 2HE2 GLN 49 HE21 GLN 49 -17.710 -10.661 5.321 1148 H ASP 50 H ASP 50 -24.132 -5.837 5.954 1149 HA ASP 50 HA ASP 50 -22.638 -3.502 6.303 1150 1HB ASP 50 HB2 ASP 50 -24.976 -3.552 5.550 1151 2HB ASP 50 HB3 ASP 50 -25.507 -4.080 7.158 1152 H ALA 51 H ALA 51 -24.230 -5.520 8.765 1153 HA ALA 51 HA ALA 51 -23.625 -4.112 11.112 1154 1HB ALA 51 HB1 ALA 51 -25.033 -6.120 11.042 1155 2HB ALA 51 HB2 ALA 51 -23.618 -7.125 10.656 1156 3HB ALA 51 HB3 ALA 51 -23.726 -6.306 12.229 1157 H GLU 52 H GLU 52 -21.538 -6.336 9.212 1158 HA GLU 52 HA GLU 52 -19.387 -6.302 11.158 1159 1HB GLU 52 HB2 GLU 52 -19.283 -7.097 8.221 1160 2HB GLU 52 HB3 GLU 52 -18.084 -7.432 9.470 1161 1HG GLU 52 HG2 GLU 52 -19.798 -8.753 10.743 1162 2HG GLU 52 HG3 GLU 52 -20.943 -8.516 9.411 1163 H ILE 53 H ILE 53 -20.179 -4.544 8.117 1164 HA ILE 53 HA ILE 53 -17.770 -3.013 8.052 1165 HB ILE 53 HB ILE 53 -20.507 -2.035 7.179 1166 1HG1 ILE 53 HG12 ILE 53 -20.058 -4.108 5.996 1167 2HG1 ILE 53 HG13 ILE 53 -19.904 -2.734 4.916 1168 1HG2 ILE 53 HG21 ILE 53 -18.873 -0.218 7.396 1169 2HG2 ILE 53 HG22 ILE 53 -17.691 -1.115 6.442 1170 3HG2 ILE 53 HG23 ILE 53 -19.206 -0.561 5.698 1171 1HD1 ILE 53 HD11 ILE 53 -18.158 -4.409 4.525 1172 2HD1 ILE 53 HD12 ILE 53 -17.439 -2.879 5.044 1173 3HD1 ILE 53 HD13 ILE 53 -17.570 -4.245 6.182 1174 H VAL 54 H VAL 54 -20.900 -2.288 9.757 1175 HA VAL 54 HA VAL 54 -19.737 0.155 10.757 1176 HB VAL 54 HB VAL 54 -21.649 0.360 12.264 1177 1HG1 VAL 54 HG11 VAL 54 -22.247 -0.155 9.331 1178 2HG1 VAL 54 HG12 VAL 54 -23.192 0.877 10.428 1179 3HG1 VAL 54 HG13 VAL 54 -21.536 1.337 9.991 1180 1HG2 VAL 54 HG21 VAL 54 -23.579 -1.056 12.057 1181 2HG2 VAL 54 HG22 VAL 54 -22.759 -2.084 10.879 1182 3HG2 VAL 54 HG23 VAL 54 -22.204 -2.051 12.569 1183 H LYS 55 H LYS 55 -19.831 -3.144 12.139 1184 HA LYS 55 HA LYS 55 -18.710 -2.372 14.655 1185 1HB LYS 55 HB2 LYS 55 -19.580 -4.595 14.318 1186 2HB LYS 55 HB3 LYS 55 -18.425 -4.921 13.021 1187 1HG LYS 55 HG2 LYS 55 -17.843 -6.017 15.168 1188 2HG LYS 55 HG3 LYS 55 -16.563 -4.964 14.555 1189 1HD LYS 55 HD2 LYS 55 -17.148 -3.212 16.165 1190 2HD LYS 55 HD3 LYS 55 -18.566 -4.129 16.712 1191 1HE LYS 55 HE2 LYS 55 -17.147 -5.854 17.662 1192 2HE LYS 55 HE3 LYS 55 -15.706 -5.183 16.874 1193 1HZ LYS 55 HZ1 LYS 55 -17.262 -3.780 18.923 1194 2HZ LYS 55 HZ2 LYS 55 -15.846 -4.587 19.181 1195 3HZ LYS 55 HZ3 LYS 55 -15.869 -3.265 18.201 1196 H LEU 56 H LEU 56 -17.149 -3.331 11.572 1197 HA LEU 56 HA LEU 56 -14.460 -2.911 12.305 1198 1HB LEU 56 HB2 LEU 56 -14.975 -4.125 10.391 1199 2HB LEU 56 HB3 LEU 56 -15.996 -2.876 9.698 1200 HG LEU 56 HG LEU 56 -13.115 -2.165 10.101 1201 1HD1 LEU 56 HD11 LEU 56 -12.527 -3.210 7.932 1202 2HD1 LEU 56 HD12 LEU 56 -12.958 -4.438 9.138 1203 3HD1 LEU 56 HD13 LEU 56 -14.120 -3.989 7.871 1204 1HD2 LEU 56 HD21 LEU 56 -14.800 -0.546 9.101 1205 2HD2 LEU 56 HD22 LEU 56 -13.496 -1.014 8.004 1206 3HD2 LEU 56 HD23 LEU 56 -15.125 -1.723 7.830 1207 H MET 57 H MET 57 -16.831 -0.593 10.965 1208 HA MET 57 HA MET 57 -15.178 1.687 10.791 1209 1HB MET 57 HB2 MET 57 -17.465 1.507 9.821 1210 2HB MET 57 HB3 MET 57 -18.128 1.432 11.455 1211 1HG MET 57 HG2 MET 57 -17.220 3.759 11.868 1212 2HG MET 57 HG3 MET 57 -16.795 3.801 10.161 1213 1HE MET 57 HE1 MET 57 -21.079 3.835 11.882 1214 2HE MET 57 HE2 MET 57 -20.066 2.388 12.039 1215 3HE MET 57 HE3 MET 57 -19.588 3.896 12.851 1216 H ASP 58 H ASP 58 -17.385 0.651 13.433 1217 HA ASP 58 HA ASP 58 -16.774 2.578 15.364 1218 1HB ASP 58 HB2 ASP 58 -18.580 1.064 15.724 1219 2HB ASP 58 HB3 ASP 58 -17.523 -0.346 15.645 1220 H ASP 59 H ASP 59 -15.157 -0.593 14.860 1221 HA ASP 59 HA ASP 59 -13.186 -0.276 16.853 1222 1HB ASP 59 HB2 ASP 59 -12.944 -1.766 14.201 1223 2HB ASP 59 HB3 ASP 59 -11.888 -1.968 15.602 1224 H LEU 60 H LEU 60 -12.961 0.557 13.361 1225 HA LEU 60 HA LEU 60 -10.364 1.665 13.449 1226 1HB LEU 60 HB2 LEU 60 -12.810 2.054 11.701 1227 2HB LEU 60 HB3 LEU 60 -11.460 3.148 11.490 1228 HG LEU 60 HG LEU 60 -10.963 0.175 11.400 1229 1HD1 LEU 60 HD11 LEU 60 -11.262 0.245 8.946 1230 2HD1 LEU 60 HD12 LEU 60 -12.790 0.609 9.782 1231 3HD1 LEU 60 HD13 LEU 60 -11.821 1.915 9.062 1232 1HD2 LEU 60 HD21 LEU 60 -9.725 2.615 10.010 1233 2HD2 LEU 60 HD22 LEU 60 -8.994 1.751 11.386 1234 3HD2 LEU 60 HD23 LEU 60 -9.177 0.981 9.785 1235 H ASP 61 H ASP 61 -13.488 3.359 13.909 1236 HA ASP 61 HA ASP 61 -12.090 5.859 14.263 1237 1HB ASP 61 HB2 ASP 61 -14.186 6.895 14.395 1238 2HB ASP 61 HB3 ASP 61 -14.285 5.656 13.154 1239 H ARG 62 H ARG 62 -13.258 3.440 16.539 1240 HA ARG 62 HA ARG 62 -13.284 5.329 18.766 1241 1HB ARG 62 HB2 ARG 62 -13.886 3.574 20.157 1242 2HB ARG 62 HB3 ARG 62 -14.717 3.266 18.627 1243 1HG ARG 62 HG2 ARG 62 -12.795 1.662 18.070 1244 2HG ARG 62 HG3 ARG 62 -12.216 1.878 19.722 1245 1HD ARG 62 HD2 ARG 62 -14.948 0.782 18.931 1246 2HD ARG 62 HD3 ARG 62 -13.576 -0.153 19.488 1247 HE ARG 62 HE ARG 62 -13.754 0.670 21.657 1248 1HH1 ARG 62 HH12 ARG 62 -16.407 1.985 19.644 1249 2HH1 ARG 62 HH11 ARG 62 -17.307 2.530 21.023 1250 1HH2 ARG 62 HH22 ARG 62 -14.968 1.379 23.407 1251 2HH2 ARG 62 HH21 ARG 62 -16.501 2.173 23.177 1252 H ASN 63 H ASN 63 -10.825 3.696 17.059 1253 HA ASN 63 HA ASN 63 -8.886 3.296 19.049 1254 1HB ASN 63 HB2 ASN 63 -8.941 2.706 16.513 1255 2HB ASN 63 HB3 ASN 63 -8.261 4.315 16.259 1256 1HD2 ASN 63 HD22 ASN 63 -6.461 4.303 18.669 1257 2HD2 ASN 63 HD21 ASN 63 -5.216 3.150 18.186 1258 H LYS 64 H LYS 64 -10.161 6.280 17.674 1259 HA LYS 64 HA LYS 64 -8.606 7.767 19.682 1260 1HB LYS 64 HB2 LYS 64 -8.803 8.713 16.798 1261 2HB LYS 64 HB3 LYS 64 -8.115 9.638 18.141 1262 1HG LYS 64 HG2 LYS 64 -6.968 7.017 17.154 1263 2HG LYS 64 HG3 LYS 64 -6.450 8.629 16.650 1264 1HD LYS 64 HD2 LYS 64 -5.739 9.227 18.891 1265 2HD LYS 64 HD3 LYS 64 -6.380 7.719 19.553 1266 1HE LYS 64 HE2 LYS 64 -3.967 7.553 19.314 1267 2HE LYS 64 HE3 LYS 64 -4.781 6.391 18.266 1268 1HZ LYS 64 HZ1 LYS 64 -3.631 8.971 17.438 1269 2HZ LYS 64 HZ2 LYS 64 -3.006 7.476 17.134 1270 3HZ LYS 64 HZ3 LYS 64 -4.422 7.929 16.437 1271 H ASP 65 H ASP 65 -9.951 10.227 18.254 1272 HA ASP 65 HA ASP 65 -11.999 10.294 20.276 1273 1HB ASP 65 HB2 ASP 65 -12.179 12.641 19.608 1274 2HB ASP 65 HB3 ASP 65 -10.489 12.176 19.819 1275 H GLN 66 H GLN 66 -12.855 8.307 18.571 1276 HA GLN 66 HA GLN 66 -14.610 7.581 17.345 1277 1HB GLN 66 HB2 GLN 66 -15.973 10.274 17.542 1278 2HB GLN 66 HB3 GLN 66 -16.700 8.708 17.308 1279 1HG GLN 66 HG2 GLN 66 -16.844 8.248 19.501 1280 2HG GLN 66 HG3 GLN 66 -15.220 8.794 19.878 1281 1HE2 GLN 66 HE22 GLN 66 -15.207 11.484 19.166 1282 2HE2 GLN 66 HE21 GLN 66 -16.365 12.313 20.201 1283 H GLU 67 H GLU 67 -12.286 8.845 16.181 1284 HA GLU 67 HA GLU 67 -13.267 9.344 13.457 1285 1HB GLU 67 HB2 GLU 67 -11.195 11.132 14.831 1286 2HB GLU 67 HB3 GLU 67 -11.635 11.118 13.115 1287 1HG GLU 67 HG2 GLU 67 -14.005 11.719 13.805 1288 2HG GLU 67 HG3 GLU 67 -13.382 11.998 15.440 1289 H VAL 68 H VAL 68 -11.808 8.384 12.034 1290 HA VAL 68 HA VAL 68 -9.852 6.510 13.217 1291 HB VAL 68 HB VAL 68 -10.274 6.990 10.252 1292 1HG1 VAL 68 HG11 VAL 68 -9.515 4.765 10.045 1293 2HG1 VAL 68 HG12 VAL 68 -8.372 5.609 11.099 1294 3HG1 VAL 68 HG13 VAL 68 -9.551 4.495 11.810 1295 1HG2 VAL 68 HG21 VAL 68 -12.050 5.295 12.016 1296 2HG2 VAL 68 HG22 VAL 68 -12.544 6.667 11.006 1297 3HG2 VAL 68 HG23 VAL 68 -11.943 5.190 10.251 1298 H ASN 69 H ASN 69 -7.894 7.525 13.808 1299 HA ASN 69 HA ASN 69 -6.908 9.784 12.216 1300 1HB ASN 69 HB2 ASN 69 -6.302 9.890 14.522 1301 2HB ASN 69 HB3 ASN 69 -5.791 8.192 14.521 1302 1HD2 ASN 69 HD22 ASN 69 -4.906 11.187 12.560 1303 2HD2 ASN 69 HD21 ASN 69 -3.195 10.907 12.795 1304 H PHE 70 H PHE 70 -5.219 9.762 10.782 1305 HA PHE 70 HA PHE 70 -4.887 7.788 8.945 1306 1HB PHE 70 HB2 PHE 70 -4.011 10.027 8.653 1307 2HB PHE 70 HB3 PHE 70 -2.833 9.788 9.946 1308 HD1 PHE 70 HD1 PHE 70 -0.640 9.068 9.374 1309 HD2 PHE 70 HD2 PHE 70 -3.925 8.211 6.715 1310 HE1 PHE 70 HE1 PHE 70 0.896 7.873 7.856 1311 HE2 PHE 70 HE2 PHE 70 -2.379 7.023 5.191 1312 HZ PHE 70 HZ PHE 70 0.027 6.819 5.776 1313 H GLN 71 H GLN 71 -2.768 8.090 11.852 1314 HA GLN 71 HA GLN 71 -1.071 5.992 11.040 1315 1HB GLN 71 HB2 GLN 71 -0.745 7.803 12.879 1316 2HB GLN 71 HB3 GLN 71 -1.702 6.769 13.938 1317 1HG GLN 71 HG2 GLN 71 0.741 6.449 14.254 1318 2HG GLN 71 HG3 GLN 71 -0.064 4.962 13.731 1319 1HE2 GLN 71 HE22 GLN 71 1.121 7.883 11.916 1320 2HE2 GLN 71 HE21 GLN 71 2.046 6.952 10.755 1321 H GLU 72 H GLU 72 -4.005 6.023 13.007 1322 HA GLU 72 HA GLU 72 -3.858 3.228 13.752 1323 1HB GLU 72 HB2 GLU 72 -6.299 5.037 13.809 1324 2HB GLU 72 HB3 GLU 72 -6.007 3.546 14.713 1325 1HG GLU 72 HG2 GLU 72 -4.626 6.240 15.052 1326 2HG GLU 72 HG3 GLU 72 -5.646 5.393 16.215 1327 H TYR 73 H TYR 73 -5.419 5.099 11.164 1328 HA TYR 73 HA TYR 73 -6.881 2.980 9.939 1329 1HB TYR 73 HB2 TYR 73 -7.364 5.060 9.093 1330 2HB TYR 73 HB3 TYR 73 -5.707 5.582 9.035 1331 HD1 TYR 73 HD1 TYR 73 -4.283 5.178 7.137 1332 HD2 TYR 73 HD2 TYR 73 -8.346 3.739 7.237 1333 HE1 TYR 73 HE1 TYR 73 -4.294 5.054 4.676 1334 HE2 TYR 73 HE2 TYR 73 -8.384 3.704 4.756 1335 HH TYR 73 HH TYR 73 -5.685 4.948 2.808 1336 H ILE 74 H ILE 74 -3.438 4.033 9.374 1337 HA ILE 74 HA ILE 74 -2.894 1.911 7.558 1338 HB ILE 74 HB ILE 74 -0.954 3.303 9.435 1339 1HG1 ILE 74 HG12 ILE 74 -2.065 4.875 7.847 1340 2HG1 ILE 74 HG13 ILE 74 -0.335 4.725 7.641 1341 1HG2 ILE 74 HG21 ILE 74 0.702 2.505 7.585 1342 2HG2 ILE 74 HG22 ILE 74 0.138 1.332 8.777 1343 3HG2 ILE 74 HG23 ILE 74 -0.559 1.353 7.143 1344 1HD1 ILE 74 HD11 ILE 74 -0.716 3.195 5.679 1345 2HD1 ILE 74 HD12 ILE 74 -2.467 3.484 5.879 1346 3HD1 ILE 74 HD13 ILE 74 -1.372 4.809 5.458 1347 H THR 75 H THR 75 -2.183 2.014 11.122 1348 HA THR 75 HA THR 75 -1.303 -0.604 11.440 1349 HB THR 75 HB THR 75 -3.020 1.135 13.248 1350 HG1 THR 75 HG1 THR 75 -0.243 0.540 13.250 1351 1HG2 THR 75 HG21 THR 75 -2.141 -0.186 15.131 1352 2HG2 THR 75 HG22 THR 75 -3.208 -1.155 14.108 1353 3HG2 THR 75 HG23 THR 75 -1.443 -1.362 13.997 1354 H PHE 76 H PHE 76 -4.725 0.504 11.492 1355 HA PHE 76 HA PHE 76 -5.839 -2.059 11.977 1356 1HB PHE 76 HB2 PHE 76 -7.075 0.036 12.333 1357 2HB PHE 76 HB3 PHE 76 -7.072 0.337 10.596 1358 HD1 PHE 76 HD1 PHE 76 -8.541 -1.671 13.336 1359 HD2 PHE 76 HD2 PHE 76 -8.429 -1.137 9.048 1360 HE1 PHE 76 HE1 PHE 76 -10.447 -3.235 13.072 1361 HE2 PHE 76 HE2 PHE 76 -10.372 -2.608 8.813 1362 HZ PHE 76 HZ PHE 76 -11.312 -3.770 10.793 1363 H LEU 77 H LEU 77 -5.122 -0.340 8.849 1364 HA LEU 77 HA LEU 77 -6.208 -2.445 7.223 1365 1HB LEU 77 HB2 LEU 77 -4.020 -0.403 6.712 1366 2HB LEU 77 HB3 LEU 77 -4.563 -1.555 5.488 1367 HG LEU 77 HG LEU 77 -6.469 0.372 6.903 1368 1HD1 LEU 77 HD11 LEU 77 -4.856 1.701 5.670 1369 2HD1 LEU 77 HD12 LEU 77 -5.037 0.658 4.231 1370 3HD1 LEU 77 HD13 LEU 77 -6.396 1.649 4.789 1371 1HD2 LEU 77 HD21 LEU 77 -7.884 -0.081 4.889 1372 2HD2 LEU 77 HD22 LEU 77 -6.722 -1.324 4.384 1373 3HD2 LEU 77 HD23 LEU 77 -7.660 -1.513 5.891 1374 H GLY 78 H GLY 78 -3.058 -2.052 8.837 1375 1HA GLY 78 HA2 GLY 78 -1.856 -4.463 7.925 1376 2HA GLY 78 HA3 GLY 78 -1.581 -3.708 9.511 1377 H ALA 79 H ALA 79 -3.998 -3.900 10.789 1378 HA ALA 79 HA ALA 79 -4.181 -6.603 11.567 1379 1HB ALA 79 HB1 ALA 79 -6.197 -6.019 12.759 1380 2HB ALA 79 HB2 ALA 79 -5.044 -4.680 12.909 1381 3HB ALA 79 HB3 ALA 79 -6.425 -4.552 11.799 1382 H LEU 80 H LEU 80 -6.207 -4.823 9.225 1383 HA LEU 80 HA LEU 80 -8.009 -6.858 8.569 1384 1HB LEU 80 HB2 LEU 80 -7.928 -4.319 7.934 1385 2HB LEU 80 HB3 LEU 80 -6.914 -4.834 6.590 1386 HG LEU 80 HG LEU 80 -8.806 -6.390 5.903 1387 1HD1 LEU 80 HD11 LEU 80 -10.144 -6.465 7.981 1388 2HD1 LEU 80 HD12 LEU 80 -10.338 -4.697 7.932 1389 3HD1 LEU 80 HD13 LEU 80 -11.088 -5.706 6.685 1390 1HD2 LEU 80 HD21 LEU 80 -10.091 -4.500 4.884 1391 2HD2 LEU 80 HD22 LEU 80 -9.358 -3.385 6.052 1392 3HD2 LEU 80 HD23 LEU 80 -8.348 -4.183 4.819 1393 H ALA 81 H ALA 81 -4.844 -6.038 7.124 1394 HA ALA 81 HA ALA 81 -4.666 -8.080 5.161 1395 1HB ALA 81 HB1 ALA 81 -2.532 -6.617 6.722 1396 2HB ALA 81 HB2 ALA 81 -2.219 -7.731 5.383 1397 3HB ALA 81 HB3 ALA 81 -3.169 -6.247 5.126 1398 H MET 82 H MET 82 -3.597 -8.041 8.595 1399 HA MET 82 HA MET 82 -2.641 -10.708 8.694 1400 1HB MET 82 HB2 MET 82 -2.036 -9.092 10.384 1401 2HB MET 82 HB3 MET 82 -3.719 -8.871 10.869 1402 1HG MET 82 HG2 MET 82 -2.531 -10.265 12.470 1403 2HG MET 82 HG3 MET 82 -3.852 -11.143 11.708 1404 1HE MET 82 HE1 MET 82 -1.521 -14.101 12.328 1405 2HE MET 82 HE2 MET 82 -1.892 -12.733 13.406 1406 3HE MET 82 HE3 MET 82 -3.172 -13.458 12.400 1407 H ILE 83 H ILE 83 -5.904 -9.417 9.286 1408 HA ILE 83 HA ILE 83 -7.090 -11.892 10.082 1409 HB ILE 83 HB ILE 83 -8.100 -9.197 9.228 1410 1HG1 ILE 83 HG12 ILE 83 -9.608 -9.642 11.233 1411 2HG1 ILE 83 HG13 ILE 83 -8.746 -11.161 11.478 1412 1HG2 ILE 83 HG21 ILE 83 -9.522 -10.547 7.781 1413 2HG2 ILE 83 HG22 ILE 83 -9.892 -11.650 9.131 1414 3HG2 ILE 83 HG23 ILE 83 -10.448 -9.966 9.154 1415 1HD1 ILE 83 HD11 ILE 83 -7.635 -8.331 11.594 1416 2HD1 ILE 83 HD12 ILE 83 -7.874 -9.436 12.954 1417 3HD1 ILE 83 HD13 ILE 83 -6.620 -9.793 11.752 1418 H TYR 84 H TYR 84 -6.842 -10.319 6.837 1419 HA TYR 84 HA TYR 84 -8.133 -12.417 5.407 1420 1HB TYR 84 HB2 TYR 84 -5.760 -10.745 4.496 1421 2HB TYR 84 HB3 TYR 84 -6.841 -11.667 3.459 1422 HD1 TYR 84 HD1 TYR 84 -6.090 -8.671 3.323 1423 HD2 TYR 84 HD2 TYR 84 -9.505 -10.782 4.920 1424 HE1 TYR 84 HE1 TYR 84 -7.548 -6.732 2.818 1425 HE2 TYR 84 HE2 TYR 84 -10.939 -8.869 4.384 1426 HH TYR 84 HH TYR 84 -11.067 -6.782 3.417 1427 H ASN 85 H ASN 85 -4.705 -12.012 6.222 1428 HA ASN 85 HA ASN 85 -3.104 -13.394 6.752 1429 1HB ASN 85 HB2 ASN 85 -5.078 -14.404 8.171 1430 2HB ASN 85 HB3 ASN 85 -4.934 -15.773 7.075 1431 1HD2 ASN 85 HD22 ASN 85 -3.083 -13.618 9.256 1432 2HD2 ASN 85 HD21 ASN 85 -1.720 -14.728 9.515 1433 H GLU 86 H GLU 86 -5.253 -15.310 4.615 1434 HA GLU 86 HA GLU 86 -3.329 -16.897 3.280 1435 1HB GLU 86 HB2 GLU 86 -5.815 -15.526 2.157 1436 2HB GLU 86 HB3 GLU 86 -4.909 -16.840 1.390 1437 1HG GLU 86 HG2 GLU 86 -5.392 -18.300 3.367 1438 2HG GLU 86 HG3 GLU 86 -6.392 -17.010 4.060 1439 H ALA 87 H ALA 87 -4.320 -13.520 2.777 1440 HA ALA 87 HA ALA 87 -2.715 -12.820 0.587 1441 1HB ALA 87 HB1 ALA 87 -2.845 -10.534 1.485 1442 2HB ALA 87 HB2 ALA 87 -4.415 -11.348 1.620 1443 3HB ALA 87 HB3 ALA 87 -3.387 -11.158 3.060 1444 H LEU 88 H LEU 88 -1.797 -13.161 4.049 1445 HA LEU 88 HA LEU 88 0.886 -12.081 3.656 1446 1HB LEU 88 HB2 LEU 88 -0.156 -13.778 5.960 1447 2HB LEU 88 HB3 LEU 88 1.311 -12.820 5.891 1448 HG LEU 88 HG LEU 88 -1.548 -11.827 6.069 1449 1HD1 LEU 88 HD11 LEU 88 -0.542 -10.684 8.094 1450 2HD1 LEU 88 HD12 LEU 88 -0.520 -12.454 8.184 1451 3HD1 LEU 88 HD13 LEU 88 0.962 -11.550 7.793 1452 1HD2 LEU 88 HD21 LEU 88 0.944 -10.169 5.528 1453 2HD2 LEU 88 HD22 LEU 88 -0.492 -10.347 4.479 1454 3HD2 LEU 88 HD23 LEU 88 -0.642 -9.541 6.032 1455 H LYS 89 H LYS 89 -0.501 -15.333 4.240 1456 HA LYS 89 HA LYS 89 1.995 -16.683 4.072 1457 1HB LYS 89 HB2 LYS 89 -0.814 -17.720 3.528 1458 2HB LYS 89 HB3 LYS 89 0.629 -18.728 3.760 1459 1HG LYS 89 HG2 LYS 89 0.972 -17.628 6.005 1460 2HG LYS 89 HG3 LYS 89 -0.595 -16.837 5.830 1461 1HD LYS 89 HD2 LYS 89 -0.043 -19.842 5.915 1462 2HD LYS 89 HD3 LYS 89 -0.754 -18.862 7.204 1463 1HE LYS 89 HE2 LYS 89 -2.021 -19.481 4.495 1464 2HE LYS 89 HE3 LYS 89 -2.503 -20.110 6.075 1465 1HZ LYS 89 HZ1 LYS 89 -2.994 -17.837 6.736 1466 2HZ LYS 89 HZ2 LYS 89 -2.629 -17.310 5.226 1467 3HZ LYS 89 HZ3 LYS 89 -3.909 -18.325 5.447 1468 H GLY 90 H GLY 90 -0.362 -15.911 1.512 1469 1HA GLY 90 HA2 GLY 90 1.534 -15.699 -0.531 1470 2HA GLY 90 HA3 GLY 90 0.899 -17.355 -0.612 Start of MODEL 9 1 1H MET 1 H1 MET 1 -14.159 1.166 -6.809 2 2H MET 1 H2 MET 1 -13.871 0.614 -5.273 3 3H MET 1 H3 MET 1 -13.959 -0.436 -6.528 4 HA MET 1 HA MET 1 -11.986 0.295 -7.484 5 1HB MET 1 HB2 MET 1 -11.727 2.388 -5.307 6 2HB MET 1 HB3 MET 1 -10.747 2.187 -6.757 7 1HG MET 1 HG2 MET 1 -13.625 3.145 -6.566 8 2HG MET 1 HG3 MET 1 -12.205 4.072 -7.037 9 1HE MET 1 HE1 MET 1 -13.567 5.028 -9.085 10 2HE MET 1 HE2 MET 1 -14.380 4.002 -10.290 11 3HE MET 1 HE3 MET 1 -14.975 4.042 -8.613 12 H ALA 2 H ALA 2 -12.754 -1.762 -5.766 13 HA ALA 2 HA ALA 2 -11.301 -1.906 -3.373 14 1HB ALA 2 HB1 ALA 2 -12.284 -4.200 -5.136 15 2HB ALA 2 HB2 ALA 2 -11.880 -4.297 -3.409 16 3HB ALA 2 HB3 ALA 2 -13.262 -3.322 -3.945 17 H SER 3 H SER 3 -10.555 -3.328 -6.591 18 HA SER 3 HA SER 3 -8.292 -4.742 -6.051 19 1HB SER 3 HB2 SER 3 -7.890 -3.731 -8.614 20 2HB SER 3 HB3 SER 3 -8.797 -5.175 -8.155 21 HG SER 3 HG SER 3 -10.088 -3.744 -9.402 22 HA PRO 4 HA PRO 4 -5.609 -0.624 -6.853 23 1HB PRO 4 HB2 PRO 4 -7.849 1.053 -5.658 24 2HB PRO 4 HB3 PRO 4 -6.451 1.617 -6.625 25 1HG PRO 4 HG2 PRO 4 -8.809 1.161 -7.864 26 2HG PRO 4 HG3 PRO 4 -7.302 0.539 -8.596 27 1HD PRO 4 HD2 PRO 4 -9.398 -0.984 -7.080 28 2HD PRO 4 HD3 PRO 4 -8.406 -1.469 -8.473 29 H LEU 5 H LEU 5 -7.840 -0.810 -3.940 30 HA LEU 5 HA LEU 5 -5.558 -0.095 -2.267 31 1HB LEU 5 HB2 LEU 5 -7.789 0.516 -1.513 32 2HB LEU 5 HB3 LEU 5 -8.272 -1.188 -1.465 33 HG LEU 5 HG LEU 5 -6.587 -1.660 0.280 34 1HD1 LEU 5 HD11 LEU 5 -4.793 -0.045 -0.226 35 2HD1 LEU 5 HD12 LEU 5 -5.894 1.315 0.101 36 3HD1 LEU 5 HD13 LEU 5 -5.405 0.214 1.401 37 1HD2 LEU 5 HD21 LEU 5 -8.827 -0.842 0.955 38 2HD2 LEU 5 HD22 LEU 5 -7.531 -0.443 2.104 39 3HD2 LEU 5 HD23 LEU 5 -8.164 0.816 1.011 40 H ASP 6 H ASP 6 -7.389 -3.068 -3.042 41 HA ASP 6 HA ASP 6 -6.109 -4.826 -1.264 42 1HB ASP 6 HB2 ASP 6 -7.248 -5.388 -4.024 43 2HB ASP 6 HB3 ASP 6 -6.735 -6.632 -2.881 44 H GLN 7 H GLN 7 -5.081 -3.930 -4.597 45 HA GLN 7 HA GLN 7 -2.793 -5.665 -4.561 46 1HB GLN 7 HB2 GLN 7 -2.051 -4.508 -6.532 47 2HB GLN 7 HB3 GLN 7 -3.783 -4.852 -6.626 48 1HG GLN 7 HG2 GLN 7 -4.202 -2.461 -5.903 49 2HG GLN 7 HG3 GLN 7 -2.490 -2.133 -6.072 50 1HE2 GLN 7 HE22 GLN 7 -1.536 -2.463 -8.287 51 2HE2 GLN 7 HE21 GLN 7 -2.597 -2.275 -9.673 52 H ALA 8 H ALA 8 -3.305 -2.296 -3.441 53 HA ALA 8 HA ALA 8 -0.514 -1.731 -3.090 54 1HB ALA 8 HB1 ALA 8 -2.968 -0.471 -1.844 55 2HB ALA 8 HB2 ALA 8 -1.296 0.091 -1.636 56 3HB ALA 8 HB3 ALA 8 -2.013 0.047 -3.256 57 H ILE 9 H ILE 9 -3.080 -2.753 -0.711 58 HA ILE 9 HA ILE 9 -1.187 -3.115 1.430 59 HB ILE 9 HB ILE 9 -2.867 -4.476 2.553 60 1HG1 ILE 9 HG12 ILE 9 -4.539 -4.142 0.070 61 2HG1 ILE 9 HG13 ILE 9 -3.872 -5.672 0.664 62 1HG2 ILE 9 HG21 ILE 9 -4.409 -2.684 2.927 63 2HG2 ILE 9 HG22 ILE 9 -2.815 -2.009 2.632 64 3HG2 ILE 9 HG23 ILE 9 -4.040 -1.966 1.341 65 1HD1 ILE 9 HD11 ILE 9 -5.995 -3.968 2.029 66 2HD1 ILE 9 HD12 ILE 9 -6.178 -5.562 1.300 67 3HD1 ILE 9 HD13 ILE 9 -5.205 -5.381 2.773 68 H GLY 10 H GLY 10 -2.404 -5.311 -1.102 69 1HA GLY 10 HA2 GLY 10 -1.050 -7.667 -0.703 70 2HA GLY 10 HA3 GLY 10 -1.330 -6.913 -2.277 71 H LEU 11 H LEU 11 0.298 -4.692 -2.243 72 HA LEU 11 HA LEU 11 2.814 -5.713 -2.893 73 1HB LEU 11 HB2 LEU 11 1.643 -3.441 -3.466 74 2HB LEU 11 HB3 LEU 11 2.333 -2.857 -1.961 75 HG LEU 11 HG LEU 11 3.707 -2.109 -3.698 76 1HD1 LEU 11 HD11 LEU 11 5.237 -4.482 -2.628 77 2HD1 LEU 11 HD12 LEU 11 5.865 -2.929 -3.198 78 3HD1 LEU 11 HD13 LEU 11 4.917 -2.990 -1.700 79 1HD2 LEU 11 HD21 LEU 11 4.716 -3.476 -5.417 80 2HD2 LEU 11 HD22 LEU 11 3.898 -4.926 -4.794 81 3HD2 LEU 11 HD23 LEU 11 2.947 -3.575 -5.463 82 H LEU 12 H LEU 12 1.978 -3.764 0.012 83 HA LEU 12 HA LEU 12 4.439 -4.000 1.367 84 1HB LEU 12 HB2 LEU 12 1.550 -3.756 2.375 85 2HB LEU 12 HB3 LEU 12 2.928 -3.823 3.468 86 HG LEU 12 HG LEU 12 3.900 -1.820 2.440 87 1HD1 LEU 12 HD11 LEU 12 1.228 -1.621 0.981 88 2HD1 LEU 12 HD12 LEU 12 2.426 -0.323 1.084 89 3HD1 LEU 12 HD13 LEU 12 2.826 -1.799 0.209 90 1HD2 LEU 12 HD21 LEU 12 1.087 -1.591 3.578 91 2HD2 LEU 12 HD22 LEU 12 2.622 -1.628 4.476 92 3HD2 LEU 12 HD23 LEU 12 2.235 -0.245 3.462 93 H ILE 13 H ILE 13 1.600 -6.162 1.448 94 HA ILE 13 HA ILE 13 2.647 -7.911 3.457 95 HB ILE 13 HB ILE 13 0.596 -8.341 1.243 96 1HG1 ILE 13 HG12 ILE 13 0.018 -7.998 4.203 97 2HG1 ILE 13 HG13 ILE 13 0.209 -6.585 3.175 98 1HG2 ILE 13 HG21 ILE 13 -0.201 -10.238 2.693 99 2HG2 ILE 13 HG22 ILE 13 1.366 -10.536 1.940 100 3HG2 ILE 13 HG23 ILE 13 1.284 -10.067 3.652 101 1HD1 ILE 13 HD11 ILE 13 -1.566 -7.666 1.620 102 2HD1 ILE 13 HD12 ILE 13 -1.921 -8.726 2.999 103 3HD1 ILE 13 HD13 ILE 13 -2.099 -6.969 3.147 104 H GLY 14 H GLY 14 2.634 -8.155 -0.110 105 1HA GLY 14 HA2 GLY 14 3.946 -10.621 -0.399 106 2HA GLY 14 HA3 GLY 14 3.959 -9.287 -1.573 107 H ILE 15 H ILE 15 5.300 -7.255 -0.345 108 HA ILE 15 HA ILE 15 8.032 -8.012 -0.570 109 HB ILE 15 HB ILE 15 6.522 -5.597 0.406 110 1HG1 ILE 15 HG12 ILE 15 8.735 -6.138 -1.637 111 2HG1 ILE 15 HG13 ILE 15 7.004 -5.980 -1.974 112 1HG2 ILE 15 HG21 ILE 15 9.488 -5.992 0.901 113 2HG2 ILE 15 HG22 ILE 15 8.617 -4.442 1.030 114 3HG2 ILE 15 HG23 ILE 15 8.203 -5.744 2.117 115 1HD1 ILE 15 HD11 ILE 15 8.958 -3.831 -1.089 116 2HD1 ILE 15 HD12 ILE 15 8.005 -3.908 -2.573 117 3HD1 ILE 15 HD13 ILE 15 7.195 -3.598 -1.019 118 H PHE 16 H PHE 16 6.033 -7.423 2.353 119 HA PHE 16 HA PHE 16 8.021 -7.958 4.227 120 1HB PHE 16 HB2 PHE 16 5.765 -7.059 4.712 121 2HB PHE 16 HB3 PHE 16 5.046 -8.627 4.439 122 HD1 PHE 16 HD1 PHE 16 5.375 -10.487 6.060 123 HD2 PHE 16 HD2 PHE 16 7.208 -6.639 6.682 124 HE1 PHE 16 HE1 PHE 16 5.913 -11.104 8.379 125 HE2 PHE 16 HE2 PHE 16 7.543 -7.185 9.080 126 HZ PHE 16 HZ PHE 16 6.882 -9.401 9.934 127 H HIS 17 H HIS 17 5.532 -10.348 3.100 128 HA HIS 17 HA HIS 17 6.874 -12.315 4.656 129 1HB HIS 17 HB2 HIS 17 4.355 -12.181 4.064 130 2HB HIS 17 HB3 HIS 17 4.801 -13.104 2.623 131 HD1 HIS 17 HD1 HIS 17 4.266 -15.643 3.226 132 HD2 HIS 17 HD2 HIS 17 5.640 -13.324 6.462 133 HE1 HIS 17 HE1 HIS 17 4.328 -17.166 5.244 134 H LYS 18 H LYS 18 7.334 -11.346 1.312 135 HA LYS 18 HA LYS 18 8.707 -13.719 0.445 136 1HB LYS 18 HB2 LYS 18 8.077 -11.849 -1.057 137 2HB LYS 18 HB3 LYS 18 9.221 -10.793 -0.215 138 1HG LYS 18 HG2 LYS 18 11.079 -12.412 -0.927 139 2HG LYS 18 HG3 LYS 18 9.847 -13.318 -1.811 140 1HD LYS 18 HD2 LYS 18 10.954 -11.919 -3.391 141 2HD LYS 18 HD3 LYS 18 9.351 -11.209 -3.137 142 1HE LYS 18 HE2 LYS 18 10.341 -9.501 -1.623 143 2HE LYS 18 HE3 LYS 18 11.925 -10.288 -1.755 144 1HZ LYS 18 HZ1 LYS 18 11.747 -8.403 -3.175 145 2HZ LYS 18 HZ2 LYS 18 11.909 -9.768 -4.084 146 3HZ LYS 18 HZ3 LYS 18 10.437 -9.036 -3.951 147 H TYR 19 H TYR 19 9.856 -10.679 2.019 148 HA TYR 19 HA TYR 19 12.535 -11.664 2.366 149 1HB TYR 19 HB2 TYR 19 10.992 -9.300 3.399 150 2HB TYR 19 HB3 TYR 19 12.547 -9.710 4.116 151 HD1 TYR 19 HD1 TYR 19 14.629 -9.781 2.802 152 HD2 TYR 19 HD2 TYR 19 10.960 -8.266 1.140 153 HE1 TYR 19 HE1 TYR 19 15.845 -9.055 0.779 154 HE2 TYR 19 HE2 TYR 19 12.176 -7.526 -0.875 155 HH TYR 19 HH TYR 19 15.672 -8.079 -1.303 156 H SER 20 H SER 20 9.654 -11.782 4.559 157 HA SER 20 HA SER 20 11.026 -13.026 6.709 158 1HB SER 20 HB2 SER 20 8.229 -13.749 5.748 159 2HB SER 20 HB3 SER 20 8.954 -13.984 7.340 160 HG SER 20 HG SER 20 8.962 -11.831 7.690 161 H GLY 21 H GLY 21 9.325 -14.594 3.958 162 1HA GLY 21 HA2 GLY 21 9.772 -17.252 4.425 163 2HA GLY 21 HA3 GLY 21 9.701 -16.514 2.817 164 H LYS 22 H LYS 22 11.981 -14.963 2.800 165 HA LYS 22 HA LYS 22 14.038 -16.602 2.004 166 1HB LYS 22 HB2 LYS 22 13.761 -14.113 1.734 167 2HB LYS 22 HB3 LYS 22 14.417 -13.908 3.357 168 1HG LYS 22 HG2 LYS 22 16.532 -14.820 2.763 169 2HG LYS 22 HG3 LYS 22 15.958 -15.399 1.191 170 1HD LYS 22 HD2 LYS 22 15.881 -12.447 1.936 171 2HD LYS 22 HD3 LYS 22 17.341 -13.191 1.278 172 1HE LYS 22 HE2 LYS 22 16.215 -13.831 -0.767 173 2HE LYS 22 HE3 LYS 22 14.638 -13.307 -0.149 174 1HZ LYS 22 HZ1 LYS 22 15.379 -11.102 -0.114 175 2HZ LYS 22 HZ2 LYS 22 16.919 -11.509 -0.519 176 3HZ LYS 22 HZ3 LYS 22 15.693 -11.710 -1.614 177 H GLU 23 H GLU 23 13.438 -15.507 5.360 178 HA GLU 23 HA GLU 23 15.760 -17.135 6.306 179 1HB GLU 23 HB2 GLU 23 15.413 -15.978 8.470 180 2HB GLU 23 HB3 GLU 23 16.007 -14.995 7.131 181 1HG GLU 23 HG2 GLU 23 13.787 -14.001 6.803 182 2HG GLU 23 HG3 GLU 23 13.118 -15.012 8.094 183 H GLY 24 H GLY 24 12.190 -16.854 6.582 184 1HA GLY 24 HA2 GLY 24 11.944 -19.623 7.090 185 2HA GLY 24 HA3 GLY 24 11.802 -18.755 8.634 186 H ASP 25 H ASP 25 9.738 -20.282 7.261 187 HA ASP 25 HA ASP 25 7.808 -18.430 6.111 188 1HB ASP 25 HB2 ASP 25 7.883 -20.798 5.453 189 2HB ASP 25 HB3 ASP 25 7.550 -21.294 7.123 190 H LYS 26 H LYS 26 8.072 -16.874 7.946 191 HA LYS 26 HA LYS 26 6.105 -17.402 10.124 192 1HB LYS 26 HB2 LYS 26 7.684 -16.488 11.773 193 2HB LYS 26 HB3 LYS 26 8.341 -17.944 11.008 194 1HG LYS 26 HG2 LYS 26 9.675 -16.438 9.456 195 2HG LYS 26 HG3 LYS 26 9.080 -15.054 10.379 196 1HD LYS 26 HD2 LYS 26 10.186 -15.905 12.403 197 2HD LYS 26 HD3 LYS 26 10.699 -17.364 11.539 198 1HE LYS 26 HE2 LYS 26 12.525 -15.682 11.689 199 2HE LYS 26 HE3 LYS 26 12.089 -16.048 10.012 200 1HZ LYS 26 HZ1 LYS 26 10.842 -14.019 9.937 201 2HZ LYS 26 HZ2 LYS 26 11.125 -13.722 11.526 202 3HZ LYS 26 HZ3 LYS 26 12.371 -13.685 10.440 203 H HIS 27 H HIS 27 4.964 -15.506 10.758 204 HA HIS 27 HA HIS 27 5.144 -13.280 8.858 205 1HB HIS 27 HB2 HIS 27 3.342 -13.688 11.256 206 2HB HIS 27 HB3 HIS 27 3.194 -12.412 10.041 207 HD1 HIS 27 HD1 HIS 27 3.913 -15.040 7.760 208 HD2 HIS 27 HD2 HIS 27 0.716 -14.206 10.394 209 HE1 HIS 27 HE1 HIS 27 1.911 -16.331 6.917 210 H THR 28 H THR 28 7.577 -13.272 9.933 211 HA THR 28 HA THR 28 7.617 -10.757 11.426 212 HB THR 28 HB THR 28 9.275 -11.482 13.025 213 HG1 THR 28 HG1 THR 28 9.793 -13.599 13.280 214 1HG2 THR 28 HG21 THR 28 7.885 -12.714 14.580 215 2HG2 THR 28 HG22 THR 28 6.880 -11.536 13.720 216 3HG2 THR 28 HG23 THR 28 6.814 -13.258 13.278 217 H LEU 29 H LEU 29 9.653 -9.687 11.228 218 HA LEU 29 HA LEU 29 11.593 -10.833 9.237 219 1HB LEU 29 HB2 LEU 29 10.645 -7.965 9.621 220 2HB LEU 29 HB3 LEU 29 12.139 -8.374 8.777 221 HG LEU 29 HG LEU 29 9.391 -9.330 7.885 222 1HD1 LEU 29 HD11 LEU 29 9.657 -6.836 7.768 223 2HD1 LEU 29 HD12 LEU 29 11.167 -7.062 6.872 224 3HD1 LEU 29 HD13 LEU 29 9.625 -7.573 6.153 225 1HD2 LEU 29 HD21 LEU 29 11.239 -10.764 7.074 226 2HD2 LEU 29 HD22 LEU 29 10.587 -9.772 5.765 227 3HD2 LEU 29 HD23 LEU 29 12.130 -9.329 6.527 228 H SER 30 H SER 30 13.621 -11.045 10.102 229 HA SER 30 HA SER 30 14.174 -9.712 12.676 230 1HB SER 30 HB2 SER 30 14.962 -12.057 12.269 231 2HB SER 30 HB3 SER 30 16.104 -11.407 11.080 232 HG SER 30 HG SER 30 15.902 -10.564 13.819 233 H LYS 31 H LYS 31 16.404 -8.721 12.813 234 HA LYS 31 HA LYS 31 16.075 -6.177 11.714 235 1HB LYS 31 HB2 LYS 31 18.487 -5.830 12.561 236 2HB LYS 31 HB3 LYS 31 17.170 -6.164 13.681 237 1HG LYS 31 HG2 LYS 31 18.057 -8.609 13.775 238 2HG LYS 31 HG3 LYS 31 19.378 -8.046 12.742 239 1HD LYS 31 HD2 LYS 31 20.368 -7.802 14.783 240 2HD LYS 31 HD3 LYS 31 19.658 -6.193 14.633 241 1HE LYS 31 HE2 LYS 31 18.579 -8.580 16.214 242 2HE LYS 31 HE3 LYS 31 19.253 -7.080 16.869 243 1HZ LYS 31 HZ1 LYS 31 16.887 -7.019 16.963 244 2HZ LYS 31 HZ2 LYS 31 17.385 -5.914 15.857 245 3HZ LYS 31 HZ3 LYS 31 16.754 -7.352 15.361 246 H LYS 32 H LYS 32 18.681 -8.479 10.817 247 HA LYS 32 HA LYS 32 19.602 -6.647 8.760 248 1HB LYS 32 HB2 LYS 32 21.199 -7.919 9.823 249 2HB LYS 32 HB3 LYS 32 20.418 -9.475 9.463 250 1HG LYS 32 HG2 LYS 32 21.299 -7.644 7.207 251 2HG LYS 32 HG3 LYS 32 22.505 -8.597 8.080 252 1HD LYS 32 HD2 LYS 32 21.534 -10.685 7.452 253 2HD LYS 32 HD3 LYS 32 20.052 -9.940 6.861 254 1HE LYS 32 HE2 LYS 32 21.431 -10.589 4.979 255 2HE LYS 32 HE3 LYS 32 21.260 -8.831 5.034 256 1HZ LYS 32 HZ1 LYS 32 23.504 -9.510 4.590 257 2HZ LYS 32 HZ2 LYS 32 23.431 -8.713 6.030 258 3HZ LYS 32 HZ3 LYS 32 23.582 -10.355 6.003 259 H GLU 33 H GLU 33 17.291 -9.316 8.828 260 HA GLU 33 HA GLU 33 17.117 -9.627 5.979 261 1HB GLU 33 HB2 GLU 33 16.212 -11.238 7.732 262 2HB GLU 33 HB3 GLU 33 14.907 -10.075 8.038 263 1HG GLU 33 HG2 GLU 33 14.059 -11.698 6.504 264 2HG GLU 33 HG3 GLU 33 14.321 -10.237 5.561 265 H LEU 34 H LEU 34 15.349 -7.635 8.383 266 HA LEU 34 HA LEU 34 13.737 -6.191 6.570 267 1HB LEU 34 HB2 LEU 34 13.314 -6.140 8.913 268 2HB LEU 34 HB3 LEU 34 14.898 -5.494 9.295 269 HG LEU 34 HG LEU 34 13.023 -3.910 9.499 270 1HD1 LEU 34 HD11 LEU 34 14.960 -2.838 7.431 271 2HD1 LEU 34 HD12 LEU 34 14.205 -2.008 8.785 272 3HD1 LEU 34 HD13 LEU 34 15.454 -3.222 9.087 273 1HD2 LEU 34 HD21 LEU 34 12.899 -4.018 6.451 274 2HD2 LEU 34 HD22 LEU 34 11.664 -4.607 7.579 275 3HD2 LEU 34 HD23 LEU 34 12.032 -2.877 7.466 276 H LYS 35 H LYS 35 17.094 -5.462 7.798 277 HA LYS 35 HA LYS 35 17.427 -3.165 6.216 278 1HB LYS 35 HB2 LYS 35 19.093 -3.828 7.871 279 2HB LYS 35 HB3 LYS 35 19.593 -5.202 6.859 280 1HG LYS 35 HG2 LYS 35 20.222 -3.686 5.031 281 2HG LYS 35 HG3 LYS 35 19.681 -2.279 5.955 282 1HD LYS 35 HD2 LYS 35 21.928 -4.180 6.775 283 2HD LYS 35 HD3 LYS 35 22.150 -2.684 5.851 284 1HE LYS 35 HE2 LYS 35 21.075 -1.397 7.740 285 2HE LYS 35 HE3 LYS 35 21.077 -2.888 8.693 286 1HZ LYS 35 HZ1 LYS 35 23.423 -1.533 7.550 287 2HZ LYS 35 HZ2 LYS 35 23.043 -1.646 9.145 288 3HZ LYS 35 HZ3 LYS 35 23.483 -2.995 8.315 289 H GLU 36 H GLU 36 17.961 -6.599 5.242 290 HA GLU 36 HA GLU 36 18.836 -6.063 2.627 291 1HB GLU 36 HB2 GLU 36 18.716 -8.301 3.953 292 2HB GLU 36 HB3 GLU 36 17.084 -8.452 3.291 293 1HG GLU 36 HG2 GLU 36 18.080 -8.160 0.978 294 2HG GLU 36 HG3 GLU 36 19.685 -8.147 1.719 295 H LEU 37 H LEU 37 15.507 -6.467 3.878 296 HA LEU 37 HA LEU 37 14.067 -6.173 1.454 297 1HB LEU 37 HB2 LEU 37 13.060 -6.870 3.555 298 2HB LEU 37 HB3 LEU 37 13.378 -5.332 4.314 299 HG LEU 37 HG LEU 37 11.527 -5.530 1.940 300 1HD1 LEU 37 HD11 LEU 37 10.710 -7.041 3.698 301 2HD1 LEU 37 HD12 LEU 37 10.967 -5.778 4.929 302 3HD1 LEU 37 HD13 LEU 37 9.714 -5.581 3.706 303 1HD2 LEU 37 HD21 LEU 37 11.834 -3.494 4.220 304 2HD2 LEU 37 HD22 LEU 37 12.132 -3.185 2.492 305 3HD2 LEU 37 HD23 LEU 37 10.502 -3.511 3.057 306 H ILE 38 H ILE 38 15.140 -3.667 3.758 307 HA ILE 38 HA ILE 38 14.145 -1.502 2.172 308 HB ILE 38 HB ILE 38 16.266 -1.640 4.344 309 1HG1 ILE 38 HG12 ILE 38 13.303 -0.866 4.226 310 2HG1 ILE 38 HG13 ILE 38 13.992 -2.287 5.014 311 1HG2 ILE 38 HG21 ILE 38 16.607 0.405 2.873 312 2HG2 ILE 38 HG22 ILE 38 14.940 0.881 3.271 313 3HG2 ILE 38 HG23 ILE 38 16.172 0.752 4.533 314 1HD1 ILE 38 HD11 ILE 38 14.297 0.601 5.832 315 2HD1 ILE 38 HD12 ILE 38 13.498 -0.739 6.694 316 3HD1 ILE 38 HD13 ILE 38 15.273 -0.720 6.528 317 H GLN 39 H GLN 39 17.459 -2.865 2.398 318 HA GLN 39 HA GLN 39 18.685 -1.112 0.563 319 1HB GLN 39 HB2 GLN 39 19.228 -4.043 1.197 320 2HB GLN 39 HB3 GLN 39 20.310 -3.045 0.222 321 1HG GLN 39 HG2 GLN 39 19.554 -2.287 3.082 322 2HG GLN 39 HG3 GLN 39 20.923 -3.326 2.670 323 1HE2 GLN 39 HE22 GLN 39 19.572 -0.028 2.250 324 2HE2 GLN 39 HE21 GLN 39 21.132 0.706 1.923 325 H LYS 40 H LYS 40 16.776 -4.105 -0.095 326 HA LYS 40 HA LYS 40 17.282 -3.816 -2.941 327 1HB LYS 40 HB2 LYS 40 16.657 -5.986 -1.734 328 2HB LYS 40 HB3 LYS 40 15.036 -5.321 -1.551 329 1HG LYS 40 HG2 LYS 40 14.648 -6.446 -3.475 330 2HG LYS 40 HG3 LYS 40 15.298 -5.007 -4.249 331 1HD LYS 40 HD2 LYS 40 16.799 -7.591 -3.594 332 2HD LYS 40 HD3 LYS 40 16.250 -7.058 -5.187 333 1HE LYS 40 HE2 LYS 40 17.774 -5.060 -5.004 334 2HE LYS 40 HE3 LYS 40 18.404 -5.729 -3.480 335 1HZ LYS 40 HZ1 LYS 40 19.099 -7.660 -4.677 336 2HZ LYS 40 HZ2 LYS 40 18.526 -7.043 -6.094 337 3HZ LYS 40 HZ3 LYS 40 19.773 -6.301 -5.317 338 H GLU 41 H GLU 41 14.377 -3.194 -0.940 339 HA GLU 41 HA GLU 41 12.920 -2.237 -3.211 340 1HB GLU 41 HB2 GLU 41 11.802 -3.286 -1.351 341 2HB GLU 41 HB3 GLU 41 12.412 -2.086 -0.211 342 1HG GLU 41 HG2 GLU 41 10.041 -1.731 -0.794 343 2HG GLU 41 HG3 GLU 41 11.033 -0.338 -1.204 344 H LEU 42 H LEU 42 14.352 -0.524 -0.436 345 HA LEU 42 HA LEU 42 13.915 2.133 -1.758 346 1HB LEU 42 HB2 LEU 42 14.742 1.487 1.101 347 2HB LEU 42 HB3 LEU 42 14.588 3.084 0.384 348 HG LEU 42 HG LEU 42 12.702 2.916 1.652 349 1HD1 LEU 42 HD11 LEU 42 10.788 2.886 0.187 350 2HD1 LEU 42 HD12 LEU 42 12.159 3.598 -0.682 351 3HD1 LEU 42 HD13 LEU 42 11.656 1.922 -1.017 352 1HD2 LEU 42 HD21 LEU 42 12.812 0.591 2.308 353 2HD2 LEU 42 HD22 LEU 42 11.172 1.016 1.805 354 3HD2 LEU 42 HD23 LEU 42 12.209 0.068 0.729 355 H THR 43 H THR 43 15.500 1.249 -3.336 356 HA THR 43 HA THR 43 18.044 0.434 -2.638 357 HB THR 43 HB THR 43 17.443 1.710 -5.307 358 HG1 THR 43 HG1 THR 43 16.209 -0.669 -4.380 359 1HG2 THR 43 HG21 THR 43 18.475 -0.356 -6.143 360 2HG2 THR 43 HG22 THR 43 19.555 0.431 -4.973 361 3HG2 THR 43 HG23 THR 43 18.606 -0.995 -4.491 362 H ILE 44 H ILE 44 18.448 2.208 -0.996 363 HA ILE 44 HA ILE 44 19.167 4.827 -1.838 364 HB ILE 44 HB ILE 44 20.282 4.970 0.415 365 1HG1 ILE 44 HG12 ILE 44 18.891 2.346 1.067 366 2HG1 ILE 44 HG13 ILE 44 20.586 2.367 0.570 367 1HG2 ILE 44 HG21 ILE 44 18.111 5.079 1.575 368 2HG2 ILE 44 HG22 ILE 44 18.002 5.738 -0.057 369 3HG2 ILE 44 HG23 ILE 44 17.361 4.120 0.285 370 1HD1 ILE 44 HD11 ILE 44 20.388 2.409 3.020 371 2HD1 ILE 44 HD12 ILE 44 21.157 3.884 2.412 372 3HD1 ILE 44 HD13 ILE 44 19.455 3.906 2.942 373 H GLY 45 H GLY 45 20.418 4.303 -3.719 374 1HA GLY 45 HA2 GLY 45 23.076 3.474 -3.834 375 2HA GLY 45 HA3 GLY 45 22.435 4.869 -4.725 376 H SER 46 H SER 46 21.737 6.397 -2.281 377 HA SER 46 HA SER 46 24.207 7.650 -1.488 378 1HB SER 46 HB2 SER 46 22.355 8.681 0.106 379 2HB SER 46 HB3 SER 46 22.319 9.037 -1.626 380 HG SER 46 HG SER 46 20.323 8.139 -0.438 381 H LYS 47 H LYS 47 24.960 5.310 -0.964 382 HA LYS 47 HA LYS 47 24.039 3.626 0.904 383 1HB LYS 47 HB2 LYS 47 26.924 4.373 0.325 384 2HB LYS 47 HB3 LYS 47 26.482 2.941 1.253 385 1HG LYS 47 HG2 LYS 47 25.059 3.180 -1.373 386 2HG LYS 47 HG3 LYS 47 26.813 3.037 -1.486 387 1HD LYS 47 HD2 LYS 47 25.805 0.852 -1.611 388 2HD LYS 47 HD3 LYS 47 26.750 0.975 -0.118 389 1HE LYS 47 HE2 LYS 47 24.671 1.323 1.185 390 2HE LYS 47 HE3 LYS 47 23.715 1.326 -0.312 391 1HZ LYS 47 HZ1 LYS 47 24.392 -0.926 -0.674 392 2HZ LYS 47 HZ2 LYS 47 25.314 -0.922 0.694 393 3HZ LYS 47 HZ3 LYS 47 23.677 -0.784 0.805 394 H LEU 48 H LEU 48 25.763 6.576 1.726 395 HA LEU 48 HA LEU 48 26.421 6.140 4.419 396 1HB LEU 48 HB2 LEU 48 25.386 8.658 3.037 397 2HB LEU 48 HB3 LEU 48 26.036 8.624 4.671 398 HG LEU 48 HG LEU 48 27.673 9.485 3.195 399 1HD1 LEU 48 HD11 LEU 48 29.582 8.125 3.747 400 2HD1 LEU 48 HD12 LEU 48 28.433 8.064 5.096 401 3HD1 LEU 48 HD13 LEU 48 28.577 6.687 3.980 402 1HD2 LEU 48 HD21 LEU 48 27.803 6.890 1.624 403 2HD2 LEU 48 HD22 LEU 48 26.928 8.347 1.080 404 3HD2 LEU 48 HD23 LEU 48 28.679 8.396 1.344 405 H GLN 49 H GLN 49 23.263 6.815 2.984 406 HA GLN 49 HA GLN 49 21.887 7.453 5.401 407 1HB GLN 49 HB2 GLN 49 20.842 6.273 2.797 408 2HB GLN 49 HB3 GLN 49 19.842 6.849 4.140 409 1HG GLN 49 HG2 GLN 49 21.007 9.104 3.940 410 2HG GLN 49 HG3 GLN 49 21.774 8.507 2.466 411 1HE2 GLN 49 HE22 GLN 49 18.569 8.980 4.025 412 2HE2 GLN 49 HE21 GLN 49 17.707 9.299 2.520 413 H ASP 50 H ASP 50 23.206 4.396 4.403 414 HA ASP 50 HA ASP 50 21.573 2.547 5.667 415 1HB ASP 50 HB2 ASP 50 23.627 1.952 4.483 416 2HB ASP 50 HB3 ASP 50 24.604 2.709 5.755 417 H ALA 51 H ALA 51 23.710 5.006 7.159 418 HA ALA 51 HA ALA 51 23.562 4.123 9.870 419 1HB ALA 51 HB1 ALA 51 25.083 5.893 9.082 420 2HB ALA 51 HB2 ALA 51 23.699 6.952 8.734 421 3HB ALA 51 HB3 ALA 51 24.059 6.479 10.409 422 H GLU 52 H GLU 52 21.300 6.094 7.907 423 HA GLU 52 HA GLU 52 19.467 6.651 10.100 424 1HB GLU 52 HB2 GLU 52 18.918 6.649 7.098 425 2HB GLU 52 HB3 GLU 52 17.944 7.382 8.371 426 1HG GLU 52 HG2 GLU 52 19.814 8.933 8.915 427 2HG GLU 52 HG3 GLU 52 20.780 8.237 7.603 428 H ILE 53 H ILE 53 19.756 4.281 7.424 429 HA ILE 53 HA ILE 53 17.371 2.888 7.949 430 HB ILE 53 HB ILE 53 19.915 1.681 6.838 431 1HG1 ILE 53 HG12 ILE 53 19.363 3.455 5.354 432 2HG1 ILE 53 HG13 ILE 53 18.676 2.009 4.633 433 1HG2 ILE 53 HG21 ILE 53 18.347 0.057 5.778 434 2HG2 ILE 53 HG22 ILE 53 18.446 -0.081 7.532 435 3HG2 ILE 53 HG23 ILE 53 17.051 0.722 6.794 436 1HD1 ILE 53 HD11 ILE 53 17.213 4.257 6.071 437 2HD1 ILE 53 HD12 ILE 53 17.083 3.765 4.379 438 3HD1 ILE 53 HD13 ILE 53 16.426 2.720 5.653 439 H VAL 54 H VAL 54 20.606 2.335 9.519 440 HA VAL 54 HA VAL 54 19.533 0.126 10.977 441 HB VAL 54 HB VAL 54 21.434 0.397 12.567 442 1HG1 VAL 54 HG11 VAL 54 22.983 -0.543 10.910 443 2HG1 VAL 54 HG12 VAL 54 21.351 -1.190 10.679 444 3HG1 VAL 54 HG13 VAL 54 21.956 0.086 9.597 445 1HG2 VAL 54 HG21 VAL 54 21.932 2.784 12.237 446 2HG2 VAL 54 HG22 VAL 54 23.324 1.728 11.942 447 3HG2 VAL 54 HG23 VAL 54 22.439 2.406 10.571 448 H LYS 55 H LYS 55 19.566 3.612 11.806 449 HA LYS 55 HA LYS 55 18.484 3.244 14.436 450 1HB LYS 55 HB2 LYS 55 19.406 5.386 13.723 451 2HB LYS 55 HB3 LYS 55 18.201 5.535 12.450 452 1HG LYS 55 HG2 LYS 55 17.664 6.961 14.374 453 2HG LYS 55 HG3 LYS 55 16.397 5.796 14.035 454 1HD LYS 55 HD2 LYS 55 16.771 6.037 16.445 455 2HD LYS 55 HD3 LYS 55 17.060 4.390 15.920 456 1HE LYS 55 HE2 LYS 55 18.754 5.140 17.547 457 2HE LYS 55 HE3 LYS 55 19.515 4.762 15.999 458 1HZ LYS 55 HZ1 LYS 55 19.540 7.098 15.509 459 2HZ LYS 55 HZ2 LYS 55 18.808 7.453 16.943 460 3HZ LYS 55 HZ3 LYS 55 20.322 6.801 16.928 461 H LEU 56 H LEU 56 16.919 3.818 11.283 462 HA LEU 56 HA LEU 56 14.216 3.556 12.051 463 1HB LEU 56 HB2 LEU 56 14.715 4.459 9.993 464 2HB LEU 56 HB3 LEU 56 15.798 3.162 9.520 465 HG LEU 56 HG LEU 56 12.936 2.381 9.921 466 1HD1 LEU 56 HD11 LEU 56 12.722 4.521 8.695 467 2HD1 LEU 56 HD12 LEU 56 13.970 4.005 7.544 468 3HD1 LEU 56 HD13 LEU 56 12.411 3.163 7.597 469 1HD2 LEU 56 HD21 LEU 56 15.015 1.757 7.768 470 2HD2 LEU 56 HD22 LEU 56 14.735 0.737 9.176 471 3HD2 LEU 56 HD23 LEU 56 13.426 0.988 8.019 472 H MET 57 H MET 57 16.556 1.023 11.121 473 HA MET 57 HA MET 57 14.765 -1.177 11.213 474 1HB MET 57 HB2 MET 57 16.810 -1.374 10.036 475 2HB MET 57 HB3 MET 57 17.757 -0.910 11.447 476 1HG MET 57 HG2 MET 57 16.092 -3.416 11.498 477 2HG MET 57 HG3 MET 57 17.698 -3.404 10.768 478 1HE MET 57 HE1 MET 57 19.503 -1.538 12.711 479 2HE MET 57 HE2 MET 57 20.091 -2.827 13.772 480 3HE MET 57 HE3 MET 57 19.952 -3.122 12.022 481 H ASP 58 H ASP 58 16.904 0.286 13.726 482 HA ASP 58 HA ASP 58 16.148 -1.485 15.820 483 1HB ASP 58 HB2 ASP 58 18.012 0.076 16.038 484 2HB ASP 58 HB3 ASP 58 16.906 1.457 15.998 485 H ASP 59 H ASP 59 14.698 1.612 14.724 486 HA ASP 59 HA ASP 59 12.602 1.653 16.627 487 1HB ASP 59 HB2 ASP 59 12.521 2.787 13.796 488 2HB ASP 59 HB3 ASP 59 11.473 3.242 15.142 489 H LEU 60 H LEU 60 12.718 0.045 13.455 490 HA LEU 60 HA LEU 60 10.028 -1.013 13.550 491 1HB LEU 60 HB2 LEU 60 12.564 -1.658 12.056 492 2HB LEU 60 HB3 LEU 60 11.237 -2.812 12.005 493 HG LEU 60 HG LEU 60 10.657 0.084 11.403 494 1HD1 LEU 60 HD11 LEU 60 12.621 -0.376 10.007 495 2HD1 LEU 60 HD12 LEU 60 11.844 -1.857 9.403 496 3HD1 LEU 60 HD13 LEU 60 11.157 -0.279 9.004 497 1HD2 LEU 60 HD21 LEU 60 9.627 -2.578 10.274 498 2HD2 LEU 60 HD22 LEU 60 8.770 -1.543 11.444 499 3HD2 LEU 60 HD23 LEU 60 9.054 -0.991 9.774 500 H ASP 61 H ASP 61 13.184 -2.611 14.295 501 HA ASP 61 HA ASP 61 11.959 -4.979 15.205 502 1HB ASP 61 HB2 ASP 61 14.019 -5.837 15.748 503 2HB ASP 61 HB3 ASP 61 14.265 -4.831 14.323 504 H ARG 62 H ARG 62 12.623 -2.067 16.960 505 HA ARG 62 HA ARG 62 12.438 -2.318 19.568 506 1HB ARG 62 HB2 ARG 62 11.912 -0.284 18.230 507 2HB ARG 62 HB3 ARG 62 10.394 -1.035 17.756 508 1HG ARG 62 HG2 ARG 62 10.040 -0.989 20.480 509 2HG ARG 62 HG3 ARG 62 11.127 0.385 20.256 510 1HD ARG 62 HD2 ARG 62 8.951 1.279 20.023 511 2HD ARG 62 HD3 ARG 62 9.518 1.151 18.363 512 HE ARG 62 HE ARG 62 7.533 -0.547 19.810 513 1HH1 ARG 62 HH22 ARG 62 9.075 0.051 16.604 514 2HH1 ARG 62 HH21 ARG 62 7.739 -0.655 15.761 515 1HH2 ARG 62 HH12 ARG 62 5.861 -1.440 18.643 516 2HH2 ARG 62 HH11 ARG 62 5.887 -1.489 16.908 517 H ASN 63 H ASN 63 9.682 -3.091 17.454 518 HA ASN 63 HA ASN 63 7.679 -3.885 19.110 519 1HB ASN 63 HB2 ASN 63 7.455 -3.871 16.721 520 2HB ASN 63 HB3 ASN 63 8.706 -5.102 16.542 521 1HD2 ASN 63 HD22 ASN 63 6.450 -5.866 19.171 522 2HD2 ASN 63 HD21 ASN 63 5.458 -6.928 18.196 523 H LYS 64 H LYS 64 10.377 -6.023 18.138 524 HA LYS 64 HA LYS 64 9.950 -7.678 20.519 525 1HB LYS 64 HB2 LYS 64 8.384 -8.379 18.453 526 2HB LYS 64 HB3 LYS 64 9.830 -9.222 17.922 527 1HG LYS 64 HG2 LYS 64 8.385 -9.519 20.602 528 2HG LYS 64 HG3 LYS 64 8.283 -10.621 19.223 529 1HD LYS 64 HD2 LYS 64 10.744 -11.103 19.456 530 2HD LYS 64 HD3 LYS 64 10.786 -10.053 20.881 531 1HE LYS 64 HE2 LYS 64 10.645 -12.339 21.620 532 2HE LYS 64 HE3 LYS 64 9.137 -11.509 22.029 533 1HZ LYS 64 HZ1 LYS 64 8.778 -13.684 21.102 534 2HZ LYS 64 HZ2 LYS 64 8.134 -12.534 20.116 535 3HZ LYS 64 HZ3 LYS 64 9.552 -13.269 19.708 536 H ASP 65 H ASP 65 11.967 -6.024 19.932 537 HA ASP 65 HA ASP 65 14.187 -5.823 19.909 538 1HB ASP 65 HB2 ASP 65 15.424 -7.566 21.257 539 2HB ASP 65 HB3 ASP 65 14.054 -6.760 22.019 540 H GLN 66 H GLN 66 14.158 -9.286 19.232 541 HA GLN 66 HA GLN 66 16.383 -9.166 17.358 542 1HB GLN 66 HB2 GLN 66 14.379 -11.292 18.174 543 2HB GLN 66 HB3 GLN 66 15.667 -11.591 16.997 544 1HG GLN 66 HG2 GLN 66 17.386 -11.348 18.566 545 2HG GLN 66 HG3 GLN 66 16.397 -10.441 19.709 546 1HE2 GLN 66 HE22 GLN 66 14.660 -11.568 20.871 547 2HE2 GLN 66 HE21 GLN 66 14.851 -13.294 21.187 548 H GLU 67 H GLU 67 12.825 -9.024 17.146 549 HA GLU 67 HA GLU 67 13.021 -8.763 14.202 550 1HB GLU 67 HB2 GLU 67 11.028 -10.622 15.583 551 2HB GLU 67 HB3 GLU 67 11.274 -10.402 13.847 552 1HG GLU 67 HG2 GLU 67 13.666 -11.312 14.249 553 2HG GLU 67 HG3 GLU 67 13.068 -11.840 15.828 554 H VAL 68 H VAL 68 11.052 -8.150 13.172 555 HA VAL 68 HA VAL 68 9.134 -6.632 14.874 556 HB VAL 68 HB VAL 68 10.513 -5.090 13.529 557 1HG1 VAL 68 HG11 VAL 68 9.367 -6.450 11.063 558 2HG1 VAL 68 HG12 VAL 68 10.350 -4.981 11.103 559 3HG1 VAL 68 HG13 VAL 68 11.064 -6.518 11.599 560 1HG2 VAL 68 HG21 VAL 68 8.152 -4.553 14.070 561 2HG2 VAL 68 HG22 VAL 68 8.706 -3.806 12.565 562 3HG2 VAL 68 HG23 VAL 68 7.657 -5.230 12.503 563 H ASN 69 H ASN 69 6.980 -7.103 14.481 564 HA ASN 69 HA ASN 69 6.414 -9.406 12.711 565 1HB ASN 69 HB2 ASN 69 5.488 -9.720 14.908 566 2HB ASN 69 HB3 ASN 69 4.916 -8.049 14.980 567 1HD2 ASN 69 HD21 ASN 69 4.360 -11.051 12.932 568 2HD2 ASN 69 HD22 ASN 69 2.643 -10.728 12.830 569 H PHE 70 H PHE 70 4.721 -9.349 11.267 570 HA PHE 70 HA PHE 70 4.518 -7.419 9.388 571 1HB PHE 70 HB2 PHE 70 3.609 -9.652 9.146 572 2HB PHE 70 HB3 PHE 70 2.408 -9.354 10.400 573 HD1 PHE 70 HD1 PHE 70 3.571 -8.078 7.070 574 HD2 PHE 70 HD2 PHE 70 0.298 -8.417 9.859 575 HE1 PHE 70 HE1 PHE 70 2.094 -6.864 5.492 576 HE2 PHE 70 HE2 PHE 70 -1.152 -7.202 8.308 577 HZ PHE 70 HZ PHE 70 -0.274 -6.415 6.105 578 H GLN 71 H GLN 71 2.239 -7.546 12.240 579 HA GLN 71 HA GLN 71 0.642 -5.405 11.266 580 1HB GLN 71 HB2 GLN 71 0.018 -7.000 13.104 581 2HB GLN 71 HB3 GLN 71 1.162 -6.166 14.172 582 1HG GLN 71 HG2 GLN 71 -0.148 -4.019 13.769 583 2HG GLN 71 HG3 GLN 71 -1.296 -4.965 12.809 584 1HE2 GLN 71 HE22 GLN 71 0.162 -4.623 16.080 585 2HE2 GLN 71 HE21 GLN 71 -1.215 -5.326 16.923 586 H GLU 72 H GLU 72 3.537 -5.455 13.348 587 HA GLU 72 HA GLU 72 3.379 -2.589 13.879 588 1HB GLU 72 HB2 GLU 72 5.622 -4.558 14.457 589 2HB GLU 72 HB3 GLU 72 5.467 -2.908 15.085 590 1HG GLU 72 HG2 GLU 72 3.645 -5.289 15.683 591 2HG GLU 72 HG3 GLU 72 4.671 -4.405 16.815 592 H TYR 73 H TYR 73 5.044 -4.698 11.586 593 HA TYR 73 HA TYR 73 6.680 -2.707 10.346 594 1HB TYR 73 HB2 TYR 73 7.145 -4.830 9.644 595 2HB TYR 73 HB3 TYR 73 5.477 -5.325 9.547 596 HD1 TYR 73 HD1 TYR 73 4.128 -5.052 7.542 597 HD2 TYR 73 HD2 TYR 73 8.192 -3.596 7.741 598 HE1 TYR 73 HE1 TYR 73 4.237 -5.024 5.089 599 HE2 TYR 73 HE2 TYR 73 8.326 -3.679 5.263 600 HH TYR 73 HH TYR 73 5.713 -5.032 3.267 601 H ILE 74 H ILE 74 3.234 -3.663 9.695 602 HA ILE 74 HA ILE 74 2.806 -1.641 7.742 603 HB ILE 74 HB ILE 74 0.798 -2.896 9.643 604 1HG1 ILE 74 HG12 ILE 74 1.960 -4.493 8.054 605 2HG1 ILE 74 HG13 ILE 74 0.217 -4.413 7.968 606 1HG2 ILE 74 HG21 ILE 74 -0.837 -2.131 7.793 607 2HG2 ILE 74 HG22 ILE 74 -0.224 -0.913 8.911 608 3HG2 ILE 74 HG23 ILE 74 0.447 -1.040 7.270 609 1HD1 ILE 74 HD11 ILE 74 0.363 -3.007 5.916 610 2HD1 ILE 74 HD12 ILE 74 2.145 -3.103 6.033 611 3HD1 ILE 74 HD13 ILE 74 1.178 -4.548 5.725 612 H THR 75 H THR 75 2.034 -1.494 11.306 613 HA THR 75 HA THR 75 1.234 1.168 11.420 614 HB THR 75 HB THR 75 2.947 -0.381 13.412 615 HG1 THR 75 HG1 THR 75 0.154 0.058 13.261 616 1HG2 THR 75 HG21 THR 75 1.891 1.104 15.116 617 2HG2 THR 75 HG22 THR 75 3.007 1.972 14.053 618 3HG2 THR 75 HG23 THR 75 1.256 2.125 13.811 619 H PHE 76 H PHE 76 4.604 -0.069 11.579 620 HA PHE 76 HA PHE 76 5.825 2.470 11.910 621 1HB PHE 76 HB2 PHE 76 6.956 0.326 12.368 622 2HB PHE 76 HB3 PHE 76 6.950 -0.046 10.645 623 HD1 PHE 76 HD1 PHE 76 8.373 2.160 13.281 624 HD2 PHE 76 HD2 PHE 76 8.418 1.188 9.074 625 HE1 PHE 76 HE1 PHE 76 10.270 3.715 12.929 626 HE2 PHE 76 HE2 PHE 76 10.408 2.600 8.770 627 HZ PHE 76 HZ PHE 76 11.264 3.976 10.664 628 H LEU 77 H LEU 77 5.085 0.576 8.899 629 HA LEU 77 HA LEU 77 6.148 2.573 7.136 630 1HB LEU 77 HB2 LEU 77 4.005 0.456 6.765 631 2HB LEU 77 HB3 LEU 77 4.508 1.542 5.467 632 HG LEU 77 HG LEU 77 6.450 -0.281 6.964 633 1HD1 LEU 77 HD11 LEU 77 4.852 -1.661 5.753 634 2HD1 LEU 77 HD12 LEU 77 5.045 -0.663 4.286 635 3HD1 LEU 77 HD13 LEU 77 6.401 -1.630 4.883 636 1HD2 LEU 77 HD21 LEU 77 7.622 1.589 5.888 637 2HD2 LEU 77 HD22 LEU 77 7.869 0.129 4.935 638 3HD2 LEU 77 HD23 LEU 77 6.688 1.339 4.386 639 H GLY 78 H GLY 78 3.007 2.315 8.794 640 1HA GLY 78 HA2 GLY 78 1.776 4.599 7.622 641 2HA GLY 78 HA3 GLY 78 1.496 3.997 9.271 642 H ALA 79 H ALA 79 3.856 4.353 10.557 643 HA ALA 79 HA ALA 79 4.023 7.129 11.090 644 1HB ALA 79 HB1 ALA 79 6.231 5.073 11.540 645 2HB ALA 79 HB2 ALA 79 6.028 6.634 12.351 646 3HB ALA 79 HB3 ALA 79 4.845 5.339 12.618 647 H LEU 80 H LEU 80 6.065 5.091 8.964 648 HA LEU 80 HA LEU 80 7.829 7.114 8.140 649 1HB LEU 80 HB2 LEU 80 7.859 4.489 7.793 650 2HB LEU 80 HB3 LEU 80 6.990 4.868 6.304 651 HG LEU 80 HG LEU 80 8.949 6.586 5.895 652 1HD1 LEU 80 HD11 LEU 80 11.091 5.884 6.907 653 2HD1 LEU 80 HD12 LEU 80 9.961 6.426 8.160 654 3HD1 LEU 80 HD13 LEU 80 10.236 4.693 7.905 655 1HD2 LEU 80 HD21 LEU 80 9.434 3.560 5.841 656 2HD2 LEU 80 HD22 LEU 80 8.591 4.490 4.578 657 3HD2 LEU 80 HD23 LEU 80 10.318 4.760 4.874 658 H ALA 81 H ALA 81 4.704 6.052 6.769 659 HA ALA 81 HA ALA 81 4.632 7.817 4.542 660 1HB ALA 81 HB1 ALA 81 2.426 6.546 6.200 661 2HB ALA 81 HB2 ALA 81 2.153 7.502 4.739 662 3HB ALA 81 HB3 ALA 81 3.092 5.987 4.662 663 H MET 82 H MET 82 3.681 8.294 7.981 664 HA MET 82 HA MET 82 2.805 10.997 7.569 665 1HB MET 82 HB2 MET 82 2.257 9.686 9.563 666 2HB MET 82 HB3 MET 82 3.934 9.753 10.114 667 1HG MET 82 HG2 MET 82 2.312 12.253 9.552 668 2HG MET 82 HG3 MET 82 2.285 11.424 11.112 669 1HE MET 82 HE1 MET 82 2.861 13.766 12.217 670 2HE MET 82 HE2 MET 82 4.316 14.705 11.802 671 3HE MET 82 HE3 MET 82 3.008 14.523 10.609 672 H ILE 83 H ILE 83 5.991 9.629 8.466 673 HA ILE 83 HA ILE 83 7.437 12.030 8.707 674 HB ILE 83 HB ILE 83 8.320 9.287 7.766 675 1HG1 ILE 83 HG12 ILE 83 7.465 9.645 10.175 676 2HG1 ILE 83 HG13 ILE 83 9.008 8.826 9.930 677 1HG2 ILE 83 HG21 ILE 83 10.079 11.678 8.327 678 2HG2 ILE 83 HG22 ILE 83 10.647 9.992 8.294 679 3HG2 ILE 83 HG23 ILE 83 9.969 10.720 6.840 680 1HD1 ILE 83 HD11 ILE 83 8.725 11.776 10.627 681 2HD1 ILE 83 HD12 ILE 83 9.030 10.464 11.785 682 3HD1 ILE 83 HD13 ILE 83 10.234 10.829 10.542 683 H TYR 84 H TYR 84 6.724 10.161 5.727 684 HA TYR 84 HA TYR 84 8.213 11.670 3.884 685 1HB TYR 84 HB2 TYR 84 5.468 10.393 3.595 686 2HB TYR 84 HB3 TYR 84 6.298 11.208 2.285 687 HD1 TYR 84 HD1 TYR 84 8.605 9.294 4.410 688 HD2 TYR 84 HD2 TYR 84 5.877 9.097 1.066 689 HE1 TYR 84 HE1 TYR 84 9.730 7.259 3.600 690 HE2 TYR 84 HE2 TYR 84 7.060 7.104 0.226 691 HH TYR 84 HH TYR 84 8.795 5.601 0.572 692 H ASN 85 H ASN 85 5.180 12.545 5.481 693 HA ASN 85 HA ASN 85 4.073 14.422 5.788 694 1HB ASN 85 HB2 ASN 85 6.213 15.259 6.532 695 2HB ASN 85 HB3 ASN 85 6.661 15.760 4.898 696 1HD2 ASN 85 HD22 ASN 85 6.080 17.843 4.237 697 2HD2 ASN 85 HD21 ASN 85 4.979 18.851 5.150 698 H GLU 86 H GLU 86 5.893 15.092 2.821 699 HA GLU 86 HA GLU 86 4.051 16.771 1.516 700 1HB GLU 86 HB2 GLU 86 5.802 14.715 0.097 701 2HB GLU 86 HB3 GLU 86 5.216 16.265 -0.513 702 1HG GLU 86 HG2 GLU 86 7.374 15.770 1.581 703 2HG GLU 86 HG3 GLU 86 7.535 16.527 0.001 704 H ALA 87 H ALA 87 4.267 13.237 1.591 705 HA ALA 87 HA ALA 87 2.322 12.564 -0.307 706 1HB ALA 87 HB1 ALA 87 3.910 10.993 0.790 707 2HB ALA 87 HB2 ALA 87 2.959 11.103 2.291 708 3HB ALA 87 HB3 ALA 87 2.238 10.415 0.815 709 H LEU 88 H LEU 88 1.873 13.652 3.070 710 HA LEU 88 HA LEU 88 -1.055 13.146 2.955 711 1HB LEU 88 HB2 LEU 88 0.758 14.376 5.073 712 2HB LEU 88 HB3 LEU 88 -0.991 14.220 5.224 713 HG LEU 88 HG LEU 88 0.836 11.816 4.836 714 1HD1 LEU 88 HD11 LEU 88 -0.219 13.096 7.399 715 2HD1 LEU 88 HD12 LEU 88 0.560 11.506 7.302 716 3HD1 LEU 88 HD13 LEU 88 1.481 12.972 6.899 717 1HD2 LEU 88 HD21 LEU 88 -1.069 10.562 5.723 718 2HD2 LEU 88 HD22 LEU 88 -1.993 12.055 5.976 719 3HD2 LEU 88 HD23 LEU 88 -1.626 11.499 4.332 720 H LYS 89 H LYS 89 1.258 15.865 3.295 721 HA LYS 89 HA LYS 89 -0.743 17.857 3.436 722 1HB LYS 89 HB2 LYS 89 2.166 18.057 2.569 723 2HB LYS 89 HB3 LYS 89 1.154 19.441 2.990 724 1HG LYS 89 HG2 LYS 89 1.776 17.158 4.933 725 2HG LYS 89 HG3 LYS 89 2.716 18.642 4.790 726 1HD LYS 89 HD2 LYS 89 0.803 20.013 5.439 727 2HD LYS 89 HD3 LYS 89 -0.261 18.601 5.447 728 1HE LYS 89 HE2 LYS 89 0.361 19.157 7.723 729 2HE LYS 89 HE3 LYS 89 1.015 17.573 7.281 730 1HZ LYS 89 HZ1 LYS 89 2.565 20.066 7.217 731 2HZ LYS 89 HZ2 LYS 89 2.568 18.983 8.461 732 3HZ LYS 89 HZ3 LYS 89 3.129 18.524 6.987 733 H GLY 90 H GLY 90 0.939 16.548 0.579 734 1HA GLY 90 HA2 GLY 90 0.518 16.794 -1.649 735 2HA GLY 90 HA3 GLY 90 -1.137 17.251 -1.211 736 1H MET 1 H1 MET 1 13.452 -0.083 -5.141 737 2H MET 1 H2 MET 1 13.969 -0.868 -6.478 738 3H MET 1 H3 MET 1 12.375 -0.451 -6.340 739 HA MET 1 HA MET 1 14.646 1.395 -6.555 740 1HB MET 1 HB2 MET 1 12.476 0.745 -8.595 741 2HB MET 1 HB3 MET 1 13.759 1.950 -8.790 742 1HG MET 1 HG2 MET 1 14.173 -1.051 -8.540 743 2HG MET 1 HG3 MET 1 14.285 -0.080 -10.005 744 1HE MET 1 HE1 MET 1 16.602 -1.166 -10.574 745 2HE MET 1 HE2 MET 1 17.975 -1.201 -9.442 746 3HE MET 1 HE3 MET 1 16.507 -2.140 -9.084 747 H ALA 2 H ALA 2 12.778 1.417 -4.454 748 HA ALA 2 HA ALA 2 11.716 2.801 -3.125 749 1HB ALA 2 HB1 ALA 2 13.333 4.482 -3.976 750 2HB ALA 2 HB2 ALA 2 12.150 4.998 -5.194 751 3HB ALA 2 HB3 ALA 2 11.798 5.189 -3.469 752 H SER 3 H SER 3 10.766 3.734 -6.328 753 HA SER 3 HA SER 3 8.169 4.410 -6.190 754 1HB SER 3 HB2 SER 3 8.975 2.711 -8.539 755 2HB SER 3 HB3 SER 3 8.095 4.229 -8.452 756 HG SER 3 HG SER 3 10.904 3.823 -8.087 757 HA PRO 4 HA PRO 4 6.653 -0.016 -6.922 758 1HB PRO 4 HB2 PRO 4 8.665 -1.708 -5.420 759 2HB PRO 4 HB3 PRO 4 7.731 -2.139 -6.878 760 1HG PRO 4 HG2 PRO 4 10.329 -1.391 -7.113 761 2HG PRO 4 HG3 PRO 4 9.115 -0.730 -8.252 762 1HD PRO 4 HD2 PRO 4 10.225 0.570 -5.758 763 2HD PRO 4 HD3 PRO 4 10.081 1.251 -7.387 764 H LEU 5 H LEU 5 8.272 0.367 -3.733 765 HA LEU 5 HA LEU 5 5.819 -0.478 -2.354 766 1HB LEU 5 HB2 LEU 5 7.941 -0.976 -1.321 767 2HB LEU 5 HB3 LEU 5 8.402 0.739 -1.326 768 HG LEU 5 HG LEU 5 6.519 1.236 0.235 769 1HD1 LEU 5 HD11 LEU 5 5.394 -0.640 1.377 770 2HD1 LEU 5 HD12 LEU 5 4.936 -0.581 -0.323 771 3HD1 LEU 5 HD13 LEU 5 6.111 -1.797 0.238 772 1HD2 LEU 5 HD21 LEU 5 8.299 -1.018 1.217 773 2HD2 LEU 5 HD22 LEU 5 8.756 0.704 1.125 774 3HD2 LEU 5 HD23 LEU 5 7.449 0.188 2.209 775 H ASP 6 H ASP 6 7.592 2.574 -3.050 776 HA ASP 6 HA ASP 6 6.054 4.298 -1.487 777 1HB ASP 6 HB2 ASP 6 7.415 4.831 -4.138 778 2HB ASP 6 HB3 ASP 6 6.656 6.085 -3.157 779 H GLN 7 H GLN 7 5.286 3.162 -4.823 780 HA GLN 7 HA GLN 7 2.967 4.774 -5.133 781 1HB GLN 7 HB2 GLN 7 2.322 3.248 -6.884 782 2HB GLN 7 HB3 GLN 7 4.084 3.432 -6.935 783 1HG GLN 7 HG2 GLN 7 4.212 1.337 -5.510 784 2HG GLN 7 HG3 GLN 7 2.481 1.086 -5.806 785 1HE2 GLN 7 HE22 GLN 7 4.460 -0.773 -6.431 786 2HE2 GLN 7 HE21 GLN 7 4.397 -0.995 -8.187 787 H ALA 8 H ALA 8 3.451 1.676 -3.407 788 HA ALA 8 HA ALA 8 0.625 1.111 -3.179 789 1HB ALA 8 HB1 ALA 8 1.348 -0.634 -1.603 790 2HB ALA 8 HB2 ALA 8 2.134 -0.687 -3.190 791 3HB ALA 8 HB3 ALA 8 3.026 -0.084 -1.769 792 H ILE 9 H ILE 9 3.134 2.259 -0.816 793 HA ILE 9 HA ILE 9 1.161 2.825 1.225 794 HB ILE 9 HB ILE 9 2.825 4.278 2.281 795 1HG1 ILE 9 HG12 ILE 9 4.659 3.488 0.001 796 2HG1 ILE 9 HG13 ILE 9 4.027 5.123 0.277 797 1HG2 ILE 9 HG21 ILE 9 2.632 1.823 2.633 798 2HG2 ILE 9 HG22 ILE 9 3.937 1.576 1.451 799 3HG2 ILE 9 HG23 ILE 9 4.238 2.450 2.969 800 1HD1 ILE 9 HD11 ILE 9 5.191 5.163 2.497 801 2HD1 ILE 9 HD12 ILE 9 5.926 3.590 2.112 802 3HD1 ILE 9 HD13 ILE 9 6.287 4.990 1.113 803 H GLY 10 H GLY 10 2.505 4.757 -1.450 804 1HA GLY 10 HA2 GLY 10 1.174 7.169 -1.272 805 2HA GLY 10 HA3 GLY 10 1.519 6.291 -2.768 806 H LEU 11 H LEU 11 -0.128 4.057 -2.550 807 HA LEU 11 HA LEU 11 -2.627 5.038 -3.358 808 1HB LEU 11 HB2 LEU 11 -1.425 2.735 -3.748 809 2HB LEU 11 HB3 LEU 11 -2.189 2.250 -2.242 810 HG LEU 11 HG LEU 11 -3.487 1.424 -4.005 811 1HD1 LEU 11 HD11 LEU 11 -5.642 2.238 -3.609 812 2HD1 LEU 11 HD12 LEU 11 -4.732 2.373 -2.089 813 3HD1 LEU 11 HD13 LEU 11 -5.048 3.825 -3.086 814 1HD2 LEU 11 HD21 LEU 11 -4.416 2.708 -5.824 815 2HD2 LEU 11 HD22 LEU 11 -3.649 4.194 -5.229 816 3HD2 LEU 11 HD23 LEU 11 -2.649 2.833 -5.801 817 H LEU 12 H LEU 12 -1.846 3.278 -0.309 818 HA LEU 12 HA LEU 12 -4.336 3.596 0.978 819 1HB LEU 12 HB2 LEU 12 -1.474 3.442 2.062 820 2HB LEU 12 HB3 LEU 12 -2.873 3.621 3.119 821 HG LEU 12 HG LEU 12 -3.850 1.540 2.243 822 1HD1 LEU 12 HD11 LEU 12 -2.699 1.322 0.063 823 2HD1 LEU 12 HD12 LEU 12 -1.133 1.180 0.903 824 3HD1 LEU 12 HD13 LEU 12 -2.361 -0.083 1.072 825 1HD2 LEU 12 HD21 LEU 12 -2.269 0.054 3.481 826 2HD2 LEU 12 HD22 LEU 12 -1.073 1.364 3.482 827 3HD2 LEU 12 HD23 LEU 12 -2.620 1.551 4.341 828 H ILE 13 H ILE 13 -1.513 5.771 0.968 829 HA ILE 13 HA ILE 13 -2.615 7.712 2.754 830 HB ILE 13 HB ILE 13 -0.524 7.954 0.550 831 1HG1 ILE 13 HG12 ILE 13 -0.002 7.933 3.535 832 2HG1 ILE 13 HG13 ILE 13 -0.163 6.409 2.672 833 1HG2 ILE 13 HG21 ILE 13 0.203 10.016 1.859 834 2HG2 ILE 13 HG22 ILE 13 -1.335 10.198 1.012 835 3HG2 ILE 13 HG23 ILE 13 -1.314 9.888 2.761 836 1HD1 ILE 13 HD11 ILE 13 1.969 8.522 2.335 837 2HD1 ILE 13 HD12 ILE 13 2.132 6.773 2.600 838 3HD1 ILE 13 HD13 ILE 13 1.628 7.372 1.024 839 H GLY 14 H GLY 14 -2.510 7.575 -0.826 840 1HA GLY 14 HA2 GLY 14 -3.813 9.970 -1.423 841 2HA GLY 14 HA3 GLY 14 -3.825 8.507 -2.429 842 H ILE 15 H ILE 15 -5.223 6.660 -1.015 843 HA ILE 15 HA ILE 15 -7.951 7.354 -1.344 844 HB ILE 15 HB ILE 15 -6.419 5.136 0.002 845 1HG1 ILE 15 HG12 ILE 15 -8.608 5.249 -2.120 846 2HG1 ILE 15 HG13 ILE 15 -6.870 5.234 -2.454 847 1HG2 ILE 15 HG21 ILE 15 -9.419 5.505 0.284 848 2HG2 ILE 15 HG22 ILE 15 -8.514 4.028 0.692 849 3HG2 ILE 15 HG23 ILE 15 -8.204 5.496 1.587 850 1HD1 ILE 15 HD11 ILE 15 -7.655 2.994 -2.790 851 2HD1 ILE 15 HD12 ILE 15 -6.766 2.983 -1.256 852 3HD1 ILE 15 HD13 ILE 15 -8.539 2.976 -1.266 853 H PHE 16 H PHE 16 -6.063 7.048 1.699 854 HA PHE 16 HA PHE 16 -8.058 7.896 3.427 855 1HB PHE 16 HB2 PHE 16 -5.851 6.979 4.072 856 2HB PHE 16 HB3 PHE 16 -5.058 8.464 3.603 857 HD1 PHE 16 HD1 PHE 16 -5.307 10.531 4.936 858 HD2 PHE 16 HD2 PHE 16 -7.288 6.886 6.094 859 HE1 PHE 16 HE1 PHE 16 -5.774 11.482 7.149 860 HE2 PHE 16 HE2 PHE 16 -7.575 7.775 8.400 861 HZ PHE 16 HZ PHE 16 -6.815 10.057 8.934 862 H HIS 17 H HIS 17 -5.619 9.938 1.779 863 HA HIS 17 HA HIS 17 -6.474 12.273 3.156 864 1HB HIS 17 HB2 HIS 17 -4.136 11.619 2.003 865 2HB HIS 17 HB3 HIS 17 -4.800 12.666 0.742 866 HD1 HIS 17 HD1 HIS 17 -5.140 15.282 1.539 867 HD2 HIS 17 HD2 HIS 17 -3.871 12.594 4.505 868 HE1 HIS 17 HE1 HIS 17 -4.626 16.672 3.616 869 H LYS 18 H LYS 18 -7.418 10.848 0.054 870 HA LYS 18 HA LYS 18 -8.867 13.190 -0.880 871 1HB LYS 18 HB2 LYS 18 -9.228 10.210 -1.343 872 2HB LYS 18 HB3 LYS 18 -10.280 11.436 -2.066 873 1HG LYS 18 HG2 LYS 18 -8.340 12.527 -3.131 874 2HG LYS 18 HG3 LYS 18 -7.263 11.290 -2.487 875 1HD LYS 18 HD2 LYS 18 -9.603 10.819 -4.404 876 2HD LYS 18 HD3 LYS 18 -7.891 10.890 -4.853 877 1HE LYS 18 HE2 LYS 18 -7.449 8.919 -3.355 878 2HE LYS 18 HE3 LYS 18 -9.194 8.790 -3.054 879 1HZ LYS 18 HZ1 LYS 18 -7.899 8.573 -5.672 880 2HZ LYS 18 HZ2 LYS 18 -8.498 7.329 -4.771 881 3HZ LYS 18 HZ3 LYS 18 -9.519 8.467 -5.385 882 H TYR 19 H TYR 19 -9.864 10.265 0.989 883 HA TYR 19 HA TYR 19 -12.528 11.208 1.362 884 1HB TYR 19 HB2 TYR 19 -10.898 9.088 2.745 885 2HB TYR 19 HB3 TYR 19 -12.563 9.451 3.211 886 HD1 TYR 19 HD1 TYR 19 -14.448 9.243 1.546 887 HD2 TYR 19 HD2 TYR 19 -10.550 7.577 0.891 888 HE1 TYR 19 HE1 TYR 19 -15.290 7.964 -0.390 889 HE2 TYR 19 HE2 TYR 19 -11.293 6.617 -1.252 890 HH TYR 19 HH TYR 19 -13.079 6.267 -2.674 891 H SER 20 H SER 20 -9.689 11.558 3.565 892 HA SER 20 HA SER 20 -11.264 13.031 5.527 893 1HB SER 20 HB2 SER 20 -9.002 13.777 6.362 894 2HB SER 20 HB3 SER 20 -9.316 12.037 6.378 895 HG SER 20 HG SER 20 -8.069 11.766 4.581 896 H GLY 21 H GLY 21 -9.074 14.013 2.837 897 1HA GLY 21 HA2 GLY 21 -9.184 16.747 2.934 898 2HA GLY 21 HA3 GLY 21 -9.222 15.806 1.434 899 H LYS 22 H LYS 22 -11.717 14.582 1.573 900 HA LYS 22 HA LYS 22 -13.500 16.411 0.573 901 1HB LYS 22 HB2 LYS 22 -13.679 13.873 0.607 902 2HB LYS 22 HB3 LYS 22 -14.332 14.003 2.241 903 1HG LYS 22 HG2 LYS 22 -15.791 15.852 0.577 904 2HG LYS 22 HG3 LYS 22 -15.636 14.339 -0.308 905 1HD LYS 22 HD2 LYS 22 -17.683 14.210 0.903 906 2HD LYS 22 HD3 LYS 22 -16.549 13.116 1.695 907 1HE LYS 22 HE2 LYS 22 -17.845 14.372 3.348 908 2HE LYS 22 HE3 LYS 22 -16.147 14.839 3.466 909 1HZ LYS 22 HZ1 LYS 22 -16.618 16.819 2.292 910 2HZ LYS 22 HZ2 LYS 22 -18.186 16.370 2.010 911 3HZ LYS 22 HZ3 LYS 22 -17.674 16.691 3.543 912 H GLU 23 H GLU 23 -13.102 15.550 4.021 913 HA GLU 23 HA GLU 23 -15.238 17.491 4.792 914 1HB GLU 23 HB2 GLU 23 -14.831 16.443 7.102 915 2HB GLU 23 HB3 GLU 23 -15.770 15.580 5.882 916 1HG GLU 23 HG2 GLU 23 -13.880 14.144 5.322 917 2HG GLU 23 HG3 GLU 23 -12.853 15.019 6.489 918 H GLY 24 H GLY 24 -11.799 17.128 4.635 919 1HA GLY 24 HA2 GLY 24 -10.146 18.659 4.953 920 2HA GLY 24 HA3 GLY 24 -11.416 19.893 4.912 921 H ASP 25 H ASP 25 -10.999 17.266 7.285 922 HA ASP 25 HA ASP 25 -11.145 19.204 9.483 923 1HB ASP 25 HB2 ASP 25 -11.417 17.247 10.903 924 2HB ASP 25 HB3 ASP 25 -12.591 17.291 9.584 925 H LYS 26 H LYS 26 -8.936 16.438 8.666 926 HA LYS 26 HA LYS 26 -6.548 17.829 9.011 927 1HB LYS 26 HB2 LYS 26 -7.661 17.434 11.564 928 2HB LYS 26 HB3 LYS 26 -6.732 15.972 11.363 929 1HG LYS 26 HG2 LYS 26 -5.306 17.495 12.432 930 2HG LYS 26 HG3 LYS 26 -4.724 17.500 10.759 931 1HD LYS 26 HD2 LYS 26 -6.110 19.580 10.344 932 2HD LYS 26 HD3 LYS 26 -6.584 19.569 12.038 933 1HE LYS 26 HE2 LYS 26 -3.721 19.811 10.978 934 2HE LYS 26 HE3 LYS 26 -4.724 21.146 11.566 935 1HZ LYS 26 HZ1 LYS 26 -4.787 20.082 13.707 936 2HZ LYS 26 HZ2 LYS 26 -3.816 18.862 13.170 937 3HZ LYS 26 HZ3 LYS 26 -3.238 20.402 13.245 938 H HIS 27 H HIS 27 -4.957 15.596 9.913 939 HA HIS 27 HA HIS 27 -5.304 13.704 7.707 940 1HB HIS 27 HB2 HIS 27 -3.329 13.651 10.011 941 2HB HIS 27 HB3 HIS 27 -3.238 12.728 8.505 942 HD1 HIS 27 HD1 HIS 27 -3.538 14.908 6.287 943 HD2 HIS 27 HD2 HIS 27 -1.496 15.472 9.940 944 HE1 HIS 27 HE1 HIS 27 -1.966 16.860 5.952 945 H THR 28 H THR 28 -7.596 13.588 8.967 946 HA THR 28 HA THR 28 -7.724 11.159 10.651 947 HB THR 28 HB THR 28 -9.379 12.518 12.053 948 HG1 THR 28 HG1 THR 28 -9.574 14.288 10.665 949 1HG2 THR 28 HG21 THR 28 -6.452 13.384 12.170 950 2HG2 THR 28 HG22 THR 28 -7.660 13.623 13.439 951 3HG2 THR 28 HG23 THR 28 -7.171 11.980 12.988 952 H LEU 29 H LEU 29 -9.532 9.985 10.080 953 HA LEU 29 HA LEU 29 -11.522 11.225 8.180 954 1HB LEU 29 HB2 LEU 29 -10.912 8.343 8.949 955 2HB LEU 29 HB3 LEU 29 -12.325 8.805 8.003 956 HG LEU 29 HG LEU 29 -9.499 9.465 7.097 957 1HD1 LEU 29 HD11 LEU 29 -11.234 7.047 6.406 958 2HD1 LEU 29 HD12 LEU 29 -9.699 7.478 5.625 959 3HD1 LEU 29 HD13 LEU 29 -9.722 6.993 7.336 960 1HD2 LEU 29 HD21 LEU 29 -11.427 10.711 6.041 961 2HD2 LEU 29 HD22 LEU 29 -10.542 9.659 4.923 962 3HD2 LEU 29 HD23 LEU 29 -12.117 9.147 5.570 963 H SER 30 H SER 30 -13.775 11.178 8.836 964 HA SER 30 HA SER 30 -14.231 10.605 11.718 965 1HB SER 30 HB2 SER 30 -16.478 11.492 11.291 966 2HB SER 30 HB3 SER 30 -15.242 12.640 10.750 967 HG SER 30 HG SER 30 -16.065 12.480 8.821 968 H LYS 31 H LYS 31 -15.921 9.033 12.316 969 HA LYS 31 HA LYS 31 -15.635 6.535 11.318 970 1HB LYS 31 HB2 LYS 31 -17.823 6.043 12.405 971 2HB LYS 31 HB3 LYS 31 -16.642 6.888 13.410 972 1HG LYS 31 HG2 LYS 31 -17.944 9.051 12.845 973 2HG LYS 31 HG3 LYS 31 -19.197 7.997 12.164 974 1HD LYS 31 HD2 LYS 31 -18.114 7.927 15.012 975 2HD LYS 31 HD3 LYS 31 -19.632 8.681 14.510 976 1HE LYS 31 HE2 LYS 31 -20.468 6.437 13.761 977 2HE LYS 31 HE3 LYS 31 -18.960 5.705 14.347 978 1HZ LYS 31 HZ1 LYS 31 -20.873 7.160 16.015 979 2HZ LYS 31 HZ2 LYS 31 -20.689 5.523 15.944 980 3HZ LYS 31 HZ3 LYS 31 -19.468 6.462 16.524 981 H LYS 32 H LYS 32 -18.173 8.791 10.258 982 HA LYS 32 HA LYS 32 -19.273 6.779 8.419 983 1HB LYS 32 HB2 LYS 32 -20.782 8.141 9.548 984 2HB LYS 32 HB3 LYS 32 -20.053 9.650 8.925 985 1HG LYS 32 HG2 LYS 32 -20.692 8.960 6.608 986 2HG LYS 32 HG3 LYS 32 -21.428 7.487 7.249 987 1HD LYS 32 HD2 LYS 32 -22.273 10.353 7.914 988 2HD LYS 32 HD3 LYS 32 -23.052 9.299 6.725 989 1HE LYS 32 HE2 LYS 32 -23.566 7.655 8.564 990 2HE LYS 32 HE3 LYS 32 -22.922 8.819 9.740 991 1HZ LYS 32 HZ1 LYS 32 -24.569 10.376 9.021 992 2HZ LYS 32 HZ2 LYS 32 -25.179 9.296 7.935 993 3HZ LYS 32 HZ3 LYS 32 -25.271 8.982 9.549 994 H GLU 33 H GLU 33 -17.006 9.541 8.156 995 HA GLU 33 HA GLU 33 -16.938 9.537 5.284 996 1HB GLU 33 HB2 GLU 33 -15.935 11.299 6.795 997 2HB GLU 33 HB3 GLU 33 -14.654 10.140 7.206 998 1HG GLU 33 HG2 GLU 33 -13.810 11.565 5.461 999 2HG GLU 33 HG3 GLU 33 -14.129 9.998 4.722 1000 H LEU 34 H LEU 34 -15.219 7.695 7.826 1001 HA LEU 34 HA LEU 34 -13.643 6.095 6.104 1002 1HB LEU 34 HB2 LEU 34 -13.149 6.147 8.413 1003 2HB LEU 34 HB3 LEU 34 -14.754 5.649 8.893 1004 HG LEU 34 HG LEU 34 -13.061 3.932 9.189 1005 1HD1 LEU 34 HD11 LEU 34 -14.972 2.825 7.133 1006 2HD1 LEU 34 HD12 LEU 34 -14.384 2.101 8.620 1007 3HD1 LEU 34 HD13 LEU 34 -15.546 3.425 8.700 1008 1HD2 LEU 34 HD21 LEU 34 -11.597 4.428 7.296 1009 2HD2 LEU 34 HD22 LEU 34 -12.090 2.729 7.230 1010 3HD2 LEU 34 HD23 LEU 34 -12.834 3.897 6.146 1011 H LYS 35 H LYS 35 -17.000 5.483 7.416 1012 HA LYS 35 HA LYS 35 -17.386 3.109 5.962 1013 1HB LYS 35 HB2 LYS 35 -19.006 3.951 7.592 1014 2HB LYS 35 HB3 LYS 35 -19.511 5.224 6.460 1015 1HG LYS 35 HG2 LYS 35 -20.153 3.499 4.784 1016 2HG LYS 35 HG3 LYS 35 -19.663 2.217 5.899 1017 1HD LYS 35 HD2 LYS 35 -21.839 4.294 6.432 1018 2HD LYS 35 HD3 LYS 35 -22.123 2.686 5.750 1019 1HE LYS 35 HE2 LYS 35 -21.078 1.661 7.806 1020 2HE LYS 35 HE3 LYS 35 -20.982 3.280 8.514 1021 1HZ LYS 35 HZ1 LYS 35 -23.421 1.866 7.694 1022 2HZ LYS 35 HZ2 LYS 35 -22.985 2.302 9.220 1023 3HZ LYS 35 HZ3 LYS 35 -23.395 3.459 8.130 1024 H GLU 36 H GLU 36 -17.849 6.483 4.798 1025 HA GLU 36 HA GLU 36 -18.726 5.840 2.208 1026 1HB GLU 36 HB2 GLU 36 -18.579 8.151 3.342 1027 2HB GLU 36 HB3 GLU 36 -16.887 8.193 2.841 1028 1HG GLU 36 HG2 GLU 36 -18.195 9.383 1.214 1029 2HG GLU 36 HG3 GLU 36 -17.586 7.903 0.463 1030 H LEU 37 H LEU 37 -15.366 6.325 3.372 1031 HA LEU 37 HA LEU 37 -13.977 5.684 1.018 1032 1HB LEU 37 HB2 LEU 37 -12.957 6.596 3.054 1033 2HB LEU 37 HB3 LEU 37 -13.258 5.124 3.944 1034 HG LEU 37 HG LEU 37 -11.439 5.130 1.530 1035 1HD1 LEU 37 HD11 LEU 37 -10.796 5.605 4.478 1036 2HD1 LEU 37 HD12 LEU 37 -9.589 5.360 3.213 1037 3HD1 LEU 37 HD13 LEU 37 -10.610 6.798 3.173 1038 1HD2 LEU 37 HD21 LEU 37 -10.379 3.230 2.796 1039 2HD2 LEU 37 HD22 LEU 37 -11.697 3.297 3.975 1040 3HD2 LEU 37 HD23 LEU 37 -12.016 2.844 2.283 1041 H ILE 38 H ILE 38 -15.075 3.406 3.567 1042 HA ILE 38 HA ILE 38 -14.052 1.139 2.157 1043 HB ILE 38 HB ILE 38 -16.245 1.370 4.247 1044 1HG1 ILE 38 HG12 ILE 38 -13.271 0.617 4.278 1045 2HG1 ILE 38 HG13 ILE 38 -13.994 2.080 4.956 1046 1HG2 ILE 38 HG21 ILE 38 -16.049 -1.047 4.540 1047 2HG2 ILE 38 HG22 ILE 38 -16.542 -0.735 2.894 1048 3HG2 ILE 38 HG23 ILE 38 -14.850 -1.155 3.241 1049 1HD1 ILE 38 HD11 ILE 38 -14.310 -0.761 5.900 1050 2HD1 ILE 38 HD12 ILE 38 -13.594 0.626 6.754 1051 3HD1 ILE 38 HD13 ILE 38 -15.357 0.564 6.482 1052 H GLN 39 H GLN 39 -17.435 2.436 2.230 1053 HA GLN 39 HA GLN 39 -18.401 0.444 0.441 1054 1HB GLN 39 HB2 GLN 39 -19.368 3.273 1.014 1055 2HB GLN 39 HB3 GLN 39 -20.272 2.118 0.031 1056 1HG GLN 39 HG2 GLN 39 -19.466 1.623 2.937 1057 2HG GLN 39 HG3 GLN 39 -21.033 2.254 2.417 1058 1HE2 GLN 39 HE22 GLN 39 -21.153 -0.030 3.950 1059 2HE2 GLN 39 HE21 GLN 39 -21.479 -1.397 2.907 1060 H LYS 40 H LYS 40 -16.852 3.623 -0.240 1061 HA LYS 40 HA LYS 40 -17.497 3.343 -3.049 1062 1HB LYS 40 HB2 LYS 40 -17.505 5.472 -1.784 1063 2HB LYS 40 HB3 LYS 40 -15.748 5.397 -1.666 1064 1HG LYS 40 HG2 LYS 40 -15.516 5.527 -4.084 1065 2HG LYS 40 HG3 LYS 40 -17.254 5.331 -4.334 1066 1HD LYS 40 HD2 LYS 40 -15.999 7.709 -2.887 1067 2HD LYS 40 HD3 LYS 40 -16.376 7.679 -4.613 1068 1HE LYS 40 HE2 LYS 40 -18.784 7.261 -4.072 1069 2HE LYS 40 HE3 LYS 40 -18.406 7.395 -2.346 1070 1HZ LYS 40 HZ1 LYS 40 -17.648 9.611 -2.731 1071 2HZ LYS 40 HZ2 LYS 40 -18.012 9.504 -4.336 1072 3HZ LYS 40 HZ3 LYS 40 -19.214 9.431 -3.211 1073 H GLU 41 H GLU 41 -14.560 2.815 -1.107 1074 HA GLU 41 HA GLU 41 -13.038 2.095 -3.531 1075 1HB GLU 41 HB2 GLU 41 -12.307 1.780 -0.591 1076 2HB GLU 41 HB3 GLU 41 -11.244 1.529 -1.981 1077 1HG GLU 41 HG2 GLU 41 -12.547 4.179 -1.184 1078 2HG GLU 41 HG3 GLU 41 -10.872 3.717 -0.893 1079 H LEU 42 H LEU 42 -14.158 0.395 -0.595 1080 HA LEU 42 HA LEU 42 -13.555 -2.237 -1.861 1081 1HB LEU 42 HB2 LEU 42 -14.195 -1.460 1.000 1082 2HB LEU 42 HB3 LEU 42 -13.908 -3.111 0.453 1083 HG LEU 42 HG LEU 42 -11.825 -0.901 0.169 1084 1HD1 LEU 42 HD11 LEU 42 -10.785 -1.861 2.203 1085 2HD1 LEU 42 HD12 LEU 42 -12.379 -1.171 2.544 1086 3HD1 LEU 42 HD13 LEU 42 -12.186 -2.932 2.411 1087 1HD2 LEU 42 HD21 LEU 42 -10.257 -2.818 0.008 1088 2HD2 LEU 42 HD22 LEU 42 -11.614 -3.952 0.138 1089 3HD2 LEU 42 HD23 LEU 42 -11.463 -2.897 -1.280 1090 H THR 43 H THR 43 -15.454 -1.259 -3.241 1091 HA THR 43 HA THR 43 -18.061 -1.253 -2.194 1092 HB THR 43 HB THR 43 -17.212 -1.669 -5.091 1093 HG1 THR 43 HG1 THR 43 -17.261 0.647 -3.462 1094 1HG2 THR 43 HG21 THR 43 -19.566 -0.190 -3.818 1095 2HG2 THR 43 HG22 THR 43 -19.157 -0.191 -5.546 1096 3HG2 THR 43 HG23 THR 43 -19.655 -1.699 -4.764 1097 H ILE 44 H ILE 44 -17.853 -3.350 -0.966 1098 HA ILE 44 HA ILE 44 -18.301 -5.828 -2.252 1099 HB ILE 44 HB ILE 44 -19.349 -6.599 -0.245 1100 1HG1 ILE 44 HG12 ILE 44 -20.790 -4.795 0.462 1101 2HG1 ILE 44 HG13 ILE 44 -19.717 -5.327 1.746 1102 1HG2 ILE 44 HG21 ILE 44 -16.930 -6.497 -0.339 1103 2HG2 ILE 44 HG22 ILE 44 -16.922 -4.874 0.367 1104 3HG2 ILE 44 HG23 ILE 44 -17.507 -6.252 1.317 1105 1HD1 ILE 44 HD11 ILE 44 -19.919 -2.951 1.870 1106 2HD1 ILE 44 HD12 ILE 44 -18.268 -3.307 1.359 1107 3HD1 ILE 44 HD13 ILE 44 -19.477 -2.734 0.177 1108 H GLY 45 H GLY 45 -19.982 -6.675 -3.370 1109 1HA GLY 45 HA2 GLY 45 -22.040 -4.992 -4.370 1110 2HA GLY 45 HA3 GLY 45 -21.960 -6.755 -4.538 1111 H SER 46 H SER 46 -22.149 -7.686 -1.992 1112 HA SER 46 HA SER 46 -24.965 -7.238 -1.374 1113 1HB SER 46 HB2 SER 46 -23.874 -9.483 -1.273 1114 2HB SER 46 HB3 SER 46 -22.942 -8.930 0.135 1115 HG SER 46 HG SER 46 -24.903 -9.992 0.724 1116 H LYS 47 H LYS 47 -24.586 -4.890 -1.001 1117 HA LYS 47 HA LYS 47 -23.134 -3.943 1.231 1118 1HB LYS 47 HB2 LYS 47 -25.510 -2.730 -0.216 1119 2HB LYS 47 HB3 LYS 47 -24.552 -1.888 1.023 1120 1HG LYS 47 HG2 LYS 47 -22.477 -2.271 -0.269 1121 2HG LYS 47 HG3 LYS 47 -23.406 -3.110 -1.520 1122 1HD LYS 47 HD2 LYS 47 -24.633 -1.055 -2.049 1123 2HD LYS 47 HD3 LYS 47 -23.844 -0.204 -0.704 1124 1HE LYS 47 HE2 LYS 47 -22.788 0.310 -2.907 1125 2HE LYS 47 HE3 LYS 47 -21.654 -0.411 -1.752 1126 1HZ LYS 47 HZ1 LYS 47 -21.865 -2.483 -2.840 1127 2HZ LYS 47 HZ2 LYS 47 -23.050 -1.923 -3.846 1128 3HZ LYS 47 HZ3 LYS 47 -21.516 -1.339 -3.974 1129 H LEU 48 H LEU 48 -25.814 -5.967 1.452 1130 HA LEU 48 HA LEU 48 -26.962 -5.140 3.937 1131 1HB LEU 48 HB2 LEU 48 -26.312 -7.948 2.940 1132 2HB LEU 48 HB3 LEU 48 -27.457 -7.538 4.221 1133 HG LEU 48 HG LEU 48 -27.743 -6.796 1.265 1134 1HD1 LEU 48 HD11 LEU 48 -29.222 -8.835 2.975 1135 2HD1 LEU 48 HD12 LEU 48 -29.562 -8.442 1.275 1136 3HD1 LEU 48 HD13 LEU 48 -28.022 -9.199 1.716 1137 1HD2 LEU 48 HD21 LEU 48 -29.626 -6.354 3.629 1138 2HD2 LEU 48 HD22 LEU 48 -28.842 -5.091 2.651 1139 3HD2 LEU 48 HD23 LEU 48 -30.062 -6.137 1.921 1140 H GLN 49 H GLN 49 -23.894 -6.620 3.028 1141 HA GLN 49 HA GLN 49 -22.902 -7.316 5.601 1142 1HB GLN 49 HB2 GLN 49 -21.464 -6.406 3.079 1143 2HB GLN 49 HB3 GLN 49 -20.673 -7.079 4.505 1144 1HG GLN 49 HG2 GLN 49 -21.971 -9.185 4.252 1145 2HG GLN 49 HG3 GLN 49 -22.731 -8.549 2.793 1146 1HE2 GLN 49 HE22 GLN 49 -19.529 -9.256 4.259 1147 2HE2 GLN 49 HE21 GLN 49 -18.737 -9.634 2.729 1148 H ASP 50 H ASP 50 -23.736 -4.135 4.500 1149 HA ASP 50 HA ASP 50 -21.752 -2.603 5.673 1150 1HB ASP 50 HB2 ASP 50 -23.634 -1.677 4.376 1151 2HB ASP 50 HB3 ASP 50 -24.707 -1.964 5.761 1152 H ALA 51 H ALA 51 -24.230 -4.593 7.232 1153 HA ALA 51 HA ALA 51 -24.011 -3.705 9.921 1154 1HB ALA 51 HB1 ALA 51 -25.628 -5.389 9.162 1155 2HB ALA 51 HB2 ALA 51 -24.312 -6.532 8.822 1156 3HB ALA 51 HB3 ALA 51 -24.638 -6.020 10.492 1157 H GLU 52 H GLU 52 -21.905 -5.944 8.046 1158 HA GLU 52 HA GLU 52 -20.086 -6.503 10.240 1159 1HB GLU 52 HB2 GLU 52 -19.568 -6.676 7.235 1160 2HB GLU 52 HB3 GLU 52 -18.633 -7.413 8.536 1161 1HG GLU 52 HG2 GLU 52 -20.627 -8.791 9.164 1162 2HG GLU 52 HG3 GLU 52 -21.512 -8.115 7.786 1163 H ILE 53 H ILE 53 -20.230 -4.250 7.456 1164 HA ILE 53 HA ILE 53 -17.740 -3.011 7.926 1165 HB ILE 53 HB ILE 53 -20.166 -1.652 6.746 1166 1HG1 ILE 53 HG12 ILE 53 -19.750 -3.635 5.404 1167 2HG1 ILE 53 HG13 ILE 53 -19.087 -2.254 4.545 1168 1HG2 ILE 53 HG21 ILE 53 -18.454 -0.268 5.565 1169 2HG2 ILE 53 HG22 ILE 53 -18.560 0.004 7.304 1170 3HG2 ILE 53 HG23 ILE 53 -17.229 -0.962 6.649 1171 1HD1 ILE 53 HD11 ILE 53 -17.582 -4.407 6.087 1172 2HD1 ILE 53 HD12 ILE 53 -17.535 -4.061 4.354 1173 3HD1 ILE 53 HD13 ILE 53 -16.798 -2.928 5.501 1174 H VAL 54 H VAL 54 -20.919 -2.205 9.497 1175 HA VAL 54 HA VAL 54 -19.705 0.005 10.842 1176 HB VAL 54 HB VAL 54 -21.595 -0.044 12.440 1177 1HG1 VAL 54 HG11 VAL 54 -22.134 0.191 9.467 1178 2HG1 VAL 54 HG12 VAL 54 -23.084 0.946 10.768 1179 3HG1 VAL 54 HG13 VAL 54 -21.408 1.450 10.495 1180 1HG2 VAL 54 HG21 VAL 54 -22.791 -2.043 10.549 1181 2HG2 VAL 54 HG22 VAL 54 -22.292 -2.393 12.225 1182 3HG2 VAL 54 HG23 VAL 54 -23.595 -1.238 11.899 1183 H LYS 55 H LYS 55 -19.936 -3.445 11.772 1184 HA LYS 55 HA LYS 55 -18.844 -3.053 14.400 1185 1HB LYS 55 HB2 LYS 55 -19.860 -5.173 13.764 1186 2HB LYS 55 HB3 LYS 55 -18.676 -5.414 12.485 1187 1HG LYS 55 HG2 LYS 55 -18.183 -6.802 14.449 1188 2HG LYS 55 HG3 LYS 55 -16.869 -5.708 14.060 1189 1HD LYS 55 HD2 LYS 55 -17.219 -5.853 16.479 1190 2HD LYS 55 HD3 LYS 55 -17.446 -4.212 15.904 1191 1HE LYS 55 HE2 LYS 55 -19.147 -4.831 17.574 1192 2HE LYS 55 HE3 LYS 55 -19.913 -4.479 16.023 1193 1HZ LYS 55 HZ1 LYS 55 -19.303 -7.162 17.057 1194 2HZ LYS 55 HZ2 LYS 55 -20.789 -6.449 17.037 1195 3HZ LYS 55 HZ3 LYS 55 -20.041 -6.829 15.620 1196 H LEU 56 H LEU 56 -17.300 -3.803 11.261 1197 HA LEU 56 HA LEU 56 -14.597 -3.610 12.081 1198 1HB LEU 56 HB2 LEU 56 -15.045 -4.582 10.040 1199 2HB LEU 56 HB3 LEU 56 -16.084 -3.280 9.481 1200 HG LEU 56 HG LEU 56 -13.225 -2.532 9.985 1201 1HD1 LEU 56 HD11 LEU 56 -12.933 -4.695 8.875 1202 2HD1 LEU 56 HD12 LEU 56 -14.103 -4.236 7.618 1203 3HD1 LEU 56 HD13 LEU 56 -12.558 -3.372 7.754 1204 1HD2 LEU 56 HD21 LEU 56 -13.612 -1.200 8.017 1205 2HD2 LEU 56 HD22 LEU 56 -15.179 -1.987 7.692 1206 3HD2 LEU 56 HD23 LEU 56 -15.000 -0.911 9.072 1207 H MET 57 H MET 57 -16.826 -1.032 10.988 1208 HA MET 57 HA MET 57 -14.954 1.096 11.052 1209 1HB MET 57 HB2 MET 57 -16.971 1.352 9.838 1210 2HB MET 57 HB3 MET 57 -17.948 0.997 11.264 1211 1HG MET 57 HG2 MET 57 -16.156 3.412 11.197 1212 2HG MET 57 HG3 MET 57 -17.776 3.447 10.503 1213 1HE MET 57 HE1 MET 57 -20.019 3.282 11.833 1214 2HE MET 57 HE2 MET 57 -19.593 1.724 12.594 1215 3HE MET 57 HE3 MET 57 -20.115 3.084 13.598 1216 H ASP 58 H ASP 58 -17.142 -0.248 13.589 1217 HA ASP 58 HA ASP 58 -16.424 1.602 15.613 1218 1HB ASP 58 HB2 ASP 58 -18.276 0.034 15.873 1219 2HB ASP 58 HB3 ASP 58 -17.152 -1.332 15.931 1220 H ASP 59 H ASP 59 -14.982 -1.539 14.658 1221 HA ASP 59 HA ASP 59 -12.883 -1.433 16.577 1222 1HB ASP 59 HB2 ASP 59 -12.835 -2.846 13.862 1223 2HB ASP 59 HB3 ASP 59 -11.798 -3.208 15.250 1224 H LEU 60 H LEU 60 -13.042 -0.030 13.334 1225 HA LEU 60 HA LEU 60 -10.315 0.981 13.346 1226 1HB LEU 60 HB2 LEU 60 -12.863 1.616 11.857 1227 2HB LEU 60 HB3 LEU 60 -11.549 2.781 11.803 1228 HG LEU 60 HG LEU 60 -10.910 -0.087 11.214 1229 1HD1 LEU 60 HD11 LEU 60 -11.403 0.259 8.798 1230 2HD1 LEU 60 HD12 LEU 60 -12.875 0.262 9.807 1231 3HD1 LEU 60 HD13 LEU 60 -12.182 1.786 9.212 1232 1HD2 LEU 60 HD21 LEU 60 -9.122 1.716 11.232 1233 2HD2 LEU 60 HD22 LEU 60 -9.327 1.019 9.597 1234 3HD2 LEU 60 HD23 LEU 60 -10.037 2.578 9.973 1235 H ASP 61 H ASP 61 -13.395 2.744 13.861 1236 HA ASP 61 HA ASP 61 -12.148 5.067 14.686 1237 1HB ASP 61 HB2 ASP 61 -14.158 6.062 15.029 1238 2HB ASP 61 HB3 ASP 61 -14.440 4.901 13.733 1239 H ARG 62 H ARG 62 -12.974 2.338 16.718 1240 HA ARG 62 HA ARG 62 -12.811 3.143 19.290 1241 1HB ARG 62 HB2 ARG 62 -12.781 0.830 18.576 1242 2HB ARG 62 HB3 ARG 62 -11.221 1.072 17.780 1243 1HG ARG 62 HG2 ARG 62 -10.155 1.368 20.042 1244 2HG ARG 62 HG3 ARG 62 -11.737 1.099 20.797 1245 1HD ARG 62 HD2 ARG 62 -10.308 -0.987 20.722 1246 2HD ARG 62 HD3 ARG 62 -11.840 -1.156 19.865 1247 HE ARG 62 HE ARG 62 -10.791 -1.278 17.836 1248 1HH1 ARG 62 HH12 ARG 62 -8.333 -0.423 20.223 1249 2HH1 ARG 62 HH11 ARG 62 -7.079 -0.184 19.035 1250 1HH2 ARG 62 HH22 ARG 62 -9.298 -0.722 16.312 1251 2HH2 ARG 62 HH21 ARG 62 -7.613 -0.479 16.733 1252 H ASN 63 H ASN 63 -10.015 3.061 17.047 1253 HA ASN 63 HA ASN 63 -7.932 3.762 18.689 1254 1HB ASN 63 HB2 ASN 63 -6.743 4.511 16.833 1255 2HB ASN 63 HB3 ASN 63 -7.873 3.340 16.144 1256 1HD2 ASN 63 HD22 ASN 63 -10.069 4.426 15.528 1257 2HD2 ASN 63 HD21 ASN 63 -10.089 6.092 14.983 1258 H LYS 64 H LYS 64 -10.430 5.990 17.550 1259 HA LYS 64 HA LYS 64 -9.598 8.022 19.481 1260 1HB LYS 64 HB2 LYS 64 -8.205 8.433 17.414 1261 2HB LYS 64 HB3 LYS 64 -9.696 8.710 16.512 1262 1HG LYS 64 HG2 LYS 64 -10.232 10.621 18.032 1263 2HG LYS 64 HG3 LYS 64 -8.754 10.285 18.955 1264 1HD LYS 64 HD2 LYS 64 -7.378 10.728 16.953 1265 2HD LYS 64 HD3 LYS 64 -8.842 10.987 15.981 1266 1HE LYS 64 HE2 LYS 64 -9.468 12.909 17.438 1267 2HE LYS 64 HE3 LYS 64 -7.998 12.657 18.398 1268 1HZ LYS 64 HZ1 LYS 64 -8.092 13.334 15.545 1269 2HZ LYS 64 HZ2 LYS 64 -7.708 14.362 16.773 1270 3HZ LYS 64 HZ3 LYS 64 -6.718 13.091 16.424 1271 H ASP 65 H ASP 65 -11.622 6.462 19.712 1272 HA ASP 65 HA ASP 65 -13.766 6.191 20.017 1273 1HB ASP 65 HB2 ASP 65 -15.079 7.999 20.893 1274 2HB ASP 65 HB3 ASP 65 -13.440 8.000 21.542 1275 H GLN 66 H GLN 66 -13.893 8.973 17.819 1276 HA GLN 66 HA GLN 66 -16.022 7.588 16.209 1277 1HB GLN 66 HB2 GLN 66 -15.862 10.465 17.175 1278 2HB GLN 66 HB3 GLN 66 -17.016 9.907 15.959 1279 1HG GLN 66 HG2 GLN 66 -18.109 8.425 17.508 1280 2HG GLN 66 HG3 GLN 66 -16.867 8.655 18.741 1281 1HE2 GLN 66 HE22 GLN 66 -16.502 10.954 19.493 1282 2HE2 GLN 66 HE21 GLN 66 -17.952 11.937 19.708 1283 H GLU 67 H GLU 67 -12.892 8.837 16.170 1284 HA GLU 67 HA GLU 67 -13.041 9.479 13.264 1285 1HB GLU 67 HB2 GLU 67 -11.306 10.651 15.485 1286 2HB GLU 67 HB3 GLU 67 -10.937 10.824 13.763 1287 1HG GLU 67 HG2 GLU 67 -12.033 12.829 14.512 1288 2HG GLU 67 HG3 GLU 67 -13.081 11.977 13.375 1289 H VAL 68 H VAL 68 -11.149 8.863 12.096 1290 HA VAL 68 HA VAL 68 -9.460 6.719 13.323 1291 HB VAL 68 HB VAL 68 -10.073 6.837 10.379 1292 1HG1 VAL 68 HG11 VAL 68 -8.071 5.592 11.317 1293 2HG1 VAL 68 HG12 VAL 68 -9.203 4.561 12.211 1294 3HG1 VAL 68 HG13 VAL 68 -9.231 4.589 10.434 1295 1HG2 VAL 68 HG21 VAL 68 -12.275 6.509 11.410 1296 2HG2 VAL 68 HG22 VAL 68 -11.682 4.992 10.728 1297 3HG2 VAL 68 HG23 VAL 68 -11.602 5.256 12.479 1298 H ASN 69 H ASN 69 -7.539 7.650 13.793 1299 HA ASN 69 HA ASN 69 -6.631 9.910 12.149 1300 1HB ASN 69 HB2 ASN 69 -6.237 9.970 14.559 1301 2HB ASN 69 HB3 ASN 69 -5.335 8.449 14.487 1302 1HD2 ASN 69 HD21 ASN 69 -3.102 8.625 14.205 1303 2HD2 ASN 69 HD22 ASN 69 -2.306 10.089 13.632 1304 H PHE 70 H PHE 70 -4.878 9.926 10.742 1305 HA PHE 70 HA PHE 70 -4.678 8.004 8.924 1306 1HB PHE 70 HB2 PHE 70 -3.708 10.177 8.619 1307 2HB PHE 70 HB3 PHE 70 -2.478 9.874 9.842 1308 HD1 PHE 70 HD1 PHE 70 -0.330 9.239 9.071 1309 HD2 PHE 70 HD2 PHE 70 -3.801 8.296 6.683 1310 HE1 PHE 70 HE1 PHE 70 1.087 7.983 7.501 1311 HE2 PHE 70 HE2 PHE 70 -2.370 7.046 5.103 1312 HZ PHE 70 HZ PHE 70 0.058 6.788 5.567 1313 H GLN 71 H GLN 71 -2.104 8.091 11.466 1314 HA GLN 71 HA GLN 71 -0.790 5.767 10.539 1315 1HB GLN 71 HB2 GLN 71 0.163 7.415 12.122 1316 2HB GLN 71 HB3 GLN 71 -0.959 6.861 13.373 1317 1HG GLN 71 HG2 GLN 71 0.111 4.553 13.197 1318 2HG GLN 71 HG3 GLN 71 1.261 5.240 12.040 1319 1HE2 GLN 71 HE22 GLN 71 -0.073 5.710 15.373 1320 2HE2 GLN 71 HE21 GLN 71 1.454 6.272 16.047 1321 H GLU 72 H GLU 72 -3.632 6.117 12.618 1322 HA GLU 72 HA GLU 72 -3.562 3.355 13.576 1323 1HB GLU 72 HB2 GLU 72 -5.490 5.663 13.941 1324 2HB GLU 72 HB3 GLU 72 -5.812 4.024 14.513 1325 1HG GLU 72 HG2 GLU 72 -4.809 5.481 16.283 1326 2HG GLU 72 HG3 GLU 72 -3.863 4.025 15.948 1327 H TYR 73 H TYR 73 -5.221 5.283 11.081 1328 HA TYR 73 HA TYR 73 -6.911 3.221 10.030 1329 1HB TYR 73 HB2 TYR 73 -7.388 5.269 9.108 1330 2HB TYR 73 HB3 TYR 73 -5.727 5.775 9.014 1331 HD1 TYR 73 HD1 TYR 73 -4.342 5.331 7.089 1332 HD2 TYR 73 HD2 TYR 73 -8.414 3.929 7.282 1333 HE1 TYR 73 HE1 TYR 73 -4.338 5.003 4.646 1334 HE2 TYR 73 HE2 TYR 73 -8.459 3.764 4.806 1335 HH TYR 73 HH TYR 73 -5.716 4.812 2.779 1336 H ILE 74 H ILE 74 -3.514 4.139 9.178 1337 HA ILE 74 HA ILE 74 -3.078 1.994 7.379 1338 HB ILE 74 HB ILE 74 -1.089 3.369 9.223 1339 1HG1 ILE 74 HG12 ILE 74 -2.185 4.903 7.585 1340 2HG1 ILE 74 HG13 ILE 74 -0.453 4.753 7.421 1341 1HG2 ILE 74 HG21 ILE 74 -0.027 1.367 8.630 1342 2HG2 ILE 74 HG22 ILE 74 -0.689 1.370 6.982 1343 3HG2 ILE 74 HG23 ILE 74 0.579 2.515 7.440 1344 1HD1 ILE 74 HD11 ILE 74 -2.520 3.426 5.638 1345 2HD1 ILE 74 HD12 ILE 74 -1.475 4.794 5.219 1346 3HD1 ILE 74 HD13 ILE 74 -0.755 3.212 5.478 1347 H THR 75 H THR 75 -2.346 2.109 10.898 1348 HA THR 75 HA THR 75 -1.449 -0.518 11.233 1349 HB THR 75 HB THR 75 -3.136 1.161 13.138 1350 HG1 THR 75 HG1 THR 75 -1.258 2.200 12.545 1351 1HG2 THR 75 HG21 THR 75 -3.164 -1.058 14.016 1352 2HG2 THR 75 HG22 THR 75 -1.464 -1.336 13.612 1353 3HG2 THR 75 HG23 THR 75 -1.899 -0.184 14.894 1354 H PHE 76 H PHE 76 -4.862 0.658 11.355 1355 HA PHE 76 HA PHE 76 -5.954 -1.925 11.874 1356 1HB PHE 76 HB2 PHE 76 -7.210 0.174 12.227 1357 2HB PHE 76 HB3 PHE 76 -7.263 0.411 10.478 1358 HD1 PHE 76 HD1 PHE 76 -8.546 -1.592 13.330 1359 HD2 PHE 76 HD2 PHE 76 -8.619 -1.162 9.028 1360 HE1 PHE 76 HE1 PHE 76 -10.370 -3.257 13.175 1361 HE2 PHE 76 HE2 PHE 76 -10.513 -2.715 8.906 1362 HZ PHE 76 HZ PHE 76 -11.346 -3.842 10.955 1363 H LEU 77 H LEU 77 -5.255 -0.198 8.747 1364 HA LEU 77 HA LEU 77 -6.320 -2.322 7.143 1365 1HB LEU 77 HB2 LEU 77 -4.206 -0.223 6.591 1366 2HB LEU 77 HB3 LEU 77 -4.672 -1.430 5.390 1367 HG LEU 77 HG LEU 77 -6.690 0.421 6.747 1368 1HD1 LEU 77 HD11 LEU 77 -5.319 0.718 4.043 1369 2HD1 LEU 77 HD12 LEU 77 -6.710 1.650 4.626 1370 3HD1 LEU 77 HD13 LEU 77 -5.147 1.791 5.460 1371 1HD2 LEU 77 HD21 LEU 77 -6.818 -1.405 4.304 1372 2HD2 LEU 77 HD22 LEU 77 -7.793 -1.535 5.798 1373 3HD2 LEU 77 HD23 LEU 77 -8.050 -0.187 4.701 1374 H GLY 78 H GLY 78 -3.205 -1.966 8.799 1375 1HA GLY 78 HA2 GLY 78 -2.016 -4.384 7.864 1376 2HA GLY 78 HA3 GLY 78 -1.755 -3.649 9.465 1377 H ALA 79 H ALA 79 -4.153 -3.807 10.722 1378 HA ALA 79 HA ALA 79 -4.451 -6.538 11.431 1379 1HB ALA 79 HB1 ALA 79 -5.209 -4.644 12.845 1380 2HB ALA 79 HB2 ALA 79 -6.572 -4.373 11.734 1381 3HB ALA 79 HB3 ALA 79 -6.450 -5.895 12.628 1382 H LEU 80 H LEU 80 -6.193 -4.630 8.977 1383 HA LEU 80 HA LEU 80 -8.115 -6.602 8.359 1384 1HB LEU 80 HB2 LEU 80 -8.079 -4.074 7.786 1385 2HB LEU 80 HB3 LEU 80 -7.084 -4.533 6.400 1386 HG LEU 80 HG LEU 80 -8.937 -6.035 5.618 1387 1HD1 LEU 80 HD11 LEU 80 -10.171 -6.544 7.667 1388 2HD1 LEU 80 HD12 LEU 80 -10.385 -4.814 8.015 1389 3HD1 LEU 80 HD13 LEU 80 -11.230 -5.570 6.650 1390 1HD2 LEU 80 HD21 LEU 80 -10.403 -4.196 4.880 1391 2HD2 LEU 80 HD22 LEU 80 -9.751 -3.145 6.155 1392 3HD2 LEU 80 HD23 LEU 80 -8.706 -3.690 4.818 1393 H ALA 81 H ALA 81 -4.898 -5.878 6.988 1394 HA ALA 81 HA ALA 81 -4.773 -7.938 5.025 1395 1HB ALA 81 HB1 ALA 81 -3.135 -6.199 5.091 1396 2HB ALA 81 HB2 ALA 81 -2.604 -6.662 6.703 1397 3HB ALA 81 HB3 ALA 81 -2.325 -7.764 5.352 1398 H MET 82 H MET 82 -3.984 -7.942 8.540 1399 HA MET 82 HA MET 82 -3.294 -10.714 8.630 1400 1HB MET 82 HB2 MET 82 -2.621 -8.997 10.288 1401 2HB MET 82 HB3 MET 82 -4.285 -8.940 10.894 1402 1HG MET 82 HG2 MET 82 -4.162 -11.187 11.706 1403 2HG MET 82 HG3 MET 82 -2.689 -11.519 10.788 1404 1HE MET 82 HE1 MET 82 -4.186 -9.467 13.797 1405 2HE MET 82 HE2 MET 82 -2.710 -8.777 14.511 1406 3HE MET 82 HE3 MET 82 -3.271 -8.206 12.928 1407 H ILE 83 H ILE 83 -6.433 -9.101 8.913 1408 HA ILE 83 HA ILE 83 -7.893 -11.498 9.588 1409 HB ILE 83 HB ILE 83 -8.723 -8.798 8.512 1410 1HG1 ILE 83 HG12 ILE 83 -9.353 -10.151 11.171 1411 2HG1 ILE 83 HG13 ILE 83 -7.888 -9.201 10.945 1412 1HG2 ILE 83 HG21 ILE 83 -10.512 -11.158 9.218 1413 2HG2 ILE 83 HG22 ILE 83 -11.081 -9.498 8.960 1414 3HG2 ILE 83 HG23 ILE 83 -10.362 -10.383 7.626 1415 1HD1 ILE 83 HD11 ILE 83 -10.728 -8.135 10.685 1416 2HD1 ILE 83 HD12 ILE 83 -9.565 -7.817 11.978 1417 3HD1 ILE 83 HD13 ILE 83 -9.248 -7.209 10.346 1418 H TYR 84 H TYR 84 -7.114 -9.913 6.433 1419 HA TYR 84 HA TYR 84 -8.422 -11.818 4.741 1420 1HB TYR 84 HB2 TYR 84 -5.777 -10.338 4.357 1421 2HB TYR 84 HB3 TYR 84 -6.505 -11.399 3.171 1422 HD1 TYR 84 HD1 TYR 84 -9.005 -9.323 4.891 1423 HD2 TYR 84 HD2 TYR 84 -6.097 -9.436 1.697 1424 HE1 TYR 84 HE1 TYR 84 -10.139 -7.441 3.774 1425 HE2 TYR 84 HE2 TYR 84 -7.290 -7.607 0.552 1426 HH TYR 84 HH TYR 84 -9.064 -6.127 0.619 1427 H ASN 85 H ASN 85 -5.222 -11.768 6.262 1428 HA ASN 85 HA ASN 85 -4.000 -13.295 7.268 1429 1HB ASN 85 HB2 ASN 85 -6.350 -14.094 8.040 1430 2HB ASN 85 HB3 ASN 85 -6.128 -15.437 6.920 1431 1HD2 ASN 85 HD22 ASN 85 -4.668 -13.679 9.644 1432 2HD2 ASN 85 HD21 ASN 85 -3.780 -15.058 10.314 1433 H GLU 86 H GLU 86 -5.660 -15.115 4.681 1434 HA GLU 86 HA GLU 86 -3.545 -16.854 4.004 1435 1HB GLU 86 HB2 GLU 86 -5.869 -17.060 3.164 1436 2HB GLU 86 HB3 GLU 86 -5.653 -15.610 2.173 1437 1HG GLU 86 HG2 GLU 86 -5.412 -17.676 0.843 1438 2HG GLU 86 HG3 GLU 86 -3.911 -16.747 0.843 1439 H ALA 87 H ALA 87 -4.278 -13.567 2.901 1440 HA ALA 87 HA ALA 87 -2.269 -13.052 1.066 1441 1HB ALA 87 HB1 ALA 87 -3.242 -11.201 3.282 1442 2HB ALA 87 HB2 ALA 87 -2.446 -10.723 1.764 1443 3HB ALA 87 HB3 ALA 87 -4.052 -11.469 1.720 1444 H LEU 88 H LEU 88 -1.943 -13.133 4.672 1445 HA LEU 88 HA LEU 88 0.783 -12.134 4.633 1446 1HB LEU 88 HB2 LEU 88 -0.605 -13.713 6.831 1447 2HB LEU 88 HB3 LEU 88 0.889 -12.787 6.931 1448 HG LEU 88 HG LEU 88 -1.951 -11.768 6.748 1449 1HD1 LEU 88 HD11 LEU 88 -0.994 -12.225 8.967 1450 2HD1 LEU 88 HD12 LEU 88 0.451 -11.265 8.582 1451 3HD1 LEU 88 HD13 LEU 88 -1.110 -10.464 8.749 1452 1HD2 LEU 88 HD21 LEU 88 -1.067 -9.479 6.552 1453 2HD2 LEU 88 HD22 LEU 88 0.563 -10.120 6.243 1454 3HD2 LEU 88 HD23 LEU 88 -0.768 -10.408 5.092 1455 H LYS 89 H LYS 89 -0.685 -15.271 4.107 1456 HA LYS 89 HA LYS 89 1.801 -16.754 4.642 1457 1HB LYS 89 HB2 LYS 89 -0.658 -17.730 3.149 1458 2HB LYS 89 HB3 LYS 89 0.613 -18.675 3.931 1459 1HG LYS 89 HG2 LYS 89 -0.101 -17.687 6.146 1460 2HG LYS 89 HG3 LYS 89 -1.437 -16.878 5.312 1461 1HD LYS 89 HD2 LYS 89 -2.126 -19.222 4.465 1462 2HD LYS 89 HD3 LYS 89 -1.031 -19.856 5.704 1463 1HE LYS 89 HE2 LYS 89 -3.452 -18.025 6.111 1464 2HE LYS 89 HE3 LYS 89 -3.325 -19.719 6.594 1465 1HZ LYS 89 HZ1 LYS 89 -3.008 -18.138 8.382 1466 2HZ LYS 89 HZ2 LYS 89 -1.674 -19.098 8.180 1467 3HZ LYS 89 HZ3 LYS 89 -1.669 -17.534 7.653 1468 H GLY 90 H GLY 90 -0.221 -15.805 1.833 1469 1HA GLY 90 HA2 GLY 90 2.091 -14.943 0.323 1470 2HA GLY 90 HA3 GLY 90 1.368 -16.428 -0.335 Start of MODEL 10 1 1H MET 1 H1 MET 1 -11.893 -0.871 -8.270 2 2H MET 1 H2 MET 1 -13.423 -0.314 -8.571 3 3H MET 1 H3 MET 1 -13.072 -1.926 -8.724 4 HA MET 1 HA MET 1 -12.989 -0.399 -6.241 5 1HB MET 1 HB2 MET 1 -15.089 -2.267 -7.400 6 2HB MET 1 HB3 MET 1 -14.938 -1.999 -5.657 7 1HG MET 1 HG2 MET 1 -16.618 -0.524 -6.556 8 2HG MET 1 HG3 MET 1 -15.253 0.396 -5.921 9 1HE MET 1 HE1 MET 1 -16.554 2.773 -8.660 10 2HE MET 1 HE2 MET 1 -17.485 1.775 -7.516 11 3HE MET 1 HE3 MET 1 -16.004 2.602 -6.975 12 H ALA 2 H ALA 2 -12.473 -1.535 -4.446 13 HA ALA 2 HA ALA 2 -11.362 -2.837 -3.058 14 1HB ALA 2 HB1 ALA 2 -11.997 -5.156 -4.939 15 2HB ALA 2 HB2 ALA 2 -11.558 -5.245 -3.224 16 3HB ALA 2 HB3 ALA 2 -13.090 -4.502 -3.705 17 H SER 3 H SER 3 -10.584 -4.033 -6.211 18 HA SER 3 HA SER 3 -8.022 -4.908 -6.018 19 1HB SER 3 HB2 SER 3 -7.819 -4.237 -8.486 20 2HB SER 3 HB3 SER 3 -9.042 -5.404 -7.974 21 HG SER 3 HG SER 3 -10.613 -3.730 -8.045 22 HA PRO 4 HA PRO 4 -6.082 -0.592 -6.820 23 1HB PRO 4 HB2 PRO 4 -7.996 1.163 -5.272 24 2HB PRO 4 HB3 PRO 4 -7.013 1.578 -6.704 25 1HG PRO 4 HG2 PRO 4 -9.662 1.076 -6.987 26 2HG PRO 4 HG3 PRO 4 -8.505 0.348 -8.146 27 1HD PRO 4 HD2 PRO 4 -9.706 -0.918 -5.674 28 2HD PRO 4 HD3 PRO 4 -9.670 -1.546 -7.340 29 H LEU 5 H LEU 5 -7.914 -1.128 -3.748 30 HA LEU 5 HA LEU 5 -5.566 -0.204 -2.234 31 1HB LEU 5 HB2 LEU 5 -7.811 0.295 -1.363 32 2HB LEU 5 HB3 LEU 5 -8.160 -1.439 -1.252 33 HG LEU 5 HG LEU 5 -6.304 -1.724 0.378 34 1HD1 LEU 5 HD11 LEU 5 -5.279 0.286 1.398 35 2HD1 LEU 5 HD12 LEU 5 -4.747 0.074 -0.261 36 3HD1 LEU 5 HD13 LEU 5 -5.974 1.309 0.124 37 1HD2 LEU 5 HD21 LEU 5 -8.548 -1.204 1.226 38 2HD2 LEU 5 HD22 LEU 5 -7.270 -0.520 2.248 39 3HD2 LEU 5 HD23 LEU 5 -8.170 0.542 1.140 40 H ASP 6 H ASP 6 -7.336 -3.204 -2.982 41 HA ASP 6 HA ASP 6 -5.976 -5.034 -1.406 42 1HB ASP 6 HB2 ASP 6 -6.895 -5.504 -4.259 43 2HB ASP 6 HB3 ASP 6 -6.508 -6.749 -3.075 44 H GLN 7 H GLN 7 -4.956 -3.851 -4.696 45 HA GLN 7 HA GLN 7 -2.656 -5.550 -4.736 46 1HB GLN 7 HB2 GLN 7 -1.880 -4.266 -6.594 47 2HB GLN 7 HB3 GLN 7 -3.627 -4.504 -6.716 48 1HG GLN 7 HG2 GLN 7 -3.828 -2.160 -5.631 49 2HG GLN 7 HG3 GLN 7 -2.106 -1.964 -5.971 50 1HE2 GLN 7 HE21 GLN 7 -5.220 -2.852 -7.479 51 2HE2 GLN 7 HE22 GLN 7 -4.859 -2.155 -9.067 52 H ALA 8 H ALA 8 -3.181 -2.397 -3.166 53 HA ALA 8 HA ALA 8 -0.342 -1.844 -2.853 54 1HB ALA 8 HB1 ALA 8 -1.122 -0.039 -1.368 55 2HB ALA 8 HB2 ALA 8 -1.863 -0.024 -2.979 56 3HB ALA 8 HB3 ALA 8 -2.795 -0.593 -1.573 57 H ILE 9 H ILE 9 -2.999 -2.969 -0.640 58 HA ILE 9 HA ILE 9 -1.161 -3.510 1.536 59 HB ILE 9 HB ILE 9 -2.860 -4.909 2.529 60 1HG1 ILE 9 HG12 ILE 9 -4.590 -4.241 0.135 61 2HG1 ILE 9 HG13 ILE 9 -3.927 -5.843 0.503 62 1HG2 ILE 9 HG21 ILE 9 -2.716 -2.419 2.803 63 2HG2 ILE 9 HG22 ILE 9 -3.941 -2.241 1.530 64 3HG2 ILE 9 HG23 ILE 9 -4.336 -3.055 3.058 65 1HD1 ILE 9 HD11 ILE 9 -6.192 -5.810 1.267 66 2HD1 ILE 9 HD12 ILE 9 -5.159 -5.773 2.713 67 3HD1 ILE 9 HD13 ILE 9 -5.971 -4.296 2.153 68 H GLY 10 H GLY 10 -2.305 -5.437 -1.220 69 1HA GLY 10 HA2 GLY 10 -0.972 -7.845 -0.895 70 2HA GLY 10 HA3 GLY 10 -1.239 -7.017 -2.436 71 H LEU 11 H LEU 11 0.364 -4.770 -2.257 72 HA LEU 11 HA LEU 11 2.923 -5.713 -2.851 73 1HB LEU 11 HB2 LEU 11 1.755 -3.445 -3.389 74 2HB LEU 11 HB3 LEU 11 2.325 -2.910 -1.817 75 HG LEU 11 HG LEU 11 3.782 -2.058 -3.457 76 1HD1 LEU 11 HD11 LEU 11 5.316 -4.384 -2.298 77 2HD1 LEU 11 HD12 LEU 11 5.919 -2.792 -2.774 78 3HD1 LEU 11 HD13 LEU 11 4.851 -2.933 -1.366 79 1HD2 LEU 11 HD21 LEU 11 4.959 -3.340 -5.114 80 2HD2 LEU 11 HD22 LEU 11 4.179 -4.842 -4.570 81 3HD2 LEU 11 HD23 LEU 11 3.203 -3.530 -5.278 82 H LEU 12 H LEU 12 1.965 -3.879 0.070 83 HA LEU 12 HA LEU 12 4.308 -4.125 1.607 84 1HB LEU 12 HB2 LEU 12 1.327 -4.143 2.341 85 2HB LEU 12 HB3 LEU 12 2.590 -4.016 3.558 86 HG LEU 12 HG LEU 12 2.713 -2.055 1.267 87 1HD1 LEU 12 HD11 LEU 12 0.346 -1.904 1.759 88 2HD1 LEU 12 HD12 LEU 12 0.655 -1.892 3.510 89 3HD1 LEU 12 HD13 LEU 12 1.159 -0.524 2.494 90 1HD2 LEU 12 HD21 LEU 12 3.539 -0.625 3.040 91 2HD2 LEU 12 HD22 LEU 12 3.040 -1.787 4.282 92 3HD2 LEU 12 HD23 LEU 12 4.358 -2.210 3.165 93 H ILE 13 H ILE 13 1.545 -6.362 1.426 94 HA ILE 13 HA ILE 13 2.475 -8.237 3.359 95 HB ILE 13 HB ILE 13 0.581 -8.330 0.975 96 1HG1 ILE 13 HG12 ILE 13 0.040 -7.114 3.223 97 2HG1 ILE 13 HG13 ILE 13 -1.182 -8.121 2.434 98 1HG2 ILE 13 HG21 ILE 13 1.316 -10.598 1.025 99 2HG2 ILE 13 HG22 ILE 13 1.174 -10.675 2.792 100 3HG2 ILE 13 HG23 ILE 13 -0.271 -10.504 1.769 101 1HD1 ILE 13 HD11 ILE 13 0.626 -9.120 4.654 102 2HD1 ILE 13 HD12 ILE 13 -1.004 -8.475 4.914 103 3HD1 ILE 13 HD13 ILE 13 -0.808 -9.938 3.965 104 H GLY 14 H GLY 14 2.654 -8.275 -0.197 105 1HA GLY 14 HA2 GLY 14 4.001 -10.704 -0.548 106 2HA GLY 14 HA3 GLY 14 4.006 -9.331 -1.676 107 H ILE 15 H ILE 15 5.291 -7.324 -0.211 108 HA ILE 15 HA ILE 15 8.044 -8.055 -0.475 109 HB ILE 15 HB ILE 15 6.485 -5.722 0.613 110 1HG1 ILE 15 HG12 ILE 15 8.780 -6.100 -1.379 111 2HG1 ILE 15 HG13 ILE 15 7.061 -5.958 -1.773 112 1HG2 ILE 15 HG21 ILE 15 8.541 -4.610 1.409 113 2HG2 ILE 15 HG22 ILE 15 8.101 -5.992 2.374 114 3HG2 ILE 15 HG23 ILE 15 9.429 -6.141 1.196 115 1HD1 ILE 15 HD11 ILE 15 8.869 -3.805 -0.603 116 2HD1 ILE 15 HD12 ILE 15 8.091 -3.835 -2.189 117 3HD1 ILE 15 HD13 ILE 15 7.108 -3.655 -0.713 118 H PHE 16 H PHE 16 6.017 -7.600 2.468 119 HA PHE 16 HA PHE 16 8.045 -8.233 4.257 120 1HB PHE 16 HB2 PHE 16 5.769 -7.319 4.778 121 2HB PHE 16 HB3 PHE 16 5.086 -8.922 4.575 122 HD1 PHE 16 HD1 PHE 16 5.732 -10.775 6.196 123 HD2 PHE 16 HD2 PHE 16 7.254 -6.779 6.659 124 HE1 PHE 16 HE1 PHE 16 6.378 -11.273 8.485 125 HE2 PHE 16 HE2 PHE 16 7.713 -7.229 9.056 126 HZ PHE 16 HZ PHE 16 7.196 -9.434 10.009 127 H HIS 17 H HIS 17 5.618 -10.475 2.847 128 HA HIS 17 HA HIS 17 6.657 -12.743 4.268 129 1HB HIS 17 HB2 HIS 17 4.646 -12.525 2.016 130 2HB HIS 17 HB3 HIS 17 5.080 -14.041 2.823 131 HD1 HIS 17 HD1 HIS 17 3.579 -10.619 3.726 132 HD2 HIS 17 HD2 HIS 17 4.251 -14.441 5.328 133 HE1 HIS 17 HE1 HIS 17 2.566 -10.618 6.079 134 H LYS 18 H LYS 18 7.438 -11.370 1.065 135 HA LYS 18 HA LYS 18 8.925 -13.614 0.096 136 1HB LYS 18 HB2 LYS 18 8.392 -11.592 -1.216 137 2HB LYS 18 HB3 LYS 18 9.493 -10.635 -0.201 138 1HG LYS 18 HG2 LYS 18 11.317 -12.336 -0.955 139 2HG LYS 18 HG3 LYS 18 10.158 -12.820 -2.194 140 1HD LYS 18 HD2 LYS 18 11.350 -10.029 -1.752 141 2HD LYS 18 HD3 LYS 18 11.786 -11.181 -3.011 142 1HE LYS 18 HE2 LYS 18 10.420 -9.651 -4.125 143 2HE LYS 18 HE3 LYS 18 9.340 -11.025 -3.832 144 1HZ LYS 18 HZ1 LYS 18 9.505 -8.549 -2.246 145 2HZ LYS 18 HZ2 LYS 18 8.340 -8.907 -3.352 146 3HZ LYS 18 HZ3 LYS 18 8.452 -9.783 -1.965 147 H TYR 19 H TYR 19 9.902 -10.787 2.108 148 HA TYR 19 HA TYR 19 12.567 -11.778 2.529 149 1HB TYR 19 HB2 TYR 19 10.924 -9.611 3.795 150 2HB TYR 19 HB3 TYR 19 12.532 -10.016 4.414 151 HD1 TYR 19 HD1 TYR 19 10.746 -8.263 1.770 152 HD2 TYR 19 HD2 TYR 19 14.555 -9.887 2.917 153 HE1 TYR 19 HE1 TYR 19 11.665 -7.593 -0.407 154 HE2 TYR 19 HE2 TYR 19 15.542 -9.004 0.823 155 HH TYR 19 HH TYR 19 13.550 -7.486 -1.742 156 H SER 20 H SER 20 9.725 -11.842 4.842 157 HA SER 20 HA SER 20 10.960 -13.393 6.798 158 1HB SER 20 HB2 SER 20 8.099 -13.654 5.779 159 2HB SER 20 HB3 SER 20 8.698 -14.136 7.369 160 HG SER 20 HG SER 20 8.920 -12.120 7.963 161 H GLY 21 H GLY 21 9.316 -14.549 3.817 162 1HA GLY 21 HA2 GLY 21 9.561 -17.299 4.095 163 2HA GLY 21 HA3 GLY 21 9.567 -16.411 2.560 164 H LYS 22 H LYS 22 11.948 -14.966 2.723 165 HA LYS 22 HA LYS 22 13.922 -16.671 1.823 166 1HB LYS 22 HB2 LYS 22 13.911 -14.139 1.766 167 2HB LYS 22 HB3 LYS 22 14.440 -14.171 3.458 168 1HG LYS 22 HG2 LYS 22 16.498 -15.315 2.905 169 2HG LYS 22 HG3 LYS 22 15.991 -15.471 1.216 170 1HD LYS 22 HD2 LYS 22 17.581 -13.646 1.491 171 2HD LYS 22 HD3 LYS 22 15.999 -13.020 0.962 172 1HE LYS 22 HE2 LYS 22 15.517 -12.224 3.200 173 2HE LYS 22 HE3 LYS 22 17.014 -12.956 3.825 174 1HZ LYS 22 HZ1 LYS 22 17.269 -10.624 3.392 175 2HZ LYS 22 HZ2 LYS 22 18.233 -11.491 2.376 176 3HZ LYS 22 HZ3 LYS 22 16.839 -10.817 1.813 177 H GLU 23 H GLU 23 13.318 -15.714 5.217 178 HA GLU 23 HA GLU 23 15.539 -17.494 6.115 179 1HB GLU 23 HB2 GLU 23 15.359 -16.317 8.261 180 2HB GLU 23 HB3 GLU 23 15.769 -15.265 6.903 181 1HG GLU 23 HG2 GLU 23 13.440 -14.466 6.781 182 2HG GLU 23 HG3 GLU 23 12.971 -15.560 8.089 183 H GLY 24 H GLY 24 12.597 -18.207 5.249 184 1HA GLY 24 HA2 GLY 24 11.052 -19.750 5.846 185 2HA GLY 24 HA3 GLY 24 12.255 -20.418 6.957 186 H ASP 25 H ASP 25 10.938 -17.118 7.189 187 HA ASP 25 HA ASP 25 9.424 -17.874 9.658 188 1HB ASP 25 HB2 ASP 25 11.341 -16.216 9.875 189 2HB ASP 25 HB3 ASP 25 10.400 -15.095 8.888 190 H LYS 26 H LYS 26 7.344 -16.702 9.834 191 HA LYS 26 HA LYS 26 5.991 -16.531 7.157 192 1HB LYS 26 HB2 LYS 26 4.902 -17.235 9.911 193 2HB LYS 26 HB3 LYS 26 3.926 -16.992 8.446 194 1HG LYS 26 HG2 LYS 26 5.193 -18.811 7.318 195 2HG LYS 26 HG3 LYS 26 6.117 -19.082 8.809 196 1HD LYS 26 HD2 LYS 26 4.010 -19.584 10.028 197 2HD LYS 26 HD3 LYS 26 3.079 -19.302 8.543 198 1HE LYS 26 HE2 LYS 26 4.301 -21.165 7.427 199 2HE LYS 26 HE3 LYS 26 5.228 -21.447 8.914 200 1HZ LYS 26 HZ1 LYS 26 3.176 -21.948 10.023 201 2HZ LYS 26 HZ2 LYS 26 2.314 -21.684 8.643 202 3HZ LYS 26 HZ3 LYS 26 3.385 -22.933 8.720 203 H HIS 27 H HIS 27 4.669 -15.257 10.152 204 HA HIS 27 HA HIS 27 4.329 -12.664 8.763 205 1HB HIS 27 HB2 HIS 27 2.989 -13.638 11.292 206 2HB HIS 27 HB3 HIS 27 2.458 -12.361 10.187 207 HD1 HIS 27 HD1 HIS 27 2.648 -13.944 7.431 208 HD2 HIS 27 HD2 HIS 27 1.239 -15.542 11.069 209 HE1 HIS 27 HE1 HIS 27 1.347 -16.076 6.858 210 H THR 28 H THR 28 6.939 -13.337 9.979 211 HA THR 28 HA THR 28 7.317 -10.951 11.552 212 HB THR 28 HB THR 28 7.756 -13.710 12.735 213 HG1 THR 28 HG1 THR 28 5.774 -12.170 12.875 214 1HG2 THR 28 HG21 THR 28 9.785 -12.420 13.216 215 2HG2 THR 28 HG22 THR 28 8.795 -11.035 13.760 216 3HG2 THR 28 HG23 THR 28 8.787 -12.558 14.671 217 H LEU 29 H LEU 29 9.595 -10.345 11.521 218 HA LEU 29 HA LEU 29 11.190 -11.693 9.388 219 1HB LEU 29 HB2 LEU 29 9.380 -10.032 8.652 220 2HB LEU 29 HB3 LEU 29 10.349 -8.761 9.384 221 HG LEU 29 HG LEU 29 11.198 -10.617 7.100 222 1HD1 LEU 29 HD11 LEU 29 10.008 -7.808 7.132 223 2HD1 LEU 29 HD12 LEU 29 10.739 -8.563 5.714 224 3HD1 LEU 29 HD13 LEU 29 9.288 -9.278 6.432 225 1HD2 LEU 29 HD21 LEU 29 12.865 -8.785 6.654 226 2HD2 LEU 29 HD22 LEU 29 12.383 -8.023 8.183 227 3HD2 LEU 29 HD23 LEU 29 13.154 -9.628 8.181 228 H SER 30 H SER 30 13.408 -11.489 9.837 229 HA SER 30 HA SER 30 14.107 -10.278 12.374 230 1HB SER 30 HB2 SER 30 15.069 -12.444 11.421 231 2HB SER 30 HB3 SER 30 16.072 -11.424 10.370 232 HG SER 30 HG SER 30 15.972 -11.550 13.206 233 H LYS 31 H LYS 31 16.105 -8.950 12.650 234 HA LYS 31 HA LYS 31 15.411 -6.447 11.468 235 1HB LYS 31 HB2 LYS 31 17.037 -5.458 12.935 236 2HB LYS 31 HB3 LYS 31 15.930 -6.573 13.729 237 1HG LYS 31 HG2 LYS 31 17.776 -8.291 13.833 238 2HG LYS 31 HG3 LYS 31 18.852 -7.111 13.052 239 1HD LYS 31 HD2 LYS 31 19.323 -6.911 15.359 240 2HD LYS 31 HD3 LYS 31 18.332 -5.506 14.948 241 1HE LYS 31 HE2 LYS 31 16.304 -6.906 15.815 242 2HE LYS 31 HE3 LYS 31 17.506 -8.040 16.428 243 1HZ LYS 31 HZ1 LYS 31 17.347 -5.193 17.115 244 2HZ LYS 31 HZ2 LYS 31 16.729 -6.421 18.010 245 3HZ LYS 31 HZ3 LYS 31 18.369 -6.305 17.790 246 H LYS 32 H LYS 32 18.518 -8.294 11.152 247 HA LYS 32 HA LYS 32 19.624 -6.373 9.317 248 1HB LYS 32 HB2 LYS 32 20.986 -7.973 10.545 249 2HB LYS 32 HB3 LYS 32 20.259 -9.331 9.652 250 1HG LYS 32 HG2 LYS 32 21.200 -8.435 7.537 251 2HG LYS 32 HG3 LYS 32 21.838 -7.030 8.414 252 1HD LYS 32 HD2 LYS 32 23.297 -8.521 9.761 253 2HD LYS 32 HD3 LYS 32 22.590 -9.940 8.974 254 1HE LYS 32 HE2 LYS 32 24.758 -9.437 7.976 255 2HE LYS 32 HE3 LYS 32 23.476 -9.197 6.780 256 1HZ LYS 32 HZ1 LYS 32 23.612 -6.849 7.201 257 2HZ LYS 32 HZ2 LYS 32 24.778 -7.073 8.345 258 3HZ LYS 32 HZ3 LYS 32 25.089 -7.434 6.767 259 H GLU 33 H GLU 33 17.527 -9.210 8.934 260 HA GLU 33 HA GLU 33 17.534 -9.233 6.076 261 1HB GLU 33 HB2 GLU 33 16.745 -11.123 7.446 262 2HB GLU 33 HB3 GLU 33 15.356 -10.159 7.987 263 1HG GLU 33 HG2 GLU 33 14.617 -9.921 5.605 264 2HG GLU 33 HG3 GLU 33 16.049 -10.820 5.092 265 H LEU 34 H LEU 34 15.412 -7.555 8.481 266 HA LEU 34 HA LEU 34 13.772 -6.185 6.663 267 1HB LEU 34 HB2 LEU 34 13.278 -6.121 8.993 268 2HB LEU 34 HB3 LEU 34 14.810 -5.405 9.411 269 HG LEU 34 HG LEU 34 12.944 -3.885 9.594 270 1HD1 LEU 34 HD11 LEU 34 14.101 -1.982 8.919 271 2HD1 LEU 34 HD12 LEU 34 15.392 -3.176 8.968 272 3HD1 LEU 34 HD13 LEU 34 14.673 -2.705 7.427 273 1HD2 LEU 34 HD21 LEU 34 11.569 -4.692 7.717 274 2HD2 LEU 34 HD22 LEU 34 11.834 -2.944 7.596 275 3HD2 LEU 34 HD23 LEU 34 12.742 -4.041 6.557 276 H LYS 35 H LYS 35 17.071 -5.296 7.910 277 HA LYS 35 HA LYS 35 17.227 -2.945 6.371 278 1HB LYS 35 HB2 LYS 35 18.891 -3.649 8.113 279 2HB LYS 35 HB3 LYS 35 19.641 -4.722 6.908 280 1HG LYS 35 HG2 LYS 35 19.998 -2.793 5.402 281 2HG LYS 35 HG3 LYS 35 19.160 -1.737 6.553 282 1HD LYS 35 HD2 LYS 35 20.960 -2.387 8.256 283 2HD LYS 35 HD3 LYS 35 21.856 -3.099 6.904 284 1HE LYS 35 HE2 LYS 35 20.936 -0.190 7.195 285 2HE LYS 35 HE3 LYS 35 22.604 -0.782 7.313 286 1HZ LYS 35 HZ1 LYS 35 20.928 -0.846 4.907 287 2HZ LYS 35 HZ2 LYS 35 22.189 0.169 5.193 288 3HZ LYS 35 HZ3 LYS 35 22.460 -1.446 5.017 289 H GLU 36 H GLU 36 18.035 -6.309 5.386 290 HA GLU 36 HA GLU 36 18.825 -5.684 2.746 291 1HB GLU 36 HB2 GLU 36 18.657 -8.005 4.154 292 2HB GLU 36 HB3 GLU 36 17.262 -8.229 3.086 293 1HG GLU 36 HG2 GLU 36 20.149 -7.662 2.269 294 2HG GLU 36 HG3 GLU 36 19.301 -9.202 2.130 295 H LEU 37 H LEU 37 15.539 -6.431 3.987 296 HA LEU 37 HA LEU 37 14.045 -6.118 1.636 297 1HB LEU 37 HB2 LEU 37 13.079 -6.903 3.736 298 2HB LEU 37 HB3 LEU 37 13.338 -5.368 4.520 299 HG LEU 37 HG LEU 37 11.470 -5.600 2.163 300 1HD1 LEU 37 HD11 LEU 37 9.651 -5.706 3.929 301 2HD1 LEU 37 HD12 LEU 37 10.667 -7.148 3.890 302 3HD1 LEU 37 HD13 LEU 37 10.905 -5.919 5.154 303 1HD2 LEU 37 HD21 LEU 37 10.365 -3.648 3.314 304 2HD2 LEU 37 HD22 LEU 37 11.714 -3.579 4.456 305 3HD2 LEU 37 HD23 LEU 37 11.966 -3.243 2.727 306 H ILE 38 H ILE 38 15.066 -3.571 3.954 307 HA ILE 38 HA ILE 38 13.926 -1.477 2.390 308 HB ILE 38 HB ILE 38 16.143 -1.476 4.463 309 1HG1 ILE 38 HG12 ILE 38 13.189 -0.656 4.457 310 2HG1 ILE 38 HG13 ILE 38 13.863 -2.107 5.202 311 1HG2 ILE 38 HG21 ILE 38 16.009 0.937 4.557 312 2HG2 ILE 38 HG22 ILE 38 16.430 0.504 2.913 313 3HG2 ILE 38 HG23 ILE 38 14.766 0.982 3.302 314 1HD1 ILE 38 HD11 ILE 38 15.269 -0.564 6.665 315 2HD1 ILE 38 HD12 ILE 38 14.271 0.769 6.019 316 3HD1 ILE 38 HD13 ILE 38 13.506 -0.560 6.917 317 H GLN 39 H GLN 39 17.345 -2.620 2.473 318 HA GLN 39 HA GLN 39 18.190 -0.747 0.540 319 1HB GLN 39 HB2 GLN 39 19.280 -3.555 1.098 320 2HB GLN 39 HB3 GLN 39 20.110 -2.327 0.138 321 1HG GLN 39 HG2 GLN 39 19.496 -2.184 3.113 322 2HG GLN 39 HG3 GLN 39 21.070 -2.339 2.342 323 1HE2 GLN 39 HE22 GLN 39 18.680 -0.151 3.524 324 2HE2 GLN 39 HE21 GLN 39 19.459 1.315 2.954 325 H LYS 40 H LYS 40 16.668 -3.943 0.033 326 HA LYS 40 HA LYS 40 17.158 -3.760 -2.836 327 1HB LYS 40 HB2 LYS 40 17.010 -5.901 -1.432 328 2HB LYS 40 HB3 LYS 40 15.290 -5.601 -1.281 329 1HG LYS 40 HG2 LYS 40 15.713 -7.224 -3.049 330 2HG LYS 40 HG3 LYS 40 15.007 -5.765 -3.734 331 1HD LYS 40 HD2 LYS 40 16.843 -6.751 -5.101 332 2HD LYS 40 HD3 LYS 40 17.141 -5.074 -4.662 333 1HE LYS 40 HE2 LYS 40 19.168 -6.513 -4.463 334 2HE LYS 40 HE3 LYS 40 18.745 -5.755 -2.926 335 1HZ LYS 40 HZ1 LYS 40 19.297 -8.059 -2.679 336 2HZ LYS 40 HZ2 LYS 40 17.732 -7.802 -2.249 337 3HZ LYS 40 HZ3 LYS 40 18.080 -8.512 -3.696 338 H GLU 41 H GLU 41 14.216 -3.494 -0.750 339 HA GLU 41 HA GLU 41 12.588 -2.989 -3.128 340 1HB GLU 41 HB2 GLU 41 11.788 -2.879 -0.194 341 2HB GLU 41 HB3 GLU 41 10.733 -2.980 -1.609 342 1HG GLU 41 HG2 GLU 41 12.680 -5.128 -0.629 343 2HG GLU 41 HG3 GLU 41 10.928 -5.158 -0.492 344 H LEU 42 H LEU 42 13.751 -1.111 -0.298 345 HA LEU 42 HA LEU 42 12.496 1.357 -1.401 346 1HB LEU 42 HB2 LEU 42 13.816 0.772 1.261 347 2HB LEU 42 HB3 LEU 42 13.401 2.383 0.687 348 HG LEU 42 HG LEU 42 11.008 1.775 0.590 349 1HD1 LEU 42 HD11 LEU 42 10.824 -0.545 0.287 350 2HD1 LEU 42 HD12 LEU 42 12.032 -0.916 1.531 351 3HD1 LEU 42 HD13 LEU 42 10.438 -0.364 2.007 352 1HD2 LEU 42 HD21 LEU 42 10.657 1.783 3.012 353 2HD2 LEU 42 HD22 LEU 42 12.326 1.245 3.281 354 3HD2 LEU 42 HD23 LEU 42 12.005 2.845 2.583 355 H THR 43 H THR 43 14.060 0.686 -3.268 356 HA THR 43 HA THR 43 16.772 0.461 -2.893 357 HB THR 43 HB THR 43 15.634 1.460 -5.499 358 HG1 THR 43 HG1 THR 43 15.062 -1.088 -4.434 359 1HG2 THR 43 HG21 THR 43 16.996 -0.370 -6.398 360 2HG2 THR 43 HG22 THR 43 17.995 0.684 -5.376 361 3HG2 THR 43 HG23 THR 43 17.435 -0.888 -4.757 362 H ILE 44 H ILE 44 17.149 2.231 -1.436 363 HA ILE 44 HA ILE 44 16.894 4.849 -1.703 364 HB ILE 44 HB ILE 44 19.499 3.720 -0.614 365 1HG1 ILE 44 HG12 ILE 44 16.728 3.674 0.640 366 2HG1 ILE 44 HG13 ILE 44 17.820 2.301 0.338 367 1HG2 ILE 44 HG21 ILE 44 17.809 6.068 0.335 368 2HG2 ILE 44 HG22 ILE 44 19.426 5.597 0.914 369 3HG2 ILE 44 HG23 ILE 44 19.232 6.224 -0.707 370 1HD1 ILE 44 HD11 ILE 44 18.220 4.467 2.406 371 2HD1 ILE 44 HD12 ILE 44 17.852 2.755 2.644 372 3HD1 ILE 44 HD13 ILE 44 19.433 3.232 1.976 373 H GLY 45 H GLY 45 19.670 3.138 -3.088 374 1HA GLY 45 HA2 GLY 45 21.169 3.801 -4.760 375 2HA GLY 45 HA3 GLY 45 20.273 5.312 -4.986 376 H SER 46 H SER 46 20.342 6.749 -2.785 377 HA SER 46 HA SER 46 23.141 7.290 -2.150 378 1HB SER 46 HB2 SER 46 21.884 9.039 -0.658 379 2HB SER 46 HB3 SER 46 21.850 9.187 -2.423 380 HG SER 46 HG SER 46 19.753 9.384 -1.583 381 H LYS 47 H LYS 47 23.123 4.874 -1.435 382 HA LYS 47 HA LYS 47 21.898 4.121 1.012 383 1HB LYS 47 HB2 LYS 47 24.214 2.923 -0.559 384 2HB LYS 47 HB3 LYS 47 23.457 2.154 0.851 385 1HG LYS 47 HG2 LYS 47 21.268 2.220 -0.236 386 2HG LYS 47 HG3 LYS 47 21.972 2.934 -1.704 387 1HD LYS 47 HD2 LYS 47 23.392 0.934 -2.012 388 2HD LYS 47 HD3 LYS 47 22.738 0.228 -0.526 389 1HE LYS 47 HE2 LYS 47 21.166 0.838 -3.080 390 2HE LYS 47 HE3 LYS 47 21.632 -0.755 -2.462 391 1HZ LYS 47 HZ1 LYS 47 20.328 -0.194 -0.466 392 2HZ LYS 47 HZ2 LYS 47 19.729 1.115 -1.256 393 3HZ LYS 47 HZ3 LYS 47 19.423 -0.401 -1.834 394 H LEU 48 H LEU 48 24.515 6.230 0.658 395 HA LEU 48 HA LEU 48 26.069 5.746 2.975 396 1HB LEU 48 HB2 LEU 48 25.105 8.410 1.856 397 2HB LEU 48 HB3 LEU 48 26.470 8.175 2.954 398 HG LEU 48 HG LEU 48 26.302 7.148 0.078 399 1HD1 LEU 48 HD11 LEU 48 26.550 9.595 0.264 400 2HD1 LEU 48 HD12 LEU 48 27.956 9.377 1.327 401 3HD1 LEU 48 HD13 LEU 48 28.024 8.838 -0.364 402 1HD2 LEU 48 HD21 LEU 48 28.729 6.629 0.400 403 2HD2 LEU 48 HD22 LEU 48 28.556 6.983 2.132 404 3HD2 LEU 48 HD23 LEU 48 27.687 5.614 1.399 405 H GLN 49 H GLN 49 22.732 6.769 2.657 406 HA GLN 49 HA GLN 49 22.356 7.741 5.340 407 1HB GLN 49 HB2 GLN 49 20.481 6.549 3.269 408 2HB GLN 49 HB3 GLN 49 19.930 7.273 4.788 409 1HG GLN 49 HG2 GLN 49 20.780 9.433 4.220 410 2HG GLN 49 HG3 GLN 49 21.664 8.826 2.816 411 1HE2 GLN 49 HE22 GLN 49 20.378 7.821 1.033 412 2HE2 GLN 49 HE21 GLN 49 18.814 8.530 0.687 413 H ASP 50 H ASP 50 23.369 4.646 4.499 414 HA ASP 50 HA ASP 50 21.838 2.812 5.739 415 1HB ASP 50 HB2 ASP 50 23.886 1.562 6.240 416 2HB ASP 50 HB3 ASP 50 23.917 2.248 4.610 417 H ALA 51 H ALA 51 24.003 5.042 7.435 418 HA ALA 51 HA ALA 51 23.762 4.074 10.077 419 1HB ALA 51 HB1 ALA 51 23.932 6.961 9.115 420 2HB ALA 51 HB2 ALA 51 24.278 6.387 10.761 421 3HB ALA 51 HB3 ALA 51 25.301 5.864 9.404 422 H GLU 52 H GLU 52 21.566 6.208 8.233 423 HA GLU 52 HA GLU 52 19.750 6.685 10.463 424 1HB GLU 52 HB2 GLU 52 19.146 6.978 7.489 425 2HB GLU 52 HB3 GLU 52 18.359 7.767 8.858 426 1HG GLU 52 HG2 GLU 52 21.170 8.282 7.784 427 2HG GLU 52 HG3 GLU 52 19.791 9.380 7.779 428 H ILE 53 H ILE 53 19.979 4.518 7.634 429 HA ILE 53 HA ILE 53 17.507 3.193 8.062 430 HB ILE 53 HB ILE 53 20.001 1.972 6.856 431 1HG1 ILE 53 HG12 ILE 53 19.486 3.963 5.596 432 2HG1 ILE 53 HG13 ILE 53 18.957 2.559 4.690 433 1HG2 ILE 53 HG21 ILE 53 18.401 0.254 7.449 434 2HG2 ILE 53 HG22 ILE 53 17.073 1.170 6.736 435 3HG2 ILE 53 HG23 ILE 53 18.349 0.499 5.699 436 1HD1 ILE 53 HD11 ILE 53 16.594 3.006 5.471 437 2HD1 ILE 53 HD12 ILE 53 17.186 4.479 6.276 438 3HD1 ILE 53 HD13 ILE 53 17.291 4.330 4.527 439 H VAL 54 H VAL 54 20.735 2.433 9.555 440 HA VAL 54 HA VAL 54 19.559 0.175 10.900 441 HB VAL 54 HB VAL 54 21.541 0.161 12.377 442 1HG1 VAL 54 HG11 VAL 54 21.984 0.139 9.379 443 2HG1 VAL 54 HG12 VAL 54 22.976 -0.708 10.586 444 3HG1 VAL 54 HG13 VAL 54 21.291 -1.194 10.330 445 1HG2 VAL 54 HG21 VAL 54 22.617 2.299 10.559 446 2HG2 VAL 54 HG22 VAL 54 22.178 2.544 12.268 447 3HG2 VAL 54 HG23 VAL 54 23.493 1.439 11.827 448 H LYS 55 H LYS 55 19.784 3.618 11.844 449 HA LYS 55 HA LYS 55 18.768 3.193 14.496 450 1HB LYS 55 HB2 LYS 55 19.672 5.353 13.801 451 2HB LYS 55 HB3 LYS 55 18.417 5.535 12.582 452 1HG LYS 55 HG2 LYS 55 17.948 6.904 14.556 453 2HG LYS 55 HG3 LYS 55 16.675 5.738 14.242 454 1HD LYS 55 HD2 LYS 55 17.152 5.928 16.642 455 2HD LYS 55 HD3 LYS 55 17.424 4.292 16.062 456 1HE LYS 55 HE2 LYS 55 19.185 5.013 17.634 457 2HE LYS 55 HE3 LYS 55 19.876 4.672 16.047 458 1HZ LYS 55 HZ1 LYS 55 20.720 6.693 16.983 459 2HZ LYS 55 HZ2 LYS 55 19.876 7.018 15.607 460 3HZ LYS 55 HZ3 LYS 55 19.206 7.341 17.079 461 H LEU 56 H LEU 56 17.113 3.839 11.393 462 HA LEU 56 HA LEU 56 14.444 3.530 12.269 463 1HB LEU 56 HB2 LEU 56 14.849 4.561 10.250 464 2HB LEU 56 HB3 LEU 56 15.874 3.278 9.630 465 HG LEU 56 HG LEU 56 13.006 2.567 10.179 466 1HD1 LEU 56 HD11 LEU 56 12.394 3.398 7.900 467 2HD1 LEU 56 HD12 LEU 56 12.782 4.728 9.013 468 3HD1 LEU 56 HD13 LEU 56 13.964 4.211 7.788 469 1HD2 LEU 56 HD21 LEU 56 13.348 1.235 8.176 470 2HD2 LEU 56 HD22 LEU 56 14.963 1.945 7.913 471 3HD2 LEU 56 HD23 LEU 56 14.677 0.876 9.288 472 H MET 57 H MET 57 16.757 1.048 11.152 473 HA MET 57 HA MET 57 15.059 -1.211 11.206 474 1HB MET 57 HB2 MET 57 17.356 -1.188 10.236 475 2HB MET 57 HB3 MET 57 18.008 -0.984 11.869 476 1HG MET 57 HG2 MET 57 16.986 -3.188 12.507 477 2HG MET 57 HG3 MET 57 16.557 -3.401 10.812 478 1HE MET 57 HE1 MET 57 20.835 -3.478 12.554 479 2HE MET 57 HE2 MET 57 19.915 -1.961 12.517 480 3HE MET 57 HE3 MET 57 19.343 -3.324 13.510 481 H ASP 58 H ASP 58 17.224 0.183 13.732 482 HA ASP 58 HA ASP 58 16.529 -1.567 15.817 483 1HB ASP 58 HB2 ASP 58 18.395 0.051 15.907 484 2HB ASP 58 HB3 ASP 58 17.236 1.376 16.092 485 H ASP 59 H ASP 59 14.997 1.569 14.903 486 HA ASP 59 HA ASP 59 12.948 1.511 16.855 487 1HB ASP 59 HB2 ASP 59 12.770 2.622 14.018 488 2HB ASP 59 HB3 ASP 59 11.638 2.946 15.330 489 H LEU 60 H LEU 60 12.818 0.168 13.525 490 HA LEU 60 HA LEU 60 10.222 -0.945 13.677 491 1HB LEU 60 HB2 LEU 60 12.736 -1.566 12.119 492 2HB LEU 60 HB3 LEU 60 11.418 -2.725 12.044 493 HG LEU 60 HG LEU 60 10.795 0.177 11.553 494 1HD1 LEU 60 HD11 LEU 60 12.787 -0.281 10.155 495 2HD1 LEU 60 HD12 LEU 60 11.938 -1.675 9.445 496 3HD1 LEU 60 HD13 LEU 60 11.327 -0.037 9.177 497 1HD2 LEU 60 HD21 LEU 60 8.956 -1.528 11.585 498 2HD2 LEU 60 HD22 LEU 60 9.171 -0.879 9.938 499 3HD2 LEU 60 HD23 LEU 60 9.808 -2.471 10.338 500 H ASP 61 H ASP 61 13.344 -2.588 14.364 501 HA ASP 61 HA ASP 61 11.975 -4.982 15.122 502 1HB ASP 61 HB2 ASP 61 14.071 -5.921 15.692 503 2HB ASP 61 HB3 ASP 61 14.180 -5.052 14.157 504 H ARG 62 H ARG 62 13.017 -2.197 17.023 505 HA ARG 62 HA ARG 62 13.286 -3.227 19.534 506 1HB ARG 62 HB2 ARG 62 13.515 -0.852 18.930 507 2HB ARG 62 HB3 ARG 62 11.755 -0.690 18.812 508 1HG ARG 62 HG2 ARG 62 11.639 -1.317 21.282 509 2HG ARG 62 HG3 ARG 62 13.412 -1.325 21.299 510 1HD ARG 62 HD2 ARG 62 11.564 1.001 20.668 511 2HD ARG 62 HD3 ARG 62 12.568 0.829 22.110 512 HE ARG 62 HE ARG 62 14.563 0.842 20.554 513 1HH1 ARG 62 HH11 ARG 62 11.637 2.731 19.721 514 2HH1 ARG 62 HH12 ARG 62 12.486 3.623 18.477 515 1HH2 ARG 62 HH22 ARG 62 15.573 2.055 18.915 516 2HH2 ARG 62 HH21 ARG 62 14.658 3.291 18.072 517 H ASN 63 H ASN 63 10.217 -2.510 17.903 518 HA ASN 63 HA ASN 63 8.467 -2.911 20.027 519 1HB ASN 63 HB2 ASN 63 8.092 -2.074 17.572 520 2HB ASN 63 HB3 ASN 63 7.717 -3.761 17.220 521 1HD2 ASN 63 HD22 ASN 63 6.291 -4.395 19.753 522 2HD2 ASN 63 HD21 ASN 63 4.839 -3.410 19.712 523 H LYS 64 H LYS 64 10.157 -5.374 18.148 524 HA LYS 64 HA LYS 64 9.139 -7.420 20.023 525 1HB LYS 64 HB2 LYS 64 9.247 -7.828 17.011 526 2HB LYS 64 HB3 LYS 64 8.940 -9.092 18.202 527 1HG LYS 64 HG2 LYS 64 7.153 -6.657 17.743 528 2HG LYS 64 HG3 LYS 64 6.929 -8.242 17.008 529 1HD LYS 64 HD2 LYS 64 6.673 -9.292 19.227 530 2HD LYS 64 HD3 LYS 64 6.883 -7.715 20.011 531 1HE LYS 64 HE2 LYS 64 4.892 -6.840 18.818 532 2HE LYS 64 HE3 LYS 64 4.658 -8.418 18.041 533 1HZ LYS 64 HZ1 LYS 64 4.363 -9.368 20.211 534 2HZ LYS 64 HZ2 LYS 64 4.580 -7.899 20.929 535 3HZ LYS 64 HZ3 LYS 64 3.277 -8.155 19.952 536 H ASP 65 H ASP 65 11.396 -5.851 20.125 537 HA ASP 65 HA ASP 65 13.623 -5.825 20.204 538 1HB ASP 65 HB2 ASP 65 14.555 -7.688 21.618 539 2HB ASP 65 HB3 ASP 65 13.171 -6.798 22.251 540 H GLN 66 H GLN 66 13.613 -9.295 19.549 541 HA GLN 66 HA GLN 66 16.020 -9.086 17.994 542 1HB GLN 66 HB2 GLN 66 15.532 -10.972 19.453 543 2HB GLN 66 HB3 GLN 66 14.075 -11.360 18.534 544 1HG GLN 66 HG2 GLN 66 15.893 -12.909 18.053 545 2HG GLN 66 HG3 GLN 66 15.423 -12.037 16.602 546 1HE2 GLN 66 HE22 GLN 66 16.858 -10.324 15.802 547 2HE2 GLN 66 HE21 GLN 66 18.576 -10.416 16.206 548 H GLU 67 H GLU 67 12.574 -9.110 17.200 549 HA GLU 67 HA GLU 67 13.178 -9.283 14.264 550 1HB GLU 67 HB2 GLU 67 10.865 -10.578 15.770 551 2HB GLU 67 HB3 GLU 67 11.176 -10.677 14.033 552 1HG GLU 67 HG2 GLU 67 13.016 -11.877 16.155 553 2HG GLU 67 HG3 GLU 67 11.728 -12.744 15.326 554 H VAL 68 H VAL 68 11.070 -8.648 13.066 555 HA VAL 68 HA VAL 68 9.415 -6.708 14.590 556 HB VAL 68 HB VAL 68 10.874 -5.397 13.147 557 1HG1 VAL 68 HG11 VAL 68 9.680 -6.882 10.773 558 2HG1 VAL 68 HG12 VAL 68 10.730 -5.459 10.714 559 3HG1 VAL 68 HG13 VAL 68 11.368 -6.983 11.332 560 1HG2 VAL 68 HG21 VAL 68 8.009 -5.470 12.120 561 2HG2 VAL 68 HG22 VAL 68 8.553 -4.673 13.612 562 3HG2 VAL 68 HG23 VAL 68 9.134 -4.104 12.041 563 H ASN 69 H ASN 69 7.292 -7.209 14.483 564 HA ASN 69 HA ASN 69 6.494 -9.639 13.013 565 1HB ASN 69 HB2 ASN 69 5.804 -9.425 15.338 566 2HB ASN 69 HB3 ASN 69 5.021 -7.877 14.972 567 1HD2 ASN 69 HD21 ASN 69 4.911 -11.400 14.448 568 2HD2 ASN 69 HD22 ASN 69 3.234 -11.436 13.920 569 H PHE 70 H PHE 70 4.753 -9.637 11.469 570 HA PHE 70 HA PHE 70 4.694 -7.690 9.533 571 1HB PHE 70 HB2 PHE 70 3.733 -9.893 9.229 572 2HB PHE 70 HB3 PHE 70 2.472 -9.560 10.417 573 HD1 PHE 70 HD1 PHE 70 3.898 -8.179 7.224 574 HD2 PHE 70 HD2 PHE 70 0.391 -8.659 9.680 575 HE1 PHE 70 HE1 PHE 70 2.547 -6.976 5.529 576 HE2 PHE 70 HE2 PHE 70 -0.951 -7.455 7.990 577 HZ PHE 70 HZ PHE 70 0.130 -6.567 5.936 578 H GLN 71 H GLN 71 2.390 -7.832 12.322 579 HA GLN 71 HA GLN 71 0.820 -5.624 11.434 580 1HB GLN 71 HB2 GLN 71 0.150 -7.249 13.200 581 2HB GLN 71 HB3 GLN 71 1.362 -6.554 14.286 582 1HG GLN 71 HG2 GLN 71 0.159 -4.316 14.067 583 2HG GLN 71 HG3 GLN 71 -1.056 -5.130 13.069 584 1HE2 GLN 71 HE22 GLN 71 0.568 -5.300 16.286 585 2HE2 GLN 71 HE21 GLN 71 -0.860 -5.886 17.137 586 H GLU 72 H GLU 72 3.700 -5.820 13.510 587 HA GLU 72 HA GLU 72 3.724 -3.019 14.222 588 1HB GLU 72 HB2 GLU 72 5.695 -5.303 14.511 589 2HB GLU 72 HB3 GLU 72 6.129 -3.637 14.912 590 1HG GLU 72 HG2 GLU 72 5.343 -4.868 16.901 591 2HG GLU 72 HG3 GLU 72 4.357 -3.444 16.540 592 H TYR 73 H TYR 73 5.274 -4.962 11.674 593 HA TYR 73 HA TYR 73 6.848 -2.914 10.476 594 1HB TYR 73 HB2 TYR 73 7.306 -4.988 9.673 595 2HB TYR 73 HB3 TYR 73 5.642 -5.505 9.617 596 HD1 TYR 73 HD1 TYR 73 4.225 -5.182 7.688 597 HD2 TYR 73 HD2 TYR 73 8.312 -3.803 7.741 598 HE1 TYR 73 HE1 TYR 73 4.239 -5.147 5.226 599 HE2 TYR 73 HE2 TYR 73 8.377 -3.954 5.268 600 HH TYR 73 HH TYR 73 5.635 -5.210 3.364 601 H ILE 74 H ILE 74 3.395 -3.855 9.775 602 HA ILE 74 HA ILE 74 3.030 -1.694 7.946 603 HB ILE 74 HB ILE 74 0.913 -2.994 9.687 604 1HG1 ILE 74 HG12 ILE 74 2.129 -4.595 8.153 605 2HG1 ILE 74 HG13 ILE 74 0.405 -4.474 7.934 606 1HG2 ILE 74 HG21 ILE 74 -0.010 -0.956 8.914 607 2HG2 ILE 74 HG22 ILE 74 0.814 -1.056 7.345 608 3HG2 ILE 74 HG23 ILE 74 -0.551 -2.107 7.695 609 1HD1 ILE 74 HD11 ILE 74 0.683 -3.082 5.928 610 2HD1 ILE 74 HD12 ILE 74 2.453 -3.087 6.165 611 3HD1 ILE 74 HD13 ILE 74 1.584 -4.584 5.782 612 H THR 75 H THR 75 2.366 -1.858 11.464 613 HA THR 75 HA THR 75 1.336 0.711 11.874 614 HB THR 75 HB THR 75 3.300 -0.732 13.717 615 HG1 THR 75 HG1 THR 75 1.565 -2.090 13.137 616 1HG2 THR 75 HG21 THR 75 1.060 1.239 14.316 617 2HG2 THR 75 HG22 THR 75 2.043 0.378 15.514 618 3HG2 THR 75 HG23 THR 75 2.800 1.574 14.448 619 H PHE 76 H PHE 76 4.777 -0.313 11.895 620 HA PHE 76 HA PHE 76 5.869 2.269 12.307 621 1HB PHE 76 HB2 PHE 76 7.123 0.171 12.650 622 2HB PHE 76 HB3 PHE 76 7.098 -0.123 10.912 623 HD1 PHE 76 HD1 PHE 76 8.447 1.300 9.361 624 HD2 PHE 76 HD2 PHE 76 8.490 2.003 13.622 625 HE1 PHE 76 HE1 PHE 76 10.376 2.801 9.096 626 HE2 PHE 76 HE2 PHE 76 10.335 3.632 13.319 627 HZ PHE 76 HZ PHE 76 11.266 4.056 11.053 628 H LEU 77 H LEU 77 5.176 0.463 9.226 629 HA LEU 77 HA LEU 77 6.180 2.519 7.522 630 1HB LEU 77 HB2 LEU 77 4.040 0.413 7.124 631 2HB LEU 77 HB3 LEU 77 4.524 1.520 5.841 632 HG LEU 77 HG LEU 77 6.550 -0.247 7.301 633 1HD1 LEU 77 HD11 LEU 77 5.174 -0.725 4.658 634 2HD1 LEU 77 HD12 LEU 77 6.413 -1.749 5.370 635 3HD1 LEU 77 HD13 LEU 77 4.815 -1.654 6.142 636 1HD2 LEU 77 HD21 LEU 77 7.573 1.621 6.032 637 2HD2 LEU 77 HD22 LEU 77 7.815 0.102 5.152 638 3HD2 LEU 77 HD23 LEU 77 6.555 1.228 4.620 639 H GLY 78 H GLY 78 3.001 2.154 9.112 640 1HA GLY 78 HA2 GLY 78 1.750 4.475 8.041 641 2HA GLY 78 HA3 GLY 78 1.465 3.790 9.661 642 H ALA 79 H ALA 79 3.801 4.126 10.980 643 HA ALA 79 HA ALA 79 3.907 6.899 11.560 644 1HB ALA 79 HB1 ALA 79 4.654 5.135 13.130 645 2HB ALA 79 HB2 ALA 79 5.872 6.406 12.907 646 3HB ALA 79 HB3 ALA 79 6.082 4.837 12.113 647 H LEU 80 H LEU 80 5.974 4.964 9.394 648 HA LEU 80 HA LEU 80 7.864 6.928 8.741 649 1HB LEU 80 HB2 LEU 80 7.811 4.386 8.190 650 2HB LEU 80 HB3 LEU 80 6.789 4.823 6.827 651 HG LEU 80 HG LEU 80 8.632 6.326 6.002 652 1HD1 LEU 80 HD11 LEU 80 9.967 6.647 8.053 653 2HD1 LEU 80 HD12 LEU 80 10.196 4.892 8.200 654 3HD1 LEU 80 HD13 LEU 80 10.940 5.779 6.857 655 1HD2 LEU 80 HD21 LEU 80 9.281 3.369 6.385 656 2HD2 LEU 80 HD22 LEU 80 8.239 4.044 5.110 657 3HD2 LEU 80 HD23 LEU 80 9.970 4.419 5.134 658 H ALA 81 H ALA 81 4.759 6.086 7.181 659 HA ALA 81 HA ALA 81 4.732 8.054 5.119 660 1HB ALA 81 HB1 ALA 81 2.489 6.695 6.623 661 2HB ALA 81 HB2 ALA 81 2.277 7.761 5.218 662 3HB ALA 81 HB3 ALA 81 3.199 6.246 5.069 663 H MET 82 H MET 82 3.460 8.121 8.491 664 HA MET 82 HA MET 82 2.465 10.763 8.386 665 1HB MET 82 HB2 MET 82 1.893 8.999 10.072 666 2HB MET 82 HB3 MET 82 3.463 9.276 10.842 667 1HG MET 82 HG2 MET 82 2.848 11.573 11.377 668 2HG MET 82 HG3 MET 82 1.390 11.457 10.384 669 1HE MET 82 HE1 MET 82 2.680 8.707 12.970 670 2HE MET 82 HE2 MET 82 1.872 9.293 14.437 671 3HE MET 82 HE3 MET 82 3.151 10.272 13.682 672 H ILE 83 H ILE 83 5.681 9.542 9.252 673 HA ILE 83 HA ILE 83 6.784 12.051 10.112 674 HB ILE 83 HB ILE 83 7.980 9.401 9.259 675 1HG1 ILE 83 HG12 ILE 83 8.071 10.818 11.958 676 2HG1 ILE 83 HG13 ILE 83 6.713 9.794 11.507 677 1HG2 ILE 83 HG21 ILE 83 9.650 11.079 8.633 678 2HG2 ILE 83 HG22 ILE 83 10.175 10.269 10.100 679 3HG2 ILE 83 HG23 ILE 83 9.464 11.891 10.203 680 1HD1 ILE 83 HD11 ILE 83 9.607 8.882 11.755 681 2HD1 ILE 83 HD12 ILE 83 8.274 7.876 11.147 682 3HD1 ILE 83 HD13 ILE 83 8.246 8.483 12.812 683 H TYR 84 H TYR 84 6.816 10.315 6.936 684 HA TYR 84 HA TYR 84 8.255 12.307 5.481 685 1HB TYR 84 HB2 TYR 84 5.865 10.665 4.539 686 2HB TYR 84 HB3 TYR 84 6.996 11.539 3.516 687 HD1 TYR 84 HD1 TYR 84 9.444 10.425 5.487 688 HD2 TYR 84 HD2 TYR 84 6.299 8.736 3.050 689 HE1 TYR 84 HE1 TYR 84 10.877 8.506 4.964 690 HE2 TYR 84 HE2 TYR 84 7.760 6.797 2.541 691 HH TYR 84 HH TYR 84 11.102 6.550 3.768 692 H ASN 85 H ASN 85 4.786 12.011 6.184 693 HA ASN 85 HA ASN 85 3.231 13.474 6.713 694 1HB ASN 85 HB2 ASN 85 5.264 14.483 8.021 695 2HB ASN 85 HB3 ASN 85 5.166 15.797 6.853 696 1HD2 ASN 85 HD22 ASN 85 3.380 13.917 9.265 697 2HD2 ASN 85 HD21 ASN 85 2.197 15.170 9.663 698 H GLU 86 H GLU 86 5.430 15.302 4.568 699 HA GLU 86 HA GLU 86 3.597 16.882 3.147 700 1HB GLU 86 HB2 GLU 86 6.067 16.992 2.946 701 2HB GLU 86 HB3 GLU 86 6.073 15.449 2.074 702 1HG GLU 86 HG2 GLU 86 4.699 16.467 0.266 703 2HG GLU 86 HG3 GLU 86 4.639 17.991 1.168 704 H ALA 87 H ALA 87 4.663 13.558 2.528 705 HA ALA 87 HA ALA 87 3.243 12.674 0.372 706 1HB ALA 87 HB1 ALA 87 3.570 11.226 3.033 707 2HB ALA 87 HB2 ALA 87 3.227 10.477 1.457 708 3HB ALA 87 HB3 ALA 87 4.774 11.300 1.725 709 H LEU 88 H LEU 88 1.840 13.238 3.645 710 HA LEU 88 HA LEU 88 -0.685 11.982 3.086 711 1HB LEU 88 HB2 LEU 88 -0.131 14.205 5.072 712 2HB LEU 88 HB3 LEU 88 -1.472 13.064 5.067 713 HG LEU 88 HG LEU 88 1.453 12.401 5.606 714 1HD1 LEU 88 HD11 LEU 88 0.288 13.548 7.439 715 2HD1 LEU 88 HD12 LEU 88 -1.044 12.372 7.353 716 3HD1 LEU 88 HD13 LEU 88 0.567 11.851 7.859 717 1HD2 LEU 88 HD21 LEU 88 -0.955 10.547 5.503 718 2HD2 LEU 88 HD22 LEU 88 0.461 10.506 4.422 719 3HD2 LEU 88 HD23 LEU 88 0.657 10.136 6.133 720 H LYS 89 H LYS 89 0.523 15.307 2.831 721 HA LYS 89 HA LYS 89 -2.100 16.377 2.100 722 1HB LYS 89 HB2 LYS 89 0.687 17.587 2.184 723 2HB LYS 89 HB3 LYS 89 -0.808 18.496 1.892 724 1HG LYS 89 HG2 LYS 89 -1.718 17.797 4.059 725 2HG LYS 89 HG3 LYS 89 -0.299 16.835 4.426 726 1HD LYS 89 HD2 LYS 89 -0.302 19.860 4.011 727 2HD LYS 89 HD3 LYS 89 -0.320 19.038 5.578 728 1HE LYS 89 HE2 LYS 89 1.935 18.898 3.525 729 2HE LYS 89 HE3 LYS 89 1.936 19.800 5.042 730 1HZ LYS 89 HZ1 LYS 89 3.076 17.748 5.278 731 2HZ LYS 89 HZ2 LYS 89 1.738 17.722 6.224 732 3HZ LYS 89 HZ3 LYS 89 1.766 16.873 4.812 733 H GLY 90 H GLY 90 0.908 15.412 0.460 734 1HA GLY 90 HA2 GLY 90 -0.515 14.963 -2.014 735 2HA GLY 90 HA3 GLY 90 0.586 16.354 -2.118 736 1H MET 1 H1 MET 1 15.930 3.918 -5.841 737 2H MET 1 H2 MET 1 15.858 5.077 -7.030 738 3H MET 1 H3 MET 1 14.912 3.716 -7.127 739 HA MET 1 HA MET 1 14.720 5.657 -4.967 740 1HB MET 1 HB2 MET 1 12.985 5.419 -7.466 741 2HB MET 1 HB3 MET 1 12.627 6.432 -6.058 742 1HG MET 1 HG2 MET 1 13.567 7.882 -7.644 743 2HG MET 1 HG3 MET 1 14.845 7.603 -6.456 744 1HE MET 1 HE1 MET 1 16.650 8.644 -8.039 745 2HE MET 1 HE2 MET 1 16.849 8.191 -9.749 746 3HE MET 1 HE3 MET 1 15.362 9.012 -9.216 747 H ALA 2 H ALA 2 12.770 5.338 -3.667 748 HA ALA 2 HA ALA 2 12.259 2.494 -3.259 749 1HB ALA 2 HB1 ALA 2 11.427 4.993 -1.728 750 2HB ALA 2 HB2 ALA 2 11.098 3.335 -1.195 751 3HB ALA 2 HB3 ALA 2 12.772 3.908 -1.351 752 H SER 3 H SER 3 11.050 4.005 -5.656 753 HA SER 3 HA SER 3 8.476 4.508 -5.649 754 1HB SER 3 HB2 SER 3 9.738 2.785 -7.787 755 2HB SER 3 HB3 SER 3 8.508 4.053 -7.945 756 HG SER 3 HG SER 3 10.646 4.806 -8.441 757 HA PRO 4 HA PRO 4 7.000 0.097 -6.399 758 1HB PRO 4 HB2 PRO 4 8.280 -2.123 -5.318 759 2HB PRO 4 HB3 PRO 4 8.587 -1.466 -6.952 760 1HG PRO 4 HG2 PRO 4 10.115 -0.867 -4.407 761 2HG PRO 4 HG3 PRO 4 10.789 -1.350 -5.990 762 1HD PRO 4 HD2 PRO 4 10.751 1.201 -5.304 763 2HD PRO 4 HD3 PRO 4 10.239 0.759 -6.951 764 H LEU 5 H LEU 5 8.494 0.658 -3.204 765 HA LEU 5 HA LEU 5 6.054 -0.386 -1.922 766 1HB LEU 5 HB2 LEU 5 8.187 -0.777 -0.780 767 2HB LEU 5 HB3 LEU 5 8.447 0.972 -0.651 768 HG LEU 5 HG LEU 5 6.391 1.198 0.730 769 1HD1 LEU 5 HD11 LEU 5 6.185 -1.835 0.417 770 2HD1 LEU 5 HD12 LEU 5 5.318 -0.872 1.619 771 3HD1 LEU 5 HD13 LEU 5 4.965 -0.631 -0.079 772 1HD2 LEU 5 HD21 LEU 5 8.488 0.774 1.884 773 2HD2 LEU 5 HD22 LEU 5 7.143 -0.023 2.719 774 3HD2 LEU 5 HD23 LEU 5 8.237 -0.994 1.721 775 H ASP 6 H ASP 6 7.734 2.731 -2.508 776 HA ASP 6 HA ASP 6 6.093 4.434 -1.059 777 1HB ASP 6 HB2 ASP 6 7.412 4.943 -3.748 778 2HB ASP 6 HB3 ASP 6 6.660 6.190 -2.756 779 H GLN 7 H GLN 7 5.489 3.230 -4.405 780 HA GLN 7 HA GLN 7 3.122 4.704 -4.848 781 1HB GLN 7 HB2 GLN 7 2.592 3.073 -6.558 782 2HB GLN 7 HB3 GLN 7 4.341 3.361 -6.561 783 1HG GLN 7 HG2 GLN 7 4.570 1.319 -5.085 784 2HG GLN 7 HG3 GLN 7 2.857 0.962 -5.383 785 1HE2 GLN 7 HE21 GLN 7 4.842 -0.852 -5.944 786 2HE2 GLN 7 HE22 GLN 7 4.824 -1.108 -7.695 787 H ALA 8 H ALA 8 3.582 1.653 -3.018 788 HA ALA 8 HA ALA 8 0.750 1.069 -2.900 789 1HB ALA 8 HB1 ALA 8 1.424 -0.610 -1.197 790 2HB ALA 8 HB2 ALA 8 2.250 -0.719 -2.761 791 3HB ALA 8 HB3 ALA 8 3.099 -0.047 -1.345 792 H ILE 9 H ILE 9 3.130 2.311 -0.463 793 HA ILE 9 HA ILE 9 1.070 2.880 1.480 794 HB ILE 9 HB ILE 9 2.659 4.276 2.636 795 1HG1 ILE 9 HG12 ILE 9 4.487 3.869 0.274 796 2HG1 ILE 9 HG13 ILE 9 3.826 5.410 0.866 797 1HG2 ILE 9 HG21 ILE 9 4.166 2.487 3.235 798 2HG2 ILE 9 HG22 ILE 9 2.624 1.764 2.794 799 3HG2 ILE 9 HG23 ILE 9 3.978 1.717 1.646 800 1HD1 ILE 9 HD11 ILE 9 5.865 3.656 2.289 801 2HD1 ILE 9 HD12 ILE 9 6.093 5.266 1.605 802 3HD1 ILE 9 HD13 ILE 9 5.058 5.057 3.032 803 H GLY 10 H GLY 10 2.489 4.761 -1.184 804 1HA GLY 10 HA2 GLY 10 1.146 7.178 -1.072 805 2HA GLY 10 HA3 GLY 10 1.573 6.298 -2.546 806 H LEU 11 H LEU 11 -0.069 4.036 -2.387 807 HA LEU 11 HA LEU 11 -2.550 4.981 -3.304 808 1HB LEU 11 HB2 LEU 11 -1.334 2.670 -3.592 809 2HB LEU 11 HB3 LEU 11 -2.140 2.224 -2.097 810 HG LEU 11 HG LEU 11 -3.400 1.340 -3.821 811 1HD1 LEU 11 HD11 LEU 11 -4.745 2.441 -2.054 812 2HD1 LEU 11 HD12 LEU 11 -4.956 3.842 -3.144 813 3HD1 LEU 11 HD13 LEU 11 -5.578 2.253 -3.609 814 1HD2 LEU 11 HD21 LEU 11 -2.478 2.604 -5.683 815 2HD2 LEU 11 HD22 LEU 11 -4.246 2.530 -5.763 816 3HD2 LEU 11 HD23 LEU 11 -3.449 4.027 -5.233 817 H LEU 12 H LEU 12 -1.846 3.307 -0.192 818 HA LEU 12 HA LEU 12 -4.365 3.647 1.022 819 1HB LEU 12 HB2 LEU 12 -1.522 3.521 2.168 820 2HB LEU 12 HB3 LEU 12 -2.933 3.738 3.199 821 HG LEU 12 HG LEU 12 -3.913 1.656 2.364 822 1HD1 LEU 12 HD11 LEU 12 -2.727 1.365 0.200 823 2HD1 LEU 12 HD12 LEU 12 -1.185 1.196 1.077 824 3HD1 LEU 12 HD13 LEU 12 -2.455 -0.026 1.250 825 1HD2 LEU 12 HD21 LEU 12 -1.154 1.431 3.627 826 2HD2 LEU 12 HD22 LEU 12 -2.697 1.685 4.474 827 3HD2 LEU 12 HD23 LEU 12 -2.392 0.158 3.642 828 H ILE 13 H ILE 13 -1.570 5.851 1.033 829 HA ILE 13 HA ILE 13 -2.749 7.834 2.720 830 HB ILE 13 HB ILE 13 -0.535 7.991 0.624 831 1HG1 ILE 13 HG12 ILE 13 -0.249 8.088 3.650 832 2HG1 ILE 13 HG13 ILE 13 -0.293 6.540 2.818 833 1HG2 ILE 13 HG21 ILE 13 -1.495 10.003 2.672 834 2HG2 ILE 13 HG22 ILE 13 0.091 10.101 1.864 835 3HG2 ILE 13 HG23 ILE 13 -1.386 10.239 0.913 836 1HD1 ILE 13 HD11 ILE 13 1.778 8.736 2.498 837 2HD1 ILE 13 HD12 ILE 13 2.001 7.058 3.021 838 3HD1 ILE 13 HD13 ILE 13 1.618 7.403 1.335 839 H GLY 14 H GLY 14 -2.598 7.494 -0.833 840 1HA GLY 14 HA2 GLY 14 -3.827 9.907 -1.578 841 2HA GLY 14 HA3 GLY 14 -3.807 8.405 -2.525 842 H ILE 15 H ILE 15 -5.268 6.619 -1.084 843 HA ILE 15 HA ILE 15 -7.984 7.336 -1.519 844 HB ILE 15 HB ILE 15 -6.507 5.124 -0.111 845 1HG1 ILE 15 HG12 ILE 15 -8.731 5.222 -2.198 846 2HG1 ILE 15 HG13 ILE 15 -6.996 5.182 -2.564 847 1HG2 ILE 15 HG21 ILE 15 -9.498 5.564 0.214 848 2HG2 ILE 15 HG22 ILE 15 -8.626 4.068 0.618 849 3HG2 ILE 15 HG23 ILE 15 -8.260 5.530 1.495 850 1HD1 ILE 15 HD11 ILE 15 -7.796 2.954 -2.836 851 2HD1 ILE 15 HD12 ILE 15 -6.896 2.967 -1.305 852 3HD1 ILE 15 HD13 ILE 15 -8.672 2.972 -1.304 853 H PHE 16 H PHE 16 -6.148 7.063 1.544 854 HA PHE 16 HA PHE 16 -8.094 7.920 3.288 855 1HB PHE 16 HB2 PHE 16 -5.867 7.055 3.883 856 2HB PHE 16 HB3 PHE 16 -5.106 8.545 3.378 857 HD1 PHE 16 HD1 PHE 16 -7.263 6.961 5.921 858 HD2 PHE 16 HD2 PHE 16 -5.390 10.640 4.680 859 HE1 PHE 16 HE1 PHE 16 -7.413 7.823 8.247 860 HE2 PHE 16 HE2 PHE 16 -5.779 11.576 6.919 861 HZ PHE 16 HZ PHE 16 -6.520 10.066 8.767 862 H HIS 17 H HIS 17 -5.616 10.092 1.788 863 HA HIS 17 HA HIS 17 -6.866 12.301 3.072 864 1HB HIS 17 HB2 HIS 17 -4.367 11.990 2.523 865 2HB HIS 17 HB3 HIS 17 -4.777 12.732 0.971 866 HD1 HIS 17 HD1 HIS 17 -6.736 14.978 1.850 867 HD2 HIS 17 HD2 HIS 17 -3.537 13.715 4.242 868 HE1 HIS 17 HE1 HIS 17 -6.285 16.861 3.526 869 H LYS 18 H LYS 18 -7.350 10.816 -0.084 870 HA LYS 18 HA LYS 18 -8.697 13.055 -1.286 871 1HB LYS 18 HB2 LYS 18 -8.064 10.958 -2.489 872 2HB LYS 18 HB3 LYS 18 -9.311 10.087 -1.578 873 1HG LYS 18 HG2 LYS 18 -11.036 11.660 -2.568 874 2HG LYS 18 HG3 LYS 18 -9.732 12.460 -3.443 875 1HD LYS 18 HD2 LYS 18 -10.778 10.963 -4.987 876 2HD LYS 18 HD3 LYS 18 -9.188 10.306 -4.598 877 1HE LYS 18 HE2 LYS 18 -10.873 8.529 -4.687 878 2HE LYS 18 HE3 LYS 18 -10.247 8.660 -3.042 879 1HZ LYS 18 HZ1 LYS 18 -12.200 9.880 -2.452 880 2HZ LYS 18 HZ2 LYS 18 -12.758 9.854 -4.004 881 3HZ LYS 18 HZ3 LYS 18 -12.641 8.454 -3.145 882 H TYR 19 H TYR 19 -9.802 10.319 0.808 883 HA TYR 19 HA TYR 19 -12.484 11.301 0.995 884 1HB TYR 19 HB2 TYR 19 -10.940 9.358 2.718 885 2HB TYR 19 HB3 TYR 19 -12.599 9.841 3.078 886 HD1 TYR 19 HD1 TYR 19 -10.565 7.694 0.968 887 HD2 TYR 19 HD2 TYR 19 -14.476 9.355 1.511 888 HE1 TYR 19 HE1 TYR 19 -11.271 6.644 -1.142 889 HE2 TYR 19 HE2 TYR 19 -15.276 8.077 -0.446 890 HH TYR 19 HH TYR 19 -13.014 6.296 -2.616 891 H SER 20 H SER 20 -9.667 11.845 3.226 892 HA SER 20 HA SER 20 -11.232 13.410 5.021 893 1HB SER 20 HB2 SER 20 -9.246 14.135 6.029 894 2HB SER 20 HB3 SER 20 -9.026 12.452 5.578 895 HG SER 20 HG SER 20 -7.276 13.915 5.110 896 H GLY 21 H GLY 21 -9.138 14.398 2.344 897 1HA GLY 21 HA2 GLY 21 -9.496 17.123 2.214 898 2HA GLY 21 HA3 GLY 21 -9.274 16.075 0.802 899 H LYS 22 H LYS 22 -11.719 14.607 0.919 900 HA LYS 22 HA LYS 22 -13.489 15.979 -0.573 901 1HB LYS 22 HB2 LYS 22 -13.506 13.529 0.229 902 2HB LYS 22 HB3 LYS 22 -14.466 14.107 1.608 903 1HG LYS 22 HG2 LYS 22 -16.069 15.120 -0.138 904 2HG LYS 22 HG3 LYS 22 -15.174 14.203 -1.353 905 1HD LYS 22 HD2 LYS 22 -16.727 13.149 1.054 906 2HD LYS 22 HD3 LYS 22 -17.159 12.954 -0.648 907 1HE LYS 22 HE2 LYS 22 -14.826 11.674 0.841 908 2HE LYS 22 HE3 LYS 22 -16.264 10.864 0.211 909 1HZ LYS 22 HZ1 LYS 22 -14.195 12.171 -1.407 910 2HZ LYS 22 HZ2 LYS 22 -14.404 10.548 -1.221 911 3HZ LYS 22 HZ3 LYS 22 -15.549 11.442 -2.001 912 H GLU 23 H GLU 23 -13.379 16.124 3.002 913 HA GLU 23 HA GLU 23 -15.353 18.391 2.943 914 1HB GLU 23 HB2 GLU 23 -16.073 17.605 5.210 915 2HB GLU 23 HB3 GLU 23 -16.532 16.548 3.870 916 1HG GLU 23 HG2 GLU 23 -14.721 15.003 4.372 917 2HG GLU 23 HG3 GLU 23 -14.102 16.066 5.648 918 H GLY 24 H GLY 24 -12.439 18.438 2.666 919 1HA GLY 24 HA2 GLY 24 -10.697 19.686 3.413 920 2HA GLY 24 HA3 GLY 24 -11.889 20.654 4.294 921 H ASP 25 H ASP 25 -11.476 17.218 5.035 922 HA ASP 25 HA ASP 25 -10.353 17.898 7.694 923 1HB ASP 25 HB2 ASP 25 -12.281 16.320 7.456 924 2HB ASP 25 HB3 ASP 25 -11.247 15.209 6.566 925 H LYS 26 H LYS 26 -8.375 16.581 8.311 926 HA LYS 26 HA LYS 26 -6.486 16.471 5.976 927 1HB LYS 26 HB2 LYS 26 -5.955 17.591 8.743 928 2HB LYS 26 HB3 LYS 26 -4.760 17.324 7.449 929 1HG LYS 26 HG2 LYS 26 -6.159 18.812 5.949 930 2HG LYS 26 HG3 LYS 26 -7.199 19.153 7.326 931 1HD LYS 26 HD2 LYS 26 -5.581 20.952 6.999 932 2HD LYS 26 HD3 LYS 26 -5.352 20.172 8.566 933 1HE LYS 26 HE2 LYS 26 -3.220 20.728 7.353 934 2HE LYS 26 HE3 LYS 26 -3.351 19.025 7.793 935 1HZ LYS 26 HZ1 LYS 26 -4.026 18.551 5.556 936 2HZ LYS 26 HZ2 LYS 26 -3.950 20.145 5.142 937 3HZ LYS 26 HZ3 LYS 26 -2.578 19.332 5.558 938 H HIS 27 H HIS 27 -5.025 15.709 8.943 939 HA HIS 27 HA HIS 27 -4.463 13.094 7.849 940 1HB HIS 27 HB2 HIS 27 -3.492 14.361 10.416 941 2HB HIS 27 HB3 HIS 27 -2.785 12.972 9.583 942 HD1 HIS 27 HD1 HIS 27 -1.115 15.646 10.136 943 HD2 HIS 27 HD2 HIS 27 -3.123 14.632 6.579 944 HE1 HIS 27 HE1 HIS 27 0.007 16.960 8.255 945 H THR 28 H THR 28 -7.242 13.299 8.642 946 HA THR 28 HA THR 28 -7.492 10.998 10.324 947 HB THR 28 HB THR 28 -7.185 12.649 12.081 948 HG1 THR 28 HG1 THR 28 -8.726 10.820 12.141 949 1HG2 THR 28 HG21 THR 28 -9.749 13.941 11.079 950 2HG2 THR 28 HG22 THR 28 -8.842 14.362 12.538 951 3HG2 THR 28 HG23 THR 28 -8.126 14.666 10.942 952 H LEU 29 H LEU 29 -9.747 10.340 10.398 953 HA LEU 29 HA LEU 29 -11.561 11.555 8.356 954 1HB LEU 29 HB2 LEU 29 -11.057 8.589 8.846 955 2HB LEU 29 HB3 LEU 29 -12.363 9.217 7.844 956 HG LEU 29 HG LEU 29 -9.427 9.735 7.224 957 1HD1 LEU 29 HD11 LEU 29 -9.828 7.301 7.232 958 2HD1 LEU 29 HD12 LEU 29 -11.273 7.519 6.221 959 3HD1 LEU 29 HD13 LEU 29 -9.667 7.890 5.565 960 1HD2 LEU 29 HD21 LEU 29 -10.245 10.204 4.982 961 2HD2 LEU 29 HD22 LEU 29 -11.898 9.780 5.440 962 3HD2 LEU 29 HD23 LEU 29 -11.133 11.234 6.121 963 H SER 30 H SER 30 -13.819 11.159 8.884 964 HA SER 30 HA SER 30 -14.353 10.585 11.765 965 1HB SER 30 HB2 SER 30 -16.532 11.714 11.281 966 2HB SER 30 HB3 SER 30 -15.129 12.759 11.003 967 HG SER 30 HG SER 30 -15.355 12.463 8.809 968 H LYS 31 H LYS 31 -16.618 9.485 12.053 969 HA LYS 31 HA LYS 31 -16.193 6.868 11.288 970 1HB LYS 31 HB2 LYS 31 -18.443 6.424 12.260 971 2HB LYS 31 HB3 LYS 31 -17.368 7.381 13.284 972 1HG LYS 31 HG2 LYS 31 -18.642 9.446 12.596 973 2HG LYS 31 HG3 LYS 31 -19.766 8.403 11.689 974 1HD LYS 31 HD2 LYS 31 -20.290 7.145 13.741 975 2HD LYS 31 HD3 LYS 31 -19.254 8.221 14.675 976 1HE LYS 31 HE2 LYS 31 -21.775 9.000 13.136 977 2HE LYS 31 HE3 LYS 31 -21.590 8.896 14.893 978 1HZ LYS 31 HZ1 LYS 31 -21.440 11.132 14.192 979 2HZ LYS 31 HZ2 LYS 31 -19.950 10.680 14.731 980 3HZ LYS 31 HZ3 LYS 31 -20.240 10.802 13.117 981 H LYS 32 H LYS 32 -18.788 8.969 9.996 982 HA LYS 32 HA LYS 32 -19.609 6.845 8.174 983 1HB LYS 32 HB2 LYS 32 -21.269 8.156 9.215 984 2HB LYS 32 HB3 LYS 32 -20.610 9.668 8.526 985 1HG LYS 32 HG2 LYS 32 -21.208 8.885 6.249 986 2HG LYS 32 HG3 LYS 32 -21.678 7.315 6.896 987 1HD LYS 32 HD2 LYS 32 -23.656 8.664 6.424 988 2HD LYS 32 HD3 LYS 32 -23.534 8.306 8.148 989 1HE LYS 32 HE2 LYS 32 -24.245 10.636 7.721 990 2HE LYS 32 HE3 LYS 32 -22.724 10.584 8.611 991 1HZ LYS 32 HZ1 LYS 32 -22.996 11.015 5.715 992 2HZ LYS 32 HZ2 LYS 32 -22.689 12.180 6.838 993 3HZ LYS 32 HZ3 LYS 32 -21.578 11.000 6.555 994 H GLU 33 H GLU 33 -17.489 9.613 8.036 995 HA GLU 33 HA GLU 33 -17.178 9.810 5.182 996 1HB GLU 33 HB2 GLU 33 -16.494 11.491 6.841 997 2HB GLU 33 HB3 GLU 33 -15.331 10.334 7.524 998 1HG GLU 33 HG2 GLU 33 -14.053 10.406 5.396 999 2HG GLU 33 HG3 GLU 33 -15.234 11.554 4.740 1000 H LEU 34 H LEU 34 -15.491 7.930 7.785 1001 HA LEU 34 HA LEU 34 -13.844 6.430 6.015 1002 1HB LEU 34 HB2 LEU 34 -13.328 6.550 8.337 1003 2HB LEU 34 HB3 LEU 34 -14.893 5.928 8.828 1004 HG LEU 34 HG LEU 34 -13.022 4.352 9.102 1005 1HD1 LEU 34 HD11 LEU 34 -14.900 3.086 7.120 1006 2HD1 LEU 34 HD12 LEU 34 -14.240 2.442 8.621 1007 3HD1 LEU 34 HD13 LEU 34 -15.499 3.683 8.671 1008 1HD2 LEU 34 HD21 LEU 34 -12.028 3.200 7.187 1009 2HD2 LEU 34 HD22 LEU 34 -12.975 4.171 6.063 1010 3HD2 LEU 34 HD23 LEU 34 -11.729 4.944 7.066 1011 H LYS 35 H LYS 35 -17.111 5.711 7.401 1012 HA LYS 35 HA LYS 35 -17.527 3.280 6.113 1013 1HB LYS 35 HB2 LYS 35 -19.087 4.509 7.722 1014 2HB LYS 35 HB3 LYS 35 -19.604 5.511 6.359 1015 1HG LYS 35 HG2 LYS 35 -21.240 3.851 6.765 1016 2HG LYS 35 HG3 LYS 35 -20.489 3.531 5.193 1017 1HD LYS 35 HD2 LYS 35 -19.232 1.691 6.065 1018 2HD LYS 35 HD3 LYS 35 -19.527 2.171 7.749 1019 1HE LYS 35 HE2 LYS 35 -20.910 0.243 7.200 1020 2HE LYS 35 HE3 LYS 35 -21.940 1.650 7.493 1021 1HZ LYS 35 HZ1 LYS 35 -22.617 0.419 5.587 1022 2HZ LYS 35 HZ2 LYS 35 -22.115 1.924 5.123 1023 3HZ LYS 35 HZ3 LYS 35 -21.137 0.613 4.871 1024 H GLU 36 H GLU 36 -18.075 6.571 4.742 1025 HA GLU 36 HA GLU 36 -18.892 5.783 2.185 1026 1HB GLU 36 HB2 GLU 36 -18.911 8.120 3.210 1027 2HB GLU 36 HB3 GLU 36 -17.200 8.246 2.808 1028 1HG GLU 36 HG2 GLU 36 -18.530 9.329 1.089 1029 2HG GLU 36 HG3 GLU 36 -17.686 7.929 0.417 1030 H LEU 37 H LEU 37 -15.540 6.490 3.321 1031 HA LEU 37 HA LEU 37 -14.126 5.812 0.993 1032 1HB LEU 37 HB2 LEU 37 -13.098 6.740 3.018 1033 2HB LEU 37 HB3 LEU 37 -13.388 5.273 3.916 1034 HG LEU 37 HG LEU 37 -11.599 5.261 1.483 1035 1HD1 LEU 37 HD11 LEU 37 -9.714 5.522 3.070 1036 2HD1 LEU 37 HD12 LEU 37 -10.765 6.937 3.154 1037 3HD1 LEU 37 HD13 LEU 37 -10.852 5.695 4.414 1038 1HD2 LEU 37 HD21 LEU 37 -12.164 2.985 2.208 1039 2HD2 LEU 37 HD22 LEU 37 -10.536 3.353 2.750 1040 3HD2 LEU 37 HD23 LEU 37 -11.872 3.414 3.909 1041 H ILE 38 H ILE 38 -15.180 3.565 3.570 1042 HA ILE 38 HA ILE 38 -14.201 1.273 2.195 1043 HB ILE 38 HB ILE 38 -16.433 1.559 4.239 1044 1HG1 ILE 38 HG12 ILE 38 -13.517 0.625 4.401 1045 2HG1 ILE 38 HG13 ILE 38 -14.123 2.194 4.952 1046 1HG2 ILE 38 HG21 ILE 38 -15.093 -0.996 3.237 1047 2HG2 ILE 38 HG22 ILE 38 -16.306 -0.853 4.523 1048 3HG2 ILE 38 HG23 ILE 38 -16.771 -0.527 2.879 1049 1HD1 ILE 38 HD11 ILE 38 -13.930 0.803 6.860 1050 2HD1 ILE 38 HD12 ILE 38 -15.677 0.940 6.518 1051 3HD1 ILE 38 HD13 ILE 38 -14.784 -0.529 6.054 1052 H GLN 39 H GLN 39 -17.593 2.619 2.186 1053 HA GLN 39 HA GLN 39 -18.407 0.537 0.409 1054 1HB GLN 39 HB2 GLN 39 -19.716 3.276 0.657 1055 2HB GLN 39 HB3 GLN 39 -20.441 1.799 0.017 1056 1HG GLN 39 HG2 GLN 39 -19.792 2.485 2.891 1057 2HG GLN 39 HG3 GLN 39 -21.336 2.049 2.195 1058 1HE2 GLN 39 HE22 GLN 39 -20.414 -0.375 0.757 1059 2HE2 GLN 39 HE21 GLN 39 -19.994 -1.505 2.035 1060 H LYS 40 H LYS 40 -16.928 3.699 -0.335 1061 HA LYS 40 HA LYS 40 -17.623 3.372 -3.140 1062 1HB LYS 40 HB2 LYS 40 -17.442 5.531 -1.899 1063 2HB LYS 40 HB3 LYS 40 -15.680 5.357 -1.936 1064 1HG LYS 40 HG2 LYS 40 -15.741 5.286 -4.417 1065 2HG LYS 40 HG3 LYS 40 -17.503 5.317 -4.405 1066 1HD LYS 40 HD2 LYS 40 -15.614 7.560 -3.583 1067 2HD LYS 40 HD3 LYS 40 -16.666 7.505 -4.993 1068 1HE LYS 40 HE2 LYS 40 -17.502 7.762 -2.073 1069 2HE LYS 40 HE3 LYS 40 -17.658 8.970 -3.348 1070 1HZ LYS 40 HZ1 LYS 40 -19.061 6.394 -3.272 1071 2HZ LYS 40 HZ2 LYS 40 -19.714 7.855 -2.901 1072 3HZ LYS 40 HZ3 LYS 40 -19.224 7.542 -4.446 1073 H GLU 41 H GLU 41 -14.687 2.800 -1.152 1074 HA GLU 41 HA GLU 41 -13.139 2.017 -3.530 1075 1HB GLU 41 HB2 GLU 41 -12.531 1.754 -0.557 1076 2HB GLU 41 HB3 GLU 41 -11.401 1.439 -1.880 1077 1HG GLU 41 HG2 GLU 41 -12.694 4.131 -1.224 1078 2HG GLU 41 HG3 GLU 41 -11.034 3.657 -0.871 1079 H LEU 42 H LEU 42 -14.456 0.347 -0.669 1080 HA LEU 42 HA LEU 42 -14.035 -2.339 -1.910 1081 1HB LEU 42 HB2 LEU 42 -14.232 -1.328 0.950 1082 2HB LEU 42 HB3 LEU 42 -14.524 -3.017 0.566 1083 HG LEU 42 HG LEU 42 -12.269 -2.518 1.435 1084 1HD1 LEU 42 HD11 LEU 42 -12.726 -4.598 0.292 1085 2HD1 LEU 42 HD12 LEU 42 -12.445 -3.851 -1.288 1086 3HD1 LEU 42 HD13 LEU 42 -11.105 -4.029 -0.141 1087 1HD2 LEU 42 HD21 LEU 42 -10.541 -1.624 -0.008 1088 2HD2 LEU 42 HD22 LEU 42 -11.707 -1.297 -1.295 1089 3HD2 LEU 42 HD23 LEU 42 -11.806 -0.411 0.247 1090 H THR 43 H THR 43 -15.993 -1.387 -3.234 1091 HA THR 43 HA THR 43 -18.531 -1.311 -1.966 1092 HB THR 43 HB THR 43 -17.994 -1.921 -4.896 1093 HG1 THR 43 HG1 THR 43 -17.749 0.517 -3.476 1094 1HG2 THR 43 HG21 THR 43 -20.108 -0.226 -3.474 1095 2HG2 THR 43 HG22 THR 43 -19.963 -0.472 -5.227 1096 3HG2 THR 43 HG23 THR 43 -20.381 -1.837 -4.173 1097 H ILE 44 H ILE 44 -18.208 -3.342 -0.644 1098 HA ILE 44 HA ILE 44 -18.550 -5.886 -1.919 1099 HB ILE 44 HB ILE 44 -18.912 -6.858 0.157 1100 1HG1 ILE 44 HG12 ILE 44 -20.355 -5.515 1.485 1101 2HG1 ILE 44 HG13 ILE 44 -18.826 -5.666 2.319 1102 1HG2 ILE 44 HG21 ILE 44 -16.816 -6.305 1.233 1103 2HG2 ILE 44 HG22 ILE 44 -16.644 -6.253 -0.526 1104 3HG2 ILE 44 HG23 ILE 44 -16.745 -4.746 0.400 1105 1HD1 ILE 44 HD11 ILE 44 -19.702 -3.441 2.546 1106 2HD1 ILE 44 HD12 ILE 44 -18.203 -3.366 1.606 1107 3HD1 ILE 44 HD13 ILE 44 -19.786 -3.226 0.788 1108 H GLY 45 H GLY 45 -20.090 -5.212 -3.482 1109 1HA GLY 45 HA2 GLY 45 -22.167 -5.347 -4.448 1110 2HA GLY 45 HA3 GLY 45 -22.691 -6.320 -3.059 1111 H SER 46 H SER 46 -24.730 -5.237 -2.883 1112 HA SER 46 HA SER 46 -24.969 -2.394 -2.538 1113 1HB SER 46 HB2 SER 46 -26.910 -4.587 -1.702 1114 2HB SER 46 HB3 SER 46 -27.282 -2.912 -2.140 1115 HG SER 46 HG SER 46 -26.477 -3.442 -4.268 1116 H LYS 47 H LYS 47 -22.968 -2.805 -0.873 1117 HA LYS 47 HA LYS 47 -22.157 -2.743 1.248 1118 1HB LYS 47 HB2 LYS 47 -24.875 -1.683 2.108 1119 2HB LYS 47 HB3 LYS 47 -23.293 -1.369 2.833 1120 1HG LYS 47 HG2 LYS 47 -22.655 -0.148 0.708 1121 2HG LYS 47 HG3 LYS 47 -24.304 -0.415 0.115 1122 1HD LYS 47 HD2 LYS 47 -25.213 0.788 2.103 1123 2HD LYS 47 HD3 LYS 47 -23.567 1.072 2.674 1124 1HE LYS 47 HE2 LYS 47 -24.366 3.078 1.565 1125 2HE LYS 47 HE3 LYS 47 -23.088 2.369 0.566 1126 1HZ LYS 47 HZ1 LYS 47 -24.782 1.432 -0.827 1127 2HZ LYS 47 HZ2 LYS 47 -25.976 2.055 0.123 1128 3HZ LYS 47 HZ3 LYS 47 -24.976 3.062 -0.714 1129 H LEU 48 H LEU 48 -22.849 -5.296 0.586 1130 HA LEU 48 HA LEU 48 -25.051 -6.305 2.105 1131 1HB LEU 48 HB2 LEU 48 -22.718 -7.844 0.915 1132 2HB LEU 48 HB3 LEU 48 -24.247 -8.547 1.452 1133 HG LEU 48 HG LEU 48 -23.901 -6.534 -0.824 1134 1HD1 LEU 48 HD11 LEU 48 -24.391 -8.442 -2.292 1135 2HD1 LEU 48 HD12 LEU 48 -22.932 -8.737 -1.330 1136 3HD1 LEU 48 HD13 LEU 48 -24.462 -9.523 -0.885 1137 1HD2 LEU 48 HD21 LEU 48 -26.362 -8.059 0.135 1138 2HD2 LEU 48 HD22 LEU 48 -26.138 -6.295 0.144 1139 3HD2 LEU 48 HD23 LEU 48 -26.255 -7.158 -1.391 1140 H GLN 49 H GLN 49 -21.607 -6.839 2.835 1141 HA GLN 49 HA GLN 49 -22.318 -7.819 5.471 1142 1HB GLN 49 HB2 GLN 49 -19.588 -6.887 4.556 1143 2HB GLN 49 HB3 GLN 49 -19.990 -7.925 5.929 1144 1HG GLN 49 HG2 GLN 49 -19.475 -9.597 4.524 1145 2HG GLN 49 HG3 GLN 49 -21.154 -9.414 4.019 1146 1HE2 GLN 49 HE22 GLN 49 -17.794 -9.068 3.114 1147 2HE2 GLN 49 HE21 GLN 49 -18.082 -8.516 1.473 1148 H ASP 50 H ASP 50 -23.534 -5.188 5.071 1149 HA ASP 50 HA ASP 50 -22.071 -3.012 5.961 1150 1HB ASP 50 HB2 ASP 50 -24.319 -2.703 5.085 1151 2HB ASP 50 HB3 ASP 50 -25.025 -3.653 6.401 1152 H ALA 51 H ALA 51 -23.867 -5.312 7.976 1153 HA ALA 51 HA ALA 51 -23.474 -4.079 10.502 1154 1HB ALA 51 HB1 ALA 51 -23.777 -6.346 11.443 1155 2HB ALA 51 HB2 ALA 51 -24.960 -6.006 10.163 1156 3HB ALA 51 HB3 ALA 51 -23.562 -7.054 9.828 1157 H GLU 52 H GLU 52 -21.322 -6.230 8.628 1158 HA GLU 52 HA GLU 52 -19.337 -6.433 10.753 1159 1HB GLU 52 HB2 GLU 52 -19.171 -7.097 7.787 1160 2HB GLU 52 HB3 GLU 52 -17.921 -7.413 8.980 1161 1HG GLU 52 HG2 GLU 52 -19.162 -9.460 8.588 1162 2HG GLU 52 HG3 GLU 52 -19.402 -8.904 10.248 1163 H ILE 53 H ILE 53 -19.859 -4.448 7.800 1164 HA ILE 53 HA ILE 53 -17.404 -3.038 7.999 1165 HB ILE 53 HB ILE 53 -20.026 -1.905 6.965 1166 1HG1 ILE 53 HG12 ILE 53 -19.513 -3.827 5.597 1167 2HG1 ILE 53 HG13 ILE 53 -19.093 -2.364 4.724 1168 1HG2 ILE 53 HG21 ILE 53 -18.504 -0.117 7.458 1169 2HG2 ILE 53 HG22 ILE 53 -17.123 -1.011 6.830 1170 3HG2 ILE 53 HG23 ILE 53 -18.360 -0.408 5.722 1171 1HD1 ILE 53 HD11 ILE 53 -17.341 -3.925 4.340 1172 2HD1 ILE 53 HD12 ILE 53 -16.677 -2.737 5.474 1173 3HD1 ILE 53 HD13 ILE 53 -17.200 -4.328 6.064 1174 H VAL 54 H VAL 54 -20.599 -2.259 9.588 1175 HA VAL 54 HA VAL 54 -19.422 0.077 10.787 1176 HB VAL 54 HB VAL 54 -21.322 0.068 12.395 1177 1HG1 VAL 54 HG11 VAL 54 -21.943 0.099 9.424 1178 2HG1 VAL 54 HG12 VAL 54 -22.879 0.904 10.699 1179 3HG1 VAL 54 HG13 VAL 54 -21.234 1.444 10.351 1180 1HG2 VAL 54 HG21 VAL 54 -21.928 -2.322 12.327 1181 2HG2 VAL 54 HG22 VAL 54 -23.280 -1.243 11.949 1182 3HG2 VAL 54 HG23 VAL 54 -22.463 -2.101 10.641 1183 H LYS 55 H LYS 55 -19.631 -3.309 11.973 1184 HA LYS 55 HA LYS 55 -18.441 -2.751 14.505 1185 1HB LYS 55 HB2 LYS 55 -19.409 -4.917 14.016 1186 2HB LYS 55 HB3 LYS 55 -18.261 -5.197 12.712 1187 1HG LYS 55 HG2 LYS 55 -17.723 -6.462 14.775 1188 2HG LYS 55 HG3 LYS 55 -16.413 -5.430 14.212 1189 1HD LYS 55 HD2 LYS 55 -16.591 -5.372 16.636 1190 2HD LYS 55 HD3 LYS 55 -16.880 -3.774 15.971 1191 1HE LYS 55 HE2 LYS 55 -19.353 -4.122 16.240 1192 2HE LYS 55 HE3 LYS 55 -19.032 -5.732 16.911 1193 1HZ LYS 55 HZ1 LYS 55 -19.360 -4.084 18.602 1194 2HZ LYS 55 HZ2 LYS 55 -17.823 -4.674 18.677 1195 3HZ LYS 55 HZ3 LYS 55 -18.101 -3.182 18.037 1196 H LEU 56 H LEU 56 -16.915 -3.517 11.347 1197 HA LEU 56 HA LEU 56 -14.221 -3.256 12.172 1198 1HB LEU 56 HB2 LEU 56 -14.661 -4.346 10.200 1199 2HB LEU 56 HB3 LEU 56 -15.692 -3.084 9.554 1200 HG LEU 56 HG LEU 56 -12.827 -2.316 10.001 1201 1HD1 LEU 56 HD11 LEU 56 -12.254 -3.317 7.765 1202 2HD1 LEU 56 HD12 LEU 56 -12.582 -4.563 8.992 1203 3HD1 LEU 56 HD13 LEU 56 -13.807 -4.166 7.767 1204 1HD2 LEU 56 HD21 LEU 56 -13.247 -1.146 7.879 1205 2HD2 LEU 56 HD22 LEU 56 -14.843 -1.926 7.750 1206 3HD2 LEU 56 HD23 LEU 56 -14.540 -0.740 9.024 1207 H MET 57 H MET 57 -16.504 -0.752 11.003 1208 HA MET 57 HA MET 57 -14.699 1.434 11.005 1209 1HB MET 57 HB2 MET 57 -16.815 1.540 9.890 1210 2HB MET 57 HB3 MET 57 -17.700 1.317 11.398 1211 1HG MET 57 HG2 MET 57 -15.847 3.671 10.948 1212 2HG MET 57 HG3 MET 57 -17.538 3.697 10.447 1213 1HE MET 57 HE1 MET 57 -19.593 3.620 12.096 1214 2HE MET 57 HE2 MET 57 -19.012 2.186 12.986 1215 3HE MET 57 HE3 MET 57 -19.436 3.661 13.868 1216 H ASP 58 H ASP 58 -16.862 0.130 13.572 1217 HA ASP 58 HA ASP 58 -16.075 1.917 15.622 1218 1HB ASP 58 HB2 ASP 58 -17.961 0.510 15.966 1219 2HB ASP 58 HB3 ASP 58 -17.019 -0.963 15.757 1220 H ASP 59 H ASP 59 -14.649 -1.287 14.724 1221 HA ASP 59 HA ASP 59 -12.501 -1.123 16.592 1222 1HB ASP 59 HB2 ASP 59 -12.691 -2.622 13.952 1223 2HB ASP 59 HB3 ASP 59 -11.371 -2.794 15.116 1224 H LEU 60 H LEU 60 -12.804 0.345 13.385 1225 HA LEU 60 HA LEU 60 -10.064 1.258 13.253 1226 1HB LEU 60 HB2 LEU 60 -12.632 1.887 11.826 1227 2HB LEU 60 HB3 LEU 60 -11.329 3.058 11.702 1228 HG LEU 60 HG LEU 60 -10.723 0.160 11.189 1229 1HD1 LEU 60 HD11 LEU 60 -12.737 0.539 9.842 1230 2HD1 LEU 60 HD12 LEU 60 -11.998 1.993 9.133 1231 3HD1 LEU 60 HD13 LEU 60 -11.301 0.395 8.809 1232 1HD2 LEU 60 HD21 LEU 60 -8.909 1.918 11.152 1233 2HD2 LEU 60 HD22 LEU 60 -9.148 1.198 9.536 1234 3HD2 LEU 60 HD23 LEU 60 -9.813 2.786 9.891 1235 H ASP 61 H ASP 61 -13.097 2.998 14.228 1236 HA ASP 61 HA ASP 61 -11.499 5.287 14.951 1237 1HB ASP 61 HB2 ASP 61 -13.440 6.395 15.608 1238 2HB ASP 61 HB3 ASP 61 -13.736 5.597 14.064 1239 H ARG 62 H ARG 62 -12.617 2.573 16.762 1240 HA ARG 62 HA ARG 62 -12.533 3.150 19.402 1241 1HB ARG 62 HB2 ARG 62 -12.769 0.898 18.487 1242 2HB ARG 62 HB3 ARG 62 -11.112 0.948 17.874 1243 1HG ARG 62 HG2 ARG 62 -10.431 1.078 20.421 1244 2HG ARG 62 HG3 ARG 62 -12.119 0.632 20.720 1245 1HD ARG 62 HD2 ARG 62 -10.767 -1.395 20.631 1246 2HD ARG 62 HD3 ARG 62 -11.786 -1.335 19.179 1247 HE ARG 62 HE ARG 62 -9.065 -0.166 19.007 1248 1HH1 ARG 62 HH12 ARG 62 -11.085 -2.993 18.204 1249 2HH1 ARG 62 HH11 ARG 62 -9.901 -3.651 17.118 1250 1HH2 ARG 62 HH21 ARG 62 -7.634 -0.947 17.517 1251 2HH2 ARG 62 HH22 ARG 62 -7.911 -2.466 16.692 1252 H ASN 63 H ASN 63 -9.698 2.944 17.283 1253 HA ASN 63 HA ASN 63 -7.757 3.075 19.380 1254 1HB ASN 63 HB2 ASN 63 -7.309 3.716 16.455 1255 2HB ASN 63 HB3 ASN 63 -6.113 3.159 17.641 1256 1HD2 ASN 63 HD22 ASN 63 -8.709 2.223 15.472 1257 2HD2 ASN 63 HD21 ASN 63 -8.764 0.528 15.851 1258 H LYS 64 H LYS 64 -9.759 5.548 18.305 1259 HA LYS 64 HA LYS 64 -8.051 7.533 19.688 1260 1HB LYS 64 HB2 LYS 64 -9.525 7.892 17.066 1261 2HB LYS 64 HB3 LYS 64 -9.146 9.269 18.109 1262 1HG LYS 64 HG2 LYS 64 -7.019 7.332 17.141 1263 2HG LYS 64 HG3 LYS 64 -7.511 8.740 16.200 1264 1HD LYS 64 HD2 LYS 64 -6.677 10.294 17.693 1265 2HD LYS 64 HD3 LYS 64 -6.761 9.226 19.092 1266 1HE LYS 64 HE2 LYS 64 -4.807 8.805 16.799 1267 2HE LYS 64 HE3 LYS 64 -4.422 9.690 18.281 1268 1HZ LYS 64 HZ1 LYS 64 -3.762 7.371 18.348 1269 2HZ LYS 64 HZ2 LYS 64 -4.814 7.768 19.551 1270 3HZ LYS 64 HZ3 LYS 64 -5.341 6.897 18.269 1271 H ASP 65 H ASP 65 -11.277 7.038 18.321 1272 HA ASP 65 HA ASP 65 -12.780 6.837 20.572 1273 1HB ASP 65 HB2 ASP 65 -13.801 9.218 20.756 1274 2HB ASP 65 HB3 ASP 65 -12.314 8.844 21.601 1275 H GLN 66 H GLN 66 -13.618 9.409 18.347 1276 HA GLN 66 HA GLN 66 -15.422 7.576 16.838 1277 1HB GLN 66 HB2 GLN 66 -16.522 9.336 18.224 1278 2HB GLN 66 HB3 GLN 66 -15.744 10.580 17.238 1279 1HG GLN 66 HG2 GLN 66 -17.189 8.463 15.685 1280 2HG GLN 66 HG3 GLN 66 -18.210 9.385 16.784 1281 1HE2 GLN 66 HE22 GLN 66 -15.787 9.887 14.144 1282 2HE2 GLN 66 HE21 GLN 66 -16.491 11.433 13.646 1283 H GLU 67 H GLU 67 -12.708 9.860 16.675 1284 HA GLU 67 HA GLU 67 -12.920 10.017 13.732 1285 1HB GLU 67 HB2 GLU 67 -10.948 11.304 13.773 1286 2HB GLU 67 HB3 GLU 67 -12.047 11.970 14.974 1287 1HG GLU 67 HG2 GLU 67 -10.724 11.091 16.795 1288 2HG GLU 67 HG3 GLU 67 -9.779 10.056 15.716 1289 H VAL 68 H VAL 68 -11.186 9.182 12.414 1290 HA VAL 68 HA VAL 68 -9.650 6.861 13.537 1291 HB VAL 68 HB VAL 68 -10.487 7.318 10.641 1292 1HG1 VAL 68 HG11 VAL 68 -9.671 5.060 10.302 1293 2HG1 VAL 68 HG12 VAL 68 -8.385 6.007 11.068 1294 3HG1 VAL 68 HG13 VAL 68 -9.333 4.863 12.037 1295 1HG2 VAL 68 HG21 VAL 68 -12.526 6.811 11.927 1296 2HG2 VAL 68 HG22 VAL 68 -12.050 5.439 10.921 1297 3HG2 VAL 68 HG23 VAL 68 -11.714 5.408 12.657 1298 H ASN 69 H ASN 69 -7.575 7.709 13.872 1299 HA ASN 69 HA ASN 69 -6.718 10.058 12.313 1300 1HB ASN 69 HB2 ASN 69 -6.081 9.965 14.671 1301 2HB ASN 69 HB3 ASN 69 -5.365 8.364 14.443 1302 1HD2 ASN 69 HD21 ASN 69 -4.896 11.830 14.012 1303 2HD2 ASN 69 HD22 ASN 69 -3.236 11.721 13.456 1304 H PHE 70 H PHE 70 -4.944 10.054 10.846 1305 HA PHE 70 HA PHE 70 -4.718 8.101 8.957 1306 1HB PHE 70 HB2 PHE 70 -3.773 10.315 8.697 1307 2HB PHE 70 HB3 PHE 70 -2.605 10.023 9.984 1308 HD1 PHE 70 HD1 PHE 70 -3.723 8.680 6.657 1309 HD2 PHE 70 HD2 PHE 70 -0.485 9.067 9.479 1310 HE1 PHE 70 HE1 PHE 70 -2.245 7.411 5.136 1311 HE2 PHE 70 HE2 PHE 70 0.969 7.756 7.988 1312 HZ PHE 70 HZ PHE 70 0.097 6.912 5.807 1313 H GLN 71 H GLN 71 -2.481 8.250 11.809 1314 HA GLN 71 HA GLN 71 -0.897 6.055 10.883 1315 1HB GLN 71 HB2 GLN 71 -0.184 7.681 12.620 1316 2HB GLN 71 HB3 GLN 71 -1.377 7.005 13.738 1317 1HG GLN 71 HG2 GLN 71 -0.188 4.758 13.518 1318 2HG GLN 71 HG3 GLN 71 1.013 5.559 12.496 1319 1HE2 GLN 71 HE21 GLN 71 -0.566 5.766 15.742 1320 2HE2 GLN 71 HE22 GLN 71 0.881 6.347 16.559 1321 H GLU 72 H GLU 72 -3.764 6.263 12.961 1322 HA GLU 72 HA GLU 72 -3.772 3.471 13.705 1323 1HB GLU 72 HB2 GLU 72 -5.754 5.743 13.987 1324 2HB GLU 72 HB3 GLU 72 -6.169 4.077 14.407 1325 1HG GLU 72 HG2 GLU 72 -5.347 5.350 16.384 1326 2HG GLU 72 HG3 GLU 72 -4.373 3.921 16.026 1327 H TYR 73 H TYR 73 -5.331 5.380 11.128 1328 HA TYR 73 HA TYR 73 -6.882 3.295 9.959 1329 1HB TYR 73 HB2 TYR 73 -7.332 5.386 9.109 1330 2HB TYR 73 HB3 TYR 73 -5.658 5.855 8.991 1331 HD1 TYR 73 HD1 TYR 73 -4.320 5.412 7.043 1332 HD2 TYR 73 HD2 TYR 73 -8.389 4.011 7.310 1333 HE1 TYR 73 HE1 TYR 73 -4.374 5.120 4.595 1334 HE2 TYR 73 HE2 TYR 73 -8.478 3.831 4.835 1335 HH TYR 73 HH TYR 73 -5.785 4.888 2.753 1336 H ILE 74 H ILE 74 -3.447 4.274 9.255 1337 HA ILE 74 HA ILE 74 -3.002 2.125 7.440 1338 HB ILE 74 HB ILE 74 -0.979 3.472 9.263 1339 1HG1 ILE 74 HG12 ILE 74 -2.123 5.059 7.696 1340 2HG1 ILE 74 HG13 ILE 74 -0.390 4.913 7.498 1341 1HG2 ILE 74 HG21 ILE 74 0.620 2.638 7.384 1342 2HG2 ILE 74 HG22 ILE 74 0.037 1.456 8.555 1343 3HG2 ILE 74 HG23 ILE 74 -0.688 1.540 6.936 1344 1HD1 ILE 74 HD11 ILE 74 -0.695 3.476 5.507 1345 2HD1 ILE 74 HD12 ILE 74 -2.465 3.604 5.710 1346 3HD1 ILE 74 HD13 ILE 74 -1.493 5.033 5.326 1347 H THR 75 H THR 75 -2.327 2.297 10.952 1348 HA THR 75 HA THR 75 -1.279 -0.264 11.355 1349 HB THR 75 HB THR 75 -3.136 1.304 13.202 1350 HG1 THR 75 HG1 THR 75 -1.362 2.536 12.579 1351 1HG2 THR 75 HG21 THR 75 -1.849 0.167 15.010 1352 2HG2 THR 75 HG22 THR 75 -2.842 -0.954 14.064 1353 3HG2 THR 75 HG23 THR 75 -1.094 -0.869 13.784 1354 H PHE 76 H PHE 76 -4.725 0.752 11.479 1355 HA PHE 76 HA PHE 76 -5.777 -1.837 11.981 1356 1HB PHE 76 HB2 PHE 76 -7.042 0.250 12.344 1357 2HB PHE 76 HB3 PHE 76 -7.067 0.530 10.601 1358 HD1 PHE 76 HD1 PHE 76 -8.403 -0.963 9.096 1359 HD2 PHE 76 HD2 PHE 76 -8.412 -1.529 13.378 1360 HE1 PHE 76 HE1 PHE 76 -10.269 -2.546 8.884 1361 HE2 PHE 76 HE2 PHE 76 -10.169 -3.261 13.127 1362 HZ PHE 76 HZ PHE 76 -11.079 -3.799 10.875 1363 H LEU 77 H LEU 77 -5.187 -0.068 8.853 1364 HA LEU 77 HA LEU 77 -6.202 -2.193 7.236 1365 1HB LEU 77 HB2 LEU 77 -4.181 0.005 6.721 1366 2HB LEU 77 HB3 LEU 77 -4.521 -1.226 5.506 1367 HG LEU 77 HG LEU 77 -6.677 0.542 6.750 1368 1HD1 LEU 77 HD11 LEU 77 -5.221 0.744 4.083 1369 2HD1 LEU 77 HD12 LEU 77 -6.641 1.692 4.556 1370 3HD1 LEU 77 HD13 LEU 77 -5.112 1.895 5.441 1371 1HD2 LEU 77 HD21 LEU 77 -6.649 -1.430 4.414 1372 2HD2 LEU 77 HD22 LEU 77 -7.681 -1.495 5.863 1373 3HD2 LEU 77 HD23 LEU 77 -7.937 -0.231 4.670 1374 H GLY 78 H GLY 78 -3.037 -1.769 8.802 1375 1HA GLY 78 HA2 GLY 78 -1.785 -4.089 7.741 1376 2HA GLY 78 HA3 GLY 78 -1.523 -3.421 9.378 1377 H ALA 79 H ALA 79 -3.825 -3.732 10.686 1378 HA ALA 79 HA ALA 79 -3.961 -6.486 11.315 1379 1HB ALA 79 HB1 ALA 79 -6.153 -4.420 11.789 1380 2HB ALA 79 HB2 ALA 79 -4.732 -4.680 12.827 1381 3HB ALA 79 HB3 ALA 79 -5.937 -5.966 12.623 1382 H LEU 80 H LEU 80 -6.057 -4.590 9.115 1383 HA LEU 80 HA LEU 80 -7.850 -6.643 8.418 1384 1HB LEU 80 HB2 LEU 80 -7.856 -4.072 7.860 1385 2HB LEU 80 HB3 LEU 80 -6.870 -4.522 6.478 1386 HG LEU 80 HG LEU 80 -8.722 -6.113 5.782 1387 1HD1 LEU 80 HD11 LEU 80 -10.204 -4.618 7.994 1388 2HD1 LEU 80 HD12 LEU 80 -11.005 -5.552 6.717 1389 3HD1 LEU 80 HD13 LEU 80 -9.972 -6.376 7.890 1390 1HD2 LEU 80 HD21 LEU 80 -8.411 -3.852 4.786 1391 2HD2 LEU 80 HD22 LEU 80 -10.129 -4.285 4.878 1392 3HD2 LEU 80 HD23 LEU 80 -9.440 -3.161 6.066 1393 H ALA 81 H ALA 81 -4.767 -5.642 6.949 1394 HA ALA 81 HA ALA 81 -4.669 -7.529 4.842 1395 1HB ALA 81 HB1 ALA 81 -2.404 -6.874 4.595 1396 2HB ALA 81 HB2 ALA 81 -3.296 -5.444 5.094 1397 3HB ALA 81 HB3 ALA 81 -2.295 -6.306 6.278 1398 H MET 82 H MET 82 -3.661 -7.714 8.252 1399 HA MET 82 HA MET 82 -2.570 -10.364 8.032 1400 1HB MET 82 HB2 MET 82 -2.150 -8.497 9.813 1401 2HB MET 82 HB3 MET 82 -3.604 -9.112 10.603 1402 1HG MET 82 HG2 MET 82 -2.543 -11.326 10.818 1403 2HG MET 82 HG3 MET 82 -1.147 -10.761 9.881 1404 1HE MET 82 HE1 MET 82 -0.815 -12.243 12.635 1405 2HE MET 82 HE2 MET 82 0.445 -11.233 13.385 1406 3HE MET 82 HE3 MET 82 0.540 -11.632 11.652 1407 H ILE 83 H ILE 83 -5.774 -9.129 8.924 1408 HA ILE 83 HA ILE 83 -6.949 -11.650 9.608 1409 HB ILE 83 HB ILE 83 -8.099 -9.029 8.607 1410 1HG1 ILE 83 HG12 ILE 83 -8.448 -10.460 11.276 1411 2HG1 ILE 83 HG13 ILE 83 -7.098 -9.370 10.976 1412 1HG2 ILE 83 HG21 ILE 83 -9.624 -11.554 9.370 1413 2HG2 ILE 83 HG22 ILE 83 -9.627 -10.755 7.782 1414 3HG2 ILE 83 HG23 ILE 83 -10.356 -9.950 9.161 1415 1HD1 ILE 83 HD11 ILE 83 -8.679 -7.519 10.477 1416 2HD1 ILE 83 HD12 ILE 83 -8.837 -8.161 12.121 1417 3HD1 ILE 83 HD13 ILE 83 -10.038 -8.587 10.897 1418 H TYR 84 H TYR 84 -6.441 -9.982 6.481 1419 HA TYR 84 HA TYR 84 -7.509 -12.206 4.918 1420 1HB TYR 84 HB2 TYR 84 -5.557 -10.043 4.088 1421 2HB TYR 84 HB3 TYR 84 -6.505 -11.078 3.025 1422 HD1 TYR 84 HD1 TYR 84 -6.322 -8.051 2.961 1423 HD2 TYR 84 HD2 TYR 84 -9.170 -10.715 4.815 1424 HE1 TYR 84 HE1 TYR 84 -8.098 -6.344 2.712 1425 HE2 TYR 84 HE2 TYR 84 -10.927 -9.007 4.563 1426 HH TYR 84 HH TYR 84 -10.328 -5.858 2.990 1427 H ASN 85 H ASN 85 -6.202 -13.587 6.636 1428 HA ASN 85 HA ASN 85 -3.575 -14.199 6.513 1429 1HB ASN 85 HB2 ASN 85 -5.168 -15.361 7.970 1430 2HB ASN 85 HB3 ASN 85 -5.876 -16.186 6.572 1431 1HD2 ASN 85 HD22 ASN 85 -2.821 -15.831 8.453 1432 2HD2 ASN 85 HD21 ASN 85 -2.185 -17.399 8.001 1433 H GLU 86 H GLU 86 -5.949 -15.161 4.045 1434 HA GLU 86 HA GLU 86 -4.393 -16.871 2.455 1435 1HB GLU 86 HB2 GLU 86 -6.399 -14.740 1.584 1436 2HB GLU 86 HB3 GLU 86 -5.789 -16.057 0.570 1437 1HG GLU 86 HG2 GLU 86 -6.734 -17.730 2.131 1438 2HG GLU 86 HG3 GLU 86 -7.380 -16.438 3.156 1439 H ALA 87 H ALA 87 -4.361 -13.290 2.618 1440 HA ALA 87 HA ALA 87 -2.586 -12.934 0.367 1441 1HB ALA 87 HB1 ALA 87 -4.152 -11.181 1.253 1442 2HB ALA 87 HB2 ALA 87 -3.111 -11.027 2.686 1443 3HB ALA 87 HB3 ALA 87 -2.478 -10.638 1.077 1444 H LEU 88 H LEU 88 -2.173 -13.106 3.940 1445 HA LEU 88 HA LEU 88 0.648 -12.692 4.021 1446 1HB LEU 88 HB2 LEU 88 -0.896 -14.649 5.774 1447 2HB LEU 88 HB3 LEU 88 0.657 -13.890 6.088 1448 HG LEU 88 HG LEU 88 -1.954 -12.352 5.987 1449 1HD1 LEU 88 HD11 LEU 88 -1.885 -12.455 8.432 1450 2HD1 LEU 88 HD12 LEU 88 -1.789 -14.110 7.836 1451 3HD1 LEU 88 HD13 LEU 88 -0.333 -13.297 8.407 1452 1HD2 LEU 88 HD21 LEU 88 -0.659 -10.545 6.972 1453 2HD2 LEU 88 HD22 LEU 88 0.735 -11.604 7.230 1454 3HD2 LEU 88 HD23 LEU 88 0.263 -11.132 5.589 1455 H LYS 89 H LYS 89 -1.272 -15.645 3.629 1456 HA LYS 89 HA LYS 89 0.873 -17.491 3.599 1457 1HB LYS 89 HB2 LYS 89 -1.603 -17.850 4.014 1458 2HB LYS 89 HB3 LYS 89 -1.849 -17.788 2.260 1459 1HG LYS 89 HG2 LYS 89 -0.176 -19.700 2.064 1460 2HG LYS 89 HG3 LYS 89 -0.169 -19.796 3.829 1461 1HD LYS 89 HD2 LYS 89 -2.491 -20.272 1.908 1462 2HD LYS 89 HD3 LYS 89 -1.720 -21.455 2.968 1463 1HE LYS 89 HE2 LYS 89 -3.503 -19.113 3.794 1464 2HE LYS 89 HE3 LYS 89 -3.886 -20.830 3.896 1465 1HZ LYS 89 HZ1 LYS 89 -1.719 -19.527 5.381 1466 2HZ LYS 89 HZ2 LYS 89 -3.216 -19.826 5.982 1467 3HZ LYS 89 HZ3 LYS 89 -2.228 -21.087 5.555 1468 H GLY 90 H GLY 90 -0.954 -15.929 0.923 1469 1HA GLY 90 HA2 GLY 90 -0.475 -15.665 -1.299 1470 2HA GLY 90 HA3 GLY 90 1.243 -15.860 -0.905 Start of MODEL 11 1 1H MET 1 H1 MET 1 -14.661 1.133 -7.155 2 2H MET 1 H2 MET 1 -13.167 1.478 -6.525 3 3H MET 1 H3 MET 1 -14.405 1.030 -5.533 4 HA MET 1 HA MET 1 -14.443 -1.117 -6.316 5 1HB MET 1 HB2 MET 1 -13.897 -0.308 -8.713 6 2HB MET 1 HB3 MET 1 -12.193 -0.464 -8.259 7 1HG MET 1 HG2 MET 1 -12.632 -2.887 -7.723 8 2HG MET 1 HG3 MET 1 -14.319 -2.649 -8.202 9 1HE MET 1 HE1 MET 1 -12.657 -5.021 -9.292 10 2HE MET 1 HE2 MET 1 -14.312 -4.654 -9.838 11 3HE MET 1 HE3 MET 1 -13.028 -4.948 -11.032 12 H ALA 2 H ALA 2 -13.016 -2.759 -5.506 13 HA ALA 2 HA ALA 2 -11.386 -1.775 -3.373 14 1HB ALA 2 HB1 ALA 2 -12.913 -3.731 -3.230 15 2HB ALA 2 HB2 ALA 2 -11.854 -4.629 -4.335 16 3HB ALA 2 HB3 ALA 2 -11.260 -4.135 -2.736 17 H SER 3 H SER 3 -10.668 -3.317 -6.490 18 HA SER 3 HA SER 3 -8.339 -4.449 -6.260 19 1HB SER 3 HB2 SER 3 -8.679 -2.698 -8.675 20 2HB SER 3 HB3 SER 3 -8.258 -4.407 -8.543 21 HG SER 3 HG SER 3 -10.488 -3.879 -9.243 22 HA PRO 4 HA PRO 4 -5.716 -0.389 -6.898 23 1HB PRO 4 HB2 PRO 4 -7.497 1.559 -5.447 24 2HB PRO 4 HB3 PRO 4 -6.393 1.851 -6.822 25 1HG PRO 4 HG2 PRO 4 -9.056 1.666 -7.262 26 2HG PRO 4 HG3 PRO 4 -7.930 0.795 -8.351 27 1HD PRO 4 HD2 PRO 4 -9.359 -0.282 -5.914 28 2HD PRO 4 HD3 PRO 4 -9.404 -0.941 -7.569 29 H LEU 5 H LEU 5 -7.813 -0.643 -3.928 30 HA LEU 5 HA LEU 5 -5.526 0.018 -2.242 31 1HB LEU 5 HB2 LEU 5 -7.774 0.591 -1.473 32 2HB LEU 5 HB3 LEU 5 -8.245 -1.113 -1.494 33 HG LEU 5 HG LEU 5 -6.627 -1.650 0.260 34 1HD1 LEU 5 HD11 LEU 5 -4.768 -0.092 -0.193 35 2HD1 LEU 5 HD12 LEU 5 -5.819 1.300 0.158 36 3HD1 LEU 5 HD13 LEU 5 -5.382 0.149 1.436 37 1HD2 LEU 5 HD21 LEU 5 -7.565 -0.436 2.103 38 2HD2 LEU 5 HD22 LEU 5 -8.103 0.885 1.032 39 3HD2 LEU 5 HD23 LEU 5 -8.852 -0.728 0.911 40 H ASP 6 H ASP 6 -7.385 -2.884 -3.172 41 HA ASP 6 HA ASP 6 -6.135 -4.783 -1.554 42 1HB ASP 6 HB2 ASP 6 -7.014 -5.181 -4.452 43 2HB ASP 6 HB3 ASP 6 -6.725 -6.461 -3.272 44 H GLN 7 H GLN 7 -5.068 -3.770 -4.862 45 HA GLN 7 HA GLN 7 -2.753 -5.448 -4.789 46 1HB GLN 7 HB2 GLN 7 -1.971 -4.270 -6.716 47 2HB GLN 7 HB3 GLN 7 -3.711 -4.547 -6.842 48 1HG GLN 7 HG2 GLN 7 -3.968 -2.138 -5.928 49 2HG GLN 7 HG3 GLN 7 -2.250 -1.926 -6.262 50 1HE2 GLN 7 HE22 GLN 7 -5.348 -2.937 -7.682 51 2HE2 GLN 7 HE21 GLN 7 -5.004 -2.379 -9.331 52 H ALA 8 H ALA 8 -3.290 -2.120 -3.557 53 HA ALA 8 HA ALA 8 -0.510 -1.575 -3.118 54 1HB ALA 8 HB1 ALA 8 -1.321 0.198 -1.618 55 2HB ALA 8 HB2 ALA 8 -1.996 0.210 -3.257 56 3HB ALA 8 HB3 ALA 8 -2.989 -0.354 -1.888 57 H ILE 9 H ILE 9 -3.118 -2.726 -0.839 58 HA ILE 9 HA ILE 9 -1.273 -3.118 1.335 59 HB ILE 9 HB ILE 9 -2.954 -4.535 2.371 60 1HG1 ILE 9 HG12 ILE 9 -4.638 -4.162 -0.089 61 2HG1 ILE 9 HG13 ILE 9 -3.904 -5.688 0.436 62 1HG2 ILE 9 HG21 ILE 9 -2.937 -2.063 2.530 63 2HG2 ILE 9 HG22 ILE 9 -4.125 -2.003 1.208 64 3HG2 ILE 9 HG23 ILE 9 -4.533 -2.762 2.762 65 1HD1 ILE 9 HD11 ILE 9 -6.191 -5.721 1.126 66 2HD1 ILE 9 HD12 ILE 9 -5.207 -5.517 2.587 67 3HD1 ILE 9 HD13 ILE 9 -6.079 -4.133 1.888 68 H GLY 10 H GLY 10 -2.414 -5.241 -1.283 69 1HA GLY 10 HA2 GLY 10 -1.020 -7.593 -0.924 70 2HA GLY 10 HA3 GLY 10 -1.329 -6.815 -2.482 71 H LEU 11 H LEU 11 0.259 -4.528 -2.343 72 HA LEU 11 HA LEU 11 2.787 -5.488 -3.055 73 1HB LEU 11 HB2 LEU 11 1.582 -3.226 -3.561 74 2HB LEU 11 HB3 LEU 11 2.267 -2.672 -2.040 75 HG LEU 11 HG LEU 11 3.632 -1.872 -3.736 76 1HD1 LEU 11 HD11 LEU 11 5.796 -2.681 -3.290 77 2HD1 LEU 11 HD12 LEU 11 4.857 -2.802 -1.790 78 3HD1 LEU 11 HD13 LEU 11 5.192 -4.261 -2.766 79 1HD2 LEU 11 HD21 LEU 11 3.866 -4.649 -4.935 80 2HD2 LEU 11 HD22 LEU 11 2.884 -3.303 -5.562 81 3HD2 LEU 11 HD23 LEU 11 4.649 -3.165 -5.516 82 H LEU 12 H LEU 12 1.941 -3.625 -0.086 83 HA LEU 12 HA LEU 12 4.418 -3.879 1.251 84 1HB LEU 12 HB2 LEU 12 1.526 -3.691 2.268 85 2HB LEU 12 HB3 LEU 12 2.902 -3.792 3.364 86 HG LEU 12 HG LEU 12 3.863 -1.753 2.443 87 1HD1 LEU 12 HD11 LEU 12 2.853 -1.665 0.180 88 2HD1 LEU 12 HD12 LEU 12 1.237 -1.496 0.913 89 3HD1 LEU 12 HD13 LEU 12 2.442 -0.212 1.089 90 1HD2 LEU 12 HD21 LEU 12 1.005 -1.516 3.469 91 2HD2 LEU 12 HD22 LEU 12 2.485 -1.645 4.447 92 3HD2 LEU 12 HD23 LEU 12 2.202 -0.205 3.473 93 H ILE 13 H ILE 13 1.600 -6.049 1.275 94 HA ILE 13 HA ILE 13 2.658 -7.890 3.180 95 HB ILE 13 HB ILE 13 0.604 -8.176 0.946 96 1HG1 ILE 13 HG12 ILE 13 0.094 -8.057 3.940 97 2HG1 ILE 13 HG13 ILE 13 0.237 -6.576 3.002 98 1HG2 ILE 13 HG21 ILE 13 -0.206 -10.181 2.175 99 2HG2 ILE 13 HG22 ILE 13 1.403 -10.433 1.497 100 3HG2 ILE 13 HG23 ILE 13 1.216 -10.078 3.232 101 1HD1 ILE 13 HD11 ILE 13 -1.581 -7.597 1.441 102 2HD1 ILE 13 HD12 ILE 13 -1.892 -8.709 2.791 103 3HD1 ILE 13 HD13 ILE 13 -2.050 -6.953 3.012 104 H GLY 14 H GLY 14 2.714 -7.924 -0.399 105 1HA GLY 14 HA2 GLY 14 4.063 -10.361 -0.789 106 2HA GLY 14 HA3 GLY 14 4.058 -8.972 -1.898 107 H ILE 15 H ILE 15 5.362 -6.987 -0.632 108 HA ILE 15 HA ILE 15 8.107 -7.631 -0.877 109 HB ILE 15 HB ILE 15 6.512 -5.320 0.183 110 1HG1 ILE 15 HG12 ILE 15 8.819 -5.663 -1.800 111 2HG1 ILE 15 HG13 ILE 15 7.096 -5.584 -2.196 112 1HG2 ILE 15 HG21 ILE 15 9.475 -5.628 0.765 113 2HG2 ILE 15 HG22 ILE 15 8.537 -4.124 0.932 114 3HG2 ILE 15 HG23 ILE 15 8.142 -5.492 1.944 115 1HD1 ILE 15 HD11 ILE 15 8.883 -3.356 -1.148 116 2HD1 ILE 15 HD12 ILE 15 7.998 -3.433 -2.673 117 3HD1 ILE 15 HD13 ILE 15 7.109 -3.239 -1.147 118 H PHE 16 H PHE 16 6.099 -7.309 2.093 119 HA PHE 16 HA PHE 16 8.144 -7.989 3.893 120 1HB PHE 16 HB2 PHE 16 5.889 -7.103 4.437 121 2HB PHE 16 HB3 PHE 16 5.176 -8.660 4.085 122 HD1 PHE 16 HD1 PHE 16 5.797 -10.681 5.528 123 HD2 PHE 16 HD2 PHE 16 7.165 -6.722 6.488 124 HE1 PHE 16 HE1 PHE 16 5.948 -11.317 7.863 125 HE2 PHE 16 HE2 PHE 16 7.260 -7.342 8.893 126 HZ PHE 16 HZ PHE 16 6.513 -9.577 9.608 127 H HIS 17 H HIS 17 5.691 -10.230 2.487 128 HA HIS 17 HA HIS 17 6.814 -12.450 3.871 129 1HB HIS 17 HB2 HIS 17 4.747 -12.318 1.666 130 2HB HIS 17 HB3 HIS 17 5.238 -13.815 2.472 131 HD1 HIS 17 HD1 HIS 17 3.543 -10.489 3.299 132 HD2 HIS 17 HD2 HIS 17 4.626 -14.121 5.095 133 HE1 HIS 17 HE1 HIS 17 2.622 -10.429 5.682 134 H LYS 18 H LYS 18 7.590 -11.123 0.683 135 HA LYS 18 HA LYS 18 9.079 -13.369 -0.305 136 1HB LYS 18 HB2 LYS 18 9.460 -10.359 -0.528 137 2HB LYS 18 HB3 LYS 18 10.554 -11.517 -1.301 138 1HG LYS 18 HG2 LYS 18 8.874 -12.373 -2.731 139 2HG LYS 18 HG3 LYS 18 7.565 -11.670 -1.777 140 1HD LYS 18 HD2 LYS 18 7.934 -10.428 -3.881 141 2HD LYS 18 HD3 LYS 18 8.152 -9.420 -2.446 142 1HE LYS 18 HE2 LYS 18 10.614 -9.600 -2.652 143 2HE LYS 18 HE3 LYS 18 10.429 -10.688 -4.043 144 1HZ LYS 18 HZ1 LYS 18 10.869 -8.440 -4.691 145 2HZ LYS 18 HZ2 LYS 18 9.368 -8.887 -5.203 146 3HZ LYS 18 HZ3 LYS 18 9.533 -7.892 -3.898 147 H TYR 19 H TYR 19 10.077 -10.622 1.804 148 HA TYR 19 HA TYR 19 12.719 -11.728 2.195 149 1HB TYR 19 HB2 TYR 19 11.213 -9.399 3.368 150 2HB TYR 19 HB3 TYR 19 12.762 -9.908 4.027 151 HD1 TYR 19 HD1 TYR 19 14.854 -9.760 2.727 152 HD2 TYR 19 HD2 TYR 19 11.124 -8.349 1.129 153 HE1 TYR 19 HE1 TYR 19 16.029 -8.862 0.738 154 HE2 TYR 19 HE2 TYR 19 12.258 -7.595 -0.910 155 HH TYR 19 HH TYR 19 14.279 -7.412 -2.024 156 H SER 20 H SER 20 9.711 -11.817 4.228 157 HA SER 20 HA SER 20 10.879 -13.245 6.371 158 1HB SER 20 HB2 SER 20 8.094 -13.728 5.238 159 2HB SER 20 HB3 SER 20 8.655 -13.981 6.891 160 HG SER 20 HG SER 20 8.687 -11.892 7.266 161 H GLY 21 H GLY 21 9.355 -14.509 3.375 162 1HA GLY 21 HA2 GLY 21 9.744 -17.246 3.703 163 2HA GLY 21 HA3 GLY 21 9.707 -16.383 2.152 164 H LYS 22 H LYS 22 11.994 -14.790 2.333 165 HA LYS 22 HA LYS 22 14.048 -16.443 1.530 166 1HB LYS 22 HB2 LYS 22 13.815 -13.928 1.305 167 2HB LYS 22 HB3 LYS 22 14.534 -13.783 2.921 168 1HG LYS 22 HG2 LYS 22 16.537 -15.001 2.160 169 2HG LYS 22 HG3 LYS 22 15.834 -15.192 0.546 170 1HD LYS 22 HD2 LYS 22 16.583 -12.557 1.903 171 2HD LYS 22 HD3 LYS 22 17.479 -13.374 0.618 172 1HE LYS 22 HE2 LYS 22 15.318 -13.158 -0.811 173 2HE LYS 22 HE3 LYS 22 14.758 -12.025 0.439 174 1HZ LYS 22 HZ1 LYS 22 16.812 -10.789 0.048 175 2HZ LYS 22 HZ2 LYS 22 17.154 -11.770 -1.226 176 3HZ LYS 22 HZ3 LYS 22 15.803 -10.824 -1.262 177 H GLU 23 H GLU 23 13.283 -15.527 4.893 178 HA GLU 23 HA GLU 23 15.561 -17.242 5.846 179 1HB GLU 23 HB2 GLU 23 15.319 -16.031 7.991 180 2HB GLU 23 HB3 GLU 23 15.886 -15.037 6.649 181 1HG GLU 23 HG2 GLU 23 13.677 -14.040 6.363 182 2HG GLU 23 HG3 GLU 23 12.992 -15.112 7.591 183 H GLY 24 H GLY 24 12.774 -18.020 4.861 184 1HA GLY 24 HA2 GLY 24 11.145 -19.495 5.414 185 2HA GLY 24 HA3 GLY 24 12.304 -20.177 6.565 186 H ASP 25 H ASP 25 11.109 -16.855 6.838 187 HA ASP 25 HA ASP 25 9.817 -17.559 9.422 188 1HB ASP 25 HB2 ASP 25 11.643 -15.840 9.328 189 2HB ASP 25 HB3 ASP 25 10.583 -14.816 8.341 190 H LYS 26 H LYS 26 7.752 -16.509 9.875 191 HA LYS 26 HA LYS 26 5.958 -16.634 7.482 192 1HB LYS 26 HB2 LYS 26 5.374 -17.029 10.445 193 2HB LYS 26 HB3 LYS 26 4.194 -17.146 9.116 194 1HG LYS 26 HG2 LYS 26 5.519 -18.986 8.109 195 2HG LYS 26 HG3 LYS 26 6.677 -18.887 9.448 196 1HD LYS 26 HD2 LYS 26 4.884 -19.447 11.068 197 2HD LYS 26 HD3 LYS 26 3.697 -19.484 9.754 198 1HE LYS 26 HE2 LYS 26 4.374 -21.761 10.334 199 2HE LYS 26 HE3 LYS 26 4.901 -21.373 8.688 200 1HZ LYS 26 HZ1 LYS 26 6.597 -21.281 11.089 201 2HZ LYS 26 HZ2 LYS 26 6.592 -22.482 9.960 202 3HZ LYS 26 HZ3 LYS 26 7.089 -20.969 9.547 203 H HIS 27 H HIS 27 4.362 -15.201 10.082 204 HA HIS 27 HA HIS 27 4.190 -12.715 8.590 205 1HB HIS 27 HB2 HIS 27 2.942 -13.406 11.260 206 2HB HIS 27 HB3 HIS 27 2.407 -12.185 10.099 207 HD1 HIS 27 HD1 HIS 27 0.612 -14.668 11.195 208 HD2 HIS 27 HD2 HIS 27 2.678 -14.431 7.534 209 HE1 HIS 27 HE1 HIS 27 -0.486 -16.348 9.619 210 H THR 28 H THR 28 6.840 -12.917 9.388 211 HA THR 28 HA THR 28 7.255 -10.714 11.241 212 HB THR 28 HB THR 28 8.093 -13.542 11.949 213 HG1 THR 28 HG1 THR 28 5.968 -12.070 12.589 214 1HG2 THR 28 HG21 THR 28 9.907 -11.994 12.544 215 2HG2 THR 28 HG22 THR 28 8.736 -10.932 13.381 216 3HG2 THR 28 HG23 THR 28 9.059 -12.566 13.987 217 H LEU 29 H LEU 29 9.388 -9.900 11.069 218 HA LEU 29 HA LEU 29 11.208 -11.171 9.058 219 1HB LEU 29 HB2 LEU 29 10.486 -8.232 9.442 220 2HB LEU 29 HB3 LEU 29 11.976 -8.734 8.648 221 HG LEU 29 HG LEU 29 9.220 -9.508 7.629 222 1HD1 LEU 29 HD11 LEU 29 11.107 -7.264 6.761 223 2HD1 LEU 29 HD12 LEU 29 9.582 -7.707 5.967 224 3HD1 LEU 29 HD13 LEU 29 9.568 -7.027 7.607 225 1HD2 LEU 29 HD21 LEU 29 11.997 -9.539 6.349 226 2HD2 LEU 29 HD22 LEU 29 11.076 -10.971 6.851 227 3HD2 LEU 29 HD23 LEU 29 10.462 -9.941 5.549 228 H SER 30 H SER 30 13.310 -11.347 9.849 229 HA SER 30 HA SER 30 13.815 -10.293 12.540 230 1HB SER 30 HB2 SER 30 14.683 -12.521 11.876 231 2HB SER 30 HB3 SER 30 15.809 -11.710 10.766 232 HG SER 30 HG SER 30 15.599 -10.893 13.478 233 H LYS 31 H LYS 31 15.471 -8.766 13.032 234 HA LYS 31 HA LYS 31 15.067 -6.401 11.736 235 1HB LYS 31 HB2 LYS 31 16.837 -5.502 13.136 236 2HB LYS 31 HB3 LYS 31 15.791 -6.624 14.008 237 1HG LYS 31 HG2 LYS 31 17.563 -8.395 13.783 238 2HG LYS 31 HG3 LYS 31 18.632 -7.165 13.053 239 1HD LYS 31 HD2 LYS 31 18.383 -5.751 15.078 240 2HD LYS 31 HD3 LYS 31 17.318 -6.965 15.792 241 1HE LYS 31 HE2 LYS 31 19.189 -8.643 15.652 242 2HE LYS 31 HE3 LYS 31 20.259 -7.351 15.071 243 1HZ LYS 31 HZ1 LYS 31 19.837 -6.195 17.127 244 2HZ LYS 31 HZ2 LYS 31 18.837 -7.398 17.642 245 3HZ LYS 31 HZ3 LYS 31 20.441 -7.700 17.423 246 H LYS 32 H LYS 32 17.929 -8.488 11.268 247 HA LYS 32 HA LYS 32 19.140 -6.627 9.397 248 1HB LYS 32 HB2 LYS 32 20.504 -8.072 10.709 249 2HB LYS 32 HB3 LYS 32 19.769 -9.531 9.997 250 1HG LYS 32 HG2 LYS 32 20.694 -8.915 7.783 251 2HG LYS 32 HG3 LYS 32 21.340 -7.407 8.460 252 1HD LYS 32 HD2 LYS 32 22.789 -8.724 9.994 253 2HD LYS 32 HD3 LYS 32 22.117 -10.231 9.337 254 1HE LYS 32 HE2 LYS 32 22.982 -9.635 7.081 255 2HE LYS 32 HE3 LYS 32 23.654 -8.129 7.734 256 1HZ LYS 32 HZ1 LYS 32 24.417 -10.843 8.555 257 2HZ LYS 32 HZ2 LYS 32 25.293 -9.842 7.584 258 3HZ LYS 32 HZ3 LYS 32 25.043 -9.444 9.164 259 H GLU 33 H GLU 33 16.813 -9.288 9.064 260 HA GLU 33 HA GLU 33 17.133 -9.513 6.185 261 1HB GLU 33 HB2 GLU 33 16.151 -11.328 7.649 262 2HB GLU 33 HB3 GLU 33 14.736 -10.287 7.899 263 1HG GLU 33 HG2 GLU 33 14.145 -11.769 6.137 264 2HG GLU 33 HG3 GLU 33 14.470 -10.228 5.363 265 H LEU 34 H LEU 34 15.018 -7.738 8.459 266 HA LEU 34 HA LEU 34 13.524 -6.289 6.529 267 1HB LEU 34 HB2 LEU 34 12.835 -6.282 8.795 268 2HB LEU 34 HB3 LEU 34 14.364 -5.664 9.380 269 HG LEU 34 HG LEU 34 12.554 -4.051 9.463 270 1HD1 LEU 34 HD11 LEU 34 13.835 -2.172 8.943 271 2HD1 LEU 34 HD12 LEU 34 15.062 -3.423 9.081 272 3HD1 LEU 34 HD13 LEU 34 14.512 -2.872 7.490 273 1HD2 LEU 34 HD21 LEU 34 11.675 -2.986 7.387 274 2HD2 LEU 34 HD22 LEU 34 12.583 -4.138 6.413 275 3HD2 LEU 34 HD23 LEU 34 11.286 -4.712 7.476 276 H LYS 35 H LYS 35 16.718 -5.496 8.099 277 HA LYS 35 HA LYS 35 17.087 -3.135 6.621 278 1HB LYS 35 HB2 LYS 35 18.555 -3.942 8.505 279 2HB LYS 35 HB3 LYS 35 19.377 -5.006 7.338 280 1HG LYS 35 HG2 LYS 35 19.863 -3.001 5.912 281 2HG LYS 35 HG3 LYS 35 19.031 -1.984 7.100 282 1HD LYS 35 HD2 LYS 35 20.747 -2.683 8.807 283 2HD LYS 35 HD3 LYS 35 21.596 -3.564 7.515 284 1HE LYS 35 HE2 LYS 35 21.661 -1.382 6.191 285 2HE LYS 35 HE3 LYS 35 20.982 -0.564 7.606 286 1HZ LYS 35 HZ1 LYS 35 22.934 -1.300 8.830 287 2HZ LYS 35 HZ2 LYS 35 23.539 -2.025 7.481 288 3HZ LYS 35 HZ3 LYS 35 23.358 -0.389 7.525 289 H GLU 36 H GLU 36 17.885 -6.510 5.666 290 HA GLU 36 HA GLU 36 18.988 -5.930 3.145 291 1HB GLU 36 HB2 GLU 36 18.818 -8.187 4.400 292 2HB GLU 36 HB3 GLU 36 17.221 -8.349 3.653 293 1HG GLU 36 HG2 GLU 36 18.301 -8.019 1.399 294 2HG GLU 36 HG3 GLU 36 19.879 -8.000 2.202 295 H LEU 37 H LEU 37 15.555 -6.518 4.019 296 HA LEU 37 HA LEU 37 14.373 -6.132 1.496 297 1HB LEU 37 HB2 LEU 37 13.127 -6.933 3.438 298 2HB LEU 37 HB3 LEU 37 13.391 -5.464 4.326 299 HG LEU 37 HG LEU 37 11.674 -5.518 1.844 300 1HD1 LEU 37 HD11 LEU 37 10.766 -7.048 3.582 301 2HD1 LEU 37 HD12 LEU 37 10.921 -5.759 4.801 302 3HD1 LEU 37 HD13 LEU 37 9.771 -5.593 3.472 303 1HD2 LEU 37 HD21 LEU 37 10.638 -3.501 2.998 304 2HD2 LEU 37 HD22 LEU 37 11.955 -3.527 4.175 305 3HD2 LEU 37 HD23 LEU 37 12.273 -3.196 2.453 306 H ILE 38 H ILE 38 15.140 -3.646 3.964 307 HA ILE 38 HA ILE 38 14.231 -1.523 2.272 308 HB ILE 38 HB ILE 38 16.180 -1.570 4.614 309 1HG1 ILE 38 HG12 ILE 38 13.232 -0.823 4.256 310 2HG1 ILE 38 HG13 ILE 38 13.869 -2.238 5.102 311 1HG2 ILE 38 HG21 ILE 38 15.992 0.849 4.740 312 2HG2 ILE 38 HG22 ILE 38 16.660 0.435 3.176 313 3HG2 ILE 38 HG23 ILE 38 14.950 0.895 3.312 314 1HD1 ILE 38 HD11 ILE 38 15.033 -0.653 6.699 315 2HD1 ILE 38 HD12 ILE 38 14.081 0.654 5.941 316 3HD1 ILE 38 HD13 ILE 38 13.251 -0.701 6.742 317 H GLN 39 H GLN 39 17.575 -2.718 2.818 318 HA GLN 39 HA GLN 39 18.793 -0.876 1.077 319 1HB GLN 39 HB2 GLN 39 19.549 -3.747 1.789 320 2HB GLN 39 HB3 GLN 39 20.628 -2.657 0.914 321 1HG GLN 39 HG2 GLN 39 19.513 -1.962 3.670 322 2HG GLN 39 HG3 GLN 39 20.993 -2.891 3.429 323 1HE2 GLN 39 HE22 GLN 39 19.743 0.275 3.743 324 2HE2 GLN 39 HE21 GLN 39 21.233 1.097 3.300 325 H LYS 40 H LYS 40 17.278 -4.061 0.284 326 HA LYS 40 HA LYS 40 18.192 -3.792 -2.462 327 1HB LYS 40 HB2 LYS 40 17.910 -6.004 -1.312 328 2HB LYS 40 HB3 LYS 40 16.180 -5.695 -1.261 329 1HG LYS 40 HG2 LYS 40 16.496 -7.129 -3.066 330 2HG LYS 40 HG3 LYS 40 16.193 -5.584 -3.822 331 1HD LYS 40 HD2 LYS 40 18.924 -6.930 -3.403 332 2HD LYS 40 HD3 LYS 40 17.943 -7.055 -4.857 333 1HE LYS 40 HE2 LYS 40 19.489 -4.636 -3.897 334 2HE LYS 40 HE3 LYS 40 19.623 -5.533 -5.395 335 1HZ LYS 40 HZ1 LYS 40 18.490 -3.514 -5.774 336 2HZ LYS 40 HZ2 LYS 40 17.438 -4.759 -6.013 337 3HZ LYS 40 HZ3 LYS 40 17.341 -3.842 -4.645 338 H GLU 41 H GLU 41 14.981 -3.524 -0.808 339 HA GLU 41 HA GLU 41 13.687 -2.993 -3.378 340 1HB GLU 41 HB2 GLU 41 12.543 -2.758 -0.563 341 2HB GLU 41 HB3 GLU 41 11.647 -2.815 -2.082 342 1HG GLU 41 HG2 GLU 41 13.308 -5.079 -0.876 343 2HG GLU 41 HG3 GLU 41 11.550 -4.972 -0.937 344 H LEU 42 H LEU 42 14.504 -1.100 -0.422 345 HA LEU 42 HA LEU 42 13.540 1.383 -1.768 346 1HB LEU 42 HB2 LEU 42 14.451 1.075 1.097 347 2HB LEU 42 HB3 LEU 42 13.562 2.409 0.358 348 HG LEU 42 HG LEU 42 12.563 -0.402 1.001 349 1HD1 LEU 42 HD11 LEU 42 12.665 1.218 2.879 350 2HD1 LEU 42 HD12 LEU 42 11.648 2.343 1.958 351 3HD1 LEU 42 HD13 LEU 42 11.000 0.771 2.474 352 1HD2 LEU 42 HD21 LEU 42 10.997 1.793 -0.413 353 2HD2 LEU 42 HD22 LEU 42 11.548 0.277 -1.166 354 3HD2 LEU 42 HD23 LEU 42 10.381 0.222 0.139 355 H THR 43 H THR 43 15.364 0.694 -3.252 356 HA THR 43 HA THR 43 17.977 0.511 -2.448 357 HB THR 43 HB THR 43 17.316 1.471 -5.226 358 HG1 THR 43 HG1 THR 43 16.462 -1.042 -4.231 359 1HG2 THR 43 HG21 THR 43 19.583 0.602 -4.675 360 2HG2 THR 43 HG22 THR 43 18.858 -0.933 -4.143 361 3HG2 THR 43 HG23 THR 43 18.736 -0.433 -5.844 362 H ILE 44 H ILE 44 17.962 2.425 -0.935 363 HA ILE 44 HA ILE 44 18.355 5.073 -1.911 364 HB ILE 44 HB ILE 44 19.440 5.407 0.365 365 1HG1 ILE 44 HG12 ILE 44 18.250 2.722 1.137 366 2HG1 ILE 44 HG13 ILE 44 19.925 2.798 0.596 367 1HG2 ILE 44 HG21 ILE 44 17.108 5.958 -0.139 368 2HG2 ILE 44 HG22 ILE 44 16.609 4.292 0.207 369 3HG2 ILE 44 HG23 ILE 44 17.246 5.321 1.503 370 1HD1 ILE 44 HD11 ILE 44 19.841 2.942 3.000 371 2HD1 ILE 44 HD12 ILE 44 20.440 4.473 2.343 372 3HD1 ILE 44 HD13 ILE 44 18.766 4.348 2.940 373 H GLY 45 H GLY 45 19.794 5.010 -3.660 374 1HA GLY 45 HA2 GLY 45 22.573 4.244 -3.421 375 2HA GLY 45 HA3 GLY 45 21.864 5.333 -4.621 376 H SER 46 H SER 46 22.412 5.327 -1.101 377 HA SER 46 HA SER 46 24.170 7.587 -0.923 378 1HB SER 46 HB2 SER 46 21.213 8.000 -0.262 379 2HB SER 46 HB3 SER 46 22.506 8.991 0.429 380 HG SER 46 HG SER 46 22.368 8.692 -2.362 381 H LYS 47 H LYS 47 24.727 5.233 -0.113 382 HA LYS 47 HA LYS 47 23.416 4.165 2.125 383 1HB LYS 47 HB2 LYS 47 26.262 3.700 1.151 384 2HB LYS 47 HB3 LYS 47 25.408 2.684 2.314 385 1HG LYS 47 HG2 LYS 47 24.607 3.101 -0.605 386 2HG LYS 47 HG3 LYS 47 25.351 1.672 0.118 387 1HD LYS 47 HD2 LYS 47 23.313 1.457 1.626 388 2HD LYS 47 HD3 LYS 47 22.564 2.772 0.707 389 1HE LYS 47 HE2 LYS 47 21.696 0.808 -0.227 390 2HE LYS 47 HE3 LYS 47 22.893 1.384 -1.398 391 1HZ LYS 47 HZ1 LYS 47 23.251 -0.722 0.628 392 2HZ LYS 47 HZ2 LYS 47 23.066 -0.967 -0.994 393 3HZ LYS 47 HZ3 LYS 47 24.429 -0.231 -0.424 394 H LEU 48 H LEU 48 25.341 6.936 2.233 395 HA LEU 48 HA LEU 48 26.402 6.813 4.871 396 1HB LEU 48 HB2 LEU 48 25.048 9.107 3.368 397 2HB LEU 48 HB3 LEU 48 25.906 9.275 4.894 398 HG LEU 48 HG LEU 48 27.288 10.067 3.157 399 1HD1 LEU 48 HD11 LEU 48 29.326 8.830 3.525 400 2HD1 LEU 48 HD12 LEU 48 28.380 8.834 5.025 401 3HD1 LEU 48 HD13 LEU 48 28.435 7.378 4.005 402 1HD2 LEU 48 HD21 LEU 48 28.082 8.884 1.261 403 2HD2 LEU 48 HD22 LEU 48 27.338 7.366 1.769 404 3HD2 LEU 48 HD23 LEU 48 26.316 8.737 1.257 405 H GLN 49 H GLN 49 23.117 7.200 3.623 406 HA GLN 49 HA GLN 49 21.913 7.863 6.156 407 1HB GLN 49 HB2 GLN 49 20.640 6.655 3.664 408 2HB GLN 49 HB3 GLN 49 19.790 7.428 5.008 409 1HG GLN 49 HG2 GLN 49 21.689 8.771 3.032 410 2HG GLN 49 HG3 GLN 49 19.947 8.998 3.160 411 1HE2 GLN 49 HE22 GLN 49 19.231 9.721 5.527 412 2HE2 GLN 49 HE21 GLN 49 20.241 10.985 6.210 413 H ASP 50 H ASP 50 23.312 4.891 5.202 414 HA ASP 50 HA ASP 50 21.483 3.013 6.182 415 1HB ASP 50 HB2 ASP 50 24.520 3.005 6.210 416 2HB ASP 50 HB3 ASP 50 23.534 1.650 6.757 417 H ALA 51 H ALA 51 23.594 5.217 8.000 418 HA ALA 51 HA ALA 51 23.281 4.116 10.609 419 1HB ALA 51 HB1 ALA 51 23.652 6.434 11.375 420 2HB ALA 51 HB2 ALA 51 24.795 5.984 10.094 421 3HB ALA 51 HB3 ALA 51 23.409 7.032 9.720 422 H GLU 52 H GLU 52 21.180 6.325 8.721 423 HA GLU 52 HA GLU 52 19.177 6.609 10.790 424 1HB GLU 52 HB2 GLU 52 18.789 6.979 7.789 425 2HB GLU 52 HB3 GLU 52 17.845 7.663 9.114 426 1HG GLU 52 HG2 GLU 52 20.707 8.383 8.333 427 2HG GLU 52 HG3 GLU 52 19.269 9.398 8.228 428 H ILE 53 H ILE 53 19.661 4.493 7.936 429 HA ILE 53 HA ILE 53 17.235 3.057 8.228 430 HB ILE 53 HB ILE 53 19.840 1.946 7.168 431 1HG1 ILE 53 HG12 ILE 53 19.271 3.844 5.792 432 2HG1 ILE 53 HG13 ILE 53 18.758 2.391 4.942 433 1HG2 ILE 53 HG21 ILE 53 18.358 0.352 5.966 434 2HG2 ILE 53 HG22 ILE 53 18.364 0.141 7.716 435 3HG2 ILE 53 HG23 ILE 53 16.993 0.938 6.941 436 1HD1 ILE 53 HD11 ILE 53 16.395 2.837 5.817 437 2HD1 ILE 53 HD12 ILE 53 17.003 4.399 6.407 438 3HD1 ILE 53 HD13 ILE 53 17.036 4.034 4.679 439 H VAL 54 H VAL 54 20.394 2.434 9.938 440 HA VAL 54 HA VAL 54 19.155 0.169 11.241 441 HB VAL 54 HB VAL 54 21.054 0.167 12.823 442 1HG1 VAL 54 HG11 VAL 54 21.568 -0.015 9.845 443 2HG1 VAL 54 HG12 VAL 54 22.540 -0.806 11.109 444 3HG1 VAL 54 HG13 VAL 54 20.855 -1.290 10.856 445 1HG2 VAL 54 HG21 VAL 54 22.294 2.182 10.962 446 2HG2 VAL 54 HG22 VAL 54 21.768 2.527 12.629 447 3HG2 VAL 54 HG23 VAL 54 23.062 1.358 12.321 448 H LYS 55 H LYS 55 19.325 3.623 12.162 449 HA LYS 55 HA LYS 55 18.183 3.202 14.763 450 1HB LYS 55 HB2 LYS 55 19.025 5.375 14.176 451 2HB LYS 55 HB3 LYS 55 17.921 5.512 12.804 452 1HG LYS 55 HG2 LYS 55 17.204 6.882 14.709 453 2HG LYS 55 HG3 LYS 55 15.988 5.686 14.261 454 1HD LYS 55 HD2 LYS 55 16.701 4.233 16.160 455 2HD LYS 55 HD3 LYS 55 17.957 5.415 16.586 456 1HE LYS 55 HE2 LYS 55 16.189 7.106 17.020 457 2HE LYS 55 HE3 LYS 55 14.945 5.949 16.508 458 1HZ LYS 55 HZ1 LYS 55 15.145 6.025 18.867 459 2HZ LYS 55 HZ2 LYS 55 15.594 4.539 18.318 460 3HZ LYS 55 HZ3 LYS 55 16.741 5.617 18.804 461 H LEU 56 H LEU 56 16.667 3.765 11.582 462 HA LEU 56 HA LEU 56 13.960 3.364 12.275 463 1HB LEU 56 HB2 LEU 56 14.488 4.368 10.270 464 2HB LEU 56 HB3 LEU 56 15.604 3.113 9.762 465 HG LEU 56 HG LEU 56 12.728 2.318 10.086 466 1HD1 LEU 56 HD11 LEU 56 13.892 3.910 7.742 467 2HD1 LEU 56 HD12 LEU 56 12.318 3.097 7.733 468 3HD1 LEU 56 HD13 LEU 56 12.607 4.464 8.828 469 1HD2 LEU 56 HD21 LEU 56 13.270 0.921 8.200 470 2HD2 LEU 56 HD22 LEU 56 14.880 1.664 8.011 471 3HD2 LEU 56 HD23 LEU 56 14.525 0.648 9.408 472 H MET 57 H MET 57 16.455 0.964 11.370 473 HA MET 57 HA MET 57 14.819 -1.337 11.373 474 1HB MET 57 HB2 MET 57 17.193 -1.237 10.535 475 2HB MET 57 HB3 MET 57 17.719 -1.108 12.226 476 1HG MET 57 HG2 MET 57 16.621 -3.312 12.685 477 2HG MET 57 HG3 MET 57 16.314 -3.454 10.957 478 1HE MET 57 HE1 MET 57 20.452 -3.677 13.003 479 2HE MET 57 HE2 MET 57 19.570 -2.139 12.945 480 3HE MET 57 HE3 MET 57 18.896 -3.516 13.849 481 H ASP 58 H ASP 58 16.733 0.219 14.013 482 HA ASP 58 HA ASP 58 15.963 -1.543 16.082 483 1HB ASP 58 HB2 ASP 58 17.746 0.123 16.315 484 2HB ASP 58 HB3 ASP 58 16.551 1.427 16.322 485 H ASP 59 H ASP 59 14.380 1.485 14.941 486 HA ASP 59 HA ASP 59 12.195 1.405 16.741 487 1HB ASP 59 HB2 ASP 59 12.194 2.446 13.875 488 2HB ASP 59 HB3 ASP 59 10.955 2.762 15.088 489 H LEU 60 H LEU 60 12.363 -0.052 13.463 490 HA LEU 60 HA LEU 60 9.798 -1.310 13.540 491 1HB LEU 60 HB2 LEU 60 12.403 -1.800 12.079 492 2HB LEU 60 HB3 LEU 60 11.114 -2.992 11.937 493 HG LEU 60 HG LEU 60 10.490 -0.084 11.437 494 1HD1 LEU 60 HD11 LEU 60 11.630 -1.932 9.327 495 2HD1 LEU 60 HD12 LEU 60 11.038 -0.296 9.063 496 3HD1 LEU 60 HD13 LEU 60 12.493 -0.550 10.052 497 1HD2 LEU 60 HD21 LEU 60 8.621 -1.741 11.395 498 2HD2 LEU 60 HD22 LEU 60 8.922 -1.128 9.749 499 3HD2 LEU 60 HD23 LEU 60 9.507 -2.724 10.199 500 H ASP 61 H ASP 61 12.999 -2.700 14.360 501 HA ASP 61 HA ASP 61 11.852 -5.195 15.118 502 1HB ASP 61 HB2 ASP 61 13.996 -5.971 15.580 503 2HB ASP 61 HB3 ASP 61 14.091 -4.951 14.142 504 H ARG 62 H ARG 62 12.351 -2.300 16.990 505 HA ARG 62 HA ARG 62 12.524 -3.075 19.563 506 1HB ARG 62 HB2 ARG 62 12.111 -0.780 18.676 507 2HB ARG 62 HB3 ARG 62 10.389 -1.151 18.538 508 1HG ARG 62 HG2 ARG 62 10.224 -1.456 20.966 509 2HG ARG 62 HG3 ARG 62 11.983 -1.315 21.144 510 1HD ARG 62 HD2 ARG 62 10.124 0.852 20.113 511 2HD ARG 62 HD3 ARG 62 10.812 0.796 21.744 512 HE ARG 62 HE ARG 62 13.088 0.775 20.556 513 1HH1 ARG 62 HH22 ARG 62 10.332 2.697 19.359 514 2HH1 ARG 62 HH21 ARG 62 11.340 3.606 18.255 515 1HH2 ARG 62 HH12 ARG 62 14.332 1.983 19.067 516 2HH2 ARG 62 HH11 ARG 62 13.550 3.237 18.129 517 H ASN 63 H ASN 63 9.711 -3.489 17.505 518 HA ASN 63 HA ASN 63 7.637 -4.594 18.797 519 1HB ASN 63 HB2 ASN 63 7.804 -4.629 16.407 520 2HB ASN 63 HB3 ASN 63 9.301 -5.551 16.467 521 1HD2 ASN 63 HD22 ASN 63 9.226 -7.874 16.918 522 2HD2 ASN 63 HD21 ASN 63 7.719 -8.755 16.700 523 H LYS 64 H LYS 64 10.630 -6.433 18.215 524 HA LYS 64 HA LYS 64 10.503 -7.761 20.744 525 1HB LYS 64 HB2 LYS 64 8.724 -9.061 19.411 526 2HB LYS 64 HB3 LYS 64 10.035 -9.617 18.377 527 1HG LYS 64 HG2 LYS 64 11.143 -10.348 20.712 528 2HG LYS 64 HG3 LYS 64 9.518 -10.070 21.337 529 1HD LYS 64 HD2 LYS 64 9.308 -12.297 20.853 530 2HD LYS 64 HD3 LYS 64 8.844 -11.670 19.268 531 1HE LYS 64 HE2 LYS 64 11.603 -12.680 20.147 532 2HE LYS 64 HE3 LYS 64 10.485 -13.497 19.044 533 1HZ LYS 64 HZ1 LYS 64 10.766 -11.700 17.515 534 2HZ LYS 64 HZ2 LYS 64 11.804 -10.917 18.533 535 3HZ LYS 64 HZ3 LYS 64 12.220 -12.377 17.882 536 H ASP 65 H ASP 65 12.335 -6.301 20.076 537 HA ASP 65 HA ASP 65 14.392 -5.808 19.465 538 1HB ASP 65 HB2 ASP 65 16.006 -6.745 20.844 539 2HB ASP 65 HB3 ASP 65 14.481 -6.861 21.723 540 H GLN 66 H GLN 66 14.368 -9.288 18.798 541 HA GLN 66 HA GLN 66 16.499 -9.030 16.786 542 1HB GLN 66 HB2 GLN 66 16.392 -10.956 18.331 543 2HB GLN 66 HB3 GLN 66 14.814 -11.404 17.682 544 1HG GLN 66 HG2 GLN 66 16.600 -12.807 16.766 545 2HG GLN 66 HG3 GLN 66 15.826 -11.887 15.483 546 1HE2 GLN 66 HE22 GLN 66 17.482 -11.470 13.963 547 2HE2 GLN 66 HE21 GLN 66 19.072 -10.890 14.426 548 H GLU 67 H GLU 67 12.962 -9.016 16.922 549 HA GLU 67 HA GLU 67 12.860 -9.009 13.959 550 1HB GLU 67 HB2 GLU 67 10.981 -10.710 15.638 551 2HB GLU 67 HB3 GLU 67 11.197 -10.707 13.889 552 1HG GLU 67 HG2 GLU 67 13.508 -11.680 14.225 553 2HG GLU 67 HG3 GLU 67 13.151 -11.805 15.952 554 H VAL 68 H VAL 68 10.957 -8.334 13.000 555 HA VAL 68 HA VAL 68 9.114 -6.692 14.644 556 HB VAL 68 HB VAL 68 10.475 -5.259 13.263 557 1HG1 VAL 68 HG11 VAL 68 9.342 -6.666 10.819 558 2HG1 VAL 68 HG12 VAL 68 10.380 -5.236 10.846 559 3HG1 VAL 68 HG13 VAL 68 11.025 -6.788 11.392 560 1HG2 VAL 68 HG21 VAL 68 7.634 -5.433 12.185 561 2HG2 VAL 68 HG22 VAL 68 8.081 -4.713 13.746 562 3HG2 VAL 68 HG23 VAL 68 8.676 -4.004 12.239 563 H ASN 69 H ASN 69 6.956 -7.331 14.549 564 HA ASN 69 HA ASN 69 6.345 -9.627 12.841 565 1HB ASN 69 HB2 ASN 69 4.631 -10.124 14.154 566 2HB ASN 69 HB3 ASN 69 5.540 -9.203 15.345 567 1HD2 ASN 69 HD21 ASN 69 4.646 -7.148 16.028 568 2HD2 ASN 69 HD22 ASN 69 2.990 -6.727 15.633 569 H PHE 70 H PHE 70 4.512 -9.642 11.427 570 HA PHE 70 HA PHE 70 4.527 -7.758 9.452 571 1HB PHE 70 HB2 PHE 70 3.558 -9.951 9.173 572 2HB PHE 70 HB3 PHE 70 2.283 -9.591 10.341 573 HD1 PHE 70 HD1 PHE 70 0.210 -8.781 9.556 574 HD2 PHE 70 HD2 PHE 70 3.739 -8.272 7.125 575 HE1 PHE 70 HE1 PHE 70 -1.117 -7.553 7.888 576 HE2 PHE 70 HE2 PHE 70 2.395 -7.051 5.442 577 HZ PHE 70 HZ PHE 70 -0.026 -6.643 5.842 578 H GLN 71 H GLN 71 2.055 -7.680 12.141 579 HA GLN 71 HA GLN 71 0.784 -5.449 10.827 580 1HB GLN 71 HB2 GLN 71 -0.390 -6.955 12.450 581 2HB GLN 71 HB3 GLN 71 0.495 -6.153 13.766 582 1HG GLN 71 HG2 GLN 71 -0.438 -3.942 12.980 583 2HG GLN 71 HG3 GLN 71 -1.299 -4.793 11.687 584 1HE2 GLN 71 HE22 GLN 71 -3.056 -3.444 12.824 585 2HE2 GLN 71 HE21 GLN 71 -3.856 -4.235 14.178 586 H GLU 72 H GLU 72 3.354 -5.705 13.298 587 HA GLU 72 HA GLU 72 3.316 -2.847 13.838 588 1HB GLU 72 HB2 GLU 72 5.232 -5.049 14.596 589 2HB GLU 72 HB3 GLU 72 5.604 -3.337 14.866 590 1HG GLU 72 HG2 GLU 72 3.524 -2.991 16.113 591 2HG GLU 72 HG3 GLU 72 3.029 -4.658 15.837 592 H TYR 73 H TYR 73 5.024 -4.947 11.524 593 HA TYR 73 HA TYR 73 6.667 -2.912 10.375 594 1HB TYR 73 HB2 TYR 73 7.202 -4.971 9.594 595 2HB TYR 73 HB3 TYR 73 5.553 -5.527 9.480 596 HD1 TYR 73 HD1 TYR 73 4.200 -5.222 7.504 597 HD2 TYR 73 HD2 TYR 73 8.232 -3.709 7.703 598 HE1 TYR 73 HE1 TYR 73 4.275 -5.117 5.041 599 HE2 TYR 73 HE2 TYR 73 8.347 -3.725 5.223 600 HH TYR 73 HH TYR 73 5.703 -4.991 3.198 601 H ILE 74 H ILE 74 3.259 -3.857 9.549 602 HA ILE 74 HA ILE 74 2.900 -1.762 7.655 603 HB ILE 74 HB ILE 74 0.817 -3.047 9.453 604 1HG1 ILE 74 HG12 ILE 74 2.001 -4.685 7.974 605 2HG1 ILE 74 HG13 ILE 74 0.281 -4.540 7.704 606 1HG2 ILE 74 HG21 ILE 74 0.566 -1.203 7.055 607 2HG2 ILE 74 HG22 ILE 74 -0.740 -2.296 7.530 608 3HG2 ILE 74 HG23 ILE 74 -0.177 -1.067 8.663 609 1HD1 ILE 74 HD11 ILE 74 1.435 -4.723 5.574 610 2HD1 ILE 74 HD12 ILE 74 0.695 -3.135 5.689 611 3HD1 ILE 74 HD13 ILE 74 2.450 -3.325 5.965 612 H THR 75 H THR 75 2.173 -1.771 11.156 613 HA THR 75 HA THR 75 1.170 0.824 11.472 614 HB THR 75 HB THR 75 3.020 -0.668 13.387 615 HG1 THR 75 HG1 THR 75 1.249 -1.946 12.768 616 1HG2 THR 75 HG21 THR 75 0.946 1.493 13.883 617 2HG2 THR 75 HG22 THR 75 1.703 0.502 15.142 618 3HG2 THR 75 HG23 THR 75 2.694 1.598 14.167 619 H PHE 76 H PHE 76 4.570 -0.297 11.546 620 HA PHE 76 HA PHE 76 5.725 2.274 11.993 621 1HB PHE 76 HB2 PHE 76 6.932 0.185 12.446 622 2HB PHE 76 HB3 PHE 76 6.900 -0.216 10.728 623 HD1 PHE 76 HD1 PHE 76 8.310 0.993 9.106 624 HD2 PHE 76 HD2 PHE 76 8.301 2.121 13.274 625 HE1 PHE 76 HE1 PHE 76 10.190 2.517 8.697 626 HE2 PHE 76 HE2 PHE 76 10.078 3.790 12.810 627 HZ PHE 76 HZ PHE 76 10.973 4.044 10.502 628 H LEU 77 H LEU 77 5.041 0.413 8.936 629 HA LEU 77 HA LEU 77 6.090 2.446 7.229 630 1HB LEU 77 HB2 LEU 77 3.932 0.362 6.791 631 2HB LEU 77 HB3 LEU 77 4.422 1.496 5.532 632 HG LEU 77 HG LEU 77 6.378 -0.377 6.944 633 1HD1 LEU 77 HD11 LEU 77 4.969 -0.654 4.259 634 2HD1 LEU 77 HD12 LEU 77 6.314 -1.659 4.826 635 3HD1 LEU 77 HD13 LEU 77 4.763 -1.704 5.687 636 1HD2 LEU 77 HD21 LEU 77 7.552 1.520 5.962 637 2HD2 LEU 77 HD22 LEU 77 7.774 0.141 4.898 638 3HD2 LEU 77 HD23 LEU 77 6.592 1.396 4.466 639 H GLY 78 H GLY 78 2.974 2.224 8.915 640 1HA GLY 78 HA2 GLY 78 1.790 4.571 7.841 641 2HA GLY 78 HA3 GLY 78 1.564 3.969 9.498 642 H ALA 79 H ALA 79 4.105 4.229 10.595 643 HA ALA 79 HA ALA 79 4.360 7.039 11.093 644 1HB ALA 79 HB1 ALA 79 6.494 4.904 11.533 645 2HB ALA 79 HB2 ALA 79 5.196 5.307 12.672 646 3HB ALA 79 HB3 ALA 79 6.418 6.515 12.252 647 H LEU 80 H LEU 80 6.136 4.839 8.895 648 HA LEU 80 HA LEU 80 8.026 6.698 7.980 649 1HB LEU 80 HB2 LEU 80 7.870 4.125 7.620 650 2HB LEU 80 HB3 LEU 80 6.845 4.522 6.236 651 HG LEU 80 HG LEU 80 8.770 5.989 5.390 652 1HD1 LEU 80 HD11 LEU 80 10.110 6.203 7.469 653 2HD1 LEU 80 HD12 LEU 80 10.237 4.437 7.577 654 3HD1 LEU 80 HD13 LEU 80 11.043 5.308 6.262 655 1HD2 LEU 80 HD21 LEU 80 8.255 3.703 4.509 656 2HD2 LEU 80 HD22 LEU 80 9.987 4.074 4.466 657 3HD2 LEU 80 HD23 LEU 80 9.348 3.019 5.741 658 H ALA 81 H ALA 81 4.758 5.945 6.734 659 HA ALA 81 HA ALA 81 4.666 7.827 4.599 660 1HB ALA 81 HB1 ALA 81 2.994 6.137 4.771 661 2HB ALA 81 HB2 ALA 81 2.497 6.671 6.377 662 3HB ALA 81 HB3 ALA 81 2.194 7.715 4.981 663 H MET 82 H MET 82 3.769 8.149 8.083 664 HA MET 82 HA MET 82 3.013 10.863 7.931 665 1HB MET 82 HB2 MET 82 2.539 9.292 9.811 666 2HB MET 82 HB3 MET 82 4.220 9.459 10.344 667 1HG MET 82 HG2 MET 82 3.896 11.873 10.674 668 2HG MET 82 HG3 MET 82 2.243 11.751 10.046 669 1HE MET 82 HE1 MET 82 3.015 13.181 12.766 670 2HE MET 82 HE2 MET 82 1.703 12.594 13.816 671 3HE MET 82 HE3 MET 82 1.352 13.063 12.135 672 H ILE 83 H ILE 83 6.207 9.396 8.391 673 HA ILE 83 HA ILE 83 7.634 11.853 8.842 674 HB ILE 83 HB ILE 83 8.490 9.045 8.097 675 1HG1 ILE 83 HG12 ILE 83 9.000 10.638 10.644 676 2HG1 ILE 83 HG13 ILE 83 7.530 9.693 10.431 677 1HG2 ILE 83 HG21 ILE 83 10.195 10.527 7.153 678 2HG2 ILE 83 HG22 ILE 83 10.829 9.779 8.609 679 3HG2 ILE 83 HG23 ILE 83 10.261 11.459 8.664 680 1HD1 ILE 83 HD11 ILE 83 9.118 8.376 11.667 681 2HD1 ILE 83 HD12 ILE 83 10.357 8.566 10.420 682 3HD1 ILE 83 HD13 ILE 83 8.882 7.636 10.075 683 H TYR 84 H TYR 84 7.015 9.900 5.866 684 HA TYR 84 HA TYR 84 8.418 11.549 4.003 685 1HB TYR 84 HB2 TYR 84 5.798 9.999 3.775 686 2HB TYR 84 HB3 TYR 84 6.432 10.993 2.479 687 HD1 TYR 84 HD1 TYR 84 8.886 9.018 4.465 688 HD2 TYR 84 HD2 TYR 84 6.284 9.090 1.021 689 HE1 TYR 84 HE1 TYR 84 10.091 7.089 3.498 690 HE2 TYR 84 HE2 TYR 84 7.525 7.203 0.042 691 HH TYR 84 HH TYR 84 9.199 5.649 0.338 692 H ASN 85 H ASN 85 5.111 11.749 5.286 693 HA ASN 85 HA ASN 85 3.826 13.404 5.938 694 1HB ASN 85 HB2 ASN 85 6.126 14.243 6.855 695 2HB ASN 85 HB3 ASN 85 6.011 15.480 5.604 696 1HD2 ASN 85 HD21 ASN 85 4.364 13.994 8.375 697 2HD2 ASN 85 HD22 ASN 85 3.399 15.414 8.813 698 H GLU 86 H GLU 86 5.822 14.850 3.345 699 HA GLU 86 HA GLU 86 3.866 16.560 2.231 700 1HB GLU 86 HB2 GLU 86 6.027 15.005 0.725 701 2HB GLU 86 HB3 GLU 86 5.199 16.471 0.183 702 1HG GLU 86 HG2 GLU 86 7.135 16.228 2.538 703 2HG GLU 86 HG3 GLU 86 7.405 17.056 1.007 704 H ALA 87 H ALA 87 4.512 13.130 1.675 705 HA ALA 87 HA ALA 87 2.749 12.414 -0.322 706 1HB ALA 87 HB1 ALA 87 3.275 10.932 2.285 707 2HB ALA 87 HB2 ALA 87 2.628 10.233 0.782 708 3HB ALA 87 HB3 ALA 87 4.282 10.870 0.820 709 H LEU 88 H LEU 88 1.919 13.223 3.075 710 HA LEU 88 HA LEU 88 -0.805 12.299 3.003 711 1HB LEU 88 HB2 LEU 88 0.401 14.512 4.686 712 2HB LEU 88 HB3 LEU 88 -1.071 13.624 5.023 713 HG LEU 88 HG LEU 88 1.734 12.401 5.014 714 1HD1 LEU 88 HD11 LEU 88 -0.086 13.129 7.335 715 2HD1 LEU 88 HD12 LEU 88 1.526 12.416 7.439 716 3HD1 LEU 88 HD13 LEU 88 1.338 14.064 6.826 717 1HD2 LEU 88 HD21 LEU 88 0.073 10.694 4.490 718 2HD2 LEU 88 HD22 LEU 88 0.620 10.494 6.156 719 3HD2 LEU 88 HD23 LEU 88 -0.963 11.233 5.832 720 H LYS 89 H LYS 89 0.818 15.348 2.103 721 HA LYS 89 HA LYS 89 -1.706 16.789 1.656 722 1HB LYS 89 HB2 LYS 89 1.096 17.457 0.683 723 2HB LYS 89 HB3 LYS 89 -0.297 18.529 0.750 724 1HG LYS 89 HG2 LYS 89 1.199 17.354 3.149 725 2HG LYS 89 HG3 LYS 89 1.321 18.981 2.507 726 1HD LYS 89 HD2 LYS 89 -0.153 19.473 4.150 727 2HD LYS 89 HD3 LYS 89 -1.321 19.040 2.906 728 1HE LYS 89 HE2 LYS 89 -1.929 18.043 5.042 729 2HE LYS 89 HE3 LYS 89 -1.502 16.742 3.937 730 1HZ LYS 89 HZ1 LYS 89 0.636 16.623 4.995 731 2HZ LYS 89 HZ2 LYS 89 0.277 17.903 5.970 732 3HZ LYS 89 HZ3 LYS 89 -0.561 16.492 6.125 733 H GLY 90 H GLY 90 0.829 15.149 -0.268 734 1HA GLY 90 HA2 GLY 90 -1.054 14.081 -2.129 735 2HA GLY 90 HA3 GLY 90 -0.219 15.472 -2.857 736 1H MET 1 H1 MET 1 15.467 1.008 -7.501 737 2H MET 1 H2 MET 1 13.982 0.323 -7.212 738 3H MET 1 H3 MET 1 15.147 0.295 -6.041 739 HA MET 1 HA MET 1 15.015 2.539 -5.642 740 1HB MET 1 HB2 MET 1 13.184 2.681 -8.080 741 2HB MET 1 HB3 MET 1 13.510 4.010 -6.957 742 1HG MET 1 HG2 MET 1 14.917 4.389 -8.801 743 2HG MET 1 HG3 MET 1 15.965 3.791 -7.512 744 1HE MET 1 HE1 MET 1 17.939 3.387 -9.167 745 2HE MET 1 HE2 MET 1 17.777 2.524 -10.715 746 3HE MET 1 HE3 MET 1 16.941 4.076 -10.473 747 H ALA 2 H ALA 2 13.362 3.535 -4.357 748 HA ALA 2 HA ALA 2 11.682 1.672 -3.039 749 1HB ALA 2 HB1 ALA 2 12.712 3.590 -1.905 750 2HB ALA 2 HB2 ALA 2 11.808 4.716 -2.928 751 3HB ALA 2 HB3 ALA 2 10.948 3.699 -1.756 752 H SER 3 H SER 3 11.008 3.490 -5.906 753 HA SER 3 HA SER 3 8.579 4.410 -5.800 754 1HB SER 3 HB2 SER 3 9.277 2.770 -8.221 755 2HB SER 3 HB3 SER 3 8.588 4.389 -8.084 756 HG SER 3 HG SER 3 10.833 4.440 -8.634 757 HA PRO 4 HA PRO 4 6.367 0.199 -6.767 758 1HB PRO 4 HB2 PRO 4 8.170 -1.688 -5.253 759 2HB PRO 4 HB3 PRO 4 7.197 -2.004 -6.718 760 1HG PRO 4 HG2 PRO 4 9.867 -1.597 -6.944 761 2HG PRO 4 HG3 PRO 4 8.764 -0.757 -8.080 762 1HD PRO 4 HD2 PRO 4 9.915 0.296 -5.488 763 2HD PRO 4 HD3 PRO 4 10.032 1.041 -7.106 764 H LEU 5 H LEU 5 8.102 0.699 -3.639 765 HA LEU 5 HA LEU 5 5.727 -0.222 -2.160 766 1HB LEU 5 HB2 LEU 5 7.925 -0.695 -1.193 767 2HB LEU 5 HB3 LEU 5 8.307 1.035 -1.167 768 HG LEU 5 HG LEU 5 6.455 1.458 0.420 769 1HD1 LEU 5 HD11 LEU 5 5.307 -0.444 1.499 770 2HD1 LEU 5 HD12 LEU 5 4.832 -0.288 -0.185 771 3HD1 LEU 5 HD13 LEU 5 5.985 -1.561 0.295 772 1HD2 LEU 5 HD21 LEU 5 8.252 -0.827 1.288 773 2HD2 LEU 5 HD22 LEU 5 8.612 0.923 1.386 774 3HD2 LEU 5 HD23 LEU 5 7.315 0.227 2.366 775 H ASP 6 H ASP 6 7.533 2.775 -2.886 776 HA ASP 6 HA ASP 6 6.081 4.612 -1.384 777 1HB ASP 6 HB2 ASP 6 7.182 5.055 -4.181 778 2HB ASP 6 HB3 ASP 6 6.682 6.321 -3.061 779 H GLN 7 H GLN 7 5.275 3.464 -4.713 780 HA GLN 7 HA GLN 7 2.931 5.059 -4.920 781 1HB GLN 7 HB2 GLN 7 2.306 3.708 -6.799 782 2HB GLN 7 HB3 GLN 7 4.027 4.069 -6.821 783 1HG GLN 7 HG2 GLN 7 3.983 1.839 -7.457 784 2HG GLN 7 HG3 GLN 7 4.389 1.768 -5.745 785 1HE2 GLN 7 HE22 GLN 7 3.602 -0.326 -5.360 786 2HE2 GLN 7 HE21 GLN 7 1.904 -0.761 -5.566 787 H ALA 8 H ALA 8 3.416 1.903 -3.317 788 HA ALA 8 HA ALA 8 0.580 1.321 -3.143 789 1HB ALA 8 HB1 ALA 8 2.056 -0.501 -3.117 790 2HB ALA 8 HB2 ALA 8 2.982 0.127 -1.731 791 3HB ALA 8 HB3 ALA 8 1.302 -0.407 -1.521 792 H ILE 9 H ILE 9 3.077 2.511 -0.785 793 HA ILE 9 HA ILE 9 1.110 2.989 1.282 794 HB ILE 9 HB ILE 9 2.743 4.430 2.359 795 1HG1 ILE 9 HG12 ILE 9 4.505 3.914 -0.045 796 2HG1 ILE 9 HG13 ILE 9 3.817 5.483 0.409 797 1HG2 ILE 9 HG21 ILE 9 2.710 1.938 2.568 798 2HG2 ILE 9 HG22 ILE 9 3.986 1.851 1.336 799 3HG2 ILE 9 HG23 ILE 9 4.285 2.649 2.896 800 1HD1 ILE 9 HD11 ILE 9 5.895 3.900 1.968 801 2HD1 ILE 9 HD12 ILE 9 6.097 5.434 1.121 802 3HD1 ILE 9 HD13 ILE 9 5.078 5.366 2.572 803 H GLY 10 H GLY 10 2.410 4.997 -1.352 804 1HA GLY 10 HA2 GLY 10 1.021 7.376 -1.148 805 2HA GLY 10 HA3 GLY 10 1.403 6.536 -2.656 806 H LEU 11 H LEU 11 -0.186 4.257 -2.512 807 HA LEU 11 HA LEU 11 -2.710 5.178 -3.296 808 1HB LEU 11 HB2 LEU 11 -1.451 2.912 -3.718 809 2HB LEU 11 HB3 LEU 11 -2.212 2.388 -2.221 810 HG LEU 11 HG LEU 11 -3.486 1.571 -3.997 811 1HD1 LEU 11 HD11 LEU 11 -5.097 3.930 -3.055 812 2HD1 LEU 11 HD12 LEU 11 -5.661 2.340 -3.591 813 3HD1 LEU 11 HD13 LEU 11 -4.757 2.477 -2.069 814 1HD2 LEU 11 HD21 LEU 11 -2.671 3.015 -5.771 815 2HD2 LEU 11 HD22 LEU 11 -4.434 2.858 -5.802 816 3HD2 LEU 11 HD23 LEU 11 -3.696 4.351 -5.186 817 H LEU 12 H LEU 12 -1.881 3.420 -0.254 818 HA LEU 12 HA LEU 12 -4.412 3.661 1.042 819 1HB LEU 12 HB2 LEU 12 -1.544 3.517 2.104 820 2HB LEU 12 HB3 LEU 12 -2.938 3.674 3.168 821 HG LEU 12 HG LEU 12 -3.916 1.609 2.254 822 1HD1 LEU 12 HD11 LEU 12 -2.431 0.005 1.052 823 2HD1 LEU 12 HD12 LEU 12 -2.771 1.428 0.068 824 3HD1 LEU 12 HD13 LEU 12 -1.203 1.270 0.901 825 1HD2 LEU 12 HD21 LEU 12 -2.676 1.571 4.347 826 2HD2 LEU 12 HD22 LEU 12 -2.345 0.089 3.451 827 3HD2 LEU 12 HD23 LEU 12 -1.136 1.389 3.477 828 H ILE 13 H ILE 13 -1.630 5.907 1.032 829 HA ILE 13 HA ILE 13 -2.802 7.804 2.822 830 HB ILE 13 HB ILE 13 -0.687 8.069 0.643 831 1HG1 ILE 13 HG12 ILE 13 -0.247 8.061 3.652 832 2HG1 ILE 13 HG13 ILE 13 -0.321 6.547 2.761 833 1HG2 ILE 13 HG21 ILE 13 -1.473 10.022 2.835 834 2HG2 ILE 13 HG22 ILE 13 0.010 10.142 1.870 835 3HG2 ILE 13 HG23 ILE 13 -1.560 10.310 1.083 836 1HD1 ILE 13 HD11 ILE 13 1.961 7.013 2.804 837 2HD1 ILE 13 HD12 ILE 13 1.494 7.571 1.201 838 3HD1 ILE 13 HD13 ILE 13 1.733 8.748 2.511 839 H GLY 14 H GLY 14 -2.700 7.686 -0.759 840 1HA GLY 14 HA2 GLY 14 -4.113 10.032 -1.342 841 2HA GLY 14 HA3 GLY 14 -4.066 8.572 -2.351 842 H ILE 15 H ILE 15 -5.363 6.659 -0.956 843 HA ILE 15 HA ILE 15 -8.117 7.253 -1.205 844 HB ILE 15 HB ILE 15 -6.507 5.045 0.062 845 1HG1 ILE 15 HG12 ILE 15 -8.707 5.170 -2.063 846 2HG1 ILE 15 HG13 ILE 15 -6.968 5.183 -2.387 847 1HG2 ILE 15 HG21 ILE 15 -8.586 3.882 0.749 848 2HG2 ILE 15 HG22 ILE 15 -8.284 5.334 1.673 849 3HG2 ILE 15 HG23 ILE 15 -9.516 5.358 0.385 850 1HD1 ILE 15 HD11 ILE 15 -7.749 2.943 -2.763 851 2HD1 ILE 15 HD12 ILE 15 -6.838 2.916 -1.240 852 3HD1 ILE 15 HD13 ILE 15 -8.610 2.893 -1.223 853 H PHE 16 H PHE 16 -6.103 7.082 1.796 854 HA PHE 16 HA PHE 16 -8.092 7.836 3.584 855 1HB PHE 16 HB2 PHE 16 -5.754 7.167 4.162 856 2HB PHE 16 HB3 PHE 16 -5.183 8.751 3.687 857 HD1 PHE 16 HD1 PHE 16 -5.673 10.759 5.061 858 HD2 PHE 16 HD2 PHE 16 -7.209 6.900 6.179 859 HE1 PHE 16 HE1 PHE 16 -6.102 11.589 7.333 860 HE2 PHE 16 HE2 PHE 16 -7.481 7.687 8.519 861 HZ PHE 16 HZ PHE 16 -6.898 10.020 9.111 862 H HIS 17 H HIS 17 -5.865 10.052 1.804 863 HA HIS 17 HA HIS 17 -7.141 12.385 2.898 864 1HB HIS 17 HB2 HIS 17 -4.896 11.946 0.946 865 2HB HIS 17 HB3 HIS 17 -5.609 13.548 1.167 866 HD1 HIS 17 HD1 HIS 17 -5.306 14.763 3.530 867 HD2 HIS 17 HD2 HIS 17 -3.601 10.925 3.186 868 HE1 HIS 17 HE1 HIS 17 -3.932 14.382 5.627 869 H LYS 18 H LYS 18 -8.008 10.507 0.057 870 HA LYS 18 HA LYS 18 -9.464 12.678 -1.211 871 1HB LYS 18 HB2 LYS 18 -9.966 9.675 -1.079 872 2HB LYS 18 HB3 LYS 18 -11.007 10.788 -1.974 873 1HG LYS 18 HG2 LYS 18 -9.198 11.482 -3.419 874 2HG LYS 18 HG3 LYS 18 -8.015 10.574 -2.472 875 1HD LYS 18 HD2 LYS 18 -9.233 8.451 -3.025 876 2HD LYS 18 HD3 LYS 18 -10.348 9.383 -4.044 877 1HE LYS 18 HE2 LYS 18 -8.428 10.116 -5.456 878 2HE LYS 18 HE3 LYS 18 -7.318 9.194 -4.422 879 1HZ LYS 18 HZ1 LYS 18 -7.907 7.991 -6.383 880 2HZ LYS 18 HZ2 LYS 18 -8.476 7.207 -5.050 881 3HZ LYS 18 HZ3 LYS 18 -9.511 8.059 -6.011 882 H TYR 19 H TYR 19 -10.310 10.317 1.312 883 HA TYR 19 HA TYR 19 -12.942 11.472 1.802 884 1HB TYR 19 HB2 TYR 19 -11.267 9.326 3.078 885 2HB TYR 19 HB3 TYR 19 -12.851 9.746 3.706 886 HD1 TYR 19 HD1 TYR 19 -11.052 7.994 1.082 887 HD2 TYR 19 HD2 TYR 19 -14.908 9.538 2.179 888 HE1 TYR 19 HE1 TYR 19 -11.965 7.176 -1.045 889 HE2 TYR 19 HE2 TYR 19 -15.878 8.531 0.133 890 HH TYR 19 HH TYR 19 -13.933 6.649 -2.168 891 H SER 20 H SER 20 -9.934 11.334 3.795 892 HA SER 20 HA SER 20 -10.667 13.687 5.372 893 1HB SER 20 HB2 SER 20 -8.022 12.209 5.036 894 2HB SER 20 HB3 SER 20 -8.364 13.481 6.216 895 HG SER 20 HG SER 20 -9.598 12.145 7.336 896 H GLY 21 H GLY 21 -11.193 14.540 3.120 897 1HA GLY 21 HA2 GLY 21 -9.454 16.728 2.403 898 2HA GLY 21 HA3 GLY 21 -9.633 15.534 1.095 899 H LYS 22 H LYS 22 -12.034 14.542 1.186 900 HA LYS 22 HA LYS 22 -13.994 16.348 0.421 901 1HB LYS 22 HB2 LYS 22 -13.990 13.797 0.319 902 2HB LYS 22 HB3 LYS 22 -14.516 13.798 2.011 903 1HG LYS 22 HG2 LYS 22 -16.464 15.293 1.253 904 2HG LYS 22 HG3 LYS 22 -15.973 14.941 -0.408 905 1HD LYS 22 HD2 LYS 22 -16.958 13.017 1.739 906 2HD LYS 22 HD3 LYS 22 -17.763 13.426 0.228 907 1HE LYS 22 HE2 LYS 22 -15.199 11.791 0.554 908 2HE LYS 22 HE3 LYS 22 -16.791 11.192 0.090 909 1HZ LYS 22 HZ1 LYS 22 -15.161 13.070 -1.467 910 2HZ LYS 22 HZ2 LYS 22 -15.384 11.472 -1.797 911 3HZ LYS 22 HZ3 LYS 22 -16.654 12.519 -1.895 912 H GLU 23 H GLU 23 -13.439 15.001 3.732 913 HA GLU 23 HA GLU 23 -15.058 17.236 4.889 914 1HB GLU 23 HB2 GLU 23 -14.837 16.053 7.008 915 2HB GLU 23 HB3 GLU 23 -15.661 15.113 5.763 916 1HG GLU 23 HG2 GLU 23 -13.754 13.718 5.394 917 2HG GLU 23 HG3 GLU 23 -12.703 14.731 6.398 918 H GLY 24 H GLY 24 -12.579 17.955 3.580 919 1HA GLY 24 HA2 GLY 24 -11.043 19.589 4.068 920 2HA GLY 24 HA3 GLY 24 -11.311 19.404 5.808 921 H ASP 25 H ASP 25 -8.757 19.548 4.391 922 HA ASP 25 HA ASP 25 -7.656 16.910 4.095 923 1HB ASP 25 HB2 ASP 25 -6.907 18.803 2.734 924 2HB ASP 25 HB3 ASP 25 -6.268 19.602 4.183 925 H LYS 26 H LYS 26 -8.495 16.358 6.361 926 HA LYS 26 HA LYS 26 -6.765 17.176 8.601 927 1HB LYS 26 HB2 LYS 26 -9.026 15.154 8.397 928 2HB LYS 26 HB3 LYS 26 -8.257 15.699 9.900 929 1HG LYS 26 HG2 LYS 26 -9.002 18.044 9.360 930 2HG LYS 26 HG3 LYS 26 -9.923 17.402 7.991 931 1HD LYS 26 HD2 LYS 26 -10.326 16.635 10.924 932 2HD LYS 26 HD3 LYS 26 -11.332 17.745 9.974 933 1HE LYS 26 HE2 LYS 26 -11.798 15.838 8.370 934 2HE LYS 26 HE3 LYS 26 -10.993 14.748 9.509 935 1HZ LYS 26 HZ1 LYS 26 -13.335 16.405 10.107 936 2HZ LYS 26 HZ2 LYS 26 -13.347 14.786 9.807 937 3HZ LYS 26 HZ3 LYS 26 -12.594 15.366 11.155 938 H HIS 27 H HIS 27 -5.868 15.445 9.957 939 HA HIS 27 HA HIS 27 -4.739 13.133 8.423 940 1HB HIS 27 HB2 HIS 27 -3.817 14.370 11.042 941 2HB HIS 27 HB3 HIS 27 -3.066 12.999 10.214 942 HD1 HIS 27 HD1 HIS 27 -2.608 16.612 10.464 943 HD2 HIS 27 HD2 HIS 27 -2.417 13.705 7.428 944 HE1 HIS 27 HE1 HIS 27 -1.242 17.628 8.562 945 H THR 28 H THR 28 -7.489 13.580 9.636 946 HA THR 28 HA THR 28 -7.704 11.055 11.099 947 HB THR 28 HB THR 28 -9.330 12.108 12.643 948 HG1 THR 28 HG1 THR 28 -9.988 13.900 11.574 949 1HG2 THR 28 HG21 THR 28 -6.643 13.538 12.756 950 2HG2 THR 28 HG22 THR 28 -7.790 13.311 14.087 951 3HG2 THR 28 HG23 THR 28 -6.971 11.905 13.382 952 H LEU 29 H LEU 29 -9.661 10.008 10.662 953 HA LEU 29 HA LEU 29 -11.310 11.201 8.468 954 1HB LEU 29 HB2 LEU 29 -9.473 9.459 7.950 955 2HB LEU 29 HB3 LEU 29 -10.552 8.259 8.651 956 HG LEU 29 HG LEU 29 -11.374 10.155 6.383 957 1HD1 LEU 29 HD11 LEU 29 -9.368 9.017 5.641 958 2HD1 LEU 29 HD12 LEU 29 -9.960 7.454 6.257 959 3HD1 LEU 29 HD13 LEU 29 -10.762 8.233 4.886 960 1HD2 LEU 29 HD21 LEU 29 -13.199 8.883 7.538 961 2HD2 LEU 29 HD22 LEU 29 -12.985 8.418 5.839 962 3HD2 LEU 29 HD23 LEU 29 -12.343 7.379 7.134 963 H SER 30 H SER 30 -13.500 11.179 8.949 964 HA SER 30 HA SER 30 -14.098 10.318 11.640 965 1HB SER 30 HB2 SER 30 -16.234 11.446 11.331 966 2HB SER 30 HB3 SER 30 -14.913 12.467 10.743 967 HG SER 30 HG SER 30 -15.890 12.455 8.892 968 H LYS 31 H LYS 31 -16.003 9.126 12.291 969 HA LYS 31 HA LYS 31 -15.858 6.535 11.444 970 1HB LYS 31 HB2 LYS 31 -17.753 6.148 12.916 971 2HB LYS 31 HB3 LYS 31 -16.672 7.360 13.594 972 1HG LYS 31 HG2 LYS 31 -18.311 9.109 12.558 973 2HG LYS 31 HG3 LYS 31 -19.433 7.744 12.405 974 1HD LYS 31 HD2 LYS 31 -18.200 8.896 14.943 975 2HD LYS 31 HD3 LYS 31 -19.869 9.022 14.402 976 1HE LYS 31 HE2 LYS 31 -20.008 7.394 16.040 977 2HE LYS 31 HE3 LYS 31 -19.936 6.417 14.565 978 1HZ LYS 31 HZ1 LYS 31 -17.644 7.058 16.318 979 2HZ LYS 31 HZ2 LYS 31 -18.499 5.652 16.356 980 3HZ LYS 31 HZ3 LYS 31 -17.620 6.038 15.025 981 H LYS 32 H LYS 32 -18.422 8.834 10.452 982 HA LYS 32 HA LYS 32 -19.699 6.836 8.758 983 1HB LYS 32 HB2 LYS 32 -21.110 8.445 9.679 984 2HB LYS 32 HB3 LYS 32 -20.100 9.801 9.136 985 1HG LYS 32 HG2 LYS 32 -22.126 9.669 7.808 986 2HG LYS 32 HG3 LYS 32 -20.716 9.373 6.793 987 1HD LYS 32 HD2 LYS 32 -21.175 6.893 6.958 988 2HD LYS 32 HD3 LYS 32 -22.622 7.260 7.918 989 1HE LYS 32 HE2 LYS 32 -23.542 8.553 5.998 990 2HE LYS 32 HE3 LYS 32 -22.061 8.237 5.070 991 1HZ LYS 32 HZ1 LYS 32 -23.935 6.193 6.028 992 2HZ LYS 32 HZ2 LYS 32 -23.795 6.743 4.480 993 3HZ LYS 32 HZ3 LYS 32 -22.553 5.914 5.170 994 H GLU 33 H GLU 33 -17.415 9.555 8.182 995 HA GLU 33 HA GLU 33 -17.417 9.350 5.353 996 1HB GLU 33 HB2 GLU 33 -16.429 11.221 6.749 997 2HB GLU 33 HB3 GLU 33 -15.086 10.140 7.142 998 1HG GLU 33 HG2 GLU 33 -14.288 11.407 5.310 999 2HG GLU 33 HG3 GLU 33 -14.813 9.899 4.563 1000 H LEU 34 H LEU 34 -15.629 7.550 7.874 1001 HA LEU 34 HA LEU 34 -13.997 6.014 6.158 1002 1HB LEU 34 HB2 LEU 34 -13.607 6.105 8.531 1003 2HB LEU 34 HB3 LEU 34 -15.174 5.432 8.903 1004 HG LEU 34 HG LEU 34 -13.255 3.918 9.198 1005 1HD1 LEU 34 HD11 LEU 34 -15.684 3.168 8.816 1006 2HD1 LEU 34 HD12 LEU 34 -15.174 2.720 7.189 1007 3HD1 LEU 34 HD13 LEU 34 -14.412 1.970 8.592 1008 1HD2 LEU 34 HD21 LEU 34 -11.901 4.537 7.253 1009 2HD2 LEU 34 HD22 LEU 34 -12.261 2.802 7.184 1010 3HD2 LEU 34 HD23 LEU 34 -13.131 3.906 6.143 1011 H LYS 35 H LYS 35 -17.364 5.359 7.370 1012 HA LYS 35 HA LYS 35 -17.639 2.896 5.977 1013 1HB LYS 35 HB2 LYS 35 -19.858 4.940 6.316 1014 2HB LYS 35 HB3 LYS 35 -19.985 3.216 5.951 1015 1HG LYS 35 HG2 LYS 35 -18.981 2.697 8.207 1016 2HG LYS 35 HG3 LYS 35 -18.945 4.429 8.536 1017 1HD LYS 35 HD2 LYS 35 -20.938 3.645 9.561 1018 2HD LYS 35 HD3 LYS 35 -21.440 4.519 8.114 1019 1HE LYS 35 HE2 LYS 35 -21.691 2.287 6.931 1020 2HE LYS 35 HE3 LYS 35 -21.198 1.484 8.428 1021 1HZ LYS 35 HZ1 LYS 35 -23.118 2.490 9.475 1022 2HZ LYS 35 HZ2 LYS 35 -23.545 3.225 8.063 1023 3HZ LYS 35 HZ3 LYS 35 -23.571 1.582 8.177 1024 H GLU 36 H GLU 36 -18.125 6.263 4.857 1025 HA GLU 36 HA GLU 36 -19.015 5.623 2.251 1026 1HB GLU 36 HB2 GLU 36 -18.886 7.934 3.483 1027 2HB GLU 36 HB3 GLU 36 -17.253 8.032 2.816 1028 1HG GLU 36 HG2 GLU 36 -18.752 9.181 1.332 1029 2HG GLU 36 HG3 GLU 36 -18.217 7.703 0.519 1030 H LEU 37 H LEU 37 -15.675 6.169 3.445 1031 HA LEU 37 HA LEU 37 -14.260 5.727 1.045 1032 1HB LEU 37 HB2 LEU 37 -13.262 6.579 3.127 1033 2HB LEU 37 HB3 LEU 37 -13.522 5.063 3.949 1034 HG LEU 37 HG LEU 37 -11.691 5.230 1.551 1035 1HD1 LEU 37 HD11 LEU 37 -10.822 6.847 3.121 1036 2HD1 LEU 37 HD12 LEU 37 -11.015 5.707 4.478 1037 3HD1 LEU 37 HD13 LEU 37 -9.816 5.406 3.211 1038 1HD2 LEU 37 HD21 LEU 37 -11.870 3.336 3.950 1039 2HD2 LEU 37 HD22 LEU 37 -12.219 2.907 2.256 1040 3HD2 LEU 37 HD23 LEU 37 -10.578 3.314 2.738 1041 H ILE 38 H ILE 38 -15.228 3.369 3.527 1042 HA ILE 38 HA ILE 38 -14.206 1.118 2.124 1043 HB ILE 38 HB ILE 38 -16.392 1.380 4.228 1044 1HG1 ILE 38 HG12 ILE 38 -13.432 0.588 4.261 1045 2HG1 ILE 38 HG13 ILE 38 -14.129 2.077 4.901 1046 1HG2 ILE 38 HG21 ILE 38 -16.680 -0.770 2.903 1047 2HG2 ILE 38 HG22 ILE 38 -15.030 -1.213 3.386 1048 3HG2 ILE 38 HG23 ILE 38 -16.304 -1.002 4.598 1049 1HD1 ILE 38 HD11 ILE 38 -13.758 0.699 6.735 1050 2HD1 ILE 38 HD12 ILE 38 -15.525 0.613 6.462 1051 3HD1 ILE 38 HD13 ILE 38 -14.462 -0.729 5.947 1052 H GLN 39 H GLN 39 -17.653 2.267 2.254 1053 HA GLN 39 HA GLN 39 -18.570 0.307 0.443 1054 1HB GLN 39 HB2 GLN 39 -19.536 3.147 0.974 1055 2HB GLN 39 HB3 GLN 39 -20.403 2.023 -0.078 1056 1HG GLN 39 HG2 GLN 39 -19.747 1.479 2.851 1057 2HG GLN 39 HG3 GLN 39 -21.295 2.089 2.255 1058 1HE2 GLN 39 HE22 GLN 39 -20.883 -0.381 3.755 1059 2HE2 GLN 39 HE21 GLN 39 -21.426 -1.679 2.699 1060 H LYS 40 H LYS 40 -16.986 3.481 -0.276 1061 HA LYS 40 HA LYS 40 -17.614 3.167 -3.049 1062 1HB LYS 40 HB2 LYS 40 -17.281 5.371 -1.917 1063 2HB LYS 40 HB3 LYS 40 -15.578 4.977 -1.718 1064 1HG LYS 40 HG2 LYS 40 -16.003 6.497 -3.640 1065 2HG LYS 40 HG3 LYS 40 -15.218 4.998 -4.132 1066 1HD LYS 40 HD2 LYS 40 -16.952 5.721 -5.712 1067 2HD LYS 40 HD3 LYS 40 -17.321 4.133 -5.046 1068 1HE LYS 40 HE2 LYS 40 -18.964 5.162 -3.478 1069 2HE LYS 40 HE3 LYS 40 -18.519 6.777 -4.064 1070 1HZ LYS 40 HZ1 LYS 40 -20.505 5.960 -5.079 1071 2HZ LYS 40 HZ2 LYS 40 -19.328 6.136 -6.217 1072 3HZ LYS 40 HZ3 LYS 40 -19.725 4.634 -5.667 1073 H GLU 41 H GLU 41 -14.514 2.668 -1.257 1074 HA GLU 41 HA GLU 41 -13.367 1.555 -3.774 1075 1HB GLU 41 HB2 GLU 41 -12.155 1.899 -1.012 1076 2HB GLU 41 HB3 GLU 41 -11.383 1.111 -2.399 1077 1HG GLU 41 HG2 GLU 41 -10.565 3.297 -2.513 1078 2HG GLU 41 HG3 GLU 41 -11.825 3.263 -3.743 1079 H LEU 42 H LEU 42 -14.164 0.389 -0.510 1080 HA LEU 42 HA LEU 42 -13.556 -2.416 -1.353 1081 1HB LEU 42 HB2 LEU 42 -14.019 -1.208 1.386 1082 2HB LEU 42 HB3 LEU 42 -13.725 -2.921 1.067 1083 HG LEU 42 HG LEU 42 -11.757 -0.646 0.540 1084 1HD1 LEU 42 HD11 LEU 42 -12.145 -1.113 2.937 1085 2HD1 LEU 42 HD12 LEU 42 -11.810 -2.835 2.665 1086 3HD1 LEU 42 HD13 LEU 42 -10.525 -1.632 2.443 1087 1HD2 LEU 42 HD21 LEU 42 -10.128 -2.576 0.235 1088 2HD2 LEU 42 HD22 LEU 42 -11.519 -3.672 0.184 1089 3HD2 LEU 42 HD23 LEU 42 -11.314 -2.414 -1.057 1090 H THR 43 H THR 43 -15.584 -1.748 -2.748 1091 HA THR 43 HA THR 43 -18.137 -1.835 -1.517 1092 HB THR 43 HB THR 43 -17.447 -2.689 -4.355 1093 HG1 THR 43 HG1 THR 43 -17.553 -0.087 -3.226 1094 1HG2 THR 43 HG21 THR 43 -19.562 -1.509 -4.875 1095 2HG2 THR 43 HG22 THR 43 -19.833 -2.838 -3.734 1096 3HG2 THR 43 HG23 THR 43 -19.803 -1.157 -3.149 1097 H ILE 44 H ILE 44 -17.576 -3.580 -0.002 1098 HA ILE 44 HA ILE 44 -17.041 -6.166 -0.392 1099 HB ILE 44 HB ILE 44 -19.349 -5.748 1.493 1100 1HG1 ILE 44 HG12 ILE 44 -17.607 -4.841 3.190 1101 2HG1 ILE 44 HG13 ILE 44 -16.751 -4.224 1.794 1102 1HG2 ILE 44 HG21 ILE 44 -16.584 -6.987 1.814 1103 2HG2 ILE 44 HG22 ILE 44 -17.917 -7.075 2.979 1104 3HG2 ILE 44 HG23 ILE 44 -18.070 -7.875 1.416 1105 1HD1 ILE 44 HD11 ILE 44 -19.643 -3.661 2.662 1106 2HD1 ILE 44 HD12 ILE 44 -18.284 -2.534 2.780 1107 3HD1 ILE 44 HD13 ILE 44 -18.951 -2.958 1.199 1108 H GLY 45 H GLY 45 -18.145 -8.145 -0.711 1109 1HA GLY 45 HA2 GLY 45 -19.551 -8.642 -2.861 1110 2HA GLY 45 HA3 GLY 45 -19.807 -9.600 -1.399 1111 H SER 46 H SER 46 -21.420 -8.301 0.243 1112 HA SER 46 HA SER 46 -23.891 -7.930 -1.380 1113 1HB SER 46 HB2 SER 46 -23.661 -8.407 1.597 1114 2HB SER 46 HB3 SER 46 -25.086 -8.569 0.563 1115 HG SER 46 HG SER 46 -23.834 -10.231 -0.572 1116 H LYS 47 H LYS 47 -21.626 -5.866 -0.377 1117 HA LYS 47 HA LYS 47 -21.431 -3.747 0.203 1118 1HB LYS 47 HB2 LYS 47 -24.202 -3.502 -1.045 1119 2HB LYS 47 HB3 LYS 47 -23.093 -2.182 -0.663 1120 1HG LYS 47 HG2 LYS 47 -22.461 -2.454 -2.814 1121 2HG LYS 47 HG3 LYS 47 -21.369 -3.635 -2.088 1122 1HD LYS 47 HD2 LYS 47 -23.162 -5.422 -2.640 1123 2HD LYS 47 HD3 LYS 47 -24.040 -4.142 -3.484 1124 1HE LYS 47 HE2 LYS 47 -22.780 -5.326 -5.136 1125 2HE LYS 47 HE3 LYS 47 -21.927 -3.792 -4.896 1126 1HZ LYS 47 HZ1 LYS 47 -21.249 -6.414 -3.746 1127 2HZ LYS 47 HZ2 LYS 47 -20.414 -5.625 -4.930 1128 3HZ LYS 47 HZ3 LYS 47 -20.436 -5.035 -3.388 1129 H LEU 48 H LEU 48 -24.838 -4.244 1.040 1130 HA LEU 48 HA LEU 48 -24.559 -2.554 3.468 1131 1HB LEU 48 HB2 LEU 48 -26.963 -4.082 2.405 1132 2HB LEU 48 HB3 LEU 48 -26.963 -2.825 3.652 1133 HG LEU 48 HG LEU 48 -26.301 -2.437 0.694 1134 1HD1 LEU 48 HD11 LEU 48 -28.380 -1.136 0.664 1135 2HD1 LEU 48 HD12 LEU 48 -28.692 -2.801 1.187 1136 3HD1 LEU 48 HD13 LEU 48 -28.650 -1.489 2.385 1137 1HD2 LEU 48 HD21 LEU 48 -26.357 -0.421 2.986 1138 2HD2 LEU 48 HD22 LEU 48 -24.948 -0.859 1.991 1139 3HD2 LEU 48 HD23 LEU 48 -26.306 0.003 1.263 1140 H GLN 49 H GLN 49 -22.832 -4.518 3.755 1141 HA GLN 49 HA GLN 49 -23.956 -6.502 5.683 1142 1HB GLN 49 HB2 GLN 49 -21.116 -5.835 4.762 1143 2HB GLN 49 HB3 GLN 49 -21.554 -7.146 5.876 1144 1HG GLN 49 HG2 GLN 49 -22.851 -8.273 4.148 1145 2HG GLN 49 HG3 GLN 49 -22.684 -6.901 3.045 1146 1HE2 GLN 49 HE22 GLN 49 -20.216 -8.669 5.009 1147 2HE2 GLN 49 HE21 GLN 49 -19.226 -9.060 3.615 1148 H ASP 50 H ASP 50 -24.836 -4.118 6.290 1149 HA ASP 50 HA ASP 50 -23.146 -2.126 7.151 1150 1HB ASP 50 HB2 ASP 50 -25.529 -1.797 6.626 1151 2HB ASP 50 HB3 ASP 50 -25.998 -2.694 8.085 1152 H ALA 51 H ALA 51 -24.698 -4.561 9.194 1153 HA ALA 51 HA ALA 51 -23.831 -3.632 11.723 1154 1HB ALA 51 HB1 ALA 51 -24.042 -5.983 12.461 1155 2HB ALA 51 HB2 ALA 51 -25.414 -5.493 11.446 1156 3HB ALA 51 HB3 ALA 51 -24.127 -6.516 10.768 1157 H GLU 52 H GLU 52 -22.107 -5.629 9.311 1158 HA GLU 52 HA GLU 52 -19.796 -6.108 11.009 1159 1HB GLU 52 HB2 GLU 52 -20.162 -6.379 7.985 1160 2HB GLU 52 HB3 GLU 52 -18.740 -6.860 8.901 1161 1HG GLU 52 HG2 GLU 52 -20.088 -8.820 8.487 1162 2HG GLU 52 HG3 GLU 52 -20.074 -8.468 10.218 1163 H ILE 53 H ILE 53 -20.681 -3.838 8.365 1164 HA ILE 53 HA ILE 53 -18.168 -2.502 8.337 1165 HB ILE 53 HB ILE 53 -20.846 -1.234 7.675 1166 1HG1 ILE 53 HG12 ILE 53 -20.785 -3.045 6.184 1167 2HG1 ILE 53 HG13 ILE 53 -20.075 -1.740 5.271 1168 1HG2 ILE 53 HG21 ILE 53 -19.018 0.391 7.952 1169 2HG2 ILE 53 HG22 ILE 53 -18.001 -0.530 6.835 1170 3HG2 ILE 53 HG23 ILE 53 -19.482 0.259 6.257 1171 1HD1 ILE 53 HD11 ILE 53 -18.560 -4.015 6.630 1172 2HD1 ILE 53 HD12 ILE 53 -18.828 -3.774 4.911 1173 3HD1 ILE 53 HD13 ILE 53 -17.787 -2.643 5.801 1174 H VAL 54 H VAL 54 -21.074 -1.830 10.411 1175 HA VAL 54 HA VAL 54 -19.714 0.439 11.527 1176 HB VAL 54 HB VAL 54 -21.464 0.567 13.210 1177 1HG1 VAL 54 HG11 VAL 54 -23.106 1.395 11.590 1178 2HG1 VAL 54 HG12 VAL 54 -21.462 1.793 11.063 1179 3HG1 VAL 54 HG13 VAL 54 -22.334 0.442 10.304 1180 1HG2 VAL 54 HG21 VAL 54 -23.475 -0.684 13.086 1181 2HG2 VAL 54 HG22 VAL 54 -22.894 -1.612 11.705 1182 3HG2 VAL 54 HG23 VAL 54 -22.139 -1.831 13.299 1183 H LYS 55 H LYS 55 -19.880 -2.993 12.538 1184 HA LYS 55 HA LYS 55 -18.513 -2.576 15.023 1185 1HB LYS 55 HB2 LYS 55 -19.487 -4.711 14.553 1186 2HB LYS 55 HB3 LYS 55 -18.555 -4.902 13.067 1187 1HG LYS 55 HG2 LYS 55 -17.729 -6.305 14.928 1188 2HG LYS 55 HG3 LYS 55 -16.495 -5.224 14.275 1189 1HD LYS 55 HD2 LYS 55 -16.756 -3.694 16.185 1190 2HD LYS 55 HD3 LYS 55 -18.102 -4.664 16.820 1191 1HE LYS 55 HE2 LYS 55 -16.616 -6.529 17.266 1192 2HE LYS 55 HE3 LYS 55 -15.296 -5.778 16.349 1193 1HZ LYS 55 HZ1 LYS 55 -16.428 -4.670 18.814 1194 2HZ LYS 55 HZ2 LYS 55 -15.023 -5.528 18.702 1195 3HZ LYS 55 HZ3 LYS 55 -15.154 -4.072 17.945 1196 H LEU 56 H LEU 56 -17.238 -3.319 11.750 1197 HA LEU 56 HA LEU 56 -14.487 -3.053 12.330 1198 1HB LEU 56 HB2 LEU 56 -15.246 -4.079 10.358 1199 2HB LEU 56 HB3 LEU 56 -16.173 -2.677 9.837 1200 HG LEU 56 HG LEU 56 -13.249 -2.179 10.188 1201 1HD1 LEU 56 HD11 LEU 56 -13.218 -4.445 9.150 1202 2HD1 LEU 56 HD12 LEU 56 -14.371 -3.898 7.916 1203 3HD1 LEU 56 HD13 LEU 56 -12.737 -3.210 7.972 1204 1HD2 LEU 56 HD21 LEU 56 -13.587 -0.936 8.159 1205 2HD2 LEU 56 HD22 LEU 56 -15.250 -1.565 7.974 1206 3HD2 LEU 56 HD23 LEU 56 -14.856 -0.467 9.301 1207 H MET 57 H MET 57 -16.846 -0.580 11.336 1208 HA MET 57 HA MET 57 -15.131 1.652 11.141 1209 1HB MET 57 HB2 MET 57 -17.536 1.574 10.374 1210 2HB MET 57 HB3 MET 57 -17.998 1.488 12.083 1211 1HG MET 57 HG2 MET 57 -16.807 3.773 12.331 1212 2HG MET 57 HG3 MET 57 -16.863 3.815 10.582 1213 1HE MET 57 HE1 MET 57 -18.840 3.910 13.942 1214 2HE MET 57 HE2 MET 57 -20.534 3.950 13.404 1215 3HE MET 57 HE3 MET 57 -19.596 2.456 13.253 1216 H ASP 58 H ASP 58 -17.060 0.400 13.953 1217 HA ASP 58 HA ASP 58 -16.172 2.297 15.842 1218 1HB ASP 58 HB2 ASP 58 -17.980 0.719 16.320 1219 2HB ASP 58 HB3 ASP 58 -16.838 -0.632 16.315 1220 H ASP 59 H ASP 59 -14.732 -0.854 14.884 1221 HA ASP 59 HA ASP 59 -12.575 -0.652 16.719 1222 1HB ASP 59 HB2 ASP 59 -12.568 -2.099 14.023 1223 2HB ASP 59 HB3 ASP 59 -11.476 -2.413 15.375 1224 H LEU 60 H LEU 60 -12.804 0.568 13.397 1225 HA LEU 60 HA LEU 60 -10.116 1.693 13.392 1226 1HB LEU 60 HB2 LEU 60 -12.685 2.082 11.821 1227 2HB LEU 60 HB3 LEU 60 -11.378 3.247 11.611 1228 HG LEU 60 HG LEU 60 -10.818 0.290 11.362 1229 1HD1 LEU 60 HD11 LEU 60 -11.945 2.017 9.159 1230 2HD1 LEU 60 HD12 LEU 60 -11.297 0.388 8.937 1231 3HD1 LEU 60 HD13 LEU 60 -12.761 0.630 9.921 1232 1HD2 LEU 60 HD21 LEU 60 -8.892 1.868 11.221 1233 2HD2 LEU 60 HD22 LEU 60 -9.201 1.188 9.600 1234 3HD2 LEU 60 HD23 LEU 60 -9.739 2.817 9.976 1235 H ASP 61 H ASP 61 -13.259 3.344 13.806 1236 HA ASP 61 HA ASP 61 -12.057 5.794 14.429 1237 1HB ASP 61 HB2 ASP 61 -14.204 6.668 14.889 1238 2HB ASP 61 HB3 ASP 61 -14.296 5.600 13.487 1239 H ARG 62 H ARG 62 -12.816 3.144 16.697 1240 HA ARG 62 HA ARG 62 -13.228 4.734 18.924 1241 1HB ARG 62 HB2 ARG 62 -12.644 2.869 20.318 1242 2HB ARG 62 HB3 ARG 62 -13.645 2.370 18.953 1243 1HG ARG 62 HG2 ARG 62 -11.505 1.624 17.785 1244 2HG ARG 62 HG3 ARG 62 -10.641 1.936 19.296 1245 1HD ARG 62 HD2 ARG 62 -12.957 -0.015 18.896 1246 2HD ARG 62 HD3 ARG 62 -11.260 -0.432 19.079 1247 HE ARG 62 HE ARG 62 -11.260 0.213 21.342 1248 1HH1 ARG 62 HH22 ARG 62 -14.579 0.320 19.975 1249 2HH1 ARG 62 HH21 ARG 62 -15.313 0.413 21.542 1250 1HH2 ARG 62 HH12 ARG 62 -12.277 0.290 23.342 1251 2HH2 ARG 62 HH11 ARG 62 -14.013 0.362 23.470 1252 H ASN 63 H ASN 63 -10.206 4.021 17.323 1253 HA ASN 63 HA ASN 63 -8.186 4.803 18.975 1254 1HB ASN 63 HB2 ASN 63 -7.752 4.322 16.668 1255 2HB ASN 63 HB3 ASN 63 -8.828 5.617 16.130 1256 1HD2 ASN 63 HD22 ASN 63 -6.357 5.977 18.751 1257 2HD2 ASN 63 HD21 ASN 63 -5.362 7.082 17.840 1258 H LYS 64 H LYS 64 -10.434 7.091 17.396 1259 HA LYS 64 HA LYS 64 -10.067 8.936 19.661 1260 1HB LYS 64 HB2 LYS 64 -9.687 9.925 16.800 1261 2HB LYS 64 HB3 LYS 64 -9.834 10.917 18.256 1262 1HG LYS 64 HG2 LYS 64 -7.799 9.809 19.183 1263 2HG LYS 64 HG3 LYS 64 -7.606 8.937 17.649 1264 1HD LYS 64 HD2 LYS 64 -7.476 11.081 16.418 1265 2HD LYS 64 HD3 LYS 64 -7.619 11.976 17.940 1266 1HE LYS 64 HE2 LYS 64 -5.370 10.019 17.241 1267 2HE LYS 64 HE3 LYS 64 -5.259 11.785 17.156 1268 1HZ LYS 64 HZ1 LYS 64 -5.752 10.214 19.586 1269 2HZ LYS 64 HZ2 LYS 64 -4.345 10.964 19.176 1270 3HZ LYS 64 HZ3 LYS 64 -5.687 11.859 19.510 1271 H ASP 65 H ASP 65 -12.007 7.242 19.410 1272 HA ASP 65 HA ASP 65 -14.221 6.927 19.335 1273 1HB ASP 65 HB2 ASP 65 -15.560 8.787 20.363 1274 2HB ASP 65 HB3 ASP 65 -14.156 8.211 21.261 1275 H GLN 66 H GLN 66 -14.230 10.210 18.024 1276 HA GLN 66 HA GLN 66 -16.479 9.596 16.236 1277 1HB GLN 66 HB2 GLN 66 -14.807 12.062 16.805 1278 2HB GLN 66 HB3 GLN 66 -16.082 12.037 15.577 1279 1HG GLN 66 HG2 GLN 66 -17.807 11.717 17.135 1280 2HG GLN 66 HG3 GLN 66 -16.729 11.139 18.404 1281 1HE2 GLN 66 HE22 GLN 66 -15.204 12.680 19.394 1282 2HE2 GLN 66 HE21 GLN 66 -15.676 14.377 19.477 1283 H GLU 67 H GLU 67 -12.940 9.811 16.072 1284 HA GLU 67 HA GLU 67 -13.078 9.223 13.168 1285 1HB GLU 67 HB2 GLU 67 -11.092 11.213 14.343 1286 2HB GLU 67 HB3 GLU 67 -11.409 10.833 12.648 1287 1HG GLU 67 HG2 GLU 67 -13.805 11.847 13.125 1288 2HG GLU 67 HG3 GLU 67 -13.072 12.468 14.598 1289 H VAL 68 H VAL 68 -11.240 8.311 12.258 1290 HA VAL 68 HA VAL 68 -9.403 6.938 14.190 1291 HB VAL 68 HB VAL 68 -10.635 5.404 12.728 1292 1HG1 VAL 68 HG11 VAL 68 -11.001 6.775 10.725 1293 2HG1 VAL 68 HG12 VAL 68 -9.260 6.726 10.359 1294 3HG1 VAL 68 HG13 VAL 68 -10.220 5.243 10.340 1295 1HG2 VAL 68 HG21 VAL 68 -7.694 5.555 11.989 1296 2HG2 VAL 68 HG22 VAL 68 -8.320 4.906 13.518 1297 3HG2 VAL 68 HG23 VAL 68 -8.724 4.116 11.986 1298 H ASN 69 H ASN 69 -7.237 7.583 14.157 1299 HA ASN 69 HA ASN 69 -6.573 9.825 12.391 1300 1HB ASN 69 HB2 ASN 69 -4.892 10.350 13.745 1301 2HB ASN 69 HB3 ASN 69 -5.786 9.393 14.924 1302 1HD2 ASN 69 HD21 ASN 69 -4.968 7.192 15.358 1303 2HD2 ASN 69 HD22 ASN 69 -3.276 6.823 15.028 1304 H PHE 70 H PHE 70 -4.847 9.837 10.925 1305 HA PHE 70 HA PHE 70 -4.696 7.946 9.009 1306 1HB PHE 70 HB2 PHE 70 -3.709 10.127 8.772 1307 2HB PHE 70 HB3 PHE 70 -2.505 9.781 10.015 1308 HD1 PHE 70 HD1 PHE 70 -3.751 8.452 6.717 1309 HD2 PHE 70 HD2 PHE 70 -0.375 8.987 9.355 1310 HE1 PHE 70 HE1 PHE 70 -2.317 7.179 5.151 1311 HE2 PHE 70 HE2 PHE 70 1.055 7.762 7.776 1312 HZ PHE 70 HZ PHE 70 0.075 6.779 5.699 1313 H GLN 71 H GLN 71 -2.349 7.900 11.820 1314 HA GLN 71 HA GLN 71 -1.047 5.625 10.638 1315 1HB GLN 71 HB2 GLN 71 0.094 7.141 12.235 1316 2HB GLN 71 HB3 GLN 71 -0.883 6.455 13.555 1317 1HG GLN 71 HG2 GLN 71 0.027 4.195 13.061 1318 2HG GLN 71 HG3 GLN 71 0.886 4.837 11.650 1319 1HE2 GLN 71 HE22 GLN 71 2.766 3.763 12.693 1320 2HE2 GLN 71 HE21 GLN 71 3.581 4.641 13.982 1321 H GLU 72 H GLU 72 -3.792 5.917 12.929 1322 HA GLU 72 HA GLU 72 -3.683 3.054 13.502 1323 1HB GLU 72 HB2 GLU 72 -5.644 5.213 14.234 1324 2HB GLU 72 HB3 GLU 72 -6.044 3.508 14.449 1325 1HG GLU 72 HG2 GLU 72 -3.545 4.810 15.627 1326 2HG GLU 72 HG3 GLU 72 -5.026 4.456 16.525 1327 H TYR 73 H TYR 73 -5.309 5.141 11.156 1328 HA TYR 73 HA TYR 73 -6.965 3.131 9.973 1329 1HB TYR 73 HB2 TYR 73 -7.381 5.224 9.161 1330 2HB TYR 73 HB3 TYR 73 -5.706 5.692 9.066 1331 HD1 TYR 73 HD1 TYR 73 -4.338 5.301 7.098 1332 HD2 TYR 73 HD2 TYR 73 -8.416 3.889 7.320 1333 HE1 TYR 73 HE1 TYR 73 -4.381 5.041 4.652 1334 HE2 TYR 73 HE2 TYR 73 -8.481 3.733 4.843 1335 HH TYR 73 HH TYR 73 -5.790 4.825 2.799 1336 H ILE 74 H ILE 74 -3.530 4.029 9.268 1337 HA ILE 74 HA ILE 74 -3.046 1.880 7.479 1338 HB ILE 74 HB ILE 74 -1.106 3.243 9.378 1339 1HG1 ILE 74 HG12 ILE 74 -2.185 4.795 7.732 1340 2HG1 ILE 74 HG13 ILE 74 -0.446 4.666 7.625 1341 1HG2 ILE 74 HG21 ILE 74 -0.053 1.236 8.777 1342 2HG2 ILE 74 HG22 ILE 74 -0.648 1.297 7.104 1343 3HG2 ILE 74 HG23 ILE 74 0.604 2.422 7.651 1344 1HD1 ILE 74 HD11 ILE 74 -2.441 3.349 5.753 1345 2HD1 ILE 74 HD12 ILE 74 -1.417 4.751 5.403 1346 3HD1 ILE 74 HD13 ILE 74 -0.666 3.177 5.638 1347 H THR 75 H THR 75 -2.532 1.974 11.026 1348 HA THR 75 HA THR 75 -1.530 -0.609 11.421 1349 HB THR 75 HB THR 75 -3.432 0.909 13.257 1350 HG1 THR 75 HG1 THR 75 -1.622 2.167 12.651 1351 1HG2 THR 75 HG21 THR 75 -2.152 -0.208 15.070 1352 2HG2 THR 75 HG22 THR 75 -3.143 -1.316 14.112 1353 3HG2 THR 75 HG23 THR 75 -1.389 -1.248 13.853 1354 H PHE 76 H PHE 76 -4.932 0.477 11.295 1355 HA PHE 76 HA PHE 76 -6.067 -2.095 11.861 1356 1HB PHE 76 HB2 PHE 76 -7.265 0.022 12.238 1357 2HB PHE 76 HB3 PHE 76 -7.253 0.328 10.500 1358 HD1 PHE 76 HD1 PHE 76 -8.699 -1.001 8.966 1359 HD2 PHE 76 HD2 PHE 76 -8.658 -1.799 13.212 1360 HE1 PHE 76 HE1 PHE 76 -10.635 -2.482 8.706 1361 HE2 PHE 76 HE2 PHE 76 -10.511 -3.419 12.909 1362 HZ PHE 76 HZ PHE 76 -11.447 -3.827 10.636 1363 H LEU 77 H LEU 77 -5.397 -0.304 8.762 1364 HA LEU 77 HA LEU 77 -6.342 -2.436 7.087 1365 1HB LEU 77 HB2 LEU 77 -4.218 -0.307 6.656 1366 2HB LEU 77 HB3 LEU 77 -4.672 -1.477 5.413 1367 HG LEU 77 HG LEU 77 -6.662 0.416 6.753 1368 1HD1 LEU 77 HD11 LEU 77 -5.057 1.718 5.454 1369 2HD1 LEU 77 HD12 LEU 77 -5.265 0.635 4.052 1370 3HD1 LEU 77 HD13 LEU 77 -6.617 1.633 4.611 1371 1HD2 LEU 77 HD21 LEU 77 -7.827 -1.508 5.831 1372 2HD2 LEU 77 HD22 LEU 77 -8.036 -0.167 4.714 1373 3HD2 LEU 77 HD23 LEU 77 -6.847 -1.436 4.336 1374 H GLY 78 H GLY 78 -3.270 -1.959 8.803 1375 1HA GLY 78 HA2 GLY 78 -1.939 -4.299 7.955 1376 2HA GLY 78 HA3 GLY 78 -1.784 -3.545 9.557 1377 H ALA 79 H ALA 79 -4.274 -3.894 10.690 1378 HA ALA 79 HA ALA 79 -4.352 -6.631 11.430 1379 1HB ALA 79 HB1 ALA 79 -6.718 -4.701 11.552 1380 2HB ALA 79 HB2 ALA 79 -5.427 -4.769 12.758 1381 3HB ALA 79 HB3 ALA 79 -6.474 -6.170 12.501 1382 H LEU 80 H LEU 80 -6.364 -4.865 9.082 1383 HA LEU 80 HA LEU 80 -8.037 -6.966 8.288 1384 1HB LEU 80 HB2 LEU 80 -7.926 -4.341 7.712 1385 2HB LEU 80 HB3 LEU 80 -7.039 -4.910 6.302 1386 HG LEU 80 HG LEU 80 -9.052 -6.459 5.864 1387 1HD1 LEU 80 HD11 LEU 80 -10.303 -4.567 7.912 1388 2HD1 LEU 80 HD12 LEU 80 -11.206 -5.670 6.859 1389 3HD1 LEU 80 HD13 LEU 80 -10.137 -6.323 8.106 1390 1HD2 LEU 80 HD21 LEU 80 -8.622 -4.353 4.600 1391 2HD2 LEU 80 HD22 LEU 80 -10.360 -4.606 4.850 1392 3HD2 LEU 80 HD23 LEU 80 -9.488 -3.437 5.858 1393 H ALA 81 H ALA 81 -4.893 -5.925 6.982 1394 HA ALA 81 HA ALA 81 -4.591 -7.907 4.958 1395 1HB ALA 81 HB1 ALA 81 -2.164 -7.390 5.221 1396 2HB ALA 81 HB2 ALA 81 -3.200 -5.964 4.952 1397 3HB ALA 81 HB3 ALA 81 -2.572 -6.314 6.568 1398 H MET 82 H MET 82 -3.646 -7.867 8.428 1399 HA MET 82 HA MET 82 -2.356 -10.364 8.388 1400 1HB MET 82 HB2 MET 82 -2.146 -8.603 10.138 1401 2HB MET 82 HB3 MET 82 -3.731 -9.075 10.771 1402 1HG MET 82 HG2 MET 82 -2.916 -11.251 11.386 1403 2HG MET 82 HG3 MET 82 -1.454 -11.058 10.415 1404 1HE MET 82 HE1 MET 82 -2.099 -8.765 14.369 1405 2HE MET 82 HE2 MET 82 -3.331 -9.822 13.639 1406 3HE MET 82 HE3 MET 82 -2.897 -8.277 12.862 1407 H ILE 83 H ILE 83 -5.744 -9.483 9.026 1408 HA ILE 83 HA ILE 83 -6.735 -12.115 9.584 1409 HB ILE 83 HB ILE 83 -8.057 -9.594 8.525 1410 1HG1 ILE 83 HG12 ILE 83 -8.364 -10.992 11.217 1411 2HG1 ILE 83 HG13 ILE 83 -7.117 -9.780 10.933 1412 1HG2 ILE 83 HG21 ILE 83 -9.365 -12.238 9.300 1413 2HG2 ILE 83 HG22 ILE 83 -9.382 -11.484 7.692 1414 3HG2 ILE 83 HG23 ILE 83 -10.235 -10.716 9.020 1415 1HD1 ILE 83 HD11 ILE 83 -10.112 -9.291 10.731 1416 2HD1 ILE 83 HD12 ILE 83 -8.848 -8.111 10.313 1417 3HD1 ILE 83 HD13 ILE 83 -8.998 -8.710 11.975 1418 H TYR 84 H TYR 84 -6.262 -10.289 6.529 1419 HA TYR 84 HA TYR 84 -7.073 -12.506 4.832 1420 1HB TYR 84 HB2 TYR 84 -5.316 -10.146 4.123 1421 2HB TYR 84 HB3 TYR 84 -6.177 -11.205 3.016 1422 HD1 TYR 84 HD1 TYR 84 -6.237 -8.189 3.043 1423 HD2 TYR 84 HD2 TYR 84 -8.861 -11.123 4.821 1424 HE1 TYR 84 HE1 TYR 84 -8.142 -6.634 2.811 1425 HE2 TYR 84 HE2 TYR 84 -10.754 -9.560 4.588 1426 HH TYR 84 HH TYR 84 -10.407 -6.334 3.096 1427 H ASN 85 H ASN 85 -5.582 -13.736 6.577 1428 HA ASN 85 HA ASN 85 -2.979 -14.409 6.288 1429 1HB ASN 85 HB2 ASN 85 -3.617 -16.671 6.855 1430 2HB ASN 85 HB3 ASN 85 -4.556 -15.506 7.792 1431 1HD2 ASN 85 HD22 ASN 85 -6.898 -15.049 6.993 1432 2HD2 ASN 85 HD21 ASN 85 -7.681 -16.397 6.194 1433 H GLU 86 H GLU 86 -5.579 -15.296 3.988 1434 HA GLU 86 HA GLU 86 -4.097 -16.842 2.177 1435 1HB GLU 86 HB2 GLU 86 -6.536 -16.560 2.184 1436 2HB GLU 86 HB3 GLU 86 -6.385 -14.889 1.631 1437 1HG GLU 86 HG2 GLU 86 -5.354 -17.314 0.078 1438 2HG GLU 86 HG3 GLU 86 -6.974 -16.639 -0.122 1439 H ALA 87 H ALA 87 -4.435 -13.262 2.361 1440 HA ALA 87 HA ALA 87 -2.865 -12.755 -0.017 1441 1HB ALA 87 HB1 ALA 87 -3.505 -10.886 2.304 1442 2HB ALA 87 HB2 ALA 87 -2.898 -10.440 0.701 1443 3HB ALA 87 HB3 ALA 87 -4.525 -11.131 0.867 1444 H LEU 88 H LEU 88 -2.215 -13.030 3.500 1445 HA LEU 88 HA LEU 88 0.536 -12.266 3.398 1446 1HB LEU 88 HB2 LEU 88 -0.536 -14.418 5.218 1447 2HB LEU 88 HB3 LEU 88 0.880 -13.411 5.440 1448 HG LEU 88 HG LEU 88 -2.025 -12.514 5.588 1449 1HD1 LEU 88 HD11 LEU 88 -1.015 -13.890 7.471 1450 2HD1 LEU 88 HD12 LEU 88 0.167 -12.584 7.701 1451 3HD1 LEU 88 HD13 LEU 88 -1.562 -12.293 7.953 1452 1HD2 LEU 88 HD21 LEU 88 0.481 -10.843 5.949 1453 2HD2 LEU 88 HD22 LEU 88 -0.725 -10.662 4.651 1454 3HD2 LEU 88 HD23 LEU 88 -1.161 -10.329 6.330 1455 H LYS 89 H LYS 89 -0.979 -15.496 2.883 1456 HA LYS 89 HA LYS 89 1.522 -16.819 2.268 1457 1HB LYS 89 HB2 LYS 89 -1.390 -17.442 1.668 1458 2HB LYS 89 HB3 LYS 89 -0.100 -18.286 0.827 1459 1HG LYS 89 HG2 LYS 89 -0.645 -19.696 2.529 1460 2HG LYS 89 HG3 LYS 89 0.888 -18.996 3.036 1461 1HD LYS 89 HD2 LYS 89 -1.763 -17.842 3.972 1462 2HD LYS 89 HD3 LYS 89 -1.144 -19.313 4.714 1463 1HE LYS 89 HE2 LYS 89 0.815 -18.266 5.561 1464 2HE LYS 89 HE3 LYS 89 0.574 -16.806 4.603 1465 1HZ LYS 89 HZ1 LYS 89 -1.191 -17.712 6.754 1466 2HZ LYS 89 HZ2 LYS 89 -0.093 -16.482 6.844 1467 3HZ LYS 89 HZ3 LYS 89 -1.392 -16.356 5.831 1468 H GLY 90 H GLY 90 -0.886 -15.108 0.262 1469 1HA GLY 90 HA2 GLY 90 0.087 -15.505 -2.291 1470 2HA GLY 90 HA3 GLY 90 -0.652 -13.998 -1.724 Start of MODEL 12 1 1H MET 1 H1 MET 1 -13.480 0.950 -6.385 2 2H MET 1 H2 MET 1 -14.559 0.366 -5.294 3 3H MET 1 H3 MET 1 -14.995 0.496 -6.878 4 HA MET 1 HA MET 1 -14.511 -1.775 -6.275 5 1HB MET 1 HB2 MET 1 -12.480 -0.537 -8.189 6 2HB MET 1 HB3 MET 1 -12.862 -2.263 -8.071 7 1HG MET 1 HG2 MET 1 -15.229 -1.762 -8.667 8 2HG MET 1 HG3 MET 1 -14.794 -0.057 -8.887 9 1HE MET 1 HE1 MET 1 -16.319 -1.786 -11.058 10 2HE MET 1 HE2 MET 1 -15.881 -0.070 -11.272 11 3HE MET 1 HE3 MET 1 -15.471 -1.259 -12.531 12 H ALA 2 H ALA 2 -13.061 -3.305 -5.425 13 HA ALA 2 HA ALA 2 -11.472 -2.217 -3.286 14 1HB ALA 2 HB1 ALA 2 -12.967 -4.181 -3.056 15 2HB ALA 2 HB2 ALA 2 -11.914 -5.105 -4.149 16 3HB ALA 2 HB3 ALA 2 -11.302 -4.553 -2.576 17 H SER 3 H SER 3 -10.716 -3.612 -6.440 18 HA SER 3 HA SER 3 -8.401 -4.826 -6.108 19 1HB SER 3 HB2 SER 3 -8.542 -3.134 -8.562 20 2HB SER 3 HB3 SER 3 -8.292 -4.864 -8.357 21 HG SER 3 HG SER 3 -10.389 -4.397 -9.196 22 HA PRO 4 HA PRO 4 -5.788 -0.729 -6.760 23 1HB PRO 4 HB2 PRO 4 -7.639 1.141 -5.270 24 2HB PRO 4 HB3 PRO 4 -6.487 1.509 -6.584 25 1HG PRO 4 HG2 PRO 4 -9.112 1.273 -7.151 26 2HG PRO 4 HG3 PRO 4 -7.915 0.464 -8.211 27 1HD PRO 4 HD2 PRO 4 -9.483 -0.732 -5.923 28 2HD PRO 4 HD3 PRO 4 -9.346 -1.342 -7.586 29 H LEU 5 H LEU 5 -7.825 -0.684 -3.722 30 HA LEU 5 HA LEU 5 -5.516 -0.264 -2.092 31 1HB LEU 5 HB2 LEU 5 -7.755 0.328 -1.316 32 2HB LEU 5 HB3 LEU 5 -8.245 -1.377 -1.344 33 HG LEU 5 HG LEU 5 -6.582 -1.908 0.409 34 1HD1 LEU 5 HD11 LEU 5 -5.442 -0.061 1.609 35 2HD1 LEU 5 HD12 LEU 5 -4.814 -0.240 -0.027 36 3HD1 LEU 5 HD13 LEU 5 -5.942 1.086 0.347 37 1HD2 LEU 5 HD21 LEU 5 -8.852 -1.149 1.052 38 2HD2 LEU 5 HD22 LEU 5 -7.601 -0.742 2.249 39 3HD2 LEU 5 HD23 LEU 5 -8.226 0.522 1.158 40 H ASP 6 H ASP 6 -7.366 -3.192 -3.025 41 HA ASP 6 HA ASP 6 -6.049 -5.053 -1.377 42 1HB ASP 6 HB2 ASP 6 -7.047 -5.489 -4.234 43 2HB ASP 6 HB3 ASP 6 -6.654 -6.761 -3.074 44 H GLN 7 H GLN 7 -5.093 -4.042 -4.718 45 HA GLN 7 HA GLN 7 -2.754 -5.683 -4.728 46 1HB GLN 7 HB2 GLN 7 -1.985 -4.428 -6.618 47 2HB GLN 7 HB3 GLN 7 -3.701 -4.817 -6.785 48 1HG GLN 7 HG2 GLN 7 -4.282 -2.508 -6.117 49 2HG GLN 7 HG3 GLN 7 -2.583 -2.071 -5.999 50 1HE2 GLN 7 HE22 GLN 7 -1.298 -2.685 -8.142 51 2HE2 GLN 7 HE21 GLN 7 -2.143 -2.254 -9.621 52 H ALA 8 H ALA 8 -3.282 -2.316 -3.570 53 HA ALA 8 HA ALA 8 -0.524 -1.776 -3.108 54 1HB ALA 8 HB1 ALA 8 -1.345 -0.027 -1.576 55 2HB ALA 8 HB2 ALA 8 -2.079 -0.011 -3.191 56 3HB ALA 8 HB3 ALA 8 -3.004 -0.622 -1.795 57 H ILE 9 H ILE 9 -3.057 -2.946 -0.760 58 HA ILE 9 HA ILE 9 -1.131 -3.302 1.346 59 HB ILE 9 HB ILE 9 -2.798 -4.630 2.500 60 1HG1 ILE 9 HG12 ILE 9 -4.500 -4.508 0.036 61 2HG1 ILE 9 HG13 ILE 9 -3.750 -5.962 0.718 62 1HG2 ILE 9 HG21 ILE 9 -4.393 -2.870 2.811 63 2HG2 ILE 9 HG22 ILE 9 -2.835 -2.140 2.443 64 3HG2 ILE 9 HG23 ILE 9 -4.083 -2.231 1.183 65 1HD1 ILE 9 HD11 ILE 9 -6.035 -5.952 1.420 66 2HD1 ILE 9 HD12 ILE 9 -5.054 -5.569 2.849 67 3HD1 ILE 9 HD13 ILE 9 -5.945 -4.286 1.999 68 H GLY 10 H GLY 10 -2.338 -5.470 -1.199 69 1HA GLY 10 HA2 GLY 10 -0.931 -7.814 -0.793 70 2HA GLY 10 HA3 GLY 10 -1.274 -7.083 -2.367 71 H LEU 11 H LEU 11 0.300 -4.764 -2.287 72 HA LEU 11 HA LEU 11 2.817 -5.738 -3.035 73 1HB LEU 11 HB2 LEU 11 1.586 -3.485 -3.566 74 2HB LEU 11 HB3 LEU 11 2.321 -2.896 -2.082 75 HG LEU 11 HG LEU 11 3.623 -2.138 -3.876 76 1HD1 LEU 11 HD11 LEU 11 5.233 -4.457 -2.831 77 2HD1 LEU 11 HD12 LEU 11 5.796 -2.887 -3.426 78 3HD1 LEU 11 HD13 LEU 11 4.886 -2.969 -1.905 79 1HD2 LEU 11 HD21 LEU 11 3.858 -4.966 -4.942 80 2HD2 LEU 11 HD22 LEU 11 2.833 -3.666 -5.598 81 3HD2 LEU 11 HD23 LEU 11 4.597 -3.498 -5.615 82 H LEU 12 H LEU 12 2.023 -3.829 -0.093 83 HA LEU 12 HA LEU 12 4.510 -4.032 1.237 84 1HB LEU 12 HB2 LEU 12 1.622 -3.881 2.253 85 2HB LEU 12 HB3 LEU 12 3.003 -3.948 3.342 86 HG LEU 12 HG LEU 12 3.938 -1.911 2.363 87 1HD1 LEU 12 HD11 LEU 12 1.272 -1.713 0.891 88 2HD1 LEU 12 HD12 LEU 12 2.459 -0.408 1.020 89 3HD1 LEU 12 HD13 LEU 12 2.873 -1.865 0.122 90 1HD2 LEU 12 HD21 LEU 12 2.621 -1.773 4.394 91 2HD2 LEU 12 HD22 LEU 12 2.276 -0.362 3.398 92 3HD2 LEU 12 HD23 LEU 12 1.108 -1.698 3.461 93 H ILE 13 H ILE 13 1.692 -6.222 1.338 94 HA ILE 13 HA ILE 13 2.796 -8.007 3.266 95 HB ILE 13 HB ILE 13 0.674 -8.346 1.087 96 1HG1 ILE 13 HG12 ILE 13 0.281 -8.190 4.099 97 2HG1 ILE 13 HG13 ILE 13 0.359 -6.731 3.121 98 1HG2 ILE 13 HG21 ILE 13 -0.065 -10.369 2.369 99 2HG2 ILE 13 HG22 ILE 13 1.485 -10.585 1.566 100 3HG2 ILE 13 HG23 ILE 13 1.442 -10.247 3.309 101 1HD1 ILE 13 HD11 ILE 13 -1.934 -7.194 3.314 102 2HD1 ILE 13 HD12 ILE 13 -1.517 -7.717 1.680 103 3HD1 ILE 13 HD13 ILE 13 -1.732 -8.922 2.967 104 H GLY 14 H GLY 14 2.759 -8.130 -0.279 105 1HA GLY 14 HA2 GLY 14 4.094 -10.564 -0.693 106 2HA GLY 14 HA3 GLY 14 4.059 -9.182 -1.807 107 H ILE 15 H ILE 15 5.422 -7.181 -0.571 108 HA ILE 15 HA ILE 15 8.147 -7.865 -0.891 109 HB ILE 15 HB ILE 15 6.617 -5.537 0.236 110 1HG1 ILE 15 HG12 ILE 15 8.834 -5.861 -1.843 111 2HG1 ILE 15 HG13 ILE 15 7.097 -5.832 -2.180 112 1HG2 ILE 15 HG21 ILE 15 8.712 -4.368 0.867 113 2HG2 ILE 15 HG22 ILE 15 8.317 -5.723 1.902 114 3HG2 ILE 15 HG23 ILE 15 9.601 -5.897 0.674 115 1HD1 ILE 15 HD11 ILE 15 7.064 -3.477 -1.169 116 2HD1 ILE 15 HD12 ILE 15 8.839 -3.532 -1.205 117 3HD1 ILE 15 HD13 ILE 15 7.926 -3.655 -2.709 118 H PHE 16 H PHE 16 6.280 -7.392 2.153 119 HA PHE 16 HA PHE 16 8.337 -8.057 3.889 120 1HB PHE 16 HB2 PHE 16 6.092 -7.148 4.486 121 2HB PHE 16 HB3 PHE 16 5.375 -8.722 4.216 122 HD1 PHE 16 HD1 PHE 16 6.152 -10.710 5.708 123 HD2 PHE 16 HD2 PHE 16 7.252 -6.634 6.539 124 HE1 PHE 16 HE1 PHE 16 6.598 -11.295 8.036 125 HE2 PHE 16 HE2 PHE 16 7.505 -7.200 8.948 126 HZ PHE 16 HZ PHE 16 7.086 -9.506 9.720 127 H HIS 17 H HIS 17 5.856 -10.369 2.622 128 HA HIS 17 HA HIS 17 7.116 -12.542 4.020 129 1HB HIS 17 HB2 HIS 17 4.940 -12.517 1.917 130 2HB HIS 17 HB3 HIS 17 5.500 -13.969 2.764 131 HD1 HIS 17 HD1 HIS 17 3.737 -10.656 3.507 132 HD2 HIS 17 HD2 HIS 17 5.004 -14.174 5.419 133 HE1 HIS 17 HE1 HIS 17 2.835 -10.562 5.911 134 H LYS 18 H LYS 18 7.596 -11.249 0.750 135 HA LYS 18 HA LYS 18 9.083 -13.517 -0.242 136 1HB LYS 18 HB2 LYS 18 9.167 -10.551 -0.875 137 2HB LYS 18 HB3 LYS 18 10.277 -11.713 -1.617 138 1HG LYS 18 HG2 LYS 18 8.362 -13.064 -2.430 139 2HG LYS 18 HG3 LYS 18 7.238 -11.852 -1.818 140 1HD LYS 18 HD2 LYS 18 9.401 -11.428 -3.942 141 2HD LYS 18 HD3 LYS 18 7.667 -11.615 -4.242 142 1HE LYS 18 HE2 LYS 18 7.243 -9.533 -2.897 143 2HE LYS 18 HE3 LYS 18 8.999 -9.309 -2.744 144 1HZ LYS 18 HZ1 LYS 18 8.108 -8.038 -4.524 145 2HZ LYS 18 HZ2 LYS 18 9.135 -9.183 -5.112 146 3HZ LYS 18 HZ3 LYS 18 7.505 -9.382 -5.262 147 H TYR 19 H TYR 19 10.060 -10.573 1.634 148 HA TYR 19 HA TYR 19 12.789 -11.489 1.829 149 1HB TYR 19 HB2 TYR 19 11.220 -9.402 3.331 150 2HB TYR 19 HB3 TYR 19 12.833 -9.895 3.860 151 HD1 TYR 19 HD1 TYR 19 10.996 -8.054 1.268 152 HD2 TYR 19 HD2 TYR 19 14.839 -9.572 2.451 153 HE1 TYR 19 HE1 TYR 19 11.911 -7.378 -0.908 154 HE2 TYR 19 HE2 TYR 19 15.834 -8.580 0.420 155 HH TYR 19 HH TYR 19 13.794 -7.221 -2.221 156 H SER 20 H SER 20 10.018 -11.845 4.171 157 HA SER 20 HA SER 20 11.328 -13.332 6.110 158 1HB SER 20 HB2 SER 20 8.602 -14.115 4.998 159 2HB SER 20 HB3 SER 20 9.275 -14.432 6.603 160 HG SER 20 HG SER 20 7.925 -12.726 6.777 161 H GLY 21 H GLY 21 10.004 -14.512 3.026 162 1HA GLY 21 HA2 GLY 21 10.375 -17.184 2.995 163 2HA GLY 21 HA3 GLY 21 10.676 -16.134 1.604 164 H LYS 22 H LYS 22 13.064 -14.816 2.933 165 HA LYS 22 HA LYS 22 15.170 -16.435 2.014 166 1HB LYS 22 HB2 LYS 22 15.291 -14.004 2.611 167 2HB LYS 22 HB3 LYS 22 15.184 -14.449 4.320 168 1HG LYS 22 HG2 LYS 22 17.321 -15.800 4.046 169 2HG LYS 22 HG3 LYS 22 17.358 -15.295 2.352 170 1HD LYS 22 HD2 LYS 22 18.861 -13.881 3.505 171 2HD LYS 22 HD3 LYS 22 17.433 -12.892 3.154 172 1HE LYS 22 HE2 LYS 22 16.651 -13.286 5.520 173 2HE LYS 22 HE3 LYS 22 18.115 -14.231 5.822 174 1HZ LYS 22 HZ1 LYS 22 19.400 -12.279 5.344 175 2HZ LYS 22 HZ2 LYS 22 18.044 -11.404 5.032 176 3HZ LYS 22 HZ3 LYS 22 18.324 -11.971 6.556 177 H GLU 23 H GLU 23 13.692 -16.209 5.259 178 HA GLU 23 HA GLU 23 15.309 -18.541 6.163 179 1HB GLU 23 HB2 GLU 23 14.658 -17.920 8.441 180 2HB GLU 23 HB3 GLU 23 15.642 -16.717 7.599 181 1HG GLU 23 HG2 GLU 23 13.624 -15.344 7.174 182 2HG GLU 23 HG3 GLU 23 12.629 -16.520 8.043 183 H GLY 24 H GLY 24 11.943 -17.309 5.841 184 1HA GLY 24 HA2 GLY 24 10.815 -19.695 5.049 185 2HA GLY 24 HA3 GLY 24 10.659 -19.698 6.821 186 H ASP 25 H ASP 25 8.364 -19.615 5.209 187 HA ASP 25 HA ASP 25 7.460 -16.905 4.759 188 1HB ASP 25 HB2 ASP 25 6.629 -18.754 3.409 189 2HB ASP 25 HB3 ASP 25 5.966 -19.550 4.851 190 H LYS 26 H LYS 26 8.166 -16.241 6.966 191 HA LYS 26 HA LYS 26 6.221 -16.758 9.147 192 1HB LYS 26 HB2 LYS 26 8.891 -15.296 9.167 193 2HB LYS 26 HB3 LYS 26 7.920 -15.766 10.573 194 1HG LYS 26 HG2 LYS 26 8.297 -18.158 10.056 195 2HG LYS 26 HG3 LYS 26 9.245 -17.703 8.626 196 1HD LYS 26 HD2 LYS 26 10.790 -16.388 10.109 197 2HD LYS 26 HD3 LYS 26 9.929 -17.036 11.517 198 1HE LYS 26 HE2 LYS 26 10.523 -19.354 10.783 199 2HE LYS 26 HE3 LYS 26 11.368 -18.683 9.373 200 1HZ LYS 26 HZ1 LYS 26 12.072 -18.204 12.179 201 2HZ LYS 26 HZ2 LYS 26 12.890 -19.157 11.111 202 3HZ LYS 26 HZ3 LYS 26 12.821 -17.524 10.878 203 H HIS 27 H HIS 27 5.239 -15.038 10.207 204 HA HIS 27 HA HIS 27 4.827 -12.542 8.699 205 1HB HIS 27 HB2 HIS 27 3.596 -13.486 11.302 206 2HB HIS 27 HB3 HIS 27 3.051 -12.136 10.297 207 HD1 HIS 27 HD1 HIS 27 3.102 -13.581 7.448 208 HD2 HIS 27 HD2 HIS 27 1.609 -15.199 11.043 209 HE1 HIS 27 HE1 HIS 27 1.496 -15.448 6.803 210 H THR 28 H THR 28 7.471 -13.167 10.003 211 HA THR 28 HA THR 28 7.832 -10.716 11.630 212 HB THR 28 HB THR 28 9.334 -12.152 13.090 213 HG1 THR 28 HG1 THR 28 9.323 -13.903 11.569 214 1HG2 THR 28 HG21 THR 28 7.130 -11.430 13.918 215 2HG2 THR 28 HG22 THR 28 6.369 -12.863 13.191 216 3HG2 THR 28 HG23 THR 28 7.546 -13.051 14.504 217 H LEU 29 H LEU 29 9.361 -9.584 10.488 218 HA LEU 29 HA LEU 29 11.468 -11.103 9.036 219 1HB LEU 29 HB2 LEU 29 10.829 -8.141 9.265 220 2HB LEU 29 HB3 LEU 29 12.276 -8.752 8.462 221 HG LEU 29 HG LEU 29 9.432 -9.450 7.623 222 1HD1 LEU 29 HD11 LEU 29 9.764 -7.750 5.851 223 2HD1 LEU 29 HD12 LEU 29 9.852 -6.995 7.453 224 3HD1 LEU 29 HD13 LEU 29 11.343 -7.324 6.547 225 1HD2 LEU 29 HD21 LEU 29 10.492 -10.053 5.510 226 2HD2 LEU 29 HD22 LEU 29 12.087 -9.663 6.167 227 3HD2 LEU 29 HD23 LEU 29 11.158 -11.036 6.820 228 H SER 30 H SER 30 13.698 -10.794 9.740 229 HA SER 30 HA SER 30 13.977 -9.896 12.598 230 1HB SER 30 HB2 SER 30 14.901 -12.105 11.996 231 2HB SER 30 HB3 SER 30 15.974 -11.345 10.805 232 HG SER 30 HG SER 30 16.886 -11.715 12.966 233 H LYS 31 H LYS 31 16.371 -8.919 12.758 234 HA LYS 31 HA LYS 31 15.916 -6.208 11.983 235 1HB LYS 31 HB2 LYS 31 18.487 -7.445 13.079 236 2HB LYS 31 HB3 LYS 31 18.032 -5.735 13.102 237 1HG LYS 31 HG2 LYS 31 15.993 -6.423 14.468 238 2HG LYS 31 HG3 LYS 31 16.721 -8.014 14.635 239 1HD LYS 31 HD2 LYS 31 17.897 -5.342 15.540 240 2HD LYS 31 HD3 LYS 31 17.227 -6.589 16.586 241 1HE LYS 31 HE2 LYS 31 19.773 -6.800 14.904 242 2HE LYS 31 HE3 LYS 31 19.668 -6.631 16.658 243 1HZ LYS 31 HZ1 LYS 31 18.593 -8.753 16.763 244 2HZ LYS 31 HZ2 LYS 31 18.668 -8.925 15.125 245 3HZ LYS 31 HZ3 LYS 31 20.052 -8.884 16.016 246 H LYS 32 H LYS 32 18.814 -8.170 11.159 247 HA LYS 32 HA LYS 32 19.683 -6.409 9.105 248 1HB LYS 32 HB2 LYS 32 21.205 -7.848 10.187 249 2HB LYS 32 HB3 LYS 32 20.346 -9.320 9.701 250 1HG LYS 32 HG2 LYS 32 21.402 -7.446 7.568 251 2HG LYS 32 HG3 LYS 32 22.537 -8.468 8.458 252 1HD LYS 32 HD2 LYS 32 21.449 -10.506 7.760 253 2HD LYS 32 HD3 LYS 32 20.098 -9.634 7.035 254 1HE LYS 32 HE2 LYS 32 21.586 -10.371 5.283 255 2HE LYS 32 HE3 LYS 32 21.592 -8.604 5.367 256 1HZ LYS 32 HZ1 LYS 32 23.785 -9.515 5.130 257 2HZ LYS 32 HZ2 LYS 32 23.652 -8.734 6.573 258 3HZ LYS 32 HZ3 LYS 32 23.631 -10.382 6.522 259 H GLU 33 H GLU 33 17.436 -9.119 9.071 260 HA GLU 33 HA GLU 33 17.242 -9.470 6.241 261 1HB GLU 33 HB2 GLU 33 16.432 -11.043 8.012 262 2HB GLU 33 HB3 GLU 33 15.150 -9.877 8.400 263 1HG GLU 33 HG2 GLU 33 14.243 -10.127 6.109 264 2HG GLU 33 HG3 GLU 33 15.550 -11.235 5.697 265 H LEU 34 H LEU 34 15.348 -7.419 8.565 266 HA LEU 34 HA LEU 34 13.790 -6.110 6.587 267 1HB LEU 34 HB2 LEU 34 13.215 -5.944 8.886 268 2HB LEU 34 HB3 LEU 34 14.766 -5.258 9.341 269 HG LEU 34 HG LEU 34 12.912 -3.665 9.356 270 1HD1 LEU 34 HD11 LEU 34 14.121 -1.819 8.621 271 2HD1 LEU 34 HD12 LEU 34 15.386 -3.017 8.891 272 3HD1 LEU 34 HD13 LEU 34 14.827 -2.663 7.253 273 1HD2 LEU 34 HD21 LEU 34 11.617 -4.508 7.445 274 2HD2 LEU 34 HD22 LEU 34 11.971 -2.782 7.236 275 3HD2 LEU 34 HD23 LEU 34 12.883 -3.973 6.322 276 H LYS 35 H LYS 35 17.036 -5.274 7.981 277 HA LYS 35 HA LYS 35 17.352 -2.949 6.444 278 1HB LYS 35 HB2 LYS 35 18.853 -3.703 8.284 279 2HB LYS 35 HB3 LYS 35 19.645 -4.824 7.149 280 1HG LYS 35 HG2 LYS 35 20.227 -2.904 5.680 281 2HG LYS 35 HG3 LYS 35 19.339 -1.822 6.764 282 1HD LYS 35 HD2 LYS 35 20.963 -2.468 8.606 283 2HD LYS 35 HD3 LYS 35 21.896 -3.345 7.371 284 1HE LYS 35 HE2 LYS 35 21.936 -1.154 6.025 285 2HE LYS 35 HE3 LYS 35 21.228 -0.360 7.442 286 1HZ LYS 35 HZ1 LYS 35 23.627 -0.185 7.321 287 2HZ LYS 35 HZ2 LYS 35 23.161 -0.993 8.684 288 3HZ LYS 35 HZ3 LYS 35 23.784 -1.818 7.399 289 H GLU 36 H GLU 36 18.109 -6.299 5.537 290 HA GLU 36 HA GLU 36 19.140 -5.921 2.953 291 1HB GLU 36 HB2 GLU 36 19.026 -8.049 4.361 292 2HB GLU 36 HB3 GLU 36 17.348 -8.220 3.833 293 1HG GLU 36 HG2 GLU 36 18.131 -8.244 1.455 294 2HG GLU 36 HG3 GLU 36 19.802 -8.242 2.053 295 H LEU 37 H LEU 37 15.714 -6.502 3.949 296 HA LEU 37 HA LEU 37 14.436 -6.130 1.486 297 1HB LEU 37 HB2 LEU 37 13.301 -6.833 3.536 298 2HB LEU 37 HB3 LEU 37 13.541 -5.284 4.292 299 HG LEU 37 HG LEU 37 11.846 -5.534 1.807 300 1HD1 LEU 37 HD11 LEU 37 10.952 -7.035 3.586 301 2HD1 LEU 37 HD12 LEU 37 11.033 -5.693 4.752 302 3HD1 LEU 37 HD13 LEU 37 9.914 -5.622 3.387 303 1HD2 LEU 37 HD21 LEU 37 12.395 -3.181 2.365 304 2HD2 LEU 37 HD22 LEU 37 10.732 -3.518 2.823 305 3HD2 LEU 37 HD23 LEU 37 11.982 -3.468 4.073 306 H ILE 38 H ILE 38 15.348 -3.564 3.822 307 HA ILE 38 HA ILE 38 14.389 -1.510 2.085 308 HB ILE 38 HB ILE 38 16.353 -1.456 4.401 309 1HG1 ILE 38 HG12 ILE 38 13.403 -0.717 4.023 310 2HG1 ILE 38 HG13 ILE 38 14.027 -2.135 4.877 311 1HG2 ILE 38 HG21 ILE 38 16.019 1.007 4.414 312 2HG2 ILE 38 HG22 ILE 38 16.863 0.488 2.962 313 3HG2 ILE 38 HG23 ILE 38 15.137 0.884 2.882 314 1HD1 ILE 38 HD11 ILE 38 13.446 -0.615 6.529 315 2HD1 ILE 38 HD12 ILE 38 15.225 -0.523 6.448 316 3HD1 ILE 38 HD13 ILE 38 14.219 0.755 5.709 317 H GLN 39 H GLN 39 17.674 -2.943 2.380 318 HA GLN 39 HA GLN 39 18.891 -1.044 0.603 319 1HB GLN 39 HB2 GLN 39 19.729 -3.946 1.048 320 2HB GLN 39 HB3 GLN 39 20.675 -2.655 0.309 321 1HG GLN 39 HG2 GLN 39 20.212 -3.233 3.180 322 2HG GLN 39 HG3 GLN 39 21.622 -2.603 2.357 323 1HE2 GLN 39 HE22 GLN 39 18.631 -1.791 3.980 324 2HE2 GLN 39 HE21 GLN 39 18.918 -0.047 4.043 325 H LYS 40 H LYS 40 17.297 -4.213 0.024 326 HA LYS 40 HA LYS 40 18.025 -4.102 -2.768 327 1HB LYS 40 HB2 LYS 40 17.864 -6.212 -1.446 328 2HB LYS 40 HB3 LYS 40 16.142 -5.933 -1.249 329 1HG LYS 40 HG2 LYS 40 16.611 -7.594 -3.020 330 2HG LYS 40 HG3 LYS 40 15.747 -6.197 -3.644 331 1HD LYS 40 HD2 LYS 40 17.508 -6.969 -5.183 332 2HD LYS 40 HD3 LYS 40 17.759 -5.303 -4.684 333 1HE LYS 40 HE2 LYS 40 19.873 -6.589 -4.722 334 2HE LYS 40 HE3 LYS 40 19.522 -6.014 -3.090 335 1HZ LYS 40 HZ1 LYS 40 18.677 -8.187 -2.572 336 2HZ LYS 40 HZ2 LYS 40 18.985 -8.722 -4.102 337 3HZ LYS 40 HZ3 LYS 40 20.230 -8.289 -3.112 338 H GLU 41 H GLU 41 15.008 -3.532 -0.940 339 HA GLU 41 HA GLU 41 13.517 -3.014 -3.407 340 1HB GLU 41 HB2 GLU 41 12.726 -2.515 -0.508 341 2HB GLU 41 HB3 GLU 41 11.671 -2.448 -1.923 342 1HG GLU 41 HG2 GLU 41 13.103 -4.936 -0.879 343 2HG GLU 41 HG3 GLU 41 11.387 -4.564 -0.717 344 H LEU 42 H LEU 42 14.680 -0.950 -0.639 345 HA LEU 42 HA LEU 42 13.513 1.365 -2.079 346 1HB LEU 42 HB2 LEU 42 14.963 1.431 0.577 347 2HB LEU 42 HB3 LEU 42 14.006 2.697 -0.182 348 HG LEU 42 HG LEU 42 13.027 0.125 1.087 349 1HD1 LEU 42 HD11 LEU 42 13.370 2.181 2.507 350 2HD1 LEU 42 HD12 LEU 42 12.215 3.040 1.477 351 3HD1 LEU 42 HD13 LEU 42 11.681 1.650 2.441 352 1HD2 LEU 42 HD21 LEU 42 10.746 0.709 0.382 353 2HD2 LEU 42 HD22 LEU 42 11.377 2.013 -0.641 354 3HD2 LEU 42 HD23 LEU 42 11.743 0.307 -1.009 355 H THR 43 H THR 43 16.692 0.237 -0.966 356 HA THR 43 HA THR 43 18.794 0.677 -1.725 357 HB THR 43 HB THR 43 17.530 1.477 -4.375 358 HG1 THR 43 HG1 THR 43 17.737 -1.075 -3.161 359 1HG2 THR 43 HG21 THR 43 20.004 -0.169 -3.665 360 2HG2 THR 43 HG22 THR 43 19.423 0.211 -5.299 361 3HG2 THR 43 HG23 THR 43 20.015 1.512 -4.252 362 H ILE 44 H ILE 44 18.475 2.551 -0.135 363 HA ILE 44 HA ILE 44 18.156 5.182 -1.091 364 HB ILE 44 HB ILE 44 18.827 5.942 1.018 365 1HG1 ILE 44 HG12 ILE 44 20.910 4.710 1.393 366 2HG1 ILE 44 HG13 ILE 44 19.837 4.695 2.778 367 1HG2 ILE 44 HG21 ILE 44 17.299 4.787 2.460 368 2HG2 ILE 44 HG22 ILE 44 16.643 4.872 0.823 369 3HG2 ILE 44 HG23 ILE 44 17.305 3.344 1.427 370 1HD1 ILE 44 HD11 ILE 44 20.361 2.377 0.870 371 2HD1 ILE 44 HD12 ILE 44 20.901 2.554 2.538 372 3HD1 ILE 44 HD13 ILE 44 19.179 2.335 2.205 373 H GLY 45 H GLY 45 20.854 3.184 -1.586 374 1HA GLY 45 HA2 GLY 45 22.668 3.552 -2.893 375 2HA GLY 45 HA3 GLY 45 22.070 5.185 -3.201 376 H SER 46 H SER 46 22.416 6.755 -1.286 377 HA SER 46 HA SER 46 25.268 6.872 -0.877 378 1HB SER 46 HB2 SER 46 23.104 8.654 0.313 379 2HB SER 46 HB3 SER 46 24.830 9.014 0.145 380 HG SER 46 HG SER 46 23.499 9.863 -1.579 381 H LYS 47 H LYS 47 25.663 4.947 0.293 382 HA LYS 47 HA LYS 47 24.443 4.088 2.567 383 1HB LYS 47 HB2 LYS 47 27.378 3.735 1.811 384 2HB LYS 47 HB3 LYS 47 26.533 2.771 3.036 385 1HG LYS 47 HG2 LYS 47 24.855 2.097 1.280 386 2HG LYS 47 HG3 LYS 47 25.886 2.836 0.056 387 1HD LYS 47 HD2 LYS 47 26.621 0.552 1.942 388 2HD LYS 47 HD3 LYS 47 26.267 0.411 0.219 389 1HE LYS 47 HE2 LYS 47 28.668 1.835 1.466 390 2HE LYS 47 HE3 LYS 47 28.676 0.304 0.589 391 1HZ LYS 47 HZ1 LYS 47 29.369 2.088 -0.802 392 2HZ LYS 47 HZ2 LYS 47 27.944 1.479 -1.363 393 3HZ LYS 47 HZ3 LYS 47 27.967 2.913 -0.551 394 H LEU 48 H LEU 48 26.264 6.929 2.622 395 HA LEU 48 HA LEU 48 27.079 7.108 5.327 396 1HB LEU 48 HB2 LEU 48 27.527 8.878 3.848 397 2HB LEU 48 HB3 LEU 48 25.856 9.029 3.312 398 HG LEU 48 HG LEU 48 26.449 9.577 6.220 399 1HD1 LEU 48 HD11 LEU 48 27.008 11.920 5.666 400 2HD1 LEU 48 HD12 LEU 48 28.229 10.796 5.050 401 3HD1 LEU 48 HD13 LEU 48 27.038 11.508 3.937 402 1HD2 LEU 48 HD21 LEU 48 24.606 10.853 4.127 403 2HD2 LEU 48 HD22 LEU 48 24.082 9.673 5.328 404 3HD2 LEU 48 HD23 LEU 48 24.649 11.258 5.856 405 H GLN 49 H GLN 49 23.888 7.098 3.821 406 HA GLN 49 HA GLN 49 22.309 7.840 6.056 407 1HB GLN 49 HB2 GLN 49 21.726 6.131 3.626 408 2HB GLN 49 HB3 GLN 49 20.475 6.651 4.760 409 1HG GLN 49 HG2 GLN 49 20.762 8.960 4.264 410 2HG GLN 49 HG3 GLN 49 22.266 8.684 3.375 411 1HE2 GLN 49 HE22 GLN 49 22.040 7.011 1.577 412 2HE2 GLN 49 HE21 GLN 49 20.681 7.226 0.464 413 H ASP 50 H ASP 50 24.088 4.859 5.597 414 HA ASP 50 HA ASP 50 22.364 2.943 6.563 415 1HB ASP 50 HB2 ASP 50 25.362 3.252 6.791 416 2HB ASP 50 HB3 ASP 50 24.536 1.946 7.634 417 H ALA 51 H ALA 51 24.135 5.316 8.558 418 HA ALA 51 HA ALA 51 23.480 4.303 11.130 419 1HB ALA 51 HB1 ALA 51 23.690 7.190 10.171 420 2HB ALA 51 HB2 ALA 51 23.709 6.651 11.864 421 3HB ALA 51 HB3 ALA 51 25.022 6.176 10.768 422 H GLU 52 H GLU 52 21.613 6.363 8.894 423 HA GLU 52 HA GLU 52 19.367 6.804 10.652 424 1HB GLU 52 HB2 GLU 52 19.268 6.874 7.608 425 2HB GLU 52 HB3 GLU 52 18.297 7.768 8.775 426 1HG GLU 52 HG2 GLU 52 21.234 8.220 8.077 427 2HG GLU 52 HG3 GLU 52 19.874 9.277 7.735 428 H ILE 53 H ILE 53 20.166 4.541 8.000 429 HA ILE 53 HA ILE 53 17.713 3.121 8.015 430 HB ILE 53 HB ILE 53 20.439 1.915 7.450 431 1HG1 ILE 53 HG12 ILE 53 20.116 3.877 5.994 432 2HG1 ILE 53 HG13 ILE 53 20.070 2.368 5.097 433 1HG2 ILE 53 HG21 ILE 53 18.764 0.199 7.756 434 2HG2 ILE 53 HG22 ILE 53 17.611 1.045 6.717 435 3HG2 ILE 53 HG23 ILE 53 19.101 0.365 6.031 436 1HD1 ILE 53 HD11 ILE 53 17.632 2.485 4.950 437 2HD1 ILE 53 HD12 ILE 53 17.611 3.956 5.961 438 3HD1 ILE 53 HD13 ILE 53 18.356 3.981 4.361 439 H VAL 54 H VAL 54 20.666 2.528 10.024 440 HA VAL 54 HA VAL 54 19.345 0.272 11.249 441 HB VAL 54 HB VAL 54 21.152 0.174 12.871 442 1HG1 VAL 54 HG11 VAL 54 21.135 -1.071 10.742 443 2HG1 VAL 54 HG12 VAL 54 21.935 0.293 9.936 444 3HG1 VAL 54 HG13 VAL 54 22.783 -0.616 11.208 445 1HG2 VAL 54 HG21 VAL 54 23.151 1.457 12.664 446 2HG2 VAL 54 HG22 VAL 54 22.473 2.387 11.326 447 3HG2 VAL 54 HG23 VAL 54 21.797 2.565 12.958 448 H LYS 55 H LYS 55 19.503 3.728 12.161 449 HA LYS 55 HA LYS 55 18.188 3.351 14.686 450 1HB LYS 55 HB2 LYS 55 19.134 5.499 14.106 451 2HB LYS 55 HB3 LYS 55 18.103 5.641 12.686 452 1HG LYS 55 HG2 LYS 55 17.351 7.053 14.579 453 2HG LYS 55 HG3 LYS 55 16.121 5.940 13.992 454 1HD LYS 55 HD2 LYS 55 16.077 6.080 16.419 455 2HD LYS 55 HD3 LYS 55 16.473 4.445 15.922 456 1HE LYS 55 HE2 LYS 55 18.899 4.905 16.374 457 2HE LYS 55 HE3 LYS 55 18.474 6.553 16.868 458 1HZ LYS 55 HZ1 LYS 55 17.139 5.607 18.611 459 2HZ LYS 55 HZ2 LYS 55 17.521 4.078 18.135 460 3HZ LYS 55 HZ3 LYS 55 18.695 5.074 18.724 461 H LEU 56 H LEU 56 16.886 3.888 11.389 462 HA LEU 56 HA LEU 56 14.143 3.567 11.978 463 1HB LEU 56 HB2 LEU 56 14.785 4.522 9.975 464 2HB LEU 56 HB3 LEU 56 15.858 3.212 9.516 465 HG LEU 56 HG LEU 56 12.955 2.522 9.810 466 1HD1 LEU 56 HD11 LEU 56 12.521 3.302 7.488 467 2HD1 LEU 56 HD12 LEU 56 12.871 4.664 8.569 468 3HD1 LEU 56 HD13 LEU 56 14.118 4.076 7.450 469 1HD2 LEU 56 HD21 LEU 56 15.100 1.815 7.739 470 2HD2 LEU 56 HD22 LEU 56 14.728 0.818 9.145 471 3HD2 LEU 56 HD23 LEU 56 13.477 1.098 7.930 472 H MET 57 H MET 57 16.583 1.078 11.168 473 HA MET 57 HA MET 57 14.913 -1.191 11.161 474 1HB MET 57 HB2 MET 57 17.303 -1.115 10.408 475 2HB MET 57 HB3 MET 57 17.784 -0.959 12.107 476 1HG MET 57 HG2 MET 57 16.783 -3.190 12.583 477 2HG MET 57 HG3 MET 57 16.389 -3.337 10.872 478 1HE MET 57 HE1 MET 57 20.640 -3.466 12.677 479 2HE MET 57 HE2 MET 57 19.699 -1.962 12.710 480 3HE MET 57 HE3 MET 57 19.133 -3.384 13.617 481 H ASP 58 H ASP 58 16.822 0.283 13.839 482 HA ASP 58 HA ASP 58 15.956 -1.376 15.937 483 1HB ASP 58 HB2 ASP 58 17.771 0.181 16.228 484 2HB ASP 58 HB3 ASP 58 16.699 1.564 15.995 485 H ASP 59 H ASP 59 14.482 1.668 14.704 486 HA ASP 59 HA ASP 59 12.298 1.643 16.517 487 1HB ASP 59 HB2 ASP 59 12.329 2.762 13.672 488 2HB ASP 59 HB3 ASP 59 11.192 3.196 14.952 489 H LEU 60 H LEU 60 12.624 0.068 13.340 490 HA LEU 60 HA LEU 60 9.930 -0.963 13.300 491 1HB LEU 60 HB2 LEU 60 12.523 -1.549 11.845 492 2HB LEU 60 HB3 LEU 60 11.210 -2.702 11.694 493 HG LEU 60 HG LEU 60 10.632 0.206 11.195 494 1HD1 LEU 60 HD11 LEU 60 11.809 -1.670 9.126 495 2HD1 LEU 60 HD12 LEU 60 11.191 -0.048 8.814 496 3HD1 LEU 60 HD13 LEU 60 12.636 -0.260 9.830 497 1HD2 LEU 60 HD21 LEU 60 9.642 -2.430 9.955 498 2HD2 LEU 60 HD22 LEU 60 8.770 -1.477 11.178 499 3HD2 LEU 60 HD23 LEU 60 9.041 -0.834 9.535 500 H ASP 61 H ASP 61 13.011 -2.484 14.332 501 HA ASP 61 HA ASP 61 11.634 -4.940 14.984 502 1HB ASP 61 HB2 ASP 61 13.738 -5.734 15.851 503 2HB ASP 61 HB3 ASP 61 13.896 -5.054 14.235 504 H ARG 62 H ARG 62 12.498 -2.088 16.882 505 HA ARG 62 HA ARG 62 12.656 -3.211 19.369 506 1HB ARG 62 HB2 ARG 62 13.227 -0.907 19.025 507 2HB ARG 62 HB3 ARG 62 11.576 -0.497 18.530 508 1HG ARG 62 HG2 ARG 62 12.055 0.322 20.776 509 2HG ARG 62 HG3 ARG 62 10.760 -0.866 20.819 510 1HD ARG 62 HD2 ARG 62 12.552 -2.608 21.519 511 2HD ARG 62 HD3 ARG 62 13.687 -1.266 21.585 512 HE ARG 62 HE ARG 62 12.752 -0.569 23.561 513 1HH1 ARG 62 HH21 ARG 62 10.512 -2.900 22.040 514 2HH1 ARG 62 HH22 ARG 62 9.511 -3.028 23.455 515 1HH2 ARG 62 HH12 ARG 62 11.416 -0.751 25.385 516 2HH2 ARG 62 HH11 ARG 62 10.020 -1.793 25.374 517 H ASN 63 H ASN 63 9.734 -2.371 17.613 518 HA ASN 63 HA ASN 63 7.794 -2.520 19.593 519 1HB ASN 63 HB2 ASN 63 7.461 -3.598 16.774 520 2HB ASN 63 HB3 ASN 63 6.196 -3.002 17.875 521 1HD2 ASN 63 HD22 ASN 63 8.723 -2.114 15.603 522 2HD2 ASN 63 HD21 ASN 63 8.644 -0.387 15.814 523 H LYS 64 H LYS 64 9.537 -5.203 18.100 524 HA LYS 64 HA LYS 64 8.609 -6.865 20.306 525 1HB LYS 64 HB2 LYS 64 7.045 -7.486 18.526 526 2HB LYS 64 HB3 LYS 64 8.378 -7.838 17.434 527 1HG LYS 64 HG2 LYS 64 7.355 -9.849 18.366 528 2HG LYS 64 HG3 LYS 64 9.059 -9.756 18.798 529 1HD LYS 64 HD2 LYS 64 8.484 -8.949 21.063 530 2HD LYS 64 HD3 LYS 64 6.758 -8.967 20.653 531 1HE LYS 64 HE2 LYS 64 8.650 -11.377 20.695 532 2HE LYS 64 HE3 LYS 64 7.506 -10.947 21.975 533 1HZ LYS 64 HZ1 LYS 64 6.606 -12.617 20.571 534 2HZ LYS 64 HZ2 LYS 64 5.725 -11.234 20.400 535 3HZ LYS 64 HZ3 LYS 64 6.792 -11.687 19.226 536 H ASP 65 H ASP 65 10.734 -5.507 20.369 537 HA ASP 65 HA ASP 65 12.935 -5.475 20.643 538 1HB ASP 65 HB2 ASP 65 13.978 -7.506 21.630 539 2HB ASP 65 HB3 ASP 65 12.511 -6.917 22.409 540 H GLN 66 H GLN 66 13.155 -8.707 19.221 541 HA GLN 66 HA GLN 66 15.253 -7.693 17.385 542 1HB GLN 66 HB2 GLN 66 15.812 -9.599 18.744 543 2HB GLN 66 HB3 GLN 66 14.371 -10.477 18.223 544 1HG GLN 66 HG2 GLN 66 15.252 -10.602 15.908 545 2HG GLN 66 HG3 GLN 66 16.619 -9.581 16.374 546 1HE2 GLN 66 HE22 GLN 66 14.998 -12.676 17.257 547 2HE2 GLN 66 HE21 GLN 66 16.499 -13.521 17.632 548 H GLU 67 H GLU 67 11.929 -8.976 17.342 549 HA GLU 67 HA GLU 67 12.170 -9.606 14.442 550 1HB GLU 67 HB2 GLU 67 10.012 -10.164 16.527 551 2HB GLU 67 HB3 GLU 67 9.847 -10.503 14.806 552 1HG GLU 67 HG2 GLU 67 10.494 -12.547 15.874 553 2HG GLU 67 HG3 GLU 67 11.846 -11.988 14.882 554 H VAL 68 H VAL 68 11.489 -8.232 12.975 555 HA VAL 68 HA VAL 68 9.775 -5.894 13.554 556 HB VAL 68 HB VAL 68 11.004 -7.021 11.014 557 1HG1 VAL 68 HG11 VAL 68 9.546 -4.400 11.541 558 2HG1 VAL 68 HG12 VAL 68 10.467 -4.769 10.057 559 3HG1 VAL 68 HG13 VAL 68 9.039 -5.723 10.471 560 1HG2 VAL 68 HG21 VAL 68 12.599 -5.184 11.132 561 2HG2 VAL 68 HG22 VAL 68 11.924 -4.693 12.688 562 3HG2 VAL 68 HG23 VAL 68 12.753 -6.256 12.522 563 H ASN 69 H ASN 69 7.904 -6.999 14.288 564 HA ASN 69 HA ASN 69 6.796 -9.246 12.853 565 1HB ASN 69 HB2 ASN 69 6.493 -8.995 15.256 566 2HB ASN 69 HB3 ASN 69 5.573 -7.504 15.013 567 1HD2 ASN 69 HD21 ASN 69 3.322 -7.746 14.780 568 2HD2 ASN 69 HD22 ASN 69 2.548 -9.283 14.407 569 H PHE 70 H PHE 70 4.989 -9.370 11.528 570 HA PHE 70 HA PHE 70 4.836 -7.609 9.510 571 1HB PHE 70 HB2 PHE 70 3.938 -9.807 9.335 572 2HB PHE 70 HB3 PHE 70 2.687 -9.474 10.533 573 HD1 PHE 70 HD1 PHE 70 3.962 -8.329 7.188 574 HD2 PHE 70 HD2 PHE 70 0.590 -8.583 9.864 575 HE1 PHE 70 HE1 PHE 70 2.538 -7.185 5.512 576 HE2 PHE 70 HE2 PHE 70 -0.825 -7.459 8.203 577 HZ PHE 70 HZ PHE 70 0.151 -6.717 6.021 578 H GLN 71 H GLN 71 2.262 -7.500 12.097 579 HA GLN 71 HA GLN 71 1.049 -5.247 10.857 580 1HB GLN 71 HB2 GLN 71 -0.115 -6.662 12.506 581 2HB GLN 71 HB3 GLN 71 0.889 -5.980 13.807 582 1HG GLN 71 HG2 GLN 71 0.005 -3.722 13.339 583 2HG GLN 71 HG3 GLN 71 -0.852 -4.329 11.912 584 1HE2 GLN 71 HE22 GLN 71 -2.781 -3.295 12.912 585 2HE2 GLN 71 HE21 GLN 71 -3.584 -4.176 14.202 586 H GLU 72 H GLU 72 3.766 -5.470 13.117 587 HA GLU 72 HA GLU 72 3.807 -2.659 13.820 588 1HB GLU 72 HB2 GLU 72 5.819 -4.922 14.095 589 2HB GLU 72 HB3 GLU 72 6.182 -3.257 14.532 590 1HG GLU 72 HG2 GLU 72 5.403 -4.726 16.431 591 2HG GLU 72 HG3 GLU 72 4.533 -3.188 16.228 592 H TYR 73 H TYR 73 5.374 -4.701 11.339 593 HA TYR 73 HA TYR 73 6.903 -2.656 10.062 594 1HB TYR 73 HB2 TYR 73 7.382 -4.800 9.402 595 2HB TYR 73 HB3 TYR 73 5.722 -5.282 9.198 596 HD1 TYR 73 HD1 TYR 73 4.488 -4.879 7.156 597 HD2 TYR 73 HD2 TYR 73 8.596 -3.639 7.600 598 HE1 TYR 73 HE1 TYR 73 4.742 -4.817 4.693 599 HE2 TYR 73 HE2 TYR 73 8.860 -3.642 5.141 600 HH TYR 73 HH TYR 73 7.783 -3.839 3.105 601 H ILE 74 H ILE 74 3.504 -3.737 9.409 602 HA ILE 74 HA ILE 74 2.998 -1.736 7.455 603 HB ILE 74 HB ILE 74 1.036 -3.009 9.399 604 1HG1 ILE 74 HG12 ILE 74 2.174 -4.694 7.981 605 2HG1 ILE 74 HG13 ILE 74 0.454 -4.554 7.674 606 1HG2 ILE 74 HG21 ILE 74 0.615 -1.280 6.941 607 2HG2 ILE 74 HG22 ILE 74 -0.627 -2.396 7.525 608 3HG2 ILE 74 HG23 ILE 74 -0.060 -1.097 8.573 609 1HD1 ILE 74 HD11 ILE 74 0.928 -3.204 5.628 610 2HD1 ILE 74 HD12 ILE 74 2.675 -3.424 5.937 611 3HD1 ILE 74 HD13 ILE 74 1.643 -4.811 5.572 612 H THR 75 H THR 75 2.357 -1.612 10.974 613 HA THR 75 HA THR 75 1.321 0.987 11.158 614 HB THR 75 HB THR 75 3.119 -0.475 13.149 615 HG1 THR 75 HG1 THR 75 1.342 -1.711 12.616 616 1HG2 THR 75 HG21 THR 75 1.142 1.808 13.516 617 2HG2 THR 75 HG22 THR 75 1.819 0.839 14.837 618 3HG2 THR 75 HG23 THR 75 2.884 1.844 13.840 619 H PHE 76 H PHE 76 4.744 -0.092 11.330 620 HA PHE 76 HA PHE 76 5.851 2.499 11.691 621 1HB PHE 76 HB2 PHE 76 7.101 0.442 12.165 622 2HB PHE 76 HB3 PHE 76 7.067 0.025 10.451 623 HD1 PHE 76 HD1 PHE 76 8.454 1.273 8.805 624 HD2 PHE 76 HD2 PHE 76 8.467 2.369 12.984 625 HE1 PHE 76 HE1 PHE 76 10.354 2.767 8.406 626 HE2 PHE 76 HE2 PHE 76 10.274 4.007 12.529 627 HZ PHE 76 HZ PHE 76 11.171 4.261 10.219 628 H LEU 77 H LEU 77 5.184 0.585 8.666 629 HA LEU 77 HA LEU 77 6.188 2.619 6.914 630 1HB LEU 77 HB2 LEU 77 4.066 0.482 6.533 631 2HB LEU 77 HB3 LEU 77 4.547 1.589 5.248 632 HG LEU 77 HG LEU 77 6.530 -0.214 6.712 633 1HD1 LEU 77 HD11 LEU 77 5.081 -0.626 4.065 634 2HD1 LEU 77 HD12 LEU 77 6.454 -1.581 4.651 635 3HD1 LEU 77 HD13 LEU 77 4.917 -1.616 5.541 636 1HD2 LEU 77 HD21 LEU 77 7.652 1.667 5.616 637 2HD2 LEU 77 HD22 LEU 77 7.908 0.217 4.651 638 3HD2 LEU 77 HD23 LEU 77 6.700 1.411 4.133 639 H GLY 78 H GLY 78 3.068 2.264 8.591 640 1HA GLY 78 HA2 GLY 78 1.789 4.557 7.512 641 2HA GLY 78 HA3 GLY 78 1.555 3.915 9.157 642 H ALA 79 H ALA 79 3.973 4.280 10.376 643 HA ALA 79 HA ALA 79 4.054 7.065 10.947 644 1HB ALA 79 HB1 ALA 79 6.075 6.605 12.213 645 2HB ALA 79 HB2 ALA 79 6.290 5.044 11.408 646 3HB ALA 79 HB3 ALA 79 4.900 5.303 12.484 647 H LEU 80 H LEU 80 6.171 5.128 8.839 648 HA LEU 80 HA LEU 80 7.937 7.102 7.949 649 1HB LEU 80 HB2 LEU 80 7.874 4.509 7.549 650 2HB LEU 80 HB3 LEU 80 6.809 4.890 6.201 651 HG LEU 80 HG LEU 80 8.681 6.449 5.366 652 1HD1 LEU 80 HD11 LEU 80 10.266 4.727 7.334 653 2HD1 LEU 80 HD12 LEU 80 10.976 5.752 6.077 654 3HD1 LEU 80 HD13 LEU 80 10.090 6.493 7.428 655 1HD2 LEU 80 HD21 LEU 80 9.204 3.451 5.530 656 2HD2 LEU 80 HD22 LEU 80 8.107 4.232 4.362 657 3HD2 LEU 80 HD23 LEU 80 9.849 4.552 4.299 658 H ALA 81 H ALA 81 4.781 6.078 6.599 659 HA ALA 81 HA ALA 81 4.594 7.945 4.476 660 1HB ALA 81 HB1 ALA 81 2.143 7.516 4.685 661 2HB ALA 81 HB2 ALA 81 3.150 6.051 4.542 662 3HB ALA 81 HB3 ALA 81 2.473 6.515 6.105 663 H MET 82 H MET 82 3.546 8.186 7.907 664 HA MET 82 HA MET 82 2.362 10.757 7.606 665 1HB MET 82 HB2 MET 82 2.014 9.049 9.467 666 2HB MET 82 HB3 MET 82 3.537 9.602 10.174 667 1HG MET 82 HG2 MET 82 2.632 11.841 10.472 668 2HG MET 82 HG3 MET 82 1.191 11.434 9.527 669 1HE MET 82 HE1 MET 82 -0.305 11.996 13.068 670 2HE MET 82 HE2 MET 82 -0.375 12.448 11.348 671 3HE MET 82 HE3 MET 82 1.053 12.875 12.325 672 H ILE 83 H ILE 83 5.631 9.735 8.490 673 HA ILE 83 HA ILE 83 6.742 12.336 8.974 674 HB ILE 83 HB ILE 83 7.960 9.672 8.177 675 1HG1 ILE 83 HG12 ILE 83 8.204 11.229 10.784 676 2HG1 ILE 83 HG13 ILE 83 6.881 10.101 10.501 677 1HG2 ILE 83 HG21 ILE 83 9.466 11.405 7.315 678 2HG2 ILE 83 HG22 ILE 83 10.174 10.684 8.752 679 3HG2 ILE 83 HG23 ILE 83 9.392 12.274 8.863 680 1HD1 ILE 83 HD11 ILE 83 9.834 9.369 10.524 681 2HD1 ILE 83 HD12 ILE 83 8.506 8.263 10.104 682 3HD1 ILE 83 HD13 ILE 83 8.605 8.962 11.729 683 H TYR 84 H TYR 84 6.411 10.327 6.008 684 HA TYR 84 HA TYR 84 7.397 12.433 4.233 685 1HB TYR 84 HB2 TYR 84 5.599 10.063 3.624 686 2HB TYR 84 HB3 TYR 84 6.484 11.040 2.458 687 HD1 TYR 84 HD1 TYR 84 9.110 10.920 4.457 688 HD2 TYR 84 HD2 TYR 84 6.495 8.107 2.485 689 HE1 TYR 84 HE1 TYR 84 10.965 9.314 4.294 690 HE2 TYR 84 HE2 TYR 84 8.385 6.503 2.296 691 HH TYR 84 HH TYR 84 11.655 7.258 3.525 692 H ASN 85 H ASN 85 5.859 13.865 5.803 693 HA ASN 85 HA ASN 85 3.128 13.784 5.589 694 1HB ASN 85 HB2 ASN 85 4.592 15.194 7.131 695 2HB ASN 85 HB3 ASN 85 4.697 16.381 5.820 696 1HD2 ASN 85 HD22 ASN 85 2.389 14.482 7.801 697 2HD2 ASN 85 HD21 ASN 85 1.088 15.675 7.779 698 H GLU 86 H GLU 86 5.380 15.308 3.371 699 HA GLU 86 HA GLU 86 3.741 16.720 1.615 700 1HB GLU 86 HB2 GLU 86 6.225 16.567 1.531 701 2HB GLU 86 HB3 GLU 86 6.094 14.907 0.919 702 1HG GLU 86 HG2 GLU 86 4.901 15.756 -1.095 703 2HG GLU 86 HG3 GLU 86 4.989 17.404 -0.449 704 H ALA 87 H ALA 87 4.244 13.159 1.825 705 HA ALA 87 HA ALA 87 2.793 12.501 -0.564 706 1HB ALA 87 HB1 ALA 87 2.805 10.240 0.286 707 2HB ALA 87 HB2 ALA 87 4.399 10.965 0.577 708 3HB ALA 87 HB3 ALA 87 3.236 10.785 1.915 709 H LEU 88 H LEU 88 1.844 13.045 2.855 710 HA LEU 88 HA LEU 88 -0.883 12.124 2.512 711 1HB LEU 88 HB2 LEU 88 0.106 14.190 4.516 712 2HB LEU 88 HB3 LEU 88 -1.386 13.266 4.541 713 HG LEU 88 HG LEU 88 1.429 12.256 5.054 714 1HD1 LEU 88 HD11 LEU 88 0.271 13.309 6.942 715 2HD1 LEU 88 HD12 LEU 88 -1.170 12.305 6.664 716 3HD1 LEU 88 HD13 LEU 88 0.333 11.560 7.209 717 1HD2 LEU 88 HD21 LEU 88 0.418 10.514 3.719 718 2HD2 LEU 88 HD22 LEU 88 0.433 10.014 5.404 719 3HD2 LEU 88 HD23 LEU 88 -1.088 10.582 4.682 720 H LYS 89 H LYS 89 0.676 15.349 2.424 721 HA LYS 89 HA LYS 89 -1.659 16.806 1.640 722 1HB LYS 89 HB2 LYS 89 1.318 17.261 1.456 723 2HB LYS 89 HB3 LYS 89 0.241 18.296 0.520 724 1HG LYS 89 HG2 LYS 89 0.792 19.288 2.673 725 2HG LYS 89 HG3 LYS 89 -0.945 19.043 2.460 726 1HD LYS 89 HD2 LYS 89 -0.888 17.054 3.911 727 2HD LYS 89 HD3 LYS 89 0.867 17.193 4.086 728 1HE LYS 89 HE2 LYS 89 -1.129 19.348 4.948 729 2HE LYS 89 HE3 LYS 89 -0.470 18.106 6.025 730 1HZ LYS 89 HZ1 LYS 89 0.745 20.125 6.193 731 2HZ LYS 89 HZ2 LYS 89 1.689 18.893 5.636 732 3HZ LYS 89 HZ3 LYS 89 1.162 20.071 4.598 733 H GLY 90 H GLY 90 0.676 14.981 -0.282 734 1HA GLY 90 HA2 GLY 90 0.419 15.665 -2.821 735 2HA GLY 90 HA3 GLY 90 0.410 13.968 -2.324 736 1H MET 1 H1 MET 1 15.064 2.009 -5.074 737 2H MET 1 H2 MET 1 15.823 0.994 -6.143 738 3H MET 1 H3 MET 1 14.979 0.389 -4.858 739 HA MET 1 HA MET 1 13.758 1.846 -7.065 740 1HB MET 1 HB2 MET 1 13.863 -1.147 -6.519 741 2HB MET 1 HB3 MET 1 12.804 -0.366 -7.689 742 1HG MET 1 HG2 MET 1 14.671 -1.270 -8.854 743 2HG MET 1 HG3 MET 1 14.700 0.488 -8.959 744 1HE MET 1 HE1 MET 1 16.301 -2.681 -7.231 745 2HE MET 1 HE2 MET 1 17.664 -1.941 -6.355 746 3HE MET 1 HE3 MET 1 16.002 -1.606 -5.843 747 H ALA 2 H ALA 2 13.230 2.883 -4.733 748 HA ALA 2 HA ALA 2 11.366 1.622 -3.064 749 1HB ALA 2 HB1 ALA 2 11.698 4.594 -3.652 750 2HB ALA 2 HB2 ALA 2 10.907 3.891 -2.221 751 3HB ALA 2 HB3 ALA 2 12.645 3.655 -2.480 752 H SER 3 H SER 3 10.810 3.247 -6.161 753 HA SER 3 HA SER 3 8.407 4.202 -6.124 754 1HB SER 3 HB2 SER 3 9.163 2.468 -8.476 755 2HB SER 3 HB3 SER 3 8.396 4.061 -8.425 756 HG SER 3 HG SER 3 10.634 4.218 -8.920 757 HA PRO 4 HA PRO 4 5.986 -0.048 -6.923 758 1HB PRO 4 HB2 PRO 4 7.276 -2.183 -5.596 759 2HB PRO 4 HB3 PRO 4 7.180 -1.894 -7.353 760 1HG PRO 4 HG2 PRO 4 9.382 -1.059 -5.449 761 2HG PRO 4 HG3 PRO 4 9.550 -1.836 -7.053 762 1HD PRO 4 HD2 PRO 4 9.880 0.786 -6.934 763 2HD PRO 4 HD3 PRO 4 8.770 0.157 -8.159 764 H LEU 5 H LEU 5 7.943 0.479 -3.896 765 HA LEU 5 HA LEU 5 5.626 -0.363 -2.310 766 1HB LEU 5 HB2 LEU 5 7.877 -0.803 -1.442 767 2HB LEU 5 HB3 LEU 5 8.226 0.934 -1.423 768 HG LEU 5 HG LEU 5 6.390 1.302 0.216 769 1HD1 LEU 5 HD11 LEU 5 4.833 -0.527 -0.307 770 2HD1 LEU 5 HD12 LEU 5 6.065 -1.738 0.132 771 3HD1 LEU 5 HD13 LEU 5 5.385 -0.649 1.357 772 1HD2 LEU 5 HD21 LEU 5 7.385 0.146 2.135 773 2HD2 LEU 5 HD22 LEU 5 8.329 -0.881 1.031 774 3HD2 LEU 5 HD23 LEU 5 8.606 0.886 1.091 775 H ASP 6 H ASP 6 7.342 2.635 -3.191 776 HA ASP 6 HA ASP 6 5.926 4.493 -1.657 777 1HB ASP 6 HB2 ASP 6 6.929 4.897 -4.504 778 2HB ASP 6 HB3 ASP 6 6.484 6.170 -3.370 779 H GLN 7 H GLN 7 5.056 3.285 -4.943 780 HA GLN 7 HA GLN 7 2.659 4.826 -5.103 781 1HB GLN 7 HB2 GLN 7 1.972 3.359 -6.897 782 2HB GLN 7 HB3 GLN 7 3.660 3.854 -7.067 783 1HG GLN 7 HG2 GLN 7 4.376 1.648 -6.166 784 2HG GLN 7 HG3 GLN 7 2.704 1.110 -6.093 785 1HE2 GLN 7 HE22 GLN 7 1.468 1.250 -8.254 786 2HE2 GLN 7 HE21 GLN 7 2.401 0.877 -9.694 787 H ALA 8 H ALA 8 3.288 1.623 -3.618 788 HA ALA 8 HA ALA 8 0.507 0.986 -3.251 789 1HB ALA 8 HB1 ALA 8 2.993 -0.075 -1.877 790 2HB ALA 8 HB2 ALA 8 1.343 -0.684 -1.642 791 3HB ALA 8 HB3 ALA 8 2.083 -0.752 -3.250 792 H ILE 9 H ILE 9 3.016 2.297 -0.953 793 HA ILE 9 HA ILE 9 1.063 2.754 1.119 794 HB ILE 9 HB ILE 9 2.674 4.225 2.181 795 1HG1 ILE 9 HG12 ILE 9 4.470 3.787 -0.201 796 2HG1 ILE 9 HG13 ILE 9 3.685 5.319 0.219 797 1HG2 ILE 9 HG21 ILE 9 3.969 1.682 1.141 798 2HG2 ILE 9 HG22 ILE 9 4.284 2.495 2.689 799 3HG2 ILE 9 HG23 ILE 9 2.718 1.748 2.401 800 1HD1 ILE 9 HD11 ILE 9 5.941 5.434 0.997 801 2HD1 ILE 9 HD12 ILE 9 4.901 5.281 2.426 802 3HD1 ILE 9 HD13 ILE 9 5.828 3.882 1.833 803 H GLY 10 H GLY 10 2.261 4.772 -1.544 804 1HA GLY 10 HA2 GLY 10 0.873 7.139 -1.336 805 2HA GLY 10 HA3 GLY 10 1.193 6.272 -2.841 806 H LEU 11 H LEU 11 -0.374 4.001 -2.595 807 HA LEU 11 HA LEU 11 -2.906 4.893 -3.373 808 1HB LEU 11 HB2 LEU 11 -1.634 2.605 -3.696 809 2HB LEU 11 HB3 LEU 11 -2.416 2.142 -2.192 810 HG LEU 11 HG LEU 11 -3.678 1.263 -3.969 811 1HD1 LEU 11 HD11 LEU 11 -5.843 2.081 -3.616 812 2HD1 LEU 11 HD12 LEU 11 -4.946 2.227 -2.089 813 3HD1 LEU 11 HD13 LEU 11 -5.256 3.672 -3.098 814 1HD2 LEU 11 HD21 LEU 11 -4.572 2.519 -5.831 815 2HD2 LEU 11 HD22 LEU 11 -3.877 4.031 -5.222 816 3HD2 LEU 11 HD23 LEU 11 -2.815 2.712 -5.769 817 H LEU 12 H LEU 12 -2.075 3.206 -0.303 818 HA LEU 12 HA LEU 12 -4.547 3.549 1.050 819 1HB LEU 12 HB2 LEU 12 -1.650 3.412 2.061 820 2HB LEU 12 HB3 LEU 12 -3.039 3.539 3.137 821 HG LEU 12 HG LEU 12 -3.963 1.447 2.258 822 1HD1 LEU 12 HD11 LEU 12 -2.881 1.257 0.049 823 2HD1 LEU 12 HD12 LEU 12 -1.278 1.198 0.830 824 3HD1 LEU 12 HD13 LEU 12 -2.434 -0.126 1.043 825 1HD2 LEU 12 HD21 LEU 12 -1.140 1.304 3.398 826 2HD2 LEU 12 HD22 LEU 12 -2.650 1.472 4.320 827 3HD2 LEU 12 HD23 LEU 12 -2.325 -0.017 3.434 828 H ILE 13 H ILE 13 -1.691 5.663 0.909 829 HA ILE 13 HA ILE 13 -2.619 7.630 2.719 830 HB ILE 13 HB ILE 13 -0.651 7.676 0.401 831 1HG1 ILE 13 HG12 ILE 13 -0.111 7.940 3.381 832 2HG1 ILE 13 HG13 ILE 13 -0.250 6.361 2.613 833 1HG2 ILE 13 HG21 ILE 13 -1.335 9.906 2.319 834 2HG2 ILE 13 HG22 ILE 13 0.194 9.839 1.403 835 3HG2 ILE 13 HG23 ILE 13 -1.343 9.967 0.546 836 1HD1 ILE 13 HD11 ILE 13 2.038 6.734 2.553 837 2HD1 ILE 13 HD12 ILE 13 1.555 7.228 0.934 838 3HD1 ILE 13 HD13 ILE 13 1.877 8.461 2.172 839 H GLY 14 H GLY 14 -2.825 7.593 -0.878 840 1HA GLY 14 HA2 GLY 14 -4.280 9.994 -1.170 841 2HA GLY 14 HA3 GLY 14 -4.289 8.623 -2.298 842 H ILE 15 H ILE 15 -5.437 6.585 -0.935 843 HA ILE 15 HA ILE 15 -8.207 7.046 -1.081 844 HB ILE 15 HB ILE 15 -6.449 4.902 0.049 845 1HG1 ILE 15 HG12 ILE 15 -8.748 5.041 -1.969 846 2HG1 ILE 15 HG13 ILE 15 -7.020 5.031 -2.339 847 1HG2 ILE 15 HG21 ILE 15 -8.361 3.596 0.848 848 2HG2 ILE 15 HG22 ILE 15 -8.103 5.044 1.794 849 3HG2 ILE 15 HG23 ILE 15 -9.427 4.999 0.594 850 1HD1 ILE 15 HD11 ILE 15 -8.716 2.771 -1.220 851 2HD1 ILE 15 HD12 ILE 15 -7.830 2.823 -2.746 852 3HD1 ILE 15 HD13 ILE 15 -6.942 2.723 -1.210 853 H PHE 16 H PHE 16 -6.108 7.119 1.825 854 HA PHE 16 HA PHE 16 -8.272 7.869 3.567 855 1HB PHE 16 HB2 PHE 16 -6.158 6.856 4.291 856 2HB PHE 16 HB3 PHE 16 -5.257 8.285 3.839 857 HD1 PHE 16 HD1 PHE 16 -5.568 10.437 5.141 858 HD2 PHE 16 HD2 PHE 16 -7.469 6.755 6.335 859 HE1 PHE 16 HE1 PHE 16 -6.048 11.391 7.362 860 HE2 PHE 16 HE2 PHE 16 -7.684 7.630 8.648 861 HZ PHE 16 HZ PHE 16 -6.962 9.931 9.169 862 H HIS 17 H HIS 17 -5.568 9.848 2.320 863 HA HIS 17 HA HIS 17 -6.456 12.111 3.618 864 1HB HIS 17 HB2 HIS 17 -4.119 11.477 2.621 865 2HB HIS 17 HB3 HIS 17 -4.654 12.501 1.285 866 HD1 HIS 17 HD1 HIS 17 -4.537 15.114 1.832 867 HD2 HIS 17 HD2 HIS 17 -4.074 12.569 5.146 868 HE1 HIS 17 HE1 HIS 17 -3.873 16.594 3.809 869 H LYS 18 H LYS 18 -7.358 10.994 0.395 870 HA LYS 18 HA LYS 18 -8.538 13.527 -0.431 871 1HB LYS 18 HB2 LYS 18 -9.147 10.658 -1.211 872 2HB LYS 18 HB3 LYS 18 -9.902 12.076 -1.949 873 1HG LYS 18 HG2 LYS 18 -7.703 12.973 -2.592 874 2HG LYS 18 HG3 LYS 18 -6.888 11.536 -1.989 875 1HD LYS 18 HD2 LYS 18 -9.084 11.367 -4.105 876 2HD LYS 18 HD3 LYS 18 -7.427 11.786 -4.532 877 1HE LYS 18 HE2 LYS 18 -7.814 9.408 -4.899 878 2HE LYS 18 HE3 LYS 18 -6.572 9.664 -3.666 879 1HZ LYS 18 HZ1 LYS 18 -9.387 9.079 -3.079 880 2HZ LYS 18 HZ2 LYS 18 -8.181 7.952 -3.130 881 3HZ LYS 18 HZ3 LYS 18 -8.128 9.156 -2.008 882 H TYR 19 H TYR 19 -9.713 10.676 1.408 883 HA TYR 19 HA TYR 19 -12.434 11.695 1.490 884 1HB TYR 19 HB2 TYR 19 -11.000 9.261 2.411 885 2HB TYR 19 HB3 TYR 19 -12.394 9.754 3.372 886 HD1 TYR 19 HD1 TYR 19 -11.425 8.072 0.312 887 HD2 TYR 19 HD2 TYR 19 -14.560 10.346 2.179 888 HE1 TYR 19 HE1 TYR 19 -13.048 7.164 -1.311 889 HE2 TYR 19 HE2 TYR 19 -16.190 9.459 0.545 890 HH TYR 19 HH TYR 19 -15.380 6.872 -1.711 891 H SER 20 H SER 20 -9.697 11.644 3.884 892 HA SER 20 HA SER 20 -11.268 13.030 5.896 893 1HB SER 20 HB2 SER 20 -8.978 13.760 6.686 894 2HB SER 20 HB3 SER 20 -9.241 12.003 6.613 895 HG SER 20 HG SER 20 -7.268 13.005 5.588 896 H GLY 21 H GLY 21 -9.032 14.122 3.287 897 1HA GLY 21 HA2 GLY 21 -9.172 16.854 3.437 898 2HA GLY 21 HA3 GLY 21 -9.184 15.952 1.911 899 H LYS 22 H LYS 22 -11.633 14.746 1.860 900 HA LYS 22 HA LYS 22 -13.429 16.661 1.009 901 1HB LYS 22 HB2 LYS 22 -13.448 14.147 0.668 902 2HB LYS 22 HB3 LYS 22 -14.266 14.014 2.236 903 1HG LYS 22 HG2 LYS 22 -16.069 15.533 1.363 904 2HG LYS 22 HG3 LYS 22 -15.285 15.508 -0.218 905 1HD LYS 22 HD2 LYS 22 -16.475 13.150 1.326 906 2HD LYS 22 HD3 LYS 22 -17.143 13.899 -0.124 907 1HE LYS 22 HE2 LYS 22 -14.580 12.250 0.081 908 2HE LYS 22 HE3 LYS 22 -16.087 11.798 -0.718 909 1HZ LYS 22 HZ1 LYS 22 -14.321 13.999 -1.523 910 2HZ LYS 22 HZ2 LYS 22 -14.473 12.546 -2.283 911 3HZ LYS 22 HZ3 LYS 22 -15.742 13.599 -2.259 912 H GLU 23 H GLU 23 -12.956 15.552 4.356 913 HA GLU 23 HA GLU 23 -15.059 17.466 5.272 914 1HB GLU 23 HB2 GLU 23 -15.178 16.095 7.360 915 2HB GLU 23 HB3 GLU 23 -15.849 15.420 5.882 916 1HG GLU 23 HG2 GLU 23 -14.893 13.592 6.744 917 2HG GLU 23 HG3 GLU 23 -13.598 14.091 5.671 918 H GLY 24 H GLY 24 -12.185 17.935 4.508 919 1HA GLY 24 HA2 GLY 24 -10.863 19.661 5.117 920 2HA GLY 24 HA3 GLY 24 -11.904 19.955 6.509 921 H ASP 25 H ASP 25 -11.444 17.347 7.813 922 HA ASP 25 HA ASP 25 -9.180 18.303 9.310 923 1HB ASP 25 HB2 ASP 25 -10.760 15.752 9.751 924 2HB ASP 25 HB3 ASP 25 -9.739 16.609 10.913 925 H LYS 26 H LYS 26 -7.963 17.814 7.075 926 HA LYS 26 HA LYS 26 -6.578 16.275 5.876 927 1HB LYS 26 HB2 LYS 26 -4.969 17.413 8.183 928 2HB LYS 26 HB3 LYS 26 -4.406 17.035 6.554 929 1HG LYS 26 HG2 LYS 26 -6.347 19.220 7.404 930 2HG LYS 26 HG3 LYS 26 -4.691 19.419 6.834 931 1HD LYS 26 HD2 LYS 26 -5.349 18.484 4.602 932 2HD LYS 26 HD3 LYS 26 -7.033 18.404 5.145 933 1HE LYS 26 HE2 LYS 26 -5.354 20.933 4.873 934 2HE LYS 26 HE3 LYS 26 -6.693 20.411 3.836 935 1HZ LYS 26 HZ1 LYS 26 -8.102 20.511 5.835 936 2HZ LYS 26 HZ2 LYS 26 -6.857 21.204 6.651 937 3HZ LYS 26 HZ3 LYS 26 -7.507 21.978 5.351 938 H HIS 27 H HIS 27 -5.320 15.675 9.147 939 HA HIS 27 HA HIS 27 -4.640 12.970 8.178 940 1HB HIS 27 HB2 HIS 27 -3.639 14.461 10.611 941 2HB HIS 27 HB3 HIS 27 -3.003 12.937 9.982 942 HD1 HIS 27 HD1 HIS 27 -3.308 14.525 6.821 943 HD2 HIS 27 HD2 HIS 27 -0.977 15.260 10.269 944 HE1 HIS 27 HE1 HIS 27 -1.285 15.824 6.069 945 H THR 28 H THR 28 -7.361 13.820 9.387 946 HA THR 28 HA THR 28 -7.683 11.255 10.764 947 HB THR 28 HB THR 28 -7.365 12.849 12.605 948 HG1 THR 28 HG1 THR 28 -8.680 11.141 13.020 949 1HG2 THR 28 HG21 THR 28 -8.244 14.907 11.622 950 2HG2 THR 28 HG22 THR 28 -9.882 14.201 11.551 951 3HG2 THR 28 HG23 THR 28 -9.109 14.506 13.116 952 H LEU 29 H LEU 29 -9.710 10.315 10.576 953 HA LEU 29 HA LEU 29 -11.427 11.514 8.446 954 1HB LEU 29 HB2 LEU 29 -9.514 9.802 7.921 955 2HB LEU 29 HB3 LEU 29 -10.635 8.585 8.513 956 HG LEU 29 HG LEU 29 -11.393 10.602 6.345 957 1HD1 LEU 29 HD11 LEU 29 -10.622 8.917 4.687 958 2HD1 LEU 29 HD12 LEU 29 -9.283 9.560 5.645 959 3HD1 LEU 29 HD13 LEU 29 -9.936 7.944 6.000 960 1HD2 LEU 29 HD21 LEU 29 -12.254 7.724 6.814 961 2HD2 LEU 29 HD22 LEU 29 -13.175 9.139 7.373 962 3HD2 LEU 29 HD23 LEU 29 -12.934 8.864 5.632 963 H SER 30 H SER 30 -13.499 11.605 9.113 964 HA SER 30 HA SER 30 -14.202 10.459 11.661 965 1HB SER 30 HB2 SER 30 -16.402 11.670 11.159 966 2HB SER 30 HB3 SER 30 -14.956 12.682 11.093 967 HG SER 30 HG SER 30 -15.063 12.783 8.958 968 H LYS 31 H LYS 31 -16.503 9.522 11.907 969 HA LYS 31 HA LYS 31 -16.222 6.867 11.179 970 1HB LYS 31 HB2 LYS 31 -18.784 8.280 12.071 971 2HB LYS 31 HB3 LYS 31 -18.414 6.562 12.210 972 1HG LYS 31 HG2 LYS 31 -16.481 7.189 13.735 973 2HG LYS 31 HG3 LYS 31 -17.101 8.851 13.732 974 1HD LYS 31 HD2 LYS 31 -19.380 7.870 14.405 975 2HD LYS 31 HD3 LYS 31 -18.535 6.342 14.694 976 1HE LYS 31 HE2 LYS 31 -17.996 9.023 16.071 977 2HE LYS 31 HE3 LYS 31 -18.812 7.619 16.777 978 1HZ LYS 31 HZ1 LYS 31 -16.748 6.392 16.473 979 2HZ LYS 31 HZ2 LYS 31 -16.009 7.770 15.928 980 3HZ LYS 31 HZ3 LYS 31 -16.582 7.690 17.470 981 H LYS 32 H LYS 32 -18.848 9.039 10.023 982 HA LYS 32 HA LYS 32 -19.725 7.031 8.145 983 1HB LYS 32 HB2 LYS 32 -21.295 8.480 9.127 984 2HB LYS 32 HB3 LYS 32 -20.556 9.938 8.428 985 1HG LYS 32 HG2 LYS 32 -21.487 7.671 6.639 986 2HG LYS 32 HG3 LYS 32 -22.687 8.760 7.334 987 1HD LYS 32 HD2 LYS 32 -21.879 10.660 6.207 988 2HD LYS 32 HD3 LYS 32 -20.325 9.923 5.814 989 1HE LYS 32 HE2 LYS 32 -21.433 8.287 4.326 990 2HE LYS 32 HE3 LYS 32 -23.005 9.037 4.663 991 1HZ LYS 32 HZ1 LYS 32 -22.210 11.034 3.670 992 2HZ LYS 32 HZ2 LYS 32 -20.695 10.408 3.476 993 3HZ LYS 32 HZ3 LYS 32 -21.950 9.777 2.625 994 H GLU 33 H GLU 33 -17.455 9.744 7.927 995 HA GLU 33 HA GLU 33 -17.283 9.742 5.072 996 1HB GLU 33 HB2 GLU 33 -16.369 11.511 6.669 997 2HB GLU 33 HB3 GLU 33 -15.061 10.389 7.052 998 1HG GLU 33 HG2 GLU 33 -14.200 11.816 5.360 999 2HG GLU 33 HG3 GLU 33 -14.587 10.332 4.505 1000 H LEU 34 H LEU 34 -15.587 7.896 7.655 1001 HA LEU 34 HA LEU 34 -13.997 6.327 5.912 1002 1HB LEU 34 HB2 LEU 34 -13.534 6.483 8.267 1003 2HB LEU 34 HB3 LEU 34 -15.081 5.808 8.713 1004 HG LEU 34 HG LEU 34 -13.100 4.318 8.953 1005 1HD1 LEU 34 HD11 LEU 34 -14.290 2.342 8.442 1006 2HD1 LEU 34 HD12 LEU 34 -15.526 3.549 8.772 1007 3HD1 LEU 34 HD13 LEU 34 -15.168 3.096 7.108 1008 1HD2 LEU 34 HD21 LEU 34 -12.158 3.194 6.983 1009 2HD2 LEU 34 HD22 LEU 34 -13.215 4.098 5.914 1010 3HD2 LEU 34 HD23 LEU 34 -11.952 4.946 6.831 1011 H LYS 35 H LYS 35 -17.320 5.733 7.230 1012 HA LYS 35 HA LYS 35 -17.758 3.292 5.889 1013 1HB LYS 35 HB2 LYS 35 -19.746 5.582 6.282 1014 2HB LYS 35 HB3 LYS 35 -20.181 3.985 5.736 1015 1HG LYS 35 HG2 LYS 35 -18.815 4.534 8.403 1016 2HG LYS 35 HG3 LYS 35 -20.560 4.476 8.206 1017 1HD LYS 35 HD2 LYS 35 -18.583 2.218 7.720 1018 2HD LYS 35 HD3 LYS 35 -19.726 2.349 9.043 1019 1HE LYS 35 HE2 LYS 35 -20.338 1.778 6.123 1020 2HE LYS 35 HE3 LYS 35 -20.696 0.787 7.534 1021 1HZ LYS 35 HZ1 LYS 35 -21.974 3.330 6.855 1022 2HZ LYS 35 HZ2 LYS 35 -22.647 1.820 6.807 1023 3HZ LYS 35 HZ3 LYS 35 -22.234 2.495 8.251 1024 H GLU 36 H GLU 36 -18.167 6.617 4.573 1025 HA GLU 36 HA GLU 36 -19.015 5.821 2.010 1026 1HB GLU 36 HB2 GLU 36 -18.969 8.172 3.078 1027 2HB GLU 36 HB3 GLU 36 -17.288 8.270 2.551 1028 1HG GLU 36 HG2 GLU 36 -18.672 9.337 0.892 1029 2HG GLU 36 HG3 GLU 36 -18.056 7.835 0.186 1030 H LEU 37 H LEU 37 -15.695 6.383 3.249 1031 HA LEU 37 HA LEU 37 -14.240 5.883 0.880 1032 1HB LEU 37 HB2 LEU 37 -13.284 6.777 2.928 1033 2HB LEU 37 HB3 LEU 37 -13.517 5.259 3.777 1034 HG LEU 37 HG LEU 37 -11.722 5.467 1.340 1035 1HD1 LEU 37 HD11 LEU 37 -10.945 7.063 3.018 1036 2HD1 LEU 37 HD12 LEU 37 -11.060 5.837 4.298 1037 3HD1 LEU 37 HD13 LEU 37 -9.857 5.674 3.010 1038 1HD2 LEU 37 HD21 LEU 37 -12.179 3.120 1.906 1039 2HD2 LEU 37 HD22 LEU 37 -10.585 3.510 2.521 1040 3HD2 LEU 37 HD23 LEU 37 -11.956 3.451 3.638 1041 H ILE 38 H ILE 38 -15.247 3.551 3.388 1042 HA ILE 38 HA ILE 38 -14.280 1.236 2.012 1043 HB ILE 38 HB ILE 38 -16.525 1.593 4.028 1044 1HG1 ILE 38 HG12 ILE 38 -13.632 0.611 4.321 1045 2HG1 ILE 38 HG13 ILE 38 -14.207 2.223 4.779 1046 1HG2 ILE 38 HG21 ILE 38 -16.574 -0.747 4.364 1047 2HG2 ILE 38 HG22 ILE 38 -16.688 -0.599 2.634 1048 3HG2 ILE 38 HG23 ILE 38 -15.135 -1.028 3.390 1049 1HD1 ILE 38 HD11 ILE 38 -15.036 -0.422 5.949 1050 2HD1 ILE 38 HD12 ILE 38 -14.110 0.866 6.736 1051 3HD1 ILE 38 HD13 ILE 38 -15.843 1.111 6.350 1052 H GLN 39 H GLN 39 -17.572 2.694 2.087 1053 HA GLN 39 HA GLN 39 -18.792 0.773 0.432 1054 1HB GLN 39 HB2 GLN 39 -19.424 3.671 1.032 1055 2HB GLN 39 HB3 GLN 39 -20.500 2.652 0.061 1056 1HG GLN 39 HG2 GLN 39 -20.894 1.116 1.811 1057 2HG GLN 39 HG3 GLN 39 -19.544 1.695 2.789 1058 1HE2 GLN 39 HE22 GLN 39 -21.747 1.439 4.206 1059 2HE2 GLN 39 HE21 GLN 39 -22.527 2.998 4.446 1060 H LYS 40 H LYS 40 -16.823 3.599 -0.497 1061 HA LYS 40 HA LYS 40 -17.362 3.090 -3.321 1062 1HB LYS 40 HB2 LYS 40 -16.823 5.340 -2.441 1063 2HB LYS 40 HB3 LYS 40 -15.185 4.785 -2.037 1064 1HG LYS 40 HG2 LYS 40 -14.731 4.289 -4.407 1065 2HG LYS 40 HG3 LYS 40 -16.382 4.727 -4.858 1066 1HD LYS 40 HD2 LYS 40 -14.396 6.665 -3.581 1067 2HD LYS 40 HD3 LYS 40 -14.578 6.454 -5.322 1068 1HE LYS 40 HE2 LYS 40 -16.871 7.195 -5.308 1069 2HE LYS 40 HE3 LYS 40 -16.930 7.258 -3.545 1070 1HZ LYS 40 HZ1 LYS 40 -15.301 8.966 -3.572 1071 2HZ LYS 40 HZ2 LYS 40 -15.203 8.924 -5.221 1072 3HZ LYS 40 HZ3 LYS 40 -16.601 9.398 -4.487 1073 H GLU 41 H GLU 41 -14.465 2.588 -1.253 1074 HA GLU 41 HA GLU 41 -13.066 1.286 -3.424 1075 1HB GLU 41 HB2 GLU 41 -11.981 2.493 -1.525 1076 2HB GLU 41 HB3 GLU 41 -12.552 1.260 -0.412 1077 1HG GLU 41 HG2 GLU 41 -10.262 0.799 -0.891 1078 2HG GLU 41 HG3 GLU 41 -11.207 -0.457 -1.684 1079 H LEU 42 H LEU 42 -14.442 0.033 -0.416 1080 HA LEU 42 HA LEU 42 -14.193 -2.797 -1.392 1081 1HB LEU 42 HB2 LEU 42 -14.669 -1.764 1.410 1082 2HB LEU 42 HB3 LEU 42 -14.425 -3.451 0.941 1083 HG LEU 42 HG LEU 42 -12.360 -1.195 0.796 1084 1HD1 LEU 42 HD11 LEU 42 -12.858 -1.954 3.087 1085 2HD1 LEU 42 HD12 LEU 42 -12.549 -3.638 2.606 1086 3HD1 LEU 42 HD13 LEU 42 -11.231 -2.446 2.587 1087 1HD2 LEU 42 HD21 LEU 42 -10.740 -3.025 0.269 1088 2HD2 LEU 42 HD22 LEU 42 -12.099 -4.157 0.102 1089 3HD2 LEU 42 HD23 LEU 42 -11.930 -2.780 -1.011 1090 H THR 43 H THR 43 -15.943 -1.737 -2.804 1091 HA THR 43 HA THR 43 -18.367 -0.981 -1.577 1092 HB THR 43 HB THR 43 -17.497 -0.178 -3.702 1093 HG1 THR 43 HG1 THR 43 -19.478 0.361 -3.174 1094 1HG2 THR 43 HG21 THR 43 -16.996 -2.398 -4.802 1095 2HG2 THR 43 HG22 THR 43 -18.746 -2.563 -5.091 1096 3HG2 THR 43 HG23 THR 43 -17.861 -1.205 -5.790 1097 H ILE 44 H ILE 44 -18.901 -2.576 -0.136 1098 HA ILE 44 HA ILE 44 -19.738 -5.181 -0.836 1099 HB ILE 44 HB ILE 44 -20.907 -5.312 1.236 1100 1HG1 ILE 44 HG12 ILE 44 -21.979 -3.248 1.728 1101 2HG1 ILE 44 HG13 ILE 44 -20.800 -3.578 2.967 1102 1HG2 ILE 44 HG21 ILE 44 -18.483 -5.654 1.093 1103 2HG2 ILE 44 HG22 ILE 44 -18.208 -3.973 1.585 1104 3HG2 ILE 44 HG23 ILE 44 -19.009 -5.106 2.690 1105 1HD1 ILE 44 HD11 ILE 44 -20.546 -1.522 0.740 1106 2HD1 ILE 44 HD12 ILE 44 -20.759 -1.243 2.472 1107 3HD1 ILE 44 HD13 ILE 44 -19.234 -1.920 1.883 1108 H GLY 45 H GLY 45 -20.730 -4.722 -2.899 1109 1HA GLY 45 HA2 GLY 45 -23.252 -3.754 -3.451 1110 2HA GLY 45 HA3 GLY 45 -22.648 -5.298 -4.087 1111 H SER 46 H SER 46 -22.479 -6.815 -1.750 1112 HA SER 46 HA SER 46 -25.117 -7.584 -1.002 1113 1HB SER 46 HB2 SER 46 -22.469 -8.026 0.441 1114 2HB SER 46 HB3 SER 46 -23.912 -9.058 0.515 1115 HG SER 46 HG SER 46 -22.263 -9.816 -0.928 1116 H LYS 47 H LYS 47 -25.660 -5.157 -0.567 1117 HA LYS 47 HA LYS 47 -24.631 -3.550 1.302 1118 1HB LYS 47 HB2 LYS 47 -27.536 -3.918 0.529 1119 2HB LYS 47 HB3 LYS 47 -27.010 -2.568 1.531 1120 1HG LYS 47 HG2 LYS 47 -25.420 -2.946 -0.988 1121 2HG LYS 47 HG3 LYS 47 -27.118 -2.544 -1.209 1122 1HD LYS 47 HD2 LYS 47 -25.839 -0.498 -1.177 1123 2HD LYS 47 HD3 LYS 47 -26.897 -0.562 0.232 1124 1HE LYS 47 HE2 LYS 47 -24.739 0.319 0.885 1125 2HE LYS 47 HE3 LYS 47 -24.935 -1.260 1.646 1126 1HZ LYS 47 HZ1 LYS 47 -22.767 -0.949 0.683 1127 2HZ LYS 47 HZ2 LYS 47 -23.532 -2.177 -0.096 1128 3HZ LYS 47 HZ3 LYS 47 -23.409 -0.700 -0.811 1129 H LEU 48 H LEU 48 -26.715 -6.245 2.187 1130 HA LEU 48 HA LEU 48 -27.306 -5.562 4.864 1131 1HB LEU 48 HB2 LEU 48 -26.557 -8.304 3.767 1132 2HB LEU 48 HB3 LEU 48 -27.427 -7.989 5.274 1133 HG LEU 48 HG LEU 48 -28.451 -7.381 2.456 1134 1HD1 LEU 48 HD11 LEU 48 -30.034 -9.200 2.909 1135 2HD1 LEU 48 HD12 LEU 48 -28.363 -9.783 3.011 1136 3HD1 LEU 48 HD13 LEU 48 -29.288 -9.481 4.498 1137 1HD2 LEU 48 HD21 LEU 48 -29.782 -7.024 5.181 1138 2HD2 LEU 48 HD22 LEU 48 -29.394 -5.739 4.014 1139 3HD2 LEU 48 HD23 LEU 48 -30.624 -6.942 3.621 1140 H GLN 49 H GLN 49 -24.308 -6.796 3.464 1141 HA GLN 49 HA GLN 49 -22.982 -7.369 5.947 1142 1HB GLN 49 HB2 GLN 49 -21.818 -6.771 3.198 1143 2HB GLN 49 HB3 GLN 49 -20.933 -7.395 4.593 1144 1HG GLN 49 HG2 GLN 49 -22.555 -9.354 4.664 1145 2HG GLN 49 HG3 GLN 49 -23.233 -8.776 3.136 1146 1HE2 GLN 49 HE22 GLN 49 -20.092 -9.669 4.667 1147 2HE2 GLN 49 HE21 GLN 49 -19.416 -10.386 3.206 1148 H ASP 50 H ASP 50 -23.878 -4.322 4.586 1149 HA ASP 50 HA ASP 50 -21.795 -2.712 5.551 1150 1HB ASP 50 HB2 ASP 50 -23.714 -1.929 4.170 1151 2HB ASP 50 HB3 ASP 50 -24.733 -1.991 5.623 1152 H ALA 51 H ALA 51 -24.267 -4.566 7.285 1153 HA ALA 51 HA ALA 51 -24.035 -3.434 9.884 1154 1HB ALA 51 HB1 ALA 51 -24.668 -5.684 10.658 1155 2HB ALA 51 HB2 ALA 51 -25.662 -5.175 9.277 1156 3HB ALA 51 HB3 ALA 51 -24.346 -6.347 9.041 1157 H GLU 52 H GLU 52 -21.935 -5.801 8.167 1158 HA GLU 52 HA GLU 52 -20.119 -6.196 10.403 1159 1HB GLU 52 HB2 GLU 52 -19.621 -6.615 7.418 1160 2HB GLU 52 HB3 GLU 52 -18.668 -7.240 8.764 1161 1HG GLU 52 HG2 GLU 52 -20.624 -8.578 9.531 1162 2HG GLU 52 HG3 GLU 52 -21.572 -7.989 8.157 1163 H ILE 53 H ILE 53 -20.290 -4.130 7.482 1164 HA ILE 53 HA ILE 53 -17.806 -2.846 7.873 1165 HB ILE 53 HB ILE 53 -20.255 -1.563 6.640 1166 1HG1 ILE 53 HG12 ILE 53 -19.775 -3.637 5.418 1167 2HG1 ILE 53 HG13 ILE 53 -19.239 -2.248 4.476 1168 1HG2 ILE 53 HG21 ILE 53 -17.304 -0.901 6.498 1169 2HG2 ILE 53 HG22 ILE 53 -18.563 -0.187 5.448 1170 3HG2 ILE 53 HG23 ILE 53 -18.574 0.074 7.191 1171 1HD1 ILE 53 HD11 ILE 53 -17.533 -4.196 6.072 1172 2HD1 ILE 53 HD12 ILE 53 -17.585 -3.972 4.314 1173 3HD1 ILE 53 HD13 ILE 53 -16.887 -2.712 5.338 1174 H VAL 54 H VAL 54 -20.998 -1.909 9.348 1175 HA VAL 54 HA VAL 54 -19.771 0.356 10.606 1176 HB VAL 54 HB VAL 54 -21.672 0.372 12.213 1177 1HG1 VAL 54 HG11 VAL 54 -21.551 1.785 10.221 1178 2HG1 VAL 54 HG12 VAL 54 -22.257 0.471 9.243 1179 3HG1 VAL 54 HG13 VAL 54 -23.210 1.258 10.517 1180 1HG2 VAL 54 HG21 VAL 54 -23.661 -0.879 11.730 1181 2HG2 VAL 54 HG22 VAL 54 -22.840 -1.729 10.416 1182 3HG2 VAL 54 HG23 VAL 54 -22.336 -1.995 12.107 1183 H LYS 55 H LYS 55 -19.900 -3.059 11.648 1184 HA LYS 55 HA LYS 55 -18.810 -2.516 14.261 1185 1HB LYS 55 HB2 LYS 55 -19.766 -4.681 13.744 1186 2HB LYS 55 HB3 LYS 55 -18.572 -4.970 12.477 1187 1HG LYS 55 HG2 LYS 55 -18.059 -6.214 14.513 1188 2HG LYS 55 HG3 LYS 55 -16.761 -5.091 14.095 1189 1HD LYS 55 HD2 LYS 55 -17.460 -3.531 15.854 1190 2HD LYS 55 HD3 LYS 55 -18.941 -4.466 16.144 1191 1HE LYS 55 HE2 LYS 55 -17.274 -4.910 17.882 1192 2HE LYS 55 HE3 LYS 55 -17.585 -6.379 16.943 1193 1HZ LYS 55 HZ1 LYS 55 -15.259 -6.032 17.330 1194 2HZ LYS 55 HZ2 LYS 55 -15.573 -5.927 15.717 1195 3HZ LYS 55 HZ3 LYS 55 -15.296 -4.560 16.591 1196 H LEU 56 H LEU 56 -17.282 -3.293 11.111 1197 HA LEU 56 HA LEU 56 -14.585 -3.007 11.978 1198 1HB LEU 56 HB2 LEU 56 -15.031 -4.190 10.042 1199 2HB LEU 56 HB3 LEU 56 -15.965 -2.898 9.302 1200 HG LEU 56 HG LEU 56 -13.086 -2.265 9.904 1201 1HD1 LEU 56 HD11 LEU 56 -13.954 -4.127 7.645 1202 2HD1 LEU 56 HD12 LEU 56 -12.376 -3.331 7.767 1203 3HD1 LEU 56 HD13 LEU 56 -12.854 -4.539 8.983 1204 1HD2 LEU 56 HD21 LEU 56 -14.689 -0.669 8.760 1205 2HD2 LEU 56 HD22 LEU 56 -13.328 -1.139 7.714 1206 3HD2 LEU 56 HD23 LEU 56 -14.921 -1.900 7.507 1207 H MET 57 H MET 57 -16.874 -0.559 10.775 1208 HA MET 57 HA MET 57 -15.164 1.706 10.704 1209 1HB MET 57 HB2 MET 57 -17.453 1.699 9.779 1210 2HB MET 57 HB3 MET 57 -18.091 1.424 11.395 1211 1HG MET 57 HG2 MET 57 -16.879 3.749 11.947 1212 2HG MET 57 HG3 MET 57 -17.076 3.959 10.216 1213 1HE MET 57 HE1 MET 57 -18.738 3.726 13.697 1214 2HE MET 57 HE2 MET 57 -20.473 3.658 13.315 1215 3HE MET 57 HE3 MET 57 -19.444 2.251 12.999 1216 H ASP 58 H ASP 58 -17.313 0.428 13.318 1217 HA ASP 58 HA ASP 58 -16.583 2.241 15.330 1218 1HB ASP 58 HB2 ASP 58 -18.414 0.662 15.628 1219 2HB ASP 58 HB3 ASP 58 -17.293 -0.705 15.634 1220 H ASP 59 H ASP 59 -15.040 -0.910 14.518 1221 HA ASP 59 HA ASP 59 -12.945 -0.725 16.409 1222 1HB ASP 59 HB2 ASP 59 -12.771 -1.971 13.632 1223 2HB ASP 59 HB3 ASP 59 -11.702 -2.281 15.005 1224 H LEU 60 H LEU 60 -12.923 0.395 12.989 1225 HA LEU 60 HA LEU 60 -10.340 1.506 12.978 1226 1HB LEU 60 HB2 LEU 60 -12.878 1.967 11.420 1227 2HB LEU 60 HB3 LEU 60 -11.594 3.152 11.231 1228 HG LEU 60 HG LEU 60 -10.923 0.220 10.992 1229 1HD1 LEU 60 HD11 LEU 60 -12.845 0.543 9.496 1230 2HD1 LEU 60 HD12 LEU 60 -12.020 1.927 8.746 1231 3HD1 LEU 60 HD13 LEU 60 -11.343 0.300 8.573 1232 1HD2 LEU 60 HD21 LEU 60 -9.252 1.183 9.359 1233 2HD2 LEU 60 HD22 LEU 60 -9.903 2.791 9.657 1234 3HD2 LEU 60 HD23 LEU 60 -9.083 1.913 10.972 1235 H ASP 61 H ASP 61 -13.418 3.273 13.680 1236 HA ASP 61 HA ASP 61 -11.960 5.681 14.278 1237 1HB ASP 61 HB2 ASP 61 -13.987 6.605 15.100 1238 2HB ASP 61 HB3 ASP 61 -14.231 5.821 13.540 1239 H ARG 62 H ARG 62 -13.062 2.980 16.301 1240 HA ARG 62 HA ARG 62 -12.449 4.103 18.832 1241 1HB ARG 62 HB2 ARG 62 -13.795 2.101 18.521 1242 2HB ARG 62 HB3 ARG 62 -12.396 1.217 17.877 1243 1HG ARG 62 HG2 ARG 62 -11.277 1.376 20.073 1244 2HG ARG 62 HG3 ARG 62 -12.648 2.320 20.707 1245 1HD ARG 62 HD2 ARG 62 -14.175 0.434 20.241 1246 2HD ARG 62 HD3 ARG 62 -12.829 -0.498 19.543 1247 HE ARG 62 HE ARG 62 -12.109 0.267 22.174 1248 1HH1 ARG 62 HH21 ARG 62 -14.418 -1.820 20.515 1249 2HH1 ARG 62 HH22 ARG 62 -14.512 -2.997 21.797 1250 1HH2 ARG 62 HH12 ARG 62 -12.214 -1.259 23.875 1251 2HH2 ARG 62 HH11 ARG 62 -13.235 -2.665 23.750 1252 H ASN 63 H ASN 63 -10.436 2.414 16.410 1253 HA ASN 63 HA ASN 63 -8.060 2.131 17.762 1254 1HB ASN 63 HB2 ASN 63 -8.719 1.661 15.251 1255 2HB ASN 63 HB3 ASN 63 -7.979 3.239 14.953 1256 1HD2 ASN 63 HD22 ASN 63 -5.784 3.005 16.941 1257 2HD2 ASN 63 HD21 ASN 63 -4.744 1.740 16.309 1258 H LYS 64 H LYS 64 -9.561 5.180 16.818 1259 HA LYS 64 HA LYS 64 -7.685 6.444 18.619 1260 1HB LYS 64 HB2 LYS 64 -6.664 6.843 16.349 1261 2HB LYS 64 HB3 LYS 64 -8.120 7.732 15.902 1262 1HG LYS 64 HG2 LYS 64 -6.301 9.212 16.605 1263 2HG LYS 64 HG3 LYS 64 -7.669 9.399 17.690 1264 1HD LYS 64 HD2 LYS 64 -6.554 8.155 19.435 1265 2HD LYS 64 HD3 LYS 64 -5.298 7.578 18.323 1266 1HE LYS 64 HE2 LYS 64 -5.743 10.478 19.189 1267 2HE LYS 64 HE3 LYS 64 -4.511 9.377 19.828 1268 1HZ LYS 64 HZ1 LYS 64 -3.526 10.722 18.209 1269 2HZ LYS 64 HZ2 LYS 64 -3.646 9.206 17.561 1270 3HZ LYS 64 HZ3 LYS 64 -4.683 10.395 17.086 1271 H ASP 65 H ASP 65 -9.916 5.665 19.355 1272 HA ASP 65 HA ASP 65 -11.691 6.170 20.495 1273 1HB ASP 65 HB2 ASP 65 -11.897 8.301 21.617 1274 2HB ASP 65 HB3 ASP 65 -10.260 7.648 21.661 1275 H GLN 66 H GLN 66 -11.682 8.803 18.105 1276 HA GLN 66 HA GLN 66 -14.610 8.319 17.693 1277 1HB GLN 66 HB2 GLN 66 -13.251 10.973 18.252 1278 2HB GLN 66 HB3 GLN 66 -14.909 10.819 17.661 1279 1HG GLN 66 HG2 GLN 66 -13.946 9.618 20.301 1280 2HG GLN 66 HG3 GLN 66 -14.726 11.184 20.118 1281 1HE2 GLN 66 HE21 GLN 66 -15.273 7.649 19.783 1282 2HE2 GLN 66 HE22 GLN 66 -17.022 7.791 19.897 1283 H GLU 67 H GLU 67 -11.607 9.597 16.262 1284 HA GLU 67 HA GLU 67 -12.885 9.407 13.564 1285 1HB GLU 67 HB2 GLU 67 -11.103 11.682 14.536 1286 2HB GLU 67 HB3 GLU 67 -11.734 11.439 12.899 1287 1HG GLU 67 HG2 GLU 67 -14.071 11.649 13.833 1288 2HG GLU 67 HG3 GLU 67 -13.365 12.046 15.408 1289 H VAL 68 H VAL 68 -11.485 8.267 12.171 1290 HA VAL 68 HA VAL 68 -9.303 7.001 13.670 1291 HB VAL 68 HB VAL 68 -10.715 5.586 12.337 1292 1HG1 VAL 68 HG11 VAL 68 -9.550 6.883 9.849 1293 2HG1 VAL 68 HG12 VAL 68 -10.544 5.423 9.916 1294 3HG1 VAL 68 HG13 VAL 68 -11.244 6.970 10.386 1295 1HG2 VAL 68 HG21 VAL 68 -8.892 4.280 11.333 1296 2HG2 VAL 68 HG22 VAL 68 -7.824 5.694 11.396 1297 3HG2 VAL 68 HG23 VAL 68 -8.403 4.949 12.895 1298 H ASN 69 H ASN 69 -7.329 7.764 13.734 1299 HA ASN 69 HA ASN 69 -6.531 10.020 12.014 1300 1HB ASN 69 HB2 ASN 69 -5.489 8.817 14.558 1301 2HB ASN 69 HB3 ASN 69 -4.479 9.881 13.568 1302 1HD2 ASN 69 HD21 ASN 69 -8.003 9.929 14.758 1303 2HD2 ASN 69 HD22 ASN 69 -7.860 11.608 15.206 1304 H PHE 70 H PHE 70 -4.718 10.008 10.710 1305 HA PHE 70 HA PHE 70 -4.621 8.036 8.904 1306 1HB PHE 70 HB2 PHE 70 -3.660 10.191 8.499 1307 2HB PHE 70 HB3 PHE 70 -2.388 9.924 9.689 1308 HD1 PHE 70 HD1 PHE 70 -3.803 8.337 6.574 1309 HD2 PHE 70 HD2 PHE 70 -0.297 9.127 8.958 1310 HE1 PHE 70 HE1 PHE 70 -2.434 7.000 5.007 1311 HE2 PHE 70 HE2 PHE 70 1.062 7.797 7.394 1312 HZ PHE 70 HZ PHE 70 -0.004 6.680 5.440 1313 H GLN 71 H GLN 71 -1.966 8.177 11.372 1314 HA GLN 71 HA GLN 71 -0.755 5.811 10.424 1315 1HB GLN 71 HB2 GLN 71 0.241 7.560 11.927 1316 2HB GLN 71 HB3 GLN 71 -0.638 6.836 13.288 1317 1HG GLN 71 HG2 GLN 71 0.522 4.659 12.839 1318 2HG GLN 71 HG3 GLN 71 1.393 5.409 11.494 1319 1HE2 GLN 71 HE22 GLN 71 2.271 7.837 12.466 1320 2HE2 GLN 71 HE21 GLN 71 3.286 7.562 13.870 1321 H GLU 72 H GLU 72 -3.319 6.283 12.840 1322 HA GLU 72 HA GLU 72 -3.449 3.572 13.756 1323 1HB GLU 72 HB2 GLU 72 -5.511 5.826 13.859 1324 2HB GLU 72 HB3 GLU 72 -5.618 4.269 14.665 1325 1HG GLU 72 HG2 GLU 72 -4.746 5.506 16.379 1326 2HG GLU 72 HG3 GLU 72 -3.261 4.872 15.690 1327 H TYR 73 H TYR 73 -5.103 5.367 11.141 1328 HA TYR 73 HA TYR 73 -6.771 3.232 10.216 1329 1HB TYR 73 HB2 TYR 73 -7.338 5.172 9.194 1330 2HB TYR 73 HB3 TYR 73 -5.708 5.784 9.107 1331 HD1 TYR 73 HD1 TYR 73 -4.297 5.427 7.176 1332 HD2 TYR 73 HD2 TYR 73 -8.221 3.652 7.429 1333 HE1 TYR 73 HE1 TYR 73 -4.261 5.014 4.748 1334 HE2 TYR 73 HE2 TYR 73 -8.245 3.389 4.961 1335 HH TYR 73 HH TYR 73 -5.671 4.674 2.898 1336 H ILE 74 H ILE 74 -3.381 4.113 9.318 1337 HA ILE 74 HA ILE 74 -2.999 1.878 7.598 1338 HB ILE 74 HB ILE 74 -0.927 3.286 9.310 1339 1HG1 ILE 74 HG12 ILE 74 -2.164 4.774 7.661 1340 2HG1 ILE 74 HG13 ILE 74 -0.425 4.712 7.538 1341 1HG2 ILE 74 HG21 ILE 74 -0.678 1.284 7.045 1342 2HG2 ILE 74 HG22 ILE 74 0.639 2.380 7.479 1343 3HG2 ILE 74 HG23 ILE 74 0.033 1.232 8.672 1344 1HD1 ILE 74 HD11 ILE 74 -0.571 3.205 5.579 1345 2HD1 ILE 74 HD12 ILE 74 -2.351 3.227 5.724 1346 3HD1 ILE 74 HD13 ILE 74 -1.454 4.700 5.319 1347 H THR 75 H THR 75 -2.388 2.175 11.114 1348 HA THR 75 HA THR 75 -1.412 -0.394 11.660 1349 HB THR 75 HB THR 75 -3.324 1.198 13.430 1350 HG1 THR 75 HG1 THR 75 -1.491 2.428 12.716 1351 1HG2 THR 75 HG21 THR 75 -1.192 -0.855 14.110 1352 2HG2 THR 75 HG22 THR 75 -2.068 0.151 15.275 1353 3HG2 THR 75 HG23 THR 75 -2.948 -1.044 14.309 1354 H PHE 76 H PHE 76 -4.820 0.721 11.528 1355 HA PHE 76 HA PHE 76 -5.979 -1.820 12.081 1356 1HB PHE 76 HB2 PHE 76 -7.198 0.313 12.288 1357 2HB PHE 76 HB3 PHE 76 -7.154 0.506 10.535 1358 HD1 PHE 76 HD1 PHE 76 -8.492 -1.013 9.050 1359 HD2 PHE 76 HD2 PHE 76 -8.593 -1.438 13.348 1360 HE1 PHE 76 HE1 PHE 76 -10.389 -2.554 8.850 1361 HE2 PHE 76 HE2 PHE 76 -10.403 -3.122 13.117 1362 HZ PHE 76 HZ PHE 76 -11.294 -3.696 10.865 1363 H LEU 77 H LEU 77 -5.183 -0.206 8.911 1364 HA LEU 77 HA LEU 77 -6.145 -2.421 7.360 1365 1HB LEU 77 HB2 LEU 77 -4.053 -0.303 6.789 1366 2HB LEU 77 HB3 LEU 77 -4.448 -1.575 5.629 1367 HG LEU 77 HG LEU 77 -6.522 0.348 6.780 1368 1HD1 LEU 77 HD11 LEU 77 -5.046 0.376 4.115 1369 2HD1 LEU 77 HD12 LEU 77 -6.441 1.386 4.521 1370 3HD1 LEU 77 HD13 LEU 77 -4.920 1.587 5.418 1371 1HD2 LEU 77 HD21 LEU 77 -7.850 -0.431 4.781 1372 2HD2 LEU 77 HD22 LEU 77 -6.610 -1.663 4.476 1373 3HD2 LEU 77 HD23 LEU 77 -7.597 -1.712 5.956 1374 H GLY 78 H GLY 78 -3.067 -1.925 9.062 1375 1HA GLY 78 HA2 GLY 78 -1.778 -4.327 8.265 1376 2HA GLY 78 HA3 GLY 78 -1.609 -3.529 9.840 1377 H ALA 79 H ALA 79 -4.115 -3.743 10.946 1378 HA ALA 79 HA ALA 79 -4.334 -6.392 11.875 1379 1HB ALA 79 HB1 ALA 79 -5.357 -4.372 12.972 1380 2HB ALA 79 HB2 ALA 79 -6.392 -5.807 12.880 1381 3HB ALA 79 HB3 ALA 79 -6.671 -4.456 11.785 1382 H LEU 80 H LEU 80 -6.241 -4.717 9.360 1383 HA LEU 80 HA LEU 80 -7.897 -6.842 8.607 1384 1HB LEU 80 HB2 LEU 80 -7.813 -4.254 7.912 1385 2HB LEU 80 HB3 LEU 80 -6.864 -4.864 6.566 1386 HG LEU 80 HG LEU 80 -8.785 -6.438 6.043 1387 1HD1 LEU 80 HD11 LEU 80 -10.000 -6.501 8.185 1388 2HD1 LEU 80 HD12 LEU 80 -10.185 -4.737 8.159 1389 3HD1 LEU 80 HD13 LEU 80 -11.032 -5.746 6.972 1390 1HD2 LEU 80 HD21 LEU 80 -10.153 -4.656 5.010 1391 2HD2 LEU 80 HD22 LEU 80 -9.424 -3.454 6.093 1392 3HD2 LEU 80 HD23 LEU 80 -8.429 -4.271 4.861 1393 H ALA 81 H ALA 81 -4.678 -5.916 7.392 1394 HA ALA 81 HA ALA 81 -4.453 -7.890 5.368 1395 1HB ALA 81 HB1 ALA 81 -2.998 -6.010 5.360 1396 2HB ALA 81 HB2 ALA 81 -2.357 -6.394 6.961 1397 3HB ALA 81 HB3 ALA 81 -2.012 -7.472 5.593 1398 H MET 82 H MET 82 -3.425 -8.016 8.865 1399 HA MET 82 HA MET 82 -2.571 -10.776 8.517 1400 1HB MET 82 HB2 MET 82 -2.307 -10.939 10.885 1401 2HB MET 82 HB3 MET 82 -1.531 -9.485 10.247 1402 1HG MET 82 HG2 MET 82 -3.394 -8.130 10.992 1403 2HG MET 82 HG3 MET 82 -4.218 -9.534 11.684 1404 1HE MET 82 HE1 MET 82 -1.674 -11.052 13.097 1405 2HE MET 82 HE2 MET 82 -3.298 -10.841 13.802 1406 3HE MET 82 HE3 MET 82 -1.853 -10.351 14.718 1407 H ILE 83 H ILE 83 -5.699 -9.349 9.413 1408 HA ILE 83 HA ILE 83 -6.977 -11.846 10.015 1409 HB ILE 83 HB ILE 83 -8.025 -9.247 8.858 1410 1HG1 ILE 83 HG12 ILE 83 -8.550 -10.610 11.535 1411 2HG1 ILE 83 HG13 ILE 83 -7.217 -9.483 11.295 1412 1HG2 ILE 83 HG21 ILE 83 -10.313 -10.162 9.233 1413 2HG2 ILE 83 HG22 ILE 83 -9.604 -11.752 9.580 1414 3HG2 ILE 83 HG23 ILE 83 -9.462 -11.027 7.963 1415 1HD1 ILE 83 HD11 ILE 83 -8.820 -7.704 10.627 1416 2HD1 ILE 83 HD12 ILE 83 -9.063 -8.297 12.278 1417 3HD1 ILE 83 HD13 ILE 83 -10.168 -8.805 10.995 1418 H TYR 84 H TYR 84 -6.327 -10.167 6.898 1419 HA TYR 84 HA TYR 84 -7.078 -12.490 5.295 1420 1HB TYR 84 HB2 TYR 84 -5.333 -10.147 4.503 1421 2HB TYR 84 HB3 TYR 84 -6.174 -11.263 3.437 1422 HD1 TYR 84 HD1 TYR 84 -6.216 -8.188 3.446 1423 HD2 TYR 84 HD2 TYR 84 -8.906 -11.151 5.068 1424 HE1 TYR 84 HE1 TYR 84 -8.127 -6.642 3.132 1425 HE2 TYR 84 HE2 TYR 84 -10.789 -9.598 4.782 1426 HH TYR 84 HH TYR 84 -11.467 -7.526 4.039 1427 H ASN 85 H ASN 85 -5.527 -13.434 7.287 1428 HA ASN 85 HA ASN 85 -2.896 -13.974 7.079 1429 1HB ASN 85 HB2 ASN 85 -3.384 -16.147 8.007 1430 2HB ASN 85 HB3 ASN 85 -4.470 -14.953 8.722 1431 1HD2 ASN 85 HD22 ASN 85 -6.798 -14.835 7.707 1432 2HD2 ASN 85 HD21 ASN 85 -7.415 -16.366 7.125 1433 H GLU 86 H GLU 86 -5.416 -15.292 4.915 1434 HA GLU 86 HA GLU 86 -3.862 -17.090 3.413 1435 1HB GLU 86 HB2 GLU 86 -6.164 -15.296 2.512 1436 2HB GLU 86 HB3 GLU 86 -5.530 -16.687 1.619 1437 1HG GLU 86 HG2 GLU 86 -6.119 -18.194 3.490 1438 2HG GLU 86 HG3 GLU 86 -6.766 -16.833 4.415 1439 H ALA 87 H ALA 87 -4.218 -13.536 3.062 1440 HA ALA 87 HA ALA 87 -2.642 -13.346 0.627 1441 1HB ALA 87 HB1 ALA 87 -4.317 -11.629 1.290 1442 2HB ALA 87 HB2 ALA 87 -3.301 -11.199 2.685 1443 3HB ALA 87 HB3 ALA 87 -2.691 -10.963 1.040 1444 H LEU 88 H LEU 88 -2.027 -13.048 4.158 1445 HA LEU 88 HA LEU 88 0.704 -12.244 3.899 1446 1HB LEU 88 HB2 LEU 88 -0.447 -13.937 6.146 1447 2HB LEU 88 HB3 LEU 88 1.078 -13.063 6.093 1448 HG LEU 88 HG LEU 88 -1.699 -11.993 6.479 1449 1HD1 LEU 88 HD11 LEU 88 -0.425 -10.753 8.289 1450 2HD1 LEU 88 HD12 LEU 88 -0.281 -12.519 8.422 1451 3HD1 LEU 88 HD13 LEU 88 1.051 -11.544 7.760 1452 1HD2 LEU 88 HD21 LEU 88 -0.905 -10.576 4.654 1453 2HD2 LEU 88 HD22 LEU 88 -0.907 -9.694 6.178 1454 3HD2 LEU 88 HD23 LEU 88 0.625 -10.285 5.520 1455 H LYS 89 H LYS 89 -0.684 -15.531 4.243 1456 HA LYS 89 HA LYS 89 1.888 -16.818 4.030 1457 1HB LYS 89 HB2 LYS 89 -0.932 -17.872 3.580 1458 2HB LYS 89 HB3 LYS 89 0.502 -18.889 3.664 1459 1HG LYS 89 HG2 LYS 89 -0.518 -17.084 5.912 1460 2HG LYS 89 HG3 LYS 89 -0.833 -18.809 5.792 1461 1HD LYS 89 HD2 LYS 89 1.966 -17.606 6.058 1462 2HD LYS 89 HD3 LYS 89 0.979 -18.168 7.403 1463 1HE LYS 89 HE2 LYS 89 0.985 -20.455 6.519 1464 2HE LYS 89 HE3 LYS 89 1.889 -19.933 5.086 1465 1HZ LYS 89 HZ1 LYS 89 2.857 -19.767 7.846 1466 2HZ LYS 89 HZ2 LYS 89 3.329 -20.865 6.711 1467 3HZ LYS 89 HZ3 LYS 89 3.677 -19.267 6.509 1468 H GLY 90 H GLY 90 -0.684 -16.109 1.639 1469 1HA GLY 90 HA2 GLY 90 -0.616 -16.032 -0.640 1470 2HA GLY 90 HA3 GLY 90 1.146 -15.868 -0.533 Start of MODEL 13 1 1H MET 1 H1 MET 1 -15.524 -0.872 -5.451 2 2H MET 1 H2 MET 1 -14.202 -0.779 -4.478 3 3H MET 1 H3 MET 1 -15.142 -2.126 -4.446 4 HA MET 1 HA MET 1 -14.547 -2.545 -6.781 5 1HB MET 1 HB2 MET 1 -12.413 -0.456 -6.152 6 2HB MET 1 HB3 MET 1 -12.539 -1.442 -7.620 7 1HG MET 1 HG2 MET 1 -14.720 -0.335 -8.134 8 2HG MET 1 HG3 MET 1 -14.552 0.641 -6.668 9 1HE MET 1 HE1 MET 1 -11.913 1.188 -10.413 10 2HE MET 1 HE2 MET 1 -11.699 -0.225 -9.361 11 3HE MET 1 HE3 MET 1 -13.214 -0.017 -10.281 12 H ALA 2 H ALA 2 -12.564 -1.719 -3.994 13 HA ALA 2 HA ALA 2 -11.354 -2.887 -2.524 14 1HB ALA 2 HB1 ALA 2 -12.051 -5.477 -3.962 15 2HB ALA 2 HB2 ALA 2 -11.458 -5.257 -2.308 16 3HB ALA 2 HB3 ALA 2 -13.078 -4.692 -2.742 17 H SER 3 H SER 3 -10.905 -4.347 -5.748 18 HA SER 3 HA SER 3 -8.363 -5.152 -5.641 19 1HB SER 3 HB2 SER 3 -9.352 -3.777 -8.143 20 2HB SER 3 HB3 SER 3 -8.286 -5.174 -7.961 21 HG SER 3 HG SER 3 -10.504 -5.742 -8.424 22 HA PRO 4 HA PRO 4 -6.540 -0.851 -6.906 23 1HB PRO 4 HB2 PRO 4 -8.467 0.964 -5.442 24 2HB PRO 4 HB3 PRO 4 -7.557 1.287 -6.945 25 1HG PRO 4 HG2 PRO 4 -10.185 0.648 -7.079 26 2HG PRO 4 HG3 PRO 4 -9.039 -0.145 -8.206 27 1HD PRO 4 HD2 PRO 4 -10.086 -1.200 -5.569 28 2HD PRO 4 HD3 PRO 4 -10.100 -2.008 -7.155 29 H LEU 5 H LEU 5 -8.134 -1.310 -3.718 30 HA LEU 5 HA LEU 5 -5.802 -0.139 -2.343 31 1HB LEU 5 HB2 LEU 5 -8.012 0.271 -1.386 32 2HB LEU 5 HB3 LEU 5 -8.305 -1.472 -1.255 33 HG LEU 5 HG LEU 5 -6.422 -1.697 0.340 34 1HD1 LEU 5 HD11 LEU 5 -5.406 0.337 1.314 35 2HD1 LEU 5 HD12 LEU 5 -4.918 0.127 -0.362 36 3HD1 LEU 5 HD13 LEU 5 -6.157 1.338 0.056 37 1HD2 LEU 5 HD21 LEU 5 -7.393 -0.486 2.211 38 2HD2 LEU 5 HD22 LEU 5 -8.334 0.533 1.099 39 3HD2 LEU 5 HD23 LEU 5 -8.661 -1.222 1.210 40 H ASP 6 H ASP 6 -7.429 -3.269 -2.852 41 HA ASP 6 HA ASP 6 -5.882 -4.939 -1.276 42 1HB ASP 6 HB2 ASP 6 -6.965 -5.616 -4.026 43 2HB ASP 6 HB3 ASP 6 -6.444 -6.769 -2.800 44 H GLN 7 H GLN 7 -5.160 -3.908 -4.669 45 HA GLN 7 HA GLN 7 -2.762 -5.418 -4.854 46 1HB GLN 7 HB2 GLN 7 -2.200 -4.064 -6.767 47 2HB GLN 7 HB3 GLN 7 -3.901 -4.515 -6.768 48 1HG GLN 7 HG2 GLN 7 -3.997 -2.299 -7.436 49 2HG GLN 7 HG3 GLN 7 -4.367 -2.212 -5.716 50 1HE2 GLN 7 HE22 GLN 7 -3.726 -0.039 -5.506 51 2HE2 GLN 7 HE21 GLN 7 -2.048 0.471 -5.694 52 H ALA 8 H ALA 8 -3.354 -2.240 -3.335 53 HA ALA 8 HA ALA 8 -0.535 -1.554 -3.196 54 1HB ALA 8 HB1 ALA 8 -1.322 0.211 -1.638 55 2HB ALA 8 HB2 ALA 8 -2.078 0.225 -3.238 56 3HB ALA 8 HB3 ALA 8 -2.982 -0.383 -1.830 57 H ILE 9 H ILE 9 -2.997 -2.674 -0.763 58 HA ILE 9 HA ILE 9 -0.997 -3.023 1.292 59 HB ILE 9 HB ILE 9 -2.595 -4.400 2.487 60 1HG1 ILE 9 HG12 ILE 9 -4.436 -4.095 0.109 61 2HG1 ILE 9 HG13 ILE 9 -3.664 -5.610 0.621 62 1HG2 ILE 9 HG21 ILE 9 -3.915 -1.934 1.300 63 2HG2 ILE 9 HG22 ILE 9 -4.174 -2.625 2.916 64 3HG2 ILE 9 HG23 ILE 9 -2.619 -1.903 2.515 65 1HD1 ILE 9 HD11 ILE 9 -5.910 -5.637 1.445 66 2HD1 ILE 9 HD12 ILE 9 -4.841 -5.406 2.841 67 3HD1 ILE 9 HD13 ILE 9 -5.757 -4.036 2.174 68 H GLY 10 H GLY 10 -2.266 -5.164 -1.229 69 1HA GLY 10 HA2 GLY 10 -0.852 -7.515 -0.921 70 2HA GLY 10 HA3 GLY 10 -1.250 -6.747 -2.463 71 H LEU 11 H LEU 11 0.325 -4.431 -2.413 72 HA LEU 11 HA LEU 11 2.853 -5.375 -3.166 73 1HB LEU 11 HB2 LEU 11 1.626 -3.120 -3.671 74 2HB LEU 11 HB3 LEU 11 2.340 -2.555 -2.167 75 HG LEU 11 HG LEU 11 3.669 -1.774 -3.936 76 1HD1 LEU 11 HD11 LEU 11 5.830 -2.503 -3.435 77 2HD1 LEU 11 HD12 LEU 11 4.892 -2.617 -1.934 78 3HD1 LEU 11 HD13 LEU 11 5.277 -4.087 -2.876 79 1HD2 LEU 11 HD21 LEU 11 2.910 -3.310 -5.675 80 2HD2 LEU 11 HD22 LEU 11 4.673 -3.132 -5.663 81 3HD2 LEU 11 HD23 LEU 11 3.935 -4.603 -5.004 82 H LEU 12 H LEU 12 2.046 -3.503 -0.191 83 HA LEU 12 HA LEU 12 4.550 -3.727 1.120 84 1HB LEU 12 HB2 LEU 12 1.666 -3.621 2.189 85 2HB LEU 12 HB3 LEU 12 3.073 -3.660 3.246 86 HG LEU 12 HG LEU 12 3.921 -1.591 2.279 87 1HD1 LEU 12 HD11 LEU 12 1.226 -1.436 0.859 88 2HD1 LEU 12 HD12 LEU 12 2.814 -1.545 0.055 89 3HD1 LEU 12 HD13 LEU 12 2.388 -0.108 0.981 90 1HD2 LEU 12 HD21 LEU 12 2.633 -1.518 4.333 91 2HD2 LEU 12 HD22 LEU 12 2.236 -0.103 3.362 92 3HD2 LEU 12 HD23 LEU 12 1.106 -1.470 3.424 93 H ILE 13 H ILE 13 1.768 -5.945 1.195 94 HA ILE 13 HA ILE 13 2.916 -7.791 3.045 95 HB ILE 13 HB ILE 13 0.795 -8.089 0.882 96 1HG1 ILE 13 HG12 ILE 13 0.391 -8.023 3.896 97 2HG1 ILE 13 HG13 ILE 13 0.484 -6.525 2.978 98 1HG2 ILE 13 HG21 ILE 13 0.091 -10.134 2.172 99 2HG2 ILE 13 HG22 ILE 13 1.628 -10.329 1.329 100 3HG2 ILE 13 HG23 ILE 13 1.617 -10.022 3.080 101 1HD1 ILE 13 HD11 ILE 13 -1.794 -6.921 3.048 102 2HD1 ILE 13 HD12 ILE 13 -1.368 -7.544 1.458 103 3HD1 ILE 13 HD13 ILE 13 -1.626 -8.674 2.806 104 H GLY 14 H GLY 14 2.876 -7.746 -0.539 105 1HA GLY 14 HA2 GLY 14 4.239 -10.164 -1.003 106 2HA GLY 14 HA3 GLY 14 4.184 -8.765 -2.094 107 H ILE 15 H ILE 15 5.511 -6.786 -0.821 108 HA ILE 15 HA ILE 15 8.261 -7.382 -1.120 109 HB ILE 15 HB ILE 15 6.668 -5.123 0.046 110 1HG1 ILE 15 HG12 ILE 15 8.988 -5.333 -1.931 111 2HG1 ILE 15 HG13 ILE 15 7.269 -5.350 -2.363 112 1HG2 ILE 15 HG21 ILE 15 8.346 -5.328 1.767 113 2HG2 ILE 15 HG22 ILE 15 9.651 -5.442 0.560 114 3HG2 ILE 15 HG23 ILE 15 8.725 -3.939 0.778 115 1HD1 ILE 15 HD11 ILE 15 8.898 -3.030 -1.254 116 2HD1 ILE 15 HD12 ILE 15 8.027 -3.132 -2.785 117 3HD1 ILE 15 HD13 ILE 15 7.123 -3.026 -1.262 118 H PHE 16 H PHE 16 6.313 -7.115 1.885 119 HA PHE 16 HA PHE 16 8.333 -7.818 3.687 120 1HB PHE 16 HB2 PHE 16 6.036 -6.950 4.165 121 2HB PHE 16 HB3 PHE 16 5.376 -8.540 3.850 122 HD1 PHE 16 HD1 PHE 16 5.782 -10.413 5.420 123 HD2 PHE 16 HD2 PHE 16 7.465 -6.516 6.139 124 HE1 PHE 16 HE1 PHE 16 6.064 -10.964 7.784 125 HE2 PHE 16 HE2 PHE 16 7.614 -7.027 8.564 126 HZ PHE 16 HZ PHE 16 6.831 -9.199 9.404 127 H HIS 17 H HIS 17 5.955 -10.020 2.134 128 HA HIS 17 HA HIS 17 6.988 -12.286 3.475 129 1HB HIS 17 HB2 HIS 17 4.733 -11.766 1.678 130 2HB HIS 17 HB3 HIS 17 5.498 -13.313 1.352 131 HD1 HIS 17 HD1 HIS 17 5.306 -15.214 3.196 132 HD2 HIS 17 HD2 HIS 17 3.791 -11.437 4.302 133 HE1 HIS 17 HE1 HIS 17 4.177 -15.515 5.439 134 H LYS 18 H LYS 18 8.153 -10.836 0.502 135 HA LYS 18 HA LYS 18 9.541 -13.183 -0.456 136 1HB LYS 18 HB2 LYS 18 10.326 -10.240 -0.446 137 2HB LYS 18 HB3 LYS 18 11.248 -11.504 -1.272 138 1HG LYS 18 HG2 LYS 18 9.400 -12.017 -2.747 139 2HG LYS 18 HG3 LYS 18 8.313 -10.969 -1.833 140 1HD LYS 18 HD2 LYS 18 9.802 -8.998 -2.410 141 2HD LYS 18 HD3 LYS 18 10.774 -10.087 -3.410 142 1HE LYS 18 HE2 LYS 18 9.223 -8.890 -4.842 143 2HE LYS 18 HE3 LYS 18 8.730 -10.591 -4.787 144 1HZ LYS 18 HZ1 LYS 18 7.552 -8.398 -3.219 145 2HZ LYS 18 HZ2 LYS 18 6.880 -9.104 -4.549 146 3HZ LYS 18 HZ3 LYS 18 7.073 -9.972 -3.161 147 H TYR 19 H TYR 19 10.393 -10.673 1.943 148 HA TYR 19 HA TYR 19 12.943 -11.932 2.555 149 1HB TYR 19 HB2 TYR 19 11.496 -9.517 3.662 150 2HB TYR 19 HB3 TYR 19 13.079 -10.045 4.218 151 HD1 TYR 19 HD1 TYR 19 11.270 -8.491 1.454 152 HD2 TYR 19 HD2 TYR 19 15.090 -9.894 2.815 153 HE1 TYR 19 HE1 TYR 19 12.282 -7.727 -0.666 154 HE2 TYR 19 HE2 TYR 19 16.149 -8.942 0.789 155 HH TYR 19 HH TYR 19 14.238 -7.508 -1.881 156 H SER 20 H SER 20 9.748 -11.679 4.283 157 HA SER 20 HA SER 20 10.641 -13.330 6.455 158 1HB SER 20 HB2 SER 20 7.815 -13.174 5.359 159 2HB SER 20 HB3 SER 20 8.363 -13.769 6.935 160 HG SER 20 HG SER 20 9.012 -11.761 7.509 161 H GLY 21 H GLY 21 9.374 -14.085 3.208 162 1HA GLY 21 HA2 GLY 21 9.129 -16.839 3.111 163 2HA GLY 21 HA3 GLY 21 9.818 -15.820 1.851 164 H LYS 22 H LYS 22 12.092 -14.944 2.503 165 HA LYS 22 HA LYS 22 13.960 -16.932 2.332 166 1HB LYS 22 HB2 LYS 22 14.210 -14.420 2.079 167 2HB LYS 22 HB3 LYS 22 14.491 -14.339 3.829 168 1HG LYS 22 HG2 LYS 22 16.356 -15.984 3.567 169 2HG LYS 22 HG3 LYS 22 16.144 -15.897 1.805 170 1HD LYS 22 HD2 LYS 22 16.990 -13.688 3.720 171 2HD LYS 22 HD3 LYS 22 17.970 -14.444 2.464 172 1HE LYS 22 HE2 LYS 22 16.460 -13.459 0.719 173 2HE LYS 22 HE3 LYS 22 15.528 -12.653 2.003 174 1HZ LYS 22 HZ1 LYS 22 18.362 -12.197 1.481 175 2HZ LYS 22 HZ2 LYS 22 17.116 -11.201 1.063 176 3HZ LYS 22 HZ3 LYS 22 17.443 -11.484 2.654 177 H GLU 23 H GLU 23 12.847 -15.446 5.420 178 HA GLU 23 HA GLU 23 14.373 -17.501 6.945 179 1HB GLU 23 HB2 GLU 23 13.696 -16.216 8.941 180 2HB GLU 23 HB3 GLU 23 14.714 -15.335 7.798 181 1HG GLU 23 HG2 GLU 23 12.908 -14.031 6.991 182 2HG GLU 23 HG3 GLU 23 11.697 -15.061 7.788 183 H GLY 24 H GLY 24 12.127 -18.378 5.283 184 1HA GLY 24 HA2 GLY 24 10.899 -20.279 5.573 185 2HA GLY 24 HA3 GLY 24 11.079 -20.175 7.324 186 H ASP 25 H ASP 25 9.790 -17.778 5.054 187 HA ASP 25 HA ASP 25 7.783 -16.733 4.828 188 1HB ASP 25 HB2 ASP 25 7.533 -18.966 3.657 189 2HB ASP 25 HB3 ASP 25 6.648 -19.541 5.080 190 H LYS 26 H LYS 26 8.554 -16.298 7.339 191 HA LYS 26 HA LYS 26 6.350 -16.818 9.196 192 1HB LYS 26 HB2 LYS 26 8.645 -14.816 9.364 193 2HB LYS 26 HB3 LYS 26 7.628 -15.359 10.704 194 1HG LYS 26 HG2 LYS 26 9.605 -17.055 9.124 195 2HG LYS 26 HG3 LYS 26 9.821 -16.428 10.755 196 1HD LYS 26 HD2 LYS 26 7.811 -17.760 11.500 197 2HD LYS 26 HD3 LYS 26 7.721 -18.475 9.876 198 1HE LYS 26 HE2 LYS 26 10.110 -18.708 11.758 199 2HE LYS 26 HE3 LYS 26 8.880 -19.952 11.468 200 1HZ LYS 26 HZ1 LYS 26 9.517 -19.900 9.134 201 2HZ LYS 26 HZ2 LYS 26 10.750 -18.867 9.482 202 3HZ LYS 26 HZ3 LYS 26 10.749 -20.383 10.127 203 H HIS 27 H HIS 27 5.512 -14.776 10.344 204 HA HIS 27 HA HIS 27 4.653 -12.671 8.376 205 1HB HIS 27 HB2 HIS 27 3.294 -13.556 10.942 206 2HB HIS 27 HB3 HIS 27 2.737 -12.295 9.830 207 HD1 HIS 27 HD1 HIS 27 3.221 -13.953 7.073 208 HD2 HIS 27 HD2 HIS 27 1.329 -15.312 10.595 209 HE1 HIS 27 HE1 HIS 27 1.742 -15.898 6.409 210 H THR 28 H THR 28 7.235 -12.723 9.446 211 HA THR 28 HA THR 28 7.457 -10.336 11.054 212 HB THR 28 HB THR 28 8.069 -13.084 12.185 213 HG1 THR 28 HG1 THR 28 5.981 -11.741 12.422 214 1HG2 THR 28 HG21 THR 28 10.022 -11.695 12.690 215 2HG2 THR 28 HG22 THR 28 8.970 -10.374 13.252 216 3HG2 THR 28 HG23 THR 28 9.024 -11.912 14.135 217 H LEU 29 H LEU 29 9.650 -9.591 10.943 218 HA LEU 29 HA LEU 29 11.546 -11.157 9.235 219 1HB LEU 29 HB2 LEU 29 11.187 -8.142 9.457 220 2HB LEU 29 HB3 LEU 29 12.468 -8.936 8.554 221 HG LEU 29 HG LEU 29 9.513 -9.309 7.901 222 1HD1 LEU 29 HD11 LEU 29 9.851 -7.577 6.162 223 2HD1 LEU 29 HD12 LEU 29 10.050 -6.894 7.787 224 3HD1 LEU 29 HD13 LEU 29 11.475 -7.254 6.792 225 1HD2 LEU 29 HD21 LEU 29 11.141 -10.948 6.934 226 2HD2 LEU 29 HD22 LEU 29 10.378 -9.904 5.708 227 3HD2 LEU 29 HD23 LEU 29 12.044 -9.582 6.238 228 H SER 30 H SER 30 13.583 -11.405 10.319 229 HA SER 30 HA SER 30 13.849 -10.193 12.995 230 1HB SER 30 HB2 SER 30 15.826 -11.724 11.254 231 2HB SER 30 HB3 SER 30 16.104 -11.206 12.933 232 HG SER 30 HG SER 30 14.285 -12.442 13.548 233 H LYS 31 H LYS 31 15.344 -8.495 13.488 234 HA LYS 31 HA LYS 31 15.030 -6.292 11.993 235 1HB LYS 31 HB2 LYS 31 16.707 -5.226 13.354 236 2HB LYS 31 HB3 LYS 31 15.690 -6.299 14.302 237 1HG LYS 31 HG2 LYS 31 17.467 -8.014 14.348 238 2HG LYS 31 HG3 LYS 31 18.518 -6.953 13.375 239 1HD LYS 31 HD2 LYS 31 18.514 -5.253 15.138 240 2HD LYS 31 HD3 LYS 31 17.364 -6.187 16.088 241 1HE LYS 31 HE2 LYS 31 19.600 -6.500 16.990 242 2HE LYS 31 HE3 LYS 31 19.011 -8.031 16.325 243 1HZ LYS 31 HZ1 LYS 31 20.843 -6.170 14.975 244 2HZ LYS 31 HZ2 LYS 31 21.274 -7.577 15.718 245 3HZ LYS 31 HZ3 LYS 31 20.323 -7.615 14.375 246 H LYS 32 H LYS 32 17.809 -8.439 11.651 247 HA LYS 32 HA LYS 32 19.123 -6.698 9.698 248 1HB LYS 32 HB2 LYS 32 20.434 -8.044 11.145 249 2HB LYS 32 HB3 LYS 32 19.716 -9.552 10.518 250 1HG LYS 32 HG2 LYS 32 20.664 -9.034 8.265 251 2HG LYS 32 HG3 LYS 32 21.378 -7.549 8.903 252 1HD LYS 32 HD2 LYS 32 22.015 -10.390 9.849 253 2HD LYS 32 HD3 LYS 32 22.968 -9.458 8.685 254 1HE LYS 32 HE2 LYS 32 23.346 -7.699 10.445 255 2HE LYS 32 HE3 LYS 32 22.527 -8.746 11.622 256 1HZ LYS 32 HZ1 LYS 32 24.944 -9.437 10.119 257 2HZ LYS 32 HZ2 LYS 32 24.874 -9.004 11.707 258 3HZ LYS 32 HZ3 LYS 32 24.176 -10.409 11.206 259 H GLU 33 H GLU 33 16.746 -9.313 9.514 260 HA GLU 33 HA GLU 33 17.067 -9.804 6.664 261 1HB GLU 33 HB2 GLU 33 15.966 -11.436 8.259 262 2HB GLU 33 HB3 GLU 33 14.645 -10.274 8.463 263 1HG GLU 33 HG2 GLU 33 13.889 -11.830 6.841 264 2HG GLU 33 HG3 GLU 33 14.286 -10.359 5.965 265 H LEU 34 H LEU 34 15.007 -7.799 8.800 266 HA LEU 34 HA LEU 34 13.636 -6.382 6.749 267 1HB LEU 34 HB2 LEU 34 12.869 -6.183 8.984 268 2HB LEU 34 HB3 LEU 34 14.424 -5.646 9.588 269 HG LEU 34 HG LEU 34 12.733 -3.882 9.510 270 1HD1 LEU 34 HD11 LEU 34 15.308 -3.495 9.174 271 2HD1 LEU 34 HD12 LEU 34 14.827 -2.953 7.565 272 3HD1 LEU 34 HD13 LEU 34 14.171 -2.160 8.987 273 1HD2 LEU 34 HD21 LEU 34 11.472 -4.568 7.545 274 2HD2 LEU 34 HD22 LEU 34 12.008 -2.890 7.359 275 3HD2 LEU 34 HD23 LEU 34 12.831 -4.173 6.481 276 H LYS 35 H LYS 35 16.790 -5.602 8.389 277 HA LYS 35 HA LYS 35 17.282 -3.345 6.826 278 1HB LYS 35 HB2 LYS 35 18.686 -4.176 8.774 279 2HB LYS 35 HB3 LYS 35 19.513 -5.252 7.620 280 1HG LYS 35 HG2 LYS 35 20.002 -3.235 6.188 281 2HG LYS 35 HG3 LYS 35 19.214 -2.226 7.411 282 1HD LYS 35 HD2 LYS 35 20.960 -2.988 9.064 283 2HD LYS 35 HD3 LYS 35 21.754 -3.870 7.737 284 1HE LYS 35 HE2 LYS 35 21.834 -1.676 6.439 285 2HE LYS 35 HE3 LYS 35 21.204 -0.858 7.876 286 1HZ LYS 35 HZ1 LYS 35 23.173 -1.659 9.046 287 2HZ LYS 35 HZ2 LYS 35 23.727 -2.375 7.669 288 3HZ LYS 35 HZ3 LYS 35 23.584 -0.738 7.745 289 H GLU 36 H GLU 36 17.946 -6.776 5.971 290 HA GLU 36 HA GLU 36 19.124 -6.249 3.470 291 1HB GLU 36 HB2 GLU 36 18.922 -8.477 4.760 292 2HB GLU 36 HB3 GLU 36 17.325 -8.644 4.029 293 1HG GLU 36 HG2 GLU 36 18.990 -9.861 2.727 294 2HG GLU 36 HG3 GLU 36 18.339 -8.527 1.763 295 H LEU 37 H LEU 37 15.656 -6.811 4.247 296 HA LEU 37 HA LEU 37 14.535 -6.364 1.708 297 1HB LEU 37 HB2 LEU 37 13.214 -7.068 3.649 298 2HB LEU 37 HB3 LEU 37 13.488 -5.564 4.479 299 HG LEU 37 HG LEU 37 11.937 -5.662 1.884 300 1HD1 LEU 37 HD11 LEU 37 10.846 -7.106 3.611 301 2HD1 LEU 37 HD12 LEU 37 10.882 -5.738 4.752 302 3HD1 LEU 37 HD13 LEU 37 9.902 -5.648 3.282 303 1HD2 LEU 37 HD21 LEU 37 12.557 -3.348 2.458 304 2HD2 LEU 37 HD22 LEU 37 10.887 -3.578 2.930 305 3HD2 LEU 37 HD23 LEU 37 12.148 -3.623 4.169 306 H ILE 38 H ILE 38 15.352 -3.879 4.155 307 HA ILE 38 HA ILE 38 14.566 -1.727 2.439 308 HB ILE 38 HB ILE 38 16.461 -1.868 4.814 309 1HG1 ILE 38 HG12 ILE 38 13.562 -0.975 4.371 310 2HG1 ILE 38 HG13 ILE 38 14.111 -2.404 5.262 311 1HG2 ILE 38 HG21 ILE 38 16.407 0.550 4.929 312 2HG2 ILE 38 HG22 ILE 38 17.083 0.106 3.378 313 3HG2 ILE 38 HG23 ILE 38 15.397 0.657 3.485 314 1HD1 ILE 38 HD11 ILE 38 14.405 0.497 5.981 315 2HD1 ILE 38 HD12 ILE 38 13.549 -0.792 6.863 316 3HD1 ILE 38 HD13 ILE 38 15.334 -0.779 6.820 317 H GLN 39 H GLN 39 17.856 -3.053 3.044 318 HA GLN 39 HA GLN 39 19.181 -1.275 1.322 319 1HB GLN 39 HB2 GLN 39 19.801 -4.169 2.066 320 2HB GLN 39 HB3 GLN 39 20.938 -3.144 1.189 321 1HG GLN 39 HG2 GLN 39 19.817 -2.371 3.918 322 2HG GLN 39 HG3 GLN 39 21.271 -3.352 3.714 323 1HE2 GLN 39 HE22 GLN 39 20.393 -0.284 4.445 324 2HE2 GLN 39 HE21 GLN 39 21.802 0.537 3.776 325 H LYS 40 H LYS 40 17.509 -4.369 0.519 326 HA LYS 40 HA LYS 40 18.450 -4.165 -2.225 327 1HB LYS 40 HB2 LYS 40 18.012 -6.334 -1.086 328 2HB LYS 40 HB3 LYS 40 16.309 -5.915 -0.970 329 1HG LYS 40 HG2 LYS 40 16.797 -7.472 -2.839 330 2HG LYS 40 HG3 LYS 40 16.044 -5.976 -3.386 331 1HD LYS 40 HD2 LYS 40 17.829 -6.736 -4.890 332 2HD LYS 40 HD3 LYS 40 18.197 -5.145 -4.229 333 1HE LYS 40 HE2 LYS 40 19.762 -6.185 -2.584 334 2HE LYS 40 HE3 LYS 40 19.313 -7.797 -3.172 335 1HZ LYS 40 HZ1 LYS 40 20.216 -7.192 -5.297 336 2HZ LYS 40 HZ2 LYS 40 20.619 -5.692 -4.746 337 3HZ LYS 40 HZ3 LYS 40 21.351 -7.026 -4.114 338 H GLU 41 H GLU 41 15.250 -3.712 -0.630 339 HA GLU 41 HA GLU 41 14.016 -3.031 -3.180 340 1HB GLU 41 HB2 GLU 41 12.909 -2.730 -0.355 341 2HB GLU 41 HB3 GLU 41 11.996 -2.679 -1.865 342 1HG GLU 41 HG2 GLU 41 13.464 -5.107 -0.721 343 2HG GLU 41 HG3 GLU 41 11.723 -4.841 -0.754 344 H LEU 42 H LEU 42 14.914 -1.196 -0.224 345 HA LEU 42 HA LEU 42 14.170 1.372 -1.575 346 1HB LEU 42 HB2 LEU 42 14.995 0.909 1.306 347 2HB LEU 42 HB3 LEU 42 14.361 2.389 0.585 348 HG LEU 42 HG LEU 42 12.874 -0.215 1.147 349 1HD1 LEU 42 HD11 LEU 42 12.460 2.632 2.153 350 2HD1 LEU 42 HD12 LEU 42 11.497 1.209 2.599 351 3HD1 LEU 42 HD13 LEU 42 13.199 1.306 3.073 352 1HD2 LEU 42 HD21 LEU 42 11.857 2.254 -0.318 353 2HD2 LEU 42 HD22 LEU 42 12.042 0.614 -0.996 354 3HD2 LEU 42 HD23 LEU 42 10.851 0.913 0.265 355 H THR 43 H THR 43 15.986 0.578 -3.034 356 HA THR 43 HA THR 43 18.536 0.141 -2.137 357 HB THR 43 HB THR 43 18.043 1.197 -4.917 358 HG1 THR 43 HG1 THR 43 16.986 -1.259 -3.997 359 1HG2 THR 43 HG21 THR 43 20.228 0.154 -4.320 360 2HG2 THR 43 HG22 THR 43 19.376 -1.330 -3.834 361 3HG2 THR 43 HG23 THR 43 19.341 -0.797 -5.528 362 H ILE 44 H ILE 44 18.588 2.146 -0.591 363 HA ILE 44 HA ILE 44 19.693 4.576 -1.732 364 HB ILE 44 HB ILE 44 20.645 4.772 0.722 365 1HG1 ILE 44 HG12 ILE 44 19.233 3.860 2.424 366 2HG1 ILE 44 HG13 ILE 44 18.224 3.009 1.268 367 1HG2 ILE 44 HG21 ILE 44 18.532 5.870 1.335 368 2HG2 ILE 44 HG22 ILE 44 19.027 6.252 -0.317 369 3HG2 ILE 44 HG23 ILE 44 17.724 5.076 -0.032 370 1HD1 ILE 44 HD11 ILE 44 20.176 1.498 0.752 371 2HD1 ILE 44 HD12 ILE 44 21.131 2.392 1.961 372 3HD1 ILE 44 HD13 ILE 44 19.688 1.479 2.449 373 H GLY 45 H GLY 45 21.031 3.601 -3.295 374 1HA GLY 45 HA2 GLY 45 23.436 2.249 -2.993 375 2HA GLY 45 HA3 GLY 45 23.195 3.606 -4.106 376 H SER 46 H SER 46 22.656 5.539 -1.878 377 HA SER 46 HA SER 46 25.282 6.393 -1.089 378 1HB SER 46 HB2 SER 46 23.587 7.904 0.308 379 2HB SER 46 HB3 SER 46 23.699 8.077 -1.449 380 HG SER 46 HG SER 46 21.516 7.601 -0.224 381 H LYS 47 H LYS 47 25.623 4.005 -0.221 382 HA LYS 47 HA LYS 47 24.337 3.065 2.045 383 1HB LYS 47 HB2 LYS 47 27.033 2.509 0.827 384 2HB LYS 47 HB3 LYS 47 26.744 1.954 2.475 385 1HG LYS 47 HG2 LYS 47 26.159 0.139 1.094 386 2HG LYS 47 HG3 LYS 47 24.664 0.797 1.756 387 1HD LYS 47 HD2 LYS 47 24.398 2.086 -0.426 388 2HD LYS 47 HD3 LYS 47 25.800 1.209 -1.053 389 1HE LYS 47 HE2 LYS 47 23.835 0.096 -1.847 390 2HE LYS 47 HE3 LYS 47 24.475 -0.947 -0.565 391 1HZ LYS 47 HZ1 LYS 47 22.826 -0.113 0.893 392 2HZ LYS 47 HZ2 LYS 47 22.360 1.064 -0.174 393 3HZ LYS 47 HZ3 LYS 47 22.063 -0.531 -0.500 394 H LEU 48 H LEU 48 26.426 5.809 2.075 395 HA LEU 48 HA LEU 48 27.285 5.812 4.784 396 1HB LEU 48 HB2 LEU 48 26.163 8.126 3.149 397 2HB LEU 48 HB3 LEU 48 27.140 8.270 4.615 398 HG LEU 48 HG LEU 48 28.088 7.112 1.948 399 1HD1 LEU 48 HD11 LEU 48 28.758 9.723 3.362 400 2HD1 LEU 48 HD12 LEU 48 29.457 9.146 1.835 401 3HD1 LEU 48 HD13 LEU 48 27.734 9.555 1.920 402 1HD2 LEU 48 HD21 LEU 48 30.352 7.205 3.012 403 2HD2 LEU 48 HD22 LEU 48 29.583 7.577 4.569 404 3HD2 LEU 48 HD23 LEU 48 29.299 6.011 3.774 405 H GLN 49 H GLN 49 24.098 6.317 3.351 406 HA GLN 49 HA GLN 49 22.787 7.279 5.718 407 1HB GLN 49 HB2 GLN 49 21.681 5.887 3.243 408 2HB GLN 49 HB3 GLN 49 20.716 6.661 4.507 409 1HG GLN 49 HG2 GLN 49 21.966 8.823 4.059 410 2HG GLN 49 HG3 GLN 49 22.739 8.032 2.680 411 1HE2 GLN 49 HE22 GLN 49 19.499 8.712 4.094 412 2HE2 GLN 49 HE21 GLN 49 18.696 8.922 2.538 413 H ASP 50 H ASP 50 24.059 4.137 5.069 414 HA ASP 50 HA ASP 50 22.171 2.435 6.194 415 1HB ASP 50 HB2 ASP 50 25.207 2.375 6.360 416 2HB ASP 50 HB3 ASP 50 24.170 1.095 6.984 417 H ALA 51 H ALA 51 24.303 4.736 7.866 418 HA ALA 51 HA ALA 51 23.839 3.920 10.555 419 1HB ALA 51 HB1 ALA 51 24.177 6.719 9.392 420 2HB ALA 51 HB2 ALA 51 24.331 6.274 11.105 421 3HB ALA 51 HB3 ALA 51 25.481 5.631 9.914 422 H GLU 52 H GLU 52 21.903 6.015 8.380 423 HA GLU 52 HA GLU 52 19.869 6.692 10.325 424 1HB GLU 52 HB2 GLU 52 19.604 6.591 7.285 425 2HB GLU 52 HB3 GLU 52 18.594 7.468 8.430 426 1HG GLU 52 HG2 GLU 52 20.536 8.901 9.046 427 2HG GLU 52 HG3 GLU 52 21.540 8.059 7.855 428 H ILE 53 H ILE 53 20.272 4.265 7.721 429 HA ILE 53 HA ILE 53 17.789 2.981 8.068 430 HB ILE 53 HB ILE 53 20.364 1.645 7.198 431 1HG1 ILE 53 HG12 ILE 53 19.968 3.476 5.673 432 2HG1 ILE 53 HG13 ILE 53 19.445 1.994 4.890 433 1HG2 ILE 53 HG21 ILE 53 18.786 0.071 6.043 434 2HG2 ILE 53 HG22 ILE 53 18.775 -0.024 7.807 435 3HG2 ILE 53 HG23 ILE 53 17.462 0.808 6.974 436 1HD1 ILE 53 HD11 ILE 53 17.812 3.681 4.419 437 2HD1 ILE 53 HD12 ILE 53 17.056 2.592 5.590 438 3HD1 ILE 53 HD13 ILE 53 17.695 4.164 6.114 439 H VAL 54 H VAL 54 20.874 2.345 9.902 440 HA VAL 54 HA VAL 54 19.556 0.212 11.239 441 HB VAL 54 HB VAL 54 21.373 0.190 12.904 442 1HG1 VAL 54 HG11 VAL 54 22.841 -0.915 11.264 443 2HG1 VAL 54 HG12 VAL 54 21.143 -1.299 10.933 444 3HG1 VAL 54 HG13 VAL 54 21.978 -0.082 9.950 445 1HG2 VAL 54 HG21 VAL 54 22.745 2.098 11.031 446 2HG2 VAL 54 HG22 VAL 54 22.162 2.528 12.656 447 3HG2 VAL 54 HG23 VAL 54 23.429 1.303 12.449 448 H LYS 55 H LYS 55 19.676 3.680 12.038 449 HA LYS 55 HA LYS 55 18.394 3.273 14.605 450 1HB LYS 55 HB2 LYS 55 19.403 5.414 14.096 451 2HB LYS 55 HB3 LYS 55 18.347 5.642 12.703 452 1HG LYS 55 HG2 LYS 55 17.682 6.971 14.709 453 2HG LYS 55 HG3 LYS 55 16.409 5.945 14.059 454 1HD LYS 55 HD2 LYS 55 16.394 5.938 16.495 455 2HD LYS 55 HD3 LYS 55 16.692 4.323 15.881 456 1HE LYS 55 HE2 LYS 55 19.158 4.645 16.331 457 2HE LYS 55 HE3 LYS 55 18.783 6.238 17.010 458 1HZ LYS 55 HZ1 LYS 55 18.955 4.547 18.682 459 2HZ LYS 55 HZ2 LYS 55 17.417 5.135 18.636 460 3HZ LYS 55 HZ3 LYS 55 17.754 3.657 17.989 461 H LEU 56 H LEU 56 17.156 3.802 11.284 462 HA LEU 56 HA LEU 56 14.407 3.625 11.919 463 1HB LEU 56 HB2 LEU 56 15.024 4.520 9.891 464 2HB LEU 56 HB3 LEU 56 16.023 3.151 9.425 465 HG LEU 56 HG LEU 56 13.102 2.595 9.844 466 1HD1 LEU 56 HD11 LEU 56 14.212 4.032 7.390 467 2HD1 LEU 56 HD12 LEU 56 12.597 3.309 7.524 468 3HD1 LEU 56 HD13 LEU 56 13.031 4.697 8.541 469 1HD2 LEU 56 HD21 LEU 56 14.761 0.800 9.146 470 2HD2 LEU 56 HD22 LEU 56 13.498 1.137 7.957 471 3HD2 LEU 56 HD23 LEU 56 15.155 1.771 7.731 472 H MET 57 H MET 57 16.684 0.913 11.148 473 HA MET 57 HA MET 57 14.566 -1.022 11.277 474 1HB MET 57 HB2 MET 57 16.119 -2.744 11.083 475 2HB MET 57 HB3 MET 57 16.668 -1.416 10.041 476 1HG MET 57 HG2 MET 57 18.651 -2.065 11.034 477 2HG MET 57 HG3 MET 57 18.071 -0.824 12.158 478 1HE MET 57 HE1 MET 57 20.435 -2.642 12.954 479 2HE MET 57 HE2 MET 57 19.709 -1.417 14.030 480 3HE MET 57 HE3 MET 57 19.963 -3.076 14.614 481 H ASP 58 H ASP 58 16.868 0.296 13.687 482 HA ASP 58 HA ASP 58 16.106 -1.344 15.862 483 1HB ASP 58 HB2 ASP 58 17.980 0.155 16.042 484 2HB ASP 58 HB3 ASP 58 16.951 1.572 15.820 485 H ASP 59 H ASP 59 14.676 1.765 14.718 486 HA ASP 59 HA ASP 59 12.511 1.829 16.528 487 1HB ASP 59 HB2 ASP 59 12.521 2.815 13.640 488 2HB ASP 59 HB3 ASP 59 11.340 3.237 14.876 489 H LEU 60 H LEU 60 12.543 0.367 13.240 490 HA LEU 60 HA LEU 60 9.919 -0.699 13.321 491 1HB LEU 60 HB2 LEU 60 12.493 -1.435 11.911 492 2HB LEU 60 HB3 LEU 60 11.162 -2.570 11.811 493 HG LEU 60 HG LEU 60 10.612 0.294 11.134 494 1HD1 LEU 60 HD11 LEU 60 11.225 -0.092 8.773 495 2HD1 LEU 60 HD12 LEU 60 12.644 -0.188 9.840 496 3HD1 LEU 60 HD13 LEU 60 11.889 -1.668 9.207 497 1HD2 LEU 60 HD21 LEU 60 9.054 -0.809 9.501 498 2HD2 LEU 60 HD22 LEU 60 9.685 -2.388 9.945 499 3HD2 LEU 60 HD23 LEU 60 8.777 -1.441 11.147 500 H ASP 61 H ASP 61 12.958 -2.313 14.355 501 HA ASP 61 HA ASP 61 11.471 -4.679 15.050 502 1HB ASP 61 HB2 ASP 61 13.435 -5.720 15.450 503 2HB ASP 61 HB3 ASP 61 13.896 -4.536 14.234 504 H ARG 62 H ARG 62 12.472 -1.862 16.881 505 HA ARG 62 HA ARG 62 12.643 -2.799 19.439 506 1HB ARG 62 HB2 ARG 62 12.992 -0.456 18.718 507 2HB ARG 62 HB3 ARG 62 11.239 -0.223 18.602 508 1HG ARG 62 HG2 ARG 62 11.117 -0.773 21.091 509 2HG ARG 62 HG3 ARG 62 12.888 -0.864 21.096 510 1HD ARG 62 HD2 ARG 62 11.144 1.536 20.450 511 2HD ARG 62 HD3 ARG 62 12.163 1.333 21.872 512 HE ARG 62 HE ARG 62 14.146 1.297 20.370 513 1HH1 ARG 62 HH21 ARG 62 11.233 3.048 19.231 514 2HH1 ARG 62 HH22 ARG 62 12.146 3.907 18.013 515 1HH2 ARG 62 HH12 ARG 62 15.248 2.497 18.754 516 2HH2 ARG 62 HH11 ARG 62 14.332 3.609 17.757 517 H ASN 63 H ASN 63 9.678 -2.050 17.660 518 HA ASN 63 HA ASN 63 7.699 -2.255 19.551 519 1HB ASN 63 HB2 ASN 63 7.626 -3.461 16.754 520 2HB ASN 63 HB3 ASN 63 6.225 -3.112 17.783 521 1HD2 ASN 63 HD22 ASN 63 8.605 -1.719 15.601 522 2HD2 ASN 63 HD21 ASN 63 8.041 -0.069 15.745 523 H LYS 64 H LYS 64 9.493 -4.975 18.165 524 HA LYS 64 HA LYS 64 8.747 -6.565 20.501 525 1HB LYS 64 HB2 LYS 64 8.287 -7.688 17.708 526 2HB LYS 64 HB3 LYS 64 8.345 -8.611 19.218 527 1HG LYS 64 HG2 LYS 64 6.425 -7.203 20.077 528 2HG LYS 64 HG3 LYS 64 6.353 -6.419 18.503 529 1HD LYS 64 HD2 LYS 64 4.646 -8.135 18.634 530 2HD LYS 64 HD3 LYS 64 5.832 -8.523 17.385 531 1HE LYS 64 HE2 LYS 64 5.119 -10.504 18.719 532 2HE LYS 64 HE3 LYS 64 6.860 -10.232 18.795 533 1HZ LYS 64 HZ1 LYS 64 6.546 -9.197 20.923 534 2HZ LYS 64 HZ2 LYS 64 4.914 -9.414 20.843 535 3HZ LYS 64 HZ3 LYS 64 5.918 -10.718 20.934 536 H ASP 65 H ASP 65 10.852 -5.263 20.406 537 HA ASP 65 HA ASP 65 13.168 -5.267 20.001 538 1HB ASP 65 HB2 ASP 65 14.077 -6.348 21.946 539 2HB ASP 65 HB3 ASP 65 12.539 -5.568 22.322 540 H GLN 66 H GLN 66 13.732 -5.937 17.993 541 HA GLN 66 HA GLN 66 15.326 -6.970 16.766 542 1HB GLN 66 HB2 GLN 66 14.996 -9.548 18.309 543 2HB GLN 66 HB3 GLN 66 16.198 -9.191 17.097 544 1HG GLN 66 HG2 GLN 66 17.462 -7.801 18.428 545 2HG GLN 66 HG3 GLN 66 16.126 -7.311 19.458 546 1HE2 GLN 66 HE22 GLN 66 15.017 -9.308 20.618 547 2HE2 GLN 66 HE21 GLN 66 16.176 -10.319 21.483 548 H GLU 67 H GLU 67 12.164 -8.342 17.391 549 HA GLU 67 HA GLU 67 12.088 -9.541 14.651 550 1HB GLU 67 HB2 GLU 67 10.774 -10.145 17.269 551 2HB GLU 67 HB3 GLU 67 9.805 -10.348 15.813 552 1HG GLU 67 HG2 GLU 67 11.036 -12.429 16.503 553 2HG GLU 67 HG3 GLU 67 11.352 -11.905 14.845 554 H VAL 68 H VAL 68 11.503 -8.116 13.205 555 HA VAL 68 HA VAL 68 9.645 -5.896 13.741 556 HB VAL 68 HB VAL 68 10.915 -6.939 11.180 557 1HG1 VAL 68 HG11 VAL 68 8.911 -5.607 10.740 558 2HG1 VAL 68 HG12 VAL 68 9.509 -4.309 11.793 559 3HG1 VAL 68 HG13 VAL 68 10.358 -4.702 10.277 560 1HG2 VAL 68 HG21 VAL 68 12.551 -5.196 11.342 561 2HG2 VAL 68 HG22 VAL 68 11.825 -4.585 12.826 562 3HG2 VAL 68 HG23 VAL 68 12.641 -6.165 12.808 563 H ASN 69 H ASN 69 7.728 -7.027 14.353 564 HA ASN 69 HA ASN 69 6.736 -9.247 12.781 565 1HB ASN 69 HB2 ASN 69 6.177 -9.120 15.112 566 2HB ASN 69 HB3 ASN 69 5.390 -7.548 14.887 567 1HD2 ASN 69 HD21 ASN 69 5.221 -11.020 14.060 568 2HD2 ASN 69 HD22 ASN 69 3.505 -11.011 13.663 569 H PHE 70 H PHE 70 4.992 -9.307 11.307 570 HA PHE 70 HA PHE 70 4.839 -7.411 9.355 571 1HB PHE 70 HB2 PHE 70 3.946 -9.648 9.114 572 2HB PHE 70 HB3 PHE 70 2.690 -9.330 10.309 573 HD1 PHE 70 HD1 PHE 70 0.588 -8.467 9.596 574 HD2 PHE 70 HD2 PHE 70 4.029 -8.079 7.021 575 HE1 PHE 70 HE1 PHE 70 -0.796 -7.320 7.915 576 HE2 PHE 70 HE2 PHE 70 2.627 -6.953 5.323 577 HZ PHE 70 HZ PHE 70 0.221 -6.525 5.783 578 H GLN 71 H GLN 71 2.568 -7.506 12.173 579 HA GLN 71 HA GLN 71 0.943 -5.362 11.212 580 1HB GLN 71 HB2 GLN 71 0.322 -6.921 13.058 581 2HB GLN 71 HB3 GLN 71 1.541 -6.157 14.093 582 1HG GLN 71 HG2 GLN 71 0.309 -3.957 13.822 583 2HG GLN 71 HG3 GLN 71 -0.899 -4.803 12.843 584 1HE2 GLN 71 HE22 GLN 71 0.718 -4.900 16.076 585 2HE2 GLN 71 HE21 GLN 71 -0.719 -5.461 16.925 586 H GLU 72 H GLU 72 3.928 -5.445 13.130 587 HA GLU 72 HA GLU 72 3.861 -2.633 13.825 588 1HB GLU 72 HB2 GLU 72 6.197 -4.576 14.001 589 2HB GLU 72 HB3 GLU 72 5.980 -3.043 14.859 590 1HG GLU 72 HG2 GLU 72 4.331 -5.598 15.216 591 2HG GLU 72 HG3 GLU 72 5.436 -4.883 16.381 592 H TYR 73 H TYR 73 5.431 -4.634 11.348 593 HA TYR 73 HA TYR 73 6.956 -2.615 10.044 594 1HB TYR 73 HB2 TYR 73 7.377 -4.751 9.329 595 2HB TYR 73 HB3 TYR 73 5.696 -5.212 9.239 596 HD1 TYR 73 HD1 TYR 73 4.392 -4.950 7.259 597 HD2 TYR 73 HD2 TYR 73 8.450 -3.509 7.449 598 HE1 TYR 73 HE1 TYR 73 4.491 -4.925 4.795 599 HE2 TYR 73 HE2 TYR 73 8.589 -3.616 4.973 600 HH TYR 73 HH TYR 73 5.917 -4.825 2.957 601 H ILE 74 H ILE 74 3.511 -3.614 9.440 602 HA ILE 74 HA ILE 74 3.057 -1.524 7.554 603 HB ILE 74 HB ILE 74 1.043 -2.846 9.400 604 1HG1 ILE 74 HG12 ILE 74 2.235 -4.475 7.912 605 2HG1 ILE 74 HG13 ILE 74 0.512 -4.368 7.666 606 1HG2 ILE 74 HG21 ILE 74 0.012 -0.878 8.611 607 2HG2 ILE 74 HG22 ILE 74 0.755 -1.003 7.003 608 3HG2 ILE 74 HG23 ILE 74 -0.541 -2.107 7.473 609 1HD1 ILE 74 HD11 ILE 74 2.636 -3.137 5.888 610 2HD1 ILE 74 HD12 ILE 74 1.630 -4.548 5.523 611 3HD1 ILE 74 HD13 ILE 74 0.875 -2.964 5.635 612 H THR 75 H THR 75 2.415 -1.577 11.087 613 HA THR 75 HA THR 75 1.379 1.000 11.417 614 HB THR 75 HB THR 75 3.297 -0.456 13.292 615 HG1 THR 75 HG1 THR 75 1.527 -1.751 12.754 616 1HG2 THR 75 HG21 THR 75 1.192 1.670 13.838 617 2HG2 THR 75 HG22 THR 75 2.040 0.724 15.074 618 3HG2 THR 75 HG23 THR 75 2.947 1.842 14.045 619 H PHE 76 H PHE 76 4.807 -0.019 11.361 620 HA PHE 76 HA PHE 76 5.906 2.584 11.772 621 1HB PHE 76 HB2 PHE 76 7.176 0.524 12.194 622 2HB PHE 76 HB3 PHE 76 7.110 0.130 10.476 623 HD1 PHE 76 HD1 PHE 76 8.502 1.354 8.827 624 HD2 PHE 76 HD2 PHE 76 8.513 2.495 12.996 625 HE1 PHE 76 HE1 PHE 76 10.442 2.794 8.429 626 HE2 PHE 76 HE2 PHE 76 10.367 4.078 12.537 627 HZ PHE 76 HZ PHE 76 11.296 4.274 10.237 628 H LEU 77 H LEU 77 5.163 0.702 8.741 629 HA LEU 77 HA LEU 77 6.154 2.747 7.002 630 1HB LEU 77 HB2 LEU 77 4.017 0.629 6.624 631 2HB LEU 77 HB3 LEU 77 4.476 1.753 5.343 632 HG LEU 77 HG LEU 77 6.488 -0.056 6.763 633 1HD1 LEU 77 HD11 LEU 77 5.073 -0.473 4.099 634 2HD1 LEU 77 HD12 LEU 77 6.427 -1.430 4.726 635 3HD1 LEU 77 HD13 LEU 77 4.871 -1.454 5.576 636 1HD2 LEU 77 HD21 LEU 77 7.597 1.834 5.702 637 2HD2 LEU 77 HD22 LEU 77 7.836 0.427 4.681 638 3HD2 LEU 77 HD23 LEU 77 6.616 1.640 4.228 639 H GLY 78 H GLY 78 3.058 2.439 8.722 640 1HA GLY 78 HA2 GLY 78 1.822 4.793 7.717 641 2HA GLY 78 HA3 GLY 78 1.624 4.142 9.358 642 H ALA 79 H ALA 79 4.137 4.422 10.467 643 HA ALA 79 HA ALA 79 4.356 7.198 11.049 644 1HB ALA 79 HB1 ALA 79 5.288 5.384 12.513 645 2HB ALA 79 HB2 ALA 79 6.426 6.696 12.172 646 3HB ALA 79 HB3 ALA 79 6.597 5.148 11.341 647 H LEU 80 H LEU 80 6.178 5.168 8.740 648 HA LEU 80 HA LEU 80 8.013 7.099 7.876 649 1HB LEU 80 HB2 LEU 80 7.843 4.513 7.423 650 2HB LEU 80 HB3 LEU 80 6.847 4.985 6.047 651 HG LEU 80 HG LEU 80 8.806 6.447 5.288 652 1HD1 LEU 80 HD11 LEU 80 10.119 6.565 7.395 653 2HD1 LEU 80 HD12 LEU 80 10.251 4.794 7.414 654 3HD1 LEU 80 HD13 LEU 80 11.054 5.729 6.144 655 1HD2 LEU 80 HD21 LEU 80 9.292 3.448 5.568 656 2HD2 LEU 80 HD22 LEU 80 8.274 4.205 4.316 657 3HD2 LEU 80 HD23 LEU 80 10.021 4.507 4.349 658 H ALA 81 H ALA 81 4.759 6.285 6.637 659 HA ALA 81 HA ALA 81 4.574 8.191 4.536 660 1HB ALA 81 HB1 ALA 81 2.965 6.424 4.769 661 2HB ALA 81 HB2 ALA 81 2.422 7.036 6.331 662 3HB ALA 81 HB3 ALA 81 2.138 7.995 4.872 663 H MET 82 H MET 82 3.612 8.447 7.990 664 HA MET 82 HA MET 82 2.799 11.146 7.906 665 1HB MET 82 HB2 MET 82 2.177 9.652 9.667 666 2HB MET 82 HB3 MET 82 3.842 9.443 10.194 667 1HG MET 82 HG2 MET 82 2.467 12.150 10.180 668 2HG MET 82 HG3 MET 82 2.306 11.030 11.532 669 1HE MET 82 HE1 MET 82 5.854 10.936 13.102 670 2HE MET 82 HE2 MET 82 5.217 9.768 11.929 671 3HE MET 82 HE3 MET 82 4.167 10.388 13.228 672 H ILE 83 H ILE 83 6.017 9.764 8.497 673 HA ILE 83 HA ILE 83 7.331 12.229 9.116 674 HB ILE 83 HB ILE 83 8.308 9.490 8.267 675 1HG1 ILE 83 HG12 ILE 83 8.681 10.980 10.903 676 2HG1 ILE 83 HG13 ILE 83 7.247 10.012 10.588 677 1HG2 ILE 83 HG21 ILE 83 9.990 11.921 9.012 678 2HG2 ILE 83 HG22 ILE 83 10.010 11.054 7.460 679 3HG2 ILE 83 HG23 ILE 83 10.607 10.261 8.909 680 1HD1 ILE 83 HD11 ILE 83 8.809 8.668 11.823 681 2HD1 ILE 83 HD12 ILE 83 10.101 8.959 10.651 682 3HD1 ILE 83 HD13 ILE 83 8.674 8.007 10.184 683 H TYR 84 H TYR 84 7.033 10.377 6.013 684 HA TYR 84 HA TYR 84 8.444 12.258 4.387 685 1HB TYR 84 HB2 TYR 84 5.977 10.610 3.704 686 2HB TYR 84 HB3 TYR 84 6.992 11.457 2.542 687 HD1 TYR 84 HD1 TYR 84 6.209 8.377 2.923 688 HD2 TYR 84 HD2 TYR 84 9.767 10.750 3.519 689 HE1 TYR 84 HE1 TYR 84 7.627 6.393 2.478 690 HE2 TYR 84 HE2 TYR 84 11.157 8.784 3.059 691 HH TYR 84 HH TYR 84 11.191 6.565 2.444 692 H ASN 85 H ASN 85 5.048 12.130 5.392 693 HA ASN 85 HA ASN 85 3.637 13.697 6.000 694 1HB ASN 85 HB2 ASN 85 5.826 14.688 7.020 695 2HB ASN 85 HB3 ASN 85 5.684 15.918 5.762 696 1HD2 ASN 85 HD22 ASN 85 4.023 14.306 8.444 697 2HD2 ASN 85 HD21 ASN 85 2.948 15.651 8.856 698 H GLU 86 H GLU 86 5.637 15.257 3.454 699 HA GLU 86 HA GLU 86 3.609 16.821 2.269 700 1HB GLU 86 HB2 GLU 86 4.954 16.774 0.231 701 2HB GLU 86 HB3 GLU 86 5.943 17.061 1.665 702 1HG GLU 86 HG2 GLU 86 6.666 14.647 1.608 703 2HG GLU 86 HG3 GLU 86 5.713 14.428 0.129 704 H ALA 87 H ALA 87 4.425 13.424 1.838 705 HA ALA 87 HA ALA 87 2.740 12.531 -0.148 706 1HB ALA 87 HB1 ALA 87 2.754 10.394 1.060 707 2HB ALA 87 HB2 ALA 87 4.357 11.150 1.133 708 3HB ALA 87 HB3 ALA 87 3.289 11.208 2.549 709 H LEU 88 H LEU 88 1.806 13.398 3.215 710 HA LEU 88 HA LEU 88 -0.847 12.322 3.102 711 1HB LEU 88 HB2 LEU 88 0.145 14.652 4.764 712 2HB LEU 88 HB3 LEU 88 -1.261 13.653 5.087 713 HG LEU 88 HG LEU 88 1.640 12.698 5.199 714 1HD1 LEU 88 HD11 LEU 88 -0.337 13.428 7.402 715 2HD1 LEU 88 HD12 LEU 88 1.295 12.784 7.649 716 3HD1 LEU 88 HD13 LEU 88 1.082 14.383 6.921 717 1HD2 LEU 88 HD21 LEU 88 0.796 10.714 6.297 718 2HD2 LEU 88 HD22 LEU 88 -0.872 11.294 6.182 719 3HD2 LEU 88 HD23 LEU 88 0.026 10.851 4.712 720 H LYS 89 H LYS 89 0.619 15.368 2.052 721 HA LYS 89 HA LYS 89 -1.977 16.740 1.722 722 1HB LYS 89 HB2 LYS 89 0.918 17.539 1.184 723 2HB LYS 89 HB3 LYS 89 -0.474 18.520 0.738 724 1HG LYS 89 HG2 LYS 89 0.546 19.278 2.810 725 2HG LYS 89 HG3 LYS 89 -1.142 18.805 3.043 726 1HD LYS 89 HD2 LYS 89 -0.555 16.798 4.169 727 2HD LYS 89 HD3 LYS 89 1.151 16.900 3.680 728 1HE LYS 89 HE2 LYS 89 -0.218 18.913 5.516 729 2HE LYS 89 HE3 LYS 89 0.644 17.473 6.086 730 1HZ LYS 89 HZ1 LYS 89 2.621 18.242 5.105 731 2HZ LYS 89 HZ2 LYS 89 1.884 19.578 4.469 732 3HZ LYS 89 HZ3 LYS 89 2.029 19.404 6.103 733 H GLY 90 H GLY 90 0.777 15.625 -0.311 734 1HA GLY 90 HA2 GLY 90 -0.365 14.253 -2.293 735 2HA GLY 90 HA3 GLY 90 -0.800 15.902 -2.786 736 1H MET 1 H1 MET 1 14.470 -0.937 -5.044 737 2H MET 1 H2 MET 1 13.580 -1.300 -6.384 738 3H MET 1 H3 MET 1 15.168 -0.817 -6.538 739 HA MET 1 HA MET 1 14.662 1.285 -5.588 740 1HB MET 1 HB2 MET 1 13.347 2.250 -7.450 741 2HB MET 1 HB3 MET 1 14.650 1.188 -7.998 742 1HG MET 1 HG2 MET 1 13.062 -0.617 -8.436 743 2HG MET 1 HG3 MET 1 11.738 0.343 -7.766 744 1HE MET 1 HE1 MET 1 10.788 0.131 -11.526 745 2HE MET 1 HE2 MET 1 10.249 -0.136 -9.851 746 3HE MET 1 HE3 MET 1 11.560 -1.129 -10.535 747 H ALA 2 H ALA 2 13.163 2.756 -4.706 748 HA ALA 2 HA ALA 2 11.278 1.498 -2.964 749 1HB ALA 2 HB1 ALA 2 12.639 3.466 -2.347 750 2HB ALA 2 HB2 ALA 2 11.765 4.450 -3.538 751 3HB ALA 2 HB3 ALA 2 10.907 3.781 -2.132 752 H SER 3 H SER 3 10.895 2.987 -6.130 753 HA SER 3 HA SER 3 8.610 4.254 -6.120 754 1HB SER 3 HB2 SER 3 8.826 2.521 -8.499 755 2HB SER 3 HB3 SER 3 8.879 4.272 -8.336 756 HG SER 3 HG SER 3 10.926 3.165 -8.950 757 HA PRO 4 HA PRO 4 5.819 0.319 -6.885 758 1HB PRO 4 HB2 PRO 4 7.445 -1.696 -5.346 759 2HB PRO 4 HB3 PRO 4 6.382 -1.947 -6.760 760 1HG PRO 4 HG2 PRO 4 9.060 -1.879 -7.107 761 2HG PRO 4 HG3 PRO 4 8.007 -0.965 -8.235 762 1HD PRO 4 HD2 PRO 4 9.428 0.070 -5.771 763 2HD PRO 4 HD3 PRO 4 9.504 0.722 -7.428 764 H LEU 5 H LEU 5 7.780 0.496 -3.841 765 HA LEU 5 HA LEU 5 5.475 -0.099 -2.194 766 1HB LEU 5 HB2 LEU 5 7.751 -0.593 -1.389 767 2HB LEU 5 HB3 LEU 5 8.160 1.129 -1.443 768 HG LEU 5 HG LEU 5 6.412 1.621 0.251 769 1HD1 LEU 5 HD11 LEU 5 5.398 -0.256 1.498 770 2HD1 LEU 5 HD12 LEU 5 5.983 -1.409 0.278 771 3HD1 LEU 5 HD13 LEU 5 4.773 -0.169 -0.145 772 1HD2 LEU 5 HD21 LEU 5 8.673 1.115 1.014 773 2HD2 LEU 5 HD22 LEU 5 7.449 0.545 2.161 774 3HD2 LEU 5 HD23 LEU 5 8.260 -0.626 1.091 775 H ASP 6 H ASP 6 7.289 2.809 -3.192 776 HA ASP 6 HA ASP 6 5.928 4.733 -1.673 777 1HB ASP 6 HB2 ASP 6 6.971 5.081 -4.519 778 2HB ASP 6 HB3 ASP 6 6.575 6.375 -3.388 779 H GLN 7 H GLN 7 5.051 3.564 -4.985 780 HA GLN 7 HA GLN 7 2.665 5.138 -5.089 781 1HB GLN 7 HB2 GLN 7 1.925 3.727 -6.906 782 2HB GLN 7 HB3 GLN 7 3.607 4.232 -7.103 783 1HG GLN 7 HG2 GLN 7 4.365 2.024 -6.322 784 2HG GLN 7 HG3 GLN 7 2.703 1.458 -6.165 785 1HE2 GLN 7 HE22 GLN 7 1.356 1.671 -8.276 786 2HE2 GLN 7 HE21 GLN 7 2.221 1.302 -9.757 787 H ALA 8 H ALA 8 3.241 1.838 -3.760 788 HA ALA 8 HA ALA 8 0.489 1.273 -3.301 789 1HB ALA 8 HB1 ALA 8 2.056 -0.466 -3.296 790 2HB ALA 8 HB2 ALA 8 1.315 -0.392 -1.687 791 3HB ALA 8 HB3 ALA 8 2.968 0.211 -1.924 792 H ILE 9 H ILE 9 2.971 2.589 -0.976 793 HA ILE 9 HA ILE 9 1.035 3.024 1.101 794 HB ILE 9 HB ILE 9 2.647 4.487 2.157 795 1HG1 ILE 9 HG12 ILE 9 4.349 4.187 -0.303 796 2HG1 ILE 9 HG13 ILE 9 3.573 5.683 0.242 797 1HG2 ILE 9 HG21 ILE 9 3.981 2.009 1.033 798 2HG2 ILE 9 HG22 ILE 9 4.299 2.797 2.594 799 3HG2 ILE 9 HG23 ILE 9 2.751 2.010 2.315 800 1HD1 ILE 9 HD11 ILE 9 5.860 5.780 0.898 801 2HD1 ILE 9 HD12 ILE 9 4.902 5.539 2.373 802 3HD1 ILE 9 HD13 ILE 9 5.810 4.186 1.656 803 H GLY 10 H GLY 10 2.223 5.066 -1.566 804 1HA GLY 10 HA2 GLY 10 0.799 7.411 -1.332 805 2HA GLY 10 HA3 GLY 10 1.153 6.580 -2.852 806 H LEU 11 H LEU 11 -0.416 4.266 -2.611 807 HA LEU 11 HA LEU 11 -2.952 5.168 -3.409 808 1HB LEU 11 HB2 LEU 11 -1.694 2.891 -3.779 809 2HB LEU 11 HB3 LEU 11 -2.424 2.407 -2.256 810 HG LEU 11 HG LEU 11 -3.726 1.509 -3.955 811 1HD1 LEU 11 HD11 LEU 11 -5.325 3.924 -3.131 812 2HD1 LEU 11 HD12 LEU 11 -5.907 2.319 -3.604 813 3HD1 LEU 11 HD13 LEU 11 -5.003 2.507 -2.088 814 1HD2 LEU 11 HD21 LEU 11 -2.941 2.886 -5.824 815 2HD2 LEU 11 HD22 LEU 11 -4.705 2.713 -5.820 816 3HD2 LEU 11 HD23 LEU 11 -3.967 4.233 -5.278 817 H LEU 12 H LEU 12 -2.118 3.462 -0.348 818 HA LEU 12 HA LEU 12 -4.602 3.752 0.970 819 1HB LEU 12 HB2 LEU 12 -1.711 3.692 2.011 820 2HB LEU 12 HB3 LEU 12 -3.099 3.816 3.085 821 HG LEU 12 HG LEU 12 -3.992 1.698 2.257 822 1HD1 LEU 12 HD11 LEU 12 -1.319 1.463 0.802 823 2HD1 LEU 12 HD12 LEU 12 -2.460 0.131 1.042 824 3HD1 LEU 12 HD13 LEU 12 -2.926 1.500 0.035 825 1HD2 LEU 12 HD21 LEU 12 -2.652 1.801 4.304 826 2HD2 LEU 12 HD22 LEU 12 -2.340 0.285 3.455 827 3HD2 LEU 12 HD23 LEU 12 -1.157 1.605 3.363 828 H ILE 13 H ILE 13 -1.808 5.938 0.906 829 HA ILE 13 HA ILE 13 -2.839 7.879 2.719 830 HB ILE 13 HB ILE 13 -0.796 7.963 0.464 831 1HG1 ILE 13 HG12 ILE 13 -0.341 8.019 3.478 832 2HG1 ILE 13 HG13 ILE 13 -0.424 6.509 2.587 833 1HG2 ILE 13 HG21 ILE 13 -1.169 10.068 2.614 834 2HG2 ILE 13 HG22 ILE 13 0.099 10.022 1.381 835 3HG2 ILE 13 HG23 ILE 13 -1.568 10.292 0.886 836 1HD1 ILE 13 HD11 ILE 13 1.870 6.964 2.701 837 2HD1 ILE 13 HD12 ILE 13 1.441 7.483 1.068 838 3HD1 ILE 13 HD13 ILE 13 1.662 8.688 2.358 839 H GLY 14 H GLY 14 -2.809 7.872 -0.874 840 1HA GLY 14 HA2 GLY 14 -4.267 10.202 -1.357 841 2HA GLY 14 HA3 GLY 14 -4.222 8.772 -2.408 842 H ILE 15 H ILE 15 -5.495 6.812 -1.015 843 HA ILE 15 HA ILE 15 -8.257 7.393 -1.323 844 HB ILE 15 HB ILE 15 -6.640 5.180 -0.094 845 1HG1 ILE 15 HG12 ILE 15 -8.876 5.371 -2.171 846 2HG1 ILE 15 HG13 ILE 15 -7.143 5.295 -2.503 847 1HG2 ILE 15 HG21 ILE 15 -8.697 4.004 0.645 848 2HG2 ILE 15 HG22 ILE 15 -8.313 5.416 1.600 849 3HG2 ILE 15 HG23 ILE 15 -9.617 5.508 0.388 850 1HD1 ILE 15 HD11 ILE 15 -8.015 3.105 -2.886 851 2HD1 ILE 15 HD12 ILE 15 -7.148 3.013 -1.339 852 3HD1 ILE 15 HD13 ILE 15 -8.921 3.096 -1.374 853 H PHE 16 H PHE 16 -6.258 7.294 1.654 854 HA PHE 16 HA PHE 16 -8.351 7.971 3.410 855 1HB PHE 16 HB2 PHE 16 -6.107 7.086 3.999 856 2HB PHE 16 HB3 PHE 16 -5.389 8.646 3.661 857 HD1 PHE 16 HD1 PHE 16 -5.974 10.625 5.071 858 HD2 PHE 16 HD2 PHE 16 -7.502 6.729 6.004 859 HE1 PHE 16 HE1 PHE 16 -6.389 11.342 7.373 860 HE2 PHE 16 HE2 PHE 16 -7.773 7.406 8.387 861 HZ PHE 16 HZ PHE 16 -7.097 9.655 9.103 862 H HIS 17 H HIS 17 -5.856 10.238 2.069 863 HA HIS 17 HA HIS 17 -7.138 12.395 3.417 864 1HB HIS 17 HB2 HIS 17 -4.992 12.508 1.305 865 2HB HIS 17 HB3 HIS 17 -5.565 13.888 2.255 866 HD1 HIS 17 HD1 HIS 17 -5.248 13.551 5.089 867 HD2 HIS 17 HD2 HIS 17 -3.204 11.018 2.421 868 HE1 HIS 17 HE1 HIS 17 -3.467 12.278 6.446 869 H LYS 18 H LYS 18 -7.811 11.094 0.189 870 HA LYS 18 HA LYS 18 -9.237 13.453 -0.718 871 1HB LYS 18 HB2 LYS 18 -9.605 10.484 -1.270 872 2HB LYS 18 HB3 LYS 18 -10.665 11.733 -1.949 873 1HG LYS 18 HG2 LYS 18 -8.627 12.894 -2.879 874 2HG LYS 18 HG3 LYS 18 -7.665 11.495 -2.417 875 1HD LYS 18 HD2 LYS 18 -10.054 11.571 -4.338 876 2HD LYS 18 HD3 LYS 18 -8.357 11.413 -4.797 877 1HE LYS 18 HE2 LYS 18 -10.005 9.355 -3.246 878 2HE LYS 18 HE3 LYS 18 -9.490 9.248 -4.932 879 1HZ LYS 18 HZ1 LYS 18 -8.061 8.002 -3.511 880 2HZ LYS 18 HZ2 LYS 18 -7.219 9.251 -4.183 881 3HZ LYS 18 HZ3 LYS 18 -7.705 9.336 -2.608 882 H TYR 19 H TYR 19 -10.226 10.600 1.234 883 HA TYR 19 HA TYR 19 -12.909 11.581 1.618 884 1HB TYR 19 HB2 TYR 19 -11.266 9.348 2.784 885 2HB TYR 19 HB3 TYR 19 -12.778 9.830 3.548 886 HD1 TYR 19 HD1 TYR 19 -11.358 8.413 0.413 887 HD2 TYR 19 HD2 TYR 19 -14.928 9.429 2.585 888 HE1 TYR 19 HE1 TYR 19 -12.733 7.507 -1.420 889 HE2 TYR 19 HE2 TYR 19 -16.295 8.704 0.669 890 HH TYR 19 HH TYR 19 -16.289 8.012 -1.507 891 H SER 20 H SER 20 -9.926 11.830 3.675 892 HA SER 20 HA SER 20 -11.122 13.332 5.750 893 1HB SER 20 HB2 SER 20 -8.372 13.869 4.545 894 2HB SER 20 HB3 SER 20 -8.923 14.227 6.181 895 HG SER 20 HG SER 20 -9.069 12.074 6.622 896 H GLY 21 H GLY 21 -9.690 14.478 2.683 897 1HA GLY 21 HA2 GLY 21 -10.010 17.220 2.901 898 2HA GLY 21 HA3 GLY 21 -10.017 16.297 1.387 899 H LYS 22 H LYS 22 -12.351 14.793 1.631 900 HA LYS 22 HA LYS 22 -14.350 16.518 0.792 901 1HB LYS 22 HB2 LYS 22 -14.249 14.065 0.519 902 2HB LYS 22 HB3 LYS 22 -14.826 13.855 2.189 903 1HG LYS 22 HG2 LYS 22 -16.885 15.138 1.614 904 2HG LYS 22 HG3 LYS 22 -16.306 15.334 -0.043 905 1HD LYS 22 HD2 LYS 22 -17.037 12.697 1.333 906 2HD LYS 22 HD3 LYS 22 -18.004 13.584 0.161 907 1HE LYS 22 HE2 LYS 22 -17.067 12.009 -1.217 908 2HE LYS 22 HE3 LYS 22 -15.899 13.320 -1.428 909 1HZ LYS 22 HZ1 LYS 22 -14.882 11.178 -1.033 910 2HZ LYS 22 HZ2 LYS 22 -14.518 12.196 0.209 911 3HZ LYS 22 HZ3 LYS 22 -15.664 11.036 0.410 912 H GLU 23 H GLU 23 -13.560 15.682 4.161 913 HA GLU 23 HA GLU 23 -15.700 17.579 5.087 914 1HB GLU 23 HB2 GLU 23 -15.605 16.327 7.236 915 2HB GLU 23 HB3 GLU 23 -16.289 15.422 5.881 916 1HG GLU 23 HG2 GLU 23 -14.251 14.140 5.583 917 2HG GLU 23 HG3 GLU 23 -13.394 15.137 6.757 918 H GLY 24 H GLY 24 -12.840 17.999 4.134 919 1HA GLY 24 HA2 GLY 24 -10.977 19.152 4.674 920 2HA GLY 24 HA3 GLY 24 -12.016 20.065 5.777 921 H ASP 25 H ASP 25 -11.562 16.631 6.416 922 HA ASP 25 HA ASP 25 -10.570 17.421 9.053 923 1HB ASP 25 HB2 ASP 25 -12.470 15.871 8.697 924 2HB ASP 25 HB3 ASP 25 -11.353 14.678 7.997 925 H LYS 26 H LYS 26 -8.662 17.893 7.151 926 HA LYS 26 HA LYS 26 -6.614 17.255 6.233 927 1HB LYS 26 HB2 LYS 26 -6.183 17.560 9.226 928 2HB LYS 26 HB3 LYS 26 -4.972 17.810 7.949 929 1HG LYS 26 HG2 LYS 26 -6.486 19.585 6.978 930 2HG LYS 26 HG3 LYS 26 -7.557 19.382 8.380 931 1HD LYS 26 HD2 LYS 26 -5.596 19.887 9.884 932 2HD LYS 26 HD3 LYS 26 -4.645 20.284 8.444 933 1HE LYS 26 HE2 LYS 26 -7.231 21.647 9.359 934 2HE LYS 26 HE3 LYS 26 -5.596 22.311 9.497 935 1HZ LYS 26 HZ1 LYS 26 -6.997 21.702 6.990 936 2HZ LYS 26 HZ2 LYS 26 -6.725 23.199 7.620 937 3HZ LYS 26 HZ3 LYS 26 -5.457 22.282 7.103 938 H HIS 27 H HIS 27 -6.003 15.572 9.274 939 HA HIS 27 HA HIS 27 -4.971 13.252 7.704 940 1HB HIS 27 HB2 HIS 27 -3.917 14.329 10.331 941 2HB HIS 27 HB3 HIS 27 -3.216 13.033 9.356 942 HD1 HIS 27 HD1 HIS 27 -1.715 15.805 10.195 943 HD2 HIS 27 HD2 HIS 27 -3.423 14.785 6.485 944 HE1 HIS 27 HE1 HIS 27 -0.535 17.214 8.425 945 H THR 28 H THR 28 -7.697 13.651 8.898 946 HA THR 28 HA THR 28 -7.817 11.140 10.433 947 HB THR 28 HB THR 28 -8.938 13.818 11.287 948 HG1 THR 28 HG1 THR 28 -7.534 13.586 12.971 949 1HG2 THR 28 HG21 THR 28 -9.239 11.089 12.621 950 2HG2 THR 28 HG22 THR 28 -9.709 12.645 13.330 951 3HG2 THR 28 HG23 THR 28 -10.548 12.052 11.897 952 H LEU 29 H LEU 29 -9.967 10.191 10.353 953 HA LEU 29 HA LEU 29 -11.853 11.329 8.316 954 1HB LEU 29 HB2 LEU 29 -11.213 8.417 8.977 955 2HB LEU 29 HB3 LEU 29 -12.555 8.930 7.961 956 HG LEU 29 HG LEU 29 -9.632 9.464 7.290 957 1HD1 LEU 29 HD11 LEU 29 -10.123 7.025 7.336 958 2HD1 LEU 29 HD12 LEU 29 -11.548 7.294 6.312 959 3HD1 LEU 29 HD13 LEU 29 -9.922 7.599 5.667 960 1HD2 LEU 29 HD21 LEU 29 -11.186 11.013 6.199 961 2HD2 LEU 29 HD22 LEU 29 -10.563 9.840 5.029 962 3HD2 LEU 29 HD23 LEU 29 -12.207 9.653 5.689 963 H SER 30 H SER 30 -13.958 11.518 9.139 964 HA SER 30 HA SER 30 -14.427 10.596 11.909 965 1HB SER 30 HB2 SER 30 -15.428 12.737 10.990 966 2HB SER 30 HB3 SER 30 -16.411 11.750 9.892 967 HG SER 30 HG SER 30 -16.471 11.876 12.718 968 H LYS 31 H LYS 31 -16.063 8.987 12.426 969 HA LYS 31 HA LYS 31 -15.527 6.590 11.210 970 1HB LYS 31 HB2 LYS 31 -17.344 5.669 12.549 971 2HB LYS 31 HB3 LYS 31 -16.351 6.809 13.452 972 1HG LYS 31 HG2 LYS 31 -18.115 8.555 13.181 973 2HG LYS 31 HG3 LYS 31 -19.117 7.371 12.302 974 1HD LYS 31 HD2 LYS 31 -19.075 5.874 14.278 975 2HD LYS 31 HD3 LYS 31 -18.149 7.090 15.175 976 1HE LYS 31 HE2 LYS 31 -19.987 8.708 14.959 977 2HE LYS 31 HE3 LYS 31 -20.901 7.588 13.928 978 1HZ LYS 31 HZ1 LYS 31 -20.175 7.108 16.730 979 2HZ LYS 31 HZ2 LYS 31 -21.662 7.552 16.178 980 3HZ LYS 31 HZ3 LYS 31 -21.034 6.085 15.766 981 H LYS 32 H LYS 32 -18.401 8.615 10.541 982 HA LYS 32 HA LYS 32 -19.488 6.691 8.658 983 1HB LYS 32 HB2 LYS 32 -20.942 8.130 9.863 984 2HB LYS 32 HB3 LYS 32 -20.166 9.587 9.185 985 1HG LYS 32 HG2 LYS 32 -20.981 8.940 6.914 986 2HG LYS 32 HG3 LYS 32 -21.630 7.442 7.577 987 1HD LYS 32 HD2 LYS 32 -23.416 9.073 7.248 988 2HD LYS 32 HD3 LYS 32 -23.236 8.682 8.959 989 1HE LYS 32 HE2 LYS 32 -23.622 11.101 8.564 990 2HE LYS 32 HE3 LYS 32 -22.085 10.811 9.380 991 1HZ LYS 32 HZ1 LYS 32 -20.987 11.070 7.272 992 2HZ LYS 32 HZ2 LYS 32 -22.424 11.306 6.500 993 3HZ LYS 32 HZ3 LYS 32 -21.894 12.401 7.611 994 H GLU 33 H GLU 33 -17.116 9.297 8.407 995 HA GLU 33 HA GLU 33 -17.289 9.529 5.512 996 1HB GLU 33 HB2 GLU 33 -16.305 11.286 7.089 997 2HB GLU 33 HB3 GLU 33 -14.913 10.206 7.291 998 1HG GLU 33 HG2 GLU 33 -14.310 11.754 5.585 999 2HG GLU 33 HG3 GLU 33 -14.643 10.234 4.770 1000 H LEU 34 H LEU 34 -15.371 7.696 7.920 1001 HA LEU 34 HA LEU 34 -13.847 6.171 6.071 1002 1HB LEU 34 HB2 LEU 34 -13.243 6.150 8.350 1003 2HB LEU 34 HB3 LEU 34 -14.800 5.566 8.887 1004 HG LEU 34 HG LEU 34 -13.023 3.908 8.997 1005 1HD1 LEU 34 HD11 LEU 34 -15.519 3.311 8.636 1006 2HD1 LEU 34 HD12 LEU 34 -15.015 2.807 7.022 1007 3HD1 LEU 34 HD13 LEU 34 -14.300 2.052 8.435 1008 1HD2 LEU 34 HD21 LEU 34 -12.147 2.825 6.932 1009 2HD2 LEU 34 HD22 LEU 34 -13.005 3.998 5.948 1010 3HD2 LEU 34 HD23 LEU 34 -11.710 4.539 7.031 1011 H LYS 35 H LYS 35 -17.140 5.468 7.487 1012 HA LYS 35 HA LYS 35 -17.547 3.126 5.975 1013 1HB LYS 35 HB2 LYS 35 -19.132 3.740 7.649 1014 2HB LYS 35 HB3 LYS 35 -19.605 5.210 6.780 1015 1HG LYS 35 HG2 LYS 35 -20.584 3.998 4.976 1016 2HG LYS 35 HG3 LYS 35 -19.898 2.457 5.513 1017 1HD LYS 35 HD2 LYS 35 -21.784 4.053 7.280 1018 2HD LYS 35 HD3 LYS 35 -22.433 3.032 5.995 1019 1HE LYS 35 HE2 LYS 35 -20.522 1.951 8.131 1020 2HE LYS 35 HE3 LYS 35 -22.295 1.975 8.276 1021 1HZ LYS 35 HZ1 LYS 35 -21.528 -0.104 7.449 1022 2HZ LYS 35 HZ2 LYS 35 -22.430 0.655 6.301 1023 3HZ LYS 35 HZ3 LYS 35 -20.786 0.609 6.168 1024 H GLU 36 H GLU 36 -18.193 6.517 4.948 1025 HA GLU 36 HA GLU 36 -19.128 5.940 2.368 1026 1HB GLU 36 HB2 GLU 36 -18.961 8.198 3.667 1027 2HB GLU 36 HB3 GLU 36 -17.356 8.335 2.940 1028 1HG GLU 36 HG2 GLU 36 -18.496 7.991 0.668 1029 2HG GLU 36 HG3 GLU 36 -20.044 8.081 1.516 1030 H LEU 37 H LEU 37 -15.757 6.417 3.474 1031 HA LEU 37 HA LEU 37 -14.381 6.017 1.041 1032 1HB LEU 37 HB2 LEU 37 -13.341 6.804 3.103 1033 2HB LEU 37 HB3 LEU 37 -13.577 5.267 3.890 1034 HG LEU 37 HG LEU 37 -11.854 5.483 1.421 1035 1HD1 LEU 37 HD11 LEU 37 -10.987 7.052 3.090 1036 2HD1 LEU 37 HD12 LEU 37 -11.127 5.816 4.366 1037 3HD1 LEU 37 HD13 LEU 37 -9.947 5.623 3.064 1038 1HD2 LEU 37 HD21 LEU 37 -12.020 3.470 3.745 1039 2HD2 LEU 37 HD22 LEU 37 -12.384 3.149 2.030 1040 3HD2 LEU 37 HD23 LEU 37 -10.738 3.495 2.522 1041 H ILE 38 H ILE 38 -15.366 3.560 3.469 1042 HA ILE 38 HA ILE 38 -14.392 1.369 1.929 1043 HB ILE 38 HB ILE 38 -16.480 1.595 4.113 1044 1HG1 ILE 38 HG12 ILE 38 -13.599 0.559 3.938 1045 2HG1 ILE 38 HG13 ILE 38 -14.121 2.088 4.659 1046 1HG2 ILE 38 HG21 ILE 38 -17.078 -0.400 2.726 1047 2HG2 ILE 38 HG22 ILE 38 -15.415 -1.000 2.923 1048 3HG2 ILE 38 HG23 ILE 38 -16.491 -0.823 4.316 1049 1HD1 ILE 38 HD11 ILE 38 -14.659 -0.710 5.643 1050 2HD1 ILE 38 HD12 ILE 38 -13.757 0.613 6.424 1051 3HD1 ILE 38 HD13 ILE 38 -15.527 0.717 6.271 1052 H GLN 39 H GLN 39 -17.683 2.804 2.030 1053 HA GLN 39 HA GLN 39 -18.822 0.899 0.259 1054 1HB GLN 39 HB2 GLN 39 -19.564 3.804 0.755 1055 2HB GLN 39 HB3 GLN 39 -20.565 2.669 -0.156 1056 1HG GLN 39 HG2 GLN 39 -19.720 2.228 2.748 1057 2HG GLN 39 HG3 GLN 39 -21.243 2.974 2.249 1058 1HE2 GLN 39 HE22 GLN 39 -21.416 0.870 3.890 1059 2HE2 GLN 39 HE21 GLN 39 -21.972 -0.556 3.029 1060 H LYS 40 H LYS 40 -17.110 3.999 -0.493 1061 HA LYS 40 HA LYS 40 -17.600 3.642 -3.328 1062 1HB LYS 40 HB2 LYS 40 -17.244 5.856 -2.320 1063 2HB LYS 40 HB3 LYS 40 -15.611 5.384 -1.848 1064 1HG LYS 40 HG2 LYS 40 -15.618 6.801 -3.884 1065 2HG LYS 40 HG3 LYS 40 -14.880 5.234 -4.155 1066 1HD LYS 40 HD2 LYS 40 -16.268 5.927 -6.039 1067 2HD LYS 40 HD3 LYS 40 -16.885 4.435 -5.339 1068 1HE LYS 40 HE2 LYS 40 -18.662 5.719 -4.151 1069 2HE LYS 40 HE3 LYS 40 -17.984 7.238 -4.771 1070 1HZ LYS 40 HZ1 LYS 40 -19.095 5.059 -6.394 1071 2HZ LYS 40 HZ2 LYS 40 -19.841 6.488 -6.050 1072 3HZ LYS 40 HZ3 LYS 40 -18.478 6.472 -6.977 1073 H GLU 41 H GLU 41 -14.715 3.155 -1.255 1074 HA GLU 41 HA GLU 41 -13.091 2.395 -3.531 1075 1HB GLU 41 HB2 GLU 41 -12.484 2.322 -0.549 1076 2HB GLU 41 HB3 GLU 41 -11.311 2.125 -1.853 1077 1HG GLU 41 HG2 GLU 41 -12.969 4.641 -1.314 1078 2HG GLU 41 HG3 GLU 41 -11.262 4.410 -0.944 1079 H LEU 42 H LEU 42 -14.551 0.579 -0.797 1080 HA LEU 42 HA LEU 42 -13.305 -1.937 -1.811 1081 1HB LEU 42 HB2 LEU 42 -14.642 -1.213 0.793 1082 2HB LEU 42 HB3 LEU 42 -14.398 -2.879 0.279 1083 HG LEU 42 HG LEU 42 -11.965 -2.575 0.186 1084 1HD1 LEU 42 HD11 LEU 42 -11.666 -0.243 -0.350 1085 2HD1 LEU 42 HD12 LEU 42 -12.545 0.266 1.112 1086 3HD1 LEU 42 HD13 LEU 42 -10.964 -0.520 1.243 1087 1HD2 LEU 42 HD21 LEU 42 -11.580 -2.439 2.581 1088 2HD2 LEU 42 HD22 LEU 42 -13.143 -1.638 2.828 1089 3HD2 LEU 42 HD23 LEU 42 -13.083 -3.324 2.269 1090 H THR 43 H THR 43 -16.497 -0.543 -0.991 1091 HA THR 43 HA THR 43 -18.584 -1.003 -1.726 1092 HB THR 43 HB THR 43 -17.362 -2.065 -4.296 1093 HG1 THR 43 HG1 THR 43 -17.512 0.610 -3.370 1094 1HG2 THR 43 HG21 THR 43 -19.228 -0.826 -5.313 1095 2HG2 THR 43 HG22 THR 43 -19.844 -2.012 -4.149 1096 3HG2 THR 43 HG23 THR 43 -19.778 -0.289 -3.713 1097 H ILE 44 H ILE 44 -18.462 -2.749 -0.009 1098 HA ILE 44 HA ILE 44 -18.658 -5.507 -0.947 1099 HB ILE 44 HB ILE 44 -19.782 -5.772 1.381 1100 1HG1 ILE 44 HG12 ILE 44 -19.034 -4.265 3.087 1101 2HG1 ILE 44 HG13 ILE 44 -18.220 -3.205 1.939 1102 1HG2 ILE 44 HG21 ILE 44 -17.613 -6.660 0.745 1103 2HG2 ILE 44 HG22 ILE 44 -16.850 -5.078 1.020 1104 3HG2 ILE 44 HG23 ILE 44 -17.540 -5.990 2.379 1105 1HD1 ILE 44 HD11 ILE 44 -20.467 -2.549 1.027 1106 2HD1 ILE 44 HD12 ILE 44 -21.227 -3.630 2.227 1107 3HD1 ILE 44 HD13 ILE 44 -20.295 -2.218 2.752 1108 H GLY 45 H GLY 45 -19.962 -4.923 -2.769 1109 1HA GLY 45 HA2 GLY 45 -22.395 -3.912 -3.096 1110 2HA GLY 45 HA3 GLY 45 -21.935 -5.426 -3.885 1111 H SER 46 H SER 46 -21.941 -7.194 -1.686 1112 HA SER 46 HA SER 46 -24.690 -7.763 -1.180 1113 1HB SER 46 HB2 SER 46 -22.193 -8.683 0.298 1114 2HB SER 46 HB3 SER 46 -23.768 -9.502 0.251 1115 HG SER 46 HG SER 46 -22.180 -10.319 -1.276 1116 H LYS 47 H LYS 47 -25.223 -5.516 -0.482 1117 HA LYS 47 HA LYS 47 -24.405 -4.002 1.518 1118 1HB LYS 47 HB2 LYS 47 -27.326 -4.621 0.956 1119 2HB LYS 47 HB3 LYS 47 -26.761 -3.231 1.883 1120 1HG LYS 47 HG2 LYS 47 -26.193 -3.728 -1.078 1121 2HG LYS 47 HG3 LYS 47 -27.358 -2.619 -0.373 1122 1HD LYS 47 HD2 LYS 47 -25.747 -1.073 -0.623 1123 2HD LYS 47 HD3 LYS 47 -25.134 -1.706 0.909 1124 1HE LYS 47 HE2 LYS 47 -23.603 -3.224 -0.407 1125 2HE LYS 47 HE3 LYS 47 -24.261 -2.552 -1.905 1126 1HZ LYS 47 HZ1 LYS 47 -22.789 -1.040 0.145 1127 2HZ LYS 47 HZ2 LYS 47 -22.217 -1.531 -1.314 1128 3HZ LYS 47 HZ3 LYS 47 -23.427 -0.419 -1.241 1129 H LEU 48 H LEU 48 -26.017 -7.029 2.298 1130 HA LEU 48 HA LEU 48 -26.641 -6.592 5.025 1131 1HB LEU 48 HB2 LEU 48 -25.375 -9.064 3.771 1132 2HB LEU 48 HB3 LEU 48 -26.230 -9.006 5.318 1133 HG LEU 48 HG LEU 48 -27.475 -8.509 2.569 1134 1HD1 LEU 48 HD11 LEU 48 -28.614 -10.645 2.976 1135 2HD1 LEU 48 HD12 LEU 48 -26.855 -10.860 2.991 1136 3HD1 LEU 48 HD13 LEU 48 -27.758 -10.829 4.521 1137 1HD2 LEU 48 HD21 LEU 48 -28.735 -8.570 5.350 1138 2HD2 LEU 48 HD22 LEU 48 -28.679 -7.180 4.240 1139 3HD2 LEU 48 HD23 LEU 48 -29.641 -8.601 3.822 1140 H GLN 49 H GLN 49 -23.528 -7.159 3.468 1141 HA GLN 49 HA GLN 49 -21.915 -7.530 5.767 1142 1HB GLN 49 HB2 GLN 49 -21.247 -6.317 3.062 1143 2HB GLN 49 HB3 GLN 49 -20.062 -6.750 4.304 1144 1HG GLN 49 HG2 GLN 49 -21.000 -9.129 4.234 1145 2HG GLN 49 HG3 GLN 49 -21.909 -8.649 2.801 1146 1HE2 GLN 49 HE22 GLN 49 -18.616 -8.832 4.195 1147 2HE2 GLN 49 HE21 GLN 49 -17.790 -9.026 2.646 1148 H ASP 50 H ASP 50 -23.530 -4.606 4.717 1149 HA ASP 50 HA ASP 50 -21.887 -2.613 5.774 1150 1HB ASP 50 HB2 ASP 50 -24.918 -2.896 5.915 1151 2HB ASP 50 HB3 ASP 50 -24.032 -1.438 6.369 1152 H ALA 51 H ALA 51 -23.844 -5.041 7.505 1153 HA ALA 51 HA ALA 51 -23.578 -3.995 10.152 1154 1HB ALA 51 HB1 ALA 51 -23.942 -6.331 10.845 1155 2HB ALA 51 HB2 ALA 51 -25.071 -5.856 9.559 1156 3HB ALA 51 HB3 ALA 51 -23.672 -6.883 9.178 1157 H GLU 52 H GLU 52 -21.401 -6.045 8.177 1158 HA GLU 52 HA GLU 52 -19.423 -6.469 10.258 1159 1HB GLU 52 HB2 GLU 52 -19.037 -6.538 7.228 1160 2HB GLU 52 HB3 GLU 52 -17.982 -7.221 8.461 1161 1HG GLU 52 HG2 GLU 52 -19.761 -8.815 9.126 1162 2HG GLU 52 HG3 GLU 52 -20.831 -8.163 7.875 1163 H ILE 53 H ILE 53 -19.902 -4.211 7.519 1164 HA ILE 53 HA ILE 53 -17.518 -2.754 7.913 1165 HB ILE 53 HB ILE 53 -20.115 -1.714 6.760 1166 1HG1 ILE 53 HG12 ILE 53 -19.479 -3.534 5.374 1167 2HG1 ILE 53 HG13 ILE 53 -18.868 -2.093 4.577 1168 1HG2 ILE 53 HG21 ILE 53 -18.615 -0.068 5.609 1169 2HG2 ILE 53 HG22 ILE 53 -18.717 0.160 7.354 1170 3HG2 ILE 53 HG23 ILE 53 -17.294 -0.626 6.658 1171 1HD1 ILE 53 HD11 ILE 53 -17.288 -4.191 6.106 1172 2HD1 ILE 53 HD12 ILE 53 -17.147 -3.726 4.407 1173 3HD1 ILE 53 HD13 ILE 53 -16.589 -2.620 5.668 1174 H VAL 54 H VAL 54 -20.727 -2.211 9.554 1175 HA VAL 54 HA VAL 54 -19.594 0.093 10.870 1176 HB VAL 54 HB VAL 54 -21.465 -0.035 12.484 1177 1HG1 VAL 54 HG11 VAL 54 -22.120 0.067 9.532 1178 2HG1 VAL 54 HG12 VAL 54 -23.025 0.871 10.833 1179 3HG1 VAL 54 HG13 VAL 54 -21.376 1.397 10.453 1180 1HG2 VAL 54 HG21 VAL 54 -22.016 -2.438 12.316 1181 2HG2 VAL 54 HG22 VAL 54 -23.397 -1.370 12.007 1182 3HG2 VAL 54 HG23 VAL 54 -22.573 -2.144 10.650 1183 H LYS 55 H LYS 55 -19.645 -3.364 11.808 1184 HA LYS 55 HA LYS 55 -18.527 -2.914 14.409 1185 1HB LYS 55 HB2 LYS 55 -19.415 -5.077 13.775 1186 2HB LYS 55 HB3 LYS 55 -18.228 -5.251 12.479 1187 1HG LYS 55 HG2 LYS 55 -17.672 -6.606 14.445 1188 2HG LYS 55 HG3 LYS 55 -16.400 -5.438 14.068 1189 1HD LYS 55 HD2 LYS 55 -17.097 -3.987 15.917 1190 2HD LYS 55 HD3 LYS 55 -18.562 -4.955 16.174 1191 1HE LYS 55 HE2 LYS 55 -16.863 -5.463 17.870 1192 2HE LYS 55 HE3 LYS 55 -17.187 -6.887 16.868 1193 1HZ LYS 55 HZ1 LYS 55 -14.903 -5.054 16.559 1194 2HZ LYS 55 HZ2 LYS 55 -14.858 -6.556 17.234 1195 3HZ LYS 55 HZ3 LYS 55 -15.198 -6.381 15.633 1196 H LEU 56 H LEU 56 -16.986 -3.548 11.259 1197 HA LEU 56 HA LEU 56 -14.280 -3.223 12.005 1198 1HB LEU 56 HB2 LEU 56 -14.811 -4.299 10.022 1199 2HB LEU 56 HB3 LEU 56 -15.842 -3.002 9.436 1200 HG LEU 56 HG LEU 56 -12.958 -2.295 9.846 1201 1HD1 LEU 56 HD11 LEU 56 -12.379 -3.222 7.615 1202 2HD1 LEU 56 HD12 LEU 56 -12.759 -4.509 8.777 1203 3HD1 LEU 56 HD13 LEU 56 -13.953 -4.038 7.547 1204 1HD2 LEU 56 HD21 LEU 56 -13.394 -1.048 7.789 1205 2HD2 LEU 56 HD22 LEU 56 -15.002 -1.794 7.628 1206 3HD2 LEU 56 HD23 LEU 56 -14.687 -0.663 8.940 1207 H MET 57 H MET 57 -16.660 -0.786 10.922 1208 HA MET 57 HA MET 57 -14.983 1.489 10.851 1209 1HB MET 57 HB2 MET 57 -17.277 1.462 9.945 1210 2HB MET 57 HB3 MET 57 -17.905 1.206 11.581 1211 1HG MET 57 HG2 MET 57 -17.016 3.427 12.260 1212 2HG MET 57 HG3 MET 57 -16.510 3.692 10.594 1213 1HE MET 57 HE1 MET 57 -20.846 3.622 12.180 1214 2HE MET 57 HE2 MET 57 -19.838 2.162 12.251 1215 3HE MET 57 HE3 MET 57 -19.375 3.603 13.180 1216 H ASP 58 H ASP 58 -16.997 0.095 13.511 1217 HA ASP 58 HA ASP 58 -16.203 1.944 15.489 1218 1HB ASP 58 HB2 ASP 58 -18.068 0.294 15.692 1219 2HB ASP 58 HB3 ASP 58 -16.868 -0.976 15.983 1220 H ASP 59 H ASP 59 -14.736 -1.218 14.590 1221 HA ASP 59 HA ASP 59 -12.584 -1.103 16.436 1222 1HB ASP 59 HB2 ASP 59 -12.540 -2.332 13.643 1223 2HB ASP 59 HB3 ASP 59 -11.406 -2.670 14.953 1224 H LEU 60 H LEU 60 -12.782 0.279 13.155 1225 HA LEU 60 HA LEU 60 -10.111 1.325 13.103 1226 1HB LEU 60 HB2 LEU 60 -12.694 1.855 11.615 1227 2HB LEU 60 HB3 LEU 60 -11.384 3.009 11.441 1228 HG LEU 60 HG LEU 60 -10.758 0.103 11.050 1229 1HD1 LEU 60 HD11 LEU 60 -12.770 0.473 9.656 1230 2HD1 LEU 60 HD12 LEU 60 -11.961 1.849 8.875 1231 3HD1 LEU 60 HD13 LEU 60 -11.315 0.221 8.665 1232 1HD2 LEU 60 HD21 LEU 60 -9.861 2.684 9.655 1233 2HD2 LEU 60 HD22 LEU 60 -8.966 1.899 10.978 1234 3HD2 LEU 60 HD23 LEU 60 -9.158 1.101 9.394 1235 H ASP 61 H ASP 61 -13.217 2.840 14.059 1236 HA ASP 61 HA ASP 61 -11.871 5.336 14.576 1237 1HB ASP 61 HB2 ASP 61 -13.966 6.253 15.080 1238 2HB ASP 61 HB3 ASP 61 -14.111 5.259 13.638 1239 H ARG 62 H ARG 62 -12.698 2.617 16.605 1240 HA ARG 62 HA ARG 62 -12.883 3.753 19.110 1241 1HB ARG 62 HB2 ARG 62 -13.149 1.371 18.557 1242 2HB ARG 62 HB3 ARG 62 -11.397 1.198 18.353 1243 1HG ARG 62 HG2 ARG 62 -11.146 1.856 20.801 1244 2HG ARG 62 HG3 ARG 62 -12.916 1.885 20.914 1245 1HD ARG 62 HD2 ARG 62 -11.132 -0.474 20.220 1246 2HD ARG 62 HD3 ARG 62 -12.060 -0.270 21.709 1247 HE ARG 62 HE ARG 62 -14.129 -0.271 20.253 1248 1HH1 ARG 62 HH21 ARG 62 -11.284 -2.222 19.309 1249 2HH1 ARG 62 HH22 ARG 62 -12.200 -3.115 18.117 1250 1HH2 ARG 62 HH12 ARG 62 -15.233 -1.462 18.671 1251 2HH2 ARG 62 HH11 ARG 62 -14.388 -2.715 17.782 1252 H ASN 63 H ASN 63 -9.961 3.048 17.270 1253 HA ASN 63 HA ASN 63 -7.996 3.477 19.190 1254 1HB ASN 63 HB2 ASN 63 -7.746 4.223 16.256 1255 2HB ASN 63 HB3 ASN 63 -6.437 3.818 17.385 1256 1HD2 ASN 63 HD22 ASN 63 -8.950 2.560 15.310 1257 2HD2 ASN 63 HD21 ASN 63 -8.813 0.874 15.721 1258 H LYS 64 H LYS 64 -9.912 5.908 17.497 1259 HA LYS 64 HA LYS 64 -8.908 7.886 19.426 1260 1HB LYS 64 HB2 LYS 64 -9.157 8.541 16.469 1261 2HB LYS 64 HB3 LYS 64 -8.892 9.704 17.764 1262 1HG LYS 64 HG2 LYS 64 -6.977 7.443 17.040 1263 2HG LYS 64 HG3 LYS 64 -6.875 9.099 16.440 1264 1HD LYS 64 HD2 LYS 64 -6.493 9.989 18.672 1265 2HD LYS 64 HD3 LYS 64 -6.751 8.398 19.402 1266 1HE LYS 64 HE2 LYS 64 -4.374 8.860 19.289 1267 2HE LYS 64 HE3 LYS 64 -4.787 7.477 18.269 1268 1HZ LYS 64 HZ1 LYS 64 -4.348 10.229 17.320 1269 2HZ LYS 64 HZ2 LYS 64 -3.274 8.983 17.202 1270 3HZ LYS 64 HZ3 LYS 64 -4.688 8.923 16.372 1271 H ASP 65 H ASP 65 -10.849 6.409 19.945 1272 HA ASP 65 HA ASP 65 -12.890 6.329 20.689 1273 1HB ASP 65 HB2 ASP 65 -14.094 8.361 21.343 1274 2HB ASP 65 HB3 ASP 65 -12.425 8.271 21.901 1275 H GLN 66 H GLN 66 -13.456 8.836 18.246 1276 HA GLN 66 HA GLN 66 -15.427 7.061 16.873 1277 1HB GLN 66 HB2 GLN 66 -15.996 9.835 17.980 1278 2HB GLN 66 HB3 GLN 66 -17.059 8.988 16.852 1279 1HG GLN 66 HG2 GLN 66 -16.354 7.898 19.618 1280 2HG GLN 66 HG3 GLN 66 -17.766 8.869 19.236 1281 1HE2 GLN 66 HE22 GLN 66 -16.201 5.704 18.474 1282 2HE2 GLN 66 HE21 GLN 66 -17.697 4.942 17.983 1283 H GLU 67 H GLU 67 -12.643 8.554 16.414 1284 HA GLU 67 HA GLU 67 -13.346 9.019 13.569 1285 1HB GLU 67 HB2 GLU 67 -11.448 10.803 15.162 1286 2HB GLU 67 HB3 GLU 67 -11.789 10.851 13.425 1287 1HG GLU 67 HG2 GLU 67 -14.290 11.186 14.158 1288 2HG GLU 67 HG3 GLU 67 -13.593 11.659 15.712 1289 H VAL 68 H VAL 68 -11.514 8.617 12.205 1290 HA VAL 68 HA VAL 68 -9.563 6.655 13.333 1291 HB VAL 68 HB VAL 68 -10.221 6.989 10.395 1292 1HG1 VAL 68 HG11 VAL 68 -9.309 4.589 12.022 1293 2HG1 VAL 68 HG12 VAL 68 -9.371 4.760 10.255 1294 3HG1 VAL 68 HG13 VAL 68 -8.208 5.708 11.198 1295 1HG2 VAL 68 HG21 VAL 68 -12.420 6.590 11.368 1296 2HG2 VAL 68 HG22 VAL 68 -11.820 5.153 10.543 1297 3HG2 VAL 68 HG23 VAL 68 -11.770 5.233 12.313 1298 H ASN 69 H ASN 69 -7.712 7.856 13.813 1299 HA ASN 69 HA ASN 69 -6.914 10.090 12.067 1300 1HB ASN 69 HB2 ASN 69 -6.588 10.367 14.422 1301 2HB ASN 69 HB3 ASN 69 -5.594 8.905 14.490 1302 1HD2 ASN 69 HD21 ASN 69 -5.798 12.056 12.639 1303 2HD2 ASN 69 HD22 ASN 69 -4.064 12.300 12.656 1304 H PHE 70 H PHE 70 -4.986 10.136 10.841 1305 HA PHE 70 HA PHE 70 -4.763 8.231 8.990 1306 1HB PHE 70 HB2 PHE 70 -3.794 10.403 8.729 1307 2HB PHE 70 HB3 PHE 70 -2.600 10.101 9.991 1308 HD1 PHE 70 HD1 PHE 70 -0.477 9.177 9.411 1309 HD2 PHE 70 HD2 PHE 70 -3.779 8.852 6.645 1310 HE1 PHE 70 HE1 PHE 70 0.963 7.955 7.835 1311 HE2 PHE 70 HE2 PHE 70 -2.328 7.625 5.067 1312 HZ PHE 70 HZ PHE 70 0.029 7.113 5.678 1313 H GLN 71 H GLN 71 -2.266 8.248 11.655 1314 HA GLN 71 HA GLN 71 -1.087 5.919 10.504 1315 1HB GLN 71 HB2 GLN 71 0.114 7.463 12.053 1316 2HB GLN 71 HB3 GLN 71 -0.793 6.755 13.411 1317 1HG GLN 71 HG2 GLN 71 0.119 4.506 12.835 1318 2HG GLN 71 HG3 GLN 71 0.931 5.193 11.418 1319 1HE2 GLN 71 HE22 GLN 71 2.786 4.000 12.544 1320 2HE2 GLN 71 HE21 GLN 71 3.633 4.917 13.784 1321 H GLU 72 H GLU 72 -3.659 6.313 12.924 1322 HA GLU 72 HA GLU 72 -3.785 3.576 13.755 1323 1HB GLU 72 HB2 GLU 72 -5.867 5.802 13.768 1324 2HB GLU 72 HB3 GLU 72 -6.128 4.184 14.411 1325 1HG GLU 72 HG2 GLU 72 -5.511 5.683 16.221 1326 2HG GLU 72 HG3 GLU 72 -4.273 4.441 16.000 1327 H TYR 73 H TYR 73 -5.368 5.402 11.103 1328 HA TYR 73 HA TYR 73 -6.876 3.246 10.002 1329 1HB TYR 73 HB2 TYR 73 -7.390 5.248 9.058 1330 2HB TYR 73 HB3 TYR 73 -5.748 5.815 8.958 1331 HD1 TYR 73 HD1 TYR 73 -4.358 5.422 7.004 1332 HD2 TYR 73 HD2 TYR 73 -8.341 3.773 7.309 1333 HE1 TYR 73 HE1 TYR 73 -4.444 5.175 4.559 1334 HE2 TYR 73 HE2 TYR 73 -8.464 3.656 4.834 1335 HH TYR 73 HH TYR 73 -5.893 4.908 2.740 1336 H ILE 74 H ILE 74 -3.484 4.256 9.242 1337 HA ILE 74 HA ILE 74 -2.989 2.112 7.448 1338 HB ILE 74 HB ILE 74 -0.991 3.479 9.288 1339 1HG1 ILE 74 HG12 ILE 74 -2.185 5.077 7.763 1340 2HG1 ILE 74 HG13 ILE 74 -0.452 4.984 7.558 1341 1HG2 ILE 74 HG21 ILE 74 0.047 1.495 8.523 1342 2HG2 ILE 74 HG22 ILE 74 -0.643 1.642 6.894 1343 3HG2 ILE 74 HG23 ILE 74 0.631 2.744 7.425 1344 1HD1 ILE 74 HD11 ILE 74 -2.484 3.631 5.745 1345 2HD1 ILE 74 HD12 ILE 74 -1.599 5.126 5.400 1346 3HD1 ILE 74 HD13 ILE 74 -0.712 3.610 5.527 1347 H THR 75 H THR 75 -2.425 2.273 10.966 1348 HA THR 75 HA THR 75 -1.349 -0.282 11.401 1349 HB THR 75 HB THR 75 -3.229 1.286 13.228 1350 HG1 THR 75 HG1 THR 75 -1.463 2.531 12.589 1351 1HG2 THR 75 HG21 THR 75 -1.134 -0.831 13.844 1352 2HG2 THR 75 HG22 THR 75 -1.964 0.174 15.046 1353 3HG2 THR 75 HG23 THR 75 -2.888 -0.985 14.075 1354 H PHE 76 H PHE 76 -4.804 0.752 11.420 1355 HA PHE 76 HA PHE 76 -5.854 -1.836 11.949 1356 1HB PHE 76 HB2 PHE 76 -7.178 0.223 12.201 1357 2HB PHE 76 HB3 PHE 76 -7.126 0.467 10.455 1358 HD1 PHE 76 HD1 PHE 76 -8.410 -1.034 8.917 1359 HD2 PHE 76 HD2 PHE 76 -8.496 -1.648 13.193 1360 HE1 PHE 76 HE1 PHE 76 -10.273 -2.606 8.653 1361 HE2 PHE 76 HE2 PHE 76 -10.249 -3.376 12.886 1362 HZ PHE 76 HZ PHE 76 -11.130 -3.874 10.613 1363 H LEU 77 H LEU 77 -5.210 -0.146 8.788 1364 HA LEU 77 HA LEU 77 -6.114 -2.356 7.204 1365 1HB LEU 77 HB2 LEU 77 -4.104 -0.151 6.671 1366 2HB LEU 77 HB3 LEU 77 -4.459 -1.402 5.477 1367 HG LEU 77 HG LEU 77 -6.606 0.392 6.696 1368 1HD1 LEU 77 HD11 LEU 77 -5.030 1.760 5.426 1369 2HD1 LEU 77 HD12 LEU 77 -5.102 0.618 4.058 1370 3HD1 LEU 77 HD13 LEU 77 -6.535 1.560 4.504 1371 1HD2 LEU 77 HD21 LEU 77 -7.888 -0.349 4.646 1372 2HD2 LEU 77 HD22 LEU 77 -6.587 -1.502 4.291 1373 3HD2 LEU 77 HD23 LEU 77 -7.572 -1.671 5.760 1374 H GLY 78 H GLY 78 -3.012 -1.764 8.846 1375 1HA GLY 78 HA2 GLY 78 -1.649 -4.077 7.937 1376 2HA GLY 78 HA3 GLY 78 -1.441 -3.311 9.532 1377 H ALA 79 H ALA 79 -3.823 -3.696 10.788 1378 HA ALA 79 HA ALA 79 -3.803 -6.433 11.536 1379 1HB ALA 79 HB1 ALA 79 -6.094 -4.448 11.875 1380 2HB ALA 79 HB2 ALA 79 -4.698 -4.624 12.964 1381 3HB ALA 79 HB3 ALA 79 -5.851 -5.960 12.769 1382 H LEU 80 H LEU 80 -5.981 -4.717 9.282 1383 HA LEU 80 HA LEU 80 -7.674 -6.837 8.574 1384 1HB LEU 80 HB2 LEU 80 -7.741 -4.289 7.953 1385 2HB LEU 80 HB3 LEU 80 -6.664 -4.729 6.636 1386 HG LEU 80 HG LEU 80 -8.447 -6.438 5.934 1387 1HD1 LEU 80 HD11 LEU 80 -10.132 -4.700 7.803 1388 2HD1 LEU 80 HD12 LEU 80 -10.775 -5.859 6.628 1389 3HD1 LEU 80 HD13 LEU 80 -9.829 -6.438 8.011 1390 1HD2 LEU 80 HD21 LEU 80 -9.754 -4.687 4.764 1391 2HD2 LEU 80 HD22 LEU 80 -9.141 -3.468 5.895 1392 3HD2 LEU 80 HD23 LEU 80 -8.029 -4.279 4.762 1393 H ALA 81 H ALA 81 -4.572 -5.788 7.130 1394 HA ALA 81 HA ALA 81 -4.367 -7.818 5.151 1395 1HB ALA 81 HB1 ALA 81 -3.013 -5.858 4.982 1396 2HB ALA 81 HB2 ALA 81 -2.279 -6.131 6.569 1397 3HB ALA 81 HB3 ALA 81 -1.930 -7.250 5.241 1398 H MET 82 H MET 82 -3.277 -7.722 8.564 1399 HA MET 82 HA MET 82 -1.962 -10.235 8.492 1400 1HB MET 82 HB2 MET 82 -1.776 -8.400 10.243 1401 2HB MET 82 HB3 MET 82 -3.303 -8.965 10.925 1402 1HG MET 82 HG2 MET 82 -0.846 -10.726 10.557 1403 2HG MET 82 HG3 MET 82 -1.179 -9.790 12.018 1404 1HE MET 82 HE1 MET 82 -1.724 -13.465 13.189 1405 2HE MET 82 HE2 MET 82 -0.823 -11.953 13.457 1406 3HE MET 82 HE3 MET 82 -0.551 -12.906 11.973 1407 H ILE 83 H ILE 83 -5.298 -9.330 9.316 1408 HA ILE 83 HA ILE 83 -6.281 -11.949 9.886 1409 HB ILE 83 HB ILE 83 -7.638 -9.424 8.882 1410 1HG1 ILE 83 HG12 ILE 83 -7.846 -10.824 11.580 1411 2HG1 ILE 83 HG13 ILE 83 -6.598 -9.627 11.252 1412 1HG2 ILE 83 HG21 ILE 83 -9.799 -10.537 9.465 1413 2HG2 ILE 83 HG22 ILE 83 -8.923 -12.062 9.704 1414 3HG2 ILE 83 HG23 ILE 83 -9.004 -11.305 8.099 1415 1HD1 ILE 83 HD11 ILE 83 -8.332 -7.936 10.704 1416 2HD1 ILE 83 HD12 ILE 83 -8.427 -8.538 12.367 1417 3HD1 ILE 83 HD13 ILE 83 -9.593 -9.102 11.164 1418 H TYR 84 H TYR 84 -5.921 -10.149 6.792 1419 HA TYR 84 HA TYR 84 -6.794 -12.419 5.182 1420 1HB TYR 84 HB2 TYR 84 -5.086 -10.051 4.374 1421 2HB TYR 84 HB3 TYR 84 -5.943 -11.156 3.305 1422 HD1 TYR 84 HD1 TYR 84 -8.561 -11.009 5.301 1423 HD2 TYR 84 HD2 TYR 84 -6.100 -8.211 3.115 1424 HE1 TYR 84 HE1 TYR 84 -10.493 -9.503 5.039 1425 HE2 TYR 84 HE2 TYR 84 -8.052 -6.725 2.831 1426 HH TYR 84 HH TYR 84 -10.307 -6.444 3.205 1427 H ASN 85 H ASN 85 -5.250 -13.705 6.858 1428 HA ASN 85 HA ASN 85 -2.580 -14.176 6.280 1429 1HB ASN 85 HB2 ASN 85 -2.894 -16.442 7.028 1430 2HB ASN 85 HB3 ASN 85 -3.838 -15.334 8.029 1431 1HD2 ASN 85 HD22 ASN 85 -4.053 -17.848 5.453 1432 2HD2 ASN 85 HD21 ASN 85 -5.799 -18.035 5.610 1433 H GLU 86 H GLU 86 -5.397 -15.020 4.293 1434 HA GLU 86 HA GLU 86 -4.164 -16.653 2.340 1435 1HB GLU 86 HB2 GLU 86 -6.395 -14.577 2.074 1436 2HB GLU 86 HB3 GLU 86 -5.904 -15.700 0.807 1437 1HG GLU 86 HG2 GLU 86 -7.843 -16.612 1.888 1438 2HG GLU 86 HG3 GLU 86 -6.448 -17.635 2.251 1439 H ALA 87 H ALA 87 -4.263 -13.080 2.670 1440 HA ALA 87 HA ALA 87 -2.877 -12.586 0.158 1441 1HB ALA 87 HB1 ALA 87 -4.414 -10.916 1.164 1442 2HB ALA 87 HB2 ALA 87 -3.307 -10.743 2.547 1443 3HB ALA 87 HB3 ALA 87 -2.774 -10.284 0.922 1444 H LEU 88 H LEU 88 -2.026 -12.792 3.645 1445 HA LEU 88 HA LEU 88 0.719 -12.132 3.420 1446 1HB LEU 88 HB2 LEU 88 -0.422 -14.266 5.249 1447 2HB LEU 88 HB3 LEU 88 1.124 -13.452 5.395 1448 HG LEU 88 HG LEU 88 -1.607 -12.176 5.774 1449 1HD1 LEU 88 HD11 LEU 88 -0.617 -13.712 7.569 1450 2HD1 LEU 88 HD12 LEU 88 0.723 -12.551 7.696 1451 3HD1 LEU 88 HD13 LEU 88 -0.925 -12.060 8.096 1452 1HD2 LEU 88 HD21 LEU 88 -0.311 -10.166 6.503 1453 2HD2 LEU 88 HD22 LEU 88 1.162 -10.903 5.838 1454 3HD2 LEU 88 HD23 LEU 88 -0.198 -10.478 4.770 1455 H LYS 89 H LYS 89 -0.776 -15.393 3.083 1456 HA LYS 89 HA LYS 89 1.715 -16.641 2.291 1457 1HB LYS 89 HB2 LYS 89 -1.207 -17.431 2.195 1458 2HB LYS 89 HB3 LYS 89 -0.029 -18.322 1.230 1459 1HG LYS 89 HG2 LYS 89 -0.287 -19.463 3.318 1460 2HG LYS 89 HG3 LYS 89 1.345 -18.796 3.189 1461 1HD LYS 89 HD2 LYS 89 0.633 -16.883 4.666 1462 2HD LYS 89 HD3 LYS 89 -0.977 -17.604 4.780 1463 1HE LYS 89 HE2 LYS 89 0.282 -18.168 6.773 1464 2HE LYS 89 HE3 LYS 89 0.047 -19.645 5.825 1465 1HZ LYS 89 HZ1 LYS 89 2.489 -17.997 5.870 1466 2HZ LYS 89 HZ2 LYS 89 2.279 -19.430 6.647 1467 3HZ LYS 89 HZ3 LYS 89 2.290 -19.378 5.003 1468 H GLY 90 H GLY 90 -1.050 -15.314 0.414 1469 1HA GLY 90 HA2 GLY 90 -1.168 -14.560 -1.735 1470 2HA GLY 90 HA3 GLY 90 0.589 -14.330 -1.686 Start of MODEL 14 1 1H MET 1 H1 MET 1 -15.443 -0.570 -5.456 2 2H MET 1 H2 MET 1 -14.298 -0.889 -4.321 3 3H MET 1 H3 MET 1 -15.220 -2.118 -4.941 4 HA MET 1 HA MET 1 -14.244 -1.744 -7.117 5 1HB MET 1 HB2 MET 1 -12.339 0.052 -5.554 6 2HB MET 1 HB3 MET 1 -12.214 -0.387 -7.266 7 1HG MET 1 HG2 MET 1 -14.301 0.804 -7.750 8 2HG MET 1 HG3 MET 1 -14.502 1.194 -6.036 9 1HE MET 1 HE1 MET 1 -13.795 4.692 -7.498 10 2HE MET 1 HE2 MET 1 -14.711 3.376 -8.276 11 3HE MET 1 HE3 MET 1 -14.893 3.679 -6.530 12 H ALA 2 H ALA 2 -12.688 -1.856 -3.969 13 HA ALA 2 HA ALA 2 -11.628 -3.388 -2.758 14 1HB ALA 2 HB1 ALA 2 -11.698 -5.742 -3.296 15 2HB ALA 2 HB2 ALA 2 -13.278 -5.010 -3.598 16 3HB ALA 2 HB3 ALA 2 -12.213 -5.414 -4.958 17 H SER 3 H SER 3 -10.868 -4.145 -6.051 18 HA SER 3 HA SER 3 -8.327 -4.959 -6.045 19 1HB SER 3 HB2 SER 3 -9.142 -3.115 -8.292 20 2HB SER 3 HB3 SER 3 -8.330 -4.676 -8.316 21 HG SER 3 HG SER 3 -11.095 -4.150 -7.799 22 HA PRO 4 HA PRO 4 -6.474 -0.576 -6.613 23 1HB PRO 4 HB2 PRO 4 -8.369 1.146 -5.005 24 2HB PRO 4 HB3 PRO 4 -7.456 1.568 -6.480 25 1HG PRO 4 HG2 PRO 4 -10.100 1.006 -6.639 26 2HG PRO 4 HG3 PRO 4 -8.981 0.307 -7.849 27 1HD PRO 4 HD2 PRO 4 -10.037 -0.995 -5.326 28 2HD PRO 4 HD3 PRO 4 -10.070 -1.631 -6.989 29 H LEU 5 H LEU 5 -8.226 -0.973 -3.468 30 HA LEU 5 HA LEU 5 -5.820 -0.121 -2.033 31 1HB LEU 5 HB2 LEU 5 -8.024 0.407 -1.112 32 2HB LEU 5 HB3 LEU 5 -8.416 -1.318 -1.014 33 HG LEU 5 HG LEU 5 -6.593 -1.674 0.615 34 1HD1 LEU 5 HD11 LEU 5 -4.951 0.043 -0.047 35 2HD1 LEU 5 HD12 LEU 5 -6.106 1.338 0.368 36 3HD1 LEU 5 HD13 LEU 5 -5.452 0.266 1.624 37 1HD2 LEU 5 HD21 LEU 5 -8.330 0.699 1.375 38 2HD2 LEU 5 HD22 LEU 5 -8.813 -1.017 1.447 39 3HD2 LEU 5 HD23 LEU 5 -7.505 -0.423 2.484 40 H ASP 6 H ASP 6 -7.620 -3.131 -2.704 41 HA ASP 6 HA ASP 6 -6.198 -4.936 -1.149 42 1HB ASP 6 HB2 ASP 6 -7.431 -5.327 -3.900 43 2HB ASP 6 HB3 ASP 6 -6.799 -6.639 -2.901 44 H GLN 7 H GLN 7 -5.331 -3.845 -4.515 45 HA GLN 7 HA GLN 7 -3.045 -5.558 -4.614 46 1HB GLN 7 HB2 GLN 7 -2.335 -4.323 -6.525 47 2HB GLN 7 HB3 GLN 7 -4.090 -4.521 -6.575 48 1HG GLN 7 HG2 GLN 7 -4.198 -2.157 -5.529 49 2HG GLN 7 HG3 GLN 7 -2.483 -2.005 -5.915 50 1HE2 GLN 7 HE22 GLN 7 -5.628 -2.884 -7.343 51 2HE2 GLN 7 HE21 GLN 7 -5.307 -2.196 -8.946 52 H ALA 8 H ALA 8 -3.489 -2.340 -3.141 53 HA ALA 8 HA ALA 8 -0.649 -1.803 -2.930 54 1HB ALA 8 HB1 ALA 8 -3.059 -0.517 -1.611 55 2HB ALA 8 HB2 ALA 8 -1.375 0.006 -1.405 56 3HB ALA 8 HB3 ALA 8 -2.109 0.027 -3.019 57 H ILE 9 H ILE 9 -3.198 -2.838 -0.546 58 HA ILE 9 HA ILE 9 -1.265 -3.283 1.554 59 HB ILE 9 HB ILE 9 -2.948 -4.620 2.682 60 1HG1 ILE 9 HG12 ILE 9 -4.612 -4.301 0.188 61 2HG1 ILE 9 HG13 ILE 9 -3.977 -5.822 0.847 62 1HG2 ILE 9 HG21 ILE 9 -4.132 -2.091 1.494 63 2HG2 ILE 9 HG22 ILE 9 -4.483 -2.809 3.082 64 3HG2 ILE 9 HG23 ILE 9 -2.891 -2.134 2.766 65 1HD1 ILE 9 HD11 ILE 9 -6.108 -4.055 2.100 66 2HD1 ILE 9 HD12 ILE 9 -6.281 -5.687 1.442 67 3HD1 ILE 9 HD13 ILE 9 -5.335 -5.436 2.922 68 H GLY 10 H GLY 10 -2.563 -5.364 -1.030 69 1HA GLY 10 HA2 GLY 10 -1.220 -7.755 -0.675 70 2HA GLY 10 HA3 GLY 10 -1.564 -6.992 -2.235 71 H LEU 11 H LEU 11 0.060 -4.749 -2.232 72 HA LEU 11 HA LEU 11 2.558 -5.747 -2.954 73 1HB LEU 11 HB2 LEU 11 1.398 -3.468 -3.480 74 2HB LEU 11 HB3 LEU 11 2.092 -2.909 -1.965 75 HG LEU 11 HG LEU 11 3.461 -2.132 -3.699 76 1HD1 LEU 11 HD11 LEU 11 4.645 -3.003 -1.695 77 2HD1 LEU 11 HD12 LEU 11 5.028 -4.466 -2.650 78 3HD1 LEU 11 HD13 LEU 11 5.595 -2.876 -3.187 79 1HD2 LEU 11 HD21 LEU 11 2.718 -3.627 -5.473 80 2HD2 LEU 11 HD22 LEU 11 4.483 -3.475 -5.423 81 3HD2 LEU 11 HD23 LEU 11 3.706 -4.946 -4.799 82 H LEU 12 H LEU 12 1.802 -3.864 0.017 83 HA LEU 12 HA LEU 12 4.295 -4.125 1.328 84 1HB LEU 12 HB2 LEU 12 1.415 -3.960 2.368 85 2HB LEU 12 HB3 LEU 12 2.796 -4.094 3.452 86 HG LEU 12 HG LEU 12 3.770 -2.047 2.542 87 1HD1 LEU 12 HD11 LEU 12 2.680 -1.913 0.305 88 2HD1 LEU 12 HD12 LEU 12 1.099 -1.717 1.104 89 3HD1 LEU 12 HD13 LEU 12 2.339 -0.467 1.250 90 1HD2 LEU 12 HD21 LEU 12 2.460 -1.960 4.580 91 2HD2 LEU 12 HD22 LEU 12 2.147 -0.502 3.641 92 3HD2 LEU 12 HD23 LEU 12 0.948 -1.812 3.657 93 H ILE 13 H ILE 13 1.461 -6.307 1.422 94 HA ILE 13 HA ILE 13 2.622 -8.117 3.307 95 HB ILE 13 HB ILE 13 0.432 -8.464 1.221 96 1HG1 ILE 13 HG12 ILE 13 0.122 -8.244 4.243 97 2HG1 ILE 13 HG13 ILE 13 0.197 -6.803 3.238 98 1HG2 ILE 13 HG21 ILE 13 1.276 -10.332 3.473 99 2HG2 ILE 13 HG22 ILE 13 -0.265 -10.450 2.601 100 3HG2 ILE 13 HG23 ILE 13 1.248 -10.697 1.735 101 1HD1 ILE 13 HD11 ILE 13 -1.924 -8.959 3.182 102 2HD1 ILE 13 HD12 ILE 13 -2.092 -7.215 3.460 103 3HD1 ILE 13 HD13 ILE 13 -1.714 -7.808 1.842 104 H GLY 14 H GLY 14 2.546 -8.140 -0.260 105 1HA GLY 14 HA2 GLY 14 3.854 -10.601 -0.709 106 2HA GLY 14 HA3 GLY 14 3.824 -9.209 -1.810 107 H ILE 15 H ILE 15 5.195 -7.237 -0.574 108 HA ILE 15 HA ILE 15 7.924 -7.923 -0.933 109 HB ILE 15 HB ILE 15 6.380 -5.601 0.179 110 1HG1 ILE 15 HG12 ILE 15 8.624 -5.945 -1.864 111 2HG1 ILE 15 HG13 ILE 15 6.886 -5.913 -2.220 112 1HG2 ILE 15 HG21 ILE 15 8.443 -4.392 0.828 113 2HG2 ILE 15 HG22 ILE 15 8.056 -5.726 1.883 114 3HG2 ILE 15 HG23 ILE 15 9.360 -5.909 0.675 115 1HD1 ILE 15 HD11 ILE 15 6.897 -3.552 -1.145 116 2HD1 ILE 15 HD12 ILE 15 8.663 -3.662 -1.255 117 3HD1 ILE 15 HD13 ILE 15 7.689 -3.735 -2.728 118 H PHE 16 H PHE 16 6.049 -7.471 2.057 119 HA PHE 16 HA PHE 16 8.078 -8.072 3.889 120 1HB PHE 16 HB2 PHE 16 5.928 -7.055 4.425 121 2HB PHE 16 HB3 PHE 16 5.063 -8.510 3.988 122 HD1 PHE 16 HD1 PHE 16 7.281 -6.962 6.516 123 HD2 PHE 16 HD2 PHE 16 4.994 -10.462 5.448 124 HE1 PHE 16 HE1 PHE 16 7.316 -7.712 8.881 125 HE2 PHE 16 HE2 PHE 16 5.066 -11.219 7.781 126 HZ PHE 16 HZ PHE 16 6.146 -9.801 9.518 127 H HIS 17 H HIS 17 5.503 -10.348 2.753 128 HA HIS 17 HA HIS 17 6.785 -12.414 4.226 129 1HB HIS 17 HB2 HIS 17 4.265 -12.137 3.687 130 2HB HIS 17 HB3 HIS 17 4.641 -12.992 2.186 131 HD1 HIS 17 HD1 HIS 17 4.238 -15.571 2.577 132 HD2 HIS 17 HD2 HIS 17 5.429 -13.451 6.012 133 HE1 HIS 17 HE1 HIS 17 4.365 -17.268 4.485 134 H LYS 18 H LYS 18 7.167 -11.342 0.902 135 HA LYS 18 HA LYS 18 8.452 -13.701 -0.108 136 1HB LYS 18 HB2 LYS 18 7.799 -11.782 -1.494 137 2HB LYS 18 HB3 LYS 18 9.008 -10.757 -0.691 138 1HG LYS 18 HG2 LYS 18 10.786 -12.380 -1.518 139 2HG LYS 18 HG3 LYS 18 9.525 -13.218 -2.425 140 1HD LYS 18 HD2 LYS 18 10.446 -10.316 -2.731 141 2HD LYS 18 HD3 LYS 18 10.753 -11.640 -3.859 142 1HE LYS 18 HE2 LYS 18 8.056 -10.337 -3.249 143 2HE LYS 18 HE3 LYS 18 8.993 -10.215 -4.741 144 1HZ LYS 18 HZ1 LYS 18 7.239 -11.788 -4.957 145 2HZ LYS 18 HZ2 LYS 18 8.687 -12.567 -5.061 146 3HZ LYS 18 HZ3 LYS 18 7.790 -12.672 -3.682 147 H TYR 19 H TYR 19 9.659 -10.812 1.702 148 HA TYR 19 HA TYR 19 12.332 -11.821 1.917 149 1HB TYR 19 HB2 TYR 19 10.804 -9.558 3.115 150 2HB TYR 19 HB3 TYR 19 12.192 -10.136 4.027 151 HD1 TYR 19 HD1 TYR 19 11.231 -8.727 0.728 152 HD2 TYR 19 HD2 TYR 19 14.440 -9.988 3.319 153 HE1 TYR 19 HE1 TYR 19 12.885 -7.773 -0.841 154 HE2 TYR 19 HE2 TYR 19 16.083 -9.152 1.683 155 HH TYR 19 HH TYR 19 16.096 -7.234 -0.036 156 H SER 20 H SER 20 9.555 -12.070 4.258 157 HA SER 20 HA SER 20 10.847 -13.651 6.163 158 1HB SER 20 HB2 SER 20 8.041 -14.124 5.115 159 2HB SER 20 HB3 SER 20 8.691 -14.625 6.669 160 HG SER 20 HG SER 20 8.842 -12.491 7.304 161 H GLY 21 H GLY 21 9.215 -14.796 3.203 162 1HA GLY 21 HA2 GLY 21 9.688 -17.532 3.343 163 2HA GLY 21 HA3 GLY 21 9.479 -16.589 1.856 164 H LYS 22 H LYS 22 11.784 -14.946 1.991 165 HA LYS 22 HA LYS 22 13.714 -16.410 0.719 166 1HB LYS 22 HB2 LYS 22 13.522 -13.895 0.965 167 2HB LYS 22 HB3 LYS 22 14.391 -14.045 2.510 168 1HG LYS 22 HG2 LYS 22 16.280 -15.149 1.308 169 2HG LYS 22 HG3 LYS 22 15.436 -14.924 -0.221 170 1HD LYS 22 HD2 LYS 22 16.410 -12.741 1.692 171 2HD LYS 22 HD3 LYS 22 17.169 -13.197 0.169 172 1HE LYS 22 HE2 LYS 22 14.461 -11.842 0.535 173 2HE LYS 22 HE3 LYS 22 15.935 -11.159 -0.164 174 1HZ LYS 22 HZ1 LYS 22 14.416 -11.807 -1.852 175 2HZ LYS 22 HZ2 LYS 22 15.765 -12.753 -1.937 176 3HZ LYS 22 HZ3 LYS 22 14.367 -13.359 -1.302 177 H GLU 23 H GLU 23 13.361 -16.091 4.255 178 HA GLU 23 HA GLU 23 15.487 -18.184 4.575 179 1HB GLU 23 HB2 GLU 23 16.047 -17.128 6.751 180 2HB GLU 23 HB3 GLU 23 16.492 -16.166 5.338 181 1HG GLU 23 HG2 GLU 23 14.586 -14.680 5.648 182 2HG GLU 23 HG3 GLU 23 13.948 -15.701 6.943 183 H GLY 24 H GLY 24 12.594 -18.432 4.166 184 1HA GLY 24 HA2 GLY 24 10.801 -19.557 5.005 185 2HA GLY 24 HA3 GLY 24 12.024 -20.559 5.802 186 H ASP 25 H ASP 25 11.342 -17.127 6.515 187 HA ASP 25 HA ASP 25 10.928 -17.804 9.341 188 1HB ASP 25 HB2 ASP 25 12.336 -15.879 8.518 189 2HB ASP 25 HB3 ASP 25 10.851 -15.081 7.978 190 H LYS 26 H LYS 26 9.053 -16.860 10.488 191 HA LYS 26 HA LYS 26 6.515 -17.467 9.131 192 1HB LYS 26 HB2 LYS 26 5.504 -17.154 11.313 193 2HB LYS 26 HB3 LYS 26 6.918 -18.194 11.433 194 1HG LYS 26 HG2 LYS 26 8.270 -16.320 12.325 195 2HG LYS 26 HG3 LYS 26 6.877 -15.230 12.173 196 1HD LYS 26 HD2 LYS 26 5.593 -16.654 13.747 197 2HD LYS 26 HD3 LYS 26 6.989 -17.743 13.895 198 1HE LYS 26 HE2 LYS 26 8.359 -15.864 14.787 199 2HE LYS 26 HE3 LYS 26 6.965 -14.775 14.640 200 1HZ LYS 26 HZ1 LYS 26 5.802 -16.161 16.196 201 2HZ LYS 26 HZ2 LYS 26 7.098 -17.172 16.329 202 3HZ LYS 26 HZ3 LYS 26 7.212 -15.612 16.848 203 H HIS 27 H HIS 27 4.844 -15.474 10.368 204 HA HIS 27 HA HIS 27 5.188 -13.359 8.444 205 1HB HIS 27 HB2 HIS 27 3.215 -13.585 10.736 206 2HB HIS 27 HB3 HIS 27 3.101 -12.490 9.353 207 HD1 HIS 27 HD1 HIS 27 3.975 -15.164 7.308 208 HD2 HIS 27 HD2 HIS 27 0.779 -14.558 10.007 209 HE1 HIS 27 HE1 HIS 27 2.133 -16.736 6.623 210 H THR 28 H THR 28 7.468 -13.000 9.495 211 HA THR 28 HA THR 28 7.465 -10.539 11.004 212 HB THR 28 HB THR 28 7.249 -12.476 12.693 213 HG1 THR 28 HG1 THR 28 8.973 -10.354 12.725 214 1HG2 THR 28 HG21 THR 28 10.193 -12.878 12.083 215 2HG2 THR 28 HG22 THR 28 9.196 -13.738 13.263 216 3HG2 THR 28 HG23 THR 28 8.905 -13.974 11.525 217 H LEU 29 H LEU 29 9.747 -9.722 11.054 218 HA LEU 29 HA LEU 29 11.616 -11.077 9.165 219 1HB LEU 29 HB2 LEU 29 11.020 -8.092 9.278 220 2HB LEU 29 HB3 LEU 29 12.293 -8.836 8.315 221 HG LEU 29 HG LEU 29 9.309 -9.374 7.925 222 1HD1 LEU 29 HD11 LEU 29 9.854 -7.019 7.452 223 2HD1 LEU 29 HD12 LEU 29 11.232 -7.525 6.450 224 3HD1 LEU 29 HD13 LEU 29 9.573 -7.900 5.937 225 1HD2 LEU 29 HD21 LEU 29 11.750 -10.003 6.226 226 2HD2 LEU 29 HD22 LEU 29 10.745 -11.199 7.067 227 3HD2 LEU 29 HD23 LEU 29 10.064 -10.253 5.738 228 H SER 30 H SER 30 13.797 -10.773 9.690 229 HA SER 30 HA SER 30 14.375 -9.806 12.438 230 1HB SER 30 HB2 SER 30 16.474 -11.100 12.145 231 2HB SER 30 HB3 SER 30 15.045 -12.105 11.896 232 HG SER 30 HG SER 30 15.370 -12.053 9.706 233 H LYS 31 H LYS 31 16.826 -8.964 12.499 234 HA LYS 31 HA LYS 31 16.539 -6.311 11.671 235 1HB LYS 31 HB2 LYS 31 18.955 -7.959 12.620 236 2HB LYS 31 HB3 LYS 31 19.022 -6.214 12.372 237 1HG LYS 31 HG2 LYS 31 17.168 -5.941 14.011 238 2HG LYS 31 HG3 LYS 31 17.185 -7.673 14.335 239 1HD LYS 31 HD2 LYS 31 19.367 -7.617 15.265 240 2HD LYS 31 HD3 LYS 31 19.732 -6.016 14.605 241 1HE LYS 31 HE2 LYS 31 17.553 -6.477 16.681 242 2HE LYS 31 HE3 LYS 31 19.235 -6.108 17.096 243 1HZ LYS 31 HZ1 LYS 31 17.935 -4.139 17.057 244 2HZ LYS 31 HZ2 LYS 31 19.030 -4.079 15.828 245 3HZ LYS 31 HZ3 LYS 31 17.443 -4.407 15.513 246 H LYS 32 H LYS 32 19.130 -8.502 10.562 247 HA LYS 32 HA LYS 32 19.933 -6.720 8.463 248 1HB LYS 32 HB2 LYS 32 21.491 -8.262 9.403 249 2HB LYS 32 HB3 LYS 32 20.509 -9.668 8.919 250 1HG LYS 32 HG2 LYS 32 20.881 -9.110 6.533 251 2HG LYS 32 HG3 LYS 32 21.829 -7.685 7.005 252 1HD LYS 32 HD2 LYS 32 23.463 -9.172 8.152 253 2HD LYS 32 HD3 LYS 32 22.515 -10.592 7.684 254 1HE LYS 32 HE2 LYS 32 23.835 -8.621 5.750 255 2HE LYS 32 HE3 LYS 32 24.465 -10.215 6.189 256 1HZ LYS 32 HZ1 LYS 32 21.926 -9.706 4.803 257 2HZ LYS 32 HZ2 LYS 32 23.303 -10.307 4.137 258 3HZ LYS 32 HZ3 LYS 32 22.482 -11.187 5.258 259 H GLU 33 H GLU 33 17.633 -9.417 8.602 260 HA GLU 33 HA GLU 33 17.135 -9.753 5.821 261 1HB GLU 33 HB2 GLU 33 16.424 -11.250 7.645 262 2HB GLU 33 HB3 GLU 33 15.332 -9.985 8.248 263 1HG GLU 33 HG2 GLU 33 14.041 -10.151 6.111 264 2HG GLU 33 HG3 GLU 33 15.124 -11.457 5.593 265 H LEU 34 H LEU 34 15.595 -7.604 8.303 266 HA LEU 34 HA LEU 34 13.865 -6.302 6.483 267 1HB LEU 34 HB2 LEU 34 13.501 -6.235 8.858 268 2HB LEU 34 HB3 LEU 34 15.047 -5.457 9.166 269 HG LEU 34 HG LEU 34 13.063 -4.006 9.382 270 1HD1 LEU 34 HD11 LEU 34 15.451 -3.198 8.743 271 2HD1 LEU 34 HD12 LEU 34 14.747 -2.834 7.165 272 3HD1 LEU 34 HD13 LEU 34 14.102 -2.067 8.605 273 1HD2 LEU 34 HD21 LEU 34 11.894 -3.167 7.373 274 2HD2 LEU 34 HD22 LEU 34 12.860 -4.209 6.345 275 3HD2 LEU 34 HD23 LEU 34 11.730 -4.928 7.513 276 H LYS 35 H LYS 35 17.201 -5.419 7.621 277 HA LYS 35 HA LYS 35 17.315 -3.059 6.080 278 1HB LYS 35 HB2 LYS 35 19.013 -3.785 7.780 279 2HB LYS 35 HB3 LYS 35 19.712 -4.881 6.563 280 1HG LYS 35 HG2 LYS 35 20.094 -2.955 5.045 281 2HG LYS 35 HG3 LYS 35 19.264 -1.889 6.190 282 1HD LYS 35 HD2 LYS 35 21.094 -2.586 7.887 283 2HD LYS 35 HD3 LYS 35 21.982 -3.206 6.487 284 1HE LYS 35 HE2 LYS 35 20.960 -0.352 6.930 285 2HE LYS 35 HE3 LYS 35 22.652 -0.879 6.990 286 1HZ LYS 35 HZ1 LYS 35 22.495 -1.444 4.670 287 2HZ LYS 35 HZ2 LYS 35 20.936 -0.909 4.611 288 3HZ LYS 35 HZ3 LYS 35 22.157 0.149 4.921 289 H GLU 36 H GLU 36 18.004 -6.416 5.102 290 HA GLU 36 HA GLU 36 18.835 -5.876 2.445 291 1HB GLU 36 HB2 GLU 36 19.031 -8.005 3.878 292 2HB GLU 36 HB3 GLU 36 17.389 -8.381 3.378 293 1HG GLU 36 HG2 GLU 36 18.169 -8.274 0.967 294 2HG GLU 36 HG3 GLU 36 19.804 -7.941 1.553 295 H LEU 37 H LEU 37 15.579 -6.417 3.850 296 HA LEU 37 HA LEU 37 14.066 -6.223 1.439 297 1HB LEU 37 HB2 LEU 37 13.117 -6.934 3.545 298 2HB LEU 37 HB3 LEU 37 13.322 -5.348 4.259 299 HG LEU 37 HG LEU 37 11.603 -5.733 1.799 300 1HD1 LEU 37 HD11 LEU 37 10.797 -5.882 4.738 301 2HD1 LEU 37 HD12 LEU 37 9.686 -5.895 3.361 302 3HD1 LEU 37 HD13 LEU 37 10.805 -7.244 3.582 303 1HD2 LEU 37 HD21 LEU 37 11.704 -3.618 4.025 304 2HD2 LEU 37 HD22 LEU 37 12.053 -3.351 2.303 305 3HD2 LEU 37 HD23 LEU 37 10.420 -3.730 2.812 306 H ILE 38 H ILE 38 15.120 -3.661 3.702 307 HA ILE 38 HA ILE 38 14.010 -1.569 2.117 308 HB ILE 38 HB ILE 38 16.154 -1.539 4.260 309 1HG1 ILE 38 HG12 ILE 38 13.172 -0.812 4.152 310 2HG1 ILE 38 HG13 ILE 38 13.864 -2.254 4.915 311 1HG2 ILE 38 HG21 ILE 38 16.456 0.462 2.779 312 2HG2 ILE 38 HG22 ILE 38 14.730 0.837 2.983 313 3HG2 ILE 38 HG23 ILE 38 15.842 0.903 4.359 314 1HD1 ILE 38 HD11 ILE 38 13.408 -0.745 6.632 315 2HD1 ILE 38 HD12 ILE 38 15.177 -0.650 6.418 316 3HD1 ILE 38 HD13 ILE 38 14.117 0.625 5.752 317 H GLN 39 H GLN 39 17.396 -2.856 2.121 318 HA GLN 39 HA GLN 39 18.300 -0.935 0.199 319 1HB GLN 39 HB2 GLN 39 19.268 -3.785 0.698 320 2HB GLN 39 HB3 GLN 39 20.087 -2.598 -0.328 321 1HG GLN 39 HG2 GLN 39 19.660 -2.367 2.676 322 2HG GLN 39 HG3 GLN 39 21.173 -2.678 1.829 323 1HE2 GLN 39 HE22 GLN 39 18.776 -0.226 2.688 324 2HE2 GLN 39 HE21 GLN 39 19.744 1.144 2.176 325 H LYS 40 H LYS 40 16.628 -4.100 -0.287 326 HA LYS 40 HA LYS 40 16.916 -3.944 -3.154 327 1HB LYS 40 HB2 LYS 40 16.495 -5.958 -1.845 328 2HB LYS 40 HB3 LYS 40 14.854 -5.434 -1.477 329 1HG LYS 40 HG2 LYS 40 16.035 -5.997 -4.247 330 2HG LYS 40 HG3 LYS 40 15.100 -7.147 -3.295 331 1HD LYS 40 HD2 LYS 40 14.028 -4.573 -4.537 332 2HD LYS 40 HD3 LYS 40 13.748 -6.216 -5.071 333 1HE LYS 40 HE2 LYS 40 12.559 -6.763 -2.992 334 2HE LYS 40 HE3 LYS 40 12.836 -5.126 -2.369 335 1HZ LYS 40 HZ1 LYS 40 11.320 -5.774 -4.788 336 2HZ LYS 40 HZ2 LYS 40 10.685 -5.347 -3.327 337 3HZ LYS 40 HZ3 LYS 40 11.577 -4.263 -4.179 338 H GLU 41 H GLU 41 14.195 -3.138 -0.933 339 HA GLU 41 HA GLU 41 12.557 -2.330 -3.135 340 1HB GLU 41 HB2 GLU 41 11.588 -3.332 -1.145 341 2HB GLU 41 HB3 GLU 41 12.202 -2.021 -0.125 342 1HG GLU 41 HG2 GLU 41 9.782 -1.809 -0.658 343 2HG GLU 41 HG3 GLU 41 10.714 -0.411 -1.151 344 H LEU 42 H LEU 42 14.314 -0.467 -0.671 345 HA LEU 42 HA LEU 42 13.671 2.102 -2.078 346 1HB LEU 42 HB2 LEU 42 14.277 1.662 0.867 347 2HB LEU 42 HB3 LEU 42 13.880 3.192 0.081 348 HG LEU 42 HG LEU 42 12.021 0.803 0.479 349 1HD1 LEU 42 HD11 LEU 42 12.042 3.572 1.747 350 2HD1 LEU 42 HD12 LEU 42 10.847 2.292 2.042 351 3HD1 LEU 42 HD13 LEU 42 12.531 2.059 2.540 352 1HD2 LEU 42 HD21 LEU 42 11.478 3.533 -0.786 353 2HD2 LEU 42 HD22 LEU 42 11.368 1.948 -1.584 354 3HD2 LEU 42 HD23 LEU 42 10.226 2.368 -0.309 355 H THR 43 H THR 43 15.540 1.333 -3.439 356 HA THR 43 HA THR 43 18.109 0.961 -2.167 357 HB THR 43 HB THR 43 17.573 1.453 -5.116 358 HG1 THR 43 HG1 THR 43 17.138 -0.885 -3.574 359 1HG2 THR 43 HG21 THR 43 19.567 -0.333 -3.632 360 2HG2 THR 43 HG22 THR 43 19.412 -0.170 -5.393 361 3HG2 THR 43 HG23 THR 43 19.960 1.211 -4.423 362 H ILE 44 H ILE 44 17.740 3.163 -0.992 363 HA ILE 44 HA ILE 44 18.123 5.579 -2.400 364 HB ILE 44 HB ILE 44 18.687 6.631 -0.373 365 1HG1 ILE 44 HG12 ILE 44 20.320 5.246 0.693 366 2HG1 ILE 44 HG13 ILE 44 18.985 5.573 1.780 367 1HG2 ILE 44 HG21 ILE 44 16.351 6.029 -0.743 368 2HG2 ILE 44 HG22 ILE 44 16.557 4.538 0.190 369 3HG2 ILE 44 HG23 ILE 44 16.748 6.110 0.979 370 1HD1 ILE 44 HD11 ILE 44 19.490 2.937 0.336 371 2HD1 ILE 44 HD12 ILE 44 19.720 3.299 2.049 372 3HD1 ILE 44 HD13 ILE 44 18.083 3.278 1.376 373 H GLY 45 H GLY 45 19.826 6.424 -3.462 374 1HA GLY 45 HA2 GLY 45 22.300 5.057 -3.783 375 2HA GLY 45 HA3 GLY 45 21.957 6.733 -4.249 376 H SER 46 H SER 46 21.224 7.502 -1.479 377 HA SER 46 HA SER 46 23.845 8.338 -0.603 378 1HB SER 46 HB2 SER 46 21.737 9.713 -0.484 379 2HB SER 46 HB3 SER 46 21.179 8.648 0.823 380 HG SER 46 HG SER 46 22.187 10.374 1.730 381 H LYS 47 H LYS 47 24.531 5.949 -0.446 382 HA LYS 47 HA LYS 47 23.750 4.355 1.775 383 1HB LYS 47 HB2 LYS 47 26.504 4.486 0.481 384 2HB LYS 47 HB3 LYS 47 25.857 3.173 1.473 385 1HG LYS 47 HG2 LYS 47 24.943 4.002 -1.311 386 2HG LYS 47 HG3 LYS 47 25.719 2.497 -0.816 387 1HD LYS 47 HD2 LYS 47 23.679 1.983 0.611 388 2HD LYS 47 HD3 LYS 47 22.911 3.434 -0.073 389 1HE LYS 47 HE2 LYS 47 23.233 2.476 -2.368 390 2HE LYS 47 HE3 LYS 47 23.802 0.970 -1.612 391 1HZ LYS 47 HZ1 LYS 47 21.190 2.253 -1.243 392 2HZ LYS 47 HZ2 LYS 47 21.480 0.881 -2.115 393 3HZ LYS 47 HZ3 LYS 47 21.673 0.866 -0.473 394 H LEU 48 H LEU 48 25.568 7.297 1.775 395 HA LEU 48 HA LEU 48 26.908 7.149 4.257 396 1HB LEU 48 HB2 LEU 48 25.314 9.469 3.088 397 2HB LEU 48 HB3 LEU 48 26.545 9.591 4.349 398 HG LEU 48 HG LEU 48 27.043 8.733 1.455 399 1HD1 LEU 48 HD11 LEU 48 27.745 11.295 2.944 400 2HD1 LEU 48 HD12 LEU 48 28.179 10.899 1.266 401 3HD1 LEU 48 HD13 LEU 48 26.477 11.119 1.709 402 1HD2 LEU 48 HD21 LEU 48 28.979 9.171 3.778 403 2HD2 LEU 48 HD22 LEU 48 28.676 7.638 2.925 404 3HD2 LEU 48 HD23 LEU 48 29.454 8.978 2.077 405 H GLN 49 H GLN 49 23.457 7.345 3.533 406 HA GLN 49 HA GLN 49 22.746 7.893 6.340 407 1HB GLN 49 HB2 GLN 49 21.075 7.424 3.849 408 2HB GLN 49 HB3 GLN 49 20.423 7.800 5.446 409 1HG GLN 49 HG2 GLN 49 21.590 9.948 5.502 410 2HG GLN 49 HG3 GLN 49 22.420 9.587 3.987 411 1HE2 GLN 49 HE22 GLN 49 19.021 9.757 5.260 412 2HE2 GLN 49 HE21 GLN 49 18.396 10.514 3.801 413 H ASP 50 H ASP 50 24.005 5.153 5.085 414 HA ASP 50 HA ASP 50 22.294 3.056 5.716 415 1HB ASP 50 HB2 ASP 50 24.245 1.745 6.224 416 2HB ASP 50 HB3 ASP 50 24.543 2.721 4.786 417 H ALA 51 H ALA 51 24.276 5.003 7.925 418 HA ALA 51 HA ALA 51 23.713 3.911 10.416 419 1HB ALA 51 HB1 ALA 51 24.037 6.193 11.276 420 2HB ALA 51 HB2 ALA 51 25.219 5.782 10.012 421 3HB ALA 51 HB3 ALA 51 23.848 6.844 9.629 422 H GLU 52 H GLU 52 21.650 6.139 8.496 423 HA GLU 52 HA GLU 52 19.598 6.379 10.526 424 1HB GLU 52 HB2 GLU 52 19.401 6.938 7.537 425 2HB GLU 52 HB3 GLU 52 18.303 7.481 8.807 426 1HG GLU 52 HG2 GLU 52 20.152 8.787 9.855 427 2HG GLU 52 HG3 GLU 52 21.240 8.304 8.542 428 H ILE 53 H ILE 53 20.129 4.382 7.586 429 HA ILE 53 HA ILE 53 17.624 3.025 7.733 430 HB ILE 53 HB ILE 53 20.222 1.859 6.696 431 1HG1 ILE 53 HG12 ILE 53 19.827 3.909 5.480 432 2HG1 ILE 53 HG13 ILE 53 19.454 2.526 4.463 433 1HG2 ILE 53 HG21 ILE 53 18.657 0.453 5.320 434 2HG2 ILE 53 HG22 ILE 53 18.551 0.132 7.056 435 3HG2 ILE 53 HG23 ILE 53 17.302 1.092 6.272 436 1HD1 ILE 53 HD11 ILE 53 17.012 2.883 4.916 437 2HD1 ILE 53 HD12 ILE 53 17.431 4.320 5.878 438 3HD1 ILE 53 HD13 ILE 53 17.794 4.272 4.147 439 H VAL 54 H VAL 54 20.778 2.186 9.336 440 HA VAL 54 HA VAL 54 19.571 -0.140 10.523 441 HB VAL 54 HB VAL 54 21.455 -0.244 12.091 442 1HG1 VAL 54 HG11 VAL 54 22.105 -0.083 9.135 443 2HG1 VAL 54 HG12 VAL 54 23.036 -0.971 10.360 444 3HG1 VAL 54 HG13 VAL 54 21.386 -1.479 9.975 445 1HG2 VAL 54 HG21 VAL 54 22.624 2.020 10.478 446 2HG2 VAL 54 HG22 VAL 54 22.097 2.145 12.177 447 3HG2 VAL 54 HG23 VAL 54 23.441 1.080 11.732 448 H LYS 55 H LYS 55 19.848 3.248 11.681 449 HA LYS 55 HA LYS 55 18.736 2.745 14.249 450 1HB LYS 55 HB2 LYS 55 19.730 4.886 13.644 451 2HB LYS 55 HB3 LYS 55 18.480 5.173 12.431 452 1HG LYS 55 HG2 LYS 55 18.103 6.471 14.471 453 2HG LYS 55 HG3 LYS 55 16.758 5.374 14.139 454 1HD LYS 55 HD2 LYS 55 17.490 3.833 15.889 455 2HD LYS 55 HD3 LYS 55 19.025 4.704 16.075 456 1HE LYS 55 HE2 LYS 55 17.481 5.245 17.900 457 2HE LYS 55 HE3 LYS 55 17.814 6.686 16.924 458 1HZ LYS 55 HZ1 LYS 55 15.718 6.331 15.819 459 2HZ LYS 55 HZ2 LYS 55 15.423 4.982 16.716 460 3HZ LYS 55 HZ3 LYS 55 15.497 6.458 17.447 461 H LEU 56 H LEU 56 17.121 3.563 11.162 462 HA LEU 56 HA LEU 56 14.433 3.347 11.994 463 1HB LEU 56 HB2 LEU 56 14.888 4.379 9.976 464 2HB LEU 56 HB3 LEU 56 15.893 3.073 9.365 465 HG LEU 56 HG LEU 56 13.014 2.405 9.872 466 1HD1 LEU 56 HD11 LEU 56 13.988 4.056 7.498 467 2HD1 LEU 56 HD12 LEU 56 12.412 3.253 7.612 468 3HD1 LEU 56 HD13 LEU 56 12.811 4.576 8.730 469 1HD2 LEU 56 HD21 LEU 56 14.665 0.701 8.960 470 2HD2 LEU 56 HD22 LEU 56 13.344 1.102 7.862 471 3HD2 LEU 56 HD23 LEU 56 14.976 1.787 7.607 472 H MET 57 H MET 57 16.645 0.806 10.763 473 HA MET 57 HA MET 57 14.798 -1.341 10.815 474 1HB MET 57 HB2 MET 57 16.861 -1.507 9.623 475 2HB MET 57 HB3 MET 57 17.805 -1.196 11.076 476 1HG MET 57 HG2 MET 57 16.020 -3.615 10.968 477 2HG MET 57 HG3 MET 57 17.602 -3.634 10.183 478 1HE MET 57 HE1 MET 57 19.563 -2.034 12.172 479 2HE MET 57 HE2 MET 57 20.108 -3.421 13.130 480 3HE MET 57 HE3 MET 57 19.896 -3.592 11.371 481 H ASP 58 H ASP 58 17.099 -0.166 13.311 482 HA ASP 58 HA ASP 58 16.422 -1.990 15.336 483 1HB ASP 58 HB2 ASP 58 18.310 -0.452 15.536 484 2HB ASP 58 HB3 ASP 58 17.202 0.920 15.704 485 H ASP 59 H ASP 59 15.000 1.230 14.637 486 HA ASP 59 HA ASP 59 12.991 1.206 16.601 487 1HB ASP 59 HB2 ASP 59 12.774 2.412 13.807 488 2HB ASP 59 HB3 ASP 59 11.781 2.815 15.209 489 H LEU 60 H LEU 60 12.776 -0.034 13.231 490 HA LEU 60 HA LEU 60 10.139 -1.026 13.310 491 1HB LEU 60 HB2 LEU 60 12.641 -1.718 11.789 492 2HB LEU 60 HB3 LEU 60 11.334 -2.890 11.735 493 HG LEU 60 HG LEU 60 10.720 0.002 11.185 494 1HD1 LEU 60 HD11 LEU 60 12.651 -0.428 9.748 495 2HD1 LEU 60 HD12 LEU 60 11.877 -1.915 9.150 496 3HD1 LEU 60 HD13 LEU 60 11.167 -0.343 8.770 497 1HD2 LEU 60 HD21 LEU 60 9.065 -1.065 9.619 498 2HD2 LEU 60 HD22 LEU 60 9.707 -2.656 10.012 499 3HD2 LEU 60 HD23 LEU 60 8.873 -1.705 11.271 500 H ASP 61 H ASP 61 13.149 -2.892 14.085 501 HA ASP 61 HA ASP 61 11.478 -5.119 14.912 502 1HB ASP 61 HB2 ASP 61 13.373 -6.341 15.255 503 2HB ASP 61 HB3 ASP 61 13.736 -5.345 13.851 504 H ARG 62 H ARG 62 12.800 -2.434 16.688 505 HA ARG 62 HA ARG 62 13.055 -3.532 19.201 506 1HB ARG 62 HB2 ARG 62 13.658 -1.194 18.526 507 2HB ARG 62 HB3 ARG 62 11.950 -0.758 18.547 508 1HG ARG 62 HG2 ARG 62 13.211 -0.024 20.545 509 2HG ARG 62 HG3 ARG 62 11.867 -1.089 20.970 510 1HD ARG 62 HD2 ARG 62 14.065 -1.508 22.203 511 2HD ARG 62 HD3 ARG 62 13.293 -2.901 21.437 512 HE ARG 62 HE ARG 62 15.364 -1.436 19.883 513 1HH1 ARG 62 HH22 ARG 62 14.811 -4.205 22.003 514 2HH1 ARG 62 HH21 ARG 62 15.652 -5.337 20.966 515 1HH2 ARG 62 HH12 ARG 62 16.764 -2.833 18.718 516 2HH2 ARG 62 HH11 ARG 62 16.904 -4.511 19.190 517 H ASN 63 H ASN 63 10.114 -2.552 17.551 518 HA ASN 63 HA ASN 63 8.167 -2.667 19.507 519 1HB ASN 63 HB2 ASN 63 8.026 -3.764 16.668 520 2HB ASN 63 HB3 ASN 63 6.637 -3.522 17.741 521 1HD2 ASN 63 HD22 ASN 63 8.970 -1.870 15.678 522 2HD2 ASN 63 HD21 ASN 63 8.275 -0.278 15.891 523 H LYS 64 H LYS 64 9.854 -5.442 18.071 524 HA LYS 64 HA LYS 64 8.928 -7.000 20.382 525 1HB LYS 64 HB2 LYS 64 7.405 -7.697 18.647 526 2HB LYS 64 HB3 LYS 64 8.724 -8.082 17.552 527 1HG LYS 64 HG2 LYS 64 7.644 -10.038 18.638 528 2HG LYS 64 HG3 LYS 64 9.383 -9.977 18.918 529 1HD LYS 64 HD2 LYS 64 9.010 -9.090 21.195 530 2HD LYS 64 HD3 LYS 64 7.257 -9.021 20.897 531 1HE LYS 64 HE2 LYS 64 7.220 -11.488 20.637 532 2HE LYS 64 HE3 LYS 64 8.983 -11.546 20.846 533 1HZ LYS 64 HZ1 LYS 64 7.063 -10.612 22.857 534 2HZ LYS 64 HZ2 LYS 64 7.841 -12.065 22.861 535 3HZ LYS 64 HZ3 LYS 64 8.701 -10.671 23.038 536 H ASP 65 H ASP 65 11.055 -5.629 20.392 537 HA ASP 65 HA ASP 65 13.124 -5.610 21.010 538 1HB ASP 65 HB2 ASP 65 13.851 -7.351 22.482 539 2HB ASP 65 HB3 ASP 65 12.118 -7.073 22.668 540 H GLN 66 H GLN 66 12.793 -7.741 18.338 541 HA GLN 66 HA GLN 66 15.582 -7.486 17.639 542 1HB GLN 66 HB2 GLN 66 15.437 -9.377 19.503 543 2HB GLN 66 HB3 GLN 66 14.660 -10.318 18.249 544 1HG GLN 66 HG2 GLN 66 17.002 -10.851 18.293 545 2HG GLN 66 HG3 GLN 66 16.690 -9.973 16.796 546 1HE2 GLN 66 HE22 GLN 66 16.715 -7.797 19.558 547 2HE2 GLN 66 HE21 GLN 66 18.402 -7.347 19.401 548 H GLU 67 H GLU 67 12.468 -9.121 17.112 549 HA GLU 67 HA GLU 67 12.967 -9.028 14.160 550 1HB GLU 67 HB2 GLU 67 11.362 -10.922 15.915 551 2HB GLU 67 HB3 GLU 67 10.910 -10.632 14.234 552 1HG GLU 67 HG2 GLU 67 12.290 -12.654 14.475 553 2HG GLU 67 HG3 GLU 67 12.981 -11.457 13.384 554 H VAL 68 H VAL 68 11.341 -8.054 12.943 555 HA VAL 68 HA VAL 68 9.330 -6.425 14.458 556 HB VAL 68 HB VAL 68 10.687 -5.114 12.899 557 1HG1 VAL 68 HG11 VAL 68 10.554 -5.318 10.513 558 2HG1 VAL 68 HG12 VAL 68 11.236 -6.797 11.196 559 3HG1 VAL 68 HG13 VAL 68 9.544 -6.764 10.628 560 1HG2 VAL 68 HG21 VAL 68 8.831 -4.026 11.759 561 2HG2 VAL 68 HG22 VAL 68 7.809 -5.453 11.983 562 3HG2 VAL 68 HG23 VAL 68 8.344 -4.508 13.389 563 H ASN 69 H ASN 69 7.268 -7.228 14.507 564 HA ASN 69 HA ASN 69 6.665 -9.622 12.871 565 1HB ASN 69 HB2 ASN 69 4.862 -8.235 14.877 566 2HB ASN 69 HB3 ASN 69 4.693 -9.864 14.226 567 1HD2 ASN 69 HD21 ASN 69 7.613 -10.616 14.606 568 2HD2 ASN 69 HD22 ASN 69 7.762 -10.754 16.341 569 H PHE 70 H PHE 70 4.646 -9.746 11.622 570 HA PHE 70 HA PHE 70 4.492 -7.925 9.634 571 1HB PHE 70 HB2 PHE 70 3.415 -10.079 9.507 572 2HB PHE 70 HB3 PHE 70 2.243 -9.634 10.742 573 HD1 PHE 70 HD1 PHE 70 3.532 -8.458 7.400 574 HD2 PHE 70 HD2 PHE 70 0.160 -8.695 10.085 575 HE1 PHE 70 HE1 PHE 70 2.138 -7.269 5.751 576 HE2 PHE 70 HE2 PHE 70 -1.202 -7.448 8.475 577 HZ PHE 70 HZ PHE 70 -0.213 -6.690 6.303 578 H GLN 71 H GLN 71 1.980 -7.729 12.263 579 HA GLN 71 HA GLN 71 0.951 -5.363 11.081 580 1HB GLN 71 HB2 GLN 71 -0.305 -6.814 12.652 581 2HB GLN 71 HB3 GLN 71 0.643 -6.147 14.001 582 1HG GLN 71 HG2 GLN 71 -0.192 -3.870 13.453 583 2HG GLN 71 HG3 GLN 71 -1.026 -4.510 12.026 584 1HE2 GLN 71 HE22 GLN 71 -2.948 -3.416 13.026 585 2HE2 GLN 71 HE21 GLN 71 -3.781 -4.289 14.305 586 H GLU 72 H GLU 72 3.623 -5.834 13.346 587 HA GLU 72 HA GLU 72 3.851 -3.097 14.227 588 1HB GLU 72 HB2 GLU 72 6.027 -5.205 13.972 589 2HB GLU 72 HB3 GLU 72 6.093 -3.723 14.920 590 1HG GLU 72 HG2 GLU 72 4.268 -4.513 16.367 591 2HG GLU 72 HG3 GLU 72 4.103 -6.000 15.426 592 H TYR 73 H TYR 73 5.280 -5.029 11.576 593 HA TYR 73 HA TYR 73 6.810 -2.989 10.330 594 1HB TYR 73 HB2 TYR 73 7.258 -5.128 9.615 595 2HB TYR 73 HB3 TYR 73 5.589 -5.591 9.454 596 HD1 TYR 73 HD1 TYR 73 8.415 -3.944 7.785 597 HD2 TYR 73 HD2 TYR 73 4.282 -5.153 7.444 598 HE1 TYR 73 HE1 TYR 73 8.584 -3.841 5.320 599 HE2 TYR 73 HE2 TYR 73 4.437 -4.957 4.984 600 HH TYR 73 HH TYR 73 7.449 -4.009 3.317 601 H ILE 74 H ILE 74 3.375 -3.954 9.690 602 HA ILE 74 HA ILE 74 2.906 -1.894 7.786 603 HB ILE 74 HB ILE 74 0.921 -3.134 9.725 604 1HG1 ILE 74 HG12 ILE 74 2.008 -4.825 8.253 605 2HG1 ILE 74 HG13 ILE 74 0.282 -4.645 8.010 606 1HG2 ILE 74 HG21 ILE 74 -0.735 -2.436 7.867 607 2HG2 ILE 74 HG22 ILE 74 -0.116 -1.169 8.927 608 3HG2 ILE 74 HG23 ILE 74 0.543 -1.360 7.290 609 1HD1 ILE 74 HD11 ILE 74 1.400 -4.897 5.860 610 2HD1 ILE 74 HD12 ILE 74 0.699 -3.288 5.960 611 3HD1 ILE 74 HD13 ILE 74 2.454 -3.522 6.209 612 H THR 75 H THR 75 2.346 -1.830 11.325 613 HA THR 75 HA THR 75 1.340 0.789 11.542 614 HB THR 75 HB THR 75 3.116 -0.709 13.527 615 HG1 THR 75 HG1 THR 75 1.332 -1.931 12.969 616 1HG2 THR 75 HG21 THR 75 1.089 1.534 13.920 617 2HG2 THR 75 HG22 THR 75 1.848 0.596 15.221 618 3HG2 THR 75 HG23 THR 75 2.841 1.641 14.190 619 H PHE 76 H PHE 76 4.737 -0.376 11.659 620 HA PHE 76 HA PHE 76 5.917 2.182 12.020 621 1HB PHE 76 HB2 PHE 76 7.109 0.041 12.383 622 2HB PHE 76 HB3 PHE 76 7.078 -0.251 10.643 623 HD1 PHE 76 HD1 PHE 76 8.455 1.169 9.091 624 HD2 PHE 76 HD2 PHE 76 8.526 1.820 13.362 625 HE1 PHE 76 HE1 PHE 76 10.404 2.638 8.836 626 HE2 PHE 76 HE2 PHE 76 10.408 3.407 13.072 627 HZ PHE 76 HZ PHE 76 11.319 3.859 10.799 628 H LEU 77 H LEU 77 5.121 0.342 8.977 629 HA LEU 77 HA LEU 77 6.115 2.386 7.243 630 1HB LEU 77 HB2 LEU 77 3.943 0.305 6.870 631 2HB LEU 77 HB3 LEU 77 4.398 1.439 5.599 632 HG LEU 77 HG LEU 77 6.410 -0.415 6.949 633 1HD1 LEU 77 HD11 LEU 77 6.248 -1.745 4.867 634 2HD1 LEU 77 HD12 LEU 77 4.744 -1.786 5.811 635 3HD1 LEU 77 HD13 LEU 77 4.863 -0.772 4.347 636 1HD2 LEU 77 HD21 LEU 77 6.493 1.221 4.369 637 2HD2 LEU 77 HD22 LEU 77 7.488 1.498 5.818 638 3HD2 LEU 77 HD23 LEU 77 7.719 0.037 4.861 639 H GLY 78 H GLY 78 3.028 2.117 9.000 640 1HA GLY 78 HA2 GLY 78 1.795 4.463 7.965 641 2HA GLY 78 HA3 GLY 78 1.584 3.821 9.609 642 H ALA 79 H ALA 79 4.011 4.106 10.789 643 HA ALA 79 HA ALA 79 4.243 6.884 11.365 644 1HB ALA 79 HB1 ALA 79 6.381 4.750 11.750 645 2HB ALA 79 HB2 ALA 79 6.283 6.324 12.554 646 3HB ALA 79 HB3 ALA 79 5.045 5.093 12.870 647 H LEU 80 H LEU 80 6.131 4.849 9.132 648 HA LEU 80 HA LEU 80 7.976 6.784 8.279 649 1HB LEU 80 HB2 LEU 80 7.876 4.196 7.881 650 2HB LEU 80 HB3 LEU 80 6.853 4.596 6.502 651 HG LEU 80 HG LEU 80 8.727 6.052 5.635 652 1HD1 LEU 80 HD11 LEU 80 10.244 4.704 7.915 653 2HD1 LEU 80 HD12 LEU 80 11.027 5.499 6.537 654 3HD1 LEU 80 HD13 LEU 80 10.058 6.452 7.664 655 1HD2 LEU 80 HD21 LEU 80 10.056 4.114 4.838 656 2HD2 LEU 80 HD22 LEU 80 9.369 3.110 6.129 657 3HD2 LEU 80 HD23 LEU 80 8.326 3.736 4.826 658 H ALA 81 H ALA 81 4.753 5.902 7.001 659 HA ALA 81 HA ALA 81 4.621 7.777 4.883 660 1HB ALA 81 HB1 ALA 81 3.071 5.967 5.025 661 2HB ALA 81 HB2 ALA 81 2.432 6.541 6.567 662 3HB ALA 81 HB3 ALA 81 2.179 7.506 5.105 663 H MET 82 H MET 82 3.705 8.127 8.374 664 HA MET 82 HA MET 82 2.888 10.873 8.133 665 1HB MET 82 HB2 MET 82 4.040 9.410 10.546 666 2HB MET 82 HB3 MET 82 3.373 11.046 10.555 667 1HG MET 82 HG2 MET 82 1.239 10.099 9.596 668 2HG MET 82 HG3 MET 82 1.872 8.486 9.959 669 1HE MET 82 HE1 MET 82 3.344 9.032 12.781 670 2HE MET 82 HE2 MET 82 2.020 8.667 13.905 671 3HE MET 82 HE3 MET 82 2.281 7.629 12.485 672 H ILE 83 H ILE 83 6.098 9.455 8.803 673 HA ILE 83 HA ILE 83 7.468 11.937 9.103 674 HB ILE 83 HB ILE 83 8.415 9.188 8.233 675 1HG1 ILE 83 HG12 ILE 83 8.914 10.755 10.804 676 2HG1 ILE 83 HG13 ILE 83 7.545 9.662 10.615 677 1HG2 ILE 83 HG21 ILE 83 10.733 10.026 8.618 678 2HG2 ILE 83 HG22 ILE 83 9.971 10.814 7.248 679 3HG2 ILE 83 HG23 ILE 83 10.091 11.670 8.800 680 1HD1 ILE 83 HD11 ILE 83 9.101 7.776 10.147 681 2HD1 ILE 83 HD12 ILE 83 10.474 8.853 10.490 682 3HD1 ILE 83 HD13 ILE 83 9.297 8.488 11.757 683 H TYR 84 H TYR 84 6.805 9.971 6.170 684 HA TYR 84 HA TYR 84 7.842 11.996 4.325 685 1HB TYR 84 HB2 TYR 84 5.874 9.729 3.852 686 2HB TYR 84 HB3 TYR 84 6.776 10.611 2.621 687 HD1 TYR 84 HD1 TYR 84 9.479 10.381 4.469 688 HD2 TYR 84 HD2 TYR 84 6.576 7.668 2.781 689 HE1 TYR 84 HE1 TYR 84 11.212 8.645 4.284 690 HE2 TYR 84 HE2 TYR 84 8.343 5.933 2.563 691 HH TYR 84 HH TYR 84 11.721 6.516 3.569 692 H ASN 85 H ASN 85 6.376 13.504 5.998 693 HA ASN 85 HA ASN 85 3.632 13.401 5.772 694 1HB ASN 85 HB2 ASN 85 4.948 14.769 7.450 695 2HB ASN 85 HB3 ASN 85 5.130 16.007 6.195 696 1HD2 ASN 85 HD22 ASN 85 2.618 13.948 7.769 697 2HD2 ASN 85 HD21 ASN 85 1.319 15.136 7.671 698 H GLU 86 H GLU 86 5.857 14.911 3.538 699 HA GLU 86 HA GLU 86 4.223 16.492 1.923 700 1HB GLU 86 HB2 GLU 86 6.297 14.499 0.892 701 2HB GLU 86 HB3 GLU 86 5.715 15.974 0.120 702 1HG GLU 86 HG2 GLU 86 7.623 16.849 0.966 703 2HG GLU 86 HG3 GLU 86 6.651 17.081 2.420 704 H ALA 87 H ALA 87 4.473 12.913 2.029 705 HA ALA 87 HA ALA 87 2.798 12.413 -0.255 706 1HB ALA 87 HB1 ALA 87 2.717 10.133 0.581 707 2HB ALA 87 HB2 ALA 87 4.375 10.748 0.722 708 3HB ALA 87 HB3 ALA 87 3.339 10.637 2.164 709 H LEU 88 H LEU 88 2.184 12.945 3.233 710 HA LEU 88 HA LEU 88 -0.617 12.175 3.083 711 1HB LEU 88 HB2 LEU 88 0.734 13.872 5.211 712 2HB LEU 88 HB3 LEU 88 -0.821 13.069 5.279 713 HG LEU 88 HG LEU 88 1.944 11.897 5.520 714 1HD1 LEU 88 HD11 LEU 88 -0.706 11.519 6.995 715 2HD1 LEU 88 HD12 LEU 88 0.800 10.705 7.406 716 3HD1 LEU 88 HD13 LEU 88 0.689 12.473 7.551 717 1HD2 LEU 88 HD21 LEU 88 -0.469 10.232 4.744 718 2HD2 LEU 88 HD22 LEU 88 1.034 10.429 3.810 719 3HD2 LEU 88 HD23 LEU 88 1.064 9.611 5.366 720 H LYS 89 H LYS 89 1.218 15.240 2.920 721 HA LYS 89 HA LYS 89 -1.060 16.962 2.619 722 1HB LYS 89 HB2 LYS 89 1.730 17.235 1.418 723 2HB LYS 89 HB3 LYS 89 0.491 18.493 1.474 724 1HG LYS 89 HG2 LYS 89 0.499 18.364 3.977 725 2HG LYS 89 HG3 LYS 89 1.826 17.195 3.894 726 1HD LYS 89 HD2 LYS 89 3.179 18.883 2.601 727 2HD LYS 89 HD3 LYS 89 1.861 20.052 2.820 728 1HE LYS 89 HE2 LYS 89 2.115 19.792 5.317 729 2HE LYS 89 HE3 LYS 89 3.498 18.721 5.029 730 1HZ LYS 89 HZ1 LYS 89 3.312 21.525 4.187 731 2HZ LYS 89 HZ2 LYS 89 4.188 20.947 5.458 732 3HZ LYS 89 HZ3 LYS 89 4.594 20.522 3.918 733 H GLY 90 H GLY 90 0.858 15.068 0.269 734 1HA GLY 90 HA2 GLY 90 -0.340 15.781 -2.137 735 2HA GLY 90 HA3 GLY 90 0.291 14.173 -1.751 736 1H MET 1 H1 MET 1 15.713 -0.164 -5.702 737 2H MET 1 H2 MET 1 15.856 1.009 -6.838 738 3H MET 1 H3 MET 1 15.625 -0.559 -7.306 739 HA MET 1 HA MET 1 13.646 0.708 -7.580 740 1HB MET 1 HB2 MET 1 13.331 -1.200 -5.237 741 2HB MET 1 HB3 MET 1 12.085 -0.717 -6.390 742 1HG MET 1 HG2 MET 1 13.466 -1.791 -8.207 743 2HG MET 1 HG3 MET 1 14.543 -2.408 -6.936 744 1HE MET 1 HE1 MET 1 14.246 -4.857 -7.812 745 2HE MET 1 HE2 MET 1 12.663 -5.622 -8.090 746 3HE MET 1 HE3 MET 1 13.179 -4.255 -9.108 747 H ALA 2 H ALA 2 11.698 1.442 -6.306 748 HA ALA 2 HA ALA 2 11.892 2.565 -3.707 749 1HB ALA 2 HB1 ALA 2 13.285 4.304 -4.741 750 2HB ALA 2 HB2 ALA 2 12.065 4.572 -6.002 751 3HB ALA 2 HB3 ALA 2 11.704 4.968 -4.310 752 H SER 3 H SER 3 10.458 3.209 -6.935 753 HA SER 3 HA SER 3 8.073 4.095 -6.316 754 1HB SER 3 HB2 SER 3 8.183 2.191 -8.631 755 2HB SER 3 HB3 SER 3 7.572 3.842 -8.519 756 HG SER 3 HG SER 3 9.582 3.784 -9.625 757 HA PRO 4 HA PRO 4 5.963 -0.216 -6.642 758 1HB PRO 4 HB2 PRO 4 7.945 -1.906 -5.087 759 2HB PRO 4 HB3 PRO 4 6.822 -2.414 -6.380 760 1HG PRO 4 HG2 PRO 4 9.429 -1.972 -6.968 761 2HG PRO 4 HG3 PRO 4 8.162 -1.319 -8.051 762 1HD PRO 4 HD2 PRO 4 9.681 0.128 -5.874 763 2HD PRO 4 HD3 PRO 4 9.378 0.645 -7.551 764 H LEU 5 H LEU 5 7.876 -0.004 -3.554 765 HA LEU 5 HA LEU 5 5.469 -0.515 -2.025 766 1HB LEU 5 HB2 LEU 5 7.644 -1.112 -1.137 767 2HB LEU 5 HB3 LEU 5 8.161 0.588 -1.155 768 HG LEU 5 HG LEU 5 6.380 1.139 0.499 769 1HD1 LEU 5 HD11 LEU 5 5.824 -1.875 0.449 770 2HD1 LEU 5 HD12 LEU 5 5.244 -0.725 1.674 771 3HD1 LEU 5 HD13 LEU 5 4.681 -0.578 0.012 772 1HD2 LEU 5 HD21 LEU 5 8.632 0.466 1.271 773 2HD2 LEU 5 HD22 LEU 5 7.336 0.029 2.406 774 3HD2 LEU 5 HD23 LEU 5 8.062 -1.226 1.370 775 H ASP 6 H ASP 6 7.379 2.393 -2.899 776 HA ASP 6 HA ASP 6 6.050 4.271 -1.307 777 1HB ASP 6 HB2 ASP 6 7.239 4.616 -4.095 778 2HB ASP 6 HB3 ASP 6 6.730 5.947 -3.048 779 H GLN 7 H GLN 7 5.093 3.144 -4.592 780 HA GLN 7 HA GLN 7 2.817 4.897 -4.699 781 1HB GLN 7 HB2 GLN 7 2.149 3.702 -6.656 782 2HB GLN 7 HB3 GLN 7 3.897 3.972 -6.689 783 1HG GLN 7 HG2 GLN 7 4.171 1.598 -5.839 784 2HG GLN 7 HG3 GLN 7 2.455 1.342 -6.114 785 1HE2 GLN 7 HE22 GLN 7 1.674 1.667 -8.403 786 2HE2 GLN 7 HE21 GLN 7 2.811 1.365 -9.704 787 H ALA 8 H ALA 8 3.302 1.612 -3.365 788 HA ALA 8 HA ALA 8 0.489 1.060 -3.063 789 1HB ALA 8 HB1 ALA 8 1.246 -0.674 -1.471 790 2HB ALA 8 HB2 ALA 8 1.960 -0.741 -3.092 791 3HB ALA 8 HB3 ALA 8 2.923 -0.139 -1.717 792 H ILE 9 H ILE 9 3.008 2.230 -0.697 793 HA ILE 9 HA ILE 9 1.023 2.739 1.341 794 HB ILE 9 HB ILE 9 2.689 4.123 2.459 795 1HG1 ILE 9 HG12 ILE 9 4.472 3.683 0.076 796 2HG1 ILE 9 HG13 ILE 9 3.762 5.230 0.571 797 1HG2 ILE 9 HG21 ILE 9 4.203 2.332 2.978 798 2HG2 ILE 9 HG22 ILE 9 2.617 1.649 2.648 799 3HG2 ILE 9 HG23 ILE 9 3.895 1.549 1.413 800 1HD1 ILE 9 HD11 ILE 9 4.983 5.033 2.764 801 2HD1 ILE 9 HD12 ILE 9 5.837 3.617 2.104 802 3HD1 ILE 9 HD13 ILE 9 6.025 5.198 1.338 803 H GLY 10 H GLY 10 2.373 4.722 -1.279 804 1HA GLY 10 HA2 GLY 10 1.028 7.111 -1.114 805 2HA GLY 10 HA3 GLY 10 1.368 6.237 -2.611 806 H LEU 11 H LEU 11 -0.304 3.982 -2.331 807 HA LEU 11 HA LEU 11 -2.788 4.978 -3.182 808 1HB LEU 11 HB2 LEU 11 -1.632 2.659 -3.528 809 2HB LEU 11 HB3 LEU 11 -2.371 2.216 -1.995 810 HG LEU 11 HG LEU 11 -3.696 1.349 -3.709 811 1HD1 LEU 11 HD11 LEU 11 -5.239 3.779 -2.825 812 2HD1 LEU 11 HD12 LEU 11 -5.853 2.188 -3.297 813 3HD1 LEU 11 HD13 LEU 11 -4.919 2.353 -1.796 814 1HD2 LEU 11 HD21 LEU 11 -3.904 4.092 -4.993 815 2HD2 LEU 11 HD22 LEU 11 -2.912 2.727 -5.564 816 3HD2 LEU 11 HD23 LEU 11 -4.678 2.589 -5.537 817 H LEU 12 H LEU 12 -2.034 3.307 -0.083 818 HA LEU 12 HA LEU 12 -4.538 3.708 1.210 819 1HB LEU 12 HB2 LEU 12 -1.661 3.522 2.275 820 2HB LEU 12 HB3 LEU 12 -3.058 3.695 3.332 821 HG LEU 12 HG LEU 12 -4.018 1.619 2.497 822 1HD1 LEU 12 HD11 LEU 12 -2.969 1.382 0.267 823 2HD1 LEU 12 HD12 LEU 12 -1.363 1.272 1.032 824 3HD1 LEU 12 HD13 LEU 12 -2.563 -0.008 1.270 825 1HD2 LEU 12 HD21 LEU 12 -2.408 0.116 3.653 826 2HD2 LEU 12 HD22 LEU 12 -1.186 1.403 3.594 827 3HD2 LEU 12 HD23 LEU 12 -2.679 1.619 4.534 828 H ILE 13 H ILE 13 -1.637 5.746 1.131 829 HA ILE 13 HA ILE 13 -2.585 7.783 2.877 830 HB ILE 13 HB ILE 13 -0.517 7.675 0.644 831 1HG1 ILE 13 HG12 ILE 13 -0.095 7.932 3.646 832 2HG1 ILE 13 HG13 ILE 13 -0.243 6.367 2.858 833 1HG2 ILE 13 HG21 ILE 13 -1.124 10.012 0.744 834 2HG2 ILE 13 HG22 ILE 13 -1.067 9.989 2.518 835 3HG2 ILE 13 HG23 ILE 13 0.421 9.798 1.563 836 1HD1 ILE 13 HD11 ILE 13 2.057 6.682 2.945 837 2HD1 ILE 13 HD12 ILE 13 1.671 7.151 1.289 838 3HD1 ILE 13 HD13 ILE 13 1.965 8.401 2.516 839 H GLY 14 H GLY 14 -2.637 7.537 -0.677 840 1HA GLY 14 HA2 GLY 14 -3.867 9.992 -1.276 841 2HA GLY 14 HA3 GLY 14 -3.906 8.524 -2.274 842 H ILE 15 H ILE 15 -5.335 6.698 -0.888 843 HA ILE 15 HA ILE 15 -8.038 7.404 -1.219 844 HB ILE 15 HB ILE 15 -6.528 5.199 0.146 845 1HG1 ILE 15 HG12 ILE 15 -8.754 5.327 -1.948 846 2HG1 ILE 15 HG13 ILE 15 -7.023 5.225 -2.280 847 1HG2 ILE 15 HG21 ILE 15 -8.619 4.139 0.934 848 2HG2 ILE 15 HG22 ILE 15 -8.203 5.596 1.801 849 3HG2 ILE 15 HG23 ILE 15 -9.497 5.647 0.574 850 1HD1 ILE 15 HD11 ILE 15 -8.786 3.087 -1.010 851 2HD1 ILE 15 HD12 ILE 15 -7.914 3.021 -2.541 852 3HD1 ILE 15 HD13 ILE 15 -7.014 3.015 -1.008 853 H PHE 16 H PHE 16 -6.090 7.308 1.792 854 HA PHE 16 HA PHE 16 -8.143 8.228 3.479 855 1HB PHE 16 HB2 PHE 16 -5.947 7.218 4.147 856 2HB PHE 16 HB3 PHE 16 -5.148 8.730 3.765 857 HD1 PHE 16 HD1 PHE 16 -7.186 6.918 6.200 858 HD2 PHE 16 HD2 PHE 16 -5.799 10.845 5.105 859 HE1 PHE 16 HE1 PHE 16 -7.376 7.649 8.563 860 HE2 PHE 16 HE2 PHE 16 -6.046 11.584 7.423 861 HZ PHE 16 HZ PHE 16 -6.736 9.946 9.197 862 H HIS 17 H HIS 17 -5.549 10.194 1.908 863 HA HIS 17 HA HIS 17 -6.604 12.571 3.144 864 1HB HIS 17 HB2 HIS 17 -4.400 12.178 1.118 865 2HB HIS 17 HB3 HIS 17 -4.852 13.742 1.811 866 HD1 HIS 17 HD1 HIS 17 -3.378 10.388 2.893 867 HD2 HIS 17 HD2 HIS 17 -4.496 14.106 4.488 868 HE1 HIS 17 HE1 HIS 17 -2.628 10.400 5.352 869 H LYS 18 H LYS 18 -7.211 11.043 0.028 870 HA LYS 18 HA LYS 18 -8.516 13.319 -1.202 871 1HB LYS 18 HB2 LYS 18 -8.859 10.312 -1.496 872 2HB LYS 18 HB3 LYS 18 -9.846 11.482 -2.387 873 1HG LYS 18 HG2 LYS 18 -7.800 12.526 -3.327 874 2HG LYS 18 HG3 LYS 18 -6.809 11.287 -2.563 875 1HD LYS 18 HD2 LYS 18 -9.008 10.833 -4.645 876 2HD LYS 18 HD3 LYS 18 -7.263 10.802 -4.946 877 1HE LYS 18 HE2 LYS 18 -7.052 8.861 -3.368 878 2HE LYS 18 HE3 LYS 18 -8.818 8.844 -3.186 879 1HZ LYS 18 HZ1 LYS 18 -8.093 7.281 -4.799 880 2HZ LYS 18 HZ2 LYS 18 -9.002 8.450 -5.521 881 3HZ LYS 18 HZ3 LYS 18 -7.363 8.455 -5.697 882 H TYR 19 H TYR 19 -9.715 10.576 0.829 883 HA TYR 19 HA TYR 19 -12.361 11.613 1.057 884 1HB TYR 19 HB2 TYR 19 -10.741 9.557 2.507 885 2HB TYR 19 HB3 TYR 19 -12.117 10.230 3.372 886 HD1 TYR 19 HD1 TYR 19 -14.383 10.010 2.698 887 HD2 TYR 19 HD2 TYR 19 -11.203 8.334 0.316 888 HE1 TYR 19 HE1 TYR 19 -16.035 9.184 1.082 889 HE2 TYR 19 HE2 TYR 19 -12.869 7.415 -1.252 890 HH TYR 19 HH TYR 19 -16.385 7.962 -0.834 891 H SER 20 H SER 20 -9.641 11.939 3.350 892 HA SER 20 HA SER 20 -10.774 13.609 5.217 893 1HB SER 20 HB2 SER 20 -8.416 12.585 5.110 894 2HB SER 20 HB3 SER 20 -7.946 14.047 4.201 895 HG SER 20 HG SER 20 -7.714 14.089 6.563 896 H GLY 21 H GLY 21 -9.155 14.680 2.206 897 1HA GLY 21 HA2 GLY 21 -9.470 17.435 2.371 898 2HA GLY 21 HA3 GLY 21 -9.423 16.485 0.875 899 H LYS 22 H LYS 22 -11.880 14.964 1.379 900 HA LYS 22 HA LYS 22 -13.739 16.589 0.078 901 1HB LYS 22 HB2 LYS 22 -13.655 14.044 0.355 902 2HB LYS 22 HB3 LYS 22 -14.492 14.286 1.905 903 1HG LYS 22 HG2 LYS 22 -16.313 15.498 0.650 904 2HG LYS 22 HG3 LYS 22 -15.507 15.069 -0.860 905 1HD LYS 22 HD2 LYS 22 -16.683 13.176 1.240 906 2HD LYS 22 HD3 LYS 22 -17.330 13.496 -0.370 907 1HE LYS 22 HE2 LYS 22 -14.752 12.015 0.322 908 2HE LYS 22 HE3 LYS 22 -16.228 11.343 -0.376 909 1HZ LYS 22 HZ1 LYS 22 -15.849 12.681 -2.323 910 2HZ LYS 22 HZ2 LYS 22 -14.456 13.283 -1.677 911 3HZ LYS 22 HZ3 LYS 22 -14.573 11.679 -2.031 912 H GLU 23 H GLU 23 -13.102 16.274 3.561 913 HA GLU 23 HA GLU 23 -15.110 18.443 4.058 914 1HB GLU 23 HB2 GLU 23 -15.573 17.454 6.255 915 2HB GLU 23 HB3 GLU 23 -16.066 16.416 4.913 916 1HG GLU 23 HG2 GLU 23 -13.983 15.064 5.215 917 2HG GLU 23 HG3 GLU 23 -13.548 16.075 6.598 918 H GLY 24 H GLY 24 -12.238 18.528 3.368 919 1HA GLY 24 HA2 GLY 24 -10.338 19.599 4.011 920 2HA GLY 24 HA3 GLY 24 -11.434 20.660 4.911 921 H ASP 25 H ASP 25 -10.839 17.205 5.604 922 HA ASP 25 HA ASP 25 -9.891 17.913 8.320 923 1HB ASP 25 HB2 ASP 25 -11.699 16.262 7.918 924 2HB ASP 25 HB3 ASP 25 -10.559 15.188 7.125 925 H LYS 26 H LYS 26 -7.954 16.392 9.017 926 HA LYS 26 HA LYS 26 -5.751 16.806 7.013 927 1HB LYS 26 HB2 LYS 26 -5.697 17.161 10.037 928 2HB LYS 26 HB3 LYS 26 -4.338 17.402 8.910 929 1HG LYS 26 HG2 LYS 26 -5.653 19.179 7.749 930 2HG LYS 26 HG3 LYS 26 -6.946 18.989 8.945 931 1HD LYS 26 HD2 LYS 26 -5.357 19.562 10.767 932 2HD LYS 26 HD3 LYS 26 -4.069 19.795 9.564 933 1HE LYS 26 HE2 LYS 26 -5.410 21.590 8.479 934 2HE LYS 26 HE3 LYS 26 -6.701 21.352 9.673 935 1HZ LYS 26 HZ1 LYS 26 -3.956 22.205 10.272 936 2HZ LYS 26 HZ2 LYS 26 -5.289 23.172 10.247 937 3HZ LYS 26 HZ3 LYS 26 -5.157 21.983 11.379 938 H HIS 27 H HIS 27 -4.425 15.433 9.732 939 HA HIS 27 HA HIS 27 -4.106 12.875 8.379 940 1HB HIS 27 HB2 HIS 27 -3.171 13.718 11.140 941 2HB HIS 27 HB3 HIS 27 -2.545 12.391 10.156 942 HD1 HIS 27 HD1 HIS 27 -1.305 15.493 11.200 943 HD2 HIS 27 HD2 HIS 27 -1.843 13.702 7.430 944 HE1 HIS 27 HE1 HIS 27 0.333 16.632 9.610 945 H THR 28 H THR 28 -6.861 13.301 9.027 946 HA THR 28 HA THR 28 -7.517 11.179 10.921 947 HB THR 28 HB THR 28 -9.211 13.119 11.837 948 HG1 THR 28 HG1 THR 28 -8.298 14.864 10.879 949 1HG2 THR 28 HG21 THR 28 -7.753 13.355 13.804 950 2HG2 THR 28 HG22 THR 28 -7.912 11.666 13.298 951 3HG2 THR 28 HG23 THR 28 -6.424 12.577 12.921 952 H LEU 29 H LEU 29 -9.606 10.435 10.580 953 HA LEU 29 HA LEU 29 -11.282 11.776 8.494 954 1HB LEU 29 HB2 LEU 29 -10.911 8.784 8.988 955 2HB LEU 29 HB3 LEU 29 -12.176 9.465 7.966 956 HG LEU 29 HG LEU 29 -9.204 9.783 7.419 957 1HD1 LEU 29 HD11 LEU 29 -9.895 7.402 7.278 958 2HD1 LEU 29 HD12 LEU 29 -11.264 7.859 6.240 959 3HD1 LEU 29 HD13 LEU 29 -9.602 8.059 5.655 960 1HD2 LEU 29 HD21 LEU 29 -10.572 11.530 6.352 961 2HD2 LEU 29 HD22 LEU 29 -9.948 10.378 5.158 962 3HD2 LEU 29 HD23 LEU 29 -11.638 10.271 5.675 963 H SER 30 H SER 30 -13.599 11.529 8.972 964 HA SER 30 HA SER 30 -14.191 10.979 11.839 965 1HB SER 30 HB2 SER 30 -16.482 11.791 11.147 966 2HB SER 30 HB3 SER 30 -15.185 12.993 11.070 967 HG SER 30 HG SER 30 -15.332 13.043 8.939 968 H LYS 31 H LYS 31 -15.862 9.402 12.377 969 HA LYS 31 HA LYS 31 -15.281 6.989 11.151 970 1HB LYS 31 HB2 LYS 31 -16.864 5.985 12.627 971 2HB LYS 31 HB3 LYS 31 -15.911 7.219 13.435 972 1HG LYS 31 HG2 LYS 31 -17.801 8.802 13.329 973 2HG LYS 31 HG3 LYS 31 -18.812 7.562 12.542 974 1HD LYS 31 HD2 LYS 31 -18.631 6.092 14.459 975 2HD LYS 31 HD3 LYS 31 -17.423 7.142 15.212 976 1HE LYS 31 HE2 LYS 31 -19.126 8.954 15.398 977 2HE LYS 31 HE3 LYS 31 -20.349 7.847 14.738 978 1HZ LYS 31 HZ1 LYS 31 -18.775 7.428 17.187 979 2HZ LYS 31 HZ2 LYS 31 -20.353 7.906 17.132 980 3HZ LYS 31 HZ3 LYS 31 -19.925 6.404 16.602 981 H LYS 32 H LYS 32 -18.250 8.934 10.610 982 HA LYS 32 HA LYS 32 -19.400 6.919 8.865 983 1HB LYS 32 HB2 LYS 32 -20.825 8.372 10.055 984 2HB LYS 32 HB3 LYS 32 -20.135 9.821 9.274 985 1HG LYS 32 HG2 LYS 32 -20.983 9.025 7.085 986 2HG LYS 32 HG3 LYS 32 -21.594 7.543 7.849 987 1HD LYS 32 HD2 LYS 32 -23.072 8.948 9.312 988 2HD LYS 32 HD3 LYS 32 -22.512 10.397 8.465 989 1HE LYS 32 HE2 LYS 32 -23.986 8.032 7.198 990 2HE LYS 32 HE3 LYS 32 -24.701 9.596 7.614 991 1HZ LYS 32 HZ1 LYS 32 -22.568 9.162 5.646 992 2HZ LYS 32 HZ2 LYS 32 -24.145 9.500 5.321 993 3HZ LYS 32 HZ3 LYS 32 -23.199 10.627 6.061 994 H GLU 33 H GLU 33 -17.311 9.763 8.377 995 HA GLU 33 HA GLU 33 -17.293 9.789 5.519 996 1HB GLU 33 HB2 GLU 33 -16.339 11.580 6.861 997 2HB GLU 33 HB3 GLU 33 -15.191 10.450 7.590 998 1HG GLU 33 HG2 GLU 33 -14.159 10.102 5.309 999 2HG GLU 33 HG3 GLU 33 -15.244 11.371 4.702 1000 H LEU 34 H LEU 34 -15.247 8.037 7.926 1001 HA LEU 34 HA LEU 34 -13.781 6.465 6.111 1002 1HB LEU 34 HB2 LEU 34 -13.107 6.545 8.348 1003 2HB LEU 34 HB3 LEU 34 -14.655 6.032 8.975 1004 HG LEU 34 HG LEU 34 -12.894 4.358 9.176 1005 1HD1 LEU 34 HD11 LEU 34 -14.981 3.140 7.365 1006 2HD1 LEU 34 HD12 LEU 34 -14.244 2.493 8.815 1007 3HD1 LEU 34 HD13 LEU 34 -15.411 3.804 8.947 1008 1HD2 LEU 34 HD21 LEU 34 -12.084 3.104 7.193 1009 2HD2 LEU 34 HD22 LEU 34 -12.954 4.208 6.136 1010 3HD2 LEU 34 HD23 LEU 34 -11.630 4.815 7.143 1011 H LYS 35 H LYS 35 -16.973 5.748 7.650 1012 HA LYS 35 HA LYS 35 -17.488 3.311 6.417 1013 1HB LYS 35 HB2 LYS 35 -18.851 4.891 8.059 1014 2HB LYS 35 HB3 LYS 35 -19.744 5.314 6.593 1015 1HG LYS 35 HG2 LYS 35 -19.341 2.527 7.771 1016 2HG LYS 35 HG3 LYS 35 -20.759 3.555 8.008 1017 1HD LYS 35 HD2 LYS 35 -21.176 3.531 5.530 1018 2HD LYS 35 HD3 LYS 35 -19.825 2.391 5.365 1019 1HE LYS 35 HE2 LYS 35 -20.997 0.832 6.956 1020 2HE LYS 35 HE3 LYS 35 -22.365 1.952 7.004 1021 1HZ LYS 35 HZ1 LYS 35 -22.729 0.189 5.465 1022 2HZ LYS 35 HZ2 LYS 35 -22.639 1.618 4.653 1023 3HZ LYS 35 HZ3 LYS 35 -21.375 0.563 4.608 1024 H GLU 36 H GLU 36 -18.099 6.572 5.075 1025 HA GLU 36 HA GLU 36 -19.028 5.756 2.530 1026 1HB GLU 36 HB2 GLU 36 -18.872 8.137 3.794 1027 2HB GLU 36 HB3 GLU 36 -17.472 8.314 2.739 1028 1HG GLU 36 HG2 GLU 36 -20.377 7.779 1.968 1029 2HG GLU 36 HG3 GLU 36 -19.449 9.254 1.676 1030 H LEU 37 H LEU 37 -15.692 6.542 3.612 1031 HA LEU 37 HA LEU 37 -14.261 6.201 1.217 1032 1HB LEU 37 HB2 LEU 37 -13.234 7.006 3.241 1033 2HB LEU 37 HB3 LEU 37 -13.472 5.484 4.067 1034 HG LEU 37 HG LEU 37 -11.717 5.633 1.620 1035 1HD1 LEU 37 HD11 LEU 37 -9.820 5.854 3.239 1036 2HD1 LEU 37 HD12 LEU 37 -10.893 7.259 3.270 1037 3HD1 LEU 37 HD13 LEU 37 -10.981 6.025 4.561 1038 1HD2 LEU 37 HD21 LEU 37 -10.587 3.700 2.820 1039 2HD2 LEU 37 HD22 LEU 37 -11.899 3.703 4.005 1040 3HD2 LEU 37 HD23 LEU 37 -12.213 3.304 2.300 1041 H ILE 38 H ILE 38 -15.177 3.747 3.627 1042 HA ILE 38 HA ILE 38 -14.219 1.524 2.112 1043 HB ILE 38 HB ILE 38 -16.376 1.726 4.240 1044 1HG1 ILE 38 HG12 ILE 38 -13.434 0.898 4.325 1045 2HG1 ILE 38 HG13 ILE 38 -14.088 2.426 4.928 1046 1HG2 ILE 38 HG21 ILE 38 -16.563 -0.401 2.782 1047 2HG2 ILE 38 HG22 ILE 38 -14.950 -0.818 3.403 1048 3HG2 ILE 38 HG23 ILE 38 -16.317 -0.623 4.500 1049 1HD1 ILE 38 HD11 ILE 38 -13.832 1.004 6.796 1050 2HD1 ILE 38 HD12 ILE 38 -15.585 1.078 6.475 1051 3HD1 ILE 38 HD13 ILE 38 -14.637 -0.341 5.954 1052 H GLN 39 H GLN 39 -17.466 3.144 2.126 1053 HA GLN 39 HA GLN 39 -18.634 1.125 0.472 1054 1HB GLN 39 HB2 GLN 39 -19.401 4.068 0.701 1055 2HB GLN 39 HB3 GLN 39 -20.352 2.823 -0.082 1056 1HG GLN 39 HG2 GLN 39 -20.056 3.404 2.809 1057 2HG GLN 39 HG3 GLN 39 -21.428 2.799 1.909 1058 1HE2 GLN 39 HE22 GLN 39 -18.397 1.897 3.509 1059 2HE2 GLN 39 HE21 GLN 39 -18.762 0.171 3.632 1060 H LYS 40 H LYS 40 -16.885 4.124 -0.435 1061 HA LYS 40 HA LYS 40 -17.318 3.626 -3.268 1062 1HB LYS 40 HB2 LYS 40 -16.867 5.854 -2.410 1063 2HB LYS 40 HB3 LYS 40 -15.240 5.364 -1.894 1064 1HG LYS 40 HG2 LYS 40 -14.586 4.887 -4.196 1065 2HG LYS 40 HG3 LYS 40 -16.220 5.188 -4.787 1066 1HD LYS 40 HD2 LYS 40 -14.414 7.249 -3.438 1067 2HD LYS 40 HD3 LYS 40 -14.532 7.033 -5.183 1068 1HE LYS 40 HE2 LYS 40 -16.836 7.891 -3.359 1069 2HE LYS 40 HE3 LYS 40 -15.892 8.936 -4.422 1070 1HZ LYS 40 HZ1 LYS 40 -17.595 6.709 -5.281 1071 2HZ LYS 40 HZ2 LYS 40 -17.931 8.312 -5.432 1072 3HZ LYS 40 HZ3 LYS 40 -16.684 7.651 -6.283 1073 H GLU 41 H GLU 41 -14.443 3.192 -1.121 1074 HA GLU 41 HA GLU 41 -12.905 2.112 -3.319 1075 1HB GLU 41 HB2 GLU 41 -12.312 2.149 -0.329 1076 2HB GLU 41 HB3 GLU 41 -11.151 1.812 -1.621 1077 1HG GLU 41 HG2 GLU 41 -12.634 4.456 -1.182 1078 2HG GLU 41 HG3 GLU 41 -10.942 4.134 -0.831 1079 H LEU 42 H LEU 42 -14.462 0.636 -0.465 1080 HA LEU 42 HA LEU 42 -13.830 -2.106 -1.497 1081 1HB LEU 42 HB2 LEU 42 -14.310 -1.163 1.340 1082 2HB LEU 42 HB3 LEU 42 -13.951 -2.818 0.838 1083 HG LEU 42 HG LEU 42 -12.068 -0.420 0.730 1084 1HD1 LEU 42 HD11 LEU 42 -10.838 -1.682 2.452 1085 2HD1 LEU 42 HD12 LEU 42 -12.495 -1.363 2.981 1086 3HD1 LEU 42 HD13 LEU 42 -12.048 -2.979 2.391 1087 1HD2 LEU 42 HD21 LEU 42 -11.506 -1.795 -1.159 1088 2HD2 LEU 42 HD22 LEU 42 -10.352 -2.197 0.114 1089 3HD2 LEU 42 HD23 LEU 42 -11.700 -3.298 -0.216 1090 H THR 43 H THR 43 -15.923 -1.146 -2.787 1091 HA THR 43 HA THR 43 -18.386 -1.155 -1.539 1092 HB THR 43 HB THR 43 -17.879 -2.145 -4.364 1093 HG1 THR 43 HG1 THR 43 -17.618 0.485 -3.302 1094 1HG2 THR 43 HG21 THR 43 -20.258 -1.926 -3.682 1095 2HG2 THR 43 HG22 THR 43 -19.950 -0.245 -3.177 1096 3HG2 THR 43 HG23 THR 43 -19.816 -0.703 -4.887 1097 H ILE 44 H ILE 44 -16.381 -3.895 -2.194 1098 HA ILE 44 HA ILE 44 -16.661 -6.137 -2.088 1099 HB ILE 44 HB ILE 44 -17.497 -6.871 0.138 1100 1HG1 ILE 44 HG12 ILE 44 -18.079 -3.906 0.633 1101 2HG1 ILE 44 HG13 ILE 44 -19.326 -5.128 0.395 1102 1HG2 ILE 44 HG21 ILE 44 -15.191 -6.140 -0.295 1103 2HG2 ILE 44 HG22 ILE 44 -15.623 -4.491 0.184 1104 3HG2 ILE 44 HG23 ILE 44 -15.703 -5.814 1.360 1105 1HD1 ILE 44 HD11 ILE 44 -18.380 -6.353 2.391 1106 2HD1 ILE 44 HD12 ILE 44 -17.331 -4.945 2.665 1107 3HD1 ILE 44 HD13 ILE 44 -19.095 -4.751 2.709 1108 H GLY 45 H GLY 45 -19.406 -6.989 -0.465 1109 1HA GLY 45 HA2 GLY 45 -20.494 -8.131 -2.945 1110 2HA GLY 45 HA3 GLY 45 -21.006 -8.448 -1.280 1111 H SER 46 H SER 46 -20.810 -5.659 -3.511 1112 HA SER 46 HA SER 46 -22.077 -3.778 -3.707 1113 1HB SER 46 HB2 SER 46 -24.395 -5.748 -3.543 1114 2HB SER 46 HB3 SER 46 -24.441 -4.121 -4.244 1115 HG SER 46 HG SER 46 -22.747 -6.241 -5.105 1116 H LYS 47 H LYS 47 -21.156 -4.146 -1.161 1117 HA LYS 47 HA LYS 47 -21.363 -3.537 0.989 1118 1HB LYS 47 HB2 LYS 47 -23.566 -1.726 -0.027 1119 2HB LYS 47 HB3 LYS 47 -22.515 -1.460 1.360 1120 1HG LYS 47 HG2 LYS 47 -20.540 -1.355 -0.051 1121 2HG LYS 47 HG3 LYS 47 -21.468 -1.633 -1.527 1122 1HD LYS 47 HD2 LYS 47 -22.120 0.709 0.263 1123 2HD LYS 47 HD3 LYS 47 -20.758 0.746 -0.868 1124 1HE LYS 47 HE2 LYS 47 -22.728 1.789 -1.874 1125 2HE LYS 47 HE3 LYS 47 -22.230 0.359 -2.785 1126 1HZ LYS 47 HZ1 LYS 47 -23.980 -0.860 -1.770 1127 2HZ LYS 47 HZ2 LYS 47 -24.411 0.419 -0.823 1128 3HZ LYS 47 HZ3 LYS 47 -24.598 0.499 -2.460 1129 H LEU 48 H LEU 48 -23.366 -5.787 0.086 1130 HA LEU 48 HA LEU 48 -25.621 -5.491 1.845 1131 1HB LEU 48 HB2 LEU 48 -24.281 -7.800 0.437 1132 2HB LEU 48 HB3 LEU 48 -25.354 -8.170 1.771 1133 HG LEU 48 HG LEU 48 -26.429 -8.258 -0.460 1134 1HD1 LEU 48 HD11 LEU 48 -28.518 -7.233 0.238 1135 2HD1 LEU 48 HD12 LEU 48 -27.738 -8.014 1.622 1136 3HD1 LEU 48 HD13 LEU 48 -27.691 -6.249 1.454 1137 1HD2 LEU 48 HD21 LEU 48 -27.126 -6.223 -1.596 1138 2HD2 LEU 48 HD22 LEU 48 -26.271 -5.211 -0.419 1139 3HD2 LEU 48 HD23 LEU 48 -25.361 -6.287 -1.501 1140 H GLN 49 H GLN 49 -22.293 -6.422 2.463 1141 HA GLN 49 HA GLN 49 -22.821 -7.526 5.082 1142 1HB GLN 49 HB2 GLN 49 -20.193 -6.480 3.986 1143 2HB GLN 49 HB3 GLN 49 -20.460 -7.567 5.348 1144 1HG GLN 49 HG2 GLN 49 -19.970 -9.130 3.832 1145 2HG GLN 49 HG3 GLN 49 -21.709 -9.073 3.539 1146 1HE2 GLN 49 HE22 GLN 49 -19.427 -9.880 1.823 1147 2HE2 GLN 49 HE21 GLN 49 -19.550 -8.917 0.364 1148 H ASP 50 H ASP 50 -24.135 -4.971 4.902 1149 HA ASP 50 HA ASP 50 -22.598 -2.742 5.591 1150 1HB ASP 50 HB2 ASP 50 -24.639 -1.625 6.086 1151 2HB ASP 50 HB3 ASP 50 -24.932 -2.692 4.707 1152 H ALA 51 H ALA 51 -24.384 -4.952 7.717 1153 HA ALA 51 HA ALA 51 -23.820 -3.865 10.236 1154 1HB ALA 51 HB1 ALA 51 -24.088 -6.165 11.077 1155 2HB ALA 51 HB2 ALA 51 -25.311 -5.768 9.849 1156 3HB ALA 51 HB3 ALA 51 -23.926 -6.797 9.423 1157 H GLU 52 H GLU 52 -21.762 -5.953 8.187 1158 HA GLU 52 HA GLU 52 -19.703 -6.282 10.199 1159 1HB GLU 52 HB2 GLU 52 -19.377 -6.648 7.197 1160 2HB GLU 52 HB3 GLU 52 -18.436 -7.370 8.503 1161 1HG GLU 52 HG2 GLU 52 -21.331 -8.010 7.764 1162 2HG GLU 52 HG3 GLU 52 -19.923 -9.061 7.615 1163 H ILE 53 H ILE 53 -20.220 -4.165 7.342 1164 HA ILE 53 HA ILE 53 -17.788 -2.730 7.583 1165 HB ILE 53 HB ILE 53 -20.465 -1.516 6.793 1166 1HG1 ILE 53 HG12 ILE 53 -20.115 -3.274 5.215 1167 2HG1 ILE 53 HG13 ILE 53 -19.673 -1.755 4.464 1168 1HG2 ILE 53 HG21 ILE 53 -18.829 0.188 7.389 1169 2HG2 ILE 53 HG22 ILE 53 -17.587 -0.591 6.418 1170 3HG2 ILE 53 HG23 ILE 53 -19.006 0.141 5.649 1171 1HD1 ILE 53 HD11 ILE 53 -17.910 -3.020 3.783 1172 2HD1 ILE 53 HD12 ILE 53 -17.204 -2.481 5.306 1173 3HD1 ILE 53 HD13 ILE 53 -17.950 -4.086 5.211 1174 H VAL 54 H VAL 54 -20.981 -2.057 9.235 1175 HA VAL 54 HA VAL 54 -19.763 0.187 10.512 1176 HB VAL 54 HB VAL 54 -21.701 0.323 12.013 1177 1HG1 VAL 54 HG11 VAL 54 -22.204 0.271 9.016 1178 2HG1 VAL 54 HG12 VAL 54 -23.115 1.205 10.222 1179 3HG1 VAL 54 HG13 VAL 54 -21.422 1.598 9.900 1180 1HG2 VAL 54 HG21 VAL 54 -22.907 -1.827 10.270 1181 2HG2 VAL 54 HG22 VAL 54 -22.407 -2.067 11.961 1182 3HG2 VAL 54 HG23 VAL 54 -23.698 -0.917 11.561 1183 H LYS 55 H LYS 55 -20.044 -3.201 11.595 1184 HA LYS 55 HA LYS 55 -18.958 -2.778 14.196 1185 1HB LYS 55 HB2 LYS 55 -19.853 -4.935 13.512 1186 2HB LYS 55 HB3 LYS 55 -18.653 -5.087 12.235 1187 1HG LYS 55 HG2 LYS 55 -18.130 -6.496 14.187 1188 2HG LYS 55 HG3 LYS 55 -16.844 -5.361 13.798 1189 1HD LYS 55 HD2 LYS 55 -17.153 -5.535 16.204 1190 2HD LYS 55 HD3 LYS 55 -17.504 -3.895 15.671 1191 1HE LYS 55 HE2 LYS 55 -19.952 -4.380 15.777 1192 2HE LYS 55 HE3 LYS 55 -19.597 -6.055 16.242 1193 1HZ LYS 55 HZ1 LYS 55 -18.550 -5.208 18.213 1194 2HZ LYS 55 HZ2 LYS 55 -18.872 -3.654 17.769 1195 3HZ LYS 55 HZ3 LYS 55 -20.109 -4.685 18.116 1196 H LEU 56 H LEU 56 -17.297 -3.427 11.078 1197 HA LEU 56 HA LEU 56 -14.636 -3.150 12.002 1198 1HB LEU 56 HB2 LEU 56 -15.023 -4.210 9.998 1199 2HB LEU 56 HB3 LEU 56 -16.021 -2.927 9.334 1200 HG LEU 56 HG LEU 56 -13.169 -2.200 9.928 1201 1HD1 LEU 56 HD11 LEU 56 -12.496 -3.137 7.701 1202 2HD1 LEU 56 HD12 LEU 56 -12.919 -4.418 8.855 1203 3HD1 LEU 56 HD13 LEU 56 -14.067 -3.948 7.583 1204 1HD2 LEU 56 HD21 LEU 56 -15.106 -1.681 7.633 1205 2HD2 LEU 56 HD22 LEU 56 -14.792 -0.549 8.951 1206 3HD2 LEU 56 HD23 LEU 56 -13.481 -0.970 7.839 1207 H MET 57 H MET 57 -16.900 -0.662 10.813 1208 HA MET 57 HA MET 57 -15.102 1.542 10.912 1209 1HB MET 57 HB2 MET 57 -17.106 1.670 9.634 1210 2HB MET 57 HB3 MET 57 -18.099 1.313 11.049 1211 1HG MET 57 HG2 MET 57 -16.397 3.772 11.114 1212 2HG MET 57 HG3 MET 57 -17.866 3.780 10.139 1213 1HE MET 57 HE1 MET 57 -20.296 3.651 11.027 1214 2HE MET 57 HE2 MET 57 -20.029 2.102 11.879 1215 3HE MET 57 HE3 MET 57 -20.725 3.478 12.746 1216 H ASP 58 H ASP 58 -17.347 0.151 13.365 1217 HA ASP 58 HA ASP 58 -16.719 1.974 15.443 1218 1HB ASP 58 HB2 ASP 58 -18.571 0.376 15.571 1219 2HB ASP 58 HB3 ASP 58 -17.426 -0.964 15.728 1220 H ASP 59 H ASP 59 -15.153 -1.142 14.549 1221 HA ASP 59 HA ASP 59 -13.113 -1.074 16.513 1222 1HB ASP 59 HB2 ASP 59 -12.905 -2.197 13.686 1223 2HB ASP 59 HB3 ASP 59 -11.784 -2.497 15.012 1224 H LEU 60 H LEU 60 -12.997 0.285 13.189 1225 HA LEU 60 HA LEU 60 -10.436 1.497 13.381 1226 1HB LEU 60 HB2 LEU 60 -12.927 1.996 11.764 1227 2HB LEU 60 HB3 LEU 60 -11.631 3.188 11.693 1228 HG LEU 60 HG LEU 60 -10.916 0.296 11.299 1229 1HD1 LEU 60 HD11 LEU 60 -11.373 0.431 8.887 1230 2HD1 LEU 60 HD12 LEU 60 -12.875 0.607 9.821 1231 3HD1 LEU 60 HD13 LEU 60 -12.079 2.030 9.105 1232 1HD2 LEU 60 HD21 LEU 60 -9.137 2.089 11.280 1233 2HD2 LEU 60 HD22 LEU 60 -9.288 1.304 9.689 1234 3HD2 LEU 60 HD23 LEU 60 -9.994 2.891 9.937 1235 H ASP 61 H ASP 61 -13.656 2.967 14.116 1236 HA ASP 61 HA ASP 61 -12.435 5.449 14.892 1237 1HB ASP 61 HB2 ASP 61 -14.538 6.310 15.272 1238 2HB ASP 61 HB3 ASP 61 -14.687 5.235 13.880 1239 H ARG 62 H ARG 62 -13.135 2.590 16.748 1240 HA ARG 62 HA ARG 62 -13.342 3.462 19.306 1241 1HB ARG 62 HB2 ARG 62 -13.153 1.112 18.467 1242 2HB ARG 62 HB3 ARG 62 -11.393 1.286 18.430 1243 1HG ARG 62 HG2 ARG 62 -11.362 1.673 20.871 1244 2HG ARG 62 HG3 ARG 62 -13.135 1.652 20.920 1245 1HD ARG 62 HD2 ARG 62 -11.338 -0.650 20.093 1246 2HD ARG 62 HD3 ARG 62 -12.180 -0.516 21.645 1247 HE ARG 62 HE ARG 62 -14.322 -0.394 20.249 1248 1HH1 ARG 62 HH21 ARG 62 -11.577 -2.475 19.309 1249 2HH1 ARG 62 HH22 ARG 62 -12.532 -3.315 18.104 1250 1HH2 ARG 62 HH12 ARG 62 -15.488 -1.537 18.645 1251 2HH2 ARG 62 HH11 ARG 62 -14.697 -2.851 17.799 1252 H ASN 63 H ASN 63 -10.478 3.662 17.296 1253 HA ASN 63 HA ASN 63 -8.389 4.508 18.821 1254 1HB ASN 63 HB2 ASN 63 -8.332 4.428 16.404 1255 2HB ASN 63 HB3 ASN 63 -9.571 5.680 16.278 1256 1HD2 ASN 63 HD21 ASN 63 -7.115 6.389 18.754 1257 2HD2 ASN 63 HD22 ASN 63 -6.112 7.352 17.679 1258 H LYS 64 H LYS 64 -11.120 6.597 17.863 1259 HA LYS 64 HA LYS 64 -10.764 8.329 20.166 1260 1HB LYS 64 HB2 LYS 64 -8.920 9.037 18.597 1261 2HB LYS 64 HB3 LYS 64 -10.131 9.408 17.387 1262 1HG LYS 64 HG2 LYS 64 -9.251 11.403 18.558 1263 2HG LYS 64 HG3 LYS 64 -10.984 11.263 18.727 1264 1HD LYS 64 HD2 LYS 64 -9.911 11.960 20.825 1265 2HD LYS 64 HD3 LYS 64 -10.797 10.454 21.015 1266 1HE LYS 64 HE2 LYS 64 -8.620 10.406 22.192 1267 2HE LYS 64 HE3 LYS 64 -8.679 9.163 20.942 1268 1HZ LYS 64 HZ1 LYS 64 -7.426 10.610 19.521 1269 2HZ LYS 64 HZ2 LYS 64 -7.383 11.787 20.676 1270 3HZ LYS 64 HZ3 LYS 64 -6.618 10.348 20.933 1271 H ASP 65 H ASP 65 -12.802 6.762 19.452 1272 HA ASP 65 HA ASP 65 -14.993 6.626 19.322 1273 1HB ASP 65 HB2 ASP 65 -16.334 8.390 20.406 1274 2HB ASP 65 HB3 ASP 65 -14.946 7.827 21.336 1275 H GLN 66 H GLN 66 -14.665 9.952 18.159 1276 HA GLN 66 HA GLN 66 -16.645 9.473 15.999 1277 1HB GLN 66 HB2 GLN 66 -16.873 11.518 17.292 1278 2HB GLN 66 HB3 GLN 66 -15.176 11.931 17.032 1279 1HG GLN 66 HG2 GLN 66 -16.643 13.287 15.618 1280 2HG GLN 66 HG3 GLN 66 -15.551 12.308 14.647 1281 1HE2 GLN 66 HE22 GLN 66 -18.840 11.989 16.153 1282 2HE2 GLN 66 HE21 GLN 66 -19.582 11.325 14.707 1283 H GLU 67 H GLU 67 -13.162 10.010 16.556 1284 HA GLU 67 HA GLU 67 -12.736 10.329 13.637 1285 1HB GLU 67 HB2 GLU 67 -10.948 11.024 15.984 1286 2HB GLU 67 HB3 GLU 67 -10.568 11.276 14.273 1287 1HG GLU 67 HG2 GLU 67 -12.567 12.759 14.063 1288 2HG GLU 67 HG3 GLU 67 -12.863 12.577 15.803 1289 H VAL 68 H VAL 68 -11.193 9.284 12.541 1290 HA VAL 68 HA VAL 68 -9.779 6.928 13.722 1291 HB VAL 68 HB VAL 68 -10.623 7.411 10.827 1292 1HG1 VAL 68 HG11 VAL 68 -9.875 5.130 10.452 1293 2HG1 VAL 68 HG12 VAL 68 -8.543 6.054 11.158 1294 3HG1 VAL 68 HG13 VAL 68 -9.466 4.929 12.172 1295 1HG2 VAL 68 HG21 VAL 68 -11.824 5.443 12.786 1296 2HG2 VAL 68 HG22 VAL 68 -12.633 6.916 12.206 1297 3HG2 VAL 68 HG23 VAL 68 -12.239 5.618 11.076 1298 H ASN 69 H ASN 69 -7.695 7.715 14.079 1299 HA ASN 69 HA ASN 69 -6.632 9.929 12.489 1300 1HB ASN 69 HB2 ASN 69 -6.088 9.751 14.899 1301 2HB ASN 69 HB3 ASN 69 -5.388 8.150 14.620 1302 1HD2 ASN 69 HD21 ASN 69 -4.839 11.625 14.268 1303 2HD2 ASN 69 HD22 ASN 69 -3.175 11.471 13.740 1304 H PHE 70 H PHE 70 -4.905 9.800 11.051 1305 HA PHE 70 HA PHE 70 -4.794 7.779 9.194 1306 1HB PHE 70 HB2 PHE 70 -3.852 9.979 8.835 1307 2HB PHE 70 HB3 PHE 70 -2.627 9.706 10.070 1308 HD1 PHE 70 HD1 PHE 70 -3.892 8.377 6.793 1309 HD2 PHE 70 HD2 PHE 70 -0.599 8.575 9.553 1310 HE1 PHE 70 HE1 PHE 70 -2.451 7.180 5.166 1311 HE2 PHE 70 HE2 PHE 70 0.864 7.466 7.902 1312 HZ PHE 70 HZ PHE 70 -0.064 6.736 5.710 1313 H GLN 71 H GLN 71 -2.591 8.009 12.053 1314 HA GLN 71 HA GLN 71 -0.982 5.782 11.298 1315 1HB GLN 71 HB2 GLN 71 -0.384 7.445 13.043 1316 2HB GLN 71 HB3 GLN 71 -1.656 6.805 14.089 1317 1HG GLN 71 HG2 GLN 71 -0.484 4.555 14.044 1318 2HG GLN 71 HG3 GLN 71 0.776 5.277 13.032 1319 1HE2 GLN 71 HE22 GLN 71 -0.942 5.780 16.170 1320 2HE2 GLN 71 HE21 GLN 71 0.494 6.333 17.030 1321 H GLU 72 H GLU 72 -3.970 6.017 13.259 1322 HA GLU 72 HA GLU 72 -3.958 3.193 13.924 1323 1HB GLU 72 HB2 GLU 72 -5.968 5.418 14.310 1324 2HB GLU 72 HB3 GLU 72 -6.372 3.723 14.614 1325 1HG GLU 72 HG2 GLU 72 -5.649 4.608 16.713 1326 2HG GLU 72 HG3 GLU 72 -4.411 3.505 16.148 1327 H TYR 73 H TYR 73 -5.448 5.168 11.367 1328 HA TYR 73 HA TYR 73 -6.999 3.122 10.135 1329 1HB TYR 73 HB2 TYR 73 -7.382 5.230 9.314 1330 2HB TYR 73 HB3 TYR 73 -5.695 5.660 9.233 1331 HD1 TYR 73 HD1 TYR 73 -8.448 3.950 7.466 1332 HD2 TYR 73 HD2 TYR 73 -4.344 5.257 7.297 1333 HE1 TYR 73 HE1 TYR 73 -8.532 3.938 4.985 1334 HE2 TYR 73 HE2 TYR 73 -4.398 5.133 4.834 1335 HH TYR 73 HH TYR 73 -5.800 4.991 2.972 1336 H ILE 74 H ILE 74 -3.525 4.027 9.535 1337 HA ILE 74 HA ILE 74 -3.058 1.848 7.758 1338 HB ILE 74 HB ILE 74 -1.081 3.228 9.603 1339 1HG1 ILE 74 HG12 ILE 74 -2.185 4.788 7.977 1340 2HG1 ILE 74 HG13 ILE 74 -0.451 4.638 7.818 1341 1HG2 ILE 74 HG21 ILE 74 -0.051 1.201 8.955 1342 2HG2 ILE 74 HG22 ILE 74 -0.709 1.273 7.307 1343 3HG2 ILE 74 HG23 ILE 74 0.574 2.380 7.801 1344 1HD1 ILE 74 HD11 ILE 74 -1.492 4.719 5.621 1345 2HD1 ILE 74 HD12 ILE 74 -0.737 3.148 5.847 1346 3HD1 ILE 74 HD13 ILE 74 -2.507 3.324 6.015 1347 H THR 75 H THR 75 -2.513 2.050 11.299 1348 HA THR 75 HA THR 75 -1.528 -0.534 11.750 1349 HB THR 75 HB THR 75 -3.428 1.024 13.556 1350 HG1 THR 75 HG1 THR 75 -1.647 2.292 12.957 1351 1HG2 THR 75 HG21 THR 75 -1.319 -1.077 14.186 1352 2HG2 THR 75 HG22 THR 75 -2.165 -0.082 15.385 1353 3HG2 THR 75 HG23 THR 75 -3.076 -1.241 14.404 1354 H PHE 76 H PHE 76 -4.924 0.571 11.591 1355 HA PHE 76 HA PHE 76 -6.102 -1.967 12.168 1356 1HB PHE 76 HB2 PHE 76 -7.311 0.151 12.466 1357 2HB PHE 76 HB3 PHE 76 -7.244 0.448 10.729 1358 HD1 PHE 76 HD1 PHE 76 -8.631 -0.872 9.155 1359 HD2 PHE 76 HD2 PHE 76 -8.706 -1.708 13.392 1360 HE1 PHE 76 HE1 PHE 76 -10.555 -2.362 8.827 1361 HE2 PHE 76 HE2 PHE 76 -10.528 -3.348 13.019 1362 HZ PHE 76 HZ PHE 76 -11.430 -3.710 10.731 1363 H LEU 77 H LEU 77 -5.314 -0.282 9.043 1364 HA LEU 77 HA LEU 77 -6.300 -2.421 7.410 1365 1HB LEU 77 HB2 LEU 77 -4.129 -0.351 6.945 1366 2HB LEU 77 HB3 LEU 77 -4.603 -1.532 5.721 1367 HG LEU 77 HG LEU 77 -6.582 0.396 7.028 1368 1HD1 LEU 77 HD11 LEU 77 -5.152 0.615 4.352 1369 2HD1 LEU 77 HD12 LEU 77 -6.472 1.654 4.918 1370 3HD1 LEU 77 HD13 LEU 77 -4.915 1.675 5.767 1371 1HD2 LEU 77 HD21 LEU 77 -7.935 -0.172 4.977 1372 2HD2 LEU 77 HD22 LEU 77 -6.746 -1.438 4.595 1373 3HD2 LEU 77 HD23 LEU 77 -7.735 -1.530 6.074 1374 H GLY 78 H GLY 78 -3.228 -2.011 9.153 1375 1HA GLY 78 HA2 GLY 78 -1.977 -4.422 8.336 1376 2HA GLY 78 HA3 GLY 78 -1.809 -3.658 9.929 1377 H ALA 79 H ALA 79 -4.330 -3.877 11.031 1378 HA ALA 79 HA ALA 79 -4.544 -6.611 11.793 1379 1HB ALA 79 HB1 ALA 79 -6.632 -6.035 12.857 1380 2HB ALA 79 HB2 ALA 79 -5.496 -4.702 13.118 1381 3HB ALA 79 HB3 ALA 79 -6.790 -4.548 11.916 1382 H LEU 80 H LEU 80 -6.382 -4.756 9.353 1383 HA LEU 80 HA LEU 80 -8.168 -6.778 8.590 1384 1HB LEU 80 HB2 LEU 80 -8.017 -4.212 7.985 1385 2HB LEU 80 HB3 LEU 80 -7.020 -4.763 6.638 1386 HG LEU 80 HG LEU 80 -8.982 -6.315 6.022 1387 1HD1 LEU 80 HD11 LEU 80 -11.219 -5.512 6.844 1388 2HD1 LEU 80 HD12 LEU 80 -10.263 -6.232 8.146 1389 3HD1 LEU 80 HD13 LEU 80 -10.386 -4.468 8.009 1390 1HD2 LEU 80 HD21 LEU 80 -10.198 -4.471 4.905 1391 2HD2 LEU 80 HD22 LEU 80 -9.439 -3.298 5.999 1392 3HD2 LEU 80 HD23 LEU 80 -8.448 -4.195 4.823 1393 H ALA 81 H ALA 81 -4.934 -5.950 7.338 1394 HA ALA 81 HA ALA 81 -4.677 -7.999 5.381 1395 1HB ALA 81 HB1 ALA 81 -2.238 -7.648 5.718 1396 2HB ALA 81 HB2 ALA 81 -3.165 -6.166 5.379 1397 3HB ALA 81 HB3 ALA 81 -2.619 -6.504 7.020 1398 H MET 82 H MET 82 -3.929 -7.986 8.914 1399 HA MET 82 HA MET 82 -2.975 -10.672 9.003 1400 1HB MET 82 HB2 MET 82 -2.754 -8.876 10.789 1401 2HB MET 82 HB3 MET 82 -4.428 -9.235 11.253 1402 1HG MET 82 HG2 MET 82 -3.713 -11.665 11.536 1403 2HG MET 82 HG3 MET 82 -2.047 -11.114 11.332 1404 1HE MET 82 HE1 MET 82 -1.697 -8.792 14.540 1405 2HE MET 82 HE2 MET 82 -0.931 -9.311 13.018 1406 3HE MET 82 HE3 MET 82 -2.346 -8.222 12.991 1407 H ILE 83 H ILE 83 -6.272 -9.358 9.373 1408 HA ILE 83 HA ILE 83 -7.581 -11.858 9.814 1409 HB ILE 83 HB ILE 83 -8.414 -9.099 9.019 1410 1HG1 ILE 83 HG12 ILE 83 -10.148 -9.548 10.745 1411 2HG1 ILE 83 HG13 ILE 83 -9.543 -11.198 10.922 1412 1HG2 ILE 83 HG21 ILE 83 -10.727 -9.791 8.505 1413 2HG2 ILE 83 HG22 ILE 83 -9.595 -10.296 7.256 1414 3HG2 ILE 83 HG23 ILE 83 -10.205 -11.485 8.435 1415 1HD1 ILE 83 HD11 ILE 83 -8.034 -8.622 11.542 1416 2HD1 ILE 83 HD12 ILE 83 -8.720 -9.754 12.716 1417 3HD1 ILE 83 HD13 ILE 83 -7.348 -10.257 11.715 1418 H TYR 84 H TYR 84 -6.661 -10.185 6.778 1419 HA TYR 84 HA TYR 84 -7.490 -12.452 5.116 1420 1HB TYR 84 HB2 TYR 84 -5.527 -10.236 4.470 1421 2HB TYR 84 HB3 TYR 84 -6.357 -11.289 3.329 1422 HD1 TYR 84 HD1 TYR 84 -6.210 -8.157 3.516 1423 HD2 TYR 84 HD2 TYR 84 -9.196 -11.079 4.613 1424 HE1 TYR 84 HE1 TYR 84 -7.997 -6.468 3.206 1425 HE2 TYR 84 HE2 TYR 84 -10.958 -9.394 4.307 1426 HH TYR 84 HH TYR 84 -11.449 -7.222 3.720 1427 H ASN 85 H ASN 85 -6.341 -13.775 6.984 1428 HA ASN 85 HA ASN 85 -3.623 -14.003 7.260 1429 1HB ASN 85 HB2 ASN 85 -3.969 -16.110 8.240 1430 2HB ASN 85 HB3 ASN 85 -5.469 -15.225 8.544 1431 1HD2 ASN 85 HD21 ASN 85 -4.234 -18.200 7.497 1432 2HD2 ASN 85 HD22 ASN 85 -5.547 -18.688 6.428 1433 H GLU 86 H GLU 86 -5.608 -15.562 4.725 1434 HA GLU 86 HA GLU 86 -3.596 -17.135 3.544 1435 1HB GLU 86 HB2 GLU 86 -5.901 -15.715 2.144 1436 2HB GLU 86 HB3 GLU 86 -4.968 -17.071 1.506 1437 1HG GLU 86 HG2 GLU 86 -6.801 -17.134 3.951 1438 2HG GLU 86 HG3 GLU 86 -7.099 -17.866 2.378 1439 H ALA 87 H ALA 87 -4.159 -13.627 3.240 1440 HA ALA 87 HA ALA 87 -2.391 -13.258 0.977 1441 1HB ALA 87 HB1 ALA 87 -2.479 -10.917 1.526 1442 2HB ALA 87 HB2 ALA 87 -4.114 -11.584 1.683 1443 3HB ALA 87 HB3 ALA 87 -3.144 -11.243 3.135 1444 H LEU 88 H LEU 88 -2.046 -13.111 4.567 1445 HA LEU 88 HA LEU 88 0.768 -12.502 4.511 1446 1HB LEU 88 HB2 LEU 88 -0.702 -14.042 6.688 1447 2HB LEU 88 HB3 LEU 88 0.872 -13.257 6.769 1448 HG LEU 88 HG LEU 88 -1.869 -11.979 6.713 1449 1HD1 LEU 88 HD11 LEU 88 -0.842 -10.817 8.713 1450 2HD1 LEU 88 HD12 LEU 88 -0.911 -12.584 8.887 1451 3HD1 LEU 88 HD13 LEU 88 0.619 -11.769 8.485 1452 1HD2 LEU 88 HD21 LEU 88 0.768 -10.537 6.187 1453 2HD2 LEU 88 HD22 LEU 88 -0.608 -10.678 5.061 1454 3HD2 LEU 88 HD23 LEU 88 -0.795 -9.773 6.553 1455 H LYS 89 H LYS 89 -1.016 -15.590 4.515 1456 HA LYS 89 HA LYS 89 1.189 -17.344 4.669 1457 1HB LYS 89 HB2 LYS 89 -1.260 -17.890 4.802 1458 2HB LYS 89 HB3 LYS 89 -1.333 -17.768 3.034 1459 1HG LYS 89 HG2 LYS 89 0.460 -19.538 2.903 1460 2HG LYS 89 HG3 LYS 89 0.321 -19.747 4.655 1461 1HD LYS 89 HD2 LYS 89 -1.952 -20.078 2.627 1462 2HD LYS 89 HD3 LYS 89 -1.004 -21.403 3.318 1463 1HE LYS 89 HE2 LYS 89 -1.816 -20.814 5.594 1464 2HE LYS 89 HE3 LYS 89 -2.791 -19.497 4.909 1465 1HZ LYS 89 HZ1 LYS 89 -4.072 -21.453 5.254 1466 2HZ LYS 89 HZ2 LYS 89 -4.007 -21.061 3.658 1467 3HZ LYS 89 HZ3 LYS 89 -3.112 -22.326 4.236 1468 H GLY 90 H GLY 90 -0.339 -15.807 1.809 1469 1HA GLY 90 HA2 GLY 90 1.634 -16.788 -0.091 1470 2HA GLY 90 HA3 GLY 90 0.412 -15.534 -0.344 Start of MODEL 15 1 1H MET 1 H1 MET 1 -10.479 3.340 -5.363 2 2H MET 1 H2 MET 1 -9.635 2.200 -6.230 3 3H MET 1 H3 MET 1 -9.456 2.300 -4.597 4 HA MET 1 HA MET 1 -11.813 1.815 -4.348 5 1HB MET 1 HB2 MET 1 -11.474 0.936 -7.244 6 2HB MET 1 HB3 MET 1 -12.867 0.574 -6.218 7 1HG MET 1 HG2 MET 1 -13.257 3.042 -5.935 8 2HG MET 1 HG3 MET 1 -11.955 3.330 -7.092 9 1HE MET 1 HE1 MET 1 -14.886 0.557 -7.221 10 2HE MET 1 HE2 MET 1 -15.595 2.035 -6.527 11 3HE MET 1 HE3 MET 1 -16.064 1.498 -8.154 12 H ALA 2 H ALA 2 -12.506 -0.688 -4.644 13 HA ALA 2 HA ALA 2 -11.122 -2.221 -2.981 14 1HB ALA 2 HB1 ALA 2 -12.488 -3.252 -5.512 15 2HB ALA 2 HB2 ALA 2 -12.121 -4.214 -4.064 16 3HB ALA 2 HB3 ALA 2 -13.278 -2.871 -3.976 17 H SER 3 H SER 3 -10.595 -2.969 -6.510 18 HA SER 3 HA SER 3 -8.378 -4.568 -6.039 19 1HB SER 3 HB2 SER 3 -8.100 -3.629 -8.649 20 2HB SER 3 HB3 SER 3 -9.017 -5.035 -8.096 21 HG SER 3 HG SER 3 -10.357 -3.625 -9.288 22 HA PRO 4 HA PRO 4 -5.602 -0.595 -7.027 23 1HB PRO 4 HB2 PRO 4 -7.634 1.287 -5.810 24 2HB PRO 4 HB3 PRO 4 -6.295 1.677 -6.926 25 1HG PRO 4 HG2 PRO 4 -8.779 1.336 -7.949 26 2HG PRO 4 HG3 PRO 4 -7.381 0.560 -8.746 27 1HD PRO 4 HD2 PRO 4 -9.429 -0.709 -6.943 28 2HD PRO 4 HD3 PRO 4 -8.654 -1.328 -8.419 29 H LEU 5 H LEU 5 -7.764 -0.691 -4.066 30 HA LEU 5 HA LEU 5 -5.494 -0.057 -2.379 31 1HB LEU 5 HB2 LEU 5 -7.758 0.452 -1.621 32 2HB LEU 5 HB3 LEU 5 -8.187 -1.264 -1.654 33 HG LEU 5 HG LEU 5 -6.509 -1.757 0.101 34 1HD1 LEU 5 HD11 LEU 5 -4.790 -0.041 -0.317 35 2HD1 LEU 5 HD12 LEU 5 -5.953 1.250 0.078 36 3HD1 LEU 5 HD13 LEU 5 -5.421 0.094 1.318 37 1HD2 LEU 5 HD21 LEU 5 -8.272 0.584 0.865 38 2HD2 LEU 5 HD22 LEU 5 -8.762 -1.135 0.809 39 3HD2 LEU 5 HD23 LEU 5 -7.529 -0.604 1.966 40 H ASP 6 H ASP 6 -7.260 -3.047 -3.191 41 HA ASP 6 HA ASP 6 -5.986 -4.862 -1.510 42 1HB ASP 6 HB2 ASP 6 -6.978 -5.349 -4.345 43 2HB ASP 6 HB3 ASP 6 -6.577 -6.603 -3.170 44 H GLN 7 H GLN 7 -4.966 -3.880 -4.825 45 HA GLN 7 HA GLN 7 -2.628 -5.515 -4.814 46 1HB GLN 7 HB2 GLN 7 -1.879 -4.301 -6.726 47 2HB GLN 7 HB3 GLN 7 -3.612 -4.588 -6.832 48 1HG GLN 7 HG2 GLN 7 -3.427 -2.386 -7.563 49 2HG GLN 7 HG3 GLN 7 -3.929 -2.238 -5.888 50 1HE2 GLN 7 HE22 GLN 7 -3.041 -0.174 -5.488 51 2HE2 GLN 7 HE21 GLN 7 -1.321 0.203 -5.692 52 H ALA 8 H ALA 8 -3.209 -2.274 -3.418 53 HA ALA 8 HA ALA 8 -0.408 -1.668 -3.075 54 1HB ALA 8 HB1 ALA 8 -1.929 0.131 -3.181 55 2HB ALA 8 HB2 ALA 8 -2.886 -0.463 -1.806 56 3HB ALA 8 HB3 ALA 8 -1.225 0.101 -1.560 57 H ILE 9 H ILE 9 -3.008 -2.776 -0.788 58 HA ILE 9 HA ILE 9 -1.156 -3.197 1.382 59 HB ILE 9 HB ILE 9 -2.851 -4.632 2.405 60 1HG1 ILE 9 HG12 ILE 9 -4.530 -4.106 -0.052 61 2HG1 ILE 9 HG13 ILE 9 -3.838 -5.676 0.398 62 1HG2 ILE 9 HG21 ILE 9 -2.780 -2.170 2.646 63 2HG2 ILE 9 HG22 ILE 9 -3.963 -2.026 1.325 64 3HG2 ILE 9 HG23 ILE 9 -4.395 -2.831 2.850 65 1HD1 ILE 9 HD11 ILE 9 -5.139 -5.584 2.545 66 2HD1 ILE 9 HD12 ILE 9 -5.971 -4.138 1.921 67 3HD1 ILE 9 HD13 ILE 9 -6.125 -5.680 1.072 68 H GLY 10 H GLY 10 -2.317 -5.310 -1.239 69 1HA GLY 10 HA2 GLY 10 -0.947 -7.679 -0.848 70 2HA GLY 10 HA3 GLY 10 -1.261 -6.918 -2.414 71 H LEU 11 H LEU 11 0.328 -4.639 -2.313 72 HA LEU 11 HA LEU 11 2.857 -5.587 -3.019 73 1HB LEU 11 HB2 LEU 11 1.620 -3.325 -3.514 74 2HB LEU 11 HB3 LEU 11 2.331 -2.768 -2.008 75 HG LEU 11 HG LEU 11 3.637 -1.962 -3.726 76 1HD1 LEU 11 HD11 LEU 11 5.238 -4.333 -2.768 77 2HD1 LEU 11 HD12 LEU 11 5.828 -2.756 -3.313 78 3HD1 LEU 11 HD13 LEU 11 4.910 -2.867 -1.799 79 1HD2 LEU 11 HD21 LEU 11 4.639 -3.240 -5.526 80 2HD2 LEU 11 HD22 LEU 11 3.888 -4.736 -4.928 81 3HD2 LEU 11 HD23 LEU 11 2.875 -3.402 -5.533 82 H LEU 12 H LEU 12 2.016 -3.699 -0.070 83 HA LEU 12 HA LEU 12 4.472 -3.954 1.292 84 1HB LEU 12 HB2 LEU 12 1.572 -3.744 2.270 85 2HB LEU 12 HB3 LEU 12 2.927 -3.866 3.387 86 HG LEU 12 HG LEU 12 3.945 -1.846 2.436 87 1HD1 LEU 12 HD11 LEU 12 2.522 -0.282 1.114 88 2HD1 LEU 12 HD12 LEU 12 2.874 -1.745 0.198 89 3HD1 LEU 12 HD13 LEU 12 1.283 -1.538 0.975 90 1HD2 LEU 12 HD21 LEU 12 1.120 -1.563 3.535 91 2HD2 LEU 12 HD22 LEU 12 2.623 -1.715 4.474 92 3HD2 LEU 12 HD23 LEU 12 2.336 -0.270 3.506 93 H ILE 13 H ILE 13 1.657 -6.151 1.316 94 HA ILE 13 HA ILE 13 2.737 -7.957 3.250 95 HB ILE 13 HB ILE 13 0.673 -8.289 1.029 96 1HG1 ILE 13 HG12 ILE 13 0.151 -8.171 4.019 97 2HG1 ILE 13 HG13 ILE 13 0.309 -6.688 3.084 98 1HG2 ILE 13 HG21 ILE 13 1.460 -10.534 1.538 99 2HG2 ILE 13 HG22 ILE 13 1.366 -10.206 3.280 100 3HG2 ILE 13 HG23 ILE 13 -0.109 -10.313 2.310 101 1HD1 ILE 13 HD11 ILE 13 -1.494 -7.692 1.501 102 2HD1 ILE 13 HD12 ILE 13 -1.826 -8.811 2.840 103 3HD1 ILE 13 HD13 ILE 13 -1.981 -7.055 3.068 104 H GLY 14 H GLY 14 2.740 -8.066 -0.319 105 1HA GLY 14 HA2 GLY 14 4.109 -10.489 -0.690 106 2HA GLY 14 HA3 GLY 14 4.096 -9.115 -1.815 107 H ILE 15 H ILE 15 5.402 -7.102 -0.550 108 HA ILE 15 HA ILE 15 8.143 -7.773 -0.799 109 HB ILE 15 HB ILE 15 6.572 -5.439 0.265 110 1HG1 ILE 15 HG12 ILE 15 8.805 -5.808 -1.796 111 2HG1 ILE 15 HG13 ILE 15 7.072 -5.719 -2.131 112 1HG2 ILE 15 HG21 ILE 15 8.633 -4.251 0.933 113 2HG2 ILE 15 HG22 ILE 15 8.249 -5.604 1.969 114 3HG2 ILE 15 HG23 ILE 15 9.547 -5.771 0.757 115 1HD1 ILE 15 HD11 ILE 15 7.130 -3.363 -1.116 116 2HD1 ILE 15 HD12 ILE 15 8.902 -3.490 -1.156 117 3HD1 ILE 15 HD13 ILE 15 7.981 -3.576 -2.659 118 H PHE 16 H PHE 16 6.170 -7.323 2.182 119 HA PHE 16 HA PHE 16 8.199 -7.945 4.000 120 1HB PHE 16 HB2 PHE 16 5.969 -7.059 4.573 121 2HB PHE 16 HB3 PHE 16 5.222 -8.597 4.205 122 HD1 PHE 16 HD1 PHE 16 7.374 -6.767 6.584 123 HD2 PHE 16 HD2 PHE 16 5.587 -10.575 5.670 124 HE1 PHE 16 HE1 PHE 16 7.771 -7.517 8.923 125 HE2 PHE 16 HE2 PHE 16 6.242 -11.401 7.889 126 HZ PHE 16 HZ PHE 16 7.193 -9.820 9.582 127 H HIS 17 H HIS 17 5.725 -10.240 2.713 128 HA HIS 17 HA HIS 17 6.945 -12.327 4.195 129 1HB HIS 17 HB2 HIS 17 4.440 -11.987 3.227 130 2HB HIS 17 HB3 HIS 17 5.053 -13.185 2.085 131 HD1 HIS 17 HD1 HIS 17 5.686 -15.640 3.241 132 HD2 HIS 17 HD2 HIS 17 4.255 -12.626 5.818 133 HE1 HIS 17 HE1 HIS 17 5.081 -16.763 5.441 134 H LYS 18 H LYS 18 7.577 -11.194 0.927 135 HA LYS 18 HA LYS 18 8.971 -13.563 0.022 136 1HB LYS 18 HB2 LYS 18 9.272 -10.593 -0.566 137 2HB LYS 18 HB3 LYS 18 10.332 -11.821 -1.278 138 1HG LYS 18 HG2 LYS 18 8.521 -12.907 -2.410 139 2HG LYS 18 HG3 LYS 18 7.310 -12.012 -1.499 140 1HD LYS 18 HD2 LYS 18 7.530 -11.123 -3.789 141 2HD LYS 18 HD3 LYS 18 7.909 -9.916 -2.559 142 1HE LYS 18 HE2 LYS 18 9.475 -9.814 -4.469 143 2HE LYS 18 HE3 LYS 18 10.316 -10.169 -2.958 144 1HZ LYS 18 HZ1 LYS 18 9.538 -12.148 -4.990 145 2HZ LYS 18 HZ2 LYS 18 11.056 -11.554 -4.752 146 3HZ LYS 18 HZ3 LYS 18 10.342 -12.476 -3.589 147 H TYR 19 H TYR 19 10.092 -10.582 1.733 148 HA TYR 19 HA TYR 19 12.752 -11.622 2.084 149 1HB TYR 19 HB2 TYR 19 11.256 -9.289 3.257 150 2HB TYR 19 HB3 TYR 19 12.848 -9.750 3.865 151 HD1 TYR 19 HD1 TYR 19 14.878 -9.620 2.479 152 HD2 TYR 19 HD2 TYR 19 11.067 -8.248 1.033 153 HE1 TYR 19 HE1 TYR 19 15.952 -8.736 0.433 154 HE2 TYR 19 HE2 TYR 19 12.083 -7.593 -1.091 155 HH TYR 19 HH TYR 19 14.051 -7.392 -2.291 156 H SER 20 H SER 20 9.836 -11.766 4.231 157 HA SER 20 HA SER 20 11.183 -13.167 6.323 158 1HB SER 20 HB2 SER 20 8.333 -13.602 5.341 159 2HB SER 20 HB3 SER 20 9.040 -14.188 6.848 160 HG SER 20 HG SER 20 9.318 -12.131 7.555 161 H GLY 21 H GLY 21 9.419 -14.516 3.482 162 1HA GLY 21 HA2 GLY 21 9.833 -17.192 3.701 163 2HA GLY 21 HA3 GLY 21 9.845 -16.315 2.165 164 H LYS 22 H LYS 22 12.172 -14.850 2.366 165 HA LYS 22 HA LYS 22 14.196 -16.507 1.542 166 1HB LYS 22 HB2 LYS 22 13.997 -13.979 1.479 167 2HB LYS 22 HB3 LYS 22 14.710 -13.942 3.098 168 1HG LYS 22 HG2 LYS 22 16.717 -15.056 2.321 169 2HG LYS 22 HG3 LYS 22 16.026 -15.306 0.709 170 1HD LYS 22 HD2 LYS 22 16.772 -12.632 1.972 171 2HD LYS 22 HD3 LYS 22 17.614 -13.468 0.666 172 1HE LYS 22 HE2 LYS 22 15.376 -13.291 -0.661 173 2HE LYS 22 HE3 LYS 22 14.886 -12.122 0.586 174 1HZ LYS 22 HZ1 LYS 22 17.193 -11.914 -1.199 175 2HZ LYS 22 HZ2 LYS 22 15.833 -10.979 -1.207 176 3HZ LYS 22 HZ3 LYS 22 16.899 -10.892 0.054 177 H GLU 23 H GLU 23 13.553 -15.586 4.936 178 HA GLU 23 HA GLU 23 15.737 -17.395 5.876 179 1HB GLU 23 HB2 GLU 23 15.164 -16.499 8.129 180 2HB GLU 23 HB3 GLU 23 15.915 -15.372 6.996 181 1HG GLU 23 HG2 GLU 23 13.815 -14.254 6.556 182 2HG GLU 23 HG3 GLU 23 12.930 -15.423 7.568 183 H GLY 24 H GLY 24 12.207 -16.896 6.117 184 1HA GLY 24 HA2 GLY 24 11.536 -19.574 5.793 185 2HA GLY 24 HA3 GLY 24 11.523 -19.256 7.546 186 H ASP 25 H ASP 25 9.268 -19.685 5.478 187 HA ASP 25 HA ASP 25 7.851 -17.146 5.345 188 1HB ASP 25 HB2 ASP 25 7.205 -19.993 4.566 189 2HB ASP 25 HB3 ASP 25 5.918 -18.798 4.667 190 H LYS 26 H LYS 26 8.205 -16.716 7.610 191 HA LYS 26 HA LYS 26 5.782 -17.430 9.203 192 1HB LYS 26 HB2 LYS 26 7.280 -16.771 11.195 193 2HB LYS 26 HB3 LYS 26 7.528 -18.373 10.485 194 1HG LYS 26 HG2 LYS 26 9.504 -17.659 9.299 195 2HG LYS 26 HG3 LYS 26 9.217 -15.964 9.724 196 1HD LYS 26 HD2 LYS 26 9.579 -16.578 12.144 197 2HD LYS 26 HD3 LYS 26 9.843 -18.255 11.649 198 1HE LYS 26 HE2 LYS 26 11.996 -17.152 11.999 199 2HE LYS 26 HE3 LYS 26 11.811 -17.557 10.284 200 1HZ LYS 26 HZ1 LYS 26 12.669 -15.349 10.630 201 2HZ LYS 26 HZ2 LYS 26 11.210 -15.289 9.874 202 3HZ LYS 26 HZ3 LYS 26 11.320 -14.916 11.478 203 H HIS 27 H HIS 27 4.954 -15.525 10.382 204 HA HIS 27 HA HIS 27 5.032 -13.231 8.623 205 1HB HIS 27 HB2 HIS 27 3.580 -13.604 11.259 206 2HB HIS 27 HB3 HIS 27 3.243 -12.375 10.033 207 HD1 HIS 27 HD1 HIS 27 3.534 -14.835 7.640 208 HD2 HIS 27 HD2 HIS 27 0.977 -14.412 10.969 209 HE1 HIS 27 HE1 HIS 27 1.478 -16.252 7.170 210 H THR 28 H THR 28 7.596 -13.351 9.499 211 HA THR 28 HA THR 28 7.973 -11.028 11.284 212 HB THR 28 HB THR 28 9.679 -12.366 12.547 213 HG1 THR 28 HG1 THR 28 9.508 -14.066 10.831 214 1HG2 THR 28 HG21 THR 28 6.844 -13.438 12.889 215 2HG2 THR 28 HG22 THR 28 8.146 -13.446 14.087 216 3HG2 THR 28 HG23 THR 28 7.447 -11.902 13.560 217 H LEU 29 H LEU 29 9.757 -9.883 10.699 218 HA LEU 29 HA LEU 29 11.750 -11.101 8.794 219 1HB LEU 29 HB2 LEU 29 10.946 -8.211 9.345 220 2HB LEU 29 HB3 LEU 29 12.402 -8.655 8.455 221 HG LEU 29 HG LEU 29 9.613 -9.474 7.564 222 1HD1 LEU 29 HD11 LEU 29 9.795 -7.592 5.966 223 2HD1 LEU 29 HD12 LEU 29 9.858 -6.979 7.630 224 3HD1 LEU 29 HD13 LEU 29 11.350 -7.119 6.685 225 1HD2 LEU 29 HD21 LEU 29 11.486 -10.823 6.632 226 2HD2 LEU 29 HD22 LEU 29 10.731 -9.788 5.413 227 3HD2 LEU 29 HD23 LEU 29 12.298 -9.329 6.121 228 H SER 30 H SER 30 13.797 -11.375 9.672 229 HA SER 30 HA SER 30 14.279 -10.398 12.409 230 1HB SER 30 HB2 SER 30 15.202 -12.577 11.507 231 2HB SER 30 HB3 SER 30 16.268 -11.620 10.458 232 HG SER 30 HG SER 30 16.124 -11.661 13.299 233 H LYS 31 H LYS 31 15.698 -8.697 12.926 234 HA LYS 31 HA LYS 31 15.387 -6.368 11.628 235 1HB LYS 31 HB2 LYS 31 17.356 -5.535 12.947 236 2HB LYS 31 HB3 LYS 31 16.129 -6.410 13.854 237 1HG LYS 31 HG2 LYS 31 17.548 -8.421 13.927 238 2HG LYS 31 HG3 LYS 31 18.792 -7.600 12.959 239 1HD LYS 31 HD2 LYS 31 19.131 -5.932 14.696 240 2HD LYS 31 HD3 LYS 31 17.800 -6.594 15.656 241 1HE LYS 31 HE2 LYS 31 19.021 -8.754 15.880 242 2HE LYS 31 HE3 LYS 31 20.355 -8.102 14.912 243 1HZ LYS 31 HZ1 LYS 31 20.705 -6.461 16.600 244 2HZ LYS 31 HZ2 LYS 31 19.442 -7.035 17.490 245 3HZ LYS 31 HZ3 LYS 31 20.772 -7.973 17.252 246 H LYS 32 H LYS 32 18.143 -8.522 11.076 247 HA LYS 32 HA LYS 32 19.402 -6.691 9.193 248 1HB LYS 32 HB2 LYS 32 20.737 -8.226 10.520 249 2HB LYS 32 HB3 LYS 32 19.917 -9.614 9.803 250 1HG LYS 32 HG2 LYS 32 22.143 -9.296 8.851 251 2HG LYS 32 HG3 LYS 32 20.887 -9.165 7.629 252 1HD LYS 32 HD2 LYS 32 22.616 -7.550 7.237 253 2HD LYS 32 HD3 LYS 32 21.126 -6.699 7.590 254 1HE LYS 32 HE2 LYS 32 23.246 -7.227 9.734 255 2HE LYS 32 HE3 LYS 32 23.360 -5.858 8.621 256 1HZ LYS 32 HZ1 LYS 32 22.336 -5.196 10.621 257 2HZ LYS 32 HZ2 LYS 32 21.248 -5.088 9.388 258 3HZ LYS 32 HZ3 LYS 32 21.142 -6.318 10.474 259 H GLU 33 H GLU 33 17.044 -9.308 8.903 260 HA GLU 33 HA GLU 33 17.279 -9.578 6.020 261 1HB GLU 33 HB2 GLU 33 16.322 -11.351 7.566 262 2HB GLU 33 HB3 GLU 33 14.932 -10.285 7.835 263 1HG GLU 33 HG2 GLU 33 14.313 -11.875 6.166 264 2HG GLU 33 HG3 GLU 33 14.496 -10.325 5.351 265 H LEU 34 H LEU 34 15.262 -7.751 8.344 266 HA LEU 34 HA LEU 34 13.724 -6.295 6.441 267 1HB LEU 34 HB2 LEU 34 13.082 -6.244 8.715 268 2HB LEU 34 HB3 LEU 34 14.642 -5.673 9.267 269 HG LEU 34 HG LEU 34 12.869 -3.997 9.364 270 1HD1 LEU 34 HD11 LEU 34 14.188 -2.166 8.831 271 2HD1 LEU 34 HD12 LEU 34 15.386 -3.450 8.982 272 3HD1 LEU 34 HD13 LEU 34 14.862 -2.906 7.387 273 1HD2 LEU 34 HD21 LEU 34 11.563 -4.598 7.386 274 2HD2 LEU 34 HD22 LEU 34 12.040 -2.893 7.295 275 3HD2 LEU 34 HD23 LEU 34 12.882 -4.085 6.317 276 H LYS 35 H LYS 35 16.958 -5.533 7.941 277 HA LYS 35 HA LYS 35 17.314 -3.174 6.482 278 1HB LYS 35 HB2 LYS 35 18.830 -4.289 8.326 279 2HB LYS 35 HB3 LYS 35 19.695 -4.966 6.925 280 1HG LYS 35 HG2 LYS 35 19.595 -2.482 6.032 281 2HG LYS 35 HG3 LYS 35 19.191 -2.092 7.713 282 1HD LYS 35 HD2 LYS 35 21.338 -2.963 8.479 283 2HD LYS 35 HD3 LYS 35 21.713 -3.572 6.849 284 1HE LYS 35 HE2 LYS 35 21.599 -1.242 5.953 285 2HE LYS 35 HE3 LYS 35 21.274 -0.639 7.583 286 1HZ LYS 35 HZ1 LYS 35 23.425 -1.479 8.233 287 2HZ LYS 35 HZ2 LYS 35 23.693 -2.078 6.720 288 3HZ LYS 35 HZ3 LYS 35 23.579 -0.456 6.949 289 H GLU 36 H GLU 36 17.987 -6.532 5.472 290 HA GLU 36 HA GLU 36 19.078 -5.956 2.925 291 1HB GLU 36 HB2 GLU 36 18.963 -8.196 4.197 292 2HB GLU 36 HB3 GLU 36 17.341 -8.380 3.512 293 1HG GLU 36 HG2 GLU 36 18.316 -8.102 1.220 294 2HG GLU 36 HG3 GLU 36 19.929 -8.005 1.945 295 H LEU 37 H LEU 37 15.665 -6.582 3.879 296 HA LEU 37 HA LEU 37 14.369 -6.149 1.433 297 1HB LEU 37 HB2 LEU 37 13.228 -6.916 3.441 298 2HB LEU 37 HB3 LEU 37 13.499 -5.409 4.271 299 HG LEU 37 HG LEU 37 11.761 -5.554 1.807 300 1HD1 LEU 37 HD11 LEU 37 10.866 -7.038 3.578 301 2HD1 LEU 37 HD12 LEU 37 11.039 -5.727 4.770 302 3HD1 LEU 37 HD13 LEU 37 9.870 -5.586 3.457 303 1HD2 LEU 37 HD21 LEU 37 12.044 -3.498 4.077 304 2HD2 LEU 37 HD22 LEU 37 12.349 -3.213 2.344 305 3HD2 LEU 37 HD23 LEU 37 10.719 -3.514 2.908 306 H ILE 38 H ILE 38 15.277 -3.658 3.867 307 HA ILE 38 HA ILE 38 14.299 -1.528 2.245 308 HB ILE 38 HB ILE 38 16.360 -1.577 4.477 309 1HG1 ILE 38 HG12 ILE 38 13.393 -0.820 4.307 310 2HG1 ILE 38 HG13 ILE 38 14.051 -2.288 5.045 311 1HG2 ILE 38 HG21 ILE 38 15.040 0.835 3.154 312 2HG2 ILE 38 HG22 ILE 38 16.022 0.874 4.624 313 3HG2 ILE 38 HG23 ILE 38 16.767 0.435 3.095 314 1HD1 ILE 38 HD11 ILE 38 14.327 0.550 5.982 315 2HD1 ILE 38 HD12 ILE 38 13.588 -0.831 6.812 316 3HD1 ILE 38 HD13 ILE 38 15.361 -0.761 6.622 317 H GLN 39 H GLN 39 17.665 -2.779 2.557 318 HA GLN 39 HA GLN 39 18.759 -0.904 0.712 319 1HB GLN 39 HB2 GLN 39 19.622 -3.666 1.590 320 2HB GLN 39 HB3 GLN 39 20.581 -2.693 0.462 321 1HG GLN 39 HG2 GLN 39 20.942 -0.940 2.020 322 2HG GLN 39 HG3 GLN 39 19.675 -1.511 3.114 323 1HE2 GLN 39 HE22 GLN 39 19.967 -3.756 3.958 324 2HE2 GLN 39 HE21 GLN 39 21.596 -4.219 4.479 325 H LYS 40 H LYS 40 17.199 -4.104 0.086 326 HA LYS 40 HA LYS 40 17.945 -3.929 -2.717 327 1HB LYS 40 HB2 LYS 40 17.754 -6.055 -1.415 328 2HB LYS 40 HB3 LYS 40 16.017 -5.802 -1.330 329 1HG LYS 40 HG2 LYS 40 16.635 -7.390 -3.119 330 2HG LYS 40 HG3 LYS 40 15.817 -5.976 -3.769 331 1HD LYS 40 HD2 LYS 40 17.720 -6.737 -5.158 332 2HD LYS 40 HD3 LYS 40 17.898 -5.071 -4.637 333 1HE LYS 40 HE2 LYS 40 20.025 -6.338 -4.492 334 2HE LYS 40 HE3 LYS 40 19.530 -5.752 -2.901 335 1HZ LYS 40 HZ1 LYS 40 19.113 -8.475 -3.926 336 2HZ LYS 40 HZ2 LYS 40 20.261 -8.017 -2.835 337 3HZ LYS 40 HZ3 LYS 40 18.665 -7.930 -2.436 338 H GLU 41 H GLU 41 14.904 -3.471 -0.871 339 HA GLU 41 HA GLU 41 13.375 -2.989 -3.314 340 1HB GLU 41 HB2 GLU 41 12.507 -2.754 -0.409 341 2HB GLU 41 HB3 GLU 41 11.467 -2.754 -1.836 342 1HG GLU 41 HG2 GLU 41 13.191 -5.082 -0.870 343 2HG GLU 41 HG3 GLU 41 11.436 -4.950 -0.769 344 H LEU 42 H LEU 42 14.551 -0.955 -0.575 345 HA LEU 42 HA LEU 42 13.265 1.423 -1.828 346 1HB LEU 42 HB2 LEU 42 14.502 0.965 0.886 347 2HB LEU 42 HB3 LEU 42 14.182 2.566 0.233 348 HG LEU 42 HG LEU 42 11.788 2.118 0.063 349 1HD1 LEU 42 HD11 LEU 42 12.480 -0.645 1.136 350 2HD1 LEU 42 HD12 LEU 42 10.853 0.052 1.181 351 3HD1 LEU 42 HD13 LEU 42 11.629 -0.241 -0.375 352 1HD2 LEU 42 HD21 LEU 42 11.272 2.100 2.420 353 2HD2 LEU 42 HD22 LEU 42 12.829 1.351 2.811 354 3HD2 LEU 42 HD23 LEU 42 12.771 3.010 2.172 355 H THR 43 H THR 43 16.469 0.288 -0.731 356 HA THR 43 HA THR 43 18.556 0.696 -1.493 357 HB THR 43 HB THR 43 17.330 1.531 -4.144 358 HG1 THR 43 HG1 THR 43 17.590 -1.054 -3.006 359 1HG2 THR 43 HG21 THR 43 19.804 -0.107 -3.421 360 2HG2 THR 43 HG22 THR 43 19.232 0.265 -5.059 361 3HG2 THR 43 HG23 THR 43 19.807 1.570 -4.010 362 H ILE 44 H ILE 44 18.530 2.511 0.081 363 HA ILE 44 HA ILE 44 18.644 5.200 -0.936 364 HB ILE 44 HB ILE 44 19.670 5.821 1.082 365 1HG1 ILE 44 HG12 ILE 44 21.290 4.236 1.728 366 2HG1 ILE 44 HG13 ILE 44 20.076 4.291 2.978 367 1HG2 ILE 44 HG21 ILE 44 17.236 5.411 0.959 368 2HG2 ILE 44 HG22 ILE 44 17.476 3.814 1.692 369 3HG2 ILE 44 HG23 ILE 44 17.894 5.289 2.592 370 1HD1 ILE 44 HD11 ILE 44 19.090 2.152 2.114 371 2HD1 ILE 44 HD12 ILE 44 20.407 2.078 0.910 372 3HD1 ILE 44 HD13 ILE 44 20.779 2.011 2.628 373 H GLY 45 H GLY 45 19.852 5.397 -2.762 374 1HA GLY 45 HA2 GLY 45 22.406 4.157 -3.184 375 2HA GLY 45 HA3 GLY 45 21.668 5.437 -4.153 376 H SER 46 H SER 46 22.942 5.159 -0.831 377 HA SER 46 HA SER 46 25.214 6.862 -1.076 378 1HB SER 46 HB2 SER 46 22.636 8.157 -0.120 379 2HB SER 46 HB3 SER 46 24.202 8.670 0.522 380 HG SER 46 HG SER 46 23.662 8.541 -2.253 381 H LYS 47 H LYS 47 25.945 4.954 -0.045 382 HA LYS 47 HA LYS 47 24.746 3.649 2.073 383 1HB LYS 47 HB2 LYS 47 27.709 3.797 1.405 384 2HB LYS 47 HB3 LYS 47 26.945 2.601 2.471 385 1HG LYS 47 HG2 LYS 47 25.423 1.968 0.533 386 2HG LYS 47 HG3 LYS 47 26.454 2.932 -0.526 387 1HD LYS 47 HD2 LYS 47 27.257 0.518 1.165 388 2HD LYS 47 HD3 LYS 47 27.077 0.554 -0.589 389 1HE LYS 47 HE2 LYS 47 29.203 2.024 1.048 390 2HE LYS 47 HE3 LYS 47 29.442 0.608 0.022 391 1HZ LYS 47 HZ1 LYS 47 30.092 2.587 -1.095 392 2HZ LYS 47 HZ2 LYS 47 28.793 1.927 -1.864 393 3HZ LYS 47 HZ3 LYS 47 28.601 3.259 -0.910 394 H LEU 48 H LEU 48 26.472 6.655 2.328 395 HA LEU 48 HA LEU 48 27.217 6.690 5.049 396 1HB LEU 48 HB2 LEU 48 25.838 8.885 3.447 397 2HB LEU 48 HB3 LEU 48 26.759 9.111 4.938 398 HG LEU 48 HG LEU 48 27.903 8.164 2.264 399 1HD1 LEU 48 HD11 LEU 48 28.189 10.802 3.756 400 2HD1 LEU 48 HD12 LEU 48 28.990 10.363 2.233 401 3HD1 LEU 48 HD13 LEU 48 27.227 10.536 2.286 402 1HD2 LEU 48 HD21 LEU 48 29.274 8.755 4.928 403 2HD2 LEU 48 HD22 LEU 48 29.211 7.184 4.094 404 3HD2 LEU 48 HD23 LEU 48 30.111 8.524 3.380 405 H GLN 49 H GLN 49 24.014 6.822 3.566 406 HA GLN 49 HA GLN 49 22.549 7.605 5.897 407 1HB GLN 49 HB2 GLN 49 21.720 6.038 3.427 408 2HB GLN 49 HB3 GLN 49 20.604 6.638 4.663 409 1HG GLN 49 HG2 GLN 49 21.356 8.971 4.212 410 2HG GLN 49 HG3 GLN 49 22.437 8.372 2.945 411 1HE2 GLN 49 HE22 GLN 49 18.950 8.114 3.932 412 2HE2 GLN 49 HE21 GLN 49 18.351 8.224 2.285 413 H ASP 50 H ASP 50 24.155 4.577 5.224 414 HA ASP 50 HA ASP 50 22.417 2.695 6.230 415 1HB ASP 50 HB2 ASP 50 25.437 2.890 6.352 416 2HB ASP 50 HB3 ASP 50 24.578 1.566 7.130 417 H ALA 51 H ALA 51 24.365 4.965 8.181 418 HA ALA 51 HA ALA 51 23.838 3.873 10.756 419 1HB ALA 51 HB1 ALA 51 24.187 6.183 11.556 420 2HB ALA 51 HB2 ALA 51 25.413 5.719 10.358 421 3HB ALA 51 HB3 ALA 51 24.072 6.790 9.891 422 H GLU 52 H GLU 52 21.896 6.059 8.701 423 HA GLU 52 HA GLU 52 19.789 6.440 10.657 424 1HB GLU 52 HB2 GLU 52 19.626 6.854 7.641 425 2HB GLU 52 HB3 GLU 52 18.617 7.567 8.902 426 1HG GLU 52 HG2 GLU 52 21.561 8.162 8.343 427 2HG GLU 52 HG3 GLU 52 20.184 9.243 8.133 428 H ILE 53 H ILE 53 20.406 4.294 7.868 429 HA ILE 53 HA ILE 53 17.884 2.971 7.929 430 HB ILE 53 HB ILE 53 20.557 1.708 7.219 431 1HG1 ILE 53 HG12 ILE 53 20.006 3.794 5.865 432 2HG1 ILE 53 HG13 ILE 53 20.213 2.305 4.952 433 1HG2 ILE 53 HG21 ILE 53 19.143 0.158 5.864 434 2HG2 ILE 53 HG22 ILE 53 18.853 0.031 7.605 435 3HG2 ILE 53 HG23 ILE 53 17.690 0.876 6.596 436 1HD1 ILE 53 HD11 ILE 53 18.239 3.767 4.296 437 2HD1 ILE 53 HD12 ILE 53 17.895 2.061 4.598 438 3HD1 ILE 53 HD13 ILE 53 17.469 3.293 5.817 439 H VAL 54 H VAL 54 20.912 2.173 9.726 440 HA VAL 54 HA VAL 54 19.563 0.000 11.035 441 HB VAL 54 HB VAL 54 21.414 -0.142 12.621 442 1HG1 VAL 54 HG11 VAL 54 21.250 -1.431 10.503 443 2HG1 VAL 54 HG12 VAL 54 22.149 -0.136 9.679 444 3HG1 VAL 54 HG13 VAL 54 22.927 -1.090 10.960 445 1HG2 VAL 54 HG21 VAL 54 23.465 1.031 12.299 446 2HG2 VAL 54 HG22 VAL 54 22.779 1.966 10.970 447 3HG2 VAL 54 HG23 VAL 54 22.179 2.205 12.627 448 H LYS 55 H LYS 55 19.884 3.441 11.953 449 HA LYS 55 HA LYS 55 18.662 3.139 14.516 450 1HB LYS 55 HB2 LYS 55 19.625 5.247 13.861 451 2HB LYS 55 HB3 LYS 55 18.531 5.395 12.484 452 1HG LYS 55 HG2 LYS 55 17.887 6.866 14.306 453 2HG LYS 55 HG3 LYS 55 16.606 5.711 13.934 454 1HD LYS 55 HD2 LYS 55 17.255 4.321 15.887 455 2HD LYS 55 HD3 LYS 55 18.581 5.436 16.259 456 1HE LYS 55 HE2 LYS 55 15.598 6.129 16.207 457 2HE LYS 55 HE3 LYS 55 16.535 5.761 17.662 458 1HZ LYS 55 HZ1 LYS 55 17.010 8.021 15.849 459 2HZ LYS 55 HZ2 LYS 55 16.336 8.094 17.348 460 3HZ LYS 55 HZ3 LYS 55 17.916 7.658 17.179 461 H LEU 56 H LEU 56 17.196 3.670 11.284 462 HA LEU 56 HA LEU 56 14.481 3.454 12.053 463 1HB LEU 56 HB2 LEU 56 15.001 4.430 10.024 464 2HB LEU 56 HB3 LEU 56 16.002 3.098 9.468 465 HG LEU 56 HG LEU 56 13.108 2.483 9.975 466 1HD1 LEU 56 HD11 LEU 56 14.093 4.009 7.528 467 2HD1 LEU 56 HD12 LEU 56 12.491 3.269 7.721 468 3HD1 LEU 56 HD13 LEU 56 12.967 4.628 8.756 469 1HD2 LEU 56 HD21 LEU 56 15.092 1.752 7.769 470 2HD2 LEU 56 HD22 LEU 56 14.750 0.730 9.165 471 3HD2 LEU 56 HD23 LEU 56 13.453 1.086 8.017 472 H MET 57 H MET 57 16.787 0.906 11.092 473 HA MET 57 HA MET 57 15.045 -1.322 11.123 474 1HB MET 57 HB2 MET 57 17.396 -1.317 10.250 475 2HB MET 57 HB3 MET 57 17.965 -1.100 11.912 476 1HG MET 57 HG2 MET 57 16.939 -3.308 12.513 477 2HG MET 57 HG3 MET 57 16.596 -3.529 10.800 478 1HE MET 57 HE1 MET 57 19.248 -3.459 13.629 479 2HE MET 57 HE2 MET 57 20.789 -3.542 12.746 480 3HE MET 57 HE3 MET 57 19.823 -2.055 12.704 481 H ASP 58 H ASP 58 17.122 0.096 13.697 482 HA ASP 58 HA ASP 58 16.332 -1.586 15.818 483 1HB ASP 58 HB2 ASP 58 18.218 -0.050 16.011 484 2HB ASP 58 HB3 ASP 58 17.135 1.346 15.936 485 H ASP 59 H ASP 59 14.909 1.552 14.740 486 HA ASP 59 HA ASP 59 12.809 1.616 16.616 487 1HB ASP 59 HB2 ASP 59 12.709 2.621 13.738 488 2HB ASP 59 HB3 ASP 59 11.614 3.075 15.044 489 H LEU 60 H LEU 60 12.735 0.177 13.318 490 HA LEU 60 HA LEU 60 10.131 -0.908 13.406 491 1HB LEU 60 HB2 LEU 60 12.682 -1.605 11.956 492 2HB LEU 60 HB3 LEU 60 11.358 -2.759 11.894 493 HG LEU 60 HG LEU 60 10.766 0.115 11.264 494 1HD1 LEU 60 HD11 LEU 60 11.909 -1.805 9.217 495 2HD1 LEU 60 HD12 LEU 60 11.273 -0.192 8.892 496 3HD1 LEU 60 HD13 LEU 60 12.744 -0.377 9.873 497 1HD2 LEU 60 HD21 LEU 60 8.922 -1.618 11.329 498 2HD2 LEU 60 HD22 LEU 60 9.149 -0.993 9.671 499 3HD2 LEU 60 HD23 LEU 60 9.799 -2.562 10.103 500 H ASP 61 H ASP 61 13.197 -2.625 14.288 501 HA ASP 61 HA ASP 61 11.633 -4.895 15.165 502 1HB ASP 61 HB2 ASP 61 13.548 -6.059 15.434 503 2HB ASP 61 HB3 ASP 61 13.979 -4.943 14.141 504 H ARG 62 H ARG 62 12.781 -2.084 16.868 505 HA ARG 62 HA ARG 62 12.692 -3.193 19.484 506 1HB ARG 62 HB2 ARG 62 13.904 -1.146 19.014 507 2HB ARG 62 HB3 ARG 62 12.419 -0.332 18.490 508 1HG ARG 62 HG2 ARG 62 13.156 0.397 20.705 509 2HG ARG 62 HG3 ARG 62 11.558 -0.328 20.765 510 1HD ARG 62 HD2 ARG 62 12.688 -2.504 21.579 511 2HD ARG 62 HD3 ARG 62 14.209 -1.611 21.583 512 HE ARG 62 HE ARG 62 13.580 -0.559 23.525 513 1HH1 ARG 62 HH12 ARG 62 10.679 -2.031 22.062 514 2HH1 ARG 62 HH11 ARG 62 9.712 -1.831 23.493 515 1HH2 ARG 62 HH22 ARG 62 12.281 -0.261 25.368 516 2HH2 ARG 62 HH21 ARG 62 10.618 -0.781 25.384 517 H ASN 63 H ASN 63 10.135 -2.458 17.261 518 HA ASN 63 HA ASN 63 8.015 -2.035 19.116 519 1HB ASN 63 HB2 ASN 63 8.010 -1.982 16.538 520 2HB ASN 63 HB3 ASN 63 7.819 -3.733 16.609 521 1HD2 ASN 63 HD21 ASN 63 5.968 -3.721 19.011 522 2HD2 ASN 63 HD22 ASN 63 4.498 -2.966 18.427 523 H LYS 64 H LYS 64 9.968 -4.838 18.284 524 HA LYS 64 HA LYS 64 8.860 -6.349 20.571 525 1HB LYS 64 HB2 LYS 64 8.120 -7.292 18.297 526 2HB LYS 64 HB3 LYS 64 9.813 -7.651 17.998 527 1HG LYS 64 HG2 LYS 64 9.628 -8.929 20.350 528 2HG LYS 64 HG3 LYS 64 7.894 -8.761 20.096 529 1HD LYS 64 HD2 LYS 64 9.873 -10.085 18.180 530 2HD LYS 64 HD3 LYS 64 8.789 -10.938 19.292 531 1HE LYS 64 HE2 LYS 64 6.817 -9.965 18.106 532 2HE LYS 64 HE3 LYS 64 7.907 -9.156 16.965 533 1HZ LYS 64 HZ1 LYS 64 7.738 -12.053 17.352 534 2HZ LYS 64 HZ2 LYS 64 7.081 -11.203 16.102 535 3HZ LYS 64 HZ3 LYS 64 8.717 -11.263 16.284 536 H ASP 65 H ASP 65 11.251 -8.130 19.329 537 HA ASP 65 HA ASP 65 13.467 -6.334 19.850 538 1HB ASP 65 HB2 ASP 65 14.593 -7.556 21.469 539 2HB ASP 65 HB3 ASP 65 12.952 -7.476 22.104 540 H GLN 66 H GLN 66 14.372 -6.536 17.945 541 HA GLN 66 HA GLN 66 15.722 -7.439 16.360 542 1HB GLN 66 HB2 GLN 66 15.367 -10.148 17.694 543 2HB GLN 66 HB3 GLN 66 16.594 -9.686 16.519 544 1HG GLN 66 HG2 GLN 66 17.552 -8.049 18.062 545 2HG GLN 66 HG3 GLN 66 16.303 -8.364 19.268 546 1HE2 GLN 66 HE22 GLN 66 16.192 -10.488 20.314 547 2HE2 GLN 66 HE21 GLN 66 17.659 -11.454 20.383 548 H GLU 67 H GLU 67 12.690 -9.232 16.878 549 HA GLU 67 HA GLU 67 12.578 -9.888 13.968 550 1HB GLU 67 HB2 GLU 67 11.012 -11.009 16.315 551 2HB GLU 67 HB3 GLU 67 10.875 -11.510 14.625 552 1HG GLU 67 HG2 GLU 67 13.343 -11.790 16.408 553 2HG GLU 67 HG3 GLU 67 12.270 -13.089 15.881 554 H VAL 68 H VAL 68 11.585 -8.345 12.848 555 HA VAL 68 HA VAL 68 9.538 -6.573 13.991 556 HB VAL 68 HB VAL 68 10.375 -6.947 11.080 557 1HG1 VAL 68 HG11 VAL 68 8.258 -5.691 11.518 558 2HG1 VAL 68 HG12 VAL 68 9.174 -4.551 12.525 559 3HG1 VAL 68 HG13 VAL 68 9.525 -4.699 10.790 560 1HG2 VAL 68 HG21 VAL 68 11.599 -4.963 12.990 561 2HG2 VAL 68 HG22 VAL 68 12.428 -6.408 12.372 562 3HG2 VAL 68 HG23 VAL 68 11.927 -5.129 11.264 563 H ASN 69 H ASN 69 7.508 -7.574 14.299 564 HA ASN 69 HA ASN 69 6.716 -9.800 12.549 565 1HB ASN 69 HB2 ASN 69 5.866 -10.009 14.749 566 2HB ASN 69 HB3 ASN 69 5.375 -8.315 14.813 567 1HD2 ASN 69 HD21 ASN 69 4.626 -11.287 12.794 568 2HD2 ASN 69 HD22 ASN 69 2.908 -10.949 12.811 569 H PHE 70 H PHE 70 5.052 -9.763 11.041 570 HA PHE 70 HA PHE 70 4.830 -7.797 9.169 571 1HB PHE 70 HB2 PHE 70 3.848 -9.987 8.881 572 2HB PHE 70 HB3 PHE 70 2.677 -9.687 10.167 573 HD1 PHE 70 HD1 PHE 70 0.524 -8.884 9.578 574 HD2 PHE 70 HD2 PHE 70 3.862 -8.149 6.946 575 HE1 PHE 70 HE1 PHE 70 -0.962 -7.664 8.031 576 HE2 PHE 70 HE2 PHE 70 2.367 -6.934 5.393 577 HZ PHE 70 HZ PHE 70 -0.041 -6.659 5.949 578 H GLN 71 H GLN 71 2.671 -7.943 12.078 579 HA GLN 71 HA GLN 71 1.101 -5.758 11.174 580 1HB GLN 71 HB2 GLN 71 0.588 -7.566 12.979 581 2HB GLN 71 HB3 GLN 71 1.528 -6.573 14.093 582 1HG GLN 71 HG2 GLN 71 -0.903 -6.128 14.273 583 2HG GLN 71 HG3 GLN 71 -0.018 -4.685 13.754 584 1HE2 GLN 71 HE21 GLN 71 -1.333 -7.614 12.037 585 2HE2 GLN 71 HE22 GLN 71 -2.136 -6.686 10.785 586 H GLU 72 H GLU 72 3.994 -5.984 13.174 587 HA GLU 72 HA GLU 72 4.089 -3.253 14.081 588 1HB GLU 72 HB2 GLU 72 6.357 -5.259 13.719 589 2HB GLU 72 HB3 GLU 72 6.381 -3.792 14.690 590 1HG GLU 72 HG2 GLU 72 4.581 -4.696 16.143 591 2HG GLU 72 HG3 GLU 72 4.501 -6.172 15.184 592 H TYR 73 H TYR 73 5.517 -5.068 11.358 593 HA TYR 73 HA TYR 73 6.926 -2.952 10.106 594 1HB TYR 73 HB2 TYR 73 7.415 -5.042 9.300 595 2HB TYR 73 HB3 TYR 73 5.751 -5.561 9.221 596 HD1 TYR 73 HD1 TYR 73 8.414 -3.735 7.435 597 HD2 TYR 73 HD2 TYR 73 4.341 -5.154 7.308 598 HE1 TYR 73 HE1 TYR 73 8.464 -3.698 4.952 599 HE2 TYR 73 HE2 TYR 73 4.365 -5.018 4.851 600 HH TYR 73 HH TYR 73 5.788 -4.960 2.996 601 H ILE 74 H ILE 74 3.484 -4.007 9.502 602 HA ILE 74 HA ILE 74 2.979 -1.869 7.689 603 HB ILE 74 HB ILE 74 0.984 -3.232 9.530 604 1HG1 ILE 74 HG12 ILE 74 2.093 -4.816 7.947 605 2HG1 ILE 74 HG13 ILE 74 0.364 -4.634 7.727 606 1HG2 ILE 74 HG21 ILE 74 -0.063 -1.228 8.844 607 2HG2 ILE 74 HG22 ILE 74 0.679 -1.264 7.233 608 3HG2 ILE 74 HG23 ILE 74 -0.617 -2.385 7.631 609 1HD1 ILE 74 HD11 ILE 74 1.429 -4.727 5.549 610 2HD1 ILE 74 HD12 ILE 74 0.775 -3.115 5.771 611 3HD1 ILE 74 HD13 ILE 74 2.524 -3.405 5.984 612 H THR 75 H THR 75 2.463 -2.008 11.243 613 HA THR 75 HA THR 75 1.392 0.556 11.616 614 HB THR 75 HB THR 75 3.366 -0.860 13.469 615 HG1 THR 75 HG1 THR 75 1.623 -2.211 12.936 616 1HG2 THR 75 HG21 THR 75 2.891 1.468 14.164 617 2HG2 THR 75 HG22 THR 75 1.148 1.151 14.032 618 3HG2 THR 75 HG23 THR 75 2.117 0.301 15.250 619 H PHE 76 H PHE 76 4.852 -0.416 11.577 620 HA PHE 76 HA PHE 76 5.907 2.191 11.952 621 1HB PHE 76 HB2 PHE 76 7.228 0.145 12.276 622 2HB PHE 76 HB3 PHE 76 7.125 -0.195 10.547 623 HD1 PHE 76 HD1 PHE 76 8.457 1.121 8.906 624 HD2 PHE 76 HD2 PHE 76 8.558 2.096 13.116 625 HE1 PHE 76 HE1 PHE 76 10.347 2.623 8.512 626 HE2 PHE 76 HE2 PHE 76 10.367 3.733 12.673 627 HZ PHE 76 HZ PHE 76 11.212 4.056 10.351 628 H LEU 77 H LEU 77 5.185 0.361 8.889 629 HA LEU 77 HA LEU 77 6.079 2.480 7.181 630 1HB LEU 77 HB2 LEU 77 4.031 0.279 6.781 631 2HB LEU 77 HB3 LEU 77 4.448 1.435 5.513 632 HG LEU 77 HG LEU 77 6.514 -0.340 6.898 633 1HD1 LEU 77 HD11 LEU 77 6.479 -1.628 4.789 634 2HD1 LEU 77 HD12 LEU 77 4.946 -1.749 5.679 635 3HD1 LEU 77 HD13 LEU 77 5.074 -0.701 4.239 636 1HD2 LEU 77 HD21 LEU 77 7.856 0.213 4.833 637 2HD2 LEU 77 HD22 LEU 77 6.612 1.399 4.386 638 3HD2 LEU 77 HD23 LEU 77 7.581 1.603 5.873 639 H GLY 78 H GLY 78 2.990 1.970 8.875 640 1HA GLY 78 HA2 GLY 78 1.595 4.233 7.882 641 2HA GLY 78 HA3 GLY 78 1.426 3.533 9.508 642 H ALA 79 H ALA 79 3.876 3.972 10.661 643 HA ALA 79 HA ALA 79 3.864 6.758 11.264 644 1HB ALA 79 HB1 ALA 79 4.742 5.020 12.797 645 2HB ALA 79 HB2 ALA 79 6.142 4.789 11.724 646 3HB ALA 79 HB3 ALA 79 5.893 6.345 12.531 647 H LEU 80 H LEU 80 5.973 4.909 9.058 648 HA LEU 80 HA LEU 80 7.702 6.980 8.266 649 1HB LEU 80 HB2 LEU 80 7.694 4.396 7.742 650 2HB LEU 80 HB3 LEU 80 6.653 4.831 6.395 651 HG LEU 80 HG LEU 80 8.526 6.478 5.707 652 1HD1 LEU 80 HD11 LEU 80 10.806 5.803 6.438 653 2HD1 LEU 80 HD12 LEU 80 9.866 6.387 7.825 654 3HD1 LEU 80 HD13 LEU 80 10.108 4.644 7.577 655 1HD2 LEU 80 HD21 LEU 80 9.064 3.476 5.688 656 2HD2 LEU 80 HD22 LEU 80 8.018 4.339 4.532 657 3HD2 LEU 80 HD23 LEU 80 9.763 4.656 4.566 658 H ALA 81 H ALA 81 4.588 5.907 6.883 659 HA ALA 81 HA ALA 81 4.331 7.886 4.854 660 1HB ALA 81 HB1 ALA 81 2.296 6.234 6.376 661 2HB ALA 81 HB2 ALA 81 1.901 7.328 5.034 662 3HB ALA 81 HB3 ALA 81 2.978 5.935 4.773 663 H MET 82 H MET 82 3.258 7.864 8.299 664 HA MET 82 HA MET 82 1.980 10.370 8.209 665 1HB MET 82 HB2 MET 82 1.791 8.650 10.046 666 2HB MET 82 HB3 MET 82 3.388 9.157 10.616 667 1HG MET 82 HG2 MET 82 1.717 10.258 11.934 668 2HG MET 82 HG3 MET 82 2.490 11.480 10.923 669 1HE MET 82 HE1 MET 82 -0.168 11.963 12.561 670 2HE MET 82 HE2 MET 82 0.567 13.200 11.508 671 3HE MET 82 HE3 MET 82 -1.164 12.819 11.362 672 H ILE 83 H ILE 83 5.366 9.516 8.928 673 HA ILE 83 HA ILE 83 6.322 12.165 9.424 674 HB ILE 83 HB ILE 83 7.688 9.636 8.446 675 1HG1 ILE 83 HG12 ILE 83 7.956 11.112 11.098 676 2HG1 ILE 83 HG13 ILE 83 6.714 9.890 10.838 677 1HG2 ILE 83 HG21 ILE 83 9.848 10.797 8.937 678 2HG2 ILE 83 HG22 ILE 83 9.004 11.513 7.574 679 3HG2 ILE 83 HG23 ILE 83 8.956 12.314 9.159 680 1HD1 ILE 83 HD11 ILE 83 8.455 8.208 10.285 681 2HD1 ILE 83 HD12 ILE 83 9.713 9.403 10.675 682 3HD1 ILE 83 HD13 ILE 83 8.591 8.856 11.928 683 H TYR 84 H TYR 84 5.886 10.297 6.381 684 HA TYR 84 HA TYR 84 6.764 12.510 4.700 685 1HB TYR 84 HB2 TYR 84 5.024 10.145 3.964 686 2HB TYR 84 HB3 TYR 84 5.907 11.198 2.865 687 HD1 TYR 84 HD1 TYR 84 8.532 11.115 4.801 688 HD2 TYR 84 HD2 TYR 84 5.996 8.209 2.856 689 HE1 TYR 84 HE1 TYR 84 10.442 9.570 4.603 690 HE2 TYR 84 HE2 TYR 84 7.924 6.678 2.645 691 HH TYR 84 HH TYR 84 10.182 6.396 2.992 692 H ASN 85 H ASN 85 5.193 13.798 6.396 693 HA ASN 85 HA ASN 85 2.561 14.351 5.983 694 1HB ASN 85 HB2 ASN 85 3.890 15.661 7.493 695 2HB ASN 85 HB3 ASN 85 4.876 16.309 6.173 696 1HD2 ASN 85 HD22 ASN 85 4.111 18.128 4.986 697 2HD2 ASN 85 HD21 ASN 85 2.566 18.875 5.356 698 H GLU 86 H GLU 86 5.198 15.346 3.788 699 HA GLU 86 HA GLU 86 3.670 16.863 1.981 700 1HB GLU 86 HB2 GLU 86 6.010 15.071 1.201 701 2HB GLU 86 HB3 GLU 86 5.444 16.545 0.406 702 1HG GLU 86 HG2 GLU 86 6.866 16.308 3.095 703 2HG GLU 86 HG3 GLU 86 7.413 17.126 1.635 704 H ALA 87 H ALA 87 4.150 13.317 2.122 705 HA ALA 87 HA ALA 87 2.736 12.766 -0.348 706 1HB ALA 87 HB1 ALA 87 2.778 10.457 0.384 707 2HB ALA 87 HB2 ALA 87 4.378 11.184 0.629 708 3HB ALA 87 HB3 ALA 87 3.291 10.922 2.013 709 H LEU 88 H LEU 88 1.906 12.916 3.142 710 HA LEU 88 HA LEU 88 -0.804 12.085 2.938 711 1HB LEU 88 HB2 LEU 88 0.162 14.272 4.794 712 2HB LEU 88 HB3 LEU 88 -1.252 13.249 4.958 713 HG LEU 88 HG LEU 88 1.634 12.330 5.186 714 1HD1 LEU 88 HD11 LEU 88 1.219 12.214 7.517 715 2HD1 LEU 88 HD12 LEU 88 0.564 13.766 7.040 716 3HD1 LEU 88 HD13 LEU 88 -0.530 12.391 7.313 717 1HD2 LEU 88 HD21 LEU 88 0.327 10.489 4.269 718 2HD2 LEU 88 HD22 LEU 88 0.625 10.185 5.983 719 3HD2 LEU 88 HD23 LEU 88 -0.970 10.761 5.458 720 H LYS 89 H LYS 89 0.559 15.388 2.650 721 HA LYS 89 HA LYS 89 -1.998 16.571 1.999 722 1HB LYS 89 HB2 LYS 89 0.823 17.592 1.478 723 2HB LYS 89 HB3 LYS 89 -0.664 18.545 1.365 724 1HG LYS 89 HG2 LYS 89 0.483 17.285 3.905 725 2HG LYS 89 HG3 LYS 89 0.478 18.993 3.463 726 1HD LYS 89 HD2 LYS 89 -2.052 18.929 3.468 727 2HD LYS 89 HD3 LYS 89 -1.962 17.265 4.081 728 1HE LYS 89 HE2 LYS 89 -0.633 18.098 6.046 729 2HE LYS 89 HE3 LYS 89 -0.891 19.754 5.466 730 1HZ LYS 89 HZ1 LYS 89 -3.257 19.366 5.657 731 2HZ LYS 89 HZ2 LYS 89 -2.995 17.844 6.217 732 3HZ LYS 89 HZ3 LYS 89 -2.495 19.138 7.102 733 H GLY 90 H GLY 90 0.655 15.289 -0.053 734 1HA GLY 90 HA2 GLY 90 -1.288 14.801 -2.172 735 2HA GLY 90 HA3 GLY 90 -0.121 16.078 -2.565 736 1H MET 1 H1 MET 1 15.589 0.293 -5.459 737 2H MET 1 H2 MET 1 14.311 0.183 -4.431 738 3H MET 1 H3 MET 1 15.145 1.592 -4.537 739 HA MET 1 HA MET 1 14.456 1.748 -6.891 740 1HB MET 1 HB2 MET 1 12.490 -0.409 -5.995 741 2HB MET 1 HB3 MET 1 12.488 0.455 -7.540 742 1HG MET 1 HG2 MET 1 14.713 -0.539 -8.071 743 2HG MET 1 HG3 MET 1 14.688 -1.394 -6.522 744 1HE MET 1 HE1 MET 1 11.623 -0.972 -9.086 745 2HE MET 1 HE2 MET 1 13.093 -1.117 -10.085 746 3HE MET 1 HE3 MET 1 11.899 -2.434 -10.051 747 H ALA 2 H ALA 2 12.615 1.073 -3.974 748 HA ALA 2 HA ALA 2 11.310 2.245 -2.590 749 1HB ALA 2 HB1 ALA 2 13.008 4.047 -2.849 750 2HB ALA 2 HB2 ALA 2 12.028 4.764 -4.145 751 3HB ALA 2 HB3 ALA 2 11.379 4.643 -2.499 752 H SER 3 H SER 3 10.870 3.582 -5.783 753 HA SER 3 HA SER 3 8.347 4.402 -5.968 754 1HB SER 3 HB2 SER 3 8.470 3.414 -8.397 755 2HB SER 3 HB3 SER 3 9.563 4.695 -7.860 756 HG SER 3 HG SER 3 11.199 3.175 -7.542 757 HA PRO 4 HA PRO 4 6.305 0.139 -6.876 758 1HB PRO 4 HB2 PRO 4 7.458 -2.140 -5.763 759 2HB PRO 4 HB3 PRO 4 7.670 -1.586 -7.448 760 1HG PRO 4 HG2 PRO 4 9.491 -1.045 -5.086 761 2HG PRO 4 HG3 PRO 4 9.947 -1.635 -6.713 762 1HD PRO 4 HD2 PRO 4 10.216 0.933 -6.143 763 2HD PRO 4 HD3 PRO 4 9.464 0.496 -7.695 764 H LEU 5 H LEU 5 8.022 0.702 -3.768 765 HA LEU 5 HA LEU 5 5.683 -0.290 -2.272 766 1HB LEU 5 HB2 LEU 5 7.903 -0.715 -1.333 767 2HB LEU 5 HB3 LEU 5 8.253 1.020 -1.318 768 HG LEU 5 HG LEU 5 6.399 1.403 0.290 769 1HD1 LEU 5 HD11 LEU 5 5.367 -0.533 1.426 770 2HD1 LEU 5 HD12 LEU 5 4.859 -0.442 -0.256 771 3HD1 LEU 5 HD13 LEU 5 6.084 -1.640 0.236 772 1HD2 LEU 5 HD21 LEU 5 8.287 -0.797 1.184 773 2HD2 LEU 5 HD22 LEU 5 8.646 0.954 1.153 774 3HD2 LEU 5 HD23 LEU 5 7.387 0.322 2.230 775 H ASP 6 H ASP 6 7.386 2.746 -3.020 776 HA ASP 6 HA ASP 6 5.942 4.576 -1.524 777 1HB ASP 6 HB2 ASP 6 6.949 5.008 -4.357 778 2HB ASP 6 HB3 ASP 6 6.497 6.268 -3.213 779 H GLN 7 H GLN 7 5.121 3.374 -4.832 780 HA GLN 7 HA GLN 7 2.743 4.894 -5.068 781 1HB GLN 7 HB2 GLN 7 2.099 3.417 -6.856 782 2HB GLN 7 HB3 GLN 7 3.817 3.789 -6.934 783 1HG GLN 7 HG2 GLN 7 3.793 1.520 -7.408 784 2HG GLN 7 HG3 GLN 7 4.215 1.577 -5.701 785 1HE2 GLN 7 HE22 GLN 7 3.524 -0.610 -5.428 786 2HE2 GLN 7 HE21 GLN 7 1.816 -1.069 -5.528 787 H ALA 8 H ALA 8 3.305 1.807 -3.351 788 HA ALA 8 HA ALA 8 0.495 1.181 -3.109 789 1HB ALA 8 HB1 ALA 8 2.043 -0.598 -3.036 790 2HB ALA 8 HB2 ALA 8 2.926 0.094 -1.656 791 3HB ALA 8 HB3 ALA 8 1.264 -0.481 -1.452 792 H ILE 9 H ILE 9 2.997 2.449 -0.803 793 HA ILE 9 HA ILE 9 1.070 2.956 1.277 794 HB ILE 9 HB ILE 9 2.710 4.384 2.332 795 1HG1 ILE 9 HG12 ILE 9 4.430 3.967 -0.111 796 2HG1 ILE 9 HG13 ILE 9 3.719 5.509 0.407 797 1HG2 ILE 9 HG21 ILE 9 3.988 1.855 1.233 798 2HG2 ILE 9 HG22 ILE 9 4.292 2.626 2.804 799 3HG2 ILE 9 HG23 ILE 9 2.729 1.884 2.485 800 1HD1 ILE 9 HD11 ILE 9 5.872 3.932 1.866 801 2HD1 ILE 9 HD12 ILE 9 6.004 5.518 1.100 802 3HD1 ILE 9 HD13 ILE 9 5.015 5.327 2.561 803 H GLY 10 H GLY 10 2.303 4.957 -1.391 804 1HA GLY 10 HA2 GLY 10 0.911 7.341 -1.152 805 2HA GLY 10 HA3 GLY 10 1.300 6.516 -2.666 806 H LEU 11 H LEU 11 -0.267 4.222 -2.529 807 HA LEU 11 HA LEU 11 -2.773 5.105 -3.384 808 1HB LEU 11 HB2 LEU 11 -1.473 2.831 -3.694 809 2HB LEU 11 HB3 LEU 11 -2.297 2.341 -2.222 810 HG LEU 11 HG LEU 11 -3.466 1.476 -4.005 811 1HD1 LEU 11 HD11 LEU 11 -4.859 2.444 -2.209 812 2HD1 LEU 11 HD12 LEU 11 -5.126 3.876 -3.244 813 3HD1 LEU 11 HD13 LEU 11 -5.677 2.279 -3.777 814 1HD2 LEU 11 HD21 LEU 11 -3.620 4.204 -5.327 815 2HD2 LEU 11 HD22 LEU 11 -2.568 2.849 -5.804 816 3HD2 LEU 11 HD23 LEU 11 -4.327 2.688 -5.923 817 H LEU 12 H LEU 12 -2.027 3.382 -0.308 818 HA LEU 12 HA LEU 12 -4.564 3.659 0.934 819 1HB LEU 12 HB2 LEU 12 -1.713 3.529 2.067 820 2HB LEU 12 HB3 LEU 12 -3.143 3.654 3.090 821 HG LEU 12 HG LEU 12 -4.051 1.583 2.144 822 1HD1 LEU 12 HD11 LEU 12 -2.507 0.000 0.985 823 2HD1 LEU 12 HD12 LEU 12 -2.841 1.416 -0.011 824 3HD1 LEU 12 HD13 LEU 12 -1.296 1.285 0.870 825 1HD2 LEU 12 HD21 LEU 12 -2.495 0.077 3.373 826 2HD2 LEU 12 HD22 LEU 12 -1.295 1.383 3.424 827 3HD2 LEU 12 HD23 LEU 12 -2.849 1.551 4.269 828 H ILE 13 H ILE 13 -1.762 5.870 0.954 829 HA ILE 13 HA ILE 13 -2.918 7.794 2.708 830 HB ILE 13 HB ILE 13 -0.803 8.010 0.525 831 1HG1 ILE 13 HG12 ILE 13 -0.401 8.148 3.532 832 2HG1 ILE 13 HG13 ILE 13 -0.456 6.591 2.710 833 1HG2 ILE 13 HG21 ILE 13 -0.147 10.149 1.681 834 2HG2 ILE 13 HG22 ILE 13 -1.684 10.257 0.828 835 3HG2 ILE 13 HG23 ILE 13 -1.673 10.053 2.595 836 1HD1 ILE 13 HD11 ILE 13 1.388 7.501 1.151 837 2HD1 ILE 13 HD12 ILE 13 1.586 8.800 2.348 838 3HD1 ILE 13 HD13 ILE 13 1.827 7.103 2.809 839 H GLY 14 H GLY 14 -2.833 7.725 -0.878 840 1HA GLY 14 HA2 GLY 14 -4.275 10.079 -1.367 841 2HA GLY 14 HA3 GLY 14 -4.203 8.667 -2.439 842 H ILE 15 H ILE 15 -5.462 6.678 -1.086 843 HA ILE 15 HA ILE 15 -8.222 7.201 -1.383 844 HB ILE 15 HB ILE 15 -6.588 5.018 -0.121 845 1HG1 ILE 15 HG12 ILE 15 -8.758 5.144 -2.275 846 2HG1 ILE 15 HG13 ILE 15 -7.012 5.148 -2.557 847 1HG2 ILE 15 HG21 ILE 15 -8.655 3.797 0.526 848 2HG2 ILE 15 HG22 ILE 15 -8.338 5.218 1.497 849 3HG2 ILE 15 HG23 ILE 15 -9.596 5.279 0.234 850 1HD1 ILE 15 HD11 ILE 15 -6.954 2.847 -1.422 851 2HD1 ILE 15 HD12 ILE 15 -8.726 2.857 -1.515 852 3HD1 ILE 15 HD13 ILE 15 -7.767 2.919 -2.994 853 H PHE 16 H PHE 16 -6.296 7.080 1.671 854 HA PHE 16 HA PHE 16 -8.401 7.833 3.370 855 1HB PHE 16 HB2 PHE 16 -6.139 7.036 4.042 856 2HB PHE 16 HB3 PHE 16 -5.449 8.582 3.607 857 HD1 PHE 16 HD1 PHE 16 -7.382 6.748 6.111 858 HD2 PHE 16 HD2 PHE 16 -6.138 10.681 4.893 859 HE1 PHE 16 HE1 PHE 16 -7.614 7.546 8.455 860 HE2 PHE 16 HE2 PHE 16 -6.614 11.520 7.135 861 HZ PHE 16 HZ PHE 16 -7.169 9.904 8.995 862 H HIS 17 H HIS 17 -5.972 9.983 1.841 863 HA HIS 17 HA HIS 17 -7.061 12.267 3.099 864 1HB HIS 17 HB2 HIS 17 -4.739 11.722 1.381 865 2HB HIS 17 HB3 HIS 17 -5.466 13.300 1.095 866 HD1 HIS 17 HD1 HIS 17 -5.474 15.054 3.067 867 HD2 HIS 17 HD2 HIS 17 -3.800 11.307 3.985 868 HE1 HIS 17 HE1 HIS 17 -4.454 15.268 5.392 869 H LYS 18 H LYS 18 -7.929 10.822 0.010 870 HA LYS 18 HA LYS 18 -9.374 13.129 -0.969 871 1HB LYS 18 HB2 LYS 18 -9.797 10.138 -1.235 872 2HB LYS 18 HB3 LYS 18 -10.879 11.321 -1.999 873 1HG LYS 18 HG2 LYS 18 -8.929 12.355 -3.142 874 2HG LYS 18 HG3 LYS 18 -7.880 11.093 -2.510 875 1HD LYS 18 HD2 LYS 18 -10.283 10.664 -4.370 876 2HD LYS 18 HD3 LYS 18 -8.591 10.755 -4.856 877 1HE LYS 18 HE2 LYS 18 -8.937 8.475 -4.818 878 2HE LYS 18 HE3 LYS 18 -8.173 8.758 -3.249 879 1HZ LYS 18 HZ1 LYS 18 -10.374 8.661 -2.274 880 2HZ LYS 18 HZ2 LYS 18 -11.064 8.479 -3.757 881 3HZ LYS 18 HZ3 LYS 18 -10.083 7.303 -3.153 882 H TYR 19 H TYR 19 -10.381 10.398 1.148 883 HA TYR 19 HA TYR 19 -13.015 11.517 1.525 884 1HB TYR 19 HB2 TYR 19 -11.542 9.228 2.824 885 2HB TYR 19 HB3 TYR 19 -13.159 9.730 3.322 886 HD1 TYR 19 HD1 TYR 19 -11.241 8.002 0.747 887 HD2 TYR 19 HD2 TYR 19 -15.120 9.478 1.830 888 HE1 TYR 19 HE1 TYR 19 -12.135 7.140 -1.377 889 HE2 TYR 19 HE2 TYR 19 -16.072 8.408 -0.180 890 HH TYR 19 HH TYR 19 -14.021 6.871 -2.691 891 H SER 20 H SER 20 -9.992 11.698 3.543 892 HA SER 20 HA SER 20 -11.419 13.160 5.608 893 1HB SER 20 HB2 SER 20 -9.350 13.836 6.494 894 2HB SER 20 HB3 SER 20 -9.246 12.115 6.085 895 HG SER 20 HG SER 20 -7.457 13.634 5.507 896 H GLY 21 H GLY 21 -9.430 14.185 2.813 897 1HA GLY 21 HA2 GLY 21 -9.593 16.878 2.646 898 2HA GLY 21 HA3 GLY 21 -9.871 15.811 1.268 899 H LYS 22 H LYS 22 -12.266 14.713 1.600 900 HA LYS 22 HA LYS 22 -14.140 16.563 0.860 901 1HB LYS 22 HB2 LYS 22 -14.310 14.020 0.850 902 2HB LYS 22 HB3 LYS 22 -14.837 14.115 2.530 903 1HG LYS 22 HG2 LYS 22 -16.401 16.013 1.002 904 2HG LYS 22 HG3 LYS 22 -16.319 14.516 0.082 905 1HD LYS 22 HD2 LYS 22 -18.283 14.390 1.427 906 2HD LYS 22 HD3 LYS 22 -17.110 13.263 2.112 907 1HE LYS 22 HE2 LYS 22 -18.255 14.487 3.890 908 2HE LYS 22 HE3 LYS 22 -16.551 14.951 3.875 909 1HZ LYS 22 HZ1 LYS 22 -18.069 16.801 4.117 910 2HZ LYS 22 HZ2 LYS 22 -17.107 16.954 2.795 911 3HZ LYS 22 HZ3 LYS 22 -18.693 16.514 2.617 912 H GLU 23 H GLU 23 -13.334 15.689 4.218 913 HA GLU 23 HA GLU 23 -15.165 17.814 5.259 914 1HB GLU 23 HB2 GLU 23 -15.112 16.488 7.393 915 2HB GLU 23 HB3 GLU 23 -16.012 15.760 6.065 916 1HG GLU 23 HG2 GLU 23 -14.237 14.196 5.580 917 2HG GLU 23 HG3 GLU 23 -13.146 14.994 6.733 918 H GLY 24 H GLY 24 -12.473 18.182 4.151 919 1HA GLY 24 HA2 GLY 24 -11.054 19.936 4.810 920 2HA GLY 24 HA3 GLY 24 -11.301 19.570 6.517 921 H ASP 25 H ASP 25 -9.017 19.529 4.264 922 HA ASP 25 HA ASP 25 -7.941 16.917 4.164 923 1HB ASP 25 HB2 ASP 25 -7.569 18.726 2.499 924 2HB ASP 25 HB3 ASP 25 -6.583 19.605 3.683 925 H LYS 26 H LYS 26 -8.174 16.523 6.527 926 HA LYS 26 HA LYS 26 -5.659 17.126 8.042 927 1HB LYS 26 HB2 LYS 26 -8.441 16.286 8.923 928 2HB LYS 26 HB3 LYS 26 -7.067 16.517 10.020 929 1HG LYS 26 HG2 LYS 26 -6.916 18.892 9.374 930 2HG LYS 26 HG3 LYS 26 -8.271 18.712 8.262 931 1HD LYS 26 HD2 LYS 26 -8.353 18.345 11.295 932 2HD LYS 26 HD3 LYS 26 -8.994 19.717 10.385 933 1HE LYS 26 HE2 LYS 26 -10.045 16.852 10.393 934 2HE LYS 26 HE3 LYS 26 -10.845 18.306 10.984 935 1HZ LYS 26 HZ1 LYS 26 -10.205 17.717 8.174 936 2HZ LYS 26 HZ2 LYS 26 -11.698 17.711 8.850 937 3HZ LYS 26 HZ3 LYS 26 -10.871 19.122 8.721 938 H HIS 27 H HIS 27 -4.924 15.292 9.390 939 HA HIS 27 HA HIS 27 -4.849 12.829 7.813 940 1HB HIS 27 HB2 HIS 27 -3.528 13.472 10.462 941 2HB HIS 27 HB3 HIS 27 -3.077 12.202 9.317 942 HD1 HIS 27 HD1 HIS 27 -2.877 13.721 6.621 943 HD2 HIS 27 HD2 HIS 27 -1.835 15.429 10.330 944 HE1 HIS 27 HE1 HIS 27 -1.440 15.761 6.114 945 H THR 28 H THR 28 -7.480 13.310 8.753 946 HA THR 28 HA THR 28 -7.952 11.195 10.801 947 HB THR 28 HB THR 28 -9.486 12.810 11.911 948 HG1 THR 28 HG1 THR 28 -9.514 14.192 9.970 949 1HG2 THR 28 HG21 THR 28 -6.645 13.922 11.840 950 2HG2 THR 28 HG22 THR 28 -7.828 14.049 13.151 951 3HG2 THR 28 HG23 THR 28 -7.113 12.473 12.753 952 H LEU 29 H LEU 29 -9.631 9.910 10.135 953 HA LEU 29 HA LEU 29 -11.675 11.076 8.242 954 1HB LEU 29 HB2 LEU 29 -10.790 8.222 8.792 955 2HB LEU 29 HB3 LEU 29 -12.302 8.597 7.968 956 HG LEU 29 HG LEU 29 -9.582 9.480 6.939 957 1HD1 LEU 29 HD11 LEU 29 -9.813 6.977 7.023 958 2HD1 LEU 29 HD12 LEU 29 -11.343 7.114 6.139 959 3HD1 LEU 29 HD13 LEU 29 -9.823 7.590 5.355 960 1HD2 LEU 29 HD21 LEU 29 -10.778 9.788 4.848 961 2HD2 LEU 29 HD22 LEU 29 -12.310 9.283 5.594 962 3HD2 LEU 29 HD23 LEU 29 -11.530 10.800 6.087 963 H SER 30 H SER 30 -13.682 11.441 9.128 964 HA SER 30 HA SER 30 -14.178 10.443 11.831 965 1HB SER 30 HB2 SER 30 -14.945 12.684 11.101 966 2HB SER 30 HB3 SER 30 -16.135 11.897 10.041 967 HG SER 30 HG SER 30 -15.844 11.464 12.859 968 H LYS 31 H LYS 31 -16.627 9.639 12.034 969 HA LYS 31 HA LYS 31 -16.354 6.867 11.509 970 1HB LYS 31 HB2 LYS 31 -18.755 8.569 12.384 971 2HB LYS 31 HB3 LYS 31 -18.748 6.806 12.416 972 1HG LYS 31 HG2 LYS 31 -16.864 6.844 14.034 973 2HG LYS 31 HG3 LYS 31 -16.784 8.589 13.920 974 1HD LYS 31 HD2 LYS 31 -17.941 8.141 15.930 975 2HD LYS 31 HD3 LYS 31 -19.119 8.774 14.780 976 1HE LYS 31 HE2 LYS 31 -20.124 6.944 15.993 977 2HE LYS 31 HE3 LYS 31 -19.872 6.387 14.335 978 1HZ LYS 31 HZ1 LYS 31 -17.870 5.276 15.120 979 2HZ LYS 31 HZ2 LYS 31 -18.141 5.817 16.647 980 3HZ LYS 31 HZ3 LYS 31 -19.198 4.763 15.949 981 H LYS 32 H LYS 32 -19.031 8.934 10.338 982 HA LYS 32 HA LYS 32 -19.859 6.959 8.424 983 1HB LYS 32 HB2 LYS 32 -21.413 8.503 9.401 984 2HB LYS 32 HB3 LYS 32 -20.569 9.895 8.670 985 1HG LYS 32 HG2 LYS 32 -21.183 9.074 6.407 986 2HG LYS 32 HG3 LYS 32 -21.861 7.608 7.110 987 1HD LYS 32 HD2 LYS 32 -23.639 9.168 6.501 988 2HD LYS 32 HD3 LYS 32 -23.619 8.877 8.242 989 1HE LYS 32 HE2 LYS 32 -24.022 11.255 7.686 990 2HE LYS 32 HE3 LYS 32 -22.555 11.056 8.646 991 1HZ LYS 32 HZ1 LYS 32 -22.657 11.383 5.724 992 2HZ LYS 32 HZ2 LYS 32 -22.250 12.553 6.812 993 3HZ LYS 32 HZ3 LYS 32 -21.285 11.232 6.627 994 H GLU 33 H GLU 33 -17.563 9.645 8.293 995 HA GLU 33 HA GLU 33 -17.272 9.761 5.461 996 1HB GLU 33 HB2 GLU 33 -16.292 11.385 7.184 997 2HB GLU 33 HB3 GLU 33 -15.056 10.162 7.524 998 1HG GLU 33 HG2 GLU 33 -14.122 11.689 5.895 999 2HG GLU 33 HG3 GLU 33 -14.455 10.171 5.076 1000 H LEU 34 H LEU 34 -15.598 7.791 7.984 1001 HA LEU 34 HA LEU 34 -14.001 6.314 6.183 1002 1HB LEU 34 HB2 LEU 34 -13.563 6.352 8.554 1003 2HB LEU 34 HB3 LEU 34 -15.121 5.645 8.945 1004 HG LEU 34 HG LEU 34 -13.199 4.124 9.166 1005 1HD1 LEU 34 HD11 LEU 34 -15.634 3.376 8.595 1006 2HD1 LEU 34 HD12 LEU 34 -14.962 2.935 7.023 1007 3HD1 LEU 34 HD13 LEU 34 -14.322 2.199 8.484 1008 1HD2 LEU 34 HD21 LEU 34 -13.063 4.232 6.119 1009 2HD2 LEU 34 HD22 LEU 34 -11.879 4.934 7.246 1010 3HD2 LEU 34 HD23 LEU 34 -12.109 3.180 7.152 1011 H LYS 35 H LYS 35 -17.300 5.621 7.523 1012 HA LYS 35 HA LYS 35 -17.574 3.202 6.100 1013 1HB LYS 35 HB2 LYS 35 -19.133 4.075 7.886 1014 2HB LYS 35 HB3 LYS 35 -19.903 5.093 6.646 1015 1HG LYS 35 HG2 LYS 35 -20.415 3.075 5.302 1016 2HG LYS 35 HG3 LYS 35 -19.518 2.075 6.455 1017 1HD LYS 35 HD2 LYS 35 -21.199 2.891 8.233 1018 2HD LYS 35 HD3 LYS 35 -22.179 3.473 6.878 1019 1HE LYS 35 HE2 LYS 35 -21.216 0.609 7.383 1020 2HE LYS 35 HE3 LYS 35 -22.879 1.202 7.545 1021 1HZ LYS 35 HZ1 LYS 35 -22.579 0.059 5.499 1022 2HZ LYS 35 HZ2 LYS 35 -22.883 1.649 5.194 1023 3HZ LYS 35 HZ3 LYS 35 -21.351 1.056 5.044 1024 H GLU 36 H GLU 36 -18.200 6.543 4.993 1025 HA GLU 36 HA GLU 36 -19.234 5.916 2.448 1026 1HB GLU 36 HB2 GLU 36 -19.120 8.205 3.635 1027 2HB GLU 36 HB3 GLU 36 -17.456 8.316 3.056 1028 1HG GLU 36 HG2 GLU 36 -18.875 9.497 1.516 1029 2HG GLU 36 HG3 GLU 36 -18.283 8.044 0.702 1030 H LEU 37 H LEU 37 -15.827 6.535 3.457 1031 HA LEU 37 HA LEU 37 -14.538 5.948 1.035 1032 1HB LEU 37 HB2 LEU 37 -13.374 6.782 3.017 1033 2HB LEU 37 HB3 LEU 37 -13.660 5.304 3.901 1034 HG LEU 37 HG LEU 37 -11.996 5.312 1.370 1035 1HD1 LEU 37 HD11 LEU 37 -11.099 5.656 4.264 1036 2HD1 LEU 37 HD12 LEU 37 -10.021 5.445 2.881 1037 3HD1 LEU 37 HD13 LEU 37 -11.007 6.905 2.999 1038 1HD2 LEU 37 HD21 LEU 37 -12.580 3.019 2.079 1039 2HD2 LEU 37 HD22 LEU 37 -10.923 3.333 2.552 1040 3HD2 LEU 37 HD23 LEU 37 -12.201 3.411 3.773 1041 H ILE 38 H ILE 38 -15.503 3.588 3.581 1042 HA ILE 38 HA ILE 38 -14.571 1.389 2.025 1043 HB ILE 38 HB ILE 38 -16.652 1.500 4.236 1044 1HG1 ILE 38 HG12 ILE 38 -13.696 0.689 4.081 1045 2HG1 ILE 38 HG13 ILE 38 -14.328 2.170 4.811 1046 1HG2 ILE 38 HG21 ILE 38 -15.311 -0.967 3.031 1047 2HG2 ILE 38 HG22 ILE 38 -16.436 -0.934 4.400 1048 3HG2 ILE 38 HG23 ILE 38 -17.019 -0.540 2.798 1049 1HD1 ILE 38 HD11 ILE 38 -15.641 0.687 6.411 1050 2HD1 ILE 38 HD12 ILE 38 -14.677 -0.671 5.766 1051 3HD1 ILE 38 HD13 ILE 38 -13.865 0.701 6.557 1052 H GLN 39 H GLN 39 -17.970 2.666 2.262 1053 HA GLN 39 HA GLN 39 -18.974 0.726 0.420 1054 1HB GLN 39 HB2 GLN 39 -19.974 3.535 1.047 1055 2HB GLN 39 HB3 GLN 39 -20.876 2.327 0.121 1056 1HG GLN 39 HG2 GLN 39 -20.017 2.010 3.034 1057 2HG GLN 39 HG3 GLN 39 -21.625 2.442 2.458 1058 1HE2 GLN 39 HE22 GLN 39 -19.245 -0.190 2.696 1059 2HE2 GLN 39 HE21 GLN 39 -20.394 -1.468 2.337 1060 H LYS 40 H LYS 40 -17.445 3.922 -0.215 1061 HA LYS 40 HA LYS 40 -18.225 3.751 -3.000 1062 1HB LYS 40 HB2 LYS 40 -18.060 5.879 -1.720 1063 2HB LYS 40 HB3 LYS 40 -16.325 5.634 -1.583 1064 1HG LYS 40 HG2 LYS 40 -16.918 7.235 -3.372 1065 2HG LYS 40 HG3 LYS 40 -16.037 5.844 -3.999 1066 1HD LYS 40 HD2 LYS 40 -17.869 6.542 -5.477 1067 2HD LYS 40 HD3 LYS 40 -18.091 4.885 -4.927 1068 1HE LYS 40 HE2 LYS 40 -19.766 5.655 -3.248 1069 2HE LYS 40 HE3 LYS 40 -19.461 7.341 -3.707 1070 1HZ LYS 40 HZ1 LYS 40 -20.279 6.816 -5.888 1071 2HZ LYS 40 HZ2 LYS 40 -20.548 5.248 -5.457 1072 3HZ LYS 40 HZ3 LYS 40 -21.408 6.459 -4.743 1073 H GLU 41 H GLU 41 -15.205 3.174 -1.164 1074 HA GLU 41 HA GLU 41 -13.729 2.611 -3.626 1075 1HB GLU 41 HB2 GLU 41 -12.926 2.260 -0.710 1076 2HB GLU 41 HB3 GLU 41 -11.847 2.119 -2.093 1077 1HG GLU 41 HG2 GLU 41 -13.312 4.645 -1.191 1078 2HG GLU 41 HG3 GLU 41 -11.594 4.296 -1.020 1079 H LEU 42 H LEU 42 -14.845 0.755 -0.800 1080 HA LEU 42 HA LEU 42 -14.290 -1.856 -2.139 1081 1HB LEU 42 HB2 LEU 42 -14.602 -0.995 0.758 1082 2HB LEU 42 HB3 LEU 42 -14.795 -2.673 0.277 1083 HG LEU 42 HG LEU 42 -12.594 -2.098 1.246 1084 1HD1 LEU 42 HD11 LEU 42 -12.609 -3.285 -1.553 1085 2HD1 LEU 42 HD12 LEU 42 -11.297 -3.449 -0.370 1086 3HD1 LEU 42 HD13 LEU 42 -12.894 -4.134 -0.027 1087 1HD2 LEU 42 HD21 LEU 42 -12.034 -0.700 -1.400 1088 2HD2 LEU 42 HD22 LEU 42 -12.241 0.101 0.178 1089 3HD2 LEU 42 HD23 LEU 42 -10.889 -1.011 -0.092 1090 H THR 43 H THR 43 -16.237 -0.865 -3.456 1091 HA THR 43 HA THR 43 -18.813 -0.922 -2.258 1092 HB THR 43 HB THR 43 -18.142 -1.254 -5.208 1093 HG1 THR 43 HG1 THR 43 -18.098 1.031 -3.534 1094 1HG2 THR 43 HG21 THR 43 -20.159 0.162 -5.491 1095 2HG2 THR 43 HG22 THR 43 -20.557 -1.351 -4.660 1096 3HG2 THR 43 HG23 THR 43 -20.419 0.165 -3.734 1097 H ILE 44 H ILE 44 -18.363 -3.021 -1.103 1098 HA ILE 44 HA ILE 44 -18.622 -5.530 -2.383 1099 HB ILE 44 HB ILE 44 -19.470 -6.339 -0.211 1100 1HG1 ILE 44 HG12 ILE 44 -19.579 -3.379 0.546 1101 2HG1 ILE 44 HG13 ILE 44 -20.900 -4.558 0.543 1102 1HG2 ILE 44 HG21 ILE 44 -17.136 -4.423 0.166 1103 2HG2 ILE 44 HG22 ILE 44 -17.434 -5.959 1.002 1104 3HG2 ILE 44 HG23 ILE 44 -17.032 -5.960 -0.714 1105 1HD1 ILE 44 HD11 ILE 44 -20.223 -4.197 2.809 1106 2HD1 ILE 44 HD12 ILE 44 -19.691 -5.829 2.346 1107 3HD1 ILE 44 HD13 ILE 44 -18.521 -4.484 2.424 1108 H GLY 45 H GLY 45 -20.311 -6.606 -3.308 1109 1HA GLY 45 HA2 GLY 45 -22.776 -5.291 -3.946 1110 2HA GLY 45 HA3 GLY 45 -22.426 -7.022 -4.118 1111 H SER 46 H SER 46 -21.887 -7.816 -1.559 1112 HA SER 46 HA SER 46 -24.454 -8.106 -0.392 1113 1HB SER 46 HB2 SER 46 -21.718 -8.792 0.749 1114 2HB SER 46 HB3 SER 46 -23.260 -9.581 1.124 1115 HG SER 46 HG SER 46 -23.321 -10.236 -1.103 1116 H LYS 47 H LYS 47 -24.492 -5.498 -0.273 1117 HA LYS 47 HA LYS 47 -23.228 -4.217 1.913 1118 1HB LYS 47 HB2 LYS 47 -25.822 -3.534 0.477 1119 2HB LYS 47 HB3 LYS 47 -24.984 -2.481 1.636 1120 1HG LYS 47 HG2 LYS 47 -22.920 -2.589 0.225 1121 2HG LYS 47 HG3 LYS 47 -23.819 -3.535 -0.975 1122 1HD LYS 47 HD2 LYS 47 -25.359 -1.664 -1.354 1123 2HD LYS 47 HD3 LYS 47 -24.609 -0.743 -0.034 1124 1HE LYS 47 HE2 LYS 47 -23.803 0.023 -2.245 1125 2HE LYS 47 HE3 LYS 47 -22.489 -0.604 -1.236 1126 1HZ LYS 47 HZ1 LYS 47 -22.548 -2.629 -2.457 1127 2HZ LYS 47 HZ2 LYS 47 -23.846 -2.130 -3.348 1128 3HZ LYS 47 HZ3 LYS 47 -22.392 -1.371 -3.509 1129 H LEU 48 H LEU 48 -25.731 -6.555 2.044 1130 HA LEU 48 HA LEU 48 -26.990 -5.945 4.507 1131 1HB LEU 48 HB2 LEU 48 -26.058 -8.652 3.466 1132 2HB LEU 48 HB3 LEU 48 -27.275 -8.384 4.719 1133 HG LEU 48 HG LEU 48 -27.537 -7.581 1.778 1134 1HD1 LEU 48 HD11 LEU 48 -27.638 -10.014 2.175 1135 2HD1 LEU 48 HD12 LEU 48 -28.902 -9.767 3.400 1136 3HD1 LEU 48 HD13 LEU 48 -29.218 -9.367 1.698 1137 1HD2 LEU 48 HD21 LEU 48 -28.808 -6.002 3.160 1138 2HD2 LEU 48 HD22 LEU 48 -29.922 -7.132 2.387 1139 3HD2 LEU 48 HD23 LEU 48 -29.506 -7.342 4.100 1140 H GLN 49 H GLN 49 -23.661 -6.854 3.827 1141 HA GLN 49 HA GLN 49 -22.934 -7.561 6.530 1142 1HB GLN 49 HB2 GLN 49 -21.300 -6.495 4.194 1143 2HB GLN 49 HB3 GLN 49 -20.624 -7.096 5.712 1144 1HG GLN 49 HG2 GLN 49 -21.672 -9.318 5.314 1145 2HG GLN 49 HG3 GLN 49 -22.287 -8.745 3.761 1146 1HE2 GLN 49 HE22 GLN 49 -19.258 -9.222 5.635 1147 2HE2 GLN 49 HE21 GLN 49 -18.246 -9.483 4.215 1148 H ASP 50 H ASP 50 -24.198 -4.606 5.528 1149 HA ASP 50 HA ASP 50 -22.577 -2.619 6.370 1150 1HB ASP 50 HB2 ASP 50 -24.576 -1.359 7.002 1151 2HB ASP 50 HB3 ASP 50 -24.819 -2.217 5.479 1152 H ALA 51 H ALA 51 -24.456 -4.703 8.537 1153 HA ALA 51 HA ALA 51 -23.879 -3.512 11.026 1154 1HB ALA 51 HB1 ALA 51 -24.118 -6.468 10.335 1155 2HB ALA 51 HB2 ALA 51 -24.243 -5.761 11.961 1156 3HB ALA 51 HB3 ALA 51 -25.453 -5.360 10.724 1157 H GLU 52 H GLU 52 -21.921 -5.788 9.088 1158 HA GLU 52 HA GLU 52 -19.819 -6.098 11.078 1159 1HB GLU 52 HB2 GLU 52 -19.719 -6.659 8.082 1160 2HB GLU 52 HB3 GLU 52 -18.605 -7.232 9.325 1161 1HG GLU 52 HG2 GLU 52 -20.497 -8.473 10.413 1162 2HG GLU 52 HG3 GLU 52 -21.555 -7.997 9.071 1163 H ILE 53 H ILE 53 -20.420 -4.143 8.131 1164 HA ILE 53 HA ILE 53 -17.897 -2.820 8.157 1165 HB ILE 53 HB ILE 53 -20.520 -1.697 7.134 1166 1HG1 ILE 53 HG12 ILE 53 -20.131 -3.780 5.981 1167 2HG1 ILE 53 HG13 ILE 53 -19.717 -2.455 4.908 1168 1HG2 ILE 53 HG21 ILE 53 -18.862 0.057 7.392 1169 2HG2 ILE 53 HG22 ILE 53 -17.625 -0.917 6.602 1170 3HG2 ILE 53 HG23 ILE 53 -19.021 -0.328 5.674 1171 1HD1 ILE 53 HD11 ILE 53 -17.764 -4.237 6.435 1172 2HD1 ILE 53 HD12 ILE 53 -18.066 -4.216 4.699 1173 3HD1 ILE 53 HD13 ILE 53 -17.283 -2.826 5.463 1174 H VAL 54 H VAL 54 -20.960 -1.904 9.890 1175 HA VAL 54 HA VAL 54 -19.660 0.435 10.936 1176 HB VAL 54 HB VAL 54 -21.466 0.631 12.570 1177 1HG1 VAL 54 HG11 VAL 54 -21.460 1.768 10.382 1178 2HG1 VAL 54 HG12 VAL 54 -22.262 0.356 9.656 1179 3HG1 VAL 54 HG13 VAL 54 -23.100 1.332 10.880 1180 1HG2 VAL 54 HG21 VAL 54 -22.758 -1.666 11.123 1181 2HG2 VAL 54 HG22 VAL 54 -22.132 -1.740 12.789 1182 3HG2 VAL 54 HG23 VAL 54 -23.479 -0.662 12.384 1183 H LYS 55 H LYS 55 -19.905 -2.920 12.200 1184 HA LYS 55 HA LYS 55 -18.628 -2.339 14.686 1185 1HB LYS 55 HB2 LYS 55 -19.637 -4.485 14.320 1186 2HB LYS 55 HB3 LYS 55 -18.590 -4.825 12.940 1187 1HG LYS 55 HG2 LYS 55 -17.924 -6.070 14.952 1188 2HG LYS 55 HG3 LYS 55 -16.632 -5.024 14.355 1189 1HD LYS 55 HD2 LYS 55 -17.127 -3.359 16.125 1190 2HD LYS 55 HD3 LYS 55 -18.492 -4.346 16.690 1191 1HE LYS 55 HE2 LYS 55 -16.938 -6.162 17.293 1192 2HE LYS 55 HE3 LYS 55 -15.577 -5.269 16.586 1193 1HZ LYS 55 HZ1 LYS 55 -15.663 -5.033 18.946 1194 2HZ LYS 55 HZ2 LYS 55 -15.885 -3.578 18.210 1195 3HZ LYS 55 HZ3 LYS 55 -17.170 -4.369 18.877 1196 H LEU 56 H LEU 56 -17.221 -3.266 11.521 1197 HA LEU 56 HA LEU 56 -14.485 -3.026 12.189 1198 1HB LEU 56 HB2 LEU 56 -15.085 -4.128 10.242 1199 2HB LEU 56 HB3 LEU 56 -16.092 -2.820 9.640 1200 HG LEU 56 HG LEU 56 -13.176 -2.194 9.983 1201 1HD1 LEU 56 HD11 LEU 56 -12.671 -3.172 7.763 1202 2HD1 LEU 56 HD12 LEU 56 -13.128 -4.446 8.912 1203 3HD1 LEU 56 HD13 LEU 56 -14.293 -3.887 7.694 1204 1HD2 LEU 56 HD21 LEU 56 -15.256 -1.627 7.810 1205 2HD2 LEU 56 HD22 LEU 56 -14.824 -0.494 9.089 1206 3HD2 LEU 56 HD23 LEU 56 -13.596 -0.978 7.914 1207 H MET 57 H MET 57 -16.773 -0.529 11.018 1208 HA MET 57 HA MET 57 -14.913 1.605 10.910 1209 1HB MET 57 HB2 MET 57 -17.032 1.666 9.773 1210 2HB MET 57 HB3 MET 57 -17.906 1.559 11.303 1211 1HG MET 57 HG2 MET 57 -16.017 3.856 10.895 1212 2HG MET 57 HG3 MET 57 -17.579 3.880 10.073 1213 1HE MET 57 HE1 MET 57 -20.158 4.134 12.936 1214 2HE MET 57 HE2 MET 57 -19.889 4.110 11.178 1215 3HE MET 57 HE3 MET 57 -19.675 2.626 12.146 1216 H ASP 58 H ASP 58 -17.037 0.450 13.570 1217 HA ASP 58 HA ASP 58 -16.257 2.343 15.524 1218 1HB ASP 58 HB2 ASP 58 -18.140 0.847 15.842 1219 2HB ASP 58 HB3 ASP 58 -17.065 -0.553 15.910 1220 H ASP 59 H ASP 59 -14.828 -0.851 14.715 1221 HA ASP 59 HA ASP 59 -12.681 -0.764 16.559 1222 1HB ASP 59 HB2 ASP 59 -12.667 -2.032 13.787 1223 2HB ASP 59 HB3 ASP 59 -11.528 -2.355 15.090 1224 H LEU 60 H LEU 60 -12.741 0.428 13.174 1225 HA LEU 60 HA LEU 60 -10.119 1.543 13.137 1226 1HB LEU 60 HB2 LEU 60 -12.708 2.041 11.666 1227 2HB LEU 60 HB3 LEU 60 -11.402 3.198 11.455 1228 HG LEU 60 HG LEU 60 -10.814 0.258 11.119 1229 1HD1 LEU 60 HD11 LEU 60 -12.043 2.006 8.976 1230 2HD1 LEU 60 HD12 LEU 60 -11.371 0.395 8.713 1231 3HD1 LEU 60 HD13 LEU 60 -12.810 0.594 9.739 1232 1HD2 LEU 60 HD21 LEU 60 -8.942 1.888 10.976 1233 2HD2 LEU 60 HD22 LEU 60 -9.259 1.203 9.359 1234 3HD2 LEU 60 HD23 LEU 60 -9.828 2.823 9.747 1235 H ASP 61 H ASP 61 -13.221 3.260 13.847 1236 HA ASP 61 HA ASP 61 -11.836 5.665 14.527 1237 1HB ASP 61 HB2 ASP 61 -13.871 6.636 15.089 1238 2HB ASP 61 HB3 ASP 61 -14.159 5.609 13.685 1239 H ARG 62 H ARG 62 -12.494 2.859 16.468 1240 HA ARG 62 HA ARG 62 -12.575 3.692 19.001 1241 1HB ARG 62 HB2 ARG 62 -12.287 1.342 18.091 1242 2HB ARG 62 HB3 ARG 62 -10.536 1.591 18.151 1243 1HG ARG 62 HG2 ARG 62 -10.677 2.010 20.586 1244 2HG ARG 62 HG3 ARG 62 -12.433 1.918 20.519 1245 1HD ARG 62 HD2 ARG 62 -10.409 -0.305 20.067 1246 2HD ARG 62 HD3 ARG 62 -11.583 -0.206 21.380 1247 HE ARG 62 HE ARG 62 -11.936 -1.382 18.812 1248 1HH1 ARG 62 HH11 ARG 62 -13.790 0.566 21.114 1249 2HH1 ARG 62 HH12 ARG 62 -15.334 0.149 20.412 1250 1HH2 ARG 62 HH21 ARG 62 -13.969 -2.021 17.983 1251 2HH2 ARG 62 HH22 ARG 62 -15.424 -1.281 18.615 1252 H ASN 63 H ASN 63 -9.747 3.966 16.939 1253 HA ASN 63 HA ASN 63 -7.629 4.915 18.347 1254 1HB ASN 63 HB2 ASN 63 -7.556 5.050 15.991 1255 2HB ASN 63 HB3 ASN 63 -9.085 5.921 15.904 1256 1HD2 ASN 63 HD22 ASN 63 -9.133 8.187 15.960 1257 2HD2 ASN 63 HD21 ASN 63 -7.689 9.154 16.089 1258 H LYS 64 H LYS 64 -10.491 6.901 17.630 1259 HA LYS 64 HA LYS 64 -10.467 8.237 20.145 1260 1HB LYS 64 HB2 LYS 64 -8.506 9.420 18.922 1261 2HB LYS 64 HB3 LYS 64 -9.710 9.976 17.772 1262 1HG LYS 64 HG2 LYS 64 -9.680 11.788 19.120 1263 2HG LYS 64 HG3 LYS 64 -10.917 10.898 20.001 1264 1HD LYS 64 HD2 LYS 64 -7.929 11.050 20.650 1265 2HD LYS 64 HD3 LYS 64 -9.240 11.883 21.499 1266 1HE LYS 64 HE2 LYS 64 -10.192 9.620 22.126 1267 2HE LYS 64 HE3 LYS 64 -8.733 8.876 21.424 1268 1HZ LYS 64 HZ1 LYS 64 -8.528 9.169 23.755 1269 2HZ LYS 64 HZ2 LYS 64 -7.424 10.106 22.969 1270 3HZ LYS 64 HZ3 LYS 64 -8.768 10.795 23.635 1271 H ASP 65 H ASP 65 -12.318 6.850 19.283 1272 HA ASP 65 HA ASP 65 -14.440 6.579 18.660 1273 1HB ASP 65 HB2 ASP 65 -15.951 7.768 20.112 1274 2HB ASP 65 HB3 ASP 65 -14.472 7.306 20.957 1275 H GLN 66 H GLN 66 -14.077 10.078 18.290 1276 HA GLN 66 HA GLN 66 -16.298 10.400 16.465 1277 1HB GLN 66 HB2 GLN 66 -15.038 12.093 18.098 1278 2HB GLN 66 HB3 GLN 66 -13.981 12.337 16.707 1279 1HG GLN 66 HG2 GLN 66 -16.999 12.761 16.875 1280 2HG GLN 66 HG3 GLN 66 -15.762 14.022 16.817 1281 1HE2 GLN 66 HE22 GLN 66 -18.081 12.640 14.919 1282 2HE2 GLN 66 HE21 GLN 66 -17.267 12.710 13.359 1283 H GLU 67 H GLU 67 -12.771 9.737 16.227 1284 HA GLU 67 HA GLU 67 -13.073 9.314 13.335 1285 1HB GLU 67 HB2 GLU 67 -11.410 11.009 12.727 1286 2HB GLU 67 HB3 GLU 67 -12.731 11.750 13.611 1287 1HG GLU 67 HG2 GLU 67 -10.839 12.768 14.518 1288 2HG GLU 67 HG3 GLU 67 -11.259 11.563 15.736 1289 H VAL 68 H VAL 68 -11.319 8.443 12.242 1290 HA VAL 68 HA VAL 68 -9.375 6.952 13.925 1291 HB VAL 68 HB VAL 68 -10.753 5.454 12.624 1292 1HG1 VAL 68 HG11 VAL 68 -10.716 5.286 10.236 1293 2HG1 VAL 68 HG12 VAL 68 -11.329 6.880 10.684 1294 3HG1 VAL 68 HG13 VAL 68 -9.658 6.690 10.085 1295 1HG2 VAL 68 HG21 VAL 68 -7.911 5.622 11.547 1296 2HG2 VAL 68 HG22 VAL 68 -8.364 4.943 13.121 1297 3HG2 VAL 68 HG23 VAL 68 -8.933 4.179 11.631 1298 H ASN 69 H ASN 69 -7.436 7.847 13.978 1299 HA ASN 69 HA ASN 69 -6.670 9.915 12.082 1300 1HB ASN 69 HB2 ASN 69 -6.069 10.293 14.351 1301 2HB ASN 69 HB3 ASN 69 -5.342 8.697 14.520 1302 1HD2 ASN 69 HD21 ASN 69 -3.182 8.388 13.895 1303 2HD2 ASN 69 HD22 ASN 69 -2.182 9.704 13.273 1304 H PHE 70 H PHE 70 -5.013 9.816 10.659 1305 HA PHE 70 HA PHE 70 -4.876 7.844 8.868 1306 1HB PHE 70 HB2 PHE 70 -3.949 10.015 8.474 1307 2HB PHE 70 HB3 PHE 70 -2.684 9.770 9.681 1308 HD1 PHE 70 HD1 PHE 70 -3.997 8.439 6.432 1309 HD2 PHE 70 HD2 PHE 70 -0.624 8.701 9.107 1310 HE1 PHE 70 HE1 PHE 70 -2.628 7.100 4.861 1311 HE2 PHE 70 HE2 PHE 70 0.744 7.427 7.525 1312 HZ PHE 70 HZ PHE 70 -0.256 6.593 5.395 1313 H GLN 71 H GLN 71 -2.355 8.030 11.454 1314 HA GLN 71 HA GLN 71 -0.959 5.765 10.487 1315 1HB GLN 71 HB2 GLN 71 -0.106 7.490 12.082 1316 2HB GLN 71 HB3 GLN 71 -1.048 6.728 13.378 1317 1HG GLN 71 HG2 GLN 71 0.194 4.603 13.038 1318 2HG GLN 71 HG3 GLN 71 1.092 5.327 11.698 1319 1HE2 GLN 71 HE22 GLN 71 2.028 7.699 12.496 1320 2HE2 GLN 71 HE21 GLN 71 2.946 7.548 13.986 1321 H GLU 72 H GLU 72 -3.659 6.016 12.807 1322 HA GLU 72 HA GLU 72 -3.616 3.218 13.545 1323 1HB GLU 72 HB2 GLU 72 -5.674 5.425 13.947 1324 2HB GLU 72 HB3 GLU 72 -5.883 3.754 14.478 1325 1HG GLU 72 HG2 GLU 72 -5.034 4.999 16.360 1326 2HG GLU 72 HG3 GLU 72 -3.796 3.877 15.815 1327 H TYR 73 H TYR 73 -5.291 5.190 11.084 1328 HA TYR 73 HA TYR 73 -6.936 3.096 10.025 1329 1HB TYR 73 HB2 TYR 73 -7.514 5.099 9.146 1330 2HB TYR 73 HB3 TYR 73 -5.879 5.695 9.035 1331 HD1 TYR 73 HD1 TYR 73 -8.481 3.725 7.302 1332 HD2 TYR 73 HD2 TYR 73 -4.487 5.340 7.084 1333 HE1 TYR 73 HE1 TYR 73 -8.542 3.580 4.824 1334 HE2 TYR 73 HE2 TYR 73 -4.514 5.092 4.632 1335 HH TYR 73 HH TYR 73 -5.904 4.824 2.779 1336 H ILE 74 H ILE 74 -3.552 4.052 9.126 1337 HA ILE 74 HA ILE 74 -3.184 1.905 7.294 1338 HB ILE 74 HB ILE 74 -1.103 3.248 9.060 1339 1HG1 ILE 74 HG12 ILE 74 -2.242 4.837 7.520 1340 2HG1 ILE 74 HG13 ILE 74 -0.528 4.632 7.219 1341 1HG2 ILE 74 HG21 ILE 74 0.464 2.388 7.185 1342 2HG2 ILE 74 HG22 ILE 74 -0.117 1.213 8.364 1343 3HG2 ILE 74 HG23 ILE 74 -0.853 1.292 6.751 1344 1HD1 ILE 74 HD11 ILE 74 -1.733 4.738 5.105 1345 2HD1 ILE 74 HD12 ILE 74 -1.019 3.142 5.293 1346 3HD1 ILE 74 HD13 ILE 74 -2.764 3.387 5.591 1347 H THR 75 H THR 75 -2.460 2.044 10.803 1348 HA THR 75 HA THR 75 -1.500 -0.574 11.117 1349 HB THR 75 HB THR 75 -3.221 0.975 13.099 1350 HG1 THR 75 HG1 THR 75 -1.442 2.208 12.390 1351 1HG2 THR 75 HG21 THR 75 -1.137 -1.211 13.470 1352 2HG2 THR 75 HG22 THR 75 -1.847 -0.247 14.779 1353 3HG2 THR 75 HG23 THR 75 -2.871 -1.336 13.825 1354 H PHE 76 H PHE 76 -4.916 0.583 11.239 1355 HA PHE 76 HA PHE 76 -6.052 -1.977 11.736 1356 1HB PHE 76 HB2 PHE 76 -7.304 0.113 12.044 1357 2HB PHE 76 HB3 PHE 76 -7.241 0.405 10.304 1358 HD1 PHE 76 HD1 PHE 76 -8.624 -0.926 8.732 1359 HD2 PHE 76 HD2 PHE 76 -8.666 -1.781 12.968 1360 HE1 PHE 76 HE1 PHE 76 -10.489 -2.472 8.399 1361 HE2 PHE 76 HE2 PHE 76 -10.453 -3.460 12.591 1362 HZ PHE 76 HZ PHE 76 -11.293 -3.884 10.282 1363 H LEU 77 H LEU 77 -5.296 -0.275 8.615 1364 HA LEU 77 HA LEU 77 -6.285 -2.436 6.998 1365 1HB LEU 77 HB2 LEU 77 -4.197 -0.297 6.472 1366 2HB LEU 77 HB3 LEU 77 -4.650 -1.504 5.267 1367 HG LEU 77 HG LEU 77 -6.666 0.364 6.604 1368 1HD1 LEU 77 HD11 LEU 77 -6.675 1.554 4.440 1369 2HD1 LEU 77 HD12 LEU 77 -5.117 1.695 5.278 1370 3HD1 LEU 77 HD13 LEU 77 -5.299 0.582 3.893 1371 1HD2 LEU 77 HD21 LEU 77 -7.788 -1.602 5.716 1372 2HD2 LEU 77 HD22 LEU 77 -8.040 -0.292 4.573 1373 3HD2 LEU 77 HD23 LEU 77 -6.820 -1.536 4.218 1374 H GLY 78 H GLY 78 -3.204 -1.991 8.702 1375 1HA GLY 78 HA2 GLY 78 -1.925 -4.370 7.782 1376 2HA GLY 78 HA3 GLY 78 -1.689 -3.586 9.359 1377 H ALA 79 H ALA 79 -4.249 -3.825 10.483 1378 HA ALA 79 HA ALA 79 -4.333 -6.553 11.334 1379 1HB ALA 79 HB1 ALA 79 -5.230 -4.657 12.664 1380 2HB ALA 79 HB2 ALA 79 -6.597 -4.527 11.535 1381 3HB ALA 79 HB3 ALA 79 -6.377 -6.001 12.485 1382 H LEU 80 H LEU 80 -6.354 -4.787 8.991 1383 HA LEU 80 HA LEU 80 -8.067 -6.852 8.188 1384 1HB LEU 80 HB2 LEU 80 -7.994 -4.284 7.620 1385 2HB LEU 80 HB3 LEU 80 -6.936 -4.770 6.298 1386 HG LEU 80 HG LEU 80 -8.839 -6.388 5.613 1387 1HD1 LEU 80 HD11 LEU 80 -11.114 -5.624 6.298 1388 2HD1 LEU 80 HD12 LEU 80 -10.212 -6.228 7.702 1389 3HD1 LEU 80 HD13 LEU 80 -10.385 -4.481 7.437 1390 1HD2 LEU 80 HD21 LEU 80 -9.327 -3.379 5.536 1391 2HD2 LEU 80 HD22 LEU 80 -8.264 -4.269 4.413 1392 3HD2 LEU 80 HD23 LEU 80 -10.013 -4.568 4.415 1393 H ALA 81 H ALA 81 -4.872 -5.897 6.896 1394 HA ALA 81 HA ALA 81 -4.557 -7.895 4.919 1395 1HB ALA 81 HB1 ALA 81 -2.518 -6.433 6.630 1396 2HB ALA 81 HB2 ALA 81 -2.125 -7.478 5.261 1397 3HB ALA 81 HB3 ALA 81 -3.083 -5.995 5.009 1398 H MET 82 H MET 82 -3.579 -7.907 8.393 1399 HA MET 82 HA MET 82 -2.478 -10.519 8.362 1400 1HB MET 82 HB2 MET 82 -2.100 -8.801 10.083 1401 2HB MET 82 HB3 MET 82 -3.757 -9.025 10.679 1402 1HG MET 82 HG2 MET 82 -3.207 -11.366 11.277 1403 2HG MET 82 HG3 MET 82 -1.606 -11.179 10.550 1404 1HE MET 82 HE1 MET 82 -3.558 -8.609 12.936 1405 2HE MET 82 HE2 MET 82 -3.951 -10.242 13.533 1406 3HE MET 82 HE3 MET 82 -2.919 -9.162 14.496 1407 H ILE 83 H ILE 83 -5.803 -9.393 8.978 1408 HA ILE 83 HA ILE 83 -6.955 -11.943 9.571 1409 HB ILE 83 HB ILE 83 -8.114 -9.344 8.522 1410 1HG1 ILE 83 HG12 ILE 83 -8.524 -10.746 11.196 1411 2HG1 ILE 83 HG13 ILE 83 -7.187 -9.631 10.928 1412 1HG2 ILE 83 HG21 ILE 83 -9.600 -11.899 9.265 1413 2HG2 ILE 83 HG22 ILE 83 -10.363 -10.318 9.008 1414 3HG2 ILE 83 HG23 ILE 83 -9.567 -11.122 7.666 1415 1HD1 ILE 83 HD11 ILE 83 -8.787 -7.826 10.331 1416 2HD1 ILE 83 HD12 ILE 83 -10.137 -8.913 10.728 1417 3HD1 ILE 83 HD13 ILE 83 -8.987 -8.435 11.983 1418 H TYR 84 H TYR 84 -6.419 -10.212 6.455 1419 HA TYR 84 HA TYR 84 -7.327 -12.492 4.850 1420 1HB TYR 84 HB2 TYR 84 -5.507 -10.193 4.071 1421 2HB TYR 84 HB3 TYR 84 -6.384 -11.266 2.985 1422 HD1 TYR 84 HD1 TYR 84 -6.350 -8.246 2.921 1423 HD2 TYR 84 HD2 TYR 84 -9.083 -11.036 4.766 1424 HE1 TYR 84 HE1 TYR 84 -8.208 -6.655 2.586 1425 HE2 TYR 84 HE2 TYR 84 -10.926 -9.425 4.455 1426 HH TYR 84 HH TYR 84 -10.470 -6.287 2.811 1427 H ASN 85 H ASN 85 -5.845 -13.672 6.686 1428 HA ASN 85 HA ASN 85 -3.114 -13.571 6.629 1429 1HB ASN 85 HB2 ASN 85 -4.577 -14.733 8.329 1430 2HB ASN 85 HB3 ASN 85 -4.762 -16.075 7.188 1431 1HD2 ASN 85 HD22 ASN 85 -2.214 -14.042 8.731 1432 2HD2 ASN 85 HD21 ASN 85 -1.019 -15.332 8.868 1433 H GLU 86 H GLU 86 -5.176 -15.433 4.495 1434 HA GLU 86 HA GLU 86 -3.411 -17.176 3.246 1435 1HB GLU 86 HB2 GLU 86 -5.496 -15.501 1.786 1436 2HB GLU 86 HB3 GLU 86 -4.859 -17.088 1.335 1437 1HG GLU 86 HG2 GLU 86 -6.720 -16.427 3.662 1438 2HG GLU 86 HG3 GLU 86 -7.044 -17.429 2.255 1439 H ALA 87 H ALA 87 -3.676 -13.638 2.811 1440 HA ALA 87 HA ALA 87 -2.020 -13.465 0.479 1441 1HB ALA 87 HB1 ALA 87 -2.522 -11.384 2.645 1442 2HB ALA 87 HB2 ALA 87 -1.938 -11.093 0.991 1443 3HB ALA 87 HB3 ALA 87 -3.586 -11.690 1.254 1444 H LEU 88 H LEU 88 -1.301 -13.691 3.956 1445 HA LEU 88 HA LEU 88 1.546 -13.003 3.605 1446 1HB LEU 88 HB2 LEU 88 -0.048 -14.110 5.957 1447 2HB LEU 88 HB3 LEU 88 1.678 -13.763 5.999 1448 HG LEU 88 HG LEU 88 -0.277 -11.586 5.222 1449 1HD1 LEU 88 HD11 LEU 88 -1.103 -12.446 7.356 1450 2HD1 LEU 88 HD12 LEU 88 0.535 -12.407 8.044 1451 3HD1 LEU 88 HD13 LEU 88 -0.284 -10.893 7.606 1452 1HD2 LEU 88 HD21 LEU 88 1.464 -10.126 5.933 1453 2HD2 LEU 88 HD22 LEU 88 2.364 -11.427 6.738 1454 3HD2 LEU 88 HD23 LEU 88 2.293 -11.356 4.969 1455 H LYS 89 H LYS 89 -0.467 -15.884 4.329 1456 HA LYS 89 HA LYS 89 1.654 -17.750 4.452 1457 1HB LYS 89 HB2 LYS 89 -1.254 -18.061 3.623 1458 2HB LYS 89 HB3 LYS 89 -0.179 -19.436 3.875 1459 1HG LYS 89 HG2 LYS 89 -0.642 -17.355 6.056 1460 2HG LYS 89 HG3 LYS 89 -1.718 -18.733 5.809 1461 1HD LYS 89 HD2 LYS 89 0.132 -20.317 6.137 1462 2HD LYS 89 HD3 LYS 89 1.293 -18.993 6.291 1463 1HE LYS 89 HE2 LYS 89 0.688 -19.906 8.488 1464 2HE LYS 89 HE3 LYS 89 0.210 -18.206 8.347 1465 1HZ LYS 89 HZ1 LYS 89 -1.468 -19.609 9.344 1466 2HZ LYS 89 HZ2 LYS 89 -1.995 -18.844 7.987 1467 3HZ LYS 89 HZ3 LYS 89 -1.625 -20.458 7.937 1468 H GLY 90 H GLY 90 -0.283 -16.722 1.612 1469 1HA GLY 90 HA2 GLY 90 0.125 -16.918 -0.629 1470 2HA GLY 90 HA3 GLY 90 1.843 -17.128 -0.245 Start of MODEL 16 1 1H MET 1 H1 MET 1 -13.783 1.213 -5.111 2 2H MET 1 H2 MET 1 -13.363 1.658 -6.638 3 3H MET 1 H3 MET 1 -12.232 0.979 -5.639 4 HA MET 1 HA MET 1 -14.674 -0.353 -6.492 5 1HB MET 1 HB2 MET 1 -13.407 0.114 -8.478 6 2HB MET 1 HB3 MET 1 -11.913 -0.496 -7.777 7 1HG MET 1 HG2 MET 1 -13.035 -2.052 -9.400 8 2HG MET 1 HG3 MET 1 -12.712 -2.769 -7.831 9 1HE MET 1 HE1 MET 1 -15.743 -0.354 -8.790 10 2HE MET 1 HE2 MET 1 -15.461 -1.354 -10.238 11 3HE MET 1 HE3 MET 1 -16.937 -1.578 -9.269 12 H ALA 2 H ALA 2 -11.371 -1.552 -6.116 13 HA ALA 2 HA ALA 2 -11.523 -2.571 -3.472 14 1HB ALA 2 HB1 ALA 2 -11.687 -5.001 -3.995 15 2HB ALA 2 HB2 ALA 2 -12.151 -4.608 -5.662 16 3HB ALA 2 HB3 ALA 2 -13.202 -4.158 -4.306 17 H SER 3 H SER 3 -10.456 -3.634 -6.723 18 HA SER 3 HA SER 3 -8.074 -4.664 -6.286 19 1HB SER 3 HB2 SER 3 -8.121 -2.946 -8.698 20 2HB SER 3 HB3 SER 3 -7.940 -4.689 -8.519 21 HG SER 3 HG SER 3 -9.950 -4.190 -9.480 22 HA PRO 4 HA PRO 4 -5.769 -0.421 -6.818 23 1HB PRO 4 HB2 PRO 4 -7.759 1.361 -5.394 24 2HB PRO 4 HB3 PRO 4 -6.590 1.789 -6.677 25 1HG PRO 4 HG2 PRO 4 -9.179 1.394 -7.334 26 2HG PRO 4 HG3 PRO 4 -7.905 0.630 -8.336 27 1HD PRO 4 HD2 PRO 4 -9.490 -0.609 -6.078 28 2HD PRO 4 HD3 PRO 4 -9.245 -1.246 -7.729 29 H LEU 5 H LEU 5 -7.841 -0.628 -3.825 30 HA LEU 5 HA LEU 5 -5.523 0.024 -2.202 31 1HB LEU 5 HB2 LEU 5 -7.762 0.621 -1.423 32 2HB LEU 5 HB3 LEU 5 -8.217 -1.089 -1.357 33 HG LEU 5 HG LEU 5 -6.545 -1.527 0.379 34 1HD1 LEU 5 HD11 LEU 5 -4.709 0.025 -0.178 35 2HD1 LEU 5 HD12 LEU 5 -5.312 0.353 1.438 36 3HD1 LEU 5 HD13 LEU 5 -5.775 1.422 0.105 37 1HD2 LEU 5 HD21 LEU 5 -8.045 1.018 1.069 38 2HD2 LEU 5 HD22 LEU 5 -8.756 -0.618 1.065 39 3HD2 LEU 5 HD23 LEU 5 -7.439 -0.225 2.189 40 H ASP 6 H ASP 6 -7.347 -2.939 -3.065 41 HA ASP 6 HA ASP 6 -6.035 -4.743 -1.369 42 1HB ASP 6 HB2 ASP 6 -7.031 -5.235 -4.212 43 2HB ASP 6 HB3 ASP 6 -6.624 -6.492 -3.040 44 H GLN 7 H GLN 7 -5.000 -3.735 -4.682 45 HA GLN 7 HA GLN 7 -2.686 -5.423 -4.647 46 1HB GLN 7 HB2 GLN 7 -1.934 -4.248 -6.586 47 2HB GLN 7 HB3 GLN 7 -3.668 -4.564 -6.707 48 1HG GLN 7 HG2 GLN 7 -4.060 -2.182 -5.945 49 2HG GLN 7 HG3 GLN 7 -2.336 -1.882 -6.089 50 1HE2 GLN 7 HE21 GLN 7 -1.366 -2.353 -8.318 51 2HE2 GLN 7 HE22 GLN 7 -2.397 -2.039 -9.702 52 H ALA 8 H ALA 8 -3.225 -2.058 -3.512 53 HA ALA 8 HA ALA 8 -0.448 -1.500 -3.065 54 1HB ALA 8 HB1 ALA 8 -1.886 0.292 -3.212 55 2HB ALA 8 HB2 ALA 8 -2.964 -0.279 -1.908 56 3HB ALA 8 HB3 ALA 8 -1.316 0.273 -1.532 57 H ILE 9 H ILE 9 -3.042 -2.626 -0.763 58 HA ILE 9 HA ILE 9 -1.156 -2.958 1.389 59 HB ILE 9 HB ILE 9 -2.813 -4.317 2.513 60 1HG1 ILE 9 HG12 ILE 9 -4.445 -4.183 -0.001 61 2HG1 ILE 9 HG13 ILE 9 -3.767 -5.641 0.751 62 1HG2 ILE 9 HG21 ILE 9 -4.403 -2.556 2.834 63 2HG2 ILE 9 HG22 ILE 9 -2.829 -1.841 2.512 64 3HG2 ILE 9 HG23 ILE 9 -4.056 -1.883 1.225 65 1HD1 ILE 9 HD11 ILE 9 -5.972 -3.874 1.877 66 2HD1 ILE 9 HD12 ILE 9 -6.083 -5.552 1.334 67 3HD1 ILE 9 HD13 ILE 9 -5.160 -5.162 2.799 68 H GLY 10 H GLY 10 -2.369 -5.200 -1.121 69 1HA GLY 10 HA2 GLY 10 -0.966 -7.514 -0.737 70 2HA GLY 10 HA3 GLY 10 -1.263 -6.772 -2.315 71 H LEU 11 H LEU 11 0.335 -4.503 -2.227 72 HA LEU 11 HA LEU 11 2.854 -5.449 -2.931 73 1HB LEU 11 HB2 LEU 11 1.598 -3.163 -3.358 74 2HB LEU 11 HB3 LEU 11 2.396 -2.632 -1.887 75 HG LEU 11 HG LEU 11 3.631 -1.835 -3.710 76 1HD1 LEU 11 HD11 LEU 11 5.817 -2.688 -3.400 77 2HD1 LEU 11 HD12 LEU 11 4.948 -2.663 -1.851 78 3HD1 LEU 11 HD13 LEU 11 5.205 -4.207 -2.721 79 1HD2 LEU 11 HD21 LEU 11 3.814 -4.648 -4.843 80 2HD2 LEU 11 HD22 LEU 11 2.761 -3.341 -5.444 81 3HD2 LEU 11 HD23 LEU 11 4.524 -3.168 -5.521 82 H LEU 12 H LEU 12 2.055 -3.610 0.050 83 HA LEU 12 HA LEU 12 4.524 -3.940 1.424 84 1HB LEU 12 HB2 LEU 12 1.635 -3.643 2.401 85 2HB LEU 12 HB3 LEU 12 3.008 -3.784 3.494 86 HG LEU 12 HG LEU 12 4.046 -1.788 2.497 87 1HD1 LEU 12 HD11 LEU 12 2.956 -1.648 0.291 88 2HD1 LEU 12 HD12 LEU 12 1.363 -1.480 1.073 89 3HD1 LEU 12 HD13 LEU 12 2.579 -0.200 1.223 90 1HD2 LEU 12 HD21 LEU 12 2.516 -0.185 3.620 91 2HD2 LEU 12 HD22 LEU 12 1.243 -1.423 3.639 92 3HD2 LEU 12 HD23 LEU 12 2.736 -1.658 4.573 93 H ILE 13 H ILE 13 1.593 -5.993 1.389 94 HA ILE 13 HA ILE 13 2.539 -7.830 3.356 95 HB ILE 13 HB ILE 13 0.335 -7.838 1.287 96 1HG1 ILE 13 HG12 ILE 13 -0.981 -8.454 3.393 97 2HG1 ILE 13 HG13 ILE 13 0.505 -8.226 4.310 98 1HG2 ILE 13 HG21 ILE 13 1.223 -10.308 2.799 99 2HG2 ILE 13 HG22 ILE 13 -0.354 -10.106 2.009 100 3HG2 ILE 13 HG23 ILE 13 1.110 -10.119 1.033 101 1HD1 ILE 13 HD11 ILE 13 -1.104 -6.197 2.728 102 2HD1 ILE 13 HD12 ILE 13 0.509 -5.802 3.400 103 3HD1 ILE 13 HD13 ILE 13 -0.839 -6.183 4.451 104 H GLY 14 H GLY 14 2.744 -7.936 -0.201 105 1HA GLY 14 HA2 GLY 14 4.051 -10.434 -0.458 106 2HA GLY 14 HA3 GLY 14 4.087 -9.096 -1.623 107 H ILE 15 H ILE 15 5.371 -7.072 -0.384 108 HA ILE 15 HA ILE 15 8.121 -7.612 -0.490 109 HB ILE 15 HB ILE 15 6.428 -5.454 0.743 110 1HG1 ILE 15 HG12 ILE 15 8.659 -5.466 -1.347 111 2HG1 ILE 15 HG13 ILE 15 6.933 -5.599 -1.702 112 1HG2 ILE 15 HG21 ILE 15 8.169 -5.645 2.388 113 2HG2 ILE 15 HG22 ILE 15 9.433 -5.694 1.127 114 3HG2 ILE 15 HG23 ILE 15 8.486 -4.222 1.435 115 1HD1 ILE 15 HD11 ILE 15 8.296 -3.176 -0.421 116 2HD1 ILE 15 HD12 ILE 15 7.593 -3.302 -2.027 117 3HD1 ILE 15 HD13 ILE 15 6.556 -3.413 -0.578 118 H PHE 16 H PHE 16 6.032 -7.388 2.420 119 HA PHE 16 HA PHE 16 8.034 -8.077 4.262 120 1HB PHE 16 HB2 PHE 16 5.800 -7.123 4.785 121 2HB PHE 16 HB3 PHE 16 5.044 -8.664 4.455 122 HD1 PHE 16 HD1 PHE 16 7.209 -6.790 6.781 123 HD2 PHE 16 HD2 PHE 16 5.530 -10.659 5.975 124 HE1 PHE 16 HE1 PHE 16 7.455 -7.400 9.179 125 HE2 PHE 16 HE2 PHE 16 5.931 -11.316 8.301 126 HZ PHE 16 HZ PHE 16 6.738 -9.631 9.962 127 H HIS 17 H HIS 17 5.485 -10.279 2.922 128 HA HIS 17 HA HIS 17 6.574 -12.494 4.350 129 1HB HIS 17 HB2 HIS 17 4.517 -12.384 2.132 130 2HB HIS 17 HB3 HIS 17 4.961 -13.856 3.009 131 HD1 HIS 17 HD1 HIS 17 3.304 -10.476 3.634 132 HD2 HIS 17 HD2 HIS 17 4.309 -14.027 5.635 133 HE1 HIS 17 HE1 HIS 17 2.268 -10.319 5.964 134 H LYS 18 H LYS 18 7.329 -11.257 1.131 135 HA LYS 18 HA LYS 18 8.758 -13.566 0.201 136 1HB LYS 18 HB2 LYS 18 8.202 -11.700 -1.232 137 2HB LYS 18 HB3 LYS 18 9.153 -10.579 -0.241 138 1HG LYS 18 HG2 LYS 18 11.228 -11.572 -0.937 139 2HG LYS 18 HG3 LYS 18 10.404 -12.981 -1.619 140 1HD LYS 18 HD2 LYS 18 11.183 -11.393 -3.372 141 2HD LYS 18 HD3 LYS 18 9.445 -11.699 -3.413 142 1HE LYS 18 HE2 LYS 18 9.970 -9.318 -3.795 143 2HE LYS 18 HE3 LYS 18 8.971 -9.537 -2.356 144 1HZ LYS 18 HZ1 LYS 18 11.886 -9.157 -2.368 145 2HZ LYS 18 HZ2 LYS 18 10.769 -8.004 -2.002 146 3HZ LYS 18 HZ3 LYS 18 10.941 -9.323 -1.029 147 H TYR 19 H TYR 19 9.768 -10.697 2.129 148 HA TYR 19 HA TYR 19 12.457 -11.678 2.498 149 1HB TYR 19 HB2 TYR 19 10.840 -9.354 3.392 150 2HB TYR 19 HB3 TYR 19 12.194 -9.815 4.431 151 HD1 TYR 19 HD1 TYR 19 11.321 -8.473 1.085 152 HD2 TYR 19 HD2 TYR 19 14.484 -9.783 3.684 153 HE1 TYR 19 HE1 TYR 19 13.010 -7.828 -0.609 154 HE2 TYR 19 HE2 TYR 19 16.126 -9.395 1.905 155 HH TYR 19 HH TYR 19 16.469 -8.714 -0.227 156 H SER 20 H SER 20 9.538 -11.795 4.639 157 HA SER 20 HA SER 20 10.805 -13.173 6.754 158 1HB SER 20 HB2 SER 20 7.994 -13.703 5.698 159 2HB SER 20 HB3 SER 20 8.630 -14.037 7.316 160 HG SER 20 HG SER 20 8.645 -11.940 7.770 161 H GLY 21 H GLY 21 9.090 -14.495 3.888 162 1HA GLY 21 HA2 GLY 21 9.444 -17.188 4.056 163 2HA GLY 21 HA3 GLY 21 9.476 -16.268 2.546 164 H LYS 22 H LYS 22 11.826 -14.861 2.717 165 HA LYS 22 HA LYS 22 13.799 -16.566 1.870 166 1HB LYS 22 HB2 LYS 22 13.654 -14.031 1.792 167 2HB LYS 22 HB3 LYS 22 14.412 -14.011 3.395 168 1HG LYS 22 HG2 LYS 22 16.357 -15.251 2.483 169 2HG LYS 22 HG3 LYS 22 15.600 -15.298 0.891 170 1HD LYS 22 HD2 LYS 22 16.556 -12.828 2.417 171 2HD LYS 22 HD3 LYS 22 17.289 -13.524 0.980 172 1HE LYS 22 HE2 LYS 22 14.610 -12.081 1.178 173 2HE LYS 22 HE3 LYS 22 16.064 -11.564 0.324 174 1HZ LYS 22 HZ1 LYS 22 15.804 -13.428 -1.148 175 2HZ LYS 22 HZ2 LYS 22 14.427 -13.892 -0.369 176 3HZ LYS 22 HZ3 LYS 22 14.471 -12.456 -1.175 177 H GLU 23 H GLU 23 13.120 -15.740 5.268 178 HA GLU 23 HA GLU 23 15.238 -17.660 6.147 179 1HB GLU 23 HB2 GLU 23 15.047 -16.562 8.370 180 2HB GLU 23 HB3 GLU 23 15.764 -15.639 7.057 181 1HG GLU 23 HG2 GLU 23 14.522 -14.088 8.239 182 2HG GLU 23 HG3 GLU 23 13.580 -14.372 6.786 183 H GLY 24 H GLY 24 11.800 -17.120 6.086 184 1HA GLY 24 HA2 GLY 24 10.909 -19.671 6.540 185 2HA GLY 24 HA3 GLY 24 11.116 -18.996 8.172 186 H ASP 25 H ASP 25 8.761 -19.466 5.949 187 HA ASP 25 HA ASP 25 7.566 -16.836 5.799 188 1HB ASP 25 HB2 ASP 25 7.227 -18.489 4.024 189 2HB ASP 25 HB3 ASP 25 6.403 -19.570 5.163 190 H LYS 26 H LYS 26 7.811 -16.549 8.186 191 HA LYS 26 HA LYS 26 5.219 -17.180 9.546 192 1HB LYS 26 HB2 LYS 26 6.463 -16.676 11.670 193 2HB LYS 26 HB3 LYS 26 6.912 -18.193 10.880 194 1HG LYS 26 HG2 LYS 26 8.963 -17.234 10.011 195 2HG LYS 26 HG3 LYS 26 8.521 -15.614 10.584 196 1HD LYS 26 HD2 LYS 26 8.561 -16.403 12.914 197 2HD LYS 26 HD3 LYS 26 8.951 -18.048 12.388 198 1HE LYS 26 HE2 LYS 26 10.701 -15.597 11.837 199 2HE LYS 26 HE3 LYS 26 10.936 -16.716 13.190 200 1HZ LYS 26 HZ1 LYS 26 12.337 -17.289 11.398 201 2HZ LYS 26 HZ2 LYS 26 11.208 -18.480 11.561 202 3HZ LYS 26 HZ3 LYS 26 11.095 -17.375 10.337 203 H HIS 27 H HIS 27 4.405 -15.310 10.807 204 HA HIS 27 HA HIS 27 4.595 -12.961 9.110 205 1HB HIS 27 HB2 HIS 27 2.899 -13.472 11.566 206 2HB HIS 27 HB3 HIS 27 2.682 -12.171 10.385 207 HD1 HIS 27 HD1 HIS 27 2.577 -13.370 7.662 208 HD2 HIS 27 HD2 HIS 27 1.449 -15.588 11.066 209 HE1 HIS 27 HE1 HIS 27 1.324 -15.418 6.826 210 H THR 28 H THR 28 7.070 -13.250 10.205 211 HA THR 28 HA THR 28 7.388 -10.819 11.787 212 HB THR 28 HB THR 28 9.063 -11.891 13.240 213 HG1 THR 28 HG1 THR 28 9.484 -13.971 13.124 214 1HG2 THR 28 HG21 THR 28 6.367 -13.291 13.503 215 2HG2 THR 28 HG22 THR 28 7.593 -13.087 14.765 216 3HG2 THR 28 HG23 THR 28 6.746 -11.667 14.117 217 H LEU 29 H LEU 29 9.582 -9.987 11.539 218 HA LEU 29 HA LEU 29 11.172 -11.215 9.332 219 1HB LEU 29 HB2 LEU 29 9.287 -9.567 8.663 220 2HB LEU 29 HB3 LEU 29 10.337 -8.287 9.262 221 HG LEU 29 HG LEU 29 11.174 -10.350 7.152 222 1HD1 LEU 29 HD11 LEU 29 9.756 -7.671 6.804 223 2HD1 LEU 29 HD12 LEU 29 10.501 -8.597 5.494 224 3HD1 LEU 29 HD13 LEU 29 9.131 -9.282 6.373 225 1HD2 LEU 29 HD21 LEU 29 12.099 -7.503 7.723 226 2HD2 LEU 29 HD22 LEU 29 12.998 -8.964 8.179 227 3HD2 LEU 29 HD23 LEU 29 12.750 -8.576 6.468 228 H SER 30 H SER 30 13.322 -11.187 9.876 229 HA SER 30 HA SER 30 14.008 -10.118 12.398 230 1HB SER 30 HB2 SER 30 16.119 -11.199 10.562 231 2HB SER 30 HB3 SER 30 15.748 -11.644 12.237 232 HG SER 30 HG SER 30 13.903 -12.781 11.389 233 H LYS 31 H LYS 31 16.371 -9.165 12.689 234 HA LYS 31 HA LYS 31 16.107 -6.479 12.027 235 1HB LYS 31 HB2 LYS 31 18.718 -7.917 12.787 236 2HB LYS 31 HB3 LYS 31 18.337 -6.217 12.992 237 1HG LYS 31 HG2 LYS 31 16.446 -7.076 14.594 238 2HG LYS 31 HG3 LYS 31 17.323 -8.613 14.524 239 1HD LYS 31 HD2 LYS 31 19.462 -7.199 15.061 240 2HD LYS 31 HD3 LYS 31 18.337 -5.891 15.450 241 1HE LYS 31 HE2 LYS 31 18.891 -6.973 17.510 242 2HE LYS 31 HE3 LYS 31 17.235 -7.453 17.123 243 1HZ LYS 31 HZ1 LYS 31 18.157 -9.506 16.231 244 2HZ LYS 31 HZ2 LYS 31 19.678 -9.031 16.652 245 3HZ LYS 31 HZ3 LYS 31 18.547 -9.320 17.817 246 H LYS 32 H LYS 32 18.768 -8.568 10.878 247 HA LYS 32 HA LYS 32 19.541 -6.591 8.895 248 1HB LYS 32 HB2 LYS 32 21.222 -7.891 9.934 249 2HB LYS 32 HB3 LYS 32 20.501 -9.425 9.377 250 1HG LYS 32 HG2 LYS 32 20.967 -8.795 7.034 251 2HG LYS 32 HG3 LYS 32 21.610 -7.229 7.567 252 1HD LYS 32 HD2 LYS 32 23.379 -8.423 8.867 253 2HD LYS 32 HD3 LYS 32 22.753 -9.974 8.287 254 1HE LYS 32 HE2 LYS 32 23.870 -7.727 6.534 255 2HE LYS 32 HE3 LYS 32 24.726 -9.208 6.989 256 1HZ LYS 32 HZ1 LYS 32 23.038 -10.464 5.846 257 2HZ LYS 32 HZ2 LYS 32 22.271 -9.080 5.385 258 3HZ LYS 32 HZ3 LYS 32 23.786 -9.403 4.833 259 H GLU 33 H GLU 33 17.432 -9.397 8.916 260 HA GLU 33 HA GLU 33 17.118 -9.708 6.108 261 1HB GLU 33 HB2 GLU 33 16.296 -11.262 7.959 262 2HB GLU 33 HB3 GLU 33 15.003 -10.099 8.273 263 1HG GLU 33 HG2 GLU 33 14.112 -11.844 6.899 264 2HG GLU 33 HG3 GLU 33 14.261 -10.430 5.863 265 H LEU 34 H LEU 34 15.459 -7.584 8.520 266 HA LEU 34 HA LEU 34 13.821 -6.230 6.641 267 1HB LEU 34 HB2 LEU 34 13.383 -6.139 9.026 268 2HB LEU 34 HB3 LEU 34 14.931 -5.408 9.367 269 HG LEU 34 HG LEU 34 13.010 -3.898 9.518 270 1HD1 LEU 34 HD11 LEU 34 14.140 -1.998 8.771 271 2HD1 LEU 34 HD12 LEU 34 15.444 -3.167 8.967 272 3HD1 LEU 34 HD13 LEU 34 14.816 -2.793 7.362 273 1HD2 LEU 34 HD21 LEU 34 12.862 -4.128 6.479 274 2HD2 LEU 34 HD22 LEU 34 11.689 -4.790 7.636 275 3HD2 LEU 34 HD23 LEU 34 11.910 -3.039 7.475 276 H LYS 35 H LYS 35 17.121 -5.452 7.920 277 HA LYS 35 HA LYS 35 17.358 -3.106 6.396 278 1HB LYS 35 HB2 LYS 35 18.971 -3.922 8.154 279 2HB LYS 35 HB3 LYS 35 19.708 -4.973 6.922 280 1HG LYS 35 HG2 LYS 35 20.181 -3.011 5.506 281 2HG LYS 35 HG3 LYS 35 19.281 -1.968 6.622 282 1HD LYS 35 HD2 LYS 35 20.960 -2.627 8.428 283 2HD LYS 35 HD3 LYS 35 21.943 -3.339 7.136 284 1HE LYS 35 HE2 LYS 35 20.985 -0.428 7.336 285 2HE LYS 35 HE3 LYS 35 22.639 -1.020 7.607 286 1HZ LYS 35 HZ1 LYS 35 21.177 -1.033 5.064 287 2HZ LYS 35 HZ2 LYS 35 22.506 -0.138 5.476 288 3HZ LYS 35 HZ3 LYS 35 22.637 -1.768 5.305 289 H GLU 36 H GLU 36 18.055 -6.456 5.414 290 HA GLU 36 HA GLU 36 18.973 -5.959 2.799 291 1HB GLU 36 HB2 GLU 36 18.981 -8.127 4.179 292 2HB GLU 36 HB3 GLU 36 17.323 -8.375 3.636 293 1HG GLU 36 HG2 GLU 36 18.146 -8.235 1.252 294 2HG GLU 36 HG3 GLU 36 19.797 -8.064 1.866 295 H LEU 37 H LEU 37 15.626 -6.555 4.000 296 HA LEU 37 HA LEU 37 14.182 -6.221 1.615 297 1HB LEU 37 HB2 LEU 37 13.221 -6.898 3.754 298 2HB LEU 37 HB3 LEU 37 13.442 -5.305 4.425 299 HG LEU 37 HG LEU 37 11.682 -5.710 2.014 300 1HD1 LEU 37 HD11 LEU 37 10.780 -7.175 3.628 301 2HD1 LEU 37 HD12 LEU 37 11.081 -6.048 4.975 302 3HD1 LEU 37 HD13 LEU 37 9.818 -5.707 3.784 303 1HD2 LEU 37 HD21 LEU 37 10.550 -3.689 2.997 304 2HD2 LEU 37 HD22 LEU 37 11.839 -3.571 4.211 305 3HD2 LEU 37 HD23 LEU 37 12.192 -3.349 2.474 306 H ILE 38 H ILE 38 15.246 -3.639 3.889 307 HA ILE 38 HA ILE 38 14.229 -1.544 2.247 308 HB ILE 38 HB ILE 38 16.413 -1.545 4.349 309 1HG1 ILE 38 HG12 ILE 38 13.468 -0.685 4.313 310 2HG1 ILE 38 HG13 ILE 38 14.098 -2.161 5.057 311 1HG2 ILE 38 HG21 ILE 38 16.699 0.416 2.764 312 2HG2 ILE 38 HG22 ILE 38 15.023 0.880 3.134 313 3HG2 ILE 38 HG23 ILE 38 16.268 0.867 4.397 314 1HD1 ILE 38 HD11 ILE 38 15.529 -0.691 6.543 315 2HD1 ILE 38 HD12 ILE 38 14.611 0.692 5.902 316 3HD1 ILE 38 HD13 ILE 38 13.762 -0.614 6.774 317 H GLN 39 H GLN 39 17.570 -2.929 2.341 318 HA GLN 39 HA GLN 39 18.491 -1.099 0.320 319 1HB GLN 39 HB2 GLN 39 19.600 -3.844 1.010 320 2HB GLN 39 HB3 GLN 39 20.402 -2.590 0.051 321 1HG GLN 39 HG2 GLN 39 19.725 -2.478 3.016 322 2HG GLN 39 HG3 GLN 39 21.316 -2.482 2.269 323 1HE2 GLN 39 HE22 GLN 39 18.898 -0.549 3.633 324 2HE2 GLN 39 HE21 GLN 39 19.494 0.997 3.054 325 H LYS 40 H LYS 40 16.762 -4.200 0.047 326 HA LYS 40 HA LYS 40 17.149 -4.351 -2.798 327 1HB LYS 40 HB2 LYS 40 16.614 -6.290 -1.336 328 2HB LYS 40 HB3 LYS 40 15.018 -5.620 -1.041 329 1HG LYS 40 HG2 LYS 40 14.805 -7.324 -2.724 330 2HG LYS 40 HG3 LYS 40 14.478 -5.772 -3.466 331 1HD LYS 40 HD2 LYS 40 15.811 -7.197 -4.937 332 2HD LYS 40 HD3 LYS 40 16.670 -5.716 -4.538 333 1HE LYS 40 HE2 LYS 40 18.146 -7.711 -4.502 334 2HE LYS 40 HE3 LYS 40 18.088 -6.929 -2.922 335 1HZ LYS 40 HZ1 LYS 40 16.555 -9.307 -3.723 336 2HZ LYS 40 HZ2 LYS 40 17.886 -9.295 -2.752 337 3HZ LYS 40 HZ3 LYS 40 16.486 -8.587 -2.241 338 H GLU 41 H GLU 41 14.325 -3.326 -0.820 339 HA GLU 41 HA GLU 41 12.812 -2.587 -3.203 340 1HB GLU 41 HB2 GLU 41 12.294 -2.548 -0.218 341 2HB GLU 41 HB3 GLU 41 11.239 -1.667 -1.327 342 1HG GLU 41 HG2 GLU 41 10.340 -3.857 -0.865 343 2HG GLU 41 HG3 GLU 41 10.702 -3.665 -2.587 344 H LEU 42 H LEU 42 14.432 -0.740 -0.592 345 HA LEU 42 HA LEU 42 13.461 1.822 -1.755 346 1HB LEU 42 HB2 LEU 42 14.985 1.185 0.782 347 2HB LEU 42 HB3 LEU 42 14.770 2.807 0.171 348 HG LEU 42 HG LEU 42 13.217 2.170 1.985 349 1HD1 LEU 42 HD11 LEU 42 12.727 4.028 0.404 350 2HD1 LEU 42 HD12 LEU 42 11.776 2.897 -0.585 351 3HD1 LEU 42 HD13 LEU 42 11.274 3.262 1.069 352 1HD2 LEU 42 HD21 LEU 42 11.301 0.771 1.625 353 2HD2 LEU 42 HD22 LEU 42 11.731 0.489 -0.068 354 3HD2 LEU 42 HD23 LEU 42 12.739 -0.186 1.234 355 H THR 43 H THR 43 16.506 0.123 -1.002 356 HA THR 43 HA THR 43 18.614 0.337 -1.862 357 HB THR 43 HB THR 43 17.319 1.276 -4.445 358 HG1 THR 43 HG1 THR 43 17.324 -1.308 -3.291 359 1HG2 THR 43 HG21 THR 43 19.797 1.049 -4.438 360 2HG2 THR 43 HG22 THR 43 19.634 -0.624 -3.854 361 3HG2 THR 43 HG23 THR 43 19.024 -0.175 -5.459 362 H ILE 44 H ILE 44 18.648 2.195 -0.279 363 HA ILE 44 HA ILE 44 18.712 4.897 -1.246 364 HB ILE 44 HB ILE 44 19.987 5.303 0.907 365 1HG1 ILE 44 HG12 ILE 44 19.094 2.531 1.740 366 2HG1 ILE 44 HG13 ILE 44 20.687 2.722 1.002 367 1HG2 ILE 44 HG21 ILE 44 17.259 3.949 1.046 368 2HG2 ILE 44 HG22 ILE 44 17.943 5.047 2.262 369 3HG2 ILE 44 HG23 ILE 44 17.570 5.650 0.647 370 1HD1 ILE 44 HD11 ILE 44 21.338 4.367 2.695 371 2HD1 ILE 44 HD12 ILE 44 19.734 4.231 3.448 372 3HD1 ILE 44 HD13 ILE 44 20.840 2.836 3.439 373 H GLY 45 H GLY 45 19.922 4.576 -3.211 374 1HA GLY 45 HA2 GLY 45 22.593 4.136 -3.621 375 2HA GLY 45 HA3 GLY 45 21.742 5.527 -4.320 376 H SER 46 H SER 46 21.215 7.042 -2.015 377 HA SER 46 HA SER 46 23.723 8.216 -1.238 378 1HB SER 46 HB2 SER 46 20.956 8.498 0.008 379 2HB SER 46 HB3 SER 46 22.298 9.650 0.112 380 HG SER 46 HG SER 46 22.126 9.826 -2.219 381 H LYS 47 H LYS 47 24.496 5.893 -0.650 382 HA LYS 47 HA LYS 47 23.555 4.439 1.488 383 1HB LYS 47 HB2 LYS 47 26.387 4.720 0.429 384 2HB LYS 47 HB3 LYS 47 25.921 3.478 1.596 385 1HG LYS 47 HG2 LYS 47 24.524 3.766 -1.099 386 2HG LYS 47 HG3 LYS 47 25.976 2.790 -0.861 387 1HD LYS 47 HD2 LYS 47 24.832 1.397 0.804 388 2HD LYS 47 HD3 LYS 47 23.362 2.383 0.672 389 1HE LYS 47 HE2 LYS 47 23.081 1.786 -1.671 390 2HE LYS 47 HE3 LYS 47 24.600 0.867 -1.662 391 1HZ LYS 47 HZ1 LYS 47 22.245 0.242 -0.013 392 2HZ LYS 47 HZ2 LYS 47 22.678 -0.528 -1.407 393 3HZ LYS 47 HZ3 LYS 47 23.649 -0.615 -0.080 394 H LEU 48 H LEU 48 25.285 7.425 1.791 395 HA LEU 48 HA LEU 48 26.284 7.282 4.421 396 1HB LEU 48 HB2 LEU 48 24.765 9.577 3.115 397 2HB LEU 48 HB3 LEU 48 25.823 9.703 4.524 398 HG LEU 48 HG LEU 48 26.703 8.950 1.693 399 1HD1 LEU 48 HD11 LEU 48 27.804 11.143 1.722 400 2HD1 LEU 48 HD12 LEU 48 26.057 11.317 1.962 401 3HD1 LEU 48 HD13 LEU 48 27.161 11.466 3.346 402 1HD2 LEU 48 HD21 LEU 48 28.325 9.330 4.253 403 2HD2 LEU 48 HD22 LEU 48 28.172 7.832 3.306 404 3HD2 LEU 48 HD23 LEU 48 29.013 9.223 2.620 405 H GLN 49 H GLN 49 22.938 7.409 3.298 406 HA GLN 49 HA GLN 49 21.753 8.022 5.842 407 1HB GLN 49 HB2 GLN 49 20.606 6.619 3.398 408 2HB GLN 49 HB3 GLN 49 19.677 7.161 4.802 409 1HG GLN 49 HG2 GLN 49 20.531 9.512 4.373 410 2HG GLN 49 HG3 GLN 49 21.247 8.921 2.868 411 1HE2 GLN 49 HE22 GLN 49 18.152 9.170 4.666 412 2HE2 GLN 49 HE21 GLN 49 17.140 9.241 3.222 413 H ASP 50 H ASP 50 23.455 5.194 4.965 414 HA ASP 50 HA ASP 50 22.091 3.056 5.977 415 1HB ASP 50 HB2 ASP 50 24.342 2.912 5.047 416 2HB ASP 50 HB3 ASP 50 25.012 3.815 6.418 417 H ALA 51 H ALA 51 23.814 5.503 7.937 418 HA ALA 51 HA ALA 51 23.416 4.395 10.506 419 1HB ALA 51 HB1 ALA 51 23.640 6.715 11.312 420 2HB ALA 51 HB2 ALA 51 24.846 6.342 10.064 421 3HB ALA 51 HB3 ALA 51 23.421 7.324 9.657 422 H GLU 52 H GLU 52 21.224 6.352 8.479 423 HA GLU 52 HA GLU 52 19.188 6.698 10.522 424 1HB GLU 52 HB2 GLU 52 18.862 6.874 7.492 425 2HB GLU 52 HB3 GLU 52 17.799 7.527 8.734 426 1HG GLU 52 HG2 GLU 52 19.623 9.060 9.482 427 2HG GLU 52 HG3 GLU 52 20.655 8.462 8.172 428 H ILE 53 H ILE 53 19.788 4.520 7.735 429 HA ILE 53 HA ILE 53 17.412 3.001 8.014 430 HB ILE 53 HB ILE 53 20.095 1.962 7.041 431 1HG1 ILE 53 HG12 ILE 53 19.537 3.808 5.653 432 2HG1 ILE 53 HG13 ILE 53 19.103 2.327 4.793 433 1HG2 ILE 53 HG21 ILE 53 18.616 0.118 7.569 434 2HG2 ILE 53 HG22 ILE 53 17.268 0.894 6.734 435 3HG2 ILE 53 HG23 ILE 53 18.671 0.311 5.816 436 1HD1 ILE 53 HD11 ILE 53 17.365 3.888 4.385 437 2HD1 ILE 53 HD12 ILE 53 16.696 2.719 5.529 438 3HD1 ILE 53 HD13 ILE 53 17.220 4.319 6.098 439 H VAL 54 H VAL 54 20.617 2.497 9.666 440 HA VAL 54 HA VAL 54 19.557 0.123 10.882 441 HB VAL 54 HB VAL 54 21.476 0.163 12.433 442 1HG1 VAL 54 HG11 VAL 54 22.006 0.269 9.449 443 2HG1 VAL 54 HG12 VAL 54 22.994 -0.586 10.654 444 3HG1 VAL 54 HG13 VAL 54 21.342 -1.130 10.319 445 1HG2 VAL 54 HG21 VAL 54 22.513 2.404 10.707 446 2HG2 VAL 54 HG22 VAL 54 21.976 2.599 12.393 447 3HG2 VAL 54 HG23 VAL 54 23.366 1.567 12.005 448 H LYS 55 H LYS 55 19.595 3.518 12.033 449 HA LYS 55 HA LYS 55 18.463 2.860 14.590 450 1HB LYS 55 HB2 LYS 55 19.378 5.053 14.191 451 2HB LYS 55 HB3 LYS 55 18.242 5.357 12.876 452 1HG LYS 55 HG2 LYS 55 17.675 6.528 15.008 453 2HG LYS 55 HG3 LYS 55 16.381 5.532 14.352 454 1HD LYS 55 HD2 LYS 55 16.487 5.344 16.775 455 2HD LYS 55 HD3 LYS 55 16.785 3.785 16.036 456 1HE LYS 55 HE2 LYS 55 19.258 4.114 16.390 457 2HE LYS 55 HE3 LYS 55 18.901 5.655 17.191 458 1HZ LYS 55 HZ1 LYS 55 17.920 3.011 18.043 459 2HZ LYS 55 HZ2 LYS 55 19.167 3.842 18.731 460 3HZ LYS 55 HZ3 LYS 55 17.634 4.441 18.806 461 H LEU 56 H LEU 56 16.914 3.695 11.459 462 HA LEU 56 HA LEU 56 14.224 3.341 12.227 463 1HB LEU 56 HB2 LEU 56 14.695 4.402 10.233 464 2HB LEU 56 HB3 LEU 56 15.767 3.143 9.645 465 HG LEU 56 HG LEU 56 12.908 2.336 10.034 466 1HD1 LEU 56 HD11 LEU 56 13.905 4.117 7.754 467 2HD1 LEU 56 HD12 LEU 56 12.352 3.265 7.777 468 3HD1 LEU 56 HD13 LEU 56 12.671 4.557 8.954 469 1HD2 LEU 56 HD21 LEU 56 14.658 0.743 9.144 470 2HD2 LEU 56 HD22 LEU 56 13.386 1.133 7.977 471 3HD2 LEU 56 HD23 LEU 56 14.999 1.884 7.844 472 H MET 57 H MET 57 16.576 0.911 11.092 473 HA MET 57 HA MET 57 14.823 -1.321 11.037 474 1HB MET 57 HB2 MET 57 16.872 -1.332 9.823 475 2HB MET 57 HB3 MET 57 17.817 -1.030 11.280 476 1HG MET 57 HG2 MET 57 16.161 -3.527 11.166 477 2HG MET 57 HG3 MET 57 17.658 -3.452 10.236 478 1HE MET 57 HE1 MET 57 20.051 -3.306 11.199 479 2HE MET 57 HE2 MET 57 19.733 -1.825 12.146 480 3HE MET 57 HE3 MET 57 20.428 -3.246 12.938 481 H ASP 58 H ASP 58 17.058 -0.115 13.587 482 HA ASP 58 HA ASP 58 16.369 -1.949 15.632 483 1HB ASP 58 HB2 ASP 58 18.200 -0.485 15.977 484 2HB ASP 58 HB3 ASP 58 17.230 0.956 15.690 485 H ASP 59 H ASP 59 14.822 1.188 14.774 486 HA ASP 59 HA ASP 59 12.796 0.993 16.758 487 1HB ASP 59 HB2 ASP 59 12.677 2.478 14.088 488 2HB ASP 59 HB3 ASP 59 11.631 2.765 15.484 489 H LEU 60 H LEU 60 12.871 -0.295 13.458 490 HA LEU 60 HA LEU 60 10.148 -1.286 13.497 491 1HB LEU 60 HB2 LEU 60 12.649 -1.851 11.902 492 2HB LEU 60 HB3 LEU 60 11.296 -2.966 11.776 493 HG LEU 60 HG LEU 60 10.747 -0.018 11.442 494 1HD1 LEU 60 HD11 LEU 60 11.877 -1.754 9.222 495 2HD1 LEU 60 HD12 LEU 60 11.263 -0.111 9.042 496 3HD1 LEU 60 HD13 LEU 60 12.726 -0.399 10.003 497 1HD2 LEU 60 HD21 LEU 60 9.163 -0.957 9.705 498 2HD2 LEU 60 HD22 LEU 60 9.724 -2.577 10.099 499 3HD2 LEU 60 HD23 LEU 60 8.858 -1.622 11.332 500 H ASP 61 H ASP 61 13.265 -3.032 14.001 501 HA ASP 61 HA ASP 61 11.950 -5.421 14.732 502 1HB ASP 61 HB2 ASP 61 14.040 -6.367 15.213 503 2HB ASP 61 HB3 ASP 61 14.187 -5.356 13.780 504 H ARG 62 H ARG 62 12.954 -2.755 16.740 505 HA ARG 62 HA ARG 62 13.055 -3.422 19.316 506 1HB ARG 62 HB2 ARG 62 12.887 -1.138 18.643 507 2HB ARG 62 HB3 ARG 62 11.350 -1.445 17.833 508 1HG ARG 62 HG2 ARG 62 10.261 -1.698 20.118 509 2HG ARG 62 HG3 ARG 62 11.819 -1.256 20.843 510 1HD ARG 62 HD2 ARG 62 10.258 0.701 20.614 511 2HD ARG 62 HD3 ARG 62 11.738 0.912 19.682 512 HE ARG 62 HE ARG 62 10.620 0.642 17.668 513 1HH1 ARG 62 HH22 ARG 62 8.275 0.145 20.275 514 2HH1 ARG 62 HH21 ARG 62 6.943 -0.097 19.175 515 1HH2 ARG 62 HH12 ARG 62 9.043 0.156 16.313 516 2HH2 ARG 62 HH11 ARG 62 7.362 0.008 16.814 517 H ASN 63 H ASN 63 10.048 -3.305 17.497 518 HA ASN 63 HA ASN 63 8.005 -3.922 19.047 519 1HB ASN 63 HB2 ASN 63 7.976 -3.786 16.579 520 2HB ASN 63 HB3 ASN 63 8.774 -5.342 16.479 521 1HD2 ASN 63 HD22 ASN 63 5.998 -4.338 18.612 522 2HD2 ASN 63 HD21 ASN 63 4.924 -5.567 18.002 523 H LYS 64 H LYS 64 10.160 -6.506 17.863 524 HA LYS 64 HA LYS 64 9.751 -7.971 20.376 525 1HB LYS 64 HB2 LYS 64 9.365 -9.430 17.731 526 2HB LYS 64 HB3 LYS 64 9.375 -10.117 19.362 527 1HG LYS 64 HG2 LYS 64 7.379 -8.562 19.861 528 2HG LYS 64 HG3 LYS 64 7.292 -8.296 18.112 529 1HD LYS 64 HD2 LYS 64 6.988 -10.925 19.631 530 2HD LYS 64 HD3 LYS 64 5.733 -10.034 18.758 531 1HE LYS 64 HE2 LYS 64 7.084 -10.427 16.621 532 2HE LYS 64 HE3 LYS 64 8.137 -11.493 17.562 533 1HZ LYS 64 HZ1 LYS 64 5.246 -11.841 17.207 534 2HZ LYS 64 HZ2 LYS 64 6.426 -12.710 16.458 535 3HZ LYS 64 HZ3 LYS 64 6.232 -12.824 18.088 536 H ASP 65 H ASP 65 11.739 -6.419 19.863 537 HA ASP 65 HA ASP 65 13.950 -6.177 19.531 538 1HB ASP 65 HB2 ASP 65 15.291 -7.852 20.901 539 2HB ASP 65 HB3 ASP 65 14.015 -6.931 21.697 540 H GLN 66 H GLN 66 14.074 -9.696 19.162 541 HA GLN 66 HA GLN 66 16.105 -9.678 17.161 542 1HB GLN 66 HB2 GLN 66 13.969 -11.730 17.871 543 2HB GLN 66 HB3 GLN 66 15.274 -12.035 16.720 544 1HG GLN 66 HG2 GLN 66 15.692 -11.303 19.656 545 2HG GLN 66 HG3 GLN 66 15.765 -12.932 18.990 546 1HE2 GLN 66 HE22 GLN 66 17.380 -13.194 17.073 547 2HE2 GLN 66 HE21 GLN 66 18.910 -12.359 17.281 548 H GLU 67 H GLU 67 12.536 -9.466 16.882 549 HA GLU 67 HA GLU 67 12.881 -9.025 13.961 550 1HB GLU 67 HB2 GLU 67 10.781 -10.924 15.087 551 2HB GLU 67 HB3 GLU 67 11.167 -10.595 13.395 552 1HG GLU 67 HG2 GLU 67 13.522 -11.604 13.976 553 2HG GLU 67 HG3 GLU 67 12.719 -12.240 15.415 554 H VAL 68 H VAL 68 11.200 -8.000 12.917 555 HA VAL 68 HA VAL 68 9.315 -6.489 14.669 556 HB VAL 68 HB VAL 68 10.547 -5.132 13.041 557 1HG1 VAL 68 HG11 VAL 68 10.906 -6.662 11.185 558 2HG1 VAL 68 HG12 VAL 68 9.157 -6.715 10.854 559 3HG1 VAL 68 HG13 VAL 68 10.063 -5.210 10.651 560 1HG2 VAL 68 HG21 VAL 68 8.644 -3.915 12.182 561 2HG2 VAL 68 HG22 VAL 68 7.599 -5.332 12.357 562 3HG2 VAL 68 HG23 VAL 68 8.255 -4.525 13.797 563 H ASN 69 H ASN 69 7.142 -7.122 14.728 564 HA ASN 69 HA ASN 69 6.450 -9.513 13.177 565 1HB ASN 69 HB2 ASN 69 4.875 -9.960 14.668 566 2HB ASN 69 HB3 ASN 69 5.705 -8.810 15.708 567 1HD2 ASN 69 HD22 ASN 69 4.764 -6.677 15.923 568 2HD2 ASN 69 HD21 ASN 69 3.043 -6.415 15.617 569 H PHE 70 H PHE 70 4.640 -9.614 11.783 570 HA PHE 70 HA PHE 70 4.526 -7.801 9.750 571 1HB PHE 70 HB2 PHE 70 3.618 -10.029 9.601 572 2HB PHE 70 HB3 PHE 70 2.375 -9.664 10.804 573 HD1 PHE 70 HD1 PHE 70 0.228 -9.077 10.018 574 HD2 PHE 70 HD2 PHE 70 3.681 -8.315 7.538 575 HE1 PHE 70 HE1 PHE 70 -1.196 -7.892 8.387 576 HE2 PHE 70 HE2 PHE 70 2.243 -7.146 5.902 577 HZ PHE 70 HZ PHE 70 -0.185 -6.860 6.381 578 H GLN 71 H GLN 71 2.220 -7.736 12.542 579 HA GLN 71 HA GLN 71 0.673 -5.562 11.522 580 1HB GLN 71 HB2 GLN 71 -0.350 -6.698 13.228 581 2HB GLN 71 HB3 GLN 71 1.076 -6.789 14.246 582 1HG GLN 71 HG2 GLN 71 -0.335 -4.146 13.711 583 2HG GLN 71 HG3 GLN 71 -0.825 -5.250 14.998 584 1HE2 GLN 71 HE22 GLN 71 0.800 -2.420 14.771 585 2HE2 GLN 71 HE21 GLN 71 2.013 -2.706 15.995 586 H GLU 72 H GLU 72 3.634 -5.599 13.580 587 HA GLU 72 HA GLU 72 3.439 -2.741 13.900 588 1HB GLU 72 HB2 GLU 72 4.398 -4.247 15.629 589 2HB GLU 72 HB3 GLU 72 5.812 -4.481 14.577 590 1HG GLU 72 HG2 GLU 72 6.145 -2.729 16.356 591 2HG GLU 72 HG3 GLU 72 6.339 -2.076 14.726 592 H TYR 73 H TYR 73 5.106 -4.906 11.669 593 HA TYR 73 HA TYR 73 6.730 -2.955 10.356 594 1HB TYR 73 HB2 TYR 73 7.131 -5.122 9.706 595 2HB TYR 73 HB3 TYR 73 5.440 -5.549 9.566 596 HD1 TYR 73 HD1 TYR 73 8.238 -3.802 7.863 597 HD2 TYR 73 HD2 TYR 73 4.195 -5.277 7.531 598 HE1 TYR 73 HE1 TYR 73 8.368 -3.619 5.399 599 HE2 TYR 73 HE2 TYR 73 4.297 -4.990 5.077 600 HH TYR 73 HH TYR 73 7.219 -3.802 3.404 601 H ILE 74 H ILE 74 3.291 -3.933 9.680 602 HA ILE 74 HA ILE 74 2.899 -1.903 7.713 603 HB ILE 74 HB ILE 74 0.835 -3.131 9.576 604 1HG1 ILE 74 HG12 ILE 74 2.022 -4.797 8.112 605 2HG1 ILE 74 HG13 ILE 74 0.289 -4.686 7.901 606 1HG2 ILE 74 HG21 ILE 74 -0.730 -2.412 7.627 607 2HG2 ILE 74 HG22 ILE 74 -0.163 -1.164 8.732 608 3HG2 ILE 74 HG23 ILE 74 0.584 -1.344 7.131 609 1HD1 ILE 74 HD11 ILE 74 1.412 -4.912 5.742 610 2HD1 ILE 74 HD12 ILE 74 0.577 -3.367 5.828 611 3HD1 ILE 74 HD13 ILE 74 2.346 -3.437 6.043 612 H THR 75 H THR 75 2.244 -1.851 11.224 613 HA THR 75 HA THR 75 1.172 0.733 11.465 614 HB THR 75 HB THR 75 3.065 -0.633 13.415 615 HG1 THR 75 HG1 THR 75 1.273 -1.943 12.759 616 1HG2 THR 75 HG21 THR 75 2.645 1.665 14.091 617 2HG2 THR 75 HG22 THR 75 0.898 1.440 13.878 618 3HG2 THR 75 HG23 THR 75 1.761 0.551 15.147 619 H PHE 76 H PHE 76 4.603 -0.274 11.609 620 HA PHE 76 HA PHE 76 5.716 2.309 11.983 621 1HB PHE 76 HB2 PHE 76 6.907 0.205 12.479 622 2HB PHE 76 HB3 PHE 76 6.947 -0.184 10.761 623 HD1 PHE 76 HD1 PHE 76 8.342 1.194 9.177 624 HD2 PHE 76 HD2 PHE 76 8.391 1.911 13.438 625 HE1 PHE 76 HE1 PHE 76 10.285 2.675 8.907 626 HE2 PHE 76 HE2 PHE 76 10.306 3.456 13.142 627 HZ PHE 76 HZ PHE 76 11.208 3.899 10.861 628 H LEU 77 H LEU 77 5.115 0.368 8.961 629 HA LEU 77 HA LEU 77 6.145 2.417 7.234 630 1HB LEU 77 HB2 LEU 77 4.111 0.204 6.823 631 2HB LEU 77 HB3 LEU 77 4.481 1.371 5.548 632 HG LEU 77 HG LEU 77 6.597 -0.361 6.908 633 1HD1 LEU 77 HD11 LEU 77 5.041 -1.750 5.635 634 2HD1 LEU 77 HD12 LEU 77 5.179 -0.659 4.231 635 3HD1 LEU 77 HD13 LEU 77 6.585 -1.596 4.763 636 1HD2 LEU 77 HD21 LEU 77 7.906 0.287 4.823 637 2HD2 LEU 77 HD22 LEU 77 6.639 1.483 4.469 638 3HD2 LEU 77 HD23 LEU 77 7.646 1.623 5.934 639 H GLY 78 H GLY 78 2.970 2.025 8.793 640 1HA GLY 78 HA2 GLY 78 1.713 4.305 7.671 641 2HA GLY 78 HA3 GLY 78 1.437 3.678 9.314 642 H ALA 79 H ALA 79 3.815 4.058 10.598 643 HA ALA 79 HA ALA 79 3.896 6.818 11.154 644 1HB ALA 79 HB1 ALA 79 5.882 6.387 12.455 645 2HB ALA 79 HB2 ALA 79 4.764 5.029 12.673 646 3HB ALA 79 HB3 ALA 79 6.184 4.858 11.622 647 H LEU 80 H LEU 80 6.051 4.919 9.023 648 HA LEU 80 HA LEU 80 7.777 6.997 8.234 649 1HB LEU 80 HB2 LEU 80 7.759 4.366 7.763 650 2HB LEU 80 HB3 LEU 80 6.866 4.823 6.325 651 HG LEU 80 HG LEU 80 8.804 6.367 5.738 652 1HD1 LEU 80 HD11 LEU 80 11.006 5.771 6.795 653 2HD1 LEU 80 HD12 LEU 80 9.925 6.569 7.943 654 3HD1 LEU 80 HD13 LEU 80 10.141 4.807 8.005 655 1HD2 LEU 80 HD21 LEU 80 10.202 4.492 4.922 656 2HD2 LEU 80 HD22 LEU 80 9.416 3.395 6.075 657 3HD2 LEU 80 HD23 LEU 80 8.481 4.104 4.733 658 H ALA 81 H ALA 81 4.728 5.854 6.811 659 HA ALA 81 HA ALA 81 4.580 7.683 4.639 660 1HB ALA 81 HB1 ALA 81 2.294 6.919 4.448 661 2HB ALA 81 HB2 ALA 81 3.348 5.555 4.810 662 3HB ALA 81 HB3 ALA 81 2.336 6.241 6.092 663 H MET 82 H MET 82 3.495 7.886 8.032 664 HA MET 82 HA MET 82 2.181 10.404 7.727 665 1HB MET 82 HB2 MET 82 1.773 8.716 9.543 666 2HB MET 82 HB3 MET 82 3.325 9.159 10.262 667 1HG MET 82 HG2 MET 82 2.559 11.381 10.751 668 2HG MET 82 HG3 MET 82 1.146 11.202 9.708 669 1HE MET 82 HE1 MET 82 1.507 9.027 13.765 670 2HE MET 82 HE2 MET 82 2.341 8.439 12.313 671 3HE MET 82 HE3 MET 82 2.818 9.993 13.046 672 H ILE 83 H ILE 83 5.484 9.475 8.680 673 HA ILE 83 HA ILE 83 6.463 12.110 9.219 674 HB ILE 83 HB ILE 83 7.814 9.541 8.335 675 1HG1 ILE 83 HG12 ILE 83 8.040 11.094 10.947 676 2HG1 ILE 83 HG13 ILE 83 6.776 9.895 10.688 677 1HG2 ILE 83 HG21 ILE 83 9.985 10.663 8.854 678 2HG2 ILE 83 HG22 ILE 83 9.198 11.356 7.445 679 3HG2 ILE 83 HG23 ILE 83 9.126 12.209 9.003 680 1HD1 ILE 83 HD11 ILE 83 8.489 8.152 10.250 681 2HD1 ILE 83 HD12 ILE 83 9.765 9.331 10.631 682 3HD1 ILE 83 HD13 ILE 83 8.596 8.858 11.871 683 H TYR 84 H TYR 84 6.071 10.244 6.179 684 HA TYR 84 HA TYR 84 6.963 12.465 4.513 685 1HB TYR 84 HB2 TYR 84 5.190 10.140 3.743 686 2HB TYR 84 HB3 TYR 84 6.107 11.187 2.666 687 HD1 TYR 84 HD1 TYR 84 8.730 11.076 4.545 688 HD2 TYR 84 HD2 TYR 84 6.121 8.150 2.733 689 HE1 TYR 84 HE1 TYR 84 10.587 9.461 4.463 690 HE2 TYR 84 HE2 TYR 84 7.992 6.538 2.661 691 HH TYR 84 HH TYR 84 10.229 6.193 3.071 692 H ASN 85 H ASN 85 5.525 13.821 6.176 693 HA ASN 85 HA ASN 85 2.847 14.377 5.762 694 1HB ASN 85 HB2 ASN 85 4.125 15.590 7.388 695 2HB ASN 85 HB3 ASN 85 5.171 16.287 6.139 696 1HD2 ASN 85 HD22 ASN 85 4.602 18.332 5.405 697 2HD2 ASN 85 HD21 ASN 85 2.992 19.006 5.566 698 H GLU 86 H GLU 86 5.577 15.248 3.652 699 HA GLU 86 HA GLU 86 4.262 16.850 1.758 700 1HB GLU 86 HB2 GLU 86 6.706 16.376 1.817 701 2HB GLU 86 HB3 GLU 86 6.398 14.724 1.243 702 1HG GLU 86 HG2 GLU 86 5.423 15.641 -0.854 703 2HG GLU 86 HG3 GLU 86 5.669 17.288 -0.250 704 H ALA 87 H ALA 87 4.400 13.252 1.990 705 HA ALA 87 HA ALA 87 2.912 12.795 -0.444 706 1HB ALA 87 HB1 ALA 87 4.433 11.100 0.548 707 2HB ALA 87 HB2 ALA 87 3.330 10.929 1.932 708 3HB ALA 87 HB3 ALA 87 2.784 10.494 0.306 709 H LEU 88 H LEU 88 2.096 12.867 3.064 710 HA LEU 88 HA LEU 88 -0.659 12.298 2.853 711 1HB LEU 88 HB2 LEU 88 0.834 14.127 4.752 712 2HB LEU 88 HB3 LEU 88 -0.894 13.856 4.876 713 HG LEU 88 HG LEU 88 1.047 11.523 4.916 714 1HD1 LEU 88 HD11 LEU 88 1.821 12.661 6.786 715 2HD1 LEU 88 HD12 LEU 88 0.274 13.448 7.110 716 3HD1 LEU 88 HD13 LEU 88 0.477 11.743 7.496 717 1HD2 LEU 88 HD21 LEU 88 -0.794 10.382 6.027 718 2HD2 LEU 88 HD22 LEU 88 -1.753 11.868 6.095 719 3HD2 LEU 88 HD23 LEU 88 -1.428 11.086 4.537 720 H LYS 89 H LYS 89 0.898 15.536 2.611 721 HA LYS 89 HA LYS 89 -1.623 16.831 2.000 722 1HB LYS 89 HB2 LYS 89 1.243 17.757 1.569 723 2HB LYS 89 HB3 LYS 89 -0.199 18.770 1.418 724 1HG LYS 89 HG2 LYS 89 0.778 17.417 3.979 725 2HG LYS 89 HG3 LYS 89 0.887 19.131 3.567 726 1HD LYS 89 HD2 LYS 89 -1.662 19.172 3.437 727 2HD LYS 89 HD3 LYS 89 -1.653 17.521 4.088 728 1HE LYS 89 HE2 LYS 89 -0.371 18.347 6.084 729 2HE LYS 89 HE3 LYS 89 -0.527 19.997 5.455 730 1HZ LYS 89 HZ1 LYS 89 -2.911 19.738 5.564 731 2HZ LYS 89 HZ2 LYS 89 -2.759 18.216 6.160 732 3HZ LYS 89 HZ3 LYS 89 -2.223 19.498 7.043 733 H GLY 90 H GLY 90 0.974 15.471 -0.067 734 1HA GLY 90 HA2 GLY 90 -0.964 15.199 -2.229 735 2HA GLY 90 HA3 GLY 90 0.295 16.406 -2.555 736 1H MET 1 H1 MET 1 15.585 4.065 -5.774 737 2H MET 1 H2 MET 1 16.515 2.730 -6.063 738 3H MET 1 H3 MET 1 15.703 2.886 -4.628 739 HA MET 1 HA MET 1 14.478 2.627 -7.267 740 1HB MET 1 HB2 MET 1 15.576 0.570 -6.522 741 2HB MET 1 HB3 MET 1 14.670 0.584 -5.016 742 1HG MET 1 HG2 MET 1 12.539 0.543 -6.524 743 2HG MET 1 HG3 MET 1 13.641 0.200 -7.855 744 1HE MET 1 HE1 MET 1 15.235 -2.003 -7.845 745 2HE MET 1 HE2 MET 1 15.754 -1.749 -6.156 746 3HE MET 1 HE3 MET 1 15.068 -3.309 -6.645 747 H ALA 2 H ALA 2 13.107 1.487 -4.214 748 HA ALA 2 HA ALA 2 11.533 2.172 -2.829 749 1HB ALA 2 HB1 ALA 2 12.964 4.208 -2.676 750 2HB ALA 2 HB2 ALA 2 11.929 4.998 -3.882 751 3HB ALA 2 HB3 ALA 2 11.256 4.502 -2.320 752 H SER 3 H SER 3 11.005 3.470 -6.058 753 HA SER 3 HA SER 3 8.519 4.336 -6.138 754 1HB SER 3 HB2 SER 3 8.858 2.737 -8.495 755 2HB SER 3 HB3 SER 3 9.038 4.477 -8.280 756 HG SER 3 HG SER 3 11.222 4.138 -7.707 757 HA PRO 4 HA PRO 4 6.536 -0.048 -6.757 758 1HB PRO 4 HB2 PRO 4 8.464 -1.651 -5.061 759 2HB PRO 4 HB3 PRO 4 7.488 -2.201 -6.453 760 1HG PRO 4 HG2 PRO 4 10.116 -1.654 -6.804 761 2HG PRO 4 HG3 PRO 4 8.933 -1.027 -7.991 762 1HD PRO 4 HD2 PRO 4 10.164 0.424 -5.639 763 2HD PRO 4 HD3 PRO 4 10.036 0.965 -7.337 764 H LEU 5 H LEU 5 8.202 0.708 -3.644 765 HA LEU 5 HA LEU 5 5.801 -0.170 -2.175 766 1HB LEU 5 HB2 LEU 5 7.982 -0.606 -1.170 767 2HB LEU 5 HB3 LEU 5 8.366 1.123 -1.197 768 HG LEU 5 HG LEU 5 6.499 1.596 0.356 769 1HD1 LEU 5 HD11 LEU 5 5.344 -0.268 1.503 770 2HD1 LEU 5 HD12 LEU 5 4.893 -0.206 -0.197 771 3HD1 LEU 5 HD13 LEU 5 6.055 -1.432 0.368 772 1HD2 LEU 5 HD21 LEU 5 8.724 1.024 1.260 773 2HD2 LEU 5 HD22 LEU 5 7.395 0.528 2.331 774 3HD2 LEU 5 HD23 LEU 5 8.229 -0.691 1.336 775 H ASP 6 H ASP 6 7.578 2.796 -3.031 776 HA ASP 6 HA ASP 6 6.142 4.726 -1.660 777 1HB ASP 6 HB2 ASP 6 7.180 4.953 -4.507 778 2HB ASP 6 HB3 ASP 6 6.693 6.300 -3.482 779 H GLN 7 H GLN 7 5.270 3.304 -4.886 780 HA GLN 7 HA GLN 7 2.947 4.956 -5.127 781 1HB GLN 7 HB2 GLN 7 2.266 3.540 -6.929 782 2HB GLN 7 HB3 GLN 7 4.009 3.818 -6.997 783 1HG GLN 7 HG2 GLN 7 4.197 1.546 -5.734 784 2HG GLN 7 HG3 GLN 7 2.512 1.287 -6.194 785 1HE2 GLN 7 HE22 GLN 7 5.704 2.213 -7.517 786 2HE2 GLN 7 HE21 GLN 7 5.490 1.414 -9.084 787 H ALA 8 H ALA 8 3.448 1.917 -3.332 788 HA ALA 8 HA ALA 8 0.595 1.379 -3.070 789 1HB ALA 8 HB1 ALA 8 3.025 0.188 -1.697 790 2HB ALA 8 HB2 ALA 8 1.345 -0.320 -1.432 791 3HB ALA 8 HB3 ALA 8 2.060 -0.462 -3.047 792 H ILE 9 H ILE 9 3.191 2.643 -0.849 793 HA ILE 9 HA ILE 9 1.269 3.306 1.221 794 HB ILE 9 HB ILE 9 2.910 4.804 2.179 795 1HG1 ILE 9 HG12 ILE 9 4.779 3.942 -0.048 796 2HG1 ILE 9 HG13 ILE 9 4.079 5.561 0.127 797 1HG2 ILE 9 HG21 ILE 9 4.032 2.064 1.452 798 2HG2 ILE 9 HG22 ILE 9 4.366 2.999 2.925 799 3HG2 ILE 9 HG23 ILE 9 2.756 2.343 2.653 800 1HD1 ILE 9 HD11 ILE 9 5.175 5.728 2.398 801 2HD1 ILE 9 HD12 ILE 9 6.029 4.210 2.047 802 3HD1 ILE 9 HD13 ILE 9 6.299 5.628 1.028 803 H GLY 10 H GLY 10 2.512 5.050 -1.607 804 1HA GLY 10 HA2 GLY 10 1.153 7.470 -1.479 805 2HA GLY 10 HA3 GLY 10 1.515 6.562 -2.954 806 H LEU 11 H LEU 11 -0.083 4.278 -2.642 807 HA LEU 11 HA LEU 11 -2.621 5.189 -3.433 808 1HB LEU 11 HB2 LEU 11 -1.418 2.918 -3.846 809 2HB LEU 11 HB3 LEU 11 -2.049 2.438 -2.277 810 HG LEU 11 HG LEU 11 -3.432 1.540 -3.963 811 1HD1 LEU 11 HD11 LEU 11 -5.046 3.854 -2.908 812 2HD1 LEU 11 HD12 LEU 11 -5.592 2.241 -3.379 813 3HD1 LEU 11 HD13 LEU 11 -4.589 2.432 -1.929 814 1HD2 LEU 11 HD21 LEU 11 -3.828 4.293 -5.145 815 2HD2 LEU 11 HD22 LEU 11 -4.537 2.760 -5.696 816 3HD2 LEU 11 HD23 LEU 11 -2.782 2.994 -5.778 817 H LEU 12 H LEU 12 -1.774 3.460 -0.397 818 HA LEU 12 HA LEU 12 -4.153 3.764 1.068 819 1HB LEU 12 HB2 LEU 12 -1.192 3.891 1.856 820 2HB LEU 12 HB3 LEU 12 -2.475 3.860 3.058 821 HG LEU 12 HG LEU 12 -2.470 1.701 0.936 822 1HD1 LEU 12 HD11 LEU 12 -0.150 1.630 1.645 823 2HD1 LEU 12 HD12 LEU 12 -0.616 1.753 3.357 824 3HD1 LEU 12 HD13 LEU 12 -1.020 0.302 2.415 825 1HD2 LEU 12 HD21 LEU 12 -3.451 0.433 2.771 826 2HD2 LEU 12 HD22 LEU 12 -3.083 1.723 3.924 827 3HD2 LEU 12 HD23 LEU 12 -4.283 2.005 2.647 828 H ILE 13 H ILE 13 -1.413 6.049 0.849 829 HA ILE 13 HA ILE 13 -2.492 8.080 2.512 830 HB ILE 13 HB ILE 13 -0.508 8.011 0.199 831 1HG1 ILE 13 HG12 ILE 13 0.039 7.031 2.530 832 2HG1 ILE 13 HG13 ILE 13 1.213 8.086 1.734 833 1HG2 ILE 13 HG21 ILE 13 -1.305 10.228 -0.030 834 2HG2 ILE 13 HG22 ILE 13 -1.319 10.480 1.724 835 3HG2 ILE 13 HG23 ILE 13 0.221 10.309 0.840 836 1HD1 ILE 13 HD11 ILE 13 0.554 9.966 3.143 837 2HD1 ILE 13 HD12 ILE 13 -0.749 8.987 3.865 838 3HD1 ILE 13 HD13 ILE 13 0.953 8.574 4.139 839 H GLY 14 H GLY 14 -2.557 7.769 -1.050 840 1HA GLY 14 HA2 GLY 14 -3.978 10.091 -1.661 841 2HA GLY 14 HA3 GLY 14 -3.948 8.608 -2.637 842 H ILE 15 H ILE 15 -5.207 6.744 -1.035 843 HA ILE 15 HA ILE 15 -7.975 7.380 -1.373 844 HB ILE 15 HB ILE 15 -6.372 5.159 -0.123 845 1HG1 ILE 15 HG12 ILE 15 -8.675 5.299 -2.130 846 2HG1 ILE 15 HG13 ILE 15 -6.954 5.245 -2.527 847 1HG2 ILE 15 HG21 ILE 15 -8.460 4.052 0.701 848 2HG2 ILE 15 HG22 ILE 15 -7.966 5.467 1.610 849 3HG2 ILE 15 HG23 ILE 15 -9.320 5.588 0.456 850 1HD1 ILE 15 HD11 ILE 15 -8.627 3.040 -1.265 851 2HD1 ILE 15 HD12 ILE 15 -7.791 3.027 -2.821 852 3HD1 ILE 15 HD13 ILE 15 -6.855 3.002 -1.311 853 H PHE 16 H PHE 16 -5.966 7.164 1.623 854 HA PHE 16 HA PHE 16 -7.984 7.929 3.374 855 1HB PHE 16 HB2 PHE 16 -5.718 7.095 3.984 856 2HB PHE 16 HB3 PHE 16 -5.032 8.660 3.586 857 HD1 PHE 16 HD1 PHE 16 -7.286 6.846 5.897 858 HD2 PHE 16 HD2 PHE 16 -5.572 10.670 4.999 859 HE1 PHE 16 HE1 PHE 16 -7.671 7.561 8.253 860 HE2 PHE 16 HE2 PHE 16 -6.171 11.460 7.226 861 HZ PHE 16 HZ PHE 16 -7.044 9.844 8.954 862 H HIS 17 H HIS 17 -5.552 10.143 1.873 863 HA HIS 17 HA HIS 17 -6.794 12.425 3.031 864 1HB HIS 17 HB2 HIS 17 -4.418 11.959 1.358 865 2HB HIS 17 HB3 HIS 17 -5.241 13.477 1.010 866 HD1 HIS 17 HD1 HIS 17 -5.106 15.397 2.812 867 HD2 HIS 17 HD2 HIS 17 -3.649 11.648 4.051 868 HE1 HIS 17 HE1 HIS 17 -4.090 15.739 5.116 869 H LYS 18 H LYS 18 -7.453 10.790 -0.062 870 HA LYS 18 HA LYS 18 -8.994 12.878 -1.237 871 1HB LYS 18 HB2 LYS 18 -8.469 10.639 -2.280 872 2HB LYS 18 HB3 LYS 18 -9.654 9.905 -1.184 873 1HG LYS 18 HG2 LYS 18 -11.313 11.678 -2.219 874 2HG LYS 18 HG3 LYS 18 -10.098 11.804 -3.495 875 1HD LYS 18 HD2 LYS 18 -11.605 9.308 -2.576 876 2HD LYS 18 HD3 LYS 18 -11.842 10.185 -4.091 877 1HE LYS 18 HE2 LYS 18 -9.505 9.578 -4.777 878 2HE LYS 18 HE3 LYS 18 -9.330 8.634 -3.286 879 1HZ LYS 18 HZ1 LYS 18 -11.309 8.142 -5.391 880 2HZ LYS 18 HZ2 LYS 18 -9.944 7.263 -5.110 881 3HZ LYS 18 HZ3 LYS 18 -11.160 7.270 -4.000 882 H TYR 19 H TYR 19 -9.840 10.345 1.166 883 HA TYR 19 HA TYR 19 -12.533 11.339 1.534 884 1HB TYR 19 HB2 TYR 19 -10.865 9.262 2.914 885 2HB TYR 19 HB3 TYR 19 -12.445 9.736 3.534 886 HD1 TYR 19 HD1 TYR 19 -10.702 7.759 1.044 887 HD2 TYR 19 HD2 TYR 19 -14.506 9.488 2.030 888 HE1 TYR 19 HE1 TYR 19 -11.576 7.009 -1.121 889 HE2 TYR 19 HE2 TYR 19 -15.465 8.529 -0.048 890 HH TYR 19 HH TYR 19 -13.421 6.877 -2.490 891 H SER 20 H SER 20 -9.498 11.797 3.474 892 HA SER 20 HA SER 20 -10.640 13.429 5.448 893 1HB SER 20 HB2 SER 20 -7.938 13.938 4.152 894 2HB SER 20 HB3 SER 20 -8.486 14.434 5.754 895 HG SER 20 HG SER 20 -8.524 12.333 6.416 896 H GLY 21 H GLY 21 -9.376 14.425 2.213 897 1HA GLY 21 HA2 GLY 21 -9.570 17.140 2.317 898 2HA GLY 21 HA3 GLY 21 -9.930 16.183 0.870 899 H LYS 22 H LYS 22 -12.299 14.884 1.842 900 HA LYS 22 HA LYS 22 -14.255 16.799 1.119 901 1HB LYS 22 HB2 LYS 22 -14.318 14.333 0.833 902 2HB LYS 22 HB3 LYS 22 -14.670 14.152 2.565 903 1HG LYS 22 HG2 LYS 22 -16.701 15.570 2.256 904 2HG LYS 22 HG3 LYS 22 -16.346 15.687 0.527 905 1HD LYS 22 HD2 LYS 22 -17.183 13.217 2.110 906 2HD LYS 22 HD3 LYS 22 -18.084 14.080 0.874 907 1HE LYS 22 HE2 LYS 22 -17.352 12.213 -0.282 908 2HE LYS 22 HE3 LYS 22 -16.145 13.419 -0.754 909 1HZ LYS 22 HZ1 LYS 22 -15.857 11.403 1.381 910 2HZ LYS 22 HZ2 LYS 22 -15.213 11.278 -0.134 911 3HZ LYS 22 HZ3 LYS 22 -14.684 12.444 0.897 912 H GLU 23 H GLU 23 -13.085 15.767 4.308 913 HA GLU 23 HA GLU 23 -15.197 17.356 5.698 914 1HB GLU 23 HB2 GLU 23 -14.231 16.265 7.757 915 2HB GLU 23 HB3 GLU 23 -15.098 15.222 6.623 916 1HG GLU 23 HG2 GLU 23 -13.027 14.324 5.729 917 2HG GLU 23 HG3 GLU 23 -12.064 15.428 6.750 918 H GLY 24 H GLY 24 -11.668 17.039 5.406 919 1HA GLY 24 HA2 GLY 24 -10.987 19.722 5.391 920 2HA GLY 24 HA3 GLY 24 -10.921 19.209 7.098 921 H ASP 25 H ASP 25 -8.772 19.755 4.859 922 HA ASP 25 HA ASP 25 -7.559 17.184 4.369 923 1HB ASP 25 HB2 ASP 25 -7.416 19.085 2.791 924 2HB ASP 25 HB3 ASP 25 -6.421 19.975 3.957 925 H LYS 26 H LYS 26 -7.666 16.721 6.786 926 HA LYS 26 HA LYS 26 -5.017 17.290 8.061 927 1HB LYS 26 HB2 LYS 26 -7.716 16.773 9.389 928 2HB LYS 26 HB3 LYS 26 -6.166 16.975 10.225 929 1HG LYS 26 HG2 LYS 26 -5.991 19.285 9.277 930 2HG LYS 26 HG3 LYS 26 -7.594 19.082 8.539 931 1HD LYS 26 HD2 LYS 26 -8.558 18.619 10.805 932 2HD LYS 26 HD3 LYS 26 -6.982 18.964 11.531 933 1HE LYS 26 HE2 LYS 26 -8.671 20.914 9.882 934 2HE LYS 26 HE3 LYS 26 -8.512 20.913 11.644 935 1HZ LYS 26 HZ1 LYS 26 -7.078 22.515 10.658 936 2HZ LYS 26 HZ2 LYS 26 -6.172 21.339 11.373 937 3HZ LYS 26 HZ3 LYS 26 -6.333 21.375 9.733 938 H HIS 27 H HIS 27 -4.381 15.394 9.473 939 HA HIS 27 HA HIS 27 -4.554 13.023 7.800 940 1HB HIS 27 HB2 HIS 27 -3.059 13.392 10.405 941 2HB HIS 27 HB3 HIS 27 -2.733 12.214 9.124 942 HD1 HIS 27 HD1 HIS 27 -2.684 14.043 6.576 943 HD2 HIS 27 HD2 HIS 27 -1.249 15.238 10.353 944 HE1 HIS 27 HE1 HIS 27 -1.200 16.074 6.189 945 H THR 28 H THR 28 -7.075 13.428 8.683 946 HA THR 28 HA THR 28 -7.633 11.321 10.688 947 HB THR 28 HB THR 28 -9.376 12.934 11.601 948 HG1 THR 28 HG1 THR 28 -9.185 14.446 9.841 949 1HG2 THR 28 HG21 THR 28 -7.275 12.433 12.831 950 2HG2 THR 28 HG22 THR 28 -6.469 13.776 11.985 951 3HG2 THR 28 HG23 THR 28 -7.824 14.103 13.079 952 H LEU 29 H LEU 29 -9.628 10.361 10.416 953 HA LEU 29 HA LEU 29 -11.401 11.249 8.173 954 1HB LEU 29 HB2 LEU 29 -9.875 8.780 8.348 955 2HB LEU 29 HB3 LEU 29 -11.561 8.384 8.641 956 HG LEU 29 HG LEU 29 -12.181 9.627 6.537 957 1HD1 LEU 29 HD11 LEU 29 -10.207 11.062 6.278 958 2HD1 LEU 29 HD12 LEU 29 -9.143 9.630 6.219 959 3HD1 LEU 29 HD13 LEU 29 -10.281 9.947 4.913 960 1HD2 LEU 29 HD21 LEU 29 -10.135 7.435 6.029 961 2HD2 LEU 29 HD22 LEU 29 -11.745 7.113 6.681 962 3HD2 LEU 29 HD23 LEU 29 -11.584 7.858 5.076 963 H SER 30 H SER 30 -13.498 11.601 8.926 964 HA SER 30 HA SER 30 -14.180 10.753 11.629 965 1HB SER 30 HB2 SER 30 -15.998 11.935 9.500 966 2HB SER 30 HB3 SER 30 -16.218 11.945 11.267 967 HG SER 30 HG SER 30 -14.079 13.107 11.226 968 H LYS 31 H LYS 31 -15.848 9.272 12.183 969 HA LYS 31 HA LYS 31 -15.485 6.810 11.188 970 1HB LYS 31 HB2 LYS 31 -17.390 6.143 12.538 971 2HB LYS 31 HB3 LYS 31 -16.381 7.327 13.327 972 1HG LYS 31 HG2 LYS 31 -18.317 8.256 13.906 973 2HG LYS 31 HG3 LYS 31 -18.223 9.040 12.338 974 1HD LYS 31 HD2 LYS 31 -19.691 7.130 11.429 975 2HD LYS 31 HD3 LYS 31 -19.687 6.439 13.048 976 1HE LYS 31 HE2 LYS 31 -21.762 7.671 12.635 977 2HE LYS 31 HE3 LYS 31 -20.846 8.388 13.966 978 1HZ LYS 31 HZ1 LYS 31 -20.884 9.389 11.204 979 2HZ LYS 31 HZ2 LYS 31 -21.720 10.024 12.474 980 3HZ LYS 31 HZ3 LYS 31 -20.075 10.068 12.472 981 H LYS 32 H LYS 32 -18.180 8.877 10.195 982 HA LYS 32 HA LYS 32 -19.225 6.808 8.377 983 1HB LYS 32 HB2 LYS 32 -20.767 8.162 9.484 984 2HB LYS 32 HB3 LYS 32 -20.076 9.669 8.853 985 1HG LYS 32 HG2 LYS 32 -20.896 7.810 6.683 986 2HG LYS 32 HG3 LYS 32 -22.187 8.079 7.833 987 1HD LYS 32 HD2 LYS 32 -22.433 9.709 6.108 988 2HD LYS 32 HD3 LYS 32 -21.974 10.529 7.599 989 1HE LYS 32 HE2 LYS 32 -20.794 11.512 5.717 990 2HE LYS 32 HE3 LYS 32 -19.612 10.702 6.747 991 1HZ LYS 32 HZ1 LYS 32 -20.781 9.592 4.279 992 2HZ LYS 32 HZ2 LYS 32 -19.285 10.266 4.419 993 3HZ LYS 32 HZ3 LYS 32 -19.631 8.869 5.217 994 H GLU 33 H GLU 33 -16.858 9.388 8.142 995 HA GLU 33 HA GLU 33 -16.935 9.550 5.241 996 1HB GLU 33 HB2 GLU 33 -15.976 11.342 6.838 997 2HB GLU 33 HB3 GLU 33 -14.597 10.252 7.064 998 1HG GLU 33 HG2 GLU 33 -13.993 11.805 5.337 999 2HG GLU 33 HG3 GLU 33 -14.301 10.256 4.548 1000 H LEU 34 H LEU 34 -15.130 7.785 7.769 1001 HA LEU 34 HA LEU 34 -13.587 6.135 6.030 1002 1HB LEU 34 HB2 LEU 34 -13.047 6.220 8.338 1003 2HB LEU 34 HB3 LEU 34 -14.647 5.745 8.850 1004 HG LEU 34 HG LEU 34 -12.950 4.013 9.129 1005 1HD1 LEU 34 HD11 LEU 34 -14.309 2.187 8.634 1006 2HD1 LEU 34 HD12 LEU 34 -15.459 3.518 8.736 1007 3HD1 LEU 34 HD13 LEU 34 -14.949 2.884 7.163 1008 1HD2 LEU 34 HD21 LEU 34 -11.551 4.464 7.174 1009 2HD2 LEU 34 HD22 LEU 34 -12.058 2.766 7.163 1010 3HD2 LEU 34 HD23 LEU 34 -12.831 3.910 6.082 1011 H LYS 35 H LYS 35 -16.913 5.597 7.408 1012 HA LYS 35 HA LYS 35 -17.290 3.193 6.020 1013 1HB LYS 35 HB2 LYS 35 -18.857 4.323 7.724 1014 2HB LYS 35 HB3 LYS 35 -19.576 5.164 6.330 1015 1HG LYS 35 HG2 LYS 35 -19.910 2.912 5.236 1016 2HG LYS 35 HG3 LYS 35 -19.227 2.149 6.683 1017 1HD LYS 35 HD2 LYS 35 -21.089 3.174 8.038 1018 2HD LYS 35 HD3 LYS 35 -21.795 3.778 6.520 1019 1HE LYS 35 HE2 LYS 35 -21.803 1.399 5.658 1020 2HE LYS 35 HE3 LYS 35 -21.220 0.854 7.234 1021 1HZ LYS 35 HZ1 LYS 35 -23.247 1.803 8.174 1022 2HZ LYS 35 HZ2 LYS 35 -23.760 2.249 6.673 1023 3HZ LYS 35 HZ3 LYS 35 -23.588 0.652 7.045 1024 H GLU 36 H GLU 36 -17.803 6.522 4.779 1025 HA GLU 36 HA GLU 36 -18.680 5.835 2.192 1026 1HB GLU 36 HB2 GLU 36 -18.455 8.167 3.369 1027 2HB GLU 36 HB3 GLU 36 -16.820 8.187 2.708 1028 1HG GLU 36 HG2 GLU 36 -18.218 9.355 1.173 1029 2HG GLU 36 HG3 GLU 36 -17.839 7.804 0.410 1030 H LEU 37 H LEU 37 -15.345 6.338 3.396 1031 HA LEU 37 HA LEU 37 -13.894 5.772 1.070 1032 1HB LEU 37 HB2 LEU 37 -12.924 6.615 3.162 1033 2HB LEU 37 HB3 LEU 37 -13.204 5.096 3.975 1034 HG LEU 37 HG LEU 37 -11.414 5.184 1.555 1035 1HD1 LEU 37 HD11 LEU 37 -10.689 5.629 4.485 1036 2HD1 LEU 37 HD12 LEU 37 -9.532 5.463 3.163 1037 3HD1 LEU 37 HD13 LEU 37 -10.597 6.864 3.209 1038 1HD2 LEU 37 HD21 LEU 37 -10.317 3.280 2.781 1039 2HD2 LEU 37 HD22 LEU 37 -11.583 3.350 4.016 1040 3HD2 LEU 37 HD23 LEU 37 -11.973 2.886 2.345 1041 H ILE 38 H ILE 38 -15.053 3.427 3.541 1042 HA ILE 38 HA ILE 38 -14.062 1.176 2.085 1043 HB ILE 38 HB ILE 38 -16.359 1.420 4.074 1044 1HG1 ILE 38 HG12 ILE 38 -13.460 0.459 4.297 1045 2HG1 ILE 38 HG13 ILE 38 -14.096 1.991 4.911 1046 1HG2 ILE 38 HG21 ILE 38 -15.030 -1.151 3.106 1047 2HG2 ILE 38 HG22 ILE 38 -16.335 -0.997 4.297 1048 3HG2 ILE 38 HG23 ILE 38 -16.657 -0.630 2.620 1049 1HD1 ILE 38 HD11 ILE 38 -15.697 0.642 6.351 1050 2HD1 ILE 38 HD12 ILE 38 -14.759 -0.799 5.869 1051 3HD1 ILE 38 HD13 ILE 38 -13.964 0.546 6.738 1052 H GLN 39 H GLN 39 -17.373 2.620 2.141 1053 HA GLN 39 HA GLN 39 -18.536 0.804 0.360 1054 1HB GLN 39 HB2 GLN 39 -19.091 3.751 0.858 1055 2HB GLN 39 HB3 GLN 39 -20.125 2.764 -0.174 1056 1HG GLN 39 HG2 GLN 39 -19.497 2.017 2.719 1057 2HG GLN 39 HG3 GLN 39 -20.872 3.026 2.251 1058 1HE2 GLN 39 HE22 GLN 39 -21.293 0.655 3.663 1059 2HE2 GLN 39 HE21 GLN 39 -22.066 -0.489 2.597 1060 H LYS 40 H LYS 40 -16.645 3.754 -0.468 1061 HA LYS 40 HA LYS 40 -17.132 3.290 -3.308 1062 1HB LYS 40 HB2 LYS 40 -16.858 5.549 -2.265 1063 2HB LYS 40 HB3 LYS 40 -15.178 5.150 -1.932 1064 1HG LYS 40 HG2 LYS 40 -15.394 6.535 -3.959 1065 2HG LYS 40 HG3 LYS 40 -14.684 4.970 -4.330 1066 1HD LYS 40 HD2 LYS 40 -16.322 5.734 -6.025 1067 2HD LYS 40 HD3 LYS 40 -16.745 4.175 -5.335 1068 1HE LYS 40 HE2 LYS 40 -18.715 5.660 -5.606 1069 2HE LYS 40 HE3 LYS 40 -18.471 5.228 -3.912 1070 1HZ LYS 40 HZ1 LYS 40 -17.636 7.749 -5.171 1071 2HZ LYS 40 HZ2 LYS 40 -18.941 7.544 -4.186 1072 3HZ LYS 40 HZ3 LYS 40 -17.419 7.349 -3.587 1073 H GLU 41 H GLU 41 -14.271 2.981 -1.149 1074 HA GLU 41 HA GLU 41 -12.592 2.191 -3.404 1075 1HB GLU 41 HB2 GLU 41 -11.872 2.311 -0.462 1076 2HB GLU 41 HB3 GLU 41 -10.776 2.238 -1.843 1077 1HG GLU 41 HG2 GLU 41 -12.635 4.556 -1.121 1078 2HG GLU 41 HG3 GLU 41 -10.881 4.513 -0.974 1079 H LEU 42 H LEU 42 -14.303 0.523 -0.858 1080 HA LEU 42 HA LEU 42 -13.280 -2.126 -1.784 1081 1HB LEU 42 HB2 LEU 42 -13.887 -1.206 1.054 1082 2HB LEU 42 HB3 LEU 42 -13.578 -2.879 0.584 1083 HG LEU 42 HG LEU 42 -11.554 -0.608 0.380 1084 1HD1 LEU 42 HD11 LEU 42 -11.834 -2.887 2.389 1085 2HD1 LEU 42 HD12 LEU 42 -10.500 -1.719 2.328 1086 3HD1 LEU 42 HD13 LEU 42 -12.138 -1.167 2.712 1087 1HD2 LEU 42 HD21 LEU 42 -9.930 -2.523 0.096 1088 2HD2 LEU 42 HD22 LEU 42 -11.309 -3.624 -0.065 1089 3HD2 LEU 42 HD23 LEU 42 -11.037 -2.338 -1.262 1090 H THR 43 H THR 43 -15.211 -1.520 -3.178 1091 HA THR 43 HA THR 43 -17.791 -1.090 -2.336 1092 HB THR 43 HB THR 43 -18.495 -2.215 -4.483 1093 HG1 THR 43 HG1 THR 43 -15.685 -2.554 -4.776 1094 1HG2 THR 43 HG21 THR 43 -16.244 -0.166 -4.621 1095 2HG2 THR 43 HG22 THR 43 -17.400 -0.530 -5.918 1096 3HG2 THR 43 HG23 THR 43 -17.968 0.180 -4.395 1097 H ILE 44 H ILE 44 -18.561 -2.097 -0.584 1098 HA ILE 44 HA ILE 44 -18.341 -4.904 -0.172 1099 HB ILE 44 HB ILE 44 -18.309 -3.261 1.602 1100 1HG1 ILE 44 HG12 ILE 44 -19.872 -4.373 3.213 1101 2HG1 ILE 44 HG13 ILE 44 -20.536 -5.324 1.890 1102 1HG2 ILE 44 HG21 ILE 44 -21.292 -2.820 1.327 1103 2HG2 ILE 44 HG22 ILE 44 -20.156 -2.082 2.456 1104 3HG2 ILE 44 HG23 ILE 44 -20.055 -1.696 0.735 1105 1HD1 ILE 44 HD11 ILE 44 -17.566 -5.240 2.605 1106 2HD1 ILE 44 HD12 ILE 44 -18.703 -6.437 3.250 1107 3HD1 ILE 44 HD13 ILE 44 -18.381 -6.388 1.510 1108 H GLY 45 H GLY 45 -19.197 -5.360 -2.383 1109 1HA GLY 45 HA2 GLY 45 -21.834 -5.274 -3.232 1110 2HA GLY 45 HA3 GLY 45 -20.734 -6.630 -3.552 1111 H SER 46 H SER 46 -20.362 -7.671 -0.999 1112 HA SER 46 HA SER 46 -22.749 -9.098 -0.363 1113 1HB SER 46 HB2 SER 46 -20.243 -8.695 1.319 1114 2HB SER 46 HB3 SER 46 -21.367 -10.069 1.360 1115 HG SER 46 HG SER 46 -19.465 -10.491 0.142 1116 H LYS 47 H LYS 47 -23.917 -6.805 -0.237 1117 HA LYS 47 HA LYS 47 -23.504 -4.991 1.788 1118 1HB LYS 47 HB2 LYS 47 -26.070 -5.815 0.396 1119 2HB LYS 47 HB3 LYS 47 -25.971 -4.391 1.437 1120 1HG LYS 47 HG2 LYS 47 -24.030 -4.740 -0.880 1121 2HG LYS 47 HG3 LYS 47 -25.660 -4.099 -1.131 1122 1HD LYS 47 HD2 LYS 47 -25.223 -2.277 0.474 1123 2HD LYS 47 HD3 LYS 47 -23.598 -2.921 0.787 1124 1HE LYS 47 HE2 LYS 47 -22.960 -2.573 -1.563 1125 2HE LYS 47 HE3 LYS 47 -24.598 -2.014 -1.948 1126 1HZ LYS 47 HZ1 LYS 47 -24.251 -0.193 -0.423 1127 2HZ LYS 47 HZ2 LYS 47 -22.698 -0.673 -0.145 1128 3HZ LYS 47 HZ3 LYS 47 -23.149 -0.191 -1.645 1129 H LEU 48 H LEU 48 -25.070 -8.099 2.174 1130 HA LEU 48 HA LEU 48 -26.406 -7.750 4.639 1131 1HB LEU 48 HB2 LEU 48 -24.766 -10.098 3.578 1132 2HB LEU 48 HB3 LEU 48 -25.738 -10.160 5.044 1133 HG LEU 48 HG LEU 48 -26.891 -11.238 3.270 1134 1HD1 LEU 48 HD11 LEU 48 -28.217 -9.978 4.962 1135 2HD1 LEU 48 HD12 LEU 48 -28.333 -8.615 3.824 1136 3HD1 LEU 48 HD13 LEU 48 -29.050 -10.180 3.410 1137 1HD2 LEU 48 HD21 LEU 48 -25.911 -9.976 1.335 1138 2HD2 LEU 48 HD22 LEU 48 -27.657 -10.259 1.243 1139 3HD2 LEU 48 HD23 LEU 48 -27.060 -8.655 1.679 1140 H GLN 49 H GLN 49 -22.957 -7.998 3.931 1141 HA GLN 49 HA GLN 49 -22.135 -8.284 6.706 1142 1HB GLN 49 HB2 GLN 49 -20.536 -7.561 4.226 1143 2HB GLN 49 HB3 GLN 49 -19.878 -7.996 5.805 1144 1HG GLN 49 HG2 GLN 49 -21.027 -10.233 5.625 1145 2HG GLN 49 HG3 GLN 49 -21.538 -9.802 3.988 1146 1HE2 GLN 49 HE22 GLN 49 -18.593 -10.093 6.043 1147 2HE2 GLN 49 HE21 GLN 49 -17.545 -10.608 4.722 1148 H ASP 50 H ASP 50 -23.536 -5.596 5.208 1149 HA ASP 50 HA ASP 50 -21.813 -3.517 5.896 1150 1HB ASP 50 HB2 ASP 50 -23.878 -3.248 4.577 1151 2HB ASP 50 HB3 ASP 50 -24.843 -3.451 6.053 1152 H ALA 51 H ALA 51 -23.948 -5.428 7.990 1153 HA ALA 51 HA ALA 51 -23.740 -3.967 10.418 1154 1HB ALA 51 HB1 ALA 51 -23.780 -6.979 9.955 1155 2HB ALA 51 HB2 ALA 51 -24.089 -6.156 11.497 1156 3HB ALA 51 HB3 ALA 51 -25.196 -5.920 10.130 1157 H GLU 52 H GLU 52 -21.510 -6.348 8.914 1158 HA GLU 52 HA GLU 52 -19.587 -6.296 11.076 1159 1HB GLU 52 HB2 GLU 52 -19.168 -7.135 8.174 1160 2HB GLU 52 HB3 GLU 52 -18.121 -7.463 9.556 1161 1HG GLU 52 HG2 GLU 52 -19.994 -8.735 10.645 1162 2HG GLU 52 HG3 GLU 52 -20.964 -8.520 9.178 1163 H ILE 53 H ILE 53 -20.013 -4.579 7.942 1164 HA ILE 53 HA ILE 53 -17.632 -3.043 8.110 1165 HB ILE 53 HB ILE 53 -20.274 -2.178 6.889 1166 1HG1 ILE 53 HG12 ILE 53 -19.496 -4.180 5.763 1167 2HG1 ILE 53 HG13 ILE 53 -19.173 -2.773 4.751 1168 1HG2 ILE 53 HG21 ILE 53 -18.978 -0.216 7.278 1169 2HG2 ILE 53 HG22 ILE 53 -17.504 -0.977 6.669 1170 3HG2 ILE 53 HG23 ILE 53 -18.848 -0.615 5.565 1171 1HD1 ILE 53 HD11 ILE 53 -16.772 -2.823 5.634 1172 2HD1 ILE 53 HD12 ILE 53 -17.179 -4.385 6.388 1173 3HD1 ILE 53 HD13 ILE 53 -17.258 -4.199 4.635 1174 H VAL 54 H VAL 54 -20.877 -2.264 9.569 1175 HA VAL 54 HA VAL 54 -19.751 0.136 10.630 1176 HB VAL 54 HB VAL 54 -21.691 0.291 12.161 1177 1HG1 VAL 54 HG11 VAL 54 -23.122 1.026 10.321 1178 2HG1 VAL 54 HG12 VAL 54 -21.441 1.442 9.957 1179 3HG1 VAL 54 HG13 VAL 54 -22.189 0.027 9.184 1180 1HG2 VAL 54 HG21 VAL 54 -22.792 -2.001 10.545 1181 2HG2 VAL 54 HG22 VAL 54 -22.336 -2.092 12.266 1182 3HG2 VAL 54 HG23 VAL 54 -23.651 -1.026 11.741 1183 H LYS 55 H LYS 55 -19.938 -3.143 12.048 1184 HA LYS 55 HA LYS 55 -18.875 -2.398 14.592 1185 1HB LYS 55 HB2 LYS 55 -19.749 -4.615 14.214 1186 2HB LYS 55 HB3 LYS 55 -18.566 -4.935 12.944 1187 1HG LYS 55 HG2 LYS 55 -18.014 -6.091 15.013 1188 2HG LYS 55 HG3 LYS 55 -16.733 -4.971 14.547 1189 1HD LYS 55 HD2 LYS 55 -17.527 -3.317 16.213 1190 2HD LYS 55 HD3 LYS 55 -18.865 -4.387 16.667 1191 1HE LYS 55 HE2 LYS 55 -15.881 -5.028 16.920 1192 2HE LYS 55 HE3 LYS 55 -16.911 -4.445 18.234 1193 1HZ LYS 55 HZ1 LYS 55 -17.259 -6.973 16.783 1194 2HZ LYS 55 HZ2 LYS 55 -16.681 -6.793 18.314 1195 3HZ LYS 55 HZ3 LYS 55 -18.249 -6.414 17.978 1196 H LEU 56 H LEU 56 -17.217 -3.377 11.591 1197 HA LEU 56 HA LEU 56 -14.536 -3.018 12.381 1198 1HB LEU 56 HB2 LEU 56 -15.019 -4.230 10.477 1199 2HB LEU 56 HB3 LEU 56 -16.055 -3.000 9.777 1200 HG LEU 56 HG LEU 56 -13.175 -2.255 10.107 1201 1HD1 LEU 56 HD11 LEU 56 -12.677 -3.386 7.920 1202 2HD1 LEU 56 HD12 LEU 56 -13.064 -4.575 9.180 1203 3HD1 LEU 56 HD13 LEU 56 -14.277 -4.146 7.959 1204 1HD2 LEU 56 HD21 LEU 56 -15.268 -1.874 7.899 1205 2HD2 LEU 56 HD22 LEU 56 -14.854 -0.656 9.105 1206 3HD2 LEU 56 HD23 LEU 56 -13.620 -1.197 7.957 1207 H MET 57 H MET 57 -16.828 -0.657 10.981 1208 HA MET 57 HA MET 57 -15.068 1.565 10.874 1209 1HB MET 57 HB2 MET 57 -17.073 1.609 9.628 1210 2HB MET 57 HB3 MET 57 -18.054 1.269 11.051 1211 1HG MET 57 HG2 MET 57 -16.471 3.805 11.012 1212 2HG MET 57 HG3 MET 57 -17.945 3.697 10.052 1213 1HE MET 57 HE1 MET 57 -20.781 3.406 12.675 1214 2HE MET 57 HE2 MET 57 -20.358 3.536 10.949 1215 3HE MET 57 HE3 MET 57 -20.043 2.026 11.852 1216 H ASP 58 H ASP 58 -17.310 0.454 13.478 1217 HA ASP 58 HA ASP 58 -16.637 2.445 15.372 1218 1HB ASP 58 HB2 ASP 58 -18.492 0.909 15.701 1219 2HB ASP 58 HB3 ASP 58 -17.377 -0.449 15.903 1220 H ASP 59 H ASP 59 -15.098 -0.746 14.793 1221 HA ASP 59 HA ASP 59 -13.093 -0.501 16.772 1222 1HB ASP 59 HB2 ASP 59 -12.864 -1.950 14.095 1223 2HB ASP 59 HB3 ASP 59 -11.844 -2.206 15.512 1224 H LEU 60 H LEU 60 -12.971 0.503 13.338 1225 HA LEU 60 HA LEU 60 -10.342 1.617 13.361 1226 1HB LEU 60 HB2 LEU 60 -12.853 2.025 11.743 1227 2HB LEU 60 HB3 LEU 60 -11.521 3.152 11.525 1228 HG LEU 60 HG LEU 60 -10.923 0.205 11.387 1229 1HD1 LEU 60 HD11 LEU 60 -12.106 1.802 9.101 1230 2HD1 LEU 60 HD12 LEU 60 -11.451 0.172 8.974 1231 3HD1 LEU 60 HD13 LEU 60 -12.912 0.460 9.944 1232 1HD2 LEU 60 HD21 LEU 60 -9.055 1.843 11.152 1233 2HD2 LEU 60 HD22 LEU 60 -9.355 1.054 9.576 1234 3HD2 LEU 60 HD23 LEU 60 -9.944 2.684 9.863 1235 H ASP 61 H ASP 61 -13.510 3.265 13.876 1236 HA ASP 61 HA ASP 61 -12.197 5.773 14.411 1237 1HB ASP 61 HB2 ASP 61 -14.246 6.750 14.374 1238 2HB ASP 61 HB3 ASP 61 -14.452 5.399 13.271 1239 H ARG 62 H ARG 62 -13.095 3.209 16.533 1240 HA ARG 62 HA ARG 62 -13.394 4.486 18.975 1241 1HB ARG 62 HB2 ARG 62 -13.643 2.269 19.124 1242 2HB ARG 62 HB3 ARG 62 -12.375 1.868 18.012 1243 1HG ARG 62 HG2 ARG 62 -11.945 2.705 20.920 1244 2HG ARG 62 HG3 ARG 62 -12.054 1.053 20.320 1245 1HD ARG 62 HD2 ARG 62 -9.779 2.986 20.019 1246 2HD ARG 62 HD3 ARG 62 -9.779 1.303 20.524 1247 HE ARG 62 HE ARG 62 -10.625 1.204 17.871 1248 1HH1 ARG 62 HH22 ARG 62 -7.662 2.229 19.542 1249 2HH1 ARG 62 HH21 ARG 62 -6.720 2.170 18.059 1250 1HH2 ARG 62 HH12 ARG 62 -9.449 1.241 16.041 1251 2HH2 ARG 62 HH11 ARG 62 -7.711 1.589 16.068 1252 H ASN 63 H ASN 63 -10.425 4.004 17.110 1253 HA ASN 63 HA ASN 63 -8.332 4.685 18.598 1254 1HB ASN 63 HB2 ASN 63 -8.015 4.460 16.263 1255 2HB ASN 63 HB3 ASN 63 -9.147 5.768 15.901 1256 1HD2 ASN 63 HD22 ASN 63 -6.618 6.154 18.463 1257 2HD2 ASN 63 HD21 ASN 63 -5.683 7.284 17.511 1258 H LYS 64 H LYS 64 -10.308 7.308 17.204 1259 HA LYS 64 HA LYS 64 -9.901 8.851 19.716 1260 1HB LYS 64 HB2 LYS 64 -8.290 9.631 18.005 1261 2HB LYS 64 HB3 LYS 64 -9.626 10.024 16.922 1262 1HG LYS 64 HG2 LYS 64 -10.517 11.595 18.697 1263 2HG LYS 64 HG3 LYS 64 -9.125 11.211 19.702 1264 1HD LYS 64 HD2 LYS 64 -9.116 12.548 16.951 1265 2HD LYS 64 HD3 LYS 64 -8.832 13.344 18.499 1266 1HE LYS 64 HE2 LYS 64 -7.019 11.299 17.135 1267 2HE LYS 64 HE3 LYS 64 -6.709 13.020 17.376 1268 1HZ LYS 64 HZ1 LYS 64 -6.960 11.017 19.505 1269 2HZ LYS 64 HZ2 LYS 64 -5.563 11.713 18.982 1270 3HZ LYS 64 HZ3 LYS 64 -6.705 12.629 19.740 1271 H ASP 65 H ASP 65 -11.841 7.289 19.618 1272 HA ASP 65 HA ASP 65 -14.126 7.023 19.422 1273 1HB ASP 65 HB2 ASP 65 -15.149 8.368 21.141 1274 2HB ASP 65 HB3 ASP 65 -13.532 7.848 21.622 1275 H GLN 66 H GLN 66 -14.238 7.405 17.128 1276 HA GLN 66 HA GLN 66 -15.954 7.885 15.620 1277 1HB GLN 66 HB2 GLN 66 -16.333 10.627 16.822 1278 2HB GLN 66 HB3 GLN 66 -17.200 9.931 15.475 1279 1HG GLN 66 HG2 GLN 66 -17.298 8.670 18.261 1280 2HG GLN 66 HG3 GLN 66 -18.428 9.869 17.653 1281 1HE2 GLN 66 HE22 GLN 66 -17.124 6.545 16.894 1282 2HE2 GLN 66 HE21 GLN 66 -18.618 6.038 16.144 1283 H GLU 67 H GLU 67 -13.010 9.432 16.309 1284 HA GLU 67 HA GLU 67 -12.709 9.999 13.396 1285 1HB GLU 67 HB2 GLU 67 -11.110 11.136 15.703 1286 2HB GLU 67 HB3 GLU 67 -10.903 11.502 13.984 1287 1HG GLU 67 HG2 GLU 67 -13.324 12.161 15.732 1288 2HG GLU 67 HG3 GLU 67 -12.122 13.298 15.122 1289 H VAL 68 H VAL 68 -11.294 8.887 12.309 1290 HA VAL 68 HA VAL 68 -9.514 6.862 13.551 1291 HB VAL 68 HB VAL 68 -10.143 7.295 10.592 1292 1HG1 VAL 68 HG11 VAL 68 -8.142 5.935 11.199 1293 2HG1 VAL 68 HG12 VAL 68 -9.181 4.854 12.147 1294 3HG1 VAL 68 HG13 VAL 68 -9.393 4.977 10.389 1295 1HG2 VAL 68 HG21 VAL 68 -12.327 6.847 11.687 1296 2HG2 VAL 68 HG22 VAL 68 -11.782 5.554 10.614 1297 3HG2 VAL 68 HG23 VAL 68 -11.624 5.358 12.360 1298 H ASN 69 H ASN 69 -7.429 7.768 13.882 1299 HA ASN 69 HA ASN 69 -6.527 9.988 12.173 1300 1HB ASN 69 HB2 ASN 69 -5.815 9.956 14.539 1301 2HB ASN 69 HB3 ASN 69 -5.094 8.354 14.316 1302 1HD2 ASN 69 HD21 ASN 69 -4.724 11.814 13.537 1303 2HD2 ASN 69 HD22 ASN 69 -3.073 11.661 12.975 1304 H PHE 70 H PHE 70 -4.939 9.811 10.606 1305 HA PHE 70 HA PHE 70 -4.785 7.766 8.838 1306 1HB PHE 70 HB2 PHE 70 -3.815 9.934 8.439 1307 2HB PHE 70 HB3 PHE 70 -2.585 9.671 9.675 1308 HD1 PHE 70 HD1 PHE 70 -0.499 8.717 9.068 1309 HD2 PHE 70 HD2 PHE 70 -3.908 8.162 6.494 1310 HE1 PHE 70 HE1 PHE 70 0.915 7.500 7.455 1311 HE2 PHE 70 HE2 PHE 70 -2.490 6.934 4.875 1312 HZ PHE 70 HZ PHE 70 -0.075 6.585 5.358 1313 H GLN 71 H GLN 71 -2.522 8.031 11.653 1314 HA GLN 71 HA GLN 71 -0.923 5.810 10.961 1315 1HB GLN 71 HB2 GLN 71 -0.265 7.417 12.661 1316 2HB GLN 71 HB3 GLN 71 -1.653 6.991 13.669 1317 1HG GLN 71 HG2 GLN 71 0.361 6.018 14.570 1318 2HG GLN 71 HG3 GLN 71 -0.717 4.729 14.058 1319 1HE2 GLN 71 HE22 GLN 71 -0.167 3.577 11.977 1320 2HE2 GLN 71 HE21 GLN 71 1.560 3.475 11.599 1321 H GLU 72 H GLU 72 -4.003 5.977 12.762 1322 HA GLU 72 HA GLU 72 -3.893 3.131 13.456 1323 1HB GLU 72 HB2 GLU 72 -5.720 5.418 14.096 1324 2HB GLU 72 HB3 GLU 72 -6.355 3.774 14.224 1325 1HG GLU 72 HG2 GLU 72 -3.701 4.551 15.511 1326 2HG GLU 72 HG3 GLU 72 -5.236 4.709 16.356 1327 H TYR 73 H TYR 73 -5.427 5.192 11.015 1328 HA TYR 73 HA TYR 73 -7.059 3.177 9.806 1329 1HB TYR 73 HB2 TYR 73 -7.384 5.313 8.991 1330 2HB TYR 73 HB3 TYR 73 -5.684 5.678 8.869 1331 HD1 TYR 73 HD1 TYR 73 -8.583 4.349 7.106 1332 HD2 TYR 73 HD2 TYR 73 -4.356 5.130 6.934 1333 HE1 TYR 73 HE1 TYR 73 -8.598 3.883 4.680 1334 HE2 TYR 73 HE2 TYR 73 -4.377 4.718 4.491 1335 HH TYR 73 HH TYR 73 -7.320 3.675 2.762 1336 H ILE 74 H ILE 74 -3.585 4.023 9.204 1337 HA ILE 74 HA ILE 74 -3.108 1.814 7.478 1338 HB ILE 74 HB ILE 74 -1.158 3.239 9.322 1339 1HG1 ILE 74 HG12 ILE 74 -2.236 4.713 7.598 1340 2HG1 ILE 74 HG13 ILE 74 -0.499 4.576 7.491 1341 1HG2 ILE 74 HG21 ILE 74 -0.770 1.151 7.154 1342 2HG2 ILE 74 HG22 ILE 74 0.516 2.285 7.563 1343 3HG2 ILE 74 HG23 ILE 74 -0.109 1.199 8.804 1344 1HD1 ILE 74 HD11 ILE 74 -2.471 3.104 5.704 1345 2HD1 ILE 74 HD12 ILE 74 -1.517 4.530 5.271 1346 3HD1 ILE 74 HD13 ILE 74 -0.693 3.007 5.590 1347 H THR 75 H THR 75 -2.515 2.038 11.035 1348 HA THR 75 HA THR 75 -1.572 -0.550 11.450 1349 HB THR 75 HB THR 75 -3.494 0.931 13.299 1350 HG1 THR 75 HG1 THR 75 -1.798 2.276 12.811 1351 1HG2 THR 75 HG21 THR 75 -1.362 -1.162 13.848 1352 2HG2 THR 75 HG22 THR 75 -2.200 -0.210 15.086 1353 3HG2 THR 75 HG23 THR 75 -3.112 -1.344 14.076 1354 H PHE 76 H PHE 76 -4.994 0.528 11.381 1355 HA PHE 76 HA PHE 76 -6.106 -2.036 11.929 1356 1HB PHE 76 HB2 PHE 76 -7.333 0.082 12.231 1357 2HB PHE 76 HB3 PHE 76 -7.312 0.334 10.485 1358 HD1 PHE 76 HD1 PHE 76 -8.717 -1.710 13.255 1359 HD2 PHE 76 HD2 PHE 76 -8.682 -1.105 8.979 1360 HE1 PHE 76 HE1 PHE 76 -10.546 -3.366 12.992 1361 HE2 PHE 76 HE2 PHE 76 -10.575 -2.650 8.745 1362 HZ PHE 76 HZ PHE 76 -11.410 -3.910 10.720 1363 H LEU 77 H LEU 77 -5.410 -0.319 8.793 1364 HA LEU 77 HA LEU 77 -6.383 -2.454 7.156 1365 1HB LEU 77 HB2 LEU 77 -4.236 -0.363 6.693 1366 2HB LEU 77 HB3 LEU 77 -4.730 -1.519 5.452 1367 HG LEU 77 HG LEU 77 -6.736 0.311 6.858 1368 1HD1 LEU 77 HD11 LEU 77 -5.045 1.686 5.641 1369 2HD1 LEU 77 HD12 LEU 77 -5.386 0.722 4.172 1370 3HD1 LEU 77 HD13 LEU 77 -6.659 1.707 4.891 1371 1HD2 LEU 77 HD21 LEU 77 -7.786 -1.591 5.690 1372 2HD2 LEU 77 HD22 LEU 77 -8.043 -0.102 4.772 1373 3HD2 LEU 77 HD23 LEU 77 -6.796 -1.245 4.234 1374 H GLY 78 H GLY 78 -3.271 -2.009 8.831 1375 1HA GLY 78 HA2 GLY 78 -1.973 -4.366 7.925 1376 2HA GLY 78 HA3 GLY 78 -1.767 -3.614 9.525 1377 H ALA 79 H ALA 79 -4.185 -3.910 10.743 1378 HA ALA 79 HA ALA 79 -4.282 -6.654 11.466 1379 1HB ALA 79 HB1 ALA 79 -5.121 -4.811 12.900 1380 2HB ALA 79 HB2 ALA 79 -6.507 -4.599 11.807 1381 3HB ALA 79 HB3 ALA 79 -6.307 -6.115 12.698 1382 H LEU 80 H LEU 80 -6.271 -4.842 9.134 1383 HA LEU 80 HA LEU 80 -8.082 -6.889 8.452 1384 1HB LEU 80 HB2 LEU 80 -7.993 -4.324 7.832 1385 2HB LEU 80 HB3 LEU 80 -7.004 -4.853 6.476 1386 HG LEU 80 HG LEU 80 -8.912 -6.392 5.815 1387 1HD1 LEU 80 HD11 LEU 80 -10.380 -4.721 7.909 1388 2HD1 LEU 80 HD12 LEU 80 -10.205 -6.488 7.923 1389 3HD1 LEU 80 HD13 LEU 80 -11.180 -5.703 6.671 1390 1HD2 LEU 80 HD21 LEU 80 -9.507 -3.404 5.972 1391 2HD2 LEU 80 HD22 LEU 80 -8.472 -4.177 4.744 1392 3HD2 LEU 80 HD23 LEU 80 -10.206 -4.545 4.803 1393 H ALA 81 H ALA 81 -4.922 -5.989 7.036 1394 HA ALA 81 HA ALA 81 -4.704 -8.065 5.108 1395 1HB ALA 81 HB1 ALA 81 -3.217 -6.183 5.085 1396 2HB ALA 81 HB2 ALA 81 -2.303 -7.700 5.277 1397 3HB ALA 81 HB3 ALA 81 -2.541 -6.624 6.664 1398 H MET 82 H MET 82 -3.787 -7.940 8.587 1399 HA MET 82 HA MET 82 -2.658 -10.521 8.682 1400 1HB MET 82 HB2 MET 82 -2.377 -8.677 10.370 1401 2HB MET 82 HB3 MET 82 -3.981 -9.085 11.003 1402 1HG MET 82 HG2 MET 82 -3.231 -11.298 11.635 1403 2HG MET 82 HG3 MET 82 -1.728 -11.110 10.728 1404 1HE MET 82 HE1 MET 82 -3.743 -9.922 13.880 1405 2HE MET 82 HE2 MET 82 -2.556 -8.861 14.674 1406 3HE MET 82 HE3 MET 82 -3.304 -8.359 13.144 1407 H ILE 83 H ILE 83 -6.023 -9.458 9.187 1408 HA ILE 83 HA ILE 83 -7.091 -12.056 9.788 1409 HB ILE 83 HB ILE 83 -8.339 -9.582 8.543 1410 1HG1 ILE 83 HG12 ILE 83 -8.749 -10.857 11.283 1411 2HG1 ILE 83 HG13 ILE 83 -7.539 -9.610 10.988 1412 1HG2 ILE 83 HG21 ILE 83 -10.539 -10.679 8.953 1413 2HG2 ILE 83 HG22 ILE 83 -9.607 -11.529 7.733 1414 3HG2 ILE 83 HG23 ILE 83 -9.695 -12.179 9.383 1415 1HD1 ILE 83 HD11 ILE 83 -10.543 -9.265 10.670 1416 2HD1 ILE 83 HD12 ILE 83 -9.324 -8.057 10.203 1417 3HD1 ILE 83 HD13 ILE 83 -9.486 -8.555 11.896 1418 H TYR 84 H TYR 84 -6.491 -10.339 6.688 1419 HA TYR 84 HA TYR 84 -7.279 -12.599 5.041 1420 1HB TYR 84 HB2 TYR 84 -5.525 -10.248 4.297 1421 2HB TYR 84 HB3 TYR 84 -6.386 -11.323 3.202 1422 HD1 TYR 84 HD1 TYR 84 -6.442 -8.304 3.186 1423 HD2 TYR 84 HD2 TYR 84 -9.068 -11.212 5.006 1424 HE1 TYR 84 HE1 TYR 84 -8.351 -6.745 2.953 1425 HE2 TYR 84 HE2 TYR 84 -10.947 -9.643 4.799 1426 HH TYR 84 HH TYR 84 -11.643 -7.572 4.067 1427 H ASN 85 H ASN 85 -5.845 -13.879 6.711 1428 HA ASN 85 HA ASN 85 -3.186 -14.504 6.492 1429 1HB ASN 85 HB2 ASN 85 -5.619 -16.329 6.581 1430 2HB ASN 85 HB3 ASN 85 -3.956 -16.916 6.698 1431 1HD2 ASN 85 HD21 ASN 85 -6.321 -14.674 8.367 1432 2HD2 ASN 85 HD22 ASN 85 -5.468 -14.801 9.885 1433 H GLU 86 H GLU 86 -5.721 -15.267 4.145 1434 HA GLU 86 HA GLU 86 -4.278 -16.844 2.297 1435 1HB GLU 86 HB2 GLU 86 -6.491 -14.791 1.766 1436 2HB GLU 86 HB3 GLU 86 -5.914 -16.029 0.654 1437 1HG GLU 86 HG2 GLU 86 -7.907 -16.894 1.572 1438 2HG GLU 86 HG3 GLU 86 -6.590 -17.801 2.321 1439 H ALA 87 H ALA 87 -4.601 -13.274 2.577 1440 HA ALA 87 HA ALA 87 -3.005 -12.701 0.232 1441 1HB ALA 87 HB1 ALA 87 -3.699 -10.884 2.576 1442 2HB ALA 87 HB2 ALA 87 -3.071 -10.405 0.992 1443 3HB ALA 87 HB3 ALA 87 -4.694 -11.112 1.119 1444 H LEU 88 H LEU 88 -2.436 -12.866 3.783 1445 HA LEU 88 HA LEU 88 0.253 -12.041 3.823 1446 1HB LEU 88 HB2 LEU 88 -0.790 -14.358 5.472 1447 2HB LEU 88 HB3 LEU 88 0.610 -13.347 5.788 1448 HG LEU 88 HG LEU 88 -2.287 -12.453 5.917 1449 1HD1 LEU 88 HD11 LEU 88 -1.991 -12.523 8.290 1450 2HD1 LEU 88 HD12 LEU 88 -1.289 -14.029 7.720 1451 3HD1 LEU 88 HD13 LEU 88 -0.232 -12.675 8.151 1452 1HD2 LEU 88 HD21 LEU 88 -0.817 -10.576 5.193 1453 2HD2 LEU 88 HD22 LEU 88 -1.410 -10.345 6.836 1454 3HD2 LEU 88 HD23 LEU 88 0.239 -10.901 6.590 1455 H LYS 89 H LYS 89 -0.963 -15.388 3.284 1456 HA LYS 89 HA LYS 89 1.694 -16.404 2.702 1457 1HB LYS 89 HB2 LYS 89 -1.117 -17.483 2.456 1458 2HB LYS 89 HB3 LYS 89 0.198 -18.270 1.578 1459 1HG LYS 89 HG2 LYS 89 -0.067 -19.375 3.694 1460 2HG LYS 89 HG3 LYS 89 1.501 -18.566 3.615 1461 1HD LYS 89 HD2 LYS 89 0.537 -16.679 4.999 1462 2HD LYS 89 HD3 LYS 89 -0.990 -17.569 5.080 1463 1HE LYS 89 HE2 LYS 89 0.218 -17.979 7.125 1464 2HE LYS 89 HE3 LYS 89 0.285 -19.476 6.182 1465 1HZ LYS 89 HZ1 LYS 89 2.510 -18.808 5.478 1466 2HZ LYS 89 HZ2 LYS 89 2.406 -17.442 6.384 1467 3HZ LYS 89 HZ3 LYS 89 2.404 -18.912 7.118 1468 H GLY 90 H GLY 90 -1.017 -15.305 0.604 1469 1HA GLY 90 HA2 GLY 90 0.740 -14.185 -1.310 1470 2HA GLY 90 HA3 GLY 90 0.253 -15.790 -1.891 Start of MODEL 17 1 1H MET 1 H1 MET 1 -13.277 -0.459 -5.278 2 2H MET 1 H2 MET 1 -13.948 0.047 -6.678 3 3H MET 1 H3 MET 1 -12.361 -0.413 -6.654 4 HA MET 1 HA MET 1 -14.689 -2.147 -6.213 5 1HB MET 1 HB2 MET 1 -12.758 -2.044 -8.561 6 2HB MET 1 HB3 MET 1 -14.059 -3.225 -8.317 7 1HG MET 1 HG2 MET 1 -15.730 -1.375 -8.337 8 2HG MET 1 HG3 MET 1 -14.427 -0.225 -8.657 9 1HE MET 1 HE1 MET 1 -14.925 -3.855 -10.322 10 2HE MET 1 HE2 MET 1 -16.557 -3.176 -10.082 11 3HE MET 1 HE3 MET 1 -15.891 -3.350 -11.722 12 H ALA 2 H ALA 2 -12.678 -1.826 -4.312 13 HA ALA 2 HA ALA 2 -11.513 -2.929 -2.828 14 1HB ALA 2 HB1 ALA 2 -13.201 -4.716 -3.099 15 2HB ALA 2 HB2 ALA 2 -12.179 -5.498 -4.324 16 3HB ALA 2 HB3 ALA 2 -11.607 -5.342 -2.653 17 H SER 3 H SER 3 -10.857 -4.522 -5.842 18 HA SER 3 HA SER 3 -8.337 -5.335 -5.768 19 1HB SER 3 HB2 SER 3 -9.206 -3.933 -8.293 20 2HB SER 3 HB3 SER 3 -8.350 -5.448 -8.050 21 HG SER 3 HG SER 3 -11.117 -4.915 -7.546 22 HA PRO 4 HA PRO 4 -6.517 -1.100 -7.082 23 1HB PRO 4 HB2 PRO 4 -8.431 0.823 -5.742 24 2HB PRO 4 HB3 PRO 4 -7.500 1.056 -7.249 25 1HG PRO 4 HG2 PRO 4 -10.133 0.435 -7.385 26 2HG PRO 4 HG3 PRO 4 -8.980 -0.429 -8.450 27 1HD PRO 4 HD2 PRO 4 -10.065 -1.324 -5.771 28 2HD PRO 4 HD3 PRO 4 -10.083 -2.216 -7.310 29 H LEU 5 H LEU 5 -8.102 -1.436 -3.909 30 HA LEU 5 HA LEU 5 -5.759 -0.287 -2.533 31 1HB LEU 5 HB2 LEU 5 -7.951 0.182 -1.571 32 2HB LEU 5 HB3 LEU 5 -8.308 -1.549 -1.460 33 HG LEU 5 HG LEU 5 -6.457 -1.862 0.152 34 1HD1 LEU 5 HD11 LEU 5 -4.878 -0.094 -0.528 35 2HD1 LEU 5 HD12 LEU 5 -6.063 1.161 -0.089 36 3HD1 LEU 5 HD13 LEU 5 -5.356 0.108 1.153 37 1HD2 LEU 5 HD21 LEU 5 -8.297 0.431 0.915 38 2HD2 LEU 5 HD22 LEU 5 -8.676 -1.312 1.009 39 3HD2 LEU 5 HD23 LEU 5 -7.403 -0.622 2.033 40 H ASP 6 H ASP 6 -7.453 -3.392 -3.039 41 HA ASP 6 HA ASP 6 -5.976 -5.059 -1.410 42 1HB ASP 6 HB2 ASP 6 -6.974 -5.810 -4.167 43 2HB ASP 6 HB3 ASP 6 -6.536 -6.918 -2.873 44 H GLN 7 H GLN 7 -5.137 -4.125 -4.796 45 HA GLN 7 HA GLN 7 -2.761 -5.652 -4.975 46 1HB GLN 7 HB2 GLN 7 -2.120 -4.164 -6.783 47 2HB GLN 7 HB3 GLN 7 -3.865 -4.464 -6.866 48 1HG GLN 7 HG2 GLN 7 -4.189 -2.310 -5.586 49 2HG GLN 7 HG3 GLN 7 -2.462 -1.963 -5.807 50 1HE2 GLN 7 HE22 GLN 7 -4.340 -0.185 -6.616 51 2HE2 GLN 7 HE21 GLN 7 -4.253 -0.080 -8.381 52 H ALA 8 H ALA 8 -3.318 -2.464 -3.445 53 HA ALA 8 HA ALA 8 -0.507 -1.830 -3.235 54 1HB ALA 8 HB1 ALA 8 -2.076 -0.068 -3.380 55 2HB ALA 8 HB2 ALA 8 -2.944 -0.594 -1.916 56 3HB ALA 8 HB3 ALA 8 -1.282 0.010 -1.797 57 H ILE 9 H ILE 9 -3.029 -2.895 -0.852 58 HA ILE 9 HA ILE 9 -1.107 -3.248 1.273 59 HB ILE 9 HB ILE 9 -2.730 -4.655 2.396 60 1HG1 ILE 9 HG12 ILE 9 -4.480 -4.296 -0.044 61 2HG1 ILE 9 HG13 ILE 9 -3.753 -5.827 0.483 62 1HG2 ILE 9 HG21 ILE 9 -3.999 -2.158 1.213 63 2HG2 ILE 9 HG22 ILE 9 -4.325 -2.881 2.804 64 3HG2 ILE 9 HG23 ILE 9 -2.752 -2.163 2.478 65 1HD1 ILE 9 HD11 ILE 9 -5.897 -4.247 1.955 66 2HD1 ILE 9 HD12 ILE 9 -6.024 -5.838 1.198 67 3HD1 ILE 9 HD13 ILE 9 -5.024 -5.632 2.649 68 H GLY 10 H GLY 10 -2.298 -5.422 -1.297 69 1HA GLY 10 HA2 GLY 10 -0.915 -7.774 -0.877 70 2HA GLY 10 HA3 GLY 10 -1.227 -7.035 -2.454 71 H LEU 11 H LEU 11 0.333 -4.767 -2.416 72 HA LEU 11 HA LEU 11 2.870 -5.703 -3.075 73 1HB LEU 11 HB2 LEU 11 1.599 -3.451 -3.596 74 2HB LEU 11 HB3 LEU 11 2.365 -2.862 -2.128 75 HG LEU 11 HG LEU 11 3.642 -2.119 -3.923 76 1HD1 LEU 11 HD11 LEU 11 5.811 -2.918 -3.553 77 2HD1 LEU 11 HD12 LEU 11 4.925 -2.958 -2.013 78 3HD1 LEU 11 HD13 LEU 11 5.229 -4.469 -2.922 79 1HD2 LEU 11 HD21 LEU 11 3.815 -4.941 -5.025 80 2HD2 LEU 11 HD22 LEU 11 2.798 -3.621 -5.656 81 3HD2 LEU 11 HD23 LEU 11 4.564 -3.481 -5.702 82 H LEU 12 H LEU 12 2.032 -3.789 -0.148 83 HA LEU 12 HA LEU 12 4.509 -3.976 1.229 84 1HB LEU 12 HB2 LEU 12 1.606 -3.812 2.193 85 2HB LEU 12 HB3 LEU 12 2.971 -3.892 3.299 86 HG LEU 12 HG LEU 12 3.940 -1.859 2.285 87 1HD1 LEU 12 HD11 LEU 12 1.227 -1.652 0.904 88 2HD1 LEU 12 HD12 LEU 12 2.413 -0.344 1.004 89 3HD1 LEU 12 HD13 LEU 12 2.805 -1.795 0.087 90 1HD2 LEU 12 HD21 LEU 12 1.153 -1.657 3.493 91 2HD2 LEU 12 HD22 LEU 12 2.699 -1.754 4.369 92 3HD2 LEU 12 HD23 LEU 12 2.322 -0.325 3.412 93 H ILE 13 H ILE 13 1.663 -6.146 1.279 94 HA ILE 13 HA ILE 13 2.665 -7.934 3.247 95 HB ILE 13 HB ILE 13 0.668 -8.314 0.981 96 1HG1 ILE 13 HG12 ILE 13 0.097 -8.103 3.958 97 2HG1 ILE 13 HG13 ILE 13 0.227 -6.654 2.972 98 1HG2 ILE 13 HG21 ILE 13 1.480 -10.548 1.635 99 2HG2 ILE 13 HG22 ILE 13 1.228 -10.136 3.348 100 3HG2 ILE 13 HG23 ILE 13 -0.152 -10.287 2.250 101 1HD1 ILE 13 HD11 ILE 13 -1.838 -8.861 2.775 102 2HD1 ILE 13 HD12 ILE 13 -2.076 -7.117 2.975 103 3HD1 ILE 13 HD13 ILE 13 -1.548 -7.752 1.418 104 H GLY 14 H GLY 14 2.814 -8.109 -0.327 105 1HA GLY 14 HA2 GLY 14 4.225 -10.531 -0.581 106 2HA GLY 14 HA3 GLY 14 4.230 -9.188 -1.742 107 H ILE 15 H ILE 15 5.473 -7.133 -0.535 108 HA ILE 15 HA ILE 15 8.230 -7.672 -0.688 109 HB ILE 15 HB ILE 15 6.521 -5.457 0.407 110 1HG1 ILE 15 HG12 ILE 15 8.801 -5.595 -1.627 111 2HG1 ILE 15 HG13 ILE 15 7.074 -5.694 -1.998 112 1HG2 ILE 15 HG21 ILE 15 8.517 -4.159 1.101 113 2HG2 ILE 15 HG22 ILE 15 8.179 -5.535 2.125 114 3HG2 ILE 15 HG23 ILE 15 9.504 -5.630 0.929 115 1HD1 ILE 15 HD11 ILE 15 6.824 -3.382 -0.949 116 2HD1 ILE 15 HD12 ILE 15 8.593 -3.282 -0.922 117 3HD1 ILE 15 HD13 ILE 15 7.750 -3.442 -2.461 118 H PHE 16 H PHE 16 6.175 -7.406 2.227 119 HA PHE 16 HA PHE 16 8.223 -7.998 4.068 120 1HB PHE 16 HB2 PHE 16 5.964 -7.020 4.520 121 2HB PHE 16 HB3 PHE 16 5.237 -8.599 4.304 122 HD1 PHE 16 HD1 PHE 16 7.501 -6.563 6.398 123 HD2 PHE 16 HD2 PHE 16 5.676 -10.437 5.965 124 HE1 PHE 16 HE1 PHE 16 7.993 -7.064 8.779 125 HE2 PHE 16 HE2 PHE 16 6.401 -11.015 8.217 126 HZ PHE 16 HZ PHE 16 7.398 -9.257 9.714 127 H HIS 17 H HIS 17 5.767 -10.232 2.672 128 HA HIS 17 HA HIS 17 6.714 -12.434 4.242 129 1HB HIS 17 HB2 HIS 17 4.770 -12.273 1.929 130 2HB HIS 17 HB3 HIS 17 5.185 -13.782 2.753 131 HD1 HIS 17 HD1 HIS 17 3.641 -10.368 3.622 132 HD2 HIS 17 HD2 HIS 17 4.204 -14.226 5.176 133 HE1 HIS 17 HE1 HIS 17 2.398 -10.442 5.864 134 H LYS 18 H LYS 18 7.604 -11.270 1.001 135 HA LYS 18 HA LYS 18 9.104 -13.604 0.227 136 1HB LYS 18 HB2 LYS 18 9.415 -10.642 -0.337 137 2HB LYS 18 HB3 LYS 18 10.536 -11.855 -0.996 138 1HG LYS 18 HG2 LYS 18 8.598 -13.071 -1.998 139 2HG LYS 18 HG3 LYS 18 7.528 -11.767 -1.495 140 1HD LYS 18 HD2 LYS 18 9.884 -11.553 -3.448 141 2HD LYS 18 HD3 LYS 18 8.169 -11.614 -3.852 142 1HE LYS 18 HE2 LYS 18 8.596 -9.352 -4.029 143 2HE LYS 18 HE3 LYS 18 7.920 -9.464 -2.398 144 1HZ LYS 18 HZ1 LYS 18 9.883 -8.099 -2.519 145 2HZ LYS 18 HZ2 LYS 18 10.192 -9.409 -1.575 146 3HZ LYS 18 HZ3 LYS 18 10.777 -9.348 -3.112 147 H TYR 19 H TYR 19 10.097 -10.654 2.087 148 HA TYR 19 HA TYR 19 12.746 -11.675 2.533 149 1HB TYR 19 HB2 TYR 19 11.112 -9.355 3.522 150 2HB TYR 19 HB3 TYR 19 12.552 -9.816 4.422 151 HD1 TYR 19 HD1 TYR 19 14.766 -9.666 3.544 152 HD2 TYR 19 HD2 TYR 19 11.396 -8.625 1.084 153 HE1 TYR 19 HE1 TYR 19 16.294 -8.849 1.812 154 HE2 TYR 19 HE2 TYR 19 12.920 -7.645 -0.581 155 HH TYR 19 HH TYR 19 16.236 -7.019 0.180 156 H SER 20 H SER 20 9.752 -11.872 4.433 157 HA SER 20 HA SER 20 10.904 -13.148 6.717 158 1HB SER 20 HB2 SER 20 8.150 -13.775 5.569 159 2HB SER 20 HB3 SER 20 8.698 -13.848 7.248 160 HG SER 20 HG SER 20 8.464 -11.469 5.701 161 H GLY 21 H GLY 21 9.469 -14.534 3.740 162 1HA GLY 21 HA2 GLY 21 9.879 -17.251 4.204 163 2HA GLY 21 HA3 GLY 21 9.792 -16.469 2.614 164 H LYS 22 H LYS 22 12.078 -14.824 2.745 165 HA LYS 22 HA LYS 22 14.153 -16.431 1.908 166 1HB LYS 22 HB2 LYS 22 13.886 -13.910 1.745 167 2HB LYS 22 HB3 LYS 22 14.595 -13.804 3.369 168 1HG LYS 22 HG2 LYS 22 16.610 -15.029 2.531 169 2HG LYS 22 HG3 LYS 22 15.916 -15.036 0.908 170 1HD LYS 22 HD2 LYS 22 16.732 -12.616 2.586 171 2HD LYS 22 HD3 LYS 22 17.566 -13.231 1.163 172 1HE LYS 22 HE2 LYS 22 14.831 -11.881 1.252 173 2HE LYS 22 HE3 LYS 22 16.323 -11.257 0.547 174 1HZ LYS 22 HZ1 LYS 22 16.255 -13.039 -1.043 175 2HZ LYS 22 HZ2 LYS 22 14.845 -13.605 -0.401 176 3HZ LYS 22 HZ3 LYS 22 14.886 -12.124 -1.121 177 H GLU 23 H GLU 23 13.350 -15.621 5.289 178 HA GLU 23 HA GLU 23 15.585 -17.408 6.201 179 1HB GLU 23 HB2 GLU 23 15.552 -16.143 8.305 180 2HB GLU 23 HB3 GLU 23 16.057 -15.179 6.913 181 1HG GLU 23 HG2 GLU 23 13.826 -14.131 6.777 182 2HG GLU 23 HG3 GLU 23 13.249 -15.141 8.114 183 H GLY 24 H GLY 24 12.853 -18.124 5.273 184 1HA GLY 24 HA2 GLY 24 11.236 -19.601 5.850 185 2HA GLY 24 HA3 GLY 24 12.387 -20.207 7.050 186 H ASP 25 H ASP 25 10.965 -16.932 7.104 187 HA ASP 25 HA ASP 25 9.262 -17.707 9.444 188 1HB ASP 25 HB2 ASP 25 11.242 -16.114 9.841 189 2HB ASP 25 HB3 ASP 25 10.352 -14.925 8.886 190 H LYS 26 H LYS 26 7.243 -16.313 9.496 191 HA LYS 26 HA LYS 26 6.172 -16.003 6.697 192 1HB LYS 26 HB2 LYS 26 4.704 -16.880 9.205 193 2HB LYS 26 HB3 LYS 26 4.008 -16.606 7.593 194 1HG LYS 26 HG2 LYS 26 5.671 -18.345 6.723 195 2HG LYS 26 HG3 LYS 26 6.020 -18.741 8.410 196 1HD LYS 26 HD2 LYS 26 3.302 -18.898 7.012 197 2HD LYS 26 HD3 LYS 26 4.341 -20.263 7.455 198 1HE LYS 26 HE2 LYS 26 4.089 -19.618 9.878 199 2HE LYS 26 HE3 LYS 26 2.949 -18.345 9.388 200 1HZ LYS 26 HZ1 LYS 26 1.547 -20.012 8.461 201 2HZ LYS 26 HZ2 LYS 26 2.590 -21.210 8.909 202 3HZ LYS 26 HZ3 LYS 26 1.825 -20.308 10.057 203 H HIS 27 H HIS 27 4.860 -14.988 9.820 204 HA HIS 27 HA HIS 27 4.288 -12.341 8.591 205 1HB HIS 27 HB2 HIS 27 3.108 -13.531 11.111 206 2HB HIS 27 HB3 HIS 27 2.447 -12.244 10.091 207 HD1 HIS 27 HD1 HIS 27 2.484 -13.613 7.265 208 HD2 HIS 27 HD2 HIS 27 1.620 -15.626 10.863 209 HE1 HIS 27 HE1 HIS 27 1.297 -15.790 6.634 210 H THR 28 H THR 28 6.972 -13.010 9.765 211 HA THR 28 HA THR 28 7.335 -10.623 11.324 212 HB THR 28 HB THR 28 7.699 -13.371 12.576 213 HG1 THR 28 HG1 THR 28 5.700 -11.914 12.686 214 1HG2 THR 28 HG21 THR 28 8.635 -12.157 14.523 215 2HG2 THR 28 HG22 THR 28 9.718 -12.126 13.122 216 3HG2 THR 28 HG23 THR 28 8.760 -10.683 13.549 217 H LEU 29 H LEU 29 9.628 -10.031 11.187 218 HA LEU 29 HA LEU 29 11.437 -12.012 10.077 219 1HB LEU 29 HB2 LEU 29 12.111 -10.870 8.068 220 2HB LEU 29 HB3 LEU 29 10.403 -11.255 8.044 221 HG LEU 29 HG LEU 29 10.070 -8.755 8.822 222 1HD1 LEU 29 HD11 LEU 29 12.505 -8.219 9.083 223 2HD1 LEU 29 HD12 LEU 29 12.756 -8.651 7.371 224 3HD1 LEU 29 HD13 LEU 29 11.745 -7.261 7.801 225 1HD2 LEU 29 HD21 LEU 29 10.893 -9.621 6.011 226 2HD2 LEU 29 HD22 LEU 29 9.254 -9.615 6.688 227 3HD2 LEU 29 HD23 LEU 29 10.082 -8.089 6.375 228 H SER 30 H SER 30 13.674 -11.335 10.079 229 HA SER 30 HA SER 30 14.156 -10.142 12.649 230 1HB SER 30 HB2 SER 30 15.359 -12.141 11.830 231 2HB SER 30 HB3 SER 30 16.083 -11.183 10.524 232 HG SER 30 HG SER 30 16.479 -10.956 13.313 233 H LYS 31 H LYS 31 15.634 -8.412 13.174 234 HA LYS 31 HA LYS 31 15.229 -6.016 11.866 235 1HB LYS 31 HB2 LYS 31 17.080 -5.165 13.227 236 2HB LYS 31 HB3 LYS 31 15.967 -6.204 14.121 237 1HG LYS 31 HG2 LYS 31 17.641 -8.090 13.899 238 2HG LYS 31 HG3 LYS 31 18.772 -6.901 13.198 239 1HD LYS 31 HD2 LYS 31 18.595 -5.519 15.249 240 2HD LYS 31 HD3 LYS 31 17.402 -6.639 15.915 241 1HE LYS 31 HE2 LYS 31 19.575 -7.082 16.915 242 2HE LYS 31 HE3 LYS 31 19.075 -8.466 15.930 243 1HZ LYS 31 HZ1 LYS 31 20.517 -7.674 14.200 244 2HZ LYS 31 HZ2 LYS 31 20.956 -6.362 15.098 245 3HZ LYS 31 HZ3 LYS 31 21.367 -7.879 15.594 246 H LYS 32 H LYS 32 18.073 -8.166 11.402 247 HA LYS 32 HA LYS 32 19.265 -6.336 9.472 248 1HB LYS 32 HB2 LYS 32 20.701 -7.696 10.732 249 2HB LYS 32 HB3 LYS 32 19.899 -9.201 10.209 250 1HG LYS 32 HG2 LYS 32 20.656 -8.803 7.890 251 2HG LYS 32 HG3 LYS 32 21.402 -7.269 8.381 252 1HD LYS 32 HD2 LYS 32 22.902 -8.520 9.934 253 2HD LYS 32 HD3 LYS 32 22.165 -10.046 9.421 254 1HE LYS 32 HE2 LYS 32 23.678 -8.099 7.608 255 2HE LYS 32 HE3 LYS 32 24.324 -9.606 8.274 256 1HZ LYS 32 HZ1 LYS 32 22.058 -9.392 6.420 257 2HZ LYS 32 HZ2 LYS 32 23.574 -9.918 6.058 258 3HZ LYS 32 HZ3 LYS 32 22.623 -10.793 7.078 259 H GLU 33 H GLU 33 16.959 -9.014 9.272 260 HA GLU 33 HA GLU 33 17.139 -9.321 6.412 261 1HB GLU 33 HB2 GLU 33 16.154 -11.008 8.042 262 2HB GLU 33 HB3 GLU 33 14.759 -9.930 8.215 263 1HG GLU 33 HG2 GLU 33 14.152 -11.586 6.624 264 2HG GLU 33 HG3 GLU 33 14.432 -10.110 5.713 265 H LEU 34 H LEU 34 15.211 -7.329 8.657 266 HA LEU 34 HA LEU 34 13.679 -5.948 6.719 267 1HB LEU 34 HB2 LEU 34 13.083 -5.844 9.030 268 2HB LEU 34 HB3 LEU 34 14.608 -5.152 9.505 269 HG LEU 34 HG LEU 34 12.701 -3.609 9.508 270 1HD1 LEU 34 HD11 LEU 34 14.744 -2.532 7.556 271 2HD1 LEU 34 HD12 LEU 34 13.947 -1.726 8.897 272 3HD1 LEU 34 HD13 LEU 34 15.181 -2.932 9.216 273 1HD2 LEU 34 HD21 LEU 34 12.829 -3.789 6.463 274 2HD2 LEU 34 HD22 LEU 34 11.534 -4.427 7.491 275 3HD2 LEU 34 HD23 LEU 34 11.823 -2.684 7.379 276 H LYS 35 H LYS 35 16.952 -5.125 8.133 277 HA LYS 35 HA LYS 35 17.346 -2.883 6.458 278 1HB LYS 35 HB2 LYS 35 18.971 -3.321 8.152 279 2HB LYS 35 HB3 LYS 35 19.416 -4.883 7.438 280 1HG LYS 35 HG2 LYS 35 20.307 -3.828 5.452 281 2HG LYS 35 HG3 LYS 35 19.737 -2.230 5.961 282 1HD LYS 35 HD2 LYS 35 21.731 -3.859 7.592 283 2HD LYS 35 HD3 LYS 35 22.228 -2.868 6.212 284 1HE LYS 35 HE2 LYS 35 21.183 -0.856 7.273 285 2HE LYS 35 HE3 LYS 35 20.820 -1.829 8.706 286 1HZ LYS 35 HZ1 LYS 35 23.177 -2.231 8.932 287 2HZ LYS 35 HZ2 LYS 35 23.497 -1.383 7.552 288 3HZ LYS 35 HZ3 LYS 35 22.909 -0.606 8.865 289 H GLU 36 H GLU 36 17.993 -6.339 5.701 290 HA GLU 36 HA GLU 36 18.956 -5.927 3.092 291 1HB GLU 36 HB2 GLU 36 18.900 -8.044 4.613 292 2HB GLU 36 HB3 GLU 36 17.337 -8.369 3.863 293 1HG GLU 36 HG2 GLU 36 18.511 -8.228 1.599 294 2HG GLU 36 HG3 GLU 36 20.035 -8.015 2.466 295 H LEU 37 H LEU 37 15.598 -6.190 4.233 296 HA LEU 37 HA LEU 37 14.285 -6.004 1.680 297 1HB LEU 37 HB2 LEU 37 13.205 -6.708 3.738 298 2HB LEU 37 HB3 LEU 37 13.405 -5.133 4.463 299 HG LEU 37 HG LEU 37 11.745 -5.498 1.966 300 1HD1 LEU 37 HD11 LEU 37 10.987 -5.752 4.918 301 2HD1 LEU 37 HD12 LEU 37 9.810 -5.578 3.612 302 3HD1 LEU 37 HD13 LEU 37 10.848 -7.005 3.664 303 1HD2 LEU 37 HD21 LEU 37 10.581 -3.473 2.919 304 2HD2 LEU 37 HD22 LEU 37 11.803 -3.383 4.198 305 3HD2 LEU 37 HD23 LEU 37 12.252 -3.127 2.496 306 H ILE 38 H ILE 38 15.114 -3.443 4.036 307 HA ILE 38 HA ILE 38 14.230 -1.320 2.404 308 HB ILE 38 HB ILE 38 16.392 -1.381 4.539 309 1HG1 ILE 38 HG12 ILE 38 13.443 -0.535 4.500 310 2HG1 ILE 38 HG13 ILE 38 14.093 -1.988 5.265 311 1HG2 ILE 38 HG21 ILE 38 14.982 1.102 3.486 312 2HG2 ILE 38 HG22 ILE 38 16.324 1.011 4.640 313 3HG2 ILE 38 HG23 ILE 38 16.614 0.653 2.955 314 1HD1 ILE 38 HD11 ILE 38 14.577 0.893 6.043 315 2HD1 ILE 38 HD12 ILE 38 13.765 -0.398 6.959 316 3HD1 ILE 38 HD13 ILE 38 15.530 -0.458 6.710 317 H GLN 39 H GLN 39 17.581 -2.698 2.611 318 HA GLN 39 HA GLN 39 18.625 -0.765 0.791 319 1HB GLN 39 HB2 GLN 39 19.639 -3.588 1.313 320 2HB GLN 39 HB3 GLN 39 20.528 -2.290 0.504 321 1HG GLN 39 HG2 GLN 39 19.684 -2.351 3.430 322 2HG GLN 39 HG3 GLN 39 21.311 -2.459 2.773 323 1HE2 GLN 39 HE22 GLN 39 18.525 -0.318 3.314 324 2HE2 GLN 39 HE21 GLN 39 19.432 1.177 3.181 325 H LYS 40 H LYS 40 16.796 -3.750 0.074 326 HA LYS 40 HA LYS 40 17.545 -3.500 -2.752 327 1HB LYS 40 HB2 LYS 40 17.080 -5.707 -1.585 328 2HB LYS 40 HB3 LYS 40 15.367 -5.229 -1.569 329 1HG LYS 40 HG2 LYS 40 15.512 -5.003 -4.118 330 2HG LYS 40 HG3 LYS 40 17.191 -5.547 -4.006 331 1HD LYS 40 HD2 LYS 40 15.974 -7.475 -4.611 332 2HD LYS 40 HD3 LYS 40 16.289 -7.672 -2.877 333 1HE LYS 40 HE2 LYS 40 13.966 -6.723 -2.446 334 2HE LYS 40 HE3 LYS 40 13.698 -6.695 -4.192 335 1HZ LYS 40 HZ1 LYS 40 12.811 -8.651 -3.184 336 2HZ LYS 40 HZ2 LYS 40 14.040 -9.067 -4.201 337 3HZ LYS 40 HZ3 LYS 40 14.281 -9.071 -2.568 338 H GLU 41 H GLU 41 14.676 -2.781 -0.738 339 HA GLU 41 HA GLU 41 13.203 -1.844 -3.090 340 1HB GLU 41 HB2 GLU 41 12.623 -1.418 -0.132 341 2HB GLU 41 HB3 GLU 41 11.516 -1.129 -1.489 342 1HG GLU 41 HG2 GLU 41 12.648 -3.828 -0.598 343 2HG GLU 41 HG3 GLU 41 11.008 -3.240 -0.351 344 H LEU 42 H LEU 42 14.557 -0.214 -0.252 345 HA LEU 42 HA LEU 42 14.391 2.459 -1.577 346 1HB LEU 42 HB2 LEU 42 14.951 1.644 1.295 347 2HB LEU 42 HB3 LEU 42 15.027 3.289 0.681 348 HG LEU 42 HG LEU 42 13.023 3.004 1.908 349 1HD1 LEU 42 HD11 LEU 42 12.950 4.447 -0.126 350 2HD1 LEU 42 HD12 LEU 42 12.247 3.086 -1.030 351 3HD1 LEU 42 HD13 LEU 42 11.368 3.792 0.335 352 1HD2 LEU 42 HD21 LEU 42 12.005 0.880 0.005 353 2HD2 LEU 42 HD22 LEU 42 12.749 0.516 1.587 354 3HD2 LEU 42 HD23 LEU 42 11.263 1.478 1.492 355 H THR 43 H THR 43 16.033 1.621 -3.094 356 HA THR 43 HA THR 43 18.650 0.851 -2.276 357 HB THR 43 HB THR 43 19.194 1.367 -4.677 358 HG1 THR 43 HG1 THR 43 17.745 3.116 -4.842 359 1HG2 THR 43 HG21 THR 43 16.600 -0.162 -4.254 360 2HG2 THR 43 HG22 THR 43 17.672 -0.300 -5.658 361 3HG2 THR 43 HG23 THR 43 18.231 -0.834 -4.058 362 H ILE 44 H ILE 44 18.863 2.580 -0.562 363 HA ILE 44 HA ILE 44 19.517 5.255 -1.294 364 HB ILE 44 HB ILE 44 20.781 5.262 0.901 365 1HG1 ILE 44 HG12 ILE 44 19.363 2.617 1.435 366 2HG1 ILE 44 HG13 ILE 44 21.057 2.664 0.946 367 1HG2 ILE 44 HG21 ILE 44 18.662 5.374 2.160 368 2HG2 ILE 44 HG22 ILE 44 18.470 6.080 0.558 369 3HG2 ILE 44 HG23 ILE 44 17.840 4.453 0.885 370 1HD1 ILE 44 HD11 ILE 44 19.882 4.004 3.405 371 2HD1 ILE 44 HD12 ILE 44 20.936 2.575 3.368 372 3HD1 ILE 44 HD13 ILE 44 21.567 4.151 2.887 373 H GLY 45 H GLY 45 20.932 5.747 -2.785 374 1HA GLY 45 HA2 GLY 45 23.037 4.433 -3.864 375 2HA GLY 45 HA3 GLY 45 23.005 6.196 -3.678 376 H SER 46 H SER 46 24.980 3.705 -3.207 377 HA SER 46 HA SER 46 26.676 3.102 -1.847 378 1HB SER 46 HB2 SER 46 26.909 6.112 -1.494 379 2HB SER 46 HB3 SER 46 28.212 4.917 -1.364 380 HG SER 46 HG SER 46 28.117 5.913 -3.455 381 H LYS 47 H LYS 47 24.057 3.279 -0.399 382 HA LYS 47 HA LYS 47 23.254 3.098 1.657 383 1HB LYS 47 HB2 LYS 47 26.104 2.514 2.544 384 2HB LYS 47 HB3 LYS 47 24.600 2.155 3.410 385 1HG LYS 47 HG2 LYS 47 23.878 0.639 1.601 386 2HG LYS 47 HG3 LYS 47 25.351 0.989 0.700 387 1HD LYS 47 HD2 LYS 47 25.534 -1.154 1.887 388 2HD LYS 47 HD3 LYS 47 26.757 0.008 2.410 389 1HE LYS 47 HE2 LYS 47 25.810 -1.268 4.310 390 2HE LYS 47 HE3 LYS 47 25.528 0.460 4.482 391 1HZ LYS 47 HZ1 LYS 47 23.289 0.041 3.552 392 2HZ LYS 47 HZ2 LYS 47 23.596 -1.573 3.616 393 3HZ LYS 47 HZ3 LYS 47 23.569 -0.675 5.005 394 H LEU 48 H LEU 48 24.094 5.795 0.734 395 HA LEU 48 HA LEU 48 25.038 7.259 2.992 396 1HB LEU 48 HB2 LEU 48 23.229 8.057 0.682 397 2HB LEU 48 HB3 LEU 48 23.890 9.199 1.860 398 HG LEU 48 HG LEU 48 25.628 7.441 0.079 399 1HD1 LEU 48 HD11 LEU 48 24.865 10.377 -0.199 400 2HD1 LEU 48 HD12 LEU 48 26.021 9.493 -1.221 401 3HD1 LEU 48 HD13 LEU 48 24.305 9.053 -1.245 402 1HD2 LEU 48 HD21 LEU 48 26.283 9.762 1.932 403 2HD2 LEU 48 HD22 LEU 48 26.844 8.076 2.070 404 3HD2 LEU 48 HD23 LEU 48 27.398 9.078 0.730 405 H GLN 49 H GLN 49 24.091 7.935 4.742 406 HA GLN 49 HA GLN 49 22.681 8.161 6.474 407 1HB GLN 49 HB2 GLN 49 20.379 7.869 4.494 408 2HB GLN 49 HB3 GLN 49 20.237 8.265 6.189 409 1HG GLN 49 HG2 GLN 49 20.100 10.310 5.032 410 2HG GLN 49 HG3 GLN 49 21.634 10.282 5.905 411 1HE2 GLN 49 HE22 GLN 49 20.373 9.252 2.653 412 2HE2 GLN 49 HE21 GLN 49 21.686 10.001 1.762 413 H ASP 50 H ASP 50 23.653 5.393 5.406 414 HA ASP 50 HA ASP 50 22.025 3.386 6.310 415 1HB ASP 50 HB2 ASP 50 24.301 3.015 5.474 416 2HB ASP 50 HB3 ASP 50 24.981 3.673 6.970 417 H ALA 51 H ALA 51 23.850 5.638 8.399 418 HA ALA 51 HA ALA 51 23.305 4.572 10.941 419 1HB ALA 51 HB1 ALA 51 23.379 7.496 10.084 420 2HB ALA 51 HB2 ALA 51 23.521 6.890 11.747 421 3HB ALA 51 HB3 ALA 51 24.776 6.500 10.555 422 H GLU 52 H GLU 52 21.239 6.635 8.861 423 HA GLU 52 HA GLU 52 19.123 6.889 10.835 424 1HB GLU 52 HB2 GLU 52 18.896 7.290 7.829 425 2HB GLU 52 HB3 GLU 52 17.864 7.937 9.106 426 1HG GLU 52 HG2 GLU 52 20.758 8.726 8.522 427 2HG GLU 52 HG3 GLU 52 19.311 9.716 8.325 428 H ILE 53 H ILE 53 19.853 4.786 8.019 429 HA ILE 53 HA ILE 53 17.448 3.279 8.141 430 HB ILE 53 HB ILE 53 20.175 2.195 7.352 431 1HG1 ILE 53 HG12 ILE 53 19.764 4.032 5.892 432 2HG1 ILE 53 HG13 ILE 53 19.321 2.552 5.042 433 1HG2 ILE 53 HG21 ILE 53 18.666 0.375 7.789 434 2HG2 ILE 53 HG22 ILE 53 17.366 1.162 6.880 435 3HG2 ILE 53 HG23 ILE 53 18.815 0.565 6.045 436 1HD1 ILE 53 HD11 ILE 53 17.436 4.613 6.249 437 2HD1 ILE 53 HD12 ILE 53 17.685 4.233 4.541 438 3HD1 ILE 53 HD13 ILE 53 16.898 3.047 5.594 439 H VAL 54 H VAL 54 20.521 2.754 10.033 440 HA VAL 54 HA VAL 54 19.268 0.493 11.309 441 HB VAL 54 HB VAL 54 21.117 0.515 12.947 442 1HG1 VAL 54 HG11 VAL 54 21.030 -0.937 10.979 443 2HG1 VAL 54 HG12 VAL 54 21.667 0.382 9.974 444 3HG1 VAL 54 HG13 VAL 54 22.689 -0.369 11.226 445 1HG2 VAL 54 HG21 VAL 54 22.360 2.572 11.117 446 2HG2 VAL 54 HG22 VAL 54 21.783 2.906 12.772 447 3HG2 VAL 54 HG23 VAL 54 23.114 1.768 12.497 448 H LYS 55 H LYS 55 19.364 3.951 12.225 449 HA LYS 55 HA LYS 55 18.131 3.550 14.780 450 1HB LYS 55 HB2 LYS 55 18.985 5.719 14.159 451 2HB LYS 55 HB3 LYS 55 17.905 5.818 12.766 452 1HG LYS 55 HG2 LYS 55 17.153 7.233 14.598 453 2HG LYS 55 HG3 LYS 55 15.944 6.012 14.194 454 1HD LYS 55 HD2 LYS 55 16.656 4.631 16.139 455 2HD LYS 55 HD3 LYS 55 17.897 5.830 16.547 456 1HE LYS 55 HE2 LYS 55 14.873 6.307 16.458 457 2HE LYS 55 HE3 LYS 55 15.815 6.000 17.921 458 1HZ LYS 55 HZ1 LYS 55 16.144 8.300 16.129 459 2HZ LYS 55 HZ2 LYS 55 15.449 8.313 17.621 460 3HZ LYS 55 HZ3 LYS 55 17.059 7.996 17.467 461 H LEU 56 H LEU 56 16.717 4.048 11.538 462 HA LEU 56 HA LEU 56 13.990 3.685 12.203 463 1HB LEU 56 HB2 LEU 56 14.604 4.722 10.217 464 2HB LEU 56 HB3 LEU 56 15.654 3.414 9.696 465 HG LEU 56 HG LEU 56 12.755 2.726 10.019 466 1HD1 LEU 56 HD11 LEU 56 12.322 3.603 7.702 467 2HD1 LEU 56 HD12 LEU 56 12.630 4.910 8.862 468 3HD1 LEU 56 HD13 LEU 56 13.901 4.404 7.731 469 1HD2 LEU 56 HD21 LEU 56 14.486 1.048 9.252 470 2HD2 LEU 56 HD22 LEU 56 13.264 1.424 8.021 471 3HD2 LEU 56 HD23 LEU 56 14.898 2.130 7.922 472 H MET 57 H MET 57 16.478 1.284 11.290 473 HA MET 57 HA MET 57 14.864 -1.033 11.269 474 1HB MET 57 HB2 MET 57 17.237 -0.939 10.469 475 2HB MET 57 HB3 MET 57 17.747 -0.733 12.155 476 1HG MET 57 HG2 MET 57 16.770 -2.950 12.712 477 2HG MET 57 HG3 MET 57 16.398 -3.174 11.009 478 1HE MET 57 HE1 MET 57 19.069 -3.149 13.803 479 2HE MET 57 HE2 MET 57 20.604 -3.207 12.906 480 3HE MET 57 HE3 MET 57 19.630 -1.723 12.899 481 H ASP 58 H ASP 58 16.752 0.500 13.948 482 HA ASP 58 HA ASP 58 15.960 -1.246 16.012 483 1HB ASP 58 HB2 ASP 58 17.703 0.398 16.342 484 2HB ASP 58 HB3 ASP 58 16.553 1.728 16.176 485 H ASP 59 H ASP 59 14.358 1.773 14.865 486 HA ASP 59 HA ASP 59 12.176 1.605 16.664 487 1HB ASP 59 HB2 ASP 59 12.141 2.768 13.842 488 2HB ASP 59 HB3 ASP 59 10.990 3.120 15.136 489 H LEU 60 H LEU 60 12.488 0.172 13.407 490 HA LEU 60 HA LEU 60 9.859 -0.998 13.360 491 1HB LEU 60 HB2 LEU 60 12.475 -1.441 11.893 492 2HB LEU 60 HB3 LEU 60 11.187 -2.623 11.690 493 HG LEU 60 HG LEU 60 10.554 0.301 11.326 494 1HD1 LEU 60 HD11 LEU 60 11.091 0.183 8.938 495 2HD1 LEU 60 HD12 LEU 60 12.549 -0.079 9.923 496 3HD1 LEU 60 HD13 LEU 60 11.716 -1.449 9.147 497 1HD2 LEU 60 HD21 LEU 60 8.975 -0.685 9.617 498 2HD2 LEU 60 HD22 LEU 60 9.607 -2.284 9.962 499 3HD2 LEU 60 HD23 LEU 60 8.715 -1.412 11.230 500 H ASP 61 H ASP 61 13.018 -2.387 14.305 501 HA ASP 61 HA ASP 61 11.829 -4.937 14.855 502 1HB ASP 61 HB2 ASP 61 13.963 -5.696 15.517 503 2HB ASP 61 HB3 ASP 61 14.097 -4.735 14.043 504 H ARG 62 H ARG 62 12.482 -2.116 16.876 505 HA ARG 62 HA ARG 62 12.688 -3.191 19.371 506 1HB ARG 62 HB2 ARG 62 12.858 -0.841 18.933 507 2HB ARG 62 HB3 ARG 62 11.143 -0.714 18.499 508 1HG ARG 62 HG2 ARG 62 10.493 -1.200 20.821 509 2HG ARG 62 HG3 ARG 62 12.185 -1.504 21.259 510 1HD ARG 62 HD2 ARG 62 11.066 1.138 20.212 511 2HD ARG 62 HD3 ARG 62 11.368 0.803 21.913 512 HE ARG 62 HE ARG 62 13.307 1.435 19.812 513 1HH1 ARG 62 HH22 ARG 62 12.943 -0.058 22.994 514 2HH1 ARG 62 HH21 ARG 62 14.632 0.080 23.405 515 1HH2 ARG 62 HH12 ARG 62 15.497 1.506 20.271 516 2HH2 ARG 62 HH11 ARG 62 16.121 1.016 21.828 517 H ASN 63 H ASN 63 9.715 -2.710 17.555 518 HA ASN 63 HA ASN 63 7.811 -3.254 19.509 519 1HB ASN 63 HB2 ASN 63 7.537 -4.017 16.585 520 2HB ASN 63 HB3 ASN 63 6.249 -3.635 17.748 521 1HD2 ASN 63 HD22 ASN 63 8.716 -2.309 15.617 522 2HD2 ASN 63 HD21 ASN 63 8.495 -0.627 16.006 523 H LYS 64 H LYS 64 9.907 -5.576 17.892 524 HA LYS 64 HA LYS 64 9.089 -7.488 19.904 525 1HB LYS 64 HB2 LYS 64 7.640 -8.047 17.916 526 2HB LYS 64 HB3 LYS 64 9.086 -8.383 16.993 527 1HG LYS 64 HG2 LYS 64 8.103 -10.444 17.802 528 2HG LYS 64 HG3 LYS 64 9.690 -10.225 18.512 529 1HD LYS 64 HD2 LYS 64 8.034 -11.098 20.123 530 2HD LYS 64 HD3 LYS 64 8.762 -9.591 20.658 531 1HE LYS 64 HE2 LYS 64 6.323 -9.669 21.096 532 2HE LYS 64 HE3 LYS 64 6.736 -8.332 20.022 533 1HZ LYS 64 HZ1 LYS 64 5.671 -10.940 19.178 534 2HZ LYS 64 HZ2 LYS 64 4.820 -9.530 19.270 535 3HZ LYS 64 HZ3 LYS 64 6.043 -9.684 18.177 536 H ASP 65 H ASP 65 11.105 -5.873 19.983 537 HA ASP 65 HA ASP 65 13.310 -5.604 20.150 538 1HB ASP 65 HB2 ASP 65 14.472 -7.464 21.365 539 2HB ASP 65 HB3 ASP 65 12.974 -6.860 22.068 540 H GLN 66 H GLN 66 13.848 -8.949 19.176 541 HA GLN 66 HA GLN 66 16.112 -8.199 17.542 542 1HB GLN 66 HB2 GLN 66 16.206 -10.164 18.818 543 2HB GLN 66 HB3 GLN 66 14.651 -10.756 18.259 544 1HG GLN 66 HG2 GLN 66 17.012 -10.457 16.356 545 2HG GLN 66 HG3 GLN 66 16.832 -11.872 17.396 546 1HE2 GLN 66 HE22 GLN 66 14.274 -12.640 17.376 547 2HE2 GLN 66 HE21 GLN 66 13.677 -12.903 15.748 548 H GLU 67 H GLU 67 12.684 -8.619 16.901 549 HA GLU 67 HA GLU 67 13.171 -8.602 13.966 550 1HB GLU 67 HB2 GLU 67 11.368 -10.392 13.840 551 2HB GLU 67 HB3 GLU 67 12.930 -10.903 14.478 552 1HG GLU 67 HG2 GLU 67 11.994 -10.683 16.830 553 2HG GLU 67 HG3 GLU 67 10.428 -10.291 16.105 554 H VAL 68 H VAL 68 11.353 -8.000 12.727 555 HA VAL 68 HA VAL 68 9.441 -6.220 14.177 556 HB VAL 68 HB VAL 68 10.743 -4.975 12.617 557 1HG1 VAL 68 HG11 VAL 68 11.483 -6.687 11.022 558 2HG1 VAL 68 HG12 VAL 68 9.825 -6.856 10.407 559 3HG1 VAL 68 HG13 VAL 68 10.702 -5.335 10.199 560 1HG2 VAL 68 HG21 VAL 68 8.922 -4.015 11.301 561 2HG2 VAL 68 HG22 VAL 68 7.942 -5.469 11.530 562 3HG2 VAL 68 HG23 VAL 68 8.344 -4.438 12.919 563 H ASN 69 H ASN 69 7.419 -6.945 14.320 564 HA ASN 69 HA ASN 69 6.601 -9.390 12.910 565 1HB ASN 69 HB2 ASN 69 5.949 -9.198 15.234 566 2HB ASN 69 HB3 ASN 69 5.206 -7.621 14.941 567 1HD2 ASN 69 HD21 ASN 69 4.942 -11.113 14.275 568 2HD2 ASN 69 HD22 ASN 69 3.240 -11.064 13.829 569 H PHE 70 H PHE 70 4.904 -9.457 11.382 570 HA PHE 70 HA PHE 70 4.770 -7.608 9.388 571 1HB PHE 70 HB2 PHE 70 3.900 -9.821 9.147 572 2HB PHE 70 HB3 PHE 70 2.674 -9.553 10.388 573 HD1 PHE 70 HD1 PHE 70 0.493 -9.012 9.674 574 HD2 PHE 70 HD2 PHE 70 3.848 -8.049 7.135 575 HE1 PHE 70 HE1 PHE 70 -1.039 -7.996 8.041 576 HE2 PHE 70 HE2 PHE 70 2.303 -7.034 5.489 577 HZ PHE 70 HZ PHE 70 -0.135 -6.937 5.969 578 H GLN 71 H GLN 71 2.450 -7.657 12.185 579 HA GLN 71 HA GLN 71 0.821 -5.537 11.169 580 1HB GLN 71 HB2 GLN 71 0.190 -7.104 13.014 581 2HB GLN 71 HB3 GLN 71 1.374 -6.309 14.065 582 1HG GLN 71 HG2 GLN 71 0.096 -4.132 13.740 583 2HG GLN 71 HG3 GLN 71 -1.089 -5.033 12.783 584 1HE2 GLN 71 HE22 GLN 71 0.537 -4.974 16.013 585 2HE2 GLN 71 HE21 GLN 71 -0.874 -5.570 16.882 586 H GLU 72 H GLU 72 3.806 -5.594 13.054 587 HA GLU 72 HA GLU 72 3.700 -2.783 13.800 588 1HB GLU 72 HB2 GLU 72 6.012 -4.745 14.025 589 2HB GLU 72 HB3 GLU 72 5.794 -3.210 14.881 590 1HG GLU 72 HG2 GLU 72 4.046 -5.715 15.177 591 2HG GLU 72 HG3 GLU 72 5.189 -5.102 16.358 592 H TYR 73 H TYR 73 5.298 -4.803 11.356 593 HA TYR 73 HA TYR 73 6.835 -2.788 10.050 594 1HB TYR 73 HB2 TYR 73 7.289 -4.914 9.330 595 2HB TYR 73 HB3 TYR 73 5.616 -5.419 9.277 596 HD1 TYR 73 HD1 TYR 73 8.262 -3.581 7.459 597 HD2 TYR 73 HD2 TYR 73 4.263 -5.221 7.274 598 HE1 TYR 73 HE1 TYR 73 8.303 -3.427 4.992 599 HE2 TYR 73 HE2 TYR 73 4.288 -4.979 4.825 600 HH TYR 73 HH TYR 73 7.091 -3.657 3.042 601 H ILE 74 H ILE 74 3.432 -3.869 9.402 602 HA ILE 74 HA ILE 74 2.893 -1.873 7.466 603 HB ILE 74 HB ILE 74 0.992 -3.180 9.449 604 1HG1 ILE 74 HG12 ILE 74 2.112 -4.768 7.857 605 2HG1 ILE 74 HG13 ILE 74 0.367 -4.709 7.778 606 1HG2 ILE 74 HG21 ILE 74 -0.730 -2.474 7.633 607 2HG2 ILE 74 HG22 ILE 74 -0.146 -1.256 8.766 608 3HG2 ILE 74 HG23 ILE 74 0.498 -1.319 7.109 609 1HD1 ILE 74 HD11 ILE 74 0.508 -3.274 5.727 610 2HD1 ILE 74 HD12 ILE 74 2.284 -3.422 5.811 611 3HD1 ILE 74 HD13 ILE 74 1.270 -4.845 5.535 612 H THR 75 H THR 75 2.197 -1.784 10.990 613 HA THR 75 HA THR 75 1.200 0.810 11.205 614 HB THR 75 HB THR 75 3.016 -0.712 13.129 615 HG1 THR 75 HG1 THR 75 1.188 -1.855 12.703 616 1HG2 THR 75 HG21 THR 75 1.833 0.639 14.887 617 2HG2 THR 75 HG22 THR 75 2.995 1.548 13.911 618 3HG2 THR 75 HG23 THR 75 1.261 1.728 13.602 619 H PHE 76 H PHE 76 4.650 -0.204 11.344 620 HA PHE 76 HA PHE 76 5.646 2.435 11.733 621 1HB PHE 76 HB2 PHE 76 6.924 0.396 12.273 622 2HB PHE 76 HB3 PHE 76 7.014 0.021 10.551 623 HD1 PHE 76 HD1 PHE 76 8.403 1.452 9.019 624 HD2 PHE 76 HD2 PHE 76 8.192 2.287 13.251 625 HE1 PHE 76 HE1 PHE 76 10.286 3.012 8.804 626 HE2 PHE 76 HE2 PHE 76 9.974 3.993 12.984 627 HZ PHE 76 HZ PHE 76 11.007 4.379 10.753 628 H LEU 77 H LEU 77 5.112 0.490 8.695 629 HA LEU 77 HA LEU 77 6.154 2.552 6.983 630 1HB LEU 77 HB2 LEU 77 4.108 0.356 6.535 631 2HB LEU 77 HB3 LEU 77 4.520 1.525 5.277 632 HG LEU 77 HG LEU 77 6.583 -0.259 6.650 633 1HD1 LEU 77 HD11 LEU 77 5.162 -0.527 3.966 634 2HD1 LEU 77 HD12 LEU 77 6.583 -1.455 4.463 635 3HD1 LEU 77 HD13 LEU 77 5.052 -1.642 5.355 636 1HD2 LEU 77 HD21 LEU 77 7.947 0.331 4.628 637 2HD2 LEU 77 HD22 LEU 77 6.697 1.493 4.150 638 3HD2 LEU 77 HD23 LEU 77 7.643 1.736 5.647 639 H GLY 78 H GLY 78 2.976 2.118 8.531 640 1HA GLY 78 HA2 GLY 78 1.712 4.408 7.431 641 2HA GLY 78 HA3 GLY 78 1.411 3.735 9.054 642 H ALA 79 H ALA 79 3.752 4.111 10.383 643 HA ALA 79 HA ALA 79 3.788 6.850 11.055 644 1HB ALA 79 HB1 ALA 79 6.141 4.942 11.425 645 2HB ALA 79 HB2 ALA 79 5.744 6.383 12.370 646 3HB ALA 79 HB3 ALA 79 4.702 4.950 12.461 647 H LEU 80 H LEU 80 5.975 5.050 8.887 648 HA LEU 80 HA LEU 80 7.695 7.143 8.182 649 1HB LEU 80 HB2 LEU 80 7.769 4.552 7.690 650 2HB LEU 80 HB3 LEU 80 6.828 4.958 6.261 651 HG LEU 80 HG LEU 80 8.700 6.586 5.629 652 1HD1 LEU 80 HD11 LEU 80 10.935 6.049 6.673 653 2HD1 LEU 80 HD12 LEU 80 9.836 6.821 7.821 654 3HD1 LEU 80 HD13 LEU 80 10.096 5.067 7.888 655 1HD2 LEU 80 HD21 LEU 80 10.141 4.769 4.779 656 2HD2 LEU 80 HD22 LEU 80 9.407 3.633 5.931 657 3HD2 LEU 80 HD23 LEU 80 8.432 4.330 4.614 658 H ALA 81 H ALA 81 4.658 6.027 6.686 659 HA ALA 81 HA ALA 81 4.519 7.894 4.552 660 1HB ALA 81 HB1 ALA 81 2.060 7.407 4.673 661 2HB ALA 81 HB2 ALA 81 3.105 5.966 4.543 662 3HB ALA 81 HB3 ALA 81 2.368 6.399 6.091 663 H MET 82 H MET 82 3.318 8.085 7.931 664 HA MET 82 HA MET 82 2.151 10.672 7.652 665 1HB MET 82 HB2 MET 82 1.835 8.962 9.512 666 2HB MET 82 HB3 MET 82 3.375 9.500 10.185 667 1HG MET 82 HG2 MET 82 2.512 11.699 10.609 668 2HG MET 82 HG3 MET 82 1.099 11.423 9.586 669 1HE MET 82 HE1 MET 82 2.845 10.384 12.961 670 2HE MET 82 HE2 MET 82 1.590 9.357 13.693 671 3HE MET 82 HE3 MET 82 2.456 8.799 12.248 672 H ILE 83 H ILE 83 5.397 9.597 8.653 673 HA ILE 83 HA ILE 83 6.498 12.151 9.234 674 HB ILE 83 HB ILE 83 7.726 9.470 8.555 675 1HG1 ILE 83 HG12 ILE 83 7.782 11.056 11.159 676 2HG1 ILE 83 HG13 ILE 83 6.446 9.979 10.767 677 1HG2 ILE 83 HG21 ILE 83 9.180 12.029 9.347 678 2HG2 ILE 83 HG22 ILE 83 9.908 10.411 9.348 679 3HG2 ILE 83 HG23 ILE 83 9.379 11.121 7.832 680 1HD1 ILE 83 HD11 ILE 83 9.353 9.140 11.095 681 2HD1 ILE 83 HD12 ILE 83 7.988 8.783 12.163 682 3HD1 ILE 83 HD13 ILE 83 8.045 8.073 10.540 683 H TYR 84 H TYR 84 6.258 10.367 6.122 684 HA TYR 84 HA TYR 84 7.813 12.097 4.530 685 1HB TYR 84 HB2 TYR 84 5.092 10.929 3.834 686 2HB TYR 84 HB3 TYR 84 6.203 11.679 2.711 687 HD1 TYR 84 HD1 TYR 84 8.507 9.887 4.578 688 HD2 TYR 84 HD2 TYR 84 5.192 9.236 1.886 689 HE1 TYR 84 HE1 TYR 84 9.666 7.945 3.593 690 HE2 TYR 84 HE2 TYR 84 6.422 7.396 0.818 691 HH TYR 84 HH TYR 84 8.466 6.266 0.677 692 H ASN 85 H ASN 85 4.632 12.688 5.989 693 HA ASN 85 HA ASN 85 3.330 14.461 6.275 694 1HB ASN 85 HB2 ASN 85 5.980 15.902 5.876 695 2HB ASN 85 HB3 ASN 85 4.470 16.784 6.031 696 1HD2 ASN 85 HD22 ASN 85 6.620 14.494 7.771 697 2HD2 ASN 85 HD21 ASN 85 5.985 14.933 9.349 698 H GLU 86 H GLU 86 5.377 15.469 3.580 699 HA GLU 86 HA GLU 86 3.420 16.955 2.178 700 1HB GLU 86 HB2 GLU 86 5.795 15.499 0.945 701 2HB GLU 86 HB3 GLU 86 4.950 16.925 0.324 702 1HG GLU 86 HG2 GLU 86 6.752 16.752 2.783 703 2HG GLU 86 HG3 GLU 86 7.004 17.682 1.311 704 H ALA 87 H ALA 87 4.183 13.499 2.098 705 HA ALA 87 HA ALA 87 2.636 12.752 -0.146 706 1HB ALA 87 HB1 ALA 87 4.210 11.256 1.031 707 2HB ALA 87 HB2 ALA 87 3.109 11.196 2.432 708 3HB ALA 87 HB3 ALA 87 2.603 10.522 0.868 709 H LEU 88 H LEU 88 1.614 13.556 3.175 710 HA LEU 88 HA LEU 88 -1.191 12.730 2.649 711 1HB LEU 88 HB2 LEU 88 0.226 14.052 5.010 712 2HB LEU 88 HB3 LEU 88 -1.519 13.905 4.886 713 HG LEU 88 HG LEU 88 -0.382 12.251 6.345 714 1HD1 LEU 88 HD11 LEU 88 -2.135 11.208 4.098 715 2HD1 LEU 88 HD12 LEU 88 -1.785 10.346 5.606 716 3HD1 LEU 88 HD13 LEU 88 -2.646 11.892 5.649 717 1HD2 LEU 88 HD21 LEU 88 0.696 10.299 5.438 718 2HD2 LEU 88 HD22 LEU 88 0.512 10.889 3.780 719 3HD2 LEU 88 HD23 LEU 88 1.577 11.749 4.918 720 H LYS 89 H LYS 89 0.688 15.666 3.439 721 HA LYS 89 HA LYS 89 -1.491 17.444 3.321 722 1HB LYS 89 HB2 LYS 89 1.478 17.969 2.943 723 2HB LYS 89 HB3 LYS 89 0.257 19.221 3.221 724 1HG LYS 89 HG2 LYS 89 -0.346 18.252 5.373 725 2HG LYS 89 HG3 LYS 89 0.772 16.896 5.140 726 1HD LYS 89 HD2 LYS 89 2.664 18.575 4.985 727 2HD LYS 89 HD3 LYS 89 1.514 19.825 5.488 728 1HE LYS 89 HE2 LYS 89 2.248 17.288 7.043 729 2HE LYS 89 HE3 LYS 89 2.797 18.929 7.418 730 1HZ LYS 89 HZ1 LYS 89 0.048 17.906 7.531 731 2HZ LYS 89 HZ2 LYS 89 1.004 18.318 8.800 732 3HZ LYS 89 HZ3 LYS 89 0.459 19.490 7.775 733 H GLY 90 H GLY 90 0.778 16.508 0.729 734 1HA GLY 90 HA2 GLY 90 -0.399 18.302 -1.258 735 2HA GLY 90 HA3 GLY 90 0.811 17.030 -1.500 736 1H MET 1 H1 MET 1 15.118 -1.036 -6.669 737 2H MET 1 H2 MET 1 14.634 -1.332 -5.119 738 3H MET 1 H3 MET 1 14.768 0.210 -5.643 739 HA MET 1 HA MET 1 13.049 -0.100 -7.253 740 1HB MET 1 HB2 MET 1 11.615 -2.127 -7.086 741 2HB MET 1 HB3 MET 1 13.229 -2.361 -7.762 742 1HG MET 1 HG2 MET 1 14.019 -3.345 -5.650 743 2HG MET 1 HG3 MET 1 12.449 -3.033 -4.905 744 1HE MET 1 HE1 MET 1 14.425 -5.151 -7.518 745 2HE MET 1 HE2 MET 1 13.161 -6.239 -8.138 746 3HE MET 1 HE3 MET 1 13.126 -4.516 -8.562 747 H ALA 2 H ALA 2 12.933 1.706 -5.756 748 HA ALA 2 HA ALA 2 11.485 1.434 -3.264 749 1HB ALA 2 HB1 ALA 2 12.241 3.896 -4.905 750 2HB ALA 2 HB2 ALA 2 11.714 3.886 -3.214 751 3HB ALA 2 HB3 ALA 2 13.248 3.125 -3.665 752 H SER 3 H SER 3 10.750 2.848 -6.484 753 HA SER 3 HA SER 3 8.411 4.006 -6.105 754 1HB SER 3 HB2 SER 3 8.717 2.470 -8.663 755 2HB SER 3 HB3 SER 3 8.305 4.161 -8.369 756 HG SER 3 HG SER 3 10.458 3.958 -9.130 757 HA PRO 4 HA PRO 4 5.879 -0.117 -6.885 758 1HB PRO 4 HB2 PRO 4 7.807 -1.948 -5.444 759 2HB PRO 4 HB3 PRO 4 6.619 -2.352 -6.717 760 1HG PRO 4 HG2 PRO 4 9.210 -2.058 -7.390 761 2HG PRO 4 HG3 PRO 4 7.970 -1.242 -8.393 762 1HD PRO 4 HD2 PRO 4 9.581 -0.073 -6.119 763 2HD PRO 4 HD3 PRO 4 9.407 0.575 -7.769 764 H LEU 5 H LEU 5 7.934 0.288 -3.896 765 HA LEU 5 HA LEU 5 5.626 -0.438 -2.244 766 1HB LEU 5 HB2 LEU 5 7.845 -0.945 -1.387 767 2HB LEU 5 HB3 LEU 5 8.305 0.763 -1.473 768 HG LEU 5 HG LEU 5 6.589 1.359 0.198 769 1HD1 LEU 5 HD11 LEU 5 5.937 -1.629 0.272 770 2HD1 LEU 5 HD12 LEU 5 5.399 -0.414 1.448 771 3HD1 LEU 5 HD13 LEU 5 4.826 -0.324 -0.212 772 1HD2 LEU 5 HD21 LEU 5 8.822 0.650 0.970 773 2HD2 LEU 5 HD22 LEU 5 7.519 0.297 2.127 774 3HD2 LEU 5 HD23 LEU 5 8.202 -1.020 1.134 775 H ASP 6 H ASP 6 7.474 2.519 -3.100 776 HA ASP 6 HA ASP 6 6.047 4.304 -1.482 777 1HB ASP 6 HB2 ASP 6 7.491 4.782 -4.087 778 2HB ASP 6 HB3 ASP 6 6.708 6.077 -3.172 779 H GLN 7 H GLN 7 5.193 3.276 -4.845 780 HA GLN 7 HA GLN 7 2.876 4.967 -4.944 781 1HB GLN 7 HB2 GLN 7 2.193 3.723 -6.859 782 2HB GLN 7 HB3 GLN 7 3.941 3.972 -6.913 783 1HG GLN 7 HG2 GLN 7 4.123 1.595 -5.899 784 2HG GLN 7 HG3 GLN 7 2.415 1.395 -6.270 785 1HE2 GLN 7 HE22 GLN 7 5.506 2.411 -7.705 786 2HE2 GLN 7 HE21 GLN 7 5.206 1.740 -9.321 787 H ALA 8 H ALA 8 3.382 1.689 -3.578 788 HA ALA 8 HA ALA 8 0.583 1.090 -3.322 789 1HB ALA 8 HB1 ALA 8 2.134 -0.675 -3.336 790 2HB ALA 8 HB2 ALA 8 3.006 -0.062 -1.908 791 3HB ALA 8 HB3 ALA 8 1.341 -0.651 -1.750 792 H ILE 9 H ILE 9 3.046 2.269 -0.921 793 HA ILE 9 HA ILE 9 1.058 2.758 1.112 794 HB ILE 9 HB ILE 9 2.698 4.164 2.242 795 1HG1 ILE 9 HG12 ILE 9 4.447 3.723 -0.174 796 2HG1 ILE 9 HG13 ILE 9 3.788 5.282 0.346 797 1HG2 ILE 9 HG21 ILE 9 2.653 1.682 2.378 798 2HG2 ILE 9 HG22 ILE 9 3.969 1.634 1.183 799 3HG2 ILE 9 HG23 ILE 9 4.209 2.402 2.769 800 1HD1 ILE 9 HD11 ILE 9 5.083 5.068 2.489 801 2HD1 ILE 9 HD12 ILE 9 5.839 3.589 1.849 802 3HD1 ILE 9 HD13 ILE 9 6.102 5.123 1.036 803 H GLY 10 H GLY 10 2.361 4.788 -1.515 804 1HA GLY 10 HA2 GLY 10 0.970 7.152 -1.326 805 2HA GLY 10 HA3 GLY 10 1.293 6.284 -2.829 806 H LEU 11 H LEU 11 -0.308 4.043 -2.636 807 HA LEU 11 HA LEU 11 -2.824 4.975 -3.418 808 1HB LEU 11 HB2 LEU 11 -1.590 2.682 -3.780 809 2HB LEU 11 HB3 LEU 11 -2.358 2.200 -2.276 810 HG LEU 11 HG LEU 11 -3.640 1.337 -4.026 811 1HD1 LEU 11 HD11 LEU 11 -5.206 3.785 -3.192 812 2HD1 LEU 11 HD12 LEU 11 -5.823 2.204 -3.698 813 3HD1 LEU 11 HD13 LEU 11 -4.943 2.348 -2.164 814 1HD2 LEU 11 HD21 LEU 11 -2.789 2.686 -5.850 815 2HD2 LEU 11 HD22 LEU 11 -4.557 2.581 -5.887 816 3HD2 LEU 11 HD23 LEU 11 -3.775 4.073 -5.324 817 H LEU 12 H LEU 12 -2.011 3.264 -0.362 818 HA LEU 12 HA LEU 12 -4.503 3.573 0.948 819 1HB LEU 12 HB2 LEU 12 -1.627 3.406 2.001 820 2HB LEU 12 HB3 LEU 12 -3.024 3.538 3.067 821 HG LEU 12 HG LEU 12 -3.968 1.470 2.169 822 1HD1 LEU 12 HD11 LEU 12 -1.296 1.187 0.724 823 2HD1 LEU 12 HD12 LEU 12 -2.488 -0.107 0.916 824 3HD1 LEU 12 HD13 LEU 12 -2.896 1.305 -0.054 825 1HD2 LEU 12 HD21 LEU 12 -1.144 1.284 3.296 826 2HD2 LEU 12 HD22 LEU 12 -2.656 1.431 4.221 827 3HD2 LEU 12 HD23 LEU 12 -2.330 -0.035 3.303 828 H ILE 13 H ILE 13 -1.668 5.724 0.894 829 HA ILE 13 HA ILE 13 -2.656 7.656 2.736 830 HB ILE 13 HB ILE 13 -0.658 7.771 0.441 831 1HG1 ILE 13 HG12 ILE 13 -0.107 7.950 3.420 832 2HG1 ILE 13 HG13 ILE 13 -0.270 6.385 2.623 833 1HG2 ILE 13 HG21 ILE 13 0.185 9.897 1.451 834 2HG2 ILE 13 HG22 ILE 13 -1.405 10.066 0.710 835 3HG2 ILE 13 HG23 ILE 13 -1.264 9.935 2.474 836 1HD1 ILE 13 HD11 ILE 13 2.016 6.719 2.534 837 2HD1 ILE 13 HD12 ILE 13 1.528 7.284 0.943 838 3HD1 ILE 13 HD13 ILE 13 1.878 8.464 2.222 839 H GLY 14 H GLY 14 -2.751 7.605 -0.846 840 1HA GLY 14 HA2 GLY 14 -4.154 10.005 -1.261 841 2HA GLY 14 HA3 GLY 14 -4.156 8.595 -2.341 842 H ILE 15 H ILE 15 -5.414 6.622 -1.038 843 HA ILE 15 HA ILE 15 -8.161 7.236 -1.296 844 HB ILE 15 HB ILE 15 -6.526 4.966 -0.218 845 1HG1 ILE 15 HG12 ILE 15 -8.859 5.264 -2.172 846 2HG1 ILE 15 HG13 ILE 15 -7.139 5.164 -2.578 847 1HG2 ILE 15 HG21 ILE 15 -9.468 5.205 0.453 848 2HG2 ILE 15 HG22 ILE 15 -8.484 3.729 0.604 849 3HG2 ILE 15 HG23 ILE 15 -8.094 5.117 1.590 850 1HD1 ILE 15 HD11 ILE 15 -7.152 2.851 -1.488 851 2HD1 ILE 15 HD12 ILE 15 -8.923 2.972 -1.452 852 3HD1 ILE 15 HD13 ILE 15 -8.075 3.017 -3.000 853 H PHE 16 H PHE 16 -6.133 7.070 1.639 854 HA PHE 16 HA PHE 16 -8.232 7.696 3.439 855 1HB PHE 16 HB2 PHE 16 -6.025 6.736 4.008 856 2HB PHE 16 HB3 PHE 16 -5.231 8.252 3.664 857 HD1 PHE 16 HD1 PHE 16 -7.507 6.462 5.957 858 HD2 PHE 16 HD2 PHE 16 -5.515 10.208 5.199 859 HE1 PHE 16 HE1 PHE 16 -7.727 7.065 8.347 860 HE2 PHE 16 HE2 PHE 16 -5.949 10.895 7.527 861 HZ PHE 16 HZ PHE 16 -6.899 9.236 9.151 862 H HIS 17 H HIS 17 -5.615 9.889 2.296 863 HA HIS 17 HA HIS 17 -6.815 11.979 3.742 864 1HB HIS 17 HB2 HIS 17 -4.317 11.560 3.008 865 2HB HIS 17 HB3 HIS 17 -4.751 12.616 1.663 866 HD1 HIS 17 HD1 HIS 17 -3.756 14.937 2.382 867 HD2 HIS 17 HD2 HIS 17 -5.409 12.737 5.562 868 HE1 HIS 17 HE1 HIS 17 -3.527 16.375 4.459 869 H LYS 18 H LYS 18 -7.381 10.974 0.416 870 HA LYS 18 HA LYS 18 -8.628 13.464 -0.410 871 1HB LYS 18 HB2 LYS 18 -9.107 10.571 -1.223 872 2HB LYS 18 HB3 LYS 18 -10.020 11.942 -1.879 873 1HG LYS 18 HG2 LYS 18 -7.814 13.015 -2.534 874 2HG LYS 18 HG3 LYS 18 -7.027 11.487 -2.163 875 1HD LYS 18 HD2 LYS 18 -9.203 12.045 -4.239 876 2HD LYS 18 HD3 LYS 18 -7.517 11.637 -4.561 877 1HE LYS 18 HE2 LYS 18 -9.650 9.791 -3.376 878 2HE LYS 18 HE3 LYS 18 -8.940 9.700 -4.991 879 1HZ LYS 18 HZ1 LYS 18 -7.946 8.138 -3.506 880 2HZ LYS 18 HZ2 LYS 18 -6.824 9.254 -3.974 881 3HZ LYS 18 HZ3 LYS 18 -7.495 9.339 -2.467 882 H TYR 19 H TYR 19 -9.793 10.587 1.411 883 HA TYR 19 HA TYR 19 -12.489 11.658 1.641 884 1HB TYR 19 HB2 TYR 19 -11.042 9.250 2.596 885 2HB TYR 19 HB3 TYR 19 -12.394 9.804 3.583 886 HD1 TYR 19 HD1 TYR 19 -11.459 8.463 0.262 887 HD2 TYR 19 HD2 TYR 19 -14.677 9.868 2.762 888 HE1 TYR 19 HE1 TYR 19 -13.105 7.443 -1.275 889 HE2 TYR 19 HE2 TYR 19 -16.318 9.004 1.124 890 HH TYR 19 HH TYR 19 -16.295 6.903 -0.403 891 H SER 20 H SER 20 -9.623 11.582 3.884 892 HA SER 20 HA SER 20 -10.773 13.086 5.957 893 1HB SER 20 HB2 SER 20 -7.996 13.540 4.803 894 2HB SER 20 HB3 SER 20 -8.574 13.993 6.405 895 HG SER 20 HG SER 20 -8.584 11.962 7.045 896 H GLY 21 H GLY 21 -9.389 14.266 2.868 897 1HA GLY 21 HA2 GLY 21 -9.560 16.970 3.000 898 2HA GLY 21 HA3 GLY 21 -9.950 16.026 1.557 899 H LYS 22 H LYS 22 -12.367 14.771 2.819 900 HA LYS 22 HA LYS 22 -14.362 16.595 1.999 901 1HB LYS 22 HB2 LYS 22 -14.474 14.096 2.249 902 2HB LYS 22 HB3 LYS 22 -14.613 14.320 3.996 903 1HG LYS 22 HG2 LYS 22 -16.673 15.684 3.631 904 2HG LYS 22 HG3 LYS 22 -16.567 15.352 1.897 905 1HD LYS 22 HD2 LYS 22 -16.981 13.356 4.175 906 2HD LYS 22 HD3 LYS 22 -18.172 13.828 2.963 907 1HE LYS 22 HE2 LYS 22 -15.637 12.191 2.484 908 2HE LYS 22 HE3 LYS 22 -17.305 11.619 2.436 909 1HZ LYS 22 HZ1 LYS 22 -16.456 12.008 0.259 910 2HZ LYS 22 HZ2 LYS 22 -17.685 13.063 0.566 911 3HZ LYS 22 HZ3 LYS 22 -16.120 13.582 0.607 912 H GLU 23 H GLU 23 -12.900 15.993 5.191 913 HA GLU 23 HA GLU 23 -14.489 18.205 6.409 914 1HB GLU 23 HB2 GLU 23 -13.516 17.414 8.549 915 2HB GLU 23 HB3 GLU 23 -14.635 16.299 7.756 916 1HG GLU 23 HG2 GLU 23 -12.800 14.898 6.977 917 2HG GLU 23 HG3 GLU 23 -11.605 16.019 7.656 918 H GLY 24 H GLY 24 -11.106 17.173 5.697 919 1HA GLY 24 HA2 GLY 24 -10.184 19.653 4.957 920 2HA GLY 24 HA3 GLY 24 -9.920 19.610 6.717 921 H ASP 25 H ASP 25 -7.620 19.801 5.416 922 HA ASP 25 HA ASP 25 -6.508 17.245 4.562 923 1HB ASP 25 HB2 ASP 25 -4.469 18.511 4.230 924 2HB ASP 25 HB3 ASP 25 -5.833 19.389 3.538 925 H LYS 26 H LYS 26 -7.518 16.672 6.933 926 HA LYS 26 HA LYS 26 -5.531 17.027 9.113 927 1HB LYS 26 HB2 LYS 26 -8.356 15.881 9.058 928 2HB LYS 26 HB3 LYS 26 -7.357 16.138 10.499 929 1HG LYS 26 HG2 LYS 26 -7.505 18.522 10.315 930 2HG LYS 26 HG3 LYS 26 -8.145 18.441 8.673 931 1HD LYS 26 HD2 LYS 26 -9.958 18.971 10.170 932 2HD LYS 26 HD3 LYS 26 -10.211 17.375 9.456 933 1HE LYS 26 HE2 LYS 26 -9.365 16.316 11.566 934 2HE LYS 26 HE3 LYS 26 -9.148 17.933 12.270 935 1HZ LYS 26 HZ1 LYS 26 -11.524 18.241 11.980 936 2HZ LYS 26 HZ2 LYS 26 -11.659 16.716 11.355 937 3HZ LYS 26 HZ3 LYS 26 -11.199 16.926 12.922 938 H HIS 27 H HIS 27 -4.306 15.226 9.746 939 HA HIS 27 HA HIS 27 -4.424 12.840 8.058 940 1HB HIS 27 HB2 HIS 27 -2.651 13.444 10.437 941 2HB HIS 27 HB3 HIS 27 -2.410 12.185 9.218 942 HD1 HIS 27 HD1 HIS 27 -3.357 14.724 6.956 943 HD2 HIS 27 HD2 HIS 27 -0.119 14.314 9.632 944 HE1 HIS 27 HE1 HIS 27 -1.560 16.330 6.181 945 H THR 28 H THR 28 -6.834 12.935 9.122 946 HA THR 28 HA THR 28 -7.136 10.602 10.737 947 HB THR 28 HB THR 28 -6.684 12.018 12.570 948 HG1 THR 28 HG1 THR 28 -9.454 12.179 12.659 949 1HG2 THR 28 HG21 THR 28 -6.856 14.213 11.679 950 2HG2 THR 28 HG22 THR 28 -8.598 14.025 11.340 951 3HG2 THR 28 HG23 THR 28 -8.007 14.105 13.016 952 H LEU 29 H LEU 29 -9.466 10.019 10.702 953 HA LEU 29 HA LEU 29 -11.028 11.414 8.555 954 1HB LEU 29 HB2 LEU 29 -9.256 9.743 7.783 955 2HB LEU 29 HB3 LEU 29 -10.261 8.462 8.453 956 HG LEU 29 HG LEU 29 -11.127 10.460 6.296 957 1HD1 LEU 29 HD11 LEU 29 -10.587 8.631 4.706 958 2HD1 LEU 29 HD12 LEU 29 -9.155 9.211 5.564 959 3HD1 LEU 29 HD13 LEU 29 -9.918 7.674 6.035 960 1HD2 LEU 29 HD21 LEU 29 -12.180 7.716 7.105 961 2HD2 LEU 29 HD22 LEU 29 -13.020 9.256 7.378 962 3HD2 LEU 29 HD23 LEU 29 -12.764 8.661 5.726 963 H SER 30 H SER 30 -13.260 11.311 8.980 964 HA SER 30 HA SER 30 -13.890 10.274 11.615 965 1HB SER 30 HB2 SER 30 -16.157 11.349 11.082 966 2HB SER 30 HB3 SER 30 -14.740 12.401 11.175 967 HG SER 30 HG SER 30 -14.792 12.748 9.091 968 H LYS 31 H LYS 31 -15.989 9.105 12.077 969 HA LYS 31 HA LYS 31 -15.651 6.541 11.141 970 1HB LYS 31 HB2 LYS 31 -17.637 6.004 12.467 971 2HB LYS 31 HB3 LYS 31 -16.528 7.107 13.278 972 1HG LYS 31 HG2 LYS 31 -18.148 9.000 12.382 973 2HG LYS 31 HG3 LYS 31 -19.306 7.662 12.244 974 1HD LYS 31 HD2 LYS 31 -17.751 8.514 14.727 975 2HD LYS 31 HD3 LYS 31 -19.447 8.886 14.400 976 1HE LYS 31 HE2 LYS 31 -20.017 6.483 14.474 977 2HE LYS 31 HE3 LYS 31 -18.317 6.067 14.762 978 1HZ LYS 31 HZ1 LYS 31 -19.960 7.723 16.530 979 2HZ LYS 31 HZ2 LYS 31 -19.558 6.140 16.780 980 3HZ LYS 31 HZ3 LYS 31 -18.387 7.300 16.778 981 H LYS 32 H LYS 32 -18.456 8.629 10.312 982 HA LYS 32 HA LYS 32 -19.491 6.630 8.471 983 1HB LYS 32 HB2 LYS 32 -20.984 8.150 9.581 984 2HB LYS 32 HB3 LYS 32 -20.232 9.557 8.784 985 1HG LYS 32 HG2 LYS 32 -20.943 8.660 6.575 986 2HG LYS 32 HG3 LYS 32 -21.652 7.245 7.376 987 1HD LYS 32 HD2 LYS 32 -23.188 8.776 8.636 988 2HD LYS 32 HD3 LYS 32 -22.512 10.156 7.755 989 1HE LYS 32 HE2 LYS 32 -23.972 7.767 6.515 990 2HE LYS 32 HE3 LYS 32 -24.648 9.383 6.766 991 1HZ LYS 32 HZ1 LYS 32 -22.973 10.242 5.280 992 2HZ LYS 32 HZ2 LYS 32 -22.386 8.725 5.011 993 3HZ LYS 32 HZ3 LYS 32 -23.914 9.110 4.539 994 H GLU 33 H GLU 33 -17.351 9.406 8.186 995 HA GLU 33 HA GLU 33 -17.187 9.604 5.351 996 1HB GLU 33 HB2 GLU 33 -16.438 11.236 7.057 997 2HB GLU 33 HB3 GLU 33 -15.131 10.150 7.523 998 1HG GLU 33 HG2 GLU 33 -14.131 10.434 5.254 999 2HG GLU 33 HG3 GLU 33 -15.466 11.517 4.832 1000 H LEU 34 H LEU 34 -15.332 7.653 7.752 1001 HA LEU 34 HA LEU 34 -13.781 6.176 5.898 1002 1HB LEU 34 HB2 LEU 34 -13.203 6.110 8.219 1003 2HB LEU 34 HB3 LEU 34 -14.782 5.564 8.708 1004 HG LEU 34 HG LEU 34 -13.001 3.898 8.853 1005 1HD1 LEU 34 HD11 LEU 34 -15.504 3.325 8.558 1006 2HD1 LEU 34 HD12 LEU 34 -15.059 2.787 6.939 1007 3HD1 LEU 34 HD13 LEU 34 -14.315 2.044 8.343 1008 1HD2 LEU 34 HD21 LEU 34 -13.026 3.944 5.802 1009 2HD2 LEU 34 HD22 LEU 34 -11.684 4.385 6.871 1010 3HD2 LEU 34 HD23 LEU 34 -12.254 2.706 6.765 1011 H LYS 35 H LYS 35 -17.024 5.477 7.352 1012 HA LYS 35 HA LYS 35 -17.424 3.077 5.999 1013 1HB LYS 35 HB2 LYS 35 -18.911 4.226 7.743 1014 2HB LYS 35 HB3 LYS 35 -19.688 5.068 6.383 1015 1HG LYS 35 HG2 LYS 35 -20.182 2.844 5.341 1016 2HG LYS 35 HG3 LYS 35 -19.382 2.056 6.716 1017 1HD LYS 35 HD2 LYS 35 -21.047 3.149 8.254 1018 2HD LYS 35 HD3 LYS 35 -21.883 3.788 6.820 1019 1HE LYS 35 HE2 LYS 35 -22.102 1.402 5.981 1020 2HE LYS 35 HE3 LYS 35 -21.387 0.848 7.504 1021 1HZ LYS 35 HZ1 LYS 35 -23.788 0.807 7.530 1022 2HZ LYS 35 HZ2 LYS 35 -23.236 1.890 8.644 1023 3HZ LYS 35 HZ3 LYS 35 -23.869 2.420 7.217 1024 H GLU 36 H GLU 36 -18.008 6.366 4.806 1025 HA GLU 36 HA GLU 36 -18.998 5.680 2.235 1026 1HB GLU 36 HB2 GLU 36 -19.066 7.911 3.586 1027 2HB GLU 36 HB3 GLU 36 -17.466 8.214 2.927 1028 1HG GLU 36 HG2 GLU 36 -19.085 9.324 1.525 1029 2HG GLU 36 HG3 GLU 36 -18.477 7.946 0.595 1030 H LEU 37 H LEU 37 -15.670 6.295 3.414 1031 HA LEU 37 HA LEU 37 -14.275 5.973 0.941 1032 1HB LEU 37 HB2 LEU 37 -13.208 6.777 2.962 1033 2HB LEU 37 HB3 LEU 37 -13.460 5.261 3.789 1034 HG LEU 37 HG LEU 37 -11.730 5.424 1.322 1035 1HD1 LEU 37 HD11 LEU 37 -9.834 5.527 2.990 1036 2HD1 LEU 37 HD12 LEU 37 -10.850 6.972 2.977 1037 3HD1 LEU 37 HD13 LEU 37 -11.024 5.763 4.277 1038 1HD2 LEU 37 HD21 LEU 37 -12.280 3.090 1.906 1039 2HD2 LEU 37 HD22 LEU 37 -10.646 3.417 2.445 1040 3HD2 LEU 37 HD23 LEU 37 -11.961 3.406 3.628 1041 H ILE 38 H ILE 38 -15.245 3.541 3.354 1042 HA ILE 38 HA ILE 38 -14.327 1.343 1.811 1043 HB ILE 38 HB ILE 38 -16.435 1.553 3.984 1044 1HG1 ILE 38 HG12 ILE 38 -13.515 0.644 3.871 1045 2HG1 ILE 38 HG13 ILE 38 -14.128 2.131 4.604 1046 1HG2 ILE 38 HG21 ILE 38 -16.474 -0.806 4.220 1047 2HG2 ILE 38 HG22 ILE 38 -16.809 -0.525 2.516 1048 3HG2 ILE 38 HG23 ILE 38 -15.192 -1.050 3.033 1049 1HD1 ILE 38 HD11 ILE 38 -15.507 0.648 6.164 1050 2HD1 ILE 38 HD12 ILE 38 -14.532 -0.708 5.537 1051 3HD1 ILE 38 HD13 ILE 38 -13.734 0.656 6.351 1052 H GLN 39 H GLN 39 -17.657 2.774 1.959 1053 HA GLN 39 HA GLN 39 -18.723 0.868 0.185 1054 1HB GLN 39 HB2 GLN 39 -19.636 3.769 0.444 1055 2HB GLN 39 HB3 GLN 39 -20.532 2.437 -0.280 1056 1HG GLN 39 HG2 GLN 39 -20.201 3.122 2.587 1057 2HG GLN 39 HG3 GLN 39 -21.565 2.444 1.728 1058 1HE2 GLN 39 HE22 GLN 39 -18.677 1.747 3.555 1059 2HE2 GLN 39 HE21 GLN 39 -18.933 0.002 3.664 1060 H LYS 40 H LYS 40 -16.971 3.899 -0.634 1061 HA LYS 40 HA LYS 40 -17.496 3.449 -3.479 1062 1HB LYS 40 HB2 LYS 40 -17.123 5.687 -2.514 1063 2HB LYS 40 HB3 LYS 40 -15.451 5.236 -2.116 1064 1HG LYS 40 HG2 LYS 40 -14.955 4.872 -4.502 1065 2HG LYS 40 HG3 LYS 40 -16.617 5.252 -4.945 1066 1HD LYS 40 HD2 LYS 40 -14.659 7.143 -3.547 1067 2HD LYS 40 HD3 LYS 40 -14.941 7.115 -5.287 1068 1HE LYS 40 HE2 LYS 40 -17.009 7.845 -3.155 1069 2HE LYS 40 HE3 LYS 40 -16.172 8.950 -4.243 1070 1HZ LYS 40 HZ1 LYS 40 -17.217 7.832 -6.086 1071 2HZ LYS 40 HZ2 LYS 40 -18.028 6.830 -5.056 1072 3HZ LYS 40 HZ3 LYS 40 -18.334 8.447 -5.042 1073 H GLU 41 H GLU 41 -14.550 3.147 -1.424 1074 HA GLU 41 HA GLU 41 -13.028 2.188 -3.700 1075 1HB GLU 41 HB2 GLU 41 -12.309 2.256 -0.737 1076 2HB GLU 41 HB3 GLU 41 -11.189 2.019 -2.086 1077 1HG GLU 41 HG2 GLU 41 -12.829 4.541 -1.509 1078 2HG GLU 41 HG3 GLU 41 -11.100 4.327 -1.252 1079 H LEU 42 H LEU 42 -14.315 0.672 -0.748 1080 HA LEU 42 HA LEU 42 -13.434 -2.052 -1.651 1081 1HB LEU 42 HB2 LEU 42 -14.376 -0.940 1.008 1082 2HB LEU 42 HB3 LEU 42 -14.195 -2.658 0.689 1083 HG LEU 42 HG LEU 42 -12.405 -1.764 2.027 1084 1HD1 LEU 42 HD11 LEU 42 -12.033 -3.718 0.504 1085 2HD1 LEU 42 HD12 LEU 42 -11.293 -2.602 -0.665 1086 3HD1 LEU 42 HD13 LEU 42 -10.564 -2.827 0.930 1087 1HD2 LEU 42 HD21 LEU 42 -12.309 0.538 1.013 1088 2HD2 LEU 42 HD22 LEU 42 -10.746 -0.232 1.289 1089 3HD2 LEU 42 HD23 LEU 42 -11.406 -0.165 -0.353 1090 H THR 43 H THR 43 -15.187 -1.398 -3.380 1091 HA THR 43 HA THR 43 -17.814 -0.965 -2.638 1092 HB THR 43 HB THR 43 -17.124 -2.296 -5.256 1093 HG1 THR 43 HG1 THR 43 -16.260 0.311 -4.554 1094 1HG2 THR 43 HG21 THR 43 -18.523 -0.500 -6.155 1095 2HG2 THR 43 HG22 THR 43 -19.400 -1.367 -4.879 1096 3HG2 THR 43 HG23 THR 43 -18.685 0.228 -4.544 1097 H ILE 44 H ILE 44 -18.052 -2.558 -0.951 1098 HA ILE 44 HA ILE 44 -17.903 -5.197 -0.930 1099 HB ILE 44 HB ILE 44 -20.332 -3.797 0.250 1100 1HG1 ILE 44 HG12 ILE 44 -18.426 -2.455 0.928 1101 2HG1 ILE 44 HG13 ILE 44 -19.089 -3.348 2.268 1102 1HG2 ILE 44 HG21 ILE 44 -20.084 -5.488 2.073 1103 2HG2 ILE 44 HG22 ILE 44 -20.481 -6.195 0.509 1104 3HG2 ILE 44 HG23 ILE 44 -18.825 -6.294 1.116 1105 1HD1 ILE 44 HD11 ILE 44 -16.593 -4.211 0.733 1106 2HD1 ILE 44 HD12 ILE 44 -16.613 -3.339 2.274 1107 3HD1 ILE 44 HD13 ILE 44 -17.257 -4.984 2.189 1108 H GLY 45 H GLY 45 -20.690 -3.537 -2.321 1109 1HA GLY 45 HA2 GLY 45 -22.371 -4.287 -3.740 1110 2HA GLY 45 HA3 GLY 45 -21.548 -5.848 -3.896 1111 H SER 46 H SER 46 -21.491 -7.075 -1.666 1112 HA SER 46 HA SER 46 -24.161 -7.655 -0.797 1113 1HB SER 46 HB2 SER 46 -21.466 -8.476 0.357 1114 2HB SER 46 HB3 SER 46 -23.017 -9.289 0.636 1115 HG SER 46 HG SER 46 -21.688 -10.212 -1.074 1116 H LYS 47 H LYS 47 -24.313 -5.119 -0.237 1117 HA LYS 47 HA LYS 47 -23.264 -4.168 2.219 1118 1HB LYS 47 HB2 LYS 47 -25.581 -3.356 0.455 1119 2HB LYS 47 HB3 LYS 47 -25.445 -2.682 2.078 1120 1HG LYS 47 HG2 LYS 47 -24.404 -1.148 0.652 1121 2HG LYS 47 HG3 LYS 47 -23.134 -1.909 1.615 1122 1HD LYS 47 HD2 LYS 47 -22.647 -3.421 -0.365 1123 2HD LYS 47 HD3 LYS 47 -23.829 -2.498 -1.305 1124 1HE LYS 47 HE2 LYS 47 -21.220 -1.493 -0.058 1125 2HE LYS 47 HE3 LYS 47 -21.573 -1.681 -1.783 1126 1HZ LYS 47 HZ1 LYS 47 -23.248 0.023 -1.541 1127 2HZ LYS 47 HZ2 LYS 47 -22.832 0.225 0.045 1128 3HZ LYS 47 HZ3 LYS 47 -21.743 0.565 -1.140 1129 H LEU 48 H LEU 48 -25.558 -6.662 1.822 1130 HA LEU 48 HA LEU 48 -27.064 -6.526 4.209 1131 1HB LEU 48 HB2 LEU 48 -25.729 -8.899 2.821 1132 2HB LEU 48 HB3 LEU 48 -26.863 -9.040 4.158 1133 HG LEU 48 HG LEU 48 -27.981 -9.549 2.138 1134 1HD1 LEU 48 HD11 LEU 48 -29.250 -8.330 3.903 1135 2HD1 LEU 48 HD12 LEU 48 -28.976 -6.811 3.019 1136 3HD1 LEU 48 HD13 LEU 48 -29.910 -8.115 2.271 1137 1HD2 LEU 48 HD21 LEU 48 -27.492 -6.768 1.019 1138 2HD2 LEU 48 HD22 LEU 48 -26.556 -8.215 0.557 1139 3HD2 LEU 48 HD23 LEU 48 -28.299 -8.139 0.256 1140 H GLN 49 H GLN 49 -23.627 -7.110 3.682 1141 HA GLN 49 HA GLN 49 -23.024 -7.984 6.378 1142 1HB GLN 49 HB2 GLN 49 -21.299 -6.810 4.162 1143 2HB GLN 49 HB3 GLN 49 -20.680 -7.516 5.658 1144 1HG GLN 49 HG2 GLN 49 -21.695 -9.695 5.095 1145 2HG GLN 49 HG3 GLN 49 -22.365 -9.019 3.604 1146 1HE2 GLN 49 HE22 GLN 49 -19.188 -9.365 5.307 1147 2HE2 GLN 49 HE21 GLN 49 -18.284 -9.647 3.823 1148 H ASP 50 H ASP 50 -24.402 -5.102 5.691 1149 HA ASP 50 HA ASP 50 -22.879 -3.016 6.426 1150 1HB ASP 50 HB2 ASP 50 -25.260 -2.840 5.840 1151 2HB ASP 50 HB3 ASP 50 -25.722 -3.613 7.366 1152 H ALA 51 H ALA 51 -24.414 -5.243 8.732 1153 HA ALA 51 HA ALA 51 -23.681 -4.023 11.165 1154 1HB ALA 51 HB1 ALA 51 -23.855 -6.281 12.139 1155 2HB ALA 51 HB2 ALA 51 -25.187 -5.957 11.012 1156 3HB ALA 51 HB3 ALA 51 -23.834 -6.997 10.514 1157 H GLU 52 H GLU 52 -21.770 -6.152 9.032 1158 HA GLU 52 HA GLU 52 -19.527 -6.422 10.864 1159 1HB GLU 52 HB2 GLU 52 -19.588 -6.873 7.851 1160 2HB GLU 52 HB3 GLU 52 -18.392 -7.458 9.007 1161 1HG GLU 52 HG2 GLU 52 -20.179 -8.804 10.142 1162 2HG GLU 52 HG3 GLU 52 -21.331 -8.303 8.891 1163 H ILE 53 H ILE 53 -20.405 -4.415 8.025 1164 HA ILE 53 HA ILE 53 -17.958 -2.960 7.907 1165 HB ILE 53 HB ILE 53 -20.711 -1.868 7.219 1166 1HG1 ILE 53 HG12 ILE 53 -20.306 -3.959 5.970 1167 2HG1 ILE 53 HG13 ILE 53 -20.326 -2.542 4.930 1168 1HG2 ILE 53 HG21 ILE 53 -17.905 -0.990 6.397 1169 2HG2 ILE 53 HG22 ILE 53 -19.425 -0.377 5.707 1170 3HG2 ILE 53 HG23 ILE 53 -19.046 -0.104 7.407 1171 1HD1 ILE 53 HD11 ILE 53 -17.912 -2.568 4.725 1172 2HD1 ILE 53 HD12 ILE 53 -17.767 -3.871 5.934 1173 3HD1 ILE 53 HD13 ILE 53 -18.538 -4.188 4.376 1174 H VAL 54 H VAL 54 -20.936 -2.267 9.836 1175 HA VAL 54 HA VAL 54 -19.648 0.090 10.890 1176 HB VAL 54 HB VAL 54 -21.476 0.297 12.493 1177 1HG1 VAL 54 HG11 VAL 54 -21.370 1.408 10.273 1178 2HG1 VAL 54 HG12 VAL 54 -22.212 0.011 9.564 1179 3HG1 VAL 54 HG13 VAL 54 -23.035 1.039 10.759 1180 1HG2 VAL 54 HG21 VAL 54 -22.797 -1.973 11.005 1181 2HG2 VAL 54 HG22 VAL 54 -22.150 -2.101 12.657 1182 3HG2 VAL 54 HG23 VAL 54 -23.481 -0.988 12.298 1183 H LYS 55 H LYS 55 -19.765 -3.276 12.102 1184 HA LYS 55 HA LYS 55 -18.501 -2.618 14.599 1185 1HB LYS 55 HB2 LYS 55 -19.419 -4.816 14.256 1186 2HB LYS 55 HB3 LYS 55 -18.375 -5.107 12.866 1187 1HG LYS 55 HG2 LYS 55 -17.652 -6.290 14.938 1188 2HG LYS 55 HG3 LYS 55 -16.412 -5.278 14.205 1189 1HD LYS 55 HD2 LYS 55 -16.358 -5.116 16.633 1190 2HD LYS 55 HD3 LYS 55 -16.712 -3.551 15.928 1191 1HE LYS 55 HE2 LYS 55 -19.152 -3.893 16.443 1192 2HE LYS 55 HE3 LYS 55 -18.744 -5.446 17.194 1193 1HZ LYS 55 HZ1 LYS 55 -17.699 -2.822 18.019 1194 2HZ LYS 55 HZ2 LYS 55 -18.916 -3.645 18.771 1195 3HZ LYS 55 HZ3 LYS 55 -17.389 -4.263 18.752 1196 H LEU 56 H LEU 56 -17.145 -3.474 11.390 1197 HA LEU 56 HA LEU 56 -14.415 -3.070 11.981 1198 1HB LEU 56 HB2 LEU 56 -15.041 -4.200 10.049 1199 2HB LEU 56 HB3 LEU 56 -16.094 -2.920 9.467 1200 HG LEU 56 HG LEU 56 -13.207 -2.200 9.770 1201 1HD1 LEU 56 HD11 LEU 56 -12.683 -3.180 7.549 1202 2HD1 LEU 56 HD12 LEU 56 -13.032 -4.436 8.751 1203 3HD1 LEU 56 HD13 LEU 56 -14.259 -3.995 7.541 1204 1HD2 LEU 56 HD21 LEU 56 -14.944 -0.578 8.897 1205 2HD2 LEU 56 HD22 LEU 56 -13.665 -0.986 7.746 1206 3HD2 LEU 56 HD23 LEU 56 -15.291 -1.708 7.588 1207 H MET 57 H MET 57 -16.867 -0.700 10.889 1208 HA MET 57 HA MET 57 -15.224 1.578 10.724 1209 1HB MET 57 HB2 MET 57 -17.607 1.454 9.924 1210 2HB MET 57 HB3 MET 57 -18.120 1.386 11.620 1211 1HG MET 57 HG2 MET 57 -17.094 3.646 11.987 1212 2HG MET 57 HG3 MET 57 -16.774 3.712 10.260 1213 1HE MET 57 HE1 MET 57 -19.388 3.877 13.117 1214 2HE MET 57 HE2 MET 57 -20.936 3.927 12.244 1215 3HE MET 57 HE3 MET 57 -19.997 2.422 12.294 1216 H ASP 58 H ASP 58 -17.207 0.375 13.480 1217 HA ASP 58 HA ASP 58 -16.391 2.218 15.446 1218 1HB ASP 58 HB2 ASP 58 -18.152 0.831 16.065 1219 2HB ASP 58 HB3 ASP 58 -17.363 -0.634 15.497 1220 H ASP 59 H ASP 59 -14.836 -0.911 14.572 1221 HA ASP 59 HA ASP 59 -12.720 -0.621 16.444 1222 1HB ASP 59 HB2 ASP 59 -12.685 -2.081 13.764 1223 2HB ASP 59 HB3 ASP 59 -11.516 -2.298 15.076 1224 H LEU 60 H LEU 60 -12.837 0.441 13.028 1225 HA LEU 60 HA LEU 60 -10.231 1.632 13.010 1226 1HB LEU 60 HB2 LEU 60 -12.788 2.033 11.451 1227 2HB LEU 60 HB3 LEU 60 -11.464 3.169 11.229 1228 HG LEU 60 HG LEU 60 -10.924 0.204 11.047 1229 1HD1 LEU 60 HD11 LEU 60 -11.907 1.881 8.734 1230 2HD1 LEU 60 HD12 LEU 60 -11.334 0.218 8.636 1231 3HD1 LEU 60 HD13 LEU 60 -12.829 0.579 9.529 1232 1HD2 LEU 60 HD21 LEU 60 -9.235 1.061 9.336 1233 2HD2 LEU 60 HD22 LEU 60 -9.776 2.698 9.660 1234 3HD2 LEU 60 HD23 LEU 60 -8.981 1.754 10.952 1235 H ASP 61 H ASP 61 -13.401 3.275 13.493 1236 HA ASP 61 HA ASP 61 -12.113 5.713 14.081 1237 1HB ASP 61 HB2 ASP 61 -14.159 6.712 14.074 1238 2HB ASP 61 HB3 ASP 61 -14.389 5.350 12.989 1239 H ARG 62 H ARG 62 -12.928 3.114 16.249 1240 HA ARG 62 HA ARG 62 -13.138 4.569 18.653 1241 1HB ARG 62 HB2 ARG 62 -13.589 2.215 18.536 1242 2HB ARG 62 HB3 ARG 62 -11.910 1.840 18.094 1243 1HG ARG 62 HG2 ARG 62 -11.123 2.498 20.287 1244 2HG ARG 62 HG3 ARG 62 -12.682 3.237 20.694 1245 1HD ARG 62 HD2 ARG 62 -12.361 1.077 21.816 1246 2HD ARG 62 HD3 ARG 62 -13.772 1.064 20.776 1247 HE ARG 62 HE ARG 62 -11.140 -0.287 20.344 1248 1HH1 ARG 62 HH12 ARG 62 -14.451 0.200 19.103 1249 2HH1 ARG 62 HH11 ARG 62 -14.459 -1.299 18.227 1250 1HH2 ARG 62 HH22 ARG 62 -11.154 -2.187 19.084 1251 2HH2 ARG 62 HH21 ARG 62 -12.563 -2.587 18.122 1252 H ASN 63 H ASN 63 -10.338 3.939 16.577 1253 HA ASN 63 HA ASN 63 -8.275 4.315 18.429 1254 1HB ASN 63 HB2 ASN 63 -8.404 4.919 15.459 1255 2HB ASN 63 HB3 ASN 63 -6.952 5.188 16.425 1256 1HD2 ASN 63 HD22 ASN 63 -9.159 2.635 15.234 1257 2HD2 ASN 63 HD21 ASN 63 -8.076 1.317 15.620 1258 H LYS 64 H LYS 64 -10.223 6.838 16.851 1259 HA LYS 64 HA LYS 64 -9.287 8.619 19.030 1260 1HB LYS 64 HB2 LYS 64 -8.201 9.175 16.754 1261 2HB LYS 64 HB3 LYS 64 -9.801 9.764 16.272 1262 1HG LYS 64 HG2 LYS 64 -9.790 11.232 18.346 1263 2HG LYS 64 HG3 LYS 64 -8.115 10.729 18.613 1264 1HD LYS 64 HD2 LYS 64 -9.237 12.298 16.244 1265 2HD LYS 64 HD3 LYS 64 -8.121 12.873 17.497 1266 1HE LYS 64 HE2 LYS 64 -6.484 11.055 16.661 1267 2HE LYS 64 HE3 LYS 64 -7.592 10.867 15.273 1268 1HZ LYS 64 HZ1 LYS 64 -6.216 13.338 16.028 1269 2HZ LYS 64 HZ2 LYS 64 -5.802 12.321 14.794 1270 3HZ LYS 64 HZ3 LYS 64 -7.237 13.137 14.744 1271 H ASP 65 H ASP 65 -11.261 6.956 19.279 1272 HA ASP 65 HA ASP 65 -13.430 6.655 19.792 1273 1HB ASP 65 HB2 ASP 65 -14.103 8.202 21.529 1274 2HB ASP 65 HB3 ASP 65 -12.369 7.893 21.617 1275 H GLN 66 H GLN 66 -13.362 7.905 17.077 1276 HA GLN 66 HA GLN 66 -15.992 8.513 16.484 1277 1HB GLN 66 HB2 GLN 66 -15.327 10.636 18.135 1278 2HB GLN 66 HB3 GLN 66 -14.563 11.187 16.675 1279 1HG GLN 66 HG2 GLN 66 -16.789 12.100 16.853 1280 2HG GLN 66 HG3 GLN 66 -16.727 11.010 15.466 1281 1HE2 GLN 66 HE22 GLN 66 -16.875 9.403 18.632 1282 2HE2 GLN 66 HE21 GLN 66 -18.598 9.097 18.569 1283 H GLU 67 H GLU 67 -12.591 9.418 16.036 1284 HA GLU 67 HA GLU 67 -12.933 9.032 13.097 1285 1HB GLU 67 HB2 GLU 67 -10.832 10.832 14.372 1286 2HB GLU 67 HB3 GLU 67 -11.243 10.650 12.665 1287 1HG GLU 67 HG2 GLU 67 -13.604 11.576 13.391 1288 2HG GLU 67 HG3 GLU 67 -12.772 12.089 14.858 1289 H VAL 68 H VAL 68 -11.118 8.136 12.023 1290 HA VAL 68 HA VAL 68 -9.352 6.495 13.788 1291 HB VAL 68 HB VAL 68 -10.601 5.152 12.232 1292 1HG1 VAL 68 HG11 VAL 68 -11.042 6.678 10.381 1293 2HG1 VAL 68 HG12 VAL 68 -9.314 6.701 9.964 1294 3HG1 VAL 68 HG13 VAL 68 -10.248 5.207 9.819 1295 1HG2 VAL 68 HG21 VAL 68 -8.318 4.515 12.910 1296 2HG2 VAL 68 HG22 VAL 68 -8.664 3.981 11.263 1297 3HG2 VAL 68 HG23 VAL 68 -7.647 5.402 11.528 1298 H ASN 69 H ASN 69 -7.315 7.185 13.986 1299 HA ASN 69 HA ASN 69 -6.468 9.575 12.539 1300 1HB ASN 69 HB2 ASN 69 -6.075 9.244 14.978 1301 2HB ASN 69 HB3 ASN 69 -5.009 7.901 14.613 1302 1HD2 ASN 69 HD21 ASN 69 -2.847 8.403 14.099 1303 2HD2 ASN 69 HD22 ASN 69 -2.286 10.050 13.780 1304 H PHE 70 H PHE 70 -4.676 9.634 11.054 1305 HA PHE 70 HA PHE 70 -4.729 7.725 9.127 1306 1HB PHE 70 HB2 PHE 70 -3.823 9.899 8.712 1307 2HB PHE 70 HB3 PHE 70 -2.505 9.645 9.851 1308 HD1 PHE 70 HD1 PHE 70 -0.415 9.025 8.975 1309 HD2 PHE 70 HD2 PHE 70 -3.990 7.976 6.806 1310 HE1 PHE 70 HE1 PHE 70 0.940 7.806 7.317 1311 HE2 PHE 70 HE2 PHE 70 -2.618 6.853 5.086 1312 HZ PHE 70 HZ PHE 70 -0.151 6.684 5.385 1313 H GLN 71 H GLN 71 -1.915 7.869 11.368 1314 HA GLN 71 HA GLN 71 -0.620 5.585 10.417 1315 1HB GLN 71 HB2 GLN 71 0.331 7.207 11.993 1316 2HB GLN 71 HB3 GLN 71 -0.778 6.670 13.259 1317 1HG GLN 71 HG2 GLN 71 0.301 4.386 13.166 1318 2HG GLN 71 HG3 GLN 71 1.423 5.017 11.951 1319 1HE2 GLN 71 HE22 GLN 71 0.240 5.515 15.329 1320 2HE2 GLN 71 HE21 GLN 71 1.756 6.198 15.901 1321 H GLU 72 H GLU 72 -3.265 5.832 12.787 1322 HA GLU 72 HA GLU 72 -3.217 3.044 13.532 1323 1HB GLU 72 HB2 GLU 72 -5.202 5.299 14.009 1324 2HB GLU 72 HB3 GLU 72 -5.419 3.641 14.572 1325 1HG GLU 72 HG2 GLU 72 -4.438 5.089 16.336 1326 2HG GLU 72 HG3 GLU 72 -3.420 3.712 15.919 1327 H TYR 73 H TYR 73 -4.982 4.978 11.106 1328 HA TYR 73 HA TYR 73 -6.713 2.867 10.183 1329 1HB TYR 73 HB2 TYR 73 -7.372 4.806 9.238 1330 2HB TYR 73 HB3 TYR 73 -5.769 5.490 9.160 1331 HD1 TYR 73 HD1 TYR 73 -8.259 3.431 7.372 1332 HD2 TYR 73 HD2 TYR 73 -4.340 5.218 7.218 1333 HE1 TYR 73 HE1 TYR 73 -8.286 3.313 4.892 1334 HE2 TYR 73 HE2 TYR 73 -4.306 4.949 4.766 1335 HH TYR 73 HH TYR 73 -5.685 4.683 2.887 1336 H ILE 74 H ILE 74 -3.354 3.814 9.272 1337 HA ILE 74 HA ILE 74 -3.010 1.701 7.393 1338 HB ILE 74 HB ILE 74 -0.898 3.014 9.125 1339 1HG1 ILE 74 HG12 ILE 74 -2.195 4.591 7.611 1340 2HG1 ILE 74 HG13 ILE 74 -0.465 4.551 7.423 1341 1HG2 ILE 74 HG21 ILE 74 0.038 1.006 8.344 1342 2HG2 ILE 74 HG22 ILE 74 -0.710 1.152 6.742 1343 3HG2 ILE 74 HG23 ILE 74 0.617 2.225 7.212 1344 1HD1 ILE 74 HD11 ILE 74 -1.529 4.655 5.240 1345 2HD1 ILE 74 HD12 ILE 74 -0.684 3.126 5.393 1346 3HD1 ILE 74 HD13 ILE 74 -2.459 3.187 5.592 1347 H THR 75 H THR 75 -2.134 1.741 10.934 1348 HA THR 75 HA THR 75 -1.403 -0.926 11.216 1349 HB THR 75 HB THR 75 -3.084 0.755 13.126 1350 HG1 THR 75 HG1 THR 75 -0.299 0.299 13.062 1351 1HG2 THR 75 HG21 THR 75 -3.161 -1.544 13.895 1352 2HG2 THR 75 HG22 THR 75 -1.421 -1.747 13.625 1353 3HG2 THR 75 HG23 THR 75 -2.008 -0.649 14.892 1354 H PHE 76 H PHE 76 -4.765 0.386 11.298 1355 HA PHE 76 HA PHE 76 -6.016 -2.107 11.781 1356 1HB PHE 76 HB2 PHE 76 -7.148 0.085 12.019 1357 2HB PHE 76 HB3 PHE 76 -7.142 0.263 10.264 1358 HD1 PHE 76 HD1 PHE 76 -8.570 -1.626 13.126 1359 HD2 PHE 76 HD2 PHE 76 -8.607 -1.173 8.829 1360 HE1 PHE 76 HE1 PHE 76 -10.488 -3.188 12.960 1361 HE2 PHE 76 HE2 PHE 76 -10.594 -2.611 8.696 1362 HZ PHE 76 HZ PHE 76 -11.493 -3.698 10.742 1363 H LEU 77 H LEU 77 -5.197 -0.476 8.645 1364 HA LEU 77 HA LEU 77 -6.244 -2.611 7.038 1365 1HB LEU 77 HB2 LEU 77 -4.097 -0.533 6.518 1366 2HB LEU 77 HB3 LEU 77 -4.573 -1.732 5.312 1367 HG LEU 77 HG LEU 77 -6.550 0.195 6.624 1368 1HD1 LEU 77 HD11 LEU 77 -4.951 1.482 5.324 1369 2HD1 LEU 77 HD12 LEU 77 -5.108 0.355 3.949 1370 3HD1 LEU 77 HD13 LEU 77 -6.483 1.361 4.431 1371 1HD2 LEU 77 HD21 LEU 77 -6.732 -1.670 4.210 1372 2HD2 LEU 77 HD22 LEU 77 -7.703 -1.762 5.703 1373 3HD2 LEU 77 HD23 LEU 77 -7.929 -0.414 4.597 1374 H GLY 78 H GLY 78 -3.123 -2.232 8.705 1375 1HA GLY 78 HA2 GLY 78 -1.892 -4.618 7.752 1376 2HA GLY 78 HA3 GLY 78 -1.645 -3.889 9.357 1377 H ALA 79 H ALA 79 -4.058 -4.109 10.590 1378 HA ALA 79 HA ALA 79 -4.254 -6.859 11.307 1379 1HB ALA 79 HB1 ALA 79 -5.010 -5.003 12.762 1380 2HB ALA 79 HB2 ALA 79 -6.378 -4.700 11.666 1381 3HB ALA 79 HB3 ALA 79 -6.262 -6.240 12.533 1382 H LEU 80 H LEU 80 -6.129 -4.923 8.965 1383 HA LEU 80 HA LEU 80 -8.010 -6.910 8.306 1384 1HB LEU 80 HB2 LEU 80 -7.893 -4.342 7.713 1385 2HB LEU 80 HB3 LEU 80 -6.992 -4.885 6.300 1386 HG LEU 80 HG LEU 80 -8.961 -6.370 5.722 1387 1HD1 LEU 80 HD11 LEU 80 -11.163 -5.707 6.763 1388 2HD1 LEU 80 HD12 LEU 80 -10.114 -6.570 7.885 1389 3HD1 LEU 80 HD13 LEU 80 -10.265 -4.804 7.996 1390 1HD2 LEU 80 HD21 LEU 80 -9.516 -3.382 6.020 1391 2HD2 LEU 80 HD22 LEU 80 -8.604 -4.134 4.686 1392 3HD2 LEU 80 HD23 LEU 80 -10.331 -4.474 4.888 1393 H ALA 81 H ALA 81 -4.821 -6.142 6.885 1394 HA ALA 81 HA ALA 81 -4.692 -8.164 4.901 1395 1HB ALA 81 HB1 ALA 81 -2.482 -6.928 6.582 1396 2HB ALA 81 HB2 ALA 81 -2.237 -7.975 5.187 1397 3HB ALA 81 HB3 ALA 81 -3.049 -6.402 5.001 1398 H MET 82 H MET 82 -3.710 -8.218 8.346 1399 HA MET 82 HA MET 82 -2.885 -10.885 8.433 1400 1HB MET 82 HB2 MET 82 -2.607 -9.029 10.192 1401 2HB MET 82 HB3 MET 82 -4.219 -9.484 10.767 1402 1HG MET 82 HG2 MET 82 -2.619 -10.641 12.097 1403 2HG MET 82 HG3 MET 82 -3.357 -11.847 11.038 1404 1HE MET 82 HE1 MET 82 -1.465 -13.584 11.599 1405 2HE MET 82 HE2 MET 82 0.272 -13.205 11.533 1406 3HE MET 82 HE3 MET 82 -0.766 -12.393 12.728 1407 H ILE 83 H ILE 83 -6.119 -9.507 8.979 1408 HA ILE 83 HA ILE 83 -7.431 -11.952 9.674 1409 HB ILE 83 HB ILE 83 -8.420 -9.262 8.690 1410 1HG1 ILE 83 HG12 ILE 83 -8.807 -10.619 11.393 1411 2HG1 ILE 83 HG13 ILE 83 -7.369 -9.665 11.045 1412 1HG2 ILE 83 HG21 ILE 83 -10.717 -10.019 9.355 1413 2HG2 ILE 83 HG22 ILE 83 -10.105 -10.876 7.950 1414 3HG2 ILE 83 HG23 ILE 83 -10.089 -11.668 9.542 1415 1HD1 ILE 83 HD11 ILE 83 -8.790 -7.684 10.535 1416 2HD1 ILE 83 HD12 ILE 83 -10.226 -8.613 11.018 1417 3HD1 ILE 83 HD13 ILE 83 -8.954 -8.270 12.199 1418 H TYR 84 H TYR 84 -7.091 -10.241 6.510 1419 HA TYR 84 HA TYR 84 -8.597 -12.103 4.984 1420 1HB TYR 84 HB2 TYR 84 -6.113 -10.536 4.185 1421 2HB TYR 84 HB3 TYR 84 -7.171 -11.389 3.066 1422 HD1 TYR 84 HD1 TYR 84 -6.331 -8.327 3.315 1423 HD2 TYR 84 HD2 TYR 84 -9.911 -10.604 4.119 1424 HE1 TYR 84 HE1 TYR 84 -7.726 -6.333 2.846 1425 HE2 TYR 84 HE2 TYR 84 -11.277 -8.635 3.615 1426 HH TYR 84 HH TYR 84 -11.291 -6.443 2.905 1427 H ASN 85 H ASN 85 -5.204 -12.195 6.008 1428 HA ASN 85 HA ASN 85 -3.872 -13.902 6.527 1429 1HB ASN 85 HB2 ASN 85 -5.718 -14.824 7.739 1430 2HB ASN 85 HB3 ASN 85 -6.352 -15.640 6.307 1431 1HD2 ASN 85 HD22 ASN 85 -5.284 -17.530 5.488 1432 2HD2 ASN 85 HD21 ASN 85 -4.049 -18.331 6.447 1433 H GLU 86 H GLU 86 -5.954 -15.200 3.916 1434 HA GLU 86 HA GLU 86 -4.031 -16.843 2.641 1435 1HB GLU 86 HB2 GLU 86 -6.303 -15.233 1.381 1436 2HB GLU 86 HB3 GLU 86 -5.427 -16.573 0.626 1437 1HG GLU 86 HG2 GLU 86 -6.191 -18.079 2.486 1438 2HG GLU 86 HG3 GLU 86 -7.170 -16.750 3.131 1439 H ALA 87 H ALA 87 -4.782 -13.400 2.228 1440 HA ALA 87 HA ALA 87 -3.046 -12.575 0.247 1441 1HB ALA 87 HB1 ALA 87 -3.631 -11.166 2.886 1442 2HB ALA 87 HB2 ALA 87 -3.037 -10.412 1.387 1443 3HB ALA 87 HB3 ALA 87 -4.658 -11.129 1.435 1444 H LEU 88 H LEU 88 -2.212 -13.367 3.644 1445 HA LEU 88 HA LEU 88 0.476 -12.336 3.605 1446 1HB LEU 88 HB2 LEU 88 -0.579 -14.628 5.275 1447 2HB LEU 88 HB3 LEU 88 0.769 -13.569 5.628 1448 HG LEU 88 HG LEU 88 -2.135 -12.640 5.563 1449 1HD1 LEU 88 HD11 LEU 88 -1.571 -14.390 7.320 1450 2HD1 LEU 88 HD12 LEU 88 -0.393 -13.240 7.982 1451 3HD1 LEU 88 HD13 LEU 88 -2.116 -12.845 7.958 1452 1HD2 LEU 88 HD21 LEU 88 -0.461 -10.828 5.178 1453 2HD2 LEU 88 HD22 LEU 88 -1.305 -10.661 6.722 1454 3HD2 LEU 88 HD23 LEU 88 0.349 -11.291 6.694 1455 H LYS 89 H LYS 89 -1.051 -15.427 2.760 1456 HA LYS 89 HA LYS 89 1.468 -16.880 2.495 1457 1HB LYS 89 HB2 LYS 89 -1.329 -17.603 1.520 1458 2HB LYS 89 HB3 LYS 89 0.084 -18.663 1.622 1459 1HG LYS 89 HG2 LYS 89 0.127 -18.396 4.089 1460 2HG LYS 89 HG3 LYS 89 -1.234 -17.273 4.011 1461 1HD LYS 89 HD2 LYS 89 -2.066 -19.406 4.693 1462 2HD LYS 89 HD3 LYS 89 -2.687 -19.043 3.075 1463 1HE LYS 89 HE2 LYS 89 -1.035 -20.575 2.066 1464 2HE LYS 89 HE3 LYS 89 -0.283 -20.845 3.652 1465 1HZ LYS 89 HZ1 LYS 89 -3.031 -21.559 2.904 1466 2HZ LYS 89 HZ2 LYS 89 -1.762 -22.600 3.042 1467 3HZ LYS 89 HZ3 LYS 89 -2.336 -21.822 4.376 1468 H GLY 90 H GLY 90 -0.931 -15.309 0.350 1469 1HA GLY 90 HA2 GLY 90 1.125 -14.543 -1.524 1470 2HA GLY 90 HA3 GLY 90 0.092 -15.834 -2.178 Start of MODEL 18 1 1H MET 1 H1 MET 1 -11.151 2.810 -5.956 2 2H MET 1 H2 MET 1 -9.852 1.786 -6.074 3 3H MET 1 H3 MET 1 -10.471 2.171 -4.602 4 HA MET 1 HA MET 1 -12.498 1.066 -5.072 5 1HB MET 1 HB2 MET 1 -11.142 0.267 -7.680 6 2HB MET 1 HB3 MET 1 -12.709 -0.314 -7.108 7 1HG MET 1 HG2 MET 1 -12.031 2.553 -7.859 8 2HG MET 1 HG3 MET 1 -12.958 1.391 -8.803 9 1HE MET 1 HE1 MET 1 -14.848 3.040 -9.227 10 2HE MET 1 HE2 MET 1 -15.706 3.945 -7.963 11 3HE MET 1 HE3 MET 1 -13.993 4.302 -8.301 12 H ALA 2 H ALA 2 -12.736 -1.357 -5.093 13 HA ALA 2 HA ALA 2 -11.299 -2.522 -3.108 14 1HB ALA 2 HB1 ALA 2 -12.099 -4.718 -3.935 15 2HB ALA 2 HB2 ALA 2 -13.370 -3.487 -3.998 16 3HB ALA 2 HB3 ALA 2 -12.542 -3.974 -5.487 17 H SER 3 H SER 3 -10.624 -3.368 -6.583 18 HA SER 3 HA SER 3 -8.381 -4.911 -6.072 19 1HB SER 3 HB2 SER 3 -7.977 -3.913 -8.616 20 2HB SER 3 HB3 SER 3 -8.958 -5.311 -8.165 21 HG SER 3 HG SER 3 -10.184 -3.825 -9.399 22 HA PRO 4 HA PRO 4 -5.642 -0.834 -6.853 23 1HB PRO 4 HB2 PRO 4 -7.820 0.938 -5.713 24 2HB PRO 4 HB3 PRO 4 -6.414 1.413 -6.708 25 1HG PRO 4 HG2 PRO 4 -8.806 1.000 -7.911 26 2HG PRO 4 HG3 PRO 4 -7.316 0.340 -8.640 27 1HD PRO 4 HD2 PRO 4 -9.437 -1.148 -7.119 28 2HD PRO 4 HD3 PRO 4 -8.427 -1.644 -8.496 29 H LEU 5 H LEU 5 -7.932 -0.768 -3.962 30 HA LEU 5 HA LEU 5 -5.653 -0.178 -2.285 31 1HB LEU 5 HB2 LEU 5 -7.865 0.439 -1.519 32 2HB LEU 5 HB3 LEU 5 -8.358 -1.260 -1.455 33 HG LEU 5 HG LEU 5 -6.701 -1.738 0.293 34 1HD1 LEU 5 HD11 LEU 5 -4.832 -0.219 -0.253 35 2HD1 LEU 5 HD12 LEU 5 -5.869 1.194 0.047 36 3HD1 LEU 5 HD13 LEU 5 -5.419 0.104 1.371 37 1HD2 LEU 5 HD21 LEU 5 -8.897 -0.779 0.968 38 2HD2 LEU 5 HD22 LEU 5 -7.569 -0.464 2.106 39 3HD2 LEU 5 HD23 LEU 5 -8.130 0.830 1.014 40 H ASP 6 H ASP 6 -7.465 -3.190 -2.968 41 HA ASP 6 HA ASP 6 -6.161 -4.907 -1.182 42 1HB ASP 6 HB2 ASP 6 -7.284 -5.511 -3.948 43 2HB ASP 6 HB3 ASP 6 -6.784 -6.737 -2.780 44 H GLN 7 H GLN 7 -5.178 -4.095 -4.550 45 HA GLN 7 HA GLN 7 -2.869 -5.800 -4.471 46 1HB GLN 7 HB2 GLN 7 -2.154 -4.726 -6.492 47 2HB GLN 7 HB3 GLN 7 -3.885 -5.083 -6.556 48 1HG GLN 7 HG2 GLN 7 -4.306 -2.663 -5.928 49 2HG GLN 7 HG3 GLN 7 -2.598 -2.338 -6.139 50 1HE2 GLN 7 HE21 GLN 7 -1.680 -2.811 -8.359 51 2HE2 GLN 7 HE22 GLN 7 -2.764 -2.670 -9.732 52 H ALA 8 H ALA 8 -3.380 -2.372 -3.504 53 HA ALA 8 HA ALA 8 -0.594 -1.803 -3.151 54 1HB ALA 8 HB1 ALA 8 -3.058 -0.522 -1.946 55 2HB ALA 8 HB2 ALA 8 -1.391 0.036 -1.702 56 3HB ALA 8 HB3 ALA 8 -2.067 -0.017 -3.339 57 H ILE 9 H ILE 9 -3.136 -2.796 -0.729 58 HA ILE 9 HA ILE 9 -1.192 -3.086 1.383 59 HB ILE 9 HB ILE 9 -2.861 -4.428 2.577 60 1HG1 ILE 9 HG12 ILE 9 -4.604 -4.097 0.139 61 2HG1 ILE 9 HG13 ILE 9 -3.917 -5.627 0.709 62 1HG2 ILE 9 HG21 ILE 9 -4.367 -2.602 2.959 63 2HG2 ILE 9 HG22 ILE 9 -2.760 -1.970 2.635 64 3HG2 ILE 9 HG23 ILE 9 -4.003 -1.912 1.361 65 1HD1 ILE 9 HD11 ILE 9 -5.976 -3.919 2.156 66 2HD1 ILE 9 HD12 ILE 9 -6.202 -5.503 1.422 67 3HD1 ILE 9 HD13 ILE 9 -5.172 -5.347 2.858 68 H GLY 10 H GLY 10 -2.447 -5.358 -1.054 69 1HA GLY 10 HA2 GLY 10 -1.076 -7.701 -0.622 70 2HA GLY 10 HA3 GLY 10 -1.365 -6.973 -2.207 71 H LEU 11 H LEU 11 0.233 -4.746 -2.222 72 HA LEU 11 HA LEU 11 2.760 -5.741 -2.855 73 1HB LEU 11 HB2 LEU 11 1.536 -3.487 -3.447 74 2HB LEU 11 HB3 LEU 11 2.278 -2.877 -1.975 75 HG LEU 11 HG LEU 11 3.596 -2.167 -3.777 76 1HD1 LEU 11 HD11 LEU 11 5.751 -2.959 -3.317 77 2HD1 LEU 11 HD12 LEU 11 4.831 -2.977 -1.798 78 3HD1 LEU 11 HD13 LEU 11 5.145 -4.499 -2.683 79 1HD2 LEU 11 HD21 LEU 11 3.787 -5.022 -4.795 80 2HD2 LEU 11 HD22 LEU 11 2.789 -3.717 -5.484 81 3HD2 LEU 11 HD23 LEU 11 4.557 -3.580 -5.489 82 H LEU 12 H LEU 12 1.870 -3.803 0.043 83 HA LEU 12 HA LEU 12 4.370 -3.968 1.409 84 1HB LEU 12 HB2 LEU 12 1.478 -3.737 2.402 85 2HB LEU 12 HB3 LEU 12 2.860 -3.778 3.491 86 HG LEU 12 HG LEU 12 3.810 -1.783 2.456 87 1HD1 LEU 12 HD11 LEU 12 1.173 -1.631 0.931 88 2HD1 LEU 12 HD12 LEU 12 2.354 -0.319 1.045 89 3HD1 LEU 12 HD13 LEU 12 2.792 -1.803 0.202 90 1HD2 LEU 12 HD21 LEU 12 2.126 -0.198 3.418 91 2HD2 LEU 12 HD22 LEU 12 0.965 -1.536 3.514 92 3HD2 LEU 12 HD23 LEU 12 2.469 -1.571 4.465 93 H ILE 13 H ILE 13 1.541 -6.148 1.486 94 HA ILE 13 HA ILE 13 2.578 -7.853 3.534 95 HB ILE 13 HB ILE 13 0.539 -8.380 1.339 96 1HG1 ILE 13 HG12 ILE 13 -0.071 -7.887 4.261 97 2HG1 ILE 13 HG13 ILE 13 0.194 -6.502 3.214 98 1HG2 ILE 13 HG21 ILE 13 1.325 -10.525 2.249 99 2HG2 ILE 13 HG22 ILE 13 1.113 -9.919 3.908 100 3HG2 ILE 13 HG23 ILE 13 -0.292 -10.176 2.876 101 1HD1 ILE 13 HD11 ILE 13 -2.018 -8.551 3.066 102 2HD1 ILE 13 HD12 ILE 13 -2.102 -6.776 3.121 103 3HD1 ILE 13 HD13 ILE 13 -1.586 -7.581 1.643 104 H GLY 14 H GLY 14 2.633 -8.127 -0.028 105 1HA GLY 14 HA2 GLY 14 4.006 -10.583 -0.259 106 2HA GLY 14 HA3 GLY 14 3.979 -9.272 -1.458 107 H ILE 15 H ILE 15 5.246 -7.182 -0.284 108 HA ILE 15 HA ILE 15 7.993 -7.792 -0.475 109 HB ILE 15 HB ILE 15 6.380 -5.461 0.535 110 1HG1 ILE 15 HG12 ILE 15 8.600 -5.865 -1.529 111 2HG1 ILE 15 HG13 ILE 15 6.867 -5.806 -1.855 112 1HG2 ILE 15 HG21 ILE 15 8.076 -5.543 2.230 113 2HG2 ILE 15 HG22 ILE 15 9.360 -5.740 1.016 114 3HG2 ILE 15 HG23 ILE 15 8.438 -4.220 1.153 115 1HD1 ILE 15 HD11 ILE 15 7.775 -3.665 -2.437 116 2HD1 ILE 15 HD12 ILE 15 6.886 -3.433 -0.912 117 3HD1 ILE 15 HD13 ILE 15 8.655 -3.521 -0.919 118 H PHE 16 H PHE 16 5.960 -7.439 2.465 119 HA PHE 16 HA PHE 16 8.047 -7.978 4.292 120 1HB PHE 16 HB2 PHE 16 5.760 -7.106 4.824 121 2HB PHE 16 HB3 PHE 16 5.097 -8.708 4.586 122 HD1 PHE 16 HD1 PHE 16 7.221 -6.596 6.749 123 HD2 PHE 16 HD2 PHE 16 5.647 -10.562 6.201 124 HE1 PHE 16 HE1 PHE 16 7.588 -7.077 9.156 125 HE2 PHE 16 HE2 PHE 16 6.090 -11.066 8.559 126 HZ PHE 16 HZ PHE 16 7.005 -9.295 10.073 127 H HIS 17 H HIS 17 5.587 -10.280 3.023 128 HA HIS 17 HA HIS 17 6.734 -12.431 4.454 129 1HB HIS 17 HB2 HIS 17 4.693 -12.367 2.226 130 2HB HIS 17 HB3 HIS 17 5.173 -13.850 3.069 131 HD1 HIS 17 HD1 HIS 17 3.298 -10.607 3.706 132 HD2 HIS 17 HD2 HIS 17 4.743 -13.951 5.779 133 HE1 HIS 17 HE1 HIS 17 2.340 -10.464 6.084 134 H LYS 18 H LYS 18 7.403 -11.238 1.205 135 HA LYS 18 HA LYS 18 8.874 -13.452 0.211 136 1HB LYS 18 HB2 LYS 18 8.309 -11.452 -1.102 137 2HB LYS 18 HB3 LYS 18 9.385 -10.467 -0.095 138 1HG LYS 18 HG2 LYS 18 11.350 -11.730 -0.917 139 2HG LYS 18 HG3 LYS 18 10.277 -12.893 -1.698 140 1HD LYS 18 HD2 LYS 18 11.003 -11.628 -3.474 141 2HD LYS 18 HD3 LYS 18 9.414 -10.938 -3.150 142 1HE LYS 18 HE2 LYS 18 12.106 -9.775 -2.237 143 2HE LYS 18 HE3 LYS 18 11.193 -9.256 -3.659 144 1HZ LYS 18 HZ1 LYS 18 9.381 -8.673 -2.170 145 2HZ LYS 18 HZ2 LYS 18 10.357 -8.978 -0.873 146 3HZ LYS 18 HZ3 LYS 18 10.754 -7.790 -1.945 147 H TYR 19 H TYR 19 9.758 -10.835 2.494 148 HA TYR 19 HA TYR 19 12.486 -11.880 2.794 149 1HB TYR 19 HB2 TYR 19 10.996 -9.465 3.715 150 2HB TYR 19 HB3 TYR 19 12.431 -9.964 4.611 151 HD1 TYR 19 HD1 TYR 19 14.634 -10.085 3.625 152 HD2 TYR 19 HD2 TYR 19 11.252 -8.697 1.344 153 HE1 TYR 19 HE1 TYR 19 16.111 -9.639 1.706 154 HE2 TYR 19 HE2 TYR 19 12.775 -8.046 -0.502 155 HH TYR 19 HH TYR 19 16.290 -8.627 -0.360 156 H SER 20 H SER 20 9.450 -11.881 4.784 157 HA SER 20 HA SER 20 10.492 -13.331 6.944 158 1HB SER 20 HB2 SER 20 7.803 -13.876 5.652 159 2HB SER 20 HB3 SER 20 8.293 -14.210 7.306 160 HG SER 20 HG SER 20 8.500 -12.036 7.715 161 H GLY 21 H GLY 21 9.660 -14.500 3.667 162 1HA GLY 21 HA2 GLY 21 9.930 -17.227 3.821 163 2HA GLY 21 HA3 GLY 21 10.581 -16.239 2.507 164 H LYS 22 H LYS 22 12.579 -14.807 4.051 165 HA LYS 22 HA LYS 22 14.757 -16.634 3.844 166 1HB LYS 22 HB2 LYS 22 14.763 -14.120 3.607 167 2HB LYS 22 HB3 LYS 22 14.683 -14.007 5.368 168 1HG LYS 22 HG2 LYS 22 16.774 -15.321 5.555 169 2HG LYS 22 HG3 LYS 22 16.885 -15.411 3.792 170 1HD LYS 22 HD2 LYS 22 17.078 -12.940 5.570 171 2HD LYS 22 HD3 LYS 22 18.376 -13.666 4.629 172 1HE LYS 22 HE2 LYS 22 15.938 -12.212 3.503 173 2HE LYS 22 HE3 LYS 22 17.609 -11.646 3.519 174 1HZ LYS 22 HZ1 LYS 22 17.015 -12.545 1.409 175 2HZ LYS 22 HZ2 LYS 22 18.182 -13.484 2.098 176 3HZ LYS 22 HZ3 LYS 22 16.616 -13.997 2.074 177 H GLU 23 H GLU 23 12.616 -15.729 6.500 178 HA GLU 23 HA GLU 23 14.012 -17.633 8.321 179 1HB GLU 23 HB2 GLU 23 12.749 -16.498 10.147 180 2HB GLU 23 HB3 GLU 23 14.020 -15.532 9.386 181 1HG GLU 23 HG2 GLU 23 12.367 -14.293 8.072 182 2HG GLU 23 HG3 GLU 23 11.052 -15.261 8.773 183 H GLY 24 H GLY 24 12.509 -18.505 6.081 184 1HA GLY 24 HA2 GLY 24 11.327 -20.478 5.957 185 2HA GLY 24 HA3 GLY 24 10.694 -20.267 7.593 186 H ASP 25 H ASP 25 9.199 -18.238 7.778 187 HA ASP 25 HA ASP 25 7.536 -17.480 5.599 188 1HB ASP 25 HB2 ASP 25 5.609 -18.873 5.792 189 2HB ASP 25 HB3 ASP 25 6.965 -19.940 5.475 190 H LYS 26 H LYS 26 7.501 -18.449 8.998 191 HA LYS 26 HA LYS 26 5.448 -17.345 10.168 192 1HB LYS 26 HB2 LYS 26 6.850 -16.914 12.166 193 2HB LYS 26 HB3 LYS 26 7.171 -18.469 11.383 194 1HG LYS 26 HG2 LYS 26 9.135 -17.325 10.184 195 2HG LYS 26 HG3 LYS 26 8.904 -15.961 11.257 196 1HD LYS 26 HD2 LYS 26 9.469 -18.853 12.079 197 2HD LYS 26 HD3 LYS 26 10.677 -17.572 11.984 198 1HE LYS 26 HE2 LYS 26 8.272 -17.554 13.880 199 2HE LYS 26 HE3 LYS 26 9.919 -18.025 14.312 200 1HZ LYS 26 HZ1 LYS 26 10.656 -15.837 13.740 201 2HZ LYS 26 HZ2 LYS 26 9.129 -15.362 13.348 202 3HZ LYS 26 HZ3 LYS 26 9.490 -15.775 14.901 203 H HIS 27 H HIS 27 4.555 -15.485 10.761 204 HA HIS 27 HA HIS 27 5.051 -13.231 9.098 205 1HB HIS 27 HB2 HIS 27 3.072 -13.523 11.384 206 2HB HIS 27 HB3 HIS 27 2.995 -12.356 10.052 207 HD1 HIS 27 HD1 HIS 27 3.049 -13.755 7.493 208 HD2 HIS 27 HD2 HIS 27 1.810 -15.783 10.963 209 HE1 HIS 27 HE1 HIS 27 2.023 -15.959 6.725 210 H THR 28 H THR 28 7.338 -13.161 10.169 211 HA THR 28 HA THR 28 7.504 -10.737 11.780 212 HB THR 28 HB THR 28 9.345 -11.897 13.103 213 HG1 THR 28 HG1 THR 28 9.460 -13.788 11.802 214 1HG2 THR 28 HG21 THR 28 7.141 -11.366 14.127 215 2HG2 THR 28 HG22 THR 28 6.545 -12.965 13.623 216 3HG2 THR 28 HG23 THR 28 7.874 -12.840 14.786 217 H LEU 29 H LEU 29 9.673 -9.809 11.500 218 HA LEU 29 HA LEU 29 11.271 -10.986 9.276 219 1HB LEU 29 HB2 LEU 29 9.377 -9.343 8.656 220 2HB LEU 29 HB3 LEU 29 10.429 -8.070 9.267 221 HG LEU 29 HG LEU 29 11.153 -10.083 7.073 222 1HD1 LEU 29 HD11 LEU 29 9.196 -8.876 6.380 223 2HD1 LEU 29 HD12 LEU 29 9.908 -7.318 6.875 224 3HD1 LEU 29 HD13 LEU 29 10.596 -8.233 5.522 225 1HD2 LEU 29 HD21 LEU 29 12.294 -7.360 7.833 226 2HD2 LEU 29 HD22 LEU 29 13.115 -8.918 8.079 227 3HD2 LEU 29 HD23 LEU 29 12.807 -8.327 6.435 228 H SER 30 H SER 30 13.390 -10.978 9.826 229 HA SER 30 HA SER 30 14.146 -9.747 12.331 230 1HB SER 30 HB2 SER 30 14.890 -12.033 11.523 231 2HB SER 30 HB3 SER 30 15.996 -11.199 10.416 232 HG SER 30 HG SER 30 15.917 -11.197 13.249 233 H LYS 31 H LYS 31 16.573 -8.992 12.361 234 HA LYS 31 HA LYS 31 16.217 -6.226 11.714 235 1HB LYS 31 HB2 LYS 31 18.788 -7.545 12.716 236 2HB LYS 31 HB3 LYS 31 18.286 -5.855 12.851 237 1HG LYS 31 HG2 LYS 31 16.236 -6.797 14.153 238 2HG LYS 31 HG3 LYS 31 17.177 -8.288 14.289 239 1HD LYS 31 HD2 LYS 31 19.060 -6.981 15.318 240 2HD LYS 31 HD3 LYS 31 18.068 -5.513 15.206 241 1HE LYS 31 HE2 LYS 31 16.287 -6.763 16.566 242 2HE LYS 31 HE3 LYS 31 17.514 -8.010 16.854 243 1HZ LYS 31 HZ1 LYS 31 17.708 -5.167 17.575 244 2HZ LYS 31 HZ2 LYS 31 17.401 -6.406 18.611 245 3HZ LYS 31 HZ3 LYS 31 18.870 -6.303 17.867 246 H LYS 32 H LYS 32 19.033 -8.279 10.780 247 HA LYS 32 HA LYS 32 19.828 -6.438 8.758 248 1HB LYS 32 HB2 LYS 32 20.567 -9.372 9.017 249 2HB LYS 32 HB3 LYS 32 21.370 -8.152 8.002 250 1HG LYS 32 HG2 LYS 32 21.887 -6.809 10.027 251 2HG LYS 32 HG3 LYS 32 21.200 -8.086 11.049 252 1HD LYS 32 HD2 LYS 32 22.828 -9.716 10.084 253 2HD LYS 32 HD3 LYS 32 23.565 -8.412 9.142 254 1HE LYS 32 HE2 LYS 32 23.398 -8.538 12.196 255 2HE LYS 32 HE3 LYS 32 24.828 -8.908 11.220 256 1HZ LYS 32 HZ1 LYS 32 24.800 -6.653 10.426 257 2HZ LYS 32 HZ2 LYS 32 23.492 -6.299 11.365 258 3HZ LYS 32 HZ3 LYS 32 24.924 -6.706 12.068 259 H GLU 33 H GLU 33 17.673 -9.205 8.782 260 HA GLU 33 HA GLU 33 17.231 -9.597 6.011 261 1HB GLU 33 HB2 GLU 33 16.522 -11.042 7.912 262 2HB GLU 33 HB3 GLU 33 15.299 -9.838 8.351 263 1HG GLU 33 HG2 GLU 33 14.181 -10.199 6.171 264 2HG GLU 33 HG3 GLU 33 15.409 -11.388 5.734 265 H LEU 34 H LEU 34 15.608 -7.371 8.376 266 HA LEU 34 HA LEU 34 13.923 -6.101 6.515 267 1HB LEU 34 HB2 LEU 34 13.599 -5.892 8.902 268 2HB LEU 34 HB3 LEU 34 15.136 -5.091 9.121 269 HG LEU 34 HG LEU 34 13.132 -3.670 9.250 270 1HD1 LEU 34 HD11 LEU 34 15.493 -2.822 8.701 271 2HD1 LEU 34 HD12 LEU 34 14.921 -2.639 7.039 272 3HD1 LEU 34 HD13 LEU 34 14.139 -1.754 8.337 273 1HD2 LEU 34 HD21 LEU 34 12.013 -2.904 7.168 274 2HD2 LEU 34 HD22 LEU 34 12.967 -4.025 6.222 275 3HD2 LEU 34 HD23 LEU 34 11.807 -4.648 7.411 276 H LYS 35 H LYS 35 17.274 -5.089 7.610 277 HA LYS 35 HA LYS 35 17.131 -2.856 5.832 278 1HB LYS 35 HB2 LYS 35 19.273 -2.322 6.193 279 2HB LYS 35 HB3 LYS 35 18.723 -3.031 7.718 280 1HG LYS 35 HG2 LYS 35 19.889 -5.169 6.989 281 2HG LYS 35 HG3 LYS 35 20.557 -4.296 5.622 282 1HD LYS 35 HD2 LYS 35 20.999 -3.736 8.585 283 2HD LYS 35 HD3 LYS 35 22.189 -4.339 7.429 284 1HE LYS 35 HE2 LYS 35 20.945 -1.540 7.512 285 2HE LYS 35 HE3 LYS 35 22.617 -1.998 7.864 286 1HZ LYS 35 HZ1 LYS 35 22.511 -1.107 5.730 287 2HZ LYS 35 HZ2 LYS 35 22.842 -2.713 5.588 288 3HZ LYS 35 HZ3 LYS 35 21.326 -2.154 5.245 289 H GLU 36 H GLU 36 18.036 -6.213 5.204 290 HA GLU 36 HA GLU 36 18.958 -5.859 2.540 291 1HB GLU 36 HB2 GLU 36 18.739 -8.007 4.190 292 2HB GLU 36 HB3 GLU 36 17.319 -8.288 3.192 293 1HG GLU 36 HG2 GLU 36 20.238 -8.041 2.353 294 2HG GLU 36 HG3 GLU 36 19.219 -9.484 2.287 295 H LEU 37 H LEU 37 15.644 -6.514 3.823 296 HA LEU 37 HA LEU 37 14.137 -6.380 1.474 297 1HB LEU 37 HB2 LEU 37 13.152 -6.941 3.589 298 2HB LEU 37 HB3 LEU 37 13.417 -5.348 4.245 299 HG LEU 37 HG LEU 37 11.627 -5.746 1.845 300 1HD1 LEU 37 HD11 LEU 37 10.713 -7.141 3.568 301 2HD1 LEU 37 HD12 LEU 37 11.015 -5.912 4.829 302 3HD1 LEU 37 HD13 LEU 37 9.766 -5.653 3.610 303 1HD2 LEU 37 HD21 LEU 37 11.863 -3.550 3.975 304 2HD2 LEU 37 HD22 LEU 37 12.145 -3.365 2.225 305 3HD2 LEU 37 HD23 LEU 37 10.531 -3.673 2.817 306 H ILE 38 H ILE 38 15.091 -3.668 3.594 307 HA ILE 38 HA ILE 38 13.984 -1.637 1.952 308 HB ILE 38 HB ILE 38 16.132 -1.678 4.086 309 1HG1 ILE 38 HG12 ILE 38 13.223 -0.734 3.872 310 2HG1 ILE 38 HG13 ILE 38 13.822 -2.166 4.725 311 1HG2 ILE 38 HG21 ILE 38 15.059 0.796 2.699 312 2HG2 ILE 38 HG22 ILE 38 16.068 0.777 4.156 313 3HG2 ILE 38 HG23 ILE 38 16.735 0.206 2.638 314 1HD1 ILE 38 HD11 ILE 38 14.188 0.740 5.444 315 2HD1 ILE 38 HD12 ILE 38 13.419 -0.580 6.352 316 3HD1 ILE 38 HD13 ILE 38 15.197 -0.549 6.159 317 H GLN 39 H GLN 39 17.350 -2.941 1.933 318 HA GLN 39 HA GLN 39 18.198 -1.107 -0.096 319 1HB GLN 39 HB2 GLN 39 19.235 -3.767 0.872 320 2HB GLN 39 HB3 GLN 39 19.998 -2.920 -0.489 321 1HG GLN 39 HG2 GLN 39 20.517 -0.993 0.782 322 2HG GLN 39 HG3 GLN 39 19.408 -1.419 2.089 323 1HE2 GLN 39 HE22 GLN 39 19.866 -3.385 3.312 324 2HE2 GLN 39 HE21 GLN 39 21.559 -3.808 3.629 325 H LYS 40 H LYS 40 16.620 -4.354 -0.409 326 HA LYS 40 HA LYS 40 16.860 -4.256 -3.293 327 1HB LYS 40 HB2 LYS 40 16.524 -6.342 -2.057 328 2HB LYS 40 HB3 LYS 40 14.897 -5.826 -1.581 329 1HG LYS 40 HG2 LYS 40 14.203 -5.709 -3.949 330 2HG LYS 40 HG3 LYS 40 15.829 -6.148 -4.487 331 1HD LYS 40 HD2 LYS 40 14.097 -7.903 -2.701 332 2HD LYS 40 HD3 LYS 40 14.037 -7.980 -4.465 333 1HE LYS 40 HE2 LYS 40 16.355 -8.654 -4.630 334 2HE LYS 40 HE3 LYS 40 16.623 -8.405 -2.898 335 1HZ LYS 40 HZ1 LYS 40 15.083 -10.126 -2.432 336 2HZ LYS 40 HZ2 LYS 40 14.795 -10.388 -4.039 337 3HZ LYS 40 HZ3 LYS 40 16.288 -10.690 -3.405 338 H GLU 41 H GLU 41 14.138 -3.504 -1.090 339 HA GLU 41 HA GLU 41 12.420 -2.848 -3.327 340 1HB GLU 41 HB2 GLU 41 11.959 -2.525 -0.337 341 2HB GLU 41 HB3 GLU 41 10.730 -2.457 -1.607 342 1HG GLU 41 HG2 GLU 41 12.425 -4.901 -0.864 343 2HG GLU 41 HG3 GLU 41 10.729 -4.648 -0.494 344 H LEU 42 H LEU 42 14.063 -0.882 -0.830 345 HA LEU 42 HA LEU 42 12.870 1.580 -2.019 346 1HB LEU 42 HB2 LEU 42 14.330 1.183 0.593 347 2HB LEU 42 HB3 LEU 42 13.794 2.734 -0.049 348 HG LEU 42 HG LEU 42 11.979 0.413 0.736 349 1HD1 LEU 42 HD11 LEU 42 12.956 1.632 2.658 350 2HD1 LEU 42 HD12 LEU 42 12.400 3.172 1.972 351 3HD1 LEU 42 HD13 LEU 42 11.225 1.955 2.513 352 1HD2 LEU 42 HD21 LEU 42 10.156 2.188 0.407 353 2HD2 LEU 42 HD22 LEU 42 11.355 3.144 -0.473 354 3HD2 LEU 42 HD23 LEU 42 10.857 1.540 -1.072 355 H THR 43 H THR 43 16.018 0.129 -1.196 356 HA THR 43 HA THR 43 18.078 0.445 -2.109 357 HB THR 43 HB THR 43 16.708 1.573 -4.578 358 HG1 THR 43 HG1 THR 43 16.764 -1.099 -3.622 359 1HG2 THR 43 HG21 THR 43 19.054 -0.346 -4.189 360 2HG2 THR 43 HG22 THR 43 18.407 0.225 -5.739 361 3HG2 THR 43 HG23 THR 43 19.189 1.371 -4.636 362 H ILE 44 H ILE 44 18.135 2.175 -0.360 363 HA ILE 44 HA ILE 44 18.189 4.944 -1.233 364 HB ILE 44 HB ILE 44 19.369 3.722 1.295 365 1HG1 ILE 44 HG12 ILE 44 17.288 4.894 2.295 366 2HG1 ILE 44 HG13 ILE 44 16.601 4.857 0.672 367 1HG2 ILE 44 HG21 ILE 44 19.262 6.033 2.141 368 2HG2 ILE 44 HG22 ILE 44 20.305 5.947 0.727 369 3HG2 ILE 44 HG23 ILE 44 18.662 6.597 0.568 370 1HD1 ILE 44 HD11 ILE 44 16.484 2.449 0.727 371 2HD1 ILE 44 HD12 ILE 44 17.670 2.358 2.054 372 3HD1 ILE 44 HD13 ILE 44 16.025 2.974 2.346 373 H GLY 45 H GLY 45 19.473 4.679 -3.118 374 1HA GLY 45 HA2 GLY 45 22.019 3.836 -3.523 375 2HA GLY 45 HA3 GLY 45 21.422 5.368 -4.185 376 H SER 46 H SER 46 21.145 6.741 -1.669 377 HA SER 46 HA SER 46 23.872 7.580 -1.092 378 1HB SER 46 HB2 SER 46 21.871 9.103 -1.081 379 2HB SER 46 HB3 SER 46 21.283 8.247 0.358 380 HG SER 46 HG SER 46 22.401 9.864 1.183 381 H LYS 47 H LYS 47 24.272 5.095 -0.658 382 HA LYS 47 HA LYS 47 23.425 3.949 1.784 383 1HB LYS 47 HB2 LYS 47 25.699 3.427 -0.134 384 2HB LYS 47 HB3 LYS 47 25.653 2.550 1.382 385 1HG LYS 47 HG2 LYS 47 23.398 2.605 -0.685 386 2HG LYS 47 HG3 LYS 47 24.574 1.306 -0.463 387 1HD LYS 47 HD2 LYS 47 22.265 2.098 1.326 388 2HD LYS 47 HD3 LYS 47 22.638 0.540 0.594 389 1HE LYS 47 HE2 LYS 47 24.669 0.369 2.103 390 2HE LYS 47 HE3 LYS 47 24.123 1.856 2.913 391 1HZ LYS 47 HZ1 LYS 47 23.385 0.020 4.114 392 2HZ LYS 47 HZ2 LYS 47 22.063 0.704 3.407 393 3HZ LYS 47 HZ3 LYS 47 22.706 -0.689 2.785 394 H LEU 48 H LEU 48 25.593 6.549 1.396 395 HA LEU 48 HA LEU 48 27.208 6.342 3.716 396 1HB LEU 48 HB2 LEU 48 25.721 8.778 2.639 397 2HB LEU 48 HB3 LEU 48 27.101 8.809 3.741 398 HG LEU 48 HG LEU 48 27.151 7.825 0.845 399 1HD1 LEU 48 HD11 LEU 48 26.875 10.263 1.073 400 2HD1 LEU 48 HD12 LEU 48 28.296 10.332 2.137 401 3HD1 LEU 48 HD13 LEU 48 28.477 9.849 0.437 402 1HD2 LEU 48 HD21 LEU 48 28.828 6.595 2.147 403 2HD2 LEU 48 HD22 LEU 48 29.632 7.820 1.163 404 3HD2 LEU 48 HD23 LEU 48 29.394 8.105 2.899 405 H GLN 49 H GLN 49 23.747 6.914 3.314 406 HA GLN 49 HA GLN 49 23.280 7.614 6.110 407 1HB GLN 49 HB2 GLN 49 21.410 6.937 3.814 408 2HB GLN 49 HB3 GLN 49 20.898 7.512 5.402 409 1HG GLN 49 HG2 GLN 49 22.101 9.617 5.122 410 2HG GLN 49 HG3 GLN 49 22.813 9.065 3.604 411 1HE2 GLN 49 HE22 GLN 49 19.477 9.371 5.036 412 2HE2 GLN 49 HE21 GLN 49 18.795 10.020 3.552 413 H ASP 50 H ASP 50 24.401 4.721 5.096 414 HA ASP 50 HA ASP 50 22.669 2.755 5.891 415 1HB ASP 50 HB2 ASP 50 24.965 2.338 5.067 416 2HB ASP 50 HB3 ASP 50 25.621 2.886 6.616 417 H ALA 51 H ALA 51 24.574 4.855 8.064 418 HA ALA 51 HA ALA 51 23.955 3.762 10.575 419 1HB ALA 51 HB1 ALA 51 24.257 6.053 11.428 420 2HB ALA 51 HB2 ALA 51 25.506 5.628 10.240 421 3HB ALA 51 HB3 ALA 51 24.162 6.693 9.773 422 H GLU 52 H GLU 52 22.004 5.948 8.515 423 HA GLU 52 HA GLU 52 19.866 6.291 10.438 424 1HB GLU 52 HB2 GLU 52 19.807 6.719 7.424 425 2HB GLU 52 HB3 GLU 52 18.673 7.345 8.621 426 1HG GLU 52 HG2 GLU 52 20.469 8.699 9.658 427 2HG GLU 52 HG3 GLU 52 21.642 8.086 8.483 428 H ILE 53 H ILE 53 20.536 4.169 7.621 429 HA ILE 53 HA ILE 53 18.031 2.807 7.668 430 HB ILE 53 HB ILE 53 20.695 1.554 6.914 431 1HG1 ILE 53 HG12 ILE 53 20.381 3.591 5.584 432 2HG1 ILE 53 HG13 ILE 53 20.195 2.144 4.606 433 1HG2 ILE 53 HG21 ILE 53 19.243 0.103 5.485 434 2HG2 ILE 53 HG22 ILE 53 18.989 -0.126 7.220 435 3HG2 ILE 53 HG23 ILE 53 17.815 0.796 6.282 436 1HD1 ILE 53 HD11 ILE 53 17.743 2.391 4.664 437 2HD1 ILE 53 HD12 ILE 53 17.895 3.831 5.703 438 3HD1 ILE 53 HD13 ILE 53 18.535 3.854 4.054 439 H VAL 54 H VAL 54 21.068 2.046 9.503 440 HA VAL 54 HA VAL 54 19.737 -0.187 10.738 441 HB VAL 54 HB VAL 54 21.607 -0.331 12.309 442 1HG1 VAL 54 HG11 VAL 54 22.287 -0.195 9.349 443 2HG1 VAL 54 HG12 VAL 54 23.153 -1.138 10.581 444 3HG1 VAL 54 HG13 VAL 54 21.482 -1.556 10.166 445 1HG2 VAL 54 HG21 VAL 54 23.627 0.929 11.979 446 2HG2 VAL 54 HG22 VAL 54 22.879 1.866 10.683 447 3HG2 VAL 54 HG23 VAL 54 22.310 2.053 12.360 448 H LYS 55 H LYS 55 20.033 3.238 11.726 449 HA LYS 55 HA LYS 55 18.818 2.865 14.284 450 1HB LYS 55 HB2 LYS 55 19.838 4.987 13.638 451 2HB LYS 55 HB3 LYS 55 18.675 5.194 12.331 452 1HG LYS 55 HG2 LYS 55 18.134 6.608 14.270 453 2HG LYS 55 HG3 LYS 55 16.838 5.500 13.859 454 1HD LYS 55 HD2 LYS 55 17.131 5.675 16.287 455 2HD LYS 55 HD3 LYS 55 17.376 4.030 15.734 456 1HE LYS 55 HE2 LYS 55 19.037 4.672 17.436 457 2HE LYS 55 HE3 LYS 55 19.839 4.306 15.906 458 1HZ LYS 55 HZ1 LYS 55 19.969 6.650 15.481 459 2HZ LYS 55 HZ2 LYS 55 19.197 6.998 16.897 460 3HZ LYS 55 HZ3 LYS 55 20.686 6.289 16.919 461 H LEU 56 H LEU 56 17.350 3.539 11.087 462 HA LEU 56 HA LEU 56 14.634 3.358 11.830 463 1HB LEU 56 HB2 LEU 56 15.213 4.318 9.793 464 2HB LEU 56 HB3 LEU 56 16.180 2.950 9.260 465 HG LEU 56 HG LEU 56 13.294 2.369 9.741 466 1HD1 LEU 56 HD11 LEU 56 12.643 3.224 7.526 467 2HD1 LEU 56 HD12 LEU 56 13.123 4.546 8.605 468 3HD1 LEU 56 HD13 LEU 56 14.239 3.984 7.340 469 1HD2 LEU 56 HD21 LEU 56 13.593 1.005 7.804 470 2HD2 LEU 56 HD22 LEU 56 15.206 1.693 7.462 471 3HD2 LEU 56 HD23 LEU 56 14.961 0.658 8.868 472 H MET 57 H MET 57 16.881 0.790 10.777 473 HA MET 57 HA MET 57 15.123 -1.409 10.789 474 1HB MET 57 HB2 MET 57 17.461 -1.421 9.902 475 2HB MET 57 HB3 MET 57 18.048 -1.217 11.555 476 1HG MET 57 HG2 MET 57 17.036 -3.461 12.131 477 2HG MET 57 HG3 MET 57 16.721 -3.652 10.407 478 1HE MET 57 HE1 MET 57 19.882 -2.131 12.412 479 2HE MET 57 HE2 MET 57 19.325 -3.573 13.285 480 3HE MET 57 HE3 MET 57 20.882 -3.594 12.428 481 H ASP 58 H ASP 58 17.260 -0.153 13.412 482 HA ASP 58 HA ASP 58 16.381 -1.836 15.484 483 1HB ASP 58 HB2 ASP 58 18.298 -0.346 15.713 484 2HB ASP 58 HB3 ASP 58 17.241 1.070 15.689 485 H ASP 59 H ASP 59 15.040 1.350 14.461 486 HA ASP 59 HA ASP 59 12.957 1.339 16.384 487 1HB ASP 59 HB2 ASP 59 12.955 2.679 13.637 488 2HB ASP 59 HB3 ASP 59 11.892 3.087 14.987 489 H LEU 60 H LEU 60 13.079 -0.220 13.224 490 HA LEU 60 HA LEU 60 10.286 -1.038 13.259 491 1HB LEU 60 HB2 LEU 60 12.740 -1.736 11.655 492 2HB LEU 60 HB3 LEU 60 11.381 -2.848 11.610 493 HG LEU 60 HG LEU 60 10.870 0.089 11.169 494 1HD1 LEU 60 HD11 LEU 60 12.742 -0.389 9.669 495 2HD1 LEU 60 HD12 LEU 60 11.848 -1.788 9.020 496 3HD1 LEU 60 HD13 LEU 60 11.236 -0.156 8.752 497 1HD2 LEU 60 HD21 LEU 60 8.932 -1.473 11.258 498 2HD2 LEU 60 HD22 LEU 60 9.141 -0.907 9.585 499 3HD2 LEU 60 HD23 LEU 60 9.694 -2.515 10.029 500 H ASP 61 H ASP 61 13.335 -2.860 13.966 501 HA ASP 61 HA ASP 61 11.833 -5.161 14.786 502 1HB ASP 61 HB2 ASP 61 13.919 -6.114 15.556 503 2HB ASP 61 HB3 ASP 61 14.015 -5.463 13.918 504 H ARG 62 H ARG 62 13.002 -2.410 16.625 505 HA ARG 62 HA ARG 62 13.125 -3.257 19.212 506 1HB ARG 62 HB2 ARG 62 13.593 -0.984 18.579 507 2HB ARG 62 HB3 ARG 62 11.943 -0.771 17.979 508 1HG ARG 62 HG2 ARG 62 11.170 -0.991 20.427 509 2HG ARG 62 HG3 ARG 62 12.874 -1.011 20.882 510 1HD ARG 62 HD2 ARG 62 11.801 1.276 21.051 511 2HD ARG 62 HD3 ARG 62 13.201 1.219 19.976 512 HE ARG 62 HE ARG 62 11.902 1.854 18.243 513 1HH1 ARG 62 HH22 ARG 62 9.656 0.596 20.685 514 2HH1 ARG 62 HH21 ARG 62 8.329 0.464 19.545 515 1HH2 ARG 62 HH12 ARG 62 10.163 1.419 16.752 516 2HH2 ARG 62 HH11 ARG 62 8.584 1.070 17.421 517 H ASN 63 H ASN 63 10.160 -2.486 17.418 518 HA ASN 63 HA ASN 63 8.335 -2.519 19.511 519 1HB ASN 63 HB2 ASN 63 7.739 -3.483 16.695 520 2HB ASN 63 HB3 ASN 63 6.596 -2.856 17.897 521 1HD2 ASN 63 HD22 ASN 63 9.007 -2.040 15.503 522 2HD2 ASN 63 HD21 ASN 63 9.048 -0.320 15.729 523 H LYS 64 H LYS 64 9.827 -5.308 17.954 524 HA LYS 64 HA LYS 64 8.813 -6.928 20.181 525 1HB LYS 64 HB2 LYS 64 8.489 -7.868 17.304 526 2HB LYS 64 HB3 LYS 64 8.415 -8.894 18.738 527 1HG LYS 64 HG2 LYS 64 6.547 -7.262 19.572 528 2HG LYS 64 HG3 LYS 64 6.569 -6.629 17.927 529 1HD LYS 64 HD2 LYS 64 4.930 -8.197 17.645 530 2HD LYS 64 HD3 LYS 64 6.320 -9.243 17.308 531 1HE LYS 64 HE2 LYS 64 4.822 -8.956 19.965 532 2HE LYS 64 HE3 LYS 64 4.704 -10.318 18.841 533 1HZ LYS 64 HZ1 LYS 64 7.022 -10.765 19.244 534 2HZ LYS 64 HZ2 LYS 64 7.112 -9.513 20.310 535 3HZ LYS 64 HZ3 LYS 64 6.155 -10.810 20.646 536 H ASP 65 H ASP 65 11.042 -5.609 20.081 537 HA ASP 65 HA ASP 65 13.249 -5.672 20.250 538 1HB ASP 65 HB2 ASP 65 14.147 -7.610 21.556 539 2HB ASP 65 HB3 ASP 65 12.767 -6.753 22.239 540 H GLN 66 H GLN 66 13.110 -9.095 19.356 541 HA GLN 66 HA GLN 66 15.580 -8.753 17.904 542 1HB GLN 66 HB2 GLN 66 14.942 -10.703 19.361 543 2HB GLN 66 HB3 GLN 66 13.831 -11.222 18.088 544 1HG GLN 66 HG2 GLN 66 15.842 -11.319 16.516 545 2HG GLN 66 HG3 GLN 66 16.864 -10.845 17.875 546 1HE2 GLN 66 HE21 GLN 66 14.345 -13.309 17.053 547 2HE2 GLN 66 HE22 GLN 66 15.168 -14.627 17.886 548 H GLU 67 H GLU 67 12.160 -9.099 17.002 549 HA GLU 67 HA GLU 67 12.852 -8.909 14.088 550 1HB GLU 67 HB2 GLU 67 10.977 -10.831 15.538 551 2HB GLU 67 HB3 GLU 67 10.612 -10.262 13.913 552 1HG GLU 67 HG2 GLU 67 11.648 -12.453 13.834 553 2HG GLU 67 HG3 GLU 67 12.603 -11.249 12.986 554 H VAL 68 H VAL 68 11.237 -7.815 12.865 555 HA VAL 68 HA VAL 68 9.294 -6.214 14.484 556 HB VAL 68 HB VAL 68 10.609 -4.911 12.904 557 1HG1 VAL 68 HG11 VAL 68 11.074 -6.463 11.099 558 2HG1 VAL 68 HG12 VAL 68 9.344 -6.535 10.679 559 3HG1 VAL 68 HG13 VAL 68 10.251 -5.030 10.492 560 1HG2 VAL 68 HG21 VAL 68 7.701 -5.146 12.057 561 2HG2 VAL 68 HG22 VAL 68 8.259 -4.311 13.521 562 3HG2 VAL 68 HG23 VAL 68 8.739 -3.721 11.926 563 H ASN 69 H ASN 69 7.171 -6.881 14.504 564 HA ASN 69 HA ASN 69 6.440 -9.277 12.935 565 1HB ASN 69 HB2 ASN 69 5.539 -9.389 15.118 566 2HB ASN 69 HB3 ASN 69 5.065 -7.679 15.104 567 1HD2 ASN 69 HD21 ASN 69 4.311 -10.791 13.255 568 2HD2 ASN 69 HD22 ASN 69 2.618 -10.380 13.161 569 H PHE 70 H PHE 70 4.777 -9.285 11.427 570 HA PHE 70 HA PHE 70 4.624 -7.422 9.460 571 1HB PHE 70 HB2 PHE 70 3.681 -9.639 9.270 572 2HB PHE 70 HB3 PHE 70 2.456 -9.276 10.485 573 HD1 PHE 70 HD1 PHE 70 3.748 -7.982 7.195 574 HD2 PHE 70 HD2 PHE 70 0.352 -8.477 9.799 575 HE1 PHE 70 HE1 PHE 70 2.323 -6.769 5.573 576 HE2 PHE 70 HE2 PHE 70 -1.087 -7.355 8.136 577 HZ PHE 70 HZ PHE 70 -0.089 -6.414 6.063 578 H GLN 71 H GLN 71 2.269 -7.383 12.262 579 HA GLN 71 HA GLN 71 0.869 -5.136 11.147 580 1HB GLN 71 HB2 GLN 71 -0.242 -6.530 12.686 581 2HB GLN 71 HB3 GLN 71 0.968 -6.300 13.949 582 1HG GLN 71 HG2 GLN 71 -0.506 -3.863 12.894 583 2HG GLN 71 HG3 GLN 71 -1.347 -4.993 13.955 584 1HE2 GLN 71 HE22 GLN 71 0.979 -2.318 13.980 585 2HE2 GLN 71 HE21 GLN 71 1.395 -2.561 15.675 586 H GLU 72 H GLU 72 3.642 -5.400 13.375 587 HA GLU 72 HA GLU 72 3.684 -2.560 13.976 588 1HB GLU 72 HB2 GLU 72 5.732 -4.783 14.338 589 2HB GLU 72 HB3 GLU 72 6.021 -3.104 14.809 590 1HG GLU 72 HG2 GLU 72 3.696 -4.809 15.837 591 2HG GLU 72 HG3 GLU 72 5.195 -4.502 16.719 592 H TYR 73 H TYR 73 5.200 -4.632 11.532 593 HA TYR 73 HA TYR 73 6.803 -2.611 10.292 594 1HB TYR 73 HB2 TYR 73 7.333 -4.690 9.559 595 2HB TYR 73 HB3 TYR 73 5.684 -5.264 9.524 596 HD1 TYR 73 HD1 TYR 73 8.272 -3.457 7.601 597 HD2 TYR 73 HD2 TYR 73 4.261 -5.042 7.591 598 HE1 TYR 73 HE1 TYR 73 8.289 -3.521 5.117 599 HE2 TYR 73 HE2 TYR 73 4.246 -5.004 5.126 600 HH TYR 73 HH TYR 73 5.634 -4.943 3.240 601 H ILE 74 H ILE 74 3.375 -3.613 9.645 602 HA ILE 74 HA ILE 74 2.915 -1.605 7.685 603 HB ILE 74 HB ILE 74 0.951 -2.884 9.616 604 1HG1 ILE 74 HG12 ILE 74 2.050 -4.497 8.055 605 2HG1 ILE 74 HG13 ILE 74 0.317 -4.354 7.872 606 1HG2 ILE 74 HG21 ILE 74 -0.136 -0.930 8.916 607 2HG2 ILE 74 HG22 ILE 74 0.517 -1.018 7.265 608 3HG2 ILE 74 HG23 ILE 74 -0.733 -2.151 7.791 609 1HD1 ILE 74 HD11 ILE 74 0.668 -2.886 5.858 610 2HD1 ILE 74 HD12 ILE 74 2.423 -3.165 6.044 611 3HD1 ILE 74 HD13 ILE 74 1.327 -4.503 5.675 612 H THR 75 H THR 75 2.214 -1.441 11.247 613 HA THR 75 HA THR 75 1.407 1.217 11.376 614 HB THR 75 HB THR 75 3.109 -0.365 13.350 615 HG1 THR 75 HG1 THR 75 0.306 0.019 13.182 616 1HG2 THR 75 HG21 THR 75 1.348 2.090 13.778 617 2HG2 THR 75 HG22 THR 75 2.006 1.064 15.070 618 3HG2 THR 75 HG23 THR 75 3.102 1.984 14.027 619 H PHE 76 H PHE 76 4.784 -0.035 11.491 620 HA PHE 76 HA PHE 76 6.025 2.498 11.803 621 1HB PHE 76 HB2 PHE 76 7.179 0.351 12.190 622 2HB PHE 76 HB3 PHE 76 7.110 0.006 10.461 623 HD1 PHE 76 HD1 PHE 76 8.543 1.282 8.844 624 HD2 PHE 76 HD2 PHE 76 8.670 2.120 13.085 625 HE1 PHE 76 HE1 PHE 76 10.543 2.652 8.514 626 HE2 PHE 76 HE2 PHE 76 10.616 3.609 12.711 627 HZ PHE 76 HZ PHE 76 11.516 3.930 10.408 628 H LEU 77 H LEU 77 5.185 0.638 8.801 629 HA LEU 77 HA LEU 77 6.201 2.648 7.024 630 1HB LEU 77 HB2 LEU 77 4.041 0.540 6.692 631 2HB LEU 77 HB3 LEU 77 4.512 1.638 5.392 632 HG LEU 77 HG LEU 77 6.477 -0.218 6.816 633 1HD1 LEU 77 HD11 LEU 77 6.360 -1.528 4.702 634 2HD1 LEU 77 HD12 LEU 77 4.838 -1.560 5.620 635 3HD1 LEU 77 HD13 LEU 77 4.995 -0.530 4.172 636 1HD2 LEU 77 HD21 LEU 77 7.854 0.230 4.759 637 2HD2 LEU 77 HD22 LEU 77 6.673 1.469 4.279 638 3HD2 LEU 77 HD23 LEU 77 7.646 1.663 5.759 639 H GLY 78 H GLY 78 3.101 2.367 8.751 640 1HA GLY 78 HA2 GLY 78 1.842 4.666 7.651 641 2HA GLY 78 HA3 GLY 78 1.621 4.054 9.306 642 H ALA 79 H ALA 79 4.036 4.395 10.507 643 HA ALA 79 HA ALA 79 4.208 7.182 11.013 644 1HB ALA 79 HB1 ALA 79 6.253 6.695 12.236 645 2HB ALA 79 HB2 ALA 79 5.035 5.451 12.572 646 3HB ALA 79 HB3 ALA 79 6.389 5.102 11.475 647 H LEU 80 H LEU 80 6.209 5.136 8.863 648 HA LEU 80 HA LEU 80 7.993 7.112 7.973 649 1HB LEU 80 HB2 LEU 80 7.919 4.489 7.593 650 2HB LEU 80 HB3 LEU 80 6.988 4.916 6.162 651 HG LEU 80 HG LEU 80 8.947 6.520 5.590 652 1HD1 LEU 80 HD11 LEU 80 10.134 6.517 7.756 653 2HD1 LEU 80 HD12 LEU 80 10.324 4.755 7.658 654 3HD1 LEU 80 HD13 LEU 80 11.152 5.803 6.494 655 1HD2 LEU 80 HD21 LEU 80 9.423 3.495 5.708 656 2HD2 LEU 80 HD22 LEU 80 8.506 4.334 4.432 657 3HD2 LEU 80 HD23 LEU 80 10.247 4.615 4.608 658 H ALA 81 H ALA 81 4.809 6.121 6.668 659 HA ALA 81 HA ALA 81 4.649 7.950 4.503 660 1HB ALA 81 HB1 ALA 81 3.083 6.155 4.711 661 2HB ALA 81 HB2 ALA 81 2.449 6.794 6.235 662 3HB ALA 81 HB3 ALA 81 2.232 7.720 4.743 663 H MET 82 H MET 82 3.758 8.303 7.984 664 HA MET 82 HA MET 82 2.887 10.994 7.749 665 1HB MET 82 HB2 MET 82 2.422 9.444 9.644 666 2HB MET 82 HB3 MET 82 4.078 9.697 10.223 667 1HG MET 82 HG2 MET 82 3.662 12.038 10.607 668 2HG MET 82 HG3 MET 82 2.122 11.969 9.744 669 1HE MET 82 HE1 MET 82 4.044 10.760 12.960 670 2HE MET 82 HE2 MET 82 2.728 9.994 13.881 671 3HE MET 82 HE3 MET 82 3.317 9.233 12.390 672 H ILE 83 H ILE 83 6.197 9.673 8.318 673 HA ILE 83 HA ILE 83 7.510 12.208 8.532 674 HB ILE 83 HB ILE 83 8.650 9.780 7.085 675 1HG1 ILE 83 HG12 ILE 83 8.066 8.988 9.278 676 2HG1 ILE 83 HG13 ILE 83 9.799 9.204 9.174 677 1HG2 ILE 83 HG21 ILE 83 9.918 11.763 6.615 678 2HG2 ILE 83 HG22 ILE 83 9.962 12.213 8.328 679 3HG2 ILE 83 HG23 ILE 83 10.824 10.769 7.756 680 1HD1 ILE 83 HD11 ILE 83 9.586 11.348 10.435 681 2HD1 ILE 83 HD12 ILE 83 7.827 11.074 10.551 682 3HD1 ILE 83 HD13 ILE 83 8.955 9.948 11.323 683 H TYR 84 H TYR 84 6.636 10.252 5.659 684 HA TYR 84 HA TYR 84 7.359 12.314 3.753 685 1HB TYR 84 HB2 TYR 84 5.497 9.954 3.360 686 2HB TYR 84 HB3 TYR 84 6.353 10.839 2.110 687 HD1 TYR 84 HD1 TYR 84 6.270 7.805 2.654 688 HD2 TYR 84 HD2 TYR 84 9.126 10.898 3.608 689 HE1 TYR 84 HE1 TYR 84 8.115 6.148 2.559 690 HE2 TYR 84 HE2 TYR 84 10.946 9.247 3.529 691 HH TYR 84 HH TYR 84 11.526 7.063 3.103 692 H ASN 85 H ASN 85 5.683 13.401 5.760 693 HA ASN 85 HA ASN 85 3.097 13.828 5.549 694 1HB ASN 85 HB2 ASN 85 3.453 16.073 6.337 695 2HB ASN 85 HB3 ASN 85 4.646 15.004 7.074 696 1HD2 ASN 85 HD22 ASN 85 6.921 14.966 5.934 697 2HD2 ASN 85 HD21 ASN 85 7.423 16.497 5.250 698 H GLU 86 H GLU 86 5.394 15.237 3.153 699 HA GLU 86 HA GLU 86 3.628 16.885 1.765 700 1HB GLU 86 HB2 GLU 86 5.067 16.751 -0.101 701 2HB GLU 86 HB3 GLU 86 6.016 16.888 1.373 702 1HG GLU 86 HG2 GLU 86 5.586 14.314 -0.235 703 2HG GLU 86 HG3 GLU 86 6.989 15.370 -0.334 704 H ALA 87 H ALA 87 3.964 13.351 1.507 705 HA ALA 87 HA ALA 87 2.273 12.979 -0.786 706 1HB ALA 87 HB1 ALA 87 3.853 11.281 0.082 707 2HB ALA 87 HB2 ALA 87 2.879 11.137 1.561 708 3HB ALA 87 HB3 ALA 87 2.192 10.654 -0.004 709 H LEU 88 H LEU 88 1.640 13.456 2.671 710 HA LEU 88 HA LEU 88 -1.125 12.462 2.517 711 1HB LEU 88 HB2 LEU 88 0.537 13.728 4.738 712 2HB LEU 88 HB3 LEU 88 -1.157 13.298 4.881 713 HG LEU 88 HG LEU 88 -0.663 10.926 4.507 714 1HD1 LEU 88 HD11 LEU 88 1.316 10.927 3.142 715 2HD1 LEU 88 HD12 LEU 88 2.245 11.792 4.390 716 3HD1 LEU 88 HD13 LEU 88 1.677 10.127 4.657 717 1HD2 LEU 88 HD21 LEU 88 1.034 12.275 6.646 718 2HD2 LEU 88 HD22 LEU 88 -0.691 11.856 6.791 719 3HD2 LEU 88 HD23 LEU 88 0.529 10.575 6.652 720 H LYS 89 H LYS 89 0.555 15.564 3.135 721 HA LYS 89 HA LYS 89 -1.988 17.001 3.154 722 1HB LYS 89 HB2 LYS 89 -0.758 18.944 3.677 723 2HB LYS 89 HB3 LYS 89 -0.058 17.606 4.599 724 1HG LYS 89 HG2 LYS 89 1.743 17.435 2.838 725 2HG LYS 89 HG3 LYS 89 1.037 18.860 2.054 726 1HD LYS 89 HD2 LYS 89 1.445 20.209 4.079 727 2HD LYS 89 HD3 LYS 89 2.119 18.789 4.900 728 1HE LYS 89 HE2 LYS 89 3.906 20.251 4.029 729 2HE LYS 89 HE3 LYS 89 3.954 18.657 3.275 730 1HZ LYS 89 HZ1 LYS 89 4.236 20.420 1.691 731 2HZ LYS 89 HZ2 LYS 89 2.863 19.576 1.360 732 3HZ LYS 89 HZ3 LYS 89 2.767 21.060 2.072 733 H GLY 90 H GLY 90 0.465 16.286 0.701 734 1HA GLY 90 HA2 GLY 90 0.262 16.541 -1.582 735 2HA GLY 90 HA3 GLY 90 -1.164 17.568 -1.389 736 1H MET 1 H1 MET 1 12.240 -0.665 -6.655 737 2H MET 1 H2 MET 1 12.767 -0.526 -5.098 738 3H MET 1 H3 MET 1 13.730 -1.238 -6.221 739 HA MET 1 HA MET 1 14.533 0.910 -5.745 740 1HB MET 1 HB2 MET 1 14.520 1.850 -8.046 741 2HB MET 1 HB3 MET 1 14.988 0.154 -7.947 742 1HG MET 1 HG2 MET 1 12.853 -0.605 -8.743 743 2HG MET 1 HG3 MET 1 12.162 1.017 -8.694 744 1HE MET 1 HE1 MET 1 13.821 2.762 -11.743 745 2HE MET 1 HE2 MET 1 12.674 2.916 -10.393 746 3HE MET 1 HE3 MET 1 14.427 2.848 -10.078 747 H ALA 2 H ALA 2 12.559 1.229 -4.182 748 HA ALA 2 HA ALA 2 11.417 2.802 -3.051 749 1HB ALA 2 HB1 ALA 2 13.068 4.422 -3.918 750 2HB ALA 2 HB2 ALA 2 12.019 4.753 -5.309 751 3HB ALA 2 HB3 ALA 2 11.463 5.121 -3.670 752 H SER 3 H SER 3 10.730 3.389 -6.389 753 HA SER 3 HA SER 3 8.178 4.128 -6.494 754 1HB SER 3 HB2 SER 3 9.089 2.143 -8.583 755 2HB SER 3 HB3 SER 3 8.219 3.664 -8.742 756 HG SER 3 HG SER 3 10.991 3.307 -8.112 757 HA PRO 4 HA PRO 4 6.418 -0.314 -6.772 758 1HB PRO 4 HB2 PRO 4 8.317 -1.899 -5.032 759 2HB PRO 4 HB3 PRO 4 7.442 -2.427 -6.496 760 1HG PRO 4 HG2 PRO 4 10.084 -1.829 -6.632 761 2HG PRO 4 HG3 PRO 4 8.979 -1.233 -7.910 762 1HD PRO 4 HD2 PRO 4 9.954 0.250 -5.456 763 2HD PRO 4 HD3 PRO 4 10.018 0.777 -7.154 764 H LEU 5 H LEU 5 8.125 0.332 -3.649 765 HA LEU 5 HA LEU 5 5.720 -0.468 -2.175 766 1HB LEU 5 HB2 LEU 5 7.899 -0.909 -1.191 767 2HB LEU 5 HB3 LEU 5 8.304 0.816 -1.229 768 HG LEU 5 HG LEU 5 6.527 1.330 0.375 769 1HD1 LEU 5 HD11 LEU 5 5.872 -1.659 0.312 770 2HD1 LEU 5 HD12 LEU 5 5.272 -0.482 1.496 771 3HD1 LEU 5 HD13 LEU 5 4.790 -0.335 -0.189 772 1HD2 LEU 5 HD21 LEU 5 7.365 0.157 2.323 773 2HD2 LEU 5 HD22 LEU 5 8.100 -1.099 1.299 774 3HD2 LEU 5 HD23 LEU 5 8.719 0.572 1.255 775 H ASP 6 H ASP 6 7.483 2.516 -3.032 776 HA ASP 6 HA ASP 6 6.029 4.411 -1.626 777 1HB ASP 6 HB2 ASP 6 7.290 4.606 -4.384 778 2HB ASP 6 HB3 ASP 6 6.612 5.981 -3.511 779 H GLN 7 H GLN 7 5.201 3.075 -4.913 780 HA GLN 7 HA GLN 7 2.894 4.751 -5.142 781 1HB GLN 7 HB2 GLN 7 2.218 3.392 -6.977 782 2HB GLN 7 HB3 GLN 7 3.973 3.593 -7.022 783 1HG GLN 7 HG2 GLN 7 4.077 1.297 -5.828 784 2HG GLN 7 HG3 GLN 7 2.365 1.120 -6.224 785 1HE2 GLN 7 HE22 GLN 7 5.525 1.913 -7.673 786 2HE2 GLN 7 HE21 GLN 7 5.220 1.123 -9.232 787 H ALA 8 H ALA 8 3.362 1.588 -3.552 788 HA ALA 8 HA ALA 8 0.545 1.037 -3.272 789 1HB ALA 8 HB1 ALA 8 2.979 -0.135 -1.901 790 2HB ALA 8 HB2 ALA 8 1.304 -0.672 -1.654 791 3HB ALA 8 HB3 ALA 8 2.026 -0.769 -3.270 792 H ILE 9 H ILE 9 3.071 2.276 -0.955 793 HA ILE 9 HA ILE 9 1.114 2.779 1.104 794 HB ILE 9 HB ILE 9 2.729 4.244 2.169 795 1HG1 ILE 9 HG12 ILE 9 4.530 3.766 -0.201 796 2HG1 ILE 9 HG13 ILE 9 3.795 5.318 0.241 797 1HG2 ILE 9 HG21 ILE 9 3.992 1.676 1.175 798 2HG2 ILE 9 HG22 ILE 9 4.301 2.501 2.719 799 3HG2 ILE 9 HG23 ILE 9 2.726 1.780 2.419 800 1HD1 ILE 9 HD11 ILE 9 5.900 3.796 1.827 801 2HD1 ILE 9 HD12 ILE 9 6.049 5.361 1.023 802 3HD1 ILE 9 HD13 ILE 9 5.010 5.203 2.452 803 H GLY 10 H GLY 10 2.419 4.827 -1.522 804 1HA GLY 10 HA2 GLY 10 1.023 7.174 -1.314 805 2HA GLY 10 HA3 GLY 10 1.352 6.335 -2.838 806 H LEU 11 H LEU 11 -0.237 4.095 -2.706 807 HA LEU 11 HA LEU 11 -2.770 4.980 -3.424 808 1HB LEU 11 HB2 LEU 11 -1.504 2.684 -3.759 809 2HB LEU 11 HB3 LEU 11 -2.296 2.221 -2.258 810 HG LEU 11 HG LEU 11 -3.545 1.350 -4.064 811 1HD1 LEU 11 HD11 LEU 11 -5.139 3.729 -3.149 812 2HD1 LEU 11 HD12 LEU 11 -5.709 2.134 -3.676 813 3HD1 LEU 11 HD13 LEU 11 -4.801 2.281 -2.155 814 1HD2 LEU 11 HD21 LEU 11 -3.747 4.121 -5.283 815 2HD2 LEU 11 HD22 LEU 11 -2.701 2.793 -5.844 816 3HD2 LEU 11 HD23 LEU 11 -4.464 2.616 -5.892 817 H LEU 12 H LEU 12 -1.907 3.361 -0.317 818 HA LEU 12 HA LEU 12 -4.431 3.675 0.984 819 1HB LEU 12 HB2 LEU 12 -1.570 3.511 2.053 820 2HB LEU 12 HB3 LEU 12 -2.978 3.699 3.096 821 HG LEU 12 HG LEU 12 -3.952 1.613 2.197 822 1HD1 LEU 12 HD11 LEU 12 -2.775 1.366 0.044 823 2HD1 LEU 12 HD12 LEU 12 -1.211 1.276 0.898 824 3HD1 LEU 12 HD13 LEU 12 -2.408 -0.014 1.077 825 1HD2 LEU 12 HD21 LEU 12 -1.192 1.422 3.477 826 2HD2 LEU 12 HD22 LEU 12 -2.740 1.659 4.320 827 3HD2 LEU 12 HD23 LEU 12 -2.419 0.139 3.488 828 H ILE 13 H ILE 13 -1.594 5.849 0.861 829 HA ILE 13 HA ILE 13 -2.661 7.755 2.722 830 HB ILE 13 HB ILE 13 -0.420 7.798 0.664 831 1HG1 ILE 13 HG12 ILE 13 0.869 8.470 2.761 832 2HG1 ILE 13 HG13 ILE 13 -0.604 8.199 3.687 833 1HG2 ILE 13 HG21 ILE 13 0.166 10.084 1.334 834 2HG2 ILE 13 HG22 ILE 13 -1.344 10.053 0.446 835 3HG2 ILE 13 HG23 ILE 13 -1.369 10.216 2.219 836 1HD1 ILE 13 HD11 ILE 13 1.071 6.214 2.120 837 2HD1 ILE 13 HD12 ILE 13 0.842 6.228 3.850 838 3HD1 ILE 13 HD13 ILE 13 -0.508 5.764 2.845 839 H GLY 14 H GLY 14 -2.702 7.619 -0.829 840 1HA GLY 14 HA2 GLY 14 -4.109 9.997 -1.373 841 2HA GLY 14 HA3 GLY 14 -4.075 8.540 -2.387 842 H ILE 15 H ILE 15 -5.345 6.613 -1.092 843 HA ILE 15 HA ILE 15 -8.084 7.174 -1.283 844 HB ILE 15 HB ILE 15 -6.409 4.965 -0.121 845 1HG1 ILE 15 HG12 ILE 15 -8.698 5.134 -2.136 846 2HG1 ILE 15 HG13 ILE 15 -6.973 5.148 -2.519 847 1HG2 ILE 15 HG21 ILE 15 -9.378 5.173 0.446 848 2HG2 ILE 15 HG22 ILE 15 -8.394 3.704 0.644 849 3HG2 ILE 15 HG23 ILE 15 -8.051 5.114 1.621 850 1HD1 ILE 15 HD11 ILE 15 -8.592 2.833 -1.395 851 2HD1 ILE 15 HD12 ILE 15 -7.773 2.931 -2.952 852 3HD1 ILE 15 HD13 ILE 15 -6.833 2.834 -1.444 853 H PHE 16 H PHE 16 -6.028 7.250 1.654 854 HA PHE 16 HA PHE 16 -8.165 7.907 3.421 855 1HB PHE 16 HB2 PHE 16 -5.872 7.144 4.045 856 2HB PHE 16 HB3 PHE 16 -5.233 8.714 3.622 857 HD1 PHE 16 HD1 PHE 16 -7.191 6.811 6.078 858 HD2 PHE 16 HD2 PHE 16 -6.043 10.786 4.951 859 HE1 PHE 16 HE1 PHE 16 -7.328 7.520 8.456 860 HE2 PHE 16 HE2 PHE 16 -6.326 11.523 7.249 861 HZ PHE 16 HZ PHE 16 -6.749 9.839 9.075 862 H HIS 17 H HIS 17 -5.738 10.121 1.921 863 HA HIS 17 HA HIS 17 -7.013 12.395 3.103 864 1HB HIS 17 HB2 HIS 17 -4.842 12.182 1.003 865 2HB HIS 17 HB3 HIS 17 -5.399 13.708 1.707 866 HD1 HIS 17 HD1 HIS 17 -3.683 10.452 2.802 867 HD2 HIS 17 HD2 HIS 17 -4.872 14.189 4.304 868 HE1 HIS 17 HE1 HIS 17 -2.832 10.585 5.222 869 H LYS 18 H LYS 18 -7.445 10.816 0.031 870 HA LYS 18 HA LYS 18 -8.970 12.670 -1.446 871 1HB LYS 18 HB2 LYS 18 -8.275 10.513 -2.300 872 2HB LYS 18 HB3 LYS 18 -9.177 9.662 -1.037 873 1HG LYS 18 HG2 LYS 18 -11.311 10.416 -2.040 874 2HG LYS 18 HG3 LYS 18 -10.399 11.253 -3.318 875 1HD LYS 18 HD2 LYS 18 -9.313 9.078 -3.924 876 2HD LYS 18 HD3 LYS 18 -10.259 8.251 -2.680 877 1HE LYS 18 HE2 LYS 18 -11.437 9.727 -5.082 878 2HE LYS 18 HE3 LYS 18 -11.157 7.975 -4.990 879 1HZ LYS 18 HZ1 LYS 18 -12.899 9.441 -3.140 880 2HZ LYS 18 HZ2 LYS 18 -13.413 8.606 -4.467 881 3HZ LYS 18 HZ3 LYS 18 -12.673 7.805 -3.238 882 H TYR 19 H TYR 19 -9.862 10.514 1.295 883 HA TYR 19 HA TYR 19 -12.619 11.523 1.285 884 1HB TYR 19 HB2 TYR 19 -11.144 9.370 2.736 885 2HB TYR 19 HB3 TYR 19 -12.556 10.071 3.511 886 HD1 TYR 19 HD1 TYR 19 -14.782 9.793 2.695 887 HD2 TYR 19 HD2 TYR 19 -11.434 8.379 0.381 888 HE1 TYR 19 HE1 TYR 19 -16.333 8.844 1.018 889 HE2 TYR 19 HE2 TYR 19 -12.991 7.302 -1.205 890 HH TYR 19 HH TYR 19 -16.239 6.777 -0.458 891 H SER 20 H SER 20 -9.792 11.768 3.591 892 HA SER 20 HA SER 20 -10.982 13.428 5.424 893 1HB SER 20 HB2 SER 20 -8.163 13.834 4.381 894 2HB SER 20 HB3 SER 20 -8.790 14.310 5.956 895 HG SER 20 HG SER 20 -8.911 12.228 6.580 896 H GLY 21 H GLY 21 -9.489 14.503 2.358 897 1HA GLY 21 HA2 GLY 21 -9.753 17.263 2.557 898 2HA GLY 21 HA3 GLY 21 -9.810 16.326 1.055 899 H LYS 22 H LYS 22 -12.275 14.857 1.712 900 HA LYS 22 HA LYS 22 -14.128 16.364 0.319 901 1HB LYS 22 HB2 LYS 22 -14.270 13.928 0.789 902 2HB LYS 22 HB3 LYS 22 -14.628 14.306 2.491 903 1HG LYS 22 HG2 LYS 22 -16.737 15.378 1.875 904 2HG LYS 22 HG3 LYS 22 -16.380 15.148 0.158 905 1HD LYS 22 HD2 LYS 22 -17.981 13.496 1.053 906 2HD LYS 22 HD3 LYS 22 -16.520 12.727 0.400 907 1HE LYS 22 HE2 LYS 22 -15.646 12.346 2.649 908 2HE LYS 22 HE3 LYS 22 -16.965 13.293 3.372 909 1HZ LYS 22 HZ1 LYS 22 -18.485 11.635 2.569 910 2HZ LYS 22 HZ2 LYS 22 -17.252 10.775 1.889 911 3HZ LYS 22 HZ3 LYS 22 -17.331 10.949 3.525 912 H GLU 23 H GLU 23 -13.723 16.137 3.847 913 HA GLU 23 HA GLU 23 -15.649 18.403 4.235 914 1HB GLU 23 HB2 GLU 23 -15.986 17.365 6.522 915 2HB GLU 23 HB3 GLU 23 -16.675 16.493 5.149 916 1HG GLU 23 HG2 GLU 23 -14.903 14.861 5.156 917 2HG GLU 23 HG3 GLU 23 -13.965 15.791 6.335 918 H GLY 24 H GLY 24 -12.640 18.366 3.696 919 1HA GLY 24 HA2 GLY 24 -10.732 19.326 4.479 920 2HA GLY 24 HA3 GLY 24 -11.805 20.452 5.327 921 H ASP 25 H ASP 25 -11.471 16.938 5.925 922 HA ASP 25 HA ASP 25 -10.872 17.430 8.752 923 1HB ASP 25 HB2 ASP 25 -12.350 15.549 7.869 924 2HB ASP 25 HB3 ASP 25 -10.878 14.764 7.280 925 H LYS 26 H LYS 26 -8.875 16.472 9.705 926 HA LYS 26 HA LYS 26 -6.548 17.353 8.122 927 1HB LYS 26 HB2 LYS 26 -6.687 16.400 11.011 928 2HB LYS 26 HB3 LYS 26 -5.363 17.290 10.226 929 1HG LYS 26 HG2 LYS 26 -6.926 19.197 9.825 930 2HG LYS 26 HG3 LYS 26 -8.173 18.345 10.757 931 1HD LYS 26 HD2 LYS 26 -6.591 18.225 12.706 932 2HD LYS 26 HD3 LYS 26 -5.450 19.237 11.806 933 1HE LYS 26 HE2 LYS 26 -8.299 20.003 12.621 934 2HE LYS 26 HE3 LYS 26 -6.808 20.570 13.390 935 1HZ LYS 26 HZ1 LYS 26 -7.615 21.098 10.617 936 2HZ LYS 26 HZ2 LYS 26 -7.647 22.170 11.865 937 3HZ LYS 26 HZ3 LYS 26 -6.205 21.597 11.311 938 H HIS 27 H HIS 27 -4.838 15.374 9.820 939 HA HIS 27 HA HIS 27 -4.878 13.159 7.900 940 1HB HIS 27 HB2 HIS 27 -3.182 13.633 10.367 941 2HB HIS 27 HB3 HIS 27 -2.942 12.359 9.164 942 HD1 HIS 27 HD1 HIS 27 -3.002 13.747 6.458 943 HD2 HIS 27 HD2 HIS 27 -1.430 15.525 9.944 944 HE1 HIS 27 HE1 HIS 27 -1.480 15.653 5.698 945 H THR 28 H THR 28 -7.323 13.204 8.907 946 HA THR 28 HA THR 28 -7.642 10.972 10.774 947 HB THR 28 HB THR 28 -9.426 12.654 11.866 948 HG1 THR 28 HG1 THR 28 -9.049 14.528 10.882 949 1HG2 THR 28 HG21 THR 28 -7.724 11.585 13.209 950 2HG2 THR 28 HG22 THR 28 -6.455 12.650 12.547 951 3HG2 THR 28 HG23 THR 28 -7.739 13.312 13.574 952 H LEU 29 H LEU 29 -9.806 10.177 10.711 953 HA LEU 29 HA LEU 29 -11.593 11.236 8.567 954 1HB LEU 29 HB2 LEU 29 -10.834 8.313 8.993 955 2HB LEU 29 HB3 LEU 29 -12.232 8.836 8.052 956 HG LEU 29 HG LEU 29 -9.362 9.569 7.353 957 1HD1 LEU 29 HD11 LEU 29 -9.634 7.861 5.568 958 2HD1 LEU 29 HD12 LEU 29 -9.763 7.123 7.178 959 3HD1 LEU 29 HD13 LEU 29 -11.228 7.434 6.221 960 1HD2 LEU 29 HD21 LEU 29 -11.965 9.788 5.791 961 2HD2 LEU 29 HD22 LEU 29 -11.010 11.155 6.410 962 3HD2 LEU 29 HD23 LEU 29 -10.341 10.109 5.150 963 H SER 30 H SER 30 -13.722 11.319 9.270 964 HA SER 30 HA SER 30 -14.312 10.397 12.022 965 1HB SER 30 HB2 SER 30 -16.126 11.660 9.923 966 2HB SER 30 HB3 SER 30 -16.519 11.374 11.633 967 HG SER 30 HG SER 30 -14.409 13.018 10.647 968 H LYS 31 H LYS 31 -15.973 8.717 12.467 969 HA LYS 31 HA LYS 31 -15.369 6.476 10.960 970 1HB LYS 31 HB2 LYS 31 -16.966 5.245 12.298 971 2HB LYS 31 HB3 LYS 31 -15.891 6.305 13.206 972 1HG LYS 31 HG2 LYS 31 -17.792 7.991 13.365 973 2HG LYS 31 HG3 LYS 31 -18.861 6.751 12.667 974 1HD LYS 31 HD2 LYS 31 -18.270 5.198 14.508 975 2HD LYS 31 HD3 LYS 31 -17.082 6.358 15.111 976 1HE LYS 31 HE2 LYS 31 -18.956 8.001 15.503 977 2HE LYS 31 HE3 LYS 31 -20.100 6.696 15.139 978 1HZ LYS 31 HZ1 LYS 31 -19.612 6.929 17.496 979 2HZ LYS 31 HZ2 LYS 31 -19.146 5.451 16.933 980 3HZ LYS 31 HZ3 LYS 31 -18.013 6.611 17.214 981 H LYS 32 H LYS 32 -18.365 8.423 10.643 982 HA LYS 32 HA LYS 32 -19.531 6.587 8.726 983 1HB LYS 32 HB2 LYS 32 -20.919 8.043 10.004 984 2HB LYS 32 HB3 LYS 32 -20.149 9.495 9.319 985 1HG LYS 32 HG2 LYS 32 -21.015 8.916 7.079 986 2HG LYS 32 HG3 LYS 32 -21.678 7.396 7.716 987 1HD LYS 32 HD2 LYS 32 -23.227 8.651 9.168 988 2HD LYS 32 HD3 LYS 32 -22.471 10.180 8.697 989 1HE LYS 32 HE2 LYS 32 -24.577 9.868 7.488 990 2HE LYS 32 HE3 LYS 32 -23.211 9.875 6.362 991 1HZ LYS 32 HZ1 LYS 32 -23.324 7.494 6.301 992 2HZ LYS 32 HZ2 LYS 32 -24.572 7.477 7.380 993 3HZ LYS 32 HZ3 LYS 32 -24.778 8.142 5.886 994 H GLU 33 H GLU 33 -17.459 9.453 8.426 995 HA GLU 33 HA GLU 33 -17.421 9.691 5.573 996 1HB GLU 33 HB2 GLU 33 -16.563 11.412 7.080 997 2HB GLU 33 HB3 GLU 33 -15.377 10.280 7.733 998 1HG GLU 33 HG2 GLU 33 -14.278 10.183 5.474 999 2HG GLU 33 HG3 GLU 33 -15.403 11.443 4.941 1000 H LEU 34 H LEU 34 -15.388 7.856 7.882 1001 HA LEU 34 HA LEU 34 -13.855 6.413 6.005 1002 1HB LEU 34 HB2 LEU 34 -13.110 6.440 8.206 1003 2HB LEU 34 HB3 LEU 34 -14.658 5.984 8.874 1004 HG LEU 34 HG LEU 34 -12.983 4.277 9.123 1005 1HD1 LEU 34 HD11 LEU 34 -15.529 3.849 8.745 1006 2HD1 LEU 34 HD12 LEU 34 -15.006 2.986 7.297 1007 3HD1 LEU 34 HD13 LEU 34 -14.420 2.483 8.875 1008 1HD2 LEU 34 HD21 LEU 34 -11.627 4.601 7.149 1009 2HD2 LEU 34 HD22 LEU 34 -12.203 2.925 7.167 1010 3HD2 LEU 34 HD23 LEU 34 -12.946 4.099 6.085 1011 H LYS 35 H LYS 35 -17.106 5.612 7.438 1012 HA LYS 35 HA LYS 35 -17.391 3.167 6.124 1013 1HB LYS 35 HB2 LYS 35 -19.017 4.331 7.763 1014 2HB LYS 35 HB3 LYS 35 -19.742 5.088 6.332 1015 1HG LYS 35 HG2 LYS 35 -20.077 2.813 5.330 1016 2HG LYS 35 HG3 LYS 35 -19.344 2.112 6.781 1017 1HD LYS 35 HD2 LYS 35 -21.220 3.287 8.111 1018 2HD LYS 35 HD3 LYS 35 -21.990 3.591 6.543 1019 1HE LYS 35 HE2 LYS 35 -21.916 1.118 6.075 1020 2HE LYS 35 HE3 LYS 35 -21.182 0.855 7.667 1021 1HZ LYS 35 HZ1 LYS 35 -23.147 1.766 8.664 1022 2HZ LYS 35 HZ2 LYS 35 -23.840 2.006 7.186 1023 3HZ LYS 35 HZ3 LYS 35 -23.521 0.477 7.711 1024 H GLU 36 H GLU 36 -18.109 6.435 4.899 1025 HA GLU 36 HA GLU 36 -18.925 5.649 2.299 1026 1HB GLU 36 HB2 GLU 36 -19.144 7.931 3.554 1027 2HB GLU 36 HB3 GLU 36 -17.539 8.278 2.921 1028 1HG GLU 36 HG2 GLU 36 -19.180 9.221 1.406 1029 2HG GLU 36 HG3 GLU 36 -18.456 7.835 0.580 1030 H LEU 37 H LEU 37 -15.675 6.339 3.614 1031 HA LEU 37 HA LEU 37 -14.214 5.974 1.169 1032 1HB LEU 37 HB2 LEU 37 -13.175 6.860 3.197 1033 2HB LEU 37 HB3 LEU 37 -13.381 5.340 4.036 1034 HG LEU 37 HG LEU 37 -11.711 5.478 1.528 1035 1HD1 LEU 37 HD11 LEU 37 -10.835 7.129 3.161 1036 2HD1 LEU 37 HD12 LEU 37 -10.809 5.864 4.419 1037 3HD1 LEU 37 HD13 LEU 37 -9.747 5.745 3.008 1038 1HD2 LEU 37 HD21 LEU 37 -11.774 3.609 3.965 1039 2HD2 LEU 37 HD22 LEU 37 -12.201 3.163 2.299 1040 3HD2 LEU 37 HD23 LEU 37 -10.539 3.563 2.696 1041 H ILE 38 H ILE 38 -15.126 3.570 3.643 1042 HA ILE 38 HA ILE 38 -14.062 1.381 2.203 1043 HB ILE 38 HB ILE 38 -16.284 1.555 4.265 1044 1HG1 ILE 38 HG12 ILE 38 -13.309 0.847 4.336 1045 2HG1 ILE 38 HG13 ILE 38 -14.057 2.305 4.984 1046 1HG2 ILE 38 HG21 ILE 38 -14.852 -0.979 3.372 1047 2HG2 ILE 38 HG22 ILE 38 -16.117 -0.826 4.599 1048 3HG2 ILE 38 HG23 ILE 38 -16.519 -0.573 2.910 1049 1HD1 ILE 38 HD11 ILE 38 -14.337 -0.515 5.975 1050 2HD1 ILE 38 HD12 ILE 38 -13.670 0.904 6.814 1051 3HD1 ILE 38 HD13 ILE 38 -15.423 0.795 6.520 1052 H GLN 39 H GLN 39 -17.408 2.738 2.090 1053 HA GLN 39 HA GLN 39 -18.403 0.674 0.441 1054 1HB GLN 39 HB2 GLN 39 -19.296 3.595 0.414 1055 2HB GLN 39 HB3 GLN 39 -20.176 2.213 -0.229 1056 1HG GLN 39 HG2 GLN 39 -19.949 3.143 2.575 1057 2HG GLN 39 HG3 GLN 39 -21.285 2.402 1.725 1058 1HE2 GLN 39 HE22 GLN 39 -18.469 1.826 3.718 1059 2HE2 GLN 39 HE21 GLN 39 -18.759 0.100 3.961 1060 H LYS 40 H LYS 40 -16.614 3.618 -0.512 1061 HA LYS 40 HA LYS 40 -16.998 2.993 -3.357 1062 1HB LYS 40 HB2 LYS 40 -16.856 5.325 -2.407 1063 2HB LYS 40 HB3 LYS 40 -15.183 5.002 -1.976 1064 1HG LYS 40 HG2 LYS 40 -15.285 6.292 -4.014 1065 2HG LYS 40 HG3 LYS 40 -14.567 4.716 -4.336 1066 1HD LYS 40 HD2 LYS 40 -16.111 5.455 -6.109 1067 2HD LYS 40 HD3 LYS 40 -16.614 3.918 -5.400 1068 1HE LYS 40 HE2 LYS 40 -18.361 5.063 -4.082 1069 2HE LYS 40 HE3 LYS 40 -17.769 6.646 -4.629 1070 1HZ LYS 40 HZ1 LYS 40 -18.909 4.546 -6.336 1071 2HZ LYS 40 HZ2 LYS 40 -19.674 5.919 -5.845 1072 3HZ LYS 40 HZ3 LYS 40 -18.373 6.018 -6.851 1073 H GLU 41 H GLU 41 -14.276 3.094 -1.073 1074 HA GLU 41 HA GLU 41 -12.388 2.209 -3.067 1075 1HB GLU 41 HB2 GLU 41 -11.979 2.741 -0.110 1076 2HB GLU 41 HB3 GLU 41 -10.739 2.606 -1.354 1077 1HG GLU 41 HG2 GLU 41 -12.880 4.784 -1.163 1078 2HG GLU 41 HG3 GLU 41 -11.169 4.973 -0.831 1079 H LEU 42 H LEU 42 -14.150 0.548 -0.527 1080 HA LEU 42 HA LEU 42 -12.752 -1.983 -1.326 1081 1HB LEU 42 HB2 LEU 42 -13.924 -1.167 1.342 1082 2HB LEU 42 HB3 LEU 42 -13.662 -2.855 0.891 1083 HG LEU 42 HG LEU 42 -11.440 -0.766 0.962 1084 1HD1 LEU 42 HD11 LEU 42 -12.197 -2.887 3.018 1085 2HD1 LEU 42 HD12 LEU 42 -10.761 -1.843 3.080 1086 3HD1 LEU 42 HD13 LEU 42 -12.375 -1.129 3.213 1087 1HD2 LEU 42 HD21 LEU 42 -10.819 -2.631 -0.493 1088 2HD2 LEU 42 HD22 LEU 42 -9.996 -2.865 1.047 1089 3HD2 LEU 42 HD23 LEU 42 -11.443 -3.813 0.680 1090 H THR 43 H THR 43 -14.119 -1.517 -3.142 1091 HA THR 43 HA THR 43 -16.823 -1.109 -3.076 1092 HB THR 43 HB THR 43 -15.501 -2.451 -5.438 1093 HG1 THR 43 HG1 THR 43 -14.716 0.108 -4.580 1094 1HG2 THR 43 HG21 THR 43 -17.009 0.181 -5.098 1095 2HG2 THR 43 HG22 THR 43 -16.473 -0.538 -6.630 1096 3HG2 THR 43 HG23 THR 43 -17.718 -1.350 -5.661 1097 H ILE 44 H ILE 44 -17.119 -3.055 -1.334 1098 HA ILE 44 HA ILE 44 -17.565 -5.649 -2.455 1099 HB ILE 44 HB ILE 44 -18.714 -6.248 -0.501 1100 1HG1 ILE 44 HG12 ILE 44 -20.158 -4.454 0.141 1101 2HG1 ILE 44 HG13 ILE 44 -19.082 -4.865 1.454 1102 1HG2 ILE 44 HG21 ILE 44 -16.298 -4.548 0.198 1103 2HG2 ILE 44 HG22 ILE 44 -16.947 -5.907 1.128 1104 3HG2 ILE 44 HG23 ILE 44 -16.280 -6.180 -0.489 1105 1HD1 ILE 44 HD11 ILE 44 -19.386 -2.468 1.331 1106 2HD1 ILE 44 HD12 ILE 44 -17.697 -2.874 1.013 1107 3HD1 ILE 44 HD13 ILE 44 -18.782 -2.421 -0.327 1108 H GLY 45 H GLY 45 -18.793 -5.821 -4.231 1109 1HA GLY 45 HA2 GLY 45 -21.125 -4.239 -4.793 1110 2HA GLY 45 HA3 GLY 45 -20.552 -5.656 -5.680 1111 H SER 46 H SER 46 -21.829 -4.998 -2.444 1112 HA SER 46 HA SER 46 -24.305 -6.365 -2.512 1113 1HB SER 46 HB2 SER 46 -21.928 -7.975 -1.461 1114 2HB SER 46 HB3 SER 46 -23.574 -8.221 -0.861 1115 HG SER 46 HG SER 46 -22.973 -8.326 -3.623 1116 H LYS 47 H LYS 47 -24.405 -4.116 -1.667 1117 HA LYS 47 HA LYS 47 -23.034 -3.512 0.820 1118 1HB LYS 47 HB2 LYS 47 -25.295 -2.041 -0.628 1119 2HB LYS 47 HB3 LYS 47 -24.311 -1.367 0.676 1120 1HG LYS 47 HG2 LYS 47 -23.238 -2.204 -2.071 1121 2HG LYS 47 HG3 LYS 47 -23.710 -0.570 -1.596 1122 1HD LYS 47 HD2 LYS 47 -21.980 -0.575 0.192 1123 2HD LYS 47 HD3 LYS 47 -21.502 -2.213 -0.274 1124 1HE LYS 47 HE2 LYS 47 -19.958 -0.575 -1.216 1125 2HE LYS 47 HE3 LYS 47 -20.810 -1.438 -2.502 1126 1HZ LYS 47 HZ1 LYS 47 -21.536 1.225 -1.499 1127 2HZ LYS 47 HZ2 LYS 47 -20.642 0.931 -2.853 1128 3HZ LYS 47 HZ3 LYS 47 -22.215 0.442 -2.781 1129 H LEU 48 H LEU 48 -23.686 -5.358 1.846 1130 HA LEU 48 HA LEU 48 -26.372 -5.256 3.174 1131 1HB LEU 48 HB2 LEU 48 -26.373 -6.629 1.168 1132 2HB LEU 48 HB3 LEU 48 -24.854 -7.386 1.642 1133 HG LEU 48 HG LEU 48 -26.006 -8.551 3.518 1134 1HD1 LEU 48 HD11 LEU 48 -27.917 -6.999 3.882 1135 2HD1 LEU 48 HD12 LEU 48 -28.518 -7.340 2.245 1136 3HD1 LEU 48 HD13 LEU 48 -28.497 -8.622 3.475 1137 1HD2 LEU 48 HD21 LEU 48 -27.128 -10.110 1.928 1138 2HD2 LEU 48 HD22 LEU 48 -27.100 -8.821 0.690 1139 3HD2 LEU 48 HD23 LEU 48 -25.579 -9.490 1.296 1140 H GLN 49 H GLN 49 -22.981 -6.221 3.435 1141 HA GLN 49 HA GLN 49 -23.380 -7.546 6.016 1142 1HB GLN 49 HB2 GLN 49 -20.778 -6.658 4.709 1143 2HB GLN 49 HB3 GLN 49 -20.976 -7.764 6.062 1144 1HG GLN 49 HG2 GLN 49 -20.522 -9.109 4.158 1145 2HG GLN 49 HG3 GLN 49 -22.209 -9.366 4.619 1146 1HE2 GLN 49 HE22 GLN 49 -20.524 -6.824 2.629 1147 2HE2 GLN 49 HE21 GLN 49 -21.647 -6.969 1.283 1148 H ASP 50 H ASP 50 -24.530 -5.001 6.139 1149 HA ASP 50 HA ASP 50 -22.819 -2.843 6.674 1150 1HB ASP 50 HB2 ASP 50 -24.747 -1.675 7.463 1151 2HB ASP 50 HB3 ASP 50 -25.256 -2.676 6.097 1152 H ALA 51 H ALA 51 -24.402 -5.101 8.887 1153 HA ALA 51 HA ALA 51 -23.538 -4.161 11.377 1154 1HB ALA 51 HB1 ALA 51 -23.771 -7.042 10.439 1155 2HB ALA 51 HB2 ALA 51 -23.743 -6.486 12.129 1156 3HB ALA 51 HB3 ALA 51 -25.085 -6.018 11.061 1157 H GLU 52 H GLU 52 -21.735 -6.169 9.015 1158 HA GLU 52 HA GLU 52 -19.456 -6.575 10.766 1159 1HB GLU 52 HB2 GLU 52 -19.518 -6.838 7.735 1160 2HB GLU 52 HB3 GLU 52 -18.396 -7.578 8.878 1161 1HG GLU 52 HG2 GLU 52 -21.358 -8.244 8.534 1162 2HG GLU 52 HG3 GLU 52 -19.973 -9.265 8.146 1163 H ILE 53 H ILE 53 -20.315 -4.365 8.077 1164 HA ILE 53 HA ILE 53 -17.853 -2.942 8.064 1165 HB ILE 53 HB ILE 53 -20.589 -1.756 7.486 1166 1HG1 ILE 53 HG12 ILE 53 -20.297 -3.661 6.008 1167 2HG1 ILE 53 HG13 ILE 53 -20.092 -2.169 5.112 1168 1HG2 ILE 53 HG21 ILE 53 -18.924 -0.032 7.802 1169 2HG2 ILE 53 HG22 ILE 53 -17.765 -0.862 6.763 1170 3HG2 ILE 53 HG23 ILE 53 -19.256 -0.189 6.074 1171 1HD1 ILE 53 HD11 ILE 53 -17.854 -4.005 6.078 1172 2HD1 ILE 53 HD12 ILE 53 -18.442 -3.810 4.418 1173 3HD1 ILE 53 HD13 ILE 53 -17.610 -2.468 5.218 1174 H VAL 54 H VAL 54 -20.808 -2.328 10.107 1175 HA VAL 54 HA VAL 54 -19.426 -0.136 11.354 1176 HB VAL 54 HB VAL 54 -21.200 -0.050 13.031 1177 1HG1 VAL 54 HG11 VAL 54 -21.807 0.086 10.059 1178 2HG1 VAL 54 HG12 VAL 54 -22.878 0.753 11.316 1179 3HG1 VAL 54 HG13 VAL 54 -21.236 1.380 11.127 1180 1HG2 VAL 54 HG21 VAL 54 -22.623 -2.118 11.352 1181 2HG2 VAL 54 HG22 VAL 54 -21.924 -2.444 12.956 1182 3HG2 VAL 54 HG23 VAL 54 -23.238 -1.269 12.771 1183 H LYS 55 H LYS 55 -19.620 -3.588 12.265 1184 HA LYS 55 HA LYS 55 -18.263 -3.270 14.764 1185 1HB LYS 55 HB2 LYS 55 -19.188 -5.399 14.181 1186 2HB LYS 55 HB3 LYS 55 -18.242 -5.494 12.694 1187 1HG LYS 55 HG2 LYS 55 -17.393 -6.975 14.473 1188 2HG LYS 55 HG3 LYS 55 -16.183 -5.827 13.895 1189 1HD LYS 55 HD2 LYS 55 -16.516 -4.412 15.892 1190 2HD LYS 55 HD3 LYS 55 -17.818 -5.475 16.459 1191 1HE LYS 55 HE2 LYS 55 -16.254 -7.298 16.795 1192 2HE LYS 55 HE3 LYS 55 -14.968 -6.437 15.926 1193 1HZ LYS 55 HZ1 LYS 55 -14.706 -6.321 18.293 1194 2HZ LYS 55 HZ2 LYS 55 -14.889 -4.831 17.618 1195 3HZ LYS 55 HZ3 LYS 55 -16.141 -5.521 18.450 1196 H LEU 56 H LEU 56 -17.002 -3.708 11.430 1197 HA LEU 56 HA LEU 56 -14.258 -3.380 12.038 1198 1HB LEU 56 HB2 LEU 56 -14.881 -4.342 10.033 1199 2HB LEU 56 HB3 LEU 56 -15.933 -3.024 9.549 1200 HG LEU 56 HG LEU 56 -13.042 -2.341 9.943 1201 1HD1 LEU 56 HD11 LEU 56 -12.526 -3.106 7.634 1202 2HD1 LEU 56 HD12 LEU 56 -12.884 -4.470 8.710 1203 3HD1 LEU 56 HD13 LEU 56 -14.106 -3.908 7.550 1204 1HD2 LEU 56 HD21 LEU 56 -14.770 -0.638 9.237 1205 2HD2 LEU 56 HD22 LEU 56 -13.488 -0.925 8.050 1206 3HD2 LEU 56 HD23 LEU 56 -15.115 -1.634 7.821 1207 H MET 57 H MET 57 -16.747 -0.886 11.307 1208 HA MET 57 HA MET 57 -15.019 1.368 11.370 1209 1HB MET 57 HB2 MET 57 -17.936 1.121 12.185 1210 2HB MET 57 HB3 MET 57 -17.056 2.637 12.126 1211 1HG MET 57 HG2 MET 57 -16.743 2.603 9.862 1212 2HG MET 57 HG3 MET 57 -17.070 0.892 9.661 1213 1HE MET 57 HE1 MET 57 -19.354 3.334 11.806 1214 2HE MET 57 HE2 MET 57 -18.633 4.386 10.565 1215 3HE MET 57 HE3 MET 57 -20.371 4.019 10.521 1216 H ASP 58 H ASP 58 -16.861 -0.224 14.026 1217 HA ASP 58 HA ASP 58 -15.933 1.404 16.156 1218 1HB ASP 58 HB2 ASP 58 -17.766 -0.269 16.292 1219 2HB ASP 58 HB3 ASP 58 -16.583 -1.575 16.175 1220 H ASP 59 H ASP 59 -14.512 -1.581 14.811 1221 HA ASP 59 HA ASP 59 -12.228 -1.625 16.470 1222 1HB ASP 59 HB2 ASP 59 -12.404 -2.604 13.598 1223 2HB ASP 59 HB3 ASP 59 -11.208 -3.076 14.813 1224 H LEU 60 H LEU 60 -12.634 0.045 13.308 1225 HA LEU 60 HA LEU 60 -9.976 1.183 13.243 1226 1HB LEU 60 HB2 LEU 60 -12.643 1.759 11.935 1227 2HB LEU 60 HB3 LEU 60 -11.372 2.969 11.816 1228 HG LEU 60 HG LEU 60 -10.730 0.135 11.096 1229 1HD1 LEU 60 HD11 LEU 60 -12.782 0.567 9.835 1230 2HD1 LEU 60 HD12 LEU 60 -12.100 2.096 9.237 1231 3HD1 LEU 60 HD13 LEU 60 -11.377 0.562 8.738 1232 1HD2 LEU 60 HD21 LEU 60 -9.218 1.286 9.459 1233 2HD2 LEU 60 HD22 LEU 60 -9.901 2.844 9.899 1234 3HD2 LEU 60 HD23 LEU 60 -8.939 1.940 11.095 1235 H ASP 61 H ASP 61 -13.077 2.593 14.307 1236 HA ASP 61 HA ASP 61 -11.868 5.041 15.099 1237 1HB ASP 61 HB2 ASP 61 -13.973 5.822 15.744 1238 2HB ASP 61 HB3 ASP 61 -14.164 4.898 14.254 1239 H ARG 62 H ARG 62 -12.023 2.062 16.806 1240 HA ARG 62 HA ARG 62 -11.795 2.556 19.452 1241 1HB ARG 62 HB2 ARG 62 -9.877 1.213 17.526 1242 2HB ARG 62 HB3 ARG 62 -9.429 1.303 19.231 1243 1HG ARG 62 HG2 ARG 62 -12.030 0.087 18.307 1244 2HG ARG 62 HG3 ARG 62 -10.546 -0.842 18.470 1245 1HD ARG 62 HD2 ARG 62 -10.370 -0.470 20.804 1246 2HD ARG 62 HD3 ARG 62 -11.588 0.797 20.825 1247 HE ARG 62 HE ARG 62 -12.032 -2.050 20.952 1248 1HH1 ARG 62 HH12 ARG 62 -13.415 0.966 19.754 1249 2HH1 ARG 62 HH11 ARG 62 -15.051 0.386 19.688 1250 1HH2 ARG 62 HH22 ARG 62 -14.173 -2.880 20.811 1251 2HH2 ARG 62 HH21 ARG 62 -15.444 -1.895 20.123 1252 H ASN 63 H ASN 63 -9.484 3.652 17.014 1253 HA ASN 63 HA ASN 63 -7.518 5.031 18.270 1254 1HB ASN 63 HB2 ASN 63 -7.765 5.046 15.880 1255 2HB ASN 63 HB3 ASN 63 -9.339 5.842 15.991 1256 1HD2 ASN 63 HD22 ASN 63 -9.438 8.112 16.126 1257 2HD2 ASN 63 HD21 ASN 63 -7.990 9.115 16.142 1258 H LYS 64 H LYS 64 -10.753 6.463 17.752 1259 HA LYS 64 HA LYS 64 -10.755 7.800 20.248 1260 1HB LYS 64 HB2 LYS 64 -9.030 9.225 18.936 1261 2HB LYS 64 HB3 LYS 64 -10.405 9.789 17.986 1262 1HG LYS 64 HG2 LYS 64 -11.489 10.509 20.195 1263 2HG LYS 64 HG3 LYS 64 -10.052 9.921 21.025 1264 1HD LYS 64 HD2 LYS 64 -9.914 12.326 20.807 1265 2HD LYS 64 HD3 LYS 64 -8.632 11.559 19.864 1266 1HE LYS 64 HE2 LYS 64 -9.702 13.479 18.685 1267 2HE LYS 64 HE3 LYS 64 -9.845 11.974 17.779 1268 1HZ LYS 64 HZ1 LYS 64 -12.080 11.761 18.614 1269 2HZ LYS 64 HZ2 LYS 64 -11.940 13.166 19.467 1270 3HZ LYS 64 HZ3 LYS 64 -11.887 13.189 17.816 1271 H ASP 65 H ASP 65 -12.538 6.220 19.340 1272 HA ASP 65 HA ASP 65 -14.686 5.828 19.253 1273 1HB ASP 65 HB2 ASP 65 -16.166 7.183 20.609 1274 2HB ASP 65 HB3 ASP 65 -14.609 6.898 21.388 1275 H GLN 66 H GLN 66 -14.663 9.238 18.283 1276 HA GLN 66 HA GLN 66 -16.864 8.788 16.364 1277 1HB GLN 66 HB2 GLN 66 -16.875 10.842 17.683 1278 2HB GLN 66 HB3 GLN 66 -15.241 11.243 17.147 1279 1HG GLN 66 HG2 GLN 66 -16.953 12.568 15.963 1280 2HG GLN 66 HG3 GLN 66 -15.986 11.603 14.856 1281 1HE2 GLN 66 HE22 GLN 66 -18.970 11.080 16.862 1282 2HE2 GLN 66 HE21 GLN 66 -19.910 10.428 15.530 1283 H GLU 67 H GLU 67 -13.308 9.188 16.467 1284 HA GLU 67 HA GLU 67 -13.277 8.942 13.492 1285 1HB GLU 67 HB2 GLU 67 -11.649 10.780 13.370 1286 2HB GLU 67 HB3 GLU 67 -13.208 11.314 14.006 1287 1HG GLU 67 HG2 GLU 67 -12.283 11.210 16.322 1288 2HG GLU 67 HG3 GLU 67 -10.716 10.711 15.659 1289 H VAL 68 H VAL 68 -11.389 8.502 12.526 1290 HA VAL 68 HA VAL 68 -9.493 6.726 13.953 1291 HB VAL 68 HB VAL 68 -9.820 6.990 10.949 1292 1HG1 VAL 68 HG11 VAL 68 -8.955 4.686 10.983 1293 2HG1 VAL 68 HG12 VAL 68 -7.855 5.766 11.843 1294 3HG1 VAL 68 HG13 VAL 68 -8.935 4.691 12.756 1295 1HG2 VAL 68 HG21 VAL 68 -11.348 5.063 10.943 1296 2HG2 VAL 68 HG22 VAL 68 -11.501 5.177 12.714 1297 3HG2 VAL 68 HG23 VAL 68 -12.097 6.481 11.662 1298 H ASN 69 H ASN 69 -7.244 7.248 13.665 1299 HA ASN 69 HA ASN 69 -6.619 9.819 12.293 1300 1HB ASN 69 HB2 ASN 69 -6.152 10.062 14.663 1301 2HB ASN 69 HB3 ASN 69 -5.312 8.508 14.700 1302 1HD2 ASN 69 HD21 ASN 69 -3.125 8.437 14.273 1303 2HD2 ASN 69 HD22 ASN 69 -2.213 9.834 13.696 1304 H PHE 70 H PHE 70 -4.859 9.824 10.949 1305 HA PHE 70 HA PHE 70 -4.672 7.901 9.118 1306 1HB PHE 70 HB2 PHE 70 -3.790 10.089 8.801 1307 2HB PHE 70 HB3 PHE 70 -2.548 9.853 10.030 1308 HD1 PHE 70 HD1 PHE 70 -0.394 9.134 9.355 1309 HD2 PHE 70 HD2 PHE 70 -3.797 8.392 6.797 1310 HE1 PHE 70 HE1 PHE 70 1.052 7.912 7.782 1311 HE2 PHE 70 HE2 PHE 70 -2.340 7.140 5.234 1312 HZ PHE 70 HZ PHE 70 0.071 6.822 5.781 1313 H GLN 71 H GLN 71 -2.168 8.026 11.727 1314 HA GLN 71 HA GLN 71 -0.752 5.753 10.820 1315 1HB GLN 71 HB2 GLN 71 0.092 7.395 12.458 1316 2HB GLN 71 HB3 GLN 71 -1.074 6.816 13.655 1317 1HG GLN 71 HG2 GLN 71 0.036 4.543 13.558 1318 2HG GLN 71 HG3 GLN 71 1.202 5.208 12.404 1319 1HE2 GLN 71 HE21 GLN 71 -0.183 5.776 15.707 1320 2HE2 GLN 71 HE22 GLN 71 1.333 6.362 16.380 1321 H GLU 72 H GLU 72 -3.621 6.004 12.900 1322 HA GLU 72 HA GLU 72 -3.553 3.205 13.717 1323 1HB GLU 72 HB2 GLU 72 -5.548 5.454 14.143 1324 2HB GLU 72 HB3 GLU 72 -5.816 3.787 14.663 1325 1HG GLU 72 HG2 GLU 72 -4.895 5.124 16.511 1326 2HG GLU 72 HG3 GLU 72 -3.811 3.811 16.056 1327 H TYR 73 H TYR 73 -5.179 5.205 11.264 1328 HA TYR 73 HA TYR 73 -6.848 3.171 10.131 1329 1HB TYR 73 HB2 TYR 73 -7.321 5.230 9.279 1330 2HB TYR 73 HB3 TYR 73 -5.659 5.749 9.207 1331 HD1 TYR 73 HD1 TYR 73 -4.267 5.421 7.250 1332 HD2 TYR 73 HD2 TYR 73 -8.309 3.912 7.411 1333 HE1 TYR 73 HE1 TYR 73 -4.270 5.175 4.800 1334 HE2 TYR 73 HE2 TYR 73 -8.362 3.844 4.931 1335 HH TYR 73 HH TYR 73 -5.644 4.933 2.917 1336 H ILE 74 H ILE 74 -3.443 4.103 9.319 1337 HA ILE 74 HA ILE 74 -3.018 2.003 7.461 1338 HB ILE 74 HB ILE 74 -1.028 3.336 9.337 1339 1HG1 ILE 74 HG12 ILE 74 -2.138 4.894 7.721 1340 2HG1 ILE 74 HG13 ILE 74 -0.402 4.767 7.574 1341 1HG2 ILE 74 HG21 ILE 74 0.648 2.530 7.544 1342 2HG2 ILE 74 HG22 ILE 74 0.034 1.344 8.694 1343 3HG2 ILE 74 HG23 ILE 74 -0.616 1.399 7.040 1344 1HD1 ILE 74 HD11 ILE 74 -0.650 3.287 5.590 1345 2HD1 ILE 74 HD12 ILE 74 -2.423 3.431 5.739 1346 3HD1 ILE 74 HD13 ILE 74 -1.430 4.848 5.368 1347 H THR 75 H THR 75 -2.307 2.042 10.987 1348 HA THR 75 HA THR 75 -1.415 -0.602 11.239 1349 HB THR 75 HB THR 75 -3.052 1.028 13.225 1350 HG1 THR 75 HG1 THR 75 -1.212 2.116 12.613 1351 1HG2 THR 75 HG21 THR 75 -1.302 -1.433 13.587 1352 2HG2 THR 75 HG22 THR 75 -1.752 -0.337 14.910 1353 3HG2 THR 75 HG23 THR 75 -3.003 -1.231 14.031 1354 H PHE 76 H PHE 76 -4.811 0.601 11.366 1355 HA PHE 76 HA PHE 76 -5.957 -1.964 11.858 1356 1HB PHE 76 HB2 PHE 76 -7.209 0.117 12.224 1357 2HB PHE 76 HB3 PHE 76 -7.175 0.445 10.489 1358 HD1 PHE 76 HD1 PHE 76 -8.585 -0.855 8.916 1359 HD2 PHE 76 HD2 PHE 76 -8.478 -1.870 13.115 1360 HE1 PHE 76 HE1 PHE 76 -10.451 -2.403 8.589 1361 HE2 PHE 76 HE2 PHE 76 -10.187 -3.622 12.708 1362 HZ PHE 76 HZ PHE 76 -11.175 -3.901 10.447 1363 H LEU 77 H LEU 77 -5.241 -0.204 8.756 1364 HA LEU 77 HA LEU 77 -6.263 -2.328 7.117 1365 1HB LEU 77 HB2 LEU 77 -4.173 -0.193 6.604 1366 2HB LEU 77 HB3 LEU 77 -4.616 -1.395 5.389 1367 HG LEU 77 HG LEU 77 -6.644 0.454 6.731 1368 1HD1 LEU 77 HD11 LEU 77 -5.080 1.793 5.413 1369 2HD1 LEU 77 HD12 LEU 77 -5.286 0.705 4.013 1370 3HD1 LEU 77 HD13 LEU 77 -6.651 1.674 4.593 1371 1HD2 LEU 77 HD21 LEU 77 -7.752 -1.523 5.801 1372 2HD2 LEU 77 HD22 LEU 77 -8.017 -0.179 4.701 1373 3HD2 LEU 77 HD23 LEU 77 -6.789 -1.401 4.307 1374 H GLY 78 H GLY 78 -3.198 -1.967 8.855 1375 1HA GLY 78 HA2 GLY 78 -1.944 -4.341 7.908 1376 2HA GLY 78 HA3 GLY 78 -1.747 -3.637 9.526 1377 H ALA 79 H ALA 79 -4.195 -3.876 10.703 1378 HA ALA 79 HA ALA 79 -4.434 -6.624 11.384 1379 1HB ALA 79 HB1 ALA 79 -6.618 -4.513 11.624 1380 2HB ALA 79 HB2 ALA 79 -6.498 -6.043 12.504 1381 3HB ALA 79 HB3 ALA 79 -5.295 -4.769 12.783 1382 H LEU 80 H LEU 80 -6.364 -4.702 9.049 1383 HA LEU 80 HA LEU 80 -8.082 -6.767 8.206 1384 1HB LEU 80 HB2 LEU 80 -8.076 -4.173 7.714 1385 2HB LEU 80 HB3 LEU 80 -7.061 -4.617 6.340 1386 HG LEU 80 HG LEU 80 -8.960 -6.332 5.773 1387 1HD1 LEU 80 HD11 LEU 80 -11.210 -5.619 6.576 1388 2HD1 LEU 80 HD12 LEU 80 -10.204 -6.145 7.934 1389 3HD1 LEU 80 HD13 LEU 80 -10.446 -4.416 7.631 1390 1HD2 LEU 80 HD21 LEU 80 -10.232 -4.576 4.574 1391 2HD2 LEU 80 HD22 LEU 80 -9.490 -3.328 5.600 1392 3HD2 LEU 80 HD23 LEU 80 -8.490 -4.266 4.465 1393 H ALA 81 H ALA 81 -4.853 -5.784 7.004 1394 HA ALA 81 HA ALA 81 -4.595 -7.738 4.972 1395 1HB ALA 81 HB1 ALA 81 -2.154 -7.419 5.329 1396 2HB ALA 81 HB2 ALA 81 -3.078 -5.916 5.047 1397 3HB ALA 81 HB3 ALA 81 -2.520 -6.329 6.666 1398 H MET 82 H MET 82 -4.101 -7.973 8.537 1399 HA MET 82 HA MET 82 -3.165 -10.693 8.360 1400 1HB MET 82 HB2 MET 82 -4.432 -9.285 10.743 1401 2HB MET 82 HB3 MET 82 -3.719 -10.896 10.741 1402 1HG MET 82 HG2 MET 82 -1.548 -9.978 10.056 1403 2HG MET 82 HG3 MET 82 -2.242 -8.356 9.986 1404 1HE MET 82 HE1 MET 82 -2.828 -11.087 12.856 1405 2HE MET 82 HE2 MET 82 -1.146 -11.306 12.304 1406 3HE MET 82 HE3 MET 82 -1.480 -10.640 13.920 1407 H ILE 83 H ILE 83 -6.435 -9.272 8.699 1408 HA ILE 83 HA ILE 83 -7.836 -11.765 8.797 1409 HB ILE 83 HB ILE 83 -8.797 -9.235 7.403 1410 1HG1 ILE 83 HG12 ILE 83 -8.259 -8.653 9.699 1411 2HG1 ILE 83 HG13 ILE 83 -9.996 -8.702 9.459 1412 1HG2 ILE 83 HG21 ILE 83 -10.143 -11.093 6.732 1413 2HG2 ILE 83 HG22 ILE 83 -10.278 -11.686 8.395 1414 3HG2 ILE 83 HG23 ILE 83 -11.053 -10.159 7.922 1415 1HD1 ILE 83 HD11 ILE 83 -9.396 -9.673 11.601 1416 2HD1 ILE 83 HD12 ILE 83 -10.068 -10.943 10.565 1417 3HD1 ILE 83 HD13 ILE 83 -8.309 -10.839 10.833 1418 H TYR 84 H TYR 84 -6.501 -9.945 6.039 1419 HA TYR 84 HA TYR 84 -7.177 -11.981 4.062 1420 1HB TYR 84 HB2 TYR 84 -5.151 -9.721 3.975 1421 2HB TYR 84 HB3 TYR 84 -5.485 -10.842 2.673 1422 HD1 TYR 84 HD1 TYR 84 -5.844 -9.115 1.121 1423 HD2 TYR 84 HD2 TYR 84 -8.367 -9.393 4.621 1424 HE1 TYR 84 HE1 TYR 84 -7.375 -7.446 0.162 1425 HE2 TYR 84 HE2 TYR 84 -9.842 -7.673 3.682 1426 HH TYR 84 HH TYR 84 -9.206 -6.082 0.541 1427 H ASN 85 H ASN 85 -6.366 -13.460 5.983 1428 HA ASN 85 HA ASN 85 -3.786 -14.260 6.456 1429 1HB ASN 85 HB2 ASN 85 -4.744 -16.456 6.911 1430 2HB ASN 85 HB3 ASN 85 -5.803 -15.186 7.534 1431 1HD2 ASN 85 HD22 ASN 85 -7.829 -14.628 6.187 1432 2HD2 ASN 85 HD21 ASN 85 -8.408 -15.872 5.091 1433 H GLU 86 H GLU 86 -5.731 -14.798 3.539 1434 HA GLU 86 HA GLU 86 -4.078 -16.718 2.241 1435 1HB GLU 86 HB2 GLU 86 -5.723 -14.505 0.914 1436 2HB GLU 86 HB3 GLU 86 -5.150 -16.012 0.210 1437 1HG GLU 86 HG2 GLU 86 -7.408 -16.441 0.651 1438 2HG GLU 86 HG3 GLU 86 -6.555 -17.255 1.969 1439 H ALA 87 H ALA 87 -3.990 -13.148 2.414 1440 HA ALA 87 HA ALA 87 -1.773 -12.873 0.549 1441 1HB ALA 87 HB1 ALA 87 -1.822 -10.545 1.137 1442 2HB ALA 87 HB2 ALA 87 -3.488 -11.093 0.902 1443 3HB ALA 87 HB3 ALA 87 -2.856 -10.849 2.546 1444 H LEU 88 H LEU 88 -2.209 -12.954 4.143 1445 HA LEU 88 HA LEU 88 0.524 -12.562 4.822 1446 1HB LEU 88 HB2 LEU 88 -1.417 -14.498 6.158 1447 2HB LEU 88 HB3 LEU 88 0.156 -14.022 6.761 1448 HG LEU 88 HG LEU 88 -2.276 -12.233 6.546 1449 1HD1 LEU 88 HD11 LEU 88 -2.276 -13.882 8.385 1450 2HD1 LEU 88 HD12 LEU 88 -0.620 -13.433 8.834 1451 3HD1 LEU 88 HD13 LEU 88 -1.938 -12.293 9.077 1452 1HD2 LEU 88 HD21 LEU 88 -0.293 -10.859 6.066 1453 2HD2 LEU 88 HD22 LEU 88 -0.841 -10.545 7.711 1454 3HD2 LEU 88 HD23 LEU 88 0.571 -11.585 7.448 1455 H LYS 89 H LYS 89 -1.132 -15.629 3.920 1456 HA LYS 89 HA LYS 89 1.252 -17.232 4.099 1457 1HB LYS 89 HB2 LYS 89 -1.494 -17.569 2.893 1458 2HB LYS 89 HB3 LYS 89 -0.188 -18.572 2.282 1459 1HG LYS 89 HG2 LYS 89 -1.192 -19.862 3.873 1460 2HG LYS 89 HG3 LYS 89 0.326 -19.367 4.600 1461 1HD LYS 89 HD2 LYS 89 -2.351 -17.991 5.157 1462 2HD LYS 89 HD3 LYS 89 -1.857 -19.438 6.021 1463 1HE LYS 89 HE2 LYS 89 -0.324 -16.807 6.093 1464 2HE LYS 89 HE3 LYS 89 -1.415 -17.411 7.333 1465 1HZ LYS 89 HZ1 LYS 89 1.068 -18.711 6.469 1466 2HZ LYS 89 HZ2 LYS 89 0.833 -17.864 7.862 1467 3HZ LYS 89 HZ3 LYS 89 0.033 -19.288 7.618 1468 H GLY 90 H GLY 90 -0.304 -15.505 1.371 1469 1HA GLY 90 HA2 GLY 90 1.894 -16.117 -0.483 1470 2HA GLY 90 HA3 GLY 90 0.472 -15.104 -0.766 Start of MODEL 19 1 1H MET 1 H1 MET 1 -14.458 -1.141 -4.310 2 2H MET 1 H2 MET 1 -15.362 -2.436 -4.806 3 3H MET 1 H3 MET 1 -15.618 -0.944 -5.460 4 HA MET 1 HA MET 1 -14.411 -2.276 -7.007 5 1HB MET 1 HB2 MET 1 -12.572 -0.237 -5.679 6 2HB MET 1 HB3 MET 1 -12.440 -0.864 -7.330 7 1HG MET 1 HG2 MET 1 -14.660 0.104 -7.863 8 2HG MET 1 HG3 MET 1 -14.738 0.828 -6.251 9 1HE MET 1 HE1 MET 1 -11.986 3.581 -6.391 10 2HE MET 1 HE2 MET 1 -13.332 2.888 -5.462 11 3HE MET 1 HE3 MET 1 -11.833 1.952 -5.702 12 H ALA 2 H ALA 2 -12.708 -1.866 -3.973 13 HA ALA 2 HA ALA 2 -11.479 -3.059 -2.605 14 1HB ALA 2 HB1 ALA 2 -11.582 -5.483 -2.588 15 2HB ALA 2 HB2 ALA 2 -13.191 -4.831 -2.929 16 3HB ALA 2 HB3 ALA 2 -12.223 -5.529 -4.241 17 H SER 3 H SER 3 -10.988 -4.477 -5.744 18 HA SER 3 HA SER 3 -8.464 -5.322 -5.765 19 1HB SER 3 HB2 SER 3 -9.347 -3.863 -8.248 20 2HB SER 3 HB3 SER 3 -8.578 -5.427 -8.033 21 HG SER 3 HG SER 3 -11.301 -4.748 -7.458 22 HA PRO 4 HA PRO 4 -6.629 -1.087 -7.047 23 1HB PRO 4 HB2 PRO 4 -8.514 0.852 -5.694 24 2HB PRO 4 HB3 PRO 4 -7.613 1.064 -7.222 25 1HG PRO 4 HG2 PRO 4 -10.254 0.466 -7.292 26 2HG PRO 4 HG3 PRO 4 -9.132 -0.409 -8.380 27 1HD PRO 4 HD2 PRO 4 -10.155 -1.297 -5.670 28 2HD PRO 4 HD3 PRO 4 -10.222 -2.185 -7.209 29 H LEU 5 H LEU 5 -8.191 -1.443 -3.871 30 HA LEU 5 HA LEU 5 -5.879 -0.242 -2.495 31 1HB LEU 5 HB2 LEU 5 -8.112 0.165 -1.567 32 2HB LEU 5 HB3 LEU 5 -8.394 -1.578 -1.430 33 HG LEU 5 HG LEU 5 -6.515 -1.766 0.190 34 1HD1 LEU 5 HD11 LEU 5 -5.086 0.136 -0.490 35 2HD1 LEU 5 HD12 LEU 5 -6.375 1.282 -0.042 36 3HD1 LEU 5 HD13 LEU 5 -5.585 0.286 1.193 37 1HD2 LEU 5 HD21 LEU 5 -8.507 0.393 0.952 38 2HD2 LEU 5 HD22 LEU 5 -8.807 -1.366 1.007 39 3HD2 LEU 5 HD23 LEU 5 -7.571 -0.640 2.056 40 H ASP 6 H ASP 6 -7.489 -3.378 -3.006 41 HA ASP 6 HA ASP 6 -5.985 -5.038 -1.394 42 1HB ASP 6 HB2 ASP 6 -7.008 -5.731 -4.161 43 2HB ASP 6 HB3 ASP 6 -6.505 -6.878 -2.923 44 H GLN 7 H GLN 7 -5.183 -4.087 -4.785 45 HA GLN 7 HA GLN 7 -2.769 -5.547 -4.963 46 1HB GLN 7 HB2 GLN 7 -2.143 -4.012 -6.753 47 2HB GLN 7 HB3 GLN 7 -3.872 -4.391 -6.863 48 1HG GLN 7 HG2 GLN 7 -4.331 -2.271 -5.597 49 2HG GLN 7 HG3 GLN 7 -2.615 -1.835 -5.746 50 1HE2 GLN 7 HE22 GLN 7 -4.479 -0.113 -6.596 51 2HE2 GLN 7 HE21 GLN 7 -4.364 0.008 -8.359 52 H ALA 8 H ALA 8 -3.383 -2.376 -3.421 53 HA ALA 8 HA ALA 8 -0.583 -1.702 -3.203 54 1HB ALA 8 HB1 ALA 8 -3.044 -0.516 -1.882 55 2HB ALA 8 HB2 ALA 8 -1.391 0.105 -1.729 56 3HB ALA 8 HB3 ALA 8 -2.160 0.042 -3.326 57 H ILE 9 H ILE 9 -3.080 -2.812 -0.820 58 HA ILE 9 HA ILE 9 -1.156 -3.138 1.305 59 HB ILE 9 HB ILE 9 -2.779 -4.550 2.428 60 1HG1 ILE 9 HG12 ILE 9 -4.524 -4.209 -0.018 61 2HG1 ILE 9 HG13 ILE 9 -3.771 -5.733 0.489 62 1HG2 ILE 9 HG21 ILE 9 -4.383 -2.793 2.818 63 2HG2 ILE 9 HG22 ILE 9 -2.818 -2.057 2.493 64 3HG2 ILE 9 HG23 ILE 9 -4.064 -2.074 1.226 65 1HD1 ILE 9 HD11 ILE 9 -6.047 -5.783 1.212 66 2HD1 ILE 9 HD12 ILE 9 -5.041 -5.582 2.660 67 3HD1 ILE 9 HD13 ILE 9 -5.933 -4.199 1.985 68 H GLY 10 H GLY 10 -2.301 -5.308 -1.280 69 1HA GLY 10 HA2 GLY 10 -0.905 -7.653 -0.868 70 2HA GLY 10 HA3 GLY 10 -1.218 -6.906 -2.440 71 H LEU 11 H LEU 11 0.328 -4.645 -2.433 72 HA LEU 11 HA LEU 11 2.879 -5.550 -3.076 73 1HB LEU 11 HB2 LEU 11 1.598 -3.311 -3.586 74 2HB LEU 11 HB3 LEU 11 2.338 -2.726 -2.105 75 HG LEU 11 HG LEU 11 3.613 -1.946 -3.899 76 1HD1 LEU 11 HD11 LEU 11 4.923 -2.795 -1.960 77 2HD1 LEU 11 HD12 LEU 11 5.229 -4.291 -2.885 78 3HD1 LEU 11 HD13 LEU 11 5.817 -2.736 -3.491 79 1HD2 LEU 11 HD21 LEU 11 2.824 -3.441 -5.640 80 2HD2 LEU 11 HD22 LEU 11 4.588 -3.283 -5.664 81 3HD2 LEU 11 HD23 LEU 11 3.845 -4.757 -5.011 82 H LEU 12 H LEU 12 1.995 -3.673 -0.134 83 HA LEU 12 HA LEU 12 4.485 -3.878 1.241 84 1HB LEU 12 HB2 LEU 12 1.585 -3.643 2.218 85 2HB LEU 12 HB3 LEU 12 2.959 -3.725 3.315 86 HG LEU 12 HG LEU 12 3.953 -1.728 2.265 87 1HD1 LEU 12 HD11 LEU 12 1.239 -1.495 0.883 88 2HD1 LEU 12 HD12 LEU 12 2.448 -0.205 0.964 89 3HD1 LEU 12 HD13 LEU 12 2.813 -1.678 0.068 90 1HD2 LEU 12 HD21 LEU 12 1.168 -1.420 3.457 91 2HD2 LEU 12 HD22 LEU 12 2.702 -1.556 4.348 92 3HD2 LEU 12 HD23 LEU 12 2.387 -0.132 3.357 93 H ILE 13 H ILE 13 1.667 -6.090 1.247 94 HA ILE 13 HA ILE 13 2.729 -7.834 3.246 95 HB ILE 13 HB ILE 13 0.698 -8.294 1.031 96 1HG1 ILE 13 HG12 ILE 13 0.143 -8.029 4.002 97 2HG1 ILE 13 HG13 ILE 13 0.324 -6.579 3.023 98 1HG2 ILE 13 HG21 ILE 13 1.488 -10.042 3.388 99 2HG2 ILE 13 HG22 ILE 13 -0.042 -10.234 2.514 100 3HG2 ILE 13 HG23 ILE 13 1.492 -10.483 1.670 101 1HD1 ILE 13 HD11 ILE 13 -1.452 -7.658 1.434 102 2HD1 ILE 13 HD12 ILE 13 -1.823 -8.687 2.832 103 3HD1 ILE 13 HD13 ILE 13 -1.959 -6.918 2.947 104 H GLY 14 H GLY 14 2.845 -7.996 -0.336 105 1HA GLY 14 HA2 GLY 14 4.252 -10.436 -0.589 106 2HA GLY 14 HA3 GLY 14 4.242 -9.104 -1.763 107 H ILE 15 H ILE 15 5.450 -7.026 -0.531 108 HA ILE 15 HA ILE 15 8.220 -7.582 -0.631 109 HB ILE 15 HB ILE 15 6.513 -5.315 0.352 110 1HG1 ILE 15 HG12 ILE 15 8.780 -5.654 -1.676 111 2HG1 ILE 15 HG13 ILE 15 7.047 -5.592 -2.028 112 1HG2 ILE 15 HG21 ILE 15 8.414 -4.012 1.059 113 2HG2 ILE 15 HG22 ILE 15 8.230 -5.405 2.079 114 3HG2 ILE 15 HG23 ILE 15 9.510 -5.401 0.836 115 1HD1 ILE 15 HD11 ILE 15 7.067 -3.230 -1.046 116 2HD1 ILE 15 HD12 ILE 15 8.841 -3.341 -1.033 117 3HD1 ILE 15 HD13 ILE 15 7.970 -3.448 -2.564 118 H PHE 16 H PHE 16 6.099 -7.212 2.236 119 HA PHE 16 HA PHE 16 8.059 -7.710 4.185 120 1HB PHE 16 HB2 PHE 16 5.822 -6.863 4.658 121 2HB PHE 16 HB3 PHE 16 5.080 -8.364 4.164 122 HD1 PHE 16 HD1 PHE 16 7.283 -6.803 6.732 123 HD2 PHE 16 HD2 PHE 16 4.955 -10.269 5.637 124 HE1 PHE 16 HE1 PHE 16 7.419 -7.639 9.069 125 HE2 PHE 16 HE2 PHE 16 5.117 -11.106 7.956 126 HZ PHE 16 HZ PHE 16 6.277 -9.747 9.684 127 H HIS 17 H HIS 17 5.748 -10.077 2.754 128 HA HIS 17 HA HIS 17 6.943 -12.117 4.372 129 1HB HIS 17 HB2 HIS 17 4.447 -11.827 3.661 130 2HB HIS 17 HB3 HIS 17 4.931 -12.820 2.281 131 HD1 HIS 17 HD1 HIS 17 6.676 -14.992 3.435 132 HD2 HIS 17 HD2 HIS 17 3.699 -13.139 5.740 133 HE1 HIS 17 HE1 HIS 17 6.218 -16.545 5.427 134 H LYS 18 H LYS 18 7.634 -11.013 1.135 135 HA LYS 18 HA LYS 18 8.913 -13.370 0.160 136 1HB LYS 18 HB2 LYS 18 8.602 -11.291 -1.125 137 2HB LYS 18 HB3 LYS 18 9.760 -10.443 -0.084 138 1HG LYS 18 HG2 LYS 18 11.513 -12.138 -0.806 139 2HG LYS 18 HG3 LYS 18 10.336 -12.797 -1.942 140 1HD LYS 18 HD2 LYS 18 11.499 -9.969 -1.871 141 2HD LYS 18 HD3 LYS 18 11.863 -11.224 -3.057 142 1HE LYS 18 HE2 LYS 18 9.211 -9.747 -2.703 143 2HE LYS 18 HE3 LYS 18 10.352 -9.599 -4.041 144 1HZ LYS 18 HZ1 LYS 18 9.917 -11.889 -4.591 145 2HZ LYS 18 HZ2 LYS 18 8.829 -12.012 -3.357 146 3HZ LYS 18 HZ3 LYS 18 8.531 -10.998 -4.618 147 H TYR 19 H TYR 19 10.135 -10.673 2.181 148 HA TYR 19 HA TYR 19 12.647 -11.980 2.759 149 1HB TYR 19 HB2 TYR 19 11.284 -9.467 3.698 150 2HB TYR 19 HB3 TYR 19 12.772 -10.039 4.439 151 HD1 TYR 19 HD1 TYR 19 11.319 -8.581 1.383 152 HD2 TYR 19 HD2 TYR 19 14.886 -10.188 3.182 153 HE1 TYR 19 HE1 TYR 19 12.644 -7.809 -0.555 154 HE2 TYR 19 HE2 TYR 19 16.199 -9.474 1.217 155 HH TYR 19 HH TYR 19 16.156 -8.386 -0.820 156 H SER 20 H SER 20 9.606 -11.595 4.656 157 HA SER 20 HA SER 20 10.666 -12.940 6.954 158 1HB SER 20 HB2 SER 20 7.731 -13.053 6.232 159 2HB SER 20 HB3 SER 20 8.525 -13.022 7.809 160 HG SER 20 HG SER 20 8.444 -10.847 5.978 161 H GLY 21 H GLY 21 9.229 -14.151 3.946 162 1HA GLY 21 HA2 GLY 21 9.087 -16.927 4.625 163 2HA GLY 21 HA3 GLY 21 9.210 -16.214 3.009 164 H LYS 22 H LYS 22 11.569 -14.881 3.005 165 HA LYS 22 HA LYS 22 13.455 -16.711 2.353 166 1HB LYS 22 HB2 LYS 22 13.480 -14.206 2.019 167 2HB LYS 22 HB3 LYS 22 14.195 -14.044 3.630 168 1HG LYS 22 HG2 LYS 22 16.077 -15.462 2.992 169 2HG LYS 22 HG3 LYS 22 15.402 -15.697 1.374 170 1HD LYS 22 HD2 LYS 22 16.415 -13.101 2.617 171 2HD LYS 22 HD3 LYS 22 17.185 -14.024 1.329 172 1HE LYS 22 HE2 LYS 22 14.583 -12.435 1.159 173 2HE LYS 22 HE3 LYS 22 16.117 -12.088 0.361 174 1HZ LYS 22 HZ1 LYS 22 14.413 -14.419 -0.155 175 2HZ LYS 22 HZ2 LYS 22 14.584 -13.102 -1.130 176 3HZ LYS 22 HZ3 LYS 22 15.860 -14.117 -0.885 177 H GLU 23 H GLU 23 13.153 -15.250 5.612 178 HA GLU 23 HA GLU 23 15.217 -17.062 6.701 179 1HB GLU 23 HB2 GLU 23 14.467 -16.124 8.916 180 2HB GLU 23 HB3 GLU 23 15.318 -15.068 7.791 181 1HG GLU 23 HG2 GLU 23 13.265 -13.964 7.126 182 2HG GLU 23 HG3 GLU 23 12.301 -15.058 8.138 183 H GLY 24 H GLY 24 13.963 -18.803 5.575 184 1HA GLY 24 HA2 GLY 24 13.162 -20.915 5.962 185 2HA GLY 24 HA3 GLY 24 12.868 -20.506 7.657 186 H ASP 25 H ASP 25 11.045 -18.851 7.908 187 HA ASP 25 HA ASP 25 8.870 -18.424 6.320 188 1HB ASP 25 HB2 ASP 25 8.407 -20.802 5.988 189 2HB ASP 25 HB3 ASP 25 8.526 -21.103 7.732 190 H LYS 26 H LYS 26 9.198 -16.576 7.692 191 HA LYS 26 HA LYS 26 7.981 -16.873 10.416 192 1HB LYS 26 HB2 LYS 26 9.992 -14.853 9.359 193 2HB LYS 26 HB3 LYS 26 9.277 -14.796 10.967 194 1HG LYS 26 HG2 LYS 26 10.784 -17.304 10.162 195 2HG LYS 26 HG3 LYS 26 11.677 -15.835 10.479 196 1HD LYS 26 HD2 LYS 26 11.614 -17.135 12.487 197 2HD LYS 26 HD3 LYS 26 10.759 -15.612 12.717 198 1HE LYS 26 HE2 LYS 26 9.615 -17.512 13.801 199 2HE LYS 26 HE3 LYS 26 8.586 -16.771 12.578 200 1HZ LYS 26 HZ1 LYS 26 10.208 -19.203 12.197 201 2HZ LYS 26 HZ2 LYS 26 8.591 -19.180 12.505 202 3HZ LYS 26 HZ3 LYS 26 9.160 -18.567 11.093 203 H HIS 27 H HIS 27 6.685 -15.055 11.066 204 HA HIS 27 HA HIS 27 5.507 -13.445 8.824 205 1HB HIS 27 HB2 HIS 27 4.180 -14.257 11.429 206 2HB HIS 27 HB3 HIS 27 3.445 -13.373 10.085 207 HD1 HIS 27 HD1 HIS 27 4.667 -15.520 7.805 208 HD2 HIS 27 HD2 HIS 27 2.396 -16.256 11.284 209 HE1 HIS 27 HE1 HIS 27 3.563 -17.783 7.493 210 H THR 28 H THR 28 7.976 -12.981 10.308 211 HA THR 28 HA THR 28 7.553 -10.315 11.314 212 HB THR 28 HB THR 28 7.016 -11.678 13.287 213 HG1 THR 28 HG1 THR 28 8.143 -10.472 14.563 214 1HG2 THR 28 HG21 THR 28 8.327 -13.714 12.867 215 2HG2 THR 28 HG22 THR 28 9.840 -12.803 13.061 216 3HG2 THR 28 HG23 THR 28 8.739 -13.004 14.433 217 H LEU 29 H LEU 29 9.498 -9.193 11.019 218 HA LEU 29 HA LEU 29 11.552 -10.697 9.412 219 1HB LEU 29 HB2 LEU 29 10.913 -7.745 9.633 220 2HB LEU 29 HB3 LEU 29 12.333 -8.366 8.802 221 HG LEU 29 HG LEU 29 9.508 -9.202 8.053 222 1HD1 LEU 29 HD11 LEU 29 9.723 -6.750 7.801 223 2HD1 LEU 29 HD12 LEU 29 11.240 -6.981 6.902 224 3HD1 LEU 29 HD13 LEU 29 9.702 -7.553 6.216 225 1HD2 LEU 29 HD21 LEU 29 11.335 -10.682 7.218 226 2HD2 LEU 29 HD22 LEU 29 10.628 -9.734 5.902 227 3HD2 LEU 29 HD23 LEU 29 12.196 -9.261 6.589 228 H SER 30 H SER 30 13.540 -11.085 10.299 229 HA SER 30 HA SER 30 14.174 -9.830 12.901 230 1HB SER 30 HB2 SER 30 14.793 -12.181 12.450 231 2HB SER 30 HB3 SER 30 15.858 -11.659 11.127 232 HG SER 30 HG SER 30 16.881 -11.965 13.246 233 H LYS 31 H LYS 31 16.541 -9.030 12.986 234 HA LYS 31 HA LYS 31 16.329 -6.389 12.034 235 1HB LYS 31 HB2 LYS 31 18.810 -7.854 13.083 236 2HB LYS 31 HB3 LYS 31 18.622 -6.104 12.971 237 1HG LYS 31 HG2 LYS 31 16.564 -6.360 14.494 238 2HG LYS 31 HG3 LYS 31 17.046 -8.047 14.714 239 1HD LYS 31 HD2 LYS 31 19.327 -7.199 15.486 240 2HD LYS 31 HD3 LYS 31 18.624 -5.561 15.487 241 1HE LYS 31 HE2 LYS 31 16.844 -6.349 17.051 242 2HE LYS 31 HE3 LYS 31 17.571 -7.971 17.033 243 1HZ LYS 31 HZ1 LYS 31 18.789 -5.520 18.075 244 2HZ LYS 31 HZ2 LYS 31 18.254 -6.828 18.936 245 3HZ LYS 31 HZ3 LYS 31 19.567 -6.972 17.952 246 H LYS 32 H LYS 32 18.873 -8.718 11.103 247 HA LYS 32 HA LYS 32 19.910 -7.099 9.018 248 1HB LYS 32 HB2 LYS 32 21.102 -8.803 10.211 249 2HB LYS 32 HB3 LYS 32 20.176 -10.094 9.433 250 1HG LYS 32 HG2 LYS 32 22.086 -8.086 8.127 251 2HG LYS 32 HG3 LYS 32 22.464 -9.753 8.543 252 1HD LYS 32 HD2 LYS 32 20.668 -8.787 6.295 253 2HD LYS 32 HD3 LYS 32 22.178 -9.654 6.201 254 1HE LYS 32 HE2 LYS 32 21.160 -11.672 7.190 255 2HE LYS 32 HE3 LYS 32 19.602 -10.840 7.337 256 1HZ LYS 32 HZ1 LYS 32 21.004 -11.343 4.819 257 2HZ LYS 32 HZ2 LYS 32 19.691 -12.166 5.385 258 3HZ LYS 32 HZ3 LYS 32 19.560 -10.573 4.983 259 H GLU 33 H GLU 33 17.342 -9.588 9.077 260 HA GLU 33 HA GLU 33 17.084 -9.785 6.252 261 1HB GLU 33 HB2 GLU 33 16.083 -11.352 8.072 262 2HB GLU 33 HB3 GLU 33 14.784 -10.151 8.202 263 1HG GLU 33 HG2 GLU 33 13.995 -11.758 6.626 264 2HG GLU 33 HG3 GLU 33 14.534 -10.396 5.650 265 H LEU 34 H LEU 34 15.441 -7.667 8.659 266 HA LEU 34 HA LEU 34 13.828 -6.255 6.805 267 1HB LEU 34 HB2 LEU 34 13.454 -6.093 9.171 268 2HB LEU 34 HB3 LEU 34 15.050 -5.423 9.470 269 HG LEU 34 HG LEU 34 13.162 -3.804 9.580 270 1HD1 LEU 34 HD11 LEU 34 14.958 -2.831 7.376 271 2HD1 LEU 34 HD12 LEU 34 14.337 -1.991 8.793 272 3HD1 LEU 34 HD13 LEU 34 15.620 -3.202 8.966 273 1HD2 LEU 34 HD21 LEU 34 13.064 -4.074 6.551 274 2HD2 LEU 34 HD22 LEU 34 11.828 -4.691 7.675 275 3HD2 LEU 34 HD23 LEU 34 12.131 -2.950 7.531 276 H LYS 35 H LYS 35 17.148 -5.560 8.043 277 HA LYS 35 HA LYS 35 17.655 -3.288 6.485 278 1HB LYS 35 HB2 LYS 35 19.299 -3.800 8.076 279 2HB LYS 35 HB3 LYS 35 19.306 -5.496 7.664 280 1HG LYS 35 HG2 LYS 35 21.415 -4.693 7.061 281 2HG LYS 35 HG3 LYS 35 20.561 -5.076 5.585 282 1HD LYS 35 HD2 LYS 35 21.694 -3.043 5.198 283 2HD LYS 35 HD3 LYS 35 19.989 -2.573 5.396 284 1HE LYS 35 HE2 LYS 35 20.421 -1.815 7.684 285 2HE LYS 35 HE3 LYS 35 22.052 -2.508 7.657 286 1HZ LYS 35 HZ1 LYS 35 21.140 -0.315 5.949 287 2HZ LYS 35 HZ2 LYS 35 22.063 -0.160 7.303 288 3HZ LYS 35 HZ3 LYS 35 22.657 -0.958 5.988 289 H GLU 36 H GLU 36 18.037 -6.722 5.537 290 HA GLU 36 HA GLU 36 18.999 -6.283 2.928 291 1HB GLU 36 HB2 GLU 36 18.713 -8.487 4.386 292 2HB GLU 36 HB3 GLU 36 17.149 -8.599 3.582 293 1HG GLU 36 HG2 GLU 36 18.682 -9.893 2.295 294 2HG GLU 36 HG3 GLU 36 18.435 -8.407 1.361 295 H LEU 37 H LEU 37 15.636 -6.699 4.093 296 HA LEU 37 HA LEU 37 14.253 -6.339 1.658 297 1HB LEU 37 HB2 LEU 37 13.151 -7.046 3.689 298 2HB LEU 37 HB3 LEU 37 13.481 -5.536 4.500 299 HG LEU 37 HG LEU 37 11.750 -5.640 2.013 300 1HD1 LEU 37 HD11 LEU 37 10.902 -5.801 4.931 301 2HD1 LEU 37 HD12 LEU 37 9.806 -5.670 3.553 302 3HD1 LEU 37 HD13 LEU 37 10.781 -7.131 3.751 303 1HD2 LEU 37 HD21 LEU 37 12.330 -3.335 2.529 304 2HD2 LEU 37 HD22 LEU 37 10.740 -3.595 3.225 305 3HD2 LEU 37 HD23 LEU 37 12.153 -3.613 4.279 306 H ILE 38 H ILE 38 15.391 -3.844 3.983 307 HA ILE 38 HA ILE 38 14.441 -1.694 2.363 308 HB ILE 38 HB ILE 38 16.508 -1.760 4.570 309 1HG1 ILE 38 HG12 ILE 38 13.584 -0.838 4.325 310 2HG1 ILE 38 HG13 ILE 38 14.157 -2.286 5.170 311 1HG2 ILE 38 HG21 ILE 38 16.310 0.717 4.560 312 2HG2 ILE 38 HG22 ILE 38 17.013 0.166 3.059 313 3HG2 ILE 38 HG23 ILE 38 15.295 0.629 3.118 314 1HD1 ILE 38 HD11 ILE 38 15.540 -0.672 6.624 315 2HD1 ILE 38 HD12 ILE 38 14.554 0.609 5.865 316 3HD1 ILE 38 HD13 ILE 38 13.765 -0.669 6.812 317 H GLN 39 H GLN 39 17.718 -3.245 2.429 318 HA GLN 39 HA GLN 39 18.850 -1.376 0.595 319 1HB GLN 39 HB2 GLN 39 19.465 -4.322 1.009 320 2HB GLN 39 HB3 GLN 39 20.440 -3.244 0.002 321 1HG GLN 39 HG2 GLN 39 19.883 -2.785 2.963 322 2HG GLN 39 HG3 GLN 39 21.326 -3.580 2.329 323 1HE2 GLN 39 HE22 GLN 39 21.207 -1.204 3.983 324 2HE2 GLN 39 HE21 GLN 39 22.045 0.042 3.078 325 H LYS 40 H LYS 40 16.895 -4.339 -0.041 326 HA LYS 40 HA LYS 40 17.126 -3.996 -2.901 327 1HB LYS 40 HB2 LYS 40 16.601 -6.175 -1.878 328 2HB LYS 40 HB3 LYS 40 15.118 -5.500 -1.202 329 1HG LYS 40 HG2 LYS 40 14.335 -6.699 -2.965 330 2HG LYS 40 HG3 LYS 40 14.356 -5.095 -3.661 331 1HD LYS 40 HD2 LYS 40 16.397 -7.339 -4.078 332 2HD LYS 40 HD3 LYS 40 15.123 -6.868 -5.199 333 1HE LYS 40 HE2 LYS 40 17.640 -5.302 -4.525 334 2HE LYS 40 HE3 LYS 40 17.177 -6.031 -6.054 335 1HZ LYS 40 HZ1 LYS 40 16.798 -3.705 -6.098 336 2HZ LYS 40 HZ2 LYS 40 15.354 -4.484 -6.207 337 3HZ LYS 40 HZ3 LYS 40 15.800 -3.759 -4.796 338 H GLU 41 H GLU 41 14.589 -3.147 -0.557 339 HA GLU 41 HA GLU 41 12.710 -2.167 -2.454 340 1HB GLU 41 HB2 GLU 41 12.174 -2.958 -0.178 341 2HB GLU 41 HB3 GLU 41 13.071 -1.606 0.517 342 1HG GLU 41 HG2 GLU 41 11.421 -0.033 -0.627 343 2HG GLU 41 HG3 GLU 41 10.489 -1.466 -1.077 344 H LEU 42 H LEU 42 14.842 -0.424 -0.203 345 HA LEU 42 HA LEU 42 14.557 2.137 -1.721 346 1HB LEU 42 HB2 LEU 42 15.253 1.779 1.215 347 2HB LEU 42 HB3 LEU 42 14.915 3.284 0.363 348 HG LEU 42 HG LEU 42 12.943 1.055 1.017 349 1HD1 LEU 42 HD11 LEU 42 13.631 2.398 2.971 350 2HD1 LEU 42 HD12 LEU 42 13.195 3.888 2.108 351 3HD1 LEU 42 HD13 LEU 42 11.941 2.705 2.539 352 1HD2 LEU 42 HD21 LEU 42 12.330 2.146 -1.091 353 2HD2 LEU 42 HD22 LEU 42 11.200 2.627 0.183 354 3HD2 LEU 42 HD23 LEU 42 12.474 3.752 -0.345 355 H THR 43 H THR 43 16.291 0.847 -3.024 356 HA THR 43 HA THR 43 18.857 0.474 -1.938 357 HB THR 43 HB THR 43 18.223 1.084 -4.852 358 HG1 THR 43 HG1 THR 43 17.642 -1.220 -3.313 359 1HG2 THR 43 HG21 THR 43 20.107 -0.911 -3.499 360 2HG2 THR 43 HG22 THR 43 19.887 -0.693 -5.247 361 3HG2 THR 43 HG23 THR 43 20.601 0.611 -4.279 362 H ILE 44 H ILE 44 18.882 2.546 -0.679 363 HA ILE 44 HA ILE 44 19.193 5.065 -1.717 364 HB ILE 44 HB ILE 44 20.533 5.630 0.252 365 1HG1 ILE 44 HG12 ILE 44 21.877 3.577 0.554 366 2HG1 ILE 44 HG13 ILE 44 21.096 4.190 2.001 367 1HG2 ILE 44 HG21 ILE 44 18.045 3.993 0.825 368 2HG2 ILE 44 HG22 ILE 44 18.802 5.168 1.920 369 3HG2 ILE 44 HG23 ILE 44 18.139 5.699 0.366 370 1HD1 ILE 44 HD11 ILE 44 19.340 2.396 1.810 371 2HD1 ILE 44 HD12 ILE 44 20.290 1.691 0.474 372 3HD1 ILE 44 HD13 ILE 44 20.986 1.831 2.083 373 H GLY 45 H GLY 45 21.636 2.538 -1.820 374 1HA GLY 45 HA2 GLY 45 23.498 2.407 -3.191 375 2HA GLY 45 HA3 GLY 45 23.131 4.012 -3.844 376 H SER 46 H SER 46 23.280 5.734 -1.838 377 HA SER 46 HA SER 46 25.961 6.024 -0.990 378 1HB SER 46 HB2 SER 46 23.394 7.222 0.130 379 2HB SER 46 HB3 SER 46 25.028 7.897 0.302 380 HG SER 46 HG SER 46 23.678 8.750 -1.471 381 H LYS 47 H LYS 47 26.143 3.726 -0.160 382 HA LYS 47 HA LYS 47 24.928 2.627 2.005 383 1HB LYS 47 HB2 LYS 47 27.819 2.453 1.111 384 2HB LYS 47 HB3 LYS 47 27.187 1.431 2.403 385 1HG LYS 47 HG2 LYS 47 25.853 1.515 -0.330 386 2HG LYS 47 HG3 LYS 47 27.227 0.465 0.022 387 1HD LYS 47 HD2 LYS 47 26.022 -0.620 1.850 388 2HD LYS 47 HD3 LYS 47 24.609 0.416 1.606 389 1HE LYS 47 HE2 LYS 47 25.729 -1.419 -0.557 390 2HE LYS 47 HE3 LYS 47 24.466 -1.902 0.586 391 1HZ LYS 47 HZ1 LYS 47 24.219 0.403 -1.205 392 2HZ LYS 47 HZ2 LYS 47 23.605 -1.099 -1.505 393 3HZ LYS 47 HZ3 LYS 47 23.059 -0.244 -0.213 394 H LEU 48 H LEU 48 27.088 5.366 2.300 395 HA LEU 48 HA LEU 48 27.787 5.211 5.037 396 1HB LEU 48 HB2 LEU 48 26.921 7.592 3.332 397 2HB LEU 48 HB3 LEU 48 27.550 7.733 4.969 398 HG LEU 48 HG LEU 48 29.249 8.287 3.404 399 1HD1 LEU 48 HD11 LEU 48 29.976 5.590 4.614 400 2HD1 LEU 48 HD12 LEU 48 31.066 6.919 4.192 401 3HD1 LEU 48 HD13 LEU 48 29.899 7.125 5.511 402 1HD2 LEU 48 HD21 LEU 48 29.222 5.482 2.239 403 2HD2 LEU 48 HD22 LEU 48 28.468 6.902 1.464 404 3HD2 LEU 48 HD23 LEU 48 30.213 6.863 1.762 405 H GLN 49 H GLN 49 24.715 6.030 3.495 406 HA GLN 49 HA GLN 49 23.369 6.903 5.884 407 1HB GLN 49 HB2 GLN 49 22.255 5.866 3.248 408 2HB GLN 49 HB3 GLN 49 21.325 6.649 4.533 409 1HG GLN 49 HG2 GLN 49 22.845 8.673 4.302 410 2HG GLN 49 HG3 GLN 49 23.570 7.898 2.886 411 1HE2 GLN 49 HE22 GLN 49 20.398 8.907 4.256 412 2HE2 GLN 49 HE21 GLN 49 19.682 9.308 2.695 413 H ASP 50 H ASP 50 24.408 3.743 5.012 414 HA ASP 50 HA ASP 50 22.340 2.110 5.945 415 1HB ASP 50 HB2 ASP 50 25.358 1.816 6.207 416 2HB ASP 50 HB3 ASP 50 24.224 0.586 6.735 417 H ALA 51 H ALA 51 24.560 4.169 7.804 418 HA ALA 51 HA ALA 51 23.976 3.260 10.430 419 1HB ALA 51 HB1 ALA 51 24.532 5.568 11.101 420 2HB ALA 51 HB2 ALA 51 25.693 4.934 9.917 421 3HB ALA 51 HB3 ALA 51 24.447 6.091 9.404 422 H GLU 52 H GLU 52 22.205 5.571 8.326 423 HA GLU 52 HA GLU 52 20.154 6.205 10.264 424 1HB GLU 52 HB2 GLU 52 20.024 6.395 7.215 425 2HB GLU 52 HB3 GLU 52 18.975 7.191 8.386 426 1HG GLU 52 HG2 GLU 52 20.930 8.476 9.256 427 2HG GLU 52 HG3 GLU 52 21.963 7.729 8.023 428 H ILE 53 H ILE 53 20.517 3.913 7.540 429 HA ILE 53 HA ILE 53 17.915 2.798 7.743 430 HB ILE 53 HB ILE 53 20.430 1.373 6.881 431 1HG1 ILE 53 HG12 ILE 53 20.252 3.292 5.459 432 2HG1 ILE 53 HG13 ILE 53 19.685 1.900 4.555 433 1HG2 ILE 53 HG21 ILE 53 17.494 0.753 6.481 434 2HG2 ILE 53 HG22 ILE 53 18.789 -0.015 5.534 435 3HG2 ILE 53 HG23 ILE 53 18.704 -0.247 7.282 436 1HD1 ILE 53 HD11 ILE 53 17.309 2.624 5.102 437 2HD1 ILE 53 HD12 ILE 53 17.992 4.097 5.823 438 3HD1 ILE 53 HD13 ILE 53 18.231 3.757 4.102 439 H VAL 54 H VAL 54 20.932 1.812 9.545 440 HA VAL 54 HA VAL 54 19.463 -0.307 10.824 441 HB VAL 54 HB VAL 54 21.273 -0.478 12.466 442 1HG1 VAL 54 HG11 VAL 54 22.814 -1.533 10.879 443 2HG1 VAL 54 HG12 VAL 54 21.139 -1.902 10.469 444 3HG1 VAL 54 HG13 VAL 54 22.032 -0.677 9.535 445 1HG2 VAL 54 HG21 VAL 54 23.387 0.575 12.135 446 2HG2 VAL 54 HG22 VAL 54 22.773 1.479 10.751 447 3HG2 VAL 54 HG23 VAL 54 22.158 1.827 12.385 448 H LYS 55 H LYS 55 20.007 3.129 11.703 449 HA LYS 55 HA LYS 55 18.790 2.938 14.277 450 1HB LYS 55 HB2 LYS 55 19.964 4.949 13.539 451 2HB LYS 55 HB3 LYS 55 18.787 5.217 12.259 452 1HG LYS 55 HG2 LYS 55 18.398 6.716 14.157 453 2HG LYS 55 HG3 LYS 55 17.015 5.686 13.834 454 1HD LYS 55 HD2 LYS 55 17.418 5.927 16.242 455 2HD LYS 55 HD3 LYS 55 17.524 4.248 15.739 456 1HE LYS 55 HE2 LYS 55 19.293 4.834 17.357 457 2HE LYS 55 HE3 LYS 55 20.003 4.351 15.815 458 1HZ LYS 55 HZ1 LYS 55 21.031 6.303 16.712 459 2HZ LYS 55 HZ2 LYS 55 20.284 6.663 15.289 460 3HZ LYS 55 HZ3 LYS 55 19.599 7.119 16.718 461 H LEU 56 H LEU 56 17.328 3.627 11.074 462 HA LEU 56 HA LEU 56 14.610 3.640 11.872 463 1HB LEU 56 HB2 LEU 56 15.163 4.521 9.812 464 2HB LEU 56 HB3 LEU 56 16.060 3.106 9.283 465 HG LEU 56 HG LEU 56 13.128 2.700 9.838 466 1HD1 LEU 56 HD11 LEU 56 13.093 4.817 8.555 467 2HD1 LEU 56 HD12 LEU 56 14.212 4.120 7.359 468 3HD1 LEU 56 HD13 LEU 56 12.578 3.459 7.528 469 1HD2 LEU 56 HD21 LEU 56 15.052 1.835 7.638 470 2HD2 LEU 56 HD22 LEU 56 14.625 0.832 9.025 471 3HD2 LEU 56 HD23 LEU 56 13.372 1.274 7.853 472 H MET 57 H MET 57 16.684 0.888 10.875 473 HA MET 57 HA MET 57 14.726 -1.139 11.062 474 1HB MET 57 HB2 MET 57 16.871 -1.472 9.991 475 2HB MET 57 HB3 MET 57 17.709 -1.223 11.521 476 1HG MET 57 HG2 MET 57 15.707 -3.454 11.252 477 2HG MET 57 HG3 MET 57 17.368 -3.646 10.678 478 1HE MET 57 HE1 MET 57 19.460 -3.533 13.955 479 2HE MET 57 HE2 MET 57 19.498 -3.663 12.181 480 3HE MET 57 HE3 MET 57 19.134 -2.103 12.966 481 H ASP 58 H ASP 58 16.913 0.241 13.571 482 HA ASP 58 HA ASP 58 16.013 -1.423 15.680 483 1HB ASP 58 HB2 ASP 58 18.026 -0.001 15.797 484 2HB ASP 58 HB3 ASP 58 17.003 1.441 15.908 485 H ASP 59 H ASP 59 14.817 1.782 14.550 486 HA ASP 59 HA ASP 59 12.694 2.028 16.424 487 1HB ASP 59 HB2 ASP 59 12.707 2.980 13.525 488 2HB ASP 59 HB3 ASP 59 11.587 3.489 14.786 489 H LEU 60 H LEU 60 12.663 0.430 13.220 490 HA LEU 60 HA LEU 60 9.994 -0.555 13.328 491 1HB LEU 60 HB2 LEU 60 12.528 -1.344 11.902 492 2HB LEU 60 HB3 LEU 60 11.163 -2.446 11.839 493 HG LEU 60 HG LEU 60 10.643 0.433 11.197 494 1HD1 LEU 60 HD11 LEU 60 11.260 0.118 8.834 495 2HD1 LEU 60 HD12 LEU 60 12.672 -0.002 9.906 496 3HD1 LEU 60 HD13 LEU 60 11.944 -1.471 9.217 497 1HD2 LEU 60 HD21 LEU 60 8.806 -1.311 11.154 498 2HD2 LEU 60 HD22 LEU 60 9.086 -0.614 9.533 499 3HD2 LEU 60 HD23 LEU 60 9.728 -2.192 9.910 500 H ASP 61 H ASP 61 13.032 -2.242 14.365 501 HA ASP 61 HA ASP 61 11.565 -4.537 15.210 502 1HB ASP 61 HB2 ASP 61 13.546 -5.512 15.919 503 2HB ASP 61 HB3 ASP 61 13.901 -4.628 14.438 504 H ARG 62 H ARG 62 12.439 -1.640 16.950 505 HA ARG 62 HA ARG 62 12.400 -2.326 19.531 506 1HB ARG 62 HB2 ARG 62 12.566 -0.044 18.561 507 2HB ARG 62 HB3 ARG 62 10.803 0.026 18.427 508 1HG ARG 62 HG2 ARG 62 10.608 -0.203 20.894 509 2HG ARG 62 HG3 ARG 62 12.368 -0.383 21.027 510 1HD ARG 62 HD2 ARG 62 10.877 2.045 19.980 511 2HD ARG 62 HD3 ARG 62 11.662 1.924 21.563 512 HE ARG 62 HE ARG 62 13.808 1.466 20.242 513 1HH1 ARG 62 HH22 ARG 62 11.343 3.780 19.092 514 2HH1 ARG 62 HH21 ARG 62 12.407 4.407 17.850 515 1HH2 ARG 62 HH12 ARG 62 15.122 2.340 18.593 516 2HH2 ARG 62 HH11 ARG 62 14.507 3.669 17.628 517 H ASN 63 H ASN 63 9.481 -2.079 17.539 518 HA ASN 63 HA ASN 63 7.375 -2.372 19.213 519 1HB ASN 63 HB2 ASN 63 6.156 -3.339 17.501 520 2HB ASN 63 HB3 ASN 63 7.418 -2.482 16.610 521 1HD2 ASN 63 HD21 ASN 63 9.352 -3.847 15.931 522 2HD2 ASN 63 HD22 ASN 63 9.246 -5.606 15.930 523 H LYS 64 H LYS 64 9.668 -4.958 18.455 524 HA LYS 64 HA LYS 64 9.010 -6.294 20.936 525 1HB LYS 64 HB2 LYS 64 7.350 -7.273 19.261 526 2HB LYS 64 HB3 LYS 64 8.746 -7.812 18.323 527 1HG LYS 64 HG2 LYS 64 7.771 -9.632 19.653 528 2HG LYS 64 HG3 LYS 64 9.437 -9.323 20.110 529 1HD LYS 64 HD2 LYS 64 8.073 -9.806 22.034 530 2HD LYS 64 HD3 LYS 64 8.708 -8.177 22.177 531 1HE LYS 64 HE2 LYS 64 5.927 -8.677 21.011 532 2HE LYS 64 HE3 LYS 64 6.191 -8.713 22.760 533 1HZ LYS 64 HZ1 LYS 64 6.791 -6.399 21.051 534 2HZ LYS 64 HZ2 LYS 64 5.507 -6.574 22.060 535 3HZ LYS 64 HZ3 LYS 64 7.032 -6.509 22.672 536 H ASP 65 H ASP 65 11.062 -4.889 20.535 537 HA ASP 65 HA ASP 65 13.310 -4.775 20.500 538 1HB ASP 65 HB2 ASP 65 14.407 -6.620 21.857 539 2HB ASP 65 HB3 ASP 65 13.089 -5.709 22.595 540 H GLN 66 H GLN 66 13.190 -8.250 19.810 541 HA GLN 66 HA GLN 66 15.545 -7.964 18.126 542 1HB GLN 66 HB2 GLN 66 13.846 -10.351 18.923 543 2HB GLN 66 HB3 GLN 66 15.260 -10.475 17.869 544 1HG GLN 66 HG2 GLN 66 15.322 -9.341 20.707 545 2HG GLN 66 HG3 GLN 66 15.784 -10.984 20.260 546 1HE2 GLN 66 HE22 GLN 66 17.507 -11.089 18.416 547 2HE2 GLN 66 HE21 GLN 66 18.820 -9.935 18.574 548 H GLU 67 H GLU 67 12.050 -8.316 17.470 549 HA GLU 67 HA GLU 67 12.746 -8.518 14.547 550 1HB GLU 67 HB2 GLU 67 10.645 -10.220 15.921 551 2HB GLU 67 HB3 GLU 67 11.098 -10.201 14.208 552 1HG GLU 67 HG2 GLU 67 13.467 -10.848 14.940 553 2HG GLU 67 HG3 GLU 67 12.786 -11.168 16.543 554 H VAL 68 H VAL 68 11.266 -7.837 13.098 555 HA VAL 68 HA VAL 68 9.394 -5.712 13.931 556 HB VAL 68 HB VAL 68 10.221 -6.436 11.132 557 1HG1 VAL 68 HG11 VAL 68 9.518 -4.225 10.631 558 2HG1 VAL 68 HG12 VAL 68 8.216 -4.969 11.566 559 3HG1 VAL 68 HG13 VAL 68 9.299 -3.814 12.353 560 1HG2 VAL 68 HG21 VAL 68 12.334 -6.020 12.294 561 2HG2 VAL 68 HG22 VAL 68 11.908 -4.682 11.228 562 3HG2 VAL 68 HG23 VAL 68 11.666 -4.523 12.971 563 H ASN 69 H ASN 69 7.435 -6.738 14.526 564 HA ASN 69 HA ASN 69 6.527 -9.046 12.992 565 1HB ASN 69 HB2 ASN 69 5.095 -7.411 15.135 566 2HB ASN 69 HB3 ASN 69 4.547 -8.959 14.475 567 1HD2 ASN 69 HD21 ASN 69 6.637 -7.443 16.819 568 2HD2 ASN 69 HD22 ASN 69 7.365 -8.934 17.387 569 H PHE 70 H PHE 70 4.680 -9.190 11.692 570 HA PHE 70 HA PHE 70 4.583 -7.499 9.639 571 1HB PHE 70 HB2 PHE 70 3.543 -9.698 9.595 572 2HB PHE 70 HB3 PHE 70 2.283 -9.172 10.704 573 HD1 PHE 70 HD1 PHE 70 0.191 -8.810 9.681 574 HD2 PHE 70 HD2 PHE 70 3.793 -7.876 7.487 575 HE1 PHE 70 HE1 PHE 70 -1.151 -7.783 7.893 576 HE2 PHE 70 HE2 PHE 70 2.437 -6.884 5.682 577 HZ PHE 70 HZ PHE 70 -0.029 -6.713 5.937 578 H GLN 71 H GLN 71 1.892 -7.273 12.058 579 HA GLN 71 HA GLN 71 0.775 -5.007 10.814 580 1HB GLN 71 HB2 GLN 71 -0.378 -6.460 12.475 581 2HB GLN 71 HB3 GLN 71 0.597 -5.726 13.768 582 1HG GLN 71 HG2 GLN 71 -0.357 -3.502 13.227 583 2HG GLN 71 HG3 GLN 71 -1.238 -4.203 11.856 584 1HE2 GLN 71 HE22 GLN 71 -3.182 -3.303 12.839 585 2HE2 GLN 71 HE21 GLN 71 -3.901 -4.117 14.226 586 H GLU 72 H GLU 72 3.524 -5.245 13.006 587 HA GLU 72 HA GLU 72 3.486 -2.413 13.724 588 1HB GLU 72 HB2 GLU 72 5.637 -4.507 14.207 589 2HB GLU 72 HB3 GLU 72 5.483 -2.912 14.959 590 1HG GLU 72 HG2 GLU 72 3.497 -5.236 15.250 591 2HG GLU 72 HG3 GLU 72 4.602 -4.668 16.483 592 H TYR 73 H TYR 73 5.154 -4.555 11.427 593 HA TYR 73 HA TYR 73 6.832 -2.586 10.195 594 1HB TYR 73 HB2 TYR 73 7.331 -4.708 9.488 595 2HB TYR 73 HB3 TYR 73 5.677 -5.239 9.429 596 HD1 TYR 73 HD1 TYR 73 8.386 -3.611 7.547 597 HD2 TYR 73 HD2 TYR 73 4.292 -4.965 7.456 598 HE1 TYR 73 HE1 TYR 73 8.440 -3.659 5.064 599 HE2 TYR 73 HE2 TYR 73 4.300 -4.840 4.996 600 HH TYR 73 HH TYR 73 5.716 -4.849 3.130 601 H ILE 74 H ILE 74 3.445 -3.599 9.442 602 HA ILE 74 HA ILE 74 2.981 -1.633 7.452 603 HB ILE 74 HB ILE 74 1.018 -2.872 9.417 604 1HG1 ILE 74 HG12 ILE 74 2.128 -4.534 7.934 605 2HG1 ILE 74 HG13 ILE 74 0.398 -4.414 7.730 606 1HG2 ILE 74 HG21 ILE 74 0.559 -1.100 7.004 607 2HG2 ILE 74 HG22 ILE 74 -0.678 -2.224 7.590 608 3HG2 ILE 74 HG23 ILE 74 -0.084 -0.952 8.655 609 1HD1 ILE 74 HD11 ILE 74 0.729 -3.038 5.664 610 2HD1 ILE 74 HD12 ILE 74 2.489 -3.246 5.865 611 3HD1 ILE 74 HD13 ILE 74 1.444 -4.642 5.555 612 H THR 75 H THR 75 2.288 -1.418 10.976 613 HA THR 75 HA THR 75 1.333 1.222 11.016 614 HB THR 75 HB THR 75 2.936 -0.261 13.142 615 HG1 THR 75 HG1 THR 75 1.103 -1.374 12.596 616 1HG2 THR 75 HG21 THR 75 1.171 2.214 13.329 617 2HG2 THR 75 HG22 THR 75 1.646 1.210 14.718 618 3HG2 THR 75 HG23 THR 75 2.879 2.063 13.778 619 H PHE 76 H PHE 76 4.739 0.074 11.290 620 HA PHE 76 HA PHE 76 5.861 2.674 11.618 621 1HB PHE 76 HB2 PHE 76 7.100 0.600 12.106 622 2HB PHE 76 HB3 PHE 76 7.092 0.202 10.388 623 HD1 PHE 76 HD1 PHE 76 8.487 1.513 8.769 624 HD2 PHE 76 HD2 PHE 76 8.471 2.483 12.980 625 HE1 PHE 76 HE1 PHE 76 10.443 2.952 8.444 626 HE2 PHE 76 HE2 PHE 76 10.350 4.057 12.604 627 HZ PHE 76 HZ PHE 76 11.312 4.329 10.323 628 H LEU 77 H LEU 77 5.193 0.707 8.635 629 HA LEU 77 HA LEU 77 6.169 2.720 6.845 630 1HB LEU 77 HB2 LEU 77 4.098 0.524 6.518 631 2HB LEU 77 HB3 LEU 77 4.509 1.634 5.209 632 HG LEU 77 HG LEU 77 6.586 -0.067 6.674 633 1HD1 LEU 77 HD11 LEU 77 5.223 -0.563 3.997 634 2HD1 LEU 77 HD12 LEU 77 6.603 -1.461 4.659 635 3HD1 LEU 77 HD13 LEU 77 5.030 -1.536 5.483 636 1HD2 LEU 77 HD21 LEU 77 7.874 0.430 4.519 637 2HD2 LEU 77 HD22 LEU 77 6.629 1.647 4.152 638 3HD2 LEU 77 HD23 LEU 77 7.672 1.804 5.600 639 H GLY 78 H GLY 78 3.064 2.403 8.538 640 1HA GLY 78 HA2 GLY 78 1.775 4.687 7.452 641 2HA GLY 78 HA3 GLY 78 1.584 4.083 9.112 642 H ALA 79 H ALA 79 3.989 4.465 10.309 643 HA ALA 79 HA ALA 79 4.121 7.255 10.806 644 1HB ALA 79 HB1 ALA 79 4.999 5.525 12.353 645 2HB ALA 79 HB2 ALA 79 6.359 5.230 11.246 646 3HB ALA 79 HB3 ALA 79 6.177 6.811 12.021 647 H LEU 80 H LEU 80 6.103 5.249 8.619 648 HA LEU 80 HA LEU 80 7.848 7.263 7.717 649 1HB LEU 80 HB2 LEU 80 7.782 4.626 7.346 650 2HB LEU 80 HB3 LEU 80 6.863 5.049 5.906 651 HG LEU 80 HG LEU 80 8.815 6.568 5.260 652 1HD1 LEU 80 HD11 LEU 80 10.181 5.004 7.505 653 2HD1 LEU 80 HD12 LEU 80 11.021 5.975 6.285 654 3HD1 LEU 80 HD13 LEU 80 9.964 6.765 7.458 655 1HD2 LEU 80 HD21 LEU 80 9.371 3.588 5.611 656 2HD2 LEU 80 HD22 LEU 80 8.442 4.309 4.274 657 3HD2 LEU 80 HD23 LEU 80 10.174 4.655 4.446 658 H ALA 81 H ALA 81 4.678 6.199 6.452 659 HA ALA 81 HA ALA 81 4.456 8.014 4.283 660 1HB ALA 81 HB1 ALA 81 2.965 6.160 4.443 661 2HB ALA 81 HB2 ALA 81 2.359 6.674 6.017 662 3HB ALA 81 HB3 ALA 81 1.997 7.652 4.593 663 H MET 82 H MET 82 3.474 8.360 7.731 664 HA MET 82 HA MET 82 2.426 10.992 7.464 665 1HB MET 82 HB2 MET 82 2.029 9.503 9.411 666 2HB MET 82 HB3 MET 82 3.717 9.664 9.890 667 1HG MET 82 HG2 MET 82 2.219 11.119 11.195 668 2HG MET 82 HG3 MET 82 3.470 12.018 10.344 669 1HE MET 82 HE1 MET 82 -0.953 11.943 8.982 670 2HE MET 82 HE2 MET 82 0.189 10.649 8.601 671 3HE MET 82 HE3 MET 82 -0.297 10.936 10.294 672 H ILE 83 H ILE 83 5.718 9.847 8.215 673 HA ILE 83 HA ILE 83 6.922 12.415 8.548 674 HB ILE 83 HB ILE 83 8.034 9.706 7.764 675 1HG1 ILE 83 HG12 ILE 83 8.458 11.361 10.287 676 2HG1 ILE 83 HG13 ILE 83 7.102 10.250 10.124 677 1HG2 ILE 83 HG21 ILE 83 9.572 12.289 8.261 678 2HG2 ILE 83 HG22 ILE 83 10.303 10.674 8.169 679 3HG2 ILE 83 HG23 ILE 83 9.531 11.359 6.747 680 1HD1 ILE 83 HD11 ILE 83 8.872 9.135 11.310 681 2HD1 ILE 83 HD12 ILE 83 8.670 8.363 9.728 682 3HD1 ILE 83 HD13 ILE 83 10.039 9.460 10.021 683 H TYR 84 H TYR 84 6.373 10.406 5.619 684 HA TYR 84 HA TYR 84 7.346 12.482 3.796 685 1HB TYR 84 HB2 TYR 84 5.458 10.168 3.260 686 2HB TYR 84 HB3 TYR 84 6.353 11.101 2.065 687 HD1 TYR 84 HD1 TYR 84 6.238 8.084 2.332 688 HD2 TYR 84 HD2 TYR 84 9.062 10.990 3.825 689 HE1 TYR 84 HE1 TYR 84 8.049 6.416 2.162 690 HE2 TYR 84 HE2 TYR 84 10.861 9.309 3.668 691 HH TYR 84 HH TYR 84 10.305 6.018 2.399 692 H ASN 85 H ASN 85 5.924 13.960 5.453 693 HA ASN 85 HA ASN 85 3.180 13.852 5.233 694 1HB ASN 85 HB2 ASN 85 4.538 15.126 6.963 695 2HB ASN 85 HB3 ASN 85 4.626 16.449 5.788 696 1HD2 ASN 85 HD22 ASN 85 2.262 14.202 7.365 697 2HD2 ASN 85 HD21 ASN 85 0.923 15.354 7.379 698 H GLU 86 H GLU 86 5.403 15.328 2.989 699 HA GLU 86 HA GLU 86 3.596 16.905 1.452 700 1HB GLU 86 HB2 GLU 86 6.066 16.874 1.229 701 2HB GLU 86 HB3 GLU 86 5.998 15.259 0.517 702 1HG GLU 86 HG2 GLU 86 4.618 17.732 -0.642 703 2HG GLU 86 HG3 GLU 86 6.238 17.198 -1.101 704 H ALA 87 H ALA 87 4.369 13.387 1.374 705 HA ALA 87 HA ALA 87 2.610 12.767 -0.857 706 1HB ALA 87 HB1 ALA 87 3.659 10.935 1.344 707 2HB ALA 87 HB2 ALA 87 2.954 10.463 -0.207 708 3HB ALA 87 HB3 ALA 87 4.519 11.304 -0.172 709 H LEU 88 H LEU 88 2.426 12.691 2.710 710 HA LEU 88 HA LEU 88 -0.145 11.655 2.968 711 1HB LEU 88 HB2 LEU 88 1.640 12.345 4.753 712 2HB LEU 88 HB3 LEU 88 0.727 13.860 4.809 713 HG LEU 88 HG LEU 88 -0.096 12.517 6.538 714 1HD1 LEU 88 HD11 LEU 88 -1.920 13.485 5.050 715 2HD1 LEU 88 HD12 LEU 88 -2.110 11.860 4.357 716 3HD1 LEU 88 HD13 LEU 88 -2.405 12.124 6.081 717 1HD2 LEU 88 HD21 LEU 88 -0.780 10.198 6.345 718 2HD2 LEU 88 HD22 LEU 88 -0.373 10.154 4.626 719 3HD2 LEU 88 HD23 LEU 88 0.908 10.361 5.832 720 H LYS 89 H LYS 89 0.751 15.120 2.638 721 HA LYS 89 HA LYS 89 -1.870 16.171 2.470 722 1HB LYS 89 HB2 LYS 89 0.769 17.120 1.311 723 2HB LYS 89 HB3 LYS 89 -0.747 18.019 1.150 724 1HG LYS 89 HG2 LYS 89 -0.996 18.136 3.588 725 2HG LYS 89 HG3 LYS 89 0.496 17.206 3.818 726 1HD LYS 89 HD2 LYS 89 1.806 18.955 2.697 727 2HD LYS 89 HD3 LYS 89 0.329 19.879 2.345 728 1HE LYS 89 HE2 LYS 89 -0.094 20.147 4.778 729 2HE LYS 89 HE3 LYS 89 1.370 19.213 5.139 730 1HZ LYS 89 HZ1 LYS 89 1.763 21.550 5.258 731 2HZ LYS 89 HZ2 LYS 89 2.646 20.893 4.031 732 3HZ LYS 89 HZ3 LYS 89 1.288 21.766 3.694 733 H GLY 90 H GLY 90 0.385 15.304 -0.175 734 1HA GLY 90 HA2 GLY 90 0.030 14.831 -2.396 735 2HA GLY 90 HA3 GLY 90 -1.103 13.668 -1.690 736 1H MET 1 H1 MET 1 15.356 2.064 -4.816 737 2H MET 1 H2 MET 1 15.672 0.519 -5.310 738 3H MET 1 H3 MET 1 14.482 0.800 -4.202 739 HA MET 1 HA MET 1 14.457 1.683 -6.994 740 1HB MET 1 HB2 MET 1 12.689 -0.344 -5.557 741 2HB MET 1 HB3 MET 1 12.587 0.127 -7.262 742 1HG MET 1 HG2 MET 1 14.924 -0.742 -7.578 743 2HG MET 1 HG3 MET 1 14.896 -1.341 -5.914 744 1HE MET 1 HE1 MET 1 11.803 -2.463 -5.737 745 2HE MET 1 HE2 MET 1 12.168 -4.159 -6.108 746 3HE MET 1 HE3 MET 1 13.252 -3.230 -5.046 747 H ALA 2 H ALA 2 12.540 1.318 -4.040 748 HA ALA 2 HA ALA 2 11.176 2.594 -2.856 749 1HB ALA 2 HB1 ALA 2 12.883 4.382 -3.206 750 2HB ALA 2 HB2 ALA 2 11.934 4.980 -4.586 751 3HB ALA 2 HB3 ALA 2 11.238 4.984 -2.956 752 H SER 3 H SER 3 10.826 3.596 -6.239 753 HA SER 3 HA SER 3 8.268 4.503 -6.176 754 1HB SER 3 HB2 SER 3 9.188 2.953 -8.598 755 2HB SER 3 HB3 SER 3 8.182 4.395 -8.487 756 HG SER 3 HG SER 3 10.077 5.456 -7.581 757 HA PRO 4 HA PRO 4 6.429 0.179 -7.118 758 1HB PRO 4 HB2 PRO 4 8.350 -1.589 -5.587 759 2HB PRO 4 HB3 PRO 4 7.417 -1.982 -7.060 760 1HG PRO 4 HG2 PRO 4 10.050 -1.368 -7.270 761 2HG PRO 4 HG3 PRO 4 8.889 -0.625 -8.412 762 1HD PRO 4 HD2 PRO 4 9.988 0.558 -5.850 763 2HD PRO 4 HD3 PRO 4 9.980 1.276 -7.477 764 H LEU 5 H LEU 5 7.986 0.865 -3.985 765 HA LEU 5 HA LEU 5 5.647 -0.191 -2.530 766 1HB LEU 5 HB2 LEU 5 7.832 -0.512 -1.478 767 2HB LEU 5 HB3 LEU 5 8.138 1.232 -1.534 768 HG LEU 5 HG LEU 5 6.187 1.634 -0.033 769 1HD1 LEU 5 HD11 LEU 5 6.011 -1.426 0.067 770 2HD1 LEU 5 HD12 LEU 5 5.198 -0.295 1.168 771 3HD1 LEU 5 HD13 LEU 5 4.753 -0.319 -0.536 772 1HD2 LEU 5 HD21 LEU 5 7.149 0.858 1.989 773 2HD2 LEU 5 HD22 LEU 5 7.972 -0.471 1.168 774 3HD2 LEU 5 HD23 LEU 5 8.493 1.217 0.886 775 H ASP 6 H ASP 6 7.267 2.882 -3.349 776 HA ASP 6 HA ASP 6 5.757 4.683 -1.899 777 1HB ASP 6 HB2 ASP 6 6.726 5.126 -4.742 778 2HB ASP 6 HB3 ASP 6 6.254 6.374 -3.594 779 H GLN 7 H GLN 7 4.942 3.381 -5.169 780 HA GLN 7 HA GLN 7 2.513 4.808 -5.462 781 1HB GLN 7 HB2 GLN 7 1.888 3.104 -7.097 782 2HB GLN 7 HB3 GLN 7 3.613 3.485 -7.258 783 1HG GLN 7 HG2 GLN 7 4.096 1.497 -5.792 784 2HG GLN 7 HG3 GLN 7 2.383 1.038 -5.896 785 1HE2 GLN 7 HE22 GLN 7 4.280 -0.734 -6.581 786 2HE2 GLN 7 HE21 GLN 7 4.160 -1.026 -8.323 787 H ALA 8 H ALA 8 3.176 1.809 -3.634 788 HA ALA 8 HA ALA 8 0.381 1.145 -3.311 789 1HB ALA 8 HB1 ALA 8 1.225 -0.532 -1.712 790 2HB ALA 8 HB2 ALA 8 1.965 -0.602 -3.323 791 3HB ALA 8 HB3 ALA 8 2.872 0.078 -1.950 792 H ILE 9 H ILE 9 2.916 2.463 -1.061 793 HA ILE 9 HA ILE 9 1.001 2.977 1.039 794 HB ILE 9 HB ILE 9 2.567 4.579 1.975 795 1HG1 ILE 9 HG12 ILE 9 4.409 3.864 -0.321 796 2HG1 ILE 9 HG13 ILE 9 3.649 5.447 -0.062 797 1HG2 ILE 9 HG21 ILE 9 2.564 2.142 2.466 798 2HG2 ILE 9 HG22 ILE 9 3.816 1.911 1.224 799 3HG2 ILE 9 HG23 ILE 9 4.146 2.874 2.681 800 1HD1 ILE 9 HD11 ILE 9 5.895 5.591 0.744 801 2HD1 ILE 9 HD12 ILE 9 4.828 5.596 2.160 802 3HD1 ILE 9 HD13 ILE 9 5.735 4.131 1.723 803 H GLY 10 H GLY 10 2.119 4.890 -1.758 804 1HA GLY 10 HA2 GLY 10 0.735 7.266 -1.536 805 2HA GLY 10 HA3 GLY 10 1.058 6.397 -3.042 806 H LEU 11 H LEU 11 -0.520 4.114 -2.763 807 HA LEU 11 HA LEU 11 -3.053 4.999 -3.544 808 1HB LEU 11 HB2 LEU 11 -1.814 2.723 -3.864 809 2HB LEU 11 HB3 LEU 11 -2.499 2.273 -2.312 810 HG LEU 11 HG LEU 11 -3.814 1.317 -3.988 811 1HD1 LEU 11 HD11 LEU 11 -5.070 2.313 -2.087 812 2HD1 LEU 11 HD12 LEU 11 -5.439 3.718 -3.128 813 3HD1 LEU 11 HD13 LEU 11 -6.014 2.105 -3.574 814 1HD2 LEU 11 HD21 LEU 11 -4.123 4.015 -5.336 815 2HD2 LEU 11 HD22 LEU 11 -3.104 2.656 -5.877 816 3HD2 LEU 11 HD23 LEU 11 -4.866 2.478 -5.830 817 H LEU 12 H LEU 12 -2.270 3.328 -0.459 818 HA LEU 12 HA LEU 12 -4.710 3.735 0.897 819 1HB LEU 12 HB2 LEU 12 -1.801 3.551 1.866 820 2HB LEU 12 HB3 LEU 12 -3.156 3.739 2.974 821 HG LEU 12 HG LEU 12 -4.173 1.663 2.130 822 1HD1 LEU 12 HD11 LEU 12 -1.498 1.292 0.704 823 2HD1 LEU 12 HD12 LEU 12 -2.711 0.023 0.931 824 3HD1 LEU 12 HD13 LEU 12 -3.091 1.411 -0.084 825 1HD2 LEU 12 HD21 LEU 12 -2.576 0.167 3.320 826 2HD2 LEU 12 HD22 LEU 12 -1.360 1.460 3.275 827 3HD2 LEU 12 HD23 LEU 12 -2.873 1.674 4.183 828 H ILE 13 H ILE 13 -1.831 5.840 0.736 829 HA ILE 13 HA ILE 13 -2.802 7.804 2.559 830 HB ILE 13 HB ILE 13 -0.762 7.908 0.292 831 1HG1 ILE 13 HG12 ILE 13 -0.290 8.036 3.297 832 2HG1 ILE 13 HG13 ILE 13 -0.435 6.487 2.478 833 1HG2 ILE 13 HG21 ILE 13 -1.491 10.027 2.327 834 2HG2 ILE 13 HG22 ILE 13 0.041 10.004 1.411 835 3HG2 ILE 13 HG23 ILE 13 -1.490 10.187 0.558 836 1HD1 ILE 13 HD11 ILE 13 1.850 6.841 2.487 837 2HD1 ILE 13 HD12 ILE 13 1.410 7.358 0.861 838 3HD1 ILE 13 HD13 ILE 13 1.720 8.576 2.118 839 H GLY 14 H GLY 14 -2.889 7.700 -1.017 840 1HA GLY 14 HA2 GLY 14 -4.220 10.114 -1.509 841 2HA GLY 14 HA3 GLY 14 -4.297 8.661 -2.528 842 H ILE 15 H ILE 15 -5.599 6.787 -1.097 843 HA ILE 15 HA ILE 15 -8.330 7.452 -1.268 844 HB ILE 15 HB ILE 15 -6.730 5.264 0.037 845 1HG1 ILE 15 HG12 ILE 15 -8.944 5.362 -2.065 846 2HG1 ILE 15 HG13 ILE 15 -7.207 5.333 -2.402 847 1HG2 ILE 15 HG21 ILE 15 -8.825 4.149 0.775 848 2HG2 ILE 15 HG22 ILE 15 -8.448 5.599 1.669 849 3HG2 ILE 15 HG23 ILE 15 -9.717 5.652 0.420 850 1HD1 ILE 15 HD11 ILE 15 -8.858 3.096 -1.153 851 2HD1 ILE 15 HD12 ILE 15 -8.019 3.107 -2.703 852 3HD1 ILE 15 HD13 ILE 15 -7.085 3.123 -1.189 853 H PHE 16 H PHE 16 -6.250 7.295 1.645 854 HA PHE 16 HA PHE 16 -8.267 8.086 3.448 855 1HB PHE 16 HB2 PHE 16 -6.080 7.040 4.017 856 2HB PHE 16 HB3 PHE 16 -5.249 8.530 3.619 857 HD1 PHE 16 HD1 PHE 16 -7.441 6.832 6.059 858 HD2 PHE 16 HD2 PHE 16 -5.488 10.545 5.065 859 HE1 PHE 16 HE1 PHE 16 -7.698 7.600 8.407 860 HE2 PHE 16 HE2 PHE 16 -5.926 11.371 7.335 861 HZ PHE 16 HZ PHE 16 -6.960 9.871 9.044 862 H HIS 17 H HIS 17 -5.750 10.122 1.888 863 HA HIS 17 HA HIS 17 -6.672 12.363 3.384 864 1HB HIS 17 HB2 HIS 17 -4.280 11.829 2.487 865 2HB HIS 17 HB3 HIS 17 -4.812 12.718 1.053 866 HD1 HIS 17 HD1 HIS 17 -4.232 15.280 1.363 867 HD2 HIS 17 HD2 HIS 17 -4.921 13.202 4.960 868 HE1 HIS 17 HE1 HIS 17 -4.078 16.994 3.252 869 H LYS 18 H LYS 18 -7.440 11.143 0.168 870 HA LYS 18 HA LYS 18 -8.756 13.516 -0.829 871 1HB LYS 18 HB2 LYS 18 -9.183 10.543 -1.260 872 2HB LYS 18 HB3 LYS 18 -10.236 11.762 -2.009 873 1HG LYS 18 HG2 LYS 18 -8.223 12.850 -3.016 874 2HG LYS 18 HG3 LYS 18 -7.230 11.521 -2.435 875 1HD LYS 18 HD2 LYS 18 -9.546 11.364 -4.437 876 2HD LYS 18 HD3 LYS 18 -7.822 11.252 -4.782 877 1HE LYS 18 HE2 LYS 18 -8.449 9.027 -4.850 878 2HE LYS 18 HE3 LYS 18 -7.823 9.170 -3.203 879 1HZ LYS 18 HZ1 LYS 18 -10.652 9.265 -4.023 880 2HZ LYS 18 HZ2 LYS 18 -9.897 7.986 -3.316 881 3HZ LYS 18 HZ3 LYS 18 -10.120 9.377 -2.471 882 H TYR 19 H TYR 19 -9.951 10.702 1.083 883 HA TYR 19 HA TYR 19 -12.532 11.844 1.530 884 1HB TYR 19 HB2 TYR 19 -10.965 9.574 2.707 885 2HB TYR 19 HB3 TYR 19 -12.350 10.178 3.606 886 HD1 TYR 19 HD1 TYR 19 -11.387 8.577 0.390 887 HD2 TYR 19 HD2 TYR 19 -14.607 10.100 2.815 888 HE1 TYR 19 HE1 TYR 19 -13.033 7.590 -1.167 889 HE2 TYR 19 HE2 TYR 19 -16.239 9.164 1.226 890 HH TYR 19 HH TYR 19 -16.316 7.265 -0.388 891 H SER 20 H SER 20 -9.566 12.000 3.546 892 HA SER 20 HA SER 20 -10.603 13.504 5.653 893 1HB SER 20 HB2 SER 20 -7.874 13.974 4.376 894 2HB SER 20 HB3 SER 20 -8.341 14.342 6.027 895 HG SER 20 HG SER 20 -8.319 11.704 4.920 896 H GLY 21 H GLY 21 -9.403 14.679 2.501 897 1HA GLY 21 HA2 GLY 21 -9.691 17.448 2.894 898 2HA GLY 21 HA3 GLY 21 -9.750 16.594 1.341 899 H LYS 22 H LYS 22 -12.199 14.996 2.309 900 HA LYS 22 HA LYS 22 -14.159 16.669 1.132 901 1HB LYS 22 HB2 LYS 22 -14.142 14.150 1.331 902 2HB LYS 22 HB3 LYS 22 -14.637 14.320 3.011 903 1HG LYS 22 HG2 LYS 22 -16.657 15.508 2.404 904 2HG LYS 22 HG3 LYS 22 -16.223 15.476 0.687 905 1HD LYS 22 HD2 LYS 22 -16.771 13.027 2.438 906 2HD LYS 22 HD3 LYS 22 -17.918 13.773 1.312 907 1HE LYS 22 HE2 LYS 22 -16.222 13.347 -0.555 908 2HE LYS 22 HE3 LYS 22 -15.306 12.363 0.604 909 1HZ LYS 22 HZ1 LYS 22 -17.258 11.014 0.883 910 2HZ LYS 22 HZ2 LYS 22 -18.076 11.905 -0.237 911 3HZ LYS 22 HZ3 LYS 22 -16.755 11.029 -0.687 912 H GLU 23 H GLU 23 -13.494 15.843 4.533 913 HA GLU 23 HA GLU 23 -15.450 17.868 5.489 914 1HB GLU 23 HB2 GLU 23 -14.912 17.043 7.727 915 2HB GLU 23 HB3 GLU 23 -15.538 15.789 6.645 916 1HG GLU 23 HG2 GLU 23 -13.243 14.926 6.291 917 2HG GLU 23 HG3 GLU 23 -12.609 16.204 7.324 918 H GLY 24 H GLY 24 -12.011 17.470 4.933 919 1HA GLY 24 HA2 GLY 24 -10.454 19.151 4.716 920 2HA GLY 24 HA3 GLY 24 -11.621 20.345 5.305 921 H ASP 25 H ASP 25 -10.574 17.289 6.813 922 HA ASP 25 HA ASP 25 -9.772 18.713 9.292 923 1HB ASP 25 HB2 ASP 25 -9.568 16.506 10.265 924 2HB ASP 25 HB3 ASP 25 -11.094 16.605 9.396 925 H LYS 26 H LYS 26 -7.651 17.552 10.248 926 HA LYS 26 HA LYS 26 -5.429 18.187 8.486 927 1HB LYS 26 HB2 LYS 26 -5.301 18.714 10.821 928 2HB LYS 26 HB3 LYS 26 -5.592 17.047 11.302 929 1HG LYS 26 HG2 LYS 26 -3.239 17.801 11.531 930 2HG LYS 26 HG3 LYS 26 -3.395 16.363 10.521 931 1HD LYS 26 HD2 LYS 26 -3.068 17.641 8.495 932 2HD LYS 26 HD3 LYS 26 -3.184 19.182 9.368 933 1HE LYS 26 HE2 LYS 26 -1.106 18.814 10.510 934 2HE LYS 26 HE3 LYS 26 -1.046 17.110 10.027 935 1HZ LYS 26 HZ1 LYS 26 -0.861 19.358 8.156 936 2HZ LYS 26 HZ2 LYS 26 0.413 18.485 8.736 937 3HZ LYS 26 HZ3 LYS 26 -0.721 17.748 7.803 938 H HIS 27 H HIS 27 -5.503 15.199 10.372 939 HA HIS 27 HA HIS 27 -5.443 13.547 7.895 940 1HB HIS 27 HB2 HIS 27 -3.293 13.456 10.043 941 2HB HIS 27 HB3 HIS 27 -3.405 12.420 8.619 942 HD1 HIS 27 HD1 HIS 27 -3.900 15.045 6.543 943 HD2 HIS 27 HD2 HIS 27 -0.907 14.401 9.442 944 HE1 HIS 27 HE1 HIS 27 -1.844 16.310 5.770 945 H THR 28 H THR 28 -7.640 13.606 9.378 946 HA THR 28 HA THR 28 -7.759 11.045 10.778 947 HB THR 28 HB THR 28 -8.152 13.715 12.178 948 HG1 THR 28 HG1 THR 28 -6.101 12.198 12.005 949 1HG2 THR 28 HG21 THR 28 -8.874 12.408 14.157 950 2HG2 THR 28 HG22 THR 28 -10.025 12.299 12.824 951 3HG2 THR 28 HG23 THR 28 -8.925 10.937 13.160 952 H LEU 29 H LEU 29 -9.515 10.099 9.986 953 HA LEU 29 HA LEU 29 -11.639 11.709 8.677 954 1HB LEU 29 HB2 LEU 29 -11.542 8.712 9.140 955 2HB LEU 29 HB3 LEU 29 -12.577 9.566 8.008 956 HG LEU 29 HG LEU 29 -9.548 9.411 7.775 957 1HD1 LEU 29 HD11 LEU 29 -10.565 7.170 7.570 958 2HD1 LEU 29 HD12 LEU 29 -11.718 7.797 6.369 959 3HD1 LEU 29 HD13 LEU 29 -9.983 7.746 5.996 960 1HD2 LEU 29 HD21 LEU 29 -9.958 10.100 5.447 961 2HD2 LEU 29 HD22 LEU 29 -11.690 10.249 5.792 962 3HD2 LEU 29 HD23 LEU 29 -10.525 11.336 6.590 963 H SER 30 H SER 30 -13.940 11.170 9.237 964 HA SER 30 HA SER 30 -14.396 10.607 12.131 965 1HB SER 30 HB2 SER 30 -16.659 11.544 11.636 966 2HB SER 30 HB3 SER 30 -15.347 12.715 11.434 967 HG SER 30 HG SER 30 -15.577 12.653 9.277 968 H LYS 31 H LYS 31 -15.937 8.915 12.645 969 HA LYS 31 HA LYS 31 -15.552 6.594 11.294 970 1HB LYS 31 HB2 LYS 31 -17.436 5.674 12.570 971 2HB LYS 31 HB3 LYS 31 -16.325 6.634 13.534 972 1HG LYS 31 HG2 LYS 31 -17.905 8.516 13.579 973 2HG LYS 31 HG3 LYS 31 -19.035 7.615 12.537 974 1HD LYS 31 HD2 LYS 31 -19.250 5.852 14.218 975 2HD LYS 31 HD3 LYS 31 -18.096 6.681 15.276 976 1HE LYS 31 HE2 LYS 31 -19.617 8.628 15.450 977 2HE LYS 31 HE3 LYS 31 -20.759 7.853 14.335 978 1HZ LYS 31 HZ1 LYS 31 -19.978 6.803 16.962 979 2HZ LYS 31 HZ2 LYS 31 -21.390 7.570 16.609 980 3HZ LYS 31 HZ3 LYS 31 -21.053 6.110 15.924 981 H LYS 32 H LYS 32 -18.301 8.772 10.721 982 HA LYS 32 HA LYS 32 -19.543 6.931 8.816 983 1HB LYS 32 HB2 LYS 32 -20.988 8.290 10.012 984 2HB LYS 32 HB3 LYS 32 -20.128 9.792 9.579 985 1HG LYS 32 HG2 LYS 32 -20.826 9.552 7.235 986 2HG LYS 32 HG3 LYS 32 -21.567 7.977 7.593 987 1HD LYS 32 HD2 LYS 32 -23.227 9.050 9.051 988 2HD LYS 32 HD3 LYS 32 -22.391 10.605 8.919 989 1HE LYS 32 HE2 LYS 32 -24.377 10.566 7.475 990 2HE LYS 32 HE3 LYS 32 -22.898 10.738 6.516 991 1HZ LYS 32 HZ1 LYS 32 -23.016 8.412 6.013 992 2HZ LYS 32 HZ2 LYS 32 -24.374 8.230 6.935 993 3HZ LYS 32 HZ3 LYS 32 -24.416 9.160 5.574 994 H GLU 33 H GLU 33 -17.166 9.590 8.573 995 HA GLU 33 HA GLU 33 -17.316 9.719 5.680 996 1HB GLU 33 HB2 GLU 33 -16.368 11.534 7.052 997 2HB GLU 33 HB3 GLU 33 -15.026 10.475 7.536 998 1HG GLU 33 HG2 GLU 33 -14.270 10.290 5.223 999 2HG GLU 33 HG3 GLU 33 -15.716 11.147 4.644 1000 H LEU 34 H LEU 34 -15.444 7.853 8.095 1001 HA LEU 34 HA LEU 34 -13.921 6.338 6.247 1002 1HB LEU 34 HB2 LEU 34 -13.326 6.311 8.521 1003 2HB LEU 34 HB3 LEU 34 -14.886 5.731 9.056 1004 HG LEU 34 HG LEU 34 -13.071 4.076 9.158 1005 1HD1 LEU 34 HD11 LEU 34 -14.378 2.212 8.614 1006 2HD1 LEU 34 HD12 LEU 34 -15.546 3.482 8.949 1007 3HD1 LEU 34 HD13 LEU 34 -15.196 3.016 7.285 1008 1HD2 LEU 34 HD21 LEU 34 -12.243 2.972 7.108 1009 2HD2 LEU 34 HD22 LEU 34 -13.148 4.099 6.112 1010 3HD2 LEU 34 HD23 LEU 34 -11.831 4.694 7.137 1011 H LYS 35 H LYS 35 -17.264 5.668 7.580 1012 HA LYS 35 HA LYS 35 -17.693 3.375 5.974 1013 1HB LYS 35 HB2 LYS 35 -19.737 5.537 6.649 1014 2HB LYS 35 HB3 LYS 35 -20.070 4.007 5.860 1015 1HG LYS 35 HG2 LYS 35 -18.985 2.869 7.938 1016 2HG LYS 35 HG3 LYS 35 -19.060 4.473 8.678 1017 1HD LYS 35 HD2 LYS 35 -21.090 3.449 9.348 1018 2HD LYS 35 HD3 LYS 35 -21.568 4.487 8.003 1019 1HE LYS 35 HE2 LYS 35 -21.385 2.421 6.480 1020 2HE LYS 35 HE3 LYS 35 -21.043 1.471 7.925 1021 1HZ LYS 35 HZ1 LYS 35 -23.482 3.029 7.380 1022 2HZ LYS 35 HZ2 LYS 35 -23.339 1.389 7.316 1023 3HZ LYS 35 HZ3 LYS 35 -23.200 2.171 8.759 1024 H GLU 36 H GLU 36 -18.182 6.816 5.061 1025 HA GLU 36 HA GLU 36 -19.055 6.303 2.435 1026 1HB GLU 36 HB2 GLU 36 -18.999 8.500 3.861 1027 2HB GLU 36 HB3 GLU 36 -17.395 8.734 3.175 1028 1HG GLU 36 HG2 GLU 36 -19.004 9.936 1.820 1029 2HG GLU 36 HG3 GLU 36 -18.476 8.545 0.858 1030 H LEU 37 H LEU 37 -15.749 6.530 3.705 1031 HA LEU 37 HA LEU 37 -14.340 6.229 1.223 1032 1HB LEU 37 HB2 LEU 37 -13.297 6.994 3.258 1033 2HB LEU 37 HB3 LEU 37 -13.575 5.468 4.067 1034 HG LEU 37 HG LEU 37 -11.859 5.622 1.580 1035 1HD1 LEU 37 HD11 LEU 37 -9.929 5.726 3.212 1036 2HD1 LEU 37 HD12 LEU 37 -10.917 7.192 3.196 1037 3HD1 LEU 37 HD13 LEU 37 -11.090 5.998 4.512 1038 1HD2 LEU 37 HD21 LEU 37 -12.027 3.666 3.940 1039 2HD2 LEU 37 HD22 LEU 37 -12.452 3.312 2.247 1040 3HD2 LEU 37 HD23 LEU 37 -10.779 3.626 2.683 1041 H ILE 38 H ILE 38 -15.380 3.785 3.631 1042 HA ILE 38 HA ILE 38 -14.479 1.557 2.142 1043 HB ILE 38 HB ILE 38 -16.668 1.869 4.217 1044 1HG1 ILE 38 HG12 ILE 38 -13.820 0.734 4.234 1045 2HG1 ILE 38 HG13 ILE 38 -14.318 2.293 4.902 1046 1HG2 ILE 38 HG21 ILE 38 -15.576 -0.779 3.181 1047 2HG2 ILE 38 HG22 ILE 38 -16.794 -0.524 4.437 1048 3HG2 ILE 38 HG23 ILE 38 -17.192 -0.152 2.784 1049 1HD1 ILE 38 HD11 ILE 38 -15.069 -0.466 5.849 1050 2HD1 ILE 38 HD12 ILE 38 -14.139 0.788 6.706 1051 3HD1 ILE 38 HD13 ILE 38 -15.890 1.001 6.437 1052 H GLN 39 H GLN 39 -17.758 3.066 2.110 1053 HA GLN 39 HA GLN 39 -18.884 1.167 0.345 1054 1HB GLN 39 HB2 GLN 39 -19.507 4.120 0.711 1055 2HB GLN 39 HB3 GLN 39 -20.531 3.005 -0.200 1056 1HG GLN 39 HG2 GLN 39 -19.802 2.615 2.747 1057 2HG GLN 39 HG3 GLN 39 -21.269 3.418 2.178 1058 1HE2 GLN 39 HE22 GLN 39 -21.393 1.235 3.889 1059 2HE2 GLN 39 HE21 GLN 39 -22.081 -0.129 3.027 1060 H LYS 40 H LYS 40 -16.921 4.080 -0.406 1061 HA LYS 40 HA LYS 40 -17.302 3.775 -3.263 1062 1HB LYS 40 HB2 LYS 40 -16.793 5.922 -2.222 1063 2HB LYS 40 HB3 LYS 40 -15.253 5.298 -1.617 1064 1HG LYS 40 HG2 LYS 40 -14.894 6.711 -3.558 1065 2HG LYS 40 HG3 LYS 40 -14.371 5.068 -3.879 1066 1HD LYS 40 HD2 LYS 40 -15.540 6.056 -5.810 1067 2HD LYS 40 HD3 LYS 40 -16.349 4.604 -5.232 1068 1HE LYS 40 HE2 LYS 40 -17.934 6.431 -5.828 1069 2HE LYS 40 HE3 LYS 40 -18.095 5.947 -4.138 1070 1HZ LYS 40 HZ1 LYS 40 -16.772 7.838 -3.528 1071 2HZ LYS 40 HZ2 LYS 40 -16.598 8.284 -5.107 1072 3HZ LYS 40 HZ3 LYS 40 -18.086 8.315 -4.398 1073 H GLU 41 H GLU 41 -14.580 3.051 -1.032 1074 HA GLU 41 HA GLU 41 -12.979 2.027 -3.230 1075 1HB GLU 41 HB2 GLU 41 -12.492 1.925 -0.225 1076 2HB GLU 41 HB3 GLU 41 -11.299 1.611 -1.493 1077 1HG GLU 41 HG2 GLU 41 -12.712 4.276 -0.961 1078 2HG GLU 41 HG3 GLU 41 -11.040 3.879 -0.594 1079 H LEU 42 H LEU 42 -14.644 0.543 -0.480 1080 HA LEU 42 HA LEU 42 -14.107 -2.219 -1.518 1081 1HB LEU 42 HB2 LEU 42 -14.445 -1.083 1.271 1082 2HB LEU 42 HB3 LEU 42 -14.521 -2.817 0.950 1083 HG LEU 42 HG LEU 42 -12.094 -1.238 0.062 1084 1HD1 LEU 42 HD11 LEU 42 -11.037 -1.761 2.247 1085 2HD1 LEU 42 HD12 LEU 42 -12.395 -0.636 2.418 1086 3HD1 LEU 42 HD13 LEU 42 -12.601 -2.346 2.857 1087 1HD2 LEU 42 HD21 LEU 42 -10.987 -3.394 0.311 1088 2HD2 LEU 42 HD22 LEU 42 -12.424 -4.100 1.081 1089 3HD2 LEU 42 HD23 LEU 42 -12.468 -3.656 -0.630 1090 H THR 43 H THR 43 -16.050 -1.142 -2.876 1091 HA THR 43 HA THR 43 -18.550 -0.849 -1.737 1092 HB THR 43 HB THR 43 -17.997 -1.792 -4.575 1093 HG1 THR 43 HG1 THR 43 -17.618 0.770 -3.425 1094 1HG2 THR 43 HG21 THR 43 -19.999 0.201 -3.403 1095 2HG2 THR 43 HG22 THR 43 -19.797 -0.192 -5.121 1096 3HG2 THR 43 HG23 THR 43 -20.385 -1.429 -3.995 1097 H ILE 44 H ILE 44 -18.569 -2.716 -0.235 1098 HA ILE 44 HA ILE 44 -19.284 -5.332 -1.151 1099 HB ILE 44 HB ILE 44 -20.545 -5.360 1.163 1100 1HG1 ILE 44 HG12 ILE 44 -19.582 -3.983 2.859 1101 2HG1 ILE 44 HG13 ILE 44 -18.542 -3.128 1.726 1102 1HG2 ILE 44 HG21 ILE 44 -18.403 -5.967 2.213 1103 2HG2 ILE 44 HG22 ILE 44 -18.566 -6.651 0.592 1104 3HG2 ILE 44 HG23 ILE 44 -17.529 -5.230 0.852 1105 1HD1 ILE 44 HD11 ILE 44 -21.581 -2.958 1.898 1106 2HD1 ILE 44 HD12 ILE 44 -20.408 -1.745 2.448 1107 3HD1 ILE 44 HD13 ILE 44 -20.580 -2.068 0.720 1108 H GLY 45 H GLY 45 -20.503 -4.771 -3.007 1109 1HA GLY 45 HA2 GLY 45 -23.028 -3.725 -3.249 1110 2HA GLY 45 HA3 GLY 45 -22.492 -5.177 -4.111 1111 H SER 46 H SER 46 -22.229 -6.902 -1.792 1112 HA SER 46 HA SER 46 -24.913 -7.724 -1.211 1113 1HB SER 46 HB2 SER 46 -22.312 -8.348 0.238 1114 2HB SER 46 HB3 SER 46 -23.791 -9.329 0.233 1115 HG SER 46 HG SER 46 -22.126 -10.013 -1.281 1116 H LYS 47 H LYS 47 -25.554 -5.426 -0.589 1117 HA LYS 47 HA LYS 47 -24.562 -3.923 1.387 1118 1HB LYS 47 HB2 LYS 47 -27.564 -4.175 0.978 1119 2HB LYS 47 HB3 LYS 47 -26.686 -2.786 1.610 1120 1HG LYS 47 HG2 LYS 47 -26.803 -3.811 -1.232 1121 2HG LYS 47 HG3 LYS 47 -27.258 -2.229 -0.611 1122 1HD LYS 47 HD2 LYS 47 -24.430 -3.325 -0.862 1123 2HD LYS 47 HD3 LYS 47 -25.180 -2.155 -1.935 1124 1HE LYS 47 HE2 LYS 47 -25.188 -0.468 -0.178 1125 2HE LYS 47 HE3 LYS 47 -24.668 -1.648 1.036 1126 1HZ LYS 47 HZ1 LYS 47 -22.809 -0.404 0.263 1127 2HZ LYS 47 HZ2 LYS 47 -22.666 -1.980 -0.205 1128 3HZ LYS 47 HZ3 LYS 47 -23.106 -0.829 -1.300 1129 H LEU 48 H LEU 48 -26.381 -6.818 2.140 1130 HA LEU 48 HA LEU 48 -27.058 -6.358 4.839 1131 1HB LEU 48 HB2 LEU 48 -25.848 -8.878 3.628 1132 2HB LEU 48 HB3 LEU 48 -26.755 -8.786 5.142 1133 HG LEU 48 HG LEU 48 -27.879 -8.245 2.349 1134 1HD1 LEU 48 HD11 LEU 48 -27.364 -10.616 2.794 1135 2HD1 LEU 48 HD12 LEU 48 -28.322 -10.549 4.289 1136 3HD1 LEU 48 HD13 LEU 48 -29.112 -10.334 2.713 1137 1HD2 LEU 48 HD21 LEU 48 -29.089 -6.868 3.979 1138 2HD2 LEU 48 HD22 LEU 48 -30.090 -8.248 3.521 1139 3HD2 LEU 48 HD23 LEU 48 -29.243 -8.255 5.082 1140 H GLN 49 H GLN 49 -23.908 -7.005 3.381 1141 HA GLN 49 HA GLN 49 -22.447 -7.454 5.789 1142 1HB GLN 49 HB2 GLN 49 -21.509 -6.381 3.101 1143 2HB GLN 49 HB3 GLN 49 -20.460 -6.889 4.434 1144 1HG GLN 49 HG2 GLN 49 -21.591 -9.173 4.344 1145 2HG GLN 49 HG3 GLN 49 -22.379 -8.649 2.852 1146 1HE2 GLN 49 HE22 GLN 49 -19.163 -9.047 4.413 1147 2HE2 GLN 49 HE21 GLN 49 -18.301 -9.371 2.910 1148 H ASP 50 H ASP 50 -23.891 -4.493 4.673 1149 HA ASP 50 HA ASP 50 -22.166 -2.561 5.731 1150 1HB ASP 50 HB2 ASP 50 -25.206 -2.705 5.785 1151 2HB ASP 50 HB3 ASP 50 -24.278 -1.298 6.309 1152 H ALA 51 H ALA 51 -24.233 -4.897 7.466 1153 HA ALA 51 HA ALA 51 -23.937 -3.823 10.103 1154 1HB ALA 51 HB1 ALA 51 -25.482 -5.652 9.544 1155 2HB ALA 51 HB2 ALA 51 -24.115 -6.721 9.171 1156 3HB ALA 51 HB3 ALA 51 -24.363 -6.141 10.832 1157 H GLU 52 H GLU 52 -21.832 -5.977 8.167 1158 HA GLU 52 HA GLU 52 -19.860 -6.396 10.251 1159 1HB GLU 52 HB2 GLU 52 -19.531 -6.642 7.228 1160 2HB GLU 52 HB3 GLU 52 -18.479 -7.302 8.479 1161 1HG GLU 52 HG2 GLU 52 -20.340 -8.743 9.293 1162 2HG GLU 52 HG3 GLU 52 -21.387 -8.129 8.004 1163 H ILE 53 H ILE 53 -20.315 -4.155 7.486 1164 HA ILE 53 HA ILE 53 -17.874 -2.760 7.824 1165 HB ILE 53 HB ILE 53 -20.479 -1.604 6.791 1166 1HG1 ILE 53 HG12 ILE 53 -19.922 -3.439 5.344 1167 2HG1 ILE 53 HG13 ILE 53 -19.377 -1.971 4.551 1168 1HG2 ILE 53 HG21 ILE 53 -19.024 0.195 7.391 1169 2HG2 ILE 53 HG22 ILE 53 -17.632 -0.599 6.647 1170 3HG2 ILE 53 HG23 ILE 53 -18.962 0.017 5.639 1171 1HD1 ILE 53 HD11 ILE 53 -17.029 -2.502 5.471 1172 2HD1 ILE 53 HD12 ILE 53 -17.687 -4.084 5.937 1173 3HD1 ILE 53 HD13 ILE 53 -17.664 -3.598 4.239 1174 H VAL 54 H VAL 54 -21.057 -2.119 9.508 1175 HA VAL 54 HA VAL 54 -19.807 0.079 10.875 1176 HB VAL 54 HB VAL 54 -21.676 0.003 12.505 1177 1HG1 VAL 54 HG11 VAL 54 -23.169 1.075 10.875 1178 2HG1 VAL 54 HG12 VAL 54 -21.485 1.530 10.576 1179 3HG1 VAL 54 HG13 VAL 54 -22.266 0.302 9.550 1180 1HG2 VAL 54 HG21 VAL 54 -22.922 -1.939 10.571 1181 2HG2 VAL 54 HG22 VAL 54 -22.388 -2.344 12.223 1182 3HG2 VAL 54 HG23 VAL 54 -23.689 -1.171 11.962 1183 H LYS 55 H LYS 55 -19.947 -3.389 11.709 1184 HA LYS 55 HA LYS 55 -18.763 -3.065 14.310 1185 1HB LYS 55 HB2 LYS 55 -19.716 -5.146 13.635 1186 2HB LYS 55 HB3 LYS 55 -18.600 -5.326 12.288 1187 1HG LYS 55 HG2 LYS 55 -17.427 -5.014 15.053 1188 2HG LYS 55 HG3 LYS 55 -18.263 -6.526 14.703 1189 1HD LYS 55 HD2 LYS 55 -15.956 -5.446 13.015 1190 2HD LYS 55 HD3 LYS 55 -15.796 -6.586 14.347 1191 1HE LYS 55 HE2 LYS 55 -17.291 -8.192 13.159 1192 2HE LYS 55 HE3 LYS 55 -17.383 -7.079 11.781 1193 1HZ LYS 55 HZ1 LYS 55 -15.026 -7.253 11.547 1194 2HZ LYS 55 HZ2 LYS 55 -14.932 -8.296 12.820 1195 3HZ LYS 55 HZ3 LYS 55 -15.736 -8.737 11.450 1196 H LEU 56 H LEU 56 -17.290 -3.525 11.083 1197 HA LEU 56 HA LEU 56 -14.576 -3.309 11.911 1198 1HB LEU 56 HB2 LEU 56 -15.084 -4.343 9.901 1199 2HB LEU 56 HB3 LEU 56 -16.067 -3.014 9.304 1200 HG LEU 56 HG LEU 56 -13.177 -2.375 9.805 1201 1HD1 LEU 56 HD11 LEU 56 -14.162 -4.089 7.472 1202 2HD1 LEU 56 HD12 LEU 56 -12.575 -3.307 7.563 1203 3HD1 LEU 56 HD13 LEU 56 -12.996 -4.590 8.717 1204 1HD2 LEU 56 HD21 LEU 56 -15.165 -1.827 7.561 1205 2HD2 LEU 56 HD22 LEU 56 -14.818 -0.700 8.877 1206 3HD2 LEU 56 HD23 LEU 56 -13.538 -1.118 7.718 1207 H MET 57 H MET 57 -16.902 -0.824 10.877 1208 HA MET 57 HA MET 57 -15.219 1.452 10.888 1209 1HB MET 57 HB2 MET 57 -17.553 1.436 9.989 1210 2HB MET 57 HB3 MET 57 -18.133 1.125 11.626 1211 1HG MET 57 HG2 MET 57 -16.968 3.409 12.217 1212 2HG MET 57 HG3 MET 57 -17.084 3.676 10.489 1213 1HE MET 57 HE1 MET 57 -20.651 3.309 13.402 1214 2HE MET 57 HE2 MET 57 -19.684 1.875 13.023 1215 3HE MET 57 HE3 MET 57 -18.939 3.245 13.876 1216 H ASP 58 H ASP 58 -17.323 0.054 13.475 1217 HA ASP 58 HA ASP 58 -16.555 1.732 15.600 1218 1HB ASP 58 HB2 ASP 58 -18.387 0.258 15.889 1219 2HB ASP 58 HB3 ASP 58 -17.425 -1.171 15.522 1220 H ASP 59 H ASP 59 -15.030 -1.352 14.534 1221 HA ASP 59 HA ASP 59 -12.917 -1.283 16.424 1222 1HB ASP 59 HB2 ASP 59 -12.858 -2.472 13.622 1223 2HB ASP 59 HB3 ASP 59 -11.748 -2.847 14.946 1224 H LEU 60 H LEU 60 -12.969 0.122 13.125 1225 HA LEU 60 HA LEU 60 -10.319 1.210 13.209 1226 1HB LEU 60 HB2 LEU 60 -12.861 1.792 11.670 1227 2HB LEU 60 HB3 LEU 60 -11.537 2.941 11.559 1228 HG LEU 60 HG LEU 60 -10.931 0.040 11.089 1229 1HD1 LEU 60 HD11 LEU 60 -11.476 0.236 8.702 1230 2HD1 LEU 60 HD12 LEU 60 -12.930 0.428 9.707 1231 3HD1 LEU 60 HD13 LEU 60 -12.140 1.847 8.983 1232 1HD2 LEU 60 HD21 LEU 60 -9.099 1.784 11.025 1233 2HD2 LEU 60 HD22 LEU 60 -9.350 1.068 9.409 1234 3HD2 LEU 60 HD23 LEU 60 -10.004 2.657 9.765 1235 H ASP 61 H ASP 61 -13.454 2.676 14.075 1236 HA ASP 61 HA ASP 61 -12.173 5.177 14.713 1237 1HB ASP 61 HB2 ASP 61 -14.255 6.121 14.834 1238 2HB ASP 61 HB3 ASP 61 -14.394 4.926 13.554 1239 H ARG 62 H ARG 62 -13.010 2.421 16.639 1240 HA ARG 62 HA ARG 62 -13.371 3.569 19.158 1241 1HB ARG 62 HB2 ARG 62 -13.587 1.226 18.834 1242 2HB ARG 62 HB3 ARG 62 -11.907 1.044 18.287 1243 1HG ARG 62 HG2 ARG 62 -11.068 1.575 20.518 1244 2HG ARG 62 HG3 ARG 62 -12.707 1.926 21.097 1245 1HD ARG 62 HD2 ARG 62 -11.763 -0.805 20.081 1246 2HD ARG 62 HD3 ARG 62 -11.769 -0.305 21.763 1247 HE ARG 62 HE ARG 62 -14.071 -0.321 21.897 1248 1HH1 ARG 62 HH22 ARG 62 -13.091 -1.206 18.598 1249 2HH1 ARG 62 HH21 ARG 62 -14.654 -1.866 18.189 1250 1HH2 ARG 62 HH12 ARG 62 -16.111 -1.142 21.315 1251 2HH2 ARG 62 HH11 ARG 62 -16.377 -1.707 19.678 1252 H ASN 63 H ASN 63 -10.371 2.965 17.378 1253 HA ASN 63 HA ASN 63 -8.511 3.434 19.368 1254 1HB ASN 63 HB2 ASN 63 -8.204 4.147 16.432 1255 2HB ASN 63 HB3 ASN 63 -6.889 3.882 17.602 1256 1HD2 ASN 63 HD22 ASN 63 -9.262 2.365 15.527 1257 2HD2 ASN 63 HD21 ASN 63 -8.944 0.708 15.962 1258 H LYS 64 H LYS 64 -10.253 5.884 17.504 1259 HA LYS 64 HA LYS 64 -9.355 7.880 19.505 1260 1HB LYS 64 HB2 LYS 64 -8.032 8.174 17.412 1261 2HB LYS 64 HB3 LYS 64 -9.523 8.525 16.539 1262 1HG LYS 64 HG2 LYS 64 -9.863 10.521 17.987 1263 2HG LYS 64 HG3 LYS 64 -8.434 10.074 18.939 1264 1HD LYS 64 HD2 LYS 64 -6.991 10.295 16.967 1265 2HD LYS 64 HD3 LYS 64 -8.393 10.641 15.936 1266 1HE LYS 64 HE2 LYS 64 -8.834 12.722 17.182 1267 2HE LYS 64 HE3 LYS 64 -7.498 12.364 18.295 1268 1HZ LYS 64 HZ1 LYS 64 -6.861 13.900 16.590 1269 2HZ LYS 64 HZ2 LYS 64 -5.992 12.507 16.464 1270 3HZ LYS 64 HZ3 LYS 64 -7.214 12.812 15.404 1271 H ASP 65 H ASP 65 -11.454 6.341 19.801 1272 HA ASP 65 HA ASP 65 -13.745 6.246 19.887 1273 1HB ASP 65 HB2 ASP 65 -14.443 7.664 21.691 1274 2HB ASP 65 HB3 ASP 65 -12.796 7.087 21.963 1275 H GLN 66 H GLN 66 -13.982 6.686 17.538 1276 HA GLN 66 HA GLN 66 -15.929 7.112 16.303 1277 1HB GLN 66 HB2 GLN 66 -16.142 9.856 17.548 1278 2HB GLN 66 HB3 GLN 66 -17.201 9.172 16.344 1279 1HG GLN 66 HG2 GLN 66 -18.205 7.636 17.746 1280 2HG GLN 66 HG3 GLN 66 -16.885 7.590 18.902 1281 1HE2 GLN 66 HE22 GLN 66 -16.351 9.853 19.883 1282 2HE2 GLN 66 HE21 GLN 66 -17.763 10.704 20.521 1283 H GLU 67 H GLU 67 -12.990 8.825 16.630 1284 HA GLU 67 HA GLU 67 -13.099 9.648 13.765 1285 1HB GLU 67 HB2 GLU 67 -11.174 10.479 15.969 1286 2HB GLU 67 HB3 GLU 67 -11.187 11.049 14.296 1287 1HG GLU 67 HG2 GLU 67 -13.397 11.526 16.348 1288 2HG GLU 67 HG3 GLU 67 -12.200 12.704 15.809 1289 H VAL 68 H VAL 68 -11.249 9.106 12.500 1290 HA VAL 68 HA VAL 68 -9.739 6.670 13.392 1291 HB VAL 68 HB VAL 68 -10.775 7.274 10.594 1292 1HG1 VAL 68 HG11 VAL 68 -9.509 4.764 11.770 1293 2HG1 VAL 68 HG12 VAL 68 -10.051 5.002 10.092 1294 3HG1 VAL 68 HG13 VAL 68 -8.680 5.927 10.719 1295 1HG2 VAL 68 HG21 VAL 68 -11.839 5.220 12.546 1296 2HG2 VAL 68 HG22 VAL 68 -12.696 6.705 12.072 1297 3HG2 VAL 68 HG23 VAL 68 -12.359 5.455 10.874 1298 H ASN 69 H ASN 69 -7.736 7.596 13.820 1299 HA ASN 69 HA ASN 69 -6.759 9.825 12.195 1300 1HB ASN 69 HB2 ASN 69 -6.160 9.668 14.579 1301 2HB ASN 69 HB3 ASN 69 -5.366 8.114 14.281 1302 1HD2 ASN 69 HD21 ASN 69 -5.196 11.613 13.594 1303 2HD2 ASN 69 HD22 ASN 69 -3.486 11.593 13.170 1304 H PHE 70 H PHE 70 -4.984 9.754 10.727 1305 HA PHE 70 HA PHE 70 -4.820 7.733 8.891 1306 1HB PHE 70 HB2 PHE 70 -3.814 9.922 8.595 1307 2HB PHE 70 HB3 PHE 70 -2.605 9.575 9.831 1308 HD1 PHE 70 HD1 PHE 70 -0.588 8.390 9.265 1309 HD2 PHE 70 HD2 PHE 70 -3.933 8.314 6.553 1310 HE1 PHE 70 HE1 PHE 70 0.831 7.372 7.536 1311 HE2 PHE 70 HE2 PHE 70 -2.527 7.192 4.851 1312 HZ PHE 70 HZ PHE 70 -0.129 6.735 5.330 1313 H GLN 71 H GLN 71 -2.716 7.918 11.828 1314 HA GLN 71 HA GLN 71 -1.134 5.633 11.178 1315 1HB GLN 71 HB2 GLN 71 -0.429 7.149 12.871 1316 2HB GLN 71 HB3 GLN 71 -1.897 6.930 13.827 1317 1HG GLN 71 HG2 GLN 71 -0.086 4.551 13.268 1318 2HG GLN 71 HG3 GLN 71 0.338 5.734 14.507 1319 1HE2 GLN 71 HE22 GLN 71 -1.486 2.837 14.006 1320 2HE2 GLN 71 HE21 GLN 71 -2.374 2.966 15.513 1321 H GLU 72 H GLU 72 -4.208 5.970 12.931 1322 HA GLU 72 HA GLU 72 -4.413 3.241 13.793 1323 1HB GLU 72 HB2 GLU 72 -6.561 5.351 13.378 1324 2HB GLU 72 HB3 GLU 72 -6.746 3.860 14.304 1325 1HG GLU 72 HG2 GLU 72 -5.103 4.543 15.942 1326 2HG GLU 72 HG3 GLU 72 -4.605 5.946 15.006 1327 H TYR 73 H TYR 73 -5.682 5.075 11.015 1328 HA TYR 73 HA TYR 73 -7.089 3.007 9.684 1329 1HB TYR 73 HB2 TYR 73 -7.406 5.176 8.919 1330 2HB TYR 73 HB3 TYR 73 -5.701 5.538 8.834 1331 HD1 TYR 73 HD1 TYR 73 -8.499 3.834 7.111 1332 HD2 TYR 73 HD2 TYR 73 -4.396 5.146 6.875 1333 HE1 TYR 73 HE1 TYR 73 -8.614 3.793 4.632 1334 HE2 TYR 73 HE2 TYR 73 -4.485 5.000 4.422 1335 HH TYR 73 HH TYR 73 -5.941 4.904 2.591 1336 H ILE 74 H ILE 74 -3.607 3.984 9.242 1337 HA ILE 74 HA ILE 74 -3.038 1.857 7.442 1338 HB ILE 74 HB ILE 74 -1.174 3.302 9.353 1339 1HG1 ILE 74 HG12 ILE 74 -2.263 4.780 7.636 1340 2HG1 ILE 74 HG13 ILE 74 -0.518 4.697 7.575 1341 1HG2 ILE 74 HG21 ILE 74 -0.026 1.327 8.804 1342 2HG2 ILE 74 HG22 ILE 74 -0.630 1.307 7.132 1343 3HG2 ILE 74 HG23 ILE 74 0.584 2.489 7.627 1344 1HD1 ILE 74 HD11 ILE 74 -2.422 3.275 5.690 1345 2HD1 ILE 74 HD12 ILE 74 -1.433 4.691 5.313 1346 3HD1 ILE 74 HD13 ILE 74 -0.642 3.153 5.619 1347 H THR 75 H THR 75 -2.435 1.966 11.019 1348 HA THR 75 HA THR 75 -1.502 -0.635 11.354 1349 HB THR 75 HB THR 75 -3.249 1.084 13.168 1350 HG1 THR 75 HG1 THR 75 -0.440 0.707 13.018 1351 1HG2 THR 75 HG21 THR 75 -1.479 -1.307 13.852 1352 2HG2 THR 75 HG22 THR 75 -2.138 -0.157 15.032 1353 3HG2 THR 75 HG23 THR 75 -3.236 -1.175 14.093 1354 H PHE 76 H PHE 76 -4.920 0.481 11.292 1355 HA PHE 76 HA PHE 76 -6.040 -2.093 11.839 1356 1HB PHE 76 HB2 PHE 76 -7.288 0.008 12.136 1357 2HB PHE 76 HB3 PHE 76 -7.247 0.283 10.395 1358 HD1 PHE 76 HD1 PHE 76 -8.619 -1.105 8.855 1359 HD2 PHE 76 HD2 PHE 76 -8.649 -1.839 13.111 1360 HE1 PHE 76 HE1 PHE 76 -10.544 -2.603 8.583 1361 HE2 PHE 76 HE2 PHE 76 -10.487 -3.474 12.801 1362 HZ PHE 76 HZ PHE 76 -11.407 -3.898 10.527 1363 H LEU 77 H LEU 77 -5.332 -0.362 8.725 1364 HA LEU 77 HA LEU 77 -6.272 -2.503 7.073 1365 1HB LEU 77 HB2 LEU 77 -4.201 -0.332 6.618 1366 2HB LEU 77 HB3 LEU 77 -4.626 -1.514 5.377 1367 HG LEU 77 HG LEU 77 -6.693 0.281 6.732 1368 1HD1 LEU 77 HD11 LEU 77 -5.268 0.641 4.064 1369 2HD1 LEU 77 HD12 LEU 77 -6.654 1.581 4.644 1370 3HD1 LEU 77 HD13 LEU 77 -5.105 1.681 5.505 1371 1HD2 LEU 77 HD21 LEU 77 -7.740 -1.682 5.713 1372 2HD2 LEU 77 HD22 LEU 77 -8.016 -0.294 4.667 1373 3HD2 LEU 77 HD23 LEU 77 -6.759 -1.477 4.238 1374 H GLY 78 H GLY 78 -3.190 -2.029 8.784 1375 1HA GLY 78 HA2 GLY 78 -1.860 -4.350 7.843 1376 2HA GLY 78 HA3 GLY 78 -1.683 -3.644 9.464 1377 H ALA 79 H ALA 79 -4.161 -4.001 10.613 1378 HA ALA 79 HA ALA 79 -4.256 -6.767 11.281 1379 1HB ALA 79 HB1 ALA 79 -5.289 -4.997 12.697 1380 2HB ALA 79 HB2 ALA 79 -6.574 -4.790 11.495 1381 3HB ALA 79 HB3 ALA 79 -6.392 -6.330 12.338 1382 H LEU 80 H LEU 80 -6.291 -4.898 8.989 1383 HA LEU 80 HA LEU 80 -7.920 -7.028 8.174 1384 1HB LEU 80 HB2 LEU 80 -8.010 -4.414 7.695 1385 2HB LEU 80 HB3 LEU 80 -7.092 -4.849 6.254 1386 HG LEU 80 HG LEU 80 -8.995 -6.621 5.862 1387 1HD1 LEU 80 HD11 LEU 80 -10.393 -4.710 7.781 1388 2HD1 LEU 80 HD12 LEU 80 -11.186 -5.946 6.790 1389 3HD1 LEU 80 HD13 LEU 80 -10.081 -6.429 8.089 1390 1HD2 LEU 80 HD21 LEU 80 -9.547 -3.611 5.705 1391 2HD2 LEU 80 HD22 LEU 80 -8.678 -4.567 4.482 1392 3HD2 LEU 80 HD23 LEU 80 -10.406 -4.851 4.773 1393 H ALA 81 H ALA 81 -4.778 -5.935 6.878 1394 HA ALA 81 HA ALA 81 -4.534 -7.804 4.741 1395 1HB ALA 81 HB1 ALA 81 -2.074 -7.457 5.122 1396 2HB ALA 81 HB2 ALA 81 -3.015 -5.960 4.882 1397 3HB ALA 81 HB3 ALA 81 -2.469 -6.423 6.497 1398 H MET 82 H MET 82 -3.695 -8.053 8.241 1399 HA MET 82 HA MET 82 -2.679 -10.715 8.022 1400 1HB MET 82 HB2 MET 82 -2.303 -9.043 9.899 1401 2HB MET 82 HB3 MET 82 -3.899 -9.486 10.523 1402 1HG MET 82 HG2 MET 82 -3.177 -11.823 10.751 1403 2HG MET 82 HG3 MET 82 -1.624 -11.440 9.990 1404 1HE MET 82 HE1 MET 82 -0.564 -12.265 13.636 1405 2HE MET 82 HE2 MET 82 -1.862 -13.036 12.692 1406 3HE MET 82 HE3 MET 82 -0.315 -12.621 11.909 1407 H ILE 83 H ILE 83 -5.961 -9.451 8.674 1408 HA ILE 83 HA ILE 83 -7.292 -11.934 9.094 1409 HB ILE 83 HB ILE 83 -8.286 -9.368 7.801 1410 1HG1 ILE 83 HG12 ILE 83 -7.590 -9.302 10.262 1411 2HG1 ILE 83 HG13 ILE 83 -9.200 -8.728 9.835 1412 1HG2 ILE 83 HG21 ILE 83 -9.869 -11.827 8.558 1413 2HG2 ILE 83 HG22 ILE 83 -10.577 -10.219 8.268 1414 3HG2 ILE 83 HG23 ILE 83 -9.733 -11.056 6.966 1415 1HD1 ILE 83 HD11 ILE 83 -10.210 -10.782 10.649 1416 2HD1 ILE 83 HD12 ILE 83 -8.605 -11.495 10.956 1417 3HD1 ILE 83 HD13 ILE 83 -9.158 -10.092 11.891 1418 H TYR 84 H TYR 84 -6.519 -10.167 6.059 1419 HA TYR 84 HA TYR 84 -7.382 -12.372 4.342 1420 1HB TYR 84 HB2 TYR 84 -5.511 -10.070 3.715 1421 2HB TYR 84 HB3 TYR 84 -6.382 -11.076 2.560 1422 HD1 TYR 84 HD1 TYR 84 -6.272 -7.981 2.879 1423 HD2 TYR 84 HD2 TYR 84 -9.145 -10.978 4.062 1424 HE1 TYR 84 HE1 TYR 84 -8.101 -6.340 2.613 1425 HE2 TYR 84 HE2 TYR 84 -10.961 -9.323 3.819 1426 HH TYR 84 HH TYR 84 -10.377 -6.005 2.638 1427 H ASN 85 H ASN 85 -6.020 -13.705 6.108 1428 HA ASN 85 HA ASN 85 -3.294 -13.783 6.191 1429 1HB ASN 85 HB2 ASN 85 -3.440 -15.990 7.072 1430 2HB ASN 85 HB3 ASN 85 -4.821 -15.059 7.665 1431 1HD2 ASN 85 HD22 ASN 85 -4.589 -17.981 7.563 1432 2HD2 ASN 85 HD21 ASN 85 -5.861 -18.528 6.483 1433 H GLU 86 H GLU 86 -5.321 -15.449 3.805 1434 HA GLU 86 HA GLU 86 -3.588 -16.869 2.261 1435 1HB GLU 86 HB2 GLU 86 -4.976 -16.267 0.319 1436 2HB GLU 86 HB3 GLU 86 -5.924 -16.673 1.754 1437 1HG GLU 86 HG2 GLU 86 -6.189 -14.173 2.195 1438 2HG GLU 86 HG3 GLU 86 -5.435 -13.883 0.618 1439 H ALA 87 H ALA 87 -3.785 -13.285 2.258 1440 HA ALA 87 HA ALA 87 -2.091 -12.815 0.037 1441 1HB ALA 87 HB1 ALA 87 -2.502 -11.088 2.511 1442 2HB ALA 87 HB2 ALA 87 -1.899 -10.556 0.926 1443 3HB ALA 87 HB3 ALA 87 -3.571 -11.122 1.091 1444 H LEU 88 H LEU 88 -1.340 -13.632 3.416 1445 HA LEU 88 HA LEU 88 1.375 -12.738 3.471 1446 1HB LEU 88 HB2 LEU 88 0.127 -15.091 4.934 1447 2HB LEU 88 HB3 LEU 88 1.619 -14.286 5.363 1448 HG LEU 88 HG LEU 88 -1.116 -12.923 5.415 1449 1HD1 LEU 88 HD11 LEU 88 0.563 -14.063 7.686 1450 2HD1 LEU 88 HD12 LEU 88 -0.965 -13.169 7.852 1451 3HD1 LEU 88 HD13 LEU 88 -0.950 -14.756 7.063 1452 1HD2 LEU 88 HD21 LEU 88 1.599 -12.038 6.491 1453 2HD2 LEU 88 HD22 LEU 88 0.707 -11.301 5.142 1454 3HD2 LEU 88 HD23 LEU 88 0.054 -11.214 6.777 1455 H LYS 89 H LYS 89 -0.138 -15.524 1.881 1456 HA LYS 89 HA LYS 89 2.355 -17.042 1.723 1457 1HB LYS 89 HB2 LYS 89 -0.329 -17.317 0.324 1458 2HB LYS 89 HB3 LYS 89 1.053 -18.362 0.025 1459 1HG LYS 89 HG2 LYS 89 -0.485 -19.412 1.562 1460 2HG LYS 89 HG3 LYS 89 1.093 -19.154 2.318 1461 1HD LYS 89 HD2 LYS 89 0.254 -17.342 3.667 1462 2HD LYS 89 HD3 LYS 89 -1.254 -17.259 2.732 1463 1HE LYS 89 HE2 LYS 89 -1.899 -19.492 3.573 1464 2HE LYS 89 HE3 LYS 89 -0.387 -19.582 4.502 1465 1HZ LYS 89 HZ1 LYS 89 -1.090 -17.665 5.723 1466 2HZ LYS 89 HZ2 LYS 89 -2.471 -17.539 4.837 1467 3HZ LYS 89 HZ3 LYS 89 -2.241 -18.842 5.824 1468 H GLY 90 H GLY 90 1.102 -14.250 0.069 1469 1HA GLY 90 HA2 GLY 90 2.301 -14.673 -2.518 1470 2HA GLY 90 HA3 GLY 90 1.796 -13.137 -1.794 Start of MODEL 20 1 1H MET 1 H1 MET 1 -14.439 1.521 -6.748 2 2H MET 1 H2 MET 1 -13.054 1.775 -5.872 3 3H MET 1 H3 MET 1 -14.378 1.098 -5.153 4 HA MET 1 HA MET 1 -14.187 -0.861 -6.337 5 1HB MET 1 HB2 MET 1 -11.975 0.532 -7.916 6 2HB MET 1 HB3 MET 1 -12.386 -1.187 -8.018 7 1HG MET 1 HG2 MET 1 -13.458 -0.177 -9.853 8 2HG MET 1 HG3 MET 1 -14.733 -0.519 -8.678 9 1HE MET 1 HE1 MET 1 -15.223 1.269 -11.195 10 2HE MET 1 HE2 MET 1 -16.450 0.982 -9.932 11 3HE MET 1 HE3 MET 1 -16.105 2.639 -10.481 12 H ALA 2 H ALA 2 -12.942 -2.539 -5.519 13 HA ALA 2 HA ALA 2 -11.336 -1.803 -3.231 14 1HB ALA 2 HB1 ALA 2 -11.401 -4.181 -2.725 15 2HB ALA 2 HB2 ALA 2 -13.011 -3.635 -3.226 16 3HB ALA 2 HB3 ALA 2 -11.997 -4.555 -4.357 17 H SER 3 H SER 3 -10.714 -3.344 -6.397 18 HA SER 3 HA SER 3 -8.415 -4.565 -6.091 19 1HB SER 3 HB2 SER 3 -8.600 -2.988 -8.617 20 2HB SER 3 HB3 SER 3 -8.374 -4.711 -8.335 21 HG SER 3 HG SER 3 -10.484 -4.271 -9.123 22 HA PRO 4 HA PRO 4 -5.729 -0.528 -6.908 23 1HB PRO 4 HB2 PRO 4 -7.570 1.384 -5.462 24 2HB PRO 4 HB3 PRO 4 -6.401 1.723 -6.772 25 1HG PRO 4 HG2 PRO 4 -9.024 1.509 -7.366 26 2HG PRO 4 HG3 PRO 4 -7.829 0.654 -8.395 27 1HD PRO 4 HD2 PRO 4 -9.429 -0.455 -6.086 28 2HD PRO 4 HD3 PRO 4 -9.299 -1.112 -7.734 29 H LEU 5 H LEU 5 -7.799 -0.696 -3.919 30 HA LEU 5 HA LEU 5 -5.511 -0.052 -2.246 31 1HB LEU 5 HB2 LEU 5 -7.768 0.543 -1.505 32 2HB LEU 5 HB3 LEU 5 -8.243 -1.163 -1.507 33 HG LEU 5 HG LEU 5 -6.590 -1.666 0.259 34 1HD1 LEU 5 HD11 LEU 5 -4.819 0.001 -0.182 35 2HD1 LEU 5 HD12 LEU 5 -5.949 1.326 0.184 36 3HD1 LEU 5 HD13 LEU 5 -5.451 0.183 1.450 37 1HD2 LEU 5 HD21 LEU 5 -8.245 0.764 0.979 38 2HD2 LEU 5 HD22 LEU 5 -8.858 -0.913 0.893 39 3HD2 LEU 5 HD23 LEU 5 -7.610 -0.483 2.085 40 H ASP 6 H ASP 6 -7.358 -2.969 -3.152 41 HA ASP 6 HA ASP 6 -6.085 -4.836 -1.487 42 1HB ASP 6 HB2 ASP 6 -7.038 -5.307 -4.346 43 2HB ASP 6 HB3 ASP 6 -6.725 -6.551 -3.135 44 H GLN 7 H GLN 7 -5.089 -3.839 -4.816 45 HA GLN 7 HA GLN 7 -2.754 -5.484 -4.803 46 1HB GLN 7 HB2 GLN 7 -1.983 -4.254 -6.701 47 2HB GLN 7 HB3 GLN 7 -3.706 -4.609 -6.863 48 1HG GLN 7 HG2 GLN 7 -4.224 -2.280 -6.164 49 2HG GLN 7 HG3 GLN 7 -2.510 -1.892 -6.098 50 1HE2 GLN 7 HE22 GLN 7 -1.284 -2.478 -8.249 51 2HE2 GLN 7 HE21 GLN 7 -2.153 -2.061 -9.716 52 H ALA 8 H ALA 8 -3.293 -2.118 -3.637 53 HA ALA 8 HA ALA 8 -0.540 -1.567 -3.167 54 1HB ALA 8 HB1 ALA 8 -2.085 0.195 -3.234 55 2HB ALA 8 HB2 ALA 8 -3.019 -0.426 -1.850 56 3HB ALA 8 HB3 ALA 8 -1.360 0.162 -1.617 57 H ILE 9 H ILE 9 -3.082 -2.748 -0.838 58 HA ILE 9 HA ILE 9 -1.192 -3.136 1.287 59 HB ILE 9 HB ILE 9 -2.870 -4.455 2.408 60 1HG1 ILE 9 HG12 ILE 9 -4.569 -4.285 -0.059 61 2HG1 ILE 9 HG13 ILE 9 -3.803 -5.759 0.555 62 1HG2 ILE 9 HG21 ILE 9 -4.466 -2.689 2.693 63 2HG2 ILE 9 HG22 ILE 9 -2.902 -1.961 2.346 64 3HG2 ILE 9 HG23 ILE 9 -4.134 -2.052 1.071 65 1HD1 ILE 9 HD11 ILE 9 -5.994 -4.151 1.936 66 2HD1 ILE 9 HD12 ILE 9 -6.085 -5.788 1.279 67 3HD1 ILE 9 HD13 ILE 9 -5.090 -5.469 2.712 68 H GLY 10 H GLY 10 -2.378 -5.274 -1.292 69 1HA GLY 10 HA2 GLY 10 -0.988 -7.636 -0.929 70 2HA GLY 10 HA3 GLY 10 -1.335 -6.872 -2.484 71 H LEU 11 H LEU 11 0.266 -4.557 -2.327 72 HA LEU 11 HA LEU 11 2.753 -5.563 -3.162 73 1HB LEU 11 HB2 LEU 11 1.517 -3.289 -3.634 74 2HB LEU 11 HB3 LEU 11 2.312 -2.723 -2.174 75 HG LEU 11 HG LEU 11 3.562 -1.987 -4.027 76 1HD1 LEU 11 HD11 LEU 11 5.734 -2.757 -3.604 77 2HD1 LEU 11 HD12 LEU 11 4.845 -2.835 -2.071 78 3HD1 LEU 11 HD13 LEU 11 5.169 -4.325 -3.006 79 1HD2 LEU 11 HD21 LEU 11 3.717 -4.834 -5.072 80 2HD2 LEU 11 HD22 LEU 11 2.658 -3.541 -5.686 81 3HD2 LEU 11 HD23 LEU 11 4.413 -3.381 -5.807 82 H LEU 12 H LEU 12 2.002 -3.672 -0.208 83 HA LEU 12 HA LEU 12 4.484 -3.878 1.131 84 1HB LEU 12 HB2 LEU 12 1.595 -3.721 2.128 85 2HB LEU 12 HB3 LEU 12 2.969 -3.811 3.221 86 HG LEU 12 HG LEU 12 3.940 -1.776 2.215 87 1HD1 LEU 12 HD11 LEU 12 2.440 -0.250 0.928 88 2HD1 LEU 12 HD12 LEU 12 2.821 -1.705 0.012 89 3HD1 LEU 12 HD13 LEU 12 1.238 -1.545 0.821 90 1HD2 LEU 12 HD21 LEU 12 2.695 -1.615 4.286 91 2HD2 LEU 12 HD22 LEU 12 2.318 -0.210 3.297 92 3HD2 LEU 12 HD23 LEU 12 1.150 -1.540 3.405 93 H ILE 13 H ILE 13 1.662 -6.100 1.195 94 HA ILE 13 HA ILE 13 2.818 -7.986 2.983 95 HB ILE 13 HB ILE 13 0.719 -8.257 0.781 96 1HG1 ILE 13 HG12 ILE 13 0.292 -8.277 3.790 97 2HG1 ILE 13 HG13 ILE 13 0.341 -6.766 2.891 98 1HG2 ILE 13 HG21 ILE 13 1.461 -10.286 2.907 99 2HG2 ILE 13 HG22 ILE 13 -0.001 -10.358 1.904 100 3HG2 ILE 13 HG23 ILE 13 1.585 -10.502 1.150 101 1HD1 ILE 13 HD11 ILE 13 -1.935 -7.263 2.984 102 2HD1 ILE 13 HD12 ILE 13 -1.483 -7.776 1.363 103 3HD1 ILE 13 HD13 ILE 13 -1.695 -8.988 2.645 104 H GLY 14 H GLY 14 2.796 -7.975 -0.601 105 1HA GLY 14 HA2 GLY 14 4.223 -10.335 -1.061 106 2HA GLY 14 HA3 GLY 14 4.219 -8.909 -2.118 107 H ILE 15 H ILE 15 5.496 -6.959 -0.756 108 HA ILE 15 HA ILE 15 8.252 -7.599 -0.984 109 HB ILE 15 HB ILE 15 6.627 -5.329 0.142 110 1HG1 ILE 15 HG12 ILE 15 8.895 -5.522 -1.894 111 2HG1 ILE 15 HG13 ILE 15 7.169 -5.610 -2.283 112 1HG2 ILE 15 HG21 ILE 15 9.614 -5.629 0.606 113 2HG2 ILE 15 HG22 ILE 15 8.688 -4.122 0.812 114 3HG2 ILE 15 HG23 ILE 15 8.311 -5.506 1.822 115 1HD1 ILE 15 HD11 ILE 15 8.700 -3.198 -1.236 116 2HD1 ILE 15 HD12 ILE 15 7.852 -3.375 -2.775 117 3HD1 ILE 15 HD13 ILE 15 6.928 -3.282 -1.266 118 H PHE 16 H PHE 16 6.240 -7.219 1.972 119 HA PHE 16 HA PHE 16 8.230 -7.845 3.808 120 1HB PHE 16 HB2 PHE 16 5.927 -6.990 4.291 121 2HB PHE 16 HB3 PHE 16 5.267 -8.582 3.974 122 HD1 PHE 16 HD1 PHE 16 7.321 -6.560 6.280 123 HD2 PHE 16 HD2 PHE 16 5.737 -10.489 5.555 124 HE1 PHE 16 HE1 PHE 16 7.540 -7.101 8.701 125 HE2 PHE 16 HE2 PHE 16 6.066 -11.063 7.918 126 HZ PHE 16 HZ PHE 16 6.848 -9.304 9.525 127 H HIS 17 H HIS 17 5.916 -10.130 2.278 128 HA HIS 17 HA HIS 17 7.014 -12.365 3.720 129 1HB HIS 17 HB2 HIS 17 4.885 -12.050 1.607 130 2HB HIS 17 HB3 HIS 17 5.508 -13.650 2.027 131 HD1 HIS 17 HD1 HIS 17 5.141 -14.541 4.503 132 HD2 HIS 17 HD2 HIS 17 3.635 -10.699 3.722 133 HE1 HIS 17 HE1 HIS 17 3.876 -13.812 6.585 134 H LYS 18 H LYS 18 7.821 -10.977 0.553 135 HA LYS 18 HA LYS 18 9.366 -13.255 -0.347 136 1HB LYS 18 HB2 LYS 18 9.655 -10.259 -0.778 137 2HB LYS 18 HB3 LYS 18 10.737 -11.446 -1.521 138 1HG LYS 18 HG2 LYS 18 8.964 -12.478 -2.748 139 2HG LYS 18 HG3 LYS 18 7.718 -11.592 -1.862 140 1HD LYS 18 HD2 LYS 18 8.664 -9.433 -2.748 141 2HD LYS 18 HD3 LYS 18 9.788 -10.366 -3.749 142 1HE LYS 18 HE2 LYS 18 6.730 -10.467 -3.868 143 2HE LYS 18 HE3 LYS 18 7.783 -9.618 -5.011 144 1HZ LYS 18 HZ1 LYS 18 7.740 -12.519 -4.556 145 2HZ LYS 18 HZ2 LYS 18 7.120 -11.729 -5.860 146 3HZ LYS 18 HZ3 LYS 18 8.747 -11.731 -5.596 147 H TYR 19 H TYR 19 10.253 -10.331 1.539 148 HA TYR 19 HA TYR 19 12.916 -11.214 2.070 149 1HB TYR 19 HB2 TYR 19 11.127 -9.071 3.189 150 2HB TYR 19 HB3 TYR 19 12.663 -9.437 3.970 151 HD1 TYR 19 HD1 TYR 19 11.154 -7.947 0.944 152 HD2 TYR 19 HD2 TYR 19 14.818 -9.060 2.895 153 HE1 TYR 19 HE1 TYR 19 12.426 -7.217 -1.036 154 HE2 TYR 19 HE2 TYR 19 16.082 -8.459 0.861 155 HH TYR 19 HH TYR 19 15.944 -7.868 -1.317 156 H SER 20 H SER 20 9.969 -11.505 4.102 157 HA SER 20 HA SER 20 11.286 -12.820 6.264 158 1HB SER 20 HB2 SER 20 8.407 -13.345 5.429 159 2HB SER 20 HB3 SER 20 9.138 -13.444 7.035 160 HG SER 20 HG SER 20 8.753 -11.070 5.516 161 H GLY 21 H GLY 21 9.563 -14.181 3.421 162 1HA GLY 21 HA2 GLY 21 9.882 -16.894 3.813 163 2HA GLY 21 HA3 GLY 21 9.870 -16.084 2.234 164 H LYS 22 H LYS 22 12.228 -14.609 2.283 165 HA LYS 22 HA LYS 22 14.164 -16.418 1.511 166 1HB LYS 22 HB2 LYS 22 14.091 -13.972 1.078 167 2HB LYS 22 HB3 LYS 22 14.751 -13.687 2.706 168 1HG LYS 22 HG2 LYS 22 16.740 -15.102 2.077 169 2HG LYS 22 HG3 LYS 22 16.080 -15.251 0.446 170 1HD LYS 22 HD2 LYS 22 17.011 -12.684 1.838 171 2HD LYS 22 HD3 LYS 22 17.844 -13.569 0.566 172 1HE LYS 22 HE2 LYS 22 16.876 -11.886 -0.669 173 2HE LYS 22 HE3 LYS 22 15.643 -13.144 -0.846 174 1HZ LYS 22 HZ1 LYS 22 14.455 -12.061 0.962 175 2HZ LYS 22 HZ2 LYS 22 15.641 -10.932 1.097 176 3HZ LYS 22 HZ3 LYS 22 14.724 -11.002 -0.272 177 H GLU 23 H GLU 23 13.511 -15.379 4.863 178 HA GLU 23 HA GLU 23 15.696 -17.219 5.771 179 1HB GLU 23 HB2 GLU 23 15.773 -15.797 7.865 180 2HB GLU 23 HB3 GLU 23 16.521 -15.210 6.385 181 1HG GLU 23 HG2 GLU 23 15.583 -13.344 7.274 182 2HG GLU 23 HG3 GLU 23 14.457 -13.763 5.986 183 H GLY 24 H GLY 24 12.760 -17.639 5.087 184 1HA GLY 24 HA2 GLY 24 11.527 -19.435 5.754 185 2HA GLY 24 HA3 GLY 24 12.494 -19.593 7.220 186 H ASP 25 H ASP 25 11.783 -16.581 7.887 187 HA ASP 25 HA ASP 25 9.600 -17.358 9.596 188 1HB ASP 25 HB2 ASP 25 10.675 -14.583 8.954 189 2HB ASP 25 HB3 ASP 25 9.499 -14.957 10.208 190 H LYS 26 H LYS 26 7.462 -16.647 9.639 191 HA LYS 26 HA LYS 26 6.270 -16.001 6.977 192 1HB LYS 26 HB2 LYS 26 5.169 -17.263 9.510 193 2HB LYS 26 HB3 LYS 26 4.125 -16.591 8.250 194 1HG LYS 26 HG2 LYS 26 4.365 -18.983 7.976 195 2HG LYS 26 HG3 LYS 26 4.994 -18.103 6.576 196 1HD LYS 26 HD2 LYS 26 7.284 -18.477 7.285 197 2HD LYS 26 HD3 LYS 26 6.753 -19.187 8.828 198 1HE LYS 26 HE2 LYS 26 5.707 -21.061 7.515 199 2HE LYS 26 HE3 LYS 26 6.297 -20.299 6.022 200 1HZ LYS 26 HZ1 LYS 26 7.928 -21.340 8.226 201 2HZ LYS 26 HZ2 LYS 26 7.822 -21.943 6.694 202 3HZ LYS 26 HZ3 LYS 26 8.533 -20.473 6.970 203 H HIS 27 H HIS 27 4.746 -15.221 10.047 204 HA HIS 27 HA HIS 27 4.143 -12.603 9.002 205 1HB HIS 27 HB2 HIS 27 3.544 -13.662 11.777 206 2HB HIS 27 HB3 HIS 27 2.668 -12.416 10.880 207 HD1 HIS 27 HD1 HIS 27 1.721 -15.503 12.013 208 HD2 HIS 27 HD2 HIS 27 2.199 -14.002 8.113 209 HE1 HIS 27 HE1 HIS 27 0.321 -16.985 10.480 210 H THR 28 H THR 28 7.066 -12.931 9.610 211 HA THR 28 HA THR 28 7.396 -10.537 11.119 212 HB THR 28 HB THR 28 7.103 -12.075 12.993 213 HG1 THR 28 HG1 THR 28 8.679 -10.235 12.871 214 1HG2 THR 28 HG21 THR 28 8.056 -14.152 11.990 215 2HG2 THR 28 HG22 THR 28 9.677 -13.414 12.068 216 3HG2 THR 28 HG23 THR 28 8.780 -13.739 13.557 217 H LEU 29 H LEU 29 9.354 -9.601 10.768 218 HA LEU 29 HA LEU 29 11.294 -10.950 8.897 219 1HB LEU 29 HB2 LEU 29 10.616 -8.024 9.439 220 2HB LEU 29 HB3 LEU 29 12.135 -8.491 8.679 221 HG LEU 29 HG LEU 29 9.439 -9.235 7.506 222 1HD1 LEU 29 HD11 LEU 29 9.786 -7.339 5.973 223 2HD1 LEU 29 HD12 LEU 29 9.725 -6.739 7.643 224 3HD1 LEU 29 HD13 LEU 29 11.285 -6.897 6.818 225 1HD2 LEU 29 HD21 LEU 29 12.249 -9.068 6.316 226 2HD2 LEU 29 HD22 LEU 29 11.420 -10.575 6.739 227 3HD2 LEU 29 HD23 LEU 29 10.759 -9.540 5.467 228 H SER 30 H SER 30 13.399 -11.215 9.694 229 HA SER 30 HA SER 30 13.920 -10.336 12.456 230 1HB SER 30 HB2 SER 30 16.152 -11.403 12.047 231 2HB SER 30 HB3 SER 30 14.781 -12.498 11.800 232 HG SER 30 HG SER 30 15.028 -12.342 9.620 233 H LYS 31 H LYS 31 15.678 -8.898 13.022 234 HA LYS 31 HA LYS 31 15.411 -6.431 11.995 235 1HB LYS 31 HB2 LYS 31 17.559 -5.902 13.152 236 2HB LYS 31 HB3 LYS 31 16.348 -6.750 14.114 237 1HG LYS 31 HG2 LYS 31 17.641 -8.854 13.894 238 2HG LYS 31 HG3 LYS 31 18.858 -8.000 12.911 239 1HD LYS 31 HD2 LYS 31 19.220 -6.397 14.779 240 2HD LYS 31 HD3 LYS 31 18.113 -7.332 15.784 241 1HE LYS 31 HE2 LYS 31 20.692 -8.399 14.518 242 2HE LYS 31 HE3 LYS 31 20.540 -7.845 16.192 243 1HZ LYS 31 HZ1 LYS 31 20.379 -10.221 15.964 244 2HZ LYS 31 HZ2 LYS 31 19.027 -9.582 16.633 245 3HZ LYS 31 HZ3 LYS 31 19.011 -10.077 15.057 246 H LYS 32 H LYS 32 18.044 -8.618 11.072 247 HA LYS 32 HA LYS 32 19.206 -6.588 9.297 248 1HB LYS 32 HB2 LYS 32 20.661 -7.990 10.493 249 2HB LYS 32 HB3 LYS 32 19.974 -9.474 9.778 250 1HG LYS 32 HG2 LYS 32 20.753 -8.752 7.540 251 2HG LYS 32 HG3 LYS 32 21.389 -7.250 8.219 252 1HD LYS 32 HD2 LYS 32 22.320 -10.069 8.963 253 2HD LYS 32 HD3 LYS 32 23.103 -9.016 7.777 254 1HE LYS 32 HE2 LYS 32 23.474 -7.301 9.584 255 2HE LYS 32 HE3 LYS 32 22.838 -8.459 10.769 256 1HZ LYS 32 HZ1 LYS 32 24.577 -9.960 10.153 257 2HZ LYS 32 HZ2 LYS 32 25.179 -8.885 9.060 258 3HZ LYS 32 HZ3 LYS 32 25.197 -8.524 10.667 259 H GLU 33 H GLU 33 16.881 -9.231 8.955 260 HA GLU 33 HA GLU 33 17.044 -9.327 6.068 261 1HB GLU 33 HB2 GLU 33 16.039 -11.107 7.584 262 2HB GLU 33 HB3 GLU 33 14.660 -10.025 7.824 263 1HG GLU 33 HG2 GLU 33 14.069 -11.529 6.061 264 2HG GLU 33 HG3 GLU 33 14.349 -9.960 5.321 265 H LEU 34 H LEU 34 15.136 -7.502 8.501 266 HA LEU 34 HA LEU 34 13.633 -5.949 6.660 267 1HB LEU 34 HB2 LEU 34 13.060 -5.929 8.957 268 2HB LEU 34 HB3 LEU 34 14.631 -5.346 9.464 269 HG LEU 34 HG LEU 34 12.823 -3.691 9.573 270 1HD1 LEU 34 HD11 LEU 34 14.890 -2.617 7.647 271 2HD1 LEU 34 HD12 LEU 34 14.107 -1.830 9.004 272 3HD1 LEU 34 HD13 LEU 34 15.305 -3.091 9.302 273 1HD2 LEU 34 HD21 LEU 34 12.846 -3.775 6.521 274 2HD2 LEU 34 HD22 LEU 34 11.542 -4.324 7.587 275 3HD2 LEU 34 HD23 LEU 34 11.973 -2.610 7.497 276 H LYS 35 H LYS 35 16.909 -5.260 8.111 277 HA LYS 35 HA LYS 35 17.372 -2.922 6.595 278 1HB LYS 35 HB2 LYS 35 18.868 -3.683 8.356 279 2HB LYS 35 HB3 LYS 35 19.430 -5.031 7.342 280 1HG LYS 35 HG2 LYS 35 20.208 -3.381 5.611 281 2HG LYS 35 HG3 LYS 35 19.719 -2.057 6.678 282 1HD LYS 35 HD2 LYS 35 21.787 -4.220 7.313 283 2HD LYS 35 HD3 LYS 35 22.151 -2.597 6.709 284 1HE LYS 35 HE2 LYS 35 20.970 -1.636 8.731 285 2HE LYS 35 HE3 LYS 35 20.838 -3.279 9.377 286 1HZ LYS 35 HZ1 LYS 35 23.316 -1.842 8.756 287 2HZ LYS 35 HZ2 LYS 35 22.786 -2.324 10.239 288 3HZ LYS 35 HZ3 LYS 35 23.264 -3.449 9.140 289 H GLU 36 H GLU 36 17.959 -6.339 5.611 290 HA GLU 36 HA GLU 36 18.993 -5.829 3.053 291 1HB GLU 36 HB2 GLU 36 18.749 -8.065 4.349 292 2HB GLU 36 HB3 GLU 36 17.126 -8.151 3.647 293 1HG GLU 36 HG2 GLU 36 18.257 -7.862 1.356 294 2HG GLU 36 HG3 GLU 36 19.798 -8.087 2.193 295 H LEU 37 H LEU 37 15.575 -6.204 4.075 296 HA LEU 37 HA LEU 37 14.294 -5.858 1.581 297 1HB LEU 37 HB2 LEU 37 13.170 -6.564 3.649 298 2HB LEU 37 HB3 LEU 37 13.407 -5.003 4.385 299 HG LEU 37 HG LEU 37 11.761 -5.249 1.870 300 1HD1 LEU 37 HD11 LEU 37 9.794 -5.373 3.414 301 2HD1 LEU 37 HD12 LEU 37 10.825 -6.799 3.542 302 3HD1 LEU 37 HD13 LEU 37 10.897 -5.521 4.786 303 1HD2 LEU 37 HD21 LEU 37 11.815 -3.241 4.201 304 2HD2 LEU 37 HD22 LEU 37 12.293 -2.910 2.516 305 3HD2 LEU 37 HD23 LEU 37 10.614 -3.259 2.900 306 H ILE 38 H ILE 38 15.203 -3.363 3.980 307 HA ILE 38 HA ILE 38 14.283 -1.235 2.302 308 HB ILE 38 HB ILE 38 16.294 -1.235 4.583 309 1HG1 ILE 38 HG12 ILE 38 13.291 -0.644 4.365 310 2HG1 ILE 38 HG13 ILE 38 14.018 -2.051 5.146 311 1HG2 ILE 38 HG21 ILE 38 14.805 1.129 3.350 312 2HG2 ILE 38 HG22 ILE 38 15.935 1.180 4.715 313 3HG2 ILE 38 HG23 ILE 38 16.539 0.806 3.111 314 1HD1 ILE 38 HD11 ILE 38 15.210 -0.460 6.714 315 2HD1 ILE 38 HD12 ILE 38 14.155 0.817 6.042 316 3HD1 ILE 38 HD13 ILE 38 13.437 -0.589 6.859 317 H GLN 39 H GLN 39 17.613 -2.547 2.771 318 HA GLN 39 HA GLN 39 18.750 -0.659 0.964 319 1HB GLN 39 HB2 GLN 39 19.757 -3.348 1.964 320 2HB GLN 39 HB3 GLN 39 20.739 -2.245 0.996 321 1HG GLN 39 HG2 GLN 39 19.508 -1.508 3.694 322 2HG GLN 39 HG3 GLN 39 21.160 -2.093 3.457 323 1HE2 GLN 39 HE21 GLN 39 21.211 0.217 4.731 324 2HE2 GLN 39 HE22 GLN 39 21.509 1.554 3.639 325 H LYS 40 H LYS 40 17.099 -3.740 0.282 326 HA LYS 40 HA LYS 40 17.987 -3.582 -2.513 327 1HB LYS 40 HB2 LYS 40 17.316 -5.698 -1.146 328 2HB LYS 40 HB3 LYS 40 15.662 -5.254 -1.557 329 1HG LYS 40 HG2 LYS 40 17.999 -5.769 -3.475 330 2HG LYS 40 HG3 LYS 40 16.731 -6.922 -3.122 331 1HD LYS 40 HD2 LYS 40 16.465 -4.329 -4.686 332 2HD LYS 40 HD3 LYS 40 16.340 -5.969 -5.285 333 1HE LYS 40 HE2 LYS 40 14.350 -4.642 -3.387 334 2HE LYS 40 HE3 LYS 40 14.124 -4.941 -5.107 335 1HZ LYS 40 HZ1 LYS 40 14.245 -7.281 -4.658 336 2HZ LYS 40 HZ2 LYS 40 14.490 -7.001 -3.047 337 3HZ LYS 40 HZ3 LYS 40 13.067 -6.562 -3.745 338 H GLU 41 H GLU 41 14.854 -3.058 -0.799 339 HA GLU 41 HA GLU 41 13.534 -2.211 -3.198 340 1HB GLU 41 HB2 GLU 41 12.849 -1.718 -0.271 341 2HB GLU 41 HB3 GLU 41 11.761 -1.420 -1.632 342 1HG GLU 41 HG2 GLU 41 12.918 -4.159 -0.879 343 2HG GLU 41 HG3 GLU 41 11.327 -3.559 -0.414 344 H LEU 42 H LEU 42 14.696 -0.351 -0.390 345 HA LEU 42 HA LEU 42 14.394 2.243 -1.853 346 1HB LEU 42 HB2 LEU 42 14.893 1.585 1.078 347 2HB LEU 42 HB3 LEU 42 14.892 3.208 0.407 348 HG LEU 42 HG LEU 42 12.886 2.763 1.631 349 1HD1 LEU 42 HD11 LEU 42 12.267 3.035 -1.326 350 2HD1 LEU 42 HD12 LEU 42 11.255 3.574 0.023 351 3HD1 LEU 42 HD13 LEU 42 12.826 4.347 -0.267 352 1HD2 LEU 42 HD21 LEU 42 11.187 1.220 1.040 353 2HD2 LEU 42 HD22 LEU 42 12.025 0.718 -0.432 354 3HD2 LEU 42 HD23 LEU 42 12.695 0.301 1.168 355 H THR 43 H THR 43 16.267 0.808 -3.069 356 HA THR 43 HA THR 43 18.693 0.622 -1.638 357 HB THR 43 HB THR 43 18.010 -0.650 -3.735 358 HG1 THR 43 HG1 THR 43 19.855 -1.026 -2.729 359 1HG2 THR 43 HG21 THR 43 18.848 0.060 -5.855 360 2HG2 THR 43 HG22 THR 43 17.743 1.318 -5.265 361 3HG2 THR 43 HG23 THR 43 19.507 1.559 -5.183 362 H ILE 44 H ILE 44 19.987 2.105 -0.916 363 HA ILE 44 HA ILE 44 19.553 4.856 -1.652 364 HB ILE 44 HB ILE 44 21.608 3.736 0.289 365 1HG1 ILE 44 HG12 ILE 44 18.643 4.340 0.718 366 2HG1 ILE 44 HG13 ILE 44 19.433 2.762 0.859 367 1HG2 ILE 44 HG21 ILE 44 20.130 6.410 0.185 368 2HG2 ILE 44 HG22 ILE 44 21.360 5.930 1.370 369 3HG2 ILE 44 HG23 ILE 44 21.820 6.163 -0.299 370 1HD1 ILE 44 HD11 ILE 44 19.748 5.097 2.738 371 2HD1 ILE 44 HD12 ILE 44 19.092 3.483 3.031 372 3HD1 ILE 44 HD13 ILE 44 20.832 3.675 2.736 373 H GLY 45 H GLY 45 22.053 2.476 -2.336 374 1HA GLY 45 HA2 GLY 45 23.924 2.581 -3.701 375 2HA GLY 45 HA3 GLY 45 23.485 4.224 -4.195 376 H SER 46 H SER 46 23.523 5.775 -2.110 377 HA SER 46 HA SER 46 26.233 5.812 -1.007 378 1HB SER 46 HB2 SER 46 23.797 7.524 -0.355 379 2HB SER 46 HB3 SER 46 25.462 7.826 0.162 380 HG SER 46 HG SER 46 24.615 7.623 -2.551 381 H LYS 47 H LYS 47 25.873 3.523 -0.187 382 HA LYS 47 HA LYS 47 24.153 2.875 1.910 383 1HB LYS 47 HB2 LYS 47 26.964 1.784 1.488 384 2HB LYS 47 HB3 LYS 47 25.666 1.024 2.414 385 1HG LYS 47 HG2 LYS 47 25.786 1.415 -0.603 386 2HG LYS 47 HG3 LYS 47 25.791 -0.084 0.319 387 1HD LYS 47 HD2 LYS 47 23.462 0.523 1.162 388 2HD LYS 47 HD3 LYS 47 23.461 1.857 -0.012 389 1HE LYS 47 HE2 LYS 47 23.839 0.188 -1.852 390 2HE LYS 47 HE3 LYS 47 23.734 -1.110 -0.646 391 1HZ LYS 47 HZ1 LYS 47 21.645 -0.829 -1.665 392 2HZ LYS 47 HZ2 LYS 47 21.513 -0.273 -0.112 393 3HZ LYS 47 HZ3 LYS 47 21.616 0.785 -1.365 394 H LEU 48 H LEU 48 26.800 5.042 2.174 395 HA LEU 48 HA LEU 48 27.490 4.968 4.881 396 1HB LEU 48 HB2 LEU 48 26.792 7.416 3.205 397 2HB LEU 48 HB3 LEU 48 27.751 7.416 4.687 398 HG LEU 48 HG LEU 48 28.554 6.097 2.047 399 1HD1 LEU 48 HD11 LEU 48 30.222 7.891 1.945 400 2HD1 LEU 48 HD12 LEU 48 28.582 8.563 1.993 401 3HD1 LEU 48 HD13 LEU 48 29.595 8.588 3.453 402 1HD2 LEU 48 HD21 LEU 48 30.781 5.842 3.155 403 2HD2 LEU 48 HD22 LEU 48 30.056 6.355 4.693 404 3HD2 LEU 48 HD23 LEU 48 29.539 4.843 3.912 405 H GLN 49 H GLN 49 24.456 6.052 3.403 406 HA GLN 49 HA GLN 49 23.405 7.277 5.781 407 1HB GLN 49 HB2 GLN 49 21.839 6.014 3.517 408 2HB GLN 49 HB3 GLN 49 21.249 7.222 4.649 409 1HG GLN 49 HG2 GLN 49 23.188 7.596 2.351 410 2HG GLN 49 HG3 GLN 49 21.666 8.417 2.655 411 1HE2 GLN 49 HE22 GLN 49 21.894 9.358 5.245 412 2HE2 GLN 49 HE21 GLN 49 23.262 10.459 5.321 413 H ASP 50 H ASP 50 24.010 3.962 5.238 414 HA ASP 50 HA ASP 50 21.806 2.701 6.305 415 1HB ASP 50 HB2 ASP 50 23.735 1.560 5.280 416 2HB ASP 50 HB3 ASP 50 24.675 1.858 6.755 417 H ALA 51 H ALA 51 24.172 4.664 8.019 418 HA ALA 51 HA ALA 51 23.729 3.929 10.702 419 1HB ALA 51 HB1 ALA 51 24.259 6.286 11.211 420 2HB ALA 51 HB2 ALA 51 25.368 5.611 9.999 421 3HB ALA 51 HB3 ALA 51 24.065 6.708 9.496 422 H GLU 52 H GLU 52 21.703 6.140 8.638 423 HA GLU 52 HA GLU 52 19.772 6.575 10.768 424 1HB GLU 52 HB2 GLU 52 19.314 6.796 7.759 425 2HB GLU 52 HB3 GLU 52 18.297 7.418 9.062 426 1HG GLU 52 HG2 GLU 52 19.434 9.340 8.582 427 2HG GLU 52 HG3 GLU 52 20.550 8.687 9.788 428 H ILE 53 H ILE 53 20.141 4.273 8.090 429 HA ILE 53 HA ILE 53 17.598 3.049 8.345 430 HB ILE 53 HB ILE 53 20.114 1.707 7.356 431 1HG1 ILE 53 HG12 ILE 53 19.891 3.770 6.092 432 2HG1 ILE 53 HG13 ILE 53 19.339 2.431 5.095 433 1HG2 ILE 53 HG21 ILE 53 18.363 0.102 7.699 434 2HG2 ILE 53 HG22 ILE 53 17.181 1.127 6.870 435 3HG2 ILE 53 HG23 ILE 53 18.523 0.398 5.966 436 1HD1 ILE 53 HD11 ILE 53 16.971 3.088 5.648 437 2HD1 ILE 53 HD12 ILE 53 17.611 4.475 6.571 438 3HD1 ILE 53 HD13 ILE 53 17.893 4.376 4.840 439 H VAL 54 H VAL 54 20.668 2.347 10.130 440 HA VAL 54 HA VAL 54 19.432 0.125 11.454 441 HB VAL 54 HB VAL 54 21.238 0.272 13.151 442 1HG1 VAL 54 HG11 VAL 54 22.828 -0.734 11.579 443 2HG1 VAL 54 HG12 VAL 54 21.172 -1.276 11.245 444 3HG1 VAL 54 HG13 VAL 54 21.924 -0.036 10.214 445 1HG2 VAL 54 HG21 VAL 54 22.487 2.233 11.251 446 2HG2 VAL 54 HG22 VAL 54 21.896 2.629 12.888 447 3HG2 VAL 54 HG23 VAL 54 23.238 1.493 12.668 448 H LYS 55 H LYS 55 19.531 3.606 12.305 449 HA LYS 55 HA LYS 55 18.278 3.227 14.871 450 1HB LYS 55 HB2 LYS 55 19.272 5.343 14.361 451 2HB LYS 55 HB3 LYS 55 18.267 5.563 12.926 452 1HG LYS 55 HG2 LYS 55 17.550 6.955 14.837 453 2HG LYS 55 HG3 LYS 55 16.275 5.887 14.247 454 1HD LYS 55 HD2 LYS 55 16.638 4.339 16.132 455 2HD LYS 55 HD3 LYS 55 18.013 5.307 16.698 456 1HE LYS 55 HE2 LYS 55 16.545 7.168 17.226 457 2HE LYS 55 HE3 LYS 55 15.181 6.408 16.382 458 1HZ LYS 55 HZ1 LYS 55 15.046 6.154 18.749 459 2HZ LYS 55 HZ2 LYS 55 15.135 4.703 17.978 460 3HZ LYS 55 HZ3 LYS 55 16.455 5.298 18.776 461 H LEU 56 H LEU 56 16.932 3.885 11.620 462 HA LEU 56 HA LEU 56 14.185 3.667 12.236 463 1HB LEU 56 HB2 LEU 56 14.834 4.572 10.207 464 2HB LEU 56 HB3 LEU 56 15.877 3.225 9.778 465 HG LEU 56 HG LEU 56 12.970 2.574 10.078 466 1HD1 LEU 56 HD11 LEU 56 12.860 4.707 8.853 467 2HD1 LEU 56 HD12 LEU 56 14.125 4.156 7.736 468 3HD1 LEU 56 HD13 LEU 56 12.541 3.358 7.745 469 1HD2 LEU 56 HD21 LEU 56 13.464 1.139 8.222 470 2HD2 LEU 56 HD22 LEU 56 15.076 1.867 7.974 471 3HD2 LEU 56 HD23 LEU 56 14.762 0.867 9.386 472 H MET 57 H MET 57 16.503 1.082 11.350 473 HA MET 57 HA MET 57 14.670 -1.078 11.411 474 1HB MET 57 HB2 MET 57 16.769 -1.322 10.323 475 2HB MET 57 HB3 MET 57 17.652 -0.891 11.786 476 1HG MET 57 HG2 MET 57 15.928 -3.355 11.723 477 2HG MET 57 HG3 MET 57 17.574 -3.373 11.093 478 1HE MET 57 HE1 MET 57 19.267 -1.537 13.197 479 2HE MET 57 HE2 MET 57 19.781 -2.854 14.261 480 3HE MET 57 HE3 MET 57 19.757 -3.104 12.500 481 H ASP 58 H ASP 58 16.738 0.356 13.993 482 HA ASP 58 HA ASP 58 15.985 -1.408 16.061 483 1HB ASP 58 HB2 ASP 58 17.791 0.150 16.365 484 2HB ASP 58 HB3 ASP 58 16.703 1.535 16.221 485 H ASP 59 H ASP 59 14.483 1.643 14.922 486 HA ASP 59 HA ASP 59 12.362 1.615 16.810 487 1HB ASP 59 HB2 ASP 59 12.319 2.820 14.000 488 2HB ASP 59 HB3 ASP 59 11.234 3.231 15.333 489 H LEU 60 H LEU 60 12.466 0.218 13.516 490 HA LEU 60 HA LEU 60 9.803 -0.883 13.572 491 1HB LEU 60 HB2 LEU 60 12.372 -1.495 12.082 492 2HB LEU 60 HB3 LEU 60 11.030 -2.620 11.957 493 HG LEU 60 HG LEU 60 10.476 0.273 11.398 494 1HD1 LEU 60 HD11 LEU 60 11.766 -1.617 9.406 495 2HD1 LEU 60 HD12 LEU 60 11.070 -0.056 8.992 496 3HD1 LEU 60 HD13 LEU 60 12.497 -0.132 10.056 497 1HD2 LEU 60 HD21 LEU 60 8.953 -0.756 9.676 498 2HD2 LEU 60 HD22 LEU 60 9.569 -2.345 10.073 499 3HD2 LEU 60 HD23 LEU 60 8.627 -1.448 11.292 500 H ASP 61 H ASP 61 12.940 -2.472 14.357 501 HA ASP 61 HA ASP 61 11.586 -4.885 15.051 502 1HB ASP 61 HB2 ASP 61 13.621 -5.893 15.376 503 2HB ASP 61 HB3 ASP 61 13.892 -4.751 14.060 504 H ARG 62 H ARG 62 12.439 -2.137 17.003 505 HA ARG 62 HA ARG 62 12.409 -2.709 19.587 506 1HB ARG 62 HB2 ARG 62 11.932 -0.492 18.580 507 2HB ARG 62 HB3 ARG 62 10.364 -1.086 18.060 508 1HG ARG 62 HG2 ARG 62 10.084 -1.409 20.771 509 2HG ARG 62 HG3 ARG 62 11.261 -0.094 20.709 510 1HD ARG 62 HD2 ARG 62 9.160 0.983 20.678 511 2HD ARG 62 HD3 ARG 62 9.655 1.035 18.990 512 HE ARG 62 HE ARG 62 7.606 -0.698 20.297 513 1HH1 ARG 62 HH12 ARG 62 9.069 0.177 17.102 514 2HH1 ARG 62 HH11 ARG 62 7.626 -0.249 16.258 515 1HH2 ARG 62 HH22 ARG 62 5.832 -1.323 19.102 516 2HH2 ARG 62 HH21 ARG 62 5.834 -1.219 17.359 517 H ASN 63 H ASN 63 9.486 -2.962 17.608 518 HA ASN 63 HA ASN 63 7.499 -3.882 19.158 519 1HB ASN 63 HB2 ASN 63 7.176 -3.538 16.872 520 2HB ASN 63 HB3 ASN 63 8.442 -4.702 16.414 521 1HD2 ASN 63 HD21 ASN 63 5.525 -4.990 18.571 522 2HD2 ASN 63 HD22 ASN 63 4.879 -6.360 17.696 523 H LYS 64 H LYS 64 10.043 -6.054 17.913 524 HA LYS 64 HA LYS 64 9.541 -7.864 20.199 525 1HB LYS 64 HB2 LYS 64 9.563 -8.861 17.320 526 2HB LYS 64 HB3 LYS 64 9.687 -9.875 18.765 527 1HG LYS 64 HG2 LYS 64 7.480 -9.051 19.529 528 2HG LYS 64 HG3 LYS 64 7.325 -8.099 18.041 529 1HD LYS 64 HD2 LYS 64 7.524 -10.146 16.671 530 2HD LYS 64 HD3 LYS 64 7.643 -11.134 18.134 531 1HE LYS 64 HE2 LYS 64 5.261 -9.364 17.385 532 2HE LYS 64 HE3 LYS 64 5.344 -11.121 17.158 533 1HZ LYS 64 HZ1 LYS 64 4.190 -10.571 19.147 534 2HZ LYS 64 HZ2 LYS 64 5.591 -11.351 19.526 535 3HZ LYS 64 HZ3 LYS 64 5.472 -9.720 19.733 536 H ASP 65 H ASP 65 11.368 -6.020 20.138 537 HA ASP 65 HA ASP 65 13.467 -5.537 20.446 538 1HB ASP 65 HB2 ASP 65 14.917 -7.083 21.567 539 2HB ASP 65 HB3 ASP 65 13.270 -7.156 22.193 540 H GLN 66 H GLN 66 13.822 -8.538 18.594 541 HA GLN 66 HA GLN 66 15.851 -7.210 16.823 542 1HB GLN 66 HB2 GLN 66 15.739 -10.026 17.951 543 2HB GLN 66 HB3 GLN 66 16.844 -9.530 16.664 544 1HG GLN 66 HG2 GLN 66 17.980 -7.955 18.090 545 2HG GLN 66 HG3 GLN 66 16.785 -8.120 19.372 546 1HE2 GLN 66 HE22 GLN 66 16.553 -10.225 20.443 547 2HE2 GLN 66 HE21 GLN 66 17.978 -11.260 20.573 548 H GLU 67 H GLU 67 12.702 -8.339 16.904 549 HA GLU 67 HA GLU 67 12.805 -8.934 13.996 550 1HB GLU 67 HB2 GLU 67 10.988 -10.325 16.009 551 2HB GLU 67 HB3 GLU 67 11.072 -10.584 14.258 552 1HG GLU 67 HG2 GLU 67 13.487 -11.319 14.571 553 2HG GLU 67 HG3 GLU 67 13.200 -11.280 16.319 554 H VAL 68 H VAL 68 11.054 -8.270 12.846 555 HA VAL 68 HA VAL 68 9.285 -6.178 14.064 556 HB VAL 68 HB VAL 68 9.794 -6.637 11.099 557 1HG1 VAL 68 HG11 VAL 68 9.039 -4.135 12.646 558 2HG1 VAL 68 HG12 VAL 68 9.059 -4.360 10.883 559 3HG1 VAL 68 HG13 VAL 68 7.871 -5.221 11.864 560 1HG2 VAL 68 HG21 VAL 68 11.465 -4.874 11.067 561 2HG2 VAL 68 HG22 VAL 68 11.487 -4.828 12.835 562 3HG2 VAL 68 HG23 VAL 68 12.048 -6.272 11.967 563 H ASN 69 H ASN 69 7.116 -7.006 14.320 564 HA ASN 69 HA ASN 69 6.355 -9.380 12.750 565 1HB ASN 69 HB2 ASN 69 5.364 -9.305 14.924 566 2HB ASN 69 HB3 ASN 69 4.925 -7.599 14.749 567 1HD2 ASN 69 HD21 ASN 69 4.162 -10.740 12.995 568 2HD2 ASN 69 HD22 ASN 69 2.463 -10.327 12.896 569 H PHE 70 H PHE 70 4.668 -9.413 11.205 570 HA PHE 70 HA PHE 70 4.624 -7.576 9.154 571 1HB PHE 70 HB2 PHE 70 3.663 -9.787 8.996 572 2HB PHE 70 HB3 PHE 70 2.423 -9.391 10.187 573 HD1 PHE 70 HD1 PHE 70 0.360 -8.456 9.496 574 HD2 PHE 70 HD2 PHE 70 3.754 -8.332 6.837 575 HE1 PHE 70 HE1 PHE 70 -1.011 -7.320 7.801 576 HE2 PHE 70 HE2 PHE 70 2.386 -7.143 5.153 577 HZ PHE 70 HZ PHE 70 0.007 -6.609 5.634 578 H GLN 71 H GLN 71 2.279 -7.467 11.956 579 HA GLN 71 HA GLN 71 0.896 -5.253 10.768 580 1HB GLN 71 HB2 GLN 71 0.004 -6.919 12.452 581 2HB GLN 71 HB3 GLN 71 0.865 -6.012 13.710 582 1HG GLN 71 HG2 GLN 71 -0.392 -3.951 13.043 583 2HG GLN 71 HG3 GLN 71 -1.238 -4.876 11.794 584 1HE2 GLN 71 HE22 GLN 71 -2.089 -7.178 12.947 585 2HE2 GLN 71 HE21 GLN 71 -3.079 -6.818 14.349 586 H GLU 72 H GLU 72 3.616 -5.517 13.027 587 HA GLU 72 HA GLU 72 3.816 -2.731 13.716 588 1HB GLU 72 HB2 GLU 72 5.080 -4.277 15.021 589 2HB GLU 72 HB3 GLU 72 5.873 -4.969 13.607 590 1HG GLU 72 HG2 GLU 72 7.464 -3.547 14.674 591 2HG GLU 72 HG3 GLU 72 7.055 -2.814 13.160 592 H TYR 73 H TYR 73 5.292 -4.741 11.119 593 HA TYR 73 HA TYR 73 6.764 -2.696 9.860 594 1HB TYR 73 HB2 TYR 73 7.239 -4.843 9.194 595 2HB TYR 73 HB3 TYR 73 5.567 -5.300 8.963 596 HD1 TYR 73 HD1 TYR 73 8.448 -3.583 7.414 597 HD2 TYR 73 HD2 TYR 73 4.377 -4.925 6.905 598 HE1 TYR 73 HE1 TYR 73 8.710 -3.457 4.958 599 HE2 TYR 73 HE2 TYR 73 4.635 -4.754 4.453 600 HH TYR 73 HH TYR 73 7.645 -3.611 2.914 601 H ILE 74 H ILE 74 3.370 -3.730 9.138 602 HA ILE 74 HA ILE 74 2.904 -1.683 7.220 603 HB ILE 74 HB ILE 74 0.910 -2.965 9.120 604 1HG1 ILE 74 HG12 ILE 74 2.075 -4.635 7.673 605 2HG1 ILE 74 HG13 ILE 74 0.352 -4.510 7.405 606 1HG2 ILE 74 HG21 ILE 74 0.578 -1.184 6.684 607 2HG2 ILE 74 HG22 ILE 74 -0.703 -2.289 7.195 608 3HG2 ILE 74 HG23 ILE 74 -0.148 -1.027 8.295 609 1HD1 ILE 74 HD11 ILE 74 0.775 -3.137 5.358 610 2HD1 ILE 74 HD12 ILE 74 2.528 -3.364 5.639 611 3HD1 ILE 74 HD13 ILE 74 1.485 -4.744 5.278 612 H THR 75 H THR 75 2.162 -1.642 10.746 613 HA THR 75 HA THR 75 1.156 0.950 10.995 614 HB THR 75 HB THR 75 2.935 -0.669 12.873 615 HG1 THR 75 HG1 THR 75 1.066 -1.687 12.492 616 1HG2 THR 75 HG21 THR 75 1.378 1.876 13.453 617 2HG2 THR 75 HG22 THR 75 1.895 0.711 14.687 618 3HG2 THR 75 HG23 THR 75 3.099 1.561 13.710 619 H PHE 76 H PHE 76 4.570 -0.073 11.141 620 HA PHE 76 HA PHE 76 5.636 2.527 11.582 621 1HB PHE 76 HB2 PHE 76 6.826 0.440 12.140 622 2HB PHE 76 HB3 PHE 76 6.937 0.056 10.422 623 HD1 PHE 76 HD1 PHE 76 8.417 1.417 8.916 624 HD2 PHE 76 HD2 PHE 76 8.188 2.232 13.151 625 HE1 PHE 76 HE1 PHE 76 10.404 2.856 8.745 626 HE2 PHE 76 HE2 PHE 76 10.106 3.791 12.939 627 HZ PHE 76 HZ PHE 76 11.188 4.142 10.722 628 H LEU 77 H LEU 77 5.060 0.618 8.534 629 HA LEU 77 HA LEU 77 6.196 2.647 6.845 630 1HB LEU 77 HB2 LEU 77 4.062 0.551 6.343 631 2HB LEU 77 HB3 LEU 77 4.619 1.667 5.093 632 HG LEU 77 HG LEU 77 6.507 -0.173 6.642 633 1HD1 LEU 77 HD11 LEU 77 5.001 -1.569 5.349 634 2HD1 LEU 77 HD12 LEU 77 5.228 -0.545 3.902 635 3HD1 LEU 77 HD13 LEU 77 6.585 -1.476 4.551 636 1HD2 LEU 77 HD21 LEU 77 7.717 1.695 5.645 637 2HD2 LEU 77 HD22 LEU 77 7.997 0.256 4.674 638 3HD2 LEU 77 HD23 LEU 77 6.835 1.473 4.100 639 H GLY 78 H GLY 78 3.012 2.357 8.402 640 1HA GLY 78 HA2 GLY 78 1.842 4.715 7.312 641 2HA GLY 78 HA3 GLY 78 1.530 4.058 8.937 642 H ALA 79 H ALA 79 3.847 4.307 10.293 643 HA ALA 79 HA ALA 79 4.085 7.048 10.900 644 1HB ALA 79 HB1 ALA 79 6.265 4.955 11.325 645 2HB ALA 79 HB2 ALA 79 6.053 6.484 12.188 646 3HB ALA 79 HB3 ALA 79 4.860 5.189 12.386 647 H LEU 80 H LEU 80 6.010 5.084 8.648 648 HA LEU 80 HA LEU 80 7.932 7.030 7.992 649 1HB LEU 80 HB2 LEU 80 7.821 4.445 7.512 650 2HB LEU 80 HB3 LEU 80 6.946 4.915 6.056 651 HG LEU 80 HG LEU 80 8.925 6.343 5.417 652 1HD1 LEU 80 HD11 LEU 80 11.109 5.738 6.556 653 2HD1 LEU 80 HD12 LEU 80 10.040 6.693 7.584 654 3HD1 LEU 80 HD13 LEU 80 10.168 4.937 7.829 655 1HD2 LEU 80 HD21 LEU 80 9.492 3.390 5.939 656 2HD2 LEU 80 HD22 LEU 80 8.587 4.032 4.545 657 3HD2 LEU 80 HD23 LEU 80 10.309 4.404 4.735 658 H ALA 81 H ALA 81 4.786 6.212 6.510 659 HA ALA 81 HA ALA 81 4.738 8.151 4.436 660 1HB ALA 81 HB1 ALA 81 2.268 7.978 4.652 661 2HB ALA 81 HB2 ALA 81 3.094 6.404 4.533 662 3HB ALA 81 HB3 ALA 81 2.474 6.964 6.078 663 H MET 82 H MET 82 3.681 8.340 7.860 664 HA MET 82 HA MET 82 2.852 11.027 7.799 665 1HB MET 82 HB2 MET 82 2.525 9.162 9.584 666 2HB MET 82 HB3 MET 82 4.028 9.768 10.291 667 1HG MET 82 HG2 MET 82 1.519 11.406 9.726 668 2HG MET 82 HG3 MET 82 1.952 10.706 11.286 669 1HE MET 82 HE1 MET 82 2.270 14.548 11.898 670 2HE MET 82 HE2 MET 82 1.110 13.746 10.813 671 3HE MET 82 HE3 MET 82 1.479 13.037 12.407 672 H ILE 83 H ILE 83 6.044 9.629 8.504 673 HA ILE 83 HA ILE 83 7.358 12.078 9.192 674 HB ILE 83 HB ILE 83 8.344 9.349 8.321 675 1HG1 ILE 83 HG12 ILE 83 8.664 10.781 10.993 676 2HG1 ILE 83 HG13 ILE 83 7.219 9.846 10.626 677 1HG2 ILE 83 HG21 ILE 83 10.628 10.094 9.041 678 2HG2 ILE 83 HG22 ILE 83 10.078 10.914 7.590 679 3HG2 ILE 83 HG23 ILE 83 10.020 11.757 9.153 680 1HD1 ILE 83 HD11 ILE 83 8.743 8.460 11.874 681 2HD1 ILE 83 HD12 ILE 83 8.613 7.822 10.227 682 3HD1 ILE 83 HD13 ILE 83 10.054 8.739 10.721 683 H TYR 84 H TYR 84 7.101 10.297 6.062 684 HA TYR 84 HA TYR 84 8.591 12.165 4.485 685 1HB TYR 84 HB2 TYR 84 6.110 10.563 3.735 686 2HB TYR 84 HB3 TYR 84 7.191 11.376 2.609 687 HD1 TYR 84 HD1 TYR 84 9.679 10.246 4.614 688 HD2 TYR 84 HD2 TYR 84 6.494 8.612 2.190 689 HE1 TYR 84 HE1 TYR 84 11.047 8.272 4.149 690 HE2 TYR 84 HE2 TYR 84 7.900 6.618 1.730 691 HH TYR 84 HH TYR 84 11.207 6.270 3.017 692 H ASN 85 H ASN 85 5.170 12.090 5.434 693 HA ASN 85 HA ASN 85 3.771 13.673 6.022 694 1HB ASN 85 HB2 ASN 85 5.983 14.588 7.085 695 2HB ASN 85 HB3 ASN 85 5.858 15.858 5.869 696 1HD2 ASN 85 HD22 ASN 85 4.049 14.134 8.435 697 2HD2 ASN 85 HD21 ASN 85 3.049 15.512 8.906 698 H GLU 86 H GLU 86 5.836 15.226 3.533 699 HA GLU 86 HA GLU 86 3.807 16.792 2.317 700 1HB GLU 86 HB2 GLU 86 6.193 17.055 1.798 701 2HB GLU 86 HB3 GLU 86 6.249 15.442 1.068 702 1HG GLU 86 HG2 GLU 86 6.120 17.261 -0.621 703 2HG GLU 86 HG3 GLU 86 4.756 16.146 -0.738 704 H ALA 87 H ALA 87 4.747 13.408 1.874 705 HA ALA 87 HA ALA 87 3.131 12.533 -0.190 706 1HB ALA 87 HB1 ALA 87 4.743 11.132 1.045 707 2HB ALA 87 HB2 ALA 87 3.666 11.126 2.461 708 3HB ALA 87 HB3 ALA 87 3.152 10.357 0.942 709 H LEU 88 H LEU 88 2.092 13.372 3.136 710 HA LEU 88 HA LEU 88 -0.524 12.177 2.997 711 1HB LEU 88 HB2 LEU 88 0.340 14.576 4.621 712 2HB LEU 88 HB3 LEU 88 -1.009 13.497 4.947 713 HG LEU 88 HG LEU 88 1.918 12.631 5.065 714 1HD1 LEU 88 HD11 LEU 88 1.737 12.875 7.475 715 2HD1 LEU 88 HD12 LEU 88 1.298 14.413 6.733 716 3HD1 LEU 88 HD13 LEU 88 0.034 13.330 7.353 717 1HD2 LEU 88 HD21 LEU 88 0.289 10.770 4.683 718 2HD2 LEU 88 HD22 LEU 88 1.099 10.684 6.250 719 3HD2 LEU 88 HD23 LEU 88 -0.567 11.270 6.164 720 H LYS 89 H LYS 89 0.878 15.194 1.869 721 HA LYS 89 HA LYS 89 -1.726 16.524 1.499 722 1HB LYS 89 HB2 LYS 89 1.054 17.529 0.788 723 2HB LYS 89 HB3 LYS 89 -0.424 18.471 1.021 724 1HG LYS 89 HG2 LYS 89 -0.420 17.796 3.443 725 2HG LYS 89 HG3 LYS 89 1.084 16.900 3.165 726 1HD LYS 89 HD2 LYS 89 2.146 19.067 2.359 727 2HD LYS 89 HD3 LYS 89 0.680 19.900 2.901 728 1HE LYS 89 HE2 LYS 89 2.333 20.051 4.671 729 2HE LYS 89 HE3 LYS 89 1.064 18.941 5.217 730 1HZ LYS 89 HZ1 LYS 89 3.679 18.193 4.098 731 2HZ LYS 89 HZ2 LYS 89 3.228 18.065 5.678 732 3HZ LYS 89 HZ3 LYS 89 2.513 17.120 4.547 733 H GLY 90 H GLY 90 1.115 15.409 -0.390 734 1HA GLY 90 HA2 GLY 90 -0.128 14.257 -2.545 735 2HA GLY 90 HA3 GLY 90 -0.078 15.981 -2.974 736 1H MET 1 H1 MET 1 12.454 -3.310 -6.176 737 2H MET 1 H2 MET 1 10.939 -2.649 -6.240 738 3H MET 1 H3 MET 1 11.647 -2.892 -4.785 739 HA MET 1 HA MET 1 13.373 -1.321 -5.346 740 1HB MET 1 HB2 MET 1 13.171 -1.637 -7.772 741 2HB MET 1 HB3 MET 1 11.595 -0.838 -7.774 742 1HG MET 1 HG2 MET 1 12.618 1.280 -7.160 743 2HG MET 1 HG3 MET 1 14.187 0.491 -6.882 744 1HE MET 1 HE1 MET 1 15.283 2.427 -8.310 745 2HE MET 1 HE2 MET 1 14.773 2.833 -9.967 746 3HE MET 1 HE3 MET 1 13.677 3.147 -8.601 747 H ALA 2 H ALA 2 13.050 0.938 -4.732 748 HA ALA 2 HA ALA 2 11.170 1.661 -2.973 749 1HB ALA 2 HB1 ALA 2 11.669 4.010 -3.522 750 2HB ALA 2 HB2 ALA 2 13.142 3.034 -3.641 751 3HB ALA 2 HB3 ALA 2 12.298 3.536 -5.112 752 H SER 3 H SER 3 10.807 2.536 -6.461 753 HA SER 3 HA SER 3 8.546 3.886 -6.393 754 1HB SER 3 HB2 SER 3 9.181 1.981 -8.666 755 2HB SER 3 HB3 SER 3 8.399 3.567 -8.731 756 HG SER 3 HG SER 3 10.377 4.460 -7.999 757 HA PRO 4 HA PRO 4 5.495 0.158 -6.997 758 1HB PRO 4 HB2 PRO 4 6.380 -2.255 -5.857 759 2HB PRO 4 HB3 PRO 4 6.195 -1.853 -7.586 760 1HG PRO 4 HG2 PRO 4 8.633 -1.770 -5.862 761 2HG PRO 4 HG3 PRO 4 8.515 -2.286 -7.563 762 1HD PRO 4 HD2 PRO 4 9.498 0.159 -7.001 763 2HD PRO 4 HD3 PRO 4 8.354 -0.069 -8.347 764 H LEU 5 H LEU 5 7.700 0.079 -4.089 765 HA LEU 5 HA LEU 5 5.458 -0.359 -2.329 766 1HB LEU 5 HB2 LEU 5 7.727 -0.917 -1.594 767 2HB LEU 5 HB3 LEU 5 8.204 0.783 -1.699 768 HG LEU 5 HG LEU 5 6.565 1.390 0.054 769 1HD1 LEU 5 HD11 LEU 5 4.796 -0.293 -0.253 770 2HD1 LEU 5 HD12 LEU 5 5.935 -1.602 0.153 771 3HD1 LEU 5 HD13 LEU 5 5.463 -0.401 1.371 772 1HD2 LEU 5 HD21 LEU 5 8.836 0.708 0.712 773 2HD2 LEU 5 HD22 LEU 5 7.604 0.347 1.941 774 3HD2 LEU 5 HD23 LEU 5 8.248 -0.968 0.921 775 H ASP 6 H ASP 6 7.289 2.516 -3.378 776 HA ASP 6 HA ASP 6 6.064 4.458 -1.765 777 1HB ASP 6 HB2 ASP 6 7.011 4.805 -4.647 778 2HB ASP 6 HB3 ASP 6 6.710 6.098 -3.486 779 H GLN 7 H GLN 7 5.054 3.355 -5.055 780 HA GLN 7 HA GLN 7 2.710 5.002 -5.072 781 1HB GLN 7 HB2 GLN 7 1.873 3.640 -6.880 782 2HB GLN 7 HB3 GLN 7 3.564 4.091 -7.130 783 1HG GLN 7 HG2 GLN 7 4.275 1.864 -6.393 784 2HG GLN 7 HG3 GLN 7 2.612 1.337 -6.168 785 1HE2 GLN 7 HE22 GLN 7 1.166 1.694 -8.227 786 2HE2 GLN 7 HE21 GLN 7 1.942 1.274 -9.745 787 H ALA 8 H ALA 8 3.241 1.667 -3.797 788 HA ALA 8 HA ALA 8 0.495 1.163 -3.267 789 1HB ALA 8 HB1 ALA 8 2.041 -0.605 -3.298 790 2HB ALA 8 HB2 ALA 8 2.971 0.047 -1.926 791 3HB ALA 8 HB3 ALA 8 1.309 -0.526 -1.685 792 H ILE 9 H ILE 9 3.059 2.419 -1.000 793 HA ILE 9 HA ILE 9 1.178 2.901 1.118 794 HB ILE 9 HB ILE 9 2.865 4.324 2.146 795 1HG1 ILE 9 HG12 ILE 9 4.507 3.932 -0.337 796 2HG1 ILE 9 HG13 ILE 9 3.824 5.464 0.235 797 1HG2 ILE 9 HG21 ILE 9 2.837 1.861 2.348 798 2HG2 ILE 9 HG22 ILE 9 4.044 1.766 1.045 799 3HG2 ILE 9 HG23 ILE 9 4.430 2.562 2.586 800 1HD1 ILE 9 HD11 ILE 9 5.193 5.238 2.334 801 2HD1 ILE 9 HD12 ILE 9 6.000 3.831 1.600 802 3HD1 ILE 9 HD13 ILE 9 6.129 5.416 0.837 803 H GLY 10 H GLY 10 2.366 4.951 -1.545 804 1HA GLY 10 HA2 GLY 10 0.992 7.327 -1.282 805 2HA GLY 10 HA3 GLY 10 1.282 6.480 -2.802 806 H LEU 11 H LEU 11 -0.297 4.232 -2.589 807 HA LEU 11 HA LEU 11 -2.790 5.168 -3.388 808 1HB LEU 11 HB2 LEU 11 -1.555 2.872 -3.739 809 2HB LEU 11 HB3 LEU 11 -2.336 2.389 -2.242 810 HG LEU 11 HG LEU 11 -3.584 1.534 -4.036 811 1HD1 LEU 11 HD11 LEU 11 -5.198 3.901 -3.125 812 2HD1 LEU 11 HD12 LEU 11 -5.756 2.308 -3.669 813 3HD1 LEU 11 HD13 LEU 11 -4.863 2.447 -2.138 814 1HD2 LEU 11 HD21 LEU 11 -4.505 2.811 -5.869 815 2HD2 LEU 11 HD22 LEU 11 -3.797 4.313 -5.244 816 3HD2 LEU 11 HD23 LEU 11 -2.745 2.993 -5.814 817 H LEU 12 H LEU 12 -2.044 3.450 -0.324 818 HA LEU 12 HA LEU 12 -4.531 3.801 0.996 819 1HB LEU 12 HB2 LEU 12 -1.649 3.629 2.022 820 2HB LEU 12 HB3 LEU 12 -3.038 3.787 3.091 821 HG LEU 12 HG LEU 12 -4.021 1.723 2.160 822 1HD1 LEU 12 HD11 LEU 12 -1.293 1.411 0.828 823 2HD1 LEU 12 HD12 LEU 12 -2.484 0.113 1.002 824 3HD1 LEU 12 HD13 LEU 12 -2.867 1.504 -0.006 825 1HD2 LEU 12 HD21 LEU 12 -2.459 0.204 3.378 826 2HD2 LEU 12 HD22 LEU 12 -1.259 1.511 3.424 827 3HD2 LEU 12 HD23 LEU 12 -2.815 1.683 4.269 828 H ILE 13 H ILE 13 -1.638 5.925 0.936 829 HA ILE 13 HA ILE 13 -2.680 7.842 2.760 830 HB ILE 13 HB ILE 13 -0.646 8.124 0.505 831 1HG1 ILE 13 HG12 ILE 13 -0.052 8.007 3.477 832 2HG1 ILE 13 HG13 ILE 13 -0.230 6.515 2.567 833 1HG2 ILE 13 HG21 ILE 13 -1.263 9.989 2.823 834 2HG2 ILE 13 HG22 ILE 13 0.168 10.116 1.786 835 3HG2 ILE 13 HG23 ILE 13 -1.435 10.369 1.092 836 1HD1 ILE 13 HD11 ILE 13 1.538 7.475 0.934 837 2HD1 ILE 13 HD12 ILE 13 1.870 8.671 2.200 838 3HD1 ILE 13 HD13 ILE 13 2.083 6.941 2.519 839 H GLY 14 H GLY 14 -2.801 7.739 -0.800 840 1HA GLY 14 HA2 GLY 14 -4.174 10.172 -1.249 841 2HA GLY 14 HA3 GLY 14 -4.153 8.757 -2.320 842 H ILE 15 H ILE 15 -5.428 6.786 -1.062 843 HA ILE 15 HA ILE 15 -8.176 7.294 -1.294 844 HB ILE 15 HB ILE 15 -6.490 5.151 -0.039 845 1HG1 ILE 15 HG12 ILE 15 -8.764 5.181 -2.085 846 2HG1 ILE 15 HG13 ILE 15 -7.035 5.227 -2.452 847 1HG2 ILE 15 HG21 ILE 15 -8.474 3.897 0.742 848 2HG2 ILE 15 HG22 ILE 15 -8.161 5.347 1.666 849 3HG2 ILE 15 HG23 ILE 15 -9.479 5.334 0.458 850 1HD1 ILE 15 HD11 ILE 15 -8.612 2.920 -1.238 851 2HD1 ILE 15 HD12 ILE 15 -7.743 2.963 -2.770 852 3HD1 ILE 15 HD13 ILE 15 -6.843 2.981 -1.238 853 H PHE 16 H PHE 16 -6.164 7.269 1.662 854 HA PHE 16 HA PHE 16 -8.238 8.005 3.421 855 1HB PHE 16 HB2 PHE 16 -5.995 7.101 4.023 856 2HB PHE 16 HB3 PHE 16 -5.257 8.633 3.621 857 HD1 PHE 16 HD1 PHE 16 -7.284 6.809 6.067 858 HD2 PHE 16 HD2 PHE 16 -5.822 10.704 5.004 859 HE1 PHE 16 HE1 PHE 16 -7.528 7.549 8.432 860 HE2 PHE 16 HE2 PHE 16 -6.202 11.476 7.285 861 HZ PHE 16 HZ PHE 16 -6.911 9.849 9.062 862 H HIS 17 H HIS 17 -5.714 10.224 2.082 863 HA HIS 17 HA HIS 17 -6.934 12.433 3.391 864 1HB HIS 17 HB2 HIS 17 -4.841 12.329 1.209 865 2HB HIS 17 HB3 HIS 17 -5.365 13.819 2.009 866 HD1 HIS 17 HD1 HIS 17 -3.517 10.572 2.798 867 HD2 HIS 17 HD2 HIS 17 -4.801 14.116 4.650 868 HE1 HIS 17 HE1 HIS 17 -2.494 10.585 5.145 869 H LYS 18 H LYS 18 -7.473 11.102 0.163 870 HA LYS 18 HA LYS 18 -8.905 13.365 -0.911 871 1HB LYS 18 HB2 LYS 18 -9.101 10.374 -1.420 872 2HB LYS 18 HB3 LYS 18 -10.099 11.569 -2.267 873 1HG LYS 18 HG2 LYS 18 -8.056 12.763 -3.026 874 2HG LYS 18 HG3 LYS 18 -7.047 11.502 -2.318 875 1HD LYS 18 HD2 LYS 18 -9.159 11.101 -4.500 876 2HD LYS 18 HD3 LYS 18 -7.416 11.246 -4.776 877 1HE LYS 18 HE2 LYS 18 -7.025 9.200 -3.411 878 2HE LYS 18 HE3 LYS 18 -8.777 9.016 -3.190 879 1HZ LYS 18 HZ1 LYS 18 -7.967 7.668 -4.956 880 2HZ LYS 18 HZ2 LYS 18 -8.993 8.812 -5.549 881 3HZ LYS 18 HZ3 LYS 18 -7.366 8.976 -5.758 882 H TYR 19 H TYR 19 -9.876 10.606 1.178 883 HA TYR 19 HA TYR 19 -12.628 11.540 1.312 884 1HB TYR 19 HB2 TYR 19 -11.061 9.326 2.558 885 2HB TYR 19 HB3 TYR 19 -12.477 9.930 3.420 886 HD1 TYR 19 HD1 TYR 19 -11.413 8.428 0.168 887 HD2 TYR 19 HD2 TYR 19 -14.699 9.633 2.680 888 HE1 TYR 19 HE1 TYR 19 -13.008 7.389 -1.406 889 HE2 TYR 19 HE2 TYR 19 -16.290 8.846 0.956 890 HH TYR 19 HH TYR 19 -16.293 6.968 -0.634 891 H SER 20 H SER 20 -9.787 11.809 3.572 892 HA SER 20 HA SER 20 -11.022 13.212 5.609 893 1HB SER 20 HB2 SER 20 -8.304 13.916 4.446 894 2HB SER 20 HB3 SER 20 -8.881 14.207 6.093 895 HG SER 20 HG SER 20 -8.910 12.048 6.493 896 H GLY 21 H GLY 21 -9.842 14.586 2.516 897 1HA GLY 21 HA2 GLY 21 -10.290 17.293 2.869 898 2HA GLY 21 HA3 GLY 21 -10.530 16.421 1.346 899 H LYS 22 H LYS 22 -12.789 14.781 2.519 900 HA LYS 22 HA LYS 22 -14.950 16.365 1.625 901 1HB LYS 22 HB2 LYS 22 -14.727 13.864 1.734 902 2HB LYS 22 HB3 LYS 22 -15.015 13.967 3.485 903 1HG LYS 22 HG2 LYS 22 -17.246 15.130 2.878 904 2HG LYS 22 HG3 LYS 22 -16.932 14.610 1.219 905 1HD LYS 22 HD2 LYS 22 -17.315 12.898 3.717 906 2HD LYS 22 HD3 LYS 22 -18.341 12.929 2.282 907 1HE LYS 22 HE2 LYS 22 -15.475 11.861 2.414 908 2HE LYS 22 HE3 LYS 22 -16.946 10.901 2.377 909 1HZ LYS 22 HZ1 LYS 22 -16.125 12.752 0.250 910 2HZ LYS 22 HZ2 LYS 22 -15.906 11.119 0.221 911 3HZ LYS 22 HZ3 LYS 22 -17.434 11.739 0.230 912 H GLU 23 H GLU 23 -13.691 15.744 4.928 913 HA GLU 23 HA GLU 23 -15.110 18.027 5.994 914 1HB GLU 23 HB2 GLU 23 -16.560 16.827 7.597 915 2HB GLU 23 HB3 GLU 23 -17.068 16.650 5.917 916 1HG GLU 23 HG2 GLU 23 -16.084 14.390 5.826 917 2HG GLU 23 HG3 GLU 23 -15.510 14.567 7.504 918 H GLY 24 H GLY 24 -13.270 15.041 6.695 919 1HA GLY 24 HA2 GLY 24 -12.544 15.550 9.361 920 2HA GLY 24 HA3 GLY 24 -11.547 14.699 8.168 921 H ASP 25 H ASP 25 -11.029 16.640 6.338 922 HA ASP 25 HA ASP 25 -9.468 18.178 5.809 923 1HB ASP 25 HB2 ASP 25 -11.536 19.483 6.355 924 2HB ASP 25 HB3 ASP 25 -10.893 19.771 7.980 925 H LYS 26 H LYS 26 -8.524 16.309 7.786 926 HA LYS 26 HA LYS 26 -6.086 17.614 8.643 927 1HB LYS 26 HB2 LYS 26 -7.918 16.219 10.664 928 2HB LYS 26 HB3 LYS 26 -6.271 16.786 10.976 929 1HG LYS 26 HG2 LYS 26 -7.050 19.138 10.532 930 2HG LYS 26 HG3 LYS 26 -8.707 18.511 10.401 931 1HD LYS 26 HD2 LYS 26 -8.558 17.572 12.684 932 2HD LYS 26 HD3 LYS 26 -6.925 18.258 12.858 933 1HE LYS 26 HE2 LYS 26 -7.858 20.543 12.496 934 2HE LYS 26 HE3 LYS 26 -9.482 19.851 12.314 935 1HZ LYS 26 HZ1 LYS 26 -7.820 19.690 14.729 936 2HZ LYS 26 HZ2 LYS 26 -9.118 20.679 14.508 937 3HZ LYS 26 HZ3 LYS 26 -9.327 19.046 14.553 938 H HIS 27 H HIS 27 -4.879 15.530 9.851 939 HA HIS 27 HA HIS 27 -5.023 13.336 7.919 940 1HB HIS 27 HB2 HIS 27 -3.350 13.649 10.432 941 2HB HIS 27 HB3 HIS 27 -3.136 12.428 9.168 942 HD1 HIS 27 HD1 HIS 27 -2.928 13.803 6.546 943 HD2 HIS 27 HD2 HIS 27 -1.774 15.702 10.129 944 HE1 HIS 27 HE1 HIS 27 -1.507 15.828 5.891 945 H THR 28 H THR 28 -7.508 13.409 8.852 946 HA THR 28 HA THR 28 -7.791 11.073 10.622 947 HB THR 28 HB THR 28 -9.506 12.193 11.926 948 HG1 THR 28 HG1 THR 28 -9.887 14.335 11.730 949 1HG2 THR 28 HG21 THR 28 -8.117 13.563 13.365 950 2HG2 THR 28 HG22 THR 28 -7.171 12.172 12.808 951 3HG2 THR 28 HG23 THR 28 -6.909 13.778 12.088 952 H LEU 29 H LEU 29 -9.843 10.089 10.448 953 HA LEU 29 HA LEU 29 -11.691 11.122 8.338 954 1HB LEU 29 HB2 LEU 29 -10.858 8.239 8.836 955 2HB LEU 29 HB3 LEU 29 -12.278 8.695 7.895 956 HG LEU 29 HG LEU 29 -9.433 9.503 7.161 957 1HD1 LEU 29 HD11 LEU 29 -9.761 7.030 7.073 958 2HD1 LEU 29 HD12 LEU 29 -11.240 7.273 6.123 959 3HD1 LEU 29 HD13 LEU 29 -9.663 7.716 5.437 960 1HD2 LEU 29 HD21 LEU 29 -10.450 9.942 4.958 961 2HD2 LEU 29 HD22 LEU 29 -12.053 9.554 5.621 962 3HD2 LEU 29 HD23 LEU 29 -11.165 10.984 6.195 963 H SER 30 H SER 30 -13.725 11.380 9.176 964 HA SER 30 HA SER 30 -14.263 10.395 11.892 965 1HB SER 30 HB2 SER 30 -15.055 12.638 11.130 966 2HB SER 30 HB3 SER 30 -16.138 11.841 9.972 967 HG SER 30 HG SER 30 -17.079 12.383 12.070 968 H LYS 31 H LYS 31 -16.675 9.549 12.033 969 HA LYS 31 HA LYS 31 -16.274 6.809 11.370 970 1HB LYS 31 HB2 LYS 31 -18.887 8.070 12.334 971 2HB LYS 31 HB3 LYS 31 -18.363 6.384 12.497 972 1HG LYS 31 HG2 LYS 31 -16.339 7.335 13.798 973 2HG LYS 31 HG3 LYS 31 -17.230 8.843 13.901 974 1HD LYS 31 HD2 LYS 31 -18.183 6.126 14.924 975 2HD LYS 31 HD3 LYS 31 -17.505 7.417 15.912 976 1HE LYS 31 HE2 LYS 31 -20.122 7.539 14.331 977 2HE LYS 31 HE3 LYS 31 -19.953 7.351 16.081 978 1HZ LYS 31 HZ1 LYS 31 -20.408 9.598 15.524 979 2HZ LYS 31 HZ2 LYS 31 -18.885 9.496 16.146 980 3HZ LYS 31 HZ3 LYS 31 -19.102 9.678 14.522 981 H LYS 32 H LYS 32 -19.030 8.861 10.295 982 HA LYS 32 HA LYS 32 -19.809 6.984 8.279 983 1HB LYS 32 HB2 LYS 32 -21.348 8.494 9.318 984 2HB LYS 32 HB3 LYS 32 -20.522 9.915 8.623 985 1HG LYS 32 HG2 LYS 32 -21.079 9.047 6.327 986 2HG LYS 32 HG3 LYS 32 -21.951 7.699 7.067 987 1HD LYS 32 HD2 LYS 32 -22.597 10.672 7.403 988 2HD LYS 32 HD3 LYS 32 -23.418 9.555 6.306 989 1HE LYS 32 HE2 LYS 32 -24.112 8.165 8.289 990 2HE LYS 32 HE3 LYS 32 -23.414 9.400 9.357 991 1HZ LYS 32 HZ1 LYS 32 -25.574 9.844 7.430 992 2HZ LYS 32 HZ2 LYS 32 -25.736 9.717 9.064 993 3HZ LYS 32 HZ3 LYS 32 -24.912 10.987 8.416 994 H GLU 33 H GLU 33 -17.603 9.751 8.252 995 HA GLU 33 HA GLU 33 -17.180 10.011 5.455 996 1HB GLU 33 HB2 GLU 33 -16.378 11.525 7.290 997 2HB GLU 33 HB3 GLU 33 -15.167 10.307 7.717 998 1HG GLU 33 HG2 GLU 33 -14.098 10.595 5.502 999 2HG GLU 33 HG3 GLU 33 -15.359 11.748 5.038 1000 H LEU 34 H LEU 34 -15.502 7.957 7.912 1001 HA LEU 34 HA LEU 34 -13.889 6.519 6.082 1002 1HB LEU 34 HB2 LEU 34 -13.408 6.554 8.433 1003 2HB LEU 34 HB3 LEU 34 -14.969 5.880 8.862 1004 HG LEU 34 HG LEU 34 -13.071 4.343 9.101 1005 1HD1 LEU 34 HD11 LEU 34 -14.240 2.419 8.509 1006 2HD1 LEU 34 HD12 LEU 34 -15.523 3.618 8.621 1007 3HD1 LEU 34 HD13 LEU 34 -14.912 3.124 7.046 1008 1HD2 LEU 34 HD21 LEU 34 -12.939 4.361 6.053 1009 2HD2 LEU 34 HD22 LEU 34 -11.730 5.036 7.163 1010 3HD2 LEU 34 HD23 LEU 34 -12.032 3.293 7.115 1011 H LYS 35 H LYS 35 -17.199 5.795 7.408 1012 HA LYS 35 HA LYS 35 -17.437 3.385 5.978 1013 1HB LYS 35 HB2 LYS 35 -19.019 4.205 7.726 1014 2HB LYS 35 HB3 LYS 35 -19.768 5.268 6.511 1015 1HG LYS 35 HG2 LYS 35 -20.297 3.335 5.101 1016 2HG LYS 35 HG3 LYS 35 -19.381 2.260 6.175 1017 1HD LYS 35 HD2 LYS 35 -21.000 2.868 8.029 1018 2HD LYS 35 HD3 LYS 35 -21.998 3.676 6.805 1019 1HE LYS 35 HE2 LYS 35 -21.145 0.729 6.846 1020 2HE LYS 35 HE3 LYS 35 -22.776 1.361 7.153 1021 1HZ LYS 35 HZ1 LYS 35 -21.326 1.466 4.609 1022 2HZ LYS 35 HZ2 LYS 35 -22.669 0.576 4.973 1023 3HZ LYS 35 HZ3 LYS 35 -22.770 2.216 4.895 1024 H GLU 36 H GLU 36 -18.022 6.714 4.835 1025 HA GLU 36 HA GLU 36 -19.031 6.004 2.269 1026 1HB GLU 36 HB2 GLU 36 -19.087 8.242 3.565 1027 2HB GLU 36 HB3 GLU 36 -17.493 8.543 2.886 1028 1HG GLU 36 HG2 GLU 36 -18.504 8.213 0.573 1029 2HG GLU 36 HG3 GLU 36 -20.080 7.980 1.343 1030 H LEU 37 H LEU 37 -15.720 6.411 3.515 1031 HA LEU 37 HA LEU 37 -14.313 6.024 1.027 1032 1HB LEU 37 HB2 LEU 37 -13.273 6.850 3.069 1033 2HB LEU 37 HB3 LEU 37 -13.504 5.326 3.884 1034 HG LEU 37 HG LEU 37 -11.821 5.483 1.388 1035 1HD1 LEU 37 HD11 LEU 37 -11.048 5.831 4.319 1036 2HD1 LEU 37 HD12 LEU 37 -9.902 5.698 2.981 1037 3HD1 LEU 37 HD13 LEU 37 -10.987 7.093 3.064 1038 1HD2 LEU 37 HD21 LEU 37 -12.371 3.161 2.064 1039 2HD2 LEU 37 HD22 LEU 37 -10.711 3.505 2.522 1040 3HD2 LEU 37 HD23 LEU 37 -11.975 3.524 3.762 1041 H ILE 38 H ILE 38 -15.309 3.697 3.543 1042 HA ILE 38 HA ILE 38 -14.419 1.419 2.127 1043 HB ILE 38 HB ILE 38 -16.615 1.772 4.202 1044 1HG1 ILE 38 HG12 ILE 38 -13.730 0.735 4.277 1045 2HG1 ILE 38 HG13 ILE 38 -14.282 2.302 4.884 1046 1HG2 ILE 38 HG21 ILE 38 -16.688 -0.604 4.512 1047 2HG2 ILE 38 HG22 ILE 38 -17.017 -0.346 2.821 1048 3HG2 ILE 38 HG23 ILE 38 -15.398 -0.871 3.339 1049 1HD1 ILE 38 HD11 ILE 38 -15.816 1.027 6.466 1050 2HD1 ILE 38 HD12 ILE 38 -14.977 -0.446 5.920 1051 3HD1 ILE 38 HD13 ILE 38 -14.059 0.849 6.734 1052 H GLN 39 H GLN 39 -17.740 2.827 2.183 1053 HA GLN 39 HA GLN 39 -18.928 0.948 0.466 1054 1HB GLN 39 HB2 GLN 39 -19.463 3.920 0.873 1055 2HB GLN 39 HB3 GLN 39 -20.519 2.883 -0.093 1056 1HG GLN 39 HG2 GLN 39 -19.875 2.275 2.829 1057 2HG GLN 39 HG3 GLN 39 -21.243 3.265 2.306 1058 1HE2 GLN 39 HE22 GLN 39 -19.876 -0.022 2.321 1059 2HE2 GLN 39 HE21 GLN 39 -21.375 -0.803 1.855 1060 H LYS 40 H LYS 40 -16.872 3.730 -0.403 1061 HA LYS 40 HA LYS 40 -17.398 3.342 -3.236 1062 1HB LYS 40 HB2 LYS 40 -16.750 5.506 -2.178 1063 2HB LYS 40 HB3 LYS 40 -15.168 4.839 -1.789 1064 1HG LYS 40 HG2 LYS 40 -14.869 6.168 -3.720 1065 2HG LYS 40 HG3 LYS 40 -14.732 4.499 -4.240 1066 1HD LYS 40 HD2 LYS 40 -16.024 5.881 -5.829 1067 2HD LYS 40 HD3 LYS 40 -16.978 4.536 -5.211 1068 1HE LYS 40 HE2 LYS 40 -18.220 6.725 -5.367 1069 2HE LYS 40 HE3 LYS 40 -18.260 6.001 -3.760 1070 1HZ LYS 40 HZ1 LYS 40 -16.444 8.153 -4.608 1071 2HZ LYS 40 HZ2 LYS 40 -17.801 8.345 -3.695 1072 3HZ LYS 40 HZ3 LYS 40 -16.520 7.502 -3.094 1073 H GLU 41 H GLU 41 -14.537 2.745 -1.153 1074 HA GLU 41 HA GLU 41 -13.148 1.479 -3.346 1075 1HB GLU 41 HB2 GLU 41 -12.529 1.354 -0.362 1076 2HB GLU 41 HB3 GLU 41 -11.438 0.942 -1.697 1077 1HG GLU 41 HG2 GLU 41 -12.584 3.713 -1.084 1078 2HG GLU 41 HG3 GLU 41 -10.932 3.173 -0.821 1079 H LEU 42 H LEU 42 -14.603 0.178 -0.378 1080 HA LEU 42 HA LEU 42 -14.359 -2.616 -1.441 1081 1HB LEU 42 HB2 LEU 42 -15.159 -1.703 1.326 1082 2HB LEU 42 HB3 LEU 42 -14.892 -3.361 0.778 1083 HG LEU 42 HG LEU 42 -12.799 -1.157 1.087 1084 1HD1 LEU 42 HD11 LEU 42 -13.152 -3.837 2.495 1085 2HD1 LEU 42 HD12 LEU 42 -11.853 -2.661 2.787 1086 3HD1 LEU 42 HD13 LEU 42 -13.526 -2.245 3.188 1087 1HD2 LEU 42 HD21 LEU 42 -11.132 -2.936 0.491 1088 2HD2 LEU 42 HD22 LEU 42 -12.473 -3.985 -0.012 1089 3HD2 LEU 42 HD23 LEU 42 -12.147 -2.459 -0.869 1090 H THR 43 H THR 43 -15.859 -1.746 -3.100 1091 HA THR 43 HA THR 43 -18.454 -0.922 -2.510 1092 HB THR 43 HB THR 43 -17.849 -2.362 -5.085 1093 HG1 THR 43 HG1 THR 43 -16.509 0.018 -4.325 1094 1HG2 THR 43 HG21 THR 43 -19.919 -1.005 -4.801 1095 2HG2 THR 43 HG22 THR 43 -18.920 0.424 -4.450 1096 3HG2 THR 43 HG23 THR 43 -18.843 -0.343 -6.049 1097 H ILE 44 H ILE 44 -18.830 -2.572 -0.759 1098 HA ILE 44 HA ILE 44 -19.361 -5.294 -1.358 1099 HB ILE 44 HB ILE 44 -20.520 -5.281 0.877 1100 1HG1 ILE 44 HG12 ILE 44 -19.356 -2.515 1.309 1101 2HG1 ILE 44 HG13 ILE 44 -20.998 -2.670 0.675 1102 1HG2 ILE 44 HG21 ILE 44 -18.400 -5.075 2.102 1103 2HG2 ILE 44 HG22 ILE 44 -18.158 -5.883 0.550 1104 3HG2 ILE 44 HG23 ILE 44 -17.679 -4.190 0.748 1105 1HD1 ILE 44 HD11 ILE 44 -20.033 -3.976 3.239 1106 2HD1 ILE 44 HD12 ILE 44 -20.960 -2.470 3.150 1107 3HD1 ILE 44 HD13 ILE 44 -21.694 -3.987 2.603 1108 H GLY 45 H GLY 45 -20.614 -4.904 -3.345 1109 1HA GLY 45 HA2 GLY 45 -23.299 -4.282 -3.565 1110 2HA GLY 45 HA3 GLY 45 -22.553 -5.684 -4.355 1111 H SER 46 H SER 46 -21.896 -7.171 -2.016 1112 HA SER 46 HA SER 46 -24.448 -8.328 -1.188 1113 1HB SER 46 HB2 SER 46 -22.533 -9.787 -1.451 1114 2HB SER 46 HB3 SER 46 -21.579 -8.821 -0.307 1115 HG SER 46 HG SER 46 -23.045 -9.369 1.305 1116 H LYS 47 H LYS 47 -25.145 -6.079 -0.559 1117 HA LYS 47 HA LYS 47 -24.174 -4.570 1.485 1118 1HB LYS 47 HB2 LYS 47 -26.971 -5.046 0.442 1119 2HB LYS 47 HB3 LYS 47 -26.727 -3.888 1.744 1120 1HG LYS 47 HG2 LYS 47 -24.886 -3.627 -0.630 1121 2HG LYS 47 HG3 LYS 47 -26.585 -3.235 -0.884 1122 1HD LYS 47 HD2 LYS 47 -25.276 -1.236 -0.273 1123 2HD LYS 47 HD3 LYS 47 -26.583 -1.575 0.870 1124 1HE LYS 47 HE2 LYS 47 -24.943 -2.592 2.440 1125 2HE LYS 47 HE3 LYS 47 -23.627 -2.230 1.302 1126 1HZ LYS 47 HZ1 LYS 47 -25.416 -0.220 2.485 1127 2HZ LYS 47 HZ2 LYS 47 -23.962 -0.636 3.126 1128 3HZ LYS 47 HZ3 LYS 47 -24.026 0.064 1.637 1129 H LEU 48 H LEU 48 -25.639 -7.655 2.005 1130 HA LEU 48 HA LEU 48 -26.470 -7.520 4.690 1131 1HB LEU 48 HB2 LEU 48 -24.784 -9.678 3.355 1132 2HB LEU 48 HB3 LEU 48 -25.737 -9.872 4.830 1133 HG LEU 48 HG LEU 48 -26.863 -9.319 2.040 1134 1HD1 LEU 48 HD11 LEU 48 -25.919 -11.580 2.312 1135 2HD1 LEU 48 HD12 LEU 48 -26.908 -11.824 3.770 1136 3HD1 LEU 48 HD13 LEU 48 -27.686 -11.626 2.185 1137 1HD2 LEU 48 HD21 LEU 48 -29.062 -9.832 3.111 1138 2HD2 LEU 48 HD22 LEU 48 -28.273 -9.822 4.701 1139 3HD2 LEU 48 HD23 LEU 48 -28.353 -8.336 3.724 1140 H GLN 49 H GLN 49 -23.215 -7.400 3.330 1141 HA GLN 49 HA GLN 49 -21.723 -7.804 5.722 1142 1HB GLN 49 HB2 GLN 49 -21.106 -6.233 3.194 1143 2HB GLN 49 HB3 GLN 49 -19.925 -6.562 4.472 1144 1HG GLN 49 HG2 GLN 49 -20.199 -8.996 4.124 1145 2HG GLN 49 HG3 GLN 49 -21.395 -8.695 2.859 1146 1HE2 GLN 49 HE22 GLN 49 -17.967 -8.011 3.756 1147 2HE2 GLN 49 HE21 GLN 49 -17.410 -7.930 2.095 1148 H ASP 50 H ASP 50 -23.715 -5.069 4.854 1149 HA ASP 50 HA ASP 50 -22.283 -2.901 5.715 1150 1HB ASP 50 HB2 ASP 50 -24.552 -2.886 4.678 1151 2HB ASP 50 HB3 ASP 50 -25.255 -3.351 6.233 1152 H ALA 51 H ALA 51 -24.167 -5.094 7.822 1153 HA ALA 51 HA ALA 51 -23.824 -3.753 10.296 1154 1HB ALA 51 HB1 ALA 51 -23.913 -6.745 9.713 1155 2HB ALA 51 HB2 ALA 51 -24.156 -5.983 11.299 1156 3HB ALA 51 HB3 ALA 51 -25.313 -5.683 9.987 1157 H GLU 52 H GLU 52 -21.673 -5.985 8.530 1158 HA GLU 52 HA GLU 52 -19.712 -6.184 10.662 1159 1HB GLU 52 HB2 GLU 52 -19.278 -6.750 7.697 1160 2HB GLU 52 HB3 GLU 52 -18.363 -7.358 9.077 1161 1HG GLU 52 HG2 GLU 52 -21.234 -8.088 8.324 1162 2HG GLU 52 HG3 GLU 52 -19.809 -9.121 8.245 1163 H ILE 53 H ILE 53 -20.167 -4.236 7.687 1164 HA ILE 53 HA ILE 53 -17.732 -2.783 7.931 1165 HB ILE 53 HB ILE 53 -20.348 -1.766 6.773 1166 1HG1 ILE 53 HG12 ILE 53 -19.712 -3.671 5.503 1167 2HG1 ILE 53 HG13 ILE 53 -19.196 -2.237 4.606 1168 1HG2 ILE 53 HG21 ILE 53 -18.926 0.115 7.307 1169 2HG2 ILE 53 HG22 ILE 53 -17.513 -0.697 6.638 1170 3HG2 ILE 53 HG23 ILE 53 -18.836 -0.169 5.569 1171 1HD1 ILE 53 HD11 ILE 53 -16.851 -2.624 5.523 1172 2HD1 ILE 53 HD12 ILE 53 -17.441 -4.180 6.148 1173 3HD1 ILE 53 HD13 ILE 53 -17.464 -3.857 4.409 1174 H VAL 54 H VAL 54 -20.971 -2.024 9.444 1175 HA VAL 54 HA VAL 54 -19.780 0.332 10.603 1176 HB VAL 54 HB VAL 54 -21.738 0.439 12.129 1177 1HG1 VAL 54 HG11 VAL 54 -22.144 0.370 9.126 1178 2HG1 VAL 54 HG12 VAL 54 -23.162 1.258 10.283 1179 3HG1 VAL 54 HG13 VAL 54 -21.470 1.730 10.051 1180 1HG2 VAL 54 HG21 VAL 54 -22.413 -1.954 12.073 1181 2HG2 VAL 54 HG22 VAL 54 -23.711 -0.829 11.638 1182 3HG2 VAL 54 HG23 VAL 54 -22.881 -1.732 10.368 1183 H LYS 55 H LYS 55 -19.994 -3.021 11.830 1184 HA LYS 55 HA LYS 55 -18.886 -2.366 14.391 1185 1HB LYS 55 HB2 LYS 55 -19.826 -4.559 13.949 1186 2HB LYS 55 HB3 LYS 55 -18.625 -4.877 12.699 1187 1HG LYS 55 HG2 LYS 55 -18.158 -6.037 14.850 1188 2HG LYS 55 HG3 LYS 55 -16.836 -5.026 14.276 1189 1HD LYS 55 HD2 LYS 55 -17.102 -4.844 16.693 1190 2HD LYS 55 HD3 LYS 55 -17.366 -3.285 15.927 1191 1HE LYS 55 HE2 LYS 55 -19.857 -3.647 16.117 1192 2HE LYS 55 HE3 LYS 55 -19.536 -5.189 16.928 1193 1HZ LYS 55 HZ1 LYS 55 -19.945 -3.414 18.465 1194 2HZ LYS 55 HZ2 LYS 55 -18.400 -3.960 18.638 1195 3HZ LYS 55 HZ3 LYS 55 -18.687 -2.532 17.867 1196 H LEU 56 H LEU 56 -17.305 -3.210 11.286 1197 HA LEU 56 HA LEU 56 -14.622 -2.906 12.148 1198 1HB LEU 56 HB2 LEU 56 -15.014 -4.109 10.241 1199 2HB LEU 56 HB3 LEU 56 -16.059 -2.901 9.511 1200 HG LEU 56 HG LEU 56 -13.195 -2.102 9.944 1201 1HD1 LEU 56 HD11 LEU 56 -12.582 -3.162 7.776 1202 2HD1 LEU 56 HD12 LEU 56 -12.969 -4.381 9.005 1203 3HD1 LEU 56 HD13 LEU 56 -14.151 -3.986 7.738 1204 1HD2 LEU 56 HD21 LEU 56 -15.259 -1.742 7.712 1205 2HD2 LEU 56 HD22 LEU 56 -14.869 -0.520 8.921 1206 3HD2 LEU 56 HD23 LEU 56 -13.623 -1.032 7.770 1207 H MET 57 H MET 57 -16.895 -0.486 10.858 1208 HA MET 57 HA MET 57 -15.157 1.757 10.733 1209 1HB MET 57 HB2 MET 57 -17.426 1.745 9.742 1210 2HB MET 57 HB3 MET 57 -18.120 1.507 11.347 1211 1HG MET 57 HG2 MET 57 -17.214 3.771 12.025 1212 2HG MET 57 HG3 MET 57 -16.767 4.006 10.343 1213 1HE MET 57 HE1 MET 57 -19.551 3.896 13.020 1214 2HE MET 57 HE2 MET 57 -21.046 3.882 12.059 1215 3HE MET 57 HE3 MET 57 -20.017 2.437 12.113 1216 H ASP 58 H ASP 58 -17.392 0.608 13.312 1217 HA ASP 58 HA ASP 58 -16.664 2.415 15.319 1218 1HB ASP 58 HB2 ASP 58 -18.562 0.926 15.544 1219 2HB ASP 58 HB3 ASP 58 -17.510 -0.489 15.596 1220 H ASP 59 H ASP 59 -15.163 -0.796 14.592 1221 HA ASP 59 HA ASP 59 -13.129 -0.632 16.539 1222 1HB ASP 59 HB2 ASP 59 -12.939 -1.925 13.779 1223 2HB ASP 59 HB3 ASP 59 -11.833 -2.193 15.124 1224 H LEU 60 H LEU 60 -12.958 0.511 13.135 1225 HA LEU 60 HA LEU 60 -10.331 1.595 13.291 1226 1HB LEU 60 HB2 LEU 60 -12.805 2.140 11.606 1227 2HB LEU 60 HB3 LEU 60 -11.457 3.255 11.479 1228 HG LEU 60 HG LEU 60 -10.893 0.322 11.160 1229 1HD1 LEU 60 HD11 LEU 60 -11.382 0.368 8.762 1230 2HD1 LEU 60 HD12 LEU 60 -12.863 0.664 9.695 1231 3HD1 LEU 60 HD13 LEU 60 -12.010 2.009 8.898 1232 1HD2 LEU 60 HD21 LEU 60 -9.017 1.968 11.022 1233 2HD2 LEU 60 HD22 LEU 60 -9.304 1.266 9.408 1234 3HD2 LEU 60 HD23 LEU 60 -9.901 2.878 9.767 1235 H ASP 61 H ASP 61 -13.433 3.344 13.781 1236 HA ASP 61 HA ASP 61 -12.012 5.747 14.467 1237 1HB ASP 61 HB2 ASP 61 -14.114 6.738 14.964 1238 2HB ASP 61 HB3 ASP 61 -14.190 5.839 13.450 1239 H ARG 62 H ARG 62 -13.190 3.086 16.458 1240 HA ARG 62 HA ARG 62 -13.584 4.253 18.863 1241 1HB ARG 62 HB2 ARG 62 -13.877 1.856 18.429 1242 2HB ARG 62 HB3 ARG 62 -12.119 1.613 18.447 1243 1HG ARG 62 HG2 ARG 62 -12.171 2.443 20.871 1244 2HG ARG 62 HG3 ARG 62 -13.936 2.517 20.733 1245 1HD ARG 62 HD2 ARG 62 -12.137 0.083 20.509 1246 2HD ARG 62 HD3 ARG 62 -13.275 0.434 21.806 1247 HE ARG 62 HE ARG 62 -15.123 0.259 20.155 1248 1HH1 ARG 62 HH11 ARG 62 -12.105 -1.546 19.452 1249 2HH1 ARG 62 HH12 ARG 62 -12.905 -2.541 18.256 1250 1HH2 ARG 62 HH22 ARG 62 -16.072 -1.125 18.599 1251 2HH2 ARG 62 HH21 ARG 62 -15.067 -2.317 17.797 1252 H ASN 63 H ASN 63 -10.385 3.446 17.485 1253 HA ASN 63 HA ASN 63 -8.833 3.811 19.768 1254 1HB ASN 63 HB2 ASN 63 -7.996 3.019 17.536 1255 2HB ASN 63 HB3 ASN 63 -8.017 4.702 16.981 1256 1HD2 ASN 63 HD22 ASN 63 -6.449 2.362 19.167 1257 2HD2 ASN 63 HD21 ASN 63 -5.083 3.394 19.555 1258 H LYS 64 H LYS 64 -10.263 6.336 17.742 1259 HA LYS 64 HA LYS 64 -9.675 8.270 19.893 1260 1HB LYS 64 HB2 LYS 64 -9.115 8.949 16.980 1261 2HB LYS 64 HB3 LYS 64 -9.052 10.050 18.363 1262 1HG LYS 64 HG2 LYS 64 -7.250 8.620 19.364 1263 2HG LYS 64 HG3 LYS 64 -7.297 7.593 17.922 1264 1HD LYS 64 HD2 LYS 64 -6.694 9.511 16.497 1265 2HD LYS 64 HD3 LYS 64 -6.588 10.551 17.935 1266 1HE LYS 64 HE2 LYS 64 -4.813 9.107 18.877 1267 2HE LYS 64 HE3 LYS 64 -4.951 7.999 17.503 1268 1HZ LYS 64 HZ1 LYS 64 -4.119 10.809 17.334 1269 2HZ LYS 64 HZ2 LYS 64 -3.125 9.495 17.264 1270 3HZ LYS 64 HZ3 LYS 64 -4.226 9.751 16.072 1271 H ASP 65 H ASP 65 -11.836 6.772 19.599 1272 HA ASP 65 HA ASP 65 -14.063 6.722 19.323 1273 1HB ASP 65 HB2 ASP 65 -15.183 8.573 20.606 1274 2HB ASP 65 HB3 ASP 65 -13.900 7.680 21.420 1275 H GLN 66 H GLN 66 -13.939 10.200 18.687 1276 HA GLN 66 HA GLN 66 -16.109 10.082 16.847 1277 1HB GLN 66 HB2 GLN 66 -15.587 12.055 18.181 1278 2HB GLN 66 HB3 GLN 66 -14.008 12.214 17.401 1279 1HG GLN 66 HG2 GLN 66 -15.607 13.857 16.563 1280 2HG GLN 66 HG3 GLN 66 -15.073 12.799 15.265 1281 1HE2 GLN 66 HE22 GLN 66 -16.597 11.268 14.343 1282 2HE2 GLN 66 HE21 GLN 66 -18.324 11.554 14.583 1283 H GLU 67 H GLU 67 -12.566 9.817 16.369 1284 HA GLU 67 HA GLU 67 -13.068 9.411 13.471 1285 1HB GLU 67 HB2 GLU 67 -10.891 11.280 14.528 1286 2HB GLU 67 HB3 GLU 67 -11.241 10.880 12.847 1287 1HG GLU 67 HG2 GLU 67 -13.604 11.950 13.357 1288 2HG GLU 67 HG3 GLU 67 -12.753 12.696 14.717 1289 H VAL 68 H VAL 68 -11.293 8.510 12.340 1290 HA VAL 68 HA VAL 68 -9.352 6.989 14.042 1291 HB VAL 68 HB VAL 68 -10.741 5.515 12.665 1292 1HG1 VAL 68 HG11 VAL 68 -10.587 5.415 10.256 1293 2HG1 VAL 68 HG12 VAL 68 -11.273 6.962 10.754 1294 3HG1 VAL 68 HG13 VAL 68 -9.575 6.864 10.211 1295 1HG2 VAL 68 HG21 VAL 68 -8.398 4.944 13.212 1296 2HG2 VAL 68 HG22 VAL 68 -8.919 4.248 11.673 1297 3HG2 VAL 68 HG23 VAL 68 -7.869 5.673 11.678 1298 H ASN 69 H ASN 69 -7.255 7.691 13.884 1299 HA ASN 69 HA ASN 69 -6.669 9.947 12.071 1300 1HB ASN 69 HB2 ASN 69 -5.794 10.329 14.235 1301 2HB ASN 69 HB3 ASN 69 -5.246 8.659 14.394 1302 1HD2 ASN 69 HD21 ASN 69 -4.597 11.583 12.271 1303 2HD2 ASN 69 HD22 ASN 69 -2.873 11.297 12.281 1304 H PHE 70 H PHE 70 -4.907 9.912 10.621 1305 HA PHE 70 HA PHE 70 -4.669 7.901 8.813 1306 1HB PHE 70 HB2 PHE 70 -3.794 10.128 8.492 1307 2HB PHE 70 HB3 PHE 70 -2.572 9.881 9.744 1308 HD1 PHE 70 HD1 PHE 70 -0.411 9.201 9.076 1309 HD2 PHE 70 HD2 PHE 70 -3.793 8.320 6.539 1310 HE1 PHE 70 HE1 PHE 70 1.070 8.013 7.520 1311 HE2 PHE 70 HE2 PHE 70 -2.302 7.102 4.987 1312 HZ PHE 70 HZ PHE 70 0.125 6.887 5.504 1313 H GLN 71 H GLN 71 -2.466 8.114 11.714 1314 HA GLN 71 HA GLN 71 -0.885 5.893 10.873 1315 1HB GLN 71 HB2 GLN 71 -0.105 7.451 12.576 1316 2HB GLN 71 HB3 GLN 71 -1.450 7.029 13.643 1317 1HG GLN 71 HG2 GLN 71 0.600 5.973 14.387 1318 2HG GLN 71 HG3 GLN 71 -0.570 4.743 13.932 1319 1HE2 GLN 71 HE22 GLN 71 -0.216 3.560 11.854 1320 2HE2 GLN 71 HE21 GLN 71 1.455 3.481 11.255 1321 H GLU 72 H GLU 72 -3.795 6.154 12.883 1322 HA GLU 72 HA GLU 72 -3.896 3.392 13.716 1323 1HB GLU 72 HB2 GLU 72 -5.903 5.672 13.674 1324 2HB GLU 72 HB3 GLU 72 -6.345 4.039 14.179 1325 1HG GLU 72 HG2 GLU 72 -5.746 5.604 16.028 1326 2HG GLU 72 HG3 GLU 72 -4.883 4.052 16.035 1327 H TYR 73 H TYR 73 -5.327 5.260 11.042 1328 HA TYR 73 HA TYR 73 -6.860 3.190 9.840 1329 1HB TYR 73 HB2 TYR 73 -7.259 5.296 9.028 1330 2HB TYR 73 HB3 TYR 73 -5.572 5.737 8.917 1331 HD1 TYR 73 HD1 TYR 73 -8.309 3.920 7.233 1332 HD2 TYR 73 HD2 TYR 73 -4.247 5.375 6.928 1333 HE1 TYR 73 HE1 TYR 73 -8.405 3.702 4.771 1334 HE2 TYR 73 HE2 TYR 73 -4.318 5.035 4.491 1335 HH TYR 73 HH TYR 73 -7.179 3.699 2.814 1336 H ILE 74 H ILE 74 -3.408 4.139 9.203 1337 HA ILE 74 HA ILE 74 -2.946 2.004 7.385 1338 HB ILE 74 HB ILE 74 -0.950 3.343 9.240 1339 1HG1 ILE 74 HG12 ILE 74 -2.136 4.871 7.576 1340 2HG1 ILE 74 HG13 ILE 74 -0.393 4.843 7.542 1341 1HG2 ILE 74 HG21 ILE 74 0.051 1.314 8.552 1342 2HG2 ILE 74 HG22 ILE 74 -0.625 1.411 6.913 1343 3HG2 ILE 74 HG23 ILE 74 0.678 2.491 7.399 1344 1HD1 ILE 74 HD11 ILE 74 -0.417 3.397 5.528 1345 2HD1 ILE 74 HD12 ILE 74 -2.202 3.380 5.593 1346 3HD1 ILE 74 HD13 ILE 74 -1.320 4.881 5.275 1347 H THR 75 H THR 75 -2.262 2.101 10.953 1348 HA THR 75 HA THR 75 -1.395 -0.538 11.249 1349 HB THR 75 HB THR 75 -3.034 1.230 13.110 1350 HG1 THR 75 HG1 THR 75 -0.277 0.601 13.005 1351 1HG2 THR 75 HG21 THR 75 -1.498 -1.334 13.730 1352 2HG2 THR 75 HG22 THR 75 -2.034 -0.154 14.943 1353 3HG2 THR 75 HG23 THR 75 -3.228 -1.040 13.984 1354 H PHE 76 H PHE 76 -4.781 0.669 11.281 1355 HA PHE 76 HA PHE 76 -5.966 -1.850 11.849 1356 1HB PHE 76 HB2 PHE 76 -7.149 0.308 12.083 1357 2HB PHE 76 HB3 PHE 76 -7.137 0.501 10.330 1358 HD1 PHE 76 HD1 PHE 76 -8.562 -0.958 8.880 1359 HD2 PHE 76 HD2 PHE 76 -8.561 -1.410 13.177 1360 HE1 PHE 76 HE1 PHE 76 -10.519 -2.433 8.726 1361 HE2 PHE 76 HE2 PHE 76 -10.465 -2.989 12.995 1362 HZ PHE 76 HZ PHE 76 -11.407 -3.553 10.761 1363 H LEU 77 H LEU 77 -5.249 -0.210 8.688 1364 HA LEU 77 HA LEU 77 -6.236 -2.387 7.100 1365 1HB LEU 77 HB2 LEU 77 -4.143 -0.254 6.566 1366 2HB LEU 77 HB3 LEU 77 -4.604 -1.458 5.360 1367 HG LEU 77 HG LEU 77 -6.615 0.413 6.699 1368 1HD1 LEU 77 HD11 LEU 77 -5.061 1.757 5.400 1369 2HD1 LEU 77 HD12 LEU 77 -5.203 0.646 4.008 1370 3HD1 LEU 77 HD13 LEU 77 -6.602 1.598 4.528 1371 1HD2 LEU 77 HD21 LEU 77 -7.717 -1.565 5.758 1372 2HD2 LEU 77 HD22 LEU 77 -7.992 -0.200 4.684 1373 3HD2 LEU 77 HD23 LEU 77 -6.763 -1.411 4.254 1374 H GLY 78 H GLY 78 -3.108 -1.869 8.714 1375 1HA GLY 78 HA2 GLY 78 -1.807 -4.222 7.809 1376 2HA GLY 78 HA3 GLY 78 -1.565 -3.447 9.392 1377 H ALA 79 H ALA 79 -3.963 -3.765 10.663 1378 HA ALA 79 HA ALA 79 -3.992 -6.498 11.435 1379 1HB ALA 79 HB1 ALA 79 -6.008 -5.962 12.692 1380 2HB ALA 79 HB2 ALA 79 -4.829 -4.646 12.861 1381 3HB ALA 79 HB3 ALA 79 -6.231 -4.457 11.785 1382 H LEU 80 H LEU 80 -6.094 -4.736 9.153 1383 HA LEU 80 HA LEU 80 -7.841 -6.838 8.507 1384 1HB LEU 80 HB2 LEU 80 -7.791 -4.253 7.838 1385 2HB LEU 80 HB3 LEU 80 -6.895 -4.834 6.443 1386 HG LEU 80 HG LEU 80 -8.852 -6.418 5.999 1387 1HD1 LEU 80 HD11 LEU 80 -9.965 -6.366 8.221 1388 2HD1 LEU 80 HD12 LEU 80 -10.184 -4.610 8.075 1389 3HD1 LEU 80 HD13 LEU 80 -11.042 -5.712 6.983 1390 1HD2 LEU 80 HD21 LEU 80 -10.224 -4.606 4.997 1391 2HD2 LEU 80 HD22 LEU 80 -9.398 -3.414 6.018 1392 3HD2 LEU 80 HD23 LEU 80 -8.495 -4.289 4.758 1393 H ALA 81 H ALA 81 -4.744 -5.869 7.020 1394 HA ALA 81 HA ALA 81 -4.567 -7.926 5.062 1395 1HB ALA 81 HB1 ALA 81 -2.110 -7.430 5.201 1396 2HB ALA 81 HB2 ALA 81 -3.162 -6.034 4.857 1397 3HB ALA 81 HB3 ALA 81 -2.477 -6.248 6.472 1398 H MET 82 H MET 82 -3.528 -7.827 8.500 1399 HA MET 82 HA MET 82 -2.332 -10.419 8.426 1400 1HB MET 82 HB2 MET 82 -1.927 -8.586 10.115 1401 2HB MET 82 HB3 MET 82 -3.467 -9.009 10.877 1402 1HG MET 82 HG2 MET 82 -2.660 -11.219 11.419 1403 2HG MET 82 HG3 MET 82 -1.234 -11.023 10.390 1404 1HE MET 82 HE1 MET 82 0.262 -11.981 12.320 1405 2HE MET 82 HE2 MET 82 0.297 -11.298 13.967 1406 3HE MET 82 HE3 MET 82 -1.167 -12.118 13.375 1407 H ILE 83 H ILE 83 -5.620 -9.328 9.217 1408 HA ILE 83 HA ILE 83 -6.702 -11.892 9.899 1409 HB ILE 83 HB ILE 83 -7.945 -9.330 8.849 1410 1HG1 ILE 83 HG12 ILE 83 -8.234 -10.687 11.562 1411 2HG1 ILE 83 HG13 ILE 83 -6.924 -9.559 11.226 1412 1HG2 ILE 83 HG21 ILE 83 -10.159 -10.333 9.440 1413 2HG2 ILE 83 HG22 ILE 83 -9.398 -11.149 8.083 1414 3HG2 ILE 83 HG23 ILE 83 -9.357 -11.896 9.695 1415 1HD1 ILE 83 HD11 ILE 83 -9.889 -8.884 11.116 1416 2HD1 ILE 83 HD12 ILE 83 -8.703 -8.368 12.323 1417 3HD1 ILE 83 HD13 ILE 83 -8.568 -7.786 10.655 1418 H TYR 84 H TYR 84 -6.285 -10.187 6.766 1419 HA TYR 84 HA TYR 84 -7.231 -12.442 5.174 1420 1HB TYR 84 HB2 TYR 84 -5.363 -10.170 4.413 1421 2HB TYR 84 HB3 TYR 84 -6.219 -11.221 3.305 1422 HD1 TYR 84 HD1 TYR 84 -6.176 -8.263 3.158 1423 HD2 TYR 84 HD2 TYR 84 -8.938 -10.949 5.107 1424 HE1 TYR 84 HE1 TYR 84 -8.006 -6.631 2.827 1425 HE2 TYR 84 HE2 TYR 84 -10.756 -9.316 4.769 1426 HH TYR 84 HH TYR 84 -10.255 -6.213 3.072 1427 H ASN 85 H ASN 85 -5.759 -13.747 6.947 1428 HA ASN 85 HA ASN 85 -2.992 -13.669 6.679 1429 1HB ASN 85 HB2 ASN 85 -4.518 -14.811 8.463 1430 2HB ASN 85 HB3 ASN 85 -4.351 -16.252 7.454 1431 1HD2 ASN 85 HD22 ASN 85 -1.561 -15.925 6.621 1432 2HD2 ASN 85 HD21 ASN 85 -0.576 -15.951 8.077 1433 H GLU 86 H GLU 86 -5.335 -15.350 4.645 1434 HA GLU 86 HA GLU 86 -3.561 -17.103 3.306 1435 1HB GLU 86 HB2 GLU 86 -5.149 -17.231 1.568 1436 2HB GLU 86 HB3 GLU 86 -6.008 -17.227 3.104 1437 1HG GLU 86 HG2 GLU 86 -5.756 -14.869 1.165 1438 2HG GLU 86 HG3 GLU 86 -7.147 -15.931 1.335 1439 H ALA 87 H ALA 87 -4.048 -13.587 2.964 1440 HA ALA 87 HA ALA 87 -2.536 -13.310 0.508 1441 1HB ALA 87 HB1 ALA 87 -2.525 -10.952 1.027 1442 2HB ALA 87 HB2 ALA 87 -4.147 -11.597 1.345 1443 3HB ALA 87 HB3 ALA 87 -3.041 -11.249 2.695 1444 H LEU 88 H LEU 88 -1.788 -13.108 4.014 1445 HA LEU 88 HA LEU 88 0.994 -12.491 3.706 1446 1HB LEU 88 HB2 LEU 88 -0.334 -14.062 5.955 1447 2HB LEU 88 HB3 LEU 88 1.255 -13.342 5.966 1448 HG LEU 88 HG LEU 88 -1.441 -11.993 6.142 1449 1HD1 LEU 88 HD11 LEU 88 -0.280 -12.649 8.208 1450 2HD1 LEU 88 HD12 LEU 88 1.197 -11.805 7.679 1451 3HD1 LEU 88 HD13 LEU 88 -0.248 -10.879 8.061 1452 1HD2 LEU 88 HD21 LEU 88 -0.380 -9.795 5.932 1453 2HD2 LEU 88 HD22 LEU 88 1.135 -10.552 5.399 1454 3HD2 LEU 88 HD23 LEU 88 -0.347 -10.676 4.411 1455 H LYS 89 H LYS 89 -0.738 -15.601 3.959 1456 HA LYS 89 HA LYS 89 1.546 -17.285 3.868 1457 1HB LYS 89 HB2 LYS 89 -0.771 -17.923 4.536 1458 2HB LYS 89 HB3 LYS 89 -1.265 -17.843 2.833 1459 1HG LYS 89 HG2 LYS 89 0.496 -19.588 2.313 1460 2HG LYS 89 HG3 LYS 89 0.801 -19.733 4.050 1461 1HD LYS 89 HD2 LYS 89 -1.845 -20.260 2.604 1462 2HD LYS 89 HD3 LYS 89 -0.711 -21.490 3.182 1463 1HE LYS 89 HE2 LYS 89 -1.055 -20.645 5.536 1464 2HE LYS 89 HE3 LYS 89 -2.306 -19.545 4.921 1465 1HZ LYS 89 HZ1 LYS 89 -3.242 -21.548 5.755 1466 2HZ LYS 89 HZ2 LYS 89 -3.509 -21.439 4.134 1467 3HZ LYS 89 HZ3 LYS 89 -2.358 -22.467 4.712 1468 H GLY 90 H GLY 90 -0.574 -16.035 1.247 1469 1HA GLY 90 HA2 GLY 90 -0.249 -15.852 -1.010 1470 2HA GLY 90 HA3 GLY 90 1.497 -16.022 -0.750 Start of MODEL 21 1 1H MET 1 H1 MET 1 -14.687 0.503 -6.962 2 2H MET 1 H2 MET 1 -13.875 0.102 -5.582 3 3H MET 1 H3 MET 1 -14.921 -0.969 -6.268 4 HA MET 1 HA MET 1 -13.591 -1.214 -8.195 5 1HB MET 1 HB2 MET 1 -11.626 0.635 -6.777 6 2HB MET 1 HB3 MET 1 -11.378 -0.217 -8.314 7 1HG MET 1 HG2 MET 1 -13.331 1.064 -9.266 8 2HG MET 1 HG3 MET 1 -13.418 1.963 -7.746 9 1HE MET 1 HE1 MET 1 -10.015 2.397 -10.831 10 2HE MET 1 HE2 MET 1 -10.183 0.902 -9.893 11 3HE MET 1 HE3 MET 1 -11.448 1.369 -11.058 12 H ALA 2 H ALA 2 -12.429 -0.880 -4.896 13 HA ALA 2 HA ALA 2 -11.517 -2.122 -3.351 14 1HB ALA 2 HB1 ALA 2 -12.299 -4.558 -5.013 15 2HB ALA 2 HB2 ALA 2 -11.909 -4.521 -3.283 16 3HB ALA 2 HB3 ALA 2 -13.360 -3.697 -3.880 17 H SER 3 H SER 3 -10.712 -3.656 -6.359 18 HA SER 3 HA SER 3 -8.327 -4.768 -6.038 19 1HB SER 3 HB2 SER 3 -8.734 -3.171 -8.572 20 2HB SER 3 HB3 SER 3 -8.075 -4.778 -8.319 21 HG SER 3 HG SER 3 -10.814 -3.973 -8.094 22 HA PRO 4 HA PRO 4 -5.881 -0.607 -6.843 23 1HB PRO 4 HB2 PRO 4 -7.797 1.254 -5.432 24 2HB PRO 4 HB3 PRO 4 -6.637 1.619 -6.742 25 1HG PRO 4 HG2 PRO 4 -9.241 1.293 -7.350 26 2HG PRO 4 HG3 PRO 4 -8.012 0.458 -8.351 27 1HD PRO 4 HD2 PRO 4 -9.588 -0.661 -6.025 28 2HD PRO 4 HD3 PRO 4 -9.416 -1.349 -7.659 29 H LEU 5 H LEU 5 -7.921 -0.882 -3.840 30 HA LEU 5 HA LEU 5 -5.611 -0.106 -2.217 31 1HB LEU 5 HB2 LEU 5 -7.872 0.464 -1.439 32 2HB LEU 5 HB3 LEU 5 -8.294 -1.256 -1.369 33 HG LEU 5 HG LEU 5 -6.518 -1.634 0.339 34 1HD1 LEU 5 HD11 LEU 5 -4.874 0.106 -0.185 35 2HD1 LEU 5 HD12 LEU 5 -6.079 1.386 0.124 36 3HD1 LEU 5 HD13 LEU 5 -5.500 0.346 1.441 37 1HD2 LEU 5 HD21 LEU 5 -7.535 -0.411 2.185 38 2HD2 LEU 5 HD22 LEU 5 -8.373 0.657 1.031 39 3HD2 LEU 5 HD23 LEU 5 -8.756 -1.092 1.095 40 H ASP 6 H ASP 6 -7.449 -3.050 -3.036 41 HA ASP 6 HA ASP 6 -6.154 -4.867 -1.342 42 1HB ASP 6 HB2 ASP 6 -7.154 -5.409 -4.168 43 2HB ASP 6 HB3 ASP 6 -6.828 -6.625 -2.930 44 H GLN 7 H GLN 7 -5.149 -3.895 -4.674 45 HA GLN 7 HA GLN 7 -2.843 -5.580 -4.679 46 1HB GLN 7 HB2 GLN 7 -2.076 -4.351 -6.575 47 2HB GLN 7 HB3 GLN 7 -3.811 -4.652 -6.720 48 1HG GLN 7 HG2 GLN 7 -4.238 -2.306 -5.965 49 2HG GLN 7 HG3 GLN 7 -2.513 -1.985 -5.942 50 1HE2 GLN 7 HE22 GLN 7 -1.344 -2.516 -8.108 51 2HE2 GLN 7 HE21 GLN 7 -2.236 -2.089 -9.559 52 H ALA 8 H ALA 8 -3.364 -2.291 -3.365 53 HA ALA 8 HA ALA 8 -0.550 -1.746 -3.041 54 1HB ALA 8 HB1 ALA 8 -2.045 0.052 -3.198 55 2HB ALA 8 HB2 ALA 8 -2.993 -0.470 -1.781 56 3HB ALA 8 HB3 ALA 8 -1.314 0.082 -1.583 57 H ILE 9 H ILE 9 -3.137 -2.801 -0.699 58 HA ILE 9 HA ILE 9 -1.249 -3.212 1.444 59 HB ILE 9 HB ILE 9 -2.927 -4.562 2.542 60 1HG1 ILE 9 HG12 ILE 9 -4.545 -4.350 0.019 61 2HG1 ILE 9 HG13 ILE 9 -3.896 -5.832 0.754 62 1HG2 ILE 9 HG21 ILE 9 -4.152 -2.080 1.298 63 2HG2 ILE 9 HG22 ILE 9 -4.511 -2.783 2.891 64 3HG2 ILE 9 HG23 ILE 9 -2.931 -2.076 2.591 65 1HD1 ILE 9 HD11 ILE 9 -6.091 -4.062 1.888 66 2HD1 ILE 9 HD12 ILE 9 -6.214 -5.723 1.300 67 3HD1 ILE 9 HD13 ILE 9 -5.306 -5.385 2.787 68 H GLY 10 H GLY 10 -2.480 -5.316 -1.150 69 1HA GLY 10 HA2 GLY 10 -1.106 -7.683 -0.809 70 2HA GLY 10 HA3 GLY 10 -1.445 -6.910 -2.363 71 H LEU 11 H LEU 11 0.187 -4.610 -2.205 72 HA LEU 11 HA LEU 11 2.716 -5.628 -2.920 73 1HB LEU 11 HB2 LEU 11 1.534 -3.378 -3.519 74 2HB LEU 11 HB3 LEU 11 2.198 -2.784 -2.002 75 HG LEU 11 HG LEU 11 3.597 -2.045 -3.742 76 1HD1 LEU 11 HD11 LEU 11 5.146 -4.342 -2.589 77 2HD1 LEU 11 HD12 LEU 11 5.726 -2.767 -3.151 78 3HD1 LEU 11 HD13 LEU 11 4.732 -2.855 -1.683 79 1HD2 LEU 11 HD21 LEU 11 3.880 -4.886 -4.755 80 2HD2 LEU 11 HD22 LEU 11 2.887 -3.595 -5.477 81 3HD2 LEU 11 HD23 LEU 11 4.650 -3.423 -5.408 82 H LEU 12 H LEU 12 1.800 -3.724 0.005 83 HA LEU 12 HA LEU 12 4.273 -3.883 1.376 84 1HB LEU 12 HB2 LEU 12 1.380 -3.727 2.349 85 2HB LEU 12 HB3 LEU 12 2.737 -3.841 3.468 86 HG LEU 12 HG LEU 12 3.740 -1.806 2.549 87 1HD1 LEU 12 HD11 LEU 12 2.744 -1.729 0.281 88 2HD1 LEU 12 HD12 LEU 12 1.126 -1.525 1.004 89 3HD1 LEU 12 HD13 LEU 12 2.353 -0.262 1.176 90 1HD2 LEU 12 HD21 LEU 12 0.882 -1.549 3.569 91 2HD2 LEU 12 HD22 LEU 12 2.360 -1.680 4.549 92 3HD2 LEU 12 HD23 LEU 12 2.084 -0.242 3.566 93 H ILE 13 H ILE 13 1.513 -6.143 1.410 94 HA ILE 13 HA ILE 13 2.649 -8.016 3.251 95 HB ILE 13 HB ILE 13 0.569 -8.302 1.048 96 1HG1 ILE 13 HG12 ILE 13 0.129 -8.227 4.062 97 2HG1 ILE 13 HG13 ILE 13 0.185 -6.743 3.119 98 1HG2 ILE 13 HG21 ILE 13 -0.164 -10.369 2.099 99 2HG2 ILE 13 HG22 ILE 13 1.516 -10.551 1.613 100 3HG2 ILE 13 HG23 ILE 13 1.107 -10.257 3.319 101 1HD1 ILE 13 HD11 ILE 13 -1.647 -7.734 1.633 102 2HD1 ILE 13 HD12 ILE 13 -1.844 -8.977 2.891 103 3HD1 ILE 13 HD13 ILE 13 -2.090 -7.262 3.277 104 H GLY 14 H GLY 14 2.522 -8.109 -0.342 105 1HA GLY 14 HA2 GLY 14 4.002 -10.387 -0.845 106 2HA GLY 14 HA3 GLY 14 3.972 -8.949 -1.883 107 H ILE 15 H ILE 15 5.268 -7.024 -0.411 108 HA ILE 15 HA ILE 15 8.019 -7.668 -0.684 109 HB ILE 15 HB ILE 15 6.442 -5.409 0.520 110 1HG1 ILE 15 HG12 ILE 15 8.707 -5.618 -1.523 111 2HG1 ILE 15 HG13 ILE 15 6.982 -5.623 -1.918 112 1HG2 ILE 15 HG21 ILE 15 9.437 -5.736 0.867 113 2HG2 ILE 15 HG22 ILE 15 8.503 -4.264 1.233 114 3HG2 ILE 15 HG23 ILE 15 8.219 -5.714 2.165 115 1HD1 ILE 15 HD11 ILE 15 7.802 -3.405 -2.330 116 2HD1 ILE 15 HD12 ILE 15 6.843 -3.317 -0.837 117 3HD1 ILE 15 HD13 ILE 15 8.612 -3.318 -0.767 118 H PHE 16 H PHE 16 6.049 -7.346 2.334 119 HA PHE 16 HA PHE 16 8.115 -8.086 4.071 120 1HB PHE 16 HB2 PHE 16 5.866 -7.199 4.711 121 2HB PHE 16 HB3 PHE 16 5.151 -8.761 4.365 122 HD1 PHE 16 HD1 PHE 16 7.297 -6.850 6.681 123 HD2 PHE 16 HD2 PHE 16 5.723 -10.757 5.788 124 HE1 PHE 16 HE1 PHE 16 7.757 -7.572 9.013 125 HE2 PHE 16 HE2 PHE 16 6.319 -11.518 8.044 126 HZ PHE 16 HZ PHE 16 7.195 -9.870 9.718 127 H HIS 17 H HIS 17 5.702 -10.206 2.519 128 HA HIS 17 HA HIS 17 6.737 -12.545 3.819 129 1HB HIS 17 HB2 HIS 17 4.580 -12.098 1.754 130 2HB HIS 17 HB3 HIS 17 5.085 -13.713 2.279 131 HD1 HIS 17 HD1 HIS 17 4.843 -14.286 4.919 132 HD2 HIS 17 HD2 HIS 17 3.334 -10.564 3.701 133 HE1 HIS 17 HE1 HIS 17 3.576 -13.306 6.901 134 H LYS 18 H LYS 18 7.556 -11.043 0.674 135 HA LYS 18 HA LYS 18 8.939 -13.493 -0.126 136 1HB LYS 18 HB2 LYS 18 9.861 -12.410 -1.917 137 2HB LYS 18 HB3 LYS 18 8.203 -11.817 -1.780 138 1HG LYS 18 HG2 LYS 18 9.066 -9.719 -0.791 139 2HG LYS 18 HG3 LYS 18 10.732 -10.317 -0.932 140 1HD LYS 18 HD2 LYS 18 10.357 -10.537 -3.423 141 2HD LYS 18 HD3 LYS 18 8.765 -9.780 -3.200 142 1HE LYS 18 HE2 LYS 18 9.907 -7.778 -2.191 143 2HE LYS 18 HE3 LYS 18 11.477 -8.550 -2.505 144 1HZ LYS 18 HZ1 LYS 18 10.912 -6.989 -4.182 145 2HZ LYS 18 HZ2 LYS 18 10.958 -8.504 -4.831 146 3HZ LYS 18 HZ3 LYS 18 9.507 -7.778 -4.536 147 H TYR 19 H TYR 19 9.874 -10.490 1.640 148 HA TYR 19 HA TYR 19 12.631 -11.290 1.895 149 1HB TYR 19 HB2 TYR 19 10.875 -9.280 3.304 150 2HB TYR 19 HB3 TYR 19 12.503 -9.611 3.879 151 HD1 TYR 19 HD1 TYR 19 10.627 -7.696 1.495 152 HD2 TYR 19 HD2 TYR 19 14.496 -9.357 2.305 153 HE1 TYR 19 HE1 TYR 19 11.445 -6.746 -0.607 154 HE2 TYR 19 HE2 TYR 19 15.387 -8.228 0.292 155 HH TYR 19 HH TYR 19 13.237 -6.574 -2.072 156 H SER 20 H SER 20 9.806 -11.740 4.048 157 HA SER 20 HA SER 20 11.134 -13.279 6.042 158 1HB SER 20 HB2 SER 20 8.731 -12.395 6.093 159 2HB SER 20 HB3 SER 20 8.302 -13.731 5.014 160 HG SER 20 HG SER 20 9.261 -13.844 7.684 161 H GLY 21 H GLY 21 9.466 -14.295 3.029 162 1HA GLY 21 HA2 GLY 21 9.849 -16.982 2.844 163 2HA GLY 21 HA3 GLY 21 9.956 -15.867 1.480 164 H LYS 22 H LYS 22 12.245 -14.523 1.845 165 HA LYS 22 HA LYS 22 14.277 -16.127 0.923 166 1HB LYS 22 HB2 LYS 22 14.062 -13.564 1.078 167 2HB LYS 22 HB3 LYS 22 14.817 -13.715 2.677 168 1HG LYS 22 HG2 LYS 22 16.723 -14.966 1.529 169 2HG LYS 22 HG3 LYS 22 15.984 -14.542 -0.019 170 1HD LYS 22 HD2 LYS 22 17.103 -12.683 2.124 171 2HD LYS 22 HD3 LYS 22 17.758 -12.952 0.507 172 1HE LYS 22 HE2 LYS 22 15.143 -11.536 1.215 173 2HE LYS 22 HE3 LYS 22 16.622 -10.792 0.606 174 1HZ LYS 22 HZ1 LYS 22 14.950 -12.710 -0.855 175 2HZ LYS 22 HZ2 LYS 22 15.024 -11.085 -1.120 176 3HZ LYS 22 HZ3 LYS 22 16.341 -12.030 -1.424 177 H GLU 23 H GLU 23 13.368 -15.646 4.319 178 HA GLU 23 HA GLU 23 15.472 -17.586 5.180 179 1HB GLU 23 HB2 GLU 23 15.514 -16.365 7.332 180 2HB GLU 23 HB3 GLU 23 16.106 -15.406 5.968 181 1HG GLU 23 HG2 GLU 23 13.957 -14.198 5.831 182 2HG GLU 23 HG3 GLU 23 13.295 -15.191 7.142 183 H GLY 24 H GLY 24 12.700 -18.061 4.205 184 1HA GLY 24 HA2 GLY 24 11.247 -19.793 4.835 185 2HA GLY 24 HA3 GLY 24 11.765 -19.672 6.519 186 H ASP 25 H ASP 25 9.342 -18.815 4.278 187 HA ASP 25 HA ASP 25 8.488 -16.310 5.178 188 1HB ASP 25 HB2 ASP 25 7.616 -17.292 3.105 189 2HB ASP 25 HB3 ASP 25 6.810 -18.572 4.033 190 H LYS 26 H LYS 26 7.657 -15.608 7.016 191 HA LYS 26 HA LYS 26 5.699 -17.201 8.549 192 1HB LYS 26 HB2 LYS 26 8.155 -15.801 9.707 193 2HB LYS 26 HB3 LYS 26 6.809 -16.454 10.663 194 1HG LYS 26 HG2 LYS 26 7.341 -18.742 9.843 195 2HG LYS 26 HG3 LYS 26 8.667 -18.082 8.882 196 1HD LYS 26 HD2 LYS 26 9.602 -19.017 10.858 197 2HD LYS 26 HD3 LYS 26 9.806 -17.262 10.899 198 1HE LYS 26 HE2 LYS 26 7.932 -17.058 12.507 199 2HE LYS 26 HE3 LYS 26 7.605 -18.798 12.372 200 1HZ LYS 26 HZ1 LYS 26 9.770 -19.195 13.296 201 2HZ LYS 26 HZ2 LYS 26 10.065 -17.577 13.406 202 3HZ LYS 26 HZ3 LYS 26 8.869 -18.259 14.310 203 H HIS 27 H HIS 27 4.981 -15.404 10.388 204 HA HIS 27 HA HIS 27 4.281 -12.909 8.920 205 1HB HIS 27 HB2 HIS 27 3.431 -13.865 11.664 206 2HB HIS 27 HB3 HIS 27 2.765 -12.504 10.754 207 HD1 HIS 27 HD1 HIS 27 2.963 -15.034 8.167 208 HD2 HIS 27 HD2 HIS 27 0.609 -14.411 11.606 209 HE1 HIS 27 HE1 HIS 27 0.887 -16.473 7.901 210 H THR 28 H THR 28 7.070 -13.606 9.829 211 HA THR 28 HA THR 28 7.736 -11.215 11.409 212 HB THR 28 HB THR 28 9.266 -12.767 12.733 213 HG1 THR 28 HG1 THR 28 8.889 -14.559 11.271 214 1HG2 THR 28 HG21 THR 28 7.575 -13.424 14.366 215 2HG2 THR 28 HG22 THR 28 7.195 -11.806 13.739 216 3HG2 THR 28 HG23 THR 28 6.280 -13.224 13.173 217 H LEU 29 H LEU 29 9.772 -10.421 10.805 218 HA LEU 29 HA LEU 29 11.589 -12.305 9.474 219 1HB LEU 29 HB2 LEU 29 12.094 -11.020 7.521 220 2HB LEU 29 HB3 LEU 29 10.396 -11.457 7.587 221 HG LEU 29 HG LEU 29 10.067 -9.017 8.566 222 1HD1 LEU 29 HD11 LEU 29 12.633 -8.744 6.925 223 2HD1 LEU 29 HD12 LEU 29 11.636 -7.413 7.539 224 3HD1 LEU 29 HD13 LEU 29 12.515 -8.449 8.676 225 1HD2 LEU 29 HD21 LEU 29 9.801 -8.218 6.206 226 2HD2 LEU 29 HD22 LEU 29 10.711 -9.631 5.644 227 3HD2 LEU 29 HD23 LEU 29 9.141 -9.846 6.439 228 H SER 30 H SER 30 13.786 -11.758 9.551 229 HA SER 30 HA SER 30 14.312 -10.617 12.080 230 1HB SER 30 HB2 SER 30 16.250 -11.627 9.972 231 2HB SER 30 HB3 SER 30 16.569 -11.462 11.714 232 HG SER 30 HG SER 30 14.933 -12.988 12.094 233 H LYS 31 H LYS 31 15.903 -9.035 12.652 234 HA LYS 31 HA LYS 31 15.644 -6.485 11.763 235 1HB LYS 31 HB2 LYS 31 17.908 -8.003 13.095 236 2HB LYS 31 HB3 LYS 31 18.112 -6.295 12.719 237 1HG LYS 31 HG2 LYS 31 16.263 -5.635 14.058 238 2HG LYS 31 HG3 LYS 31 15.687 -7.289 14.249 239 1HD LYS 31 HD2 LYS 31 16.749 -6.588 16.302 240 2HD LYS 31 HD3 LYS 31 17.732 -7.861 15.553 241 1HE LYS 31 HE2 LYS 31 19.319 -6.168 14.704 242 2HE LYS 31 HE3 LYS 31 18.290 -4.872 15.344 243 1HZ LYS 31 HZ1 LYS 31 19.634 -6.924 16.948 244 2HZ LYS 31 HZ2 LYS 31 20.109 -5.356 16.784 245 3HZ LYS 31 HZ3 LYS 31 18.685 -5.708 17.531 246 H LYS 32 H LYS 32 18.303 -8.619 10.739 247 HA LYS 32 HA LYS 32 19.308 -6.617 8.872 248 1HB LYS 32 HB2 LYS 32 20.864 -8.008 9.869 249 2HB LYS 32 HB3 LYS 32 20.096 -9.511 9.306 250 1HG LYS 32 HG2 LYS 32 21.067 -7.416 7.337 251 2HG LYS 32 HG3 LYS 32 22.229 -8.510 8.083 252 1HD LYS 32 HD2 LYS 32 21.409 -10.415 7.043 253 2HD LYS 32 HD3 LYS 32 19.797 -9.756 6.784 254 1HE LYS 32 HE2 LYS 32 20.710 -8.141 5.118 255 2HE LYS 32 HE3 LYS 32 22.312 -8.881 5.301 256 1HZ LYS 32 HZ1 LYS 32 19.877 -10.282 4.434 257 2HZ LYS 32 HZ2 LYS 32 21.047 -9.705 3.431 258 3HZ LYS 32 HZ3 LYS 32 21.399 -10.920 4.497 259 H GLU 33 H GLU 33 16.962 -9.242 8.606 260 HA GLU 33 HA GLU 33 16.982 -9.323 5.715 261 1HB GLU 33 HB2 GLU 33 16.111 -11.155 7.261 262 2HB GLU 33 HB3 GLU 33 14.717 -10.114 7.599 263 1HG GLU 33 HG2 GLU 33 14.061 -11.636 5.876 264 2HG GLU 33 HG3 GLU 33 14.261 -10.060 5.115 265 H LEU 34 H LEU 34 15.200 -7.573 8.257 266 HA LEU 34 HA LEU 34 13.548 -6.008 6.566 267 1HB LEU 34 HB2 LEU 34 13.091 -6.089 8.891 268 2HB LEU 34 HB3 LEU 34 14.682 -5.543 9.346 269 HG LEU 34 HG LEU 34 12.915 -3.896 9.666 270 1HD1 LEU 34 HD11 LEU 34 14.824 -2.735 7.636 271 2HD1 LEU 34 HD12 LEU 34 14.192 -2.023 9.119 272 3HD1 LEU 34 HD13 LEU 34 15.393 -3.312 9.206 273 1HD2 LEU 34 HD21 LEU 34 11.930 -2.701 7.704 274 2HD2 LEU 34 HD22 LEU 34 12.708 -3.843 6.621 275 3HD2 LEU 34 HD23 LEU 34 11.480 -4.413 7.761 276 H LYS 35 H LYS 35 16.906 -5.330 7.846 277 HA LYS 35 HA LYS 35 17.217 -2.918 6.402 278 1HB LYS 35 HB2 LYS 35 19.366 -5.011 6.901 279 2HB LYS 35 HB3 LYS 35 19.586 -3.383 6.271 280 1HG LYS 35 HG2 LYS 35 18.555 -2.480 8.425 281 2HG LYS 35 HG3 LYS 35 18.584 -4.141 9.016 282 1HD LYS 35 HD2 LYS 35 20.584 -3.349 9.848 283 2HD LYS 35 HD3 LYS 35 21.137 -4.109 8.363 284 1HE LYS 35 HE2 LYS 35 20.574 -1.122 8.779 285 2HE LYS 35 HE3 LYS 35 22.172 -1.896 8.819 286 1HZ LYS 35 HZ1 LYS 35 21.844 -2.514 6.524 287 2HZ LYS 35 HZ2 LYS 35 20.435 -1.657 6.488 288 3HZ LYS 35 HZ3 LYS 35 21.858 -0.885 6.759 289 H GLU 36 H GLU 36 17.721 -6.275 5.229 290 HA GLU 36 HA GLU 36 18.627 -5.582 2.642 291 1HB GLU 36 HB2 GLU 36 18.533 -7.906 3.802 292 2HB GLU 36 HB3 GLU 36 16.863 -7.994 3.239 293 1HG GLU 36 HG2 GLU 36 18.231 -9.141 1.650 294 2HG GLU 36 HG3 GLU 36 17.695 -7.641 0.880 295 H LEU 37 H LEU 37 15.315 -6.186 3.846 296 HA LEU 37 HA LEU 37 13.861 -5.698 1.502 297 1HB LEU 37 HB2 LEU 37 12.921 -6.607 3.595 298 2HB LEU 37 HB3 LEU 37 13.169 -5.097 4.432 299 HG LEU 37 HG LEU 37 11.281 -5.281 2.095 300 1HD1 LEU 37 HD11 LEU 37 9.507 -5.506 3.877 301 2HD1 LEU 37 HD12 LEU 37 10.583 -6.904 3.825 302 3HD1 LEU 37 HD13 LEU 37 10.780 -5.671 5.091 303 1HD2 LEU 37 HD21 LEU 37 11.563 -3.300 4.410 304 2HD2 LEU 37 HD22 LEU 37 11.763 -2.944 2.677 305 3HD2 LEU 37 HD23 LEU 37 10.182 -3.360 3.304 306 H ILE 38 H ILE 38 14.797 -3.304 3.993 307 HA ILE 38 HA ILE 38 13.642 -1.140 2.521 308 HB ILE 38 HB ILE 38 15.910 -1.128 4.552 309 1HG1 ILE 38 HG12 ILE 38 12.890 -0.664 4.809 310 2HG1 ILE 38 HG13 ILE 38 13.752 -2.103 5.360 311 1HG2 ILE 38 HG21 ILE 38 15.825 0.984 3.150 312 2HG2 ILE 38 HG22 ILE 38 14.127 1.178 3.638 313 3HG2 ILE 38 HG23 ILE 38 15.424 1.262 4.832 314 1HD1 ILE 38 HD11 ILE 38 15.184 -0.606 6.815 315 2HD1 ILE 38 HD12 ILE 38 14.031 0.695 6.384 316 3HD1 ILE 38 HD13 ILE 38 13.455 -0.733 7.259 317 H GLN 39 H GLN 39 17.086 -2.218 2.720 318 HA GLN 39 HA GLN 39 18.038 -0.214 0.975 319 1HB GLN 39 HB2 GLN 39 19.088 -2.987 1.603 320 2HB GLN 39 HB3 GLN 39 19.990 -1.809 0.638 321 1HG GLN 39 HG2 GLN 39 20.115 -0.223 2.434 322 2HG GLN 39 HG3 GLN 39 18.976 -1.126 3.433 323 1HE2 GLN 39 HE22 GLN 39 19.620 -3.482 3.757 324 2HE2 GLN 39 HE21 GLN 39 21.304 -3.788 4.212 325 H LYS 40 H LYS 40 16.541 -3.393 0.162 326 HA LYS 40 HA LYS 40 17.194 -2.989 -2.652 327 1HB LYS 40 HB2 LYS 40 16.956 -5.235 -1.608 328 2HB LYS 40 HB3 LYS 40 15.257 -4.901 -1.306 329 1HG LYS 40 HG2 LYS 40 15.576 -6.306 -3.307 330 2HG LYS 40 HG3 LYS 40 14.781 -4.788 -3.699 331 1HD LYS 40 HD2 LYS 40 16.477 -5.474 -5.375 332 2HD LYS 40 HD3 LYS 40 16.806 -3.887 -4.695 333 1HE LYS 40 HE2 LYS 40 18.859 -5.260 -4.937 334 2HE LYS 40 HE3 LYS 40 18.576 -4.844 -3.246 335 1HZ LYS 40 HZ1 LYS 40 17.889 -7.405 -4.514 336 2HZ LYS 40 HZ2 LYS 40 19.173 -7.129 -3.516 337 3HZ LYS 40 HZ3 LYS 40 17.637 -7.017 -2.930 338 H GLU 41 H GLU 41 14.143 -2.870 -0.734 339 HA GLU 41 HA GLU 41 12.622 -2.129 -3.083 340 1HB GLU 41 HB2 GLU 41 11.797 -2.127 -0.153 341 2HB GLU 41 HB3 GLU 41 10.719 -2.044 -1.549 342 1HG GLU 41 HG2 GLU 41 12.543 -4.394 -0.832 343 2HG GLU 41 HG3 GLU 41 10.803 -4.311 -0.589 344 H LEU 42 H LEU 42 13.703 -0.369 -0.172 345 HA LEU 42 HA LEU 42 12.794 2.235 -1.359 346 1HB LEU 42 HB2 LEU 42 13.471 1.468 1.495 347 2HB LEU 42 HB3 LEU 42 13.117 3.109 0.940 348 HG LEU 42 HG LEU 42 11.175 0.753 0.872 349 1HD1 LEU 42 HD11 LEU 42 11.667 1.549 3.154 350 2HD1 LEU 42 HD12 LEU 42 11.311 3.220 2.663 351 3HD1 LEU 42 HD13 LEU 42 10.022 2.002 2.683 352 1HD2 LEU 42 HD21 LEU 42 10.824 3.696 0.130 353 2HD2 LEU 42 HD22 LEU 42 10.598 2.291 -0.937 354 3HD2 LEU 42 HD23 LEU 42 9.478 2.574 0.394 355 H THR 43 H THR 43 14.610 1.730 -2.848 356 HA THR 43 HA THR 43 17.193 1.324 -1.996 357 HB THR 43 HB THR 43 16.533 2.644 -4.637 358 HG1 THR 43 HG1 THR 43 15.714 0.024 -3.914 359 1HG2 THR 43 HG21 THR 43 17.985 0.865 -5.509 360 2HG2 THR 43 HG22 THR 43 18.827 1.761 -4.229 361 3HG2 THR 43 HG23 THR 43 18.140 0.155 -3.887 362 H ILE 44 H ILE 44 17.282 3.032 -0.253 363 HA ILE 44 HA ILE 44 17.514 5.737 -0.748 364 HB ILE 44 HB ILE 44 18.604 6.021 1.292 365 1HG1 ILE 44 HG12 ILE 44 20.463 4.462 1.189 366 2HG1 ILE 44 HG13 ILE 44 19.578 4.339 2.699 367 1HG2 ILE 44 HG21 ILE 44 16.243 5.314 1.319 368 2HG2 ILE 44 HG22 ILE 44 16.763 3.673 1.745 369 3HG2 ILE 44 HG23 ILE 44 17.130 5.025 2.821 370 1HD1 ILE 44 HD11 ILE 44 19.426 2.364 0.381 371 2HD1 ILE 44 HD12 ILE 44 20.245 2.150 1.931 372 3HD1 ILE 44 HD13 ILE 44 18.480 2.246 1.887 373 H GLY 45 H GLY 45 19.809 3.388 -1.766 374 1HA GLY 45 HA2 GLY 45 21.493 3.604 -3.270 375 2HA GLY 45 HA3 GLY 45 21.088 5.315 -3.420 376 H SER 46 H SER 46 21.818 6.634 -1.370 377 HA SER 46 HA SER 46 24.733 6.370 -1.287 378 1HB SER 46 HB2 SER 46 22.885 8.329 0.140 379 2HB SER 46 HB3 SER 46 24.652 8.404 0.085 380 HG SER 46 HG SER 46 22.945 8.401 -2.195 381 H LYS 47 H LYS 47 24.919 4.302 -0.347 382 HA LYS 47 HA LYS 47 23.780 3.358 1.943 383 1HB LYS 47 HB2 LYS 47 26.638 2.755 1.100 384 2HB LYS 47 HB3 LYS 47 25.598 1.738 2.095 385 1HG LYS 47 HG2 LYS 47 25.310 2.358 -0.870 386 2HG LYS 47 HG3 LYS 47 25.661 0.816 -0.117 387 1HD LYS 47 HD2 LYS 47 23.019 2.345 -0.015 388 2HD LYS 47 HD3 LYS 47 23.361 0.882 -0.922 389 1HE LYS 47 HE2 LYS 47 23.267 1.102 2.131 390 2HE LYS 47 HE3 LYS 47 22.061 0.366 1.075 391 1HZ LYS 47 HZ1 LYS 47 24.814 -0.567 1.436 392 2HZ LYS 47 HZ2 LYS 47 23.439 -1.251 2.045 393 3HZ LYS 47 HZ3 LYS 47 23.703 -1.240 0.415 394 H LEU 48 H LEU 48 26.061 5.926 2.002 395 HA LEU 48 HA LEU 48 27.066 5.735 4.654 396 1HB LEU 48 HB2 LEU 48 26.104 8.203 3.150 397 2HB LEU 48 HB3 LEU 48 27.180 8.192 4.551 398 HG LEU 48 HG LEU 48 27.829 7.035 1.793 399 1HD1 LEU 48 HD11 LEU 48 28.866 9.508 3.237 400 2HD1 LEU 48 HD12 LEU 48 29.400 8.916 1.651 401 3HD1 LEU 48 HD13 LEU 48 27.740 9.501 1.862 402 1HD2 LEU 48 HD21 LEU 48 30.151 6.846 2.708 403 2HD2 LEU 48 HD22 LEU 48 29.529 7.247 4.322 404 3HD2 LEU 48 HD23 LEU 48 29.022 5.748 3.508 405 H GLN 49 H GLN 49 23.813 6.306 3.472 406 HA GLN 49 HA GLN 49 22.704 7.339 5.915 407 1HB GLN 49 HB2 GLN 49 21.496 5.862 3.562 408 2HB GLN 49 HB3 GLN 49 20.532 6.575 4.857 409 1HG GLN 49 HG2 GLN 49 21.176 8.805 4.332 410 2HG GLN 49 HG3 GLN 49 22.488 8.281 3.273 411 1HE2 GLN 49 HE22 GLN 49 21.732 6.706 1.518 412 2HE2 GLN 49 HE21 GLN 49 20.342 7.235 0.553 413 H ASP 50 H ASP 50 24.100 4.274 5.392 414 HA ASP 50 HA ASP 50 22.419 2.411 6.460 415 1HB ASP 50 HB2 ASP 50 24.363 1.231 7.299 416 2HB ASP 50 HB3 ASP 50 24.637 1.842 5.666 417 H ALA 51 H ALA 51 24.339 4.727 8.352 418 HA ALA 51 HA ALA 51 23.630 4.036 10.968 419 1HB ALA 51 HB1 ALA 51 25.215 5.795 10.368 420 2HB ALA 51 HB2 ALA 51 23.895 6.814 9.754 421 3HB ALA 51 HB3 ALA 51 23.982 6.418 11.488 422 H GLU 52 H GLU 52 21.727 5.961 8.621 423 HA GLU 52 HA GLU 52 19.555 6.598 10.417 424 1HB GLU 52 HB2 GLU 52 19.339 6.381 7.387 425 2HB GLU 52 HB3 GLU 52 18.396 7.366 8.501 426 1HG GLU 52 HG2 GLU 52 20.514 8.694 8.985 427 2HG GLU 52 HG3 GLU 52 21.306 7.786 7.680 428 H ILE 53 H ILE 53 20.219 4.122 7.923 429 HA ILE 53 HA ILE 53 17.737 2.771 8.152 430 HB ILE 53 HB ILE 53 20.380 1.459 7.438 431 1HG1 ILE 53 HG12 ILE 53 20.087 3.368 5.949 432 2HG1 ILE 53 HG13 ILE 53 19.774 1.874 5.087 433 1HG2 ILE 53 HG21 ILE 53 17.484 0.691 6.893 434 2HG2 ILE 53 HG22 ILE 53 18.893 -0.076 6.132 435 3HG2 ILE 53 HG23 ILE 53 18.655 -0.180 7.879 436 1HD1 ILE 53 HD11 ILE 53 17.333 2.257 5.306 437 2HD1 ILE 53 HD12 ILE 53 17.641 3.783 6.164 438 3HD1 ILE 53 HD13 ILE 53 18.148 3.586 4.480 439 H VAL 54 H VAL 54 20.755 2.259 10.095 440 HA VAL 54 HA VAL 54 19.431 0.118 11.517 441 HB VAL 54 HB VAL 54 21.253 0.180 13.154 442 1HG1 VAL 54 HG11 VAL 54 22.806 -0.910 11.632 443 2HG1 VAL 54 HG12 VAL 54 21.149 -1.312 11.158 444 3HG1 VAL 54 HG13 VAL 54 22.064 -0.082 10.248 445 1HG2 VAL 54 HG21 VAL 54 22.583 2.135 11.282 446 2HG2 VAL 54 HG22 VAL 54 21.974 2.542 12.904 447 3HG2 VAL 54 HG23 VAL 54 23.290 1.371 12.709 448 H LYS 55 H LYS 55 19.694 3.636 12.182 449 HA LYS 55 HA LYS 55 18.485 3.469 14.772 450 1HB LYS 55 HB2 LYS 55 19.472 5.534 13.988 451 2HB LYS 55 HB3 LYS 55 18.356 5.621 12.621 452 1HG LYS 55 HG2 LYS 55 17.756 7.186 14.411 453 2HG LYS 55 HG3 LYS 55 16.462 6.029 14.086 454 1HD LYS 55 HD2 LYS 55 17.049 4.738 16.106 455 2HD LYS 55 HD3 LYS 55 18.495 5.735 16.350 456 1HE LYS 55 HE2 LYS 55 16.704 6.409 17.878 457 2HE LYS 55 HE3 LYS 55 17.066 7.721 16.745 458 1HZ LYS 55 HZ1 LYS 55 15.153 7.051 15.470 459 2HZ LYS 55 HZ2 LYS 55 14.823 5.826 16.516 460 3HZ LYS 55 HZ3 LYS 55 14.723 7.390 17.022 461 H LEU 56 H LEU 56 17.047 3.858 11.527 462 HA LEU 56 HA LEU 56 14.315 3.705 12.269 463 1HB LEU 56 HB2 LEU 56 14.978 4.569 10.193 464 2HB LEU 56 HB3 LEU 56 15.858 3.115 9.733 465 HG LEU 56 HG LEU 56 12.958 2.685 10.309 466 1HD1 LEU 56 HD11 LEU 56 12.322 3.536 8.037 467 2HD1 LEU 56 HD12 LEU 56 12.823 4.847 9.122 468 3HD1 LEU 56 HD13 LEU 56 13.935 4.252 7.871 469 1HD2 LEU 56 HD21 LEU 56 14.816 1.897 8.045 470 2HD2 LEU 56 HD22 LEU 56 14.488 0.898 9.467 471 3HD2 LEU 56 HD23 LEU 56 13.161 1.283 8.356 472 H MET 57 H MET 57 16.634 1.114 11.404 473 HA MET 57 HA MET 57 14.881 -1.090 11.564 474 1HB MET 57 HB2 MET 57 17.238 -1.191 10.714 475 2HB MET 57 HB3 MET 57 17.783 -0.924 12.380 476 1HG MET 57 HG2 MET 57 16.601 -3.067 13.031 477 2HG MET 57 HG3 MET 57 16.327 -3.344 11.314 478 1HE MET 57 HE1 MET 57 20.436 -3.383 13.448 479 2HE MET 57 HE2 MET 57 19.667 -1.831 13.079 480 3HE MET 57 HE3 MET 57 18.888 -2.950 14.213 481 H ASP 58 H ASP 58 16.876 0.517 14.130 482 HA ASP 58 HA ASP 58 16.035 -1.108 16.281 483 1HB ASP 58 HB2 ASP 58 17.878 0.514 16.431 484 2HB ASP 58 HB3 ASP 58 16.716 1.849 16.402 485 H ASP 59 H ASP 59 14.577 1.919 14.995 486 HA ASP 59 HA ASP 59 12.381 2.005 16.779 487 1HB ASP 59 HB2 ASP 59 12.369 2.892 13.866 488 2HB ASP 59 HB3 ASP 59 11.212 3.348 15.118 489 H LEU 60 H LEU 60 12.573 0.301 13.626 490 HA LEU 60 HA LEU 60 9.956 -0.869 13.757 491 1HB LEU 60 HB2 LEU 60 12.518 -1.434 12.288 492 2HB LEU 60 HB3 LEU 60 11.260 -2.672 12.260 493 HG LEU 60 HG LEU 60 10.556 0.184 11.593 494 1HD1 LEU 60 HD11 LEU 60 11.824 -1.790 9.686 495 2HD1 LEU 60 HD12 LEU 60 11.037 -0.286 9.185 496 3HD1 LEU 60 HD13 LEU 60 12.503 -0.229 10.196 497 1HD2 LEU 60 HD21 LEU 60 9.608 -2.529 10.508 498 2HD2 LEU 60 HD22 LEU 60 8.723 -1.536 11.688 499 3HD2 LEU 60 HD23 LEU 60 8.967 -0.973 10.011 500 H ASP 61 H ASP 61 13.110 -2.389 14.576 501 HA ASP 61 HA ASP 61 11.888 -4.732 15.629 502 1HB ASP 61 HB2 ASP 61 14.013 -5.548 16.144 503 2HB ASP 61 HB3 ASP 61 14.134 -4.684 14.607 504 H ARG 62 H ARG 62 12.346 -1.675 17.182 505 HA ARG 62 HA ARG 62 12.348 -2.349 19.855 506 1HB ARG 62 HB2 ARG 62 12.139 -0.080 18.808 507 2HB ARG 62 HB3 ARG 62 10.413 -0.381 18.560 508 1HG ARG 62 HG2 ARG 62 10.050 -0.551 20.976 509 2HG ARG 62 HG3 ARG 62 11.795 -0.478 21.287 510 1HD ARG 62 HD2 ARG 62 10.134 1.696 19.980 511 2HD ARG 62 HD3 ARG 62 10.675 1.715 21.670 512 HE ARG 62 HE ARG 62 13.044 1.494 20.653 513 1HH1 ARG 62 HH12 ARG 62 10.502 3.553 19.260 514 2HH1 ARG 62 HH11 ARG 62 11.614 4.351 18.170 515 1HH2 ARG 62 HH21 ARG 62 14.443 2.525 19.163 516 2HH2 ARG 62 HH22 ARG 62 13.810 3.796 18.146 517 H ASN 63 H ASN 63 9.868 -3.010 17.451 518 HA ASN 63 HA ASN 63 7.655 -3.894 18.777 519 1HB ASN 63 HB2 ASN 63 7.950 -4.068 16.374 520 2HB ASN 63 HB3 ASN 63 9.295 -5.191 16.563 521 1HD2 ASN 63 HD22 ASN 63 6.666 -6.011 18.771 522 2HD2 ASN 63 HD21 ASN 63 5.883 -7.128 17.668 523 H LYS 64 H LYS 64 10.695 -5.723 18.448 524 HA LYS 64 HA LYS 64 10.843 -6.885 20.897 525 1HB LYS 64 HB2 LYS 64 10.219 -9.265 20.519 526 2HB LYS 64 HB3 LYS 64 8.825 -8.199 20.589 527 1HG LYS 64 HG2 LYS 64 8.762 -8.185 18.072 528 2HG LYS 64 HG3 LYS 64 10.115 -9.327 18.062 529 1HD LYS 64 HD2 LYS 64 8.777 -11.011 19.223 530 2HD LYS 64 HD3 LYS 64 7.481 -9.839 19.524 531 1HE LYS 64 HE2 LYS 64 6.869 -11.317 17.666 532 2HE LYS 64 HE3 LYS 64 7.026 -9.635 17.129 533 1HZ LYS 64 HZ1 LYS 64 8.066 -11.178 15.625 534 2HZ LYS 64 HZ2 LYS 64 9.185 -10.156 16.270 535 3HZ LYS 64 HZ3 LYS 64 9.080 -11.712 16.811 536 H ASP 65 H ASP 65 12.580 -8.410 21.052 537 HA ASP 65 HA ASP 65 14.739 -7.670 19.485 538 1HB ASP 65 HB2 ASP 65 15.963 -9.447 20.599 539 2HB ASP 65 HB3 ASP 65 14.881 -8.672 21.759 540 H GLN 66 H GLN 66 15.768 -8.496 17.817 541 HA GLN 66 HA GLN 66 16.453 -9.741 16.071 542 1HB GLN 66 HB2 GLN 66 14.826 -12.001 17.285 543 2HB GLN 66 HB3 GLN 66 15.989 -12.141 15.966 544 1HG GLN 66 HG2 GLN 66 17.811 -11.379 17.385 545 2HG GLN 66 HG3 GLN 66 16.709 -11.098 18.741 546 1HE2 GLN 66 HE21 GLN 66 15.646 -12.957 19.758 547 2HE2 GLN 66 HE22 GLN 66 16.379 -14.550 19.592 548 H GLU 67 H GLU 67 12.952 -10.436 16.514 549 HA GLU 67 HA GLU 67 12.636 -10.438 13.539 550 1HB GLU 67 HB2 GLU 67 11.324 -11.936 15.797 551 2HB GLU 67 HB3 GLU 67 10.423 -11.610 14.317 552 1HG GLU 67 HG2 GLU 67 11.478 -13.798 14.170 553 2HG GLU 67 HG3 GLU 67 12.134 -12.708 12.944 554 H VAL 68 H VAL 68 11.697 -8.755 12.641 555 HA VAL 68 HA VAL 68 9.872 -6.957 14.109 556 HB VAL 68 HB VAL 68 10.694 -7.050 11.168 557 1HG1 VAL 68 HG11 VAL 68 9.330 -4.854 12.794 558 2HG1 VAL 68 HG12 VAL 68 9.822 -4.759 11.089 559 3HG1 VAL 68 HG13 VAL 68 8.539 -5.872 11.572 560 1HG2 VAL 68 HG21 VAL 68 12.671 -6.579 12.572 561 2HG2 VAL 68 HG22 VAL 68 12.158 -5.132 11.698 562 3HG2 VAL 68 HG23 VAL 68 11.766 -5.304 13.417 563 H ASN 69 H ASN 69 7.706 -7.492 14.197 564 HA ASN 69 HA ASN 69 6.728 -9.744 12.596 565 1HB ASN 69 HB2 ASN 69 6.144 -9.651 14.979 566 2HB ASN 69 HB3 ASN 69 5.429 -8.049 14.761 567 1HD2 ASN 69 HD21 ASN 69 4.897 -11.510 14.382 568 2HD2 ASN 69 HD22 ASN 69 3.238 -11.361 13.844 569 H PHE 70 H PHE 70 5.054 -9.664 11.179 570 HA PHE 70 HA PHE 70 4.799 -7.757 9.265 571 1HB PHE 70 HB2 PHE 70 3.886 -9.995 9.087 572 2HB PHE 70 HB3 PHE 70 2.731 -9.686 10.384 573 HD1 PHE 70 HD1 PHE 70 0.585 -8.737 9.897 574 HD2 PHE 70 HD2 PHE 70 3.754 -8.542 6.984 575 HE1 PHE 70 HE1 PHE 70 -0.918 -7.540 8.359 576 HE2 PHE 70 HE2 PHE 70 2.240 -7.329 5.428 577 HZ PHE 70 HZ PHE 70 -0.090 -6.810 6.117 578 H GLN 71 H GLN 71 2.628 -7.905 12.148 579 HA GLN 71 HA GLN 71 0.953 -5.778 11.273 580 1HB GLN 71 HB2 GLN 71 0.398 -7.413 13.055 581 2HB GLN 71 HB3 GLN 71 1.599 -6.669 14.117 582 1HG GLN 71 HG2 GLN 71 0.308 -4.499 13.978 583 2HG GLN 71 HG3 GLN 71 -0.874 -5.308 12.938 584 1HE2 GLN 71 HE22 GLN 71 0.730 -5.604 16.162 585 2HE2 GLN 71 HE21 GLN 71 -0.701 -6.243 16.970 586 H GLU 72 H GLU 72 3.916 -5.821 13.265 587 HA GLU 72 HA GLU 72 3.728 -2.980 13.896 588 1HB GLU 72 HB2 GLU 72 5.838 -5.093 14.394 589 2HB GLU 72 HB3 GLU 72 6.135 -3.372 14.685 590 1HG GLU 72 HG2 GLU 72 5.366 -4.303 16.768 591 2HG GLU 72 HG3 GLU 72 4.129 -3.233 16.147 592 H TYR 73 H TYR 73 5.397 -4.972 11.470 593 HA TYR 73 HA TYR 73 6.867 -2.902 10.194 594 1HB TYR 73 HB2 TYR 73 7.376 -4.995 9.439 595 2HB TYR 73 HB3 TYR 73 5.724 -5.542 9.379 596 HD1 TYR 73 HD1 TYR 73 8.341 -3.707 7.533 597 HD2 TYR 73 HD2 TYR 73 4.318 -5.261 7.439 598 HE1 TYR 73 HE1 TYR 73 8.372 -3.673 5.053 599 HE2 TYR 73 HE2 TYR 73 4.316 -5.123 4.980 600 HH TYR 73 HH TYR 73 5.687 -4.966 3.105 601 H ILE 74 H ILE 74 3.444 -3.964 9.510 602 HA ILE 74 HA ILE 74 2.962 -1.861 7.654 603 HB ILE 74 HB ILE 74 0.939 -3.169 9.504 604 1HG1 ILE 74 HG12 ILE 74 2.114 -4.821 8.022 605 2HG1 ILE 74 HG13 ILE 74 0.382 -4.702 7.815 606 1HG2 ILE 74 HG21 ILE 74 -0.070 -1.186 8.673 607 2HG2 ILE 74 HG22 ILE 74 0.651 -1.377 7.064 608 3HG2 ILE 74 HG23 ILE 74 -0.650 -2.448 7.586 609 1HD1 ILE 74 HD11 ILE 74 1.491 -4.925 5.652 610 2HD1 ILE 74 HD12 ILE 74 0.679 -3.370 5.750 611 3HD1 ILE 74 HD13 ILE 74 2.450 -3.468 5.969 612 H THR 75 H THR 75 2.289 -1.962 11.171 613 HA THR 75 HA THR 75 1.189 0.573 11.547 614 HB THR 75 HB THR 75 3.181 -0.821 13.391 615 HG1 THR 75 HG1 THR 75 1.468 -2.201 12.847 616 1HG2 THR 75 HG21 THR 75 2.648 1.493 14.121 617 2HG2 THR 75 HG22 THR 75 0.918 1.094 14.047 618 3HG2 THR 75 HG23 THR 75 1.968 0.268 15.205 619 H PHE 76 H PHE 76 4.660 -0.330 11.593 620 HA PHE 76 HA PHE 76 5.643 2.303 12.039 621 1HB PHE 76 HB2 PHE 76 6.943 0.260 12.493 622 2HB PHE 76 HB3 PHE 76 6.980 -0.093 10.765 623 HD1 PHE 76 HD1 PHE 76 8.452 1.196 9.243 624 HD2 PHE 76 HD2 PHE 76 8.140 2.266 13.417 625 HE1 PHE 76 HE1 PHE 76 10.398 2.671 9.012 626 HE2 PHE 76 HE2 PHE 76 9.961 3.920 13.109 627 HZ PHE 76 HZ PHE 76 11.095 4.133 10.909 628 H LEU 77 H LEU 77 5.076 0.434 8.970 629 HA LEU 77 HA LEU 77 6.095 2.489 7.265 630 1HB LEU 77 HB2 LEU 77 3.948 0.387 6.823 631 2HB LEU 77 HB3 LEU 77 4.486 1.493 5.557 632 HG LEU 77 HG LEU 77 6.393 -0.359 7.066 633 1HD1 LEU 77 HD11 LEU 77 4.824 -1.738 5.824 634 2HD1 LEU 77 HD12 LEU 77 5.035 -0.730 4.363 635 3HD1 LEU 77 HD13 LEU 77 6.388 -1.687 4.987 636 1HD2 LEU 77 HD21 LEU 77 7.594 1.493 6.053 637 2HD2 LEU 77 HD22 LEU 77 7.835 0.064 5.059 638 3HD2 LEU 77 HD23 LEU 77 6.672 1.303 4.529 639 H GLY 78 H GLY 78 2.922 2.134 8.852 640 1HA GLY 78 HA2 GLY 78 1.693 4.458 7.777 641 2HA GLY 78 HA3 GLY 78 1.418 3.812 9.415 642 H ALA 79 H ALA 79 3.791 4.154 10.687 643 HA ALA 79 HA ALA 79 3.873 6.930 11.256 644 1HB ALA 79 HB1 ALA 79 5.864 6.458 12.574 645 2HB ALA 79 HB2 ALA 79 4.664 5.172 12.815 646 3HB ALA 79 HB3 ALA 79 6.082 4.891 11.780 647 H LEU 80 H LEU 80 5.962 4.969 9.138 648 HA LEU 80 HA LEU 80 7.796 6.944 8.398 649 1HB LEU 80 HB2 LEU 80 7.669 4.341 7.875 650 2HB LEU 80 HB3 LEU 80 6.784 4.852 6.446 651 HG LEU 80 HG LEU 80 8.763 6.321 5.855 652 1HD1 LEU 80 HD11 LEU 80 10.039 4.748 8.140 653 2HD1 LEU 80 HD12 LEU 80 10.956 5.644 6.916 654 3HD1 LEU 80 HD13 LEU 80 9.906 6.514 8.035 655 1HD2 LEU 80 HD21 LEU 80 9.255 3.325 6.165 656 2HD2 LEU 80 HD22 LEU 80 8.379 4.099 4.824 657 3HD2 LEU 80 HD23 LEU 80 10.113 4.394 5.042 658 H ALA 81 H ALA 81 4.676 6.043 6.897 659 HA ALA 81 HA ALA 81 4.643 7.970 4.811 660 1HB ALA 81 HB1 ALA 81 3.107 6.145 4.797 661 2HB ALA 81 HB2 ALA 81 2.398 6.628 6.341 662 3HB ALA 81 HB3 ALA 81 2.174 7.659 4.918 663 H MET 82 H MET 82 3.357 8.135 8.156 664 HA MET 82 HA MET 82 2.321 10.753 8.022 665 1HB MET 82 HB2 MET 82 1.894 9.052 9.792 666 2HB MET 82 HB3 MET 82 3.499 9.349 10.462 667 1HG MET 82 HG2 MET 82 1.417 11.537 10.122 668 2HG MET 82 HG3 MET 82 1.525 10.516 11.559 669 1HE MET 82 HE1 MET 82 2.787 13.970 12.854 670 2HE MET 82 HE2 MET 82 1.556 13.707 11.598 671 3HE MET 82 HE3 MET 82 1.582 12.675 13.053 672 H ILE 83 H ILE 83 5.554 9.618 8.925 673 HA ILE 83 HA ILE 83 6.654 12.171 9.596 674 HB ILE 83 HB ILE 83 7.875 9.482 8.908 675 1HG1 ILE 83 HG12 ILE 83 7.847 11.004 11.551 676 2HG1 ILE 83 HG13 ILE 83 6.529 9.933 11.090 677 1HG2 ILE 83 HG21 ILE 83 9.311 12.015 9.813 678 2HG2 ILE 83 HG22 ILE 83 10.035 10.396 9.788 679 3HG2 ILE 83 HG23 ILE 83 9.555 11.152 8.278 680 1HD1 ILE 83 HD11 ILE 83 9.426 9.098 11.497 681 2HD1 ILE 83 HD12 ILE 83 8.025 8.702 12.501 682 3HD1 ILE 83 HD13 ILE 83 8.147 8.040 10.860 683 H TYR 84 H TYR 84 6.786 10.232 6.549 684 HA TYR 84 HA TYR 84 8.296 12.077 4.990 685 1HB TYR 84 HB2 TYR 84 5.922 10.347 4.169 686 2HB TYR 84 HB3 TYR 84 7.006 11.179 3.064 687 HD1 TYR 84 HD1 TYR 84 6.437 8.376 2.712 688 HD2 TYR 84 HD2 TYR 84 9.473 10.227 5.169 689 HE1 TYR 84 HE1 TYR 84 7.978 6.478 2.275 690 HE2 TYR 84 HE2 TYR 84 10.990 8.362 4.703 691 HH TYR 84 HH TYR 84 11.312 6.398 3.540 692 H ASN 85 H ASN 85 4.797 11.892 5.568 693 HA ASN 85 HA ASN 85 3.243 13.397 5.848 694 1HB ASN 85 HB2 ASN 85 5.185 14.454 7.256 695 2HB ASN 85 HB3 ASN 85 5.212 15.693 6.000 696 1HD2 ASN 85 HD22 ASN 85 3.068 13.907 8.233 697 2HD2 ASN 85 HD21 ASN 85 1.796 15.159 8.311 698 H GLU 86 H GLU 86 5.609 14.983 3.675 699 HA GLU 86 HA GLU 86 3.827 16.460 2.054 700 1HB GLU 86 HB2 GLU 86 6.396 15.018 1.265 701 2HB GLU 86 HB3 GLU 86 5.569 16.277 0.331 702 1HG GLU 86 HG2 GLU 86 5.855 17.856 2.267 703 2HG GLU 86 HG3 GLU 86 6.817 16.622 3.102 704 H ALA 87 H ALA 87 4.703 13.027 2.031 705 HA ALA 87 HA ALA 87 3.352 12.132 -0.274 706 1HB ALA 87 HB1 ALA 87 3.218 9.978 0.900 707 2HB ALA 87 HB2 ALA 87 4.809 10.721 1.149 708 3HB ALA 87 HB3 ALA 87 3.597 10.770 2.448 709 H LEU 88 H LEU 88 2.052 12.910 2.984 710 HA LEU 88 HA LEU 88 -0.672 12.099 2.316 711 1HB LEU 88 HB2 LEU 88 0.133 13.990 4.544 712 2HB LEU 88 HB3 LEU 88 -1.306 12.989 4.394 713 HG LEU 88 HG LEU 88 1.535 12.053 4.992 714 1HD1 LEU 88 HD11 LEU 88 -1.059 12.122 6.589 715 2HD1 LEU 88 HD12 LEU 88 0.393 11.269 7.109 716 3HD1 LEU 88 HD13 LEU 88 0.448 13.026 6.912 717 1HD2 LEU 88 HD21 LEU 88 -0.972 10.375 4.606 718 2HD2 LEU 88 HD22 LEU 88 0.521 10.343 3.624 719 3HD2 LEU 88 HD23 LEU 88 0.565 9.805 5.296 720 H LYS 89 H LYS 89 1.156 15.150 2.644 721 HA LYS 89 HA LYS 89 -1.074 16.776 1.670 722 1HB LYS 89 HB2 LYS 89 1.825 17.523 2.113 723 2HB LYS 89 HB3 LYS 89 0.459 18.635 1.965 724 1HG LYS 89 HG2 LYS 89 -0.540 17.690 4.039 725 2HG LYS 89 HG3 LYS 89 0.844 16.603 4.222 726 1HD LYS 89 HD2 LYS 89 0.922 19.642 4.357 727 2HD LYS 89 HD3 LYS 89 1.128 18.475 5.678 728 1HE LYS 89 HE2 LYS 89 3.122 17.539 4.279 729 2HE LYS 89 HE3 LYS 89 3.029 19.069 3.382 730 1HZ LYS 89 HZ1 LYS 89 4.563 19.209 5.169 731 2HZ LYS 89 HZ2 LYS 89 3.278 20.184 5.522 732 3HZ LYS 89 HZ3 LYS 89 3.433 18.710 6.260 733 H GLY 90 H GLY 90 -0.797 14.936 -0.275 734 1HA GLY 90 HA2 GLY 90 -0.325 16.323 -2.680 735 2HA GLY 90 HA3 GLY 90 1.144 15.403 -2.280 736 1H MET 1 H1 MET 1 15.065 0.889 -6.065 737 2H MET 1 H2 MET 1 14.887 1.594 -7.549 738 3H MET 1 H3 MET 1 15.175 -0.028 -7.434 739 HA MET 1 HA MET 1 12.911 0.327 -7.956 740 1HB MET 1 HB2 MET 1 13.402 -0.628 -5.106 741 2HB MET 1 HB3 MET 1 11.860 -0.801 -5.961 742 1HG MET 1 HG2 MET 1 13.042 -2.094 -7.736 743 2HG MET 1 HG3 MET 1 14.529 -2.001 -6.772 744 1HE MET 1 HE1 MET 1 14.738 -4.615 -6.983 745 2HE MET 1 HE2 MET 1 13.469 -5.755 -6.474 746 3HE MET 1 HE3 MET 1 13.206 -4.707 -7.887 747 H ALA 2 H ALA 2 12.596 1.134 -4.553 748 HA ALA 2 HA ALA 2 11.653 2.750 -3.361 749 1HB ALA 2 HB1 ALA 2 13.250 4.284 -4.465 750 2HB ALA 2 HB2 ALA 2 12.046 4.641 -5.717 751 3HB ALA 2 HB3 ALA 2 11.725 5.061 -4.028 752 H SER 3 H SER 3 10.614 3.259 -6.623 753 HA SER 3 HA SER 3 8.108 4.073 -6.548 754 1HB SER 3 HB2 SER 3 8.902 1.935 -8.550 755 2HB SER 3 HB3 SER 3 7.892 3.366 -8.763 756 HG SER 3 HG SER 3 10.723 3.219 -8.386 757 HA PRO 4 HA PRO 4 5.990 -0.245 -6.571 758 1HB PRO 4 HB2 PRO 4 7.203 -2.341 -5.180 759 2HB PRO 4 HB3 PRO 4 7.279 -2.073 -6.941 760 1HG PRO 4 HG2 PRO 4 9.299 -1.209 -4.854 761 2HG PRO 4 HG3 PRO 4 9.605 -2.048 -6.403 762 1HD PRO 4 HD2 PRO 4 9.936 0.583 -6.259 763 2HD PRO 4 HD3 PRO 4 9.065 -0.097 -7.658 764 H LEU 5 H LEU 5 8.025 0.133 -3.563 765 HA LEU 5 HA LEU 5 5.654 -0.374 -1.978 766 1HB LEU 5 HB2 LEU 5 7.853 -0.931 -1.086 767 2HB LEU 5 HB3 LEU 5 8.318 0.777 -1.103 768 HG LEU 5 HG LEU 5 6.593 1.325 0.546 769 1HD1 LEU 5 HD11 LEU 5 4.764 -0.242 0.001 770 2HD1 LEU 5 HD12 LEU 5 5.797 -1.628 0.425 771 3HD1 LEU 5 HD13 LEU 5 5.283 -0.470 1.665 772 1HD2 LEU 5 HD21 LEU 5 7.412 0.119 2.455 773 2HD2 LEU 5 HD22 LEU 5 8.021 -1.202 1.428 774 3HD2 LEU 5 HD23 LEU 5 8.772 0.413 1.350 775 H ASP 6 H ASP 6 7.503 2.547 -2.977 776 HA ASP 6 HA ASP 6 6.121 4.442 -1.438 777 1HB ASP 6 HB2 ASP 6 7.307 4.707 -4.237 778 2HB ASP 6 HB3 ASP 6 6.722 6.066 -3.271 779 H GLN 7 H GLN 7 5.213 3.234 -4.721 780 HA GLN 7 HA GLN 7 2.906 4.925 -4.861 781 1HB GLN 7 HB2 GLN 7 2.238 3.678 -6.773 782 2HB GLN 7 HB3 GLN 7 3.985 3.936 -6.825 783 1HG GLN 7 HG2 GLN 7 4.237 1.570 -5.896 784 2HG GLN 7 HG3 GLN 7 2.519 1.337 -6.166 785 1HE2 GLN 7 HE22 GLN 7 1.759 1.834 -8.495 786 2HE2 GLN 7 HE21 GLN 7 2.870 1.383 -9.777 787 H ALA 8 H ALA 8 3.410 1.649 -3.490 788 HA ALA 8 HA ALA 8 0.614 1.112 -3.135 789 1HB ALA 8 HB1 ALA 8 1.381 -0.588 -1.517 790 2HB ALA 8 HB2 ALA 8 2.090 -0.673 -3.139 791 3HB ALA 8 HB3 ALA 8 3.058 -0.046 -1.776 792 H ILE 9 H ILE 9 3.127 2.340 -0.786 793 HA ILE 9 HA ILE 9 1.185 2.820 1.281 794 HB ILE 9 HB ILE 9 2.802 4.234 2.366 795 1HG1 ILE 9 HG12 ILE 9 4.541 3.941 -0.065 796 2HG1 ILE 9 HG13 ILE 9 3.781 5.443 0.494 797 1HG2 ILE 9 HG21 ILE 9 4.419 2.516 2.812 798 2HG2 ILE 9 HG22 ILE 9 2.866 1.755 2.493 799 3HG2 ILE 9 HG23 ILE 9 4.119 1.759 1.234 800 1HD1 ILE 9 HD11 ILE 9 5.968 3.880 1.922 801 2HD1 ILE 9 HD12 ILE 9 6.055 5.492 1.205 802 3HD1 ILE 9 HD13 ILE 9 5.068 5.226 2.656 803 H GLY 10 H GLY 10 2.436 4.825 -1.378 804 1HA GLY 10 HA2 GLY 10 1.039 7.193 -1.196 805 2HA GLY 10 HA3 GLY 10 1.422 6.342 -2.697 806 H LEU 11 H LEU 11 -0.218 4.044 -2.445 807 HA LEU 11 HA LEU 11 -2.701 5.033 -3.341 808 1HB LEU 11 HB2 LEU 11 -1.516 2.745 -3.732 809 2HB LEU 11 HB3 LEU 11 -2.239 2.253 -2.209 810 HG LEU 11 HG LEU 11 -3.578 1.404 -3.910 811 1HD1 LEU 11 HD11 LEU 11 -5.145 3.830 -3.060 812 2HD1 LEU 11 HD12 LEU 11 -5.739 2.231 -3.533 813 3HD1 LEU 11 HD13 LEU 11 -4.831 2.410 -2.019 814 1HD2 LEU 11 HD21 LEU 11 -4.534 2.644 -5.754 815 2HD2 LEU 11 HD22 LEU 11 -3.746 4.139 -5.207 816 3HD2 LEU 11 HD23 LEU 11 -2.768 2.758 -5.759 817 H LEU 12 H LEU 12 -1.994 3.251 -0.300 818 HA LEU 12 HA LEU 12 -4.484 3.580 0.996 819 1HB LEU 12 HB2 LEU 12 -1.588 3.452 2.040 820 2HB LEU 12 HB3 LEU 12 -2.963 3.597 3.124 821 HG LEU 12 HG LEU 12 -3.897 1.496 2.301 822 1HD1 LEU 12 HD11 LEU 12 -2.438 -0.095 1.060 823 2HD1 LEU 12 HD12 LEU 12 -2.826 1.310 0.066 824 3HD1 LEU 12 HD13 LEU 12 -1.231 1.183 0.852 825 1HD2 LEU 12 HD21 LEU 12 -2.564 1.540 4.337 826 2HD2 LEU 12 HD22 LEU 12 -2.235 0.045 3.460 827 3HD2 LEU 12 HD23 LEU 12 -1.063 1.376 3.400 828 H ILE 13 H ILE 13 -1.633 5.697 1.008 829 HA ILE 13 HA ILE 13 -2.678 7.677 2.750 830 HB ILE 13 HB ILE 13 -0.602 7.673 0.508 831 1HG1 ILE 13 HG12 ILE 13 -0.185 7.984 3.504 832 2HG1 ILE 13 HG13 ILE 13 -0.222 6.412 2.717 833 1HG2 ILE 13 HG21 ILE 13 -1.377 9.974 2.296 834 2HG2 ILE 13 HG22 ILE 13 0.180 9.878 1.425 835 3HG2 ILE 13 HG23 ILE 13 -1.322 9.951 0.523 836 1HD1 ILE 13 HD11 ILE 13 2.063 6.895 2.757 837 2HD1 ILE 13 HD12 ILE 13 1.613 7.361 1.120 838 3HD1 ILE 13 HD13 ILE 13 1.827 8.607 2.366 839 H GLY 14 H GLY 14 -2.600 7.587 -0.820 840 1HA GLY 14 HA2 GLY 14 -3.890 9.995 -1.364 841 2HA GLY 14 HA3 GLY 14 -3.925 8.548 -2.397 842 H ILE 15 H ILE 15 -5.320 6.681 -0.997 843 HA ILE 15 HA ILE 15 -8.029 7.454 -1.351 844 HB ILE 15 HB ILE 15 -6.566 5.129 -0.129 845 1HG1 ILE 15 HG12 ILE 15 -8.769 5.445 -2.225 846 2HG1 ILE 15 HG13 ILE 15 -7.032 5.377 -2.560 847 1HG2 ILE 15 HG21 ILE 15 -8.700 4.063 0.535 848 2HG2 ILE 15 HG22 ILE 15 -8.274 5.451 1.519 849 3HG2 ILE 15 HG23 ILE 15 -9.536 5.617 0.271 850 1HD1 ILE 15 HD11 ILE 15 -8.817 3.139 -1.544 851 2HD1 ILE 15 HD12 ILE 15 -7.878 3.218 -3.042 852 3HD1 ILE 15 HD13 ILE 15 -7.044 3.050 -1.483 853 H PHE 16 H PHE 16 -6.151 7.081 1.699 854 HA PHE 16 HA PHE 16 -8.200 7.879 3.423 855 1HB PHE 16 HB2 PHE 16 -6.008 6.913 4.055 856 2HB PHE 16 HB3 PHE 16 -5.203 8.420 3.691 857 HD1 PHE 16 HD1 PHE 16 -7.596 6.734 5.966 858 HD2 PHE 16 HD2 PHE 16 -5.507 10.401 5.148 859 HE1 PHE 16 HE1 PHE 16 -7.985 7.476 8.308 860 HE2 PHE 16 HE2 PHE 16 -6.077 11.218 7.392 861 HZ PHE 16 HZ PHE 16 -7.160 9.664 9.050 862 H HIS 17 H HIS 17 -5.596 9.966 2.112 863 HA HIS 17 HA HIS 17 -6.624 12.224 3.473 864 1HB HIS 17 HB2 HIS 17 -4.191 11.562 2.445 865 2HB HIS 17 HB3 HIS 17 -4.730 12.717 1.230 866 HD1 HIS 17 HD1 HIS 17 -3.247 14.740 1.925 867 HD2 HIS 17 HD2 HIS 17 -4.928 12.709 5.179 868 HE1 HIS 17 HE1 HIS 17 -2.554 16.019 4.005 869 H LYS 18 H LYS 18 -7.338 10.958 0.237 870 HA LYS 18 HA LYS 18 -8.649 13.309 -0.796 871 1HB LYS 18 HB2 LYS 18 -9.189 10.336 -1.119 872 2HB LYS 18 HB3 LYS 18 -10.140 11.570 -1.945 873 1HG LYS 18 HG2 LYS 18 -8.324 12.308 -3.266 874 2HG LYS 18 HG3 LYS 18 -7.131 11.502 -2.239 875 1HD LYS 18 HD2 LYS 18 -8.077 9.280 -2.880 876 2HD LYS 18 HD3 LYS 18 -9.283 10.080 -3.892 877 1HE LYS 18 HE2 LYS 18 -7.425 9.147 -5.210 878 2HE LYS 18 HE3 LYS 18 -7.522 10.913 -5.391 879 1HZ LYS 18 HZ1 LYS 18 -5.675 9.463 -3.626 880 2HZ LYS 18 HZ2 LYS 18 -5.282 10.147 -5.072 881 3HZ LYS 18 HZ3 LYS 18 -5.740 11.098 -3.809 882 H TYR 19 H TYR 19 -9.887 10.536 1.154 883 HA TYR 19 HA TYR 19 -12.511 11.650 1.482 884 1HB TYR 19 HB2 TYR 19 -10.993 9.451 2.833 885 2HB TYR 19 HB3 TYR 19 -12.578 9.940 3.435 886 HD1 TYR 19 HD1 TYR 19 -10.878 7.990 0.909 887 HD2 TYR 19 HD2 TYR 19 -14.611 9.850 1.938 888 HE1 TYR 19 HE1 TYR 19 -11.852 7.128 -1.174 889 HE2 TYR 19 HE2 TYR 19 -15.675 8.718 -0.005 890 HH TYR 19 HH TYR 19 -13.760 6.953 -2.463 891 H SER 20 H SER 20 -9.647 11.752 3.748 892 HA SER 20 HA SER 20 -10.801 13.422 5.663 893 1HB SER 20 HB2 SER 20 -7.981 13.717 4.545 894 2HB SER 20 HB3 SER 20 -8.562 14.153 6.152 895 HG SER 20 HG SER 20 -8.636 12.128 6.733 896 H GLY 21 H GLY 21 -9.186 14.410 2.617 897 1HA GLY 21 HA2 GLY 21 -9.382 17.178 2.780 898 2HA GLY 21 HA3 GLY 21 -9.368 16.226 1.283 899 H LYS 22 H LYS 22 -11.799 14.809 1.572 900 HA LYS 22 HA LYS 22 -13.716 16.504 0.521 901 1HB LYS 22 HB2 LYS 22 -13.721 13.970 0.637 902 2HB LYS 22 HB3 LYS 22 -14.378 14.114 2.277 903 1HG LYS 22 HG2 LYS 22 -16.294 15.411 1.427 904 2HG LYS 22 HG3 LYS 22 -15.702 15.216 -0.230 905 1HD LYS 22 HD2 LYS 22 -16.497 12.959 1.681 906 2HD LYS 22 HD3 LYS 22 -17.511 13.622 0.390 907 1HE LYS 22 HE2 LYS 22 -15.728 12.947 -1.281 908 2HE LYS 22 HE3 LYS 22 -14.877 12.117 0.037 909 1HZ LYS 22 HZ1 LYS 22 -17.605 11.538 -0.868 910 2HZ LYS 22 HZ2 LYS 22 -16.260 10.639 -1.182 911 3HZ LYS 22 HZ3 LYS 22 -16.817 10.775 0.364 912 H GLU 23 H GLU 23 -13.090 15.854 3.976 913 HA GLU 23 HA GLU 23 -15.236 17.809 4.740 914 1HB GLU 23 HB2 GLU 23 -15.148 16.758 6.949 915 2HB GLU 23 HB3 GLU 23 -15.618 15.633 5.667 916 1HG GLU 23 HG2 GLU 23 -13.340 14.680 5.625 917 2HG GLU 23 HG3 GLU 23 -12.817 15.842 6.847 918 H GLY 24 H GLY 24 -12.355 18.302 3.753 919 1HA GLY 24 HA2 GLY 24 -10.667 19.738 4.207 920 2HA GLY 24 HA3 GLY 24 -11.786 20.566 5.302 921 H ASP 25 H ASP 25 -10.815 17.191 5.834 922 HA ASP 25 HA ASP 25 -9.354 18.026 8.297 923 1HB ASP 25 HB2 ASP 25 -11.283 16.423 8.453 924 2HB ASP 25 HB3 ASP 25 -10.336 15.249 7.524 925 H LYS 26 H LYS 26 -7.313 16.930 8.683 926 HA LYS 26 HA LYS 26 -5.733 16.528 6.161 927 1HB LYS 26 HB2 LYS 26 -4.808 17.340 8.949 928 2HB LYS 26 HB3 LYS 26 -3.784 17.166 7.516 929 1HG LYS 26 HG2 LYS 26 -5.997 19.206 8.017 930 2HG LYS 26 HG3 LYS 26 -4.266 19.512 7.936 931 1HD LYS 26 HD2 LYS 26 -6.082 18.695 5.616 932 2HD LYS 26 HD3 LYS 26 -5.381 20.282 5.914 933 1HE LYS 26 HE2 LYS 26 -3.088 19.342 5.643 934 2HE LYS 26 HE3 LYS 26 -3.789 17.750 5.297 935 1HZ LYS 26 HZ1 LYS 26 -4.238 20.175 3.719 936 2HZ LYS 26 HZ2 LYS 26 -3.256 18.918 3.307 937 3HZ LYS 26 HZ3 LYS 26 -4.885 18.691 3.413 938 H HIS 27 H HIS 27 -4.110 15.416 8.924 939 HA HIS 27 HA HIS 27 -4.157 12.769 7.771 940 1HB HIS 27 HB2 HIS 27 -2.840 13.668 10.344 941 2HB HIS 27 HB3 HIS 27 -2.379 12.311 9.310 942 HD1 HIS 27 HD1 HIS 27 -2.632 14.509 6.625 943 HD2 HIS 27 HD2 HIS 27 -0.308 14.579 10.149 944 HE1 HIS 27 HE1 HIS 27 -0.636 16.028 6.170 945 H THR 28 H THR 28 -6.795 13.300 8.671 946 HA THR 28 HA THR 28 -7.304 11.183 10.546 947 HB THR 28 HB THR 28 -7.724 14.068 11.385 948 HG1 THR 28 HG1 THR 28 -5.772 12.620 11.845 949 1HG2 THR 28 HG21 THR 28 -8.857 13.161 13.377 950 2HG2 THR 28 HG22 THR 28 -9.812 12.867 11.917 951 3HG2 THR 28 HG23 THR 28 -8.864 11.542 12.644 952 H LEU 29 H LEU 29 -9.639 10.667 10.471 953 HA LEU 29 HA LEU 29 -11.157 11.895 8.215 954 1HB LEU 29 HB2 LEU 29 -9.418 10.156 7.555 955 2HB LEU 29 HB3 LEU 29 -10.375 8.950 8.410 956 HG LEU 29 HG LEU 29 -11.275 10.629 6.011 957 1HD1 LEU 29 HD11 LEU 29 -9.399 9.201 5.416 958 2HD1 LEU 29 HD12 LEU 29 -10.135 7.808 6.242 959 3HD1 LEU 29 HD13 LEU 29 -10.879 8.463 4.783 960 1HD2 LEU 29 HD21 LEU 29 -13.222 9.730 7.226 961 2HD2 LEU 29 HD22 LEU 29 -12.980 8.832 5.727 962 3HD2 LEU 29 HD23 LEU 29 -12.469 8.118 7.273 963 H SER 30 H SER 30 -13.379 11.809 8.667 964 HA SER 30 HA SER 30 -14.091 10.925 11.317 965 1HB SER 30 HB2 SER 30 -14.938 12.988 10.255 966 2HB SER 30 HB3 SER 30 -15.939 11.997 9.170 967 HG SER 30 HG SER 30 -16.992 12.749 11.139 968 H LYS 31 H LYS 31 -16.391 10.014 11.531 969 HA LYS 31 HA LYS 31 -15.984 7.202 11.356 970 1HB LYS 31 HB2 LYS 31 -16.955 8.323 13.241 971 2HB LYS 31 HB3 LYS 31 -18.309 8.948 12.300 972 1HG LYS 31 HG2 LYS 31 -19.281 6.734 12.120 973 2HG LYS 31 HG3 LYS 31 -17.805 5.991 12.765 974 1HD LYS 31 HD2 LYS 31 -18.117 7.207 14.913 975 2HD LYS 31 HD3 LYS 31 -19.596 7.956 14.276 976 1HE LYS 31 HE2 LYS 31 -20.624 5.690 14.075 977 2HE LYS 31 HE3 LYS 31 -19.127 4.971 14.720 978 1HZ LYS 31 HZ1 LYS 31 -20.762 5.240 16.408 979 2HZ LYS 31 HZ2 LYS 31 -19.455 6.191 16.723 980 3HZ LYS 31 HZ3 LYS 31 -20.845 6.866 16.148 981 H LYS 32 H LYS 32 -18.930 8.936 10.252 982 HA LYS 32 HA LYS 32 -19.684 6.724 8.576 983 1HB LYS 32 HB2 LYS 32 -21.314 8.177 9.522 984 2HB LYS 32 HB3 LYS 32 -20.722 9.589 8.622 985 1HG LYS 32 HG2 LYS 32 -21.605 7.070 7.188 986 2HG LYS 32 HG3 LYS 32 -22.826 8.179 7.803 987 1HD LYS 32 HD2 LYS 32 -22.244 9.942 6.406 988 2HD LYS 32 HD3 LYS 32 -20.623 9.351 6.081 989 1HE LYS 32 HE2 LYS 32 -23.192 8.116 5.000 990 2HE LYS 32 HE3 LYS 32 -22.004 9.087 4.115 991 1HZ LYS 32 HZ1 LYS 32 -21.684 6.386 5.163 992 2HZ LYS 32 HZ2 LYS 32 -21.443 6.954 3.629 993 3HZ LYS 32 HZ3 LYS 32 -20.377 7.326 4.836 994 H GLU 33 H GLU 33 -17.630 9.535 8.059 995 HA GLU 33 HA GLU 33 -17.557 9.350 5.200 996 1HB GLU 33 HB2 GLU 33 -16.810 11.337 6.498 997 2HB GLU 33 HB3 GLU 33 -15.397 10.412 7.049 998 1HG GLU 33 HG2 GLU 33 -14.733 10.078 4.642 999 2HG GLU 33 HG3 GLU 33 -16.159 10.998 4.138 1000 H LEU 34 H LEU 34 -15.562 7.774 7.814 1001 HA LEU 34 HA LEU 34 -13.908 6.301 6.063 1002 1HB LEU 34 HB2 LEU 34 -13.493 6.335 8.434 1003 2HB LEU 34 HB3 LEU 34 -15.036 5.597 8.810 1004 HG LEU 34 HG LEU 34 -13.107 4.121 9.056 1005 1HD1 LEU 34 HD11 LEU 34 -14.173 2.163 8.387 1006 2HD1 LEU 34 HD12 LEU 34 -15.512 3.298 8.522 1007 3HD1 LEU 34 HD13 LEU 34 -14.864 2.875 6.940 1008 1HD2 LEU 34 HD21 LEU 34 -11.759 4.905 7.144 1009 2HD2 LEU 34 HD22 LEU 34 -11.988 3.147 7.080 1010 3HD2 LEU 34 HD23 LEU 34 -12.924 4.187 6.013 1011 H LYS 35 H LYS 35 -17.202 5.545 7.342 1012 HA LYS 35 HA LYS 35 -17.417 3.110 5.929 1013 1HB LYS 35 HB2 LYS 35 -18.985 3.959 7.684 1014 2HB LYS 35 HB3 LYS 35 -19.773 4.970 6.453 1015 1HG LYS 35 HG2 LYS 35 -20.284 2.958 5.114 1016 2HG LYS 35 HG3 LYS 35 -19.372 1.958 6.264 1017 1HD LYS 35 HD2 LYS 35 -20.986 2.772 8.075 1018 2HD LYS 35 HD3 LYS 35 -21.990 3.426 6.771 1019 1HE LYS 35 HE2 LYS 35 -21.115 0.511 7.141 1020 2HE LYS 35 HE3 LYS 35 -22.739 1.172 7.426 1021 1HZ LYS 35 HZ1 LYS 35 -22.812 1.750 5.083 1022 2HZ LYS 35 HZ2 LYS 35 -21.373 0.976 4.839 1023 3HZ LYS 35 HZ3 LYS 35 -22.699 0.133 5.356 1024 H GLU 36 H GLU 36 -18.129 6.429 4.806 1025 HA GLU 36 HA GLU 36 -19.047 5.766 2.219 1026 1HB GLU 36 HB2 GLU 36 -18.995 8.082 3.390 1027 2HB GLU 36 HB3 GLU 36 -17.325 8.199 2.844 1028 1HG GLU 36 HG2 GLU 36 -18.731 9.357 1.274 1029 2HG GLU 36 HG3 GLU 36 -18.049 7.925 0.492 1030 H LEU 37 H LEU 37 -15.697 6.411 3.347 1031 HA LEU 37 HA LEU 37 -14.321 5.940 0.944 1032 1HB LEU 37 HB2 LEU 37 -13.211 6.819 2.907 1033 2HB LEU 37 HB3 LEU 37 -13.529 5.389 3.849 1034 HG LEU 37 HG LEU 37 -11.719 5.304 1.426 1035 1HD1 LEU 37 HD11 LEU 37 -9.846 5.466 3.073 1036 2HD1 LEU 37 HD12 LEU 37 -10.816 6.936 3.045 1037 3HD1 LEU 37 HD13 LEU 37 -11.013 5.760 4.370 1038 1HD2 LEU 37 HD21 LEU 37 -10.712 3.374 2.742 1039 2HD2 LEU 37 HD22 LEU 37 -12.074 3.483 3.866 1040 3HD2 LEU 37 HD23 LEU 37 -12.328 3.033 2.162 1041 H ILE 38 H ILE 38 -15.267 3.551 3.456 1042 HA ILE 38 HA ILE 38 -14.224 1.368 1.948 1043 HB ILE 38 HB ILE 38 -16.346 1.440 4.115 1044 1HG1 ILE 38 HG12 ILE 38 -13.350 0.782 3.994 1045 2HG1 ILE 38 HG13 ILE 38 -14.081 2.211 4.735 1046 1HG2 ILE 38 HG21 ILE 38 -16.586 -0.641 2.685 1047 2HG2 ILE 38 HG22 ILE 38 -14.877 -1.000 3.014 1048 3HG2 ILE 38 HG23 ILE 38 -16.067 -0.972 4.328 1049 1HD1 ILE 38 HD11 ILE 38 -13.526 0.761 6.462 1050 2HD1 ILE 38 HD12 ILE 38 -15.301 0.642 6.316 1051 3HD1 ILE 38 HD13 ILE 38 -14.255 -0.656 5.672 1052 H GLN 39 H GLN 39 -17.667 2.501 2.125 1053 HA GLN 39 HA GLN 39 -18.541 0.532 0.266 1054 1HB GLN 39 HB2 GLN 39 -19.677 3.300 0.846 1055 2HB GLN 39 HB3 GLN 39 -20.494 2.054 -0.109 1056 1HG GLN 39 HG2 GLN 39 -19.739 1.807 2.837 1057 2HG GLN 39 HG3 GLN 39 -21.348 2.096 2.178 1058 1HE2 GLN 39 HE22 GLN 39 -18.834 -0.326 2.713 1059 2HE2 GLN 39 HE21 GLN 39 -19.822 -1.699 2.249 1060 H LYS 40 H LYS 40 -17.112 3.785 -0.394 1061 HA LYS 40 HA LYS 40 -17.810 3.470 -3.202 1062 1HB LYS 40 HB2 LYS 40 -17.743 5.626 -1.859 1063 2HB LYS 40 HB3 LYS 40 -15.982 5.577 -2.054 1064 1HG LYS 40 HG2 LYS 40 -16.327 5.448 -4.557 1065 2HG LYS 40 HG3 LYS 40 -18.070 5.535 -4.302 1066 1HD LYS 40 HD2 LYS 40 -15.986 7.691 -3.802 1067 2HD LYS 40 HD3 LYS 40 -17.306 7.710 -4.965 1068 1HE LYS 40 HE2 LYS 40 -17.529 7.889 -1.929 1069 2HE LYS 40 HE3 LYS 40 -17.852 9.173 -3.096 1070 1HZ LYS 40 HZ1 LYS 40 -19.844 8.090 -2.273 1071 2HZ LYS 40 HZ2 LYS 40 -19.700 7.944 -3.915 1072 3HZ LYS 40 HZ3 LYS 40 -19.366 6.666 -2.929 1073 H GLU 41 H GLU 41 -14.803 3.127 -1.276 1074 HA GLU 41 HA GLU 41 -13.242 2.579 -3.716 1075 1HB GLU 41 HB2 GLU 41 -12.434 2.331 -0.794 1076 2HB GLU 41 HB3 GLU 41 -11.373 2.258 -2.205 1077 1HG GLU 41 HG2 GLU 41 -12.968 4.678 -1.241 1078 2HG GLU 41 HG3 GLU 41 -11.222 4.449 -1.152 1079 H LEU 42 H LEU 42 -14.305 0.736 -0.829 1080 HA LEU 42 HA LEU 42 -13.464 -1.843 -2.068 1081 1HB LEU 42 HB2 LEU 42 -14.436 -1.135 0.726 1082 2HB LEU 42 HB3 LEU 42 -14.154 -2.767 0.160 1083 HG LEU 42 HG LEU 42 -12.409 -1.912 1.619 1084 1HD1 LEU 42 HD11 LEU 42 -10.505 -2.733 0.370 1085 2HD1 LEU 42 HD12 LEU 42 -11.932 -3.710 -0.017 1086 3HD1 LEU 42 HD13 LEU 42 -11.346 -2.491 -1.166 1087 1HD2 LEU 42 HD21 LEU 42 -12.449 0.476 0.791 1088 2HD2 LEU 42 HD22 LEU 42 -10.850 -0.224 1.031 1089 3HD2 LEU 42 HD23 LEU 42 -11.494 -0.069 -0.611 1090 H THR 43 H THR 43 -15.180 -1.329 -3.743 1091 HA THR 43 HA THR 43 -17.950 -1.255 -2.985 1092 HB THR 43 HB THR 43 -18.292 -1.633 -5.442 1093 HG1 THR 43 HG1 THR 43 -16.491 -2.961 -5.729 1094 1HG2 THR 43 HG21 THR 43 -17.185 0.447 -6.187 1095 2HG2 THR 43 HG22 THR 43 -17.940 0.653 -4.595 1096 3HG2 THR 43 HG23 THR 43 -16.185 0.443 -4.721 1097 H ILE 44 H ILE 44 -17.611 -3.196 -1.438 1098 HA ILE 44 HA ILE 44 -17.778 -5.843 -2.614 1099 HB ILE 44 HB ILE 44 -18.505 -6.576 -0.416 1100 1HG1 ILE 44 HG12 ILE 44 -18.611 -3.619 0.353 1101 2HG1 ILE 44 HG13 ILE 44 -19.963 -4.764 0.303 1102 1HG2 ILE 44 HG21 ILE 44 -16.447 -6.111 0.743 1103 2HG2 ILE 44 HG22 ILE 44 -16.089 -6.133 -0.983 1104 3HG2 ILE 44 HG23 ILE 44 -16.223 -4.581 -0.130 1105 1HD1 ILE 44 HD11 ILE 44 -17.626 -4.832 2.228 1106 2HD1 ILE 44 HD12 ILE 44 -19.327 -4.490 2.579 1107 3HD1 ILE 44 HD13 ILE 44 -18.847 -6.124 2.077 1108 H GLY 45 H GLY 45 -19.548 -6.843 -3.494 1109 1HA GLY 45 HA2 GLY 45 -21.997 -5.383 -3.984 1110 2HA GLY 45 HA3 GLY 45 -21.693 -7.101 -4.297 1111 H SER 46 H SER 46 -20.871 -7.699 -1.507 1112 HA SER 46 HA SER 46 -23.441 -8.453 -0.509 1113 1HB SER 46 HB2 SER 46 -21.735 -9.401 1.278 1114 2HB SER 46 HB3 SER 46 -21.756 -10.049 -0.365 1115 HG SER 46 HG SER 46 -19.678 -9.108 0.761 1116 H LYS 47 H LYS 47 -23.926 -5.924 -0.405 1117 HA LYS 47 HA LYS 47 -23.103 -4.414 1.845 1118 1HB LYS 47 HB2 LYS 47 -25.647 -4.443 0.188 1119 2HB LYS 47 HB3 LYS 47 -25.525 -3.461 1.648 1120 1HG LYS 47 HG2 LYS 47 -24.959 -2.034 -0.127 1121 2HG LYS 47 HG3 LYS 47 -23.478 -2.355 0.777 1122 1HD LYS 47 HD2 LYS 47 -22.817 -4.027 -0.985 1123 2HD LYS 47 HD3 LYS 47 -24.323 -3.681 -1.850 1124 1HE LYS 47 HE2 LYS 47 -22.593 -2.422 -2.913 1125 2HE LYS 47 HE3 LYS 47 -23.544 -1.243 -1.992 1126 1HZ LYS 47 HZ1 LYS 47 -21.834 -1.370 -0.277 1127 2HZ LYS 47 HZ2 LYS 47 -21.006 -2.484 -1.186 1128 3HZ LYS 47 HZ3 LYS 47 -21.186 -0.939 -1.729 1129 H LEU 48 H LEU 48 -25.029 -7.295 1.800 1130 HA LEU 48 HA LEU 48 -26.409 -7.192 4.238 1131 1HB LEU 48 HB2 LEU 48 -24.795 -9.459 2.978 1132 2HB LEU 48 HB3 LEU 48 -25.849 -9.651 4.372 1133 HG LEU 48 HG LEU 48 -26.948 -10.473 2.447 1134 1HD1 LEU 48 HD11 LEU 48 -28.318 -9.321 4.179 1135 2HD1 LEU 48 HD12 LEU 48 -28.305 -7.850 3.178 1136 3HD1 LEU 48 HD13 LEU 48 -29.063 -9.329 2.571 1137 1HD2 LEU 48 HD21 LEU 48 -25.797 -9.071 0.708 1138 2HD2 LEU 48 HD22 LEU 48 -27.542 -9.276 0.487 1139 3HD2 LEU 48 HD23 LEU 48 -26.924 -7.747 1.111 1140 H GLN 49 H GLN 49 -22.929 -7.366 3.658 1141 HA GLN 49 HA GLN 49 -22.218 -8.025 6.390 1142 1HB GLN 49 HB2 GLN 49 -20.605 -6.839 4.098 1143 2HB GLN 49 HB3 GLN 49 -19.932 -7.382 5.639 1144 1HG GLN 49 HG2 GLN 49 -20.727 -9.679 5.230 1145 2HG GLN 49 HG3 GLN 49 -21.452 -9.174 3.699 1146 1HE2 GLN 49 HE22 GLN 49 -18.236 -8.860 5.368 1147 2HE2 GLN 49 HE21 GLN 49 -17.317 -9.269 3.930 1148 H ASP 50 H ASP 50 -23.772 -5.258 5.409 1149 HA ASP 50 HA ASP 50 -22.371 -3.072 6.181 1150 1HB ASP 50 HB2 ASP 50 -24.675 -2.980 5.350 1151 2HB ASP 50 HB3 ASP 50 -25.279 -3.720 6.842 1152 H ALA 51 H ALA 51 -24.043 -5.280 8.422 1153 HA ALA 51 HA ALA 51 -23.542 -3.999 10.880 1154 1HB ALA 51 HB1 ALA 51 -23.538 -6.981 10.252 1155 2HB ALA 51 HB2 ALA 51 -23.698 -6.255 11.864 1156 3HB ALA 51 HB3 ALA 51 -24.959 -5.988 10.644 1157 H GLU 52 H GLU 52 -21.419 -6.119 8.947 1158 HA GLU 52 HA GLU 52 -19.313 -6.265 10.945 1159 1HB GLU 52 HB2 GLU 52 -19.059 -6.825 7.963 1160 2HB GLU 52 HB3 GLU 52 -18.053 -7.415 9.287 1161 1HG GLU 52 HG2 GLU 52 -20.938 -8.210 8.675 1162 2HG GLU 52 HG3 GLU 52 -19.495 -9.217 8.560 1163 H ILE 53 H ILE 53 -20.020 -4.367 7.985 1164 HA ILE 53 HA ILE 53 -17.594 -2.867 8.028 1165 HB ILE 53 HB ILE 53 -20.286 -1.883 7.030 1166 1HG1 ILE 53 HG12 ILE 53 -19.836 -3.903 5.827 1167 2HG1 ILE 53 HG13 ILE 53 -19.429 -2.553 4.782 1168 1HG2 ILE 53 HG21 ILE 53 -17.436 -0.949 6.492 1169 2HG2 ILE 53 HG22 ILE 53 -18.872 -0.403 5.603 1170 3HG2 ILE 53 HG23 ILE 53 -18.700 -0.049 7.328 1171 1HD1 ILE 53 HD11 ILE 53 -17.470 -4.334 6.303 1172 2HD1 ILE 53 HD12 ILE 53 -17.748 -4.282 4.565 1173 3HD1 ILE 53 HD13 ILE 53 -16.994 -2.898 5.367 1174 H VAL 54 H VAL 54 -20.746 -2.180 9.711 1175 HA VAL 54 HA VAL 54 -19.593 0.227 10.792 1176 HB VAL 54 HB VAL 54 -21.519 0.396 12.274 1177 1HG1 VAL 54 HG11 VAL 54 -21.374 1.396 9.995 1178 2HG1 VAL 54 HG12 VAL 54 -22.126 -0.072 9.334 1179 3HG1 VAL 54 HG13 VAL 54 -23.036 0.975 10.444 1180 1HG2 VAL 54 HG21 VAL 54 -23.446 -1.011 12.026 1181 2HG2 VAL 54 HG22 VAL 54 -22.613 -2.020 10.840 1182 3HG2 VAL 54 HG23 VAL 54 -22.076 -2.013 12.537 1183 H LYS 55 H LYS 55 -19.700 -3.122 12.053 1184 HA LYS 55 HA LYS 55 -18.575 -2.463 14.603 1185 1HB LYS 55 HB2 LYS 55 -19.395 -4.673 14.204 1186 2HB LYS 55 HB3 LYS 55 -18.323 -4.910 12.822 1187 1HG LYS 55 HG2 LYS 55 -17.594 -6.143 14.828 1188 2HG LYS 55 HG3 LYS 55 -16.367 -5.028 14.223 1189 1HD LYS 55 HD2 LYS 55 -16.897 -3.409 16.005 1190 2HD LYS 55 HD3 LYS 55 -18.234 -4.429 16.573 1191 1HE LYS 55 HE2 LYS 55 -16.682 -6.173 17.250 1192 2HE LYS 55 HE3 LYS 55 -15.331 -5.370 16.425 1193 1HZ LYS 55 HZ1 LYS 55 -16.771 -4.229 18.707 1194 2HZ LYS 55 HZ2 LYS 55 -15.314 -5.001 18.780 1195 3HZ LYS 55 HZ3 LYS 55 -15.452 -3.595 17.934 1196 H LEU 56 H LEU 56 -17.000 -3.290 11.495 1197 HA LEU 56 HA LEU 56 -14.318 -2.831 12.221 1198 1HB LEU 56 HB2 LEU 56 -14.828 -3.991 10.283 1199 2HB LEU 56 HB3 LEU 56 -15.891 -2.750 9.642 1200 HG LEU 56 HG LEU 56 -13.018 -1.982 10.008 1201 1HD1 LEU 56 HD11 LEU 56 -12.857 -4.236 8.963 1202 2HD1 LEU 56 HD12 LEU 56 -14.092 -3.781 7.773 1203 3HD1 LEU 56 HD13 LEU 56 -12.513 -2.981 7.756 1204 1HD2 LEU 56 HD21 LEU 56 -15.079 -1.510 7.795 1205 2HD2 LEU 56 HD22 LEU 56 -14.754 -0.370 9.101 1206 3HD2 LEU 56 HD23 LEU 56 -13.461 -0.775 7.971 1207 H MET 57 H MET 57 -16.741 -0.510 10.980 1208 HA MET 57 HA MET 57 -15.114 1.796 10.877 1209 1HB MET 57 HB2 MET 57 -17.417 1.598 9.910 1210 2HB MET 57 HB3 MET 57 -18.055 1.538 11.562 1211 1HG MET 57 HG2 MET 57 -17.132 3.823 11.973 1212 2HG MET 57 HG3 MET 57 -16.651 3.879 10.279 1213 1HE MET 57 HE1 MET 57 -21.020 3.914 11.782 1214 2HE MET 57 HE2 MET 57 -20.098 2.402 11.768 1215 3HE MET 57 HE3 MET 57 -19.585 3.732 12.820 1216 H ASP 58 H ASP 58 -17.207 0.516 13.505 1217 HA ASP 58 HA ASP 58 -16.673 2.448 15.461 1218 1HB ASP 58 HB2 ASP 58 -18.447 0.766 15.611 1219 2HB ASP 58 HB3 ASP 58 -17.246 -0.509 15.849 1220 H ASP 59 H ASP 59 -14.945 -0.610 14.754 1221 HA ASP 59 HA ASP 59 -12.944 -0.347 16.754 1222 1HB ASP 59 HB2 ASP 59 -12.657 -1.653 14.010 1223 2HB ASP 59 HB3 ASP 59 -11.614 -1.907 15.411 1224 H LEU 60 H LEU 60 -12.834 0.694 13.303 1225 HA LEU 60 HA LEU 60 -10.291 1.959 13.424 1226 1HB LEU 60 HB2 LEU 60 -12.767 2.275 11.702 1227 2HB LEU 60 HB3 LEU 60 -11.450 3.422 11.507 1228 HG LEU 60 HG LEU 60 -10.832 0.476 11.379 1229 1HD1 LEU 60 HD11 LEU 60 -11.246 0.475 8.947 1230 2HD1 LEU 60 HD12 LEU 60 -12.750 0.772 9.849 1231 3HD1 LEU 60 HD13 LEU 60 -11.890 2.111 9.050 1232 1HD2 LEU 60 HD21 LEU 60 -8.944 2.119 11.242 1233 2HD2 LEU 60 HD22 LEU 60 -9.176 1.316 9.665 1234 3HD2 LEU 60 HD23 LEU 60 -9.769 2.950 9.895 1235 H ASP 61 H ASP 61 -13.523 3.419 14.034 1236 HA ASP 61 HA ASP 61 -12.337 6.008 14.489 1237 1HB ASP 61 HB2 ASP 61 -14.517 6.787 15.071 1238 2HB ASP 61 HB3 ASP 61 -14.541 5.868 13.567 1239 H ARG 62 H ARG 62 -13.115 3.355 16.666 1240 HA ARG 62 HA ARG 62 -13.350 4.458 19.088 1241 1HB ARG 62 HB2 ARG 62 -13.125 1.990 18.669 1242 2HB ARG 62 HB3 ARG 62 -11.404 2.209 18.397 1243 1HG ARG 62 HG2 ARG 62 -11.683 1.324 20.593 1244 2HG ARG 62 HG3 ARG 62 -11.110 2.976 20.751 1245 1HD ARG 62 HD2 ARG 62 -12.755 2.704 22.403 1246 2HD ARG 62 HD3 ARG 62 -13.574 3.660 21.187 1247 HE ARG 62 HE ARG 62 -13.997 0.842 21.983 1248 1HH1 ARG 62 HH22 ARG 62 -14.900 3.330 19.614 1249 2HH1 ARG 62 HH21 ARG 62 -16.297 2.465 19.050 1250 1HH2 ARG 62 HH12 ARG 62 -15.782 -0.291 21.228 1251 2HH2 ARG 62 HH11 ARG 62 -16.730 0.318 19.896 1252 H ASN 63 H ASN 63 -10.272 4.094 17.439 1253 HA ASN 63 HA ASN 63 -8.259 4.992 18.943 1254 1HB ASN 63 HB2 ASN 63 -7.870 4.591 16.699 1255 2HB ASN 63 HB3 ASN 63 -9.139 5.709 16.157 1256 1HD2 ASN 63 HD22 ASN 63 -6.443 6.429 18.478 1257 2HD2 ASN 63 HD21 ASN 63 -5.726 7.631 17.428 1258 H LYS 64 H LYS 64 -10.661 7.243 17.587 1259 HA LYS 64 HA LYS 64 -10.215 9.027 19.867 1260 1HB LYS 64 HB2 LYS 64 -8.548 9.635 18.000 1261 2HB LYS 64 HB3 LYS 64 -9.924 10.235 17.099 1262 1HG LYS 64 HG2 LYS 64 -9.027 11.164 19.879 1263 2HG LYS 64 HG3 LYS 64 -8.612 11.942 18.347 1264 1HD LYS 64 HD2 LYS 64 -11.089 12.279 17.920 1265 2HD LYS 64 HD3 LYS 64 -11.386 11.739 19.583 1266 1HE LYS 64 HE2 LYS 64 -10.024 13.581 20.462 1267 2HE LYS 64 HE3 LYS 64 -9.608 14.094 18.812 1268 1HZ LYS 64 HZ1 LYS 64 -11.389 15.384 19.721 1269 2HZ LYS 64 HZ2 LYS 64 -11.892 14.529 18.402 1270 3HZ LYS 64 HZ3 LYS 64 -12.322 14.038 19.919 1271 H ASP 65 H ASP 65 -12.149 7.431 19.667 1272 HA ASP 65 HA ASP 65 -14.321 7.118 19.734 1273 1HB ASP 65 HB2 ASP 65 -15.807 8.980 20.372 1274 2HB ASP 65 HB3 ASP 65 -14.362 8.784 21.362 1275 H GLN 66 H GLN 66 -14.350 10.026 17.717 1276 HA GLN 66 HA GLN 66 -16.157 8.638 15.764 1277 1HB GLN 66 HB2 GLN 66 -16.985 10.722 16.861 1278 2HB GLN 66 HB3 GLN 66 -15.611 11.604 16.176 1279 1HG GLN 66 HG2 GLN 66 -16.434 11.027 13.869 1280 2HG GLN 66 HG3 GLN 66 -17.778 10.134 14.603 1281 1HE2 GLN 66 HE22 GLN 66 -16.244 13.417 14.797 1282 2HE2 GLN 66 HE21 GLN 66 -17.782 14.265 14.842 1283 H GLU 67 H GLU 67 -13.004 10.181 16.224 1284 HA GLU 67 HA GLU 67 -12.630 10.534 13.311 1285 1HB GLU 67 HB2 GLU 67 -11.010 11.475 15.691 1286 2HB GLU 67 HB3 GLU 67 -10.729 11.874 14.000 1287 1HG GLU 67 HG2 GLU 67 -12.942 12.976 13.870 1288 2HG GLU 67 HG3 GLU 67 -13.249 12.577 15.570 1289 H VAL 68 H VAL 68 -11.638 9.005 12.177 1290 HA VAL 68 HA VAL 68 -9.864 6.977 13.368 1291 HB VAL 68 HB VAL 68 -10.517 7.560 10.440 1292 1HG1 VAL 68 HG11 VAL 68 -9.504 5.038 11.816 1293 2HG1 VAL 68 HG12 VAL 68 -9.807 5.262 10.077 1294 3HG1 VAL 68 HG13 VAL 68 -8.505 6.158 10.868 1295 1HG2 VAL 68 HG21 VAL 68 -11.957 5.643 12.290 1296 2HG2 VAL 68 HG22 VAL 68 -12.653 7.104 11.558 1297 3HG2 VAL 68 HG23 VAL 68 -12.162 5.752 10.536 1298 H ASN 69 H ASN 69 -7.753 7.788 13.850 1299 HA ASN 69 HA ASN 69 -6.706 10.043 12.331 1300 1HB ASN 69 HB2 ASN 69 -6.087 9.677 14.694 1301 2HB ASN 69 HB3 ASN 69 -5.299 8.151 14.244 1302 1HD2 ASN 69 HD21 ASN 69 -5.254 11.699 13.530 1303 2HD2 ASN 69 HD22 ASN 69 -3.538 11.728 13.156 1304 H PHE 70 H PHE 70 -4.856 9.969 10.877 1305 HA PHE 70 HA PHE 70 -4.825 7.969 8.940 1306 1HB PHE 70 HB2 PHE 70 -3.836 10.147 8.587 1307 2HB PHE 70 HB3 PHE 70 -2.644 9.870 9.860 1308 HD1 PHE 70 HD1 PHE 70 -3.872 8.318 6.653 1309 HD2 PHE 70 HD2 PHE 70 -0.512 9.039 9.258 1310 HE1 PHE 70 HE1 PHE 70 -2.394 7.115 5.080 1311 HE2 PHE 70 HE2 PHE 70 0.948 7.801 7.713 1312 HZ PHE 70 HZ PHE 70 0.013 6.808 5.625 1313 H GLN 71 H GLN 71 -2.687 8.143 11.856 1314 HA GLN 71 HA GLN 71 -1.150 5.857 11.118 1315 1HB GLN 71 HB2 GLN 71 -0.440 7.408 12.893 1316 2HB GLN 71 HB3 GLN 71 -1.825 6.938 13.891 1317 1HG GLN 71 HG2 GLN 71 0.219 5.803 14.632 1318 2HG GLN 71 HG3 GLN 71 -0.960 4.623 14.062 1319 1HE2 GLN 71 HE22 GLN 71 0.165 2.933 13.023 1320 2HE2 GLN 71 HE21 GLN 71 1.558 3.219 11.987 1321 H GLU 72 H GLU 72 -4.144 6.213 13.043 1322 HA GLU 72 HA GLU 72 -4.431 3.489 13.806 1323 1HB GLU 72 HB2 GLU 72 -5.777 5.136 14.891 1324 2HB GLU 72 HB3 GLU 72 -6.473 5.704 13.369 1325 1HG GLU 72 HG2 GLU 72 -8.097 4.362 14.513 1326 2HG GLU 72 HG3 GLU 72 -7.655 3.562 13.034 1327 H TYR 73 H TYR 73 -5.672 5.294 10.959 1328 HA TYR 73 HA TYR 73 -7.006 3.157 9.704 1329 1HB TYR 73 HB2 TYR 73 -7.375 5.280 8.864 1330 2HB TYR 73 HB3 TYR 73 -5.674 5.671 8.729 1331 HD1 TYR 73 HD1 TYR 73 -8.487 3.894 7.106 1332 HD2 TYR 73 HD2 TYR 73 -4.362 5.117 6.810 1333 HE1 TYR 73 HE1 TYR 73 -8.616 3.766 4.633 1334 HE2 TYR 73 HE2 TYR 73 -4.447 4.833 4.370 1335 HH TYR 73 HH TYR 73 -5.897 4.731 2.555 1336 H ILE 74 H ILE 74 -3.531 4.132 9.203 1337 HA ILE 74 HA ILE 74 -3.021 1.941 7.443 1338 HB ILE 74 HB ILE 74 -1.069 3.356 9.291 1339 1HG1 ILE 74 HG12 ILE 74 -2.216 4.882 7.650 1340 2HG1 ILE 74 HG13 ILE 74 -0.478 4.790 7.517 1341 1HG2 ILE 74 HG21 ILE 74 -0.006 1.347 8.661 1342 2HG2 ILE 74 HG22 ILE 74 -0.710 1.359 7.029 1343 3HG2 ILE 74 HG23 ILE 74 0.575 2.489 7.448 1344 1HD1 ILE 74 HD11 ILE 74 -2.450 3.385 5.686 1345 2HD1 ILE 74 HD12 ILE 74 -1.487 4.822 5.303 1346 3HD1 ILE 74 HD13 ILE 74 -0.671 3.285 5.551 1347 H THR 75 H THR 75 -2.499 2.207 10.967 1348 HA THR 75 HA THR 75 -1.395 -0.336 11.462 1349 HB THR 75 HB THR 75 -3.305 1.250 13.243 1350 HG1 THR 75 HG1 THR 75 -1.661 2.549 12.599 1351 1HG2 THR 75 HG21 THR 75 -2.017 0.247 15.098 1352 2HG2 THR 75 HG22 THR 75 -2.869 -0.987 14.154 1353 3HG2 THR 75 HG23 THR 75 -1.123 -0.753 13.939 1354 H PHE 76 H PHE 76 -4.808 0.690 11.385 1355 HA PHE 76 HA PHE 76 -5.954 -1.841 11.993 1356 1HB PHE 76 HB2 PHE 76 -7.157 0.286 12.246 1357 2HB PHE 76 HB3 PHE 76 -7.109 0.533 10.502 1358 HD1 PHE 76 HD1 PHE 76 -8.498 -0.857 8.985 1359 HD2 PHE 76 HD2 PHE 76 -8.597 -1.459 13.259 1360 HE1 PHE 76 HE1 PHE 76 -10.431 -2.353 8.729 1361 HE2 PHE 76 HE2 PHE 76 -10.454 -3.082 12.974 1362 HZ PHE 76 HZ PHE 76 -11.310 -3.603 10.693 1363 H LEU 77 H LEU 77 -5.170 -0.222 8.828 1364 HA LEU 77 HA LEU 77 -6.189 -2.394 7.259 1365 1HB LEU 77 HB2 LEU 77 -4.052 -0.323 6.683 1366 2HB LEU 77 HB3 LEU 77 -4.565 -1.532 5.503 1367 HG LEU 77 HG LEU 77 -6.498 0.424 6.838 1368 1HD1 LEU 77 HD11 LEU 77 -5.168 0.560 4.104 1369 2HD1 LEU 77 HD12 LEU 77 -6.495 1.587 4.676 1370 3HD1 LEU 77 HD13 LEU 77 -4.911 1.677 5.473 1371 1HD2 LEU 77 HD21 LEU 77 -7.700 -1.503 6.007 1372 2HD2 LEU 77 HD22 LEU 77 -7.937 -0.186 4.870 1373 3HD2 LEU 77 HD23 LEU 77 -6.780 -1.476 4.475 1374 H GLY 78 H GLY 78 -3.086 -1.964 8.947 1375 1HA GLY 78 HA2 GLY 78 -1.860 -4.390 8.079 1376 2HA GLY 78 HA3 GLY 78 -1.631 -3.621 9.667 1377 H ALA 79 H ALA 79 -4.072 -3.783 10.860 1378 HA ALA 79 HA ALA 79 -4.341 -6.514 11.614 1379 1HB ALA 79 HB1 ALA 79 -6.450 -4.338 11.914 1380 2HB ALA 79 HB2 ALA 79 -6.329 -5.854 12.817 1381 3HB ALA 79 HB3 ALA 79 -5.081 -4.608 13.016 1382 H LEU 80 H LEU 80 -6.084 -4.639 9.132 1383 HA LEU 80 HA LEU 80 -8.035 -6.600 8.518 1384 1HB LEU 80 HB2 LEU 80 -7.887 -4.073 7.860 1385 2HB LEU 80 HB3 LEU 80 -6.883 -4.633 6.522 1386 HG LEU 80 HG LEU 80 -8.814 -6.154 5.849 1387 1HD1 LEU 80 HD11 LEU 80 -10.140 -6.195 7.936 1388 2HD1 LEU 80 HD12 LEU 80 -10.272 -4.425 7.903 1389 3HD1 LEU 80 HD13 LEU 80 -11.080 -5.402 6.664 1390 1HD2 LEU 80 HD21 LEU 80 -10.058 -4.308 4.788 1391 2HD2 LEU 80 HD22 LEU 80 -9.378 -3.160 5.954 1392 3HD2 LEU 80 HD23 LEU 80 -8.319 -3.954 4.758 1393 H ALA 81 H ALA 81 -4.799 -5.915 7.164 1394 HA ALA 81 HA ALA 81 -4.659 -8.030 5.270 1395 1HB ALA 81 HB1 ALA 81 -2.222 -7.826 5.553 1396 2HB ALA 81 HB2 ALA 81 -3.038 -6.266 5.275 1397 3HB ALA 81 HB3 ALA 81 -2.480 -6.697 6.894 1398 H MET 82 H MET 82 -3.874 -7.944 8.800 1399 HA MET 82 HA MET 82 -3.144 -10.693 8.966 1400 1HB MET 82 HB2 MET 82 -2.687 -8.913 10.690 1401 2HB MET 82 HB3 MET 82 -4.381 -9.048 11.200 1402 1HG MET 82 HG2 MET 82 -3.984 -11.526 11.575 1403 2HG MET 82 HG3 MET 82 -2.272 -11.237 11.262 1404 1HE MET 82 HE1 MET 82 -1.344 -8.983 14.366 1405 2HE MET 82 HE2 MET 82 -0.774 -9.675 12.827 1406 3HE MET 82 HE3 MET 82 -1.954 -8.332 12.830 1407 H ILE 83 H ILE 83 -6.353 -9.135 9.303 1408 HA ILE 83 HA ILE 83 -7.786 -11.528 9.933 1409 HB ILE 83 HB ILE 83 -8.633 -8.930 8.616 1410 1HG1 ILE 83 HG12 ILE 83 -9.348 -10.153 11.319 1411 2HG1 ILE 83 HG13 ILE 83 -7.958 -9.095 11.098 1412 1HG2 ILE 83 HG21 ILE 83 -10.386 -11.307 9.361 1413 2HG2 ILE 83 HG22 ILE 83 -10.986 -9.697 8.917 1414 3HG2 ILE 83 HG23 ILE 83 -10.130 -10.661 7.726 1415 1HD1 ILE 83 HD11 ILE 83 -10.864 -8.308 10.651 1416 2HD1 ILE 83 HD12 ILE 83 -9.784 -7.790 11.951 1417 3HD1 ILE 83 HD13 ILE 83 -9.459 -7.279 10.286 1418 H TYR 84 H TYR 84 -6.865 -10.068 6.781 1419 HA TYR 84 HA TYR 84 -7.763 -12.418 5.260 1420 1HB TYR 84 HB2 TYR 84 -5.764 -10.284 4.461 1421 2HB TYR 84 HB3 TYR 84 -6.675 -11.348 3.394 1422 HD1 TYR 84 HD1 TYR 84 -9.442 -10.877 4.883 1423 HD2 TYR 84 HD2 TYR 84 -6.365 -8.277 3.329 1424 HE1 TYR 84 HE1 TYR 84 -11.122 -9.105 4.507 1425 HE2 TYR 84 HE2 TYR 84 -8.059 -6.520 2.933 1426 HH TYR 84 HH TYR 84 -10.290 -5.963 3.028 1427 H ASN 85 H ASN 85 -6.411 -13.456 7.353 1428 HA ASN 85 HA ASN 85 -3.705 -13.410 7.447 1429 1HB ASN 85 HB2 ASN 85 -5.488 -14.576 8.993 1430 2HB ASN 85 HB3 ASN 85 -5.074 -16.026 8.083 1431 1HD2 ASN 85 HD22 ASN 85 -2.217 -15.619 7.732 1432 2HD2 ASN 85 HD21 ASN 85 -1.491 -15.624 9.328 1433 H GLU 86 H GLU 86 -5.598 -15.375 5.216 1434 HA GLU 86 HA GLU 86 -3.682 -17.217 4.356 1435 1HB GLU 86 HB2 GLU 86 -5.770 -15.729 2.697 1436 2HB GLU 86 HB3 GLU 86 -4.888 -17.175 2.181 1437 1HG GLU 86 HG2 GLU 86 -5.832 -18.441 4.112 1438 2HG GLU 86 HG3 GLU 86 -6.783 -17.022 4.578 1439 H ALA 87 H ALA 87 -4.050 -13.768 3.498 1440 HA ALA 87 HA ALA 87 -2.159 -13.647 1.373 1441 1HB ALA 87 HB1 ALA 87 -2.213 -11.268 1.750 1442 2HB ALA 87 HB2 ALA 87 -3.851 -11.893 1.985 1443 3HB ALA 87 HB3 ALA 87 -2.850 -11.478 3.396 1444 H LEU 88 H LEU 88 -1.773 -13.765 4.912 1445 HA LEU 88 HA LEU 88 0.985 -12.863 4.829 1446 1HB LEU 88 HB2 LEU 88 -0.477 -14.255 7.079 1447 2HB LEU 88 HB3 LEU 88 1.038 -13.351 7.165 1448 HG LEU 88 HG LEU 88 -1.754 -12.241 6.778 1449 1HD1 LEU 88 HD11 LEU 88 -1.062 -12.669 9.083 1450 2HD1 LEU 88 HD12 LEU 88 0.497 -11.858 8.814 1451 3HD1 LEU 88 HD13 LEU 88 -0.989 -10.913 8.805 1452 1HD2 LEU 88 HD21 LEU 88 -0.310 -10.994 5.204 1453 2HD2 LEU 88 HD22 LEU 88 -0.778 -10.010 6.584 1454 3HD2 LEU 88 HD23 LEU 88 0.857 -10.696 6.516 1455 H LYS 89 H LYS 89 -0.241 -15.661 3.583 1456 HA LYS 89 HA LYS 89 2.144 -17.271 4.362 1457 1HB LYS 89 HB2 LYS 89 -0.163 -17.907 2.513 1458 2HB LYS 89 HB3 LYS 89 1.113 -19.017 3.047 1459 1HG LYS 89 HG2 LYS 89 0.381 -18.647 5.431 1460 2HG LYS 89 HG3 LYS 89 -0.989 -17.701 4.834 1461 1HD LYS 89 HD2 LYS 89 -0.431 -20.653 4.281 1462 2HD LYS 89 HD3 LYS 89 -1.698 -19.971 5.319 1463 1HE LYS 89 HE2 LYS 89 -2.563 -18.750 3.228 1464 2HE LYS 89 HE3 LYS 89 -1.468 -19.766 2.283 1465 1HZ LYS 89 HZ1 LYS 89 -3.605 -20.748 4.037 1466 2HZ LYS 89 HZ2 LYS 89 -3.644 -20.700 2.391 1467 3HZ LYS 89 HZ3 LYS 89 -2.573 -21.688 3.160 1468 H GLY 90 H GLY 90 1.438 -14.684 2.294 1469 1HA GLY 90 HA2 GLY 90 2.591 -13.824 0.525 1470 2HA GLY 90 HA3 GLY 90 3.790 -15.125 0.665 Start of MODEL 22 1 1H MET 1 H1 MET 1 -14.900 -1.031 -5.379 2 2H MET 1 H2 MET 1 -13.457 -0.895 -6.187 3 3H MET 1 H3 MET 1 -13.491 -1.331 -4.607 4 HA MET 1 HA MET 1 -14.811 -3.297 -5.229 5 1HB MET 1 HB2 MET 1 -14.617 -4.044 -7.593 6 2HB MET 1 HB3 MET 1 -15.630 -2.619 -7.340 7 1HG MET 1 HG2 MET 1 -13.932 -1.139 -8.214 8 2HG MET 1 HG3 MET 1 -12.729 -2.429 -8.237 9 1HE MET 1 HE1 MET 1 -16.005 -1.030 -9.863 10 2HE MET 1 HE2 MET 1 -16.270 -2.187 -11.189 11 3HE MET 1 HE3 MET 1 -16.506 -2.705 -9.507 12 H ALA 2 H ALA 2 -12.706 -2.794 -3.813 13 HA ALA 2 HA ALA 2 -11.121 -3.886 -2.722 14 1HB ALA 2 HB1 ALA 2 -11.336 -6.067 -4.847 15 2HB ALA 2 HB2 ALA 2 -10.539 -6.190 -3.271 16 3HB ALA 2 HB3 ALA 2 -12.290 -5.952 -3.355 17 H SER 3 H SER 3 -10.492 -4.438 -6.084 18 HA SER 3 HA SER 3 -7.880 -4.820 -6.291 19 1HB SER 3 HB2 SER 3 -8.114 -3.571 -8.597 20 2HB SER 3 HB3 SER 3 -9.000 -5.059 -8.249 21 HG SER 3 HG SER 3 -10.853 -3.835 -7.772 22 HA PRO 4 HA PRO 4 -6.375 -0.346 -6.836 23 1HB PRO 4 HB2 PRO 4 -7.743 1.755 -5.614 24 2HB PRO 4 HB3 PRO 4 -7.944 1.251 -7.314 25 1HG PRO 4 HG2 PRO 4 -9.633 0.422 -4.935 26 2HG PRO 4 HG3 PRO 4 -10.193 1.028 -6.522 27 1HD PRO 4 HD2 PRO 4 -10.167 -1.587 -6.055 28 2HD PRO 4 HD3 PRO 4 -9.528 -0.993 -7.609 29 H LEU 5 H LEU 5 -8.074 -0.963 -3.710 30 HA LEU 5 HA LEU 5 -5.723 0.089 -2.278 31 1HB LEU 5 HB2 LEU 5 -7.946 0.503 -1.349 32 2HB LEU 5 HB3 LEU 5 -8.235 -1.241 -1.214 33 HG LEU 5 HG LEU 5 -6.363 -1.447 0.395 34 1HD1 LEU 5 HD11 LEU 5 -5.350 0.620 1.351 35 2HD1 LEU 5 HD12 LEU 5 -4.838 0.353 -0.310 36 3HD1 LEU 5 HD13 LEU 5 -6.078 1.582 0.051 37 1HD2 LEU 5 HD21 LEU 5 -8.632 -0.897 1.224 38 2HD2 LEU 5 HD22 LEU 5 -7.338 -0.236 2.249 39 3HD2 LEU 5 HD23 LEU 5 -8.216 0.838 1.135 40 H ASP 6 H ASP 6 -7.351 -3.005 -2.959 41 HA ASP 6 HA ASP 6 -5.808 -4.739 -1.431 42 1HB ASP 6 HB2 ASP 6 -7.265 -5.137 -4.044 43 2HB ASP 6 HB3 ASP 6 -6.310 -6.424 -3.310 44 H GLN 7 H GLN 7 -4.997 -3.493 -4.758 45 HA GLN 7 HA GLN 7 -2.644 -5.075 -4.936 46 1HB GLN 7 HB2 GLN 7 -1.884 -3.693 -6.691 47 2HB GLN 7 HB3 GLN 7 -3.637 -3.787 -6.810 48 1HG GLN 7 HG2 GLN 7 -3.276 -1.557 -7.218 49 2HG GLN 7 HG3 GLN 7 -3.645 -1.557 -5.495 50 1HE2 GLN 7 HE22 GLN 7 -2.586 0.689 -5.922 51 2HE2 GLN 7 HE21 GLN 7 -0.828 0.777 -5.849 52 H ALA 8 H ALA 8 -3.195 -1.946 -3.298 53 HA ALA 8 HA ALA 8 -0.399 -1.435 -2.889 54 1HB ALA 8 HB1 ALA 8 -1.914 0.372 -2.912 55 2HB ALA 8 HB2 ALA 8 -2.866 -0.277 -1.554 56 3HB ALA 8 HB3 ALA 8 -1.200 0.273 -1.291 57 H ILE 9 H ILE 9 -3.016 -2.604 -0.646 58 HA ILE 9 HA ILE 9 -1.107 -3.136 1.456 59 HB ILE 9 HB ILE 9 -2.796 -4.446 2.567 60 1HG1 ILE 9 HG12 ILE 9 -4.605 -3.920 0.199 61 2HG1 ILE 9 HG13 ILE 9 -3.909 -5.501 0.605 62 1HG2 ILE 9 HG21 ILE 9 -4.263 -2.583 3.026 63 2HG2 ILE 9 HG22 ILE 9 -2.660 -1.950 2.673 64 3HG2 ILE 9 HG23 ILE 9 -3.932 -1.862 1.437 65 1HD1 ILE 9 HD11 ILE 9 -5.903 -3.922 2.288 66 2HD1 ILE 9 HD12 ILE 9 -6.150 -5.455 1.446 67 3HD1 ILE 9 HD13 ILE 9 -5.061 -5.383 2.846 68 H GLY 10 H GLY 10 -2.369 -5.136 -1.218 69 1HA GLY 10 HA2 GLY 10 -1.111 -7.587 -0.814 70 2HA GLY 10 HA3 GLY 10 -1.427 -6.815 -2.370 71 H LEU 11 H LEU 11 0.224 -4.564 -2.220 72 HA LEU 11 HA LEU 11 2.702 -5.573 -3.038 73 1HB LEU 11 HB2 LEU 11 1.495 -3.288 -3.475 74 2HB LEU 11 HB3 LEU 11 2.239 -2.758 -1.974 75 HG LEU 11 HG LEU 11 3.458 -1.953 -3.729 76 1HD1 LEU 11 HD11 LEU 11 5.124 -4.272 -2.751 77 2HD1 LEU 11 HD12 LEU 11 5.680 -2.692 -3.321 78 3HD1 LEU 11 HD13 LEU 11 4.764 -2.800 -1.803 79 1HD2 LEU 11 HD21 LEU 11 3.747 -4.718 -4.928 80 2HD2 LEU 11 HD22 LEU 11 2.713 -3.388 -5.516 81 3HD2 LEU 11 HD23 LEU 11 4.476 -3.213 -5.531 82 H LEU 12 H LEU 12 1.979 -3.703 -0.050 83 HA LEU 12 HA LEU 12 4.454 -4.025 1.254 84 1HB LEU 12 HB2 LEU 12 1.590 -3.739 2.292 85 2HB LEU 12 HB3 LEU 12 2.963 -3.927 3.380 86 HG LEU 12 HG LEU 12 4.045 -1.936 2.432 87 1HD1 LEU 12 HD11 LEU 12 2.667 -0.306 1.147 88 2HD1 LEU 12 HD12 LEU 12 2.939 -1.775 0.210 89 3HD1 LEU 12 HD13 LEU 12 1.375 -1.505 1.019 90 1HD2 LEU 12 HD21 LEU 12 2.663 -1.846 4.490 91 2HD2 LEU 12 HD22 LEU 12 2.592 -0.326 3.589 92 3HD2 LEU 12 HD23 LEU 12 1.232 -1.463 3.504 93 H ILE 13 H ILE 13 1.583 -6.153 1.311 94 HA ILE 13 HA ILE 13 2.637 -8.065 3.145 95 HB ILE 13 HB ILE 13 0.571 -8.263 0.910 96 1HG1 ILE 13 HG12 ILE 13 0.060 -8.260 3.905 97 2HG1 ILE 13 HG13 ILE 13 0.168 -6.760 2.999 98 1HG2 ILE 13 HG21 ILE 13 1.248 -10.306 3.046 99 2HG2 ILE 13 HG22 ILE 13 -0.244 -10.341 2.074 100 3HG2 ILE 13 HG23 ILE 13 1.320 -10.537 1.287 101 1HD1 ILE 13 HD11 ILE 13 -1.914 -8.943 2.733 102 2HD1 ILE 13 HD12 ILE 13 -2.134 -7.204 2.990 103 3HD1 ILE 13 HD13 ILE 13 -1.630 -7.791 1.413 104 H GLY 14 H GLY 14 2.635 -8.050 -0.433 105 1HA GLY 14 HA2 GLY 14 3.952 -10.492 -0.852 106 2HA GLY 14 HA3 GLY 14 3.961 -9.101 -1.956 107 H ILE 15 H ILE 15 5.328 -7.146 -0.652 108 HA ILE 15 HA ILE 15 8.068 -7.814 -0.954 109 HB ILE 15 HB ILE 15 6.504 -5.568 0.291 110 1HG1 ILE 15 HG12 ILE 15 8.732 -5.704 -1.795 111 2HG1 ILE 15 HG13 ILE 15 6.997 -5.757 -2.151 112 1HG2 ILE 15 HG21 ILE 15 9.494 -5.913 0.693 113 2HG2 ILE 15 HG22 ILE 15 8.595 -4.405 0.971 114 3HG2 ILE 15 HG23 ILE 15 8.217 -5.811 1.937 115 1HD1 ILE 15 HD11 ILE 15 8.567 -3.409 -1.011 116 2HD1 ILE 15 HD12 ILE 15 7.700 -3.509 -2.543 117 3HD1 ILE 15 HD13 ILE 15 6.800 -3.489 -1.012 118 H PHE 16 H PHE 16 6.099 -7.506 2.012 119 HA PHE 16 HA PHE 16 8.130 -8.187 3.810 120 1HB PHE 16 HB2 PHE 16 5.908 -7.176 4.328 121 2HB PHE 16 HB3 PHE 16 5.126 -8.717 4.042 122 HD1 PHE 16 HD1 PHE 16 7.291 -6.785 6.308 123 HD2 PHE 16 HD2 PHE 16 5.552 -10.657 5.584 124 HE1 PHE 16 HE1 PHE 16 7.608 -7.376 8.701 125 HE2 PHE 16 HE2 PHE 16 6.252 -11.357 7.822 126 HZ PHE 16 HZ PHE 16 7.062 -9.630 9.473 127 H HIS 17 H HIS 17 5.598 -10.382 2.485 128 HA HIS 17 HA HIS 17 6.669 -12.521 4.039 129 1HB HIS 17 HB2 HIS 17 4.231 -12.112 3.177 130 2HB HIS 17 HB3 HIS 17 4.772 -13.032 1.770 131 HD1 HIS 17 HD1 HIS 17 4.306 -15.606 2.178 132 HD2 HIS 17 HD2 HIS 17 4.845 -13.339 5.679 133 HE1 HIS 17 HE1 HIS 17 3.917 -17.188 4.148 134 H LYS 18 H LYS 18 7.317 -11.429 0.721 135 HA LYS 18 HA LYS 18 8.705 -13.867 -0.063 136 1HB LYS 18 HB2 LYS 18 9.012 -10.967 -0.933 137 2HB LYS 18 HB3 LYS 18 10.012 -12.293 -1.555 138 1HG LYS 18 HG2 LYS 18 7.885 -13.512 -2.204 139 2HG LYS 18 HG3 LYS 18 6.994 -12.036 -1.854 140 1HD LYS 18 HD2 LYS 18 9.209 -12.468 -3.921 141 2HD LYS 18 HD3 LYS 18 7.497 -12.187 -4.250 142 1HE LYS 18 HE2 LYS 18 9.488 -10.177 -3.087 143 2HE LYS 18 HE3 LYS 18 8.776 -10.158 -4.703 144 1HZ LYS 18 HZ1 LYS 18 7.300 -9.877 -2.187 145 2HZ LYS 18 HZ2 LYS 18 7.671 -8.654 -3.232 146 3HZ LYS 18 HZ3 LYS 18 6.633 -9.849 -3.696 147 H TYR 19 H TYR 19 9.785 -10.780 1.478 148 HA TYR 19 HA TYR 19 12.458 -11.681 1.870 149 1HB TYR 19 HB2 TYR 19 10.763 -9.450 2.935 150 2HB TYR 19 HB3 TYR 19 12.189 -9.900 3.865 151 HD1 TYR 19 HD1 TYR 19 11.124 -8.282 0.736 152 HD2 TYR 19 HD2 TYR 19 14.418 -9.979 2.920 153 HE1 TYR 19 HE1 TYR 19 12.698 -7.416 -0.955 154 HE2 TYR 19 HE2 TYR 19 15.976 -9.225 1.193 155 HH TYR 19 HH TYR 19 16.230 -7.994 -0.738 156 H SER 20 H SER 20 9.590 -12.087 3.937 157 HA SER 20 HA SER 20 11.001 -13.330 6.108 158 1HB SER 20 HB2 SER 20 8.146 -13.966 5.278 159 2HB SER 20 HB3 SER 20 8.903 -14.064 6.871 160 HG SER 20 HG SER 20 8.540 -11.630 5.416 161 H GLY 21 H GLY 21 9.343 -14.737 3.267 162 1HA GLY 21 HA2 GLY 21 9.904 -17.444 3.607 163 2HA GLY 21 HA3 GLY 21 9.725 -16.610 2.051 164 H LYS 22 H LYS 22 11.958 -14.869 2.170 165 HA LYS 22 HA LYS 22 14.042 -16.394 1.193 166 1HB LYS 22 HB2 LYS 22 13.684 -13.888 1.066 167 2HB LYS 22 HB3 LYS 22 14.461 -13.765 2.655 168 1HG LYS 22 HG2 LYS 22 16.487 -14.859 1.767 169 2HG LYS 22 HG3 LYS 22 15.744 -14.981 0.171 170 1HD LYS 22 HD2 LYS 22 16.435 -12.428 1.706 171 2HD LYS 22 HD3 LYS 22 17.306 -13.077 0.318 172 1HE LYS 22 HE2 LYS 22 14.495 -11.888 0.334 173 2HE LYS 22 HE3 LYS 22 15.946 -11.232 -0.427 174 1HZ LYS 22 HZ1 LYS 22 15.968 -13.125 -1.888 175 2HZ LYS 22 HZ2 LYS 22 14.591 -13.715 -1.196 176 3HZ LYS 22 HZ3 LYS 22 14.554 -12.286 -2.016 177 H GLU 23 H GLU 23 13.382 -15.660 4.616 178 HA GLU 23 HA GLU 23 15.778 -17.295 5.405 179 1HB GLU 23 HB2 GLU 23 15.610 -16.145 7.584 180 2HB GLU 23 HB3 GLU 23 16.052 -15.087 6.244 181 1HG GLU 23 HG2 GLU 23 13.760 -14.208 6.108 182 2HG GLU 23 HG3 GLU 23 13.225 -15.334 7.365 183 H GLY 24 H GLY 24 12.961 -18.116 4.544 184 1HA GLY 24 HA2 GLY 24 11.366 -19.606 5.153 185 2HA GLY 24 HA3 GLY 24 12.604 -20.322 6.197 186 H ASP 25 H ASP 25 11.308 -17.023 6.621 187 HA ASP 25 HA ASP 25 10.093 -17.874 9.213 188 1HB ASP 25 HB2 ASP 25 11.920 -16.119 9.181 189 2HB ASP 25 HB3 ASP 25 10.783 -15.045 8.351 190 H LYS 26 H LYS 26 7.999 -16.934 9.689 191 HA LYS 26 HA LYS 26 6.273 -17.142 7.292 192 1HB LYS 26 HB2 LYS 26 6.098 -18.607 9.393 193 2HB LYS 26 HB3 LYS 26 5.453 -17.213 10.230 194 1HG LYS 26 HG2 LYS 26 3.666 -18.645 9.502 195 2HG LYS 26 HG3 LYS 26 3.552 -17.183 8.516 196 1HD LYS 26 HD2 LYS 26 4.444 -18.299 6.580 197 2HD LYS 26 HD3 LYS 26 5.079 -19.636 7.553 198 1HE LYS 26 HE2 LYS 26 3.110 -20.367 6.327 199 2HE LYS 26 HE3 LYS 26 2.796 -20.404 8.068 200 1HZ LYS 26 HZ1 LYS 26 0.979 -19.464 6.862 201 2HZ LYS 26 HZ2 LYS 26 1.648 -18.305 7.822 202 3HZ LYS 26 HZ3 LYS 26 1.944 -18.304 6.200 203 H HIS 27 H HIS 27 4.466 -15.555 9.637 204 HA HIS 27 HA HIS 27 4.551 -13.092 8.069 205 1HB HIS 27 HB2 HIS 27 2.943 -13.753 10.543 206 2HB HIS 27 HB3 HIS 27 2.627 -12.470 9.369 207 HD1 HIS 27 HD1 HIS 27 3.174 -14.700 6.809 208 HD2 HIS 27 HD2 HIS 27 0.567 -14.904 10.124 209 HE1 HIS 27 HE1 HIS 27 1.283 -16.236 6.153 210 H THR 28 H THR 28 7.071 -13.418 9.222 211 HA THR 28 HA THR 28 7.343 -11.092 10.921 212 HB THR 28 HB THR 28 7.876 -13.850 12.027 213 HG1 THR 28 HG1 THR 28 5.836 -12.381 12.207 214 1HG2 THR 28 HG21 THR 28 8.820 -11.154 13.102 215 2HG2 THR 28 HG22 THR 28 8.856 -12.690 13.993 216 3HG2 THR 28 HG23 THR 28 9.859 -12.491 12.548 217 H LEU 29 H LEU 29 9.400 -10.243 10.695 218 HA LEU 29 HA LEU 29 11.342 -11.628 8.866 219 1HB LEU 29 HB2 LEU 29 10.793 -8.686 9.470 220 2HB LEU 29 HB3 LEU 29 12.207 -9.227 8.572 221 HG LEU 29 HG LEU 29 9.374 -9.747 7.616 222 1HD1 LEU 29 HD11 LEU 29 11.326 -7.521 6.841 223 2HD1 LEU 29 HD12 LEU 29 9.736 -7.818 6.112 224 3HD1 LEU 29 HD13 LEU 29 9.857 -7.278 7.800 225 1HD2 LEU 29 HD21 LEU 29 12.074 -9.746 6.200 226 2HD2 LEU 29 HD22 LEU 29 11.155 -11.192 6.659 227 3HD2 LEU 29 HD23 LEU 29 10.482 -10.064 5.465 228 H SER 30 H SER 30 13.617 -11.369 9.499 229 HA SER 30 HA SER 30 14.057 -10.711 12.359 230 1HB SER 30 HB2 SER 30 16.339 -11.415 11.983 231 2HB SER 30 HB3 SER 30 15.255 -12.651 11.326 232 HG SER 30 HG SER 30 16.105 -12.297 9.439 233 H LYS 31 H LYS 31 15.533 -8.921 12.955 234 HA LYS 31 HA LYS 31 14.969 -6.581 11.604 235 1HB LYS 31 HB2 LYS 31 16.341 -5.466 13.029 236 2HB LYS 31 HB3 LYS 31 15.780 -6.836 13.960 237 1HG LYS 31 HG2 LYS 31 18.556 -6.552 12.702 238 2HG LYS 31 HG3 LYS 31 18.120 -6.223 14.374 239 1HD LYS 31 HD2 LYS 31 17.496 -8.572 14.741 240 2HD LYS 31 HD3 LYS 31 17.895 -8.975 13.072 241 1HE LYS 31 HE2 LYS 31 19.746 -9.637 14.433 242 2HE LYS 31 HE3 LYS 31 20.265 -8.209 13.523 243 1HZ LYS 31 HZ1 LYS 31 19.802 -6.906 15.500 244 2HZ LYS 31 HZ2 LYS 31 19.340 -8.262 16.319 245 3HZ LYS 31 HZ3 LYS 31 20.897 -8.095 15.816 246 H LYS 32 H LYS 32 17.797 -8.666 11.061 247 HA LYS 32 HA LYS 32 19.055 -6.792 9.222 248 1HB LYS 32 HB2 LYS 32 20.502 -8.044 10.404 249 2HB LYS 32 HB3 LYS 32 19.663 -9.577 10.179 250 1HG LYS 32 HG2 LYS 32 21.168 -8.035 8.007 251 2HG LYS 32 HG3 LYS 32 21.849 -9.326 8.993 252 1HD LYS 32 HD2 LYS 32 19.785 -9.601 6.785 253 2HD LYS 32 HD3 LYS 32 21.379 -10.302 6.927 254 1HE LYS 32 HE2 LYS 32 20.612 -11.726 8.823 255 2HE LYS 32 HE3 LYS 32 18.975 -11.060 8.657 256 1HZ LYS 32 HZ1 LYS 32 19.176 -13.113 7.527 257 2HZ LYS 32 HZ2 LYS 32 18.891 -11.904 6.447 258 3HZ LYS 32 HZ3 LYS 32 20.402 -12.547 6.584 259 H GLU 33 H GLU 33 16.845 -9.644 8.864 260 HA GLU 33 HA GLU 33 17.072 -9.650 6.011 261 1HB GLU 33 HB2 GLU 33 16.068 -11.487 7.367 262 2HB GLU 33 HB3 GLU 33 14.667 -10.441 7.698 263 1HG GLU 33 HG2 GLU 33 14.072 -11.890 5.879 264 2HG GLU 33 HG3 GLU 33 14.327 -10.307 5.171 265 H LEU 34 H LEU 34 14.917 -7.934 8.296 266 HA LEU 34 HA LEU 34 13.477 -6.366 6.431 267 1HB LEU 34 HB2 LEU 34 12.782 -6.352 8.667 268 2HB LEU 34 HB3 LEU 34 14.356 -5.925 9.292 269 HG LEU 34 HG LEU 34 12.702 -4.141 9.450 270 1HD1 LEU 34 HD11 LEU 34 15.254 -3.750 9.214 271 2HD1 LEU 34 HD12 LEU 34 14.846 -3.054 7.639 272 3HD1 LEU 34 HD13 LEU 34 14.162 -2.376 9.104 273 1HD2 LEU 34 HD21 LEU 34 11.999 -2.867 7.418 274 2HD2 LEU 34 HD22 LEU 34 12.758 -4.084 6.405 275 3HD2 LEU 34 HD23 LEU 34 11.401 -4.534 7.444 276 H LYS 35 H LYS 35 16.705 -5.700 7.992 277 HA LYS 35 HA LYS 35 17.149 -3.320 6.633 278 1HB LYS 35 HB2 LYS 35 18.604 -4.427 8.436 279 2HB LYS 35 HB3 LYS 35 19.419 -5.279 7.101 280 1HG LYS 35 HG2 LYS 35 19.827 -3.036 6.015 281 2HG LYS 35 HG3 LYS 35 19.066 -2.275 7.427 282 1HD LYS 35 HD2 LYS 35 20.841 -3.259 8.883 283 2HD LYS 35 HD3 LYS 35 21.600 -3.968 7.437 284 1HE LYS 35 HE2 LYS 35 21.761 -1.648 6.447 285 2HE LYS 35 HE3 LYS 35 21.110 -0.991 7.952 286 1HZ LYS 35 HZ1 LYS 35 23.596 -2.554 7.685 287 2HZ LYS 35 HZ2 LYS 35 23.503 -0.917 7.835 288 3HZ LYS 35 HZ3 LYS 35 23.027 -1.889 9.083 289 H GLU 36 H GLU 36 17.779 -6.631 5.422 290 HA GLU 36 HA GLU 36 18.851 -5.843 2.912 291 1HB GLU 36 HB2 GLU 36 18.584 -8.234 4.117 292 2HB GLU 36 HB3 GLU 36 17.186 -8.340 3.052 293 1HG GLU 36 HG2 GLU 36 20.122 -7.955 2.333 294 2HG GLU 36 HG3 GLU 36 19.091 -9.332 1.938 295 H LEU 37 H LEU 37 15.473 -6.528 3.911 296 HA LEU 37 HA LEU 37 14.124 -6.120 1.469 297 1HB LEU 37 HB2 LEU 37 13.049 -6.941 3.468 298 2HB LEU 37 HB3 LEU 37 13.281 -5.434 4.316 299 HG LEU 37 HG LEU 37 11.555 -5.568 1.847 300 1HD1 LEU 37 HD11 LEU 37 10.706 -7.160 3.477 301 2HD1 LEU 37 HD12 LEU 37 10.894 -5.977 4.803 302 3HD1 LEU 37 HD13 LEU 37 9.680 -5.720 3.548 303 1HD2 LEU 37 HD21 LEU 37 10.449 -3.599 3.020 304 2HD2 LEU 37 HD22 LEU 37 11.777 -3.587 4.188 305 3HD2 LEU 37 HD23 LEU 37 12.070 -3.236 2.469 306 H ILE 38 H ILE 38 15.016 -3.697 3.941 307 HA ILE 38 HA ILE 38 14.147 -1.443 2.442 308 HB ILE 38 HB ILE 38 16.355 -1.752 4.510 309 1HG1 ILE 38 HG12 ILE 38 13.485 -0.731 4.685 310 2HG1 ILE 38 HG13 ILE 38 14.070 -2.287 5.287 311 1HG2 ILE 38 HG21 ILE 38 15.108 0.893 3.704 312 2HG2 ILE 38 HG22 ILE 38 16.498 0.576 4.757 313 3HG2 ILE 38 HG23 ILE 38 16.661 0.350 3.035 314 1HD1 ILE 38 HD11 ILE 38 15.707 -1.016 6.757 315 2HD1 ILE 38 HD12 ILE 38 14.855 0.460 6.256 316 3HD1 ILE 38 HD13 ILE 38 13.979 -0.814 7.144 317 H GLN 39 H GLN 39 17.418 -2.997 2.598 318 HA GLN 39 HA GLN 39 18.676 -1.128 0.892 319 1HB GLN 39 HB2 GLN 39 19.255 -4.096 1.335 320 2HB GLN 39 HB3 GLN 39 20.294 -3.035 0.421 321 1HG GLN 39 HG2 GLN 39 20.127 -3.388 3.315 322 2HG GLN 39 HG3 GLN 39 21.413 -2.715 2.331 323 1HE2 GLN 39 HE22 GLN 39 18.521 -2.000 4.193 324 2HE2 GLN 39 HE21 GLN 39 18.781 -0.254 4.275 325 H LYS 40 H LYS 40 16.828 -4.043 0.009 326 HA LYS 40 HA LYS 40 17.386 -3.630 -2.798 327 1HB LYS 40 HB2 LYS 40 16.897 -5.887 -1.866 328 2HB LYS 40 HB3 LYS 40 15.318 -5.304 -1.334 329 1HG LYS 40 HG2 LYS 40 14.770 -6.527 -3.166 330 2HG LYS 40 HG3 LYS 40 14.761 -4.923 -3.851 331 1HD LYS 40 HD2 LYS 40 17.002 -7.005 -4.060 332 2HD LYS 40 HD3 LYS 40 15.784 -6.675 -5.289 333 1HE LYS 40 HE2 LYS 40 18.063 -4.846 -4.448 334 2HE LYS 40 HE3 LYS 40 17.813 -5.647 -5.992 335 1HZ LYS 40 HZ1 LYS 40 17.182 -3.392 -6.152 336 2HZ LYS 40 HZ2 LYS 40 15.830 -4.323 -6.299 337 3HZ LYS 40 HZ3 LYS 40 16.126 -3.505 -4.897 338 H GLU 41 H GLU 41 14.460 -3.045 -0.793 339 HA GLU 41 HA GLU 41 13.083 -1.985 -3.128 340 1HB GLU 41 HB2 GLU 41 12.316 -1.814 -0.188 341 2HB GLU 41 HB3 GLU 41 11.273 -1.489 -1.583 342 1HG GLU 41 HG2 GLU 41 12.528 -4.190 -0.865 343 2HG GLU 41 HG3 GLU 41 10.850 -3.723 -0.634 344 H LEU 42 H LEU 42 14.342 -0.529 -0.139 345 HA LEU 42 HA LEU 42 13.792 2.209 -1.227 346 1HB LEU 42 HB2 LEU 42 14.443 1.277 1.580 347 2HB LEU 42 HB3 LEU 42 14.161 2.954 1.095 348 HG LEU 42 HG LEU 42 12.113 0.688 0.943 349 1HD1 LEU 42 HD11 LEU 42 12.652 1.363 3.252 350 2HD1 LEU 42 HD12 LEU 42 12.330 3.062 2.840 351 3HD1 LEU 42 HD13 LEU 42 11.014 1.868 2.802 352 1HD2 LEU 42 HD21 LEU 42 11.858 3.673 0.344 353 2HD2 LEU 42 HD22 LEU 42 11.604 2.330 -0.796 354 3HD2 LEU 42 HD23 LEU 42 10.485 2.569 0.546 355 H THR 43 H THR 43 15.515 1.698 -2.769 356 HA THR 43 HA THR 43 18.243 1.414 -1.961 357 HB THR 43 HB THR 43 18.685 2.045 -4.330 358 HG1 THR 43 HG1 THR 43 16.958 3.548 -4.457 359 1HG2 THR 43 HG21 THR 43 18.053 -0.299 -3.758 360 2HG2 THR 43 HG22 THR 43 16.349 0.116 -4.030 361 3HG2 THR 43 HG23 THR 43 17.498 0.181 -5.375 362 H ILE 44 H ILE 44 18.052 3.048 -0.211 363 HA ILE 44 HA ILE 44 18.014 5.816 -0.507 364 HB ILE 44 HB ILE 44 19.649 5.702 1.524 365 1HG1 ILE 44 HG12 ILE 44 18.849 2.788 1.654 366 2HG1 ILE 44 HG13 ILE 44 20.307 3.247 0.766 367 1HG2 ILE 44 HG21 ILE 44 17.215 6.060 1.679 368 2HG2 ILE 44 HG22 ILE 44 16.943 4.306 1.645 369 3HG2 ILE 44 HG23 ILE 44 17.797 5.058 3.008 370 1HD1 ILE 44 HD11 ILE 44 20.730 2.630 3.147 371 2HD1 ILE 44 HD12 ILE 44 21.271 4.275 2.750 372 3HD1 ILE 44 HD13 ILE 44 19.759 4.037 3.636 373 H GLY 45 H GLY 45 19.761 7.383 -0.296 374 1HA GLY 45 HA2 GLY 45 21.069 7.656 -2.684 375 2HA GLY 45 HA3 GLY 45 21.490 8.523 -1.202 376 H SER 46 H SER 46 22.339 5.932 -3.346 377 HA SER 46 HA SER 46 24.041 4.455 -3.502 378 1HB SER 46 HB2 SER 46 25.649 6.782 -2.374 379 2HB SER 46 HB3 SER 46 26.287 5.432 -3.326 380 HG SER 46 HG SER 46 24.916 6.140 -5.048 381 H LYS 47 H LYS 47 22.527 4.253 -1.073 382 HA LYS 47 HA LYS 47 22.529 3.441 1.026 383 1HB LYS 47 HB2 LYS 47 24.723 1.752 -0.210 384 2HB LYS 47 HB3 LYS 47 23.959 1.395 1.353 385 1HG LYS 47 HG2 LYS 47 21.765 1.269 0.366 386 2HG LYS 47 HG3 LYS 47 22.376 1.748 -1.232 387 1HD LYS 47 HD2 LYS 47 23.591 -0.317 -1.489 388 2HD LYS 47 HD3 LYS 47 23.375 -0.726 0.223 389 1HE LYS 47 HE2 LYS 47 21.817 -2.040 -1.154 390 2HE LYS 47 HE3 LYS 47 20.964 -0.932 -0.059 391 1HZ LYS 47 HZ1 LYS 47 19.975 -0.907 -2.167 392 2HZ LYS 47 HZ2 LYS 47 20.675 0.559 -1.903 393 3HZ LYS 47 HZ3 LYS 47 21.395 -0.518 -2.928 394 H LEU 48 H LEU 48 24.166 5.877 0.705 395 HA LEU 48 HA LEU 48 26.287 5.656 2.692 396 1HB LEU 48 HB2 LEU 48 24.780 8.054 1.576 397 2HB LEU 48 HB3 LEU 48 26.226 8.150 2.586 398 HG LEU 48 HG LEU 48 26.155 6.759 -0.129 399 1HD1 LEU 48 HD11 LEU 48 27.113 9.558 0.596 400 2HD1 LEU 48 HD12 LEU 48 27.286 8.773 -0.989 401 3HD1 LEU 48 HD13 LEU 48 25.673 9.161 -0.368 402 1HD2 LEU 48 HD21 LEU 48 28.631 7.001 0.011 403 2HD2 LEU 48 HD22 LEU 48 28.465 7.614 1.670 404 3HD2 LEU 48 HD23 LEU 48 27.995 5.945 1.274 405 H GLN 49 H GLN 49 22.838 6.256 2.759 406 HA GLN 49 HA GLN 49 22.798 7.579 5.309 407 1HB GLN 49 HB2 GLN 49 20.546 6.281 3.726 408 2HB GLN 49 HB3 GLN 49 20.347 7.448 5.026 409 1HG GLN 49 HG2 GLN 49 21.455 9.188 3.684 410 2HG GLN 49 HG3 GLN 49 21.785 8.035 2.385 411 1HE2 GLN 49 HE22 GLN 49 19.010 9.343 4.279 412 2HE2 GLN 49 HE21 GLN 49 17.899 9.310 2.918 413 H ASP 50 H ASP 50 24.173 5.052 5.560 414 HA ASP 50 HA ASP 50 22.436 2.927 6.268 415 1HB ASP 50 HB2 ASP 50 24.753 2.603 5.466 416 2HB ASP 50 HB3 ASP 50 25.381 3.327 6.959 417 H ALA 51 H ALA 51 24.156 5.298 8.304 418 HA ALA 51 HA ALA 51 23.507 4.198 10.838 419 1HB ALA 51 HB1 ALA 51 23.777 6.484 11.688 420 2HB ALA 51 HB2 ALA 51 25.068 6.061 10.546 421 3HB ALA 51 HB3 ALA 51 23.738 7.126 10.031 422 H GLU 52 H GLU 52 21.651 6.343 8.662 423 HA GLU 52 HA GLU 52 19.418 6.677 10.427 424 1HB GLU 52 HB2 GLU 52 19.386 6.847 7.376 425 2HB GLU 52 HB3 GLU 52 18.209 7.484 8.519 426 1HG GLU 52 HG2 GLU 52 19.373 9.406 8.170 427 2HG GLU 52 HG3 GLU 52 20.342 8.785 9.508 428 H ILE 53 H ILE 53 20.106 4.365 7.742 429 HA ILE 53 HA ILE 53 17.711 2.890 7.999 430 HB ILE 53 HB ILE 53 20.460 1.730 7.379 431 1HG1 ILE 53 HG12 ILE 53 20.011 3.302 5.691 432 2HG1 ILE 53 HG13 ILE 53 19.595 1.725 5.030 433 1HG2 ILE 53 HG21 ILE 53 17.686 0.547 6.991 434 2HG2 ILE 53 HG22 ILE 53 19.207 -0.117 6.361 435 3HG2 ILE 53 HG23 ILE 53 18.939 -0.031 8.094 436 1HD1 ILE 53 HD11 ILE 53 17.778 4.015 5.787 437 2HD1 ILE 53 HD12 ILE 53 17.798 3.021 4.313 438 3HD1 ILE 53 HD13 ILE 53 17.130 2.370 5.808 439 H VAL 54 H VAL 54 20.793 2.403 9.906 440 HA VAL 54 HA VAL 54 19.439 0.250 11.235 441 HB VAL 54 HB VAL 54 21.306 0.152 12.843 442 1HG1 VAL 54 HG11 VAL 54 21.927 -0.002 9.879 443 2HG1 VAL 54 HG12 VAL 54 22.761 -0.897 11.167 444 3HG1 VAL 54 HG13 VAL 54 21.068 -1.260 10.798 445 1HG2 VAL 54 HG21 VAL 54 22.093 2.523 12.621 446 2HG2 VAL 54 HG22 VAL 54 23.359 1.301 12.396 447 3HG2 VAL 54 HG23 VAL 54 22.671 2.114 10.988 448 H LYS 55 H LYS 55 19.705 3.695 12.094 449 HA LYS 55 HA LYS 55 18.505 3.417 14.675 450 1HB LYS 55 HB2 LYS 55 19.391 5.548 13.895 451 2HB LYS 55 HB3 LYS 55 18.229 5.603 12.566 452 1HG LYS 55 HG2 LYS 55 17.601 7.098 14.404 453 2HG LYS 55 HG3 LYS 55 16.362 5.873 14.110 454 1HD LYS 55 HD2 LYS 55 17.082 4.591 16.079 455 2HD LYS 55 HD3 LYS 55 18.503 5.635 16.280 456 1HE LYS 55 HE2 LYS 55 16.770 6.220 17.900 457 2HE LYS 55 HE3 LYS 55 17.014 7.563 16.770 458 1HZ LYS 55 HZ1 LYS 55 14.703 7.114 17.166 459 2HZ LYS 55 HZ2 LYS 55 15.065 6.817 15.588 460 3HZ LYS 55 HZ3 LYS 55 14.856 5.563 16.631 461 H LEU 56 H LEU 56 17.063 3.767 11.416 462 HA LEU 56 HA LEU 56 14.353 3.468 12.204 463 1HB LEU 56 HB2 LEU 56 14.812 4.490 10.204 464 2HB LEU 56 HB3 LEU 56 15.883 3.227 9.622 465 HG LEU 56 HG LEU 56 13.020 2.442 10.091 466 1HD1 LEU 56 HD11 LEU 56 13.972 4.122 7.728 467 2HD1 LEU 56 HD12 LEU 56 12.411 3.282 7.838 468 3HD1 LEU 56 HD13 LEU 56 12.778 4.614 8.949 469 1HD2 LEU 56 HD21 LEU 56 14.739 0.792 9.260 470 2HD2 LEU 56 HD22 LEU 56 13.497 1.153 8.046 471 3HD2 LEU 56 HD23 LEU 56 15.118 1.889 7.933 472 H MET 57 H MET 57 16.771 0.951 11.324 473 HA MET 57 HA MET 57 14.816 -1.138 11.315 474 1HB MET 57 HB2 MET 57 16.440 -2.629 10.819 475 2HB MET 57 HB3 MET 57 17.131 -1.138 10.188 476 1HG MET 57 HG2 MET 57 18.918 -2.202 11.233 477 2HG MET 57 HG3 MET 57 18.383 -1.084 12.494 478 1HE MET 57 HE1 MET 57 19.713 -2.157 14.361 479 2HE MET 57 HE2 MET 57 19.736 -3.908 14.670 480 3HE MET 57 HE3 MET 57 20.422 -3.266 13.156 481 H ASP 58 H ASP 58 16.953 0.248 13.824 482 HA ASP 58 HA ASP 58 16.205 -1.543 15.912 483 1HB ASP 58 HB2 ASP 58 18.006 0.091 16.198 484 2HB ASP 58 HB3 ASP 58 16.849 1.425 16.117 485 H ASP 59 H ASP 59 14.779 1.614 14.870 486 HA ASP 59 HA ASP 59 12.620 1.604 16.642 487 1HB ASP 59 HB2 ASP 59 12.553 2.651 13.776 488 2HB ASP 59 HB3 ASP 59 11.448 3.089 15.081 489 H LEU 60 H LEU 60 12.672 0.121 13.376 490 HA LEU 60 HA LEU 60 10.078 -1.062 13.472 491 1HB LEU 60 HB2 LEU 60 12.659 -1.670 12.035 492 2HB LEU 60 HB3 LEU 60 11.361 -2.855 11.978 493 HG LEU 60 HG LEU 60 10.675 -0.002 11.349 494 1HD1 LEU 60 HD11 LEU 60 12.645 -0.340 9.931 495 2HD1 LEU 60 HD12 LEU 60 11.964 -1.881 9.359 496 3HD1 LEU 60 HD13 LEU 60 11.164 -0.370 8.936 497 1HD2 LEU 60 HD21 LEU 60 9.845 -2.680 10.108 498 2HD2 LEU 60 HD22 LEU 60 8.922 -1.847 11.390 499 3HD2 LEU 60 HD23 LEU 60 9.107 -1.126 9.769 500 H ASP 61 H ASP 61 13.230 -2.677 14.249 501 HA ASP 61 HA ASP 61 11.933 -5.012 15.131 502 1HB ASP 61 HB2 ASP 61 13.964 -5.915 15.721 503 2HB ASP 61 HB3 ASP 61 14.226 -4.934 14.279 504 H ARG 62 H ARG 62 12.551 -2.111 16.913 505 HA ARG 62 HA ARG 62 12.438 -2.920 19.532 506 1HB ARG 62 HB2 ARG 62 12.565 -0.548 18.399 507 2HB ARG 62 HB3 ARG 62 10.810 -0.534 18.591 508 1HG ARG 62 HG2 ARG 62 11.168 -0.869 21.064 509 2HG ARG 62 HG3 ARG 62 12.917 -0.947 20.764 510 1HD ARG 62 HD2 ARG 62 12.665 1.403 19.660 511 2HD ARG 62 HD3 ARG 62 11.062 1.429 20.384 512 HE ARG 62 HE ARG 62 11.977 1.725 22.478 513 1HH1 ARG 62 HH22 ARG 62 14.600 0.892 20.199 514 2HH1 ARG 62 HH21 ARG 62 15.854 1.201 21.353 515 1HH2 ARG 62 HH12 ARG 62 13.645 2.153 23.954 516 2HH2 ARG 62 HH11 ARG 62 15.316 1.948 23.504 517 H ASN 63 H ASN 63 9.794 -2.918 17.181 518 HA ASN 63 HA ASN 63 7.579 -3.267 18.824 519 1HB ASN 63 HB2 ASN 63 6.465 -4.245 17.054 520 2HB ASN 63 HB3 ASN 63 7.651 -3.214 16.252 521 1HD2 ASN 63 HD22 ASN 63 9.858 -4.471 15.922 522 2HD2 ASN 63 HD21 ASN 63 9.804 -6.187 15.549 523 H LYS 64 H LYS 64 10.200 -5.562 18.335 524 HA LYS 64 HA LYS 64 8.973 -7.338 20.402 525 1HB LYS 64 HB2 LYS 64 10.378 -8.225 17.855 526 2HB LYS 64 HB3 LYS 64 10.080 -9.262 19.260 527 1HG LYS 64 HG2 LYS 64 7.656 -8.968 19.031 528 2HG LYS 64 HG3 LYS 64 7.885 -7.806 17.735 529 1HD LYS 64 HD2 LYS 64 7.251 -9.945 16.789 530 2HD LYS 64 HD3 LYS 64 8.872 -9.483 16.270 531 1HE LYS 64 HE2 LYS 64 8.734 -11.891 16.813 532 2HE LYS 64 HE3 LYS 64 9.870 -11.079 17.893 533 1HZ LYS 64 HZ1 LYS 64 8.163 -11.019 19.554 534 2HZ LYS 64 HZ2 LYS 64 7.087 -11.753 18.543 535 3HZ LYS 64 HZ3 LYS 64 8.427 -12.566 19.055 536 H ASP 65 H ASP 65 11.963 -6.727 18.617 537 HA ASP 65 HA ASP 65 13.633 -5.810 20.478 538 1HB ASP 65 HB2 ASP 65 14.983 -7.546 21.412 539 2HB ASP 65 HB3 ASP 65 13.348 -7.832 21.956 540 H GLN 66 H GLN 66 13.651 -8.583 18.291 541 HA GLN 66 HA GLN 66 15.812 -7.376 16.589 542 1HB GLN 66 HB2 GLN 66 15.740 -10.100 17.953 543 2HB GLN 66 HB3 GLN 66 16.877 -9.683 16.670 544 1HG GLN 66 HG2 GLN 66 17.812 -7.855 18.013 545 2HG GLN 66 HG3 GLN 66 16.704 -8.215 19.339 546 1HE2 GLN 66 HE22 GLN 66 16.807 -10.378 20.357 547 2HE2 GLN 66 HE21 GLN 66 18.370 -11.192 20.383 548 H GLU 67 H GLU 67 12.714 -8.316 16.485 549 HA GLU 67 HA GLU 67 12.926 -9.378 13.758 550 1HB GLU 67 HB2 GLU 67 11.133 -10.554 15.934 551 2HB GLU 67 HB3 GLU 67 11.134 -11.009 14.225 552 1HG GLU 67 HG2 GLU 67 13.520 -11.776 14.484 553 2HG GLU 67 HG3 GLU 67 13.386 -11.479 16.227 554 H VAL 68 H VAL 68 11.018 -8.888 12.574 555 HA VAL 68 HA VAL 68 9.302 -6.725 13.748 556 HB VAL 68 HB VAL 68 10.034 -6.971 10.826 557 1HG1 VAL 68 HG11 VAL 68 7.961 -5.716 11.535 558 2HG1 VAL 68 HG12 VAL 68 8.990 -4.646 12.506 559 3HG1 VAL 68 HG13 VAL 68 9.183 -4.710 10.742 560 1HG2 VAL 68 HG21 VAL 68 11.399 -5.256 12.935 561 2HG2 VAL 68 HG22 VAL 68 12.162 -6.552 11.983 562 3HG2 VAL 68 HG23 VAL 68 11.591 -5.088 11.182 563 H ASN 69 H ASN 69 7.276 -7.554 14.105 564 HA ASN 69 HA ASN 69 6.400 -9.875 12.514 565 1HB ASN 69 HB2 ASN 69 5.725 -9.719 14.865 566 2HB ASN 69 HB3 ASN 69 4.919 -8.178 14.540 567 1HD2 ASN 69 HD21 ASN 69 4.910 -11.681 13.830 568 2HD2 ASN 69 HD22 ASN 69 3.241 -11.740 13.281 569 H PHE 70 H PHE 70 4.741 -9.839 10.943 570 HA PHE 70 HA PHE 70 4.655 -7.875 9.057 571 1HB PHE 70 HB2 PHE 70 3.705 -10.041 8.674 572 2HB PHE 70 HB3 PHE 70 2.485 -9.801 9.927 573 HD1 PHE 70 HD1 PHE 70 3.698 -8.368 6.677 574 HD2 PHE 70 HD2 PHE 70 0.404 -8.744 9.434 575 HE1 PHE 70 HE1 PHE 70 2.280 -6.992 5.182 576 HE2 PHE 70 HE2 PHE 70 -1.007 -7.403 7.933 577 HZ PHE 70 HZ PHE 70 -0.086 -6.544 5.782 578 H GLN 71 H GLN 71 2.209 -8.028 11.732 579 HA GLN 71 HA GLN 71 0.731 -5.805 10.694 580 1HB GLN 71 HB2 GLN 71 -0.166 -7.435 12.310 581 2HB GLN 71 HB3 GLN 71 0.940 -6.837 13.553 582 1HG GLN 71 HG2 GLN 71 -0.177 -4.560 13.346 583 2HG GLN 71 HG3 GLN 71 -1.296 -5.277 12.176 584 1HE2 GLN 71 HE22 GLN 71 -0.040 -5.659 15.539 585 2HE2 GLN 71 HE21 GLN 71 -1.560 -6.272 16.187 586 H GLU 72 H GLU 72 3.407 -6.066 12.994 587 HA GLU 72 HA GLU 72 3.383 -3.295 13.802 588 1HB GLU 72 HB2 GLU 72 5.309 -5.600 14.178 589 2HB GLU 72 HB3 GLU 72 5.664 -3.958 14.728 590 1HG GLU 72 HG2 GLU 72 4.647 -5.400 16.518 591 2HG GLU 72 HG3 GLU 72 3.754 -3.908 16.198 592 H TYR 73 H TYR 73 5.095 -5.176 11.312 593 HA TYR 73 HA TYR 73 6.803 -3.119 10.324 594 1HB TYR 73 HB2 TYR 73 7.305 -5.112 9.377 595 2HB TYR 73 HB3 TYR 73 5.656 -5.661 9.291 596 HD1 TYR 73 HD1 TYR 73 8.313 -3.806 7.531 597 HD2 TYR 73 HD2 TYR 73 4.280 -5.315 7.355 598 HE1 TYR 73 HE1 TYR 73 8.427 -3.873 5.053 599 HE2 TYR 73 HE2 TYR 73 4.338 -5.211 4.897 600 HH TYR 73 HH TYR 73 5.761 -5.129 3.056 601 H ILE 74 H ILE 74 3.385 -3.940 9.350 602 HA ILE 74 HA ILE 74 3.248 -1.620 7.660 603 HB ILE 74 HB ILE 74 0.996 -3.242 8.878 604 1HG1 ILE 74 HG12 ILE 74 2.777 -3.406 6.471 605 2HG1 ILE 74 HG13 ILE 74 2.010 -4.685 7.414 606 1HG2 ILE 74 HG21 ILE 74 -0.433 -2.088 7.167 607 2HG2 ILE 74 HG22 ILE 74 0.164 -0.996 8.391 608 3HG2 ILE 74 HG23 ILE 74 0.934 -1.016 6.791 609 1HD1 ILE 74 HD11 ILE 74 1.219 -4.595 5.099 610 2HD1 ILE 74 HD12 ILE 74 -0.121 -4.221 6.206 611 3HD1 ILE 74 HD13 ILE 74 0.697 -2.925 5.300 612 H THR 75 H THR 75 2.324 -2.031 11.079 613 HA THR 75 HA THR 75 1.312 0.539 11.589 614 HB THR 75 HB THR 75 3.198 -1.038 13.396 615 HG1 THR 75 HG1 THR 75 1.402 -2.290 12.680 616 1HG2 THR 75 HG21 THR 75 1.042 0.994 14.049 617 2HG2 THR 75 HG22 THR 75 1.939 0.017 15.224 618 3HG2 THR 75 HG23 THR 75 2.790 1.224 14.243 619 H PHE 76 H PHE 76 4.752 -0.541 11.620 620 HA PHE 76 HA PHE 76 5.841 2.049 12.056 621 1HB PHE 76 HB2 PHE 76 7.129 -0.014 12.400 622 2HB PHE 76 HB3 PHE 76 7.091 -0.330 10.666 623 HD1 PHE 76 HD1 PHE 76 8.459 1.023 9.089 624 HD2 PHE 76 HD2 PHE 76 8.416 1.934 13.315 625 HE1 PHE 76 HE1 PHE 76 10.353 2.544 8.781 626 HE2 PHE 76 HE2 PHE 76 10.202 3.614 12.950 627 HZ PHE 76 HZ PHE 76 11.152 3.950 10.675 628 H LEU 77 H LEU 77 5.101 0.300 8.950 629 HA LEU 77 HA LEU 77 6.128 2.379 7.298 630 1HB LEU 77 HB2 LEU 77 3.914 0.379 6.768 631 2HB LEU 77 HB3 LEU 77 4.511 1.508 5.555 632 HG LEU 77 HG LEU 77 6.317 -0.477 7.000 633 1HD1 LEU 77 HD11 LEU 77 6.351 -1.754 4.938 634 2HD1 LEU 77 HD12 LEU 77 4.745 -1.758 5.688 635 3HD1 LEU 77 HD13 LEU 77 5.069 -0.741 4.251 636 1HD2 LEU 77 HD21 LEU 77 7.823 -0.023 5.030 637 2HD2 LEU 77 HD22 LEU 77 6.687 1.215 4.475 638 3HD2 LEU 77 HD23 LEU 77 7.576 1.424 6.005 639 H GLY 78 H GLY 78 3.048 2.178 9.054 640 1HA GLY 78 HA2 GLY 78 1.879 4.573 8.016 641 2HA GLY 78 HA3 GLY 78 1.641 3.913 9.650 642 H ALA 79 H ALA 79 4.193 4.076 10.727 643 HA ALA 79 HA ALA 79 4.502 6.871 11.331 644 1HB ALA 79 HB1 ALA 79 5.215 5.059 12.865 645 2HB ALA 79 HB2 ALA 79 6.542 4.649 11.754 646 3HB ALA 79 HB3 ALA 79 6.498 6.237 12.529 647 H LEU 80 H LEU 80 6.175 4.706 9.024 648 HA LEU 80 HA LEU 80 8.118 6.560 8.197 649 1HB LEU 80 HB2 LEU 80 7.933 4.011 7.717 650 2HB LEU 80 HB3 LEU 80 6.898 4.478 6.365 651 HG LEU 80 HG LEU 80 8.789 5.900 5.485 652 1HD1 LEU 80 HD11 LEU 80 11.097 5.283 6.391 653 2HD1 LEU 80 HD12 LEU 80 10.154 6.297 7.481 654 3HD1 LEU 80 HD13 LEU 80 10.279 4.553 7.784 655 1HD2 LEU 80 HD21 LEU 80 8.359 3.576 4.686 656 2HD2 LEU 80 HD22 LEU 80 10.082 3.992 4.638 657 3HD2 LEU 80 HD23 LEU 80 9.460 2.965 5.948 658 H ALA 81 H ALA 81 4.835 5.910 6.941 659 HA ALA 81 HA ALA 81 4.752 7.873 4.895 660 1HB ALA 81 HB1 ALA 81 2.530 6.843 6.686 661 2HB ALA 81 HB2 ALA 81 2.327 7.760 5.186 662 3HB ALA 81 HB3 ALA 81 3.066 6.146 5.150 663 H MET 82 H MET 82 3.979 8.111 8.417 664 HA MET 82 HA MET 82 3.382 10.898 8.377 665 1HB MET 82 HB2 MET 82 2.791 9.293 10.192 666 2HB MET 82 HB3 MET 82 4.486 9.292 10.711 667 1HG MET 82 HG2 MET 82 4.380 11.695 11.169 668 2HG MET 82 HG3 MET 82 2.725 11.764 10.536 669 1HE MET 82 HE1 MET 82 3.633 12.965 13.336 670 2HE MET 82 HE2 MET 82 1.969 13.054 12.701 671 3HE MET 82 HE3 MET 82 2.264 12.459 14.352 672 H ILE 83 H ILE 83 6.496 9.223 8.683 673 HA ILE 83 HA ILE 83 8.032 11.611 9.173 674 HB ILE 83 HB ILE 83 8.771 8.824 8.250 675 1HG1 ILE 83 HG12 ILE 83 9.437 10.295 10.836 676 2HG1 ILE 83 HG13 ILE 83 7.952 9.368 10.655 677 1HG2 ILE 83 HG21 ILE 83 11.151 9.479 8.659 678 2HG2 ILE 83 HG22 ILE 83 10.454 10.318 7.283 679 3HG2 ILE 83 HG23 ILE 83 10.630 11.166 8.833 680 1HD1 ILE 83 HD11 ILE 83 10.766 8.228 10.459 681 2HD1 ILE 83 HD12 ILE 83 9.588 7.994 11.758 682 3HD1 ILE 83 HD13 ILE 83 9.269 7.321 10.151 683 H TYR 84 H TYR 84 7.195 9.832 6.146 684 HA TYR 84 HA TYR 84 8.546 11.539 4.297 685 1HB TYR 84 HB2 TYR 84 5.889 10.050 4.109 686 2HB TYR 84 HB3 TYR 84 6.500 11.079 2.831 687 HD1 TYR 84 HD1 TYR 84 8.970 8.961 4.649 688 HD2 TYR 84 HD2 TYR 84 6.252 9.233 1.303 689 HE1 TYR 84 HE1 TYR 84 10.085 7.041 3.568 690 HE2 TYR 84 HE2 TYR 84 7.403 7.346 0.215 691 HH TYR 84 HH TYR 84 9.084 5.772 0.369 692 H ASN 85 H ASN 85 5.297 11.734 5.720 693 HA ASN 85 HA ASN 85 4.060 13.373 6.503 694 1HB ASN 85 HB2 ASN 85 6.411 14.142 7.369 695 2HB ASN 85 HB3 ASN 85 6.249 15.445 6.194 696 1HD2 ASN 85 HD22 ASN 85 4.821 13.874 9.010 697 2HD2 ASN 85 HD21 ASN 85 3.830 15.245 9.534 698 H GLU 86 H GLU 86 6.005 14.929 3.948 699 HA GLU 86 HA GLU 86 4.067 16.740 2.995 700 1HB GLU 86 HB2 GLU 86 6.182 15.279 1.344 701 2HB GLU 86 HB3 GLU 86 5.379 16.804 0.943 702 1HG GLU 86 HG2 GLU 86 7.345 16.314 3.233 703 2HG GLU 86 HG3 GLU 86 7.597 17.285 1.787 704 H ALA 87 H ALA 87 4.622 13.330 2.207 705 HA ALA 87 HA ALA 87 2.700 12.937 0.193 706 1HB ALA 87 HB1 ALA 87 2.687 10.598 0.946 707 2HB ALA 87 HB2 ALA 87 4.341 11.239 0.913 708 3HB ALA 87 HB3 ALA 87 3.489 11.060 2.465 709 H LEU 88 H LEU 88 2.253 13.180 3.758 710 HA LEU 88 HA LEU 88 -0.559 12.405 3.643 711 1HB LEU 88 HB2 LEU 88 0.802 13.946 5.878 712 2HB LEU 88 HB3 LEU 88 -0.682 13.004 5.906 713 HG LEU 88 HG LEU 88 2.179 12.018 5.873 714 1HD1 LEU 88 HD11 LEU 88 1.270 10.799 7.903 715 2HD1 LEU 88 HD12 LEU 88 1.199 12.570 8.045 716 3HD1 LEU 88 HD13 LEU 88 -0.264 11.632 7.675 717 1HD2 LEU 88 HD21 LEU 88 1.322 9.720 5.783 718 2HD2 LEU 88 HD22 LEU 88 -0.299 10.319 5.397 719 3HD2 LEU 88 HD23 LEU 88 1.051 10.568 4.263 720 H LYS 89 H LYS 89 1.352 15.411 3.894 721 HA LYS 89 HA LYS 89 -0.850 17.203 4.114 722 1HB LYS 89 HB2 LYS 89 1.894 17.660 2.885 723 2HB LYS 89 HB3 LYS 89 0.761 18.933 3.325 724 1HG LYS 89 HG2 LYS 89 1.943 16.946 5.328 725 2HG LYS 89 HG3 LYS 89 2.600 18.545 4.987 726 1HD LYS 89 HD2 LYS 89 0.439 19.587 5.658 727 2HD LYS 89 HD3 LYS 89 -0.196 17.995 6.100 728 1HE LYS 89 HE2 LYS 89 2.261 19.306 7.347 729 2HE LYS 89 HE3 LYS 89 0.636 19.257 8.054 730 1HZ LYS 89 HZ1 LYS 89 0.785 16.852 8.035 731 2HZ LYS 89 HZ2 LYS 89 2.353 16.946 7.491 732 3HZ LYS 89 HZ3 LYS 89 1.953 17.556 8.962 733 H GLY 90 H GLY 90 0.743 15.853 1.222 734 1HA GLY 90 HA2 GLY 90 -1.724 16.337 -0.319 735 2HA GLY 90 HA3 GLY 90 -0.244 17.110 -0.924 736 1H MET 1 H1 MET 1 14.560 -1.199 -4.903 737 2H MET 1 H2 MET 1 14.471 0.202 -5.756 738 3H MET 1 H3 MET 1 14.931 -1.195 -6.506 739 HA MET 1 HA MET 1 12.733 -0.751 -7.146 740 1HB MET 1 HB2 MET 1 13.476 -3.079 -6.737 741 2HB MET 1 HB3 MET 1 12.841 -3.004 -5.097 742 1HG MET 1 HG2 MET 1 10.552 -2.692 -6.013 743 2HG MET 1 HG3 MET 1 11.228 -2.720 -7.656 744 1HE MET 1 HE1 MET 1 9.166 -6.045 -7.351 745 2HE MET 1 HE2 MET 1 8.781 -4.489 -6.578 746 3HE MET 1 HE3 MET 1 9.381 -4.530 -8.258 747 H ALA 2 H ALA 2 12.810 1.427 -5.790 748 HA ALA 2 HA ALA 2 11.371 1.375 -3.276 749 1HB ALA 2 HB1 ALA 2 13.258 2.914 -3.775 750 2HB ALA 2 HB2 ALA 2 12.252 3.743 -4.978 751 3HB ALA 2 HB3 ALA 2 11.794 3.762 -3.262 752 H SER 3 H SER 3 10.679 2.835 -6.508 753 HA SER 3 HA SER 3 8.376 4.054 -6.036 754 1HB SER 3 HB2 SER 3 8.460 2.663 -8.662 755 2HB SER 3 HB3 SER 3 8.309 4.370 -8.254 756 HG SER 3 HG SER 3 10.366 3.930 -9.153 757 HA PRO 4 HA PRO 4 5.769 0.028 -6.973 758 1HB PRO 4 HB2 PRO 4 7.725 -1.918 -5.726 759 2HB PRO 4 HB3 PRO 4 6.469 -2.236 -6.962 760 1HG PRO 4 HG2 PRO 4 9.007 -1.908 -7.784 761 2HG PRO 4 HG3 PRO 4 7.728 -0.984 -8.623 762 1HD PRO 4 HD2 PRO 4 9.497 -0.044 -6.350 763 2HD PRO 4 HD3 PRO 4 9.247 0.737 -7.931 764 H LEU 5 H LEU 5 7.820 0.405 -4.014 765 HA LEU 5 HA LEU 5 5.543 -0.384 -2.319 766 1HB LEU 5 HB2 LEU 5 7.778 -0.986 -1.537 767 2HB LEU 5 HB3 LEU 5 8.283 0.708 -1.592 768 HG LEU 5 HG LEU 5 6.601 1.292 0.142 769 1HD1 LEU 5 HD11 LEU 5 5.476 -0.509 1.409 770 2HD1 LEU 5 HD12 LEU 5 4.868 -0.423 -0.240 771 3HD1 LEU 5 HD13 LEU 5 6.013 -1.707 0.217 772 1HD2 LEU 5 HD21 LEU 5 8.878 0.620 0.831 773 2HD2 LEU 5 HD22 LEU 5 7.624 0.246 2.033 774 3HD2 LEU 5 HD23 LEU 5 8.296 -1.057 1.021 775 H ASP 6 H ASP 6 7.430 2.541 -3.179 776 HA ASP 6 HA ASP 6 6.129 4.362 -1.492 777 1HB ASP 6 HB2 ASP 6 7.256 4.873 -4.259 778 2HB ASP 6 HB3 ASP 6 6.746 6.127 -3.129 779 H GLN 7 H GLN 7 5.120 3.333 -4.794 780 HA GLN 7 HA GLN 7 2.822 5.007 -4.905 781 1HB GLN 7 HB2 GLN 7 2.055 3.652 -6.721 782 2HB GLN 7 HB3 GLN 7 3.800 3.859 -6.837 783 1HG GLN 7 HG2 GLN 7 3.572 1.608 -7.338 784 2HG GLN 7 HG3 GLN 7 3.981 1.600 -5.628 785 1HE2 GLN 7 HE22 GLN 7 3.067 -0.543 -5.417 786 2HE2 GLN 7 HE21 GLN 7 1.317 -0.837 -5.577 787 H ALA 8 H ALA 8 3.325 1.840 -3.306 788 HA ALA 8 HA ALA 8 0.514 1.275 -3.009 789 1HB ALA 8 HB1 ALA 8 2.958 0.121 -1.634 790 2HB ALA 8 HB2 ALA 8 1.291 -0.412 -1.368 791 3HB ALA 8 HB3 ALA 8 2.004 -0.535 -2.982 792 H ILE 9 H ILE 9 3.089 2.426 -0.734 793 HA ILE 9 HA ILE 9 1.220 2.994 1.386 794 HB ILE 9 HB ILE 9 2.986 4.301 2.434 795 1HG1 ILE 9 HG12 ILE 9 4.548 3.890 -0.111 796 2HG1 ILE 9 HG13 ILE 9 3.975 5.446 0.521 797 1HG2 ILE 9 HG21 ILE 9 4.120 1.762 1.228 798 2HG2 ILE 9 HG22 ILE 9 4.475 2.472 2.818 799 3HG2 ILE 9 HG23 ILE 9 2.880 1.798 2.501 800 1HD1 ILE 9 HD11 ILE 9 6.088 3.649 1.779 801 2HD1 ILE 9 HD12 ILE 9 6.304 5.238 1.048 802 3HD1 ILE 9 HD13 ILE 9 5.395 5.089 2.565 803 H GLY 10 H GLY 10 2.498 4.979 -1.287 804 1HA GLY 10 HA2 GLY 10 1.182 7.394 -0.991 805 2HA GLY 10 HA3 GLY 10 1.491 6.573 -2.526 806 H LEU 11 H LEU 11 -0.153 4.335 -2.350 807 HA LEU 11 HA LEU 11 -2.638 5.314 -3.150 808 1HB LEU 11 HB2 LEU 11 -1.414 2.984 -3.483 809 2HB LEU 11 HB3 LEU 11 -2.247 2.526 -2.007 810 HG LEU 11 HG LEU 11 -3.447 1.667 -3.822 811 1HD1 LEU 11 HD11 LEU 11 -5.011 4.087 -2.947 812 2HD1 LEU 11 HD12 LEU 11 -5.627 2.529 -3.534 813 3HD1 LEU 11 HD13 LEU 11 -4.761 2.598 -1.983 814 1HD2 LEU 11 HD21 LEU 11 -3.598 4.439 -5.061 815 2HD2 LEU 11 HD22 LEU 11 -2.541 3.111 -5.596 816 3HD2 LEU 11 HD23 LEU 11 -4.304 2.938 -5.696 817 H LEU 12 H LEU 12 -1.874 3.577 -0.098 818 HA LEU 12 HA LEU 12 -4.354 3.940 1.202 819 1HB LEU 12 HB2 LEU 12 -1.485 3.712 2.251 820 2HB LEU 12 HB3 LEU 12 -2.865 3.918 3.327 821 HG LEU 12 HG LEU 12 -3.908 1.878 2.461 822 1HD1 LEU 12 HD11 LEU 12 -1.248 1.449 1.035 823 2HD1 LEU 12 HD12 LEU 12 -2.510 0.223 1.228 824 3HD1 LEU 12 HD13 LEU 12 -2.833 1.648 0.243 825 1HD2 LEU 12 HD21 LEU 12 -2.362 0.316 3.624 826 2HD2 LEU 12 HD22 LEU 12 -1.092 1.557 3.579 827 3HD2 LEU 12 HD23 LEU 12 -2.578 1.822 4.517 828 H ILE 13 H ILE 13 -1.483 6.062 1.174 829 HA ILE 13 HA ILE 13 -2.513 7.974 3.032 830 HB ILE 13 HB ILE 13 -0.427 8.149 0.819 831 1HG1 ILE 13 HG12 ILE 13 0.046 8.109 3.822 832 2HG1 ILE 13 HG13 ILE 13 -0.093 6.615 2.908 833 1HG2 ILE 13 HG21 ILE 13 -1.048 10.173 2.998 834 2HG2 ILE 13 HG22 ILE 13 0.402 10.197 1.973 835 3HG2 ILE 13 HG23 ILE 13 -1.180 10.437 1.246 836 1HD1 ILE 13 HD11 ILE 13 1.755 7.529 1.360 837 2HD1 ILE 13 HD12 ILE 13 2.038 8.752 2.616 838 3HD1 ILE 13 HD13 ILE 13 2.224 7.029 2.984 839 H GLY 14 H GLY 14 -2.492 7.923 -0.523 840 1HA GLY 14 HA2 GLY 14 -3.714 10.421 -1.000 841 2HA GLY 14 HA3 GLY 14 -3.674 9.032 -2.107 842 H ILE 15 H ILE 15 -5.111 7.077 -0.732 843 HA ILE 15 HA ILE 15 -7.835 7.802 -1.140 844 HB ILE 15 HB ILE 15 -6.350 5.544 0.176 845 1HG1 ILE 15 HG12 ILE 15 -8.528 5.725 -1.966 846 2HG1 ILE 15 HG13 ILE 15 -6.784 5.769 -2.299 847 1HG2 ILE 15 HG21 ILE 15 -8.133 5.884 1.760 848 2HG2 ILE 15 HG22 ILE 15 -9.341 5.981 0.451 849 3HG2 ILE 15 HG23 ILE 15 -8.490 4.461 0.821 850 1HD1 ILE 15 HD11 ILE 15 -7.569 3.526 -2.671 851 2HD1 ILE 15 HD12 ILE 15 -6.587 3.536 -1.171 852 3HD1 ILE 15 HD13 ILE 15 -8.336 3.471 -1.085 853 H PHE 16 H PHE 16 -5.948 7.480 1.893 854 HA PHE 16 HA PHE 16 -8.005 8.222 3.605 855 1HB PHE 16 HB2 PHE 16 -5.755 7.341 4.237 856 2HB PHE 16 HB3 PHE 16 -5.046 8.911 3.925 857 HD1 PHE 16 HD1 PHE 16 -7.159 6.939 6.193 858 HD2 PHE 16 HD2 PHE 16 -5.793 10.920 5.319 859 HE1 PHE 16 HE1 PHE 16 -7.636 7.616 8.536 860 HE2 PHE 16 HE2 PHE 16 -6.560 11.650 7.493 861 HZ PHE 16 HZ PHE 16 -7.283 9.952 9.224 862 H HIS 17 H HIS 17 -5.491 10.430 2.246 863 HA HIS 17 HA HIS 17 -6.724 12.709 3.473 864 1HB HIS 17 HB2 HIS 17 -4.536 12.496 1.390 865 2HB HIS 17 HB3 HIS 17 -5.063 14.012 2.140 866 HD1 HIS 17 HD1 HIS 17 -3.341 10.732 3.074 867 HD2 HIS 17 HD2 HIS 17 -4.659 14.319 4.815 868 HE1 HIS 17 HE1 HIS 17 -2.493 10.739 5.498 869 H LYS 18 H LYS 18 -7.210 11.208 0.298 870 HA LYS 18 HA LYS 18 -8.670 13.376 -0.892 871 1HB LYS 18 HB2 LYS 18 -7.902 11.405 -2.106 872 2HB LYS 18 HB3 LYS 18 -8.979 10.358 -1.154 873 1HG LYS 18 HG2 LYS 18 -10.908 11.795 -2.108 874 2HG LYS 18 HG3 LYS 18 -9.712 12.430 -3.243 875 1HD LYS 18 HD2 LYS 18 -10.567 9.507 -2.875 876 2HD LYS 18 HD3 LYS 18 -11.006 10.585 -4.198 877 1HE LYS 18 HE2 LYS 18 -9.339 9.256 -5.137 878 2HE LYS 18 HE3 LYS 18 -8.471 10.745 -4.727 879 1HZ LYS 18 HZ1 LYS 18 -7.674 9.585 -2.753 880 2HZ LYS 18 HZ2 LYS 18 -8.523 8.241 -3.179 881 3HZ LYS 18 HZ3 LYS 18 -7.282 8.766 -4.123 882 H TYR 19 H TYR 19 -9.713 10.539 1.084 883 HA TYR 19 HA TYR 19 -12.443 11.399 1.216 884 1HB TYR 19 HB2 TYR 19 -10.787 9.325 2.620 885 2HB TYR 19 HB3 TYR 19 -12.363 9.753 3.273 886 HD1 TYR 19 HD1 TYR 19 -10.689 8.171 0.356 887 HD2 TYR 19 HD2 TYR 19 -14.438 9.265 2.154 888 HE1 TYR 19 HE1 TYR 19 -11.889 7.166 -1.539 889 HE2 TYR 19 HE2 TYR 19 -15.639 8.365 0.201 890 HH TYR 19 HH TYR 19 -15.445 7.386 -1.870 891 H SER 20 H SER 20 -9.726 11.916 3.566 892 HA SER 20 HA SER 20 -11.225 13.407 5.434 893 1HB SER 20 HB2 SER 20 -8.346 13.927 4.574 894 2HB SER 20 HB3 SER 20 -9.097 14.307 6.125 895 HG SER 20 HG SER 20 -9.133 12.260 6.682 896 H GLY 21 H GLY 21 -9.453 14.531 2.528 897 1HA GLY 21 HA2 GLY 21 -9.937 17.261 2.620 898 2HA GLY 21 HA3 GLY 21 -9.739 16.299 1.143 899 H LYS 22 H LYS 22 -12.012 14.653 1.250 900 HA LYS 22 HA LYS 22 -14.033 16.157 0.131 901 1HB LYS 22 HB2 LYS 22 -13.734 13.610 0.250 902 2HB LYS 22 HB3 LYS 22 -14.588 13.692 1.806 903 1HG LYS 22 HG2 LYS 22 -16.455 14.923 0.591 904 2HG LYS 22 HG3 LYS 22 -15.640 14.524 -0.928 905 1HD LYS 22 HD2 LYS 22 -16.829 12.661 1.166 906 2HD LYS 22 HD3 LYS 22 -17.400 12.896 -0.485 907 1HE LYS 22 HE2 LYS 22 -14.819 11.519 0.396 908 2HE LYS 22 HE3 LYS 22 -16.251 10.761 -0.303 909 1HZ LYS 22 HZ1 LYS 22 -14.542 11.051 -1.924 910 2HZ LYS 22 HZ2 LYS 22 -15.847 11.980 -2.322 911 3HZ LYS 22 HZ3 LYS 22 -14.502 12.680 -1.671 912 H GLU 23 H GLU 23 -13.513 15.548 3.614 913 HA GLU 23 HA GLU 23 -15.868 17.292 4.265 914 1HB GLU 23 HB2 GLU 23 -15.812 16.200 6.483 915 2HB GLU 23 HB3 GLU 23 -16.252 15.129 5.150 916 1HG GLU 23 HG2 GLU 23 -14.015 14.140 5.118 917 2HG GLU 23 HG3 GLU 23 -13.462 15.271 6.367 918 H GLY 24 H GLY 24 -13.062 18.069 3.443 919 1HA GLY 24 HA2 GLY 24 -11.515 19.622 4.010 920 2HA GLY 24 HA3 GLY 24 -12.775 20.331 5.032 921 H ASP 25 H ASP 25 -11.426 17.090 5.579 922 HA ASP 25 HA ASP 25 -10.275 18.037 8.164 923 1HB ASP 25 HB2 ASP 25 -12.107 16.294 8.124 924 2HB ASP 25 HB3 ASP 25 -10.970 15.188 7.343 925 H LYS 26 H LYS 26 -8.218 17.013 8.777 926 HA LYS 26 HA LYS 26 -6.350 16.862 6.439 927 1HB LYS 26 HB2 LYS 26 -5.839 17.572 9.357 928 2HB LYS 26 HB3 LYS 26 -4.616 17.490 8.065 929 1HG LYS 26 HG2 LYS 26 -5.854 19.241 6.801 930 2HG LYS 26 HG3 LYS 26 -7.024 19.364 8.128 931 1HD LYS 26 HD2 LYS 26 -5.197 19.997 9.688 932 2HD LYS 26 HD3 LYS 26 -4.025 19.890 8.357 933 1HE LYS 26 HE2 LYS 26 -5.260 21.669 7.128 934 2HE LYS 26 HE3 LYS 26 -6.430 21.775 8.457 935 1HZ LYS 26 HZ1 LYS 26 -4.761 23.456 8.609 936 2HZ LYS 26 HZ2 LYS 26 -4.645 22.434 9.896 937 3HZ LYS 26 HZ3 LYS 26 -3.555 22.335 8.662 938 H HIS 27 H HIS 27 -4.902 15.671 9.263 939 HA HIS 27 HA HIS 27 -4.742 13.041 8.052 940 1HB HIS 27 HB2 HIS 27 -3.608 14.046 10.677 941 2HB HIS 27 HB3 HIS 27 -3.097 12.612 9.778 942 HD1 HIS 27 HD1 HIS 27 -2.837 13.885 6.866 943 HD2 HIS 27 HD2 HIS 27 -1.534 15.644 10.468 944 HE1 HIS 27 HE1 HIS 27 -1.120 15.663 6.241 945 H THR 28 H THR 28 -7.453 13.522 8.765 946 HA THR 28 HA THR 28 -7.976 11.380 10.658 947 HB THR 28 HB THR 28 -8.804 14.225 11.235 948 HG1 THR 28 HG1 THR 28 -6.732 12.707 12.047 949 1HG2 THR 28 HG21 THR 28 -9.915 13.407 13.224 950 2HG2 THR 28 HG22 THR 28 -10.647 12.603 11.833 951 3HG2 THR 28 HG23 THR 28 -9.460 11.737 12.851 952 H LEU 29 H LEU 29 -10.106 10.594 10.445 953 HA LEU 29 HA LEU 29 -11.793 11.613 8.196 954 1HB LEU 29 HB2 LEU 29 -11.048 8.747 8.948 955 2HB LEU 29 HB3 LEU 29 -12.418 9.131 7.911 956 HG LEU 29 HG LEU 29 -9.553 9.868 7.205 957 1HD1 LEU 29 HD11 LEU 29 -9.855 7.389 7.392 958 2HD1 LEU 29 HD12 LEU 29 -11.274 7.494 6.337 959 3HD1 LEU 29 HD13 LEU 29 -9.664 7.896 5.702 960 1HD2 LEU 29 HD21 LEU 29 -12.129 9.686 5.579 961 2HD2 LEU 29 HD22 LEU 29 -11.319 11.190 6.054 962 3HD2 LEU 29 HD23 LEU 29 -10.511 10.067 4.945 963 H SER 30 H SER 30 -14.062 11.444 8.679 964 HA SER 30 HA SER 30 -14.744 10.756 11.473 965 1HB SER 30 HB2 SER 30 -16.957 11.544 10.926 966 2HB SER 30 HB3 SER 30 -15.779 12.726 10.344 967 HG SER 30 HG SER 30 -16.558 12.403 8.412 968 H LYS 31 H LYS 31 -16.447 9.218 11.940 969 HA LYS 31 HA LYS 31 -16.169 6.661 11.102 970 1HB LYS 31 HB2 LYS 31 -18.672 6.466 11.824 971 2HB LYS 31 HB3 LYS 31 -17.474 7.017 13.005 972 1HG LYS 31 HG2 LYS 31 -18.245 9.311 12.820 973 2HG LYS 31 HG3 LYS 31 -19.338 8.892 11.484 974 1HD LYS 31 HD2 LYS 31 -20.591 7.371 12.956 975 2HD LYS 31 HD3 LYS 31 -19.501 7.767 14.295 976 1HE LYS 31 HE2 LYS 31 -20.191 10.155 14.156 977 2HE LYS 31 HE3 LYS 31 -21.263 9.773 12.793 978 1HZ LYS 31 HZ1 LYS 31 -22.494 8.336 14.254 979 2HZ LYS 31 HZ2 LYS 31 -21.484 8.692 15.510 980 3HZ LYS 31 HZ3 LYS 31 -22.438 9.870 14.858 981 H LYS 32 H LYS 32 -18.542 8.901 9.712 982 HA LYS 32 HA LYS 32 -19.545 6.789 7.939 983 1HB LYS 32 HB2 LYS 32 -21.116 8.260 8.887 984 2HB LYS 32 HB3 LYS 32 -20.295 9.701 8.219 985 1HG LYS 32 HG2 LYS 32 -20.872 8.977 5.925 986 2HG LYS 32 HG3 LYS 32 -21.502 7.447 6.545 987 1HD LYS 32 HD2 LYS 32 -23.343 8.915 6.009 988 2HD LYS 32 HD3 LYS 32 -23.298 8.661 7.760 989 1HE LYS 32 HE2 LYS 32 -22.250 10.880 8.078 990 2HE LYS 32 HE3 LYS 32 -22.144 11.105 6.320 991 1HZ LYS 32 HZ1 LYS 32 -24.006 12.235 7.260 992 2HZ LYS 32 HZ2 LYS 32 -24.526 11.051 6.241 993 3HZ LYS 32 HZ3 LYS 32 -24.621 10.835 7.873 994 H GLU 33 H GLU 33 -17.335 9.588 7.679 995 HA GLU 33 HA GLU 33 -17.045 9.434 4.844 996 1HB GLU 33 HB2 GLU 33 -16.228 11.290 6.385 997 2HB GLU 33 HB3 GLU 33 -14.896 10.215 6.856 998 1HG GLU 33 HG2 GLU 33 -14.069 11.651 5.113 999 2HG GLU 33 HG3 GLU 33 -14.320 10.077 4.366 1000 H LEU 34 H LEU 34 -15.447 7.716 7.584 1001 HA LEU 34 HA LEU 34 -13.702 6.171 5.970 1002 1HB LEU 34 HB2 LEU 34 -13.357 6.326 8.321 1003 2HB LEU 34 HB3 LEU 34 -14.931 5.657 8.705 1004 HG LEU 34 HG LEU 34 -13.042 4.132 9.081 1005 1HD1 LEU 34 HD11 LEU 34 -14.775 2.822 6.993 1006 2HD1 LEU 34 HD12 LEU 34 -14.144 2.177 8.500 1007 3HD1 LEU 34 HD13 LEU 34 -15.451 3.366 8.533 1008 1HD2 LEU 34 HD21 LEU 34 -11.623 4.785 7.169 1009 2HD2 LEU 34 HD22 LEU 34 -11.896 3.033 7.180 1010 3HD2 LEU 34 HD23 LEU 34 -12.774 4.041 6.043 1011 H LYS 35 H LYS 35 -17.069 5.416 7.151 1012 HA LYS 35 HA LYS 35 -17.265 2.959 5.807 1013 1HB LYS 35 HB2 LYS 35 -19.006 3.667 7.283 1014 2HB LYS 35 HB3 LYS 35 -19.443 5.037 6.237 1015 1HG LYS 35 HG2 LYS 35 -20.119 3.515 4.435 1016 2HG LYS 35 HG3 LYS 35 -19.629 2.109 5.387 1017 1HD LYS 35 HD2 LYS 35 -21.799 4.094 6.196 1018 2HD LYS 35 HD3 LYS 35 -22.093 2.613 5.269 1019 1HE LYS 35 HE2 LYS 35 -21.152 1.244 7.132 1020 2HE LYS 35 HE3 LYS 35 -20.956 2.719 8.094 1021 1HZ LYS 35 HZ1 LYS 35 -23.358 3.070 7.796 1022 2HZ LYS 35 HZ2 LYS 35 -23.462 1.600 7.045 1023 3HZ LYS 35 HZ3 LYS 35 -23.016 1.688 8.620 1024 H GLU 36 H GLU 36 -17.928 6.223 4.467 1025 HA GLU 36 HA GLU 36 -18.633 5.434 1.876 1026 1HB GLU 36 HB2 GLU 36 -18.696 7.777 3.024 1027 2HB GLU 36 HB3 GLU 36 -17.031 7.955 2.467 1028 1HG GLU 36 HG2 GLU 36 -18.481 8.984 0.843 1029 2HG GLU 36 HG3 GLU 36 -17.855 7.501 0.106 1030 H LEU 37 H LEU 37 -15.392 6.189 3.183 1031 HA LEU 37 HA LEU 37 -13.790 5.755 0.905 1032 1HB LEU 37 HB2 LEU 37 -13.022 6.666 3.034 1033 2HB LEU 37 HB3 LEU 37 -13.234 5.133 3.843 1034 HG LEU 37 HG LEU 37 -11.293 5.424 1.569 1035 1HD1 LEU 37 HD11 LEU 37 -9.574 5.733 3.376 1036 2HD1 LEU 37 HD12 LEU 37 -10.696 7.087 3.223 1037 3HD1 LEU 37 HD13 LEU 37 -10.889 5.902 4.545 1038 1HD2 LEU 37 HD21 LEU 37 -10.156 3.543 2.783 1039 2HD2 LEU 37 HD22 LEU 37 -11.495 3.476 3.940 1040 3HD2 LEU 37 HD23 LEU 37 -11.755 3.063 2.226 1041 H ILE 38 H ILE 38 -14.910 3.361 3.336 1042 HA ILE 38 HA ILE 38 -13.778 1.156 1.891 1043 HB ILE 38 HB ILE 38 -15.928 1.245 4.034 1044 1HG1 ILE 38 HG12 ILE 38 -12.911 0.686 4.028 1045 2HG1 ILE 38 HG13 ILE 38 -13.692 2.142 4.652 1046 1HG2 ILE 38 HG21 ILE 38 -16.161 -0.859 2.786 1047 2HG2 ILE 38 HG22 ILE 38 -14.399 -1.088 2.822 1048 3HG2 ILE 38 HG23 ILE 38 -15.353 -1.198 4.309 1049 1HD1 ILE 38 HD11 ILE 38 -13.227 0.859 6.522 1050 2HD1 ILE 38 HD12 ILE 38 -14.977 0.632 6.258 1051 3HD1 ILE 38 HD13 ILE 38 -13.814 -0.640 5.779 1052 H GLN 39 H GLN 39 -17.004 2.695 1.652 1053 HA GLN 39 HA GLN 39 -18.114 0.591 0.030 1054 1HB GLN 39 HB2 GLN 39 -18.852 3.546 -0.090 1055 2HB GLN 39 HB3 GLN 39 -19.766 2.172 -0.712 1056 1HG GLN 39 HG2 GLN 39 -19.505 3.134 2.100 1057 2HG GLN 39 HG3 GLN 39 -20.908 2.568 1.225 1058 1HE2 GLN 39 HE22 GLN 39 -18.216 1.644 3.257 1059 2HE2 GLN 39 HE21 GLN 39 -18.710 -0.039 3.474 1060 H LYS 40 H LYS 40 -16.236 3.547 -0.816 1061 HA LYS 40 HA LYS 40 -16.374 2.963 -3.636 1062 1HB LYS 40 HB2 LYS 40 -15.802 5.159 -2.366 1063 2HB LYS 40 HB3 LYS 40 -14.143 4.566 -2.345 1064 1HG LYS 40 HG2 LYS 40 -15.909 5.151 -4.775 1065 2HG LYS 40 HG3 LYS 40 -14.561 6.112 -4.181 1066 1HD LYS 40 HD2 LYS 40 -13.311 5.071 -5.721 1067 2HD LYS 40 HD3 LYS 40 -13.255 3.744 -4.578 1068 1HE LYS 40 HE2 LYS 40 -13.875 2.798 -6.684 1069 2HE LYS 40 HE3 LYS 40 -15.380 2.831 -5.762 1070 1HZ LYS 40 HZ1 LYS 40 -15.688 3.626 -7.969 1071 2HZ LYS 40 HZ2 LYS 40 -15.963 4.850 -6.902 1072 3HZ LYS 40 HZ3 LYS 40 -14.560 4.810 -7.766 1073 H GLU 41 H GLU 41 -13.801 2.474 -1.188 1074 HA GLU 41 HA GLU 41 -11.953 1.273 -2.973 1075 1HB GLU 41 HB2 GLU 41 -12.241 1.433 0.035 1076 2HB GLU 41 HB3 GLU 41 -11.065 0.318 -0.653 1077 1HG GLU 41 HG2 GLU 41 -10.108 2.525 -0.111 1078 2HG GLU 41 HG3 GLU 41 -9.888 2.001 -1.794 1079 H LEU 42 H LEU 42 -14.114 -0.361 -0.604 1080 HA LEU 42 HA LEU 42 -13.180 -2.975 -1.716 1081 1HB LEU 42 HB2 LEU 42 -14.765 -2.443 0.803 1082 2HB LEU 42 HB3 LEU 42 -14.110 -3.984 0.242 1083 HG LEU 42 HG LEU 42 -12.554 -1.560 1.228 1084 1HD1 LEU 42 HD11 LEU 42 -11.763 -3.118 2.937 1085 2HD1 LEU 42 HD12 LEU 42 -13.534 -3.182 2.906 1086 3HD1 LEU 42 HD13 LEU 42 -12.593 -4.473 2.146 1087 1HD2 LEU 42 HD21 LEU 42 -10.491 -2.944 0.854 1088 2HD2 LEU 42 HD22 LEU 42 -11.462 -4.085 -0.096 1089 3HD2 LEU 42 HD23 LEU 42 -11.239 -2.408 -0.648 1090 H THR 43 H THR 43 -16.164 -1.100 -1.119 1091 HA THR 43 HA THR 43 -18.272 -1.356 -1.969 1092 HB THR 43 HB THR 43 -17.075 -2.789 -4.368 1093 HG1 THR 43 HG1 THR 43 -16.680 -0.104 -3.584 1094 1HG2 THR 43 HG21 THR 43 -18.619 -1.333 -5.601 1095 2HG2 THR 43 HG22 THR 43 -19.510 -2.253 -4.375 1096 3HG2 THR 43 HG23 THR 43 -19.122 -0.539 -4.094 1097 H ILE 44 H ILE 44 -17.963 -3.130 -0.068 1098 HA ILE 44 HA ILE 44 -17.975 -5.831 -0.731 1099 HB ILE 44 HB ILE 44 -18.731 -6.313 1.456 1100 1HG1 ILE 44 HG12 ILE 44 -20.625 -4.915 1.806 1101 2HG1 ILE 44 HG13 ILE 44 -19.459 -4.661 3.090 1102 1HG2 ILE 44 HG21 ILE 44 -17.045 -5.215 2.758 1103 2HG2 ILE 44 HG22 ILE 44 -16.428 -5.500 1.128 1104 3HG2 ILE 44 HG23 ILE 44 -16.926 -3.870 1.608 1105 1HD1 ILE 44 HD11 ILE 44 -20.425 -2.553 2.509 1106 2HD1 ILE 44 HD12 ILE 44 -18.735 -2.517 1.992 1107 3HD1 ILE 44 HD13 ILE 44 -20.040 -2.745 0.800 1108 H GLY 45 H GLY 45 -19.468 -7.390 -1.024 1109 1HA GLY 45 HA2 GLY 45 -21.309 -7.329 -2.861 1110 2HA GLY 45 HA3 GLY 45 -21.474 -8.421 -1.486 1111 H SER 46 H SER 46 -22.647 -5.528 -3.004 1112 HA SER 46 HA SER 46 -24.406 -4.151 -2.682 1113 1HB SER 46 HB2 SER 46 -25.803 -6.735 -1.886 1114 2HB SER 46 HB3 SER 46 -26.556 -5.274 -2.545 1115 HG SER 46 HG SER 46 -24.628 -6.918 -3.844 1116 H LYS 47 H LYS 47 -22.701 -4.256 -0.363 1117 HA LYS 47 HA LYS 47 -22.601 -3.605 1.781 1118 1HB LYS 47 HB2 LYS 47 -25.303 -2.306 1.230 1119 2HB LYS 47 HB3 LYS 47 -24.247 -1.991 2.592 1120 1HG LYS 47 HG2 LYS 47 -23.804 -0.229 1.178 1121 2HG LYS 47 HG3 LYS 47 -22.419 -1.302 1.044 1122 1HD LYS 47 HD2 LYS 47 -23.027 -0.299 -1.090 1123 2HD LYS 47 HD3 LYS 47 -23.168 -2.045 -1.187 1124 1HE LYS 47 HE2 LYS 47 -25.653 -1.854 -0.932 1125 2HE LYS 47 HE3 LYS 47 -25.491 -0.102 -0.724 1126 1HZ LYS 47 HZ1 LYS 47 -26.102 -0.699 -2.939 1127 2HZ LYS 47 HZ2 LYS 47 -24.616 0.011 -2.939 1128 3HZ LYS 47 HZ3 LYS 47 -24.751 -1.622 -3.124 1129 H LEU 48 H LEU 48 -24.106 -6.265 1.157 1130 HA LEU 48 HA LEU 48 -26.033 -6.633 3.221 1131 1HB LEU 48 HB2 LEU 48 -24.085 -8.608 1.962 1132 2HB LEU 48 HB3 LEU 48 -25.456 -9.065 2.979 1133 HG LEU 48 HG LEU 48 -25.719 -7.552 0.338 1134 1HD1 LEU 48 HD11 LEU 48 -26.498 -9.697 -0.581 1135 2HD1 LEU 48 HD12 LEU 48 -24.832 -9.831 0.009 1136 3HD1 LEU 48 HD13 LEU 48 -26.169 -10.496 0.972 1137 1HD2 LEU 48 HD21 LEU 48 -28.110 -8.247 0.516 1138 2HD2 LEU 48 HD22 LEU 48 -27.794 -8.825 2.166 1139 3HD2 LEU 48 HD23 LEU 48 -27.634 -7.098 1.766 1140 H GLN 49 H GLN 49 -22.529 -6.704 3.262 1141 HA GLN 49 HA GLN 49 -22.361 -7.683 6.007 1142 1HB GLN 49 HB2 GLN 49 -20.208 -6.416 4.273 1143 2HB GLN 49 HB3 GLN 49 -19.967 -7.409 5.709 1144 1HG GLN 49 HG2 GLN 49 -21.078 -8.331 3.016 1145 2HG GLN 49 HG3 GLN 49 -19.512 -8.725 3.716 1146 1HE2 GLN 49 HE22 GLN 49 -19.764 -9.652 6.120 1147 2HE2 GLN 49 HE21 GLN 49 -20.966 -10.929 6.246 1148 H ASP 50 H ASP 50 -23.712 -4.847 5.213 1149 HA ASP 50 HA ASP 50 -22.160 -2.797 6.123 1150 1HB ASP 50 HB2 ASP 50 -24.359 -2.426 5.173 1151 2HB ASP 50 HB3 ASP 50 -25.141 -3.143 6.596 1152 H ALA 51 H ALA 51 -23.990 -5.040 8.211 1153 HA ALA 51 HA ALA 51 -23.526 -3.847 10.733 1154 1HB ALA 51 HB1 ALA 51 -24.979 -5.798 10.401 1155 2HB ALA 51 HB2 ALA 51 -23.571 -6.804 9.993 1156 3HB ALA 51 HB3 ALA 51 -23.742 -6.136 11.629 1157 H GLU 52 H GLU 52 -21.414 -5.972 8.780 1158 HA GLU 52 HA GLU 52 -19.329 -6.161 10.791 1159 1HB GLU 52 HB2 GLU 52 -19.033 -6.652 7.805 1160 2HB GLU 52 HB3 GLU 52 -18.060 -7.287 9.132 1161 1HG GLU 52 HG2 GLU 52 -20.929 -8.046 8.416 1162 2HG GLU 52 HG3 GLU 52 -19.489 -9.065 8.360 1163 H ILE 53 H ILE 53 -20.000 -4.180 7.885 1164 HA ILE 53 HA ILE 53 -17.595 -2.667 7.939 1165 HB ILE 53 HB ILE 53 -20.341 -1.645 7.120 1166 1HG1 ILE 53 HG12 ILE 53 -19.790 -3.626 5.786 1167 2HG1 ILE 53 HG13 ILE 53 -19.696 -2.156 4.829 1168 1HG2 ILE 53 HG21 ILE 53 -18.900 0.223 7.446 1169 2HG2 ILE 53 HG22 ILE 53 -17.546 -0.574 6.636 1170 3HG2 ILE 53 HG23 ILE 53 -18.978 -0.085 5.710 1171 1HD1 ILE 53 HD11 ILE 53 -17.210 -2.178 5.096 1172 2HD1 ILE 53 HD12 ILE 53 -17.347 -3.729 5.973 1173 3HD1 ILE 53 HD13 ILE 53 -17.837 -3.608 4.280 1174 H VAL 54 H VAL 54 -20.708 -2.015 9.702 1175 HA VAL 54 HA VAL 54 -19.525 0.299 10.899 1176 HB VAL 54 HB VAL 54 -21.388 0.364 12.484 1177 1HG1 VAL 54 HG11 VAL 54 -22.949 1.101 10.717 1178 2HG1 VAL 54 HG12 VAL 54 -21.295 1.629 10.372 1179 3HG1 VAL 54 HG13 VAL 54 -21.972 0.228 9.512 1180 1HG2 VAL 54 HG21 VAL 54 -22.574 -1.871 10.849 1181 2HG2 VAL 54 HG22 VAL 54 -21.999 -2.040 12.527 1182 3HG2 VAL 54 HG23 VAL 54 -23.353 -0.960 12.145 1183 H LYS 55 H LYS 55 -19.633 -3.100 12.037 1184 HA LYS 55 HA LYS 55 -18.452 -2.539 14.579 1185 1HB LYS 55 HB2 LYS 55 -19.332 -4.718 14.131 1186 2HB LYS 55 HB3 LYS 55 -18.272 -4.949 12.739 1187 1HG LYS 55 HG2 LYS 55 -17.568 -6.242 14.721 1188 2HG LYS 55 HG3 LYS 55 -16.313 -5.149 14.129 1189 1HD LYS 55 HD2 LYS 55 -16.791 -3.547 15.942 1190 2HD LYS 55 HD3 LYS 55 -18.147 -4.545 16.503 1191 1HE LYS 55 HE2 LYS 55 -16.631 -6.336 17.136 1192 2HE LYS 55 HE3 LYS 55 -15.268 -5.549 16.315 1193 1HZ LYS 55 HZ1 LYS 55 -15.338 -3.799 17.859 1194 2HZ LYS 55 HZ2 LYS 55 -16.666 -4.417 18.627 1195 3HZ LYS 55 HZ3 LYS 55 -15.228 -5.223 18.678 1196 H LEU 56 H LEU 56 -16.889 -3.377 11.466 1197 HA LEU 56 HA LEU 56 -14.194 -3.026 12.196 1198 1HB LEU 56 HB2 LEU 56 -14.754 -4.084 10.194 1199 2HB LEU 56 HB3 LEU 56 -15.772 -2.770 9.623 1200 HG LEU 56 HG LEU 56 -12.904 -2.051 10.032 1201 1HD1 LEU 56 HD11 LEU 56 -12.310 -3.042 7.810 1202 2HD1 LEU 56 HD12 LEU 56 -12.663 -4.285 9.026 1203 3HD1 LEU 56 HD13 LEU 56 -13.870 -3.883 7.784 1204 1HD2 LEU 56 HD21 LEU 56 -14.875 -1.599 7.736 1205 2HD2 LEU 56 HD22 LEU 56 -14.670 -0.471 9.074 1206 3HD2 LEU 56 HD23 LEU 56 -13.298 -0.809 8.017 1207 H MET 57 H MET 57 -16.528 -0.619 10.982 1208 HA MET 57 HA MET 57 -14.760 1.602 10.938 1209 1HB MET 57 HB2 MET 57 -16.792 1.588 9.670 1210 2HB MET 57 HB3 MET 57 -17.759 1.376 11.129 1211 1HG MET 57 HG2 MET 57 -16.038 3.823 10.755 1212 2HG MET 57 HG3 MET 57 -17.663 3.717 10.070 1213 1HE MET 57 HE1 MET 57 -19.884 3.626 11.435 1214 2HE MET 57 HE2 MET 57 -19.393 2.213 12.413 1215 3HE MET 57 HE3 MET 57 -19.959 3.687 13.213 1216 H ASP 58 H ASP 58 -16.949 0.324 13.502 1217 HA ASP 58 HA ASP 58 -16.454 2.358 15.398 1218 1HB ASP 58 HB2 ASP 58 -18.233 0.737 15.696 1219 2HB ASP 58 HB3 ASP 58 -17.062 -0.578 15.876 1220 H ASP 59 H ASP 59 -14.769 -0.749 14.769 1221 HA ASP 59 HA ASP 59 -12.793 -0.451 16.789 1222 1HB ASP 59 HB2 ASP 59 -12.456 -1.827 14.084 1223 2HB ASP 59 HB3 ASP 59 -11.460 -2.076 15.522 1224 H LEU 60 H LEU 60 -12.658 0.556 13.346 1225 HA LEU 60 HA LEU 60 -10.128 1.860 13.455 1226 1HB LEU 60 HB2 LEU 60 -12.635 2.174 11.783 1227 2HB LEU 60 HB3 LEU 60 -11.327 3.332 11.589 1228 HG LEU 60 HG LEU 60 -10.690 0.397 11.400 1229 1HD1 LEU 60 HD11 LEU 60 -11.822 2.099 9.151 1230 2HD1 LEU 60 HD12 LEU 60 -11.114 0.497 8.944 1231 3HD1 LEU 60 HD13 LEU 60 -12.610 0.686 9.887 1232 1HD2 LEU 60 HD21 LEU 60 -8.838 2.097 11.319 1233 2HD2 LEU 60 HD22 LEU 60 -9.024 1.290 9.738 1234 3HD2 LEU 60 HD23 LEU 60 -9.660 2.907 9.962 1235 H ASP 61 H ASP 61 -13.389 3.237 14.066 1236 HA ASP 61 HA ASP 61 -12.267 5.856 14.452 1237 1HB ASP 61 HB2 ASP 61 -14.374 6.698 14.486 1238 2HB ASP 61 HB3 ASP 61 -14.505 5.336 13.382 1239 H ARG 62 H ARG 62 -12.970 3.273 16.664 1240 HA ARG 62 HA ARG 62 -13.315 4.438 19.083 1241 1HB ARG 62 HB2 ARG 62 -12.981 2.024 18.661 1242 2HB ARG 62 HB3 ARG 62 -11.242 2.288 18.441 1243 1HG ARG 62 HG2 ARG 62 -11.056 3.048 20.790 1244 2HG ARG 62 HG3 ARG 62 -12.817 2.899 20.987 1245 1HD ARG 62 HD2 ARG 62 -12.676 0.481 20.530 1246 2HD ARG 62 HD3 ARG 62 -10.914 0.617 20.301 1247 HE ARG 62 HE ARG 62 -11.547 1.697 22.835 1248 1HH1 ARG 62 HH22 ARG 62 -11.605 -1.421 21.189 1249 2HH1 ARG 62 HH21 ARG 62 -11.361 -2.363 22.636 1250 1HH2 ARG 62 HH12 ARG 62 -11.229 0.492 24.746 1251 2HH2 ARG 62 HH11 ARG 62 -11.144 -1.247 24.702 1252 H ASN 63 H ASN 63 -10.314 4.303 17.270 1253 HA ASN 63 HA ASN 63 -8.265 5.489 18.470 1254 1HB ASN 63 HB2 ASN 63 -8.177 5.143 16.139 1255 2HB ASN 63 HB3 ASN 63 -9.648 6.085 15.858 1256 1HD2 ASN 63 HD22 ASN 63 -9.585 8.310 15.588 1257 2HD2 ASN 63 HD21 ASN 63 -8.051 9.165 15.482 1258 H LYS 64 H LYS 64 -11.002 7.473 17.336 1259 HA LYS 64 HA LYS 64 -10.666 9.286 19.633 1260 1HB LYS 64 HB2 LYS 64 -10.577 10.301 16.761 1261 2HB LYS 64 HB3 LYS 64 -10.946 11.309 18.170 1262 1HG LYS 64 HG2 LYS 64 -8.752 10.707 19.178 1263 2HG LYS 64 HG3 LYS 64 -8.326 9.831 17.719 1264 1HD LYS 64 HD2 LYS 64 -8.818 12.823 18.018 1265 2HD LYS 64 HD3 LYS 64 -7.308 11.993 17.625 1266 1HE LYS 64 HE2 LYS 64 -8.604 11.152 15.493 1267 2HE LYS 64 HE3 LYS 64 -9.745 12.444 15.865 1268 1HZ LYS 64 HZ1 LYS 64 -6.854 12.798 15.457 1269 2HZ LYS 64 HZ2 LYS 64 -8.001 13.116 14.329 1270 3HZ LYS 64 HZ3 LYS 64 -7.949 13.999 15.722 1271 H ASP 65 H ASP 65 -12.360 7.438 19.639 1272 HA ASP 65 HA ASP 65 -14.451 6.866 19.930 1273 1HB ASP 65 HB2 ASP 65 -16.081 8.501 20.688 1274 2HB ASP 65 HB3 ASP 65 -14.504 8.664 21.458 1275 H GLN 66 H GLN 66 -14.898 9.559 17.658 1276 HA GLN 66 HA GLN 66 -16.537 7.767 15.898 1277 1HB GLN 66 HB2 GLN 66 -17.002 10.693 16.528 1278 2HB GLN 66 HB3 GLN 66 -17.940 9.727 15.383 1279 1HG GLN 66 HG2 GLN 66 -17.775 9.121 18.386 1280 2HG GLN 66 HG3 GLN 66 -19.016 10.098 17.619 1281 1HE2 GLN 66 HE22 GLN 66 -17.593 6.742 17.493 1282 2HE2 GLN 66 HE21 GLN 66 -19.110 6.014 17.017 1283 H GLU 67 H GLU 67 -13.630 9.319 16.132 1284 HA GLU 67 HA GLU 67 -13.483 9.779 13.193 1285 1HB GLU 67 HB2 GLU 67 -12.436 11.365 15.544 1286 2HB GLU 67 HB3 GLU 67 -11.495 11.304 14.054 1287 1HG GLU 67 HG2 GLU 67 -12.922 13.283 14.092 1288 2HG GLU 67 HG3 GLU 67 -13.314 12.217 12.744 1289 H VAL 68 H VAL 68 -11.816 8.898 12.136 1290 HA VAL 68 HA VAL 68 -9.963 7.023 13.550 1291 HB VAL 68 HB VAL 68 -10.277 7.353 10.553 1292 1HG1 VAL 68 HG11 VAL 68 -8.318 6.096 11.409 1293 2HG1 VAL 68 HG12 VAL 68 -9.412 4.987 12.259 1294 3HG1 VAL 68 HG13 VAL 68 -9.432 5.084 10.486 1295 1HG2 VAL 68 HG21 VAL 68 -11.828 5.469 10.490 1296 2HG2 VAL 68 HG22 VAL 68 -11.977 5.511 12.253 1297 3HG2 VAL 68 HG23 VAL 68 -12.557 6.871 11.269 1298 H ASN 69 H ASN 69 -7.692 7.543 13.436 1299 HA ASN 69 HA ASN 69 -6.976 10.084 12.036 1300 1HB ASN 69 HB2 ASN 69 -6.791 10.334 14.413 1301 2HB ASN 69 HB3 ASN 69 -5.807 8.876 14.554 1302 1HD2 ASN 69 HD21 ASN 69 -3.593 8.985 13.948 1303 2HD2 ASN 69 HD22 ASN 69 -2.814 10.530 13.586 1304 H PHE 70 H PHE 70 -5.105 10.134 10.839 1305 HA PHE 70 HA PHE 70 -4.793 8.187 9.032 1306 1HB PHE 70 HB2 PHE 70 -3.856 10.358 8.700 1307 2HB PHE 70 HB3 PHE 70 -2.689 10.133 10.004 1308 HD1 PHE 70 HD1 PHE 70 -0.520 9.277 9.510 1309 HD2 PHE 70 HD2 PHE 70 -3.768 8.581 6.756 1310 HE1 PHE 70 HE1 PHE 70 0.981 7.948 8.078 1311 HE2 PHE 70 HE2 PHE 70 -2.240 7.305 5.287 1312 HZ PHE 70 HZ PHE 70 0.127 6.949 5.960 1313 H GLN 71 H GLN 71 -2.325 8.363 11.677 1314 HA GLN 71 HA GLN 71 -0.964 6.109 10.649 1315 1HB GLN 71 HB2 GLN 71 -0.041 7.818 12.215 1316 2HB GLN 71 HB3 GLN 71 -0.925 7.048 13.546 1317 1HG GLN 71 HG2 GLN 71 0.313 4.952 13.201 1318 2HG GLN 71 HG3 GLN 71 1.087 5.600 11.748 1319 1HE2 GLN 71 HE22 GLN 71 2.294 7.819 12.171 1320 2HE2 GLN 71 HE21 GLN 71 3.268 7.824 13.629 1321 H GLU 72 H GLU 72 -3.625 6.340 12.984 1322 HA GLU 72 HA GLU 72 -3.600 3.575 13.776 1323 1HB GLU 72 HB2 GLU 72 -5.768 5.717 13.954 1324 2HB GLU 72 HB3 GLU 72 -5.883 4.083 14.608 1325 1HG GLU 72 HG2 GLU 72 -5.198 5.406 16.427 1326 2HG GLU 72 HG3 GLU 72 -3.782 4.489 15.939 1327 H TYR 73 H TYR 73 -5.271 5.442 11.215 1328 HA TYR 73 HA TYR 73 -6.792 3.280 10.132 1329 1HB TYR 73 HB2 TYR 73 -7.387 5.259 9.210 1330 2HB TYR 73 HB3 TYR 73 -5.769 5.891 9.120 1331 HD1 TYR 73 HD1 TYR 73 -8.330 3.941 7.353 1332 HD2 TYR 73 HD2 TYR 73 -4.289 5.450 7.226 1333 HE1 TYR 73 HE1 TYR 73 -8.371 3.881 4.873 1334 HE2 TYR 73 HE2 TYR 73 -4.302 5.286 4.767 1335 HH TYR 73 HH TYR 73 -5.689 5.134 2.899 1336 H ILE 74 H ILE 74 -3.393 4.305 9.364 1337 HA ILE 74 HA ILE 74 -2.931 2.139 7.570 1338 HB ILE 74 HB ILE 74 -0.899 3.509 9.372 1339 1HG1 ILE 74 HG12 ILE 74 -2.042 5.107 7.843 1340 2HG1 ILE 74 HG13 ILE 74 -0.324 4.922 7.557 1341 1HG2 ILE 74 HG21 ILE 74 -0.625 1.574 7.048 1342 2HG2 ILE 74 HG22 ILE 74 0.679 2.682 7.482 1343 3HG2 ILE 74 HG23 ILE 74 0.112 1.496 8.659 1344 1HD1 ILE 74 HD11 ILE 74 -0.775 3.445 5.610 1345 2HD1 ILE 74 HD12 ILE 74 -2.525 3.664 5.887 1346 3HD1 ILE 74 HD13 ILE 74 -1.503 5.036 5.434 1347 H THR 75 H THR 75 -2.256 2.339 11.077 1348 HA THR 75 HA THR 75 -1.220 -0.219 11.529 1349 HB THR 75 HB THR 75 -3.149 1.325 13.327 1350 HG1 THR 75 HG1 THR 75 -1.381 2.605 12.713 1351 1HG2 THR 75 HG21 THR 75 -1.919 0.248 15.172 1352 2HG2 THR 75 HG22 THR 75 -2.771 -0.944 14.174 1353 3HG2 THR 75 HG23 THR 75 -1.017 -0.731 14.001 1354 H PHE 76 H PHE 76 -4.654 0.808 11.531 1355 HA PHE 76 HA PHE 76 -5.741 -1.762 12.050 1356 1HB PHE 76 HB2 PHE 76 -6.959 0.373 12.357 1357 2HB PHE 76 HB3 PHE 76 -6.999 0.583 10.608 1358 HD1 PHE 76 HD1 PHE 76 -8.392 -0.948 9.184 1359 HD2 PHE 76 HD2 PHE 76 -8.331 -1.341 13.484 1360 HE1 PHE 76 HE1 PHE 76 -10.370 -2.409 9.080 1361 HE2 PHE 76 HE2 PHE 76 -10.237 -2.920 13.353 1362 HZ PHE 76 HZ PHE 76 -11.251 -3.474 11.151 1363 H LEU 77 H LEU 77 -5.055 -0.054 8.908 1364 HA LEU 77 HA LEU 77 -6.065 -2.201 7.301 1365 1HB LEU 77 HB2 LEU 77 -3.979 -0.064 6.764 1366 2HB LEU 77 HB3 LEU 77 -4.426 -1.274 5.559 1367 HG LEU 77 HG LEU 77 -6.443 0.609 6.872 1368 1HD1 LEU 77 HD11 LEU 77 -5.074 0.766 4.157 1369 2HD1 LEU 77 HD12 LEU 77 -6.431 1.771 4.686 1370 3HD1 LEU 77 HD13 LEU 77 -4.867 1.904 5.517 1371 1HD2 LEU 77 HD21 LEU 77 -6.601 -1.281 4.478 1372 2HD2 LEU 77 HD22 LEU 77 -7.561 -1.379 5.981 1373 3HD2 LEU 77 HD23 LEU 77 -7.820 -0.047 4.861 1374 H GLY 78 H GLY 78 -2.904 -1.733 8.873 1375 1HA GLY 78 HA2 GLY 78 -1.593 -4.076 7.950 1376 2HA GLY 78 HA3 GLY 78 -1.408 -3.347 9.558 1377 H ALA 79 H ALA 79 -3.716 -3.666 10.834 1378 HA ALA 79 HA ALA 79 -3.851 -6.416 11.501 1379 1HB ALA 79 HB1 ALA 79 -5.813 -5.857 12.818 1380 2HB ALA 79 HB2 ALA 79 -4.609 -4.563 12.981 1381 3HB ALA 79 HB3 ALA 79 -6.034 -4.332 11.944 1382 H LEU 80 H LEU 80 -5.888 -4.542 9.255 1383 HA LEU 80 HA LEU 80 -7.780 -6.545 8.697 1384 1HB LEU 80 HB2 LEU 80 -7.734 -3.988 8.069 1385 2HB LEU 80 HB3 LEU 80 -6.821 -4.506 6.660 1386 HG LEU 80 HG LEU 80 -8.735 -6.030 6.055 1387 1HD1 LEU 80 HD11 LEU 80 -10.966 -5.451 7.115 1388 2HD1 LEU 80 HD12 LEU 80 -9.888 -6.330 8.197 1389 3HD1 LEU 80 HD13 LEU 80 -10.079 -4.573 8.377 1390 1HD2 LEU 80 HD21 LEU 80 -10.174 -4.178 5.247 1391 2HD2 LEU 80 HD22 LEU 80 -9.397 -3.072 6.396 1392 3HD2 LEU 80 HD23 LEU 80 -8.457 -3.775 5.057 1393 H ALA 81 H ALA 81 -4.695 -5.707 7.113 1394 HA ALA 81 HA ALA 81 -4.718 -7.743 5.110 1395 1HB ALA 81 HB1 ALA 81 -2.474 -6.250 6.512 1396 2HB ALA 81 HB2 ALA 81 -2.218 -7.417 5.204 1397 3HB ALA 81 HB3 ALA 81 -3.169 -5.937 4.916 1398 H MET 82 H MET 82 -3.544 -7.734 8.518 1399 HA MET 82 HA MET 82 -2.583 -10.412 8.411 1400 1HB MET 82 HB2 MET 82 -2.043 -8.655 10.152 1401 2HB MET 82 HB3 MET 82 -3.615 -8.984 10.897 1402 1HG MET 82 HG2 MET 82 -2.963 -11.314 11.296 1403 2HG MET 82 HG3 MET 82 -1.459 -11.075 10.393 1404 1HE MET 82 HE1 MET 82 -0.080 -11.607 13.965 1405 2HE MET 82 HE2 MET 82 -1.461 -12.432 13.202 1406 3HE MET 82 HE3 MET 82 0.014 -12.094 12.255 1407 H ILE 83 H ILE 83 -5.780 -9.129 9.264 1408 HA ILE 83 HA ILE 83 -7.012 -11.634 9.873 1409 HB ILE 83 HB ILE 83 -8.114 -8.978 8.909 1410 1HG1 ILE 83 HG12 ILE 83 -8.412 -10.385 11.597 1411 2HG1 ILE 83 HG13 ILE 83 -7.060 -9.309 11.254 1412 1HG2 ILE 83 HG21 ILE 83 -10.371 -9.857 9.523 1413 2HG2 ILE 83 HG22 ILE 83 -9.689 -10.691 8.137 1414 3HG2 ILE 83 HG23 ILE 83 -9.662 -11.470 9.733 1415 1HD1 ILE 83 HD11 ILE 83 -9.992 -8.498 11.247 1416 2HD1 ILE 83 HD12 ILE 83 -8.749 -8.067 12.428 1417 3HD1 ILE 83 HD13 ILE 83 -8.635 -7.450 10.771 1418 H TYR 84 H TYR 84 -6.533 -9.897 6.762 1419 HA TYR 84 HA TYR 84 -7.674 -12.054 5.153 1420 1HB TYR 84 HB2 TYR 84 -5.667 -9.922 4.353 1421 2HB TYR 84 HB3 TYR 84 -6.663 -10.895 3.279 1422 HD1 TYR 84 HD1 TYR 84 -9.259 -10.380 5.208 1423 HD2 TYR 84 HD2 TYR 84 -6.355 -7.957 3.127 1424 HE1 TYR 84 HE1 TYR 84 -10.958 -8.618 4.882 1425 HE2 TYR 84 HE2 TYR 84 -8.070 -6.196 2.802 1426 HH TYR 84 HH TYR 84 -10.278 -5.615 3.070 1427 H ASN 85 H ASN 85 -6.233 -13.472 6.875 1428 HA ASN 85 HA ASN 85 -3.499 -13.577 6.608 1429 1HB ASN 85 HB2 ASN 85 -4.804 -14.742 8.382 1430 2HB ASN 85 HB3 ASN 85 -5.273 -15.981 7.199 1431 1HD2 ASN 85 HD22 ASN 85 -2.401 -14.325 8.598 1432 2HD2 ASN 85 HD21 ASN 85 -1.290 -15.672 8.357 1433 H GLU 86 H GLU 86 -5.880 -15.178 4.560 1434 HA GLU 86 HA GLU 86 -4.297 -16.920 3.043 1435 1HB GLU 86 HB2 GLU 86 -6.577 -15.114 2.120 1436 2HB GLU 86 HB3 GLU 86 -5.922 -16.493 1.225 1437 1HG GLU 86 HG2 GLU 86 -6.539 -18.015 3.089 1438 2HG GLU 86 HG3 GLU 86 -7.255 -16.659 3.974 1439 H ALA 87 H ALA 87 -4.523 -13.343 2.836 1440 HA ALA 87 HA ALA 87 -2.905 -13.132 0.439 1441 1HB ALA 87 HB1 ALA 87 -3.385 -11.072 2.636 1442 2HB ALA 87 HB2 ALA 87 -2.735 -10.781 1.014 1443 3HB ALA 87 HB3 ALA 87 -4.416 -11.313 1.208 1444 H LEU 88 H LEU 88 -2.283 -12.847 3.985 1445 HA LEU 88 HA LEU 88 0.498 -12.355 3.796 1446 1HB LEU 88 HB2 LEU 88 -0.872 -13.927 6.018 1447 2HB LEU 88 HB3 LEU 88 0.742 -13.230 6.002 1448 HG LEU 88 HG LEU 88 -1.893 -11.821 6.306 1449 1HD1 LEU 88 HD11 LEU 88 0.846 -11.774 7.684 1450 2HD1 LEU 88 HD12 LEU 88 -0.513 -10.779 8.168 1451 3HD1 LEU 88 HD13 LEU 88 -0.635 -12.546 8.295 1452 1HD2 LEU 88 HD21 LEU 88 -0.812 -10.542 4.511 1453 2HD2 LEU 88 HD22 LEU 88 -0.790 -9.661 6.031 1454 3HD2 LEU 88 HD23 LEU 88 0.697 -10.455 5.464 1455 H LYS 89 H LYS 89 -1.223 -15.493 3.756 1456 HA LYS 89 HA LYS 89 1.012 -17.190 3.925 1457 1HB LYS 89 HB2 LYS 89 -1.421 -17.534 2.132 1458 2HB LYS 89 HB3 LYS 89 -0.240 -18.787 2.528 1459 1HG LYS 89 HG2 LYS 89 -0.807 -18.526 4.960 1460 2HG LYS 89 HG3 LYS 89 -2.085 -17.393 4.507 1461 1HD LYS 89 HD2 LYS 89 -3.004 -19.215 2.955 1462 2HD LYS 89 HD3 LYS 89 -1.878 -20.329 3.744 1463 1HE LYS 89 HE2 LYS 89 -4.156 -18.757 5.048 1464 2HE LYS 89 HE3 LYS 89 -4.079 -20.507 4.780 1465 1HZ LYS 89 HZ1 LYS 89 -2.449 -18.899 6.608 1466 2HZ LYS 89 HZ2 LYS 89 -3.551 -20.050 6.999 1467 3HZ LYS 89 HZ3 LYS 89 -2.135 -20.494 6.277 1468 H GLY 90 H GLY 90 -0.030 -15.191 1.158 1469 1HA GLY 90 HA2 GLY 90 1.904 -16.325 -0.722 1470 2HA GLY 90 HA3 GLY 90 0.918 -14.866 -0.912
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