NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
13581 | 1v5s | 10026 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 -16.407 12.671 16.460 2 HA MET 1 HA MET 1 -16.309 13.607 13.859 3 HB2 MET 1 1HB MET 1 -14.088 12.507 13.724 4 HB3 MET 1 2HB MET 1 -14.310 13.434 15.202 5 HG2 MET 1 1HG MET 1 -15.061 11.132 16.180 6 HG3 MET 1 2HG MET 1 -14.149 10.488 14.817 7 HE1 MET 1 1HE MET 1 -12.966 9.187 16.214 8 HE2 MET 1 2HE MET 1 -11.293 9.698 15.984 9 HE3 MET 1 3HE MET 1 -11.981 9.633 17.608 10 H LYS 2 H LYS 2 -18.059 12.636 12.731 11 HA LYS 2 HA LYS 2 -17.437 9.932 11.746 12 HB2 LYS 2 1HB LYS 2 -19.741 9.334 11.723 13 HB3 LYS 2 2HB LYS 2 -19.407 9.993 13.319 14 HG2 LYS 2 1HG LYS 2 -20.375 12.139 12.616 15 HG3 LYS 2 2HG LYS 2 -20.752 11.435 11.042 16 HD2 LYS 2 1HD LYS 2 -21.720 10.089 13.527 17 HD3 LYS 2 2HD LYS 2 -22.567 11.516 12.926 18 HE2 LYS 2 1HE LYS 2 -23.718 9.880 11.821 19 HE3 LYS 2 2HE LYS 2 -22.447 10.203 10.644 20 HZ1 LYS 2 1HZ LYS 2 -21.889 8.080 10.776 21 HZ2 LYS 2 2HZ LYS 2 -23.028 7.799 11.994 22 HZ3 LYS 2 3HZ LYS 2 -21.461 8.291 12.399 23 H ASP 3 H ASP 3 -17.470 9.666 9.582 24 HA ASP 3 HA ASP 3 -17.652 12.004 7.928 25 HB2 ASP 3 1HB ASP 3 -16.020 10.103 7.591 26 HB3 ASP 3 2HB ASP 3 -17.376 9.138 7.016 27 H HIS 4 H HIS 4 -19.707 12.772 7.782 28 HA HIS 4 HA HIS 4 -21.876 10.942 7.101 29 HB2 HIS 4 1HB HIS 4 -23.254 13.101 7.298 30 HB3 HIS 4 2HB HIS 4 -22.542 12.455 8.773 31 HD1 HIS 4 1HD HIS 4 -20.338 13.708 9.627 32 HD2 HIS 4 2HD HIS 4 -22.513 15.661 6.674 33 HE1 HIS 4 1HE HIS 4 -19.528 16.088 9.658 34 HE2 HIS 4 2HE HIS 4 -20.918 17.270 7.922 35 H LEU 5 H LEU 5 -19.914 13.458 5.698 36 HA LEU 5 HA LEU 5 -21.564 13.606 3.306 37 HB2 LEU 5 1HB LEU 5 -19.911 15.273 2.558 38 HB3 LEU 5 2HB LEU 5 -20.643 15.670 4.111 39 HG LEU 5 HG LEU 5 -18.449 14.489 5.024 40 HD11 LEU 5 1HD1 LEU 5 -17.962 14.626 2.236 41 HD12 LEU 5 2HD1 LEU 5 -16.883 14.075 3.516 42 HD13 LEU 5 3HD1 LEU 5 -16.885 15.772 3.034 43 HD21 LEU 5 1HD2 LEU 5 -19.008 17.280 4.168 44 HD22 LEU 5 2HD2 LEU 5 -17.378 16.885 4.715 45 HD23 LEU 5 3HD2 LEU 5 -18.756 16.620 5.784 46 H ILE 6 H ILE 6 -21.046 12.769 1.340 47 HA ILE 6 HA ILE 6 -19.111 10.637 1.293 48 HB ILE 6 HB ILE 6 -19.897 10.718 -1.256 49 HG12 ILE 6 1HG1 ILE 6 -22.373 11.745 0.090 50 HG13 ILE 6 2HG1 ILE 6 -21.203 12.882 -0.573 51 HG21 ILE 6 1HG2 ILE 6 -21.946 9.715 0.650 52 HG22 ILE 6 2HG2 ILE 6 -21.223 8.927 -0.752 53 HG23 ILE 6 3HG2 ILE 6 -20.313 9.059 0.753 54 HD11 ILE 6 1HD1 ILE 6 -22.847 10.837 -2.016 55 HD12 ILE 6 2HD1 ILE 6 -22.785 12.582 -2.260 56 HD13 ILE 6 3HD1 ILE 6 -21.422 11.575 -2.746 57 H HIS 7 H HIS 7 -17.522 10.417 -0.463 58 HA HIS 7 HA HIS 7 -16.603 12.821 -1.769 59 HB2 HIS 7 1HB HIS 7 -14.587 13.136 -0.664 60 HB3 HIS 7 2HB HIS 7 -15.663 12.723 0.668 61 HD1 HIS 7 1HD HIS 7 -15.259 10.494 1.871 62 HD2 HIS 7 2HD HIS 7 -12.660 11.181 -1.297 63 HE1 HIS 7 1HE HIS 7 -13.452 8.760 2.096 64 HE2 HIS 7 2HE HIS 7 -11.846 9.249 0.219 65 H ASN 8 H ASN 8 -16.064 12.197 -3.744 66 HA ASN 8 HA ASN 8 -14.768 9.574 -4.087 67 HB2 ASN 8 1HB ASN 8 -17.244 9.912 -4.904 68 HB3 ASN 8 2HB ASN 8 -16.475 10.746 -6.251 69 HD21 ASN 8 1HD2 ASN 8 -14.962 9.567 -7.543 70 HD22 ASN 8 2HD2 ASN 8 -15.098 7.850 -7.683 71 H VAL 9 H VAL 9 -12.685 10.218 -4.329 72 HA VAL 9 HA VAL 9 -12.124 12.149 -6.486 73 HB VAL 9 HB VAL 9 -10.464 11.577 -4.027 74 HG11 VAL 9 1HG1 VAL 9 -9.923 13.760 -6.002 75 HG12 VAL 9 2HG1 VAL 9 -8.836 13.027 -4.820 76 HG13 VAL 9 3HG1 VAL 9 -9.298 12.133 -6.269 77 HG21 VAL 9 1HG2 VAL 9 -11.312 14.316 -4.470 78 HG22 VAL 9 2HG2 VAL 9 -12.680 13.216 -4.295 79 HG23 VAL 9 3HG2 VAL 9 -11.455 13.309 -3.029 80 H HIS 10 H HIS 10 -11.854 10.749 -8.175 81 HA HIS 10 HA HIS 10 -9.982 8.520 -7.859 82 HB2 HIS 10 1HB HIS 10 -12.328 8.384 -9.005 83 HB3 HIS 10 2HB HIS 10 -11.493 9.089 -10.386 84 HD1 HIS 10 1HD HIS 10 -12.620 5.991 -9.569 85 HD2 HIS 10 2HD HIS 10 -8.802 7.348 -10.488 86 HE1 HIS 10 1HE HIS 10 -11.351 3.960 -10.334 87 HE2 HIS 10 2HE HIS 10 -9.020 4.790 -10.803 88 H LYS 11 H LYS 11 -8.035 8.438 -8.844 89 HA LYS 11 HA LYS 11 -7.287 10.730 -10.540 90 HB2 LYS 11 1HB LYS 11 -6.143 10.913 -8.430 91 HB3 LYS 11 2HB LYS 11 -5.638 9.230 -8.501 92 HG2 LYS 11 1HG LYS 11 -3.721 10.355 -9.107 93 HG3 LYS 11 2HG LYS 11 -4.422 9.938 -10.673 94 HD2 LYS 11 1HD LYS 11 -3.948 12.148 -11.029 95 HD3 LYS 11 2HD LYS 11 -5.585 12.291 -10.385 96 HE2 LYS 11 1HE LYS 11 -4.312 13.902 -9.234 97 HE3 LYS 11 2HE LYS 11 -4.509 12.563 -8.104 98 HZ1 LYS 11 1HZ LYS 11 -2.324 12.087 -8.149 99 HZ2 LYS 11 2HZ LYS 11 -2.170 13.701 -8.629 100 HZ3 LYS 11 3HZ LYS 11 -2.143 12.469 -9.787 101 H GLU 12 H GLU 12 -5.936 10.346 -12.307 102 HA GLU 12 HA GLU 12 -5.351 7.544 -12.946 103 HB2 GLU 12 1HB GLU 12 -7.048 9.441 -14.499 104 HB3 GLU 12 2HB GLU 12 -6.015 8.333 -15.392 105 HG2 GLU 12 1HG GLU 12 -8.245 7.671 -13.498 106 HG3 GLU 12 2HG GLU 12 -8.117 7.291 -15.214 107 H GLU 13 H GLU 13 -3.232 7.421 -13.234 108 HA GLU 13 HA GLU 13 -1.872 9.644 -14.612 109 HB2 GLU 13 1HB GLU 13 -0.979 7.926 -12.311 110 HB3 GLU 13 2HB GLU 13 0.189 8.750 -13.335 111 HG2 GLU 13 1HG GLU 13 -2.029 10.122 -11.836 112 HG3 GLU 13 2HG GLU 13 -0.368 9.977 -11.264 113 H HIS 14 H HIS 14 -0.316 9.147 -16.149 114 HA HIS 14 HA HIS 14 -0.274 6.331 -17.018 115 HB2 HIS 14 1HB HIS 14 0.081 8.769 -18.769 116 HB3 HIS 14 2HB HIS 14 -0.059 7.096 -19.300 117 HD1 HIS 14 1HD HIS 14 -1.980 9.459 -20.167 118 HD2 HIS 14 2HD HIS 14 -2.776 6.600 -17.260 119 HE1 HIS 14 1HE HIS 14 -4.487 9.360 -19.990 120 HE2 HIS 14 2HE HIS 14 -4.943 7.685 -18.165 121 H ALA 15 H ALA 15 1.536 7.175 -15.110 122 HA ALA 15 HA ALA 15 4.050 7.180 -16.645 123 HB1 ALA 15 1HB ALA 15 3.741 8.501 -13.961 124 HB2 ALA 15 2HB ALA 15 5.089 8.626 -15.091 125 HB3 ALA 15 3HB ALA 15 3.537 9.365 -15.485 126 H HIS 16 H HIS 16 4.676 5.102 -16.483 127 HA HIS 16 HA HIS 16 5.490 4.112 -13.912 128 HB2 HIS 16 1HB HIS 16 4.104 2.227 -13.728 129 HB3 HIS 16 2HB HIS 16 2.997 3.519 -14.181 130 HD1 HIS 16 1HD HIS 16 4.533 0.365 -15.461 131 HD2 HIS 16 2HD HIS 16 1.852 3.275 -16.727 132 HE1 HIS 16 1HE HIS 16 3.437 -0.581 -17.517 133 HE2 HIS 16 2HE HIS 16 1.880 1.232 -18.314 134 H ALA 17 H ALA 17 6.309 1.724 -14.232 135 HA ALA 17 HA ALA 17 7.628 1.550 -16.861 136 HB1 ALA 17 1HB ALA 17 9.641 1.641 -15.932 137 HB2 ALA 17 2HB ALA 17 8.869 2.024 -14.392 138 HB3 ALA 17 3HB ALA 17 9.228 0.348 -14.806 139 H HIS 18 H HIS 18 7.465 -0.355 -17.868 140 HA HIS 18 HA HIS 18 6.188 -2.563 -16.424 141 HB2 HIS 18 1HB HIS 18 5.984 -3.468 -18.855 142 HB3 HIS 18 2HB HIS 18 4.936 -2.148 -18.342 143 HD1 HIS 18 1HD HIS 18 4.642 -1.206 -20.700 144 HD2 HIS 18 2HD HIS 18 8.607 -1.415 -19.477 145 HE1 HIS 18 1HE HIS 18 5.941 0.117 -22.400 146 HE2 HIS 18 2HE HIS 18 8.347 -0.095 -21.687 147 H ASN 19 H ASN 19 7.875 -3.557 -15.379 148 HA ASN 19 HA ASN 19 9.630 -5.142 -17.055 149 HB2 ASN 19 1HB ASN 19 10.881 -3.475 -14.876 150 HB3 ASN 19 2HB ASN 19 11.688 -4.402 -16.138 151 HD21 ASN 19 1HD2 ASN 19 9.812 -1.535 -15.449 152 HD22 ASN 19 2HD2 ASN 19 10.265 -0.663 -16.870 153 H LYS 20 H LYS 20 10.384 -7.003 -16.051 154 HA LYS 20 HA LYS 20 9.131 -7.584 -13.455 155 HB2 LYS 20 1HB LYS 20 10.084 -9.463 -15.625 156 HB3 LYS 20 2HB LYS 20 9.377 -9.967 -14.095 157 HG2 LYS 20 1HG LYS 20 7.545 -10.085 -15.440 158 HG3 LYS 20 2HG LYS 20 7.400 -8.417 -14.880 159 HD2 LYS 20 1HD LYS 20 8.770 -7.814 -16.970 160 HD3 LYS 20 2HD LYS 20 8.363 -9.436 -17.534 161 HE2 LYS 20 1HE LYS 20 6.669 -8.149 -18.446 162 HE3 LYS 20 2HE LYS 20 5.930 -8.755 -16.965 163 HZ1 LYS 20 1HZ LYS 20 6.121 -6.708 -15.934 164 HZ2 LYS 20 2HZ LYS 20 5.710 -6.278 -17.518 165 HZ3 LYS 20 3HZ LYS 20 7.315 -6.152 -16.997 166 H ASP 21 H ASP 21 11.060 -6.315 -12.622 167 HA ASP 21 HA ASP 21 13.235 -8.212 -12.069 168 HB2 ASP 21 1HB ASP 21 14.025 -6.575 -13.738 169 HB3 ASP 21 2HB ASP 21 13.602 -5.263 -12.641 170 H TYR 22 H TYR 22 12.073 -8.618 -10.103 171 HA TYR 22 HA TYR 22 12.427 -6.475 -8.112 172 HB2 TYR 22 1HB TYR 22 10.470 -7.829 -6.945 173 HB3 TYR 22 2HB TYR 22 10.132 -6.578 -8.136 174 HD1 TYR 22 2HD TYR 22 10.183 -7.550 -10.666 175 HD2 TYR 22 1HD TYR 22 9.277 -9.783 -7.160 176 HE1 TYR 22 2HE TYR 22 8.942 -9.177 -12.031 177 HE2 TYR 22 1HE TYR 22 8.034 -11.417 -8.515 178 HH TYR 22 HH TYR 22 7.300 -10.857 -11.853 179 H ASP 23 H ASP 23 12.860 -7.187 -5.937 180 HA ASP 23 HA ASP 23 14.152 -9.835 -5.849 181 HB2 ASP 23 1HB ASP 23 15.539 -7.608 -5.660 182 HB3 ASP 23 2HB ASP 23 14.949 -7.620 -4.000 183 H ILE 24 H ILE 24 12.583 -11.067 -4.933 184 HA ILE 24 HA ILE 24 11.293 -10.104 -2.483 185 HB ILE 24 HB ILE 24 10.564 -12.726 -3.685 186 HG12 ILE 24 1HG1 ILE 24 8.902 -11.289 -5.124 187 HG13 ILE 24 2HG1 ILE 24 10.147 -10.054 -4.974 188 HG21 ILE 24 1HG2 ILE 24 9.385 -12.132 -1.731 189 HG22 ILE 24 2HG2 ILE 24 9.115 -10.486 -2.302 190 HG23 ILE 24 3HG2 ILE 24 8.275 -11.834 -3.068 191 HD11 ILE 24 1HD1 ILE 24 10.018 -12.218 -6.782 192 HD12 ILE 24 2HD1 ILE 24 11.268 -10.983 -6.631 193 HD13 ILE 24 3HD1 ILE 24 11.399 -12.486 -5.719 194 HA PRO 25 HA PRO 25 13.920 -12.611 0.028 195 HB2 PRO 25 1HB PRO 25 12.395 -12.623 2.274 196 HB3 PRO 25 2HB PRO 25 13.330 -11.216 1.755 197 HG2 PRO 25 1HG PRO 25 10.414 -11.788 1.396 198 HG3 PRO 25 2HG PRO 25 11.207 -10.273 1.864 199 HD2 PRO 25 1HD PRO 25 10.337 -10.743 -0.656 200 HD3 PRO 25 2HD PRO 25 11.764 -9.746 -0.309 201 H THR 26 H THR 26 13.524 -14.496 1.698 202 HA THR 26 HA THR 26 11.981 -16.520 0.255 203 HB THR 26 HB THR 26 13.216 -18.157 1.658 204 HG1 THR 26 1HG THR 26 14.443 -17.489 3.262 205 HG21 THR 26 1HG2 THR 26 14.553 -18.129 -0.130 206 HG22 THR 26 2HG2 THR 26 15.580 -16.991 0.742 207 HG23 THR 26 3HG2 THR 26 14.326 -16.394 -0.345 208 H THR 27 H THR 27 11.630 -14.500 2.889 209 HA THR 27 HA THR 27 10.483 -16.040 4.880 210 HB THR 27 HB THR 27 9.040 -13.930 5.307 211 HG1 THR 27 1HG THR 27 9.379 -12.242 4.023 212 HG21 THR 27 1HG2 THR 27 11.163 -12.646 5.987 213 HG22 THR 27 2HG2 THR 27 12.041 -14.041 5.359 214 HG23 THR 27 3HG2 THR 27 10.903 -14.241 6.690 215 H GLU 28 H GLU 28 8.064 -15.879 5.483 216 HA GLU 28 HA GLU 28 6.554 -16.915 3.199 217 HB2 GLU 28 1HB GLU 28 5.015 -17.831 4.884 218 HB3 GLU 28 2HB GLU 28 6.668 -18.366 5.150 219 HG2 GLU 28 1HG GLU 28 6.810 -16.399 6.802 220 HG3 GLU 28 2HG GLU 28 5.049 -16.408 6.725 221 H ASN 29 H ASN 29 6.495 -14.523 2.556 222 HA ASN 29 HA ASN 29 3.894 -13.497 3.326 223 HB2 ASN 29 1HB ASN 29 6.444 -11.932 3.748 224 HB3 ASN 29 2HB ASN 29 4.854 -11.179 3.672 225 HD21 ASN 29 1HD2 ASN 29 6.967 -13.243 5.498 226 HD22 ASN 29 2HD2 ASN 29 6.061 -13.208 6.969 227 H LEU 30 H LEU 30 2.873 -12.530 1.659 228 HA LEU 30 HA LEU 30 4.386 -12.245 -0.839 229 HB2 LEU 30 1HB LEU 30 1.508 -12.759 -0.208 230 HB3 LEU 30 2HB LEU 30 1.969 -12.099 -1.775 231 HG LEU 30 HG LEU 30 1.630 -14.537 -1.824 232 HD11 LEU 30 1HD1 LEU 30 3.281 -13.297 -3.295 233 HD12 LEU 30 2HD1 LEU 30 3.519 -15.036 -3.133 234 HD13 LEU 30 3HD1 LEU 30 4.542 -13.919 -2.231 235 HD21 LEU 30 1HD2 LEU 30 4.138 -15.135 -0.436 236 HD22 LEU 30 2HD2 LEU 30 2.588 -15.975 -0.397 237 HD23 LEU 30 3HD2 LEU 30 2.847 -14.554 0.616 238 H TYR 31 H TYR 31 4.131 -10.403 -2.155 239 HA TYR 31 HA TYR 31 3.077 -8.037 -0.747 240 HB2 TYR 31 1HB TYR 31 5.446 -8.135 -2.626 241 HB3 TYR 31 2HB TYR 31 4.840 -6.708 -1.794 242 HD1 TYR 31 1HD TYR 31 4.675 -7.022 0.860 243 HD2 TYR 31 2HD TYR 31 7.271 -9.202 -1.711 244 HE1 TYR 31 1HE TYR 31 6.149 -7.505 2.768 245 HE2 TYR 31 2HE TYR 31 8.752 -9.692 0.191 246 HH TYR 31 HH TYR 31 8.142 -8.323 3.395 247 H PHE 32 H PHE 32 2.226 -6.342 -2.075 248 HA PHE 32 HA PHE 32 1.771 -6.843 -4.881 249 HB2 PHE 32 1HB PHE 32 -0.615 -6.679 -3.033 250 HB3 PHE 32 2HB PHE 32 -0.641 -6.905 -4.779 251 HD1 PHE 32 1HD PHE 32 0.273 -8.495 -1.575 252 HD2 PHE 32 2HD PHE 32 -0.430 -9.047 -5.736 253 HE1 PHE 32 1HE PHE 32 0.299 -10.934 -1.252 254 HE2 PHE 32 2HE PHE 32 -0.406 -11.487 -5.420 255 HZ PHE 32 HZ PHE 32 -0.042 -12.433 -3.176 256 H GLN 33 H GLN 33 0.769 -5.035 -5.969 257 HA GLN 33 HA GLN 33 0.594 -2.566 -4.404 258 HB2 GLN 33 1HB GLN 33 1.924 -1.366 -6.126 259 HB3 GLN 33 2HB GLN 33 2.859 -2.556 -5.230 260 HG2 GLN 33 1HG GLN 33 3.111 -3.927 -7.034 261 HG3 GLN 33 2HG GLN 33 1.612 -3.392 -7.791 262 HE21 GLN 33 1HE2 GLN 33 4.993 -2.865 -7.455 263 HE22 GLN 33 2HE2 GLN 33 5.138 -1.610 -8.634 264 H GLY 34 H GLY 34 -0.949 -1.163 -5.089 265 HA2 GLY 34 1HA GLY 34 -1.977 -0.560 -7.475 266 HA3 GLY 34 2HA GLY 34 -2.730 -2.121 -7.183 267 H SER 35 H SER 35 -2.210 1.017 -5.581 268 HA SER 35 HA SER 35 -4.436 0.700 -3.828 269 HB2 SER 35 1HB SER 35 -2.505 2.151 -3.290 270 HB3 SER 35 2HB SER 35 -2.964 3.230 -4.607 271 HG SER 35 HG SER 35 -5.109 3.183 -3.357 272 H SER 36 H SER 36 -6.444 1.738 -3.876 273 HA SER 36 HA SER 36 -7.298 2.584 -6.564 274 HB2 SER 36 1HB SER 36 -8.840 1.264 -4.323 275 HB3 SER 36 2HB SER 36 -9.608 1.941 -5.759 276 HG SER 36 HG SER 36 -9.267 -0.146 -6.271 277 H GLY 37 H GLY 37 -6.059 4.331 -4.608 278 HA2 GLY 37 1HA GLY 37 -6.970 6.709 -4.771 279 HA3 GLY 37 2HA GLY 37 -8.334 6.059 -3.874 280 H SER 38 H SER 38 -8.196 5.820 -1.691 281 HA SER 38 HA SER 38 -5.678 6.720 -0.453 282 HB2 SER 38 1HB SER 38 -8.545 7.266 0.194 283 HB3 SER 38 2HB SER 38 -7.377 7.225 1.515 284 HG SER 38 HG SER 38 -7.858 9.268 0.079 285 H SER 39 H SER 39 -5.412 5.922 1.843 286 HA SER 39 HA SER 39 -5.164 3.166 1.896 287 HB2 SER 39 1HB SER 39 -4.023 4.845 3.415 288 HB3 SER 39 2HB SER 39 -5.508 4.876 4.365 289 HG SER 39 HG SER 39 -3.864 3.361 5.094 290 H GLY 40 H GLY 40 -7.921 5.136 2.589 291 HA2 GLY 40 1HA GLY 40 -9.364 3.246 4.158 292 HA3 GLY 40 2HA GLY 40 -10.042 4.643 3.334 293 H ASP 41 H ASP 41 -9.762 4.237 0.754 294 HA ASP 41 HA ASP 41 -11.754 2.566 -0.033 295 HB2 ASP 41 1HB ASP 41 -9.251 3.313 -1.554 296 HB3 ASP 41 2HB ASP 41 -10.642 2.522 -2.291 297 H MET 42 H MET 42 -8.327 1.722 0.275 298 HA MET 42 HA MET 42 -8.172 -0.751 -0.794 299 HB2 MET 42 1HB MET 42 -6.956 0.476 1.624 300 HB3 MET 42 2HB MET 42 -6.780 -1.263 1.433 301 HG2 MET 42 1HG MET 42 -6.136 0.466 -0.889 302 HG3 MET 42 2HG MET 42 -5.014 0.440 0.469 303 HE1 MET 42 1HE MET 42 -5.772 -0.776 -2.760 304 HE2 MET 42 2HE MET 42 -5.297 -2.470 -2.884 305 HE3 MET 42 3HE MET 42 -6.863 -2.041 -2.193 306 H MET 43 H MET 43 -9.265 -0.144 2.549 307 HA MET 43 HA MET 43 -9.949 -2.745 3.214 308 HB2 MET 43 1HB MET 43 -11.326 -0.201 4.097 309 HB3 MET 43 2HB MET 43 -11.442 -1.760 4.903 310 HG2 MET 43 1HG MET 43 -8.935 -1.650 5.193 311 HG3 MET 43 2HG MET 43 -9.044 0.028 4.667 312 HE1 MET 43 1HE MET 43 -8.688 -2.087 7.669 313 HE2 MET 43 2HE MET 43 -10.032 -1.697 8.742 314 HE3 MET 43 3HE MET 43 -10.324 -2.600 7.255 315 H ARG 44 H ARG 44 -12.156 -0.208 2.014 316 HA ARG 44 HA ARG 44 -14.444 -1.733 1.779 317 HB2 ARG 44 1HB ARG 44 -13.433 0.636 0.233 318 HB3 ARG 44 2HB ARG 44 -14.968 -0.116 -0.177 319 HG2 ARG 44 1HG ARG 44 -15.553 1.627 1.243 320 HG3 ARG 44 2HG ARG 44 -15.571 0.206 2.289 321 HD2 ARG 44 1HD ARG 44 -13.645 0.829 3.391 322 HD3 ARG 44 2HD ARG 44 -13.067 1.808 2.044 323 HE ARG 44 HE ARG 44 -15.288 3.121 2.870 324 HH11 ARG 44 2HH1 ARG 44 -12.428 1.974 4.490 325 HH12 ARG 44 1HH1 ARG 44 -12.444 3.227 5.686 326 HH21 ARG 44 2HH2 ARG 44 -15.321 4.776 4.440 327 HH22 ARG 44 1HH2 ARG 44 -14.091 4.820 5.658 328 H GLU 45 H GLU 45 -12.256 -0.952 -0.933 329 HA GLU 45 HA GLU 45 -13.325 -2.625 -2.828 330 HB2 GLU 45 1HB GLU 45 -11.272 -0.947 -2.866 331 HB3 GLU 45 2HB GLU 45 -10.352 -2.432 -2.674 332 HG2 GLU 45 1HG GLU 45 -10.465 -1.959 -4.991 333 HG3 GLU 45 2HG GLU 45 -11.529 -3.330 -4.682 334 H ILE 46 H ILE 46 -10.405 -3.460 -0.956 335 HA ILE 46 HA ILE 46 -10.052 -6.044 -1.590 336 HB ILE 46 HB ILE 46 -9.957 -4.969 1.231 337 HG12 ILE 46 1HG1 ILE 46 -7.549 -5.359 -0.490 338 HG13 ILE 46 2HG1 ILE 46 -8.567 -3.955 -0.791 339 HG21 ILE 46 1HG2 ILE 46 -9.917 -7.327 1.385 340 HG22 ILE 46 2HG2 ILE 46 -8.842 -7.473 -0.004 341 HG23 ILE 46 3HG2 ILE 46 -8.238 -6.803 1.511 342 HD11 ILE 46 1HD1 ILE 46 -8.317 -3.591 1.779 343 HD12 ILE 46 2HD1 ILE 46 -6.892 -4.611 1.577 344 HD13 ILE 46 3HD1 ILE 46 -7.033 -3.102 0.675 345 H ARG 47 H ARG 47 -12.127 -5.097 1.158 346 HA ARG 47 HA ARG 47 -13.186 -7.531 1.802 347 HB2 ARG 47 1HB ARG 47 -14.554 -4.838 1.773 348 HB3 ARG 47 2HB ARG 47 -15.237 -6.270 2.531 349 HG2 ARG 47 1HG ARG 47 -13.772 -6.223 4.270 350 HG3 ARG 47 2HG ARG 47 -12.491 -5.474 3.315 351 HD2 ARG 47 1HD ARG 47 -13.168 -3.800 4.804 352 HD3 ARG 47 2HD ARG 47 -13.968 -3.393 3.287 353 HE ARG 47 HE ARG 47 -15.767 -4.939 4.674 354 HH11 ARG 47 2HH1 ARG 47 -14.076 -1.945 5.220 355 HH12 ARG 47 1HH1 ARG 47 -15.325 -1.269 6.211 356 HH21 ARG 47 2HH2 ARG 47 -17.419 -4.059 5.978 357 HH22 ARG 47 1HH2 ARG 47 -17.226 -2.473 6.642 358 H LYS 48 H LYS 48 -14.286 -5.344 -0.757 359 HA LYS 48 HA LYS 48 -16.585 -6.621 -1.571 360 HB2 LYS 48 1HB LYS 48 -15.500 -4.462 -2.458 361 HB3 LYS 48 2HB LYS 48 -14.606 -5.512 -3.550 362 HG2 LYS 48 1HG LYS 48 -17.557 -5.809 -3.436 363 HG3 LYS 48 2HG LYS 48 -16.888 -4.391 -4.248 364 HD2 LYS 48 1HD LYS 48 -15.734 -7.054 -4.898 365 HD3 LYS 48 2HD LYS 48 -17.331 -6.661 -5.540 366 HE2 LYS 48 1HE LYS 48 -16.011 -5.857 -7.226 367 HE3 LYS 48 2HE LYS 48 -16.136 -4.416 -6.219 368 HZ1 LYS 48 1HZ LYS 48 -13.832 -5.263 -7.073 369 HZ2 LYS 48 2HZ LYS 48 -13.928 -6.281 -5.726 370 HZ3 LYS 48 3HZ LYS 48 -13.986 -4.602 -5.523 371 H VAL 49 H VAL 49 -13.242 -7.351 -2.499 372 HA VAL 49 HA VAL 49 -13.765 -9.344 -4.381 373 HB VAL 49 HB VAL 49 -11.410 -9.412 -2.505 374 HG11 VAL 49 1HG1 VAL 49 -10.336 -10.109 -4.760 375 HG12 VAL 49 2HG1 VAL 49 -11.305 -11.283 -3.867 376 HG13 VAL 49 3HG1 VAL 49 -11.997 -10.439 -5.253 377 HG21 VAL 49 1HG2 VAL 49 -12.197 -7.228 -4.103 378 HG22 VAL 49 2HG2 VAL 49 -10.670 -7.454 -3.251 379 HG23 VAL 49 3HG2 VAL 49 -10.837 -7.995 -4.921 380 H LEU 50 H LEU 50 -13.040 -9.700 -0.908 381 HA LEU 50 HA LEU 50 -13.195 -12.421 -0.653 382 HB2 LEU 50 1HB LEU 50 -14.418 -10.516 1.328 383 HB3 LEU 50 2HB LEU 50 -13.715 -12.100 1.649 384 HG LEU 50 HG LEU 50 -12.215 -9.610 0.838 385 HD11 LEU 50 1HD1 LEU 50 -11.228 -9.834 3.096 386 HD12 LEU 50 2HD1 LEU 50 -12.380 -11.124 3.439 387 HD13 LEU 50 3HD1 LEU 50 -12.957 -9.487 3.122 388 HD21 LEU 50 1HD2 LEU 50 -10.484 -10.887 0.297 389 HD22 LEU 50 2HD2 LEU 50 -11.525 -12.304 0.445 390 HD23 LEU 50 3HD2 LEU 50 -10.587 -11.749 1.833 391 H GLY 51 H GLY 51 -15.951 -10.234 -0.023 392 HA2 GLY 51 1HA GLY 51 -17.948 -12.077 0.274 393 HA3 GLY 51 2HA GLY 51 -18.196 -10.503 -0.468 394 H ALA 52 H ALA 52 -16.541 -10.964 -2.762 395 HA ALA 52 HA ALA 52 -18.444 -12.195 -4.462 396 HB1 ALA 52 1HB ALA 52 -17.309 -11.155 -6.068 397 HB2 ALA 52 2HB ALA 52 -16.274 -10.504 -4.796 398 HB3 ALA 52 3HB ALA 52 -15.809 -11.981 -5.641 399 H ASN 53 H ASN 53 -15.376 -13.268 -3.087 400 HA ASN 53 HA ASN 53 -15.654 -15.860 -4.415 401 HB2 ASN 53 1HB ASN 53 -13.408 -14.434 -3.042 402 HB3 ASN 53 2HB ASN 53 -13.363 -16.191 -3.157 403 HD21 ASN 53 1HD2 ASN 53 -14.199 -13.463 -5.274 404 HD22 ASN 53 2HD2 ASN 53 -13.285 -14.019 -6.630 405 H ASN 54 H ASN 54 -17.589 -15.327 -2.491 406 HA ASN 54 HA ASN 54 -18.456 -16.002 -0.470 407 HB2 ASN 54 1HB ASN 54 -17.118 -18.517 -1.488 408 HB3 ASN 54 2HB ASN 54 -18.309 -18.482 -0.191 409 HD21 ASN 54 1HD2 ASN 54 -17.903 -19.032 -3.383 410 HD22 ASN 54 2HD2 ASN 54 -19.508 -18.728 -3.944 411 H CYS 55 H CYS 55 -16.095 -14.642 -0.008 412 HA CYS 55 HA CYS 55 -14.828 -16.223 2.131 413 HB2 CYS 55 1HB CYS 55 -13.743 -14.058 0.345 414 HB3 CYS 55 2HB CYS 55 -12.970 -14.448 1.877 415 HG CYS 55 HG CYS 55 -13.263 -16.434 -0.881 416 H ASP 56 H ASP 56 -14.733 -15.407 4.171 417 HA ASP 56 HA ASP 56 -16.245 -12.929 4.641 418 HB2 ASP 56 1HB ASP 56 -15.599 -14.950 6.770 419 HB3 ASP 56 2HB ASP 56 -16.918 -13.784 6.717 420 H TYR 57 H TYR 57 -15.551 -11.647 6.564 421 HA TYR 57 HA TYR 57 -12.718 -11.832 7.214 422 HB2 TYR 57 1HB TYR 57 -12.443 -9.365 6.699 423 HB3 TYR 57 2HB TYR 57 -12.566 -10.427 5.301 424 HD1 TYR 57 2HD TYR 57 -14.837 -10.616 4.147 425 HD2 TYR 57 1HD TYR 57 -13.913 -7.558 6.958 426 HE1 TYR 57 2HE TYR 57 -16.696 -9.261 3.276 427 HE2 TYR 57 1HE TYR 57 -15.770 -6.196 6.096 428 HH TYR 57 HH TYR 57 -17.044 -6.055 3.812 429 H GLU 58 H GLU 58 -12.132 -10.729 9.108 430 HA GLU 58 HA GLU 58 -14.387 -9.652 10.670 431 HB2 GLU 58 1HB GLU 58 -13.646 -11.943 11.391 432 HB3 GLU 58 2HB GLU 58 -12.081 -11.248 11.793 433 HG2 GLU 58 1HG GLU 58 -13.045 -11.148 13.835 434 HG3 GLU 58 2HG GLU 58 -13.591 -9.596 13.204 435 H GLN 59 H GLN 59 -14.020 -7.514 10.654 436 HA GLN 59 HA GLN 59 -11.532 -6.253 10.486 437 HB2 GLN 59 1HB GLN 59 -13.864 -5.266 10.105 438 HB3 GLN 59 2HB GLN 59 -13.931 -5.044 11.848 439 HG2 GLN 59 1HG GLN 59 -11.560 -3.992 10.414 440 HG3 GLN 59 2HG GLN 59 -13.093 -3.145 10.211 441 HE21 GLN 59 1HE2 GLN 59 -10.344 -3.233 11.973 442 HE22 GLN 59 2HE2 GLN 59 -10.893 -2.470 13.422 443 H ARG 60 H ARG 60 -9.954 -5.948 11.909 444 HA ARG 60 HA ARG 60 -10.529 -6.449 14.752 445 HB2 ARG 60 1HB ARG 60 -7.865 -6.604 13.332 446 HB3 ARG 60 2HB ARG 60 -8.190 -7.054 15.000 447 HG2 ARG 60 1HG ARG 60 -9.426 -8.397 12.607 448 HG3 ARG 60 2HG ARG 60 -7.994 -8.980 13.458 449 HD2 ARG 60 1HD ARG 60 -10.455 -8.419 15.034 450 HD3 ARG 60 2HD ARG 60 -10.410 -9.874 14.040 451 HE ARG 60 HE ARG 60 -8.789 -10.762 15.439 452 HH11 ARG 60 2HH1 ARG 60 -9.494 -7.464 16.301 453 HH12 ARG 60 1HH1 ARG 60 -8.671 -7.549 17.824 454 HH21 ARG 60 2HH2 ARG 60 -7.702 -10.887 17.440 455 HH22 ARG 60 1HH2 ARG 60 -7.651 -9.496 18.470 456 H GLU 61 H GLU 61 -8.476 -4.450 12.634 457 HA GLU 61 HA GLU 61 -8.688 -2.295 14.629 458 HB2 GLU 61 1HB GLU 61 -6.239 -2.904 12.966 459 HB3 GLU 61 2HB GLU 61 -6.397 -1.635 14.172 460 HG2 GLU 61 1HG GLU 61 -6.807 -4.489 14.943 461 HG3 GLU 61 2HG GLU 61 -5.177 -3.840 14.767 462 H ARG 62 H ARG 62 -8.295 -0.120 13.711 463 HA ARG 62 HA ARG 62 -10.008 0.599 11.750 464 HB2 ARG 62 1HB ARG 62 -8.699 2.654 11.449 465 HB3 ARG 62 2HB ARG 62 -8.840 2.223 13.148 466 HG2 ARG 62 1HG ARG 62 -6.580 1.283 13.092 467 HG3 ARG 62 2HG ARG 62 -6.441 1.741 11.394 468 HD2 ARG 62 1HD ARG 62 -6.415 4.021 11.887 469 HD3 ARG 62 2HD ARG 62 -7.107 3.776 13.489 470 HE ARG 62 HE ARG 62 -4.763 2.508 13.713 471 HH11 ARG 62 2HH1 ARG 62 -5.577 5.648 12.450 472 HH12 ARG 62 1HH1 ARG 62 -4.058 6.360 12.884 473 HH21 ARG 62 2HH2 ARG 62 -2.760 3.433 14.289 474 HH22 ARG 62 1HH2 ARG 62 -2.456 5.099 13.929 475 H PHE 63 H PHE 63 -6.572 -0.166 11.239 476 HA PHE 63 HA PHE 63 -7.155 -0.459 8.366 477 HB2 PHE 63 1HB PHE 63 -4.581 0.294 9.760 478 HB3 PHE 63 2HB PHE 63 -4.690 -0.084 8.044 479 HD1 PHE 63 2HD PHE 63 -6.831 1.261 6.939 480 HD2 PHE 63 1HD PHE 63 -4.413 2.526 10.206 481 HE1 PHE 63 2HE PHE 63 -7.415 3.603 6.461 482 HE2 PHE 63 1HE PHE 63 -4.994 4.870 9.733 483 HZ PHE 63 HZ PHE 63 -6.496 5.411 7.858 484 H LEU 64 H LEU 64 -7.735 -2.545 10.112 485 HA LEU 64 HA LEU 64 -5.916 -4.582 9.096 486 HB2 LEU 64 1HB LEU 64 -5.211 -3.830 11.431 487 HB3 LEU 64 2HB LEU 64 -6.696 -4.592 11.997 488 HG LEU 64 HG LEU 64 -5.669 -6.664 10.677 489 HD11 LEU 64 1HD1 LEU 64 -3.166 -6.615 11.332 490 HD12 LEU 64 2HD1 LEU 64 -3.360 -4.863 11.281 491 HD13 LEU 64 3HD1 LEU 64 -3.681 -5.827 9.840 492 HD21 LEU 64 1HD2 LEU 64 -5.960 -5.882 13.340 493 HD22 LEU 64 2HD2 LEU 64 -4.309 -6.490 13.212 494 HD23 LEU 64 3HD2 LEU 64 -5.666 -7.511 12.731 495 H LEU 65 H LEU 65 -7.059 -6.187 8.251 496 HA LEU 65 HA LEU 65 -9.694 -6.812 9.396 497 HB2 LEU 65 1HB LEU 65 -8.974 -6.217 6.564 498 HB3 LEU 65 2HB LEU 65 -10.253 -7.381 6.897 499 HG LEU 65 HG LEU 65 -10.381 -4.673 8.149 500 HD11 LEU 65 1HD1 LEU 65 -11.192 -5.308 5.316 501 HD12 LEU 65 2HD1 LEU 65 -9.904 -4.211 5.811 502 HD13 LEU 65 3HD1 LEU 65 -11.582 -3.828 6.192 503 HD21 LEU 65 1HD2 LEU 65 -12.799 -5.801 7.047 504 HD22 LEU 65 2HD2 LEU 65 -12.429 -5.334 8.707 505 HD23 LEU 65 3HD2 LEU 65 -11.995 -6.942 8.126 506 H PHE 66 H PHE 66 -9.931 -8.890 9.884 507 HA PHE 66 HA PHE 66 -7.868 -10.775 9.156 508 HB2 PHE 66 1HB PHE 66 -8.935 -10.655 11.441 509 HB3 PHE 66 2HB PHE 66 -10.397 -11.316 10.717 510 HD1 PHE 66 1HD PHE 66 -10.061 -13.544 9.374 511 HD2 PHE 66 2HD PHE 66 -7.403 -12.096 12.367 512 HE1 PHE 66 1HE PHE 66 -9.194 -15.823 9.703 513 HE2 PHE 66 2HE PHE 66 -6.532 -14.372 12.700 514 HZ PHE 66 HZ PHE 66 -7.427 -16.239 11.366 515 H CYS 67 H CYS 67 -8.050 -11.229 6.994 516 HA CYS 67 HA CYS 67 -10.579 -11.923 5.808 517 HB2 CYS 67 1HB CYS 67 -7.761 -12.104 4.724 518 HB3 CYS 67 2HB CYS 67 -9.219 -12.387 3.782 519 HG CYS 67 HG CYS 67 -9.742 -9.516 5.068 520 H VAL 68 H VAL 68 -11.219 -13.946 5.050 521 HA VAL 68 HA VAL 68 -9.592 -16.278 5.595 522 HB VAL 68 HB VAL 68 -10.608 -15.992 7.768 523 HG11 VAL 68 1HG1 VAL 68 -12.495 -14.735 7.662 524 HG12 VAL 68 2HG1 VAL 68 -13.040 -15.480 6.158 525 HG13 VAL 68 3HG1 VAL 68 -13.252 -16.327 7.691 526 HG21 VAL 68 1HG2 VAL 68 -10.753 -18.205 7.841 527 HG22 VAL 68 2HG2 VAL 68 -12.387 -18.114 7.183 528 HG23 VAL 68 3HG2 VAL 68 -11.006 -18.263 6.096 529 H HIS 69 H HIS 69 -10.066 -17.946 4.259 530 HA HIS 69 HA HIS 69 -12.380 -17.594 2.473 531 HB2 HIS 69 1HB HIS 69 -10.406 -17.479 1.169 532 HB3 HIS 69 2HB HIS 69 -9.671 -18.834 2.020 533 HD1 HIS 69 1HD HIS 69 -9.456 -20.659 0.367 534 HD2 HIS 69 2HD HIS 69 -13.122 -18.726 0.068 535 HE1 HIS 69 1HE HIS 69 -10.746 -21.930 -1.377 536 HE2 HIS 69 2HE HIS 69 -12.927 -20.692 -1.602 537 H GLY 70 H GLY 70 -13.843 -19.208 2.228 538 HA2 GLY 70 1HA GLY 70 -13.283 -21.771 3.574 539 HA3 GLY 70 2HA GLY 70 -14.781 -20.909 3.888 540 H ASP 71 H ASP 71 -13.483 -23.383 2.184 541 HA ASP 71 HA ASP 71 -15.326 -23.072 -0.085 542 HB2 ASP 71 1HB ASP 71 -12.888 -23.517 -0.543 543 HB3 ASP 71 2HB ASP 71 -13.101 -25.096 0.209 544 H GLY 72 H GLY 72 -14.105 -25.701 2.007 545 HA2 GLY 72 1HA GLY 72 -16.856 -26.638 2.351 546 HA3 GLY 72 2HA GLY 72 -15.711 -27.749 1.614 547 H HIS 73 H HIS 73 -13.435 -27.155 3.123 548 HA HIS 73 HA HIS 73 -14.153 -27.521 5.917 549 HB2 HIS 73 1HB HIS 73 -13.033 -29.667 4.178 550 HB3 HIS 73 2HB HIS 73 -12.422 -29.545 5.825 551 HD1 HIS 73 1HD HIS 73 -13.837 -30.537 7.634 552 HD2 HIS 73 2HD HIS 73 -15.900 -30.125 4.051 553 HE1 HIS 73 1HE HIS 73 -16.036 -31.705 7.986 554 HE2 HIS 73 2HE HIS 73 -17.232 -31.517 5.778 555 H ALA 74 H ALA 74 -11.952 -27.981 7.167 556 HA ALA 74 HA ALA 74 -10.437 -25.702 7.119 557 HB1 ALA 74 1HB ALA 74 -8.611 -27.295 8.149 558 HB2 ALA 74 2HB ALA 74 -10.097 -26.922 9.024 559 HB3 ALA 74 3HB ALA 74 -9.946 -28.448 8.153 560 H GLU 75 H GLU 75 -9.529 -28.817 5.636 561 HA GLU 75 HA GLU 75 -7.123 -28.334 4.565 562 HB2 GLU 75 1HB GLU 75 -8.779 -30.313 4.182 563 HB3 GLU 75 2HB GLU 75 -9.227 -29.429 2.730 564 HG2 GLU 75 1HG GLU 75 -6.622 -29.398 2.354 565 HG3 GLU 75 2HG GLU 75 -6.688 -30.812 3.404 566 H ASN 76 H ASN 76 -10.171 -27.128 3.215 567 HA ASN 76 HA ASN 76 -8.747 -25.622 1.176 568 HB2 ASN 76 1HB ASN 76 -11.708 -25.480 1.699 569 HB3 ASN 76 2HB ASN 76 -10.844 -25.208 0.188 570 HD21 ASN 76 1HD2 ASN 76 -13.071 -26.949 0.636 571 HD22 ASN 76 2HD2 ASN 76 -12.545 -28.551 0.260 572 H LEU 77 H LEU 77 -10.208 -25.138 4.275 573 HA LEU 77 HA LEU 77 -10.680 -22.368 4.152 574 HB2 LEU 77 1HB LEU 77 -11.335 -24.157 5.932 575 HB3 LEU 77 2HB LEU 77 -9.798 -23.713 6.670 576 HG LEU 77 HG LEU 77 -10.836 -21.273 6.430 577 HD11 LEU 77 1HD1 LEU 77 -13.013 -22.980 5.762 578 HD12 LEU 77 2HD1 LEU 77 -12.983 -21.222 5.892 579 HD13 LEU 77 3HD1 LEU 77 -13.355 -22.205 7.309 580 HD21 LEU 77 1HD2 LEU 77 -11.943 -21.856 8.764 581 HD22 LEU 77 2HD2 LEU 77 -10.193 -21.803 8.551 582 HD23 LEU 77 3HD2 LEU 77 -11.036 -23.353 8.541 583 H VAL 78 H VAL 78 -9.447 -20.603 4.778 584 HA VAL 78 HA VAL 78 -6.687 -20.977 5.586 585 HB VAL 78 HB VAL 78 -7.381 -19.649 2.963 586 HG11 VAL 78 1HG1 VAL 78 -5.690 -18.408 4.325 587 HG12 VAL 78 2HG1 VAL 78 -4.668 -19.846 4.260 588 HG13 VAL 78 3HG1 VAL 78 -5.093 -18.996 2.773 589 HG21 VAL 78 1HG2 VAL 78 -7.208 -21.905 2.485 590 HG22 VAL 78 2HG2 VAL 78 -5.555 -21.348 2.227 591 HG23 VAL 78 3HG2 VAL 78 -5.981 -22.180 3.722 592 H GLN 79 H GLN 79 -6.206 -19.478 7.044 593 HA GLN 79 HA GLN 79 -7.811 -17.014 7.098 594 HB2 GLN 79 1HB GLN 79 -6.281 -18.382 9.317 595 HB3 GLN 79 2HB GLN 79 -7.165 -16.871 9.486 596 HG2 GLN 79 1HG GLN 79 -9.216 -17.895 9.368 597 HG3 GLN 79 2HG GLN 79 -8.590 -19.285 8.482 598 HE21 GLN 79 1HE2 GLN 79 -9.680 -20.643 9.963 599 HE22 GLN 79 2HE2 GLN 79 -9.029 -20.946 11.534 600 H TRP 80 H TRP 80 -6.862 -15.062 6.950 601 HA TRP 80 HA TRP 80 -4.040 -14.707 7.430 602 HB2 TRP 80 1HB TRP 80 -3.372 -14.097 5.242 603 HB3 TRP 80 2HB TRP 80 -4.259 -15.607 5.054 604 HD1 TRP 80 HD TRP 80 -4.374 -11.934 4.116 605 HE1 TRP 80 1HE TRP 80 -6.298 -11.549 2.451 606 HE3 TRP 80 3HE TRP 80 -6.632 -16.511 4.413 607 HZ2 TRP 80 2HZ TRP 80 -8.484 -12.994 1.402 608 HZ3 TRP 80 3HZ TRP 80 -8.636 -16.928 3.047 609 HH2 TRP 80 HH TRP 80 -9.541 -15.205 1.573 610 H GLU 81 H GLU 81 -3.502 -12.595 7.845 611 HA GLU 81 HA GLU 81 -5.758 -10.732 7.982 612 HB2 GLU 81 1HB GLU 81 -3.124 -10.907 9.416 613 HB3 GLU 81 2HB GLU 81 -4.045 -9.410 9.408 614 HG2 GLU 81 1HG GLU 81 -5.953 -10.595 10.397 615 HG3 GLU 81 2HG GLU 81 -4.993 -12.073 10.442 616 H MET 82 H MET 82 -5.770 -8.774 6.976 617 HA MET 82 HA MET 82 -3.497 -8.203 5.188 618 HB2 MET 82 1HB MET 82 -6.447 -8.074 4.752 619 HB3 MET 82 2HB MET 82 -5.428 -6.909 3.917 620 HG2 MET 82 1HG MET 82 -4.172 -8.706 2.886 621 HG3 MET 82 2HG MET 82 -5.122 -9.898 3.769 622 HE1 MET 82 1HE MET 82 -4.948 -7.538 0.667 623 HE2 MET 82 2HE MET 82 -6.654 -7.240 0.333 624 HE3 MET 82 3HE MET 82 -5.918 -6.602 1.804 625 H GLU 83 H GLU 83 -2.366 -6.581 6.047 626 HA GLU 83 HA GLU 83 -3.796 -4.403 7.396 627 HB2 GLU 83 1HB GLU 83 -1.817 -5.705 8.452 628 HB3 GLU 83 2HB GLU 83 -0.811 -4.741 7.380 629 HG2 GLU 83 1HG GLU 83 -2.794 -3.450 9.212 630 HG3 GLU 83 2HG GLU 83 -1.193 -3.923 9.780 631 H VAL 84 H VAL 84 -3.818 -2.372 6.618 632 HA VAL 84 HA VAL 84 -2.563 -1.925 4.009 633 HB VAL 84 HB VAL 84 -4.619 -0.207 5.401 634 HG11 VAL 84 1HG1 VAL 84 -5.000 0.616 3.064 635 HG12 VAL 84 2HG1 VAL 84 -3.435 1.049 3.757 636 HG13 VAL 84 3HG1 VAL 84 -3.550 -0.266 2.586 637 HG21 VAL 84 1HG2 VAL 84 -6.124 -1.768 4.913 638 HG22 VAL 84 2HG2 VAL 84 -5.774 -1.507 3.204 639 HG23 VAL 84 3HG2 VAL 84 -4.908 -2.754 4.101 640 H CYS 85 H CYS 85 -0.728 -0.827 3.905 641 HA CYS 85 HA CYS 85 -0.308 1.496 5.591 642 HB2 CYS 85 1HB CYS 85 0.593 -0.505 6.850 643 HB3 CYS 85 2HB CYS 85 1.765 -0.700 5.553 644 HG CYS 85 HG CYS 85 3.505 0.825 6.642 645 H LYS 86 H LYS 86 1.486 2.820 4.884 646 HA LYS 86 HA LYS 86 2.414 2.213 2.158 647 HB2 LYS 86 1HB LYS 86 0.536 3.846 2.112 648 HB3 LYS 86 2HB LYS 86 1.489 4.926 3.122 649 HG2 LYS 86 1HG LYS 86 3.256 4.714 1.233 650 HG3 LYS 86 2HG LYS 86 1.886 4.168 0.262 651 HD2 LYS 86 1HD LYS 86 1.675 6.680 1.873 652 HD3 LYS 86 2HD LYS 86 2.507 6.696 0.316 653 HE2 LYS 86 1HE LYS 86 0.583 6.193 -0.863 654 HE3 LYS 86 2HE LYS 86 -0.208 5.470 0.536 655 HZ1 LYS 86 1HZ LYS 86 0.335 8.187 1.054 656 HZ2 LYS 86 2HZ LYS 86 -1.161 7.401 0.987 657 HZ3 LYS 86 3HZ LYS 86 -0.489 8.061 -0.418 658 H LEU 87 H LEU 87 4.499 2.767 1.693 659 HA LEU 87 HA LEU 87 6.042 4.041 3.856 660 HB2 LEU 87 1HB LEU 87 7.963 2.623 2.842 661 HB3 LEU 87 2HB LEU 87 6.816 1.880 3.954 662 HG LEU 87 HG LEU 87 6.395 1.678 0.997 663 HD11 LEU 87 1HD1 LEU 87 8.758 0.877 2.075 664 HD12 LEU 87 2HD1 LEU 87 7.993 0.143 0.667 665 HD13 LEU 87 3HD1 LEU 87 7.775 -0.575 2.262 666 HD21 LEU 87 1HD2 LEU 87 4.853 0.930 3.063 667 HD22 LEU 87 2HD2 LEU 87 5.837 -0.522 2.885 668 HD23 LEU 87 3HD2 LEU 87 4.891 0.075 1.521 669 HA PRO 88 HA PRO 88 7.459 6.986 0.920 670 HB2 PRO 88 1HB PRO 88 9.908 7.565 1.939 671 HB3 PRO 88 2HB PRO 88 8.402 8.104 2.692 672 HG2 PRO 88 1HG PRO 88 10.147 5.778 3.401 673 HG3 PRO 88 2HG PRO 88 9.353 6.948 4.471 674 HD2 PRO 88 1HD PRO 88 8.357 4.469 4.028 675 HD3 PRO 88 2HD PRO 88 7.318 5.874 4.343 676 H ARG 89 H ARG 89 9.431 4.175 1.616 677 HA ARG 89 HA ARG 89 11.366 4.519 -0.403 678 HB2 ARG 89 1HB ARG 89 10.326 2.082 1.033 679 HB3 ARG 89 2HB ARG 89 11.594 1.982 -0.182 680 HG2 ARG 89 1HG ARG 89 11.789 3.738 2.248 681 HG3 ARG 89 2HG ARG 89 12.365 2.071 2.206 682 HD2 ARG 89 1HD ARG 89 13.250 3.943 0.067 683 HD3 ARG 89 2HD ARG 89 13.967 4.097 1.671 684 HE ARG 89 HE ARG 89 14.155 1.435 1.078 685 HH11 ARG 89 2HH1 ARG 89 15.203 4.389 -0.438 686 HH12 ARG 89 1HH1 ARG 89 16.597 3.671 -1.174 687 HH21 ARG 89 2HH2 ARG 89 15.987 0.477 0.113 688 HH22 ARG 89 1HH2 ARG 89 17.041 1.445 -0.861 689 H LEU 90 H LEU 90 8.471 2.432 -0.368 690 HA LEU 90 HA LEU 90 8.669 2.025 -3.228 691 HB2 LEU 90 1HB LEU 90 6.961 0.962 -1.032 692 HB3 LEU 90 2HB LEU 90 6.380 0.840 -2.691 693 HG LEU 90 HG LEU 90 8.242 -0.536 -3.309 694 HD11 LEU 90 1HD1 LEU 90 9.393 0.545 -0.854 695 HD12 LEU 90 2HD1 LEU 90 10.182 -0.069 -2.306 696 HD13 LEU 90 3HD1 LEU 90 9.642 -1.189 -1.056 697 HD21 LEU 90 1HD2 LEU 90 7.484 -2.434 -2.346 698 HD22 LEU 90 2HD2 LEU 90 6.237 -1.353 -1.723 699 HD23 LEU 90 3HD2 LEU 90 7.614 -1.788 -0.710 700 H SER 91 H SER 91 6.818 3.944 -0.982 701 HA SER 91 HA SER 91 5.280 5.596 -1.261 702 HB2 SER 91 1HB SER 91 5.586 7.070 -3.059 703 HB3 SER 91 2HB SER 91 7.167 6.306 -2.893 704 HG SER 91 HG SER 91 5.406 6.220 -4.967 705 H LEU 92 H LEU 92 4.496 2.846 -1.728 706 HA LEU 92 HA LEU 92 1.996 3.375 -3.105 707 HB2 LEU 92 1HB LEU 92 3.933 1.241 -3.966 708 HB3 LEU 92 2HB LEU 92 2.222 1.209 -4.384 709 HG LEU 92 HG LEU 92 3.951 3.549 -5.115 710 HD11 LEU 92 1HD1 LEU 92 3.874 0.848 -6.343 711 HD12 LEU 92 2HD1 LEU 92 5.197 2.010 -6.239 712 HD13 LEU 92 3HD1 LEU 92 3.906 2.247 -7.417 713 HD21 LEU 92 1HD2 LEU 92 2.180 4.244 -6.298 714 HD22 LEU 92 2HD2 LEU 92 1.262 3.135 -5.279 715 HD23 LEU 92 3HD2 LEU 92 1.805 2.621 -6.877 716 H ASN 93 H ASN 93 0.419 2.636 -1.858 717 HA ASN 93 HA ASN 93 0.550 1.409 0.517 718 HB2 ASN 93 1HB ASN 93 -1.728 0.761 0.294 719 HB3 ASN 93 2HB ASN 93 -1.535 2.208 -0.693 720 HD21 ASN 93 1HD2 ASN 93 -0.211 0.962 -2.869 721 HD22 ASN 93 2HD2 ASN 93 -1.371 -0.021 -3.690 722 H GLY 94 H GLY 94 1.840 -0.259 1.023 723 HA2 GLY 94 1HA GLY 94 2.035 -2.557 -0.761 724 HA3 GLY 94 2HA GLY 94 3.003 -2.268 0.677 725 H VAL 95 H VAL 95 0.477 -4.038 -0.630 726 HA VAL 95 HA VAL 95 -0.787 -4.594 1.943 727 HB VAL 95 HB VAL 95 -1.467 -5.718 -0.777 728 HG11 VAL 95 1HG1 VAL 95 -2.509 -7.186 0.613 729 HG12 VAL 95 2HG1 VAL 95 -2.601 -6.032 1.945 730 HG13 VAL 95 3HG1 VAL 95 -3.734 -5.917 0.598 731 HG21 VAL 95 1HG2 VAL 95 -1.679 -3.137 -0.243 732 HG22 VAL 95 2HG2 VAL 95 -2.925 -3.997 -1.147 733 HG23 VAL 95 3HG2 VAL 95 -3.149 -3.671 0.571 734 H ARG 96 H ARG 96 0.388 -5.942 3.170 735 HA ARG 96 HA ARG 96 1.814 -8.170 1.955 736 HB2 ARG 96 1HB ARG 96 1.722 -7.052 4.753 737 HB3 ARG 96 2HB ARG 96 2.544 -8.558 4.369 738 HG2 ARG 96 1HG ARG 96 4.161 -7.489 3.078 739 HG3 ARG 96 2HG ARG 96 3.187 -6.028 2.903 740 HD2 ARG 96 1HD ARG 96 4.716 -5.345 4.473 741 HD3 ARG 96 2HD ARG 96 3.414 -5.930 5.508 742 HE ARG 96 HE ARG 96 6.031 -7.113 5.156 743 HH11 ARG 96 2HH1 ARG 96 2.767 -7.535 6.291 744 HH12 ARG 96 1HH1 ARG 96 3.169 -8.836 7.362 745 HH21 ARG 96 2HH2 ARG 96 6.573 -8.825 6.563 746 HH22 ARG 96 1HH2 ARG 96 5.334 -9.568 7.517 747 H PHE 97 H PHE 97 1.309 -10.297 2.209 748 HA PHE 97 HA PHE 97 -1.284 -10.870 3.472 749 HB2 PHE 97 1HB PHE 97 0.190 -12.224 1.214 750 HB3 PHE 97 2HB PHE 97 -1.197 -12.957 2.015 751 HD1 PHE 97 1HD PHE 97 -0.273 -9.663 0.516 752 HD2 PHE 97 2HD PHE 97 -3.219 -12.700 0.977 753 HE1 PHE 97 1HE PHE 97 -1.783 -8.420 -0.976 754 HE2 PHE 97 2HE PHE 97 -4.733 -11.463 -0.515 755 HZ PHE 97 HZ PHE 97 -4.016 -9.320 -1.494 756 H LYS 98 H LYS 98 -1.051 -11.672 5.451 757 HA LYS 98 HA LYS 98 1.224 -13.439 6.020 758 HB2 LYS 98 1HB LYS 98 0.938 -11.456 7.471 759 HB3 LYS 98 2HB LYS 98 -0.652 -12.044 7.939 760 HG2 LYS 98 1HG LYS 98 0.494 -14.111 8.807 761 HG3 LYS 98 2HG LYS 98 2.023 -13.267 8.554 762 HD2 LYS 98 1HD LYS 98 1.585 -12.778 10.766 763 HD3 LYS 98 2HD LYS 98 0.884 -11.378 9.951 764 HE2 LYS 98 1HE LYS 98 -1.322 -12.343 10.104 765 HE3 LYS 98 2HE LYS 98 -0.662 -13.831 10.781 766 HZ1 LYS 98 1HZ LYS 98 -0.096 -11.320 12.173 767 HZ2 LYS 98 2HZ LYS 98 -0.323 -12.873 12.800 768 HZ3 LYS 98 3HZ LYS 98 -1.657 -11.959 12.304 769 H ARG 99 H ARG 99 0.873 -15.551 6.045 770 HA ARG 99 HA ARG 99 -1.823 -16.594 6.096 771 HB2 ARG 99 1HB ARG 99 -0.390 -17.665 4.548 772 HB3 ARG 99 2HB ARG 99 0.892 -17.844 5.738 773 HG2 ARG 99 1HG ARG 99 -0.684 -19.386 6.990 774 HG3 ARG 99 2HG ARG 99 -1.683 -19.370 5.535 775 HD2 ARG 99 1HD ARG 99 -0.368 -21.239 5.197 776 HD3 ARG 99 2HD ARG 99 0.528 -19.995 4.326 777 HE ARG 99 HE ARG 99 1.357 -20.331 7.060 778 HH11 ARG 99 2HH1 ARG 99 1.768 -21.424 3.780 779 HH12 ARG 99 1HH1 ARG 99 3.367 -22.035 4.046 780 HH21 ARG 99 2HH2 ARG 99 3.462 -21.132 7.423 781 HH22 ARG 99 1HH2 ARG 99 4.330 -21.869 6.119 782 H ILE 100 H ILE 100 -2.756 -16.584 8.057 783 HA ILE 100 HA ILE 100 -1.319 -17.028 10.484 784 HB ILE 100 HB ILE 100 -4.295 -17.022 9.969 785 HG12 ILE 100 1HG1 ILE 100 -2.382 -14.886 10.926 786 HG13 ILE 100 2HG1 ILE 100 -3.335 -14.875 9.446 787 HG21 ILE 100 1HG2 ILE 100 -3.356 -16.378 12.655 788 HG22 ILE 100 2HG2 ILE 100 -4.673 -17.428 12.135 789 HG23 ILE 100 3HG2 ILE 100 -3.019 -18.039 12.168 790 HD11 ILE 100 1HD1 ILE 100 -4.056 -13.531 11.601 791 HD12 ILE 100 2HD1 ILE 100 -5.239 -14.265 10.517 792 HD13 ILE 100 3HD1 ILE 100 -4.792 -15.079 12.016 793 H SER 101 H SER 101 -3.671 -18.959 8.640 794 HA SER 101 HA SER 101 -2.417 -21.396 9.584 795 HB2 SER 101 1HB SER 101 -4.334 -20.578 11.206 796 HB3 SER 101 2HB SER 101 -5.382 -21.267 9.966 797 HG SER 101 HG SER 101 -3.251 -22.847 10.747 798 H GLY 102 H GLY 102 -3.653 -23.354 8.620 799 HA2 GLY 102 1HA GLY 102 -5.050 -24.156 6.821 800 HA3 GLY 102 2HA GLY 102 -4.753 -22.642 5.979 801 H THR 103 H THR 103 -3.821 -23.293 4.127 802 HA THR 103 HA THR 103 -1.275 -24.744 4.363 803 HB THR 103 HB THR 103 -1.842 -25.847 2.143 804 HG1 THR 103 1HG THR 103 -4.056 -25.973 1.645 805 HG21 THR 103 1HG2 THR 103 -3.663 -27.351 3.482 806 HG22 THR 103 2HG2 THR 103 -2.889 -26.496 4.816 807 HG23 THR 103 3HG2 THR 103 -1.919 -27.469 3.711 808 H SER 104 H SER 104 0.250 -24.318 2.690 809 HA SER 104 HA SER 104 0.342 -21.623 1.875 810 HB2 SER 104 1HB SER 104 2.224 -22.684 0.303 811 HB3 SER 104 2HB SER 104 2.469 -22.470 2.037 812 HG SER 104 HG SER 104 2.824 -24.656 0.889 813 H ILE 105 H ILE 105 0.019 -24.575 -0.101 814 HA ILE 105 HA ILE 105 -0.273 -23.616 -2.590 815 HB ILE 105 HB ILE 105 -1.880 -25.761 -1.227 816 HG12 ILE 105 1HG1 ILE 105 0.452 -26.282 -1.580 817 HG13 ILE 105 2HG1 ILE 105 -0.507 -27.214 -2.725 818 HG21 ILE 105 1HG2 ILE 105 -2.134 -26.188 -3.955 819 HG22 ILE 105 2HG2 ILE 105 -3.398 -25.652 -2.850 820 HG23 ILE 105 3HG2 ILE 105 -2.454 -24.466 -3.750 821 HD11 ILE 105 1HD1 ILE 105 1.364 -24.962 -3.205 822 HD12 ILE 105 2HD1 ILE 105 1.160 -26.476 -4.085 823 HD13 ILE 105 3HD1 ILE 105 -0.005 -25.170 -4.297 824 H ALA 106 H ALA 106 -3.193 -24.132 -0.607 825 HA ALA 106 HA ALA 106 -4.899 -22.601 -2.195 826 HB1 ALA 106 1HB ALA 106 -5.201 -24.182 0.010 827 HB2 ALA 106 2HB ALA 106 -5.567 -22.580 0.652 828 HB3 ALA 106 3HB ALA 106 -6.474 -23.207 -0.724 829 H PHE 107 H PHE 107 -2.839 -21.677 0.508 830 HA PHE 107 HA PHE 107 -3.831 -19.120 0.994 831 HB2 PHE 107 1HB PHE 107 -2.200 -20.200 2.461 832 HB3 PHE 107 2HB PHE 107 -0.978 -20.108 1.196 833 HD1 PHE 107 1HD PHE 107 -3.251 -17.917 3.174 834 HD2 PHE 107 2HD PHE 107 0.491 -18.337 1.189 835 HE1 PHE 107 1HE PHE 107 -2.565 -15.705 4.006 836 HE2 PHE 107 2HE PHE 107 1.183 -16.126 2.019 837 HZ PHE 107 HZ PHE 107 -0.345 -14.808 3.430 838 H LYS 108 H LYS 108 -1.525 -20.254 -1.418 839 HA LYS 108 HA LYS 108 -1.020 -17.581 -2.405 840 HB2 LYS 108 1HB LYS 108 -0.117 -20.326 -3.255 841 HB3 LYS 108 2HB LYS 108 0.235 -18.896 -4.217 842 HG2 LYS 108 1HG LYS 108 1.602 -17.974 -2.555 843 HG3 LYS 108 2HG LYS 108 0.977 -19.065 -1.316 844 HD2 LYS 108 1HD LYS 108 2.314 -20.268 -3.683 845 HD3 LYS 108 2HD LYS 108 3.327 -19.460 -2.484 846 HE2 LYS 108 1HE LYS 108 1.965 -20.879 -0.779 847 HE3 LYS 108 2HE LYS 108 1.588 -21.875 -2.184 848 HZ1 LYS 108 1HZ LYS 108 3.515 -22.744 -1.088 849 HZ2 LYS 108 2HZ LYS 108 4.293 -21.244 -1.136 850 HZ3 LYS 108 3HZ LYS 108 3.998 -22.089 -2.571 851 H ASN 109 H ASN 109 -2.278 -20.558 -3.926 852 HA ASN 109 HA ASN 109 -3.174 -19.684 -6.293 853 HB2 ASN 109 1HB ASN 109 -4.446 -21.563 -4.329 854 HB3 ASN 109 2HB ASN 109 -5.258 -21.198 -5.849 855 HD21 ASN 109 1HD2 ASN 109 -2.451 -22.634 -4.370 856 HD22 ASN 109 2HD2 ASN 109 -1.943 -23.540 -5.750 857 H ILE 110 H ILE 110 -4.671 -18.969 -3.192 858 HA ILE 110 HA ILE 110 -6.881 -17.554 -4.416 859 HB ILE 110 HB ILE 110 -7.217 -18.797 -2.316 860 HG12 ILE 110 1HG1 ILE 110 -8.398 -16.982 -1.083 861 HG13 ILE 110 2HG1 ILE 110 -7.593 -15.801 -2.112 862 HG21 ILE 110 1HG2 ILE 110 -6.086 -18.415 -0.379 863 HG22 ILE 110 2HG2 ILE 110 -4.832 -17.943 -1.524 864 HG23 ILE 110 3HG2 ILE 110 -5.819 -16.710 -0.740 865 HD11 ILE 110 1HD1 ILE 110 -9.121 -16.050 -3.690 866 HD12 ILE 110 2HD1 ILE 110 -8.909 -17.801 -3.701 867 HD13 ILE 110 3HD1 ILE 110 -10.032 -17.057 -2.564 868 H ALA 111 H ALA 111 -3.866 -16.794 -2.765 869 HA ALA 111 HA ALA 111 -4.259 -14.039 -2.420 870 HB1 ALA 111 1HB ALA 111 -2.291 -14.231 -1.419 871 HB2 ALA 111 2HB ALA 111 -2.169 -15.889 -2.008 872 HB3 ALA 111 3HB ALA 111 -1.509 -14.563 -2.965 873 H SER 112 H SER 112 -3.299 -15.918 -5.204 874 HA SER 112 HA SER 112 -2.325 -13.729 -6.749 875 HB2 SER 112 1HB SER 112 -1.824 -16.212 -7.103 876 HB3 SER 112 2HB SER 112 -3.412 -16.315 -7.863 877 HG SER 112 HG SER 112 -1.118 -15.469 -8.923 878 H LYS 113 H LYS 113 -5.452 -15.259 -6.321 879 HA LYS 113 HA LYS 113 -6.752 -14.001 -8.506 880 HB2 LYS 113 1HB LYS 113 -8.069 -14.946 -5.961 881 HB3 LYS 113 2HB LYS 113 -8.793 -14.806 -7.558 882 HG2 LYS 113 1HG LYS 113 -6.459 -16.612 -7.241 883 HG3 LYS 113 2HG LYS 113 -8.012 -17.126 -6.577 884 HD2 LYS 113 1HD LYS 113 -8.177 -17.976 -8.698 885 HD3 LYS 113 2HD LYS 113 -8.890 -16.380 -8.947 886 HE2 LYS 113 1HE LYS 113 -7.415 -16.398 -10.684 887 HE3 LYS 113 2HE LYS 113 -6.365 -15.739 -9.430 888 HZ1 LYS 113 1HZ LYS 113 -5.964 -18.030 -10.935 889 HZ2 LYS 113 2HZ LYS 113 -6.289 -18.560 -9.362 890 HZ3 LYS 113 3HZ LYS 113 -5.025 -17.471 -9.643 891 H ILE 114 H ILE 114 -7.074 -13.362 -5.007 892 HA ILE 114 HA ILE 114 -8.590 -11.150 -4.952 893 HB ILE 114 HB ILE 114 -6.029 -11.501 -3.391 894 HG12 ILE 114 1HG1 ILE 114 -7.620 -13.350 -3.112 895 HG13 ILE 114 2HG1 ILE 114 -7.496 -12.396 -1.638 896 HG21 ILE 114 1HG2 ILE 114 -8.162 -10.007 -2.110 897 HG22 ILE 114 2HG2 ILE 114 -6.451 -9.617 -2.278 898 HG23 ILE 114 3HG2 ILE 114 -7.577 -9.223 -3.577 899 HD11 ILE 114 1HD1 ILE 114 -9.781 -12.856 -3.400 900 HD12 ILE 114 2HD1 ILE 114 -9.726 -12.457 -1.683 901 HD13 ILE 114 3HD1 ILE 114 -9.574 -11.181 -2.890 902 H ALA 115 H ALA 115 -5.134 -11.177 -5.751 903 HA ALA 115 HA ALA 115 -4.759 -8.424 -6.021 904 HB1 ALA 115 1HB ALA 115 -2.690 -9.153 -6.336 905 HB2 ALA 115 2HB ALA 115 -3.279 -10.798 -6.580 906 HB3 ALA 115 3HB ALA 115 -3.143 -9.697 -7.951 907 H ASN 116 H ASN 116 -5.596 -10.835 -8.506 908 HA ASN 116 HA ASN 116 -5.690 -9.242 -10.733 909 HB2 ASN 116 1HB ASN 116 -6.740 -10.986 -11.746 910 HB3 ASN 116 2HB ASN 116 -6.339 -11.816 -10.245 911 HD21 ASN 116 1HD2 ASN 116 -7.954 -12.975 -9.520 912 HD22 ASN 116 2HD2 ASN 116 -9.631 -12.567 -9.611 913 H GLU 117 H GLU 117 -8.328 -9.781 -8.406 914 HA GLU 117 HA GLU 117 -10.207 -8.106 -9.651 915 HB2 GLU 117 1HB GLU 117 -9.982 -8.701 -6.697 916 HB3 GLU 117 2HB GLU 117 -11.421 -8.171 -7.555 917 HG2 GLU 117 1HG GLU 117 -10.044 -10.828 -7.680 918 HG3 GLU 117 2HG GLU 117 -11.708 -10.467 -7.222 919 H LEU 118 H LEU 118 -7.873 -7.457 -7.055 920 HA LEU 118 HA LEU 118 -8.599 -4.658 -6.966 921 HB2 LEU 118 1HB LEU 118 -6.661 -6.395 -5.493 922 HB3 LEU 118 2HB LEU 118 -6.523 -4.640 -5.401 923 HG LEU 118 HG LEU 118 -9.154 -5.887 -4.774 924 HD11 LEU 118 1HD1 LEU 118 -8.049 -7.290 -3.359 925 HD12 LEU 118 2HD1 LEU 118 -8.154 -5.864 -2.328 926 HD13 LEU 118 3HD1 LEU 118 -6.660 -6.216 -3.195 927 HD21 LEU 118 1HD2 LEU 118 -8.626 -3.972 -2.922 928 HD22 LEU 118 2HD2 LEU 118 -9.449 -3.684 -4.456 929 HD23 LEU 118 3HD2 LEU 118 -7.719 -3.370 -4.310 930 H LYS 119 H LYS 119 -7.485 -5.822 -9.445 931 HA LYS 119 HA LYS 119 -5.770 -5.511 -10.961 932 HB2 LYS 119 1HB LYS 119 -6.312 -2.698 -9.992 933 HB3 LYS 119 2HB LYS 119 -5.497 -3.108 -11.495 934 HG2 LYS 119 1HG LYS 119 -8.267 -4.083 -10.898 935 HG3 LYS 119 2HG LYS 119 -7.971 -2.492 -11.602 936 HD2 LYS 119 1HD LYS 119 -6.660 -3.640 -13.408 937 HD3 LYS 119 2HD LYS 119 -7.225 -5.178 -12.751 938 HE2 LYS 119 1HE LYS 119 -9.578 -4.234 -13.021 939 HE3 LYS 119 2HE LYS 119 -8.838 -2.971 -14.004 940 HZ1 LYS 119 1HZ LYS 119 -7.827 -4.925 -15.291 941 HZ2 LYS 119 2HZ LYS 119 -9.460 -4.563 -15.543 942 HZ3 LYS 119 3HZ LYS 119 -9.025 -5.863 -14.551 943 H LEU 120 H LEU 120 -4.744 -6.195 -8.375 944 HA LEU 120 HA LEU 120 -2.515 -4.458 -7.817 945 HB2 LEU 120 1HB LEU 120 -3.262 -7.189 -6.788 946 HB3 LEU 120 2HB LEU 120 -1.863 -6.274 -6.229 947 HG LEU 120 HG LEU 120 -4.703 -5.292 -5.988 948 HD11 LEU 120 1HD1 LEU 120 -3.375 -7.352 -4.514 949 HD12 LEU 120 2HD1 LEU 120 -5.004 -6.707 -4.311 950 HD13 LEU 120 3HD1 LEU 120 -3.648 -5.958 -3.468 951 HD21 LEU 120 1HD2 LEU 120 -2.321 -4.429 -4.386 952 HD22 LEU 120 2HD2 LEU 120 -3.852 -3.592 -4.642 953 HD23 LEU 120 3HD2 LEU 120 -2.678 -3.705 -5.954 954 H SER 121 H SER 121 -0.273 -5.237 -7.823 955 HA SER 121 HA SER 121 0.780 -5.820 -10.207 956 HB2 SER 121 1HB SER 121 2.101 -5.369 -8.145 957 HB3 SER 121 2HB SER 121 1.832 -7.038 -7.642 958 HG SER 121 HG SER 121 2.754 -7.368 -9.968 959 H GLY 122 H GLY 122 0.460 -8.466 -7.833 960 HA2 GLY 122 1HA GLY 122 -0.517 -10.574 -8.205 961 HA3 GLY 122 2HA GLY 122 -0.600 -10.207 -9.922 962 HA PRO 123 HA PRO 123 3.997 -11.451 -9.206 963 HB2 PRO 123 1HB PRO 123 4.738 -12.145 -6.687 964 HB3 PRO 123 2HB PRO 123 4.816 -10.484 -7.289 965 HG2 PRO 123 1HG PRO 123 2.727 -11.785 -5.584 966 HG3 PRO 123 2HG PRO 123 3.458 -10.177 -5.426 967 HD2 PRO 123 1HD PRO 123 1.018 -10.565 -6.534 968 HD3 PRO 123 2HD PRO 123 2.108 -9.264 -7.056 969 H SER 124 H SER 124 4.872 -13.504 -9.433 970 HA SER 124 HA SER 124 3.262 -15.745 -8.407 971 HB2 SER 124 1HB SER 124 3.538 -16.914 -10.543 972 HB3 SER 124 2HB SER 124 2.727 -15.368 -10.788 973 HG SER 124 HG SER 124 5.479 -15.914 -11.224 974 H SER 125 H SER 125 4.478 -17.864 -8.611 975 HA SER 125 HA SER 125 7.187 -17.438 -7.607 976 HB2 SER 125 1HB SER 125 5.463 -19.928 -7.605 977 HB3 SER 125 2HB SER 125 7.043 -19.777 -6.835 978 HG SER 125 HG SER 125 5.893 -17.858 -5.764 979 H GLY 126 H GLY 126 8.731 -17.417 -9.108 980 HA2 GLY 126 1HA GLY 126 8.580 -19.429 -11.269 981 HA3 GLY 126 2HA GLY 126 9.254 -17.822 -11.495 Start of MODEL 2 1 H1 MET 1 H MET 1 17.019 8.858 13.726 2 HA MET 1 HA MET 1 16.169 10.085 11.204 3 HB2 MET 1 1HB MET 1 16.652 11.718 13.233 4 HB3 MET 1 2HB MET 1 18.324 11.437 12.764 5 HG2 MET 1 1HG MET 1 16.384 12.179 10.645 6 HG3 MET 1 2HG MET 1 16.909 13.426 11.774 7 HE1 MET 1 1HE MET 1 18.171 14.982 9.987 8 HE2 MET 1 2HE MET 1 18.901 14.739 11.574 9 HE3 MET 1 3HE MET 1 19.910 14.722 10.127 10 H LYS 2 H LYS 2 17.099 8.759 9.772 11 HA LYS 2 HA LYS 2 19.974 8.196 10.094 12 HB2 LYS 2 1HB LYS 2 17.718 6.401 9.322 13 HB3 LYS 2 2HB LYS 2 19.287 6.135 8.572 14 HG2 LYS 2 1HG LYS 2 19.399 4.737 10.386 15 HG3 LYS 2 2HG LYS 2 20.162 6.196 11.023 16 HD2 LYS 2 1HD LYS 2 18.311 6.753 12.310 17 HD3 LYS 2 2HD LYS 2 17.215 5.771 11.335 18 HE2 LYS 2 1HE LYS 2 17.497 4.619 13.381 19 HE3 LYS 2 2HE LYS 2 18.461 3.750 12.188 20 HZ1 LYS 2 1HZ LYS 2 20.429 4.910 13.008 21 HZ2 LYS 2 2HZ LYS 2 19.683 4.021 14.239 22 HZ3 LYS 2 3HZ LYS 2 19.494 5.701 14.176 23 H ASP 3 H ASP 3 19.242 10.473 8.823 24 HA ASP 3 HA ASP 3 19.463 11.655 6.891 25 HB2 ASP 3 1HB ASP 3 20.931 9.285 5.751 26 HB3 ASP 3 2HB ASP 3 21.190 10.995 5.421 27 H HIS 4 H HIS 4 17.047 10.385 7.100 28 HA HIS 4 HA HIS 4 16.530 9.409 4.369 29 HB2 HIS 4 1HB HIS 4 14.378 8.504 5.445 30 HB3 HIS 4 2HB HIS 4 15.887 7.679 5.824 31 HD1 HIS 4 1HD HIS 4 14.845 6.793 8.037 32 HD2 HIS 4 2HD HIS 4 15.108 10.932 7.794 33 HE1 HIS 4 1HE HIS 4 14.452 7.630 10.376 34 HE2 HIS 4 2HE HIS 4 14.531 10.141 10.188 35 H LEU 5 H LEU 5 16.321 11.507 3.500 36 HA LEU 5 HA LEU 5 14.194 13.204 4.554 37 HB2 LEU 5 1HB LEU 5 16.425 13.574 2.609 38 HB3 LEU 5 2HB LEU 5 15.031 14.650 2.535 39 HG LEU 5 HG LEU 5 15.496 15.106 5.017 40 HD11 LEU 5 1HD1 LEU 5 18.269 14.208 4.310 41 HD12 LEU 5 2HD1 LEU 5 17.122 13.135 5.113 42 HD13 LEU 5 3HD1 LEU 5 17.612 14.641 5.889 43 HD21 LEU 5 1HD2 LEU 5 15.870 16.875 3.557 44 HD22 LEU 5 2HD2 LEU 5 17.173 16.036 2.715 45 HD23 LEU 5 3HD2 LEU 5 17.435 16.666 4.341 46 H ILE 6 H ILE 6 13.239 10.827 3.539 47 HA ILE 6 HA ILE 6 12.551 10.475 0.968 48 HB ILE 6 HB ILE 6 10.637 10.323 3.298 49 HG12 ILE 6 1HG1 ILE 6 12.127 8.068 1.960 50 HG13 ILE 6 2HG1 ILE 6 12.796 8.951 3.328 51 HG21 ILE 6 1HG2 ILE 6 9.341 8.782 1.895 52 HG22 ILE 6 2HG2 ILE 6 9.418 10.401 1.200 53 HG23 ILE 6 3HG2 ILE 6 10.427 9.112 0.545 54 HD11 ILE 6 1HD1 ILE 6 11.163 8.155 4.786 55 HD12 ILE 6 2HD1 ILE 6 10.101 7.656 3.469 56 HD13 ILE 6 3HD1 ILE 6 11.585 6.760 3.794 57 H HIS 7 H HIS 7 10.990 11.206 -0.489 58 HA HIS 7 HA HIS 7 9.754 13.796 0.177 59 HB2 HIS 7 1HB HIS 7 11.097 12.949 -2.392 60 HB3 HIS 7 2HB HIS 7 10.066 14.371 -2.266 61 HD1 HIS 7 1HD HIS 7 13.446 13.688 -2.438 62 HD2 HIS 7 2HD HIS 7 11.181 15.932 0.225 63 HE1 HIS 7 1HE HIS 7 15.062 15.286 -1.362 64 HE2 HIS 7 2HE HIS 7 13.685 16.575 0.307 65 H ASN 8 H ASN 8 7.679 14.152 -0.525 66 HA ASN 8 HA ASN 8 6.327 11.832 -1.737 67 HB2 ASN 8 1HB ASN 8 5.768 12.723 0.685 68 HB3 ASN 8 2HB ASN 8 4.822 13.913 -0.204 69 HD21 ASN 8 1HD2 ASN 8 2.960 13.303 -1.209 70 HD22 ASN 8 2HD2 ASN 8 2.259 11.733 -1.043 71 H VAL 9 H VAL 9 6.868 12.662 -3.847 72 HA VAL 9 HA VAL 9 4.987 14.751 -4.705 73 HB VAL 9 HB VAL 9 6.739 15.502 -6.372 74 HG11 VAL 9 1HG1 VAL 9 8.102 16.459 -4.145 75 HG12 VAL 9 2HG1 VAL 9 6.707 17.200 -4.932 76 HG13 VAL 9 3HG1 VAL 9 6.474 16.115 -3.560 77 HG21 VAL 9 1HG2 VAL 9 9.107 15.110 -5.613 78 HG22 VAL 9 2HG2 VAL 9 8.479 13.849 -4.553 79 HG23 VAL 9 3HG2 VAL 9 8.293 13.705 -6.301 80 H HIS 10 H HIS 10 3.582 13.663 -5.928 81 HA HIS 10 HA HIS 10 4.210 11.299 -7.365 82 HB2 HIS 10 1HB HIS 10 1.916 12.143 -6.487 83 HB3 HIS 10 2HB HIS 10 1.843 13.039 -8.002 84 HD1 HIS 10 1HD HIS 10 2.657 11.151 -10.093 85 HD2 HIS 10 2HD HIS 10 0.465 9.897 -6.794 86 HE1 HIS 10 1HE HIS 10 1.540 9.012 -10.802 87 HE2 HIS 10 2HE HIS 10 0.151 8.318 -8.818 88 H LYS 11 H LYS 11 5.467 11.235 -9.100 89 HA LYS 11 HA LYS 11 5.336 13.464 -11.022 90 HB2 LYS 11 1HB LYS 11 7.563 11.750 -10.052 91 HB3 LYS 11 2HB LYS 11 7.602 12.232 -11.743 92 HG2 LYS 11 1HG LYS 11 7.537 14.567 -11.115 93 HG3 LYS 11 2HG LYS 11 7.392 14.127 -9.411 94 HD2 LYS 11 1HD LYS 11 9.726 13.404 -11.182 95 HD3 LYS 11 2HD LYS 11 9.695 14.775 -10.072 96 HE2 LYS 11 1HE LYS 11 9.315 13.217 -8.202 97 HE3 LYS 11 2HE LYS 11 9.417 11.864 -9.328 98 HZ1 LYS 11 1HZ LYS 11 11.698 12.893 -9.900 99 HZ2 LYS 11 2HZ LYS 11 11.541 11.979 -8.486 100 HZ3 LYS 11 3HZ LYS 11 11.551 13.669 -8.404 101 H GLU 12 H GLU 12 6.178 12.599 -13.289 102 HA GLU 12 HA GLU 12 4.324 10.455 -14.009 103 HB2 GLU 12 1HB GLU 12 5.825 12.440 -15.726 104 HB3 GLU 12 2HB GLU 12 4.713 11.225 -16.339 105 HG2 GLU 12 1HG GLU 12 3.772 13.152 -14.272 106 HG3 GLU 12 2HG GLU 12 3.922 13.677 -15.948 107 H GLU 13 H GLU 13 4.970 8.492 -14.633 108 HA GLU 13 HA GLU 13 7.832 8.092 -15.208 109 HB2 GLU 13 1HB GLU 13 6.807 7.180 -12.975 110 HB3 GLU 13 2HB GLU 13 6.151 5.921 -14.012 111 HG2 GLU 13 1HG GLU 13 8.485 5.491 -14.810 112 HG3 GLU 13 2HG GLU 13 9.044 6.597 -13.557 113 H HIS 14 H HIS 14 8.312 7.092 -17.063 114 HA HIS 14 HA HIS 14 6.139 5.713 -18.498 115 HB2 HIS 14 1HB HIS 14 8.127 7.731 -19.466 116 HB3 HIS 14 2HB HIS 14 7.542 6.498 -20.580 117 HD1 HIS 14 1HD HIS 14 5.848 7.577 -22.017 118 HD2 HIS 14 2HD HIS 14 5.476 8.748 -18.048 119 HE1 HIS 14 1HE HIS 14 3.816 9.057 -21.940 120 HE2 HIS 14 2HE HIS 14 3.661 9.822 -19.545 121 H ALA 15 H ALA 15 6.943 3.753 -17.530 122 HA ALA 15 HA ALA 15 8.893 2.457 -19.192 123 HB1 ALA 15 1HB ALA 15 10.381 1.777 -17.334 124 HB2 ALA 15 2HB ALA 15 10.427 3.510 -17.664 125 HB3 ALA 15 3HB ALA 15 9.523 2.900 -16.277 126 H HIS 16 H HIS 16 9.099 0.140 -18.675 127 HA HIS 16 HA HIS 16 6.609 -1.065 -18.267 128 HB2 HIS 16 1HB HIS 16 7.806 -3.184 -18.275 129 HB3 HIS 16 2HB HIS 16 8.471 -2.117 -19.509 130 HD1 HIS 16 1HD HIS 16 10.907 -1.432 -19.282 131 HD2 HIS 16 2HD HIS 16 9.511 -3.624 -16.040 132 HE1 HIS 16 1HE HIS 16 12.949 -2.011 -17.933 133 HE2 HIS 16 2HE HIS 16 12.089 -3.410 -16.023 134 H ALA 17 H ALA 17 6.079 -2.687 -16.582 135 HA ALA 17 HA ALA 17 6.167 -1.518 -14.011 136 HB1 ALA 17 1HB ALA 17 5.518 -4.319 -13.906 137 HB2 ALA 17 2HB ALA 17 4.484 -2.916 -13.632 138 HB3 ALA 17 3HB ALA 17 4.707 -3.542 -15.265 139 H HIS 18 H HIS 18 7.831 -1.486 -12.663 140 HA HIS 18 HA HIS 18 10.096 -3.196 -12.973 141 HB2 HIS 18 1HB HIS 18 9.394 -1.315 -10.709 142 HB3 HIS 18 2HB HIS 18 10.973 -2.045 -10.987 143 HD1 HIS 18 1HD HIS 18 12.471 -0.253 -11.785 144 HD2 HIS 18 2HD HIS 18 8.696 0.015 -13.500 145 HE1 HIS 18 1HE HIS 18 12.608 1.655 -13.417 146 HE2 HIS 18 2HE HIS 18 10.289 1.854 -14.380 147 H ASN 19 H ASN 19 9.417 -5.317 -12.694 148 HA ASN 19 HA ASN 19 8.153 -6.066 -10.178 149 HB2 ASN 19 1HB ASN 19 8.980 -7.945 -12.386 150 HB3 ASN 19 2HB ASN 19 7.741 -8.185 -11.157 151 HD21 ASN 19 1HD2 ASN 19 7.774 -8.152 -14.180 152 HD22 ASN 19 2HD2 ASN 19 6.464 -7.107 -14.602 153 H LYS 20 H LYS 20 9.026 -7.751 -8.832 154 HA LYS 20 HA LYS 20 11.953 -8.022 -9.020 155 HB2 LYS 20 1HB LYS 20 10.246 -7.208 -6.710 156 HB3 LYS 20 2HB LYS 20 11.688 -8.161 -6.388 157 HG2 LYS 20 1HG LYS 20 12.795 -6.323 -7.943 158 HG3 LYS 20 2HG LYS 20 11.428 -5.373 -7.357 159 HD2 LYS 20 1HD LYS 20 13.026 -6.918 -5.378 160 HD3 LYS 20 2HD LYS 20 13.726 -5.444 -6.052 161 HE2 LYS 20 1HE LYS 20 11.936 -4.119 -5.244 162 HE3 LYS 20 2HE LYS 20 10.967 -5.540 -4.855 163 HZ1 LYS 20 1HZ LYS 20 12.322 -4.244 -3.028 164 HZ2 LYS 20 2HZ LYS 20 13.565 -5.269 -3.543 165 HZ3 LYS 20 3HZ LYS 20 12.119 -5.922 -2.954 166 H ASP 21 H ASP 21 11.467 -10.051 -10.089 167 HA ASP 21 HA ASP 21 10.941 -12.180 -8.136 168 HB2 ASP 21 1HB ASP 21 8.892 -11.847 -9.468 169 HB3 ASP 21 2HB ASP 21 9.818 -12.099 -10.945 170 H TYR 22 H TYR 22 13.245 -12.378 -8.077 171 HA TYR 22 HA TYR 22 14.312 -13.826 -10.408 172 HB2 TYR 22 1HB TYR 22 16.581 -12.810 -9.464 173 HB3 TYR 22 2HB TYR 22 15.586 -11.933 -10.622 174 HD1 TYR 22 2HD TYR 22 13.806 -10.318 -9.588 175 HD2 TYR 22 1HD TYR 22 17.218 -11.763 -7.496 176 HE1 TYR 22 2HE TYR 22 13.637 -8.430 -8.021 177 HE2 TYR 22 1HE TYR 22 17.058 -9.880 -5.922 178 HH TYR 22 HH TYR 22 15.782 -8.168 -5.223 179 H ASP 23 H ASP 23 15.415 -13.071 -7.104 180 HA ASP 23 HA ASP 23 15.671 -15.967 -6.628 181 HB2 ASP 23 1HB ASP 23 17.606 -13.747 -6.125 182 HB3 ASP 23 2HB ASP 23 17.576 -15.106 -5.006 183 H ILE 24 H ILE 24 13.339 -14.870 -5.954 184 HA ILE 24 HA ILE 24 13.390 -13.884 -3.235 185 HB ILE 24 HB ILE 24 10.852 -14.781 -4.508 186 HG12 ILE 24 1HG1 ILE 24 11.894 -13.728 -6.394 187 HG13 ILE 24 2HG1 ILE 24 10.742 -12.579 -5.722 188 HG21 ILE 24 1HG2 ILE 24 10.653 -13.829 -2.352 189 HG22 ILE 24 2HG2 ILE 24 11.713 -12.484 -2.769 190 HG23 ILE 24 3HG2 ILE 24 10.106 -12.595 -3.487 191 HD11 ILE 24 1HD1 ILE 24 12.352 -11.077 -5.582 192 HD12 ILE 24 2HD1 ILE 24 13.230 -12.123 -4.465 193 HD13 ILE 24 3HD1 ILE 24 13.516 -12.249 -6.201 194 HA PRO 25 HA PRO 25 13.184 -17.847 -1.301 195 HB2 PRO 25 1HB PRO 25 12.306 -17.031 1.135 196 HB3 PRO 25 2HB PRO 25 13.967 -16.789 0.583 197 HG2 PRO 25 1HG PRO 25 11.680 -14.858 0.608 198 HG3 PRO 25 2HG PRO 25 13.375 -14.592 1.058 199 HD2 PRO 25 1HD PRO 25 12.366 -13.831 -1.337 200 HD3 PRO 25 2HD PRO 25 14.050 -14.355 -1.133 201 H THR 26 H THR 26 11.565 -19.071 0.151 202 HA THR 26 HA THR 26 8.959 -18.897 -1.144 203 HB THR 26 HB THR 26 8.513 -21.093 -0.158 204 HG1 THR 26 1HG THR 26 10.758 -20.431 1.330 205 HG21 THR 26 1HG2 THR 26 10.668 -20.498 -1.980 206 HG22 THR 26 2HG2 THR 26 9.505 -21.824 -2.018 207 HG23 THR 26 3HG2 THR 26 10.997 -21.985 -1.092 208 H THR 27 H THR 27 9.506 -16.832 0.687 209 HA THR 27 HA THR 27 8.551 -17.267 3.283 210 HB THR 27 HB THR 27 8.256 -14.709 1.700 211 HG1 THR 27 1HG THR 27 10.458 -15.613 3.274 212 HG21 THR 27 1HG2 THR 27 8.072 -13.598 3.738 213 HG22 THR 27 2HG2 THR 27 8.769 -14.941 4.645 214 HG23 THR 27 3HG2 THR 27 7.129 -15.063 4.008 215 H GLU 28 H GLU 28 6.533 -16.973 4.237 216 HA GLU 28 HA GLU 28 4.290 -17.571 2.508 217 HB2 GLU 28 1HB GLU 28 3.082 -18.079 4.480 218 HB3 GLU 28 2HB GLU 28 4.714 -18.673 4.752 219 HG2 GLU 28 1HG GLU 28 4.084 -15.927 5.667 220 HG3 GLU 28 2HG GLU 28 3.390 -17.275 6.566 221 H ASN 29 H ASN 29 5.695 -14.841 2.745 222 HA ASN 29 HA ASN 29 3.299 -13.235 3.338 223 HB2 ASN 29 1HB ASN 29 6.228 -12.698 3.607 224 HB3 ASN 29 2HB ASN 29 5.147 -11.344 3.287 225 HD21 ASN 29 1HD2 ASN 29 6.419 -13.418 5.621 226 HD22 ASN 29 2HD2 ASN 29 5.439 -12.920 6.955 227 H LEU 30 H LEU 30 2.215 -12.624 1.595 228 HA LEU 30 HA LEU 30 3.682 -12.217 -0.921 229 HB2 LEU 30 1HB LEU 30 0.856 -12.994 -0.304 230 HB3 LEU 30 2HB LEU 30 1.280 -12.308 -1.871 231 HG LEU 30 HG LEU 30 2.495 -14.820 -0.723 232 HD11 LEU 30 1HD1 LEU 30 -0.084 -14.471 -1.729 233 HD12 LEU 30 2HD1 LEU 30 0.772 -15.992 -1.482 234 HD13 LEU 30 3HD1 LEU 30 0.842 -15.186 -3.049 235 HD21 LEU 30 1HD2 LEU 30 3.820 -14.900 -2.525 236 HD22 LEU 30 2HD2 LEU 30 3.482 -13.175 -2.667 237 HD23 LEU 30 3HD2 LEU 30 2.545 -14.338 -3.607 238 H TYR 31 H TYR 31 3.731 -10.268 -1.873 239 HA TYR 31 HA TYR 31 2.168 -8.110 -0.617 240 HB2 TYR 31 1HB TYR 31 4.669 -7.680 -2.233 241 HB3 TYR 31 2HB TYR 31 3.923 -6.604 -1.057 242 HD1 TYR 31 2HD TYR 31 5.674 -9.874 -1.352 243 HD2 TYR 31 1HD TYR 31 4.659 -6.594 1.160 244 HE1 TYR 31 2HE TYR 31 7.170 -10.754 0.392 245 HE2 TYR 31 1HE TYR 31 6.152 -7.464 2.910 246 HH TYR 31 HH TYR 31 7.083 -10.189 3.347 247 H PHE 32 H PHE 32 1.364 -6.422 -1.982 248 HA PHE 32 HA PHE 32 1.380 -6.789 -4.843 249 HB2 PHE 32 1HB PHE 32 -1.288 -6.908 -3.436 250 HB3 PHE 32 2HB PHE 32 -0.960 -7.153 -5.148 251 HD1 PHE 32 1HD PHE 32 -0.450 -8.607 -1.785 252 HD2 PHE 32 2HD PHE 32 -0.443 -9.279 -5.988 253 HE1 PHE 32 1HE PHE 32 -0.254 -11.028 -1.394 254 HE2 PHE 32 2HE PHE 32 -0.248 -11.701 -5.604 255 HZ PHE 32 HZ PHE 32 -0.154 -12.579 -3.304 256 H GLN 33 H GLN 33 1.329 -4.859 -5.795 257 HA GLN 33 HA GLN 33 0.524 -2.545 -4.183 258 HB2 GLN 33 1HB GLN 33 2.685 -2.139 -4.915 259 HB3 GLN 33 2HB GLN 33 2.421 -2.933 -6.462 260 HG2 GLN 33 1HG GLN 33 2.658 -0.580 -6.819 261 HG3 GLN 33 2HG GLN 33 0.989 -1.044 -7.148 262 HE21 GLN 33 1HE2 GLN 33 -0.292 0.550 -6.565 263 HE22 GLN 33 2HE2 GLN 33 -0.190 1.455 -5.097 264 H GLY 34 H GLY 34 -0.948 -1.033 -4.914 265 HA2 GLY 34 1HA GLY 34 -2.042 -0.403 -7.221 266 HA3 GLY 34 2HA GLY 34 -2.740 -2.002 -7.016 267 H SER 35 H SER 35 -2.248 0.925 -5.035 268 HA SER 35 HA SER 35 -4.585 0.453 -3.477 269 HB2 SER 35 1HB SER 35 -2.565 2.631 -3.703 270 HB3 SER 35 2HB SER 35 -4.113 3.030 -2.959 271 HG SER 35 HG SER 35 -3.166 0.686 -2.012 272 H SER 36 H SER 36 -6.633 1.055 -3.806 273 HA SER 36 HA SER 36 -7.346 2.258 -6.326 274 HB2 SER 36 1HB SER 36 -9.699 1.933 -5.471 275 HB3 SER 36 2HB SER 36 -8.736 0.458 -5.560 276 HG SER 36 HG SER 36 -10.011 1.304 -3.487 277 H GLY 37 H GLY 37 -6.019 4.231 -5.464 278 HA2 GLY 37 1HA GLY 37 -6.570 6.557 -5.410 279 HA3 GLY 37 2HA GLY 37 -8.008 6.159 -4.480 280 H SER 38 H SER 38 -7.770 5.602 -2.248 281 HA SER 38 HA SER 38 -5.303 6.702 -1.070 282 HB2 SER 38 1HB SER 38 -6.681 7.316 0.888 283 HB3 SER 38 2HB SER 38 -7.266 8.083 -0.589 284 HG SER 38 HG SER 38 -8.378 5.621 -0.023 285 H SER 39 H SER 39 -5.273 5.909 1.409 286 HA SER 39 HA SER 39 -4.724 3.109 1.248 287 HB2 SER 39 1HB SER 39 -4.789 4.825 3.738 288 HB3 SER 39 2HB SER 39 -3.920 3.308 3.508 289 HG SER 39 HG SER 39 -2.333 4.532 2.897 290 H GLY 40 H GLY 40 -7.303 5.074 2.593 291 HA2 GLY 40 1HA GLY 40 -8.538 3.089 4.169 292 HA3 GLY 40 2HA GLY 40 -9.327 4.520 3.523 293 H ASP 41 H ASP 41 -9.198 4.130 0.832 294 HA ASP 41 HA ASP 41 -11.376 2.606 0.225 295 HB2 ASP 41 1HB ASP 41 -9.844 4.194 -1.243 296 HB3 ASP 41 2HB ASP 41 -9.168 2.660 -1.783 297 H MET 42 H MET 42 -7.992 1.545 0.200 298 HA MET 42 HA MET 42 -8.081 -0.924 -0.864 299 HB2 MET 42 1HB MET 42 -6.648 0.098 1.561 300 HB3 MET 42 2HB MET 42 -6.497 -1.593 1.106 301 HG2 MET 42 1HG MET 42 -6.037 0.452 -0.990 302 HG3 MET 42 2HG MET 42 -4.810 0.252 0.259 303 HE1 MET 42 1HE MET 42 -5.523 -2.022 -3.427 304 HE2 MET 42 2HE MET 42 -6.846 -2.479 -2.354 305 HE3 MET 42 3HE MET 42 -6.534 -0.776 -2.694 306 H MET 43 H MET 43 -8.891 -0.263 2.548 307 HA MET 43 HA MET 43 -9.680 -2.831 3.251 308 HB2 MET 43 1HB MET 43 -10.860 -0.245 4.278 309 HB3 MET 43 2HB MET 43 -10.895 -1.803 5.092 310 HG2 MET 43 1HG MET 43 -8.351 -1.697 5.041 311 HG3 MET 43 2HG MET 43 -8.552 0.001 4.614 312 HE1 MET 43 1HE MET 43 -9.307 -1.976 8.667 313 HE2 MET 43 2HE MET 43 -10.138 -2.588 7.236 314 HE3 MET 43 3HE MET 43 -8.375 -2.612 7.311 315 H ARG 44 H ARG 44 -11.614 -0.183 1.894 316 HA ARG 44 HA ARG 44 -14.093 -1.508 1.955 317 HB2 ARG 44 1HB ARG 44 -12.975 0.844 0.513 318 HB3 ARG 44 2HB ARG 44 -14.468 0.147 -0.102 319 HG2 ARG 44 1HG ARG 44 -15.309 1.702 1.333 320 HG3 ARG 44 2HG ARG 44 -15.197 0.315 2.419 321 HD2 ARG 44 1HD ARG 44 -13.269 1.139 3.457 322 HD3 ARG 44 2HD ARG 44 -12.939 2.270 2.145 323 HE ARG 44 HE ARG 44 -15.284 3.170 3.087 324 HH11 ARG 44 2HH1 ARG 44 -12.314 2.296 4.678 325 HH12 ARG 44 1HH1 ARG 44 -12.525 3.423 5.976 326 HH21 ARG 44 2HH2 ARG 44 -15.574 4.658 4.791 327 HH22 ARG 44 1HH2 ARG 44 -14.381 4.765 6.040 328 H GLU 45 H GLU 45 -11.945 -0.957 -0.845 329 HA GLU 45 HA GLU 45 -13.272 -2.515 -2.689 330 HB2 GLU 45 1HB GLU 45 -11.083 -1.030 -2.839 331 HB3 GLU 45 2HB GLU 45 -10.290 -2.590 -2.674 332 HG2 GLU 45 1HG GLU 45 -10.422 -2.351 -4.954 333 HG3 GLU 45 2HG GLU 45 -11.855 -3.316 -4.601 334 H ILE 46 H ILE 46 -10.405 -3.591 -0.856 335 HA ILE 46 HA ILE 46 -10.250 -6.191 -1.503 336 HB ILE 46 HB ILE 46 -10.067 -5.099 1.306 337 HG12 ILE 46 1HG1 ILE 46 -7.759 -5.787 -0.487 338 HG13 ILE 46 2HG1 ILE 46 -8.566 -4.230 -0.642 339 HG21 ILE 46 1HG2 ILE 46 -8.432 -7.171 1.408 340 HG22 ILE 46 2HG2 ILE 46 -10.153 -7.335 1.753 341 HG23 ILE 46 3HG2 ILE 46 -9.525 -7.790 0.170 342 HD11 ILE 46 1HD1 ILE 46 -7.518 -3.422 1.136 343 HD12 ILE 46 2HD1 ILE 46 -7.914 -4.838 2.109 344 HD13 ILE 46 3HD1 ILE 46 -6.492 -4.855 1.066 345 H ARG 47 H ARG 47 -12.315 -5.052 1.178 346 HA ARG 47 HA ARG 47 -13.542 -7.368 1.898 347 HB2 ARG 47 1HB ARG 47 -14.676 -4.585 1.669 348 HB3 ARG 47 2HB ARG 47 -15.601 -5.918 2.348 349 HG2 ARG 47 1HG ARG 47 -14.201 -6.114 4.193 350 HG3 ARG 47 2HG ARG 47 -12.887 -5.237 3.407 351 HD2 ARG 47 1HD ARG 47 -14.134 -3.170 3.549 352 HD3 ARG 47 2HD ARG 47 -15.527 -4.023 4.214 353 HE ARG 47 HE ARG 47 -13.642 -4.611 6.009 354 HH11 ARG 47 2HH1 ARG 47 -14.531 -1.588 4.527 355 HH12 ARG 47 1HH1 ARG 47 -14.066 -0.631 5.894 356 HH21 ARG 47 2HH2 ARG 47 -13.026 -3.362 7.816 357 HH22 ARG 47 1HH2 ARG 47 -13.209 -1.641 7.764 358 H LYS 48 H LYS 48 -14.559 -5.236 -0.760 359 HA LYS 48 HA LYS 48 -16.797 -6.651 -1.598 360 HB2 LYS 48 1HB LYS 48 -16.320 -4.459 -2.481 361 HB3 LYS 48 2HB LYS 48 -14.817 -5.024 -3.200 362 HG2 LYS 48 1HG LYS 48 -17.358 -6.326 -4.027 363 HG3 LYS 48 2HG LYS 48 -16.993 -4.710 -4.637 364 HD2 LYS 48 1HD LYS 48 -15.232 -5.433 -5.890 365 HD3 LYS 48 2HD LYS 48 -14.833 -6.739 -4.772 366 HE2 LYS 48 1HE LYS 48 -15.658 -7.930 -6.553 367 HE3 LYS 48 2HE LYS 48 -17.119 -7.723 -5.589 368 HZ1 LYS 48 1HZ LYS 48 -16.745 -6.985 -8.217 369 HZ2 LYS 48 2HZ LYS 48 -16.756 -5.531 -7.353 370 HZ3 LYS 48 3HZ LYS 48 -18.064 -6.597 -7.230 371 H VAL 49 H VAL 49 -13.401 -7.063 -2.530 372 HA VAL 49 HA VAL 49 -13.828 -9.083 -4.451 373 HB VAL 49 HB VAL 49 -11.325 -8.973 -2.807 374 HG11 VAL 49 1HG1 VAL 49 -11.825 -10.594 -4.758 375 HG12 VAL 49 2HG1 VAL 49 -11.544 -9.187 -5.785 376 HG13 VAL 49 3HG1 VAL 49 -10.268 -9.768 -4.714 377 HG21 VAL 49 1HG2 VAL 49 -10.997 -7.204 -4.958 378 HG22 VAL 49 2HG2 VAL 49 -12.507 -6.741 -4.173 379 HG23 VAL 49 3HG2 VAL 49 -11.014 -6.814 -3.238 380 H LEU 50 H LEU 50 -13.057 -9.237 -0.991 381 HA LEU 50 HA LEU 50 -12.734 -11.976 -0.722 382 HB2 LEU 50 1HB LEU 50 -14.081 -10.177 1.283 383 HB3 LEU 50 2HB LEU 50 -13.237 -11.690 1.608 384 HG LEU 50 HG LEU 50 -11.980 -9.101 0.699 385 HD11 LEU 50 1HD1 LEU 50 -12.636 -8.976 3.000 386 HD12 LEU 50 2HD1 LEU 50 -10.891 -9.215 2.927 387 HD13 LEU 50 3HD1 LEU 50 -11.949 -10.567 3.331 388 HD21 LEU 50 1HD2 LEU 50 -10.013 -10.837 1.602 389 HD22 LEU 50 2HD2 LEU 50 -10.325 -10.373 -0.071 390 HD23 LEU 50 3HD2 LEU 50 -11.052 -11.839 0.589 391 H GLY 51 H GLY 51 -15.735 -10.124 -0.144 392 HA2 GLY 51 1HA GLY 51 -17.433 -12.272 0.297 393 HA3 GLY 51 2HA GLY 51 -17.939 -10.726 -0.367 394 H ALA 52 H ALA 52 -16.247 -10.981 -2.738 395 HA ALA 52 HA ALA 52 -18.094 -12.256 -4.446 396 HB1 ALA 52 1HB ALA 52 -17.026 -10.986 -5.914 397 HB2 ALA 52 2HB ALA 52 -15.773 -10.633 -4.723 398 HB3 ALA 52 3HB ALA 52 -15.612 -12.033 -5.784 399 H ASN 53 H ASN 53 -14.979 -13.273 -3.123 400 HA ASN 53 HA ASN 53 -15.254 -15.872 -4.447 401 HB2 ASN 53 1HB ASN 53 -12.977 -14.357 -3.253 402 HB3 ASN 53 2HB ASN 53 -12.890 -16.116 -3.255 403 HD21 ASN 53 1HD2 ASN 53 -13.228 -13.276 -5.284 404 HD22 ASN 53 2HD2 ASN 53 -12.629 -14.007 -6.731 405 H ASN 54 H ASN 54 -17.071 -15.301 -2.379 406 HA ASN 54 HA ASN 54 -17.845 -16.027 -0.350 407 HB2 ASN 54 1HB ASN 54 -16.435 -18.478 -1.418 408 HB3 ASN 54 2HB ASN 54 -17.498 -18.504 -0.015 409 HD21 ASN 54 1HD2 ASN 54 -18.276 -20.135 -1.844 410 HD22 ASN 54 2HD2 ASN 54 -19.588 -19.526 -2.789 411 H CYS 55 H CYS 55 -15.572 -14.525 0.017 412 HA CYS 55 HA CYS 55 -14.049 -16.009 2.051 413 HB2 CYS 55 1HB CYS 55 -13.332 -13.457 0.592 414 HB3 CYS 55 2HB CYS 55 -12.335 -14.246 1.808 415 HG CYS 55 HG CYS 55 -13.158 -15.567 -1.241 416 H ASP 56 H ASP 56 -14.233 -15.470 4.132 417 HA ASP 56 HA ASP 56 -15.956 -13.209 4.817 418 HB2 ASP 56 1HB ASP 56 -16.549 -15.373 5.784 419 HB3 ASP 56 2HB ASP 56 -14.947 -15.508 6.505 420 H TYR 57 H TYR 57 -15.354 -11.602 6.272 421 HA TYR 57 HA TYR 57 -12.524 -11.515 7.049 422 HB2 TYR 57 1HB TYR 57 -12.752 -8.962 6.516 423 HB3 TYR 57 2HB TYR 57 -12.397 -10.099 5.219 424 HD1 TYR 57 2HD TYR 57 -14.600 -11.107 4.072 425 HD2 TYR 57 1HD TYR 57 -14.384 -7.385 6.122 426 HE1 TYR 57 2HE TYR 57 -16.573 -10.317 2.834 427 HE2 TYR 57 1HE TYR 57 -16.358 -6.586 4.891 428 HH TYR 57 HH TYR 57 -18.474 -8.400 3.433 429 H GLU 58 H GLU 58 -12.076 -10.442 8.959 430 HA GLU 58 HA GLU 58 -14.380 -9.382 10.449 431 HB2 GLU 58 1HB GLU 58 -14.013 -11.607 11.298 432 HB3 GLU 58 2HB GLU 58 -12.287 -11.313 11.455 433 HG2 GLU 58 1HG GLU 58 -12.542 -9.999 13.330 434 HG3 GLU 58 2HG GLU 58 -14.218 -9.605 12.954 435 H GLN 59 H GLN 59 -13.909 -7.266 10.515 436 HA GLN 59 HA GLN 59 -11.298 -6.191 10.601 437 HB2 GLN 59 1HB GLN 59 -13.640 -5.128 9.966 438 HB3 GLN 59 2HB GLN 59 -13.614 -4.632 11.653 439 HG2 GLN 59 1HG GLN 59 -11.185 -3.816 10.985 440 HG3 GLN 59 2HG GLN 59 -11.924 -3.752 9.386 441 HE21 GLN 59 1HE2 GLN 59 -11.148 -1.430 10.137 442 HE22 GLN 59 2HE2 GLN 59 -12.423 -0.439 10.751 443 H ARG 60 H ARG 60 -9.956 -6.557 12.246 444 HA ARG 60 HA ARG 60 -10.964 -6.771 14.963 445 HB2 ARG 60 1HB ARG 60 -8.275 -7.219 13.690 446 HB3 ARG 60 2HB ARG 60 -8.465 -7.171 15.437 447 HG2 ARG 60 1HG ARG 60 -10.080 -9.014 13.706 448 HG3 ARG 60 2HG ARG 60 -8.488 -9.452 14.329 449 HD2 ARG 60 1HD ARG 60 -9.433 -8.816 16.628 450 HD3 ARG 60 2HD ARG 60 -11.013 -8.885 15.849 451 HE ARG 60 HE ARG 60 -9.414 -11.238 15.437 452 HH11 ARG 60 2HH1 ARG 60 -11.675 -9.643 17.550 453 HH12 ARG 60 1HH1 ARG 60 -12.238 -11.114 18.272 454 HH21 ARG 60 2HH2 ARG 60 -10.147 -13.181 16.380 455 HH22 ARG 60 1HH2 ARG 60 -11.368 -13.126 17.606 456 H GLU 61 H GLU 61 -8.680 -4.745 13.144 457 HA GLU 61 HA GLU 61 -8.943 -2.713 15.263 458 HB2 GLU 61 1HB GLU 61 -6.542 -3.231 13.498 459 HB3 GLU 61 2HB GLU 61 -6.671 -1.961 14.708 460 HG2 GLU 61 1HG GLU 61 -6.872 -3.651 16.461 461 HG3 GLU 61 2HG GLU 61 -6.734 -4.921 15.247 462 H ARG 62 H ARG 62 -8.041 -0.503 14.230 463 HA ARG 62 HA ARG 62 -10.012 0.434 12.526 464 HB2 ARG 62 1HB ARG 62 -8.804 2.036 13.771 465 HB3 ARG 62 2HB ARG 62 -7.257 1.461 13.164 466 HG2 ARG 62 1HG ARG 62 -7.494 2.541 11.142 467 HG3 ARG 62 2HG ARG 62 -9.253 2.612 11.269 468 HD2 ARG 62 1HD ARG 62 -7.525 4.091 13.216 469 HD3 ARG 62 2HD ARG 62 -7.861 4.771 11.624 470 HE ARG 62 HE ARG 62 -10.106 5.025 12.225 471 HH11 ARG 62 2HH1 ARG 62 -8.242 3.545 14.765 472 HH12 ARG 62 1HH1 ARG 62 -9.444 3.815 15.983 473 HH21 ARG 62 2HH2 ARG 62 -11.697 5.386 13.819 474 HH22 ARG 62 1HH2 ARG 62 -11.409 4.862 15.443 475 H PHE 63 H PHE 63 -6.601 -0.139 11.639 476 HA PHE 63 HA PHE 63 -7.471 -0.451 8.848 477 HB2 PHE 63 1HB PHE 63 -4.865 0.407 10.083 478 HB3 PHE 63 2HB PHE 63 -4.943 -0.151 8.415 479 HD1 PHE 63 2HD PHE 63 -6.895 1.007 7.009 480 HD2 PHE 63 1HD PHE 63 -5.013 2.660 10.451 481 HE1 PHE 63 2HE PHE 63 -7.562 3.262 6.286 482 HE2 PHE 63 1HE PHE 63 -5.678 4.918 9.734 483 HZ PHE 63 HZ PHE 63 -6.953 5.221 7.649 484 H LEU 64 H LEU 64 -8.080 -2.643 10.110 485 HA LEU 64 HA LEU 64 -6.152 -4.579 9.124 486 HB2 LEU 64 1HB LEU 64 -5.427 -4.267 11.409 487 HB3 LEU 64 2HB LEU 64 -7.070 -4.517 11.994 488 HG LEU 64 HG LEU 64 -6.935 -6.862 11.140 489 HD11 LEU 64 1HD1 LEU 64 -5.069 -7.747 10.199 490 HD12 LEU 64 2HD1 LEU 64 -3.981 -6.655 11.054 491 HD13 LEU 64 3HD1 LEU 64 -4.878 -6.083 9.648 492 HD21 LEU 64 1HD2 LEU 64 -4.672 -6.528 13.032 493 HD22 LEU 64 2HD2 LEU 64 -6.060 -7.614 13.105 494 HD23 LEU 64 3HD2 LEU 64 -6.251 -5.909 13.514 495 H LEU 65 H LEU 65 -7.050 -6.596 8.656 496 HA LEU 65 HA LEU 65 -9.842 -7.088 9.282 497 HB2 LEU 65 1HB LEU 65 -8.822 -6.489 6.539 498 HB3 LEU 65 2HB LEU 65 -10.151 -7.627 6.746 499 HG LEU 65 HG LEU 65 -10.282 -4.853 7.886 500 HD11 LEU 65 1HD1 LEU 65 -10.071 -4.132 5.757 501 HD12 LEU 65 2HD1 LEU 65 -11.760 -4.629 5.661 502 HD13 LEU 65 3HD1 LEU 65 -10.491 -5.699 5.066 503 HD21 LEU 65 1HD2 LEU 65 -11.931 -6.398 8.707 504 HD22 LEU 65 2HD2 LEU 65 -12.335 -6.905 7.067 505 HD23 LEU 65 3HD2 LEU 65 -12.712 -5.267 7.602 506 H PHE 66 H PHE 66 -10.016 -9.148 9.836 507 HA PHE 66 HA PHE 66 -7.911 -11.019 9.172 508 HB2 PHE 66 1HB PHE 66 -9.003 -10.862 11.448 509 HB3 PHE 66 2HB PHE 66 -10.442 -11.572 10.724 510 HD1 PHE 66 2HD PHE 66 -6.956 -12.171 11.695 511 HD2 PHE 66 1HD PHE 66 -10.532 -13.895 10.160 512 HE1 PHE 66 2HE PHE 66 -6.035 -14.419 12.085 513 HE2 PHE 66 1HE PHE 66 -9.617 -16.146 10.548 514 HZ PHE 66 HZ PHE 66 -7.366 -16.410 11.510 515 H CYS 67 H CYS 67 -8.090 -11.482 7.004 516 HA CYS 67 HA CYS 67 -10.611 -12.263 5.845 517 HB2 CYS 67 1HB CYS 67 -7.805 -12.362 4.717 518 HB3 CYS 67 2HB CYS 67 -9.277 -12.659 3.800 519 HG CYS 67 HG CYS 67 -8.975 -9.692 5.411 520 H VAL 68 H VAL 68 -11.271 -14.296 5.268 521 HA VAL 68 HA VAL 68 -9.526 -16.576 5.690 522 HB VAL 68 HB VAL 68 -10.512 -16.152 7.928 523 HG11 VAL 68 1HG1 VAL 68 -12.681 -15.254 6.929 524 HG12 VAL 68 2HG1 VAL 68 -13.162 -16.943 6.755 525 HG13 VAL 68 3HG1 VAL 68 -12.816 -16.284 8.354 526 HG21 VAL 68 1HG2 VAL 68 -11.872 -18.638 7.274 527 HG22 VAL 68 2HG2 VAL 68 -10.259 -18.540 6.568 528 HG23 VAL 68 3HG2 VAL 68 -10.472 -18.353 8.309 529 H HIS 69 H HIS 69 -9.858 -17.961 4.087 530 HA HIS 69 HA HIS 69 -12.438 -17.887 2.678 531 HB2 HIS 69 1HB HIS 69 -10.645 -17.333 1.196 532 HB3 HIS 69 2HB HIS 69 -9.677 -18.693 1.758 533 HD1 HIS 69 1HD HIS 69 -10.882 -21.131 1.212 534 HD2 HIS 69 2HD HIS 69 -11.980 -17.854 -1.094 535 HE1 HIS 69 1HE HIS 69 -11.920 -22.090 -0.869 536 HE2 HIS 69 2HE HIS 69 -12.499 -20.090 -2.286 537 H GLY 70 H GLY 70 -13.602 -19.740 2.315 538 HA2 GLY 70 1HA GLY 70 -12.879 -22.355 2.411 539 HA3 GLY 70 2HA GLY 70 -13.070 -21.936 4.107 540 H ASP 71 H ASP 71 -14.642 -22.873 1.252 541 HA ASP 71 HA ASP 71 -17.211 -21.883 1.535 542 HB2 ASP 71 1HB ASP 71 -16.745 -23.077 -0.444 543 HB3 ASP 71 2HB ASP 71 -16.171 -24.487 0.441 544 H GLY 72 H GLY 72 -15.541 -24.206 3.463 545 HA2 GLY 72 1HA GLY 72 -16.874 -24.245 5.715 546 HA3 GLY 72 2HA GLY 72 -18.028 -25.118 4.718 547 H HIS 73 H HIS 73 -14.553 -25.397 4.358 548 HA HIS 73 HA HIS 73 -14.556 -27.967 5.748 549 HB2 HIS 73 1HB HIS 73 -13.348 -27.801 3.002 550 HB3 HIS 73 2HB HIS 73 -13.793 -29.231 3.928 551 HD1 HIS 73 1HD HIS 73 -14.820 -27.635 1.035 552 HD2 HIS 73 2HD HIS 73 -16.884 -28.960 4.388 553 HE1 HIS 73 1HE HIS 73 -17.209 -27.894 0.295 554 HE2 HIS 73 2HE HIS 73 -18.454 -28.615 2.362 555 H ALA 74 H ALA 74 -12.983 -27.744 7.192 556 HA ALA 74 HA ALA 74 -10.983 -25.911 7.322 557 HB1 ALA 74 1HB ALA 74 -11.254 -28.672 8.392 558 HB2 ALA 74 2HB ALA 74 -9.696 -27.859 8.549 559 HB3 ALA 74 3HB ALA 74 -11.144 -27.133 9.246 560 H GLU 75 H GLU 75 -10.959 -28.920 5.498 561 HA GLU 75 HA GLU 75 -8.271 -29.099 4.849 562 HB2 GLU 75 1HB GLU 75 -9.010 -30.324 2.828 563 HB3 GLU 75 2HB GLU 75 -9.825 -30.867 4.288 564 HG2 GLU 75 1HG GLU 75 -11.804 -29.620 3.696 565 HG3 GLU 75 2HG GLU 75 -10.991 -28.949 2.284 566 H ASN 76 H ASN 76 -10.830 -27.228 3.271 567 HA ASN 76 HA ASN 76 -8.792 -25.940 1.589 568 HB2 ASN 76 1HB ASN 76 -11.763 -25.666 1.196 569 HB3 ASN 76 2HB ASN 76 -10.472 -25.436 0.020 570 HD21 ASN 76 1HD2 ASN 76 -12.904 -27.160 0.065 571 HD22 ASN 76 2HD2 ASN 76 -12.323 -28.751 -0.277 572 H LEU 77 H LEU 77 -9.265 -25.314 4.408 573 HA LEU 77 HA LEU 77 -10.397 -22.612 4.231 574 HB2 LEU 77 1HB LEU 77 -11.137 -24.319 5.989 575 HB3 LEU 77 2HB LEU 77 -9.577 -24.020 6.753 576 HG LEU 77 HG LEU 77 -10.435 -21.500 6.587 577 HD11 LEU 77 1HD1 LEU 77 -13.010 -22.270 7.445 578 HD12 LEU 77 2HD1 LEU 77 -12.730 -23.037 5.883 579 HD13 LEU 77 3HD1 LEU 77 -12.572 -21.288 6.047 580 HD21 LEU 77 1HD2 LEU 77 -9.735 -22.402 8.646 581 HD22 LEU 77 2HD2 LEU 77 -11.048 -23.580 8.670 582 HD23 LEU 77 3HD2 LEU 77 -11.395 -21.866 8.909 583 H VAL 78 H VAL 78 -9.171 -20.833 4.471 584 HA VAL 78 HA VAL 78 -6.432 -21.112 5.475 585 HB VAL 78 HB VAL 78 -7.132 -19.711 2.891 586 HG11 VAL 78 1HG1 VAL 78 -5.385 -18.561 4.176 587 HG12 VAL 78 2HG1 VAL 78 -4.458 -20.061 4.244 588 HG13 VAL 78 3HG1 VAL 78 -4.750 -19.272 2.693 589 HG21 VAL 78 1HG2 VAL 78 -5.125 -21.684 2.570 590 HG22 VAL 78 2HG2 VAL 78 -6.473 -22.426 3.432 591 HG23 VAL 78 3HG2 VAL 78 -6.745 -21.647 1.874 592 H GLN 79 H GLN 79 -5.856 -19.513 6.812 593 HA GLN 79 HA GLN 79 -7.611 -17.154 6.957 594 HB2 GLN 79 1HB GLN 79 -5.969 -18.524 9.087 595 HB3 GLN 79 2HB GLN 79 -6.745 -16.963 9.318 596 HG2 GLN 79 1HG GLN 79 -8.851 -17.857 9.364 597 HG3 GLN 79 2HG GLN 79 -8.396 -19.258 8.396 598 HE21 GLN 79 1HE2 GLN 79 -8.955 -20.920 9.648 599 HE22 GLN 79 2HE2 GLN 79 -8.396 -21.183 11.261 600 H TRP 80 H TRP 80 -6.775 -15.169 6.704 601 HA TRP 80 HA TRP 80 -3.944 -14.677 7.044 602 HB2 TRP 80 1HB TRP 80 -3.438 -14.040 4.829 603 HB3 TRP 80 2HB TRP 80 -4.301 -15.567 4.671 604 HD1 TRP 80 HD TRP 80 -4.577 -11.873 3.834 605 HE1 TRP 80 1HE TRP 80 -6.605 -11.511 2.291 606 HE3 TRP 80 3HE TRP 80 -6.663 -16.531 4.129 607 HZ2 TRP 80 2HZ TRP 80 -8.799 -13.003 1.327 608 HZ3 TRP 80 3HZ TRP 80 -8.727 -16.981 2.867 609 HH2 TRP 80 HH TRP 80 -9.771 -15.252 1.496 610 H GLU 81 H GLU 81 -3.598 -12.659 7.756 611 HA GLU 81 HA GLU 81 -5.888 -10.853 7.877 612 HB2 GLU 81 1HB GLU 81 -3.300 -11.078 9.365 613 HB3 GLU 81 2HB GLU 81 -4.152 -9.540 9.347 614 HG2 GLU 81 1HG GLU 81 -6.152 -10.678 10.241 615 HG3 GLU 81 2HG GLU 81 -5.220 -12.171 10.344 616 H MET 82 H MET 82 -6.077 -9.099 6.646 617 HA MET 82 HA MET 82 -3.762 -8.294 5.021 618 HB2 MET 82 1HB MET 82 -6.729 -8.109 4.570 619 HB3 MET 82 2HB MET 82 -5.606 -7.114 3.653 620 HG2 MET 82 1HG MET 82 -4.462 -9.183 2.910 621 HG3 MET 82 2HG MET 82 -5.712 -10.118 3.728 622 HE1 MET 82 1HE MET 82 -4.890 -7.988 0.428 623 HE2 MET 82 2HE MET 82 -6.488 -7.282 0.190 624 HE3 MET 82 3HE MET 82 -5.565 -6.904 1.645 625 H GLU 83 H GLU 83 -2.741 -6.835 6.337 626 HA GLU 83 HA GLU 83 -4.320 -4.584 7.366 627 HB2 GLU 83 1HB GLU 83 -3.009 -5.651 9.070 628 HB3 GLU 83 2HB GLU 83 -1.564 -5.595 8.070 629 HG2 GLU 83 1HG GLU 83 -1.250 -3.334 8.414 630 HG3 GLU 83 2HG GLU 83 -2.935 -3.063 8.856 631 H VAL 84 H VAL 84 -4.118 -2.594 6.548 632 HA VAL 84 HA VAL 84 -2.451 -2.206 4.222 633 HB VAL 84 HB VAL 84 -4.333 -0.298 5.617 634 HG11 VAL 84 1HG1 VAL 84 -4.170 1.071 3.618 635 HG12 VAL 84 2HG1 VAL 84 -2.576 0.859 4.346 636 HG13 VAL 84 3HG1 VAL 84 -3.022 -0.065 2.910 637 HG21 VAL 84 1HG2 VAL 84 -5.917 -1.558 4.682 638 HG22 VAL 84 2HG2 VAL 84 -5.354 -0.948 3.126 639 HG23 VAL 84 3HG2 VAL 84 -4.739 -2.479 3.748 640 H CYS 85 H CYS 85 -0.341 -1.905 4.635 641 HA CYS 85 HA CYS 85 0.380 0.140 6.631 642 HB2 CYS 85 1HB CYS 85 1.624 -2.490 5.953 643 HB3 CYS 85 2HB CYS 85 2.673 -1.178 6.476 644 HG CYS 85 HG CYS 85 0.298 -1.156 8.624 645 H LYS 86 H LYS 86 2.802 0.864 6.104 646 HA LYS 86 HA LYS 86 2.867 1.569 3.243 647 HB2 LYS 86 1HB LYS 86 2.265 3.522 4.544 648 HB3 LYS 86 2HB LYS 86 3.625 3.263 5.629 649 HG2 LYS 86 1HG LYS 86 5.186 3.915 4.016 650 HG3 LYS 86 2HG LYS 86 4.027 3.740 2.697 651 HD2 LYS 86 1HD LYS 86 2.796 5.661 3.450 652 HD3 LYS 86 2HD LYS 86 3.786 5.779 4.907 653 HE2 LYS 86 1HE LYS 86 4.875 6.034 2.109 654 HE3 LYS 86 2HE LYS 86 4.371 7.407 3.093 655 HZ1 LYS 86 1HZ LYS 86 6.329 7.387 4.091 656 HZ2 LYS 86 2HZ LYS 86 6.834 6.109 3.105 657 HZ3 LYS 86 3HZ LYS 86 6.106 5.788 4.597 658 H LEU 87 H LEU 87 4.587 0.817 2.211 659 HA LEU 87 HA LEU 87 6.710 -0.514 3.501 660 HB2 LEU 87 1HB LEU 87 6.303 0.467 0.694 661 HB3 LEU 87 2HB LEU 87 7.790 -0.340 1.188 662 HG LEU 87 HG LEU 87 6.289 -1.886 0.064 663 HD11 LEU 87 1HD1 LEU 87 7.565 -2.296 2.475 664 HD12 LEU 87 2HD1 LEU 87 6.943 -3.545 1.397 665 HD13 LEU 87 3HD1 LEU 87 5.955 -2.966 2.738 666 HD21 LEU 87 1HD2 LEU 87 4.349 -1.345 2.308 667 HD22 LEU 87 2HD2 LEU 87 4.133 -2.471 0.968 668 HD23 LEU 87 3HD2 LEU 87 4.183 -0.734 0.662 669 HA PRO 88 HA PRO 88 9.380 2.821 4.586 670 HB2 PRO 88 1HB PRO 88 11.699 1.426 4.804 671 HB3 PRO 88 2HB PRO 88 10.405 1.332 6.005 672 HG2 PRO 88 1HG PRO 88 11.056 -0.551 3.771 673 HG3 PRO 88 2HG PRO 88 10.603 -0.916 5.446 674 HD2 PRO 88 1HD PRO 88 8.841 -1.064 3.394 675 HD3 PRO 88 2HD PRO 88 8.356 -0.602 5.039 676 H ARG 89 H ARG 89 10.634 0.543 2.144 677 HA ARG 89 HA ARG 89 12.234 2.644 0.936 678 HB2 ARG 89 1HB ARG 89 11.934 -0.308 0.443 679 HB3 ARG 89 2HB ARG 89 12.789 0.723 -0.696 680 HG2 ARG 89 1HG ARG 89 13.499 0.568 2.220 681 HG3 ARG 89 2HG ARG 89 14.212 -0.480 0.992 682 HD2 ARG 89 1HD ARG 89 14.228 2.478 0.594 683 HD3 ARG 89 2HD ARG 89 15.397 1.745 1.691 684 HE ARG 89 HE ARG 89 15.373 1.587 -1.180 685 HH11 ARG 89 2HH1 ARG 89 16.448 0.077 1.767 686 HH12 ARG 89 1HH1 ARG 89 17.772 -0.750 1.014 687 HH21 ARG 89 2HH2 ARG 89 17.113 0.504 -2.182 688 HH22 ARG 89 1HH2 ARG 89 18.150 -0.505 -1.232 689 H LEU 90 H LEU 90 9.787 0.331 -0.252 690 HA LEU 90 HA LEU 90 9.363 1.505 -2.733 691 HB2 LEU 90 1HB LEU 90 7.513 -0.065 -0.954 692 HB3 LEU 90 2HB LEU 90 7.087 0.420 -2.594 693 HG LEU 90 HG LEU 90 9.371 -0.841 -3.134 694 HD11 LEU 90 1HD1 LEU 90 9.240 -2.971 -1.669 695 HD12 LEU 90 2HD1 LEU 90 8.455 -1.912 -0.497 696 HD13 LEU 90 3HD1 LEU 90 10.089 -1.553 -1.054 697 HD21 LEU 90 1HD2 LEU 90 7.834 -2.967 -3.266 698 HD22 LEU 90 2HD2 LEU 90 7.546 -1.574 -4.308 699 HD23 LEU 90 3HD2 LEU 90 6.568 -1.808 -2.859 700 H SER 91 H SER 91 8.226 2.444 0.410 701 HA SER 91 HA SER 91 6.936 4.169 1.151 702 HB2 SER 91 1HB SER 91 8.115 5.311 -1.376 703 HB3 SER 91 2HB SER 91 7.059 6.266 -0.336 704 HG SER 91 HG SER 91 9.474 6.288 0.016 705 H LEU 92 H LEU 92 5.437 2.197 0.012 706 HA LEU 92 HA LEU 92 3.261 3.736 -1.225 707 HB2 LEU 92 1HB LEU 92 4.563 1.253 -2.190 708 HB3 LEU 92 2HB LEU 92 2.811 1.365 -2.352 709 HG LEU 92 HG LEU 92 4.499 3.598 -3.381 710 HD11 LEU 92 1HD1 LEU 92 4.369 0.841 -4.484 711 HD12 LEU 92 2HD1 LEU 92 5.691 2.006 -4.503 712 HD13 LEU 92 3HD1 LEU 92 4.330 2.201 -5.607 713 HD21 LEU 92 1HD2 LEU 92 2.552 3.137 -5.185 714 HD22 LEU 92 2HD2 LEU 92 2.362 4.192 -3.784 715 HD23 LEU 92 3HD2 LEU 92 1.774 2.529 -3.723 716 H ASN 93 H ASN 93 1.162 2.388 -1.161 717 HA ASN 93 HA ASN 93 0.830 1.492 1.587 718 HB2 ASN 93 1HB ASN 93 -1.429 1.605 -0.371 719 HB3 ASN 93 2HB ASN 93 -1.427 1.958 1.355 720 HD21 ASN 93 1HD2 ASN 93 -0.392 3.149 -1.787 721 HD22 ASN 93 2HD2 ASN 93 -0.393 4.823 -1.358 722 H GLY 94 H GLY 94 2.155 -0.128 -0.595 723 HA2 GLY 94 1HA GLY 94 0.867 -2.197 -1.673 724 HA3 GLY 94 2HA GLY 94 2.362 -2.442 -0.782 725 H VAL 95 H VAL 95 -0.185 -4.052 -1.133 726 HA VAL 95 HA VAL 95 -1.119 -4.235 1.627 727 HB VAL 95 HB VAL 95 -2.065 -5.955 -0.651 728 HG11 VAL 95 1HG1 VAL 95 -3.042 -5.227 2.068 729 HG12 VAL 95 2HG1 VAL 95 -4.219 -5.610 0.810 730 HG13 VAL 95 3HG1 VAL 95 -2.998 -6.798 1.268 731 HG21 VAL 95 1HG2 VAL 95 -3.898 -4.242 -0.914 732 HG22 VAL 95 2HG2 VAL 95 -2.893 -3.141 0.028 733 HG23 VAL 95 3HG2 VAL 95 -2.312 -3.760 -1.517 734 H ARG 96 H ARG 96 -0.006 -5.477 2.976 735 HA ARG 96 HA ARG 96 1.619 -7.666 1.974 736 HB2 ARG 96 1HB ARG 96 1.407 -6.159 4.531 737 HB3 ARG 96 2HB ARG 96 2.003 -7.811 4.614 738 HG2 ARG 96 1HG ARG 96 3.680 -7.158 2.839 739 HG3 ARG 96 2HG ARG 96 3.185 -5.488 3.124 740 HD2 ARG 96 1HD ARG 96 3.964 -7.196 5.442 741 HD3 ARG 96 2HD ARG 96 5.224 -6.525 4.407 742 HE ARG 96 HE ARG 96 3.780 -4.350 4.952 743 HH11 ARG 96 2HH1 ARG 96 4.968 -6.884 7.023 744 HH12 ARG 96 1HH1 ARG 96 5.118 -5.858 8.411 745 HH21 ARG 96 2HH2 ARG 96 3.972 -2.989 6.773 746 HH22 ARG 96 1HH2 ARG 96 4.550 -3.643 8.268 747 H PHE 97 H PHE 97 1.356 -9.821 2.492 748 HA PHE 97 HA PHE 97 -1.255 -10.528 3.661 749 HB2 PHE 97 1HB PHE 97 0.324 -11.801 1.434 750 HB3 PHE 97 2HB PHE 97 -0.940 -12.679 2.289 751 HD1 PHE 97 1HD PHE 97 -0.512 -9.301 0.753 752 HD2 PHE 97 2HD PHE 97 -2.966 -12.745 1.233 753 HE1 PHE 97 1HE PHE 97 -2.202 -8.299 -0.728 754 HE2 PHE 97 2HE PHE 97 -4.659 -11.749 -0.248 755 HZ PHE 97 HZ PHE 97 -4.278 -9.524 -1.232 756 H LYS 98 H LYS 98 -1.173 -11.553 5.538 757 HA LYS 98 HA LYS 98 1.296 -12.997 6.247 758 HB2 LYS 98 1HB LYS 98 0.699 -10.985 7.634 759 HB3 LYS 98 2HB LYS 98 -0.747 -11.842 8.150 760 HG2 LYS 98 1HG LYS 98 1.859 -13.212 8.496 761 HG3 LYS 98 2HG LYS 98 1.487 -11.859 9.566 762 HD2 LYS 98 1HD LYS 98 -0.830 -13.167 9.743 763 HD3 LYS 98 2HD LYS 98 0.221 -14.534 9.365 764 HE2 LYS 98 1HE LYS 98 0.442 -14.553 11.625 765 HE3 LYS 98 2HE LYS 98 1.714 -13.391 11.249 766 HZ1 LYS 98 1HZ LYS 98 0.598 -11.748 12.234 767 HZ2 LYS 98 2HZ LYS 98 -0.325 -12.962 12.964 768 HZ3 LYS 98 3HZ LYS 98 -0.887 -12.201 11.562 769 H ARG 99 H ARG 99 1.134 -15.130 6.329 770 HA ARG 99 HA ARG 99 -1.379 -16.465 6.118 771 HB2 ARG 99 1HB ARG 99 0.750 -17.302 5.118 772 HB3 ARG 99 2HB ARG 99 1.328 -17.655 6.741 773 HG2 ARG 99 1HG ARG 99 -0.065 -19.449 6.999 774 HG3 ARG 99 2HG ARG 99 -1.271 -18.812 5.879 775 HD2 ARG 99 1HD ARG 99 -0.360 -20.534 4.648 776 HD3 ARG 99 2HD ARG 99 0.602 -19.160 4.102 777 HE ARG 99 HE ARG 99 2.448 -20.107 5.074 778 HH11 ARG 99 2HH1 ARG 99 -0.416 -21.688 6.265 779 HH12 ARG 99 1HH1 ARG 99 0.458 -22.939 7.085 780 HH21 ARG 99 2HH2 ARG 99 3.610 -21.749 6.149 781 HH22 ARG 99 1HH2 ARG 99 2.748 -22.972 7.019 782 H ILE 100 H ILE 100 -2.688 -17.144 7.681 783 HA ILE 100 HA ILE 100 -1.757 -16.974 10.454 784 HB ILE 100 HB ILE 100 -4.509 -17.016 9.238 785 HG12 ILE 100 1HG1 ILE 100 -3.205 -14.873 9.376 786 HG13 ILE 100 2HG1 ILE 100 -4.735 -14.849 10.246 787 HG21 ILE 100 1HG2 ILE 100 -3.689 -17.490 12.083 788 HG22 ILE 100 2HG2 ILE 100 -5.258 -16.795 11.681 789 HG23 ILE 100 3HG2 ILE 100 -4.829 -18.400 11.091 790 HD11 ILE 100 1HD1 ILE 100 -3.163 -13.787 11.633 791 HD12 ILE 100 2HD1 ILE 100 -3.412 -15.391 12.323 792 HD13 ILE 100 3HD1 ILE 100 -1.964 -15.055 11.375 793 H SER 101 H SER 101 -3.625 -19.153 8.347 794 HA SER 101 HA SER 101 -2.354 -21.485 9.303 795 HB2 SER 101 1HB SER 101 -4.976 -20.737 10.564 796 HB3 SER 101 2HB SER 101 -4.542 -22.433 10.350 797 HG SER 101 HG SER 101 -2.429 -21.468 11.382 798 H GLY 102 H GLY 102 -3.115 -23.408 8.269 799 HA2 GLY 102 1HA GLY 102 -5.037 -24.282 6.859 800 HA3 GLY 102 2HA GLY 102 -4.800 -22.816 5.919 801 H THR 103 H THR 103 -3.843 -23.252 4.058 802 HA THR 103 HA THR 103 -1.514 -25.044 4.063 803 HB THR 103 HB THR 103 -2.243 -25.913 1.825 804 HG1 THR 103 1HG THR 103 -4.753 -24.784 2.575 805 HG21 THR 103 1HG2 THR 103 -3.257 -26.595 4.435 806 HG22 THR 103 2HG2 THR 103 -2.799 -27.654 3.102 807 HG23 THR 103 3HG2 THR 103 -4.435 -27.001 3.188 808 H SER 104 H SER 104 0.158 -24.434 2.762 809 HA SER 104 HA SER 104 0.395 -21.751 2.011 810 HB2 SER 104 1HB SER 104 2.343 -22.852 0.530 811 HB3 SER 104 2HB SER 104 2.476 -22.666 2.279 812 HG SER 104 HG SER 104 1.261 -24.982 1.311 813 H ILE 105 H ILE 105 -0.036 -24.629 -0.045 814 HA ILE 105 HA ILE 105 -0.077 -23.494 -2.527 815 HB ILE 105 HB ILE 105 -1.720 -25.752 -1.415 816 HG12 ILE 105 1HG1 ILE 105 0.636 -26.218 -1.640 817 HG13 ILE 105 2HG1 ILE 105 -0.219 -27.075 -2.918 818 HG21 ILE 105 1HG2 ILE 105 -2.390 -26.309 -3.704 819 HG22 ILE 105 2HG2 ILE 105 -3.034 -24.748 -3.198 820 HG23 ILE 105 3HG2 ILE 105 -1.644 -24.819 -4.281 821 HD11 ILE 105 1HD1 ILE 105 1.654 -26.184 -3.965 822 HD12 ILE 105 2HD1 ILE 105 0.358 -25.064 -4.386 823 HD13 ILE 105 3HD1 ILE 105 1.511 -24.643 -3.120 824 H ALA 106 H ALA 106 -3.023 -24.053 -0.587 825 HA ALA 106 HA ALA 106 -4.737 -22.561 -2.223 826 HB1 ALA 106 1HB ALA 106 -5.032 -24.134 0.007 827 HB2 ALA 106 2HB ALA 106 -5.473 -22.531 0.596 828 HB3 ALA 106 3HB ALA 106 -6.316 -23.224 -0.789 829 H PHE 107 H PHE 107 -2.639 -21.608 0.418 830 HA PHE 107 HA PHE 107 -3.691 -19.066 0.935 831 HB2 PHE 107 1HB PHE 107 -2.045 -20.141 2.398 832 HB3 PHE 107 2HB PHE 107 -0.823 -20.008 1.138 833 HD1 PHE 107 1HD PHE 107 -3.001 -18.026 3.380 834 HD2 PHE 107 2HD PHE 107 0.463 -18.067 0.906 835 HE1 PHE 107 1HE PHE 107 -2.365 -15.809 4.239 836 HE2 PHE 107 2HE PHE 107 1.105 -15.852 1.761 837 HZ PHE 107 HZ PHE 107 -0.309 -14.720 3.430 838 H LYS 108 H LYS 108 -1.232 -20.124 -1.384 839 HA LYS 108 HA LYS 108 -0.834 -17.455 -2.403 840 HB2 LYS 108 1HB LYS 108 0.189 -20.171 -3.213 841 HB3 LYS 108 2HB LYS 108 0.519 -18.731 -4.168 842 HG2 LYS 108 1HG LYS 108 1.653 -17.707 -2.289 843 HG3 LYS 108 2HG LYS 108 1.263 -19.097 -1.272 844 HD2 LYS 108 1HD LYS 108 2.480 -20.401 -3.234 845 HD3 LYS 108 2HD LYS 108 3.261 -18.834 -3.460 846 HE2 LYS 108 1HE LYS 108 3.098 -19.940 -0.705 847 HE3 LYS 108 2HE LYS 108 4.248 -20.668 -1.825 848 HZ1 LYS 108 1HZ LYS 108 5.366 -18.953 -0.661 849 HZ2 LYS 108 2HZ LYS 108 4.132 -17.835 -0.956 850 HZ3 LYS 108 3HZ LYS 108 5.104 -18.377 -2.230 851 H ASN 109 H ASN 109 -2.300 -20.462 -3.607 852 HA ASN 109 HA ASN 109 -3.061 -19.675 -6.125 853 HB2 ASN 109 1HB ASN 109 -4.213 -21.571 -4.127 854 HB3 ASN 109 2HB ASN 109 -5.165 -21.194 -5.560 855 HD21 ASN 109 1HD2 ASN 109 -2.476 -22.882 -4.293 856 HD22 ASN 109 2HD2 ASN 109 -1.978 -23.648 -5.759 857 H ILE 110 H ILE 110 -4.769 -19.101 -3.073 858 HA ILE 110 HA ILE 110 -6.931 -17.697 -4.337 859 HB ILE 110 HB ILE 110 -7.257 -18.909 -2.219 860 HG12 ILE 110 1HG1 ILE 110 -8.346 -16.927 -0.965 861 HG13 ILE 110 2HG1 ILE 110 -7.776 -15.946 -2.311 862 HG21 ILE 110 1HG2 ILE 110 -6.086 -18.540 -0.332 863 HG22 ILE 110 2HG2 ILE 110 -4.895 -17.859 -1.440 864 HG23 ILE 110 3HG2 ILE 110 -6.017 -16.797 -0.590 865 HD11 ILE 110 1HD1 ILE 110 -9.372 -16.694 -3.680 866 HD12 ILE 110 2HD1 ILE 110 -9.222 -18.357 -3.110 867 HD13 ILE 110 3HD1 ILE 110 -10.180 -17.194 -2.194 868 H ALA 111 H ALA 111 -3.939 -16.826 -2.714 869 HA ALA 111 HA ALA 111 -4.392 -14.091 -2.361 870 HB1 ALA 111 1HB ALA 111 -1.746 -15.394 -2.982 871 HB2 ALA 111 2HB ALA 111 -2.011 -13.862 -2.150 872 HB3 ALA 111 3HB ALA 111 -2.502 -15.375 -1.389 873 H SER 112 H SER 112 -3.743 -15.921 -5.215 874 HA SER 112 HA SER 112 -2.739 -13.779 -6.809 875 HB2 SER 112 1HB SER 112 -2.181 -15.922 -7.600 876 HB3 SER 112 2HB SER 112 -3.832 -16.516 -7.426 877 HG SER 112 HG SER 112 -3.477 -14.375 -9.151 878 H LYS 113 H LYS 113 -5.925 -15.307 -6.467 879 HA LYS 113 HA LYS 113 -7.302 -13.847 -8.392 880 HB2 LYS 113 1HB LYS 113 -8.297 -14.939 -5.754 881 HB3 LYS 113 2HB LYS 113 -9.337 -14.359 -7.048 882 HG2 LYS 113 1HG LYS 113 -8.765 -16.131 -8.461 883 HG3 LYS 113 2HG LYS 113 -7.345 -16.553 -7.500 884 HD2 LYS 113 1HD LYS 113 -8.595 -17.605 -5.874 885 HD3 LYS 113 2HD LYS 113 -10.050 -16.677 -6.243 886 HE2 LYS 113 1HE LYS 113 -10.396 -18.926 -6.979 887 HE3 LYS 113 2HE LYS 113 -10.200 -17.909 -8.405 888 HZ1 LYS 113 1HZ LYS 113 -8.245 -19.796 -7.232 889 HZ2 LYS 113 2HZ LYS 113 -7.794 -18.615 -8.355 890 HZ3 LYS 113 3HZ LYS 113 -8.909 -19.812 -8.788 891 H ILE 114 H ILE 114 -7.259 -13.203 -4.880 892 HA ILE 114 HA ILE 114 -8.620 -10.861 -4.762 893 HB ILE 114 HB ILE 114 -6.059 -11.434 -3.267 894 HG12 ILE 114 1HG1 ILE 114 -7.793 -13.199 -3.050 895 HG13 ILE 114 2HG1 ILE 114 -7.481 -12.364 -1.532 896 HG21 ILE 114 1HG2 ILE 114 -7.451 -9.972 -1.550 897 HG22 ILE 114 2HG2 ILE 114 -6.386 -9.241 -2.750 898 HG23 ILE 114 3HG2 ILE 114 -8.124 -9.315 -3.041 899 HD11 ILE 114 1HD1 ILE 114 -9.500 -11.094 -1.756 900 HD12 ILE 114 2HD1 ILE 114 -9.782 -11.751 -3.369 901 HD13 ILE 114 3HD1 ILE 114 -9.872 -12.805 -1.958 902 H ALA 115 H ALA 115 -5.121 -11.116 -5.391 903 HA ALA 115 HA ALA 115 -4.582 -8.416 -5.747 904 HB1 ALA 115 1HB ALA 115 -2.795 -9.458 -7.426 905 HB2 ALA 115 2HB ALA 115 -2.643 -9.591 -5.674 906 HB3 ALA 115 3HB ALA 115 -3.294 -10.939 -6.607 907 H ASN 116 H ASN 116 -5.135 -10.811 -8.339 908 HA ASN 116 HA ASN 116 -5.189 -9.113 -10.494 909 HB2 ASN 116 1HB ASN 116 -6.566 -11.705 -9.907 910 HB3 ASN 116 2HB ASN 116 -6.972 -10.836 -11.384 911 HD21 ASN 116 1HD2 ASN 116 -4.470 -12.501 -9.630 912 HD22 ASN 116 2HD2 ASN 116 -3.401 -12.722 -10.970 913 H GLU 117 H GLU 117 -8.029 -10.150 -8.600 914 HA GLU 117 HA GLU 117 -9.926 -8.578 -9.888 915 HB2 GLU 117 1HB GLU 117 -9.895 -9.314 -6.956 916 HB3 GLU 117 2HB GLU 117 -11.305 -8.861 -7.904 917 HG2 GLU 117 1HG GLU 117 -10.502 -10.916 -9.374 918 HG3 GLU 117 2HG GLU 117 -9.798 -11.408 -7.835 919 H LEU 118 H LEU 118 -7.898 -7.807 -7.083 920 HA LEU 118 HA LEU 118 -8.979 -5.179 -6.764 921 HB2 LEU 118 1HB LEU 118 -6.722 -6.721 -5.585 922 HB3 LEU 118 2HB LEU 118 -6.737 -4.969 -5.395 923 HG LEU 118 HG LEU 118 -9.134 -6.577 -4.607 924 HD11 LEU 118 1HD1 LEU 118 -6.921 -6.008 -2.672 925 HD12 LEU 118 2HD1 LEU 118 -6.951 -7.504 -3.604 926 HD13 LEU 118 3HD1 LEU 118 -8.283 -7.118 -2.516 927 HD21 LEU 118 1HD2 LEU 118 -9.736 -4.428 -4.295 928 HD22 LEU 118 2HD2 LEU 118 -8.068 -3.860 -4.202 929 HD23 LEU 118 3HD2 LEU 118 -8.827 -4.605 -2.794 930 H LYS 119 H LYS 119 -7.168 -6.409 -9.168 931 HA LYS 119 HA LYS 119 -5.883 -5.525 -10.822 932 HB2 LYS 119 1HB LYS 119 -7.016 -2.993 -9.641 933 HB3 LYS 119 2HB LYS 119 -5.964 -2.986 -11.050 934 HG2 LYS 119 1HG LYS 119 -8.547 -4.521 -10.896 935 HG3 LYS 119 2HG LYS 119 -8.400 -2.893 -11.563 936 HD2 LYS 119 1HD LYS 119 -6.773 -3.737 -13.207 937 HD3 LYS 119 2HD LYS 119 -6.978 -5.365 -12.555 938 HE2 LYS 119 1HE LYS 119 -8.331 -5.156 -14.523 939 HE3 LYS 119 2HE LYS 119 -9.394 -5.222 -13.118 940 HZ1 LYS 119 1HZ LYS 119 -9.251 -2.661 -13.263 941 HZ2 LYS 119 2HZ LYS 119 -10.273 -3.491 -14.323 942 HZ3 LYS 119 3HZ LYS 119 -8.769 -2.936 -14.861 943 H LEU 120 H LEU 120 -4.700 -6.120 -8.236 944 HA LEU 120 HA LEU 120 -2.700 -4.079 -7.780 945 HB2 LEU 120 1HB LEU 120 -2.947 -6.847 -6.613 946 HB3 LEU 120 2HB LEU 120 -1.862 -5.577 -6.052 947 HG LEU 120 HG LEU 120 -4.856 -5.279 -6.013 948 HD11 LEU 120 1HD1 LEU 120 -4.887 -6.882 -4.458 949 HD12 LEU 120 2HD1 LEU 120 -4.101 -5.697 -3.416 950 HD13 LEU 120 3HD1 LEU 120 -3.132 -6.883 -4.289 951 HD21 LEU 120 1HD2 LEU 120 -2.730 -3.512 -5.558 952 HD22 LEU 120 2HD2 LEU 120 -3.368 -3.919 -3.965 953 HD23 LEU 120 3HD2 LEU 120 -4.438 -3.255 -5.201 954 H SER 121 H SER 121 -0.362 -5.075 -7.450 955 HA SER 121 HA SER 121 0.842 -5.393 -9.850 956 HB2 SER 121 1HB SER 121 2.006 -5.135 -7.646 957 HB3 SER 121 2HB SER 121 1.746 -6.856 -7.359 958 HG SER 121 HG SER 121 2.819 -6.572 -9.772 959 H GLY 122 H GLY 122 0.017 -8.152 -7.734 960 HA2 GLY 122 1HA GLY 122 -0.669 -10.284 -8.272 961 HA3 GLY 122 2HA GLY 122 -0.932 -9.726 -9.917 962 HA PRO 123 HA PRO 123 3.734 -10.943 -9.761 963 HB2 PRO 123 1HB PRO 123 4.665 -12.010 -7.445 964 HB3 PRO 123 2HB PRO 123 4.689 -10.275 -7.781 965 HG2 PRO 123 1HG PRO 123 2.742 -11.862 -6.154 966 HG3 PRO 123 2HG PRO 123 3.474 -10.286 -5.799 967 HD2 PRO 123 1HD PRO 123 0.960 -10.538 -6.771 968 HD3 PRO 123 2HD PRO 123 2.000 -9.153 -7.161 969 H SER 124 H SER 124 3.784 -12.713 -10.987 970 HA SER 124 HA SER 124 3.110 -15.296 -9.766 971 HB2 SER 124 1HB SER 124 1.162 -14.544 -11.098 972 HB3 SER 124 2HB SER 124 2.199 -14.420 -12.519 973 HG SER 124 HG SER 124 2.674 -16.752 -11.980 974 H SER 125 H SER 125 4.728 -16.679 -9.985 975 HA SER 125 HA SER 125 7.160 -16.295 -11.039 976 HB2 SER 125 1HB SER 125 5.657 -18.920 -11.179 977 HB3 SER 125 2HB SER 125 7.408 -18.735 -11.267 978 HG SER 125 HG SER 125 6.449 -19.260 -9.141 979 H GLY 126 H GLY 126 4.419 -17.634 -12.869 980 HA2 GLY 126 1HA GLY 126 5.322 -16.414 -15.295 981 HA3 GLY 126 2HA GLY 126 5.621 -18.146 -15.286 Start of MODEL 3 1 H1 MET 1 H MET 1 12.017 28.995 24.149 2 HA MET 1 HA MET 1 10.508 28.952 21.716 3 HB2 MET 1 1HB MET 1 13.324 29.842 22.347 4 HB3 MET 1 2HB MET 1 12.597 29.990 20.752 5 HG2 MET 1 1HG MET 1 12.198 32.070 21.591 6 HG3 MET 1 2HG MET 1 10.713 31.244 22.059 7 HE1 MET 1 1HE MET 1 13.979 32.574 22.771 8 HE2 MET 1 2HE MET 1 13.516 33.610 24.121 9 HE3 MET 1 3HE MET 1 14.392 32.108 24.421 10 H LYS 2 H LYS 2 10.641 26.382 22.289 11 HA LYS 2 HA LYS 2 12.845 25.253 20.703 12 HB2 LYS 2 1HB LYS 2 11.182 24.231 22.950 13 HB3 LYS 2 2HB LYS 2 11.724 23.066 21.750 14 HG2 LYS 2 1HG LYS 2 13.402 22.960 23.318 15 HG3 LYS 2 2HG LYS 2 14.061 24.116 22.158 16 HD2 LYS 2 1HD LYS 2 14.448 25.065 24.280 17 HD3 LYS 2 2HD LYS 2 13.055 25.931 23.627 18 HE2 LYS 2 1HE LYS 2 11.548 24.709 24.993 19 HE3 LYS 2 2HE LYS 2 12.796 23.552 25.452 20 HZ1 LYS 2 1HZ LYS 2 13.894 25.195 26.740 21 HZ2 LYS 2 2HZ LYS 2 12.259 25.249 27.172 22 HZ3 LYS 2 3HZ LYS 2 12.904 26.433 26.149 23 H ASP 3 H ASP 3 12.418 24.676 18.687 24 HA ASP 3 HA ASP 3 9.701 23.764 18.019 25 HB2 ASP 3 1HB ASP 3 9.597 25.064 16.082 26 HB3 ASP 3 2HB ASP 3 10.337 26.157 17.248 27 H HIS 4 H HIS 4 9.730 22.682 15.763 28 HA HIS 4 HA HIS 4 12.166 21.429 14.944 29 HB2 HIS 4 1HB HIS 4 11.322 20.193 17.087 30 HB3 HIS 4 2HB HIS 4 10.133 19.489 15.994 31 HD1 HIS 4 1HD HIS 4 12.404 17.857 17.436 32 HD2 HIS 4 2HD HIS 4 12.530 19.243 13.521 33 HE1 HIS 4 1HE HIS 4 14.044 16.367 16.248 34 HE2 HIS 4 2HE HIS 4 14.168 17.278 13.903 35 H LEU 5 H LEU 5 11.956 21.366 12.815 36 HA LEU 5 HA LEU 5 9.431 20.423 11.660 37 HB2 LEU 5 1HB LEU 5 10.874 22.972 11.032 38 HB3 LEU 5 2HB LEU 5 9.864 22.182 9.823 39 HG LEU 5 HG LEU 5 8.067 22.300 11.759 40 HD11 LEU 5 1HD1 LEU 5 8.765 23.408 13.553 41 HD12 LEU 5 2HD1 LEU 5 8.761 24.865 12.560 42 HD13 LEU 5 3HD1 LEU 5 10.243 23.927 12.742 43 HD21 LEU 5 1HD2 LEU 5 8.905 24.501 9.889 44 HD22 LEU 5 2HD2 LEU 5 7.424 24.572 10.845 45 HD23 LEU 5 3HD2 LEU 5 7.647 23.287 9.656 46 H ILE 6 H ILE 6 9.812 18.771 10.353 47 HA ILE 6 HA ILE 6 12.500 18.431 9.235 48 HB ILE 6 HB ILE 6 10.231 16.446 9.435 49 HG12 ILE 6 1HG1 ILE 6 12.838 16.441 10.954 50 HG13 ILE 6 2HG1 ILE 6 11.380 17.200 11.584 51 HG21 ILE 6 1HG2 ILE 6 12.391 14.931 9.015 52 HG22 ILE 6 2HG2 ILE 6 11.380 15.542 7.706 53 HG23 ILE 6 3HG2 ILE 6 12.879 16.372 8.122 54 HD11 ILE 6 1HD1 ILE 6 12.103 14.652 12.068 55 HD12 ILE 6 2HD1 ILE 6 10.438 15.235 12.110 56 HD13 ILE 6 3HD1 ILE 6 11.055 14.431 10.667 57 H HIS 7 H HIS 7 12.649 19.472 7.334 58 HA HIS 7 HA HIS 7 10.720 18.737 5.246 59 HB2 HIS 7 1HB HIS 7 11.097 21.147 4.369 60 HB3 HIS 7 2HB HIS 7 9.975 20.902 5.704 61 HD1 HIS 7 1HD HIS 7 13.752 21.150 5.933 62 HD2 HIS 7 2HD HIS 7 10.340 23.214 7.101 63 HE1 HIS 7 1HE HIS 7 14.566 23.010 7.417 64 HE2 HIS 7 2HE HIS 7 12.477 24.193 8.180 65 H ASN 8 H ASN 8 12.348 17.220 4.600 66 HA ASN 8 HA ASN 8 14.273 18.404 2.781 67 HB2 ASN 8 1HB ASN 8 15.378 18.087 5.083 68 HB3 ASN 8 2HB ASN 8 15.278 16.360 4.753 69 HD21 ASN 8 1HD2 ASN 8 16.874 19.314 4.045 70 HD22 ASN 8 2HD2 ASN 8 18.086 18.664 3.000 71 H VAL 9 H VAL 9 14.376 17.262 0.953 72 HA VAL 9 HA VAL 9 14.001 14.392 0.944 73 HB VAL 9 HB VAL 9 12.211 14.535 -0.828 74 HG11 VAL 9 1HG1 VAL 9 11.514 15.507 1.941 75 HG12 VAL 9 2HG1 VAL 9 10.384 14.790 0.791 76 HG13 VAL 9 3HG1 VAL 9 11.710 13.827 1.444 77 HG21 VAL 9 1HG2 VAL 9 11.081 17.010 0.067 78 HG22 VAL 9 2HG2 VAL 9 12.705 17.291 -0.562 79 HG23 VAL 9 3HG2 VAL 9 11.493 16.502 -1.571 80 H HIS 10 H HIS 10 15.485 13.618 -0.391 81 HA HIS 10 HA HIS 10 16.148 15.156 -2.813 82 HB2 HIS 10 1HB HIS 10 17.938 14.016 -0.726 83 HB3 HIS 10 2HB HIS 10 18.479 13.918 -2.400 84 HD1 HIS 10 1HD HIS 10 19.703 15.902 -3.227 85 HD2 HIS 10 2HD HIS 10 17.270 16.823 0.012 86 HE1 HIS 10 1HE HIS 10 20.175 18.314 -2.698 87 HE2 HIS 10 2HE HIS 10 18.755 18.825 -0.681 88 H LYS 11 H LYS 11 15.001 13.955 -4.259 89 HA LYS 11 HA LYS 11 15.881 11.172 -4.607 90 HB2 LYS 11 1HB LYS 11 13.627 10.472 -5.156 91 HB3 LYS 11 2HB LYS 11 13.642 11.198 -3.554 92 HG2 LYS 11 1HG LYS 11 12.407 12.997 -4.202 93 HG3 LYS 11 2HG LYS 11 13.002 12.949 -5.863 94 HD2 LYS 11 1HD LYS 11 11.318 10.695 -4.885 95 HD3 LYS 11 2HD LYS 11 10.535 12.230 -5.269 96 HE2 LYS 11 1HE LYS 11 12.439 10.960 -7.200 97 HE3 LYS 11 2HE LYS 11 10.762 10.426 -7.114 98 HZ1 LYS 11 1HZ LYS 11 10.566 12.054 -8.660 99 HZ2 LYS 11 2HZ LYS 11 11.858 12.964 -8.057 100 HZ3 LYS 11 3HZ LYS 11 10.356 13.009 -7.279 101 H GLU 12 H GLU 12 15.352 10.340 -6.828 102 HA GLU 12 HA GLU 12 15.078 12.381 -8.880 103 HB2 GLU 12 1HB GLU 12 17.588 10.826 -8.382 104 HB3 GLU 12 2HB GLU 12 17.155 11.266 -10.028 105 HG2 GLU 12 1HG GLU 12 17.252 13.579 -9.531 106 HG3 GLU 12 2HG GLU 12 17.359 13.269 -7.799 107 H GLU 13 H GLU 13 13.903 11.642 -10.528 108 HA GLU 13 HA GLU 13 13.859 8.760 -11.073 109 HB2 GLU 13 1HB GLU 13 11.483 8.663 -11.152 110 HB3 GLU 13 2HB GLU 13 11.906 9.431 -9.628 111 HG2 GLU 13 1HG GLU 13 11.536 11.644 -10.791 112 HG3 GLU 13 2HG GLU 13 10.823 10.720 -12.112 113 H HIS 14 H HIS 14 13.480 8.192 -13.207 114 HA HIS 14 HA HIS 14 13.312 10.423 -15.124 115 HB2 HIS 14 1HB HIS 14 15.040 7.949 -15.286 116 HB3 HIS 14 2HB HIS 14 14.785 9.059 -16.629 117 HD1 HIS 14 1HD HIS 14 16.919 10.288 -16.879 118 HD2 HIS 14 2HD HIS 14 15.781 9.951 -12.898 119 HE1 HIS 14 1HE HIS 14 18.609 11.624 -15.581 120 HE2 HIS 14 2HE HIS 14 17.949 11.334 -13.168 121 H ALA 15 H ALA 15 12.846 6.926 -14.694 122 HA ALA 15 HA ALA 15 10.291 7.038 -16.000 123 HB1 ALA 15 1HB ALA 15 10.725 5.772 -17.918 124 HB2 ALA 15 2HB ALA 15 12.036 6.951 -17.867 125 HB3 ALA 15 3HB ALA 15 12.324 5.291 -17.348 126 H HIS 16 H HIS 16 9.001 5.342 -15.433 127 HA HIS 16 HA HIS 16 10.260 3.162 -13.902 128 HB2 HIS 16 1HB HIS 16 7.593 4.462 -13.311 129 HB3 HIS 16 2HB HIS 16 8.340 3.156 -12.396 130 HD1 HIS 16 1HD HIS 16 10.844 3.907 -11.405 131 HD2 HIS 16 2HD HIS 16 8.066 6.885 -12.226 132 HE1 HIS 16 1HE HIS 16 11.604 5.915 -10.095 133 HE2 HIS 16 2HE HIS 16 9.861 7.677 -10.540 134 H ALA 17 H ALA 17 9.349 1.110 -14.090 135 HA ALA 17 HA ALA 17 7.083 0.728 -15.873 136 HB1 ALA 17 1HB ALA 17 9.445 0.765 -17.093 137 HB2 ALA 17 2HB ALA 17 9.451 -0.916 -16.558 138 HB3 ALA 17 3HB ALA 17 8.146 -0.323 -17.584 139 H HIS 18 H HIS 18 6.184 -1.393 -15.776 140 HA HIS 18 HA HIS 18 6.440 -2.601 -13.196 141 HB2 HIS 18 1HB HIS 18 4.914 -3.636 -15.592 142 HB3 HIS 18 2HB HIS 18 4.661 -4.077 -13.906 143 HD1 HIS 18 1HD HIS 18 2.985 -2.731 -12.646 144 HD2 HIS 18 2HD HIS 18 4.203 -0.851 -16.145 145 HE1 HIS 18 1HE HIS 18 1.508 -0.708 -12.871 146 HE2 HIS 18 2HE HIS 18 2.206 0.367 -15.039 147 H ASN 19 H ASN 19 8.528 -3.415 -13.032 148 HA ASN 19 HA ASN 19 9.152 -5.679 -14.812 149 HB2 ASN 19 1HB ASN 19 11.102 -3.975 -13.247 150 HB3 ASN 19 2HB ASN 19 11.511 -5.264 -14.375 151 HD21 ASN 19 1HD2 ASN 19 12.385 -2.562 -14.500 152 HD22 ASN 19 2HD2 ASN 19 11.783 -1.891 -15.974 153 H LYS 20 H LYS 20 7.458 -6.089 -12.669 154 HA LYS 20 HA LYS 20 8.851 -6.959 -10.337 155 HB2 LYS 20 1HB LYS 20 6.077 -7.699 -11.287 156 HB3 LYS 20 2HB LYS 20 6.709 -7.924 -9.662 157 HG2 LYS 20 1HG LYS 20 6.716 -5.185 -10.816 158 HG3 LYS 20 2HG LYS 20 5.185 -5.874 -10.271 159 HD2 LYS 20 1HD LYS 20 5.871 -5.985 -8.065 160 HD3 LYS 20 2HD LYS 20 7.584 -5.997 -8.492 161 HE2 LYS 20 1HE LYS 20 5.866 -3.603 -9.045 162 HE3 LYS 20 2HE LYS 20 6.575 -3.861 -7.452 163 HZ1 LYS 20 1HZ LYS 20 8.288 -2.742 -8.335 164 HZ2 LYS 20 2HZ LYS 20 7.843 -3.075 -9.933 165 HZ3 LYS 20 3HZ LYS 20 8.695 -4.228 -9.034 166 H ASP 21 H ASP 21 10.498 -8.235 -11.498 167 HA ASP 21 HA ASP 21 9.577 -11.004 -11.823 168 HB2 ASP 21 1HB ASP 21 9.905 -10.023 -14.069 169 HB3 ASP 21 2HB ASP 21 11.568 -9.631 -13.641 170 H TYR 22 H TYR 22 10.358 -11.314 -9.679 171 HA TYR 22 HA TYR 22 13.292 -11.525 -9.549 172 HB2 TYR 22 1HB TYR 22 12.764 -11.192 -6.961 173 HB3 TYR 22 2HB TYR 22 13.048 -9.826 -8.034 174 HD1 TYR 22 2HD TYR 22 10.902 -8.828 -9.169 175 HD2 TYR 22 1HD TYR 22 10.857 -11.214 -5.646 176 HE1 TYR 22 2HE TYR 22 8.703 -7.900 -8.575 177 HE2 TYR 22 1HE TYR 22 8.657 -10.295 -5.044 178 HH TYR 22 HH TYR 22 6.682 -9.241 -6.354 179 H ASP 23 H ASP 23 13.864 -12.965 -7.529 180 HA ASP 23 HA ASP 23 12.465 -15.483 -7.956 181 HB2 ASP 23 1HB ASP 23 15.093 -14.727 -6.710 182 HB3 ASP 23 2HB ASP 23 14.396 -16.321 -6.436 183 H ILE 24 H ILE 24 10.555 -15.218 -6.807 184 HA ILE 24 HA ILE 24 10.352 -14.236 -4.184 185 HB ILE 24 HB ILE 24 8.466 -16.346 -5.129 186 HG12 ILE 24 1HG1 ILE 24 8.702 -15.206 -7.177 187 HG13 ILE 24 2HG1 ILE 24 7.297 -14.460 -6.424 188 HG21 ILE 24 1HG2 ILE 24 8.203 -13.724 -3.674 189 HG22 ILE 24 2HG2 ILE 24 6.827 -14.693 -4.197 190 HG23 ILE 24 3HG2 ILE 24 7.971 -15.347 -3.026 191 HD11 ILE 24 1HD1 ILE 24 8.290 -12.524 -6.863 192 HD12 ILE 24 2HD1 ILE 24 9.382 -12.909 -5.533 193 HD13 ILE 24 3HD1 ILE 24 9.840 -13.298 -7.191 194 HA PRO 25 HA PRO 25 12.055 -17.543 -1.806 195 HB2 PRO 25 1HB PRO 25 10.997 -16.858 0.599 196 HB3 PRO 25 2HB PRO 25 12.342 -15.984 -0.143 197 HG2 PRO 25 1HG PRO 25 9.429 -15.297 -0.103 198 HG3 PRO 25 2HG PRO 25 10.831 -14.239 0.140 199 HD2 PRO 25 1HD PRO 25 9.494 -14.369 -2.211 200 HD3 PRO 25 2HD PRO 25 11.238 -14.049 -2.121 201 H THR 26 H THR 26 11.276 -19.195 -0.165 202 HA THR 26 HA THR 26 8.684 -20.234 -1.063 203 HB THR 26 HB THR 26 9.420 -22.404 -0.213 204 HG1 THR 26 1HG THR 26 11.185 -22.613 0.989 205 HG21 THR 26 1HG2 THR 26 10.729 -20.927 -2.313 206 HG22 THR 26 2HG2 THR 26 10.265 -22.628 -2.264 207 HG23 THR 26 3HG2 THR 26 11.825 -22.120 -1.619 208 H THR 27 H THR 27 8.779 -18.119 0.866 209 HA THR 27 HA THR 27 7.972 -19.481 3.344 210 HB THR 27 HB THR 27 8.010 -17.054 4.250 211 HG1 THR 27 1HG THR 27 9.500 -15.728 3.056 212 HG21 THR 27 1HG2 THR 27 10.747 -17.967 3.491 213 HG22 THR 27 2HG2 THR 27 9.743 -19.025 4.482 214 HG23 THR 27 3HG2 THR 27 10.139 -17.402 5.047 215 H GLU 28 H GLU 28 6.301 -17.819 4.536 216 HA GLU 28 HA GLU 28 4.003 -17.726 2.711 217 HB2 GLU 28 1HB GLU 28 2.627 -17.731 4.771 218 HB3 GLU 28 2HB GLU 28 3.659 -19.147 4.636 219 HG2 GLU 28 1HG GLU 28 4.165 -18.692 6.763 220 HG3 GLU 28 2HG GLU 28 5.259 -17.502 6.059 221 H ASN 29 H ASN 29 5.073 -15.665 1.935 222 HA ASN 29 HA ASN 29 3.764 -13.435 3.237 223 HB2 ASN 29 1HB ASN 29 6.764 -13.626 2.984 224 HB3 ASN 29 2HB ASN 29 5.931 -12.082 3.139 225 HD21 ASN 29 1HD2 ASN 29 6.653 -15.117 4.709 226 HD22 ASN 29 2HD2 ASN 29 6.314 -14.586 6.318 227 H LEU 30 H LEU 30 2.715 -12.477 1.634 228 HA LEU 30 HA LEU 30 4.034 -12.283 -0.994 229 HB2 LEU 30 1HB LEU 30 1.210 -12.827 -0.215 230 HB3 LEU 30 2HB LEU 30 1.526 -11.971 -1.722 231 HG LEU 30 HG LEU 30 2.628 -14.696 -1.044 232 HD11 LEU 30 1HD1 LEU 30 0.534 -14.279 -3.107 233 HD12 LEU 30 2HD1 LEU 30 0.041 -14.303 -1.415 234 HD13 LEU 30 3HD1 LEU 30 0.877 -15.691 -2.109 235 HD21 LEU 30 1HD2 LEU 30 2.418 -13.824 -3.831 236 HD22 LEU 30 2HD2 LEU 30 3.737 -14.640 -2.990 237 HD23 LEU 30 3HD2 LEU 30 3.557 -12.889 -2.862 238 H TYR 31 H TYR 31 3.993 -10.338 -2.072 239 HA TYR 31 HA TYR 31 2.740 -8.064 -0.693 240 HB2 TYR 31 1HB TYR 31 5.454 -7.827 -1.971 241 HB3 TYR 31 2HB TYR 31 4.678 -6.733 -0.831 242 HD1 TYR 31 1HD TYR 31 3.865 -8.388 1.365 243 HD2 TYR 31 2HD TYR 31 7.380 -8.668 -1.016 244 HE1 TYR 31 1HE TYR 31 5.031 -9.494 3.227 245 HE2 TYR 31 2HE TYR 31 8.555 -9.776 0.839 246 HH TYR 31 HH TYR 31 7.161 -10.009 4.020 247 H PHE 32 H PHE 32 1.553 -6.831 -1.993 248 HA PHE 32 HA PHE 32 2.094 -6.907 -4.886 249 HB2 PHE 32 1HB PHE 32 -0.680 -6.700 -3.726 250 HB3 PHE 32 2HB PHE 32 -0.220 -7.039 -5.391 251 HD1 PHE 32 1HD PHE 32 0.009 -8.440 -1.955 252 HD2 PHE 32 2HD PHE 32 -0.111 -9.227 -6.137 253 HE1 PHE 32 1HE PHE 32 -0.126 -10.853 -1.494 254 HE2 PHE 32 2HE PHE 32 -0.248 -11.641 -5.682 255 HZ PHE 32 HZ PHE 32 -0.256 -12.457 -3.358 256 H GLN 33 H GLN 33 0.866 -5.054 -6.017 257 HA GLN 33 HA GLN 33 0.694 -2.653 -4.366 258 HB2 GLN 33 1HB GLN 33 2.516 -2.924 -6.761 259 HB3 GLN 33 2HB GLN 33 2.106 -1.394 -5.998 260 HG2 GLN 33 1HG GLN 33 3.321 -3.623 -4.416 261 HG3 GLN 33 2HG GLN 33 4.321 -2.537 -5.380 262 HE21 GLN 33 1HE2 GLN 33 2.048 -2.720 -2.719 263 HE22 GLN 33 2HE2 GLN 33 2.530 -1.247 -1.957 264 H GLY 34 H GLY 34 -0.744 -1.146 -5.108 265 HA2 GLY 34 1HA GLY 34 -1.642 -0.569 -7.589 266 HA3 GLY 34 2HA GLY 34 -2.542 -2.026 -7.195 267 H SER 35 H SER 35 -1.710 1.126 -5.755 268 HA SER 35 HA SER 35 -3.888 1.184 -3.970 269 HB2 SER 35 1HB SER 35 -3.384 3.593 -3.751 270 HB3 SER 35 2HB SER 35 -1.922 2.610 -3.664 271 HG SER 35 HG SER 35 -1.511 4.299 -5.045 272 H SER 36 H SER 36 -5.943 1.905 -4.149 273 HA SER 36 HA SER 36 -6.827 2.719 -6.836 274 HB2 SER 36 1HB SER 36 -8.053 1.044 -4.702 275 HB3 SER 36 2HB SER 36 -9.139 2.032 -5.679 276 HG SER 36 HG SER 36 -8.869 0.027 -6.657 277 H GLY 37 H GLY 37 -5.706 4.533 -4.861 278 HA2 GLY 37 1HA GLY 37 -6.680 6.861 -5.000 279 HA3 GLY 37 2HA GLY 37 -8.093 6.155 -4.229 280 H SER 38 H SER 38 -8.095 5.791 -2.042 281 HA SER 38 HA SER 38 -5.755 6.834 -0.588 282 HB2 SER 38 1HB SER 38 -8.639 6.777 0.331 283 HB3 SER 38 2HB SER 38 -7.282 7.512 1.185 284 HG SER 38 HG SER 38 -7.684 8.351 -1.427 285 H SER 39 H SER 39 -5.131 5.814 1.360 286 HA SER 39 HA SER 39 -5.051 3.040 1.306 287 HB2 SER 39 1HB SER 39 -4.842 4.529 3.906 288 HB3 SER 39 2HB SER 39 -3.902 3.150 3.337 289 HG SER 39 HG SER 39 -3.150 4.738 1.659 290 H GLY 40 H GLY 40 -7.431 5.183 2.671 291 HA2 GLY 40 1HA GLY 40 -8.686 3.326 4.408 292 HA3 GLY 40 2HA GLY 40 -9.410 4.797 3.774 293 H ASP 41 H ASP 41 -9.472 4.351 1.093 294 HA ASP 41 HA ASP 41 -11.779 2.954 0.658 295 HB2 ASP 41 1HB ASP 41 -9.499 3.229 -1.313 296 HB3 ASP 41 2HB ASP 41 -11.181 2.898 -1.715 297 H MET 42 H MET 42 -8.471 1.705 0.511 298 HA MET 42 HA MET 42 -8.771 -0.769 -0.545 299 HB2 MET 42 1HB MET 42 -7.073 0.298 1.651 300 HB3 MET 42 2HB MET 42 -7.130 -1.448 1.449 301 HG2 MET 42 1HG MET 42 -6.625 0.254 -0.936 302 HG3 MET 42 2HG MET 42 -5.327 0.007 0.230 303 HE1 MET 42 1HE MET 42 -6.783 -1.956 -3.119 304 HE2 MET 42 2HE MET 42 -5.851 -0.501 -2.762 305 HE3 MET 42 3HE MET 42 -5.020 -2.012 -3.138 306 H MET 43 H MET 43 -9.113 -0.156 2.958 307 HA MET 43 HA MET 43 -9.934 -2.514 3.909 308 HB2 MET 43 1HB MET 43 -11.504 -0.022 4.552 309 HB3 MET 43 2HB MET 43 -11.178 -1.393 5.604 310 HG2 MET 43 1HG MET 43 -8.673 -0.660 5.154 311 HG3 MET 43 2HG MET 43 -9.449 0.896 4.872 312 HE1 MET 43 1HE MET 43 -8.725 -1.980 7.046 313 HE2 MET 43 2HE MET 43 -8.797 -1.377 8.702 314 HE3 MET 43 3HE MET 43 -10.265 -1.949 7.907 315 H ARG 44 H ARG 44 -11.865 -0.404 1.869 316 HA ARG 44 HA ARG 44 -14.169 -2.170 2.038 317 HB2 ARG 44 1HB ARG 44 -13.654 0.458 0.664 318 HB3 ARG 44 2HB ARG 44 -15.103 -0.484 0.341 319 HG2 ARG 44 1HG ARG 44 -16.008 -0.058 2.385 320 HG3 ARG 44 2HG ARG 44 -14.435 0.100 3.171 321 HD2 ARG 44 1HD ARG 44 -15.077 2.290 3.161 322 HD3 ARG 44 2HD ARG 44 -14.261 2.216 1.600 323 HE ARG 44 HE ARG 44 -16.774 1.638 0.911 324 HH11 ARG 44 2HH1 ARG 44 -15.475 4.140 2.954 325 HH12 ARG 44 1HH1 ARG 44 -16.737 5.270 2.594 326 HH21 ARG 44 2HH2 ARG 44 -18.442 3.117 0.429 327 HH22 ARG 44 1HH2 ARG 44 -18.425 4.687 1.159 328 H GLU 45 H GLU 45 -12.262 -0.789 -0.647 329 HA GLU 45 HA GLU 45 -13.136 -2.236 -2.746 330 HB2 GLU 45 1HB GLU 45 -11.122 -0.556 -2.499 331 HB3 GLU 45 2HB GLU 45 -10.171 -2.032 -2.413 332 HG2 GLU 45 1HG GLU 45 -10.089 -1.581 -4.651 333 HG3 GLU 45 2HG GLU 45 -11.474 -2.668 -4.576 334 H ILE 46 H ILE 46 -11.038 -3.406 -0.181 335 HA ILE 46 HA ILE 46 -10.317 -5.863 -1.350 336 HB ILE 46 HB ILE 46 -10.570 -5.099 1.560 337 HG12 ILE 46 1HG1 ILE 46 -8.032 -5.494 -0.005 338 HG13 ILE 46 2HG1 ILE 46 -8.879 -3.951 -0.031 339 HG21 ILE 46 1HG2 ILE 46 -8.734 -7.222 1.173 340 HG22 ILE 46 2HG2 ILE 46 -10.229 -7.220 2.107 341 HG23 ILE 46 3HG2 ILE 46 -10.254 -7.674 0.403 342 HD11 ILE 46 1HD1 ILE 46 -8.759 -4.322 2.606 343 HD12 ILE 46 2HD1 ILE 46 -7.324 -5.227 2.123 344 HD13 ILE 46 3HD1 ILE 46 -7.483 -3.527 1.684 345 H ARG 47 H ARG 47 -12.621 -5.403 1.336 346 HA ARG 47 HA ARG 47 -13.792 -7.787 1.537 347 HB2 ARG 47 1HB ARG 47 -15.241 -5.138 1.404 348 HB3 ARG 47 2HB ARG 47 -15.967 -6.630 1.988 349 HG2 ARG 47 1HG ARG 47 -14.669 -6.668 3.902 350 HG3 ARG 47 2HG ARG 47 -13.438 -5.612 3.207 351 HD2 ARG 47 1HD ARG 47 -14.753 -3.701 3.489 352 HD3 ARG 47 2HD ARG 47 -16.233 -4.639 3.680 353 HE ARG 47 HE ARG 47 -14.834 -5.423 5.812 354 HH11 ARG 47 2HH1 ARG 47 -15.435 -2.251 4.510 355 HH12 ARG 47 1HH1 ARG 47 -15.360 -1.462 6.051 356 HH21 ARG 47 2HH2 ARG 47 -14.733 -4.396 7.846 357 HH22 ARG 47 1HH2 ARG 47 -14.959 -2.683 7.947 358 H LYS 48 H LYS 48 -14.380 -5.519 -1.100 359 HA LYS 48 HA LYS 48 -16.513 -6.602 -2.395 360 HB2 LYS 48 1HB LYS 48 -15.160 -4.611 -3.119 361 HB3 LYS 48 2HB LYS 48 -13.989 -5.728 -3.807 362 HG2 LYS 48 1HG LYS 48 -16.830 -5.995 -4.628 363 HG3 LYS 48 2HG LYS 48 -15.892 -4.644 -5.267 364 HD2 LYS 48 1HD LYS 48 -14.836 -7.450 -5.363 365 HD3 LYS 48 2HD LYS 48 -15.939 -6.847 -6.603 366 HE2 LYS 48 1HE LYS 48 -13.426 -5.384 -5.844 367 HE3 LYS 48 2HE LYS 48 -13.435 -6.657 -7.063 368 HZ1 LYS 48 1HZ LYS 48 -14.204 -3.953 -7.323 369 HZ2 LYS 48 2HZ LYS 48 -15.525 -4.946 -7.682 370 HZ3 LYS 48 3HZ LYS 48 -14.070 -5.138 -8.523 371 H VAL 49 H VAL 49 -13.131 -7.640 -2.837 372 HA VAL 49 HA VAL 49 -13.738 -9.794 -4.562 373 HB VAL 49 HB VAL 49 -11.328 -9.627 -2.756 374 HG11 VAL 49 1HG1 VAL 49 -10.446 -10.632 -5.084 375 HG12 VAL 49 2HG1 VAL 49 -11.051 -11.633 -3.764 376 HG13 VAL 49 3HG1 VAL 49 -12.107 -11.222 -5.116 377 HG21 VAL 49 1HG2 VAL 49 -11.803 -8.283 -5.413 378 HG22 VAL 49 2HG2 VAL 49 -11.526 -7.495 -3.860 379 HG23 VAL 49 3HG2 VAL 49 -10.231 -8.417 -4.624 380 H LEU 50 H LEU 50 -13.243 -9.603 -1.060 381 HA LEU 50 HA LEU 50 -13.287 -12.312 -0.450 382 HB2 LEU 50 1HB LEU 50 -14.514 -10.121 1.213 383 HB3 LEU 50 2HB LEU 50 -13.908 -11.675 1.781 384 HG LEU 50 HG LEU 50 -12.186 -9.503 0.593 385 HD11 LEU 50 1HD1 LEU 50 -11.911 -10.148 3.434 386 HD12 LEU 50 2HD1 LEU 50 -13.433 -9.366 3.008 387 HD13 LEU 50 3HD1 LEU 50 -11.901 -8.586 2.615 388 HD21 LEU 50 1HD2 LEU 50 -11.564 -12.062 0.603 389 HD22 LEU 50 2HD2 LEU 50 -11.181 -11.730 2.293 390 HD23 LEU 50 3HD2 LEU 50 -10.370 -10.829 1.011 391 H GLY 51 H GLY 51 -16.058 -10.063 -0.242 392 HA2 GLY 51 1HA GLY 51 -18.039 -11.922 0.264 393 HA3 GLY 51 2HA GLY 51 -18.302 -10.411 -0.593 394 H ALA 52 H ALA 52 -16.643 -11.006 -2.843 395 HA ALA 52 HA ALA 52 -18.503 -12.314 -4.494 396 HB1 ALA 52 1HB ALA 52 -15.598 -11.655 -4.948 397 HB2 ALA 52 2HB ALA 52 -16.684 -12.264 -6.198 398 HB3 ALA 52 3HB ALA 52 -17.002 -10.706 -5.436 399 H ASN 53 H ASN 53 -15.498 -13.437 -2.995 400 HA ASN 53 HA ASN 53 -15.914 -16.113 -4.087 401 HB2 ASN 53 1HB ASN 53 -13.627 -14.698 -2.781 402 HB3 ASN 53 2HB ASN 53 -13.683 -16.456 -2.711 403 HD21 ASN 53 1HD2 ASN 53 -13.809 -13.724 -4.938 404 HD22 ASN 53 2HD2 ASN 53 -13.082 -14.548 -6.272 405 H ASN 54 H ASN 54 -17.831 -15.219 -2.217 406 HA ASN 54 HA ASN 54 -18.784 -15.685 -0.181 407 HB2 ASN 54 1HB ASN 54 -19.035 -17.776 -1.566 408 HB3 ASN 54 2HB ASN 54 -17.629 -18.424 -0.727 409 HD21 ASN 54 1HD2 ASN 54 -20.983 -17.797 -0.590 410 HD22 ASN 54 2HD2 ASN 54 -21.273 -18.455 0.981 411 H CYS 55 H CYS 55 -16.259 -14.538 0.172 412 HA CYS 55 HA CYS 55 -15.052 -16.089 2.350 413 HB2 CYS 55 1HB CYS 55 -14.055 -13.776 0.694 414 HB3 CYS 55 2HB CYS 55 -13.241 -14.288 2.168 415 HG CYS 55 HG CYS 55 -13.587 -16.054 -0.733 416 H ASP 56 H ASP 56 -14.573 -15.075 4.365 417 HA ASP 56 HA ASP 56 -16.403 -12.854 4.993 418 HB2 ASP 56 1HB ASP 56 -15.374 -15.053 6.799 419 HB3 ASP 56 2HB ASP 56 -16.415 -13.728 7.309 420 H TYR 57 H TYR 57 -15.704 -11.273 6.522 421 HA TYR 57 HA TYR 57 -12.814 -11.167 7.012 422 HB2 TYR 57 1HB TYR 57 -13.029 -8.642 6.465 423 HB3 TYR 57 2HB TYR 57 -12.899 -9.785 5.133 424 HD1 TYR 57 2HD TYR 57 -15.000 -10.463 3.910 425 HD2 TYR 57 1HD TYR 57 -14.909 -7.234 6.680 426 HE1 TYR 57 2HE TYR 57 -17.089 -9.588 2.950 427 HE2 TYR 57 1HE TYR 57 -16.998 -6.351 5.728 428 HH TYR 57 HH TYR 57 -18.898 -8.157 3.474 429 H GLU 58 H GLU 58 -12.227 -10.263 8.929 430 HA GLU 58 HA GLU 58 -14.368 -9.094 10.580 431 HB2 GLU 58 1HB GLU 58 -14.045 -11.307 11.422 432 HB3 GLU 58 2HB GLU 58 -12.296 -11.138 11.373 433 HG2 GLU 58 1HG GLU 58 -12.980 -10.977 13.640 434 HG3 GLU 58 2HG GLU 58 -12.485 -9.369 13.113 435 H GLN 59 H GLN 59 -13.831 -6.997 10.655 436 HA GLN 59 HA GLN 59 -11.181 -6.010 10.546 437 HB2 GLN 59 1HB GLN 59 -13.520 -4.864 10.075 438 HB3 GLN 59 2HB GLN 59 -13.369 -4.384 11.760 439 HG2 GLN 59 1HG GLN 59 -10.963 -3.640 10.943 440 HG3 GLN 59 2HG GLN 59 -11.800 -3.540 9.395 441 HE21 GLN 59 1HE2 GLN 59 -10.683 -1.529 11.374 442 HE22 GLN 59 2HE2 GLN 59 -11.969 -0.395 11.583 443 H ARG 60 H ARG 60 -9.692 -5.954 12.083 444 HA ARG 60 HA ARG 60 -10.538 -6.274 14.878 445 HB2 ARG 60 1HB ARG 60 -7.838 -6.734 13.595 446 HB3 ARG 60 2HB ARG 60 -8.208 -6.983 15.296 447 HG2 ARG 60 1HG ARG 60 -9.701 -8.424 13.133 448 HG3 ARG 60 2HG ARG 60 -8.172 -9.026 13.776 449 HD2 ARG 60 1HD ARG 60 -9.674 -10.124 15.122 450 HD3 ARG 60 2HD ARG 60 -9.353 -8.682 16.084 451 HE ARG 60 HE ARG 60 -11.493 -7.951 14.619 452 HH11 ARG 60 2HH1 ARG 60 -10.820 -10.738 16.593 453 HH12 ARG 60 1HH1 ARG 60 -12.475 -10.983 17.041 454 HH21 ARG 60 2HH2 ARG 60 -13.676 -8.263 15.201 455 HH22 ARG 60 1HH2 ARG 60 -14.099 -9.575 16.248 456 H GLU 61 H GLU 61 -7.960 -4.604 13.056 457 HA GLU 61 HA GLU 61 -7.955 -2.511 15.112 458 HB2 GLU 61 1HB GLU 61 -5.951 -3.302 13.003 459 HB3 GLU 61 2HB GLU 61 -5.819 -1.801 13.909 460 HG2 GLU 61 1HG GLU 61 -6.054 -4.436 15.308 461 HG3 GLU 61 2HG GLU 61 -4.502 -3.845 14.717 462 H ARG 62 H ARG 62 -7.062 -0.335 13.891 463 HA ARG 62 HA ARG 62 -9.325 0.688 12.565 464 HB2 ARG 62 1HB ARG 62 -7.998 2.232 13.766 465 HB3 ARG 62 2HB ARG 62 -6.527 1.727 12.946 466 HG2 ARG 62 1HG ARG 62 -6.980 2.959 11.072 467 HG3 ARG 62 2HG ARG 62 -8.725 2.911 11.331 468 HD2 ARG 62 1HD ARG 62 -8.336 5.072 11.928 469 HD3 ARG 62 2HD ARG 62 -8.060 4.301 13.489 470 HE ARG 62 HE ARG 62 -6.080 5.532 11.775 471 HH11 ARG 62 2HH1 ARG 62 -6.696 3.419 14.472 472 HH12 ARG 62 1HH1 ARG 62 -5.109 3.598 15.143 473 HH21 ARG 62 2HH2 ARG 62 -3.987 5.776 12.648 474 HH22 ARG 62 1HH2 ARG 62 -3.569 4.940 14.105 475 H PHE 63 H PHE 63 -6.063 -0.036 11.324 476 HA PHE 63 HA PHE 63 -7.202 -0.074 8.609 477 HB2 PHE 63 1HB PHE 63 -4.431 0.571 9.603 478 HB3 PHE 63 2HB PHE 63 -4.751 0.194 7.913 479 HD1 PHE 63 2HD PHE 63 -6.729 1.587 6.847 480 HD2 PHE 63 1HD PHE 63 -4.470 2.768 10.255 481 HE1 PHE 63 2HE PHE 63 -7.351 3.932 6.441 482 HE2 PHE 63 1HE PHE 63 -5.089 5.116 9.856 483 HZ PHE 63 HZ PHE 63 -6.530 5.701 7.946 484 H LEU 64 H LEU 64 -7.574 -2.311 10.172 485 HA LEU 64 HA LEU 64 -5.881 -4.256 8.775 486 HB2 LEU 64 1HB LEU 64 -5.159 -3.865 11.180 487 HB3 LEU 64 2HB LEU 64 -6.687 -4.607 11.650 488 HG LEU 64 HG LEU 64 -5.829 -6.584 10.151 489 HD11 LEU 64 1HD1 LEU 64 -3.434 -4.888 10.551 490 HD12 LEU 64 2HD1 LEU 64 -3.854 -5.965 9.220 491 HD13 LEU 64 3HD1 LEU 64 -3.237 -6.631 10.732 492 HD21 LEU 64 1HD2 LEU 64 -5.193 -5.855 12.963 493 HD22 LEU 64 2HD2 LEU 64 -4.438 -7.295 12.279 494 HD23 LEU 64 3HD2 LEU 64 -6.196 -7.161 12.331 495 H LEU 65 H LEU 65 -6.857 -6.302 8.425 496 HA LEU 65 HA LEU 65 -9.633 -6.670 9.175 497 HB2 LEU 65 1HB LEU 65 -8.728 -6.068 6.403 498 HB3 LEU 65 2HB LEU 65 -10.037 -7.226 6.632 499 HG LEU 65 HG LEU 65 -10.177 -4.486 7.845 500 HD11 LEU 65 1HD1 LEU 65 -10.094 -5.081 5.046 501 HD12 LEU 65 2HD1 LEU 65 -10.294 -3.526 5.852 502 HD13 LEU 65 3HD1 LEU 65 -11.706 -4.518 5.489 503 HD21 LEU 65 1HD2 LEU 65 -12.195 -6.562 7.008 504 HD22 LEU 65 2HD2 LEU 65 -12.617 -4.931 7.529 505 HD23 LEU 65 3HD2 LEU 65 -11.811 -6.033 8.646 506 H PHE 66 H PHE 66 -9.949 -8.737 9.661 507 HA PHE 66 HA PHE 66 -7.918 -10.688 9.005 508 HB2 PHE 66 1HB PHE 66 -9.052 -10.503 11.265 509 HB3 PHE 66 2HB PHE 66 -10.495 -11.165 10.503 510 HD1 PHE 66 1HD PHE 66 -9.987 -13.382 9.080 511 HD2 PHE 66 2HD PHE 66 -7.704 -11.972 12.383 512 HE1 PHE 66 1HE PHE 66 -9.146 -15.662 9.468 513 HE2 PHE 66 2HE PHE 66 -6.859 -14.248 12.776 514 HZ PHE 66 HZ PHE 66 -7.579 -16.097 11.317 515 H CYS 67 H CYS 67 -8.016 -11.332 6.920 516 HA CYS 67 HA CYS 67 -10.573 -11.931 5.682 517 HB2 CYS 67 1HB CYS 67 -7.734 -11.865 4.683 518 HB3 CYS 67 2HB CYS 67 -9.036 -12.535 3.708 519 HG CYS 67 HG CYS 67 -9.340 -9.385 4.949 520 H VAL 68 H VAL 68 -11.310 -13.936 5.130 521 HA VAL 68 HA VAL 68 -9.631 -16.270 5.600 522 HB VAL 68 HB VAL 68 -10.728 -15.840 7.773 523 HG11 VAL 68 1HG1 VAL 68 -13.300 -16.326 6.274 524 HG12 VAL 68 2HG1 VAL 68 -13.130 -16.076 8.013 525 HG13 VAL 68 3HG1 VAL 68 -12.759 -14.765 6.891 526 HG21 VAL 68 1HG2 VAL 68 -10.278 -18.176 6.691 527 HG22 VAL 68 2HG2 VAL 68 -11.194 -18.057 8.194 528 HG23 VAL 68 3HG2 VAL 68 -12.038 -18.281 6.661 529 H HIS 69 H HIS 69 -10.050 -17.885 4.206 530 HA HIS 69 HA HIS 69 -12.425 -17.600 2.488 531 HB2 HIS 69 1HB HIS 69 -10.454 -17.347 1.167 532 HB3 HIS 69 2HB HIS 69 -9.689 -18.742 1.921 533 HD1 HIS 69 1HD HIS 69 -9.605 -20.628 0.343 534 HD2 HIS 69 2HD HIS 69 -13.074 -18.391 -0.129 535 HE1 HIS 69 1HE HIS 69 -10.895 -21.767 -1.491 536 HE2 HIS 69 2HE HIS 69 -12.949 -20.347 -1.818 537 H GLY 70 H GLY 70 -13.700 -19.381 2.036 538 HA2 GLY 70 1HA GLY 70 -13.007 -21.920 3.335 539 HA3 GLY 70 2HA GLY 70 -14.524 -21.147 3.770 540 H ASP 71 H ASP 71 -13.879 -23.734 2.404 541 HA ASP 71 HA ASP 71 -15.651 -23.329 0.092 542 HB2 ASP 71 1HB ASP 71 -13.487 -23.625 -0.879 543 HB3 ASP 71 2HB ASP 71 -13.119 -24.970 0.196 544 H GLY 72 H GLY 72 -14.221 -25.775 2.254 545 HA2 GLY 72 1HA GLY 72 -16.839 -26.885 2.769 546 HA3 GLY 72 2HA GLY 72 -15.787 -27.939 1.836 547 H HIS 73 H HIS 73 -13.337 -27.284 3.078 548 HA HIS 73 HA HIS 73 -13.693 -27.869 5.908 549 HB2 HIS 73 1HB HIS 73 -12.661 -29.804 3.898 550 HB3 HIS 73 2HB HIS 73 -11.830 -29.732 5.449 551 HD1 HIS 73 1HD HIS 73 -12.819 -31.105 7.262 552 HD2 HIS 73 2HD HIS 73 -15.554 -30.324 4.234 553 HE1 HIS 73 1HE HIS 73 -14.874 -32.427 7.855 554 HE2 HIS 73 2HE HIS 73 -16.484 -32.006 5.965 555 H ALA 74 H ALA 74 -11.494 -27.999 7.015 556 HA ALA 74 HA ALA 74 -10.117 -25.655 6.785 557 HB1 ALA 74 1HB ALA 74 -9.640 -28.221 8.077 558 HB2 ALA 74 2HB ALA 74 -8.154 -27.361 7.671 559 HB3 ALA 74 3HB ALA 74 -9.377 -26.583 8.676 560 H GLU 75 H GLU 75 -9.277 -28.744 5.241 561 HA GLU 75 HA GLU 75 -6.904 -28.323 4.089 562 HB2 GLU 75 1HB GLU 75 -9.389 -29.456 2.816 563 HB3 GLU 75 2HB GLU 75 -7.830 -29.478 2.005 564 HG2 GLU 75 1HG GLU 75 -6.882 -30.831 3.749 565 HG3 GLU 75 2HG GLU 75 -8.363 -30.710 4.697 566 H ASN 76 H ASN 76 -9.943 -27.022 2.774 567 HA ASN 76 HA ASN 76 -8.472 -25.410 0.854 568 HB2 ASN 76 1HB ASN 76 -10.990 -24.621 0.453 569 HB3 ASN 76 2HB ASN 76 -10.365 -26.125 -0.217 570 HD21 ASN 76 1HD2 ASN 76 -11.111 -28.056 0.541 571 HD22 ASN 76 2HD2 ASN 76 -12.428 -28.197 1.650 572 H LEU 77 H LEU 77 -10.100 -25.072 3.904 573 HA LEU 77 HA LEU 77 -10.542 -22.298 3.897 574 HB2 LEU 77 1HB LEU 77 -11.261 -24.195 5.561 575 HB3 LEU 77 2HB LEU 77 -9.784 -23.729 6.402 576 HG LEU 77 HG LEU 77 -10.886 -21.316 6.176 577 HD11 LEU 77 1HD1 LEU 77 -12.950 -21.420 5.343 578 HD12 LEU 77 2HD1 LEU 77 -13.416 -22.144 6.882 579 HD13 LEU 77 3HD1 LEU 77 -13.018 -23.175 5.507 580 HD21 LEU 77 1HD2 LEU 77 -11.848 -21.686 8.439 581 HD22 LEU 77 2HD2 LEU 77 -10.193 -22.271 8.263 582 HD23 LEU 77 3HD2 LEU 77 -11.539 -23.411 8.242 583 H VAL 78 H VAL 78 -9.307 -20.566 4.481 584 HA VAL 78 HA VAL 78 -6.605 -20.984 5.482 585 HB VAL 78 HB VAL 78 -7.155 -19.586 2.862 586 HG11 VAL 78 1HG1 VAL 78 -4.587 -19.763 4.435 587 HG12 VAL 78 2HG1 VAL 78 -4.760 -19.079 2.817 588 HG13 VAL 78 3HG1 VAL 78 -5.557 -18.311 4.191 589 HG21 VAL 78 1HG2 VAL 78 -5.944 -22.182 3.633 590 HG22 VAL 78 2HG2 VAL 78 -6.915 -21.760 2.223 591 HG23 VAL 78 3HG2 VAL 78 -5.213 -21.305 2.289 592 H GLN 79 H GLN 79 -6.222 -19.545 7.024 593 HA GLN 79 HA GLN 79 -7.818 -17.079 7.071 594 HB2 GLN 79 1HB GLN 79 -6.386 -18.561 9.279 595 HB3 GLN 79 2HB GLN 79 -7.162 -16.997 9.492 596 HG2 GLN 79 1HG GLN 79 -9.275 -17.865 9.330 597 HG3 GLN 79 2HG GLN 79 -8.751 -19.249 8.372 598 HE21 GLN 79 1HE2 GLN 79 -9.684 -20.798 9.631 599 HE22 GLN 79 2HE2 GLN 79 -9.171 -21.155 11.242 600 H TRP 80 H TRP 80 -6.877 -15.157 6.818 601 HA TRP 80 HA TRP 80 -4.069 -14.779 7.446 602 HB2 TRP 80 1HB TRP 80 -3.366 -14.103 5.283 603 HB3 TRP 80 2HB TRP 80 -4.221 -15.626 5.051 604 HD1 TRP 80 HD TRP 80 -4.401 -11.933 4.193 605 HE1 TRP 80 1HE TRP 80 -6.294 -11.556 2.490 606 HE3 TRP 80 3HE TRP 80 -6.545 -16.572 4.325 607 HZ2 TRP 80 2HZ TRP 80 -8.416 -13.031 1.354 608 HZ3 TRP 80 3HZ TRP 80 -8.503 -17.007 2.900 609 HH2 TRP 80 HH TRP 80 -9.418 -15.272 1.446 610 H GLU 81 H GLU 81 -3.567 -12.686 7.953 611 HA GLU 81 HA GLU 81 -5.831 -10.854 8.149 612 HB2 GLU 81 1HB GLU 81 -3.075 -10.819 9.382 613 HB3 GLU 81 2HB GLU 81 -4.240 -9.518 9.579 614 HG2 GLU 81 1HG GLU 81 -5.823 -11.289 10.488 615 HG3 GLU 81 2HG GLU 81 -4.409 -12.337 10.582 616 H MET 82 H MET 82 -6.138 -9.348 6.661 617 HA MET 82 HA MET 82 -3.974 -8.634 4.850 618 HB2 MET 82 1HB MET 82 -6.937 -8.377 4.830 619 HB3 MET 82 2HB MET 82 -6.017 -7.190 3.915 620 HG2 MET 82 1HG MET 82 -5.510 -10.116 3.569 621 HG3 MET 82 2HG MET 82 -6.842 -9.320 2.734 622 HE1 MET 82 1HE MET 82 -5.416 -7.091 0.203 623 HE2 MET 82 2HE MET 82 -6.115 -8.694 -0.028 624 HE3 MET 82 3HE MET 82 -6.773 -7.614 1.202 625 H GLU 83 H GLU 83 -2.615 -7.187 5.750 626 HA GLU 83 HA GLU 83 -3.741 -4.879 7.164 627 HB2 GLU 83 1HB GLU 83 -2.006 -6.082 8.366 628 HB3 GLU 83 2HB GLU 83 -0.908 -5.919 7.002 629 HG2 GLU 83 1HG GLU 83 -0.645 -3.614 7.349 630 HG3 GLU 83 2HG GLU 83 -2.038 -3.534 8.426 631 H VAL 84 H VAL 84 -3.370 -2.784 6.525 632 HA VAL 84 HA VAL 84 -2.303 -2.465 3.800 633 HB VAL 84 HB VAL 84 -4.196 -0.644 5.293 634 HG11 VAL 84 1HG1 VAL 84 -3.933 -0.475 2.367 635 HG12 VAL 84 2HG1 VAL 84 -4.105 0.805 3.570 636 HG13 VAL 84 3HG1 VAL 84 -2.529 0.064 3.287 637 HG21 VAL 84 1HG2 VAL 84 -4.622 -2.985 3.555 638 HG22 VAL 84 2HG2 VAL 84 -5.656 -2.296 4.807 639 HG23 VAL 84 3HG2 VAL 84 -5.617 -1.574 3.198 640 H CYS 85 H CYS 85 -0.155 -2.088 4.189 641 HA CYS 85 HA CYS 85 0.984 -0.623 6.234 642 HB2 CYS 85 1HB CYS 85 2.024 -2.016 4.233 643 HB3 CYS 85 2HB CYS 85 2.181 -0.421 3.505 644 HG CYS 85 HG CYS 85 4.495 -0.091 4.560 645 H LYS 86 H LYS 86 2.313 1.483 5.730 646 HA LYS 86 HA LYS 86 0.609 3.420 4.328 647 HB2 LYS 86 1HB LYS 86 1.029 5.032 6.213 648 HB3 LYS 86 2HB LYS 86 -0.028 3.684 6.613 649 HG2 LYS 86 1HG LYS 86 1.551 2.674 7.964 650 HG3 LYS 86 2HG LYS 86 2.898 3.515 7.192 651 HD2 LYS 86 1HD LYS 86 2.053 5.640 8.175 652 HD3 LYS 86 2HD LYS 86 0.834 4.704 9.044 653 HE2 LYS 86 1HE LYS 86 2.661 5.102 10.533 654 HE3 LYS 86 2HE LYS 86 2.686 3.397 10.085 655 HZ1 LYS 86 1HZ LYS 86 4.726 5.286 9.801 656 HZ2 LYS 86 2HZ LYS 86 4.247 4.821 8.247 657 HZ3 LYS 86 3HZ LYS 86 4.747 3.652 9.362 658 H LEU 87 H LEU 87 1.703 4.815 3.084 659 HA LEU 87 HA LEU 87 4.613 4.653 3.085 660 HB2 LEU 87 1HB LEU 87 2.569 5.698 1.162 661 HB3 LEU 87 2HB LEU 87 4.269 6.135 0.997 662 HG LEU 87 HG LEU 87 3.887 4.342 -0.492 663 HD11 LEU 87 1HD1 LEU 87 5.928 4.229 0.972 664 HD12 LEU 87 2HD1 LEU 87 5.421 2.699 0.257 665 HD13 LEU 87 3HD1 LEU 87 5.067 3.041 1.951 666 HD21 LEU 87 1HD2 LEU 87 3.093 2.120 0.886 667 HD22 LEU 87 2HD2 LEU 87 2.042 3.136 -0.101 668 HD23 LEU 87 3HD2 LEU 87 2.130 3.389 1.642 669 HA PRO 88 HA PRO 88 5.366 8.566 4.922 670 HB2 PRO 88 1HB PRO 88 7.497 9.453 3.494 671 HB3 PRO 88 2HB PRO 88 7.608 8.136 4.667 672 HG2 PRO 88 1HG PRO 88 7.377 8.002 1.685 673 HG3 PRO 88 2HG PRO 88 8.415 7.059 2.771 674 HD2 PRO 88 1HD PRO 88 6.106 6.081 1.748 675 HD3 PRO 88 2HD PRO 88 6.712 5.618 3.351 676 H ARG 89 H ARG 89 5.218 8.553 1.384 677 HA ARG 89 HA ARG 89 4.185 11.310 1.472 678 HB2 ARG 89 1HB ARG 89 5.788 9.816 -0.572 679 HB3 ARG 89 2HB ARG 89 4.758 11.148 -1.078 680 HG2 ARG 89 1HG ARG 89 6.845 11.410 1.069 681 HG3 ARG 89 2HG ARG 89 7.160 11.727 -0.638 682 HD2 ARG 89 1HD ARG 89 5.533 13.488 -0.673 683 HD3 ARG 89 2HD ARG 89 4.999 13.090 0.960 684 HE ARG 89 HE ARG 89 7.289 14.657 0.220 685 HH11 ARG 89 2HH1 ARG 89 5.887 12.634 2.682 686 HH12 ARG 89 1HH1 ARG 89 6.819 13.328 3.967 687 HH21 ARG 89 2HH2 ARG 89 8.522 15.578 1.902 688 HH22 ARG 89 1HH2 ARG 89 8.317 15.003 3.522 689 H LEU 90 H LEU 90 2.710 8.763 1.893 690 HA LEU 90 HA LEU 90 0.872 7.615 1.121 691 HB2 LEU 90 1HB LEU 90 0.336 10.526 0.961 692 HB3 LEU 90 2HB LEU 90 -0.851 9.445 0.233 693 HG LEU 90 HG LEU 90 -0.627 8.280 2.634 694 HD11 LEU 90 1HD1 LEU 90 -0.216 9.744 4.385 695 HD12 LEU 90 2HD1 LEU 90 -0.392 11.172 3.367 696 HD13 LEU 90 3HD1 LEU 90 1.042 10.157 3.220 697 HD21 LEU 90 1HD2 LEU 90 -2.603 9.385 1.331 698 HD22 LEU 90 2HD2 LEU 90 -2.340 10.719 2.455 699 HD23 LEU 90 3HD2 LEU 90 -2.729 9.111 3.069 700 H SER 91 H SER 91 2.772 7.324 -0.770 701 HA SER 91 HA SER 91 1.838 8.180 -3.355 702 HB2 SER 91 1HB SER 91 3.987 6.180 -2.611 703 HB3 SER 91 2HB SER 91 3.703 6.823 -4.228 704 HG SER 91 HG SER 91 5.354 7.976 -3.190 705 H LEU 92 H LEU 92 1.220 5.556 -1.256 706 HA LEU 92 HA LEU 92 -0.805 4.483 -2.885 707 HB2 LEU 92 1HB LEU 92 0.156 2.324 -3.448 708 HB3 LEU 92 2HB LEU 92 1.052 3.637 -4.208 709 HG LEU 92 HG LEU 92 2.590 3.325 -2.067 710 HD11 LEU 92 1HD1 LEU 92 2.787 0.970 -1.470 711 HD12 LEU 92 2HD1 LEU 92 1.400 0.587 -2.489 712 HD13 LEU 92 3HD1 LEU 92 1.191 1.598 -1.059 713 HD21 LEU 92 1HD2 LEU 92 2.810 1.343 -4.312 714 HD22 LEU 92 2HD2 LEU 92 4.099 2.163 -3.431 715 HD23 LEU 92 3HD2 LEU 92 3.088 3.067 -4.559 716 H ASN 93 H ASN 93 -1.182 2.006 -2.018 717 HA ASN 93 HA ASN 93 -0.985 2.167 0.917 718 HB2 ASN 93 1HB ASN 93 -3.210 0.834 0.826 719 HB3 ASN 93 2HB ASN 93 -3.255 2.572 0.541 720 HD21 ASN 93 1HD2 ASN 93 -3.191 -0.562 -1.058 721 HD22 ASN 93 2HD2 ASN 93 -4.014 -0.052 -2.489 722 H GLY 94 H GLY 94 0.770 0.793 1.094 723 HA2 GLY 94 1HA GLY 94 1.270 -1.552 -0.264 724 HA3 GLY 94 2HA GLY 94 1.774 -1.253 1.392 725 H VAL 95 H VAL 95 0.752 -3.692 -0.040 726 HA VAL 95 HA VAL 95 -1.315 -4.374 1.939 727 HB VAL 95 HB VAL 95 -1.358 -5.380 -0.905 728 HG11 VAL 95 1HG1 VAL 95 -2.423 -6.630 1.124 729 HG12 VAL 95 2HG1 VAL 95 -3.670 -5.390 0.985 730 HG13 VAL 95 3HG1 VAL 95 -3.328 -6.455 -0.379 731 HG21 VAL 95 1HG2 VAL 95 -2.185 -2.832 0.122 732 HG22 VAL 95 2HG2 VAL 95 -2.240 -3.439 -1.533 733 HG23 VAL 95 3HG2 VAL 95 -3.588 -3.742 -0.437 734 H ARG 96 H ARG 96 -0.246 -5.717 3.261 735 HA ARG 96 HA ARG 96 1.641 -7.653 2.175 736 HB2 ARG 96 1HB ARG 96 0.876 -7.171 5.058 737 HB3 ARG 96 2HB ARG 96 2.257 -8.088 4.472 738 HG2 ARG 96 1HG ARG 96 2.015 -5.238 3.667 739 HG3 ARG 96 2HG ARG 96 2.504 -5.612 5.321 740 HD2 ARG 96 1HD ARG 96 3.834 -6.823 2.910 741 HD3 ARG 96 2HD ARG 96 4.370 -5.308 3.636 742 HE ARG 96 HE ARG 96 4.171 -7.550 5.454 743 HH11 ARG 96 2HH1 ARG 96 6.201 -5.700 3.315 744 HH12 ARG 96 1HH1 ARG 96 7.678 -6.214 4.061 745 HH21 ARG 96 2HH2 ARG 96 6.109 -8.234 6.445 746 HH22 ARG 96 1HH2 ARG 96 7.624 -7.656 5.840 747 H PHE 97 H PHE 97 1.553 -9.912 3.030 748 HA PHE 97 HA PHE 97 -1.171 -10.855 3.550 749 HB2 PHE 97 1HB PHE 97 0.567 -11.600 1.226 750 HB3 PHE 97 2HB PHE 97 -0.541 -12.792 1.897 751 HD1 PHE 97 1HD PHE 97 -0.464 -9.297 0.620 752 HD2 PHE 97 2HD PHE 97 -2.723 -12.866 1.149 753 HE1 PHE 97 1HE PHE 97 -2.298 -8.328 -0.703 754 HE2 PHE 97 2HE PHE 97 -4.560 -11.903 -0.174 755 HZ PHE 97 HZ PHE 97 -4.349 -9.632 -1.103 756 H LYS 98 H LYS 98 -0.992 -11.841 5.451 757 HA LYS 98 HA LYS 98 1.345 -13.574 5.918 758 HB2 LYS 98 1HB LYS 98 1.319 -11.744 7.489 759 HB3 LYS 98 2HB LYS 98 -0.369 -12.045 7.881 760 HG2 LYS 98 1HG LYS 98 0.382 -14.321 8.712 761 HG3 LYS 98 2HG LYS 98 2.030 -13.700 8.597 762 HD2 LYS 98 1HD LYS 98 1.438 -13.286 10.815 763 HD3 LYS 98 2HD LYS 98 1.163 -11.735 10.016 764 HE2 LYS 98 1HE LYS 98 -1.157 -12.005 10.037 765 HE3 LYS 98 2HE LYS 98 -1.045 -13.743 10.311 766 HZ1 LYS 98 1HZ LYS 98 -1.501 -11.887 12.221 767 HZ2 LYS 98 2HZ LYS 98 0.158 -12.168 12.395 768 HZ3 LYS 98 3HZ LYS 98 -0.934 -13.456 12.506 769 H ARG 99 H ARG 99 0.970 -15.683 6.040 770 HA ARG 99 HA ARG 99 -1.752 -16.663 6.051 771 HB2 ARG 99 1HB ARG 99 -0.253 -17.736 4.528 772 HB3 ARG 99 2HB ARG 99 0.925 -18.030 5.800 773 HG2 ARG 99 1HG ARG 99 -1.042 -19.403 6.865 774 HG3 ARG 99 2HG ARG 99 -1.610 -19.458 5.195 775 HD2 ARG 99 1HD ARG 99 -0.308 -21.329 5.207 776 HD3 ARG 99 2HD ARG 99 0.904 -20.136 4.742 777 HE ARG 99 HE ARG 99 0.662 -20.612 7.586 778 HH11 ARG 99 2HH1 ARG 99 2.274 -21.447 4.615 779 HH12 ARG 99 1HH1 ARG 99 3.673 -22.096 5.405 780 HH21 ARG 99 2HH2 ARG 99 2.499 -21.463 8.637 781 HH22 ARG 99 1HH2 ARG 99 3.800 -22.105 7.692 782 H ILE 100 H ILE 100 -2.828 -17.287 7.798 783 HA ILE 100 HA ILE 100 -1.390 -17.561 10.326 784 HB ILE 100 HB ILE 100 -4.343 -17.356 9.735 785 HG12 ILE 100 1HG1 ILE 100 -2.372 -15.445 11.006 786 HG13 ILE 100 2HG1 ILE 100 -3.147 -15.258 9.437 787 HG21 ILE 100 1HG2 ILE 100 -4.807 -18.073 11.784 788 HG22 ILE 100 2HG2 ILE 100 -3.115 -18.537 11.956 789 HG23 ILE 100 3HG2 ILE 100 -3.652 -16.945 12.491 790 HD11 ILE 100 1HD1 ILE 100 -4.021 -14.018 11.595 791 HD12 ILE 100 2HD1 ILE 100 -5.119 -14.593 10.340 792 HD13 ILE 100 3HD1 ILE 100 -4.893 -15.535 11.814 793 H SER 101 H SER 101 -3.921 -19.311 8.523 794 HA SER 101 HA SER 101 -2.821 -21.823 9.573 795 HB2 SER 101 1HB SER 101 -4.918 -22.659 10.234 796 HB3 SER 101 2HB SER 101 -4.928 -20.995 10.815 797 HG SER 101 HG SER 101 -5.892 -20.751 8.474 798 H GLY 102 H GLY 102 -3.989 -23.734 8.381 799 HA2 GLY 102 1HA GLY 102 -4.693 -24.718 6.390 800 HA3 GLY 102 2HA GLY 102 -4.746 -23.125 5.650 801 H THR 103 H THR 103 -3.777 -24.943 4.054 802 HA THR 103 HA THR 103 -0.928 -25.295 4.355 803 HB THR 103 HB THR 103 -1.018 -26.419 2.183 804 HG1 THR 103 1HG THR 103 -3.375 -26.654 1.423 805 HG21 THR 103 1HG2 THR 103 -3.316 -27.792 3.079 806 HG22 THR 103 2HG2 THR 103 -2.490 -27.187 4.514 807 HG23 THR 103 3HG2 THR 103 -1.626 -28.206 3.364 808 H SER 104 H SER 104 0.678 -24.414 3.024 809 HA SER 104 HA SER 104 0.450 -21.705 2.418 810 HB2 SER 104 1HB SER 104 2.434 -23.600 1.149 811 HB3 SER 104 2HB SER 104 2.634 -21.871 1.435 812 HG SER 104 HG SER 104 3.705 -22.972 3.051 813 H ILE 105 H ILE 105 0.419 -24.502 0.220 814 HA ILE 105 HA ILE 105 0.290 -23.407 -2.227 815 HB ILE 105 HB ILE 105 -1.505 -25.590 -1.171 816 HG12 ILE 105 1HG1 ILE 105 0.974 -25.954 -1.105 817 HG13 ILE 105 2HG1 ILE 105 0.109 -27.103 -2.120 818 HG21 ILE 105 1HG2 ILE 105 -2.460 -24.564 -3.191 819 HG22 ILE 105 2HG2 ILE 105 -0.947 -24.864 -4.043 820 HG23 ILE 105 3HG2 ILE 105 -1.922 -26.219 -3.476 821 HD11 ILE 105 1HD1 ILE 105 1.110 -26.390 -4.000 822 HD12 ILE 105 2HD1 ILE 105 1.124 -24.703 -3.484 823 HD13 ILE 105 3HD1 ILE 105 2.341 -25.823 -2.872 824 H ALA 106 H ALA 106 -2.732 -24.028 -0.433 825 HA ALA 106 HA ALA 106 -4.470 -22.621 -2.009 826 HB1 ALA 106 1HB ALA 106 -5.475 -22.103 0.479 827 HB2 ALA 106 2HB ALA 106 -5.718 -23.596 -0.428 828 HB3 ALA 106 3HB ALA 106 -4.437 -23.498 0.779 829 H PHE 107 H PHE 107 -2.492 -21.342 0.646 830 HA PHE 107 HA PHE 107 -3.405 -18.781 0.847 831 HB2 PHE 107 1HB PHE 107 -1.498 -19.860 2.129 832 HB3 PHE 107 2HB PHE 107 -0.460 -19.436 0.772 833 HD1 PHE 107 1HD PHE 107 -2.723 -17.989 3.327 834 HD2 PHE 107 2HD PHE 107 0.486 -17.312 0.614 835 HE1 PHE 107 1HE PHE 107 -2.380 -15.754 4.296 836 HE2 PHE 107 2HE PHE 107 0.835 -15.076 1.579 837 HZ PHE 107 HZ PHE 107 -0.598 -14.294 3.423 838 H LYS 108 H LYS 108 -0.800 -19.803 -1.366 839 HA LYS 108 HA LYS 108 -0.700 -17.331 -2.747 840 HB2 LYS 108 1HB LYS 108 0.326 -20.092 -3.375 841 HB3 LYS 108 2HB LYS 108 0.532 -18.753 -4.497 842 HG2 LYS 108 1HG LYS 108 2.489 -18.549 -3.393 843 HG3 LYS 108 2HG LYS 108 1.490 -17.594 -2.295 844 HD2 LYS 108 1HD LYS 108 2.467 -18.985 -0.776 845 HD3 LYS 108 2HD LYS 108 1.076 -19.981 -1.208 846 HE2 LYS 108 1HE LYS 108 2.739 -20.844 -3.078 847 HE3 LYS 108 2HE LYS 108 3.947 -20.305 -1.912 848 HZ1 LYS 108 1HZ LYS 108 2.686 -22.711 -1.897 849 HZ2 LYS 108 2HZ LYS 108 1.851 -21.844 -0.710 850 HZ3 LYS 108 3HZ LYS 108 3.528 -22.032 -0.596 851 H ASN 109 H ASN 109 -2.198 -20.456 -3.537 852 HA ASN 109 HA ASN 109 -3.162 -19.962 -6.048 853 HB2 ASN 109 1HB ASN 109 -4.201 -21.569 -3.750 854 HB3 ASN 109 2HB ASN 109 -5.215 -21.379 -5.177 855 HD21 ASN 109 1HD2 ASN 109 -2.247 -22.678 -3.919 856 HD22 ASN 109 2HD2 ASN 109 -1.909 -23.730 -5.248 857 H ILE 110 H ILE 110 -4.599 -18.963 -2.971 858 HA ILE 110 HA ILE 110 -6.795 -17.625 -4.307 859 HB ILE 110 HB ILE 110 -7.055 -18.776 -2.091 860 HG12 ILE 110 1HG1 ILE 110 -8.433 -16.925 -1.093 861 HG13 ILE 110 2HG1 ILE 110 -7.755 -15.842 -2.305 862 HG21 ILE 110 1HG2 ILE 110 -5.243 -16.543 -1.264 863 HG22 ILE 110 2HG2 ILE 110 -6.395 -17.235 -0.124 864 HG23 ILE 110 3HG2 ILE 110 -5.160 -18.257 -0.858 865 HD11 ILE 110 1HD1 ILE 110 -9.020 -18.333 -3.274 866 HD12 ILE 110 2HD1 ILE 110 -10.076 -17.077 -2.627 867 HD13 ILE 110 3HD1 ILE 110 -9.001 -16.716 -3.978 868 H ALA 111 H ALA 111 -3.662 -16.850 -3.081 869 HA ALA 111 HA ALA 111 -3.971 -14.102 -2.596 870 HB1 ALA 111 1HB ALA 111 -1.432 -15.258 -3.686 871 HB2 ALA 111 2HB ALA 111 -1.654 -13.985 -2.485 872 HB3 ALA 111 3HB ALA 111 -1.989 -15.664 -2.062 873 H SER 112 H SER 112 -3.281 -15.898 -5.552 874 HA SER 112 HA SER 112 -2.647 -13.711 -7.197 875 HB2 SER 112 1HB SER 112 -2.193 -16.043 -7.839 876 HB3 SER 112 2HB SER 112 -3.926 -16.346 -7.967 877 HG SER 112 HG SER 112 -3.057 -15.887 -10.003 878 H LYS 113 H LYS 113 -5.737 -15.412 -6.722 879 HA LYS 113 HA LYS 113 -7.317 -13.936 -8.446 880 HB2 LYS 113 1HB LYS 113 -7.828 -15.998 -6.865 881 HB3 LYS 113 2HB LYS 113 -8.450 -14.741 -5.803 882 HG2 LYS 113 1HG LYS 113 -10.341 -15.309 -6.952 883 HG3 LYS 113 2HG LYS 113 -9.738 -13.985 -7.952 884 HD2 LYS 113 1HD LYS 113 -8.493 -15.891 -9.228 885 HD3 LYS 113 2HD LYS 113 -9.708 -16.928 -8.477 886 HE2 LYS 113 1HE LYS 113 -11.407 -15.216 -9.392 887 HE3 LYS 113 2HE LYS 113 -10.085 -14.684 -10.430 888 HZ1 LYS 113 1HZ LYS 113 -9.979 -16.769 -11.466 889 HZ2 LYS 113 2HZ LYS 113 -11.632 -16.421 -11.370 890 HZ3 LYS 113 3HZ LYS 113 -10.934 -17.516 -10.285 891 H ILE 114 H ILE 114 -7.123 -13.411 -4.919 892 HA ILE 114 HA ILE 114 -8.528 -11.128 -4.631 893 HB ILE 114 HB ILE 114 -5.844 -11.637 -3.342 894 HG12 ILE 114 1HG1 ILE 114 -7.436 -13.488 -3.029 895 HG13 ILE 114 2HG1 ILE 114 -7.137 -12.636 -1.518 896 HG21 ILE 114 1HG2 ILE 114 -8.011 -10.109 -2.006 897 HG22 ILE 114 2HG2 ILE 114 -6.261 -9.966 -1.848 898 HG23 ILE 114 3HG2 ILE 114 -7.075 -9.297 -3.261 899 HD11 ILE 114 1HD1 ILE 114 -9.316 -12.390 -1.270 900 HD12 ILE 114 2HD1 ILE 114 -9.356 -11.400 -2.729 901 HD13 ILE 114 3HD1 ILE 114 -9.605 -13.142 -2.839 902 H ALA 115 H ALA 115 -5.078 -11.215 -5.522 903 HA ALA 115 HA ALA 115 -4.721 -8.466 -5.845 904 HB1 ALA 115 1HB ALA 115 -3.327 -10.746 -7.243 905 HB2 ALA 115 2HB ALA 115 -2.776 -9.070 -7.242 906 HB3 ALA 115 3HB ALA 115 -2.841 -9.977 -5.731 907 H ASN 116 H ASN 116 -5.270 -10.898 -8.403 908 HA ASN 116 HA ASN 116 -5.481 -9.240 -10.572 909 HB2 ASN 116 1HB ASN 116 -6.713 -11.867 -9.872 910 HB3 ASN 116 2HB ASN 116 -7.303 -11.029 -11.305 911 HD21 ASN 116 1HD2 ASN 116 -5.158 -13.252 -10.241 912 HD22 ASN 116 2HD2 ASN 116 -3.986 -13.164 -11.509 913 H GLU 117 H GLU 117 -7.986 -10.012 -8.200 914 HA GLU 117 HA GLU 117 -10.046 -8.554 -9.527 915 HB2 GLU 117 1HB GLU 117 -9.889 -9.353 -6.617 916 HB3 GLU 117 2HB GLU 117 -11.339 -8.892 -7.498 917 HG2 GLU 117 1HG GLU 117 -10.595 -10.910 -9.040 918 HG3 GLU 117 2HG GLU 117 -9.808 -11.428 -7.550 919 H LEU 118 H LEU 118 -7.829 -7.837 -6.865 920 HA LEU 118 HA LEU 118 -8.906 -5.178 -6.510 921 HB2 LEU 118 1HB LEU 118 -6.813 -6.836 -5.210 922 HB3 LEU 118 2HB LEU 118 -6.691 -5.085 -5.053 923 HG LEU 118 HG LEU 118 -9.224 -6.513 -4.328 924 HD11 LEU 118 1HD1 LEU 118 -6.769 -7.068 -3.130 925 HD12 LEU 118 2HD1 LEU 118 -8.374 -7.428 -2.494 926 HD13 LEU 118 3HD1 LEU 118 -7.566 -5.925 -2.049 927 HD21 LEU 118 1HD2 LEU 118 -9.789 -4.369 -4.047 928 HD22 LEU 118 2HD2 LEU 118 -8.113 -3.824 -4.106 929 HD23 LEU 118 3HD2 LEU 118 -8.790 -4.434 -2.595 930 H LYS 119 H LYS 119 -7.353 -6.290 -8.989 931 HA LYS 119 HA LYS 119 -5.908 -5.495 -10.561 932 HB2 LYS 119 1HB LYS 119 -6.860 -2.943 -9.269 933 HB3 LYS 119 2HB LYS 119 -5.786 -2.942 -10.662 934 HG2 LYS 119 1HG LYS 119 -8.449 -4.334 -10.651 935 HG3 LYS 119 2HG LYS 119 -8.233 -2.657 -11.157 936 HD2 LYS 119 1HD LYS 119 -6.677 -4.938 -12.355 937 HD3 LYS 119 2HD LYS 119 -8.227 -4.394 -13.001 938 HE2 LYS 119 1HE LYS 119 -7.167 -2.070 -13.090 939 HE3 LYS 119 2HE LYS 119 -5.628 -2.894 -12.844 940 HZ1 LYS 119 1HZ LYS 119 -7.182 -4.104 -14.913 941 HZ2 LYS 119 2HZ LYS 119 -5.587 -3.543 -14.954 942 HZ3 LYS 119 3HZ LYS 119 -6.867 -2.474 -15.239 943 H LEU 120 H LEU 120 -4.811 -6.255 -7.953 944 HA LEU 120 HA LEU 120 -2.588 -4.417 -7.557 945 HB2 LEU 120 1HB LEU 120 -3.393 -6.959 -6.157 946 HB3 LEU 120 2HB LEU 120 -1.959 -6.020 -5.745 947 HG LEU 120 HG LEU 120 -4.769 -4.937 -5.600 948 HD11 LEU 120 1HD1 LEU 120 -4.022 -5.172 -3.036 949 HD12 LEU 120 2HD1 LEU 120 -3.213 -6.585 -3.712 950 HD13 LEU 120 3HD1 LEU 120 -4.958 -6.398 -3.891 951 HD21 LEU 120 1HD2 LEU 120 -3.365 -3.105 -5.710 952 HD22 LEU 120 2HD2 LEU 120 -2.055 -3.924 -4.859 953 HD23 LEU 120 3HD2 LEU 120 -3.479 -3.378 -3.972 954 H SER 121 H SER 121 -0.383 -5.524 -7.218 955 HA SER 121 HA SER 121 0.541 -6.480 -9.655 956 HB2 SER 121 1HB SER 121 1.680 -6.540 -6.874 957 HB3 SER 121 2HB SER 121 2.541 -7.302 -8.211 958 HG SER 121 HG SER 121 3.199 -5.391 -8.738 959 H GLY 122 H GLY 122 2.023 -8.672 -9.471 960 HA2 GLY 122 1HA GLY 122 0.471 -10.864 -8.353 961 HA3 GLY 122 2HA GLY 122 0.538 -10.800 -10.108 962 HA PRO 123 HA PRO 123 5.047 -11.602 -8.492 963 HB2 PRO 123 1HB PRO 123 5.226 -12.442 -5.917 964 HB3 PRO 123 2HB PRO 123 5.324 -10.740 -6.380 965 HG2 PRO 123 1HG PRO 123 2.993 -12.279 -5.304 966 HG3 PRO 123 2HG PRO 123 3.550 -10.650 -4.879 967 HD2 PRO 123 1HD PRO 123 1.470 -11.087 -6.557 968 HD3 PRO 123 2HD PRO 123 2.556 -9.693 -6.725 969 H SER 124 H SER 124 4.769 -13.372 -9.875 970 HA SER 124 HA SER 124 3.419 -15.694 -9.562 971 HB2 SER 124 1HB SER 124 6.258 -15.503 -10.597 972 HB3 SER 124 2HB SER 124 5.107 -16.790 -10.954 973 HG SER 124 HG SER 124 3.810 -14.703 -11.621 974 H SER 125 H SER 125 3.861 -17.773 -8.720 975 HA SER 125 HA SER 125 5.247 -17.695 -6.182 976 HB2 SER 125 1HB SER 125 3.171 -18.824 -6.094 977 HB3 SER 125 2HB SER 125 3.519 -19.748 -7.555 978 HG SER 125 HG SER 125 5.280 -20.069 -5.432 979 H GLY 126 H GLY 126 7.418 -17.475 -6.922 980 HA2 GLY 126 1HA GLY 126 9.007 -19.668 -6.871 981 HA3 GLY 126 2HA GLY 126 8.581 -19.541 -8.571 Start of MODEL 4 1 H1 MET 1 H MET 1 7.395 40.763 -25.213 2 HA MET 1 HA MET 1 9.722 39.613 -26.359 3 HB2 MET 1 1HB MET 1 10.427 41.958 -25.429 4 HB3 MET 1 2HB MET 1 10.364 41.149 -23.869 5 HG2 MET 1 1HG MET 1 11.965 40.089 -26.175 6 HG3 MET 1 2HG MET 1 12.612 41.248 -25.015 7 HE1 MET 1 1HE MET 1 14.509 39.655 -24.736 8 HE2 MET 1 2HE MET 1 14.483 38.190 -23.755 9 HE3 MET 1 3HE MET 1 13.964 38.132 -25.440 10 H LYS 2 H LYS 2 9.790 37.596 -25.631 11 HA LYS 2 HA LYS 2 8.820 37.046 -22.905 12 HB2 LYS 2 1HB LYS 2 7.842 34.947 -23.720 13 HB3 LYS 2 2HB LYS 2 7.123 36.341 -24.514 14 HG2 LYS 2 1HG LYS 2 8.622 35.943 -26.451 15 HG3 LYS 2 2HG LYS 2 9.183 34.469 -25.659 16 HD2 LYS 2 1HD LYS 2 7.531 33.590 -26.968 17 HD3 LYS 2 2HD LYS 2 6.584 33.982 -25.531 18 HE2 LYS 2 1HE LYS 2 6.902 35.926 -27.797 19 HE3 LYS 2 2HE LYS 2 5.650 34.685 -27.810 20 HZ1 LYS 2 1HZ LYS 2 5.974 36.934 -25.917 21 HZ2 LYS 2 2HZ LYS 2 4.992 35.604 -25.562 22 HZ3 LYS 2 3HZ LYS 2 4.647 36.576 -26.903 23 H ASP 3 H ASP 3 9.941 35.542 -21.723 24 HA ASP 3 HA ASP 3 12.350 34.417 -22.995 25 HB2 ASP 3 1HB ASP 3 12.530 36.334 -21.185 26 HB3 ASP 3 2HB ASP 3 12.293 34.996 -20.064 27 H HIS 4 H HIS 4 13.191 32.454 -21.937 28 HA HIS 4 HA HIS 4 11.323 30.941 -20.315 29 HB2 HIS 4 1HB HIS 4 11.302 29.020 -21.894 30 HB3 HIS 4 2HB HIS 4 10.482 30.442 -22.530 31 HD1 HIS 4 1HD HIS 4 10.846 30.200 -24.986 32 HD2 HIS 4 2HD HIS 4 14.355 29.713 -22.815 33 HE1 HIS 4 1HE HIS 4 12.681 30.049 -26.699 34 HE2 HIS 4 2HE HIS 4 14.784 29.669 -25.366 35 H LEU 5 H LEU 5 12.284 28.621 -19.998 36 HA LEU 5 HA LEU 5 15.211 28.697 -19.963 37 HB2 LEU 5 1HB LEU 5 15.207 27.869 -17.628 38 HB3 LEU 5 2HB LEU 5 14.626 29.523 -17.802 39 HG LEU 5 HG LEU 5 12.654 27.283 -17.677 40 HD11 LEU 5 1HD1 LEU 5 12.626 27.783 -15.155 41 HD12 LEU 5 2HD1 LEU 5 14.268 28.376 -15.402 42 HD13 LEU 5 3HD1 LEU 5 13.870 26.701 -15.782 43 HD21 LEU 5 1HD2 LEU 5 11.972 29.606 -18.208 44 HD22 LEU 5 2HD2 LEU 5 12.593 30.113 -16.636 45 HD23 LEU 5 3HD2 LEU 5 11.241 28.983 -16.729 46 H ILE 6 H ILE 6 16.170 26.569 -19.475 47 HA ILE 6 HA ILE 6 14.721 24.494 -20.865 48 HB ILE 6 HB ILE 6 17.469 24.427 -19.612 49 HG12 ILE 6 1HG1 ILE 6 16.782 24.645 -22.541 50 HG13 ILE 6 2HG1 ILE 6 17.043 26.061 -21.529 51 HG21 ILE 6 1HG2 ILE 6 16.847 22.196 -19.787 52 HG22 ILE 6 2HG2 ILE 6 15.935 22.465 -21.272 53 HG23 ILE 6 3HG2 ILE 6 17.697 22.491 -21.304 54 HD11 ILE 6 1HD1 ILE 6 18.955 24.541 -22.899 55 HD12 ILE 6 2HD1 ILE 6 19.228 25.884 -21.788 56 HD13 ILE 6 3HD1 ILE 6 19.207 24.229 -21.182 57 H HIS 7 H HIS 7 13.585 22.908 -19.964 58 HA HIS 7 HA HIS 7 13.395 22.731 -17.091 59 HB2 HIS 7 1HB HIS 7 11.479 22.491 -18.812 60 HB3 HIS 7 2HB HIS 7 12.069 20.846 -19.025 61 HD1 HIS 7 1HD HIS 7 10.315 19.490 -17.889 62 HD2 HIS 7 2HD HIS 7 11.573 22.696 -15.565 63 HE1 HIS 7 1HE HIS 7 9.190 19.187 -15.661 64 HE2 HIS 7 2HE HIS 7 9.898 21.184 -14.300 65 H ASN 8 H ASN 8 13.492 20.613 -15.977 66 HA ASN 8 HA ASN 8 15.854 19.137 -16.882 67 HB2 ASN 8 1HB ASN 8 16.144 18.435 -14.616 68 HB3 ASN 8 2HB ASN 8 15.772 20.156 -14.572 69 HD21 ASN 8 1HD2 ASN 8 14.999 17.138 -13.370 70 HD22 ASN 8 2HD2 ASN 8 13.505 17.536 -12.601 71 H VAL 9 H VAL 9 15.894 16.780 -16.526 72 HA VAL 9 HA VAL 9 13.259 15.502 -16.651 73 HB VAL 9 HB VAL 9 14.247 13.980 -18.474 74 HG11 VAL 9 1HG1 VAL 9 13.844 16.159 -20.112 75 HG12 VAL 9 2HG1 VAL 9 12.590 15.090 -19.480 76 HG13 VAL 9 3HG1 VAL 9 12.976 16.592 -18.639 77 HG21 VAL 9 1HG2 VAL 9 15.944 14.909 -19.886 78 HG22 VAL 9 2HG2 VAL 9 15.982 16.400 -18.946 79 HG23 VAL 9 3HG2 VAL 9 16.556 14.894 -18.232 80 H HIS 10 H HIS 10 13.283 14.190 -14.943 81 HA HIS 10 HA HIS 10 15.637 13.107 -13.794 82 HB2 HIS 10 1HB HIS 10 13.722 13.467 -12.392 83 HB3 HIS 10 2HB HIS 10 12.716 12.439 -13.408 84 HD1 HIS 10 1HD HIS 10 12.153 10.521 -11.933 85 HD2 HIS 10 2HD HIS 10 16.195 11.473 -11.787 86 HE1 HIS 10 1HE HIS 10 13.215 8.730 -10.523 87 HE2 HIS 10 2HE HIS 10 15.646 9.375 -10.378 88 H LYS 11 H LYS 11 16.844 11.768 -15.011 89 HA LYS 11 HA LYS 11 15.520 9.586 -16.456 90 HB2 LYS 11 1HB LYS 11 18.310 10.725 -16.639 91 HB3 LYS 11 2HB LYS 11 17.797 9.279 -17.499 92 HG2 LYS 11 1HG LYS 11 16.348 10.466 -18.881 93 HG3 LYS 11 2HG LYS 11 16.318 11.865 -17.805 94 HD2 LYS 11 1HD LYS 11 18.810 10.960 -19.228 95 HD3 LYS 11 2HD LYS 11 17.672 12.108 -19.936 96 HE2 LYS 11 1HE LYS 11 18.192 13.759 -18.430 97 HE3 LYS 11 2HE LYS 11 18.681 12.615 -17.181 98 HZ1 LYS 11 1HZ LYS 11 20.740 12.278 -18.202 99 HZ2 LYS 11 2HZ LYS 11 20.500 13.949 -18.299 100 HZ3 LYS 11 3HZ LYS 11 20.250 12.980 -19.662 101 H GLU 12 H GLU 12 15.698 7.518 -15.834 102 HA GLU 12 HA GLU 12 17.528 6.920 -13.603 103 HB2 GLU 12 1HB GLU 12 14.746 5.995 -14.213 104 HB3 GLU 12 2HB GLU 12 15.819 4.959 -13.283 105 HG2 GLU 12 1HG GLU 12 15.482 7.799 -12.460 106 HG3 GLU 12 2HG GLU 12 14.207 6.638 -12.096 107 H GLU 13 H GLU 13 19.217 5.763 -14.233 108 HA GLU 13 HA GLU 13 18.851 3.799 -16.398 109 HB2 GLU 13 1HB GLU 13 21.157 5.554 -15.643 110 HB3 GLU 13 2HB GLU 13 21.458 4.037 -16.478 111 HG2 GLU 13 1HG GLU 13 20.334 4.726 -18.396 112 HG3 GLU 13 2HG GLU 13 19.497 6.026 -17.550 113 H HIS 14 H HIS 14 20.662 2.038 -16.245 114 HA HIS 14 HA HIS 14 21.164 0.075 -15.179 115 HB2 HIS 14 1HB HIS 14 22.153 2.166 -13.240 116 HB3 HIS 14 2HB HIS 14 22.492 0.449 -13.045 117 HD1 HIS 14 1HD HIS 14 24.941 0.373 -13.541 118 HD2 HIS 14 2HD HIS 14 22.802 2.444 -16.439 119 HE1 HIS 14 1HE HIS 14 26.588 0.850 -15.380 120 HE2 HIS 14 2HE HIS 14 25.292 2.178 -17.083 121 H ALA 15 H ALA 15 18.478 0.715 -14.861 122 HA ALA 15 HA ALA 15 17.950 -0.523 -12.257 123 HB1 ALA 15 1HB ALA 15 17.534 2.131 -12.564 124 HB2 ALA 15 2HB ALA 15 15.966 1.494 -13.062 125 HB3 ALA 15 3HB ALA 15 16.610 1.103 -11.467 126 H HIS 16 H HIS 16 16.042 -1.763 -12.161 127 HA HIS 16 HA HIS 16 15.404 -3.426 -14.148 128 HB2 HIS 16 1HB HIS 16 13.012 -3.460 -13.175 129 HB3 HIS 16 2HB HIS 16 14.350 -3.860 -12.102 130 HD1 HIS 16 1HD HIS 16 14.591 -2.481 -10.027 131 HD2 HIS 16 2HD HIS 16 11.980 -0.776 -12.773 132 HE1 HIS 16 1HE HIS 16 13.539 -0.533 -8.834 133 HE2 HIS 16 2HE HIS 16 11.900 0.431 -10.487 134 H ALA 17 H ALA 17 14.113 -3.537 -15.948 135 HA ALA 17 HA ALA 17 12.725 -1.076 -16.767 136 HB1 ALA 17 1HB ALA 17 14.586 -2.719 -18.478 137 HB2 ALA 17 2HB ALA 17 13.546 -1.426 -19.076 138 HB3 ALA 17 3HB ALA 17 14.834 -1.061 -17.929 139 H HIS 18 H HIS 18 10.672 -1.817 -16.510 140 HA HIS 18 HA HIS 18 8.823 -3.165 -16.715 141 HB2 HIS 18 1HB HIS 18 9.966 -2.744 -19.431 142 HB3 HIS 18 2HB HIS 18 8.649 -3.902 -19.276 143 HD1 HIS 18 1HD HIS 18 6.390 -2.923 -19.479 144 HD2 HIS 18 2HD HIS 18 9.184 -0.111 -18.236 145 HE1 HIS 18 1HE HIS 18 5.142 -0.743 -19.357 146 HE2 HIS 18 2HE HIS 18 6.872 0.959 -18.685 147 H ASN 19 H ASN 19 11.096 -4.599 -15.768 148 HA ASN 19 HA ASN 19 10.528 -7.260 -16.896 149 HB2 ASN 19 1HB ASN 19 12.945 -7.734 -15.945 150 HB3 ASN 19 2HB ASN 19 12.730 -7.023 -17.542 151 HD21 ASN 19 1HD2 ASN 19 12.753 -5.834 -14.195 152 HD22 ASN 19 2HD2 ASN 19 13.865 -4.543 -14.484 153 H LYS 20 H LYS 20 11.425 -8.983 -15.213 154 HA LYS 20 HA LYS 20 10.603 -8.176 -12.508 155 HB2 LYS 20 1HB LYS 20 9.746 -10.717 -13.907 156 HB3 LYS 20 2HB LYS 20 9.358 -10.271 -12.251 157 HG2 LYS 20 1HG LYS 20 7.431 -9.651 -13.291 158 HG3 LYS 20 2HG LYS 20 8.339 -8.142 -13.415 159 HD2 LYS 20 1HD LYS 20 9.119 -8.937 -15.680 160 HD3 LYS 20 2HD LYS 20 7.937 -10.241 -15.539 161 HE2 LYS 20 1HE LYS 20 7.116 -7.384 -15.168 162 HE3 LYS 20 2HE LYS 20 7.280 -8.068 -16.785 163 HZ1 LYS 20 1HZ LYS 20 5.720 -9.837 -16.086 164 HZ2 LYS 20 2HZ LYS 20 5.026 -8.294 -16.083 165 HZ3 LYS 20 3HZ LYS 20 5.482 -9.019 -14.624 166 H ASP 21 H ASP 21 13.076 -8.117 -12.557 167 HA ASP 21 HA ASP 21 14.064 -10.759 -11.715 168 HB2 ASP 21 1HB ASP 21 14.980 -10.158 -13.940 169 HB3 ASP 21 2HB ASP 21 15.658 -8.690 -13.243 170 H TYR 22 H TYR 22 13.531 -10.072 -9.565 171 HA TYR 22 HA TYR 22 15.515 -8.198 -8.456 172 HB2 TYR 22 1HB TYR 22 13.606 -7.906 -6.642 173 HB3 TYR 22 2HB TYR 22 13.622 -6.942 -8.114 174 HD1 TYR 22 2HD TYR 22 12.340 -8.093 -10.156 175 HD2 TYR 22 1HD TYR 22 11.619 -8.908 -6.043 176 HE1 TYR 22 2HE TYR 22 10.088 -8.906 -10.718 177 HE2 TYR 22 1HE TYR 22 9.365 -9.725 -6.594 178 HH TYR 22 HH TYR 22 8.383 -10.738 -9.283 179 H ASP 23 H ASP 23 15.769 -8.530 -6.028 180 HA ASP 23 HA ASP 23 16.186 -11.379 -5.573 181 HB2 ASP 23 1HB ASP 23 18.049 -9.803 -5.175 182 HB3 ASP 23 2HB ASP 23 17.089 -9.001 -3.934 183 H ILE 24 H ILE 24 14.658 -12.506 -4.584 184 HA ILE 24 HA ILE 24 12.722 -11.165 -2.871 185 HB ILE 24 HB ILE 24 12.624 -14.107 -3.288 186 HG12 ILE 24 1HG1 ILE 24 13.229 -13.393 -5.510 187 HG13 ILE 24 2HG1 ILE 24 11.505 -13.750 -5.498 188 HG21 ILE 24 1HG2 ILE 24 10.666 -11.849 -3.057 189 HG22 ILE 24 2HG2 ILE 24 10.173 -13.436 -3.644 190 HG23 ILE 24 3HG2 ILE 24 10.851 -13.267 -2.026 191 HD11 ILE 24 1HD1 ILE 24 11.598 -11.068 -4.899 192 HD12 ILE 24 2HD1 ILE 24 12.889 -11.274 -6.083 193 HD13 ILE 24 3HD1 ILE 24 11.245 -11.776 -6.475 194 HA PRO 25 HA PRO 25 14.751 -12.329 0.873 195 HB2 PRO 25 1HB PRO 25 12.653 -11.984 2.561 196 HB3 PRO 25 2HB PRO 25 13.553 -10.634 1.859 197 HG2 PRO 25 1HG PRO 25 10.936 -11.812 1.008 198 HG3 PRO 25 2HG PRO 25 11.406 -10.107 1.139 199 HD2 PRO 25 1HD PRO 25 11.349 -11.424 -1.226 200 HD3 PRO 25 2HD PRO 25 12.509 -10.125 -0.884 201 H THR 26 H THR 26 14.114 -13.714 2.900 202 HA THR 26 HA THR 26 13.264 -16.310 1.865 203 HB THR 26 HB THR 26 14.184 -17.220 3.983 204 HG1 THR 26 1HG THR 26 15.228 -15.834 5.405 205 HG21 THR 26 1HG2 THR 26 15.597 -16.101 1.810 206 HG22 THR 26 2HG2 THR 26 16.110 -17.406 2.880 207 HG23 THR 26 3HG2 THR 26 16.524 -15.736 3.264 208 H THR 27 H THR 27 12.033 -13.735 3.678 209 HA THR 27 HA THR 27 10.476 -14.840 5.644 210 HB THR 27 HB THR 27 8.781 -13.000 5.059 211 HG1 THR 27 1HG THR 27 10.780 -11.866 3.468 212 HG21 THR 27 1HG2 THR 27 10.624 -11.196 5.584 213 HG22 THR 27 2HG2 THR 27 11.640 -12.618 5.821 214 HG23 THR 27 3HG2 THR 27 10.180 -12.406 6.786 215 H GLU 28 H GLU 28 8.105 -15.221 5.665 216 HA GLU 28 HA GLU 28 7.304 -16.741 3.274 217 HB2 GLU 28 1HB GLU 28 6.873 -17.182 6.199 218 HB3 GLU 28 2HB GLU 28 5.675 -17.787 5.063 219 HG2 GLU 28 1HG GLU 28 7.764 -18.816 3.873 220 HG3 GLU 28 2HG GLU 28 8.502 -18.624 5.462 221 H ASN 29 H ASN 29 6.880 -14.012 3.259 222 HA ASN 29 HA ASN 29 3.948 -13.879 3.485 223 HB2 ASN 29 1HB ASN 29 5.985 -11.800 4.272 224 HB3 ASN 29 2HB ASN 29 4.308 -11.382 3.935 225 HD21 ASN 29 1HD2 ASN 29 6.506 -12.818 6.149 226 HD22 ASN 29 2HD2 ASN 29 5.376 -13.105 7.424 227 H LEU 30 H LEU 30 2.865 -12.827 1.841 228 HA LEU 30 HA LEU 30 4.480 -12.269 -0.548 229 HB2 LEU 30 1HB LEU 30 1.659 -13.175 -0.132 230 HB3 LEU 30 2HB LEU 30 2.137 -12.411 -1.646 231 HG LEU 30 HG LEU 30 2.139 -14.838 -1.840 232 HD11 LEU 30 1HD1 LEU 30 4.200 -15.061 -2.923 233 HD12 LEU 30 2HD1 LEU 30 5.005 -13.950 -1.815 234 HD13 LEU 30 3HD1 LEU 30 3.848 -13.334 -2.995 235 HD21 LEU 30 1HD2 LEU 30 3.780 -16.175 -0.584 236 HD22 LEU 30 2HD2 LEU 30 2.573 -15.434 0.468 237 HD23 LEU 30 3HD2 LEU 30 4.195 -14.748 0.366 238 H TYR 31 H TYR 31 4.495 -10.304 -1.478 239 HA TYR 31 HA TYR 31 2.798 -8.227 -0.261 240 HB2 TYR 31 1HB TYR 31 5.458 -7.857 -1.651 241 HB3 TYR 31 2HB TYR 31 4.533 -6.620 -0.807 242 HD1 TYR 31 1HD TYR 31 3.884 -7.468 1.724 243 HD2 TYR 31 2HD TYR 31 7.313 -8.608 -0.523 244 HE1 TYR 31 1HE TYR 31 5.068 -8.003 3.812 245 HE2 TYR 31 2HE TYR 31 8.505 -9.147 1.559 246 HH TYR 31 HH TYR 31 8.302 -9.432 3.777 247 H PHE 32 H PHE 32 1.999 -6.543 -1.632 248 HA PHE 32 HA PHE 32 2.105 -6.976 -4.506 249 HB2 PHE 32 1HB PHE 32 -0.569 -6.833 -3.112 250 HB3 PHE 32 2HB PHE 32 -0.261 -7.151 -4.816 251 HD1 PHE 32 1HD PHE 32 0.373 -8.547 -1.427 252 HD2 PHE 32 2HD PHE 32 -0.151 -9.331 -5.578 253 HE1 PHE 32 1HE PHE 32 0.379 -10.964 -0.968 254 HE2 PHE 32 2HE PHE 32 -0.146 -11.749 -5.125 255 HZ PHE 32 HZ PHE 32 0.118 -12.569 -2.818 256 H GLN 33 H GLN 33 1.136 -5.192 -5.723 257 HA GLN 33 HA GLN 33 0.757 -2.730 -4.182 258 HB2 GLN 33 1HB GLN 33 2.261 -1.481 -5.620 259 HB3 GLN 33 2HB GLN 33 3.127 -2.811 -4.863 260 HG2 GLN 33 1HG GLN 33 3.380 -3.953 -6.827 261 HG3 GLN 33 2HG GLN 33 1.948 -3.230 -7.559 262 HE21 GLN 33 1HE2 GLN 33 5.061 -2.158 -6.224 263 HE22 GLN 33 2HE2 GLN 33 5.432 -1.071 -7.514 264 H GLY 34 H GLY 34 -0.674 -1.290 -5.061 265 HA2 GLY 34 1HA GLY 34 -1.502 -0.733 -7.519 266 HA3 GLY 34 2HA GLY 34 -2.261 -2.301 -7.290 267 H SER 35 H SER 35 -1.882 0.764 -5.506 268 HA SER 35 HA SER 35 -4.304 0.440 -4.059 269 HB2 SER 35 1HB SER 35 -3.935 2.701 -3.274 270 HB3 SER 35 2HB SER 35 -2.387 1.856 -3.306 271 HG SER 35 HG SER 35 -1.777 3.009 -5.050 272 H SER 36 H SER 36 -6.111 2.043 -4.164 273 HA SER 36 HA SER 36 -6.699 2.832 -6.939 274 HB2 SER 36 1HB SER 36 -7.910 0.737 -6.269 275 HB3 SER 36 2HB SER 36 -8.721 1.669 -5.011 276 HG SER 36 HG SER 36 -9.370 3.092 -6.835 277 H GLY 37 H GLY 37 -5.634 4.496 -4.901 278 HA2 GLY 37 1HA GLY 37 -6.534 6.874 -5.005 279 HA3 GLY 37 2HA GLY 37 -7.950 6.193 -4.217 280 H SER 38 H SER 38 -7.927 5.818 -2.040 281 HA SER 38 HA SER 38 -5.511 6.723 -0.618 282 HB2 SER 38 1HB SER 38 -8.421 6.875 0.196 283 HB3 SER 38 2HB SER 38 -7.074 7.293 1.255 284 HG SER 38 HG SER 38 -6.548 8.676 -0.795 285 H SER 39 H SER 39 -5.478 5.828 1.719 286 HA SER 39 HA SER 39 -5.203 3.012 1.536 287 HB2 SER 39 1HB SER 39 -4.639 3.133 3.946 288 HB3 SER 39 2HB SER 39 -3.758 4.331 2.997 289 HG SER 39 HG SER 39 -4.527 5.601 4.515 290 H GLY 40 H GLY 40 -7.704 5.128 2.773 291 HA2 GLY 40 1HA GLY 40 -9.140 3.224 4.282 292 HA3 GLY 40 2HA GLY 40 -9.801 4.705 3.606 293 H ASP 41 H ASP 41 -10.107 4.571 1.127 294 HA ASP 41 HA ASP 41 -12.155 2.996 0.441 295 HB2 ASP 41 1HB ASP 41 -9.879 3.552 -1.471 296 HB3 ASP 41 2HB ASP 41 -11.565 3.260 -1.889 297 H MET 42 H MET 42 -8.755 2.021 0.214 298 HA MET 42 HA MET 42 -8.961 -0.406 -1.031 299 HB2 MET 42 1HB MET 42 -7.197 0.447 1.259 300 HB3 MET 42 2HB MET 42 -7.022 -1.112 0.465 301 HG2 MET 42 1HG MET 42 -6.685 1.609 -0.767 302 HG3 MET 42 2HG MET 42 -5.435 0.404 -0.466 303 HE1 MET 42 1HE MET 42 -4.973 -1.470 -1.505 304 HE2 MET 42 2HE MET 42 -6.268 -2.469 -2.167 305 HE3 MET 42 3HE MET 42 -5.137 -1.658 -3.252 306 H MET 43 H MET 43 -9.441 0.248 2.430 307 HA MET 43 HA MET 43 -9.873 -2.324 3.333 308 HB2 MET 43 1HB MET 43 -11.310 0.179 4.236 309 HB3 MET 43 2HB MET 43 -11.185 -1.320 5.148 310 HG2 MET 43 1HG MET 43 -8.827 0.351 4.317 311 HG3 MET 43 2HG MET 43 -9.629 0.470 5.881 312 HE1 MET 43 1HE MET 43 -8.910 -1.297 7.990 313 HE2 MET 43 2HE MET 43 -10.300 -1.831 7.045 314 HE3 MET 43 3HE MET 43 -9.026 -2.977 7.466 315 H ARG 44 H ARG 44 -12.066 -0.178 1.623 316 HA ARG 44 HA ARG 44 -14.325 -1.952 1.941 317 HB2 ARG 44 1HB ARG 44 -13.895 0.600 0.395 318 HB3 ARG 44 2HB ARG 44 -15.386 -0.326 0.287 319 HG2 ARG 44 1HG ARG 44 -15.997 1.115 1.919 320 HG3 ARG 44 2HG ARG 44 -15.246 -0.120 2.932 321 HD2 ARG 44 1HD ARG 44 -14.166 1.701 3.756 322 HD3 ARG 44 2HD ARG 44 -13.082 1.334 2.414 323 HE ARG 44 HE ARG 44 -13.815 3.233 1.326 324 HH11 ARG 44 2HH1 ARG 44 -15.782 2.619 4.131 325 HH12 ARG 44 1HH1 ARG 44 -16.565 4.164 4.082 326 HH21 ARG 44 2HH2 ARG 44 -14.838 5.270 1.250 327 HH22 ARG 44 1HH2 ARG 44 -16.027 5.671 2.443 328 H GLU 45 H GLU 45 -12.177 -0.946 -0.702 329 HA GLU 45 HA GLU 45 -13.345 -2.412 -2.760 330 HB2 GLU 45 1HB GLU 45 -11.447 -0.677 -2.858 331 HB3 GLU 45 2HB GLU 45 -10.370 -2.025 -2.520 332 HG2 GLU 45 1HG GLU 45 -10.652 -1.397 -4.942 333 HG3 GLU 45 2HG GLU 45 -10.898 -3.096 -4.542 334 H ILE 46 H ILE 46 -10.913 -3.376 -0.380 335 HA ILE 46 HA ILE 46 -10.288 -5.892 -1.425 336 HB ILE 46 HB ILE 46 -10.353 -5.065 1.480 337 HG12 ILE 46 1HG1 ILE 46 -7.845 -5.215 -0.125 338 HG13 ILE 46 2HG1 ILE 46 -8.903 -3.832 -0.384 339 HG21 ILE 46 1HG2 ILE 46 -10.178 -7.374 1.548 340 HG22 ILE 46 2HG2 ILE 46 -9.241 -7.448 0.057 341 HG23 ILE 46 3HG2 ILE 46 -8.490 -6.864 1.542 342 HD11 ILE 46 1HD1 ILE 46 -7.805 -2.896 1.305 343 HD12 ILE 46 2HD1 ILE 46 -8.741 -3.968 2.348 344 HD13 ILE 46 3HD1 ILE 46 -7.122 -4.435 1.828 345 H ARG 47 H ARG 47 -12.568 -5.122 1.213 346 HA ARG 47 HA ARG 47 -13.613 -7.557 1.759 347 HB2 ARG 47 1HB ARG 47 -15.155 -4.975 1.450 348 HB3 ARG 47 2HB ARG 47 -15.768 -6.414 2.253 349 HG2 ARG 47 1HG ARG 47 -14.419 -6.142 4.080 350 HG3 ARG 47 2HG ARG 47 -13.187 -5.261 3.175 351 HD2 ARG 47 1HD ARG 47 -14.100 -3.539 4.365 352 HD3 ARG 47 2HD ARG 47 -15.127 -3.491 2.933 353 HE ARG 47 HE ARG 47 -16.901 -4.267 4.197 354 HH11 ARG 47 2HH1 ARG 47 -13.953 -4.360 6.047 355 HH12 ARG 47 1HH1 ARG 47 -14.755 -4.643 7.557 356 HH21 ARG 47 2HH2 ARG 47 -17.969 -4.639 6.178 357 HH22 ARG 47 1HH2 ARG 47 -17.040 -4.802 7.630 358 H LYS 48 H LYS 48 -14.754 -5.427 -0.858 359 HA LYS 48 HA LYS 48 -16.788 -6.845 -1.933 360 HB2 LYS 48 1HB LYS 48 -16.186 -4.795 -2.961 361 HB3 LYS 48 2HB LYS 48 -14.562 -5.365 -3.322 362 HG2 LYS 48 1HG LYS 48 -15.645 -5.421 -5.375 363 HG3 LYS 48 2HG LYS 48 -15.710 -7.096 -4.822 364 HD2 LYS 48 1HD LYS 48 -17.967 -5.301 -4.100 365 HD3 LYS 48 2HD LYS 48 -17.848 -5.845 -5.775 366 HE2 LYS 48 1HE LYS 48 -18.022 -8.110 -5.160 367 HE3 LYS 48 2HE LYS 48 -17.697 -7.758 -3.463 368 HZ1 LYS 48 1HZ LYS 48 -19.823 -7.162 -3.085 369 HZ2 LYS 48 2HZ LYS 48 -20.133 -8.159 -4.415 370 HZ3 LYS 48 3HZ LYS 48 -20.042 -6.482 -4.619 371 H VAL 49 H VAL 49 -13.387 -7.333 -2.902 372 HA VAL 49 HA VAL 49 -13.794 -9.563 -4.515 373 HB VAL 49 HB VAL 49 -11.350 -9.007 -2.828 374 HG11 VAL 49 1HG1 VAL 49 -10.144 -10.375 -4.322 375 HG12 VAL 49 2HG1 VAL 49 -11.605 -11.283 -3.925 376 HG13 VAL 49 3HG1 VAL 49 -11.483 -10.438 -5.469 377 HG21 VAL 49 1HG2 VAL 49 -12.237 -7.143 -4.368 378 HG22 VAL 49 2HG2 VAL 49 -10.539 -7.600 -4.500 379 HG23 VAL 49 3HG2 VAL 49 -11.704 -8.183 -5.689 380 H LEU 50 H LEU 50 -13.009 -9.411 -1.052 381 HA LEU 50 HA LEU 50 -12.754 -12.111 -0.522 382 HB2 LEU 50 1HB LEU 50 -14.023 -10.035 1.256 383 HB3 LEU 50 2HB LEU 50 -13.363 -11.583 1.777 384 HG LEU 50 HG LEU 50 -11.767 -9.307 0.602 385 HD11 LEU 50 1HD1 LEU 50 -11.232 -8.623 2.695 386 HD12 LEU 50 2HD1 LEU 50 -11.404 -10.235 3.389 387 HD13 LEU 50 3HD1 LEU 50 -12.837 -9.268 3.040 388 HD21 LEU 50 1HD2 LEU 50 -10.299 -11.319 2.055 389 HD22 LEU 50 2HD2 LEU 50 -10.048 -10.704 0.421 390 HD23 LEU 50 3HD2 LEU 50 -11.178 -12.030 0.701 391 H GLY 51 H GLY 51 -15.724 -10.182 -0.040 392 HA2 GLY 51 1HA GLY 51 -17.441 -12.286 0.528 393 HA3 GLY 51 2HA GLY 51 -17.939 -10.765 -0.196 394 H ALA 52 H ALA 52 -16.335 -11.109 -2.592 395 HA ALA 52 HA ALA 52 -18.208 -12.418 -4.218 396 HB1 ALA 52 1HB ALA 52 -15.437 -12.163 -5.224 397 HB2 ALA 52 2HB ALA 52 -16.965 -11.692 -5.970 398 HB3 ALA 52 3HB ALA 52 -16.246 -10.679 -4.718 399 H ASN 53 H ASN 53 -15.073 -13.485 -2.956 400 HA ASN 53 HA ASN 53 -15.437 -16.116 -4.160 401 HB2 ASN 53 1HB ASN 53 -13.158 -14.687 -2.848 402 HB3 ASN 53 2HB ASN 53 -13.142 -16.447 -2.902 403 HD21 ASN 53 1HD2 ASN 53 -13.727 -13.665 -5.022 404 HD22 ASN 53 2HD2 ASN 53 -12.919 -14.327 -6.397 405 H ASN 54 H ASN 54 -17.286 -15.350 -2.131 406 HA ASN 54 HA ASN 54 -18.156 -15.994 -0.113 407 HB2 ASN 54 1HB ASN 54 -17.094 -18.457 -1.423 408 HB3 ASN 54 2HB ASN 54 -17.702 -18.588 0.225 409 HD21 ASN 54 1HD2 ASN 54 -18.643 -19.478 -2.532 410 HD22 ASN 54 2HD2 ASN 54 -20.303 -19.003 -2.568 411 H CYS 55 H CYS 55 -15.691 -14.728 0.219 412 HA CYS 55 HA CYS 55 -14.389 -16.301 2.335 413 HB2 CYS 55 1HB CYS 55 -13.418 -14.048 0.591 414 HB3 CYS 55 2HB CYS 55 -12.585 -14.476 2.080 415 HG CYS 55 HG CYS 55 -12.730 -16.152 -0.848 416 H ASP 56 H ASP 56 -14.604 -15.708 4.392 417 HA ASP 56 HA ASP 56 -16.172 -13.353 5.019 418 HB2 ASP 56 1HB ASP 56 -16.713 -15.391 6.202 419 HB3 ASP 56 2HB ASP 56 -15.050 -15.557 6.758 420 H TYR 57 H TYR 57 -15.508 -11.662 6.371 421 HA TYR 57 HA TYR 57 -12.655 -11.490 7.003 422 HB2 TYR 57 1HB TYR 57 -12.747 -9.068 6.158 423 HB3 TYR 57 2HB TYR 57 -12.649 -10.343 4.949 424 HD1 TYR 57 2HD TYR 57 -14.827 -11.088 3.833 425 HD2 TYR 57 1HD TYR 57 -14.488 -7.503 6.100 426 HE1 TYR 57 2HE TYR 57 -16.849 -10.212 2.739 427 HE2 TYR 57 1HE TYR 57 -16.509 -6.618 5.014 428 HH TYR 57 HH TYR 57 -18.051 -8.300 2.351 429 H GLU 58 H GLU 58 -12.200 -10.404 8.856 430 HA GLU 58 HA GLU 58 -14.418 -9.009 10.196 431 HB2 GLU 58 1HB GLU 58 -14.188 -11.223 11.197 432 HB3 GLU 58 2HB GLU 58 -12.473 -10.945 11.463 433 HG2 GLU 58 1HG GLU 58 -13.399 -10.554 13.541 434 HG3 GLU 58 2HG GLU 58 -13.230 -8.933 12.870 435 H GLN 59 H GLN 59 -13.834 -6.942 10.285 436 HA GLN 59 HA GLN 59 -11.135 -6.057 10.231 437 HB2 GLN 59 1HB GLN 59 -13.407 -4.867 9.557 438 HB3 GLN 59 2HB GLN 59 -13.313 -4.269 11.208 439 HG2 GLN 59 1HG GLN 59 -10.843 -3.682 10.456 440 HG3 GLN 59 2HG GLN 59 -11.604 -3.663 8.866 441 HE21 GLN 59 1HE2 GLN 59 -10.453 -1.445 10.252 442 HE22 GLN 59 2HE2 GLN 59 -11.714 -0.293 10.510 443 H ARG 60 H ARG 60 -9.739 -6.045 11.852 444 HA ARG 60 HA ARG 60 -10.734 -6.183 14.600 445 HB2 ARG 60 1HB ARG 60 -7.967 -6.631 13.468 446 HB3 ARG 60 2HB ARG 60 -8.392 -6.783 15.167 447 HG2 ARG 60 1HG ARG 60 -9.793 -8.392 13.066 448 HG3 ARG 60 2HG ARG 60 -8.254 -8.911 13.755 449 HD2 ARG 60 1HD ARG 60 -9.432 -8.518 16.032 450 HD3 ARG 60 2HD ARG 60 -10.917 -8.600 15.084 451 HE ARG 60 HE ARG 60 -9.127 -10.803 14.629 452 HH11 ARG 60 2HH1 ARG 60 -11.697 -9.562 16.623 453 HH12 ARG 60 1HH1 ARG 60 -12.230 -11.127 17.138 454 HH21 ARG 60 2HH2 ARG 60 -9.820 -12.870 15.299 455 HH22 ARG 60 1HH2 ARG 60 -11.161 -13.009 16.385 456 H GLU 61 H GLU 61 -8.480 -4.316 12.594 457 HA GLU 61 HA GLU 61 -8.619 -2.164 14.603 458 HB2 GLU 61 1HB GLU 61 -6.290 -2.882 12.814 459 HB3 GLU 61 2HB GLU 61 -6.349 -1.491 13.887 460 HG2 GLU 61 1HG GLU 61 -6.400 -4.388 14.695 461 HG3 GLU 61 2HG GLU 61 -5.065 -3.255 14.898 462 H ARG 62 H ARG 62 -7.798 -0.017 13.471 463 HA ARG 62 HA ARG 62 -9.782 0.745 11.656 464 HB2 ARG 62 1HB ARG 62 -8.521 2.827 11.405 465 HB3 ARG 62 2HB ARG 62 -8.606 2.341 13.092 466 HG2 ARG 62 1HG ARG 62 -6.345 1.568 13.054 467 HG3 ARG 62 2HG ARG 62 -6.244 1.805 11.309 468 HD2 ARG 62 1HD ARG 62 -5.210 3.711 12.050 469 HD3 ARG 62 2HD ARG 62 -6.876 4.275 11.929 470 HE ARG 62 HE ARG 62 -6.684 3.384 14.485 471 HH11 ARG 62 2HH1 ARG 62 -4.843 5.624 12.559 472 HH12 ARG 62 1HH1 ARG 62 -4.383 6.608 13.908 473 HH21 ARG 62 2HH2 ARG 62 -6.085 4.672 16.270 474 HH22 ARG 62 1HH2 ARG 62 -5.090 6.065 16.019 475 H PHE 63 H PHE 63 -6.416 -0.206 11.130 476 HA PHE 63 HA PHE 63 -6.984 -0.321 8.240 477 HB2 PHE 63 1HB PHE 63 -4.408 0.350 9.668 478 HB3 PHE 63 2HB PHE 63 -4.490 -0.022 7.949 479 HD1 PHE 63 2HD PHE 63 -6.536 1.372 6.773 480 HD2 PHE 63 1HD PHE 63 -4.250 2.573 10.156 481 HE1 PHE 63 2HE PHE 63 -7.064 3.726 6.289 482 HE2 PHE 63 1HE PHE 63 -4.775 4.929 9.678 483 HZ PHE 63 HZ PHE 63 -6.182 5.508 7.741 484 H LEU 64 H LEU 64 -7.629 -2.448 9.896 485 HA LEU 64 HA LEU 64 -5.815 -4.487 8.859 486 HB2 LEU 64 1HB LEU 64 -5.172 -3.898 11.224 487 HB3 LEU 64 2HB LEU 64 -6.743 -4.524 11.722 488 HG LEU 64 HG LEU 64 -5.973 -6.707 10.560 489 HD11 LEU 64 1HD1 LEU 64 -3.783 -5.140 9.945 490 HD12 LEU 64 2HD1 LEU 64 -3.878 -6.897 9.837 491 HD13 LEU 64 3HD1 LEU 64 -3.225 -6.138 11.288 492 HD21 LEU 64 1HD2 LEU 64 -4.325 -6.290 12.963 493 HD22 LEU 64 2HD2 LEU 64 -5.555 -7.508 12.624 494 HD23 LEU 64 3HD2 LEU 64 -6.034 -5.887 13.132 495 H LEU 65 H LEU 65 -6.784 -6.466 8.449 496 HA LEU 65 HA LEU 65 -9.574 -6.851 9.187 497 HB2 LEU 65 1HB LEU 65 -8.579 -6.470 6.395 498 HB3 LEU 65 2HB LEU 65 -9.955 -7.528 6.702 499 HG LEU 65 HG LEU 65 -10.034 -4.753 7.780 500 HD11 LEU 65 1HD1 LEU 65 -9.236 -4.506 5.461 501 HD12 LEU 65 2HD1 LEU 65 -10.865 -3.872 5.692 502 HD13 LEU 65 3HD1 LEU 65 -10.630 -5.432 4.905 503 HD21 LEU 65 1HD2 LEU 65 -11.939 -6.881 6.943 504 HD22 LEU 65 2HD2 LEU 65 -12.457 -5.198 6.852 505 HD23 LEU 65 3HD2 LEU 65 -11.931 -5.877 8.393 506 H PHE 66 H PHE 66 -10.051 -8.939 9.550 507 HA PHE 66 HA PHE 66 -7.927 -10.893 9.149 508 HB2 PHE 66 1HB PHE 66 -9.162 -10.599 11.354 509 HB3 PHE 66 2HB PHE 66 -10.555 -11.332 10.565 510 HD1 PHE 66 1HD PHE 66 -10.501 -13.680 9.879 511 HD2 PHE 66 2HD PHE 66 -7.272 -11.903 12.008 512 HE1 PHE 66 1HE PHE 66 -9.633 -15.917 10.422 513 HE2 PHE 66 2HE PHE 66 -6.398 -14.137 12.553 514 HZ PHE 66 HZ PHE 66 -7.578 -16.148 11.760 515 H CYS 67 H CYS 67 -8.010 -11.420 6.990 516 HA CYS 67 HA CYS 67 -10.523 -12.218 5.783 517 HB2 CYS 67 1HB CYS 67 -7.714 -12.216 4.659 518 HB3 CYS 67 2HB CYS 67 -9.180 -12.534 3.739 519 HG CYS 67 HG CYS 67 -9.831 -9.731 5.073 520 H VAL 68 H VAL 68 -11.140 -14.266 5.279 521 HA VAL 68 HA VAL 68 -9.288 -16.475 5.755 522 HB VAL 68 HB VAL 68 -10.488 -16.108 7.894 523 HG11 VAL 68 1HG1 VAL 68 -13.021 -17.161 6.818 524 HG12 VAL 68 2HG1 VAL 68 -12.732 -15.973 8.090 525 HG13 VAL 68 3HG1 VAL 68 -12.644 -15.492 6.395 526 HG21 VAL 68 1HG2 VAL 68 -9.854 -18.426 6.750 527 HG22 VAL 68 2HG2 VAL 68 -10.644 -18.337 8.324 528 HG23 VAL 68 3HG2 VAL 68 -11.597 -18.663 6.876 529 H HIS 69 H HIS 69 -9.712 -18.300 4.557 530 HA HIS 69 HA HIS 69 -12.062 -18.200 2.784 531 HB2 HIS 69 1HB HIS 69 -10.179 -17.581 1.432 532 HB3 HIS 69 2HB HIS 69 -9.213 -18.908 2.070 533 HD1 HIS 69 1HD HIS 69 -9.078 -20.855 0.563 534 HD2 HIS 69 2HD HIS 69 -12.572 -18.689 -0.035 535 HE1 HIS 69 1HE HIS 69 -10.255 -21.993 -1.346 536 HE2 HIS 69 2HE HIS 69 -12.325 -20.614 -1.745 537 H GLY 70 H GLY 70 -13.348 -19.795 3.467 538 HA2 GLY 70 1HA GLY 70 -12.099 -22.416 4.021 539 HA3 GLY 70 2HA GLY 70 -13.502 -21.818 4.894 540 H ASP 71 H ASP 71 -12.341 -23.138 1.874 541 HA ASP 71 HA ASP 71 -14.477 -23.020 0.206 542 HB2 ASP 71 1HB ASP 71 -12.749 -25.446 0.735 543 HB3 ASP 71 2HB ASP 71 -13.787 -25.239 -0.673 544 H GLY 72 H GLY 72 -14.195 -24.962 3.109 545 HA2 GLY 72 1HA GLY 72 -16.975 -25.217 3.441 546 HA3 GLY 72 2HA GLY 72 -16.368 -26.691 2.701 547 H HIS 73 H HIS 73 -13.808 -26.627 4.042 548 HA HIS 73 HA HIS 73 -14.456 -26.787 6.875 549 HB2 HIS 73 1HB HIS 73 -13.944 -29.138 5.127 550 HB3 HIS 73 2HB HIS 73 -13.198 -29.143 6.723 551 HD1 HIS 73 1HD HIS 73 -14.707 -29.552 8.724 552 HD2 HIS 73 2HD HIS 73 -16.790 -29.194 5.147 553 HE1 HIS 73 1HE HIS 73 -17.061 -30.267 9.243 554 HE2 HIS 73 2HE HIS 73 -18.282 -30.123 7.045 555 H ALA 74 H ALA 74 -12.335 -27.762 8.009 556 HA ALA 74 HA ALA 74 -10.324 -25.835 7.639 557 HB1 ALA 74 1HB ALA 74 -9.075 -27.861 9.008 558 HB2 ALA 74 2HB ALA 74 -10.036 -26.570 9.729 559 HB3 ALA 74 3HB ALA 74 -10.778 -28.130 9.376 560 H GLU 75 H GLU 75 -10.721 -29.081 6.381 561 HA GLU 75 HA GLU 75 -8.246 -29.821 5.569 562 HB2 GLU 75 1HB GLU 75 -10.791 -29.975 3.946 563 HB3 GLU 75 2HB GLU 75 -9.320 -30.865 3.577 564 HG2 GLU 75 1HG GLU 75 -10.855 -31.120 6.151 565 HG3 GLU 75 2HG GLU 75 -11.044 -32.192 4.765 566 H ASN 76 H ASN 76 -10.341 -27.488 3.909 567 HA ASN 76 HA ASN 76 -7.977 -26.573 2.407 568 HB2 ASN 76 1HB ASN 76 -9.931 -25.751 0.781 569 HB3 ASN 76 2HB ASN 76 -9.214 -27.354 0.647 570 HD21 ASN 76 1HD2 ASN 76 -11.593 -25.950 2.870 571 HD22 ASN 76 2HD2 ASN 76 -12.821 -27.126 2.569 572 H LEU 77 H LEU 77 -8.635 -25.565 4.922 573 HA LEU 77 HA LEU 77 -9.919 -22.984 4.386 574 HB2 LEU 77 1HB LEU 77 -10.787 -24.171 6.292 575 HB3 LEU 77 2HB LEU 77 -9.168 -24.354 6.962 576 HG LEU 77 HG LEU 77 -9.193 -21.743 6.999 577 HD11 LEU 77 1HD1 LEU 77 -11.810 -22.308 6.055 578 HD12 LEU 77 2HD1 LEU 77 -11.080 -20.743 6.415 579 HD13 LEU 77 3HD1 LEU 77 -11.942 -21.624 7.676 580 HD21 LEU 77 1HD2 LEU 77 -8.985 -22.807 9.044 581 HD22 LEU 77 2HD2 LEU 77 -10.527 -23.649 8.881 582 HD23 LEU 77 3HD2 LEU 77 -10.498 -21.920 9.231 583 H VAL 78 H VAL 78 -8.900 -21.026 4.851 584 HA VAL 78 HA VAL 78 -6.085 -21.077 5.620 585 HB VAL 78 HB VAL 78 -7.068 -19.866 3.035 586 HG11 VAL 78 1HG1 VAL 78 -4.756 -19.083 2.731 587 HG12 VAL 78 2HG1 VAL 78 -5.536 -18.330 4.123 588 HG13 VAL 78 3HG1 VAL 78 -4.369 -19.631 4.362 589 HG21 VAL 78 1HG2 VAL 78 -6.621 -22.254 2.899 590 HG22 VAL 78 2HG2 VAL 78 -5.399 -21.345 2.009 591 HG23 VAL 78 3HG2 VAL 78 -5.020 -22.009 3.598 592 H GLN 79 H GLN 79 -5.673 -19.504 7.024 593 HA GLN 79 HA GLN 79 -7.512 -17.205 7.119 594 HB2 GLN 79 1HB GLN 79 -5.959 -18.563 9.324 595 HB3 GLN 79 2HB GLN 79 -6.790 -17.026 9.528 596 HG2 GLN 79 1HG GLN 79 -8.886 -17.984 9.357 597 HG3 GLN 79 2HG GLN 79 -8.275 -19.414 8.526 598 HE21 GLN 79 1HE2 GLN 79 -8.806 -21.057 9.798 599 HE22 GLN 79 2HE2 GLN 79 -8.428 -21.187 11.479 600 H TRP 80 H TRP 80 -6.709 -15.206 6.903 601 HA TRP 80 HA TRP 80 -3.920 -14.642 7.433 602 HB2 TRP 80 1HB TRP 80 -3.283 -13.991 5.256 603 HB3 TRP 80 2HB TRP 80 -4.097 -15.538 5.041 604 HD1 TRP 80 HD TRP 80 -4.389 -11.859 4.167 605 HE1 TRP 80 1HE TRP 80 -6.324 -11.540 2.500 606 HE3 TRP 80 3HE TRP 80 -6.418 -16.546 4.373 607 HZ2 TRP 80 2HZ TRP 80 -8.433 -13.072 1.417 608 HZ3 TRP 80 3HZ TRP 80 -8.394 -17.038 2.991 609 HH2 TRP 80 HH TRP 80 -9.379 -15.335 1.545 610 H GLU 81 H GLU 81 -3.520 -12.482 7.812 611 HA GLU 81 HA GLU 81 -5.907 -10.765 7.868 612 HB2 GLU 81 1HB GLU 81 -3.382 -10.733 9.521 613 HB3 GLU 81 2HB GLU 81 -4.564 -9.432 9.550 614 HG2 GLU 81 1HG GLU 81 -6.278 -11.053 10.274 615 HG3 GLU 81 2HG GLU 81 -5.032 -12.298 10.337 616 H MET 82 H MET 82 -6.016 -9.246 6.365 617 HA MET 82 HA MET 82 -3.582 -8.392 4.997 618 HB2 MET 82 1HB MET 82 -6.497 -8.312 4.370 619 HB3 MET 82 2HB MET 82 -5.451 -7.114 3.619 620 HG2 MET 82 1HG MET 82 -4.114 -8.842 2.614 621 HG3 MET 82 2HG MET 82 -5.028 -10.088 3.462 622 HE1 MET 82 1HE MET 82 -6.605 -6.969 0.832 623 HE2 MET 82 2HE MET 82 -4.898 -7.292 1.136 624 HE3 MET 82 3HE MET 82 -5.673 -7.939 -0.310 625 H GLU 83 H GLU 83 -2.538 -6.728 5.868 626 HA GLU 83 HA GLU 83 -4.098 -4.586 7.142 627 HB2 GLU 83 1HB GLU 83 -2.400 -5.714 8.550 628 HB3 GLU 83 2HB GLU 83 -1.153 -5.212 7.416 629 HG2 GLU 83 1HG GLU 83 -1.887 -2.833 7.880 630 HG3 GLU 83 2HG GLU 83 -2.817 -3.492 9.225 631 H VAL 84 H VAL 84 -4.072 -2.561 6.358 632 HA VAL 84 HA VAL 84 -2.626 -2.103 3.860 633 HB VAL 84 HB VAL 84 -4.774 -0.443 5.188 634 HG11 VAL 84 1HG1 VAL 84 -3.554 1.054 3.871 635 HG12 VAL 84 2HG1 VAL 84 -3.275 -0.144 2.605 636 HG13 VAL 84 3HG1 VAL 84 -4.882 0.550 2.826 637 HG21 VAL 84 1HG2 VAL 84 -5.734 -1.427 2.786 638 HG22 VAL 84 2HG2 VAL 84 -4.863 -2.792 3.485 639 HG23 VAL 84 3HG2 VAL 84 -6.153 -2.008 4.398 640 H CYS 85 H CYS 85 -0.756 -1.061 3.871 641 HA CYS 85 HA CYS 85 -0.333 1.098 5.808 642 HB2 CYS 85 1HB CYS 85 1.922 0.326 6.300 643 HB3 CYS 85 2HB CYS 85 0.759 -0.933 6.698 644 HG CYS 85 HG CYS 85 1.280 -2.453 4.410 645 H LYS 86 H LYS 86 1.892 2.201 5.213 646 HA LYS 86 HA LYS 86 2.031 2.458 2.282 647 HB2 LYS 86 1HB LYS 86 0.809 4.366 3.172 648 HB3 LYS 86 2HB LYS 86 2.097 4.684 4.327 649 HG2 LYS 86 1HG LYS 86 2.301 6.247 2.545 650 HG3 LYS 86 2HG LYS 86 3.628 5.091 2.404 651 HD2 LYS 86 1HD LYS 86 2.829 5.339 0.215 652 HD3 LYS 86 2HD LYS 86 2.112 3.826 0.777 653 HE2 LYS 86 1HE LYS 86 0.002 4.769 1.010 654 HE3 LYS 86 2HE LYS 86 0.636 6.412 1.086 655 HZ1 LYS 86 1HZ LYS 86 -0.510 5.729 -1.044 656 HZ2 LYS 86 2HZ LYS 86 0.841 4.763 -1.362 657 HZ3 LYS 86 3HZ LYS 86 1.017 6.438 -1.210 658 H LEU 87 H LEU 87 4.037 2.636 1.395 659 HA LEU 87 HA LEU 87 6.349 3.119 3.083 660 HB2 LEU 87 1HB LEU 87 7.445 1.031 2.071 661 HB3 LEU 87 2HB LEU 87 6.332 0.829 3.423 662 HG LEU 87 HG LEU 87 5.370 0.505 0.605 663 HD11 LEU 87 1HD1 LEU 87 6.015 -1.998 1.888 664 HD12 LEU 87 2HD1 LEU 87 7.455 -1.007 1.653 665 HD13 LEU 87 3HD1 LEU 87 6.433 -1.417 0.276 666 HD21 LEU 87 1HD2 LEU 87 3.478 -0.006 1.639 667 HD22 LEU 87 2HD2 LEU 87 4.245 0.294 3.198 668 HD23 LEU 87 3HD2 LEU 87 4.286 -1.322 2.492 669 HA PRO 88 HA PRO 88 7.797 5.083 -0.576 670 HB2 PRO 88 1HB PRO 88 10.465 5.074 -0.073 671 HB3 PRO 88 2HB PRO 88 9.332 6.138 0.770 672 HG2 PRO 88 1HG PRO 88 10.521 3.542 1.671 673 HG3 PRO 88 2HG PRO 88 10.287 5.043 2.586 674 HD2 PRO 88 1HD PRO 88 8.616 2.925 2.811 675 HD3 PRO 88 2HD PRO 88 8.060 4.602 2.984 676 H ARG 89 H ARG 89 8.995 1.940 0.361 677 HA ARG 89 HA ARG 89 10.717 1.162 -1.550 678 HB2 ARG 89 1HB ARG 89 8.294 -0.453 -0.731 679 HB3 ARG 89 2HB ARG 89 9.781 -1.091 -1.419 680 HG2 ARG 89 1HG ARG 89 10.966 -0.105 0.594 681 HG3 ARG 89 2HG ARG 89 9.361 0.130 1.288 682 HD2 ARG 89 1HD ARG 89 10.042 -1.934 2.134 683 HD3 ARG 89 2HD ARG 89 8.993 -2.356 0.781 684 HE ARG 89 HE ARG 89 11.814 -2.193 0.158 685 HH11 ARG 89 2HH1 ARG 89 9.152 -4.218 1.124 686 HH12 ARG 89 1HH1 ARG 89 9.903 -5.685 0.588 687 HH21 ARG 89 2HH2 ARG 89 12.813 -4.117 -0.551 688 HH22 ARG 89 1HH2 ARG 89 11.986 -5.626 -0.363 689 H LEU 90 H LEU 90 7.181 0.987 -2.009 690 HA LEU 90 HA LEU 90 7.653 1.096 -4.914 691 HB2 LEU 90 1HB LEU 90 5.159 0.063 -3.599 692 HB3 LEU 90 2HB LEU 90 5.694 -0.170 -5.261 693 HG LEU 90 HG LEU 90 7.247 -1.319 -2.967 694 HD11 LEU 90 1HD1 LEU 90 5.142 -2.879 -4.412 695 HD12 LEU 90 2HD1 LEU 90 4.747 -1.955 -2.963 696 HD13 LEU 90 3HD1 LEU 90 5.952 -3.240 -2.887 697 HD21 LEU 90 1HD2 LEU 90 8.104 -1.172 -5.368 698 HD22 LEU 90 2HD2 LEU 90 6.887 -2.391 -5.749 699 HD23 LEU 90 3HD2 LEU 90 8.160 -2.749 -4.582 700 H SER 91 H SER 91 7.376 3.327 -2.960 701 HA SER 91 HA SER 91 6.128 5.232 -2.591 702 HB2 SER 91 1HB SER 91 6.168 6.600 -4.477 703 HB3 SER 91 2HB SER 91 7.366 5.374 -4.890 704 HG SER 91 HG SER 91 6.061 5.507 -6.640 705 H LEU 92 H LEU 92 4.526 2.807 -2.518 706 HA LEU 92 HA LEU 92 1.929 4.047 -2.873 707 HB2 LEU 92 1HB LEU 92 2.792 1.581 -4.351 708 HB3 LEU 92 2HB LEU 92 1.096 1.908 -4.001 709 HG LEU 92 HG LEU 92 2.920 3.651 -5.658 710 HD11 LEU 92 1HD1 LEU 92 2.443 1.674 -6.884 711 HD12 LEU 92 2HD1 LEU 92 1.372 2.934 -7.497 712 HD13 LEU 92 3HD1 LEU 92 0.747 1.704 -6.398 713 HD21 LEU 92 1HD2 LEU 92 0.443 4.196 -4.332 714 HD22 LEU 92 2HD2 LEU 92 0.200 4.239 -6.079 715 HD23 LEU 92 3HD2 LEU 92 1.429 5.262 -5.333 716 H ASN 93 H ASN 93 0.172 2.396 -2.124 717 HA ASN 93 HA ASN 93 0.482 1.868 0.541 718 HB2 ASN 93 1HB ASN 93 -1.279 0.498 -1.493 719 HB3 ASN 93 2HB ASN 93 -1.399 0.187 0.236 720 HD21 ASN 93 1HD2 ASN 93 -1.067 2.654 1.309 721 HD22 ASN 93 2HD2 ASN 93 -2.359 3.693 0.822 722 H GLY 94 H GLY 94 0.256 -0.431 1.540 723 HA2 GLY 94 1HA GLY 94 2.142 -2.282 0.237 724 HA3 GLY 94 2HA GLY 94 2.408 -1.789 1.903 725 H VAL 95 H VAL 95 0.431 -3.683 -0.256 726 HA VAL 95 HA VAL 95 -1.126 -4.758 1.972 727 HB VAL 95 HB VAL 95 -1.350 -5.429 -0.964 728 HG11 VAL 95 1HG1 VAL 95 -3.552 -6.291 -0.354 729 HG12 VAL 95 2HG1 VAL 95 -2.274 -7.124 0.532 730 HG13 VAL 95 3HG1 VAL 95 -3.246 -5.891 1.336 731 HG21 VAL 95 1HG2 VAL 95 -2.412 -3.508 -1.296 732 HG22 VAL 95 2HG2 VAL 95 -3.535 -3.874 0.014 733 HG23 VAL 95 3HG2 VAL 95 -2.027 -3.026 0.357 734 H ARG 96 H ARG 96 -0.122 -6.300 3.097 735 HA ARG 96 HA ARG 96 1.425 -8.327 1.625 736 HB2 ARG 96 1HB ARG 96 2.661 -8.731 3.662 737 HB3 ARG 96 2HB ARG 96 2.694 -7.011 3.300 738 HG2 ARG 96 1HG ARG 96 0.842 -6.699 4.935 739 HG3 ARG 96 2HG ARG 96 1.012 -8.401 5.370 740 HD2 ARG 96 1HD ARG 96 2.305 -7.331 6.969 741 HD3 ARG 96 2HD ARG 96 3.496 -7.811 5.761 742 HE ARG 96 HE ARG 96 2.706 -5.271 5.061 743 HH11 ARG 96 2HH1 ARG 96 4.159 -6.789 7.836 744 HH12 ARG 96 1HH1 ARG 96 5.035 -5.374 8.315 745 HH21 ARG 96 2HH2 ARG 96 3.855 -3.400 5.681 746 HH22 ARG 96 1HH2 ARG 96 4.861 -3.446 7.089 747 H PHE 97 H PHE 97 1.132 -10.518 2.099 748 HA PHE 97 HA PHE 97 -1.424 -11.129 3.423 749 HB2 PHE 97 1HB PHE 97 0.067 -12.538 1.209 750 HB3 PHE 97 2HB PHE 97 -1.281 -13.277 2.067 751 HD1 PHE 97 1HD PHE 97 -0.609 -9.910 0.596 752 HD2 PHE 97 2HD PHE 97 -3.214 -13.267 0.846 753 HE1 PHE 97 1HE PHE 97 -2.185 -8.798 -0.932 754 HE2 PHE 97 2HE PHE 97 -4.792 -12.161 -0.682 755 HZ PHE 97 HZ PHE 97 -4.279 -9.924 -1.574 756 H LYS 98 H LYS 98 -1.212 -11.943 5.391 757 HA LYS 98 HA LYS 98 1.189 -13.510 6.037 758 HB2 LYS 98 1HB LYS 98 0.929 -11.635 7.502 759 HB3 LYS 98 2HB LYS 98 -0.767 -12.012 7.780 760 HG2 LYS 98 1HG LYS 98 -0.006 -14.154 8.851 761 HG3 LYS 98 2HG LYS 98 1.640 -13.522 8.760 762 HD2 LYS 98 1HD LYS 98 1.150 -11.746 10.227 763 HD3 LYS 98 2HD LYS 98 -0.591 -11.985 10.063 764 HE2 LYS 98 1HE LYS 98 -0.236 -14.260 11.121 765 HE3 LYS 98 2HE LYS 98 1.396 -13.720 11.510 766 HZ1 LYS 98 1HZ LYS 98 0.488 -11.925 12.805 767 HZ2 LYS 98 2HZ LYS 98 -0.175 -13.385 13.343 768 HZ3 LYS 98 3HZ LYS 98 -1.092 -12.347 12.372 769 H ARG 99 H ARG 99 0.989 -15.640 6.125 770 HA ARG 99 HA ARG 99 -1.622 -16.875 6.153 771 HB2 ARG 99 1HB ARG 99 0.082 -17.793 4.690 772 HB3 ARG 99 2HB ARG 99 1.160 -18.052 6.055 773 HG2 ARG 99 1HG ARG 99 -0.389 -19.699 6.974 774 HG3 ARG 99 2HG ARG 99 -1.478 -19.434 5.611 775 HD2 ARG 99 1HD ARG 99 -0.302 -21.335 4.982 776 HD3 ARG 99 2HD ARG 99 0.562 -20.040 4.154 777 HE ARG 99 HE ARG 99 1.530 -21.661 6.354 778 HH11 ARG 99 2HH1 ARG 99 1.970 -18.822 4.388 779 HH12 ARG 99 1HH1 ARG 99 3.654 -18.663 4.764 780 HH21 ARG 99 2HH2 ARG 99 3.746 -21.463 6.856 781 HH22 ARG 99 1HH2 ARG 99 4.663 -20.166 6.167 782 H ILE 100 H ILE 100 -2.616 -16.872 8.083 783 HA ILE 100 HA ILE 100 -1.187 -17.188 10.555 784 HB ILE 100 HB ILE 100 -4.155 -17.175 9.996 785 HG12 ILE 100 1HG1 ILE 100 -2.251 -15.042 10.978 786 HG13 ILE 100 2HG1 ILE 100 -3.144 -15.046 9.462 787 HG21 ILE 100 1HG2 ILE 100 -4.558 -17.106 12.299 788 HG22 ILE 100 2HG2 ILE 100 -3.337 -18.362 12.108 789 HG23 ILE 100 3HG2 ILE 100 -2.870 -16.759 12.674 790 HD11 ILE 100 1HD1 ILE 100 -4.602 -15.124 12.064 791 HD12 ILE 100 2HD1 ILE 100 -3.981 -13.602 11.426 792 HD13 ILE 100 3HD1 ILE 100 -5.145 -14.540 10.491 793 H SER 101 H SER 101 -3.453 -19.176 8.676 794 HA SER 101 HA SER 101 -2.213 -21.595 9.567 795 HB2 SER 101 1HB SER 101 -3.905 -20.746 11.423 796 HB3 SER 101 2HB SER 101 -5.097 -21.470 10.344 797 HG SER 101 HG SER 101 -2.856 -23.007 10.877 798 H GLY 102 H GLY 102 -3.301 -23.534 8.643 799 HA2 GLY 102 1HA GLY 102 -4.968 -24.396 7.092 800 HA3 GLY 102 2HA GLY 102 -4.909 -22.847 6.264 801 H THR 103 H THR 103 -4.574 -24.148 4.334 802 HA THR 103 HA THR 103 -1.948 -25.410 4.104 803 HB THR 103 HB THR 103 -2.700 -26.256 1.955 804 HG1 THR 103 1HG THR 103 -3.984 -24.477 1.304 805 HG21 THR 103 1HG2 THR 103 -4.072 -26.758 4.448 806 HG22 THR 103 2HG2 THR 103 -3.576 -27.893 3.192 807 HG23 THR 103 3HG2 THR 103 -5.128 -27.066 3.070 808 H SER 104 H SER 104 -0.384 -24.764 2.634 809 HA SER 104 HA SER 104 -0.196 -21.984 2.142 810 HB2 SER 104 1HB SER 104 1.457 -24.170 0.862 811 HB3 SER 104 2HB SER 104 1.909 -22.479 1.073 812 HG SER 104 HG SER 104 1.252 -24.058 3.307 813 H ILE 105 H ILE 105 -0.639 -24.746 -0.060 814 HA ILE 105 HA ILE 105 -0.690 -23.624 -2.498 815 HB ILE 105 HB ILE 105 -2.666 -25.608 -1.382 816 HG12 ILE 105 1HG1 ILE 105 -0.256 -26.252 -1.514 817 HG13 ILE 105 2HG1 ILE 105 -1.305 -27.250 -2.515 818 HG21 ILE 105 1HG2 ILE 105 -3.345 -26.116 -3.645 819 HG22 ILE 105 2HG2 ILE 105 -3.647 -24.413 -3.302 820 HG23 ILE 105 3HG2 ILE 105 -2.256 -24.882 -4.279 821 HD11 ILE 105 1HD1 ILE 105 -0.249 -26.659 -4.380 822 HD12 ILE 105 2HD1 ILE 105 -0.229 -24.953 -3.934 823 HD13 ILE 105 3HD1 ILE 105 1.014 -26.041 -3.317 824 H ALA 106 H ALA 106 -3.679 -23.829 -0.555 825 HA ALA 106 HA ALA 106 -5.243 -22.171 -2.133 826 HB1 ALA 106 1HB ALA 106 -5.342 -23.104 0.668 827 HB2 ALA 106 2HB ALA 106 -6.321 -21.692 0.273 828 HB3 ALA 106 3HB ALA 106 -6.556 -23.202 -0.607 829 H PHE 107 H PHE 107 -3.090 -21.332 0.548 830 HA PHE 107 HA PHE 107 -3.703 -18.692 0.943 831 HB2 PHE 107 1HB PHE 107 -1.967 -20.053 2.169 832 HB3 PHE 107 2HB PHE 107 -0.873 -19.743 0.825 833 HD1 PHE 107 1HD PHE 107 -2.891 -18.070 3.444 834 HD2 PHE 107 2HD PHE 107 0.371 -17.772 0.726 835 HE1 PHE 107 1HE PHE 107 -2.220 -15.945 4.488 836 HE2 PHE 107 2HE PHE 107 1.048 -15.648 1.766 837 HZ PHE 107 HZ PHE 107 -0.247 -14.732 3.650 838 H LYS 108 H LYS 108 -1.512 -20.022 -1.516 839 HA LYS 108 HA LYS 108 -1.053 -17.433 -2.698 840 HB2 LYS 108 1HB LYS 108 -0.261 -20.234 -3.487 841 HB3 LYS 108 2HB LYS 108 0.122 -18.828 -4.472 842 HG2 LYS 108 1HG LYS 108 2.043 -18.939 -3.288 843 HG3 LYS 108 2HG LYS 108 1.102 -17.965 -2.155 844 HD2 LYS 108 1HD LYS 108 1.762 -19.544 -0.679 845 HD3 LYS 108 2HD LYS 108 0.398 -20.440 -1.352 846 HE2 LYS 108 1HE LYS 108 3.081 -20.648 -2.645 847 HE3 LYS 108 2HE LYS 108 2.759 -21.552 -1.167 848 HZ1 LYS 108 1HZ LYS 108 2.289 -22.657 -3.420 849 HZ2 LYS 108 2HZ LYS 108 0.893 -21.702 -3.444 850 HZ3 LYS 108 3HZ LYS 108 1.136 -22.814 -2.192 851 H ASN 109 H ASN 109 -2.786 -20.395 -3.621 852 HA ASN 109 HA ASN 109 -3.682 -19.694 -6.120 853 HB2 ASN 109 1HB ASN 109 -4.790 -21.404 -3.940 854 HB3 ASN 109 2HB ASN 109 -5.829 -21.037 -5.314 855 HD21 ASN 109 1HD2 ASN 109 -2.923 -22.621 -4.255 856 HD22 ASN 109 2HD2 ASN 109 -2.685 -23.574 -5.676 857 H ILE 110 H ILE 110 -4.904 -18.653 -2.995 858 HA ILE 110 HA ILE 110 -7.114 -17.205 -4.206 859 HB ILE 110 HB ILE 110 -7.413 -18.348 -2.030 860 HG12 ILE 110 1HG1 ILE 110 -8.457 -16.375 -0.852 861 HG13 ILE 110 2HG1 ILE 110 -7.729 -15.342 -2.077 862 HG21 ILE 110 1HG2 ILE 110 -4.992 -17.005 -1.408 863 HG22 ILE 110 2HG2 ILE 110 -6.236 -16.434 -0.297 864 HG23 ILE 110 3HG2 ILE 110 -5.893 -18.159 -0.426 865 HD11 ILE 110 1HD1 ILE 110 -10.005 -15.740 -2.663 866 HD12 ILE 110 2HD1 ILE 110 -8.981 -16.617 -3.800 867 HD13 ILE 110 3HD1 ILE 110 -9.796 -17.483 -2.498 868 H ALA 111 H ALA 111 -3.932 -16.593 -2.919 869 HA ALA 111 HA ALA 111 -4.172 -13.787 -2.606 870 HB1 ALA 111 1HB ALA 111 -2.103 -15.773 -2.365 871 HB2 ALA 111 2HB ALA 111 -1.495 -14.333 -3.183 872 HB3 ALA 111 3HB ALA 111 -2.239 -14.193 -1.591 873 H SER 112 H SER 112 -3.295 -15.853 -5.313 874 HA SER 112 HA SER 112 -2.329 -13.801 -7.009 875 HB2 SER 112 1HB SER 112 -2.135 -16.420 -7.185 876 HB3 SER 112 2HB SER 112 -3.626 -16.266 -8.114 877 HG SER 112 HG SER 112 -1.825 -16.147 -9.480 878 H LYS 113 H LYS 113 -5.518 -15.149 -6.419 879 HA LYS 113 HA LYS 113 -6.818 -13.881 -8.603 880 HB2 LYS 113 1HB LYS 113 -7.654 -15.868 -7.244 881 HB3 LYS 113 2HB LYS 113 -8.121 -14.705 -6.010 882 HG2 LYS 113 1HG LYS 113 -10.083 -14.959 -7.166 883 HG3 LYS 113 2HG LYS 113 -9.389 -13.550 -7.971 884 HD2 LYS 113 1HD LYS 113 -10.126 -14.940 -9.715 885 HD3 LYS 113 2HD LYS 113 -8.383 -15.206 -9.632 886 HE2 LYS 113 1HE LYS 113 -8.908 -17.191 -8.140 887 HE3 LYS 113 2HE LYS 113 -10.590 -16.985 -8.624 888 HZ1 LYS 113 1HZ LYS 113 -10.082 -18.270 -10.347 889 HZ2 LYS 113 2HZ LYS 113 -8.418 -18.152 -10.068 890 HZ3 LYS 113 3HZ LYS 113 -9.209 -16.963 -10.975 891 H ILE 114 H ILE 114 -7.024 -13.167 -5.110 892 HA ILE 114 HA ILE 114 -8.427 -10.860 -5.111 893 HB ILE 114 HB ILE 114 -5.920 -11.321 -3.490 894 HG12 ILE 114 1HG1 ILE 114 -7.642 -13.124 -3.327 895 HG13 ILE 114 2HG1 ILE 114 -7.366 -12.277 -1.809 896 HG21 ILE 114 1HG2 ILE 114 -7.733 -9.862 -1.985 897 HG22 ILE 114 2HG2 ILE 114 -6.267 -9.251 -2.749 898 HG23 ILE 114 3HG2 ILE 114 -7.813 -9.133 -3.589 899 HD11 ILE 114 1HD1 ILE 114 -9.658 -12.448 -1.879 900 HD12 ILE 114 2HD1 ILE 114 -9.389 -10.836 -2.544 901 HD13 ILE 114 3HD1 ILE 114 -9.730 -12.190 -3.622 902 H ALA 115 H ALA 115 -5.068 -11.227 -6.084 903 HA ALA 115 HA ALA 115 -4.457 -8.472 -6.290 904 HB1 ALA 115 1HB ALA 115 -3.154 -10.550 -8.005 905 HB2 ALA 115 2HB ALA 115 -2.448 -9.121 -7.250 906 HB3 ALA 115 3HB ALA 115 -2.877 -10.518 -6.263 907 H ASN 116 H ASN 116 -5.732 -10.835 -8.590 908 HA ASN 116 HA ASN 116 -5.601 -9.259 -10.900 909 HB2 ASN 116 1HB ASN 116 -6.716 -10.964 -11.913 910 HB3 ASN 116 2HB ASN 116 -6.341 -11.806 -10.413 911 HD21 ASN 116 1HD2 ASN 116 -7.995 -12.918 -9.701 912 HD22 ASN 116 2HD2 ASN 116 -9.656 -12.449 -9.783 913 H GLU 117 H GLU 117 -8.151 -9.580 -8.460 914 HA GLU 117 HA GLU 117 -9.977 -7.834 -9.768 915 HB2 GLU 117 1HB GLU 117 -9.869 -8.550 -6.834 916 HB3 GLU 117 2HB GLU 117 -11.254 -7.916 -7.711 917 HG2 GLU 117 1HG GLU 117 -9.996 -10.629 -7.936 918 HG3 GLU 117 2HG GLU 117 -11.640 -10.219 -7.448 919 H LEU 118 H LEU 118 -7.631 -7.408 -7.146 920 HA LEU 118 HA LEU 118 -8.246 -4.596 -6.888 921 HB2 LEU 118 1HB LEU 118 -6.271 -6.444 -5.592 922 HB3 LEU 118 2HB LEU 118 -6.185 -4.699 -5.354 923 HG LEU 118 HG LEU 118 -8.731 -6.154 -4.768 924 HD11 LEU 118 1HD1 LEU 118 -6.784 -5.773 -2.568 925 HD12 LEU 118 2HD1 LEU 118 -6.529 -7.138 -3.654 926 HD13 LEU 118 3HD1 LEU 118 -8.047 -6.987 -2.770 927 HD21 LEU 118 1HD2 LEU 118 -7.855 -4.071 -2.962 928 HD22 LEU 118 2HD2 LEU 118 -9.345 -4.201 -3.896 929 HD23 LEU 118 3HD2 LEU 118 -7.899 -3.510 -4.634 930 H LYS 119 H LYS 119 -7.090 -5.846 -9.408 931 HA LYS 119 HA LYS 119 -5.379 -5.495 -10.915 932 HB2 LYS 119 1HB LYS 119 -6.365 -2.817 -10.007 933 HB3 LYS 119 2HB LYS 119 -5.054 -2.906 -11.175 934 HG2 LYS 119 1HG LYS 119 -7.034 -2.681 -12.425 935 HG3 LYS 119 2HG LYS 119 -6.557 -4.374 -12.571 936 HD2 LYS 119 1HD LYS 119 -8.149 -4.914 -10.733 937 HD3 LYS 119 2HD LYS 119 -8.691 -3.234 -10.768 938 HE2 LYS 119 1HE LYS 119 -10.232 -4.490 -12.069 939 HE3 LYS 119 2HE LYS 119 -9.239 -3.567 -13.196 940 HZ1 LYS 119 1HZ LYS 119 -7.838 -5.650 -13.362 941 HZ2 LYS 119 2HZ LYS 119 -9.365 -5.711 -14.086 942 HZ3 LYS 119 3HZ LYS 119 -9.108 -6.460 -12.592 943 H LEU 120 H LEU 120 -4.317 -6.178 -8.389 944 HA LEU 120 HA LEU 120 -2.167 -4.349 -7.785 945 HB2 LEU 120 1HB LEU 120 -2.721 -7.140 -6.789 946 HB3 LEU 120 2HB LEU 120 -1.481 -6.059 -6.157 947 HG LEU 120 HG LEU 120 -4.451 -5.536 -6.040 948 HD11 LEU 120 1HD1 LEU 120 -4.459 -6.992 -4.359 949 HD12 LEU 120 2HD1 LEU 120 -3.476 -5.828 -3.470 950 HD13 LEU 120 3HD1 LEU 120 -2.700 -7.132 -4.370 951 HD21 LEU 120 1HD2 LEU 120 -2.749 -4.110 -4.184 952 HD22 LEU 120 2HD2 LEU 120 -3.972 -3.494 -5.296 953 HD23 LEU 120 3HD2 LEU 120 -2.322 -3.766 -5.860 954 H SER 121 H SER 121 0.074 -5.558 -7.452 955 HA SER 121 HA SER 121 1.181 -5.947 -9.963 956 HB2 SER 121 1HB SER 121 2.384 -5.448 -7.769 957 HB3 SER 121 2HB SER 121 2.307 -7.181 -7.447 958 HG SER 121 HG SER 121 4.174 -7.029 -8.490 959 H GLY 122 H GLY 122 0.262 -8.410 -7.560 960 HA2 GLY 122 1HA GLY 122 -0.334 -10.613 -7.825 961 HA3 GLY 122 2HA GLY 122 -0.605 -10.255 -9.524 962 HA PRO 123 HA PRO 123 4.065 -11.457 -9.173 963 HB2 PRO 123 1HB PRO 123 4.911 -12.385 -6.766 964 HB3 PRO 123 2HB PRO 123 4.969 -10.676 -7.210 965 HG2 PRO 123 1HG PRO 123 2.951 -12.134 -5.548 966 HG3 PRO 123 2HG PRO 123 3.694 -10.548 -5.270 967 HD2 PRO 123 1HD PRO 123 1.207 -10.831 -6.303 968 HD3 PRO 123 2HD PRO 123 2.277 -9.486 -6.746 969 H SER 124 H SER 124 2.944 -13.118 -10.413 970 HA SER 124 HA SER 124 2.966 -15.726 -9.040 971 HB2 SER 124 1HB SER 124 1.105 -16.459 -10.352 972 HB3 SER 124 2HB SER 124 0.667 -14.883 -9.693 973 HG SER 124 HG SER 124 0.910 -15.655 -12.274 974 H SER 125 H SER 125 3.524 -17.559 -10.369 975 HA SER 125 HA SER 125 5.811 -17.139 -11.934 976 HB2 SER 125 1HB SER 125 5.521 -19.567 -12.564 977 HB3 SER 125 2HB SER 125 5.529 -19.249 -10.830 978 HG SER 125 HG SER 125 3.346 -19.869 -12.507 979 H GLY 126 H GLY 126 2.465 -17.872 -12.867 980 HA2 GLY 126 1HA GLY 126 2.166 -16.368 -15.060 981 HA3 GLY 126 2HA GLY 126 3.134 -17.692 -15.690 Start of MODEL 5 1 H1 MET 1 H MET 1 -34.643 5.864 -49.709 2 HA MET 1 HA MET 1 -34.203 8.470 -48.697 3 HB2 MET 1 1HB MET 1 -35.161 7.998 -46.390 4 HB3 MET 1 2HB MET 1 -36.323 8.366 -47.657 5 HG2 MET 1 1HG MET 1 -35.628 5.534 -47.002 6 HG3 MET 1 2HG MET 1 -36.799 6.425 -46.034 7 HE1 MET 1 1HE MET 1 -39.701 7.004 -47.687 8 HE2 MET 1 2HE MET 1 -39.666 5.307 -47.207 9 HE3 MET 1 3HE MET 1 -38.821 6.516 -46.239 10 H LYS 2 H LYS 2 -32.108 8.306 -48.279 11 HA LYS 2 HA LYS 2 -31.169 6.227 -46.469 12 HB2 LYS 2 1HB LYS 2 -29.923 6.680 -49.187 13 HB3 LYS 2 2HB LYS 2 -29.283 5.626 -47.932 14 HG2 LYS 2 1HG LYS 2 -30.363 4.086 -49.201 15 HG3 LYS 2 2HG LYS 2 -31.684 4.538 -48.120 16 HD2 LYS 2 1HD LYS 2 -32.373 6.230 -49.855 17 HD3 LYS 2 2HD LYS 2 -31.195 5.486 -50.939 18 HE2 LYS 2 1HE LYS 2 -32.352 3.384 -50.841 19 HE3 LYS 2 2HE LYS 2 -33.442 3.991 -49.595 20 HZ1 LYS 2 1HZ LYS 2 -34.761 4.344 -51.369 21 HZ2 LYS 2 2HZ LYS 2 -33.478 4.435 -52.467 22 HZ3 LYS 2 3HZ LYS 2 -33.868 5.774 -51.510 23 H ASP 3 H ASP 3 -28.934 6.643 -45.721 24 HA ASP 3 HA ASP 3 -27.782 9.232 -46.197 25 HB2 ASP 3 1HB ASP 3 -28.959 8.654 -43.469 26 HB3 ASP 3 2HB ASP 3 -27.994 10.064 -43.900 27 H HIS 4 H HIS 4 -25.814 9.573 -44.843 28 HA HIS 4 HA HIS 4 -24.711 7.223 -43.557 29 HB2 HIS 4 1HB HIS 4 -22.603 7.561 -45.106 30 HB3 HIS 4 2HB HIS 4 -23.940 6.535 -45.618 31 HD1 HIS 4 1HD HIS 4 -24.126 6.865 -48.064 32 HD2 HIS 4 2HD HIS 4 -23.584 10.459 -46.051 33 HE1 HIS 4 1HE HIS 4 -24.308 8.654 -49.822 34 HE2 HIS 4 2HE HIS 4 -23.892 10.814 -48.595 35 H LEU 5 H LEU 5 -23.748 7.943 -41.786 36 HA LEU 5 HA LEU 5 -22.411 10.567 -41.877 37 HB2 LEU 5 1HB LEU 5 -24.180 9.329 -39.820 38 HB3 LEU 5 2HB LEU 5 -22.913 10.442 -39.307 39 HG LEU 5 HG LEU 5 -25.161 11.483 -39.562 40 HD11 LEU 5 1HD1 LEU 5 -22.817 12.426 -41.175 41 HD12 LEU 5 2HD1 LEU 5 -23.385 12.993 -39.605 42 HD13 LEU 5 3HD1 LEU 5 -24.301 13.373 -41.063 43 HD21 LEU 5 1HD2 LEU 5 -24.713 11.095 -42.516 44 HD22 LEU 5 2HD2 LEU 5 -26.102 11.842 -41.726 45 HD23 LEU 5 3HD2 LEU 5 -25.811 10.111 -41.549 46 H ILE 6 H ILE 6 -20.285 10.292 -41.822 47 HA ILE 6 HA ILE 6 -19.182 8.291 -39.963 48 HB ILE 6 HB ILE 6 -18.102 8.956 -42.705 49 HG12 ILE 6 1HG1 ILE 6 -18.984 6.233 -41.825 50 HG13 ILE 6 2HG1 ILE 6 -20.193 7.401 -42.346 51 HG21 ILE 6 1HG2 ILE 6 -16.536 8.375 -40.670 52 HG22 ILE 6 2HG2 ILE 6 -17.059 6.730 -41.029 53 HG23 ILE 6 3HG2 ILE 6 -16.248 7.687 -42.268 54 HD11 ILE 6 1HD1 ILE 6 -19.337 7.483 -44.516 55 HD12 ILE 6 2HD1 ILE 6 -17.816 6.729 -44.039 56 HD13 ILE 6 3HD1 ILE 6 -19.298 5.775 -44.080 57 H HIS 7 H HIS 7 -18.227 9.378 -38.376 58 HA HIS 7 HA HIS 7 -16.140 11.270 -38.974 59 HB2 HIS 7 1HB HIS 7 -17.032 13.176 -37.904 60 HB3 HIS 7 2HB HIS 7 -18.327 12.595 -38.946 61 HD1 HIS 7 1HD HIS 7 -20.021 10.842 -37.520 62 HD2 HIS 7 2HD HIS 7 -17.930 13.763 -35.434 63 HE1 HIS 7 1HE HIS 7 -21.250 11.123 -35.344 64 HE2 HIS 7 2HE HIS 7 -20.016 12.956 -34.135 65 H ASN 8 H ASN 8 -14.533 10.855 -37.618 66 HA ASN 8 HA ASN 8 -14.832 10.614 -34.821 67 HB2 ASN 8 1HB ASN 8 -15.651 8.450 -34.971 68 HB3 ASN 8 2HB ASN 8 -14.714 8.084 -36.416 69 HD21 ASN 8 1HD2 ASN 8 -14.396 8.742 -32.962 70 HD22 ASN 8 2HD2 ASN 8 -13.015 7.732 -32.717 71 H VAL 9 H VAL 9 -12.994 11.373 -34.023 72 HA VAL 9 HA VAL 9 -10.465 10.687 -35.351 73 HB VAL 9 HB VAL 9 -9.668 13.029 -34.906 74 HG11 VAL 9 1HG1 VAL 9 -11.429 12.077 -36.991 75 HG12 VAL 9 2HG1 VAL 9 -11.547 13.826 -36.792 76 HG13 VAL 9 3HG1 VAL 9 -9.982 13.077 -37.109 77 HG21 VAL 9 1HG2 VAL 9 -12.599 13.436 -34.354 78 HG22 VAL 9 2HG2 VAL 9 -11.232 13.814 -33.306 79 HG23 VAL 9 3HG2 VAL 9 -11.505 14.755 -34.772 80 H HIS 10 H HIS 10 -9.369 9.567 -33.878 81 HA HIS 10 HA HIS 10 -8.747 10.761 -31.333 82 HB2 HIS 10 1HB HIS 10 -10.985 9.428 -31.131 83 HB3 HIS 10 2HB HIS 10 -9.939 8.012 -31.173 84 HD1 HIS 10 1HD HIS 10 -9.721 11.313 -29.274 85 HD2 HIS 10 2HD HIS 10 -9.553 7.212 -28.631 86 HE1 HIS 10 1HE HIS 10 -9.279 11.036 -26.814 87 HE2 HIS 10 2HE HIS 10 -9.097 8.549 -26.464 88 H LYS 11 H LYS 11 -6.633 10.478 -31.167 89 HA LYS 11 HA LYS 11 -5.285 8.371 -32.599 90 HB2 LYS 11 1HB LYS 11 -4.473 10.796 -32.214 91 HB3 LYS 11 2HB LYS 11 -3.981 10.226 -30.625 92 HG2 LYS 11 1HG LYS 11 -2.751 8.369 -31.958 93 HG3 LYS 11 2HG LYS 11 -2.916 9.487 -33.313 94 HD2 LYS 11 1HD LYS 11 -0.905 10.190 -32.493 95 HD3 LYS 11 2HD LYS 11 -1.978 11.206 -31.527 96 HE2 LYS 11 1HE LYS 11 -1.910 9.390 -29.773 97 HE3 LYS 11 2HE LYS 11 -0.614 8.649 -30.711 98 HZ1 LYS 11 1HZ LYS 11 -0.528 10.909 -28.954 99 HZ2 LYS 11 2HZ LYS 11 0.163 11.244 -30.461 100 HZ3 LYS 11 3HZ LYS 11 0.737 9.948 -29.537 101 H GLU 12 H GLU 12 -3.999 6.734 -31.691 102 HA GLU 12 HA GLU 12 -4.277 6.252 -28.818 103 HB2 GLU 12 1HB GLU 12 -6.114 5.012 -29.802 104 HB3 GLU 12 2HB GLU 12 -5.030 4.269 -30.970 105 HG2 GLU 12 1HG GLU 12 -5.366 2.617 -29.374 106 HG3 GLU 12 2HG GLU 12 -3.801 3.308 -28.950 107 H GLU 13 H GLU 13 -2.559 5.222 -27.892 108 HA GLU 13 HA GLU 13 -0.284 4.674 -29.672 109 HB2 GLU 13 1HB GLU 13 1.167 5.187 -27.860 110 HB3 GLU 13 2HB GLU 13 -0.058 6.447 -27.892 111 HG2 GLU 13 1HG GLU 13 -1.112 5.646 -25.982 112 HG3 GLU 13 2HG GLU 13 -0.362 4.057 -26.120 113 H HIS 14 H HIS 14 1.301 3.030 -28.616 114 HA HIS 14 HA HIS 14 0.130 0.920 -27.076 115 HB2 HIS 14 1HB HIS 14 0.909 0.120 -29.866 116 HB3 HIS 14 2HB HIS 14 -0.044 -0.776 -28.687 117 HD1 HIS 14 1HD HIS 14 -2.549 -0.392 -28.671 118 HD2 HIS 14 2HD HIS 14 -0.520 2.183 -31.223 119 HE1 HIS 14 1HE HIS 14 -4.331 0.761 -30.018 120 HE2 HIS 14 2HE HIS 14 -3.076 2.252 -31.614 121 H ALA 15 H ALA 15 1.816 0.691 -25.744 122 HA ALA 15 HA ALA 15 4.293 -0.353 -26.797 123 HB1 ALA 15 1HB ALA 15 4.281 2.271 -25.310 124 HB2 ALA 15 2HB ALA 15 5.720 1.334 -25.717 125 HB3 ALA 15 3HB ALA 15 4.725 2.023 -26.999 126 H HIS 16 H HIS 16 4.819 -1.982 -25.509 127 HA HIS 16 HA HIS 16 5.000 -1.737 -22.685 128 HB2 HIS 16 1HB HIS 16 3.257 -3.216 -21.979 129 HB3 HIS 16 2HB HIS 16 2.514 -1.989 -23.001 130 HD1 HIS 16 1HD HIS 16 2.752 -5.574 -22.566 131 HD2 HIS 16 2HD HIS 16 2.030 -2.986 -25.735 132 HE1 HIS 16 1HE HIS 16 1.704 -6.987 -24.363 133 HE2 HIS 16 2HE HIS 16 1.354 -5.418 -26.302 134 H ALA 17 H ALA 17 5.281 -4.083 -21.710 135 HA ALA 17 HA ALA 17 6.294 -6.074 -23.499 136 HB1 ALA 17 1HB ALA 17 8.083 -4.108 -23.107 137 HB2 ALA 17 2HB ALA 17 8.468 -5.146 -21.734 138 HB3 ALA 17 3HB ALA 17 8.530 -5.793 -23.373 139 H HIS 18 H HIS 18 7.306 -7.910 -22.269 140 HA HIS 18 HA HIS 18 5.913 -8.212 -19.703 141 HB2 HIS 18 1HB HIS 18 6.377 -10.682 -20.099 142 HB3 HIS 18 2HB HIS 18 5.247 -9.916 -21.211 143 HD1 HIS 18 1HD HIS 18 8.203 -11.979 -21.155 144 HD2 HIS 18 2HD HIS 18 6.579 -9.177 -23.758 145 HE1 HIS 18 1HE HIS 18 9.336 -12.377 -23.364 146 HE2 HIS 18 2HE HIS 18 8.400 -10.615 -24.901 147 H ASN 19 H ASN 19 7.400 -7.236 -18.332 148 HA ASN 19 HA ASN 19 10.077 -8.444 -18.215 149 HB2 ASN 19 1HB ASN 19 9.236 -5.975 -16.714 150 HB3 ASN 19 2HB ASN 19 10.858 -6.481 -17.177 151 HD21 ASN 19 1HD2 ASN 19 10.884 -6.891 -19.725 152 HD22 ASN 19 2HD2 ASN 19 10.337 -5.527 -20.635 153 H LYS 20 H LYS 20 9.882 -10.234 -16.977 154 HA LYS 20 HA LYS 20 8.938 -9.835 -14.221 155 HB2 LYS 20 1HB LYS 20 8.423 -12.291 -15.908 156 HB3 LYS 20 2HB LYS 20 7.952 -12.076 -14.228 157 HG2 LYS 20 1HG LYS 20 6.994 -10.093 -16.221 158 HG3 LYS 20 2HG LYS 20 6.252 -11.695 -16.198 159 HD2 LYS 20 1HD LYS 20 5.519 -11.433 -13.971 160 HD3 LYS 20 2HD LYS 20 6.562 -10.033 -13.710 161 HE2 LYS 20 1HE LYS 20 5.208 -8.848 -15.479 162 HE3 LYS 20 2HE LYS 20 4.083 -10.203 -15.411 163 HZ1 LYS 20 1HZ LYS 20 3.101 -8.980 -13.834 164 HZ2 LYS 20 2HZ LYS 20 4.472 -8.035 -13.543 165 HZ3 LYS 20 3HZ LYS 20 4.326 -9.557 -12.819 166 H ASP 21 H ASP 21 11.298 -9.492 -13.965 167 HA ASP 21 HA ASP 21 12.634 -12.073 -13.521 168 HB2 ASP 21 1HB ASP 21 13.580 -11.047 -15.548 169 HB3 ASP 21 2HB ASP 21 13.947 -9.586 -14.636 170 H TYR 22 H TYR 22 11.958 -11.863 -11.329 171 HA TYR 22 HA TYR 22 13.542 -9.892 -9.817 172 HB2 TYR 22 1HB TYR 22 11.539 -10.352 -8.095 173 HB3 TYR 22 2HB TYR 22 11.480 -9.069 -9.299 174 HD1 TYR 22 2HD TYR 22 10.360 -9.637 -11.553 175 HD2 TYR 22 1HD TYR 22 9.870 -11.978 -8.034 176 HE1 TYR 22 2HE TYR 22 8.304 -10.608 -12.492 177 HE2 TYR 22 1HE TYR 22 7.814 -12.957 -8.964 178 HH TYR 22 HH TYR 22 6.333 -12.893 -10.629 179 H ASP 23 H ASP 23 13.809 -10.592 -7.471 180 HA ASP 23 HA ASP 23 14.131 -13.511 -7.282 181 HB2 ASP 23 1HB ASP 23 16.290 -12.216 -7.770 182 HB3 ASP 23 2HB ASP 23 16.139 -11.579 -6.135 183 H ILE 24 H ILE 24 12.417 -13.843 -5.926 184 HA ILE 24 HA ILE 24 12.358 -12.330 -3.407 185 HB ILE 24 HB ILE 24 10.158 -14.205 -4.069 186 HG12 ILE 24 1HG1 ILE 24 10.731 -13.026 -6.226 187 HG13 ILE 24 2HG1 ILE 24 9.098 -12.741 -5.635 188 HG21 ILE 24 1HG2 ILE 24 10.514 -11.587 -2.684 189 HG22 ILE 24 2HG2 ILE 24 8.916 -12.053 -3.265 190 HG23 ILE 24 3HG2 ILE 24 9.764 -13.074 -2.104 191 HD11 ILE 24 1HD1 ILE 24 10.353 -10.743 -6.534 192 HD12 ILE 24 2HD1 ILE 24 9.623 -10.561 -4.939 193 HD13 ILE 24 3HD1 ILE 24 11.357 -10.847 -5.089 194 HA PRO 25 HA PRO 25 13.933 -15.857 -1.263 195 HB2 PRO 25 1HB PRO 25 13.251 -15.092 1.250 196 HB3 PRO 25 2HB PRO 25 14.597 -14.372 0.359 197 HG2 PRO 25 1HG PRO 25 11.812 -13.342 0.741 198 HG3 PRO 25 2HG PRO 25 13.350 -12.464 0.821 199 HD2 PRO 25 1HD PRO 25 11.743 -12.393 -1.358 200 HD3 PRO 25 2HD PRO 25 13.512 -12.286 -1.471 201 H THR 26 H THR 26 12.969 -17.042 0.932 202 HA THR 26 HA THR 26 10.417 -18.145 0.009 203 HB THR 26 HB THR 26 10.891 -20.059 1.448 204 HG1 THR 26 1HG THR 26 13.462 -19.110 2.035 205 HG21 THR 26 1HG2 THR 26 11.958 -20.822 -0.356 206 HG22 THR 26 2HG2 THR 26 13.462 -20.234 0.352 207 HG23 THR 26 3HG2 THR 26 12.546 -19.209 -0.752 208 H THR 27 H THR 27 10.201 -15.669 1.218 209 HA THR 27 HA THR 27 9.519 -16.018 4.006 210 HB THR 27 HB THR 27 8.915 -13.609 2.291 211 HG1 THR 27 1HG THR 27 11.309 -14.363 3.629 212 HG21 THR 27 1HG2 THR 27 9.692 -13.176 5.052 213 HG22 THR 27 2HG2 THR 27 8.276 -14.220 4.924 214 HG23 THR 27 3HG2 THR 27 8.262 -12.619 4.185 215 H GLU 28 H GLU 28 7.501 -16.132 4.886 216 HA GLU 28 HA GLU 28 5.362 -16.930 3.113 217 HB2 GLU 28 1HB GLU 28 5.561 -16.760 6.121 218 HB3 GLU 28 2HB GLU 28 4.115 -17.290 5.273 219 HG2 GLU 28 1HG GLU 28 5.135 -19.281 5.812 220 HG3 GLU 28 2HG GLU 28 5.682 -19.012 4.158 221 H ASN 29 H ASN 29 6.042 -14.283 2.677 222 HA ASN 29 HA ASN 29 3.546 -12.963 3.436 223 HB2 ASN 29 1HB ASN 29 6.314 -11.854 3.901 224 HB3 ASN 29 2HB ASN 29 4.889 -10.823 3.808 225 HD21 ASN 29 1HD2 ASN 29 6.633 -13.137 5.677 226 HD22 ASN 29 2HD2 ASN 29 5.685 -13.008 7.115 227 H LEU 30 H LEU 30 2.586 -12.238 1.665 228 HA LEU 30 HA LEU 30 4.215 -11.735 -0.724 229 HB2 LEU 30 1HB LEU 30 1.362 -12.510 -0.284 230 HB3 LEU 30 2HB LEU 30 1.839 -11.727 -1.789 231 HG LEU 30 HG LEU 30 1.726 -14.162 -2.013 232 HD11 LEU 30 1HD1 LEU 30 4.633 -13.533 -2.140 233 HD12 LEU 30 2HD1 LEU 30 3.511 -12.593 -3.123 234 HD13 LEU 30 3HD1 LEU 30 3.599 -14.343 -3.317 235 HD21 LEU 30 1HD2 LEU 30 2.741 -14.248 0.517 236 HD22 LEU 30 2HD2 LEU 30 4.151 -14.671 -0.454 237 HD23 LEU 30 3HD2 LEU 30 2.668 -15.617 -0.594 238 H TYR 31 H TYR 31 4.524 -9.727 -1.418 239 HA TYR 31 HA TYR 31 2.823 -7.594 -0.314 240 HB2 TYR 31 1HB TYR 31 5.472 -7.045 -1.593 241 HB3 TYR 31 2HB TYR 31 4.643 -6.158 -0.319 242 HD1 TYR 31 1HD TYR 31 4.236 -7.739 1.872 243 HD2 TYR 31 2HD TYR 31 7.398 -8.120 -0.950 244 HE1 TYR 31 1HE TYR 31 5.600 -8.889 3.565 245 HE2 TYR 31 2HE TYR 31 8.770 -9.273 0.735 246 HH TYR 31 HH TYR 31 7.474 -10.075 3.924 247 H PHE 32 H PHE 32 1.465 -6.625 -1.654 248 HA PHE 32 HA PHE 32 2.048 -6.694 -4.542 249 HB2 PHE 32 1HB PHE 32 -0.694 -6.596 -3.276 250 HB3 PHE 32 2HB PHE 32 -0.319 -6.812 -4.982 251 HD1 PHE 32 1HD PHE 32 -0.073 -8.405 -1.655 252 HD2 PHE 32 2HD PHE 32 0.090 -8.944 -5.873 253 HE1 PHE 32 1HE PHE 32 -0.075 -10.845 -1.339 254 HE2 PHE 32 2HE PHE 32 0.087 -11.385 -5.565 255 HZ PHE 32 HZ PHE 32 0.003 -12.338 -3.296 256 H GLN 33 H GLN 33 0.930 -4.910 -5.769 257 HA GLN 33 HA GLN 33 0.575 -2.460 -4.220 258 HB2 GLN 33 1HB GLN 33 2.168 -1.199 -5.427 259 HB3 GLN 33 2HB GLN 33 2.994 -2.681 -4.966 260 HG2 GLN 33 1HG GLN 33 2.870 -3.552 -7.149 261 HG3 GLN 33 2HG GLN 33 1.699 -2.333 -7.649 262 HE21 GLN 33 1HE2 GLN 33 3.457 -2.298 -9.383 263 HE22 GLN 33 2HE2 GLN 33 4.712 -1.132 -9.161 264 H GLY 34 H GLY 34 -0.898 -1.070 -5.075 265 HA2 GLY 34 1HA GLY 34 -1.739 -0.297 -7.394 266 HA3 GLY 34 2HA GLY 34 -2.237 -1.977 -7.532 267 H SER 35 H SER 35 -2.730 1.016 -5.747 268 HA SER 35 HA SER 35 -5.162 -0.059 -4.536 269 HB2 SER 35 1HB SER 35 -3.479 1.303 -3.211 270 HB3 SER 35 2HB SER 35 -3.997 2.702 -4.151 271 HG SER 35 HG SER 35 -5.974 1.159 -2.932 272 H SER 36 H SER 36 -7.119 1.346 -4.550 273 HA SER 36 HA SER 36 -7.522 2.424 -7.253 274 HB2 SER 36 1HB SER 36 -8.958 0.502 -6.358 275 HB3 SER 36 2HB SER 36 -9.701 1.698 -5.296 276 HG SER 36 HG SER 36 -10.178 1.218 -7.896 277 H GLY 37 H GLY 37 -6.217 4.012 -5.297 278 HA2 GLY 37 1HA GLY 37 -6.933 6.487 -5.525 279 HA3 GLY 37 2HA GLY 37 -8.277 5.964 -4.519 280 H SER 38 H SER 38 -7.988 5.695 -2.345 281 HA SER 38 HA SER 38 -5.361 6.523 -1.307 282 HB2 SER 38 1HB SER 38 -7.620 7.830 -0.861 283 HB3 SER 38 2HB SER 38 -7.822 6.602 0.388 284 HG SER 38 HG SER 38 -6.731 8.325 1.284 285 H SER 39 H SER 39 -5.133 5.726 1.102 286 HA SER 39 HA SER 39 -4.825 2.921 0.985 287 HB2 SER 39 1HB SER 39 -4.801 4.601 3.498 288 HB3 SER 39 2HB SER 39 -3.967 3.072 3.216 289 HG SER 39 HG SER 39 -2.603 4.106 1.782 290 H GLY 40 H GLY 40 -7.278 5.006 2.398 291 HA2 GLY 40 1HA GLY 40 -8.605 3.154 4.009 292 HA3 GLY 40 2HA GLY 40 -9.360 4.544 3.245 293 H ASP 41 H ASP 41 -9.244 3.980 0.605 294 HA ASP 41 HA ASP 41 -11.419 2.472 0.049 295 HB2 ASP 41 1HB ASP 41 -10.697 3.565 -1.828 296 HB3 ASP 41 2HB ASP 41 -9.002 3.194 -1.523 297 H MET 42 H MET 42 -8.080 1.260 0.160 298 HA MET 42 HA MET 42 -8.293 -1.298 -0.640 299 HB2 MET 42 1HB MET 42 -6.824 -0.157 1.722 300 HB3 MET 42 2HB MET 42 -6.701 -1.863 1.313 301 HG2 MET 42 1HG MET 42 -6.223 0.083 -0.862 302 HG3 MET 42 2HG MET 42 -5.004 -0.032 0.405 303 HE1 MET 42 1HE MET 42 -5.851 -2.968 -2.948 304 HE2 MET 42 2HE MET 42 -7.113 -1.991 -2.198 305 HE3 MET 42 3HE MET 42 -5.765 -1.208 -3.024 306 H MET 43 H MET 43 -8.910 -0.352 2.748 307 HA MET 43 HA MET 43 -9.821 -2.725 3.742 308 HB2 MET 43 1HB MET 43 -11.164 -0.107 4.398 309 HB3 MET 43 2HB MET 43 -10.940 -1.500 5.447 310 HG2 MET 43 1HG MET 43 -8.388 -0.976 4.966 311 HG3 MET 43 2HG MET 43 -9.038 0.640 4.696 312 HE1 MET 43 1HE MET 43 -9.922 -2.309 7.090 313 HE2 MET 43 2HE MET 43 -8.190 -2.123 7.365 314 HE3 MET 43 3HE MET 43 -9.335 -1.718 8.645 315 H ARG 44 H ARG 44 -11.577 -0.436 1.730 316 HA ARG 44 HA ARG 44 -14.071 -1.865 1.956 317 HB2 ARG 44 1HB ARG 44 -13.129 0.500 0.362 318 HB3 ARG 44 2HB ARG 44 -14.669 -0.267 -0.001 319 HG2 ARG 44 1HG ARG 44 -15.650 0.477 1.909 320 HG3 ARG 44 2HG ARG 44 -14.138 0.472 2.819 321 HD2 ARG 44 1HD ARG 44 -14.940 2.747 2.439 322 HD3 ARG 44 2HD ARG 44 -13.401 2.465 1.626 323 HE ARG 44 HE ARG 44 -15.705 2.028 -0.043 324 HH11 ARG 44 2HH1 ARG 44 -13.416 4.369 1.143 325 HH12 ARG 44 1HH1 ARG 44 -13.632 5.449 -0.194 326 HH21 ARG 44 2HH2 ARG 44 -15.997 3.443 -1.808 327 HH22 ARG 44 1HH2 ARG 44 -15.101 4.922 -1.872 328 H GLU 45 H GLU 45 -12.020 -1.083 -0.862 329 HA GLU 45 HA GLU 45 -13.126 -2.731 -2.723 330 HB2 GLU 45 1HB GLU 45 -11.031 -1.140 -2.811 331 HB3 GLU 45 2HB GLU 45 -10.141 -2.634 -2.557 332 HG2 GLU 45 1HG GLU 45 -10.257 -2.155 -4.905 333 HG3 GLU 45 2HG GLU 45 -11.219 -3.589 -4.551 334 H ILE 46 H ILE 46 -10.424 -3.663 -0.588 335 HA ILE 46 HA ILE 46 -10.053 -6.258 -1.292 336 HB ILE 46 HB ILE 46 -10.131 -5.208 1.539 337 HG12 ILE 46 1HG1 ILE 46 -7.700 -5.626 -0.190 338 HG13 ILE 46 2HG1 ILE 46 -8.590 -4.108 -0.202 339 HG21 ILE 46 1HG2 ILE 46 -8.917 -7.098 2.221 340 HG22 ILE 46 2HG2 ILE 46 -10.214 -7.730 1.207 341 HG23 ILE 46 3HG2 ILE 46 -8.580 -7.585 0.559 342 HD11 ILE 46 1HD1 ILE 46 -7.823 -5.123 2.450 343 HD12 ILE 46 2HD1 ILE 46 -6.503 -4.603 1.402 344 HD13 ILE 46 3HD1 ILE 46 -7.803 -3.481 1.807 345 H ARG 47 H ARG 47 -12.235 -5.342 1.383 346 HA ARG 47 HA ARG 47 -13.422 -7.714 1.914 347 HB2 ARG 47 1HB ARG 47 -14.640 -4.961 1.801 348 HB3 ARG 47 2HB ARG 47 -15.544 -6.358 2.370 349 HG2 ARG 47 1HG ARG 47 -13.716 -6.723 4.055 350 HG3 ARG 47 2HG ARG 47 -13.069 -5.153 3.573 351 HD2 ARG 47 1HD ARG 47 -15.944 -5.379 4.337 352 HD3 ARG 47 2HD ARG 47 -14.716 -5.360 5.602 353 HE ARG 47 HE ARG 47 -14.024 -3.221 4.167 354 HH11 ARG 47 2HH1 ARG 47 -17.124 -4.282 5.343 355 HH12 ARG 47 1HH1 ARG 47 -17.761 -2.678 5.496 356 HH21 ARG 47 2HH2 ARG 47 -14.851 -1.104 4.364 357 HH22 ARG 47 1HH2 ARG 47 -16.468 -0.871 4.938 358 H LYS 48 H LYS 48 -14.386 -5.489 -0.682 359 HA LYS 48 HA LYS 48 -16.595 -6.732 -1.688 360 HB2 LYS 48 1HB LYS 48 -15.403 -4.624 -2.526 361 HB3 LYS 48 2HB LYS 48 -14.416 -5.706 -3.499 362 HG2 LYS 48 1HG LYS 48 -17.367 -5.970 -3.683 363 HG3 LYS 48 2HG LYS 48 -16.600 -4.577 -4.450 364 HD2 LYS 48 1HD LYS 48 -15.527 -7.333 -4.912 365 HD3 LYS 48 2HD LYS 48 -16.937 -6.766 -5.810 366 HE2 LYS 48 1HE LYS 48 -15.520 -4.718 -6.385 367 HE3 LYS 48 2HE LYS 48 -14.145 -5.656 -5.803 368 HZ1 LYS 48 1HZ LYS 48 -14.156 -6.944 -7.617 369 HZ2 LYS 48 2HZ LYS 48 -15.045 -5.693 -8.326 370 HZ3 LYS 48 3HZ LYS 48 -15.843 -7.040 -7.688 371 H VAL 49 H VAL 49 -13.234 -7.465 -2.625 372 HA VAL 49 HA VAL 49 -13.746 -9.548 -4.381 373 HB VAL 49 HB VAL 49 -11.391 -9.468 -2.497 374 HG11 VAL 49 1HG1 VAL 49 -12.003 -10.833 -5.076 375 HG12 VAL 49 2HG1 VAL 49 -10.338 -10.369 -4.721 376 HG13 VAL 49 3HG1 VAL 49 -11.203 -11.456 -3.634 377 HG21 VAL 49 1HG2 VAL 49 -10.749 -8.319 -5.002 378 HG22 VAL 49 2HG2 VAL 49 -12.198 -7.512 -4.404 379 HG23 VAL 49 3HG2 VAL 49 -10.739 -7.553 -3.414 380 H LEU 50 H LEU 50 -13.108 -9.737 -0.882 381 HA LEU 50 HA LEU 50 -13.241 -12.472 -0.547 382 HB2 LEU 50 1HB LEU 50 -14.387 -10.455 1.373 383 HB3 LEU 50 2HB LEU 50 -13.769 -12.062 1.754 384 HG LEU 50 HG LEU 50 -12.119 -9.719 0.807 385 HD11 LEU 50 1HD1 LEU 50 -13.059 -9.566 3.129 386 HD12 LEU 50 2HD1 LEU 50 -11.299 -9.557 3.029 387 HD13 LEU 50 3HD1 LEU 50 -12.147 -11.024 3.519 388 HD21 LEU 50 1HD2 LEU 50 -11.606 -12.538 0.836 389 HD22 LEU 50 2HD2 LEU 50 -10.537 -11.723 1.978 390 HD23 LEU 50 3HD2 LEU 50 -10.570 -11.220 0.287 391 H GLY 51 H GLY 51 -15.957 -10.206 -0.030 392 HA2 GLY 51 1HA GLY 51 -17.974 -12.030 0.371 393 HA3 GLY 51 2HA GLY 51 -18.212 -10.468 -0.399 394 H ALA 52 H ALA 52 -16.660 -10.931 -2.722 395 HA ALA 52 HA ALA 52 -18.565 -12.128 -4.394 396 HB1 ALA 52 1HB ALA 52 -15.845 -12.109 -5.464 397 HB2 ALA 52 2HB ALA 52 -17.306 -11.317 -6.058 398 HB3 ALA 52 3HB ALA 52 -16.355 -10.567 -4.776 399 H ASN 53 H ASN 53 -15.567 -13.388 -3.005 400 HA ASN 53 HA ASN 53 -16.047 -15.989 -4.249 401 HB2 ASN 53 1HB ASN 53 -13.707 -14.719 -2.871 402 HB3 ASN 53 2HB ASN 53 -13.796 -16.474 -2.995 403 HD21 ASN 53 1HD2 ASN 53 -14.180 -13.581 -5.011 404 HD22 ASN 53 2HD2 ASN 53 -13.390 -14.238 -6.400 405 H ASN 54 H ASN 54 -17.948 -15.265 -2.355 406 HA ASN 54 HA ASN 54 -18.867 -15.812 -0.318 407 HB2 ASN 54 1HB ASN 54 -17.900 -18.321 -1.615 408 HB3 ASN 54 2HB ASN 54 -18.551 -18.426 0.018 409 HD21 ASN 54 1HD2 ASN 54 -19.358 -18.877 -3.044 410 HD22 ASN 54 2HD2 ASN 54 -21.036 -18.468 -3.006 411 H CYS 55 H CYS 55 -16.378 -14.655 0.100 412 HA CYS 55 HA CYS 55 -15.159 -16.314 2.197 413 HB2 CYS 55 1HB CYS 55 -14.113 -13.962 0.623 414 HB3 CYS 55 2HB CYS 55 -13.296 -14.584 2.052 415 HG CYS 55 HG CYS 55 -13.491 -15.897 -1.046 416 H ASP 56 H ASP 56 -14.898 -15.544 4.277 417 HA ASP 56 HA ASP 56 -16.633 -13.286 4.975 418 HB2 ASP 56 1HB ASP 56 -15.482 -15.494 6.693 419 HB3 ASP 56 2HB ASP 56 -16.521 -14.200 7.281 420 H TYR 57 H TYR 57 -15.918 -11.867 6.760 421 HA TYR 57 HA TYR 57 -13.067 -11.659 7.217 422 HB2 TYR 57 1HB TYR 57 -13.060 -9.241 6.445 423 HB3 TYR 57 2HB TYR 57 -13.114 -10.453 5.170 424 HD1 TYR 57 2HD TYR 57 -15.157 -10.791 3.861 425 HD2 TYR 57 1HD TYR 57 -14.929 -7.768 6.846 426 HE1 TYR 57 2HE TYR 57 -17.169 -9.727 2.929 427 HE2 TYR 57 1HE TYR 57 -16.941 -6.696 5.923 428 HH TYR 57 HH TYR 57 -18.109 -7.210 2.975 429 H GLU 58 H GLU 58 -12.541 -10.410 9.007 430 HA GLU 58 HA GLU 58 -14.751 -9.113 10.435 431 HB2 GLU 58 1HB GLU 58 -13.805 -10.125 12.570 432 HB3 GLU 58 2HB GLU 58 -14.697 -11.210 11.514 433 HG2 GLU 58 1HG GLU 58 -12.640 -12.133 10.656 434 HG3 GLU 58 2HG GLU 58 -11.698 -10.984 11.604 435 H GLN 59 H GLN 59 -14.097 -7.055 10.455 436 HA GLN 59 HA GLN 59 -11.443 -6.166 10.377 437 HB2 GLN 59 1HB GLN 59 -13.770 -4.939 10.001 438 HB3 GLN 59 2HB GLN 59 -13.514 -4.462 11.675 439 HG2 GLN 59 1HG GLN 59 -11.123 -3.822 10.729 440 HG3 GLN 59 2HG GLN 59 -12.039 -3.684 9.229 441 HE21 GLN 59 1HE2 GLN 59 -10.721 -1.632 10.857 442 HE22 GLN 59 2HE2 GLN 59 -11.948 -0.481 11.246 443 H ARG 60 H ARG 60 -9.967 -6.616 11.877 444 HA ARG 60 HA ARG 60 -10.710 -6.882 14.667 445 HB2 ARG 60 1HB ARG 60 -8.115 -7.264 13.177 446 HB3 ARG 60 2HB ARG 60 -8.234 -7.391 14.927 447 HG2 ARG 60 1HG ARG 60 -9.957 -9.034 13.104 448 HG3 ARG 60 2HG ARG 60 -8.335 -9.545 13.576 449 HD2 ARG 60 1HD ARG 60 -9.600 -10.569 15.195 450 HD3 ARG 60 2HD ARG 60 -9.213 -9.045 15.991 451 HE ARG 60 HE ARG 60 -11.685 -9.020 14.509 452 HH11 ARG 60 2HH1 ARG 60 -10.160 -9.679 17.569 453 HH12 ARG 60 1HH1 ARG 60 -11.616 -9.475 18.486 454 HH21 ARG 60 2HH2 ARG 60 -13.608 -8.749 15.705 455 HH22 ARG 60 1HH2 ARG 60 -13.577 -8.947 17.425 456 H GLU 61 H GLU 61 -8.417 -4.903 12.786 457 HA GLU 61 HA GLU 61 -8.577 -2.876 14.920 458 HB2 GLU 61 1HB GLU 61 -6.203 -3.376 13.119 459 HB3 GLU 61 2HB GLU 61 -6.286 -2.258 14.473 460 HG2 GLU 61 1HG GLU 61 -6.767 -4.338 15.897 461 HG3 GLU 61 2HG GLU 61 -6.168 -5.247 14.511 462 H ARG 62 H ARG 62 -7.709 -0.675 13.974 463 HA ARG 62 HA ARG 62 -9.605 0.302 12.214 464 HB2 ARG 62 1HB ARG 62 -8.224 2.298 12.034 465 HB3 ARG 62 2HB ARG 62 -8.238 1.717 13.694 466 HG2 ARG 62 1HG ARG 62 -6.042 0.790 13.454 467 HG3 ARG 62 2HG ARG 62 -6.031 1.155 11.728 468 HD2 ARG 62 1HD ARG 62 -5.828 3.445 12.088 469 HD3 ARG 62 2HD ARG 62 -6.411 3.332 13.748 470 HE ARG 62 HE ARG 62 -3.709 2.889 12.811 471 HH11 ARG 62 2HH1 ARG 62 -6.009 2.466 15.390 472 HH12 ARG 62 1HH1 ARG 62 -4.798 2.269 16.614 473 HH21 ARG 62 2HH2 ARG 62 -2.105 2.630 14.413 474 HH22 ARG 62 1HH2 ARG 62 -2.578 2.363 16.056 475 H PHE 63 H PHE 63 -6.324 -0.841 11.534 476 HA PHE 63 HA PHE 63 -7.019 -0.865 8.671 477 HB2 PHE 63 1HB PHE 63 -4.377 -0.220 9.981 478 HB3 PHE 63 2HB PHE 63 -4.532 -0.589 8.267 479 HD1 PHE 63 2HD PHE 63 -6.378 0.839 7.018 480 HD2 PHE 63 1HD PHE 63 -4.428 1.978 10.626 481 HE1 PHE 63 2HE PHE 63 -6.914 3.196 6.559 482 HE2 PHE 63 1HE PHE 63 -4.962 4.337 10.173 483 HZ PHE 63 HZ PHE 63 -6.205 4.949 8.136 484 H LEU 64 H LEU 64 -7.611 -3.013 10.299 485 HA LEU 64 HA LEU 64 -5.837 -5.044 9.174 486 HB2 LEU 64 1HB LEU 64 -5.291 -4.407 11.634 487 HB3 LEU 64 2HB LEU 64 -6.745 -5.328 12.010 488 HG LEU 64 HG LEU 64 -4.619 -6.598 12.271 489 HD11 LEU 64 1HD1 LEU 64 -6.606 -7.858 12.016 490 HD12 LEU 64 2HD1 LEU 64 -5.411 -8.584 10.942 491 HD13 LEU 64 3HD1 LEU 64 -6.670 -7.540 10.282 492 HD21 LEU 64 1HD2 LEU 64 -4.507 -6.547 9.263 493 HD22 LEU 64 2HD2 LEU 64 -3.351 -7.274 10.379 494 HD23 LEU 64 3HD2 LEU 64 -3.509 -5.519 10.292 495 H LEU 65 H LEU 65 -7.058 -6.413 8.073 496 HA LEU 65 HA LEU 65 -9.750 -7.038 9.095 497 HB2 LEU 65 1HB LEU 65 -8.830 -6.284 6.378 498 HB3 LEU 65 2HB LEU 65 -10.084 -7.517 6.496 499 HG LEU 65 HG LEU 65 -10.458 -4.943 7.954 500 HD11 LEU 65 1HD1 LEU 65 -10.897 -5.319 4.995 501 HD12 LEU 65 2HD1 LEU 65 -9.749 -4.217 5.754 502 HD13 LEU 65 3HD1 LEU 65 -11.481 -3.957 5.952 503 HD21 LEU 65 1HD2 LEU 65 -12.311 -6.125 8.397 504 HD22 LEU 65 2HD2 LEU 65 -12.056 -7.224 7.041 505 HD23 LEU 65 3HD2 LEU 65 -12.805 -5.650 6.772 506 H PHE 66 H PHE 66 -10.123 -9.120 9.474 507 HA PHE 66 HA PHE 66 -8.097 -11.074 8.894 508 HB2 PHE 66 1HB PHE 66 -9.629 -10.919 10.983 509 HB3 PHE 66 2HB PHE 66 -10.824 -11.727 9.974 510 HD1 PHE 66 2HD PHE 66 -7.229 -12.084 10.913 511 HD2 PHE 66 1HD PHE 66 -10.938 -14.010 10.104 512 HE1 PHE 66 2HE PHE 66 -6.217 -14.257 11.464 513 HE2 PHE 66 1HE PHE 66 -9.932 -16.187 10.655 514 HZ PHE 66 HZ PHE 66 -7.568 -16.313 11.335 515 H CYS 67 H CYS 67 -7.996 -11.378 6.693 516 HA CYS 67 HA CYS 67 -10.392 -11.988 5.187 517 HB2 CYS 67 1HB CYS 67 -7.482 -11.970 4.359 518 HB3 CYS 67 2HB CYS 67 -8.843 -12.191 3.266 519 HG CYS 67 HG CYS 67 -8.320 -9.362 5.120 520 H VAL 68 H VAL 68 -11.249 -13.949 5.190 521 HA VAL 68 HA VAL 68 -9.449 -16.277 5.217 522 HB VAL 68 HB VAL 68 -10.428 -16.028 7.455 523 HG11 VAL 68 1HG1 VAL 68 -13.124 -16.519 6.222 524 HG12 VAL 68 2HG1 VAL 68 -12.743 -16.052 7.880 525 HG13 VAL 68 3HG1 VAL 68 -12.526 -14.896 6.565 526 HG21 VAL 68 1HG2 VAL 68 -10.290 -18.301 5.944 527 HG22 VAL 68 2HG2 VAL 68 -10.606 -18.252 7.679 528 HG23 VAL 68 3HG2 VAL 68 -11.949 -18.354 6.541 529 H HIS 69 H HIS 69 -10.047 -17.994 3.943 530 HA HIS 69 HA HIS 69 -12.400 -17.557 2.225 531 HB2 HIS 69 1HB HIS 69 -10.467 -17.409 0.856 532 HB3 HIS 69 2HB HIS 69 -9.720 -18.803 1.631 533 HD1 HIS 69 1HD HIS 69 -9.564 -20.517 -0.152 534 HD2 HIS 69 2HD HIS 69 -13.267 -18.635 -0.127 535 HE1 HIS 69 1HE HIS 69 -10.942 -21.722 -1.876 536 HE2 HIS 69 2HE HIS 69 -13.150 -20.511 -1.904 537 H GLY 70 H GLY 70 -13.893 -19.141 2.029 538 HA2 GLY 70 1HA GLY 70 -13.286 -21.750 3.266 539 HA3 GLY 70 2HA GLY 70 -14.766 -20.890 3.666 540 H ASP 71 H ASP 71 -13.033 -22.609 1.150 541 HA ASP 71 HA ASP 71 -14.985 -22.412 -0.871 542 HB2 ASP 71 1HB ASP 71 -12.813 -23.119 -1.518 543 HB3 ASP 71 2HB ASP 71 -12.804 -24.423 -0.334 544 H GLY 72 H GLY 72 -14.534 -24.698 1.779 545 HA2 GLY 72 1HA GLY 72 -17.310 -25.459 1.636 546 HA3 GLY 72 2HA GLY 72 -16.210 -26.745 1.161 547 H HIS 73 H HIS 73 -14.152 -26.542 2.881 548 HA HIS 73 HA HIS 73 -15.184 -26.365 5.593 549 HB2 HIS 73 1HB HIS 73 -14.533 -28.920 4.218 550 HB3 HIS 73 2HB HIS 73 -14.006 -28.750 5.889 551 HD1 HIS 73 1HD HIS 73 -15.719 -29.176 7.653 552 HD2 HIS 73 2HD HIS 73 -17.420 -28.614 3.904 553 HE1 HIS 73 1HE HIS 73 -18.162 -29.696 7.939 554 HE2 HIS 73 2HE HIS 73 -19.155 -29.432 5.639 555 H ALA 74 H ALA 74 -13.257 -27.286 7.098 556 HA ALA 74 HA ALA 74 -11.227 -25.438 7.034 557 HB1 ALA 74 1HB ALA 74 -11.487 -28.122 8.310 558 HB2 ALA 74 2HB ALA 74 -9.949 -27.263 8.397 559 HB3 ALA 74 3HB ALA 74 -11.409 -26.525 9.053 560 H GLU 75 H GLU 75 -11.258 -28.678 5.606 561 HA GLU 75 HA GLU 75 -8.669 -29.031 4.853 562 HB2 GLU 75 1HB GLU 75 -11.100 -29.576 3.139 563 HB3 GLU 75 2HB GLU 75 -9.507 -30.282 2.899 564 HG2 GLU 75 1HG GLU 75 -10.934 -30.621 5.501 565 HG3 GLU 75 2HG GLU 75 -11.330 -31.641 4.119 566 H ASN 76 H ASN 76 -11.088 -27.089 3.126 567 HA ASN 76 HA ASN 76 -8.924 -25.966 1.480 568 HB2 ASN 76 1HB ASN 76 -11.869 -25.677 0.915 569 HB3 ASN 76 2HB ASN 76 -10.518 -25.476 -0.197 570 HD21 ASN 76 1HD2 ASN 76 -12.958 -27.477 0.692 571 HD22 ASN 76 2HD2 ASN 76 -12.350 -28.971 0.071 572 H LEU 77 H LEU 77 -9.359 -25.125 4.177 573 HA LEU 77 HA LEU 77 -10.436 -22.413 3.794 574 HB2 LEU 77 1HB LEU 77 -11.498 -23.815 5.546 575 HB3 LEU 77 2HB LEU 77 -9.946 -23.886 6.378 576 HG LEU 77 HG LEU 77 -10.220 -21.237 6.269 577 HD11 LEU 77 1HD1 LEU 77 -12.330 -20.433 6.130 578 HD12 LEU 77 2HD1 LEU 77 -13.052 -21.892 6.808 579 HD13 LEU 77 3HD1 LEU 77 -12.550 -21.860 5.118 580 HD21 LEU 77 1HD2 LEU 77 -10.931 -23.317 8.206 581 HD22 LEU 77 2HD2 LEU 77 -11.698 -21.755 8.497 582 HD23 LEU 77 3HD2 LEU 77 -9.940 -21.871 8.401 583 H VAL 78 H VAL 78 -9.201 -20.641 4.241 584 HA VAL 78 HA VAL 78 -6.517 -21.033 5.340 585 HB VAL 78 HB VAL 78 -7.079 -19.686 2.697 586 HG11 VAL 78 1HG1 VAL 78 -5.504 -18.304 3.792 587 HG12 VAL 78 2HG1 VAL 78 -4.613 -19.691 4.420 588 HG13 VAL 78 3HG1 VAL 78 -4.576 -19.326 2.695 589 HG21 VAL 78 1HG2 VAL 78 -6.877 -21.964 2.265 590 HG22 VAL 78 2HG2 VAL 78 -5.240 -21.360 2.009 591 HG23 VAL 78 3HG2 VAL 78 -5.649 -22.192 3.510 592 H GLN 79 H GLN 79 -5.873 -19.415 6.644 593 HA GLN 79 HA GLN 79 -7.582 -17.020 6.761 594 HB2 GLN 79 1HB GLN 79 -6.045 -18.444 8.933 595 HB3 GLN 79 2HB GLN 79 -6.769 -16.856 9.146 596 HG2 GLN 79 1HG GLN 79 -8.934 -17.685 9.011 597 HG3 GLN 79 2HG GLN 79 -8.414 -19.181 8.238 598 HE21 GLN 79 1HE2 GLN 79 -8.852 -20.798 9.552 599 HE22 GLN 79 2HE2 GLN 79 -8.521 -20.850 11.246 600 H TRP 80 H TRP 80 -6.684 -15.086 6.429 601 HA TRP 80 HA TRP 80 -3.853 -14.657 6.891 602 HB2 TRP 80 1HB TRP 80 -3.251 -14.074 4.689 603 HB3 TRP 80 2HB TRP 80 -4.168 -15.568 4.514 604 HD1 TRP 80 HD TRP 80 -4.286 -11.865 3.660 605 HE1 TRP 80 1HE TRP 80 -6.238 -11.442 2.038 606 HE3 TRP 80 3HE TRP 80 -6.526 -16.456 3.871 607 HZ2 TRP 80 2HZ TRP 80 -8.438 -12.865 0.987 608 HZ3 TRP 80 3HZ TRP 80 -8.550 -16.843 2.528 609 HH2 TRP 80 HH TRP 80 -9.485 -15.083 1.116 610 H GLU 81 H GLU 81 -3.607 -12.726 7.795 611 HA GLU 81 HA GLU 81 -5.806 -10.837 7.758 612 HB2 GLU 81 1HB GLU 81 -3.242 -11.065 9.298 613 HB3 GLU 81 2HB GLU 81 -4.133 -9.549 9.285 614 HG2 GLU 81 1HG GLU 81 -6.061 -10.608 10.242 615 HG3 GLU 81 2HG GLU 81 -5.300 -12.193 10.119 616 H MET 82 H MET 82 -5.969 -9.293 6.286 617 HA MET 82 HA MET 82 -3.607 -8.504 4.758 618 HB2 MET 82 1HB MET 82 -6.559 -8.297 4.333 619 HB3 MET 82 2HB MET 82 -5.500 -7.171 3.495 620 HG2 MET 82 1HG MET 82 -4.235 -9.188 2.654 621 HG3 MET 82 2HG MET 82 -5.564 -10.163 3.277 622 HE1 MET 82 1HE MET 82 -4.760 -7.021 1.545 623 HE2 MET 82 2HE MET 82 -5.225 -7.335 -0.127 624 HE3 MET 82 3HE MET 82 -6.361 -6.553 0.972 625 H GLU 83 H GLU 83 -2.468 -7.042 5.927 626 HA GLU 83 HA GLU 83 -3.895 -4.781 7.126 627 HB2 GLU 83 1HB GLU 83 -2.362 -5.906 8.618 628 HB3 GLU 83 2HB GLU 83 -1.054 -5.755 7.452 629 HG2 GLU 83 1HG GLU 83 -0.853 -3.452 7.801 630 HG3 GLU 83 2HG GLU 83 -2.423 -3.348 8.596 631 H VAL 84 H VAL 84 -3.619 -2.707 6.466 632 HA VAL 84 HA VAL 84 -2.344 -2.315 3.885 633 HB VAL 84 HB VAL 84 -3.940 -0.387 5.578 634 HG11 VAL 84 1HG1 VAL 84 -4.122 0.631 3.127 635 HG12 VAL 84 2HG1 VAL 84 -2.822 1.071 4.236 636 HG13 VAL 84 3HG1 VAL 84 -2.539 -0.131 2.977 637 HG21 VAL 84 1HG2 VAL 84 -5.562 -0.826 3.563 638 HG22 VAL 84 2HG2 VAL 84 -4.670 -2.343 3.448 639 HG23 VAL 84 3HG2 VAL 84 -5.518 -1.930 4.937 640 H CYS 85 H CYS 85 -0.150 -2.304 4.240 641 HA CYS 85 HA CYS 85 1.025 -0.692 6.319 642 HB2 CYS 85 1HB CYS 85 2.016 -2.570 4.238 643 HB3 CYS 85 2HB CYS 85 3.146 -1.354 4.821 644 HG CYS 85 HG CYS 85 1.488 -3.514 6.892 645 H LYS 86 H LYS 86 3.101 0.603 5.407 646 HA LYS 86 HA LYS 86 2.221 2.307 3.185 647 HB2 LYS 86 1HB LYS 86 1.749 3.212 5.599 648 HB3 LYS 86 2HB LYS 86 3.474 3.555 5.604 649 HG2 LYS 86 1HG LYS 86 2.791 5.530 4.775 650 HG3 LYS 86 2HG LYS 86 2.807 4.647 3.247 651 HD2 LYS 86 1HD LYS 86 0.327 4.477 4.850 652 HD3 LYS 86 2HD LYS 86 0.687 6.041 4.115 653 HE2 LYS 86 1HE LYS 86 0.840 3.525 2.499 654 HE3 LYS 86 2HE LYS 86 -0.713 4.306 2.792 655 HZ1 LYS 86 1HZ LYS 86 -0.267 5.768 1.212 656 HZ2 LYS 86 2HZ LYS 86 1.176 4.957 0.865 657 HZ3 LYS 86 3HZ LYS 86 1.170 6.235 1.974 658 H LEU 87 H LEU 87 3.757 1.935 1.710 659 HA LEU 87 HA LEU 87 6.292 1.013 1.989 660 HB2 LEU 87 1HB LEU 87 5.054 2.879 0.018 661 HB3 LEU 87 2HB LEU 87 6.785 2.559 -0.069 662 HG LEU 87 HG LEU 87 4.681 0.403 -0.174 663 HD11 LEU 87 1HD1 LEU 87 5.161 0.354 -2.605 664 HD12 LEU 87 2HD1 LEU 87 6.077 1.849 -2.419 665 HD13 LEU 87 3HD1 LEU 87 4.347 1.828 -2.079 666 HD21 LEU 87 1HD2 LEU 87 7.625 0.434 -0.832 667 HD22 LEU 87 2HD2 LEU 87 6.534 -0.925 -1.102 668 HD23 LEU 87 3HD2 LEU 87 6.862 -0.371 0.540 669 HA PRO 88 HA PRO 88 8.855 4.018 3.900 670 HB2 PRO 88 1HB PRO 88 11.173 3.762 2.509 671 HB3 PRO 88 2HB PRO 88 10.599 2.542 3.653 672 HG2 PRO 88 1HG PRO 88 10.387 2.587 0.668 673 HG3 PRO 88 2HG PRO 88 10.805 1.238 1.739 674 HD2 PRO 88 1HD PRO 88 8.333 1.542 0.676 675 HD3 PRO 88 2HD PRO 88 8.602 0.815 2.273 676 H ARG 89 H ARG 89 8.981 4.120 0.346 677 HA ARG 89 HA ARG 89 9.574 6.979 0.433 678 HB2 ARG 89 1HB ARG 89 9.504 4.972 -1.820 679 HB3 ARG 89 2HB ARG 89 9.736 6.696 -2.080 680 HG2 ARG 89 1HG ARG 89 11.905 6.039 -2.024 681 HG3 ARG 89 2HG ARG 89 11.661 6.332 -0.301 682 HD2 ARG 89 1HD ARG 89 11.623 4.097 0.213 683 HD3 ARG 89 2HD ARG 89 11.052 3.629 -1.388 684 HE ARG 89 HE ARG 89 13.655 4.690 -1.581 685 HH11 ARG 89 2HH1 ARG 89 11.952 1.880 -0.430 686 HH12 ARG 89 1HH1 ARG 89 13.295 0.810 -0.662 687 HH21 ARG 89 2HH2 ARG 89 15.430 3.291 -1.891 688 HH22 ARG 89 1HH2 ARG 89 15.273 1.614 -1.492 689 H LEU 90 H LEU 90 6.944 5.808 1.193 690 HA LEU 90 HA LEU 90 4.697 5.962 0.662 691 HB2 LEU 90 1HB LEU 90 5.778 8.751 0.317 692 HB3 LEU 90 2HB LEU 90 4.058 8.374 0.395 693 HG LEU 90 HG LEU 90 4.662 9.147 2.539 694 HD11 LEU 90 1HD1 LEU 90 4.739 6.142 2.731 695 HD12 LEU 90 2HD1 LEU 90 3.273 7.082 2.458 696 HD13 LEU 90 3HD1 LEU 90 4.181 7.282 3.956 697 HD21 LEU 90 1HD2 LEU 90 6.605 7.425 3.542 698 HD22 LEU 90 2HD2 LEU 90 6.808 9.124 3.115 699 HD23 LEU 90 3HD2 LEU 90 7.177 7.867 1.933 700 H SER 91 H SER 91 6.279 5.154 -1.624 701 HA SER 91 HA SER 91 5.481 6.605 -3.934 702 HB2 SER 91 1HB SER 91 7.382 5.291 -4.274 703 HB3 SER 91 2HB SER 91 6.681 3.892 -3.461 704 HG SER 91 HG SER 91 6.017 3.253 -5.336 705 H LEU 92 H LEU 92 4.031 4.079 -2.037 706 HA LEU 92 HA LEU 92 1.534 4.395 -3.429 707 HB2 LEU 92 1HB LEU 92 3.166 1.899 -3.689 708 HB3 LEU 92 2HB LEU 92 1.405 1.824 -3.731 709 HG LEU 92 HG LEU 92 3.186 3.313 -5.658 710 HD11 LEU 92 1HD1 LEU 92 2.156 1.694 -7.278 711 HD12 LEU 92 2HD1 LEU 92 1.538 0.806 -5.886 712 HD13 LEU 92 3HD1 LEU 92 3.277 0.986 -6.115 713 HD21 LEU 92 1HD2 LEU 92 1.314 4.646 -5.634 714 HD22 LEU 92 2HD2 LEU 92 0.235 3.314 -5.222 715 HD23 LEU 92 3HD2 LEU 92 0.870 3.461 -6.861 716 H ASN 93 H ASN 93 -0.010 2.499 -2.515 717 HA ASN 93 HA ASN 93 -0.071 2.953 0.316 718 HB2 ASN 93 1HB ASN 93 -1.838 1.055 -1.229 719 HB3 ASN 93 2HB ASN 93 -2.197 1.877 0.287 720 HD21 ASN 93 1HD2 ASN 93 -1.682 2.342 -3.154 721 HD22 ASN 93 2HD2 ASN 93 -2.585 3.810 -3.280 722 H GLY 94 H GLY 94 0.472 0.145 -1.781 723 HA2 GLY 94 1HA GLY 94 1.598 -1.820 -1.369 724 HA3 GLY 94 2HA GLY 94 2.184 -1.099 0.123 725 H VAL 95 H VAL 95 0.953 -3.793 -0.698 726 HA VAL 95 HA VAL 95 -0.793 -3.983 1.650 727 HB VAL 95 HB VAL 95 -1.482 -5.218 -1.020 728 HG11 VAL 95 1HG1 VAL 95 -3.651 -5.186 0.808 729 HG12 VAL 95 2HG1 VAL 95 -2.816 -6.579 0.117 730 HG13 VAL 95 3HG1 VAL 95 -2.254 -5.875 1.634 731 HG21 VAL 95 1HG2 VAL 95 -1.765 -2.660 -0.662 732 HG22 VAL 95 2HG2 VAL 95 -3.098 -3.592 -1.343 733 HG23 VAL 95 3HG2 VAL 95 -3.123 -3.132 0.359 734 H ARG 96 H ARG 96 0.286 -5.326 2.940 735 HA ARG 96 HA ARG 96 1.729 -7.594 1.772 736 HB2 ARG 96 1HB ARG 96 2.945 -6.085 3.325 737 HB3 ARG 96 2HB ARG 96 1.814 -6.523 4.598 738 HG2 ARG 96 1HG ARG 96 3.206 -8.745 3.234 739 HG3 ARG 96 2HG ARG 96 4.179 -7.708 4.280 740 HD2 ARG 96 1HD ARG 96 1.564 -8.786 5.248 741 HD3 ARG 96 2HD ARG 96 2.999 -9.809 5.267 742 HE ARG 96 HE ARG 96 3.898 -7.636 6.517 743 HH11 ARG 96 2HH1 ARG 96 0.941 -9.430 6.913 744 HH12 ARG 96 1HH1 ARG 96 0.786 -9.056 8.597 745 HH21 ARG 96 2HH2 ARG 96 3.706 -7.137 8.734 746 HH22 ARG 96 1HH2 ARG 96 2.359 -7.751 9.632 747 H PHE 97 H PHE 97 1.398 -9.713 2.467 748 HA PHE 97 HA PHE 97 -1.158 -10.158 3.861 749 HB2 PHE 97 1HB PHE 97 0.216 -11.784 1.718 750 HB3 PHE 97 2HB PHE 97 -1.162 -12.373 2.642 751 HD1 PHE 97 1HD PHE 97 -0.292 -9.192 0.886 752 HD2 PHE 97 2HD PHE 97 -3.124 -12.315 1.472 753 HE1 PHE 97 1HE PHE 97 -1.819 -8.102 -0.706 754 HE2 PHE 97 2HE PHE 97 -4.655 -11.231 -0.119 755 HZ PHE 97 HZ PHE 97 -4.003 -9.122 -1.211 756 H LYS 98 H LYS 98 -1.311 -11.935 5.306 757 HA LYS 98 HA LYS 98 1.257 -13.031 6.227 758 HB2 LYS 98 1HB LYS 98 0.620 -11.174 7.709 759 HB3 LYS 98 2HB LYS 98 -0.935 -11.941 8.004 760 HG2 LYS 98 1HG LYS 98 0.090 -13.751 9.162 761 HG3 LYS 98 2HG LYS 98 1.702 -13.219 8.681 762 HD2 LYS 98 1HD LYS 98 1.601 -12.397 10.824 763 HD3 LYS 98 2HD LYS 98 0.996 -11.011 9.914 764 HE2 LYS 98 1HE LYS 98 -1.330 -12.000 10.317 765 HE3 LYS 98 2HE LYS 98 -0.550 -13.018 11.526 766 HZ1 LYS 98 1HZ LYS 98 -0.962 -11.316 12.890 767 HZ2 LYS 98 2HZ LYS 98 -1.202 -10.213 11.630 768 HZ3 LYS 98 3HZ LYS 98 0.367 -10.567 12.156 769 H ARG 99 H ARG 99 1.244 -15.167 6.564 770 HA ARG 99 HA ARG 99 -1.188 -16.640 6.060 771 HB2 ARG 99 1HB ARG 99 1.097 -17.286 5.186 772 HB3 ARG 99 2HB ARG 99 1.509 -17.754 6.831 773 HG2 ARG 99 1HG ARG 99 0.104 -19.574 6.812 774 HG3 ARG 99 2HG ARG 99 -0.931 -18.894 5.555 775 HD2 ARG 99 1HD ARG 99 0.252 -20.622 4.496 776 HD3 ARG 99 2HD ARG 99 1.070 -19.141 4.001 777 HE ARG 99 HE ARG 99 2.930 -19.788 5.204 778 HH11 ARG 99 2HH1 ARG 99 0.255 -21.904 5.898 779 HH12 ARG 99 1HH1 ARG 99 1.226 -23.075 6.727 780 HH21 ARG 99 2HH2 ARG 99 4.220 -21.321 6.293 781 HH22 ARG 99 1HH2 ARG 99 3.482 -22.741 6.952 782 H ILE 100 H ILE 100 -2.601 -16.646 7.712 783 HA ILE 100 HA ILE 100 -1.802 -16.713 10.456 784 HB ILE 100 HB ILE 100 -4.508 -17.123 9.183 785 HG12 ILE 100 1HG1 ILE 100 -3.609 -14.878 8.859 786 HG13 ILE 100 2HG1 ILE 100 -4.939 -14.836 10.012 787 HG21 ILE 100 1HG2 ILE 100 -3.714 -17.836 11.757 788 HG22 ILE 100 2HG2 ILE 100 -4.555 -16.298 11.944 789 HG23 ILE 100 3HG2 ILE 100 -5.365 -17.657 11.164 790 HD11 ILE 100 1HD1 ILE 100 -2.028 -14.416 10.458 791 HD12 ILE 100 2HD1 ILE 100 -3.408 -13.476 11.030 792 HD13 ILE 100 3HD1 ILE 100 -3.027 -15.028 11.775 793 H SER 101 H SER 101 -3.363 -19.070 8.293 794 HA SER 101 HA SER 101 -1.981 -21.280 9.355 795 HB2 SER 101 1HB SER 101 -3.651 -20.626 11.241 796 HB3 SER 101 2HB SER 101 -4.870 -21.341 10.186 797 HG SER 101 HG SER 101 -2.625 -22.887 10.511 798 H GLY 102 H GLY 102 -2.899 -23.380 8.550 799 HA2 GLY 102 1HA GLY 102 -4.463 -24.471 7.041 800 HA3 GLY 102 2HA GLY 102 -4.552 -22.965 6.140 801 H THR 103 H THR 103 -4.110 -24.462 4.322 802 HA THR 103 HA THR 103 -1.368 -25.425 4.136 803 HB THR 103 HB THR 103 -2.044 -26.420 2.004 804 HG1 THR 103 1HG THR 103 -3.983 -26.001 1.105 805 HG21 THR 103 1HG2 THR 103 -2.661 -28.102 3.337 806 HG22 THR 103 2HG2 THR 103 -4.312 -27.492 3.218 807 HG23 THR 103 3HG2 THR 103 -3.280 -26.990 4.557 808 H SER 104 H SER 104 0.159 -24.667 2.711 809 HA SER 104 HA SER 104 0.148 -21.942 2.082 810 HB2 SER 104 1HB SER 104 1.838 -24.089 0.778 811 HB3 SER 104 2HB SER 104 2.207 -22.367 0.870 812 HG SER 104 HG SER 104 2.001 -24.170 3.053 813 H ILE 105 H ILE 105 -0.344 -24.766 -0.023 814 HA ILE 105 HA ILE 105 -0.553 -23.710 -2.485 815 HB ILE 105 HB ILE 105 -2.455 -25.689 -1.234 816 HG12 ILE 105 1HG1 ILE 105 -0.179 -26.485 -1.267 817 HG13 ILE 105 2HG1 ILE 105 -1.072 -27.318 -2.534 818 HG21 ILE 105 1HG2 ILE 105 -2.056 -25.164 -4.173 819 HG22 ILE 105 2HG2 ILE 105 -3.193 -26.287 -3.429 820 HG23 ILE 105 3HG2 ILE 105 -3.415 -24.548 -3.234 821 HD11 ILE 105 1HD1 ILE 105 -0.129 -25.695 -4.165 822 HD12 ILE 105 2HD1 ILE 105 0.874 -25.053 -2.864 823 HD13 ILE 105 3HD1 ILE 105 1.070 -26.726 -3.384 824 H ALA 106 H ALA 106 -3.476 -24.010 -0.462 825 HA ALA 106 HA ALA 106 -5.155 -22.423 -1.955 826 HB1 ALA 106 1HB ALA 106 -6.231 -21.920 0.367 827 HB2 ALA 106 2HB ALA 106 -6.226 -23.566 -0.267 828 HB3 ALA 106 3HB ALA 106 -5.046 -23.087 0.953 829 H PHE 107 H PHE 107 -2.870 -21.423 0.556 830 HA PHE 107 HA PHE 107 -3.551 -18.781 0.873 831 HB2 PHE 107 1HB PHE 107 -1.717 -20.083 2.061 832 HB3 PHE 107 2HB PHE 107 -0.690 -19.718 0.678 833 HD1 PHE 107 1HD PHE 107 -2.805 -18.071 3.255 834 HD2 PHE 107 2HD PHE 107 0.537 -17.758 0.638 835 HE1 PHE 107 1HE PHE 107 -2.218 -15.908 4.268 836 HE2 PHE 107 2HE PHE 107 1.130 -15.595 1.648 837 HZ PHE 107 HZ PHE 107 -0.248 -14.667 3.466 838 H LYS 108 H LYS 108 -1.352 -20.136 -1.572 839 HA LYS 108 HA LYS 108 -1.007 -17.609 -2.889 840 HB2 LYS 108 1HB LYS 108 -0.248 -20.430 -3.648 841 HB3 LYS 108 2HB LYS 108 0.121 -19.032 -4.649 842 HG2 LYS 108 1HG LYS 108 2.073 -19.190 -3.508 843 HG3 LYS 108 2HG LYS 108 1.183 -18.153 -2.391 844 HD2 LYS 108 1HD LYS 108 0.810 -19.878 -0.887 845 HD3 LYS 108 2HD LYS 108 1.052 -21.129 -2.108 846 HE2 LYS 108 1HE LYS 108 2.985 -21.246 -0.815 847 HE3 LYS 108 2HE LYS 108 3.474 -20.274 -2.203 848 HZ1 LYS 108 1HZ LYS 108 4.300 -19.156 -0.342 849 HZ2 LYS 108 2HZ LYS 108 2.877 -19.365 0.547 850 HZ3 LYS 108 3HZ LYS 108 2.908 -18.290 -0.758 851 H ASN 109 H ASN 109 -2.728 -20.624 -3.662 852 HA ASN 109 HA ASN 109 -3.749 -20.001 -6.131 853 HB2 ASN 109 1HB ASN 109 -4.795 -21.637 -3.851 854 HB3 ASN 109 2HB ASN 109 -5.818 -21.372 -5.260 855 HD21 ASN 109 1HD2 ASN 109 -2.829 -22.754 -4.108 856 HD22 ASN 109 2HD2 ASN 109 -2.570 -23.806 -5.454 857 H ILE 110 H ILE 110 -5.007 -19.043 -2.966 858 HA ILE 110 HA ILE 110 -7.211 -17.586 -4.152 859 HB ILE 110 HB ILE 110 -7.497 -18.739 -1.990 860 HG12 ILE 110 1HG1 ILE 110 -8.457 -16.722 -0.748 861 HG13 ILE 110 2HG1 ILE 110 -7.819 -15.740 -2.062 862 HG21 ILE 110 1HG2 ILE 110 -6.099 -18.503 -0.273 863 HG22 ILE 110 2HG2 ILE 110 -5.037 -17.631 -1.377 864 HG23 ILE 110 3HG2 ILE 110 -6.172 -16.743 -0.361 865 HD11 ILE 110 1HD1 ILE 110 -9.662 -16.132 -3.210 866 HD12 ILE 110 2HD1 ILE 110 -9.275 -17.852 -3.232 867 HD13 ILE 110 3HD1 ILE 110 -10.260 -17.186 -1.930 868 H ALA 111 H ALA 111 -4.025 -16.935 -2.899 869 HA ALA 111 HA ALA 111 -4.231 -14.179 -2.451 870 HB1 ALA 111 1HB ALA 111 -1.870 -15.853 -3.288 871 HB2 ALA 111 2HB ALA 111 -1.760 -14.161 -2.802 872 HB3 ALA 111 3HB ALA 111 -2.321 -15.375 -1.652 873 H SER 112 H SER 112 -3.478 -15.998 -5.391 874 HA SER 112 HA SER 112 -2.786 -13.851 -7.038 875 HB2 SER 112 1HB SER 112 -2.379 -16.132 -7.741 876 HB3 SER 112 2HB SER 112 -4.107 -16.483 -7.737 877 HG SER 112 HG SER 112 -3.550 -16.048 -9.830 878 H LYS 113 H LYS 113 -5.948 -15.325 -6.407 879 HA LYS 113 HA LYS 113 -7.441 -13.779 -8.207 880 HB2 LYS 113 1HB LYS 113 -8.186 -15.167 -5.636 881 HB3 LYS 113 2HB LYS 113 -9.371 -14.330 -6.632 882 HG2 LYS 113 1HG LYS 113 -8.369 -15.850 -8.527 883 HG3 LYS 113 2HG LYS 113 -7.893 -16.855 -7.156 884 HD2 LYS 113 1HD LYS 113 -9.965 -17.726 -7.565 885 HD3 LYS 113 2HD LYS 113 -10.407 -16.438 -6.442 886 HE2 LYS 113 1HE LYS 113 -10.823 -14.970 -8.424 887 HE3 LYS 113 2HE LYS 113 -10.568 -16.379 -9.452 888 HZ1 LYS 113 1HZ LYS 113 -12.859 -15.653 -7.871 889 HZ2 LYS 113 2HZ LYS 113 -12.387 -17.263 -7.662 890 HZ3 LYS 113 3HZ LYS 113 -12.751 -16.683 -9.209 891 H ILE 114 H ILE 114 -7.080 -13.349 -4.682 892 HA ILE 114 HA ILE 114 -8.455 -10.996 -4.369 893 HB ILE 114 HB ILE 114 -5.888 -11.739 -2.961 894 HG12 ILE 114 1HG1 ILE 114 -7.655 -13.480 -2.846 895 HG13 ILE 114 2HG1 ILE 114 -7.303 -12.765 -1.277 896 HG21 ILE 114 1HG2 ILE 114 -6.094 -9.859 -1.803 897 HG22 ILE 114 2HG2 ILE 114 -7.461 -9.397 -2.817 898 HG23 ILE 114 3HG2 ILE 114 -7.732 -10.306 -1.330 899 HD11 ILE 114 1HD1 ILE 114 -9.390 -11.264 -2.453 900 HD12 ILE 114 2HD1 ILE 114 -9.789 -12.975 -2.616 901 HD13 ILE 114 3HD1 ILE 114 -9.444 -12.297 -1.025 902 H ALA 115 H ALA 115 -5.041 -11.378 -5.271 903 HA ALA 115 HA ALA 115 -4.393 -8.651 -5.385 904 HB1 ALA 115 1HB ALA 115 -2.741 -10.488 -5.373 905 HB2 ALA 115 2HB ALA 115 -3.197 -10.875 -7.033 906 HB3 ALA 115 3HB ALA 115 -2.458 -9.317 -6.662 907 H ASN 116 H ASN 116 -5.253 -10.868 -8.048 908 HA ASN 116 HA ASN 116 -5.258 -9.021 -10.111 909 HB2 ASN 116 1HB ASN 116 -6.871 -11.534 -9.685 910 HB3 ASN 116 2HB ASN 116 -6.980 -10.593 -11.169 911 HD21 ASN 116 1HD2 ASN 116 -5.932 -13.329 -10.488 912 HD22 ASN 116 2HD2 ASN 116 -4.352 -13.366 -11.186 913 H GLU 117 H GLU 117 -8.012 -10.042 -8.094 914 HA GLU 117 HA GLU 117 -9.951 -8.402 -9.224 915 HB2 GLU 117 1HB GLU 117 -9.674 -9.328 -6.360 916 HB3 GLU 117 2HB GLU 117 -11.125 -8.602 -7.036 917 HG2 GLU 117 1HG GLU 117 -9.891 -11.254 -7.685 918 HG3 GLU 117 2HG GLU 117 -11.506 -10.910 -7.066 919 H LEU 118 H LEU 118 -7.564 -7.701 -6.728 920 HA LEU 118 HA LEU 118 -8.597 -5.044 -6.264 921 HB2 LEU 118 1HB LEU 118 -6.328 -6.666 -5.207 922 HB3 LEU 118 2HB LEU 118 -6.311 -4.918 -4.986 923 HG LEU 118 HG LEU 118 -8.664 -6.556 -4.108 924 HD11 LEU 118 1HD1 LEU 118 -7.712 -6.958 -1.998 925 HD12 LEU 118 2HD1 LEU 118 -6.333 -5.910 -2.328 926 HD13 LEU 118 3HD1 LEU 118 -6.485 -7.455 -3.164 927 HD21 LEU 118 1HD2 LEU 118 -9.212 -4.321 -3.977 928 HD22 LEU 118 2HD2 LEU 118 -7.565 -3.829 -3.581 929 HD23 LEU 118 3HD2 LEU 118 -8.567 -4.621 -2.363 930 H LYS 119 H LYS 119 -7.488 -5.985 -8.940 931 HA LYS 119 HA LYS 119 -6.116 -5.240 -10.615 932 HB2 LYS 119 1HB LYS 119 -7.133 -2.772 -9.250 933 HB3 LYS 119 2HB LYS 119 -6.017 -2.627 -10.601 934 HG2 LYS 119 1HG LYS 119 -8.067 -2.466 -11.635 935 HG3 LYS 119 2HG LYS 119 -7.689 -4.179 -11.828 936 HD2 LYS 119 1HD LYS 119 -9.072 -4.697 -9.871 937 HD3 LYS 119 2HD LYS 119 -9.455 -2.983 -9.691 938 HE2 LYS 119 1HE LYS 119 -11.292 -3.707 -10.856 939 HE3 LYS 119 2HE LYS 119 -10.239 -3.220 -12.183 940 HZ1 LYS 119 1HZ LYS 119 -9.655 -5.455 -12.599 941 HZ2 LYS 119 2HZ LYS 119 -11.339 -5.437 -12.436 942 HZ3 LYS 119 3HZ LYS 119 -10.373 -6.001 -11.167 943 H LEU 120 H LEU 120 -4.657 -6.124 -8.371 944 HA LEU 120 HA LEU 120 -2.523 -4.178 -7.980 945 HB2 LEU 120 1HB LEU 120 -2.968 -6.930 -6.836 946 HB3 LEU 120 2HB LEU 120 -1.594 -5.898 -6.445 947 HG LEU 120 HG LEU 120 -4.458 -5.125 -5.910 948 HD11 LEU 120 1HD1 LEU 120 -3.558 -5.619 -3.476 949 HD12 LEU 120 2HD1 LEU 120 -2.551 -6.778 -4.343 950 HD13 LEU 120 3HD1 LEU 120 -4.308 -6.877 -4.460 951 HD21 LEU 120 1HD2 LEU 120 -1.996 -4.071 -4.566 952 HD22 LEU 120 2HD2 LEU 120 -3.600 -3.345 -4.683 953 HD23 LEU 120 3HD2 LEU 120 -2.551 -3.402 -6.101 954 H SER 121 H SER 121 -0.271 -4.813 -8.282 955 HA SER 121 HA SER 121 0.452 -5.462 -10.793 956 HB2 SER 121 1HB SER 121 1.829 -5.761 -8.172 957 HB3 SER 121 2HB SER 121 2.572 -6.544 -9.567 958 HG SER 121 HG SER 121 3.104 -4.222 -9.035 959 H GLY 122 H GLY 122 0.582 -7.887 -8.170 960 HA2 GLY 122 1HA GLY 122 -0.137 -10.106 -8.239 961 HA3 GLY 122 2HA GLY 122 -0.533 -9.899 -9.939 962 HA PRO 123 HA PRO 123 4.227 -10.802 -9.666 963 HB2 PRO 123 1HB PRO 123 5.101 -11.787 -7.292 964 HB3 PRO 123 2HB PRO 123 5.089 -10.060 -7.669 965 HG2 PRO 123 1HG PRO 123 3.126 -11.665 -6.077 966 HG3 PRO 123 2HG PRO 123 3.800 -10.061 -5.733 967 HD2 PRO 123 1HD PRO 123 1.332 -10.407 -6.792 968 HD3 PRO 123 2HD PRO 123 2.348 -9.003 -7.176 969 H SER 124 H SER 124 4.380 -12.599 -10.842 970 HA SER 124 HA SER 124 3.049 -15.039 -9.976 971 HB2 SER 124 1HB SER 124 2.694 -14.480 -12.277 972 HB3 SER 124 2HB SER 124 4.422 -14.256 -12.553 973 HG SER 124 HG SER 124 4.633 -16.537 -12.044 974 H SER 125 H SER 125 4.084 -16.500 -8.808 975 HA SER 125 HA SER 125 6.993 -16.800 -9.179 976 HB2 SER 125 1HB SER 125 5.360 -16.809 -6.648 977 HB3 SER 125 2HB SER 125 6.942 -17.585 -6.721 978 HG SER 125 HG SER 125 6.942 -15.067 -7.777 979 H GLY 126 H GLY 126 6.490 -18.441 -10.754 980 HA2 GLY 126 1HA GLY 126 6.126 -20.603 -11.444 981 HA3 GLY 126 2HA GLY 126 6.713 -21.038 -9.845 Start of MODEL 6 1 H1 MET 1 H MET 1 -17.963 4.372 12.330 2 HA MET 1 HA MET 1 -18.584 6.947 11.038 3 HB2 MET 1 1HB MET 1 -19.265 5.925 13.781 4 HB3 MET 1 2HB MET 1 -19.176 7.651 13.457 5 HG2 MET 1 1HG MET 1 -20.815 7.195 11.553 6 HG3 MET 1 2HG MET 1 -21.070 5.629 12.321 7 HE1 MET 1 1HE MET 1 -22.291 5.075 13.951 8 HE2 MET 1 2HE MET 1 -22.099 5.925 15.484 9 HE3 MET 1 3HE MET 1 -23.627 6.023 14.607 10 H LYS 2 H LYS 2 -16.656 7.851 10.645 11 HA LYS 2 HA LYS 2 -14.930 8.429 12.912 12 HB2 LYS 2 1HB LYS 2 -14.174 6.253 11.770 13 HB3 LYS 2 2HB LYS 2 -13.693 7.274 10.421 14 HG2 LYS 2 1HG LYS 2 -11.728 7.122 11.581 15 HG3 LYS 2 2HG LYS 2 -12.405 8.601 12.267 16 HD2 LYS 2 1HD LYS 2 -11.761 7.453 14.164 17 HD3 LYS 2 2HD LYS 2 -13.455 6.980 14.018 18 HE2 LYS 2 1HE LYS 2 -12.925 4.853 13.254 19 HE3 LYS 2 2HE LYS 2 -11.308 5.333 12.739 20 HZ1 LYS 2 1HZ LYS 2 -11.945 4.073 15.072 21 HZ2 LYS 2 2HZ LYS 2 -11.700 5.676 15.550 22 HZ3 LYS 2 3HZ LYS 2 -10.479 4.844 14.728 23 H ASP 3 H ASP 3 -14.340 10.491 12.832 24 HA ASP 3 HA ASP 3 -14.891 12.068 10.487 25 HB2 ASP 3 1HB ASP 3 -14.309 13.976 11.849 26 HB3 ASP 3 2HB ASP 3 -15.316 12.890 12.802 27 H HIS 4 H HIS 4 -13.432 11.264 8.943 28 HA HIS 4 HA HIS 4 -10.851 12.527 9.007 29 HB2 HIS 4 1HB HIS 4 -10.023 10.660 10.119 30 HB3 HIS 4 2HB HIS 4 -11.130 9.558 9.305 31 HD1 HIS 4 1HD HIS 4 -7.704 10.699 9.246 32 HD2 HIS 4 2HD HIS 4 -10.390 9.182 6.463 33 HE1 HIS 4 1HE HIS 4 -6.300 9.928 7.307 34 HE2 HIS 4 2HE HIS 4 -7.953 9.093 5.600 35 H LEU 5 H LEU 5 -10.728 13.401 7.057 36 HA LEU 5 HA LEU 5 -11.153 11.763 4.700 37 HB2 LEU 5 1HB LEU 5 -12.835 14.148 5.389 38 HB3 LEU 5 2HB LEU 5 -12.570 13.669 3.714 39 HG LEU 5 HG LEU 5 -13.820 11.910 5.822 40 HD11 LEU 5 1HD1 LEU 5 -15.635 12.612 3.769 41 HD12 LEU 5 2HD1 LEU 5 -14.923 14.103 4.386 42 HD13 LEU 5 3HD1 LEU 5 -15.726 12.987 5.491 43 HD21 LEU 5 1HD2 LEU 5 -14.566 10.676 3.724 44 HD22 LEU 5 2HD2 LEU 5 -12.869 10.524 4.181 45 HD23 LEU 5 3HD2 LEU 5 -13.336 11.611 2.872 46 H ILE 6 H ILE 6 -9.466 12.117 3.433 47 HA ILE 6 HA ILE 6 -7.787 14.422 3.781 48 HB ILE 6 HB ILE 6 -7.638 12.210 1.730 49 HG12 ILE 6 1HG1 ILE 6 -5.839 12.534 4.114 50 HG13 ILE 6 2HG1 ILE 6 -7.389 11.715 4.273 51 HG21 ILE 6 1HG2 ILE 6 -6.328 14.686 1.776 52 HG22 ILE 6 2HG2 ILE 6 -5.142 13.500 2.319 53 HG23 ILE 6 3HG2 ILE 6 -5.952 13.289 0.767 54 HD11 ILE 6 1HD1 ILE 6 -6.239 10.534 2.058 55 HD12 ILE 6 2HD1 ILE 6 -4.895 10.760 3.177 56 HD13 ILE 6 3HD1 ILE 6 -6.325 9.864 3.687 57 H HIS 7 H HIS 7 -8.336 16.327 2.956 58 HA HIS 7 HA HIS 7 -9.627 16.397 0.309 59 HB2 HIS 7 1HB HIS 7 -10.958 17.331 2.206 60 HB3 HIS 7 2HB HIS 7 -9.695 18.535 2.448 61 HD1 HIS 7 1HD HIS 7 -11.775 17.376 -0.534 62 HD2 HIS 7 2HD HIS 7 -10.375 20.852 1.260 63 HE1 HIS 7 1HE HIS 7 -12.667 19.263 -1.937 64 HE2 HIS 7 2HE HIS 7 -11.736 21.352 -0.881 65 H ASN 8 H ASN 8 -7.781 16.423 -0.952 66 HA ASN 8 HA ASN 8 -6.533 18.963 -1.291 67 HB2 ASN 8 1HB ASN 8 -4.979 16.730 -0.005 68 HB3 ASN 8 2HB ASN 8 -4.170 17.954 -0.979 69 HD21 ASN 8 1HD2 ASN 8 -5.256 20.253 -0.363 70 HD22 ASN 8 2HD2 ASN 8 -5.136 20.602 1.325 71 H VAL 9 H VAL 9 -6.284 19.170 -3.408 72 HA VAL 9 HA VAL 9 -5.614 16.778 -4.994 73 HB VAL 9 HB VAL 9 -7.947 17.323 -5.389 74 HG11 VAL 9 1HG1 VAL 9 -8.728 19.403 -5.429 75 HG12 VAL 9 2HG1 VAL 9 -7.094 19.972 -5.083 76 HG13 VAL 9 3HG1 VAL 9 -7.647 19.836 -6.753 77 HG21 VAL 9 1HG2 VAL 9 -7.658 18.031 -7.906 78 HG22 VAL 9 2HG2 VAL 9 -5.949 17.783 -7.551 79 HG23 VAL 9 3HG2 VAL 9 -7.095 16.460 -7.336 80 H HIS 10 H HIS 10 -3.534 17.095 -5.519 81 HA HIS 10 HA HIS 10 -2.861 19.284 -7.257 82 HB2 HIS 10 1HB HIS 10 -1.511 19.051 -4.560 83 HB3 HIS 10 2HB HIS 10 -0.945 20.071 -5.879 84 HD1 HIS 10 1HD HIS 10 -3.270 20.001 -3.050 85 HD2 HIS 10 2HD HIS 10 -2.751 22.247 -6.507 86 HE1 HIS 10 1HE HIS 10 -4.639 22.083 -2.711 87 HE2 HIS 10 2HE HIS 10 -4.378 23.387 -4.850 88 H LYS 11 H LYS 11 -0.377 19.150 -7.747 89 HA LYS 11 HA LYS 11 1.059 17.849 -8.999 90 HB2 LYS 11 1HB LYS 11 1.141 16.718 -6.209 91 HB3 LYS 11 2HB LYS 11 2.242 16.168 -7.466 92 HG2 LYS 11 1HG LYS 11 3.395 18.146 -7.518 93 HG3 LYS 11 2HG LYS 11 2.022 19.087 -6.929 94 HD2 LYS 11 1HD LYS 11 3.351 17.050 -5.177 95 HD3 LYS 11 2HD LYS 11 4.026 18.673 -5.347 96 HE2 LYS 11 1HE LYS 11 1.127 18.348 -4.715 97 HE3 LYS 11 2HE LYS 11 2.319 18.128 -3.435 98 HZ1 LYS 11 1HZ LYS 11 2.964 20.460 -4.836 99 HZ2 LYS 11 2HZ LYS 11 2.445 20.314 -3.233 100 HZ3 LYS 11 3HZ LYS 11 1.313 20.525 -4.472 101 H GLU 12 H GLU 12 -1.361 17.054 -9.783 102 HA GLU 12 HA GLU 12 -1.534 14.153 -9.489 103 HB2 GLU 12 1HB GLU 12 -3.680 14.352 -10.643 104 HB3 GLU 12 2HB GLU 12 -3.602 15.447 -9.270 105 HG2 GLU 12 1HG GLU 12 -2.788 17.152 -11.097 106 HG3 GLU 12 2HG GLU 12 -3.637 16.048 -12.178 107 H GLU 13 H GLU 13 -0.313 12.988 -10.815 108 HA GLU 13 HA GLU 13 0.032 13.919 -13.589 109 HB2 GLU 13 1HB GLU 13 2.148 12.842 -13.659 110 HB3 GLU 13 2HB GLU 13 2.100 13.741 -12.149 111 HG2 GLU 13 1HG GLU 13 1.361 10.843 -12.250 112 HG3 GLU 13 2HG GLU 13 3.042 11.360 -12.129 113 H HIS 14 H HIS 14 -0.299 12.503 -15.275 114 HA HIS 14 HA HIS 14 -1.490 9.904 -14.558 115 HB2 HIS 14 1HB HIS 14 -2.280 11.849 -16.728 116 HB3 HIS 14 2HB HIS 14 -2.837 10.179 -16.689 117 HD1 HIS 14 1HD HIS 14 -5.161 10.141 -15.873 118 HD2 HIS 14 2HD HIS 14 -2.870 12.956 -13.851 119 HE1 HIS 14 1HE HIS 14 -6.694 11.143 -14.150 120 HE2 HIS 14 2HE HIS 14 -5.311 12.903 -12.995 121 H ALA 15 H ALA 15 0.628 8.974 -14.780 122 HA ALA 15 HA ALA 15 1.178 8.198 -17.524 123 HB1 ALA 15 1HB ALA 15 2.857 10.066 -16.045 124 HB2 ALA 15 2HB ALA 15 3.740 8.668 -16.660 125 HB3 ALA 15 3HB ALA 15 2.824 9.689 -17.767 126 H HIS 16 H HIS 16 1.903 6.143 -17.675 127 HA HIS 16 HA HIS 16 2.948 4.830 -15.273 128 HB2 HIS 16 1HB HIS 16 0.546 3.990 -16.874 129 HB3 HIS 16 2HB HIS 16 1.498 2.804 -15.985 130 HD1 HIS 16 1HD HIS 16 0.827 2.453 -13.626 131 HD2 HIS 16 2HD HIS 16 -0.472 6.122 -15.079 132 HE1 HIS 16 1HE HIS 16 -0.574 3.445 -11.789 133 HE2 HIS 16 2HE HIS 16 -1.419 5.626 -12.724 134 H ALA 17 H ALA 17 4.096 2.840 -15.712 135 HA ALA 17 HA ALA 17 4.847 2.406 -18.509 136 HB1 ALA 17 1HB ALA 17 6.781 3.471 -18.224 137 HB2 ALA 17 2HB ALA 17 6.547 3.589 -16.480 138 HB3 ALA 17 3HB ALA 17 7.255 2.132 -17.178 139 H HIS 18 H HIS 18 5.878 0.351 -18.894 140 HA HIS 18 HA HIS 18 4.944 -1.683 -17.021 141 HB2 HIS 18 1HB HIS 18 6.180 -2.214 -19.714 142 HB3 HIS 18 2HB HIS 18 5.062 -3.224 -18.802 143 HD1 HIS 18 1HD HIS 18 2.604 -2.895 -19.224 144 HD2 HIS 18 2HD HIS 18 4.942 0.074 -20.951 145 HE1 HIS 18 1HE HIS 18 1.038 -1.565 -20.674 146 HE2 HIS 18 2HE HIS 18 2.492 0.173 -21.775 147 H ASN 19 H ASN 19 6.442 -1.754 -15.393 148 HA ASN 19 HA ASN 19 9.203 -2.419 -16.179 149 HB2 ASN 19 1HB ASN 19 8.348 -1.252 -13.527 150 HB3 ASN 19 2HB ASN 19 9.988 -1.417 -14.149 151 HD21 ASN 19 1HD2 ASN 19 8.170 0.888 -13.308 152 HD22 ASN 19 2HD2 ASN 19 8.347 2.030 -14.593 153 H LYS 20 H LYS 20 9.081 -4.621 -16.241 154 HA LYS 20 HA LYS 20 7.815 -6.109 -14.111 155 HB2 LYS 20 1HB LYS 20 9.519 -7.149 -16.380 156 HB3 LYS 20 2HB LYS 20 8.418 -8.081 -15.373 157 HG2 LYS 20 1HG LYS 20 7.348 -5.793 -16.950 158 HG3 LYS 20 2HG LYS 20 7.717 -7.312 -17.770 159 HD2 LYS 20 1HD LYS 20 6.342 -8.367 -15.816 160 HD3 LYS 20 2HD LYS 20 5.682 -6.738 -15.656 161 HE2 LYS 20 1HE LYS 20 4.223 -7.953 -17.089 162 HE3 LYS 20 2HE LYS 20 5.128 -6.827 -18.101 163 HZ1 LYS 20 1HZ LYS 20 6.011 -8.495 -19.248 164 HZ2 LYS 20 2HZ LYS 20 4.881 -9.512 -18.506 165 HZ3 LYS 20 3HZ LYS 20 6.434 -9.358 -17.855 166 H ASP 21 H ASP 21 9.153 -5.244 -12.381 167 HA ASP 21 HA ASP 21 11.634 -6.789 -12.100 168 HB2 ASP 21 1HB ASP 21 12.229 -4.466 -12.704 169 HB3 ASP 21 2HB ASP 21 11.322 -3.885 -11.311 170 H TYR 22 H TYR 22 10.432 -8.237 -10.802 171 HA TYR 22 HA TYR 22 9.906 -7.205 -8.098 172 HB2 TYR 22 1HB TYR 22 8.110 -9.182 -8.167 173 HB3 TYR 22 2HB TYR 22 7.717 -7.538 -8.656 174 HD1 TYR 22 2HD TYR 22 7.743 -6.967 -11.114 175 HD2 TYR 22 1HD TYR 22 7.978 -10.972 -9.698 176 HE1 TYR 22 2HE TYR 22 7.071 -7.784 -13.334 177 HE2 TYR 22 1HE TYR 22 7.308 -11.801 -11.915 178 HH TYR 22 HH TYR 22 7.226 -9.795 -14.679 179 H ASP 23 H ASP 23 10.018 -10.316 -9.844 180 HA ASP 23 HA ASP 23 10.940 -12.326 -9.279 181 HB2 ASP 23 1HB ASP 23 13.044 -10.288 -8.721 182 HB3 ASP 23 2HB ASP 23 13.341 -11.944 -8.199 183 H ILE 24 H ILE 24 9.129 -11.307 -7.354 184 HA ILE 24 HA ILE 24 9.755 -11.153 -4.748 185 HB ILE 24 HB ILE 24 7.648 -13.155 -5.422 186 HG12 ILE 24 1HG1 ILE 24 6.251 -10.892 -5.785 187 HG13 ILE 24 2HG1 ILE 24 7.801 -10.363 -6.429 188 HG21 ILE 24 1HG2 ILE 24 7.821 -12.582 -3.131 189 HG22 ILE 24 2HG2 ILE 24 7.913 -10.860 -3.496 190 HG23 ILE 24 3HG2 ILE 24 6.403 -11.736 -3.748 191 HD11 ILE 24 1HD1 ILE 24 6.607 -11.159 -8.270 192 HD12 ILE 24 2HD1 ILE 24 7.730 -12.458 -7.866 193 HD13 ILE 24 3HD1 ILE 24 6.035 -12.580 -7.396 194 HA PRO 25 HA PRO 25 12.088 -14.739 -3.661 195 HB2 PRO 25 1HB PRO 25 11.838 -14.549 -0.964 196 HB3 PRO 25 2HB PRO 25 12.890 -13.488 -1.908 197 HG2 PRO 25 1HG PRO 25 10.140 -12.971 -0.847 198 HG3 PRO 25 2HG PRO 25 11.554 -11.902 -0.856 199 HD2 PRO 25 1HD PRO 25 9.549 -11.680 -2.662 200 HD3 PRO 25 2HD PRO 25 11.236 -11.292 -3.056 201 H THR 26 H THR 26 11.673 -16.361 -1.513 202 HA THR 26 HA THR 26 9.026 -17.536 -2.065 203 HB THR 26 HB THR 26 9.989 -19.733 -1.580 204 HG1 THR 26 1HG THR 26 12.182 -19.945 -1.161 205 HG21 THR 26 1HG2 THR 26 11.988 -19.202 -3.494 206 HG22 THR 26 2HG2 THR 26 10.671 -18.074 -3.817 207 HG23 THR 26 3HG2 THR 26 10.356 -19.808 -3.776 208 H THR 27 H THR 27 9.488 -15.574 -0.045 209 HA THR 27 HA THR 27 9.811 -16.813 2.502 210 HB THR 27 HB THR 27 8.374 -14.205 2.093 211 HG1 THR 27 1HG THR 27 10.133 -13.354 1.296 212 HG21 THR 27 1HG2 THR 27 10.019 -13.800 4.148 213 HG22 THR 27 2HG2 THR 27 9.881 -15.555 4.267 214 HG23 THR 27 3HG2 THR 27 8.435 -14.548 4.348 215 H GLU 28 H GLU 28 8.015 -16.478 4.206 216 HA GLU 28 HA GLU 28 5.697 -17.933 3.264 217 HB2 GLU 28 1HB GLU 28 6.497 -17.022 6.033 218 HB3 GLU 28 2HB GLU 28 5.088 -18.011 5.675 219 HG2 GLU 28 1HG GLU 28 6.865 -19.565 4.531 220 HG3 GLU 28 2HG GLU 28 7.972 -18.726 5.616 221 H ASN 29 H ASN 29 6.081 -15.129 2.453 222 HA ASN 29 HA ASN 29 3.426 -14.185 3.174 223 HB2 ASN 29 1HB ASN 29 4.534 -11.822 3.458 224 HB3 ASN 29 2HB ASN 29 4.478 -12.940 4.818 225 HD21 ASN 29 1HD2 ASN 29 6.288 -13.015 5.911 226 HD22 ASN 29 2HD2 ASN 29 7.881 -12.823 5.271 227 H LEU 30 H LEU 30 2.471 -12.916 1.612 228 HA LEU 30 HA LEU 30 3.996 -12.646 -0.891 229 HB2 LEU 30 1HB LEU 30 1.078 -13.068 -0.335 230 HB3 LEU 30 2HB LEU 30 1.643 -12.470 -1.893 231 HG LEU 30 HG LEU 30 2.422 -15.114 -0.665 232 HD11 LEU 30 1HD1 LEU 30 0.327 -14.348 -2.669 233 HD12 LEU 30 2HD1 LEU 30 0.171 -15.356 -1.231 234 HD13 LEU 30 3HD1 LEU 30 1.036 -15.963 -2.642 235 HD21 LEU 30 1HD2 LEU 30 3.315 -15.580 -2.913 236 HD22 LEU 30 2HD2 LEU 30 4.145 -14.240 -2.122 237 HD23 LEU 30 3HD2 LEU 30 2.954 -13.918 -3.383 238 H TYR 31 H TYR 31 4.332 -10.687 -1.735 239 HA TYR 31 HA TYR 31 3.174 -8.384 -0.348 240 HB2 TYR 31 1HB TYR 31 5.403 -8.375 -2.386 241 HB3 TYR 31 2HB TYR 31 4.968 -7.086 -1.269 242 HD1 TYR 31 1HD TYR 31 4.711 -8.443 1.282 243 HD2 TYR 31 2HD TYR 31 7.542 -9.073 -1.832 244 HE1 TYR 31 1HE TYR 31 6.316 -9.320 2.926 245 HE2 TYR 31 2HE TYR 31 9.154 -9.953 -0.196 246 HH TYR 31 HH TYR 31 9.562 -10.381 1.940 247 H PHE 32 H PHE 32 2.081 -6.747 -1.408 248 HA PHE 32 HA PHE 32 1.535 -7.060 -4.260 249 HB2 PHE 32 1HB PHE 32 -0.687 -6.766 -2.232 250 HB3 PHE 32 2HB PHE 32 -0.864 -6.933 -3.975 251 HD1 PHE 32 1HD PHE 32 0.563 -8.729 -1.039 252 HD2 PHE 32 2HD PHE 32 -1.292 -9.015 -4.859 253 HE1 PHE 32 1HE PHE 32 0.423 -11.172 -0.784 254 HE2 PHE 32 2HE PHE 32 -1.436 -11.458 -4.610 255 HZ PHE 32 HZ PHE 32 -0.578 -12.540 -2.571 256 H GLN 33 H GLN 33 0.967 -5.160 -5.312 257 HA GLN 33 HA GLN 33 0.790 -2.719 -3.703 258 HB2 GLN 33 1HB GLN 33 2.646 -2.999 -6.071 259 HB3 GLN 33 2HB GLN 33 2.433 -1.571 -5.067 260 HG2 GLN 33 1HG GLN 33 3.442 -4.194 -4.003 261 HG3 GLN 33 2HG GLN 33 4.498 -2.927 -4.626 262 HE21 GLN 33 1HE2 GLN 33 5.395 -1.825 -3.053 263 HE22 GLN 33 2HE2 GLN 33 4.645 -1.364 -1.567 264 H GLY 34 H GLY 34 -0.340 -1.024 -4.664 265 HA2 GLY 34 1HA GLY 34 -1.118 -0.323 -7.048 266 HA3 GLY 34 2HA GLY 34 -1.984 -1.849 -6.953 267 H SER 35 H SER 35 -1.537 1.192 -5.161 268 HA SER 35 HA SER 35 -3.875 0.951 -3.606 269 HB2 SER 35 1HB SER 35 -3.418 3.099 -2.839 270 HB3 SER 35 2HB SER 35 -1.824 2.563 -3.370 271 HG SER 35 HG SER 35 -2.730 3.586 -5.491 272 H SER 36 H SER 36 -5.809 2.303 -3.749 273 HA SER 36 HA SER 36 -6.560 2.918 -6.531 274 HB2 SER 36 1HB SER 36 -8.895 2.165 -5.871 275 HB3 SER 36 2HB SER 36 -7.693 0.883 -6.017 276 HG SER 36 HG SER 36 -9.196 1.228 -3.995 277 H GLY 37 H GLY 37 -5.577 4.644 -4.351 278 HA2 GLY 37 1HA GLY 37 -6.540 7.004 -4.576 279 HA3 GLY 37 2HA GLY 37 -7.976 6.286 -3.860 280 H SER 38 H SER 38 -8.073 5.962 -1.680 281 HA SER 38 HA SER 38 -5.761 6.941 -0.137 282 HB2 SER 38 1HB SER 38 -8.675 6.983 0.683 283 HB3 SER 38 2HB SER 38 -7.324 7.703 1.558 284 HG SER 38 HG SER 38 -8.769 8.712 -0.490 285 H SER 39 H SER 39 -5.480 6.003 2.016 286 HA SER 39 HA SER 39 -5.291 3.232 1.970 287 HB2 SER 39 1HB SER 39 -3.894 4.346 3.507 288 HB3 SER 39 2HB SER 39 -5.241 5.229 4.225 289 HG SER 39 HG SER 39 -4.250 3.184 5.268 290 H GLY 40 H GLY 40 -7.959 5.268 2.822 291 HA2 GLY 40 1HA GLY 40 -9.412 3.396 4.390 292 HA3 GLY 40 2HA GLY 40 -10.076 4.816 3.596 293 H ASP 41 H ASP 41 -10.084 4.510 1.069 294 HA ASP 41 HA ASP 41 -12.068 2.906 0.290 295 HB2 ASP 41 1HB ASP 41 -9.554 3.400 -1.320 296 HB3 ASP 41 2HB ASP 41 -11.088 2.845 -1.984 297 H MET 42 H MET 42 -8.661 1.863 0.274 298 HA MET 42 HA MET 42 -8.772 -0.641 -0.689 299 HB2 MET 42 1HB MET 42 -7.230 0.571 1.545 300 HB3 MET 42 2HB MET 42 -7.181 -1.181 1.394 301 HG2 MET 42 1HG MET 42 -6.671 0.486 -1.017 302 HG3 MET 42 2HG MET 42 -5.410 0.335 0.205 303 HE1 MET 42 1HE MET 42 -6.488 -1.346 -3.160 304 HE2 MET 42 2HE MET 42 -5.160 -0.286 -2.689 305 HE3 MET 42 3HE MET 42 -4.844 -1.979 -3.072 306 H MET 43 H MET 43 -9.112 -0.136 2.827 307 HA MET 43 HA MET 43 -9.915 -2.522 3.697 308 HB2 MET 43 1HB MET 43 -11.519 -0.087 4.457 309 HB3 MET 43 2HB MET 43 -11.128 -1.481 5.454 310 HG2 MET 43 1HG MET 43 -8.657 -0.660 4.968 311 HG3 MET 43 2HG MET 43 -9.484 0.881 4.757 312 HE1 MET 43 1HE MET 43 -10.160 -2.133 7.515 313 HE2 MET 43 2HE MET 43 -8.503 -1.992 6.925 314 HE3 MET 43 3HE MET 43 -8.893 -1.524 8.581 315 H ARG 44 H ARG 44 -11.868 -0.378 1.724 316 HA ARG 44 HA ARG 44 -14.185 -2.120 1.888 317 HB2 ARG 44 1HB ARG 44 -13.632 0.480 0.471 318 HB3 ARG 44 2HB ARG 44 -15.102 -0.441 0.184 319 HG2 ARG 44 1HG ARG 44 -15.973 0.040 2.231 320 HG3 ARG 44 2HG ARG 44 -14.388 0.183 2.994 321 HD2 ARG 44 1HD ARG 44 -14.977 2.384 2.950 322 HD3 ARG 44 2HD ARG 44 -14.201 2.264 1.371 323 HE ARG 44 HE ARG 44 -16.239 2.604 0.378 324 HH11 ARG 44 2HH1 ARG 44 -16.710 1.841 3.741 325 HH12 ARG 44 1HH1 ARG 44 -18.402 2.210 3.723 326 HH21 ARG 44 2HH2 ARG 44 -18.466 3.093 0.340 327 HH22 ARG 44 1HH2 ARG 44 -19.401 2.921 1.787 328 H GLU 45 H GLU 45 -12.234 -0.805 -0.800 329 HA GLU 45 HA GLU 45 -13.142 -2.284 -2.877 330 HB2 GLU 45 1HB GLU 45 -11.208 -0.567 -2.774 331 HB3 GLU 45 2HB GLU 45 -10.178 -1.965 -2.495 332 HG2 GLU 45 1HG GLU 45 -10.430 -2.753 -4.614 333 HG3 GLU 45 2HG GLU 45 -12.037 -2.056 -4.803 334 H ILE 46 H ILE 46 -10.820 -3.362 -0.434 335 HA ILE 46 HA ILE 46 -10.186 -5.847 -1.548 336 HB ILE 46 HB ILE 46 -10.319 -5.077 1.370 337 HG12 ILE 46 1HG1 ILE 46 -7.846 -5.282 -0.330 338 HG13 ILE 46 2HG1 ILE 46 -8.788 -3.797 -0.278 339 HG21 ILE 46 1HG2 ILE 46 -10.124 -7.309 1.633 340 HG22 ILE 46 2HG2 ILE 46 -9.532 -7.559 -0.009 341 HG23 ILE 46 3HG2 ILE 46 -8.433 -6.992 1.247 342 HD11 ILE 46 1HD1 ILE 46 -8.322 -4.667 2.387 343 HD12 ILE 46 2HD1 ILE 46 -6.793 -4.668 1.507 344 HD13 ILE 46 3HD1 ILE 46 -7.766 -3.199 1.583 345 H ARG 47 H ARG 47 -12.326 -5.367 1.265 346 HA ARG 47 HA ARG 47 -13.465 -7.760 1.555 347 HB2 ARG 47 1HB ARG 47 -14.910 -5.107 1.524 348 HB3 ARG 47 2HB ARG 47 -15.624 -6.599 2.122 349 HG2 ARG 47 1HG ARG 47 -13.737 -6.749 3.756 350 HG3 ARG 47 2HG ARG 47 -13.244 -5.137 3.234 351 HD2 ARG 47 1HD ARG 47 -16.073 -5.548 4.050 352 HD3 ARG 47 2HD ARG 47 -14.842 -5.508 5.312 353 HE ARG 47 HE ARG 47 -14.310 -3.304 3.816 354 HH11 ARG 47 2HH1 ARG 47 -17.152 -4.524 5.415 355 HH12 ARG 47 1HH1 ARG 47 -17.814 -2.953 5.721 356 HH21 ARG 47 2HH2 ARG 47 -15.171 -1.229 4.213 357 HH22 ARG 47 1HH2 ARG 47 -16.687 -1.079 5.036 358 H LYS 48 H LYS 48 -14.491 -5.420 -0.915 359 HA LYS 48 HA LYS 48 -16.613 -6.595 -2.079 360 HB2 LYS 48 1HB LYS 48 -15.278 -4.536 -2.841 361 HB3 LYS 48 2HB LYS 48 -14.319 -5.662 -3.792 362 HG2 LYS 48 1HG LYS 48 -17.272 -5.762 -4.074 363 HG3 LYS 48 2HG LYS 48 -16.406 -4.408 -4.804 364 HD2 LYS 48 1HD LYS 48 -15.358 -7.153 -5.264 365 HD3 LYS 48 2HD LYS 48 -16.826 -6.670 -6.118 366 HE2 LYS 48 1HE LYS 48 -15.478 -4.553 -6.742 367 HE3 LYS 48 2HE LYS 48 -14.069 -5.510 -6.287 368 HZ1 LYS 48 1HZ LYS 48 -14.134 -6.464 -8.267 369 HZ2 LYS 48 2HZ LYS 48 -15.501 -5.565 -8.693 370 HZ3 LYS 48 3HZ LYS 48 -15.680 -7.074 -7.950 371 H VAL 49 H VAL 49 -13.238 -7.520 -2.719 372 HA VAL 49 HA VAL 49 -13.822 -9.600 -4.526 373 HB VAL 49 HB VAL 49 -11.421 -9.555 -2.709 374 HG11 VAL 49 1HG1 VAL 49 -10.451 -10.373 -5.014 375 HG12 VAL 49 2HG1 VAL 49 -11.265 -11.494 -3.921 376 HG13 VAL 49 3HG1 VAL 49 -12.129 -10.826 -5.307 377 HG21 VAL 49 1HG2 VAL 49 -11.543 -7.339 -3.564 378 HG22 VAL 49 2HG2 VAL 49 -10.337 -8.195 -4.525 379 HG23 VAL 49 3HG2 VAL 49 -11.950 -7.917 -5.180 380 H LEU 50 H LEU 50 -13.260 -9.618 -1.022 381 HA LEU 50 HA LEU 50 -13.343 -12.359 -0.585 382 HB2 LEU 50 1HB LEU 50 -14.490 -10.281 1.266 383 HB3 LEU 50 2HB LEU 50 -13.845 -11.863 1.698 384 HG LEU 50 HG LEU 50 -12.238 -9.532 0.654 385 HD11 LEU 50 1HD1 LEU 50 -11.429 -9.241 2.848 386 HD12 LEU 50 2HD1 LEU 50 -12.169 -10.742 3.405 387 HD13 LEU 50 3HD1 LEU 50 -13.183 -9.358 2.995 388 HD21 LEU 50 1HD2 LEU 50 -10.717 -11.599 1.921 389 HD22 LEU 50 2HD2 LEU 50 -10.574 -10.952 0.286 390 HD23 LEU 50 3HD2 LEU 50 -11.678 -12.288 0.612 391 H GLY 51 H GLY 51 -16.056 -10.079 -0.117 392 HA2 GLY 51 1HA GLY 51 -18.068 -11.896 0.343 393 HA3 GLY 51 2HA GLY 51 -18.314 -10.351 -0.459 394 H ALA 52 H ALA 52 -16.669 -10.974 -2.751 395 HA ALA 52 HA ALA 52 -18.634 -12.220 -4.373 396 HB1 ALA 52 1HB ALA 52 -16.167 -10.796 -4.761 397 HB2 ALA 52 2HB ALA 52 -16.231 -12.216 -5.805 398 HB3 ALA 52 3HB ALA 52 -17.521 -11.015 -5.870 399 H ASN 53 H ASN 53 -15.588 -13.315 -2.971 400 HA ASN 53 HA ASN 53 -15.914 -15.945 -4.201 401 HB2 ASN 53 1HB ASN 53 -13.670 -14.540 -2.801 402 HB3 ASN 53 2HB ASN 53 -13.669 -16.300 -2.878 403 HD21 ASN 53 1HD2 ASN 53 -13.689 -13.360 -4.786 404 HD22 ASN 53 2HD2 ASN 53 -13.018 -14.060 -6.216 405 H ASN 54 H ASN 54 -17.831 -15.158 -2.250 406 HA ASN 54 HA ASN 54 -18.764 -15.767 -0.246 407 HB2 ASN 54 1HB ASN 54 -17.543 -18.451 -0.897 408 HB3 ASN 54 2HB ASN 54 -19.031 -18.133 -0.009 409 HD21 ASN 54 1HD2 ASN 54 -17.691 -18.855 -2.987 410 HD22 ASN 54 2HD2 ASN 54 -19.078 -18.563 -3.975 411 H CYS 55 H CYS 55 -16.306 -14.551 0.182 412 HA CYS 55 HA CYS 55 -15.042 -16.182 2.273 413 HB2 CYS 55 1HB CYS 55 -14.071 -13.721 0.812 414 HB3 CYS 55 2HB CYS 55 -13.212 -14.468 2.153 415 HG CYS 55 HG CYS 55 -13.773 -15.818 -0.936 416 H ASP 56 H ASP 56 -14.297 -14.962 4.225 417 HA ASP 56 HA ASP 56 -16.265 -12.903 4.984 418 HB2 ASP 56 1HB ASP 56 -15.101 -15.038 6.785 419 HB3 ASP 56 2HB ASP 56 -16.282 -13.816 7.247 420 H TYR 57 H TYR 57 -15.563 -11.361 6.572 421 HA TYR 57 HA TYR 57 -12.673 -11.189 7.002 422 HB2 TYR 57 1HB TYR 57 -12.842 -8.705 6.416 423 HB3 TYR 57 2HB TYR 57 -12.859 -9.843 5.073 424 HD1 TYR 57 2HD TYR 57 -14.935 -10.262 3.827 425 HD2 TYR 57 1HD TYR 57 -14.774 -7.371 6.945 426 HE1 TYR 57 2HE TYR 57 -17.044 -9.287 3.024 427 HE2 TYR 57 1HE TYR 57 -16.884 -6.388 6.150 428 HH TYR 57 HH TYR 57 -18.967 -7.893 4.132 429 H GLU 58 H GLU 58 -12.061 -10.039 8.831 430 HA GLU 58 HA GLU 58 -14.219 -8.962 10.507 431 HB2 GLU 58 1HB GLU 58 -13.805 -11.212 11.315 432 HB3 GLU 58 2HB GLU 58 -12.077 -10.899 11.395 433 HG2 GLU 58 1HG GLU 58 -12.250 -9.631 13.291 434 HG3 GLU 58 2HG GLU 58 -13.917 -9.165 12.960 435 H GLN 59 H GLN 59 -13.717 -6.864 10.602 436 HA GLN 59 HA GLN 59 -11.145 -5.776 10.357 437 HB2 GLN 59 1HB GLN 59 -13.568 -4.705 10.222 438 HB3 GLN 59 2HB GLN 59 -13.231 -4.307 11.901 439 HG2 GLN 59 1HG GLN 59 -10.966 -3.427 10.850 440 HG3 GLN 59 2HG GLN 59 -11.982 -3.284 9.417 441 HE21 GLN 59 1HE2 GLN 59 -10.947 -1.032 10.374 442 HE22 GLN 59 2HE2 GLN 59 -12.145 -0.077 11.173 443 H ARG 60 H ARG 60 -9.499 -5.937 11.714 444 HA ARG 60 HA ARG 60 -9.969 -6.543 14.519 445 HB2 ARG 60 1HB ARG 60 -7.391 -6.329 12.952 446 HB3 ARG 60 2HB ARG 60 -7.524 -6.864 14.622 447 HG2 ARG 60 1HG ARG 60 -9.024 -8.264 12.446 448 HG3 ARG 60 2HG ARG 60 -7.325 -8.625 12.758 449 HD2 ARG 60 1HD ARG 60 -8.418 -10.190 14.068 450 HD3 ARG 60 2HD ARG 60 -8.089 -8.894 15.217 451 HE ARG 60 HE ARG 60 -10.670 -8.767 13.917 452 HH11 ARG 60 2HH1 ARG 60 -8.841 -9.877 16.663 453 HH12 ARG 60 1HH1 ARG 60 -10.226 -10.017 17.694 454 HH21 ARG 60 2HH2 ARG 60 -12.502 -8.947 15.265 455 HH22 ARG 60 1HH2 ARG 60 -12.308 -9.488 16.898 456 H GLU 61 H GLU 61 -8.500 -4.008 12.538 457 HA GLU 61 HA GLU 61 -8.782 -2.164 14.790 458 HB2 GLU 61 1HB GLU 61 -6.246 -2.341 13.156 459 HB3 GLU 61 2HB GLU 61 -6.556 -1.261 14.508 460 HG2 GLU 61 1HG GLU 61 -6.806 -3.299 15.949 461 HG3 GLU 61 2HG GLU 61 -6.220 -4.245 14.582 462 H ARG 62 H ARG 62 -7.861 0.121 13.807 463 HA ARG 62 HA ARG 62 -9.824 1.018 12.070 464 HB2 ARG 62 1HB ARG 62 -8.520 3.051 11.849 465 HB3 ARG 62 2HB ARG 62 -8.449 2.482 13.511 466 HG2 ARG 62 1HG ARG 62 -6.238 1.458 12.992 467 HG3 ARG 62 2HG ARG 62 -6.311 2.237 11.411 468 HD2 ARG 62 1HD ARG 62 -6.205 4.387 12.343 469 HD3 ARG 62 2HD ARG 62 -6.616 3.801 13.954 470 HE ARG 62 HE ARG 62 -4.155 2.718 12.970 471 HH11 ARG 62 2HH1 ARG 62 -5.619 5.463 14.532 472 HH12 ARG 62 1HH1 ARG 62 -4.155 5.966 15.310 473 HH21 ARG 62 2HH2 ARG 62 -2.221 3.370 13.988 474 HH22 ARG 62 1HH2 ARG 62 -2.223 4.775 14.999 475 H PHE 63 H PHE 63 -6.477 0.080 11.337 476 HA PHE 63 HA PHE 63 -7.238 -0.060 8.493 477 HB2 PHE 63 1HB PHE 63 -4.589 0.681 9.742 478 HB3 PHE 63 2HB PHE 63 -4.779 0.306 8.032 479 HD1 PHE 63 2HD PHE 63 -6.907 1.648 6.977 480 HD2 PHE 63 1HD PHE 63 -4.486 2.904 10.244 481 HE1 PHE 63 2HE PHE 63 -7.528 3.987 6.533 482 HE2 PHE 63 1HE PHE 63 -5.103 5.245 9.806 483 HZ PHE 63 HZ PHE 63 -6.625 5.789 7.948 484 H LEU 64 H LEU 64 -7.803 -2.224 9.993 485 HA LEU 64 HA LEU 64 -5.916 -4.189 8.952 486 HB2 LEU 64 1HB LEU 64 -5.540 -3.513 11.468 487 HB3 LEU 64 2HB LEU 64 -6.906 -4.595 11.733 488 HG LEU 64 HG LEU 64 -4.548 -5.565 10.176 489 HD11 LEU 64 1HD1 LEU 64 -4.050 -6.426 12.727 490 HD12 LEU 64 2HD1 LEU 64 -4.526 -4.746 12.975 491 HD13 LEU 64 3HD1 LEU 64 -3.188 -5.132 11.893 492 HD21 LEU 64 1HD2 LEU 64 -5.758 -7.323 12.128 493 HD22 LEU 64 2HD2 LEU 64 -5.559 -7.536 10.388 494 HD23 LEU 64 3HD2 LEU 64 -6.957 -6.662 11.016 495 H LEU 65 H LEU 65 -6.849 -6.111 8.367 496 HA LEU 65 HA LEU 65 -9.609 -6.652 9.126 497 HB2 LEU 65 1HB LEU 65 -8.692 -5.915 6.400 498 HB3 LEU 65 2HB LEU 65 -9.897 -7.193 6.542 499 HG LEU 65 HG LEU 65 -10.374 -4.587 7.917 500 HD11 LEU 65 1HD1 LEU 65 -11.461 -4.781 5.206 501 HD12 LEU 65 2HD1 LEU 65 -9.713 -4.558 5.278 502 HD13 LEU 65 3HD1 LEU 65 -10.784 -3.398 6.065 503 HD21 LEU 65 1HD2 LEU 65 -11.943 -6.907 6.934 504 HD22 LEU 65 2HD2 LEU 65 -12.720 -5.324 6.926 505 HD23 LEU 65 3HD2 LEU 65 -12.091 -5.992 8.434 506 H PHE 66 H PHE 66 -9.859 -8.743 9.551 507 HA PHE 66 HA PHE 66 -7.737 -10.594 8.830 508 HB2 PHE 66 1HB PHE 66 -8.808 -10.426 11.151 509 HB3 PHE 66 2HB PHE 66 -10.197 -11.245 10.444 510 HD1 PHE 66 1HD PHE 66 -9.526 -13.428 9.053 511 HD2 PHE 66 2HD PHE 66 -7.263 -11.724 12.230 512 HE1 PHE 66 1HE PHE 66 -8.445 -15.603 9.445 513 HE2 PHE 66 2HE PHE 66 -6.178 -13.896 12.626 514 HZ PHE 66 HZ PHE 66 -6.767 -15.839 11.233 515 H CYS 67 H CYS 67 -7.906 -11.310 6.785 516 HA CYS 67 HA CYS 67 -10.508 -11.987 5.675 517 HB2 CYS 67 1HB CYS 67 -7.738 -12.019 4.461 518 HB3 CYS 67 2HB CYS 67 -9.211 -12.421 3.587 519 HG CYS 67 HG CYS 67 -8.695 -9.370 5.041 520 H VAL 68 H VAL 68 -11.261 -14.003 5.351 521 HA VAL 68 HA VAL 68 -9.459 -16.284 5.662 522 HB VAL 68 HB VAL 68 -10.333 -15.949 7.905 523 HG11 VAL 68 1HG1 VAL 68 -12.403 -15.260 8.338 524 HG12 VAL 68 2HG1 VAL 68 -12.643 -15.102 6.597 525 HG13 VAL 68 3HG1 VAL 68 -13.104 -16.593 7.420 526 HG21 VAL 68 1HG2 VAL 68 -11.988 -18.203 7.544 527 HG22 VAL 68 2HG2 VAL 68 -10.713 -18.305 6.330 528 HG23 VAL 68 3HG2 VAL 68 -10.295 -18.166 8.038 529 H HIS 69 H HIS 69 -9.821 -17.725 4.114 530 HA HIS 69 HA HIS 69 -12.322 -17.567 2.599 531 HB2 HIS 69 1HB HIS 69 -10.398 -17.405 1.200 532 HB3 HIS 69 2HB HIS 69 -9.632 -18.787 1.979 533 HD1 HIS 69 1HD HIS 69 -9.723 -20.820 0.595 534 HD2 HIS 69 2HD HIS 69 -12.997 -18.355 -0.089 535 HE1 HIS 69 1HE HIS 69 -11.077 -21.978 -1.180 536 HE2 HIS 69 2HE HIS 69 -13.007 -20.426 -1.638 537 H GLY 70 H GLY 70 -13.834 -19.106 2.695 538 HA2 GLY 70 1HA GLY 70 -13.087 -21.722 3.837 539 HA3 GLY 70 2HA GLY 70 -14.505 -20.861 4.416 540 H ASP 71 H ASP 71 -13.066 -22.391 1.577 541 HA ASP 71 HA ASP 71 -15.169 -22.231 -0.202 542 HB2 ASP 71 1HB ASP 71 -12.771 -23.332 -0.378 543 HB3 ASP 71 2HB ASP 71 -13.663 -24.805 -0.006 544 H GLY 72 H GLY 72 -14.649 -24.605 2.380 545 HA2 GLY 72 1HA GLY 72 -17.442 -25.014 2.737 546 HA3 GLY 72 2HA GLY 72 -16.730 -26.352 1.848 547 H HIS 73 H HIS 73 -14.202 -26.357 3.151 548 HA HIS 73 HA HIS 73 -14.805 -26.813 5.969 549 HB2 HIS 73 1HB HIS 73 -14.175 -28.935 3.982 550 HB3 HIS 73 2HB HIS 73 -13.417 -29.065 5.567 551 HD1 HIS 73 1HD HIS 73 -14.802 -30.057 7.386 552 HD2 HIS 73 2HD HIS 73 -17.096 -28.863 4.134 553 HE1 HIS 73 1HE HIS 73 -17.129 -30.882 7.865 554 HE2 HIS 73 2HE HIS 73 -18.480 -30.222 5.845 555 H ALA 74 H ALA 74 -12.571 -27.890 6.899 556 HA ALA 74 HA ALA 74 -10.702 -25.796 6.837 557 HB1 ALA 74 1HB ALA 74 -10.953 -27.326 8.735 558 HB2 ALA 74 2HB ALA 74 -10.283 -28.636 7.761 559 HB3 ALA 74 3HB ALA 74 -9.282 -27.245 8.177 560 H GLU 75 H GLU 75 -11.009 -28.696 4.931 561 HA GLU 75 HA GLU 75 -8.452 -29.051 3.962 562 HB2 GLU 75 1HB GLU 75 -10.689 -30.326 3.474 563 HB3 GLU 75 2HB GLU 75 -10.784 -29.244 2.092 564 HG2 GLU 75 1HG GLU 75 -8.309 -30.079 1.715 565 HG3 GLU 75 2HG GLU 75 -8.891 -31.459 2.644 566 H ASN 76 H ASN 76 -10.946 -26.818 2.790 567 HA ASN 76 HA ASN 76 -8.895 -25.509 1.131 568 HB2 ASN 76 1HB ASN 76 -11.827 -25.024 0.753 569 HB3 ASN 76 2HB ASN 76 -10.520 -24.925 -0.424 570 HD21 ASN 76 1HD2 ASN 76 -13.091 -26.722 0.619 571 HD22 ASN 76 2HD2 ASN 76 -12.695 -28.231 -0.124 572 H LEU 77 H LEU 77 -9.270 -25.070 3.975 573 HA LEU 77 HA LEU 77 -10.382 -22.356 4.043 574 HB2 LEU 77 1HB LEU 77 -11.078 -24.155 5.704 575 HB3 LEU 77 2HB LEU 77 -9.469 -23.980 6.402 576 HG LEU 77 HG LEU 77 -10.210 -21.433 6.523 577 HD11 LEU 77 1HD1 LEU 77 -12.833 -22.409 7.295 578 HD12 LEU 77 2HD1 LEU 77 -12.533 -22.565 5.565 579 HD13 LEU 77 3HD1 LEU 77 -12.385 -20.991 6.346 580 HD21 LEU 77 1HD2 LEU 77 -10.305 -23.707 8.321 581 HD22 LEU 77 2HD2 LEU 77 -11.463 -22.454 8.769 582 HD23 LEU 77 3HD2 LEU 77 -9.751 -22.057 8.612 583 H VAL 78 H VAL 78 -9.188 -20.609 4.819 584 HA VAL 78 HA VAL 78 -6.424 -20.945 5.584 585 HB VAL 78 HB VAL 78 -7.127 -19.564 2.992 586 HG11 VAL 78 1HG1 VAL 78 -4.528 -19.609 4.521 587 HG12 VAL 78 2HG1 VAL 78 -4.710 -19.033 2.863 588 HG13 VAL 78 3HG1 VAL 78 -5.535 -18.202 4.182 589 HG21 VAL 78 1HG2 VAL 78 -6.887 -21.827 2.506 590 HG22 VAL 78 2HG2 VAL 78 -5.277 -21.177 2.197 591 HG23 VAL 78 3HG2 VAL 78 -5.604 -22.048 3.696 592 H GLN 79 H GLN 79 -5.851 -19.393 6.975 593 HA GLN 79 HA GLN 79 -7.571 -17.011 7.151 594 HB2 GLN 79 1HB GLN 79 -6.001 -18.467 9.279 595 HB3 GLN 79 2HB GLN 79 -6.759 -16.901 9.535 596 HG2 GLN 79 1HG GLN 79 -8.900 -17.770 9.415 597 HG3 GLN 79 2HG GLN 79 -8.372 -19.216 8.555 598 HE21 GLN 79 1HE2 GLN 79 -8.955 -20.835 9.840 599 HE22 GLN 79 2HE2 GLN 79 -8.521 -20.999 11.504 600 H TRP 80 H TRP 80 -6.686 -15.129 6.640 601 HA TRP 80 HA TRP 80 -3.863 -14.645 7.186 602 HB2 TRP 80 1HB TRP 80 -3.274 -14.031 4.984 603 HB3 TRP 80 2HB TRP 80 -4.154 -15.547 4.808 604 HD1 TRP 80 HD TRP 80 -4.322 -11.870 3.902 605 HE1 TRP 80 1HE TRP 80 -6.301 -11.485 2.303 606 HE3 TRP 80 3HE TRP 80 -6.546 -16.461 4.243 607 HZ2 TRP 80 2HZ TRP 80 -8.513 -12.935 1.317 608 HZ3 TRP 80 3HZ TRP 80 -8.591 -16.880 2.940 609 HH2 TRP 80 HH TRP 80 -9.553 -15.152 1.508 610 H GLU 81 H GLU 81 -3.380 -12.520 7.595 611 HA GLU 81 HA GLU 81 -5.681 -10.741 7.873 612 HB2 GLU 81 1HB GLU 81 -2.974 -10.899 9.119 613 HB3 GLU 81 2HB GLU 81 -3.771 -9.334 9.053 614 HG2 GLU 81 1HG GLU 81 -5.781 -10.579 10.093 615 HG3 GLU 81 2HG GLU 81 -4.588 -11.806 10.516 616 H MET 82 H MET 82 -6.007 -9.014 6.622 617 HA MET 82 HA MET 82 -3.829 -8.188 4.817 618 HB2 MET 82 1HB MET 82 -6.726 -8.654 4.343 619 HB3 MET 82 2HB MET 82 -5.978 -7.314 3.485 620 HG2 MET 82 1HG MET 82 -4.217 -8.982 2.732 621 HG3 MET 82 2HG MET 82 -5.309 -10.231 3.327 622 HE1 MET 82 1HE MET 82 -6.302 -7.244 -0.021 623 HE2 MET 82 2HE MET 82 -5.505 -6.883 1.510 624 HE3 MET 82 3HE MET 82 -4.631 -7.743 0.242 625 H GLU 83 H GLU 83 -3.073 -6.595 6.248 626 HA GLU 83 HA GLU 83 -4.927 -4.423 6.907 627 HB2 GLU 83 1HB GLU 83 -3.506 -3.816 8.636 628 HB3 GLU 83 2HB GLU 83 -3.321 -5.564 8.604 629 HG2 GLU 83 1HG GLU 83 -1.449 -3.689 7.189 630 HG3 GLU 83 2HG GLU 83 -1.204 -4.237 8.846 631 H VAL 84 H VAL 84 -4.494 -2.274 6.364 632 HA VAL 84 HA VAL 84 -2.900 -1.962 3.946 633 HB VAL 84 HB VAL 84 -4.757 -0.003 5.304 634 HG11 VAL 84 1HG1 VAL 84 -3.562 0.108 2.538 635 HG12 VAL 84 2HG1 VAL 84 -4.601 1.316 3.298 636 HG13 VAL 84 3HG1 VAL 84 -2.975 1.032 3.920 637 HG21 VAL 84 1HG2 VAL 84 -5.649 -2.213 4.247 638 HG22 VAL 84 2HG2 VAL 84 -6.453 -0.684 3.894 639 HG23 VAL 84 3HG2 VAL 84 -5.340 -1.386 2.720 640 H CYS 85 H CYS 85 -0.781 -1.794 4.512 641 HA CYS 85 HA CYS 85 0.303 -0.577 6.745 642 HB2 CYS 85 1HB CYS 85 1.381 -1.957 4.756 643 HB3 CYS 85 2HB CYS 85 1.763 -0.350 4.150 644 HG CYS 85 HG CYS 85 3.790 0.098 5.671 645 H LYS 86 H LYS 86 1.956 1.387 6.353 646 HA LYS 86 HA LYS 86 0.650 3.561 4.913 647 HB2 LYS 86 1HB LYS 86 -0.223 3.423 7.321 648 HB3 LYS 86 2HB LYS 86 1.388 3.930 7.810 649 HG2 LYS 86 1HG LYS 86 0.142 5.899 7.754 650 HG3 LYS 86 2HG LYS 86 1.055 5.914 6.243 651 HD2 LYS 86 1HD LYS 86 -1.129 6.546 5.644 652 HD3 LYS 86 2HD LYS 86 -1.001 4.847 5.179 653 HE2 LYS 86 1HE LYS 86 -3.121 5.225 6.265 654 HE3 LYS 86 2HE LYS 86 -2.104 4.222 7.299 655 HZ1 LYS 86 1HZ LYS 86 -1.722 6.970 7.881 656 HZ2 LYS 86 2HZ LYS 86 -2.228 5.723 8.906 657 HZ3 LYS 86 3HZ LYS 86 -3.364 6.576 7.987 658 H LEU 87 H LEU 87 2.206 4.413 3.711 659 HA LEU 87 HA LEU 87 4.983 4.199 4.493 660 HB2 LEU 87 1HB LEU 87 3.512 5.063 2.050 661 HB3 LEU 87 2HB LEU 87 5.181 5.586 2.267 662 HG LEU 87 HG LEU 87 4.533 2.682 2.496 663 HD11 LEU 87 1HD1 LEU 87 5.176 2.742 -0.063 664 HD12 LEU 87 2HD1 LEU 87 4.407 4.327 0.025 665 HD13 LEU 87 3HD1 LEU 87 3.501 2.881 0.473 666 HD21 LEU 87 1HD2 LEU 87 6.769 3.355 3.034 667 HD22 LEU 87 2HD2 LEU 87 6.899 4.290 1.544 668 HD23 LEU 87 3HD2 LEU 87 6.799 2.530 1.475 669 HA PRO 88 HA PRO 88 5.568 8.218 6.156 670 HB2 PRO 88 1HB PRO 88 8.033 8.861 5.218 671 HB3 PRO 88 2HB PRO 88 7.771 7.650 6.479 672 HG2 PRO 88 1HG PRO 88 8.237 7.263 3.547 673 HG3 PRO 88 2HG PRO 88 8.920 6.367 4.916 674 HD2 PRO 88 1HD PRO 88 6.852 5.424 3.445 675 HD3 PRO 88 2HD PRO 88 7.029 5.075 5.177 676 H ARG 89 H ARG 89 6.073 7.840 2.692 677 HA ARG 89 HA ARG 89 5.522 10.700 2.302 678 HB2 ARG 89 1HB ARG 89 6.909 8.627 0.636 679 HB3 ARG 89 2HB ARG 89 6.241 10.066 -0.122 680 HG2 ARG 89 1HG ARG 89 8.182 10.163 2.171 681 HG3 ARG 89 2HG ARG 89 8.672 10.182 0.476 682 HD2 ARG 89 1HD ARG 89 6.611 12.130 1.363 683 HD3 ARG 89 2HD ARG 89 8.282 12.413 1.848 684 HE ARG 89 HE ARG 89 8.489 11.961 -0.805 685 HH11 ARG 89 2HH1 ARG 89 6.491 14.084 1.097 686 HH12 ARG 89 1HH1 ARG 89 6.382 15.298 -0.134 687 HH21 ARG 89 2HH2 ARG 89 8.354 13.552 -2.434 688 HH22 ARG 89 1HH2 ARG 89 7.442 14.994 -2.143 689 H LEU 90 H LEU 90 3.715 8.165 2.703 690 HA LEU 90 HA LEU 90 1.764 7.310 1.861 691 HB2 LEU 90 1HB LEU 90 1.606 10.265 1.719 692 HB3 LEU 90 2HB LEU 90 0.335 9.354 0.906 693 HG LEU 90 HG LEU 90 0.285 8.142 3.300 694 HD11 LEU 90 1HD1 LEU 90 0.738 10.966 4.139 695 HD12 LEU 90 2HD1 LEU 90 2.120 9.887 3.954 696 HD13 LEU 90 3HD1 LEU 90 0.828 9.480 5.084 697 HD21 LEU 90 1HD2 LEU 90 -1.142 10.739 3.165 698 HD22 LEU 90 2HD2 LEU 90 -1.750 9.128 3.548 699 HD23 LEU 90 3HD2 LEU 90 -1.434 9.576 1.871 700 H SER 91 H SER 91 3.988 7.315 -0.016 701 HA SER 91 HA SER 91 3.204 8.134 -2.587 702 HB2 SER 91 1HB SER 91 5.060 6.947 -3.385 703 HB3 SER 91 2HB SER 91 5.523 7.343 -1.730 704 HG SER 91 HG SER 91 5.819 5.083 -2.477 705 H LEU 92 H LEU 92 2.347 5.379 -0.670 706 HA LEU 92 HA LEU 92 0.190 4.668 -2.331 707 HB2 LEU 92 1HB LEU 92 0.933 2.530 -3.179 708 HB3 LEU 92 2HB LEU 92 1.963 3.825 -3.787 709 HG LEU 92 HG LEU 92 3.474 3.100 -1.740 710 HD11 LEU 92 1HD1 LEU 92 2.084 1.447 -0.774 711 HD12 LEU 92 2HD1 LEU 92 3.394 0.587 -1.582 712 HD13 LEU 92 3HD1 LEU 92 1.801 0.672 -2.333 713 HD21 LEU 92 1HD2 LEU 92 4.479 1.347 -3.370 714 HD22 LEU 92 2HD2 LEU 92 4.451 3.048 -3.834 715 HD23 LEU 92 3HD2 LEU 92 3.245 1.935 -4.484 716 H ASN 93 H ASN 93 -0.412 2.174 -1.717 717 HA ASN 93 HA ASN 93 -0.288 2.106 1.224 718 HB2 ASN 93 1HB ASN 93 -2.466 1.349 1.299 719 HB3 ASN 93 2HB ASN 93 -2.532 2.358 -0.143 720 HD21 ASN 93 1HD2 ASN 93 -1.805 1.075 -2.180 721 HD22 ASN 93 2HD2 ASN 93 -2.569 -0.462 -2.374 722 H GLY 94 H GLY 94 0.731 0.460 2.161 723 HA2 GLY 94 1HA GLY 94 1.780 -1.684 0.515 724 HA3 GLY 94 2HA GLY 94 2.147 -1.390 2.209 725 H VAL 95 H VAL 95 0.665 -3.468 0.123 726 HA VAL 95 HA VAL 95 -1.140 -4.480 2.224 727 HB VAL 95 HB VAL 95 -1.413 -4.962 -0.744 728 HG11 VAL 95 1HG1 VAL 95 -2.460 -6.735 0.354 729 HG12 VAL 95 2HG1 VAL 95 -3.049 -5.703 1.658 730 HG13 VAL 95 3HG1 VAL 95 -3.772 -5.596 0.052 731 HG21 VAL 95 1HG2 VAL 95 -2.054 -2.637 0.758 732 HG22 VAL 95 2HG2 VAL 95 -2.385 -2.975 -0.941 733 HG23 VAL 95 3HG2 VAL 95 -3.561 -3.426 0.294 734 H ARG 96 H ARG 96 -0.051 -6.057 3.235 735 HA ARG 96 HA ARG 96 1.406 -8.020 1.597 736 HB2 ARG 96 1HB ARG 96 2.777 -6.855 3.269 737 HB3 ARG 96 2HB ARG 96 1.687 -7.391 4.541 738 HG2 ARG 96 1HG ARG 96 2.434 -9.565 4.454 739 HG3 ARG 96 2HG ARG 96 3.007 -9.413 2.792 740 HD2 ARG 96 1HD ARG 96 4.887 -9.538 4.316 741 HD3 ARG 96 2HD ARG 96 4.816 -7.943 3.568 742 HE ARG 96 HE ARG 96 4.418 -7.024 5.632 743 HH11 ARG 96 2HH1 ARG 96 4.003 -10.476 5.800 744 HH12 ARG 96 1HH1 ARG 96 3.875 -10.508 7.528 745 HH21 ARG 96 2HH2 ARG 96 4.250 -7.052 7.906 746 HH22 ARG 96 1HH2 ARG 96 4.014 -8.559 8.725 747 H PHE 97 H PHE 97 1.319 -10.275 2.322 748 HA PHE 97 HA PHE 97 -1.272 -10.930 3.564 749 HB2 PHE 97 1HB PHE 97 0.128 -12.211 1.221 750 HB3 PHE 97 2HB PHE 97 -1.143 -13.036 2.117 751 HD1 PHE 97 1HD PHE 97 -0.597 -9.649 0.640 752 HD2 PHE 97 2HD PHE 97 -3.213 -12.966 1.152 753 HE1 PHE 97 1HE PHE 97 -2.293 -8.519 -0.738 754 HE2 PHE 97 2HE PHE 97 -4.914 -11.843 -0.225 755 HZ PHE 97 HZ PHE 97 -4.455 -9.616 -1.173 756 H LYS 98 H LYS 98 -1.129 -12.052 5.382 757 HA LYS 98 HA LYS 98 1.339 -13.576 5.902 758 HB2 LYS 98 1HB LYS 98 1.047 -11.677 7.421 759 HB3 LYS 98 2HB LYS 98 -0.547 -12.267 7.872 760 HG2 LYS 98 1HG LYS 98 1.770 -14.083 8.250 761 HG3 LYS 98 2HG LYS 98 1.581 -12.723 9.360 762 HD2 LYS 98 1HD LYS 98 -0.896 -13.582 9.488 763 HD3 LYS 98 2HD LYS 98 -0.178 -15.098 8.939 764 HE2 LYS 98 1HE LYS 98 0.890 -13.562 11.293 765 HE3 LYS 98 2HE LYS 98 -0.391 -14.763 11.453 766 HZ1 LYS 98 1HZ LYS 98 1.094 -16.420 10.513 767 HZ2 LYS 98 2HZ LYS 98 1.777 -15.724 11.894 768 HZ3 LYS 98 3HZ LYS 98 2.324 -15.269 10.359 769 H ARG 99 H ARG 99 1.149 -15.708 6.062 770 HA ARG 99 HA ARG 99 -1.457 -16.939 5.989 771 HB2 ARG 99 1HB ARG 99 0.315 -17.874 4.625 772 HB3 ARG 99 2HB ARG 99 1.324 -18.118 6.045 773 HG2 ARG 99 1HG ARG 99 -0.511 -19.655 6.897 774 HG3 ARG 99 2HG ARG 99 -1.174 -19.581 5.263 775 HD2 ARG 99 1HD ARG 99 0.150 -21.423 5.042 776 HD3 ARG 99 2HD ARG 99 1.322 -20.176 4.617 777 HE ARG 99 HE ARG 99 1.264 -20.846 7.419 778 HH11 ARG 99 2HH1 ARG 99 2.632 -21.583 4.304 779 HH12 ARG 99 1HH1 ARG 99 4.058 -22.318 4.959 780 HH21 ARG 99 2HH2 ARG 99 3.136 -21.811 8.293 781 HH22 ARG 99 1HH2 ARG 99 4.343 -22.448 7.228 782 H ILE 100 H ILE 100 -2.561 -16.965 7.852 783 HA ILE 100 HA ILE 100 -1.244 -17.273 10.399 784 HB ILE 100 HB ILE 100 -4.178 -17.152 9.696 785 HG12 ILE 100 1HG1 ILE 100 -2.277 -15.100 10.848 786 HG13 ILE 100 2HG1 ILE 100 -3.009 -15.064 9.248 787 HG21 ILE 100 1HG2 ILE 100 -4.697 -17.085 11.979 788 HG22 ILE 100 2HG2 ILE 100 -3.527 -18.395 11.831 789 HG23 ILE 100 3HG2 ILE 100 -3.017 -16.823 12.443 790 HD11 ILE 100 1HD1 ILE 100 -3.983 -13.612 11.162 791 HD12 ILE 100 2HD1 ILE 100 -5.072 -14.462 10.064 792 HD13 ILE 100 3HD1 ILE 100 -4.748 -15.119 11.669 793 H SER 101 H SER 101 -3.593 -19.169 8.510 794 HA SER 101 HA SER 101 -2.471 -21.622 9.580 795 HB2 SER 101 1HB SER 101 -5.217 -20.633 10.251 796 HB3 SER 101 2HB SER 101 -4.954 -22.365 10.051 797 HG SER 101 HG SER 101 -3.128 -20.998 11.638 798 H GLY 102 H GLY 102 -3.329 -23.551 8.486 799 HA2 GLY 102 1HA GLY 102 -4.618 -24.514 6.693 800 HA3 GLY 102 2HA GLY 102 -4.601 -22.946 5.898 801 H THR 103 H THR 103 -3.962 -24.647 4.166 802 HA THR 103 HA THR 103 -1.186 -25.450 4.233 803 HB THR 103 HB THR 103 -1.588 -26.403 2.020 804 HG1 THR 103 1HG THR 103 -4.296 -25.657 2.118 805 HG21 THR 103 1HG2 THR 103 -3.220 -27.016 4.364 806 HG22 THR 103 2HG2 THR 103 -2.296 -28.092 3.315 807 HG23 THR 103 3HG2 THR 103 -3.923 -27.592 2.854 808 H SER 104 H SER 104 0.300 -24.899 2.458 809 HA SER 104 HA SER 104 0.417 -22.061 2.097 810 HB2 SER 104 1HB SER 104 2.179 -24.141 0.789 811 HB3 SER 104 2HB SER 104 2.557 -22.444 1.080 812 HG SER 104 HG SER 104 2.497 -24.594 2.867 813 H ILE 105 H ILE 105 0.222 -24.799 -0.178 814 HA ILE 105 HA ILE 105 0.099 -23.607 -2.579 815 HB ILE 105 HB ILE 105 -1.707 -25.801 -1.573 816 HG12 ILE 105 1HG1 ILE 105 0.786 -26.168 -1.658 817 HG13 ILE 105 2HG1 ILE 105 -0.160 -27.290 -2.630 818 HG21 ILE 105 1HG2 ILE 105 -2.198 -26.316 -3.910 819 HG22 ILE 105 2HG2 ILE 105 -2.766 -24.705 -3.477 820 HG23 ILE 105 3HG2 ILE 105 -1.287 -24.895 -4.418 821 HD11 ILE 105 1HD1 ILE 105 0.618 -26.450 -4.599 822 HD12 ILE 105 2HD1 ILE 105 0.899 -24.842 -3.932 823 HD13 ILE 105 3HD1 ILE 105 2.014 -26.157 -3.563 824 H ALA 106 H ALA 106 -2.865 -24.136 -0.658 825 HA ALA 106 HA ALA 106 -4.590 -22.628 -2.211 826 HB1 ALA 106 1HB ALA 106 -6.059 -23.292 -0.685 827 HB2 ALA 106 2HB ALA 106 -4.721 -23.978 0.238 828 HB3 ALA 106 3HB ALA 106 -5.266 -22.333 0.566 829 H PHE 107 H PHE 107 -2.422 -21.591 0.371 830 HA PHE 107 HA PHE 107 -3.313 -19.008 0.781 831 HB2 PHE 107 1HB PHE 107 -1.459 -20.235 2.012 832 HB3 PHE 107 2HB PHE 107 -0.393 -19.768 0.691 833 HD1 PHE 107 1HD PHE 107 -2.706 -18.339 3.227 834 HD2 PHE 107 2HD PHE 107 0.706 -17.731 0.755 835 HE1 PHE 107 1HE PHE 107 -2.293 -16.180 4.332 836 HE2 PHE 107 2HE PHE 107 1.124 -15.572 1.857 837 HZ PHE 107 HZ PHE 107 -0.376 -14.794 3.649 838 H LYS 108 H LYS 108 -1.032 -20.186 -1.668 839 HA LYS 108 HA LYS 108 -0.739 -17.578 -2.857 840 HB2 LYS 108 1HB LYS 108 0.204 -20.328 -3.667 841 HB3 LYS 108 2HB LYS 108 0.513 -18.890 -4.633 842 HG2 LYS 108 1HG LYS 108 2.440 -18.941 -3.444 843 HG3 LYS 108 2HG LYS 108 1.456 -17.997 -2.323 844 HD2 LYS 108 1HD LYS 108 2.404 -19.599 -0.939 845 HD3 LYS 108 2HD LYS 108 0.830 -20.303 -1.318 846 HE2 LYS 108 1HE LYS 108 1.727 -21.937 -2.639 847 HE3 LYS 108 2HE LYS 108 3.109 -20.950 -3.110 848 HZ1 LYS 108 1HZ LYS 108 4.308 -21.961 -1.569 849 HZ2 LYS 108 2HZ LYS 108 2.981 -22.906 -1.115 850 HZ3 LYS 108 3HZ LYS 108 3.262 -21.420 -0.355 851 H ASN 109 H ASN 109 -2.286 -20.643 -3.782 852 HA ASN 109 HA ASN 109 -3.237 -20.034 -6.269 853 HB2 ASN 109 1HB ASN 109 -4.292 -21.715 -4.039 854 HB3 ASN 109 2HB ASN 109 -5.331 -21.431 -5.433 855 HD21 ASN 109 1HD2 ASN 109 -2.219 -22.688 -4.407 856 HD22 ASN 109 2HD2 ASN 109 -1.995 -23.749 -5.752 857 H ILE 110 H ILE 110 -4.733 -19.188 -3.165 858 HA ILE 110 HA ILE 110 -6.896 -17.766 -4.429 859 HB ILE 110 HB ILE 110 -7.064 -18.937 -2.194 860 HG12 ILE 110 1HG1 ILE 110 -8.534 -17.202 -1.225 861 HG13 ILE 110 2HG1 ILE 110 -7.838 -16.013 -2.320 862 HG21 ILE 110 1HG2 ILE 110 -6.276 -17.821 -0.223 863 HG22 ILE 110 2HG2 ILE 110 -4.913 -18.049 -1.318 864 HG23 ILE 110 3HG2 ILE 110 -5.674 -16.465 -1.176 865 HD11 ILE 110 1HD1 ILE 110 -9.086 -16.697 -4.046 866 HD12 ILE 110 2HD1 ILE 110 -8.922 -18.402 -3.625 867 HD13 ILE 110 3HD1 ILE 110 -10.107 -17.397 -2.791 868 H ALA 111 H ALA 111 -4.039 -16.860 -2.513 869 HA ALA 111 HA ALA 111 -4.297 -14.160 -2.342 870 HB1 ALA 111 1HB ALA 111 -1.943 -15.945 -2.663 871 HB2 ALA 111 2HB ALA 111 -1.694 -14.204 -2.792 872 HB3 ALA 111 3HB ALA 111 -2.389 -14.888 -1.323 873 H SER 112 H SER 112 -3.616 -16.023 -5.212 874 HA SER 112 HA SER 112 -2.684 -13.926 -6.854 875 HB2 SER 112 1HB SER 112 -2.347 -16.241 -7.499 876 HB3 SER 112 2HB SER 112 -4.088 -16.510 -7.575 877 HG SER 112 HG SER 112 -4.211 -15.263 -9.373 878 H LYS 113 H LYS 113 -5.911 -15.436 -6.688 879 HA LYS 113 HA LYS 113 -7.258 -13.810 -8.449 880 HB2 LYS 113 1HB LYS 113 -8.099 -15.277 -5.978 881 HB3 LYS 113 2HB LYS 113 -9.252 -14.224 -6.789 882 HG2 LYS 113 1HG LYS 113 -9.582 -16.444 -7.584 883 HG3 LYS 113 2HG LYS 113 -8.849 -15.503 -8.885 884 HD2 LYS 113 1HD LYS 113 -6.788 -16.558 -8.652 885 HD3 LYS 113 2HD LYS 113 -7.144 -17.103 -7.011 886 HE2 LYS 113 1HE LYS 113 -7.430 -19.068 -8.135 887 HE3 LYS 113 2HE LYS 113 -9.067 -18.424 -8.251 888 HZ1 LYS 113 1HZ LYS 113 -8.838 -18.710 -10.431 889 HZ2 LYS 113 2HZ LYS 113 -7.165 -18.940 -10.327 890 HZ3 LYS 113 3HZ LYS 113 -7.800 -17.374 -10.417 891 H ILE 114 H ILE 114 -7.330 -13.351 -4.909 892 HA ILE 114 HA ILE 114 -8.576 -10.986 -4.668 893 HB ILE 114 HB ILE 114 -6.007 -11.666 -3.231 894 HG12 ILE 114 1HG1 ILE 114 -7.651 -13.448 -3.003 895 HG13 ILE 114 2HG1 ILE 114 -7.512 -12.570 -1.484 896 HG21 ILE 114 1HG2 ILE 114 -8.123 -10.086 -1.916 897 HG22 ILE 114 2HG2 ILE 114 -6.369 -9.952 -1.805 898 HG23 ILE 114 3HG2 ILE 114 -7.219 -9.270 -3.191 899 HD11 ILE 114 1HD1 ILE 114 -9.542 -11.240 -2.726 900 HD12 ILE 114 2HD1 ILE 114 -9.797 -12.902 -3.259 901 HD13 ILE 114 3HD1 ILE 114 -9.736 -12.527 -1.537 902 H ALA 115 H ALA 115 -5.113 -11.303 -5.431 903 HA ALA 115 HA ALA 115 -4.529 -8.582 -5.647 904 HB1 ALA 115 1HB ALA 115 -2.501 -9.208 -6.579 905 HB2 ALA 115 2HB ALA 115 -2.958 -10.635 -5.648 906 HB3 ALA 115 3HB ALA 115 -3.194 -10.610 -7.396 907 H ASN 116 H ASN 116 -5.016 -10.846 -8.366 908 HA ASN 116 HA ASN 116 -5.101 -9.069 -10.433 909 HB2 ASN 116 1HB ASN 116 -6.489 -11.676 -9.951 910 HB3 ASN 116 2HB ASN 116 -6.905 -10.743 -11.386 911 HD21 ASN 116 1HD2 ASN 116 -4.381 -12.472 -9.720 912 HD22 ASN 116 2HD2 ASN 116 -3.330 -12.645 -11.080 913 H GLU 117 H GLU 117 -7.741 -9.892 -8.230 914 HA GLU 117 HA GLU 117 -9.711 -8.334 -9.559 915 HB2 GLU 117 1HB GLU 117 -9.647 -9.203 -6.665 916 HB3 GLU 117 2HB GLU 117 -11.062 -8.673 -7.564 917 HG2 GLU 117 1HG GLU 117 -10.343 -10.675 -9.142 918 HG3 GLU 117 2HG GLU 117 -9.615 -11.255 -7.646 919 H LEU 118 H LEU 118 -7.539 -7.721 -6.837 920 HA LEU 118 HA LEU 118 -8.568 -5.056 -6.428 921 HB2 LEU 118 1HB LEU 118 -6.470 -6.756 -5.179 922 HB3 LEU 118 2HB LEU 118 -6.381 -5.011 -4.952 923 HG LEU 118 HG LEU 118 -8.835 -6.609 -4.260 924 HD11 LEU 118 1HD1 LEU 118 -8.048 -7.122 -2.198 925 HD12 LEU 118 2HD1 LEU 118 -6.977 -5.723 -2.133 926 HD13 LEU 118 3HD1 LEU 118 -6.513 -7.146 -3.066 927 HD21 LEU 118 1HD2 LEU 118 -9.528 -4.710 -3.090 928 HD22 LEU 118 2HD2 LEU 118 -8.857 -4.069 -4.590 929 HD23 LEU 118 3HD2 LEU 118 -7.913 -4.000 -3.101 930 H LYS 119 H LYS 119 -6.914 -6.207 -8.882 931 HA LYS 119 HA LYS 119 -5.440 -5.398 -10.418 932 HB2 LYS 119 1HB LYS 119 -6.725 -2.970 -9.257 933 HB3 LYS 119 2HB LYS 119 -5.343 -2.743 -10.322 934 HG2 LYS 119 1HG LYS 119 -7.853 -4.250 -11.030 935 HG3 LYS 119 2HG LYS 119 -7.481 -2.593 -11.511 936 HD2 LYS 119 1HD LYS 119 -5.358 -3.556 -12.553 937 HD3 LYS 119 2HD LYS 119 -6.115 -5.138 -12.345 938 HE2 LYS 119 1HE LYS 119 -8.094 -4.221 -13.614 939 HE3 LYS 119 2HE LYS 119 -7.099 -2.816 -13.992 940 HZ1 LYS 119 1HZ LYS 119 -6.650 -5.628 -14.805 941 HZ2 LYS 119 2HZ LYS 119 -5.454 -4.440 -14.938 942 HZ3 LYS 119 3HZ LYS 119 -6.900 -4.284 -15.802 943 H LEU 120 H LEU 120 -4.375 -6.141 -7.830 944 HA LEU 120 HA LEU 120 -2.279 -4.216 -7.266 945 HB2 LEU 120 1HB LEU 120 -2.975 -6.897 -6.091 946 HB3 LEU 120 2HB LEU 120 -1.567 -5.961 -5.593 947 HG LEU 120 HG LEU 120 -4.416 -4.998 -5.361 948 HD11 LEU 120 1HD1 LEU 120 -4.528 -5.772 -3.218 949 HD12 LEU 120 2HD1 LEU 120 -2.778 -5.774 -3.005 950 HD13 LEU 120 3HD1 LEU 120 -3.554 -7.049 -3.945 951 HD21 LEU 120 1HD2 LEU 120 -1.891 -3.951 -4.090 952 HD22 LEU 120 2HD2 LEU 120 -3.506 -3.247 -4.003 953 HD23 LEU 120 3HD2 LEU 120 -2.634 -3.268 -5.536 954 H SER 121 H SER 121 -0.040 -5.434 -6.805 955 HA SER 121 HA SER 121 1.231 -5.830 -9.176 956 HB2 SER 121 1HB SER 121 2.274 -5.639 -6.867 957 HB3 SER 121 2HB SER 121 1.988 -7.370 -6.689 958 HG SER 121 HG SER 121 3.151 -7.302 -8.923 959 H GLY 122 H GLY 122 -0.030 -8.434 -7.090 960 HA2 GLY 122 1HA GLY 122 -0.881 -10.501 -7.661 961 HA3 GLY 122 2HA GLY 122 -0.833 -10.000 -9.345 962 HA PRO 123 HA PRO 123 3.561 -11.761 -8.325 963 HB2 PRO 123 1HB PRO 123 3.824 -13.038 -5.944 964 HB3 PRO 123 2HB PRO 123 4.141 -11.311 -6.147 965 HG2 PRO 123 1HG PRO 123 1.701 -12.676 -5.078 966 HG3 PRO 123 2HG PRO 123 2.533 -11.233 -4.469 967 HD2 PRO 123 1HD PRO 123 0.279 -11.094 -5.963 968 HD3 PRO 123 2HD PRO 123 1.546 -9.853 -6.029 969 H SER 124 H SER 124 3.654 -13.471 -9.629 970 HA SER 124 HA SER 124 3.023 -16.090 -8.763 971 HB2 SER 124 1HB SER 124 1.177 -16.608 -10.275 972 HB3 SER 124 2HB SER 124 0.714 -15.300 -9.187 973 HG SER 124 HG SER 124 0.216 -14.321 -10.982 974 H SER 125 H SER 125 4.333 -17.431 -9.818 975 HA SER 125 HA SER 125 5.905 -16.467 -12.016 976 HB2 SER 125 1HB SER 125 6.944 -18.757 -11.904 977 HB3 SER 125 2HB SER 125 6.999 -17.858 -10.388 978 HG SER 125 HG SER 125 6.294 -20.121 -10.266 979 H GLY 126 H GLY 126 4.274 -16.125 -13.615 980 HA2 GLY 126 1HA GLY 126 3.324 -16.761 -15.620 981 HA3 GLY 126 2HA GLY 126 3.919 -18.390 -15.333 Start of MODEL 7 1 H1 MET 1 H MET 1 -30.317 -22.979 -32.967 2 HA MET 1 HA MET 1 -30.184 -20.054 -32.972 3 HB2 MET 1 1HB MET 1 -31.590 -20.991 -31.251 4 HB3 MET 1 2HB MET 1 -30.300 -22.059 -30.715 5 HG2 MET 1 1HG MET 1 -30.397 -20.313 -29.148 6 HG3 MET 1 2HG MET 1 -28.982 -19.991 -30.148 7 HE1 MET 1 1HE MET 1 -29.375 -16.490 -31.043 8 HE2 MET 1 2HE MET 1 -28.402 -17.809 -30.391 9 HE3 MET 1 3HE MET 1 -28.971 -17.873 -32.060 10 H LYS 2 H LYS 2 -28.164 -19.840 -34.012 11 HA LYS 2 HA LYS 2 -25.876 -20.517 -32.287 12 HB2 LYS 2 1HB LYS 2 -24.569 -20.629 -34.510 13 HB3 LYS 2 2HB LYS 2 -25.573 -22.002 -34.062 14 HG2 LYS 2 1HG LYS 2 -26.756 -19.870 -35.765 15 HG3 LYS 2 2HG LYS 2 -25.620 -21.010 -36.490 16 HD2 LYS 2 1HD LYS 2 -27.029 -22.863 -35.548 17 HD3 LYS 2 2HD LYS 2 -28.215 -21.639 -35.089 18 HE2 LYS 2 1HE LYS 2 -29.052 -22.236 -37.126 19 HE3 LYS 2 2HE LYS 2 -27.956 -20.950 -37.627 20 HZ1 LYS 2 1HZ LYS 2 -26.359 -22.510 -38.326 21 HZ2 LYS 2 2HZ LYS 2 -27.833 -23.072 -38.936 22 HZ3 LYS 2 3HZ LYS 2 -27.152 -23.800 -37.570 23 H ASP 3 H ASP 3 -26.387 -18.308 -31.494 24 HA ASP 3 HA ASP 3 -25.444 -16.199 -33.309 25 HB2 ASP 3 1HB ASP 3 -27.694 -16.009 -32.107 26 HB3 ASP 3 2HB ASP 3 -26.762 -15.774 -30.631 27 H HIS 4 H HIS 4 -23.236 -16.419 -33.147 28 HA HIS 4 HA HIS 4 -22.089 -15.954 -30.472 29 HB2 HIS 4 1HB HIS 4 -21.592 -18.193 -31.588 30 HB3 HIS 4 2HB HIS 4 -20.643 -17.284 -32.761 31 HD1 HIS 4 1HD HIS 4 -20.737 -18.045 -29.056 32 HD2 HIS 4 2HD HIS 4 -18.103 -16.662 -31.956 33 HE1 HIS 4 1HE HIS 4 -18.491 -17.942 -27.930 34 HE2 HIS 4 2HE HIS 4 -16.930 -17.022 -29.679 35 H LEU 5 H LEU 5 -20.870 -14.189 -30.202 36 HA LEU 5 HA LEU 5 -19.876 -12.788 -32.589 37 HB2 LEU 5 1HB LEU 5 -20.354 -10.694 -31.027 38 HB3 LEU 5 2HB LEU 5 -21.549 -11.333 -32.155 39 HG LEU 5 HG LEU 5 -22.432 -10.737 -29.890 40 HD11 LEU 5 1HD1 LEU 5 -22.939 -13.608 -30.013 41 HD12 LEU 5 2HD1 LEU 5 -23.100 -12.791 -31.567 42 HD13 LEU 5 3HD1 LEU 5 -24.050 -12.249 -30.183 43 HD21 LEU 5 1HD2 LEU 5 -21.544 -13.211 -28.660 44 HD22 LEU 5 2HD2 LEU 5 -21.578 -11.572 -28.009 45 HD23 LEU 5 3HD2 LEU 5 -20.209 -12.105 -28.985 46 H ILE 6 H ILE 6 -18.534 -14.571 -30.718 47 HA ILE 6 HA ILE 6 -16.561 -12.673 -29.625 48 HB ILE 6 HB ILE 6 -17.304 -15.361 -28.465 49 HG12 ILE 6 1HG1 ILE 6 -19.029 -13.698 -28.028 50 HG13 ILE 6 2HG1 ILE 6 -18.136 -14.033 -26.549 51 HG21 ILE 6 1HG2 ILE 6 -15.609 -13.412 -27.012 52 HG22 ILE 6 2HG2 ILE 6 -15.591 -15.174 -26.982 53 HG23 ILE 6 3HG2 ILE 6 -14.868 -14.308 -28.338 54 HD11 ILE 6 1HD1 ILE 6 -16.839 -11.880 -27.805 55 HD12 ILE 6 2HD1 ILE 6 -18.570 -11.547 -27.864 56 HD13 ILE 6 3HD1 ILE 6 -17.786 -11.868 -26.318 57 H HIS 7 H HIS 7 -14.465 -13.005 -30.134 58 HA HIS 7 HA HIS 7 -13.835 -15.400 -31.732 59 HB2 HIS 7 1HB HIS 7 -12.296 -14.097 -33.030 60 HB3 HIS 7 2HB HIS 7 -13.824 -13.224 -32.988 61 HD1 HIS 7 1HD HIS 7 -10.392 -12.557 -32.812 62 HD2 HIS 7 2HD HIS 7 -13.664 -11.269 -30.600 63 HE1 HIS 7 1HE HIS 7 -9.656 -10.423 -31.703 64 HE2 HIS 7 2HE HIS 7 -11.624 -9.707 -30.303 65 H ASN 8 H ASN 8 -12.625 -16.767 -30.606 66 HA ASN 8 HA ASN 8 -10.730 -15.699 -28.632 67 HB2 ASN 8 1HB ASN 8 -10.695 -18.299 -28.063 68 HB3 ASN 8 2HB ASN 8 -11.951 -17.233 -27.440 69 HD21 ASN 8 1HD2 ASN 8 -11.201 -19.362 -30.162 70 HD22 ASN 8 2HD2 ASN 8 -12.821 -19.913 -30.403 71 H VAL 9 H VAL 9 -9.996 -15.483 -31.303 72 HA VAL 9 HA VAL 9 -7.681 -17.279 -31.359 73 HB VAL 9 HB VAL 9 -9.192 -18.323 -32.905 74 HG11 VAL 9 1HG1 VAL 9 -10.540 -16.168 -33.214 75 HG12 VAL 9 2HG1 VAL 9 -9.388 -15.786 -34.495 76 HG13 VAL 9 3HG1 VAL 9 -10.379 -17.241 -34.604 77 HG21 VAL 9 1HG2 VAL 9 -7.021 -18.478 -33.729 78 HG22 VAL 9 2HG2 VAL 9 -7.929 -17.853 -35.105 79 HG23 VAL 9 3HG2 VAL 9 -6.946 -16.762 -34.129 80 H HIS 10 H HIS 10 -5.985 -15.970 -31.223 81 HA HIS 10 HA HIS 10 -5.585 -13.897 -33.175 82 HB2 HIS 10 1HB HIS 10 -5.093 -12.182 -31.313 83 HB3 HIS 10 2HB HIS 10 -6.776 -12.475 -31.741 84 HD1 HIS 10 1HD HIS 10 -4.664 -14.613 -29.438 85 HD2 HIS 10 2HD HIS 10 -7.950 -12.074 -29.307 86 HE1 HIS 10 1HE HIS 10 -5.577 -14.815 -27.103 87 HE2 HIS 10 2HE HIS 10 -7.616 -13.335 -27.074 88 H LYS 11 H LYS 11 -3.417 -12.912 -32.985 89 HA LYS 11 HA LYS 11 -1.494 -14.926 -32.207 90 HB2 LYS 11 1HB LYS 11 -1.395 -12.367 -33.753 91 HB3 LYS 11 2HB LYS 11 0.100 -13.034 -33.110 92 HG2 LYS 11 1HG LYS 11 -0.041 -14.946 -34.433 93 HG3 LYS 11 2HG LYS 11 -1.760 -14.707 -34.757 94 HD2 LYS 11 1HD LYS 11 0.142 -12.600 -35.647 95 HD3 LYS 11 2HD LYS 11 0.098 -14.115 -36.552 96 HE2 LYS 11 1HE LYS 11 -2.502 -13.701 -36.456 97 HE3 LYS 11 2HE LYS 11 -2.002 -12.026 -36.226 98 HZ1 LYS 11 1HZ LYS 11 -2.210 -12.239 -38.511 99 HZ2 LYS 11 2HZ LYS 11 -1.532 -13.788 -38.546 100 HZ3 LYS 11 3HZ LYS 11 -0.547 -12.440 -38.272 101 H GLU 12 H GLU 12 0.536 -14.227 -31.066 102 HA GLU 12 HA GLU 12 -0.207 -12.915 -28.596 103 HB2 GLU 12 1HB GLU 12 1.860 -13.724 -27.719 104 HB3 GLU 12 2HB GLU 12 1.166 -15.017 -28.687 105 HG2 GLU 12 1HG GLU 12 2.672 -13.953 -30.568 106 HG3 GLU 12 2HG GLU 12 3.581 -13.363 -29.178 107 H GLU 13 H GLU 13 1.393 -11.364 -27.594 108 HA GLU 13 HA GLU 13 1.696 -9.122 -29.334 109 HB2 GLU 13 1HB GLU 13 1.199 -9.158 -26.791 110 HB3 GLU 13 2HB GLU 13 2.940 -9.320 -26.607 111 HG2 GLU 13 1HG GLU 13 2.368 -7.018 -26.390 112 HG3 GLU 13 2HG GLU 13 3.222 -7.236 -27.916 113 H HIS 14 H HIS 14 3.617 -8.053 -29.929 114 HA HIS 14 HA HIS 14 5.967 -9.823 -30.032 115 HB2 HIS 14 1HB HIS 14 5.352 -7.498 -31.862 116 HB3 HIS 14 2HB HIS 14 6.612 -8.711 -32.068 117 HD1 HIS 14 1HD HIS 14 4.294 -8.091 -34.140 118 HD2 HIS 14 2HD HIS 14 4.392 -11.248 -31.441 119 HE1 HIS 14 1HE HIS 14 2.782 -9.852 -35.109 120 HE2 HIS 14 2HE HIS 14 2.790 -11.717 -33.417 121 H ALA 15 H ALA 15 5.580 -8.379 -27.712 122 HA ALA 15 HA ALA 15 7.965 -6.732 -27.711 123 HB1 ALA 15 1HB ALA 15 5.771 -5.360 -26.339 124 HB2 ALA 15 2HB ALA 15 7.053 -4.714 -27.363 125 HB3 ALA 15 3HB ALA 15 5.611 -5.419 -28.094 126 H HIS 16 H HIS 16 8.858 -6.432 -25.637 127 HA HIS 16 HA HIS 16 7.611 -7.181 -23.230 128 HB2 HIS 16 1HB HIS 16 8.022 -9.423 -24.589 129 HB3 HIS 16 2HB HIS 16 9.648 -9.246 -23.935 130 HD1 HIS 16 1HD HIS 16 8.775 -11.596 -22.768 131 HD2 HIS 16 2HD HIS 16 7.216 -8.022 -21.333 132 HE1 HIS 16 1HE HIS 16 7.843 -12.134 -20.496 133 HE2 HIS 16 2HE HIS 16 6.829 -9.976 -19.683 134 H ALA 17 H ALA 17 9.348 -7.592 -21.465 135 HA ALA 17 HA ALA 17 11.807 -6.106 -22.083 136 HB1 ALA 17 1HB ALA 17 10.728 -4.366 -21.081 137 HB2 ALA 17 2HB ALA 17 9.721 -5.417 -20.084 138 HB3 ALA 17 3HB ALA 17 11.410 -5.144 -19.652 139 H HIS 18 H HIS 18 13.284 -7.679 -21.829 140 HA HIS 18 HA HIS 18 13.047 -9.673 -19.760 141 HB2 HIS 18 1HB HIS 18 15.046 -10.632 -20.685 142 HB3 HIS 18 2HB HIS 18 14.019 -10.135 -22.026 143 HD1 HIS 18 1HD HIS 18 17.167 -10.498 -22.148 144 HD2 HIS 18 2HD HIS 18 15.125 -6.898 -21.788 145 HE1 HIS 18 1HE HIS 18 18.741 -8.742 -23.022 146 HE2 HIS 18 2HE HIS 18 17.517 -6.563 -22.715 147 H ASN 19 H ASN 19 13.277 -8.845 -17.748 148 HA ASN 19 HA ASN 19 15.895 -7.713 -17.089 149 HB2 ASN 19 1HB ASN 19 13.239 -6.506 -16.292 150 HB3 ASN 19 2HB ASN 19 14.783 -6.052 -15.577 151 HD21 ASN 19 1HD2 ASN 19 13.011 -6.207 -18.616 152 HD22 ASN 19 2HD2 ASN 19 13.830 -4.886 -19.370 153 H LYS 20 H LYS 20 16.622 -8.162 -15.011 154 HA LYS 20 HA LYS 20 15.080 -10.230 -13.601 155 HB2 LYS 20 1HB LYS 20 18.034 -9.607 -13.428 156 HB3 LYS 20 2HB LYS 20 17.210 -10.939 -12.628 157 HG2 LYS 20 1HG LYS 20 18.061 -12.036 -14.426 158 HG3 LYS 20 2HG LYS 20 16.507 -11.535 -15.098 159 HD2 LYS 20 1HD LYS 20 18.103 -10.993 -16.743 160 HD3 LYS 20 2HD LYS 20 17.715 -9.465 -15.948 161 HE2 LYS 20 1HE LYS 20 20.007 -9.353 -16.003 162 HE3 LYS 20 2HE LYS 20 19.752 -10.096 -14.425 163 HZ1 LYS 20 1HZ LYS 20 19.970 -11.959 -16.627 164 HZ2 LYS 20 2HZ LYS 20 20.673 -12.012 -15.089 165 HZ3 LYS 20 3HZ LYS 20 21.379 -11.077 -16.310 166 H ASP 21 H ASP 21 13.764 -8.698 -12.492 167 HA ASP 21 HA ASP 21 15.145 -7.478 -10.202 168 HB2 ASP 21 1HB ASP 21 14.586 -5.712 -11.846 169 HB3 ASP 21 2HB ASP 21 12.892 -6.185 -11.753 170 H TYR 22 H TYR 22 14.492 -9.334 -9.015 171 HA TYR 22 HA TYR 22 11.680 -9.209 -8.178 172 HB2 TYR 22 1HB TYR 22 12.075 -11.835 -7.882 173 HB3 TYR 22 2HB TYR 22 11.447 -11.143 -9.373 174 HD1 TYR 22 2HD TYR 22 12.894 -10.930 -11.350 175 HD2 TYR 22 1HD TYR 22 14.273 -12.806 -7.789 176 HE1 TYR 22 2HE TYR 22 14.761 -11.925 -12.604 177 HE2 TYR 22 1HE TYR 22 16.145 -13.805 -9.032 178 HH TYR 22 HH TYR 22 17.410 -12.970 -11.437 179 H ASP 23 H ASP 23 14.800 -10.758 -7.415 180 HA ASP 23 HA ASP 23 15.678 -11.373 -5.374 181 HB2 ASP 23 1HB ASP 23 16.245 -8.922 -5.793 182 HB3 ASP 23 2HB ASP 23 14.969 -8.534 -4.643 183 H ILE 24 H ILE 24 13.231 -12.417 -5.361 184 HA ILE 24 HA ILE 24 11.380 -11.563 -3.476 185 HB ILE 24 HB ILE 24 11.869 -14.489 -3.711 186 HG12 ILE 24 1HG1 ILE 24 10.433 -14.075 -5.963 187 HG13 ILE 24 2HG1 ILE 24 11.452 -12.640 -5.989 188 HG21 ILE 24 1HG2 ILE 24 9.942 -13.889 -2.503 189 HG22 ILE 24 2HG2 ILE 24 9.480 -12.669 -3.689 190 HG23 ILE 24 3HG2 ILE 24 9.358 -14.381 -4.093 191 HD11 ILE 24 1HD1 ILE 24 12.862 -13.985 -7.091 192 HD12 ILE 24 2HD1 ILE 24 13.290 -14.546 -5.474 193 HD13 ILE 24 3HD1 ILE 24 12.133 -15.455 -6.445 194 HA PRO 25 HA PRO 25 13.451 -12.084 0.387 195 HB2 PRO 25 1HB PRO 25 11.264 -12.047 1.995 196 HB3 PRO 25 2HB PRO 25 11.917 -10.595 1.227 197 HG2 PRO 25 1HG PRO 25 9.605 -12.304 0.392 198 HG3 PRO 25 2HG PRO 25 9.736 -10.536 0.420 199 HD2 PRO 25 1HD PRO 25 10.020 -11.981 -1.852 200 HD3 PRO 25 2HD PRO 25 10.898 -10.464 -1.569 201 H THR 26 H THR 26 12.520 -13.375 2.584 202 HA THR 26 HA THR 26 12.198 -16.162 1.673 203 HB THR 26 HB THR 26 13.494 -16.878 3.630 204 HG1 THR 26 1HG THR 26 13.284 -15.300 5.127 205 HG21 THR 26 1HG2 THR 26 14.623 -16.395 1.460 206 HG22 THR 26 2HG2 THR 26 15.675 -16.203 2.863 207 HG23 THR 26 3HG2 THR 26 15.001 -14.782 2.065 208 H THR 27 H THR 27 11.048 -13.645 3.699 209 HA THR 27 HA THR 27 9.763 -15.070 5.727 210 HB THR 27 HB THR 27 8.650 -12.563 4.471 211 HG1 THR 27 1HG THR 27 11.007 -12.979 5.885 212 HG21 THR 27 1HG2 THR 27 7.714 -14.081 6.545 213 HG22 THR 27 2HG2 THR 27 7.388 -12.362 6.322 214 HG23 THR 27 3HG2 THR 27 8.697 -12.882 7.383 215 H GLU 28 H GLU 28 7.691 -15.895 5.959 216 HA GLU 28 HA GLU 28 6.500 -16.903 3.535 217 HB2 GLU 28 1HB GLU 28 5.823 -17.257 6.454 218 HB3 GLU 28 2HB GLU 28 4.885 -17.986 5.158 219 HG2 GLU 28 1HG GLU 28 6.283 -19.706 5.701 220 HG3 GLU 28 2HG GLU 28 7.198 -18.933 4.408 221 H ASN 29 H ASN 29 6.291 -14.243 3.347 222 HA ASN 29 HA ASN 29 3.409 -13.805 3.656 223 HB2 ASN 29 1HB ASN 29 5.618 -12.044 4.661 224 HB3 ASN 29 2HB ASN 29 4.103 -11.321 4.128 225 HD21 ASN 29 1HD2 ASN 29 5.290 -13.961 6.176 226 HD22 ASN 29 2HD2 ASN 29 4.126 -13.736 7.434 227 H LEU 30 H LEU 30 2.450 -12.646 2.018 228 HA LEU 30 HA LEU 30 4.157 -12.128 -0.315 229 HB2 LEU 30 1HB LEU 30 1.318 -12.937 0.048 230 HB3 LEU 30 2HB LEU 30 1.742 -11.997 -1.381 231 HG LEU 30 HG LEU 30 1.668 -14.463 -1.741 232 HD11 LEU 30 1HD1 LEU 30 4.382 -13.217 -2.147 233 HD12 LEU 30 2HD1 LEU 30 2.976 -12.935 -3.173 234 HD13 LEU 30 3HD1 LEU 30 3.679 -14.549 -3.066 235 HD21 LEU 30 1HD2 LEU 30 3.066 -14.572 0.635 236 HD22 LEU 30 2HD2 LEU 30 4.291 -14.934 -0.581 237 HD23 LEU 30 3HD2 LEU 30 2.821 -15.906 -0.492 238 H TYR 31 H TYR 31 4.142 -10.176 -1.369 239 HA TYR 31 HA TYR 31 2.618 -8.007 -0.082 240 HB2 TYR 31 1HB TYR 31 5.339 -7.663 -1.339 241 HB3 TYR 31 2HB TYR 31 4.465 -6.522 -0.323 242 HD1 TYR 31 1HD TYR 31 3.587 -8.471 1.822 243 HD2 TYR 31 2HD TYR 31 7.338 -7.876 -0.097 244 HE1 TYR 31 1HE TYR 31 4.736 -9.355 3.808 245 HE2 TYR 31 2HE TYR 31 8.497 -8.760 1.884 246 HH TYR 31 HH TYR 31 6.812 -10.314 4.460 247 H PHE 32 H PHE 32 1.092 -7.354 -1.440 248 HA PHE 32 HA PHE 32 1.587 -7.452 -4.325 249 HB2 PHE 32 1HB PHE 32 -1.002 -6.945 -2.844 250 HB3 PHE 32 2HB PHE 32 -0.826 -7.195 -4.578 251 HD1 PHE 32 1HD PHE 32 -0.299 -8.851 -1.297 252 HD2 PHE 32 2HD PHE 32 -0.946 -9.335 -5.476 253 HE1 PHE 32 1HE PHE 32 -0.583 -11.273 -0.969 254 HE2 PHE 32 2HE PHE 32 -1.232 -11.757 -5.155 255 HZ PHE 32 HZ PHE 32 -1.052 -12.729 -2.899 256 H GLN 33 H GLN 33 0.627 -5.620 -5.616 257 HA GLN 33 HA GLN 33 0.776 -3.042 -4.239 258 HB2 GLN 33 1HB GLN 33 2.324 -3.675 -6.757 259 HB3 GLN 33 2HB GLN 33 2.260 -2.117 -5.945 260 HG2 GLN 33 1HG GLN 33 3.469 -2.936 -4.083 261 HG3 GLN 33 2HG GLN 33 3.308 -4.605 -4.629 262 HE21 GLN 33 1HE2 GLN 33 5.716 -4.297 -4.179 263 HE22 GLN 33 2HE2 GLN 33 6.686 -3.849 -5.537 264 H GLY 34 H GLY 34 -0.399 -1.382 -5.204 265 HA2 GLY 34 1HA GLY 34 -1.447 -0.795 -7.489 266 HA3 GLY 34 2HA GLY 34 -2.308 -2.306 -7.243 267 H SER 35 H SER 35 -1.570 0.634 -5.360 268 HA SER 35 HA SER 35 -3.893 0.480 -3.769 269 HB2 SER 35 1HB SER 35 -1.911 1.787 -3.115 270 HB3 SER 35 2HB SER 35 -2.210 2.907 -4.444 271 HG SER 35 HG SER 35 -3.149 3.101 -2.039 272 H SER 36 H SER 36 -5.923 1.203 -4.047 273 HA SER 36 HA SER 36 -6.616 2.273 -6.675 274 HB2 SER 36 1HB SER 36 -8.123 0.860 -4.509 275 HB3 SER 36 2HB SER 36 -9.014 1.874 -5.644 276 HG SER 36 HG SER 36 -7.990 0.629 -7.335 277 H GLY 37 H GLY 37 -5.297 4.083 -5.019 278 HA2 GLY 37 1HA GLY 37 -6.059 6.461 -5.142 279 HA3 GLY 37 2HA GLY 37 -7.482 5.924 -4.262 280 H SER 38 H SER 38 -7.307 5.404 -2.057 281 HA SER 38 HA SER 38 -4.888 6.497 -0.781 282 HB2 SER 38 1HB SER 38 -6.378 6.916 1.193 283 HB3 SER 38 2HB SER 38 -6.825 7.834 -0.245 284 HG SER 38 HG SER 38 -8.024 5.353 0.026 285 H SER 39 H SER 39 -4.738 5.608 1.598 286 HA SER 39 HA SER 39 -4.234 2.805 1.347 287 HB2 SER 39 1HB SER 39 -4.147 4.435 3.890 288 HB3 SER 39 2HB SER 39 -3.276 2.943 3.536 289 HG SER 39 HG SER 39 -1.798 4.056 2.535 290 H GLY 40 H GLY 40 -6.709 4.775 2.865 291 HA2 GLY 40 1HA GLY 40 -7.887 2.640 4.363 292 HA3 GLY 40 2HA GLY 40 -8.608 4.211 4.046 293 H ASP 41 H ASP 41 -8.894 4.335 1.393 294 HA ASP 41 HA ASP 41 -11.206 3.071 0.785 295 HB2 ASP 41 1HB ASP 41 -10.119 4.817 -0.613 296 HB3 ASP 41 2HB ASP 41 -9.003 3.596 -1.221 297 H MET 42 H MET 42 -7.971 1.729 0.494 298 HA MET 42 HA MET 42 -8.436 -0.519 -1.028 299 HB2 MET 42 1HB MET 42 -6.625 -0.168 1.363 300 HB3 MET 42 2HB MET 42 -6.585 -1.576 0.310 301 HG2 MET 42 1HG MET 42 -6.356 0.363 -1.525 302 HG3 MET 42 2HG MET 42 -5.608 1.164 -0.146 303 HE1 MET 42 1HE MET 42 -5.505 -2.403 -2.070 304 HE2 MET 42 2HE MET 42 -5.206 -0.983 -3.073 305 HE3 MET 42 3HE MET 42 -3.899 -2.121 -2.742 306 H MET 43 H MET 43 -8.581 -0.358 2.537 307 HA MET 43 HA MET 43 -9.471 -2.904 3.057 308 HB2 MET 43 1HB MET 43 -10.347 -0.385 4.482 309 HB3 MET 43 2HB MET 43 -10.429 -2.018 5.130 310 HG2 MET 43 1HG MET 43 -7.820 -0.857 4.250 311 HG3 MET 43 2HG MET 43 -8.491 -0.478 5.834 312 HE1 MET 43 1HE MET 43 -8.554 -3.891 7.641 313 HE2 MET 43 2HE MET 43 -8.669 -2.140 7.818 314 HE3 MET 43 3HE MET 43 -9.866 -3.010 6.858 315 H ARG 44 H ARG 44 -11.237 -0.235 1.704 316 HA ARG 44 HA ARG 44 -13.830 -1.423 2.112 317 HB2 ARG 44 1HB ARG 44 -12.773 1.060 0.881 318 HB3 ARG 44 2HB ARG 44 -14.308 0.468 0.262 319 HG2 ARG 44 1HG ARG 44 -15.045 1.839 1.924 320 HG3 ARG 44 2HG ARG 44 -14.908 0.323 2.817 321 HD2 ARG 44 1HD ARG 44 -12.998 0.994 3.925 322 HD3 ARG 44 2HD ARG 44 -12.567 2.169 2.683 323 HE ARG 44 HE ARG 44 -14.880 3.141 3.730 324 HH11 ARG 44 2HH1 ARG 44 -11.817 2.175 5.073 325 HH12 ARG 44 1HH1 ARG 44 -11.894 3.296 6.391 326 HH21 ARG 44 2HH2 ARG 44 -14.993 4.621 5.461 327 HH22 ARG 44 1HH2 ARG 44 -13.701 4.686 6.612 328 H GLU 45 H GLU 45 -11.846 -0.710 -0.766 329 HA GLU 45 HA GLU 45 -13.450 -2.015 -2.632 330 HB2 GLU 45 1HB GLU 45 -11.517 -0.485 -3.123 331 HB3 GLU 45 2HB GLU 45 -10.438 -1.818 -2.737 332 HG2 GLU 45 1HG GLU 45 -11.389 -3.131 -4.552 333 HG3 GLU 45 2HG GLU 45 -12.497 -1.815 -4.932 334 H ILE 46 H ILE 46 -10.654 -3.256 -0.819 335 HA ILE 46 HA ILE 46 -10.397 -5.766 -1.847 336 HB ILE 46 HB ILE 46 -10.274 -5.035 1.081 337 HG12 ILE 46 1HG1 ILE 46 -7.882 -5.394 -0.675 338 HG13 ILE 46 2HG1 ILE 46 -8.787 -3.888 -0.782 339 HG21 ILE 46 1HG2 ILE 46 -10.454 -7.512 0.425 340 HG22 ILE 46 2HG2 ILE 46 -8.823 -7.315 -0.215 341 HG23 ILE 46 3HG2 ILE 46 -9.139 -7.029 1.496 342 HD11 ILE 46 1HD1 ILE 46 -6.843 -4.676 1.134 343 HD12 ILE 46 2HD1 ILE 46 -7.682 -3.133 0.972 344 HD13 ILE 46 3HD1 ILE 46 -8.381 -4.419 1.956 345 H ARG 47 H ARG 47 -12.440 -5.033 0.989 346 HA ARG 47 HA ARG 47 -13.658 -7.393 1.426 347 HB2 ARG 47 1HB ARG 47 -15.002 -4.686 1.367 348 HB3 ARG 47 2HB ARG 47 -15.696 -6.125 2.102 349 HG2 ARG 47 1HG ARG 47 -14.078 -6.176 3.797 350 HG3 ARG 47 2HG ARG 47 -13.023 -5.053 2.937 351 HD2 ARG 47 1HD ARG 47 -14.126 -3.927 4.781 352 HD3 ARG 47 2HD ARG 47 -14.689 -3.276 3.243 353 HE ARG 47 HE ARG 47 -16.482 -5.250 3.917 354 HH11 ARG 47 2HH1 ARG 47 -15.339 -2.284 5.337 355 HH12 ARG 47 1HH1 ARG 47 -16.826 -1.953 6.161 356 HH21 ARG 47 2HH2 ARG 47 -18.446 -4.825 4.997 357 HH22 ARG 47 1HH2 ARG 47 -18.593 -3.399 5.968 358 H LYS 48 H LYS 48 -14.329 -5.209 -1.244 359 HA LYS 48 HA LYS 48 -16.678 -6.241 -2.242 360 HB2 LYS 48 1HB LYS 48 -15.169 -4.291 -3.087 361 HB3 LYS 48 2HB LYS 48 -14.434 -5.526 -4.102 362 HG2 LYS 48 1HG LYS 48 -16.559 -5.987 -5.149 363 HG3 LYS 48 2HG LYS 48 -17.369 -4.851 -4.068 364 HD2 LYS 48 1HD LYS 48 -17.078 -3.591 -5.991 365 HD3 LYS 48 2HD LYS 48 -15.679 -3.128 -5.019 366 HE2 LYS 48 1HE LYS 48 -14.239 -4.545 -6.272 367 HE3 LYS 48 2HE LYS 48 -15.600 -5.320 -7.081 368 HZ1 LYS 48 1HZ LYS 48 -15.100 -2.425 -7.375 369 HZ2 LYS 48 2HZ LYS 48 -15.987 -3.453 -8.383 370 HZ3 LYS 48 3HZ LYS 48 -14.299 -3.550 -8.351 371 H VAL 49 H VAL 49 -13.372 -7.339 -2.979 372 HA VAL 49 HA VAL 49 -14.166 -9.472 -4.660 373 HB VAL 49 HB VAL 49 -11.607 -9.414 -3.074 374 HG11 VAL 49 1HG1 VAL 49 -10.957 -11.080 -4.399 375 HG12 VAL 49 2HG1 VAL 49 -12.631 -11.194 -4.944 376 HG13 VAL 49 3HG1 VAL 49 -11.472 -10.219 -5.848 377 HG21 VAL 49 1HG2 VAL 49 -11.695 -7.239 -3.981 378 HG22 VAL 49 2HG2 VAL 49 -10.686 -8.171 -5.088 379 HG23 VAL 49 3HG2 VAL 49 -12.362 -7.817 -5.508 380 H LEU 50 H LEU 50 -12.835 -9.581 -1.347 381 HA LEU 50 HA LEU 50 -13.019 -12.169 -0.702 382 HB2 LEU 50 1HB LEU 50 -14.162 -10.046 1.099 383 HB3 LEU 50 2HB LEU 50 -13.420 -11.571 1.577 384 HG LEU 50 HG LEU 50 -11.979 -9.239 0.314 385 HD11 LEU 50 1HD1 LEU 50 -12.035 -8.392 2.374 386 HD12 LEU 50 2HD1 LEU 50 -10.930 -9.692 2.818 387 HD13 LEU 50 3HD1 LEU 50 -12.665 -9.887 3.064 388 HD21 LEU 50 1HD2 LEU 50 -11.220 -12.025 0.933 389 HD22 LEU 50 2HD2 LEU 50 -10.057 -10.776 1.381 390 HD23 LEU 50 3HD2 LEU 50 -10.596 -10.922 -0.293 391 H GLY 51 H GLY 51 -15.805 -9.991 -0.183 392 HA2 GLY 51 1HA GLY 51 -17.668 -11.991 0.384 393 HA3 GLY 51 2HA GLY 51 -18.063 -10.393 -0.233 394 H ALA 52 H ALA 52 -16.466 -10.845 -2.686 395 HA ALA 52 HA ALA 52 -18.556 -12.001 -4.262 396 HB1 ALA 52 1HB ALA 52 -15.934 -10.711 -4.822 397 HB2 ALA 52 2HB ALA 52 -16.681 -11.690 -6.085 398 HB3 ALA 52 3HB ALA 52 -17.545 -10.305 -5.416 399 H ASN 53 H ASN 53 -15.390 -13.045 -3.144 400 HA ASN 53 HA ASN 53 -15.650 -15.559 -4.618 401 HB2 ASN 53 1HB ASN 53 -13.383 -14.169 -3.233 402 HB3 ASN 53 2HB ASN 53 -13.296 -15.904 -3.523 403 HD21 ASN 53 1HD2 ASN 53 -14.315 -13.014 -5.321 404 HD22 ASN 53 2HD2 ASN 53 -13.452 -13.405 -6.766 405 H ASN 54 H ASN 54 -17.461 -15.089 -2.485 406 HA ASN 54 HA ASN 54 -18.222 -15.947 -0.502 407 HB2 ASN 54 1HB ASN 54 -16.841 -18.402 -1.609 408 HB3 ASN 54 2HB ASN 54 -18.113 -18.396 -0.391 409 HD21 ASN 54 1HD2 ASN 54 -20.164 -17.304 -1.081 410 HD22 ASN 54 2HD2 ASN 54 -20.699 -17.593 -2.699 411 H CYS 55 H CYS 55 -15.956 -14.520 -0.008 412 HA CYS 55 HA CYS 55 -14.413 -16.201 1.851 413 HB2 CYS 55 1HB CYS 55 -13.669 -13.511 0.682 414 HB3 CYS 55 2HB CYS 55 -12.656 -14.506 1.721 415 HG CYS 55 HG CYS 55 -13.624 -15.250 -1.475 416 H ASP 56 H ASP 56 -13.957 -15.412 3.949 417 HA ASP 56 HA ASP 56 -15.924 -13.439 4.902 418 HB2 ASP 56 1HB ASP 56 -16.286 -15.635 5.865 419 HB3 ASP 56 2HB ASP 56 -14.598 -15.732 6.360 420 H TYR 57 H TYR 57 -15.295 -11.810 6.303 421 HA TYR 57 HA TYR 57 -12.464 -11.579 6.983 422 HB2 TYR 57 1HB TYR 57 -12.616 -9.119 6.208 423 HB3 TYR 57 2HB TYR 57 -12.385 -10.363 4.985 424 HD1 TYR 57 2HD TYR 57 -14.416 -11.159 3.683 425 HD2 TYR 57 1HD TYR 57 -14.463 -7.668 6.116 426 HE1 TYR 57 2HE TYR 57 -16.409 -10.359 2.486 427 HE2 TYR 57 1HE TYR 57 -16.457 -6.859 4.926 428 HH TYR 57 HH TYR 57 -17.611 -7.159 2.849 429 H GLU 58 H GLU 58 -12.095 -10.562 8.889 430 HA GLU 58 HA GLU 58 -14.396 -9.281 10.207 431 HB2 GLU 58 1HB GLU 58 -14.052 -11.487 11.180 432 HB3 GLU 58 2HB GLU 58 -12.353 -11.127 11.455 433 HG2 GLU 58 1HG GLU 58 -13.237 -10.778 13.537 434 HG3 GLU 58 2HG GLU 58 -13.278 -9.149 12.865 435 H GLN 59 H GLN 59 -13.876 -7.175 10.139 436 HA GLN 59 HA GLN 59 -11.264 -6.134 10.187 437 HB2 GLN 59 1HB GLN 59 -13.602 -5.072 9.528 438 HB3 GLN 59 2HB GLN 59 -13.545 -4.494 11.188 439 HG2 GLN 59 1HG GLN 59 -11.113 -3.749 10.445 440 HG3 GLN 59 2HG GLN 59 -11.877 -3.750 8.857 441 HE21 GLN 59 1HE2 GLN 59 -10.870 -1.464 10.128 442 HE22 GLN 59 2HE2 GLN 59 -12.192 -0.403 10.463 443 H ARG 60 H ARG 60 -9.916 -6.469 11.839 444 HA ARG 60 HA ARG 60 -10.901 -6.530 14.570 445 HB2 ARG 60 1HB ARG 60 -8.229 -7.079 13.300 446 HB3 ARG 60 2HB ARG 60 -8.409 -6.956 15.045 447 HG2 ARG 60 1HG ARG 60 -9.947 -8.879 13.314 448 HG3 ARG 60 2HG ARG 60 -8.462 -9.278 14.180 449 HD2 ARG 60 1HD ARG 60 -9.561 -8.696 16.299 450 HD3 ARG 60 2HD ARG 60 -11.047 -8.340 15.419 451 HE ARG 60 HE ARG 60 -10.017 -11.001 15.002 452 HH11 ARG 60 2HH1 ARG 60 -12.069 -8.967 16.944 453 HH12 ARG 60 1HH1 ARG 60 -13.048 -10.278 17.514 454 HH21 ARG 60 2HH2 ARG 60 -11.300 -12.735 15.745 455 HH22 ARG 60 1HH2 ARG 60 -12.610 -12.420 16.832 456 H GLU 61 H GLU 61 -8.859 -4.518 12.518 457 HA GLU 61 HA GLU 61 -9.053 -2.391 14.534 458 HB2 GLU 61 1HB GLU 61 -6.551 -3.171 13.027 459 HB3 GLU 61 2HB GLU 61 -6.717 -1.720 14.006 460 HG2 GLU 61 1HG GLU 61 -7.312 -4.337 15.273 461 HG3 GLU 61 2HG GLU 61 -5.629 -3.925 14.952 462 H ARG 62 H ARG 62 -7.933 -0.316 13.348 463 HA ARG 62 HA ARG 62 -9.786 0.519 11.440 464 HB2 ARG 62 1HB ARG 62 -8.171 2.400 11.022 465 HB3 ARG 62 2HB ARG 62 -8.607 2.160 12.709 466 HG2 ARG 62 1HG ARG 62 -6.507 1.034 13.126 467 HG3 ARG 62 2HG ARG 62 -6.075 1.164 11.419 468 HD2 ARG 62 1HD ARG 62 -4.954 2.977 12.230 469 HD3 ARG 62 2HD ARG 62 -6.508 3.730 11.876 470 HE ARG 62 HE ARG 62 -6.749 2.895 14.455 471 HH11 ARG 62 2HH1 ARG 62 -4.469 4.886 12.735 472 HH12 ARG 62 1HH1 ARG 62 -4.088 5.866 14.112 473 HH21 ARG 62 2HH2 ARG 62 -6.256 4.178 16.275 474 HH22 ARG 62 1HH2 ARG 62 -5.104 5.462 16.125 475 H PHE 63 H PHE 63 -6.472 -0.675 11.022 476 HA PHE 63 HA PHE 63 -7.052 -1.014 8.153 477 HB2 PHE 63 1HB PHE 63 -4.403 -0.369 9.464 478 HB3 PHE 63 2HB PHE 63 -4.614 -0.733 7.755 479 HD1 PHE 63 2HD PHE 63 -6.715 0.748 6.751 480 HD2 PHE 63 1HD PHE 63 -4.075 1.846 9.904 481 HE1 PHE 63 2HE PHE 63 -7.172 3.123 6.301 482 HE2 PHE 63 1HE PHE 63 -4.529 4.223 9.460 483 HZ PHE 63 HZ PHE 63 -6.078 4.864 7.656 484 H LEU 64 H LEU 64 -7.626 -2.926 10.191 485 HA LEU 64 HA LEU 64 -5.850 -5.094 9.312 486 HB2 LEU 64 1HB LEU 64 -5.390 -4.252 11.677 487 HB3 LEU 64 2HB LEU 64 -6.952 -4.948 12.102 488 HG LEU 64 HG LEU 64 -5.875 -7.114 11.026 489 HD11 LEU 64 1HD1 LEU 64 -3.389 -6.202 12.286 490 HD12 LEU 64 2HD1 LEU 64 -3.756 -5.442 10.737 491 HD13 LEU 64 3HD1 LEU 64 -3.641 -7.198 10.852 492 HD21 LEU 64 1HD2 LEU 64 -4.701 -6.906 13.620 493 HD22 LEU 64 2HD2 LEU 64 -6.142 -7.791 13.121 494 HD23 LEU 64 3HD2 LEU 64 -6.273 -6.107 13.631 495 H LEU 65 H LEU 65 -6.942 -6.709 8.417 496 HA LEU 65 HA LEU 65 -9.699 -7.222 9.293 497 HB2 LEU 65 1HB LEU 65 -8.687 -6.699 6.542 498 HB3 LEU 65 2HB LEU 65 -9.998 -7.858 6.754 499 HG LEU 65 HG LEU 65 -10.267 -5.143 7.958 500 HD11 LEU 65 1HD1 LEU 65 -11.160 -4.253 5.891 501 HD12 LEU 65 2HD1 LEU 65 -10.790 -5.759 5.053 502 HD13 LEU 65 3HD1 LEU 65 -9.482 -4.745 5.663 503 HD21 LEU 65 1HD2 LEU 65 -12.507 -5.599 7.941 504 HD22 LEU 65 2HD2 LEU 65 -11.864 -7.234 8.093 505 HD23 LEU 65 3HD2 LEU 65 -12.400 -6.639 6.520 506 H PHE 66 H PHE 66 -10.020 -9.274 9.834 507 HA PHE 66 HA PHE 66 -7.957 -11.233 9.299 508 HB2 PHE 66 1HB PHE 66 -9.227 -10.927 11.517 509 HB3 PHE 66 2HB PHE 66 -10.555 -11.767 10.723 510 HD1 PHE 66 2HD PHE 66 -7.034 -12.094 11.792 511 HD2 PHE 66 1HD PHE 66 -10.551 -14.106 10.489 512 HE1 PHE 66 2HE PHE 66 -6.012 -14.253 12.379 513 HE2 PHE 66 1HE PHE 66 -9.535 -16.269 11.075 514 HZ PHE 66 HZ PHE 66 -7.262 -16.345 12.019 515 H CYS 67 H CYS 67 -8.072 -11.734 7.134 516 HA CYS 67 HA CYS 67 -10.592 -12.497 5.934 517 HB2 CYS 67 1HB CYS 67 -7.773 -12.554 4.835 518 HB3 CYS 67 2HB CYS 67 -9.228 -12.885 3.902 519 HG CYS 67 HG CYS 67 -9.660 -9.998 5.340 520 H VAL 68 H VAL 68 -11.226 -14.536 5.349 521 HA VAL 68 HA VAL 68 -9.465 -16.802 5.743 522 HB VAL 68 HB VAL 68 -10.433 -16.339 8.010 523 HG11 VAL 68 1HG1 VAL 68 -12.671 -15.617 7.004 524 HG12 VAL 68 2HG1 VAL 68 -13.036 -17.341 6.899 525 HG13 VAL 68 3HG1 VAL 68 -12.714 -16.600 8.468 526 HG21 VAL 68 1HG2 VAL 68 -10.535 -18.565 8.519 527 HG22 VAL 68 2HG2 VAL 68 -11.547 -18.952 7.128 528 HG23 VAL 68 3HG2 VAL 68 -9.821 -18.662 6.910 529 H HIS 69 H HIS 69 -9.817 -18.127 4.098 530 HA HIS 69 HA HIS 69 -12.451 -18.097 2.794 531 HB2 HIS 69 1HB HIS 69 -10.671 -17.489 1.287 532 HB3 HIS 69 2HB HIS 69 -9.727 -18.899 1.757 533 HD1 HIS 69 1HD HIS 69 -10.850 -21.271 1.057 534 HD2 HIS 69 2HD HIS 69 -12.283 -17.879 -0.867 535 HE1 HIS 69 1HE HIS 69 -12.038 -22.113 -0.994 536 HE2 HIS 69 2HE HIS 69 -12.823 -20.038 -2.186 537 H GLY 70 H GLY 70 -13.509 -20.023 2.274 538 HA2 GLY 70 1HA GLY 70 -12.771 -22.600 2.369 539 HA3 GLY 70 2HA GLY 70 -12.908 -22.216 4.078 540 H ASP 71 H ASP 71 -14.570 -23.103 1.251 541 HA ASP 71 HA ASP 71 -17.147 -22.177 1.685 542 HB2 ASP 71 1HB ASP 71 -16.703 -23.267 -0.371 543 HB3 ASP 71 2HB ASP 71 -16.123 -24.721 0.436 544 H GLY 72 H GLY 72 -15.338 -24.507 3.454 545 HA2 GLY 72 1HA GLY 72 -16.595 -24.697 5.739 546 HA3 GLY 72 2HA GLY 72 -17.746 -25.575 4.743 547 H HIS 73 H HIS 73 -14.280 -25.702 4.249 548 HA HIS 73 HA HIS 73 -14.103 -28.294 5.571 549 HB2 HIS 73 1HB HIS 73 -13.038 -28.135 2.782 550 HB3 HIS 73 2HB HIS 73 -13.552 -29.545 3.704 551 HD1 HIS 73 1HD HIS 73 -14.560 -27.670 0.908 552 HD2 HIS 73 2HD HIS 73 -16.583 -29.287 4.156 553 HE1 HIS 73 1HE HIS 73 -16.965 -27.829 0.191 554 HE2 HIS 73 2HE HIS 73 -18.183 -28.730 2.203 555 H ALA 74 H ALA 74 -12.264 -28.420 6.672 556 HA ALA 74 HA ALA 74 -10.349 -26.387 6.716 557 HB1 ALA 74 1HB ALA 74 -9.003 -27.928 8.082 558 HB2 ALA 74 2HB ALA 74 -10.689 -27.872 8.601 559 HB3 ALA 74 3HB ALA 74 -10.101 -29.242 7.657 560 H GLU 75 H GLU 75 -10.619 -29.211 4.718 561 HA GLU 75 HA GLU 75 -7.962 -29.527 3.910 562 HB2 GLU 75 1HB GLU 75 -8.979 -30.514 1.814 563 HB3 GLU 75 2HB GLU 75 -9.508 -31.229 3.331 564 HG2 GLU 75 1HG GLU 75 -11.572 -29.962 3.239 565 HG3 GLU 75 2HG GLU 75 -11.039 -29.171 1.757 566 H ASN 76 H ASN 76 -10.338 -27.150 3.053 567 HA ASN 76 HA ASN 76 -8.387 -25.915 1.228 568 HB2 ASN 76 1HB ASN 76 -10.447 -25.003 -0.002 569 HB3 ASN 76 2HB ASN 76 -10.048 -26.701 -0.248 570 HD21 ASN 76 1HD2 ASN 76 -12.010 -24.599 1.820 571 HD22 ASN 76 2HD2 ASN 76 -13.348 -25.685 1.948 572 H LEU 77 H LEU 77 -9.011 -25.515 4.103 573 HA LEU 77 HA LEU 77 -10.155 -22.822 4.099 574 HB2 LEU 77 1HB LEU 77 -10.834 -24.643 5.749 575 HB3 LEU 77 2HB LEU 77 -9.261 -24.388 6.502 576 HG LEU 77 HG LEU 77 -10.121 -21.877 6.567 577 HD11 LEU 77 1HD1 LEU 77 -12.230 -21.676 5.889 578 HD12 LEU 77 2HD1 LEU 77 -12.685 -22.529 7.363 579 HD13 LEU 77 3HD1 LEU 77 -12.468 -23.424 5.859 580 HD21 LEU 77 1HD2 LEU 77 -10.539 -24.168 8.423 581 HD22 LEU 77 2HD2 LEU 77 -11.245 -22.603 8.828 582 HD23 LEU 77 3HD2 LEU 77 -9.503 -22.750 8.593 583 H VAL 78 H VAL 78 -9.007 -21.016 4.566 584 HA VAL 78 HA VAL 78 -6.246 -21.267 5.491 585 HB VAL 78 HB VAL 78 -7.006 -19.793 2.965 586 HG11 VAL 78 1HG1 VAL 78 -4.588 -19.279 2.818 587 HG12 VAL 78 2HG1 VAL 78 -5.376 -18.513 4.198 588 HG13 VAL 78 3HG1 VAL 78 -4.378 -19.947 4.436 589 HG21 VAL 78 1HG2 VAL 78 -6.700 -21.858 2.113 590 HG22 VAL 78 2HG2 VAL 78 -4.991 -21.457 2.280 591 HG23 VAL 78 3HG2 VAL 78 -5.795 -22.420 3.519 592 H GLN 79 H GLN 79 -5.711 -19.716 6.902 593 HA GLN 79 HA GLN 79 -7.542 -17.427 7.171 594 HB2 GLN 79 1HB GLN 79 -5.844 -18.831 9.236 595 HB3 GLN 79 2HB GLN 79 -6.712 -17.332 9.539 596 HG2 GLN 79 1HG GLN 79 -8.770 -18.351 9.491 597 HG3 GLN 79 2HG GLN 79 -8.200 -19.694 8.502 598 HE21 GLN 79 1HE2 GLN 79 -8.733 -21.398 9.725 599 HE22 GLN 79 2HE2 GLN 79 -8.170 -21.671 11.335 600 H TRP 80 H TRP 80 -6.770 -15.441 6.861 601 HA TRP 80 HA TRP 80 -3.969 -14.843 7.315 602 HB2 TRP 80 1HB TRP 80 -3.440 -14.135 5.122 603 HB3 TRP 80 2HB TRP 80 -4.220 -15.702 4.923 604 HD1 TRP 80 HD TRP 80 -4.669 -12.013 4.134 605 HE1 TRP 80 1HE TRP 80 -6.674 -11.733 2.544 606 HE3 TRP 80 3HE TRP 80 -6.511 -16.779 4.303 607 HZ2 TRP 80 2HZ TRP 80 -8.761 -13.322 1.501 608 HZ3 TRP 80 3HZ TRP 80 -8.515 -17.317 2.981 609 HH2 TRP 80 HH TRP 80 -9.615 -15.623 1.610 610 H GLU 81 H GLU 81 -3.577 -12.682 7.709 611 HA GLU 81 HA GLU 81 -5.981 -11.012 7.947 612 HB2 GLU 81 1HB GLU 81 -3.371 -11.086 9.425 613 HB3 GLU 81 2HB GLU 81 -4.352 -9.627 9.434 614 HG2 GLU 81 1HG GLU 81 -6.247 -10.983 10.302 615 HG3 GLU 81 2HG GLU 81 -5.142 -12.351 10.433 616 H MET 82 H MET 82 -6.262 -9.458 6.503 617 HA MET 82 HA MET 82 -4.001 -8.574 4.883 618 HB2 MET 82 1HB MET 82 -6.985 -8.308 4.614 619 HB3 MET 82 2HB MET 82 -5.890 -7.349 3.626 620 HG2 MET 82 1HG MET 82 -4.876 -9.415 2.774 621 HG3 MET 82 2HG MET 82 -6.017 -10.354 3.734 622 HE1 MET 82 1HE MET 82 -5.832 -7.394 1.260 623 HE2 MET 82 2HE MET 82 -5.413 -8.773 0.243 624 HE3 MET 82 3HE MET 82 -6.920 -7.899 -0.034 625 H GLU 83 H GLU 83 -2.851 -7.062 5.962 626 HA GLU 83 HA GLU 83 -4.328 -4.757 7.051 627 HB2 GLU 83 1HB GLU 83 -3.179 -5.793 8.847 628 HB3 GLU 83 2HB GLU 83 -1.721 -6.012 7.889 629 HG2 GLU 83 1HG GLU 83 -1.113 -3.782 8.066 630 HG3 GLU 83 2HG GLU 83 -2.746 -3.270 8.491 631 H VAL 84 H VAL 84 -4.105 -2.906 5.997 632 HA VAL 84 HA VAL 84 -2.386 -2.641 3.751 633 HB VAL 84 HB VAL 84 -3.852 -0.437 5.204 634 HG11 VAL 84 1HG1 VAL 84 -3.553 -0.270 2.309 635 HG12 VAL 84 2HG1 VAL 84 -3.244 0.943 3.553 636 HG13 VAL 84 3HG1 VAL 84 -2.014 -0.262 3.170 637 HG21 VAL 84 1HG2 VAL 84 -5.525 -0.869 3.277 638 HG22 VAL 84 2HG2 VAL 84 -4.775 -2.464 3.202 639 HG23 VAL 84 3HG2 VAL 84 -5.557 -1.927 4.689 640 H CYS 85 H CYS 85 -0.244 -2.799 4.289 641 HA CYS 85 HA CYS 85 0.910 -1.361 6.477 642 HB2 CYS 85 1HB CYS 85 1.715 -3.555 5.280 643 HB3 CYS 85 2HB CYS 85 2.539 -2.434 4.203 644 HG CYS 85 HG CYS 85 3.151 -3.087 7.472 645 H LYS 86 H LYS 86 2.303 0.415 6.405 646 HA LYS 86 HA LYS 86 2.064 2.054 3.967 647 HB2 LYS 86 1HB LYS 86 0.922 2.876 6.082 648 HB3 LYS 86 2HB LYS 86 2.529 3.091 6.763 649 HG2 LYS 86 1HG LYS 86 2.998 4.891 5.454 650 HG3 LYS 86 2HG LYS 86 1.964 4.342 4.133 651 HD2 LYS 86 1HD LYS 86 0.685 6.064 4.911 652 HD3 LYS 86 2HD LYS 86 0.069 4.767 5.938 653 HE2 LYS 86 1HE LYS 86 1.798 5.459 7.639 654 HE3 LYS 86 2HE LYS 86 2.098 6.879 6.639 655 HZ1 LYS 86 1HZ LYS 86 -0.555 6.161 7.760 656 HZ2 LYS 86 2HZ LYS 86 -0.151 7.586 6.944 657 HZ3 LYS 86 3HZ LYS 86 0.508 7.269 8.469 658 H LEU 87 H LEU 87 3.902 2.076 2.859 659 HA LEU 87 HA LEU 87 6.383 1.229 3.659 660 HB2 LEU 87 1HB LEU 87 5.436 3.098 1.548 661 HB3 LEU 87 2HB LEU 87 7.168 2.995 1.858 662 HG LEU 87 HG LEU 87 6.677 0.399 1.576 663 HD11 LEU 87 1HD1 LEU 87 4.296 0.596 1.268 664 HD12 LEU 87 2HD1 LEU 87 5.038 0.065 -0.240 665 HD13 LEU 87 3HD1 LEU 87 4.526 1.742 -0.053 666 HD21 LEU 87 1HD2 LEU 87 7.449 0.583 -0.687 667 HD22 LEU 87 2HD2 LEU 87 8.241 1.831 0.276 668 HD23 LEU 87 3HD2 LEU 87 6.899 2.256 -0.788 669 HA PRO 88 HA PRO 88 8.083 4.250 6.355 670 HB2 PRO 88 1HB PRO 88 10.724 4.015 5.769 671 HB3 PRO 88 2HB PRO 88 9.829 2.792 6.679 672 HG2 PRO 88 1HG PRO 88 10.570 2.830 3.779 673 HG3 PRO 88 2HG PRO 88 10.641 1.486 4.934 674 HD2 PRO 88 1HD PRO 88 8.629 1.764 3.143 675 HD3 PRO 88 2HD PRO 88 8.387 1.042 4.747 676 H ARG 89 H ARG 89 8.805 4.408 2.933 677 HA ARG 89 HA ARG 89 9.505 7.252 3.211 678 HB2 ARG 89 1HB ARG 89 10.307 5.122 1.297 679 HB3 ARG 89 2HB ARG 89 10.164 6.758 0.670 680 HG2 ARG 89 1HG ARG 89 11.634 7.331 2.779 681 HG3 ARG 89 2HG ARG 89 12.096 5.635 2.623 682 HD2 ARG 89 1HD ARG 89 12.214 7.622 0.362 683 HD3 ARG 89 2HD ARG 89 13.579 7.255 1.415 684 HE ARG 89 HE ARG 89 12.715 4.829 0.452 685 HH11 ARG 89 2HH1 ARG 89 13.887 7.810 -0.912 686 HH12 ARG 89 1HH1 ARG 89 14.591 7.049 -2.301 687 HH21 ARG 89 2HH2 ARG 89 13.637 3.816 -1.372 688 HH22 ARG 89 1HH2 ARG 89 14.448 4.778 -2.562 689 H LEU 90 H LEU 90 6.819 5.676 2.932 690 HA LEU 90 HA LEU 90 4.805 5.918 1.884 691 HB2 LEU 90 1HB LEU 90 5.942 8.635 2.197 692 HB3 LEU 90 2HB LEU 90 4.519 8.476 1.170 693 HG LEU 90 HG LEU 90 3.652 7.148 3.335 694 HD11 LEU 90 1HD1 LEU 90 5.949 7.806 4.381 695 HD12 LEU 90 2HD1 LEU 90 4.474 7.914 5.341 696 HD13 LEU 90 3HD1 LEU 90 5.169 9.369 4.626 697 HD21 LEU 90 1HD2 LEU 90 3.501 10.105 3.511 698 HD22 LEU 90 2HD2 LEU 90 2.221 8.896 3.606 699 HD23 LEU 90 3HD2 LEU 90 2.903 9.339 2.040 700 H SER 91 H SER 91 7.032 5.149 0.178 701 HA SER 91 HA SER 91 6.970 6.523 -2.285 702 HB2 SER 91 1HB SER 91 8.611 4.676 -1.346 703 HB3 SER 91 2HB SER 91 7.515 3.582 -2.191 704 HG SER 91 HG SER 91 8.194 4.323 -4.061 705 H LEU 92 H LEU 92 4.846 4.206 -0.849 706 HA LEU 92 HA LEU 92 2.819 4.614 -2.758 707 HB2 LEU 92 1HB LEU 92 2.741 2.504 -3.877 708 HB3 LEU 92 2HB LEU 92 4.335 3.213 -4.124 709 HG LEU 92 HG LEU 92 4.906 1.664 -2.031 710 HD11 LEU 92 1HD1 LEU 92 3.337 0.192 -1.510 711 HD12 LEU 92 2HD1 LEU 92 3.412 -0.460 -3.146 712 HD13 LEU 92 3HD1 LEU 92 2.283 0.841 -2.766 713 HD21 LEU 92 1HD2 LEU 92 4.690 0.374 -4.725 714 HD22 LEU 92 2HD2 LEU 92 5.972 0.237 -3.522 715 HD23 LEU 92 3HD2 LEU 92 5.791 1.725 -4.454 716 H ASN 93 H ASN 93 1.201 2.526 -2.537 717 HA ASN 93 HA ASN 93 1.085 1.825 0.315 718 HB2 ASN 93 1HB ASN 93 -1.501 2.388 -1.021 719 HB3 ASN 93 2HB ASN 93 -0.998 2.695 0.639 720 HD21 ASN 93 1HD2 ASN 93 -0.103 3.749 -2.632 721 HD22 ASN 93 2HD2 ASN 93 -0.014 5.431 -2.248 722 H GLY 94 H GLY 94 1.808 -0.264 -0.279 723 HA2 GLY 94 1HA GLY 94 0.076 -1.821 -2.052 724 HA3 GLY 94 2HA GLY 94 1.640 -2.324 -1.429 725 H VAL 95 H VAL 95 -0.689 -3.930 -1.426 726 HA VAL 95 HA VAL 95 -1.564 -3.956 1.367 727 HB VAL 95 HB VAL 95 -2.516 -5.695 -0.912 728 HG11 VAL 95 1HG1 VAL 95 -4.435 -6.127 0.555 729 HG12 VAL 95 2HG1 VAL 95 -2.919 -6.662 1.282 730 HG13 VAL 95 3HG1 VAL 95 -3.676 -5.162 1.821 731 HG21 VAL 95 1HG2 VAL 95 -3.198 -3.600 -1.601 732 HG22 VAL 95 2HG2 VAL 95 -4.575 -4.121 -0.628 733 HG23 VAL 95 3HG2 VAL 95 -3.389 -3.003 0.048 734 H ARG 96 H ARG 96 -0.354 -5.071 2.743 735 HA ARG 96 HA ARG 96 1.304 -7.267 1.815 736 HB2 ARG 96 1HB ARG 96 1.100 -5.671 4.334 737 HB3 ARG 96 2HB ARG 96 1.857 -7.258 4.395 738 HG2 ARG 96 1HG ARG 96 3.266 -6.380 2.402 739 HG3 ARG 96 2HG ARG 96 2.748 -4.792 2.970 740 HD2 ARG 96 1HD ARG 96 3.615 -5.381 5.224 741 HD3 ARG 96 2HD ARG 96 4.241 -6.884 4.547 742 HE ARG 96 HE ARG 96 5.299 -4.925 2.966 743 HH11 ARG 96 2HH1 ARG 96 5.303 -5.613 6.379 744 HH12 ARG 96 1HH1 ARG 96 6.853 -4.891 6.656 745 HH21 ARG 96 2HH2 ARG 96 7.341 -3.970 3.318 746 HH22 ARG 96 1HH2 ARG 96 8.011 -3.956 4.914 747 H PHE 97 H PHE 97 1.022 -9.391 2.287 748 HA PHE 97 HA PHE 97 -1.514 -10.111 3.585 749 HB2 PHE 97 1HB PHE 97 0.186 -11.499 1.523 750 HB3 PHE 97 2HB PHE 97 -1.050 -12.365 2.430 751 HD1 PHE 97 1HD PHE 97 -0.927 -8.995 0.830 752 HD2 PHE 97 2HD PHE 97 -2.880 -12.767 1.112 753 HE1 PHE 97 1HE PHE 97 -2.630 -8.229 -0.771 754 HE2 PHE 97 2HE PHE 97 -4.586 -12.007 -0.490 755 HZ PHE 97 HZ PHE 97 -4.462 -9.735 -1.434 756 H LYS 98 H LYS 98 -1.576 -11.933 5.009 757 HA LYS 98 HA LYS 98 0.966 -12.884 6.071 758 HB2 LYS 98 1HB LYS 98 0.664 -11.011 7.490 759 HB3 LYS 98 2HB LYS 98 -1.060 -11.315 7.655 760 HG2 LYS 98 1HG LYS 98 -0.060 -11.944 9.697 761 HG3 LYS 98 2HG LYS 98 -0.462 -13.442 8.854 762 HD2 LYS 98 1HD LYS 98 1.978 -13.265 7.955 763 HD3 LYS 98 2HD LYS 98 2.212 -12.194 9.338 764 HE2 LYS 98 1HE LYS 98 1.941 -13.876 10.860 765 HE3 LYS 98 2HE LYS 98 0.870 -14.802 9.809 766 HZ1 LYS 98 1HZ LYS 98 2.841 -16.017 9.877 767 HZ2 LYS 98 2HZ LYS 98 3.820 -14.645 9.740 768 HZ3 LYS 98 3HZ LYS 98 2.934 -15.188 8.405 769 H ARG 99 H ARG 99 0.820 -15.014 6.226 770 HA ARG 99 HA ARG 99 -1.767 -16.311 6.253 771 HB2 ARG 99 1HB ARG 99 -0.043 -17.224 4.815 772 HB3 ARG 99 2HB ARG 99 1.043 -17.419 6.184 773 HG2 ARG 99 1HG ARG 99 -0.636 -19.015 7.156 774 HG3 ARG 99 2HG ARG 99 -1.488 -18.935 5.612 775 HD2 ARG 99 1HD ARG 99 -0.050 -20.868 5.627 776 HD3 ARG 99 2HD ARG 99 0.578 -19.685 4.480 777 HE ARG 99 HE ARG 99 1.928 -19.138 6.769 778 HH11 ARG 99 2HH1 ARG 99 1.421 -22.026 4.893 779 HH12 ARG 99 1HH1 ARG 99 2.942 -22.732 5.328 780 HH21 ARG 99 2HH2 ARG 99 3.934 -20.057 7.349 781 HH22 ARG 99 1HH2 ARG 99 4.370 -21.612 6.725 782 H ILE 100 H ILE 100 -2.809 -16.576 8.109 783 HA ILE 100 HA ILE 100 -1.354 -16.736 10.618 784 HB ILE 100 HB ILE 100 -4.272 -16.520 9.932 785 HG12 ILE 100 1HG1 ILE 100 -3.839 -14.567 11.673 786 HG13 ILE 100 2HG1 ILE 100 -2.171 -14.785 11.154 787 HG21 ILE 100 1HG2 ILE 100 -3.030 -17.231 12.571 788 HG22 ILE 100 2HG2 ILE 100 -4.609 -16.456 12.456 789 HG23 ILE 100 3HG2 ILE 100 -4.348 -18.037 11.722 790 HD11 ILE 100 1HD1 ILE 100 -4.496 -14.208 9.334 791 HD12 ILE 100 2HD1 ILE 100 -3.317 -13.026 9.903 792 HD13 ILE 100 3HD1 ILE 100 -2.804 -14.352 8.860 793 H SER 101 H SER 101 -3.009 -18.827 8.405 794 HA SER 101 HA SER 101 -1.995 -21.173 9.588 795 HB2 SER 101 1HB SER 101 -3.591 -20.969 11.329 796 HB3 SER 101 2HB SER 101 -4.866 -20.488 10.211 797 HG SER 101 HG SER 101 -4.741 -22.619 9.327 798 H GLY 102 H GLY 102 -3.078 -23.179 8.597 799 HA2 GLY 102 1HA GLY 102 -4.345 -24.106 6.782 800 HA3 GLY 102 2HA GLY 102 -4.217 -22.562 5.954 801 H THR 103 H THR 103 -3.494 -23.720 4.090 802 HA THR 103 HA THR 103 -0.734 -24.729 4.303 803 HB THR 103 HB THR 103 -1.196 -25.862 2.110 804 HG1 THR 103 1HG THR 103 -2.977 -25.237 1.159 805 HG21 THR 103 1HG2 THR 103 -2.363 -26.528 4.719 806 HG22 THR 103 2HG2 THR 103 -1.360 -27.502 3.644 807 HG23 THR 103 3HG2 THR 103 -3.095 -27.374 3.356 808 H SER 104 H SER 104 0.811 -24.076 2.789 809 HA SER 104 HA SER 104 0.725 -21.398 1.992 810 HB2 SER 104 1HB SER 104 2.675 -22.323 0.399 811 HB3 SER 104 2HB SER 104 2.901 -22.094 2.133 812 HG SER 104 HG SER 104 2.654 -24.440 0.660 813 H ILE 105 H ILE 105 0.581 -24.314 -0.059 814 HA ILE 105 HA ILE 105 0.263 -23.317 -2.528 815 HB ILE 105 HB ILE 105 -1.275 -25.557 -1.237 816 HG12 ILE 105 1HG1 ILE 105 1.070 -26.005 -1.504 817 HG13 ILE 105 2HG1 ILE 105 0.210 -26.914 -2.742 818 HG21 ILE 105 1HG2 ILE 105 -1.277 -24.842 -4.166 819 HG22 ILE 105 2HG2 ILE 105 -2.058 -26.238 -3.425 820 HG23 ILE 105 3HG2 ILE 105 -2.632 -24.610 -3.061 821 HD11 ILE 105 1HD1 ILE 105 2.033 -24.593 -3.011 822 HD12 ILE 105 2HD1 ILE 105 1.908 -26.060 -3.983 823 HD13 ILE 105 3HD1 ILE 105 0.724 -24.768 -4.179 824 H ALA 106 H ALA 106 -2.634 -23.994 -0.558 825 HA ALA 106 HA ALA 106 -4.446 -22.594 -2.116 826 HB1 ALA 106 1HB ALA 106 -5.071 -24.150 -0.317 827 HB2 ALA 106 2HB ALA 106 -4.558 -22.956 0.876 828 HB3 ALA 106 3HB ALA 106 -5.918 -22.608 -0.191 829 H PHE 107 H PHE 107 -2.531 -21.442 0.641 830 HA PHE 107 HA PHE 107 -3.568 -18.920 0.970 831 HB2 PHE 107 1HB PHE 107 -1.802 -19.905 2.394 832 HB3 PHE 107 2HB PHE 107 -0.639 -19.670 1.094 833 HD1 PHE 107 1HD PHE 107 -2.751 -17.971 3.576 834 HD2 PHE 107 2HD PHE 107 0.315 -17.533 0.657 835 HE1 PHE 107 1HE PHE 107 -2.280 -15.707 4.417 836 HE2 PHE 107 2HE PHE 107 0.793 -15.269 1.494 837 HZ PHE 107 HZ PHE 107 -0.505 -14.353 3.376 838 H LYS 108 H LYS 108 -1.424 -20.083 -1.544 839 HA LYS 108 HA LYS 108 -1.076 -17.411 -2.647 840 HB2 LYS 108 1HB LYS 108 0.009 -20.122 -3.388 841 HB3 LYS 108 2HB LYS 108 0.236 -18.715 -4.418 842 HG2 LYS 108 1HG LYS 108 1.585 -17.636 -2.853 843 HG3 LYS 108 2HG LYS 108 1.041 -18.675 -1.533 844 HD2 LYS 108 1HD LYS 108 2.435 -19.920 -3.854 845 HD3 LYS 108 2HD LYS 108 3.393 -19.027 -2.670 846 HE2 LYS 108 1HE LYS 108 2.808 -20.473 -0.933 847 HE3 LYS 108 2HE LYS 108 1.418 -21.113 -1.809 848 HZ1 LYS 108 1HZ LYS 108 2.690 -22.567 -2.943 849 HZ2 LYS 108 2HZ LYS 108 3.727 -22.394 -1.619 850 HZ3 LYS 108 3HZ LYS 108 4.020 -21.527 -3.041 851 H ASN 109 H ASN 109 -2.475 -20.529 -3.632 852 HA ASN 109 HA ASN 109 -3.394 -19.926 -6.136 853 HB2 ASN 109 1HB ASN 109 -4.466 -21.671 -3.952 854 HB3 ASN 109 2HB ASN 109 -5.418 -21.447 -5.416 855 HD21 ASN 109 1HD2 ASN 109 -2.423 -22.657 -4.102 856 HD22 ASN 109 2HD2 ASN 109 -2.011 -23.661 -5.446 857 H ILE 110 H ILE 110 -4.911 -19.110 -3.047 858 HA ILE 110 HA ILE 110 -7.166 -17.834 -4.311 859 HB ILE 110 HB ILE 110 -7.315 -18.949 -2.080 860 HG12 ILE 110 1HG1 ILE 110 -8.689 -17.141 -1.033 861 HG13 ILE 110 2HG1 ILE 110 -8.055 -16.020 -2.232 862 HG21 ILE 110 1HG2 ILE 110 -5.060 -17.498 -1.493 863 HG22 ILE 110 2HG2 ILE 110 -6.322 -16.633 -0.617 864 HG23 ILE 110 3HG2 ILE 110 -6.067 -18.353 -0.324 865 HD11 ILE 110 1HD1 ILE 110 -9.452 -16.745 -3.810 866 HD12 ILE 110 2HD1 ILE 110 -9.219 -18.439 -3.376 867 HD13 ILE 110 3HD1 ILE 110 -10.358 -17.444 -2.469 868 H ALA 111 H ALA 111 -4.077 -16.873 -2.994 869 HA ALA 111 HA ALA 111 -4.527 -14.125 -2.690 870 HB1 ALA 111 1HB ALA 111 -2.407 -14.133 -2.027 871 HB2 ALA 111 2HB ALA 111 -2.366 -15.856 -2.403 872 HB3 ALA 111 3HB ALA 111 -1.849 -14.678 -3.609 873 H SER 112 H SER 112 -3.818 -16.060 -5.520 874 HA SER 112 HA SER 112 -3.052 -14.010 -7.276 875 HB2 SER 112 1HB SER 112 -2.677 -16.296 -7.909 876 HB3 SER 112 2HB SER 112 -4.396 -16.669 -7.791 877 HG SER 112 HG SER 112 -4.020 -16.347 -9.924 878 H LYS 113 H LYS 113 -6.245 -15.439 -6.647 879 HA LYS 113 HA LYS 113 -7.704 -13.918 -8.483 880 HB2 LYS 113 1HB LYS 113 -8.358 -15.438 -6.006 881 HB3 LYS 113 2HB LYS 113 -9.571 -14.325 -6.625 882 HG2 LYS 113 1HG LYS 113 -10.203 -16.205 -7.724 883 HG3 LYS 113 2HG LYS 113 -9.038 -15.578 -8.893 884 HD2 LYS 113 1HD LYS 113 -8.306 -17.739 -8.732 885 HD3 LYS 113 2HD LYS 113 -7.350 -17.003 -7.443 886 HE2 LYS 113 1HE LYS 113 -8.800 -17.831 -5.769 887 HE3 LYS 113 2HE LYS 113 -10.034 -18.267 -6.949 888 HZ1 LYS 113 1HZ LYS 113 -7.352 -19.522 -6.908 889 HZ2 LYS 113 2HZ LYS 113 -8.734 -20.049 -7.729 890 HZ3 LYS 113 3HZ LYS 113 -8.664 -20.147 -6.041 891 H ILE 114 H ILE 114 -7.641 -13.414 -4.950 892 HA ILE 114 HA ILE 114 -8.896 -11.057 -4.693 893 HB ILE 114 HB ILE 114 -6.279 -11.717 -3.338 894 HG12 ILE 114 1HG1 ILE 114 -7.926 -13.479 -3.017 895 HG13 ILE 114 2HG1 ILE 114 -7.728 -12.574 -1.520 896 HG21 ILE 114 1HG2 ILE 114 -6.479 -9.862 -2.124 897 HG22 ILE 114 2HG2 ILE 114 -7.703 -9.339 -3.280 898 HG23 ILE 114 3HG2 ILE 114 -8.185 -10.174 -1.804 899 HD11 ILE 114 1HD1 ILE 114 -10.040 -12.661 -3.392 900 HD12 ILE 114 2HD1 ILE 114 -10.004 -12.795 -1.634 901 HD13 ILE 114 3HD1 ILE 114 -9.774 -11.226 -2.404 902 H ALA 115 H ALA 115 -5.532 -11.421 -5.751 903 HA ALA 115 HA ALA 115 -4.963 -8.665 -5.972 904 HB1 ALA 115 1HB ALA 115 -3.593 -10.523 -7.817 905 HB2 ALA 115 2HB ALA 115 -2.928 -9.309 -6.724 906 HB3 ALA 115 3HB ALA 115 -3.452 -10.870 -6.094 907 H ASN 116 H ASN 116 -5.364 -10.969 -8.667 908 HA ASN 116 HA ASN 116 -5.575 -9.287 -10.762 909 HB2 ASN 116 1HB ASN 116 -7.041 -11.836 -10.157 910 HB3 ASN 116 2HB ASN 116 -7.372 -10.960 -11.649 911 HD21 ASN 116 1HD2 ASN 116 -5.161 -12.947 -9.934 912 HD22 ASN 116 2HD2 ASN 116 -4.009 -13.144 -11.206 913 H GLU 117 H GLU 117 -8.107 -9.942 -8.398 914 HA GLU 117 HA GLU 117 -10.116 -8.422 -9.740 915 HB2 GLU 117 1HB GLU 117 -9.969 -9.222 -6.828 916 HB3 GLU 117 2HB GLU 117 -11.403 -8.672 -7.682 917 HG2 GLU 117 1HG GLU 117 -9.999 -11.286 -7.817 918 HG3 GLU 117 2HG GLU 117 -11.722 -10.934 -7.699 919 H LEU 118 H LEU 118 -7.839 -7.761 -7.119 920 HA LEU 118 HA LEU 118 -8.818 -5.060 -6.779 921 HB2 LEU 118 1HB LEU 118 -6.713 -6.742 -5.497 922 HB3 LEU 118 2HB LEU 118 -6.656 -4.992 -5.300 923 HG LEU 118 HG LEU 118 -9.161 -6.485 -4.633 924 HD11 LEU 118 1HD1 LEU 118 -7.218 -5.996 -2.460 925 HD12 LEU 118 2HD1 LEU 118 -6.892 -7.360 -3.529 926 HD13 LEU 118 3HD1 LEU 118 -8.417 -7.276 -2.649 927 HD21 LEU 118 1HD2 LEU 118 -9.773 -4.579 -3.598 928 HD22 LEU 118 2HD2 LEU 118 -8.583 -3.852 -4.677 929 HD23 LEU 118 3HD2 LEU 118 -8.142 -4.244 -3.015 930 H LYS 119 H LYS 119 -7.526 -6.083 -9.332 931 HA LYS 119 HA LYS 119 -5.966 -5.435 -10.882 932 HB2 LYS 119 1HB LYS 119 -6.969 -2.872 -9.671 933 HB3 LYS 119 2HB LYS 119 -5.808 -2.856 -10.991 934 HG2 LYS 119 1HG LYS 119 -7.791 -2.671 -12.124 935 HG3 LYS 119 2HG LYS 119 -7.536 -4.417 -12.160 936 HD2 LYS 119 1HD LYS 119 -9.031 -4.691 -10.258 937 HD3 LYS 119 2HD LYS 119 -9.251 -2.942 -10.161 938 HE2 LYS 119 1HE LYS 119 -11.146 -3.750 -11.298 939 HE3 LYS 119 2HE LYS 119 -10.107 -3.066 -12.547 940 HZ1 LYS 119 1HZ LYS 119 -10.686 -5.065 -13.469 941 HZ2 LYS 119 2HZ LYS 119 -10.732 -5.881 -11.988 942 HZ3 LYS 119 3HZ LYS 119 -9.244 -5.498 -12.697 943 H LEU 120 H LEU 120 -4.816 -6.213 -8.363 944 HA LEU 120 HA LEU 120 -2.687 -4.342 -7.797 945 HB2 LEU 120 1HB LEU 120 -3.230 -7.132 -6.798 946 HB3 LEU 120 2HB LEU 120 -1.907 -6.112 -6.237 947 HG LEU 120 HG LEU 120 -4.796 -5.311 -5.976 948 HD11 LEU 120 1HD1 LEU 120 -4.108 -5.998 -3.475 949 HD12 LEU 120 2HD1 LEU 120 -3.198 -7.207 -4.380 950 HD13 LEU 120 3HD1 LEU 120 -4.945 -7.082 -4.587 951 HD21 LEU 120 1HD2 LEU 120 -2.707 -3.723 -5.793 952 HD22 LEU 120 2HD2 LEU 120 -2.580 -4.441 -4.186 953 HD23 LEU 120 3HD2 LEU 120 -4.053 -3.591 -4.659 954 H SER 121 H SER 121 -0.437 -5.643 -7.484 955 HA SER 121 HA SER 121 0.618 -5.947 -10.046 956 HB2 SER 121 1HB SER 121 1.850 -5.492 -7.838 957 HB3 SER 121 2HB SER 121 1.831 -7.241 -7.607 958 HG SER 121 HG SER 121 3.422 -5.736 -9.196 959 H GLY 122 H GLY 122 0.001 -8.500 -7.626 960 HA2 GLY 122 1HA GLY 122 -0.814 -10.648 -7.982 961 HA3 GLY 122 2HA GLY 122 -0.856 -10.317 -9.707 962 HA PRO 123 HA PRO 123 3.685 -11.635 -8.632 963 HB2 PRO 123 1HB PRO 123 4.046 -12.756 -6.185 964 HB3 PRO 123 2HB PRO 123 4.230 -11.024 -6.485 965 HG2 PRO 123 1HG PRO 123 1.901 -12.510 -5.331 966 HG3 PRO 123 2HG PRO 123 2.622 -10.976 -4.806 967 HD2 PRO 123 1HD PRO 123 0.362 -11.091 -6.294 968 HD3 PRO 123 2HD PRO 123 1.532 -9.762 -6.434 969 H SER 124 H SER 124 4.459 -13.602 -9.259 970 HA SER 124 HA SER 124 2.711 -15.934 -8.815 971 HB2 SER 124 1HB SER 124 2.454 -15.385 -11.109 972 HB3 SER 124 2HB SER 124 4.178 -15.073 -11.308 973 HG SER 124 HG SER 124 4.582 -17.208 -11.307 974 H SER 125 H SER 125 3.708 -17.947 -8.545 975 HA SER 125 HA SER 125 6.626 -17.989 -8.324 976 HB2 SER 125 1HB SER 125 5.347 -17.505 -6.073 977 HB3 SER 125 2HB SER 125 5.035 -19.240 -6.116 978 HG SER 125 HG SER 125 6.962 -18.757 -4.992 979 H GLY 126 H GLY 126 7.393 -19.705 -9.356 980 HA2 GLY 126 1HA GLY 126 7.618 -21.938 -9.961 981 HA3 GLY 126 2HA GLY 126 6.123 -22.290 -9.109 Start of MODEL 8 1 H1 MET 1 H MET 1 -11.234 19.145 -27.349 2 HA MET 1 HA MET 1 -8.353 19.679 -27.105 3 HB2 MET 1 1HB MET 1 -9.460 21.379 -28.563 4 HB3 MET 1 2HB MET 1 -10.489 21.815 -27.205 5 HG2 MET 1 1HG MET 1 -8.445 22.395 -25.920 6 HG3 MET 1 2HG MET 1 -7.501 22.099 -27.378 7 HE1 MET 1 1HE MET 1 -7.330 24.343 -25.670 8 HE2 MET 1 2HE MET 1 -7.029 25.578 -26.892 9 HE3 MET 1 3HE MET 1 -8.430 25.713 -25.828 10 H LYS 2 H LYS 2 -11.556 20.283 -25.682 11 HA LYS 2 HA LYS 2 -10.341 20.563 -23.042 12 HB2 LYS 2 1HB LYS 2 -13.134 21.021 -24.082 13 HB3 LYS 2 2HB LYS 2 -12.747 21.068 -22.368 14 HG2 LYS 2 1HG LYS 2 -10.965 22.805 -23.050 15 HG3 LYS 2 2HG LYS 2 -11.895 22.932 -24.545 16 HD2 LYS 2 1HD LYS 2 -13.744 23.809 -23.474 17 HD3 LYS 2 2HD LYS 2 -13.302 23.110 -21.915 18 HE2 LYS 2 1HE LYS 2 -11.299 24.702 -21.981 19 HE3 LYS 2 2HE LYS 2 -12.155 25.525 -23.284 20 HZ1 LYS 2 1HZ LYS 2 -13.912 25.091 -21.123 21 HZ2 LYS 2 2HZ LYS 2 -13.409 26.557 -21.800 22 HZ3 LYS 2 3HZ LYS 2 -12.512 25.851 -20.552 23 H ASP 3 H ASP 3 -9.795 18.577 -22.298 24 HA ASP 3 HA ASP 3 -11.920 16.834 -21.472 25 HB2 ASP 3 1HB ASP 3 -10.040 16.011 -23.671 26 HB3 ASP 3 2HB ASP 3 -10.766 14.815 -22.601 27 H HIS 4 H HIS 4 -11.393 15.971 -19.571 28 HA HIS 4 HA HIS 4 -8.547 15.934 -18.814 29 HB2 HIS 4 1HB HIS 4 -9.948 17.482 -17.492 30 HB3 HIS 4 2HB HIS 4 -10.974 16.132 -17.016 31 HD1 HIS 4 1HD HIS 4 -9.071 18.046 -15.187 32 HD2 HIS 4 2HD HIS 4 -8.456 14.073 -16.237 33 HE1 HIS 4 1HE HIS 4 -7.544 17.112 -13.420 34 HE2 HIS 4 2HE HIS 4 -7.117 14.732 -14.123 35 H LEU 5 H LEU 5 -8.187 13.847 -19.663 36 HA LEU 5 HA LEU 5 -9.328 11.699 -18.007 37 HB2 LEU 5 1HB LEU 5 -8.829 11.646 -20.978 38 HB3 LEU 5 2HB LEU 5 -9.212 10.225 -20.009 39 HG LEU 5 HG LEU 5 -11.052 12.597 -20.235 40 HD11 LEU 5 1HD1 LEU 5 -12.271 11.427 -21.931 41 HD12 LEU 5 2HD1 LEU 5 -11.180 10.045 -21.830 42 HD13 LEU 5 3HD1 LEU 5 -10.595 11.585 -22.459 43 HD21 LEU 5 1HD2 LEU 5 -12.013 11.495 -18.541 44 HD22 LEU 5 2HD2 LEU 5 -11.077 10.030 -18.838 45 HD23 LEU 5 3HD2 LEU 5 -12.537 10.349 -19.775 46 H ILE 6 H ILE 6 -7.807 10.656 -16.923 47 HA ILE 6 HA ILE 6 -5.019 10.983 -17.629 48 HB ILE 6 HB ILE 6 -6.278 9.450 -15.351 49 HG12 ILE 6 1HG1 ILE 6 -4.770 12.007 -15.017 50 HG13 ILE 6 2HG1 ILE 6 -6.429 12.083 -15.599 51 HG21 ILE 6 1HG2 ILE 6 -4.261 8.687 -14.820 52 HG22 ILE 6 2HG2 ILE 6 -3.677 9.301 -16.366 53 HG23 ILE 6 3HG2 ILE 6 -3.567 10.305 -14.920 54 HD11 ILE 6 1HD1 ILE 6 -7.286 11.209 -13.624 55 HD12 ILE 6 2HD1 ILE 6 -5.724 10.564 -13.121 56 HD13 ILE 6 3HD1 ILE 6 -6.011 12.303 -13.090 57 H HIS 7 H HIS 7 -4.920 9.819 -19.597 58 HA HIS 7 HA HIS 7 -5.126 6.895 -19.294 59 HB2 HIS 7 1HB HIS 7 -6.642 8.034 -20.994 60 HB3 HIS 7 2HB HIS 7 -5.183 8.395 -21.912 61 HD1 HIS 7 1HD HIS 7 -4.798 6.759 -23.710 62 HD2 HIS 7 2HD HIS 7 -6.670 5.020 -20.433 63 HE1 HIS 7 1HE HIS 7 -5.155 4.350 -24.339 64 HE2 HIS 7 2HE HIS 7 -6.366 3.339 -22.375 65 H ASN 8 H ASN 8 -2.991 6.821 -18.410 66 HA ASN 8 HA ASN 8 -0.889 7.176 -20.445 67 HB2 ASN 8 1HB ASN 8 -0.697 7.576 -17.452 68 HB3 ASN 8 2HB ASN 8 0.687 7.567 -18.541 69 HD21 ASN 8 1HD2 ASN 8 -2.453 9.139 -18.088 70 HD22 ASN 8 2HD2 ASN 8 -1.942 10.701 -18.624 71 H VAL 9 H VAL 9 -1.896 4.872 -20.763 72 HA VAL 9 HA VAL 9 -0.549 2.941 -19.004 73 HB VAL 9 HB VAL 9 -2.002 1.240 -20.065 74 HG11 VAL 9 1HG1 VAL 9 -3.170 3.600 -18.648 75 HG12 VAL 9 2HG1 VAL 9 -4.206 2.262 -19.149 76 HG13 VAL 9 3HG1 VAL 9 -2.861 1.972 -18.045 77 HG21 VAL 9 1HG2 VAL 9 -2.381 2.238 -22.215 78 HG22 VAL 9 2HG2 VAL 9 -3.938 2.044 -21.410 79 HG23 VAL 9 3HG2 VAL 9 -3.174 3.631 -21.480 80 H HIS 10 H HIS 10 1.241 4.160 -20.553 81 HA HIS 10 HA HIS 10 1.764 2.248 -22.734 82 HB2 HIS 10 1HB HIS 10 3.080 4.039 -23.823 83 HB3 HIS 10 2HB HIS 10 1.385 4.476 -23.630 84 HD1 HIS 10 1HD HIS 10 4.812 5.434 -22.572 85 HD2 HIS 10 2HD HIS 10 0.891 6.534 -21.750 86 HE1 HIS 10 1HE HIS 10 4.972 7.616 -21.333 87 HE2 HIS 10 2HE HIS 10 2.592 8.219 -20.771 88 H LYS 11 H LYS 11 2.898 0.808 -21.413 89 HA LYS 11 HA LYS 11 5.611 1.689 -20.759 90 HB2 LYS 11 1HB LYS 11 3.775 0.221 -18.859 91 HB3 LYS 11 2HB LYS 11 5.507 0.401 -18.615 92 HG2 LYS 11 1HG LYS 11 3.742 2.792 -18.980 93 HG3 LYS 11 2HG LYS 11 3.925 2.015 -17.405 94 HD2 LYS 11 1HD LYS 11 6.361 2.739 -18.972 95 HD3 LYS 11 2HD LYS 11 5.487 4.001 -18.102 96 HE2 LYS 11 1HE LYS 11 5.664 2.597 -16.045 97 HE3 LYS 11 2HE LYS 11 6.696 1.491 -16.950 98 HZ1 LYS 11 1HZ LYS 11 7.249 4.276 -16.141 99 HZ2 LYS 11 2HZ LYS 11 8.103 3.551 -17.409 100 HZ3 LYS 11 3HZ LYS 11 8.172 2.888 -15.854 101 H GLU 12 H GLU 12 7.073 0.324 -21.547 102 HA GLU 12 HA GLU 12 6.372 -2.508 -21.848 103 HB2 GLU 12 1HB GLU 12 7.207 -0.609 -23.993 104 HB3 GLU 12 2HB GLU 12 7.783 -2.268 -24.076 105 HG2 GLU 12 1HG GLU 12 4.943 -1.297 -24.108 106 HG3 GLU 12 2HG GLU 12 5.818 -2.146 -25.381 107 H GLU 13 H GLU 13 8.049 -3.935 -21.571 108 HA GLU 13 HA GLU 13 10.668 -2.756 -20.907 109 HB2 GLU 13 1HB GLU 13 8.991 -4.723 -19.433 110 HB3 GLU 13 2HB GLU 13 10.731 -4.967 -19.411 111 HG2 GLU 13 1HG GLU 13 10.194 -3.716 -17.487 112 HG3 GLU 13 2HG GLU 13 10.956 -2.600 -18.618 113 H HIS 14 H HIS 14 12.439 -3.684 -21.781 114 HA HIS 14 HA HIS 14 11.999 -6.032 -23.503 115 HB2 HIS 14 1HB HIS 14 14.041 -5.198 -24.736 116 HB3 HIS 14 2HB HIS 14 12.619 -4.164 -24.853 117 HD1 HIS 14 1HD HIS 14 16.142 -4.068 -24.068 118 HD2 HIS 14 2HD HIS 14 12.782 -1.884 -22.969 119 HE1 HIS 14 1HE HIS 14 17.022 -1.908 -23.128 120 HE2 HIS 14 2HE HIS 14 14.974 -0.639 -22.392 121 H ALA 15 H ALA 15 12.356 -7.420 -21.658 122 HA ALA 15 HA ALA 15 15.112 -8.191 -21.428 123 HB1 ALA 15 1HB ALA 15 14.610 -6.290 -19.699 124 HB2 ALA 15 2HB ALA 15 13.855 -7.600 -18.790 125 HB3 ALA 15 3HB ALA 15 15.560 -7.701 -19.230 126 H HIS 16 H HIS 16 15.265 -10.046 -19.710 127 HA HIS 16 HA HIS 16 13.725 -12.168 -20.557 128 HB2 HIS 16 1HB HIS 16 15.200 -11.742 -17.958 129 HB3 HIS 16 2HB HIS 16 14.442 -13.275 -18.381 130 HD1 HIS 16 1HD HIS 16 16.514 -14.667 -18.692 131 HD2 HIS 16 2HD HIS 16 16.592 -11.154 -20.908 132 HE1 HIS 16 1HE HIS 16 18.518 -14.867 -20.199 133 HE2 HIS 16 2HE HIS 16 18.593 -12.694 -21.469 134 H ALA 17 H ALA 17 12.313 -13.546 -19.043 135 HA ALA 17 HA ALA 17 9.900 -12.232 -18.598 136 HB1 ALA 17 1HB ALA 17 9.096 -14.281 -18.199 137 HB2 ALA 17 2HB ALA 17 10.713 -14.840 -18.630 138 HB3 ALA 17 3HB ALA 17 10.283 -14.605 -16.936 139 H HIS 18 H HIS 18 8.770 -12.534 -16.310 140 HA HIS 18 HA HIS 18 10.398 -10.965 -14.446 141 HB2 HIS 18 1HB HIS 18 7.412 -11.451 -14.461 142 HB3 HIS 18 2HB HIS 18 8.276 -10.359 -13.382 143 HD1 HIS 18 1HD HIS 18 9.392 -8.232 -14.550 144 HD2 HIS 18 2HD HIS 18 6.701 -10.377 -16.879 145 HE1 HIS 18 1HE HIS 18 8.790 -6.708 -16.457 146 HE2 HIS 18 2HE HIS 18 7.096 -7.995 -17.806 147 H ASN 19 H ASN 19 11.615 -12.624 -13.513 148 HA ASN 19 HA ASN 19 10.076 -14.510 -11.852 149 HB2 ASN 19 1HB ASN 19 12.887 -14.919 -12.888 150 HB3 ASN 19 2HB ASN 19 11.886 -16.095 -12.042 151 HD21 ASN 19 1HD2 ASN 19 13.006 -15.218 -14.978 152 HD22 ASN 19 2HD2 ASN 19 11.789 -15.920 -15.984 153 H LYS 20 H LYS 20 10.007 -13.572 -9.893 154 HA LYS 20 HA LYS 20 12.277 -12.130 -8.830 155 HB2 LYS 20 1HB LYS 20 9.651 -12.847 -7.514 156 HB3 LYS 20 2HB LYS 20 10.838 -11.705 -6.898 157 HG2 LYS 20 1HG LYS 20 9.741 -11.248 -9.618 158 HG3 LYS 20 2HG LYS 20 8.705 -10.914 -8.228 159 HD2 LYS 20 1HD LYS 20 11.491 -9.861 -8.212 160 HD3 LYS 20 2HD LYS 20 10.295 -9.063 -9.235 161 HE2 LYS 20 1HE LYS 20 10.446 -8.021 -7.020 162 HE3 LYS 20 2HE LYS 20 8.851 -8.714 -7.313 163 HZ1 LYS 20 1HZ LYS 20 9.497 -10.645 -6.004 164 HZ2 LYS 20 2HZ LYS 20 9.628 -9.227 -5.092 165 HZ3 LYS 20 3HZ LYS 20 11.018 -9.965 -5.712 166 H ASP 21 H ASP 21 13.616 -14.159 -9.035 167 HA ASP 21 HA ASP 21 13.486 -15.629 -6.492 168 HB2 ASP 21 1HB ASP 21 12.640 -17.054 -8.355 169 HB3 ASP 21 2HB ASP 21 14.199 -16.873 -9.156 170 H TYR 22 H TYR 22 15.068 -14.056 -5.810 171 HA TYR 22 HA TYR 22 17.767 -14.716 -6.783 172 HB2 TYR 22 1HB TYR 22 18.242 -12.239 -6.017 173 HB3 TYR 22 2HB TYR 22 17.606 -12.576 -7.623 174 HD1 TYR 22 2HD TYR 22 14.893 -12.738 -7.614 175 HD2 TYR 22 1HD TYR 22 17.268 -10.483 -4.897 176 HE1 TYR 22 2HE TYR 22 12.974 -11.265 -7.167 177 HE2 TYR 22 1HE TYR 22 15.355 -9.005 -4.442 178 HH TYR 22 HH TYR 22 13.051 -8.863 -4.637 179 H ASP 23 H ASP 23 16.512 -12.659 -4.169 180 HA ASP 23 HA ASP 23 17.816 -14.443 -2.226 181 HB2 ASP 23 1HB ASP 23 18.570 -12.469 -0.956 182 HB3 ASP 23 2HB ASP 23 19.278 -12.517 -2.568 183 H ILE 24 H ILE 24 15.265 -14.876 -2.584 184 HA ILE 24 HA ILE 24 13.554 -13.176 -1.028 185 HB ILE 24 HB ILE 24 12.762 -15.978 -1.642 186 HG12 ILE 24 1HG1 ILE 24 12.089 -14.838 -3.974 187 HG13 ILE 24 2HG1 ILE 24 13.568 -13.940 -3.652 188 HG21 ILE 24 1HG2 ILE 24 11.429 -13.283 -1.683 189 HG22 ILE 24 2HG2 ILE 24 10.659 -14.739 -2.309 190 HG23 ILE 24 3HG2 ILE 24 11.111 -14.643 -0.607 191 HD11 ILE 24 1HD1 ILE 24 14.754 -15.632 -4.425 192 HD12 ILE 24 2HD1 ILE 24 14.090 -16.681 -3.171 193 HD13 ILE 24 3HD1 ILE 24 13.272 -16.538 -4.727 194 HA PRO 25 HA PRO 25 14.443 -14.878 2.947 195 HB2 PRO 25 1HB PRO 25 12.236 -13.976 4.244 196 HB3 PRO 25 2HB PRO 25 13.585 -12.924 3.797 197 HG2 PRO 25 1HG PRO 25 10.957 -13.325 2.419 198 HG3 PRO 25 2HG PRO 25 11.838 -11.818 2.732 199 HD2 PRO 25 1HD PRO 25 11.877 -13.054 0.323 200 HD3 PRO 25 2HD PRO 25 13.259 -12.129 0.944 201 H THR 26 H THR 26 13.253 -16.161 4.685 202 HA THR 26 HA THR 26 11.759 -18.299 3.359 203 HB THR 26 HB THR 26 13.755 -18.940 4.659 204 HG1 THR 26 1HG THR 26 12.448 -20.420 6.145 205 HG21 THR 26 1HG2 THR 26 12.321 -17.435 6.778 206 HG22 THR 26 2HG2 THR 26 14.051 -17.587 6.469 207 HG23 THR 26 3HG2 THR 26 13.179 -18.896 7.267 208 H THR 27 H THR 27 10.495 -15.761 4.045 209 HA THR 27 HA THR 27 8.688 -16.521 6.225 210 HB THR 27 HB THR 27 7.795 -14.130 5.817 211 HG1 THR 27 1HG THR 27 8.949 -13.882 3.796 212 HG21 THR 27 1HG2 THR 27 9.750 -15.156 7.471 213 HG22 THR 27 2HG2 THR 27 9.010 -13.560 7.612 214 HG23 THR 27 3HG2 THR 27 10.533 -13.753 6.744 215 H GLU 28 H GLU 28 6.358 -16.108 5.926 216 HA GLU 28 HA GLU 28 5.528 -16.883 3.213 217 HB2 GLU 28 1HB GLU 28 4.089 -17.245 5.848 218 HB3 GLU 28 2HB GLU 28 3.487 -17.765 4.281 219 HG2 GLU 28 1HG GLU 28 5.968 -18.778 5.648 220 HG3 GLU 28 2HG GLU 28 4.427 -19.625 5.522 221 H ASN 29 H ASN 29 6.078 -14.170 3.810 222 HA ASN 29 HA ASN 29 3.388 -12.978 3.859 223 HB2 ASN 29 1HB ASN 29 6.089 -11.779 4.496 224 HB3 ASN 29 2HB ASN 29 4.606 -10.837 4.376 225 HD21 ASN 29 1HD2 ASN 29 6.576 -12.699 6.371 226 HD22 ASN 29 2HD2 ASN 29 5.521 -12.806 7.735 227 H LEU 30 H LEU 30 2.599 -12.305 1.986 228 HA LEU 30 HA LEU 30 4.444 -11.846 -0.248 229 HB2 LEU 30 1HB LEU 30 1.598 -12.680 -0.024 230 HB3 LEU 30 2HB LEU 30 2.098 -11.803 -1.468 231 HG LEU 30 HG LEU 30 2.079 -14.281 -1.717 232 HD11 LEU 30 1HD1 LEU 30 3.605 -12.593 -2.951 233 HD12 LEU 30 2HD1 LEU 30 3.946 -14.318 -3.082 234 HD13 LEU 30 3HD1 LEU 30 4.896 -13.313 -1.988 235 HD21 LEU 30 1HD2 LEU 30 2.774 -15.053 0.403 236 HD22 LEU 30 2HD2 LEU 30 4.238 -14.069 0.367 237 HD23 LEU 30 3HD2 LEU 30 4.081 -15.457 -0.711 238 H TYR 31 H TYR 31 4.232 -10.005 -1.585 239 HA TYR 31 HA TYR 31 2.712 -7.774 -0.414 240 HB2 TYR 31 1HB TYR 31 5.470 -7.496 -1.613 241 HB3 TYR 31 2HB TYR 31 4.541 -6.262 -0.769 242 HD1 TYR 31 1HD TYR 31 3.928 -6.812 1.715 243 HD2 TYR 31 2HD TYR 31 7.064 -8.709 -0.447 244 HE1 TYR 31 1HE TYR 31 4.993 -7.456 3.837 245 HE2 TYR 31 2HE TYR 31 8.137 -9.359 1.669 246 HH TYR 31 HH TYR 31 6.809 -8.340 4.792 247 H PHE 32 H PHE 32 1.548 -6.602 -1.816 248 HA PHE 32 HA PHE 32 2.041 -7.002 -4.693 249 HB2 PHE 32 1HB PHE 32 -0.677 -6.652 -3.418 250 HB3 PHE 32 2HB PHE 32 -0.335 -7.010 -5.107 251 HD1 PHE 32 1HD PHE 32 0.314 -8.407 -1.711 252 HD2 PHE 32 2HD PHE 32 -0.512 -9.187 -5.813 253 HE1 PHE 32 1HE PHE 32 0.178 -10.815 -1.223 254 HE2 PHE 32 2HE PHE 32 -0.650 -11.595 -5.331 255 HZ PHE 32 HZ PHE 32 -0.305 -12.412 -3.033 256 H GLN 33 H GLN 33 0.680 -5.253 -5.956 257 HA GLN 33 HA GLN 33 0.747 -2.670 -4.599 258 HB2 GLN 33 1HB GLN 33 2.247 -3.214 -7.167 259 HB3 GLN 33 2HB GLN 33 2.062 -1.641 -6.401 260 HG2 GLN 33 1HG GLN 33 3.374 -2.320 -4.528 261 HG3 GLN 33 2HG GLN 33 3.409 -3.989 -5.093 262 HE21 GLN 33 1HE2 GLN 33 5.690 -2.484 -4.480 263 HE22 GLN 33 2HE2 GLN 33 6.598 -2.256 -5.932 264 H GLY 34 H GLY 34 -0.949 -1.451 -5.143 265 HA2 GLY 34 1HA GLY 34 -2.028 -0.898 -7.567 266 HA3 GLY 34 2HA GLY 34 -2.793 -2.422 -7.141 267 H SER 35 H SER 35 -2.081 0.741 -5.657 268 HA SER 35 HA SER 35 -4.419 0.549 -3.973 269 HB2 SER 35 1HB SER 35 -2.339 1.614 -3.158 270 HB3 SER 35 2HB SER 35 -2.516 2.869 -4.384 271 HG SER 35 HG SER 35 -3.388 3.628 -2.476 272 H SER 36 H SER 36 -6.327 1.611 -4.198 273 HA SER 36 HA SER 36 -6.838 2.810 -6.811 274 HB2 SER 36 1HB SER 36 -8.357 1.035 -6.036 275 HB3 SER 36 2HB SER 36 -8.767 2.003 -4.620 276 HG SER 36 HG SER 36 -9.252 3.627 -6.497 277 H GLY 37 H GLY 37 -5.308 4.315 -4.913 278 HA2 GLY 37 1HA GLY 37 -5.614 6.792 -5.013 279 HA3 GLY 37 2HA GLY 37 -7.205 6.504 -4.325 280 H SER 38 H SER 38 -7.399 5.957 -2.139 281 HA SER 38 HA SER 38 -5.069 6.727 -0.537 282 HB2 SER 38 1HB SER 38 -8.012 6.562 0.143 283 HB3 SER 38 2HB SER 38 -6.754 6.950 1.316 284 HG SER 38 HG SER 38 -7.268 8.907 0.631 285 H SER 39 H SER 39 -4.857 5.591 1.609 286 HA SER 39 HA SER 39 -4.600 2.779 1.130 287 HB2 SER 39 1HB SER 39 -4.150 4.342 3.684 288 HB3 SER 39 2HB SER 39 -3.604 2.696 3.366 289 HG SER 39 HG SER 39 -2.783 4.328 1.399 290 H GLY 40 H GLY 40 -6.977 4.810 2.566 291 HA2 GLY 40 1HA GLY 40 -8.163 2.839 4.271 292 HA3 GLY 40 2HA GLY 40 -8.881 4.370 3.791 293 H ASP 41 H ASP 41 -9.131 4.212 1.128 294 HA ASP 41 HA ASP 41 -11.445 2.875 0.649 295 HB2 ASP 41 1HB ASP 41 -10.944 4.265 -1.099 296 HB3 ASP 41 2HB ASP 41 -9.239 3.821 -1.103 297 H MET 42 H MET 42 -8.176 1.580 0.334 298 HA MET 42 HA MET 42 -8.606 -0.800 -0.935 299 HB2 MET 42 1HB MET 42 -6.778 -0.097 1.349 300 HB3 MET 42 2HB MET 42 -6.780 -1.707 0.641 301 HG2 MET 42 1HG MET 42 -6.531 -0.283 -1.593 302 HG3 MET 42 2HG MET 42 -5.802 0.854 -0.461 303 HE1 MET 42 1HE MET 42 -4.550 -1.224 -3.063 304 HE2 MET 42 2HE MET 42 -3.881 -2.697 -2.362 305 HE3 MET 42 3HE MET 42 -5.624 -2.420 -2.336 306 H MET 43 H MET 43 -9.049 -0.157 2.533 307 HA MET 43 HA MET 43 -9.804 -2.726 3.310 308 HB2 MET 43 1HB MET 43 -10.868 -0.151 4.476 309 HB3 MET 43 2HB MET 43 -10.743 -1.708 5.282 310 HG2 MET 43 1HG MET 43 -8.257 -0.491 4.217 311 HG3 MET 43 2HG MET 43 -8.979 0.217 5.661 312 HE1 MET 43 1HE MET 43 -10.252 -2.206 7.173 313 HE2 MET 43 2HE MET 43 -8.914 -2.715 8.203 314 HE3 MET 43 3HE MET 43 -9.231 -0.997 7.954 315 H ARG 44 H ARG 44 -11.562 -0.272 1.606 316 HA ARG 44 HA ARG 44 -14.128 -1.570 2.029 317 HB2 ARG 44 1HB ARG 44 -13.257 0.911 0.564 318 HB3 ARG 44 2HB ARG 44 -14.881 0.260 0.384 319 HG2 ARG 44 1HG ARG 44 -15.516 0.888 2.465 320 HG3 ARG 44 2HG ARG 44 -13.902 0.669 3.144 321 HD2 ARG 44 1HD ARG 44 -13.208 2.765 2.523 322 HD3 ARG 44 2HD ARG 44 -14.328 2.848 1.163 323 HE ARG 44 HE ARG 44 -15.562 2.872 3.778 324 HH11 ARG 44 2HH1 ARG 44 -14.273 4.755 1.150 325 HH12 ARG 44 1HH1 ARG 44 -15.157 6.185 1.568 326 HH21 ARG 44 2HH2 ARG 44 -16.732 4.747 4.339 327 HH22 ARG 44 1HH2 ARG 44 -16.555 6.180 3.383 328 H GLU 45 H GLU 45 -11.725 -1.160 -0.509 329 HA GLU 45 HA GLU 45 -13.284 -2.351 -2.575 330 HB2 GLU 45 1HB GLU 45 -11.115 -0.843 -2.669 331 HB3 GLU 45 2HB GLU 45 -10.298 -2.399 -2.643 332 HG2 GLU 45 1HG GLU 45 -11.376 -3.083 -4.655 333 HG3 GLU 45 2HG GLU 45 -12.433 -1.672 -4.631 334 H ILE 46 H ILE 46 -10.514 -3.555 -0.678 335 HA ILE 46 HA ILE 46 -10.206 -6.068 -1.594 336 HB ILE 46 HB ILE 46 -10.333 -5.334 1.333 337 HG12 ILE 46 1HG1 ILE 46 -7.793 -5.623 -0.210 338 HG13 ILE 46 2HG1 ILE 46 -8.727 -4.145 -0.409 339 HG21 ILE 46 1HG2 ILE 46 -8.588 -7.503 0.313 340 HG22 ILE 46 2HG2 ILE 46 -9.395 -7.335 1.871 341 HG23 ILE 46 3HG2 ILE 46 -10.313 -7.838 0.452 342 HD11 ILE 46 1HD1 ILE 46 -7.435 -3.472 1.307 343 HD12 ILE 46 2HD1 ILE 46 -8.682 -4.278 2.260 344 HD13 ILE 46 3HD1 ILE 46 -7.172 -5.113 1.897 345 H ARG 47 H ARG 47 -12.348 -5.489 1.199 346 HA ARG 47 HA ARG 47 -13.604 -7.825 1.476 347 HB2 ARG 47 1HB ARG 47 -14.947 -5.118 1.417 348 HB3 ARG 47 2HB ARG 47 -15.697 -6.578 2.050 349 HG2 ARG 47 1HG ARG 47 -13.853 -6.753 3.696 350 HG3 ARG 47 2HG ARG 47 -13.235 -5.208 3.107 351 HD2 ARG 47 1HD ARG 47 -15.945 -5.696 4.340 352 HD3 ARG 47 2HD ARG 47 -14.576 -4.901 5.117 353 HE ARG 47 HE ARG 47 -14.949 -3.394 2.922 354 HH11 ARG 47 2HH1 ARG 47 -17.130 -4.547 5.379 355 HH12 ARG 47 1HH1 ARG 47 -18.196 -3.187 5.255 356 HH21 ARG 47 2HH2 ARG 47 -16.345 -1.598 2.750 357 HH22 ARG 47 1HH2 ARG 47 -17.749 -1.511 3.758 358 H LYS 48 H LYS 48 -14.239 -5.536 -1.132 359 HA LYS 48 HA LYS 48 -16.488 -6.521 -2.301 360 HB2 LYS 48 1HB LYS 48 -14.913 -4.623 -3.069 361 HB3 LYS 48 2HB LYS 48 -14.080 -5.873 -3.983 362 HG2 LYS 48 1HG LYS 48 -16.164 -6.386 -5.167 363 HG3 LYS 48 2HG LYS 48 -16.979 -5.106 -4.265 364 HD2 LYS 48 1HD LYS 48 -16.401 -4.165 -6.355 365 HD3 LYS 48 2HD LYS 48 -15.235 -3.523 -5.196 366 HE2 LYS 48 1HE LYS 48 -13.970 -4.136 -7.084 367 HE3 LYS 48 2HE LYS 48 -13.709 -5.424 -5.908 368 HZ1 LYS 48 1HZ LYS 48 -14.694 -5.639 -8.515 369 HZ2 LYS 48 2HZ LYS 48 -15.941 -6.086 -7.463 370 HZ3 LYS 48 3HZ LYS 48 -14.447 -6.875 -7.386 371 H VAL 49 H VAL 49 -13.190 -7.738 -2.878 372 HA VAL 49 HA VAL 49 -13.994 -9.863 -4.569 373 HB VAL 49 HB VAL 49 -11.491 -9.959 -2.917 374 HG11 VAL 49 1HG1 VAL 49 -12.435 -11.045 -5.523 375 HG12 VAL 49 2HG1 VAL 49 -10.713 -10.719 -5.313 376 HG13 VAL 49 3HG1 VAL 49 -11.540 -11.838 -4.228 377 HG21 VAL 49 1HG2 VAL 49 -12.108 -8.115 -5.206 378 HG22 VAL 49 2HG2 VAL 49 -11.419 -7.722 -3.631 379 HG23 VAL 49 3HG2 VAL 49 -10.458 -8.605 -4.818 380 H LEU 50 H LEU 50 -13.263 -9.689 -1.105 381 HA LEU 50 HA LEU 50 -13.380 -12.367 -0.447 382 HB2 LEU 50 1HB LEU 50 -14.461 -10.074 1.185 383 HB3 LEU 50 2HB LEU 50 -13.998 -11.661 1.796 384 HG LEU 50 HG LEU 50 -12.151 -9.566 0.655 385 HD11 LEU 50 1HD1 LEU 50 -13.239 -9.674 3.149 386 HD12 LEU 50 2HD1 LEU 50 -11.688 -8.935 2.752 387 HD13 LEU 50 3HD1 LEU 50 -11.745 -10.586 3.368 388 HD21 LEU 50 1HD2 LEU 50 -10.723 -11.212 0.237 389 HD22 LEU 50 2HD2 LEU 50 -11.848 -12.410 0.879 390 HD23 LEU 50 3HD2 LEU 50 -10.716 -11.595 1.959 391 H GLY 51 H GLY 51 -16.103 -10.068 -0.168 392 HA2 GLY 51 1HA GLY 51 -18.097 -11.892 0.416 393 HA3 GLY 51 2HA GLY 51 -18.363 -10.379 -0.436 394 H ALA 52 H ALA 52 -16.689 -11.116 -2.704 395 HA ALA 52 HA ALA 52 -18.665 -12.373 -4.296 396 HB1 ALA 52 1HB ALA 52 -17.246 -10.819 -5.367 397 HB2 ALA 52 2HB ALA 52 -15.792 -11.653 -4.819 398 HB3 ALA 52 3HB ALA 52 -16.829 -12.396 -6.036 399 H ASN 53 H ASN 53 -15.660 -13.512 -2.829 400 HA ASN 53 HA ASN 53 -16.121 -16.194 -3.905 401 HB2 ASN 53 1HB ASN 53 -13.774 -14.782 -2.710 402 HB3 ASN 53 2HB ASN 53 -13.842 -16.538 -2.602 403 HD21 ASN 53 1HD2 ASN 53 -14.550 -14.064 -5.051 404 HD22 ASN 53 2HD2 ASN 53 -13.679 -14.838 -6.327 405 H ASN 54 H ASN 54 -17.932 -15.208 -1.942 406 HA ASN 54 HA ASN 54 -18.812 -15.650 0.130 407 HB2 ASN 54 1HB ASN 54 -17.738 -18.423 -0.400 408 HB3 ASN 54 2HB ASN 54 -19.176 -17.983 0.517 409 HD21 ASN 54 1HD2 ASN 54 -21.054 -18.005 -0.499 410 HD22 ASN 54 2HD2 ASN 54 -21.273 -18.072 -2.212 411 H CYS 55 H CYS 55 -16.207 -14.588 0.322 412 HA CYS 55 HA CYS 55 -14.959 -16.135 2.478 413 HB2 CYS 55 1HB CYS 55 -13.966 -13.846 0.779 414 HB3 CYS 55 2HB CYS 55 -13.093 -14.431 2.190 415 HG CYS 55 HG CYS 55 -13.827 -16.323 -0.567 416 H ASP 56 H ASP 56 -14.901 -15.440 4.541 417 HA ASP 56 HA ASP 56 -16.475 -13.071 5.191 418 HB2 ASP 56 1HB ASP 56 -15.325 -15.153 7.060 419 HB3 ASP 56 2HB ASP 56 -16.531 -13.932 7.455 420 H TYR 57 H TYR 57 -15.709 -11.636 6.943 421 HA TYR 57 HA TYR 57 -12.822 -11.477 7.278 422 HB2 TYR 57 1HB TYR 57 -13.033 -8.949 6.682 423 HB3 TYR 57 2HB TYR 57 -12.867 -10.128 5.386 424 HD1 TYR 57 2HD TYR 57 -14.878 -10.796 4.068 425 HD2 TYR 57 1HD TYR 57 -14.987 -7.611 6.887 426 HE1 TYR 57 2HE TYR 57 -16.952 -9.965 3.040 427 HE2 TYR 57 1HE TYR 57 -17.062 -6.771 5.867 428 HH TYR 57 HH TYR 57 -18.974 -8.524 3.882 429 H GLU 58 H GLU 58 -12.220 -10.559 9.180 430 HA GLU 58 HA GLU 58 -14.350 -9.354 10.822 431 HB2 GLU 58 1HB GLU 58 -13.997 -11.486 11.776 432 HB3 GLU 58 2HB GLU 58 -12.254 -11.373 11.585 433 HG2 GLU 58 1HG GLU 58 -13.705 -9.460 13.361 434 HG3 GLU 58 2HG GLU 58 -13.298 -11.080 13.926 435 H GLN 59 H GLN 59 -13.871 -7.244 10.844 436 HA GLN 59 HA GLN 59 -11.305 -6.139 10.580 437 HB2 GLN 59 1HB GLN 59 -13.740 -5.098 10.395 438 HB3 GLN 59 2HB GLN 59 -13.412 -4.638 12.060 439 HG2 GLN 59 1HG GLN 59 -11.174 -3.736 11.051 440 HG3 GLN 59 2HG GLN 59 -12.097 -3.735 9.549 441 HE21 GLN 59 1HE2 GLN 59 -11.141 -1.825 11.965 442 HE22 GLN 59 2HE2 GLN 59 -12.438 -0.684 12.002 443 H ARG 60 H ARG 60 -9.672 -6.293 11.957 444 HA ARG 60 HA ARG 60 -10.184 -6.752 14.787 445 HB2 ARG 60 1HB ARG 60 -7.735 -6.912 13.049 446 HB3 ARG 60 2HB ARG 60 -7.606 -6.926 14.803 447 HG2 ARG 60 1HG ARG 60 -9.302 -8.871 13.261 448 HG3 ARG 60 2HG ARG 60 -7.618 -9.175 13.694 449 HD2 ARG 60 1HD ARG 60 -8.267 -8.761 16.086 450 HD3 ARG 60 2HD ARG 60 -9.947 -8.738 15.552 451 HE ARG 60 HE ARG 60 -8.914 -11.095 14.597 452 HH11 ARG 60 2HH1 ARG 60 -9.280 -9.600 17.720 453 HH12 ARG 60 1HH1 ARG 60 -9.425 -11.104 18.568 454 HH21 ARG 60 2HH2 ARG 60 -9.105 -13.081 15.702 455 HH22 ARG 60 1HH2 ARG 60 -9.325 -13.083 17.419 456 H GLU 61 H GLU 61 -8.319 -4.486 12.768 457 HA GLU 61 HA GLU 61 -8.540 -2.519 14.949 458 HB2 GLU 61 1HB GLU 61 -6.187 -2.900 13.088 459 HB3 GLU 61 2HB GLU 61 -6.333 -1.642 14.308 460 HG2 GLU 61 1HG GLU 61 -6.430 -3.393 16.047 461 HG3 GLU 61 2HG GLU 61 -6.165 -4.607 14.797 462 H ARG 62 H ARG 62 -7.749 -0.261 13.879 463 HA ARG 62 HA ARG 62 -9.846 0.597 12.276 464 HB2 ARG 62 1HB ARG 62 -8.618 2.209 13.530 465 HB3 ARG 62 2HB ARG 62 -7.107 1.765 12.747 466 HG2 ARG 62 1HG ARG 62 -7.560 2.970 10.870 467 HG3 ARG 62 2HG ARG 62 -9.307 2.778 11.035 468 HD2 ARG 62 1HD ARG 62 -9.122 4.974 11.614 469 HD3 ARG 62 2HD ARG 62 -8.892 4.242 13.201 470 HE ARG 62 HE ARG 62 -6.441 4.635 11.761 471 HH11 ARG 62 2HH1 ARG 62 -8.791 6.126 13.852 472 HH12 ARG 62 1HH1 ARG 62 -7.680 7.297 14.482 473 HH21 ARG 62 2HH2 ARG 62 -4.969 6.171 12.583 474 HH22 ARG 62 1HH2 ARG 62 -5.507 7.322 13.759 475 H PHE 63 H PHE 63 -6.486 -0.093 11.309 476 HA PHE 63 HA PHE 63 -7.421 -0.278 8.523 477 HB2 PHE 63 1HB PHE 63 -4.747 0.499 9.678 478 HB3 PHE 63 2HB PHE 63 -4.940 0.049 7.987 479 HD1 PHE 63 2HD PHE 63 -6.574 1.388 6.578 480 HD2 PHE 63 1HD PHE 63 -5.201 2.666 10.398 481 HE1 PHE 63 2HE PHE 63 -7.235 3.696 6.039 482 HE2 PHE 63 1HE PHE 63 -5.861 4.976 9.866 483 HZ PHE 63 HZ PHE 63 -6.878 5.493 7.684 484 H LEU 64 H LEU 64 -7.801 -2.447 10.217 485 HA LEU 64 HA LEU 64 -6.071 -4.419 8.929 486 HB2 LEU 64 1HB LEU 64 -5.120 -3.915 11.165 487 HB3 LEU 64 2HB LEU 64 -6.641 -4.434 11.889 488 HG LEU 64 HG LEU 64 -6.177 -6.685 10.716 489 HD11 LEU 64 1HD1 LEU 64 -4.172 -5.449 9.506 490 HD12 LEU 64 2HD1 LEU 64 -4.100 -7.161 9.921 491 HD13 LEU 64 3HD1 LEU 64 -3.307 -5.970 10.952 492 HD21 LEU 64 1HD2 LEU 64 -5.792 -5.801 13.232 493 HD22 LEU 64 2HD2 LEU 64 -4.151 -6.297 12.820 494 HD23 LEU 64 3HD2 LEU 64 -5.476 -7.457 12.715 495 H LEU 65 H LEU 65 -7.018 -6.443 8.638 496 HA LEU 65 HA LEU 65 -9.672 -6.950 9.689 497 HB2 LEU 65 1HB LEU 65 -9.127 -6.222 6.867 498 HB3 LEU 65 2HB LEU 65 -10.273 -7.528 7.160 499 HG LEU 65 HG LEU 65 -10.658 -4.958 8.613 500 HD11 LEU 65 1HD1 LEU 65 -11.417 -5.379 5.726 501 HD12 LEU 65 2HD1 LEU 65 -10.196 -4.253 6.319 502 HD13 LEU 65 3HD1 LEU 65 -11.892 -4.016 6.739 503 HD21 LEU 65 1HD2 LEU 65 -12.028 -7.126 8.839 504 HD22 LEU 65 2HD2 LEU 65 -12.713 -6.682 7.275 505 HD23 LEU 65 3HD2 LEU 65 -12.895 -5.600 8.657 506 H PHE 66 H PHE 66 -10.057 -9.081 9.941 507 HA PHE 66 HA PHE 66 -7.926 -10.915 9.211 508 HB2 PHE 66 1HB PHE 66 -9.003 -10.862 11.503 509 HB3 PHE 66 2HB PHE 66 -10.443 -11.545 10.755 510 HD1 PHE 66 2HD PHE 66 -6.936 -12.171 11.645 511 HD2 PHE 66 1HD PHE 66 -10.539 -13.840 10.113 512 HE1 PHE 66 2HE PHE 66 -6.003 -14.430 11.923 513 HE2 PHE 66 1HE PHE 66 -9.612 -16.103 10.389 514 HZ PHE 66 HZ PHE 66 -7.341 -16.400 11.294 515 H CYS 67 H CYS 67 -8.096 -11.353 7.055 516 HA CYS 67 HA CYS 67 -10.631 -12.008 5.848 517 HB2 CYS 67 1HB CYS 67 -7.803 -12.089 4.783 518 HB3 CYS 67 2HB CYS 67 -9.227 -12.462 3.819 519 HG CYS 67 HG CYS 67 -9.502 -9.516 5.328 520 H VAL 68 H VAL 68 -11.344 -14.001 5.180 521 HA VAL 68 HA VAL 68 -9.685 -16.350 5.599 522 HB VAL 68 HB VAL 68 -10.754 -15.969 7.800 523 HG11 VAL 68 1HG1 VAL 68 -12.933 -15.542 8.076 524 HG12 VAL 68 2HG1 VAL 68 -12.948 -15.201 6.345 525 HG13 VAL 68 3HG1 VAL 68 -13.415 -16.796 6.934 526 HG21 VAL 68 1HG2 VAL 68 -12.202 -18.339 7.286 527 HG22 VAL 68 2HG2 VAL 68 -10.795 -18.347 6.223 528 HG23 VAL 68 3HG2 VAL 68 -10.582 -18.177 7.965 529 H HIS 69 H HIS 69 -10.088 -17.864 4.108 530 HA HIS 69 HA HIS 69 -12.459 -17.509 2.410 531 HB2 HIS 69 1HB HIS 69 -10.487 -17.371 1.098 532 HB3 HIS 69 2HB HIS 69 -9.765 -18.763 1.900 533 HD1 HIS 69 1HD HIS 69 -9.585 -20.531 0.182 534 HD2 HIS 69 2HD HIS 69 -13.232 -18.551 -0.014 535 HE1 HIS 69 1HE HIS 69 -10.906 -21.730 -1.591 536 HE2 HIS 69 2HE HIS 69 -13.076 -20.461 -1.751 537 H GLY 70 H GLY 70 -14.019 -19.003 2.363 538 HA2 GLY 70 1HA GLY 70 -13.431 -21.647 3.543 539 HA3 GLY 70 2HA GLY 70 -14.904 -20.770 3.928 540 H ASP 71 H ASP 71 -13.098 -22.053 1.145 541 HA ASP 71 HA ASP 71 -15.075 -21.977 -0.767 542 HB2 ASP 71 1HB ASP 71 -12.597 -22.808 -0.883 543 HB3 ASP 71 2HB ASP 71 -13.305 -24.390 -0.567 544 H GLY 72 H GLY 72 -14.581 -24.378 1.777 545 HA2 GLY 72 1HA GLY 72 -17.357 -25.184 1.548 546 HA3 GLY 72 2HA GLY 72 -16.192 -26.435 1.140 547 H HIS 73 H HIS 73 -14.255 -26.278 2.929 548 HA HIS 73 HA HIS 73 -15.370 -26.020 5.601 549 HB2 HIS 73 1HB HIS 73 -14.757 -28.619 4.292 550 HB3 HIS 73 2HB HIS 73 -14.280 -28.436 5.977 551 HD1 HIS 73 1HD HIS 73 -16.068 -28.746 7.695 552 HD2 HIS 73 2HD HIS 73 -17.615 -28.258 3.870 553 HE1 HIS 73 1HE HIS 73 -18.534 -29.191 7.905 554 HE2 HIS 73 2HE HIS 73 -19.435 -28.974 5.563 555 H ALA 74 H ALA 74 -13.525 -26.975 7.185 556 HA ALA 74 HA ALA 74 -11.416 -25.192 7.106 557 HB1 ALA 74 1HB ALA 74 -10.332 -27.186 8.568 558 HB2 ALA 74 2HB ALA 74 -11.528 -26.046 9.186 559 HB3 ALA 74 3HB ALA 74 -12.036 -27.637 8.620 560 H GLU 75 H GLU 75 -11.677 -28.384 5.676 561 HA GLU 75 HA GLU 75 -9.046 -28.988 5.136 562 HB2 GLU 75 1HB GLU 75 -11.523 -29.474 3.484 563 HB3 GLU 75 2HB GLU 75 -9.952 -30.146 3.070 564 HG2 GLU 75 1HG GLU 75 -9.895 -31.293 5.245 565 HG3 GLU 75 2HG GLU 75 -11.505 -30.664 5.595 566 H ASN 76 H ASN 76 -11.223 -26.873 3.315 567 HA ASN 76 HA ASN 76 -8.920 -25.998 1.700 568 HB2 ASN 76 1HB ASN 76 -10.647 -25.162 0.083 569 HB3 ASN 76 2HB ASN 76 -10.639 -26.911 0.288 570 HD21 ASN 76 1HD2 ASN 76 -12.576 -27.758 0.389 571 HD22 ASN 76 2HD2 ASN 76 -13.988 -27.012 1.048 572 H LEU 77 H LEU 77 -9.797 -25.093 4.418 573 HA LEU 77 HA LEU 77 -10.639 -22.347 3.924 574 HB2 LEU 77 1HB LEU 77 -11.602 -23.711 5.778 575 HB3 LEU 77 2HB LEU 77 -10.016 -23.695 6.546 576 HG LEU 77 HG LEU 77 -10.367 -21.067 6.321 577 HD11 LEU 77 1HD1 LEU 77 -12.882 -22.098 5.545 578 HD12 LEU 77 2HD1 LEU 77 -12.418 -20.416 5.801 579 HD13 LEU 77 3HD1 LEU 77 -13.077 -21.362 7.136 580 HD21 LEU 77 1HD2 LEU 77 -11.306 -21.126 8.627 581 HD22 LEU 77 2HD2 LEU 77 -9.898 -22.163 8.398 582 HD23 LEU 77 3HD2 LEU 77 -11.515 -22.868 8.447 583 H VAL 78 H VAL 78 -9.391 -20.556 4.284 584 HA VAL 78 HA VAL 78 -6.638 -20.941 5.215 585 HB VAL 78 HB VAL 78 -7.396 -19.563 2.636 586 HG11 VAL 78 1HG1 VAL 78 -5.211 -19.064 4.438 587 HG12 VAL 78 2HG1 VAL 78 -4.610 -19.661 2.890 588 HG13 VAL 78 3HG1 VAL 78 -5.643 -18.232 2.944 589 HG21 VAL 78 1HG2 VAL 78 -6.676 -21.383 1.561 590 HG22 VAL 78 2HG2 VAL 78 -5.252 -21.531 2.590 591 HG23 VAL 78 3HG2 VAL 78 -6.793 -22.210 3.114 592 H GLN 79 H GLN 79 -6.095 -19.460 6.674 593 HA GLN 79 HA GLN 79 -7.716 -17.013 6.844 594 HB2 GLN 79 1HB GLN 79 -6.179 -18.547 8.936 595 HB3 GLN 79 2HB GLN 79 -6.812 -16.931 9.217 596 HG2 GLN 79 1HG GLN 79 -9.018 -17.640 9.133 597 HG3 GLN 79 2HG GLN 79 -8.609 -19.128 8.282 598 HE21 GLN 79 1HE2 GLN 79 -9.109 -20.767 9.546 599 HE22 GLN 79 2HE2 GLN 79 -8.721 -20.912 11.223 600 H TRP 80 H TRP 80 -6.798 -15.099 6.485 601 HA TRP 80 HA TRP 80 -3.938 -14.740 6.888 602 HB2 TRP 80 1HB TRP 80 -3.431 -14.046 4.693 603 HB3 TRP 80 2HB TRP 80 -4.381 -15.515 4.486 604 HD1 TRP 80 HD TRP 80 -4.496 -11.760 3.863 605 HE1 TRP 80 1HE TRP 80 -6.509 -11.228 2.349 606 HE3 TRP 80 3HE TRP 80 -6.752 -16.348 3.869 607 HZ2 TRP 80 2HZ TRP 80 -8.755 -12.575 1.297 608 HZ3 TRP 80 3HZ TRP 80 -8.829 -16.642 2.584 609 HH2 TRP 80 HH TRP 80 -9.809 -14.794 1.326 610 H GLU 81 H GLU 81 -3.526 -12.809 7.757 611 HA GLU 81 HA GLU 81 -5.700 -10.922 8.065 612 HB2 GLU 81 1HB GLU 81 -3.003 -11.291 9.275 613 HB3 GLU 81 2HB GLU 81 -3.705 -9.680 9.311 614 HG2 GLU 81 1HG GLU 81 -5.779 -10.838 10.296 615 HG3 GLU 81 2HG GLU 81 -4.689 -12.189 10.605 616 H MET 82 H MET 82 -6.019 -9.183 6.847 617 HA MET 82 HA MET 82 -3.934 -8.411 4.938 618 HB2 MET 82 1HB MET 82 -6.908 -8.138 5.009 619 HB3 MET 82 2HB MET 82 -5.976 -6.984 4.066 620 HG2 MET 82 1HG MET 82 -5.630 -9.940 3.728 621 HG3 MET 82 2HG MET 82 -6.885 -9.044 2.876 622 HE1 MET 82 1HE MET 82 -6.109 -8.403 0.151 623 HE2 MET 82 2HE MET 82 -6.630 -7.266 1.395 624 HE3 MET 82 3HE MET 82 -5.227 -6.895 0.392 625 H GLU 83 H GLU 83 -2.589 -6.968 5.851 626 HA GLU 83 HA GLU 83 -3.745 -4.755 7.399 627 HB2 GLU 83 1HB GLU 83 -1.970 -6.097 8.488 628 HB3 GLU 83 2HB GLU 83 -0.862 -5.644 7.200 629 HG2 GLU 83 1HG GLU 83 -1.033 -3.309 7.846 630 HG3 GLU 83 2HG GLU 83 -2.186 -3.732 9.111 631 H VAL 84 H VAL 84 -3.966 -2.852 6.444 632 HA VAL 84 HA VAL 84 -2.687 -2.346 3.889 633 HB VAL 84 HB VAL 84 -4.645 -0.662 5.459 634 HG11 VAL 84 1HG1 VAL 84 -2.964 0.271 3.568 635 HG12 VAL 84 2HG1 VAL 84 -4.312 -0.259 2.560 636 HG13 VAL 84 3HG1 VAL 84 -4.582 0.915 3.848 637 HG21 VAL 84 1HG2 VAL 84 -5.925 -2.453 4.822 638 HG22 VAL 84 2HG2 VAL 84 -6.080 -1.435 3.390 639 HG23 VAL 84 3HG2 VAL 84 -4.947 -2.786 3.393 640 H CYS 85 H CYS 85 -0.614 -1.725 4.033 641 HA CYS 85 HA CYS 85 0.090 0.335 6.012 642 HB2 CYS 85 1HB CYS 85 1.308 -1.925 5.981 643 HB3 CYS 85 2HB CYS 85 2.057 -1.366 4.490 644 HG CYS 85 HG CYS 85 2.277 0.712 7.138 645 H LYS 86 H LYS 86 1.715 1.938 5.315 646 HA LYS 86 HA LYS 86 1.225 2.737 2.526 647 HB2 LYS 86 1HB LYS 86 1.715 5.026 3.255 648 HB3 LYS 86 2HB LYS 86 0.398 4.328 4.188 649 HG2 LYS 86 1HG LYS 86 1.585 5.266 5.876 650 HG3 LYS 86 2HG LYS 86 2.380 3.691 5.821 651 HD2 LYS 86 1HD LYS 86 4.291 4.535 4.884 652 HD3 LYS 86 2HD LYS 86 3.443 5.863 4.089 653 HE2 LYS 86 1HE LYS 86 3.252 7.063 6.145 654 HE3 LYS 86 2HE LYS 86 3.839 5.682 7.070 655 HZ1 LYS 86 1HZ LYS 86 5.988 6.024 6.392 656 HZ2 LYS 86 2HZ LYS 86 5.435 7.619 6.483 657 HZ3 LYS 86 3HZ LYS 86 5.547 6.848 4.981 658 H LEU 87 H LEU 87 2.927 3.460 1.234 659 HA LEU 87 HA LEU 87 5.560 2.492 2.078 660 HB2 LEU 87 1HB LEU 87 4.221 2.918 -0.545 661 HB3 LEU 87 2HB LEU 87 5.979 3.015 -0.474 662 HG LEU 87 HG LEU 87 4.378 0.622 0.424 663 HD11 LEU 87 1HD1 LEU 87 5.129 -0.427 -1.661 664 HD12 LEU 87 2HD1 LEU 87 5.822 1.109 -2.178 665 HD13 LEU 87 3HD1 LEU 87 4.078 0.957 -1.961 666 HD21 LEU 87 1HD2 LEU 87 6.601 0.907 1.461 667 HD22 LEU 87 2HD2 LEU 87 7.323 0.938 -0.148 668 HD23 LEU 87 3HD2 LEU 87 6.506 -0.517 0.426 669 HA PRO 88 HA PRO 88 7.400 6.465 2.353 670 HB2 PRO 88 1HB PRO 88 9.829 6.073 1.206 671 HB3 PRO 88 2HB PRO 88 9.395 5.411 2.787 672 HG2 PRO 88 1HG PRO 88 9.416 4.067 0.112 673 HG3 PRO 88 2HG PRO 88 9.984 3.455 1.676 674 HD2 PRO 88 1HD PRO 88 7.591 2.756 0.620 675 HD3 PRO 88 2HD PRO 88 7.859 2.893 2.369 676 H ARG 89 H ARG 89 6.083 5.481 -0.382 677 HA ARG 89 HA ARG 89 6.784 7.939 -1.795 678 HB2 ARG 89 1HB ARG 89 7.237 5.168 -2.787 679 HB3 ARG 89 2HB ARG 89 6.654 6.363 -3.937 680 HG2 ARG 89 1HG ARG 89 8.610 7.810 -3.058 681 HG3 ARG 89 2HG ARG 89 9.243 6.279 -2.451 682 HD2 ARG 89 1HD ARG 89 9.558 5.418 -4.563 683 HD3 ARG 89 2HD ARG 89 8.326 6.453 -5.282 684 HE ARG 89 HE ARG 89 10.658 7.842 -4.296 685 HH11 ARG 89 2HH1 ARG 89 9.144 6.274 -7.011 686 HH12 ARG 89 1HH1 ARG 89 10.106 7.100 -8.191 687 HH21 ARG 89 2HH2 ARG 89 11.930 8.937 -5.841 688 HH22 ARG 89 1HH2 ARG 89 11.691 8.614 -7.525 689 H LEU 90 H LEU 90 4.882 8.942 -1.893 690 HA LEU 90 HA LEU 90 2.373 8.114 -1.556 691 HB2 LEU 90 1HB LEU 90 3.423 10.090 -3.554 692 HB3 LEU 90 2HB LEU 90 1.693 9.813 -3.356 693 HG LEU 90 HG LEU 90 3.515 10.703 -1.125 694 HD11 LEU 90 1HD1 LEU 90 1.708 12.733 -1.937 695 HD12 LEU 90 2HD1 LEU 90 2.598 12.189 -3.359 696 HD13 LEU 90 3HD1 LEU 90 3.471 12.762 -1.938 697 HD21 LEU 90 1HD2 LEU 90 0.515 10.837 -1.351 698 HD22 LEU 90 2HD2 LEU 90 1.508 11.177 0.067 699 HD23 LEU 90 3HD2 LEU 90 1.379 9.527 -0.546 700 H SER 91 H SER 91 4.321 7.409 -4.354 701 HA SER 91 HA SER 91 2.740 6.748 -6.375 702 HB2 SER 91 1HB SER 91 4.868 4.981 -5.156 703 HB3 SER 91 2HB SER 91 4.124 4.659 -6.723 704 HG SER 91 HG SER 91 5.398 6.096 -7.552 705 H LEU 92 H LEU 92 2.802 5.026 -3.311 706 HA LEU 92 HA LEU 92 0.153 4.107 -3.569 707 HB2 LEU 92 1HB LEU 92 0.647 1.666 -3.679 708 HB3 LEU 92 2HB LEU 92 0.949 2.551 -5.173 709 HG LEU 92 HG LEU 92 3.256 2.130 -3.355 710 HD11 LEU 92 1HD1 LEU 92 3.543 -0.117 -4.637 711 HD12 LEU 92 2HD1 LEU 92 1.785 -0.057 -4.758 712 HD13 LEU 92 3HD1 LEU 92 2.560 -0.058 -3.174 713 HD21 LEU 92 1HD2 LEU 92 4.158 1.556 -5.764 714 HD22 LEU 92 2HD2 LEU 92 3.920 3.226 -5.248 715 HD23 LEU 92 3HD2 LEU 92 2.713 2.437 -6.264 716 H ASN 93 H ASN 93 -0.208 2.216 -1.872 717 HA ASN 93 HA ASN 93 1.195 3.079 0.559 718 HB2 ASN 93 1HB ASN 93 -0.726 2.297 1.799 719 HB3 ASN 93 2HB ASN 93 -1.287 3.327 0.486 720 HD21 ASN 93 1HD2 ASN 93 -2.289 2.371 -1.317 721 HD22 ASN 93 2HD2 ASN 93 -2.993 0.796 -1.219 722 H GLY 94 H GLY 94 0.110 0.186 -1.177 723 HA2 GLY 94 1HA GLY 94 1.458 -1.769 -1.350 724 HA3 GLY 94 2HA GLY 94 2.260 -1.313 0.145 725 H VAL 95 H VAL 95 0.783 -3.791 -0.825 726 HA VAL 95 HA VAL 95 -0.883 -4.088 1.582 727 HB VAL 95 HB VAL 95 -1.558 -5.175 -1.155 728 HG11 VAL 95 1HG1 VAL 95 -2.425 -5.898 1.533 729 HG12 VAL 95 2HG1 VAL 95 -3.762 -5.500 0.450 730 HG13 VAL 95 3HG1 VAL 95 -2.614 -6.765 0.009 731 HG21 VAL 95 1HG2 VAL 95 -2.188 -2.952 -1.263 732 HG22 VAL 95 2HG2 VAL 95 -3.658 -3.722 -0.665 733 HG23 VAL 95 3HG2 VAL 95 -2.589 -2.874 0.453 734 H ARG 96 H ARG 96 0.176 -5.482 2.833 735 HA ARG 96 HA ARG 96 1.658 -7.688 1.601 736 HB2 ARG 96 1HB ARG 96 2.825 -7.909 3.675 737 HB3 ARG 96 2HB ARG 96 2.775 -6.196 3.281 738 HG2 ARG 96 1HG ARG 96 0.898 -5.909 4.840 739 HG3 ARG 96 2HG ARG 96 1.011 -7.619 5.262 740 HD2 ARG 96 1HD ARG 96 2.217 -6.580 6.953 741 HD3 ARG 96 2HD ARG 96 3.471 -7.088 5.822 742 HE ARG 96 HE ARG 96 2.590 -4.442 5.271 743 HH11 ARG 96 2HH1 ARG 96 4.578 -6.314 7.431 744 HH12 ARG 96 1HH1 ARG 96 5.638 -4.996 7.807 745 HH21 ARG 96 2HH2 ARG 96 3.979 -2.700 5.757 746 HH22 ARG 96 1HH2 ARG 96 5.296 -2.940 6.855 747 H PHE 97 H PHE 97 1.446 -9.843 2.418 748 HA PHE 97 HA PHE 97 -1.225 -10.377 3.540 749 HB2 PHE 97 1HB PHE 97 0.432 -11.888 1.533 750 HB3 PHE 97 2HB PHE 97 -0.866 -12.676 2.424 751 HD1 PHE 97 1HD PHE 97 -0.424 -9.419 0.647 752 HD2 PHE 97 2HD PHE 97 -2.796 -12.906 1.224 753 HE1 PHE 97 1HE PHE 97 -2.054 -8.578 -0.993 754 HE2 PHE 97 2HE PHE 97 -4.429 -12.071 -0.416 755 HZ PHE 97 HZ PHE 97 -4.059 -9.905 -1.527 756 H LYS 98 H LYS 98 -1.395 -11.556 5.355 757 HA LYS 98 HA LYS 98 1.067 -12.775 6.426 758 HB2 LYS 98 1HB LYS 98 0.044 -10.647 7.555 759 HB3 LYS 98 2HB LYS 98 -1.132 -11.781 8.205 760 HG2 LYS 98 1HG LYS 98 1.812 -12.246 8.509 761 HG3 LYS 98 2HG LYS 98 0.918 -11.212 9.625 762 HD2 LYS 98 1HD LYS 98 -0.229 -12.958 10.539 763 HD3 LYS 98 2HD LYS 98 -0.214 -13.893 9.042 764 HE2 LYS 98 1HE LYS 98 1.277 -15.127 10.233 765 HE3 LYS 98 2HE LYS 98 2.393 -13.940 9.561 766 HZ1 LYS 98 1HZ LYS 98 2.879 -14.061 11.836 767 HZ2 LYS 98 2HZ LYS 98 1.249 -14.026 12.289 768 HZ3 LYS 98 3HZ LYS 98 1.984 -12.636 11.665 769 H ARG 99 H ARG 99 0.826 -14.903 6.098 770 HA ARG 99 HA ARG 99 -1.638 -16.267 6.011 771 HB2 ARG 99 1HB ARG 99 0.507 -17.059 4.989 772 HB3 ARG 99 2HB ARG 99 1.078 -17.449 6.605 773 HG2 ARG 99 1HG ARG 99 -0.635 -19.101 6.879 774 HG3 ARG 99 2HG ARG 99 -1.392 -18.628 5.357 775 HD2 ARG 99 1HD ARG 99 0.190 -19.671 4.087 776 HD3 ARG 99 2HD ARG 99 1.461 -19.438 5.286 777 HE ARG 99 HE ARG 99 -0.597 -21.287 6.088 778 HH11 ARG 99 2HH1 ARG 99 2.443 -20.897 4.436 779 HH12 ARG 99 1HH1 ARG 99 2.917 -22.550 4.645 780 HH21 ARG 99 2HH2 ARG 99 0.016 -23.466 6.369 781 HH22 ARG 99 1HH2 ARG 99 1.536 -24.011 5.744 782 H ILE 100 H ILE 100 -2.772 -17.406 7.517 783 HA ILE 100 HA ILE 100 -1.834 -17.187 10.303 784 HB ILE 100 HB ILE 100 -4.688 -17.272 9.317 785 HG12 ILE 100 1HG1 ILE 100 -3.454 -15.138 8.866 786 HG13 ILE 100 2HG1 ILE 100 -4.832 -14.953 9.945 787 HG21 ILE 100 1HG2 ILE 100 -3.595 -16.898 12.102 788 HG22 ILE 100 2HG2 ILE 100 -5.295 -16.841 11.638 789 HG23 ILE 100 3HG2 ILE 100 -4.391 -18.349 11.492 790 HD11 ILE 100 1HD1 ILE 100 -3.553 -14.175 11.580 791 HD12 ILE 100 2HD1 ILE 100 -2.380 -15.479 11.390 792 HD13 ILE 100 3HD1 ILE 100 -2.270 -14.040 10.377 793 H SER 101 H SER 101 -3.825 -19.176 8.123 794 HA SER 101 HA SER 101 -2.727 -21.582 9.313 795 HB2 SER 101 1HB SER 101 -4.793 -22.543 10.001 796 HB3 SER 101 2HB SER 101 -4.771 -20.916 10.681 797 HG SER 101 HG SER 101 -5.876 -20.555 8.408 798 H GLY 102 H GLY 102 -3.808 -23.569 8.190 799 HA2 GLY 102 1HA GLY 102 -4.592 -24.596 6.239 800 HA3 GLY 102 2HA GLY 102 -4.690 -23.017 5.474 801 H THR 103 H THR 103 -3.710 -24.994 3.976 802 HA THR 103 HA THR 103 -0.863 -25.259 4.186 803 HB THR 103 HB THR 103 -0.982 -26.411 2.036 804 HG1 THR 103 1HG THR 103 -2.666 -26.201 0.738 805 HG21 THR 103 1HG2 THR 103 -1.473 -28.023 3.554 806 HG22 THR 103 2HG2 THR 103 -3.049 -27.972 2.765 807 HG23 THR 103 3HG2 THR 103 -2.789 -27.096 4.272 808 H SER 104 H SER 104 0.672 -24.525 2.590 809 HA SER 104 HA SER 104 0.456 -21.770 2.040 810 HB2 SER 104 1HB SER 104 2.384 -23.699 0.734 811 HB3 SER 104 2HB SER 104 2.603 -21.966 0.981 812 HG SER 104 HG SER 104 3.265 -23.946 2.612 813 H ILE 105 H ILE 105 0.376 -24.587 -0.135 814 HA ILE 105 HA ILE 105 0.144 -23.499 -2.580 815 HB ILE 105 HB ILE 105 -1.540 -25.729 -1.448 816 HG12 ILE 105 1HG1 ILE 105 0.950 -26.017 -1.535 817 HG13 ILE 105 2HG1 ILE 105 0.058 -27.189 -2.499 818 HG21 ILE 105 1HG2 ILE 105 -2.097 -26.357 -3.714 819 HG22 ILE 105 2HG2 ILE 105 -2.632 -24.705 -3.409 820 HG23 ILE 105 3HG2 ILE 105 -1.170 -24.998 -4.349 821 HD11 ILE 105 1HD1 ILE 105 1.365 -24.712 -3.595 822 HD12 ILE 105 2HD1 ILE 105 2.072 -26.329 -3.620 823 HD13 ILE 105 3HD1 ILE 105 0.590 -26.000 -4.517 824 H ALA 106 H ALA 106 -2.768 -24.129 -0.612 825 HA ALA 106 HA ALA 106 -4.587 -22.752 -2.165 826 HB1 ALA 106 1HB ALA 106 -4.597 -24.008 0.342 827 HB2 ALA 106 2HB ALA 106 -5.238 -22.386 0.604 828 HB3 ALA 106 3HB ALA 106 -5.986 -23.447 -0.589 829 H PHE 107 H PHE 107 -2.419 -21.516 0.326 830 HA PHE 107 HA PHE 107 -3.446 -18.957 0.636 831 HB2 PHE 107 1HB PHE 107 -1.556 -20.050 1.937 832 HB3 PHE 107 2HB PHE 107 -0.496 -19.593 0.608 833 HD1 PHE 107 1HD PHE 107 -2.773 -18.240 3.193 834 HD2 PHE 107 2HD PHE 107 0.388 -17.430 0.459 835 HE1 PHE 107 1HE PHE 107 -2.467 -16.020 4.209 836 HE2 PHE 107 2HE PHE 107 0.699 -15.209 1.471 837 HZ PHE 107 HZ PHE 107 -0.729 -14.502 3.349 838 H LYS 108 H LYS 108 -1.013 -20.100 -1.691 839 HA LYS 108 HA LYS 108 -0.807 -17.558 -2.996 840 HB2 LYS 108 1HB LYS 108 0.191 -20.322 -3.659 841 HB3 LYS 108 2HB LYS 108 0.424 -18.963 -4.750 842 HG2 LYS 108 1HG LYS 108 2.384 -18.860 -3.616 843 HG3 LYS 108 2HG LYS 108 1.400 -17.843 -2.561 844 HD2 LYS 108 1HD LYS 108 2.353 -19.256 -1.021 845 HD3 LYS 108 2HD LYS 108 0.864 -20.131 -1.387 846 HE2 LYS 108 1HE LYS 108 2.585 -21.740 -1.453 847 HE3 LYS 108 2HE LYS 108 2.198 -21.387 -3.136 848 HZ1 LYS 108 1HZ LYS 108 4.487 -21.328 -3.116 849 HZ2 LYS 108 2HZ LYS 108 4.578 -20.616 -1.584 850 HZ3 LYS 108 3HZ LYS 108 4.108 -19.690 -2.919 851 H ASN 109 H ASN 109 -2.425 -20.628 -3.714 852 HA ASN 109 HA ASN 109 -3.362 -20.093 -6.258 853 HB2 ASN 109 1HB ASN 109 -4.356 -21.775 -3.997 854 HB3 ASN 109 2HB ASN 109 -5.399 -21.546 -5.398 855 HD21 ASN 109 1HD2 ASN 109 -2.424 -22.894 -4.224 856 HD22 ASN 109 2HD2 ASN 109 -2.096 -23.890 -5.598 857 H ILE 110 H ILE 110 -4.749 -19.164 -3.141 858 HA ILE 110 HA ILE 110 -6.982 -17.820 -4.413 859 HB ILE 110 HB ILE 110 -7.106 -19.037 -2.174 860 HG12 ILE 110 1HG1 ILE 110 -8.708 -17.396 -1.252 861 HG13 ILE 110 2HG1 ILE 110 -8.068 -16.171 -2.343 862 HG21 ILE 110 1HG2 ILE 110 -6.239 -16.526 -0.862 863 HG22 ILE 110 2HG2 ILE 110 -6.159 -18.192 -0.291 864 HG23 ILE 110 3HG2 ILE 110 -4.979 -17.605 -1.461 865 HD11 ILE 110 1HD1 ILE 110 -8.807 -18.452 -3.871 866 HD12 ILE 110 2HD1 ILE 110 -10.143 -18.014 -2.807 867 HD13 ILE 110 3HD1 ILE 110 -9.472 -16.819 -3.916 868 H ALA 111 H ALA 111 -3.880 -17.026 -3.041 869 HA ALA 111 HA ALA 111 -4.234 -14.281 -2.606 870 HB1 ALA 111 1HB ALA 111 -1.749 -15.813 -3.359 871 HB2 ALA 111 2HB ALA 111 -1.768 -14.138 -2.803 872 HB3 ALA 111 3HB ALA 111 -2.309 -15.430 -1.731 873 H SER 112 H SER 112 -3.566 -16.104 -5.522 874 HA SER 112 HA SER 112 -2.748 -13.980 -7.171 875 HB2 SER 112 1HB SER 112 -2.420 -16.292 -7.848 876 HB3 SER 112 2HB SER 112 -4.162 -16.561 -7.883 877 HG SER 112 HG SER 112 -2.523 -15.302 -9.717 878 H LYS 113 H LYS 113 -5.961 -15.446 -6.726 879 HA LYS 113 HA LYS 113 -7.373 -13.796 -8.475 880 HB2 LYS 113 1HB LYS 113 -8.324 -15.094 -5.914 881 HB3 LYS 113 2HB LYS 113 -9.374 -14.422 -7.155 882 HG2 LYS 113 1HG LYS 113 -8.157 -16.067 -8.736 883 HG3 LYS 113 2HG LYS 113 -7.676 -16.880 -7.245 884 HD2 LYS 113 1HD LYS 113 -9.633 -17.984 -7.704 885 HD3 LYS 113 2HD LYS 113 -10.242 -16.671 -6.694 886 HE2 LYS 113 1HE LYS 113 -10.067 -16.256 -9.639 887 HE3 LYS 113 2HE LYS 113 -11.368 -17.262 -9.002 888 HZ1 LYS 113 1HZ LYS 113 -10.991 -14.400 -8.825 889 HZ2 LYS 113 2HZ LYS 113 -11.486 -15.132 -7.382 890 HZ3 LYS 113 3HZ LYS 113 -12.417 -15.310 -8.784 891 H ILE 114 H ILE 114 -7.402 -13.520 -4.916 892 HA ILE 114 HA ILE 114 -8.651 -11.169 -4.554 893 HB ILE 114 HB ILE 114 -6.077 -11.871 -3.140 894 HG12 ILE 114 1HG1 ILE 114 -7.589 -13.759 -3.039 895 HG13 ILE 114 2HG1 ILE 114 -7.575 -12.958 -1.472 896 HG21 ILE 114 1HG2 ILE 114 -6.473 -10.188 -1.729 897 HG22 ILE 114 2HG2 ILE 114 -7.597 -9.586 -2.946 898 HG23 ILE 114 3HG2 ILE 114 -8.189 -10.577 -1.613 899 HD11 ILE 114 1HD1 ILE 114 -9.803 -13.226 -1.695 900 HD12 ILE 114 2HD1 ILE 114 -9.652 -11.698 -2.563 901 HD13 ILE 114 3HD1 ILE 114 -9.743 -13.216 -3.457 902 H ALA 115 H ALA 115 -5.332 -11.548 -5.683 903 HA ALA 115 HA ALA 115 -4.693 -8.775 -5.645 904 HB1 ALA 115 1HB ALA 115 -3.306 -11.151 -6.087 905 HB2 ALA 115 2HB ALA 115 -3.180 -10.255 -7.602 906 HB3 ALA 115 3HB ALA 115 -2.646 -9.515 -6.092 907 H ASN 116 H ASN 116 -5.353 -10.985 -8.373 908 HA ASN 116 HA ASN 116 -5.398 -9.123 -10.406 909 HB2 ASN 116 1HB ASN 116 -6.979 -11.672 -10.060 910 HB3 ASN 116 2HB ASN 116 -6.998 -10.732 -11.549 911 HD21 ASN 116 1HD2 ASN 116 -5.959 -13.458 -10.761 912 HD22 ASN 116 2HD2 ASN 116 -4.342 -13.483 -11.369 913 H GLU 117 H GLU 117 -8.122 -10.197 -8.389 914 HA GLU 117 HA GLU 117 -10.101 -8.624 -9.581 915 HB2 GLU 117 1HB GLU 117 -9.937 -9.442 -6.675 916 HB3 GLU 117 2HB GLU 117 -11.389 -8.971 -7.547 917 HG2 GLU 117 1HG GLU 117 -9.770 -11.473 -7.811 918 HG3 GLU 117 2HG GLU 117 -11.487 -11.295 -7.454 919 H LEU 118 H LEU 118 -7.823 -7.896 -6.986 920 HA LEU 118 HA LEU 118 -8.929 -5.247 -6.592 921 HB2 LEU 118 1HB LEU 118 -6.765 -6.864 -5.330 922 HB3 LEU 118 2HB LEU 118 -6.762 -5.114 -5.118 923 HG LEU 118 HG LEU 118 -9.213 -6.700 -4.458 924 HD11 LEU 118 1HD1 LEU 118 -8.450 -7.411 -2.435 925 HD12 LEU 118 2HD1 LEU 118 -7.232 -6.142 -2.319 926 HD13 LEU 118 3HD1 LEU 118 -6.955 -7.536 -3.362 927 HD21 LEU 118 1HD2 LEU 118 -9.919 -4.684 -3.863 928 HD22 LEU 118 2HD2 LEU 118 -8.348 -3.984 -4.253 929 HD23 LEU 118 3HD2 LEU 118 -8.653 -4.624 -2.637 930 H LYS 119 H LYS 119 -7.626 -6.153 -9.168 931 HA LYS 119 HA LYS 119 -6.122 -5.407 -10.725 932 HB2 LYS 119 1HB LYS 119 -6.804 -2.773 -9.405 933 HB3 LYS 119 2HB LYS 119 -6.134 -2.973 -11.019 934 HG2 LYS 119 1HG LYS 119 -8.720 -4.285 -10.306 935 HG3 LYS 119 2HG LYS 119 -8.676 -2.569 -10.717 936 HD2 LYS 119 1HD LYS 119 -7.401 -3.280 -12.812 937 HD3 LYS 119 2HD LYS 119 -7.913 -4.924 -12.423 938 HE2 LYS 119 1HE LYS 119 -9.609 -4.271 -13.822 939 HE3 LYS 119 2HE LYS 119 -10.282 -3.811 -12.259 940 HZ1 LYS 119 1HZ LYS 119 -9.761 -1.567 -12.631 941 HZ2 LYS 119 2HZ LYS 119 -10.431 -2.106 -14.087 942 HZ3 LYS 119 3HZ LYS 119 -8.756 -1.916 -13.947 943 H LEU 120 H LEU 120 -4.861 -6.337 -8.369 944 HA LEU 120 HA LEU 120 -2.753 -4.445 -7.739 945 HB2 LEU 120 1HB LEU 120 -3.287 -7.266 -6.829 946 HB3 LEU 120 2HB LEU 120 -1.914 -6.300 -6.289 947 HG LEU 120 HG LEU 120 -4.785 -5.494 -5.855 948 HD11 LEU 120 1HD1 LEU 120 -4.897 -7.128 -4.349 949 HD12 LEU 120 2HD1 LEU 120 -3.718 -6.211 -3.412 950 HD13 LEU 120 3HD1 LEU 120 -3.177 -7.491 -4.497 951 HD21 LEU 120 1HD2 LEU 120 -2.508 -4.594 -4.176 952 HD22 LEU 120 2HD2 LEU 120 -3.990 -3.750 -4.622 953 HD23 LEU 120 3HD2 LEU 120 -2.673 -3.896 -5.787 954 H SER 121 H SER 121 -0.454 -5.319 -7.741 955 HA SER 121 HA SER 121 0.443 -5.710 -10.310 956 HB2 SER 121 1HB SER 121 1.769 -5.112 -8.177 957 HB3 SER 121 2HB SER 121 1.933 -6.854 -7.955 958 HG SER 121 HG SER 121 2.617 -6.594 -10.373 959 H GLY 122 H GLY 122 -0.185 -8.181 -7.837 960 HA2 GLY 122 1HA GLY 122 -0.633 -10.425 -8.039 961 HA3 GLY 122 2HA GLY 122 -0.978 -10.122 -9.735 962 HA PRO 123 HA PRO 123 3.762 -11.108 -9.346 963 HB2 PRO 123 1HB PRO 123 4.513 -12.299 -7.025 964 HB3 PRO 123 2HB PRO 123 4.545 -10.547 -7.260 965 HG2 PRO 123 1HG PRO 123 2.489 -12.238 -5.890 966 HG3 PRO 123 2HG PRO 123 3.172 -10.681 -5.388 967 HD2 PRO 123 1HD PRO 123 0.748 -10.893 -6.577 968 HD3 PRO 123 2HD PRO 123 1.801 -9.481 -6.800 969 H SER 124 H SER 124 3.985 -12.816 -10.635 970 HA SER 124 HA SER 124 2.438 -15.201 -10.292 971 HB2 SER 124 1HB SER 124 3.410 -15.937 -12.350 972 HB3 SER 124 2HB SER 124 3.128 -14.204 -12.516 973 HG SER 124 HG SER 124 5.480 -14.237 -11.598 974 H SER 125 H SER 125 2.923 -16.672 -8.809 975 HA SER 125 HA SER 125 5.760 -17.353 -8.389 976 HB2 SER 125 1HB SER 125 4.951 -16.234 -6.406 977 HB3 SER 125 2HB SER 125 3.520 -17.263 -6.356 978 HG SER 125 HG SER 125 4.673 -18.856 -5.543 979 H GLY 126 H GLY 126 6.208 -19.316 -9.121 980 HA2 GLY 126 1HA GLY 126 4.119 -21.395 -8.898 981 HA3 GLY 126 2HA GLY 126 5.162 -21.256 -10.306 Start of MODEL 9 1 H1 MET 1 H MET 1 6.188 -15.549 17.981 2 HA MET 1 HA MET 1 9.010 -15.719 17.383 3 HB2 MET 1 1HB MET 1 8.155 -16.942 15.492 4 HB3 MET 1 2HB MET 1 6.937 -15.711 15.187 5 HG2 MET 1 1HG MET 1 8.810 -15.603 13.610 6 HG3 MET 1 2HG MET 1 8.630 -14.125 14.552 7 HE1 MET 1 1HE MET 1 11.966 -17.021 14.182 8 HE2 MET 1 2HE MET 1 10.519 -16.722 13.219 9 HE3 MET 1 3HE MET 1 11.885 -15.608 13.130 10 H LYS 2 H LYS 2 9.915 -13.749 17.396 11 HA LYS 2 HA LYS 2 8.163 -11.409 17.052 12 HB2 LYS 2 1HB LYS 2 8.972 -12.092 19.480 13 HB3 LYS 2 2HB LYS 2 10.446 -11.279 18.971 14 HG2 LYS 2 1HG LYS 2 9.217 -9.239 18.550 15 HG3 LYS 2 2HG LYS 2 7.699 -10.044 18.953 16 HD2 LYS 2 1HD LYS 2 8.188 -8.975 20.935 17 HD3 LYS 2 2HD LYS 2 8.909 -10.562 21.211 18 HE2 LYS 2 1HE LYS 2 11.053 -9.490 20.237 19 HE3 LYS 2 2HE LYS 2 10.249 -7.958 20.576 20 HZ1 LYS 2 1HZ LYS 2 10.440 -8.243 22.798 21 HZ2 LYS 2 2HZ LYS 2 11.777 -9.171 22.339 22 HZ3 LYS 2 3HZ LYS 2 10.315 -9.929 22.726 23 H ASP 3 H ASP 3 9.006 -9.700 15.938 24 HA ASP 3 HA ASP 3 11.826 -9.799 15.153 25 HB2 ASP 3 1HB ASP 3 10.953 -10.800 13.242 26 HB3 ASP 3 2HB ASP 3 9.458 -9.873 13.318 27 H HIS 4 H HIS 4 12.612 -7.765 14.257 28 HA HIS 4 HA HIS 4 10.991 -5.452 15.094 29 HB2 HIS 4 1HB HIS 4 13.883 -6.063 15.623 30 HB3 HIS 4 2HB HIS 4 13.326 -4.393 15.557 31 HD1 HIS 4 1HD HIS 4 13.606 -7.242 17.798 32 HD2 HIS 4 2HD HIS 4 11.251 -3.828 17.549 33 HE1 HIS 4 1HE HIS 4 12.590 -6.958 20.081 34 HE2 HIS 4 2HE HIS 4 11.102 -4.936 19.882 35 H LEU 5 H LEU 5 11.161 -3.578 13.853 36 HA LEU 5 HA LEU 5 12.647 -3.846 11.325 37 HB2 LEU 5 1HB LEU 5 9.910 -2.627 11.654 38 HB3 LEU 5 2HB LEU 5 10.818 -2.771 10.150 39 HG LEU 5 HG LEU 5 10.691 -5.333 10.659 40 HD11 LEU 5 1HD1 LEU 5 9.002 -6.092 12.020 41 HD12 LEU 5 2HD1 LEU 5 8.112 -4.571 11.947 42 HD13 LEU 5 3HD1 LEU 5 9.572 -4.691 12.929 43 HD21 LEU 5 1HD2 LEU 5 8.946 -3.463 9.289 44 HD22 LEU 5 2HD2 LEU 5 8.106 -4.939 9.765 45 HD23 LEU 5 3HD2 LEU 5 9.556 -5.033 8.765 46 H ILE 6 H ILE 6 14.235 -2.397 11.435 47 HA ILE 6 HA ILE 6 13.679 0.233 12.623 48 HB ILE 6 HB ILE 6 16.339 -1.070 12.033 49 HG12 ILE 6 1HG1 ILE 6 15.420 -2.216 13.879 50 HG13 ILE 6 2HG1 ILE 6 16.471 -0.999 14.593 51 HG21 ILE 6 1HG2 ILE 6 15.975 1.552 12.035 52 HG22 ILE 6 2HG2 ILE 6 16.069 1.315 13.779 53 HG23 ILE 6 3HG2 ILE 6 17.408 0.812 12.748 54 HD11 ILE 6 1HD1 ILE 6 14.346 0.433 14.755 55 HD12 ILE 6 2HD1 ILE 6 13.487 -1.086 14.499 56 HD13 ILE 6 3HD1 ILE 6 14.557 -0.902 15.888 57 H HIS 7 H HIS 7 13.836 2.072 11.457 58 HA HIS 7 HA HIS 7 15.292 2.380 9.070 59 HB2 HIS 7 1HB HIS 7 13.686 2.243 7.372 60 HB3 HIS 7 2HB HIS 7 13.343 0.833 8.370 61 HD1 HIS 7 1HD HIS 7 10.917 0.521 8.633 62 HD2 HIS 7 2HD HIS 7 11.932 4.546 8.465 63 HE1 HIS 7 1HE HIS 7 8.748 1.772 8.864 64 HE2 HIS 7 2HE HIS 7 9.377 4.203 8.673 65 H ASN 8 H ASN 8 14.709 4.457 7.934 66 HA ASN 8 HA ASN 8 12.982 6.346 9.102 67 HB2 ASN 8 1HB ASN 8 14.355 6.489 11.004 68 HB3 ASN 8 2HB ASN 8 15.834 6.360 10.057 69 HD21 ASN 8 1HD2 ASN 8 13.588 8.442 11.488 70 HD22 ASN 8 2HD2 ASN 8 14.220 9.933 10.887 71 H VAL 9 H VAL 9 12.523 7.654 7.471 72 HA VAL 9 HA VAL 9 14.687 8.538 5.692 73 HB VAL 9 HB VAL 9 13.181 8.315 3.740 74 HG11 VAL 9 1HG1 VAL 9 13.227 5.747 3.714 75 HG12 VAL 9 2HG1 VAL 9 14.759 6.602 3.902 76 HG13 VAL 9 3HG1 VAL 9 13.971 5.883 5.307 77 HG21 VAL 9 1HG2 VAL 9 11.271 6.585 4.168 78 HG22 VAL 9 2HG2 VAL 9 11.364 7.185 5.823 79 HG23 VAL 9 3HG2 VAL 9 11.005 8.296 4.501 80 H HIS 10 H HIS 10 14.777 10.658 6.094 81 HA HIS 10 HA HIS 10 12.248 12.170 6.120 82 HB2 HIS 10 1HB HIS 10 13.649 13.891 7.431 83 HB3 HIS 10 2HB HIS 10 13.122 12.440 8.280 84 HD1 HIS 10 1HD HIS 10 14.912 10.923 9.209 85 HD2 HIS 10 2HD HIS 10 16.438 13.913 6.760 86 HE1 HIS 10 1HE HIS 10 17.408 10.818 9.495 87 HE2 HIS 10 2HE HIS 10 18.304 12.691 8.070 88 H LYS 11 H LYS 11 13.974 11.421 3.839 89 HA LYS 11 HA LYS 11 14.841 14.099 2.973 90 HB2 LYS 11 1HB LYS 11 15.841 11.354 2.417 91 HB3 LYS 11 2HB LYS 11 15.937 12.525 1.109 92 HG2 LYS 11 1HG LYS 11 16.950 13.321 3.785 93 HG3 LYS 11 2HG LYS 11 17.910 12.199 2.818 94 HD2 LYS 11 1HD LYS 11 18.007 13.775 0.998 95 HD3 LYS 11 2HD LYS 11 16.904 14.869 1.837 96 HE2 LYS 11 1HE LYS 11 19.040 15.772 2.194 97 HE3 LYS 11 2HE LYS 11 18.646 14.935 3.695 98 HZ1 LYS 11 1HZ LYS 11 20.394 13.917 1.521 99 HZ2 LYS 11 2HZ LYS 11 19.961 13.039 2.900 100 HZ3 LYS 11 3HZ LYS 11 20.894 14.442 3.049 101 H GLU 12 H GLU 12 14.018 14.996 1.141 102 HA GLU 12 HA GLU 12 11.893 13.476 -0.222 103 HB2 GLU 12 1HB GLU 12 11.190 15.972 -0.818 104 HB3 GLU 12 2HB GLU 12 10.672 15.186 0.667 105 HG2 GLU 12 1HG GLU 12 12.195 16.369 1.971 106 HG3 GLU 12 2HG GLU 12 13.175 16.823 0.578 107 H GLU 13 H GLU 13 13.458 12.635 -1.709 108 HA GLU 13 HA GLU 13 14.415 14.623 -3.662 109 HB2 GLU 13 1HB GLU 13 16.082 13.127 -2.329 110 HB3 GLU 13 2HB GLU 13 15.564 11.862 -3.434 111 HG2 GLU 13 1HG GLU 13 17.444 12.698 -4.468 112 HG3 GLU 13 2HG GLU 13 16.142 13.559 -5.287 113 H HIS 14 H HIS 14 13.522 14.564 -5.611 114 HA HIS 14 HA HIS 14 11.593 12.554 -6.282 115 HB2 HIS 14 1HB HIS 14 12.692 14.663 -8.137 116 HB3 HIS 14 2HB HIS 14 11.125 13.864 -8.215 117 HD1 HIS 14 1HD HIS 14 11.115 16.863 -8.231 118 HD2 HIS 14 2HD HIS 14 11.016 14.643 -4.720 119 HE1 HIS 14 1HE HIS 14 10.119 18.389 -6.498 120 HE2 HIS 14 2HE HIS 14 10.148 17.053 -4.363 121 H ALA 15 H ALA 15 13.369 10.849 -6.043 122 HA ALA 15 HA ALA 15 14.722 10.463 -8.633 123 HB1 ALA 15 1HB ALA 15 15.780 8.738 -6.617 124 HB2 ALA 15 2HB ALA 15 16.593 10.008 -7.534 125 HB3 ALA 15 3HB ALA 15 15.775 10.399 -6.021 126 H HIS 16 H HIS 16 14.757 8.350 -9.526 127 HA HIS 16 HA HIS 16 13.134 6.277 -8.330 128 HB2 HIS 16 1HB HIS 16 12.330 7.288 -11.055 129 HB3 HIS 16 2HB HIS 16 11.485 6.126 -10.037 130 HD1 HIS 16 1HD HIS 16 9.697 7.036 -8.560 131 HD2 HIS 16 2HD HIS 16 12.234 10.007 -9.974 132 HE1 HIS 16 1HE HIS 16 8.672 9.207 -7.813 133 HE2 HIS 16 2HE HIS 16 10.178 10.994 -8.752 134 H ALA 17 H ALA 17 13.192 4.263 -9.595 135 HA ALA 17 HA ALA 17 15.202 4.096 -11.685 136 HB1 ALA 17 1HB ALA 17 16.573 2.463 -10.556 137 HB2 ALA 17 2HB ALA 17 16.488 3.932 -9.582 138 HB3 ALA 17 3HB ALA 17 15.529 2.521 -9.135 139 H HIS 18 H HIS 18 14.732 2.542 -13.127 140 HA HIS 18 HA HIS 18 12.448 0.805 -12.539 141 HB2 HIS 18 1HB HIS 18 13.751 1.578 -15.156 142 HB3 HIS 18 2HB HIS 18 12.405 0.450 -15.016 143 HD1 HIS 18 1HD HIS 18 10.702 1.865 -16.250 144 HD2 HIS 18 2HD HIS 18 12.464 3.850 -13.054 145 HE1 HIS 18 1HE HIS 18 9.363 3.972 -15.946 146 HE2 HIS 18 2HE HIS 18 10.500 5.197 -14.062 147 H ASN 19 H ASN 19 13.374 -0.875 -11.404 148 HA ASN 19 HA ASN 19 14.753 -2.840 -12.988 149 HB2 ASN 19 1HB ASN 19 16.154 -1.902 -10.486 150 HB3 ASN 19 2HB ASN 19 16.756 -3.010 -11.716 151 HD21 ASN 19 1HD2 ASN 19 16.327 0.267 -10.786 152 HD22 ASN 19 2HD2 ASN 19 17.172 0.984 -12.112 153 H LYS 20 H LYS 20 14.718 -4.918 -12.059 154 HA LYS 20 HA LYS 20 12.967 -5.147 -9.699 155 HB2 LYS 20 1HB LYS 20 13.244 -6.957 -12.102 156 HB3 LYS 20 2HB LYS 20 12.345 -7.393 -10.654 157 HG2 LYS 20 1HG LYS 20 10.646 -6.598 -11.936 158 HG3 LYS 20 2HG LYS 20 11.132 -5.101 -11.136 159 HD2 LYS 20 1HD LYS 20 11.029 -4.425 -13.335 160 HD3 LYS 20 2HD LYS 20 12.731 -4.867 -13.192 161 HE2 LYS 20 1HE LYS 20 12.326 -6.992 -14.230 162 HE3 LYS 20 2HE LYS 20 10.584 -6.721 -14.210 163 HZ1 LYS 20 1HZ LYS 20 12.302 -6.116 -16.253 164 HZ2 LYS 20 2HZ LYS 20 11.965 -4.617 -15.548 165 HZ3 LYS 20 3HZ LYS 20 10.700 -5.594 -16.103 166 H ASP 21 H ASP 21 15.332 -4.844 -8.809 167 HA ASP 21 HA ASP 21 16.329 -7.549 -8.231 168 HB2 ASP 21 1HB ASP 21 17.863 -6.463 -9.826 169 HB3 ASP 21 2HB ASP 21 18.054 -5.110 -8.714 170 H TYR 22 H TYR 22 14.943 -7.285 -6.343 171 HA TYR 22 HA TYR 22 16.166 -5.564 -4.286 172 HB2 TYR 22 1HB TYR 22 13.771 -6.038 -3.208 173 HB3 TYR 22 2HB TYR 22 14.048 -4.705 -4.324 174 HD1 TYR 22 2HD TYR 22 13.850 -5.554 -6.919 175 HD2 TYR 22 1HD TYR 22 11.835 -7.223 -3.564 176 HE1 TYR 22 2HE TYR 22 12.107 -6.437 -8.413 177 HE2 TYR 22 1HE TYR 22 10.087 -8.112 -5.049 178 HH TYR 22 HH TYR 22 9.348 -8.275 -7.133 179 H ASP 23 H ASP 23 15.897 -6.413 -2.036 180 HA ASP 23 HA ASP 23 16.648 -9.230 -2.003 181 HB2 ASP 23 1HB ASP 23 18.070 -7.589 -0.825 182 HB3 ASP 23 2HB ASP 23 16.712 -7.175 0.217 183 H ILE 24 H ILE 24 14.427 -9.909 -2.483 184 HA ILE 24 HA ILE 24 12.329 -9.448 -0.611 185 HB ILE 24 HB ILE 24 12.286 -11.859 -2.357 186 HG12 ILE 24 1HG1 ILE 24 11.420 -10.029 -4.124 187 HG13 ILE 24 2HG1 ILE 24 12.630 -9.059 -3.291 188 HG21 ILE 24 1HG2 ILE 24 9.961 -10.965 -2.758 189 HG22 ILE 24 2HG2 ILE 24 10.323 -11.449 -1.102 190 HG23 ILE 24 3HG2 ILE 24 10.314 -9.741 -1.539 191 HD11 ILE 24 1HD1 ILE 24 12.956 -11.281 -5.160 192 HD12 ILE 24 2HD1 ILE 24 14.032 -9.934 -4.790 193 HD13 ILE 24 3HD1 ILE 24 14.004 -11.353 -3.744 194 HA PRO 25 HA PRO 25 13.458 -12.381 2.490 195 HB2 PRO 25 1HB PRO 25 11.048 -12.565 3.727 196 HB3 PRO 25 2HB PRO 25 12.112 -11.165 3.901 197 HG2 PRO 25 1HG PRO 25 9.720 -11.518 2.137 198 HG3 PRO 25 2HG PRO 25 10.189 -10.118 3.118 199 HD2 PRO 25 1HD PRO 25 10.624 -10.237 0.448 200 HD3 PRO 25 2HD PRO 25 11.711 -9.373 1.555 201 H THR 26 H THR 26 12.893 -14.533 3.247 202 HA THR 26 HA THR 26 11.543 -16.101 1.154 203 HB THR 26 HB THR 26 12.832 -18.038 1.996 204 HG1 THR 26 1HG THR 26 13.137 -17.117 4.154 205 HG21 THR 26 1HG2 THR 26 15.150 -16.492 1.565 206 HG22 THR 26 2HG2 THR 26 13.863 -15.747 0.617 207 HG23 THR 26 3HG2 THR 26 14.255 -17.450 0.386 208 H THR 27 H THR 27 10.247 -14.728 3.431 209 HA THR 27 HA THR 27 9.381 -16.926 5.138 210 HB THR 27 HB THR 27 8.154 -14.212 5.323 211 HG1 THR 27 1HG THR 27 10.853 -14.850 5.827 212 HG21 THR 27 1HG2 THR 27 8.612 -16.559 7.032 213 HG22 THR 27 2HG2 THR 27 7.318 -15.362 7.073 214 HG23 THR 27 3HG2 THR 27 8.872 -15.006 7.826 215 H GLU 28 H GLU 28 6.865 -16.684 5.673 216 HA GLU 28 HA GLU 28 5.529 -17.204 3.134 217 HB2 GLU 28 1HB GLU 28 4.809 -17.765 6.005 218 HB3 GLU 28 2HB GLU 28 3.656 -17.981 4.695 219 HG2 GLU 28 1HG GLU 28 4.987 -19.667 3.688 220 HG3 GLU 28 2HG GLU 28 6.341 -19.327 4.765 221 H ASN 29 H ASN 29 5.602 -14.856 2.636 222 HA ASN 29 HA ASN 29 3.091 -13.635 3.411 223 HB2 ASN 29 1HB ASN 29 4.275 -11.434 3.905 224 HB3 ASN 29 2HB ASN 29 4.409 -12.683 5.139 225 HD21 ASN 29 1HD2 ASN 29 6.300 -12.033 6.029 226 HD22 ASN 29 2HD2 ASN 29 7.812 -12.044 5.193 227 H LEU 30 H LEU 30 2.180 -12.757 1.673 228 HA LEU 30 HA LEU 30 3.851 -12.280 -0.687 229 HB2 LEU 30 1HB LEU 30 0.916 -12.771 -0.303 230 HB3 LEU 30 2HB LEU 30 1.557 -12.139 -1.818 231 HG LEU 30 HG LEU 30 2.355 -14.776 -0.589 232 HD11 LEU 30 1HD1 LEU 30 -0.041 -14.625 -1.331 233 HD12 LEU 30 2HD1 LEU 30 0.929 -15.847 -2.152 234 HD13 LEU 30 3HD1 LEU 30 0.561 -14.325 -2.962 235 HD21 LEU 30 1HD2 LEU 30 3.310 -15.194 -2.821 236 HD22 LEU 30 2HD2 LEU 30 4.082 -13.838 -1.999 237 HD23 LEU 30 3HD2 LEU 30 2.910 -13.540 -3.283 238 H TYR 31 H TYR 31 3.463 -10.393 -2.006 239 HA TYR 31 HA TYR 31 2.278 -8.125 -0.559 240 HB2 TYR 31 1HB TYR 31 4.830 -7.859 -2.138 241 HB3 TYR 31 2HB TYR 31 4.127 -6.716 -1.000 242 HD1 TYR 31 1HD TYR 31 3.780 -7.811 1.454 243 HD2 TYR 31 2HD TYR 31 6.691 -9.000 -1.412 244 HE1 TYR 31 1HE TYR 31 5.165 -8.748 3.258 245 HE2 TYR 31 2HE TYR 31 8.083 -9.942 0.384 246 HH TYR 31 HH TYR 31 6.982 -9.941 3.754 247 H PHE 32 H PHE 32 1.447 -6.457 -1.856 248 HA PHE 32 HA PHE 32 1.528 -6.703 -4.737 249 HB2 PHE 32 1HB PHE 32 -1.175 -6.789 -3.406 250 HB3 PHE 32 2HB PHE 32 -0.790 -7.049 -5.104 251 HD1 PHE 32 1HD PHE 32 -0.182 -8.488 -1.728 252 HD2 PHE 32 2HD PHE 32 -0.551 -9.202 -5.908 253 HE1 PHE 32 1HE PHE 32 -0.058 -10.912 -1.321 254 HE2 PHE 32 2HE PHE 32 -0.429 -11.627 -5.508 255 HZ PHE 32 HZ PHE 32 -0.183 -12.485 -3.212 256 H GLN 33 H GLN 33 0.339 -4.909 -5.805 257 HA GLN 33 HA GLN 33 -0.158 -2.600 -4.082 258 HB2 GLN 33 1HB GLN 33 1.193 -1.186 -5.705 259 HB3 GLN 33 2HB GLN 33 2.111 -2.215 -4.614 260 HG2 GLN 33 1HG GLN 33 2.424 -3.845 -6.390 261 HG3 GLN 33 2HG GLN 33 1.472 -2.846 -7.486 262 HE21 GLN 33 1HE2 GLN 33 2.796 -2.011 -8.931 263 HE22 GLN 33 2HE2 GLN 33 4.315 -1.257 -8.602 264 H GLY 34 H GLY 34 -1.879 -1.452 -4.718 265 HA2 GLY 34 1HA GLY 34 -2.651 -0.779 -7.274 266 HA3 GLY 34 2HA GLY 34 -3.416 -2.330 -6.961 267 H SER 35 H SER 35 -2.827 0.485 -4.865 268 HA SER 35 HA SER 35 -5.380 0.291 -3.645 269 HB2 SER 35 1HB SER 35 -3.630 1.279 -2.363 270 HB3 SER 35 2HB SER 35 -3.267 2.450 -3.631 271 HG SER 35 HG SER 35 -5.528 2.348 -1.933 272 H SER 36 H SER 36 -7.113 1.820 -3.727 273 HA SER 36 HA SER 36 -7.443 2.975 -6.407 274 HB2 SER 36 1HB SER 36 -9.112 1.280 -5.623 275 HB3 SER 36 2HB SER 36 -9.581 2.399 -4.342 276 HG SER 36 HG SER 36 -9.685 2.974 -7.121 277 H GLY 37 H GLY 37 -5.872 4.383 -4.543 278 HA2 GLY 37 1HA GLY 37 -6.137 6.897 -4.670 279 HA3 GLY 37 2HA GLY 37 -7.643 6.627 -3.805 280 H SER 38 H SER 38 -7.614 6.241 -1.615 281 HA SER 38 HA SER 38 -5.035 6.755 -0.309 282 HB2 SER 38 1HB SER 38 -7.887 7.148 0.600 283 HB3 SER 38 2HB SER 38 -6.517 7.258 1.705 284 HG SER 38 HG SER 38 -6.254 9.210 1.008 285 H SER 39 H SER 39 -4.719 5.681 1.835 286 HA SER 39 HA SER 39 -4.689 2.907 1.559 287 HB2 SER 39 1HB SER 39 -4.084 2.866 3.971 288 HB3 SER 39 2HB SER 39 -3.152 4.052 3.057 289 HG SER 39 HG SER 39 -5.112 5.447 3.820 290 H GLY 40 H GLY 40 -7.145 5.029 2.777 291 HA2 GLY 40 1HA GLY 40 -8.607 3.198 4.345 292 HA3 GLY 40 2HA GLY 40 -9.257 4.646 3.591 293 H ASP 41 H ASP 41 -9.351 4.326 1.042 294 HA ASP 41 HA ASP 41 -11.457 2.827 0.362 295 HB2 ASP 41 1HB ASP 41 -9.010 3.080 -1.400 296 HB3 ASP 41 2HB ASP 41 -10.660 2.778 -1.940 297 H MET 42 H MET 42 -8.113 1.611 0.291 298 HA MET 42 HA MET 42 -8.351 -0.881 -0.677 299 HB2 MET 42 1HB MET 42 -6.824 0.076 1.731 300 HB3 MET 42 2HB MET 42 -6.709 -1.590 1.182 301 HG2 MET 42 1HG MET 42 -6.270 0.569 -0.805 302 HG3 MET 42 2HG MET 42 -5.012 0.263 0.390 303 HE1 MET 42 1HE MET 42 -7.412 -2.491 -1.517 304 HE2 MET 42 2HE MET 42 -7.169 -0.997 -2.421 305 HE3 MET 42 3HE MET 42 -6.420 -2.495 -2.975 306 H MET 43 H MET 43 -8.808 -0.248 2.808 307 HA MET 43 HA MET 43 -9.677 -2.622 3.710 308 HB2 MET 43 1HB MET 43 -11.032 0.003 4.351 309 HB3 MET 43 2HB MET 43 -11.074 -1.450 5.341 310 HG2 MET 43 1HG MET 43 -8.559 0.049 4.655 311 HG3 MET 43 2HG MET 43 -9.494 0.299 6.128 312 HE1 MET 43 1HE MET 43 -10.127 -1.293 7.651 313 HE2 MET 43 2HE MET 43 -9.808 -3.025 7.558 314 HE3 MET 43 3HE MET 43 -8.739 -1.980 8.495 315 H ARG 44 H ARG 44 -11.584 -0.374 1.774 316 HA ARG 44 HA ARG 44 -13.926 -2.076 1.870 317 HB2 ARG 44 1HB ARG 44 -13.307 0.513 0.452 318 HB3 ARG 44 2HB ARG 44 -14.814 -0.360 0.212 319 HG2 ARG 44 1HG ARG 44 -15.629 0.204 2.248 320 HG3 ARG 44 2HG ARG 44 -14.035 0.217 3.005 321 HD2 ARG 44 1HD ARG 44 -14.560 2.459 2.998 322 HD3 ARG 44 2HD ARG 44 -13.645 2.306 1.498 323 HE ARG 44 HE ARG 44 -16.295 1.900 0.835 324 HH11 ARG 44 2HH1 ARG 44 -14.368 4.450 2.215 325 HH12 ARG 44 1HH1 ARG 44 -15.366 5.721 1.588 326 HH21 ARG 44 2HH2 ARG 44 -17.616 3.564 0.004 327 HH22 ARG 44 1HH2 ARG 44 -17.214 5.215 0.331 328 H GLU 45 H GLU 45 -11.933 -0.769 -0.791 329 HA GLU 45 HA GLU 45 -12.854 -2.195 -2.894 330 HB2 GLU 45 1HB GLU 45 -10.796 -0.559 -2.637 331 HB3 GLU 45 2HB GLU 45 -9.886 -2.062 -2.576 332 HG2 GLU 45 1HG GLU 45 -9.820 -1.518 -4.813 333 HG3 GLU 45 2HG GLU 45 -11.161 -2.660 -4.735 334 H ILE 46 H ILE 46 -10.890 -3.415 -0.269 335 HA ILE 46 HA ILE 46 -10.182 -5.889 -1.448 336 HB ILE 46 HB ILE 46 -10.463 -5.194 1.478 337 HG12 ILE 46 1HG1 ILE 46 -7.843 -5.417 0.063 338 HG13 ILE 46 2HG1 ILE 46 -8.795 -3.955 -0.173 339 HG21 ILE 46 1HG2 ILE 46 -9.715 -7.649 0.076 340 HG22 ILE 46 2HG2 ILE 46 -8.550 -7.132 1.295 341 HG23 ILE 46 3HG2 ILE 46 -10.233 -7.406 1.744 342 HD11 ILE 46 1HD1 ILE 46 -8.727 -3.446 2.145 343 HD12 ILE 46 2HD1 ILE 46 -8.026 -5.019 2.529 344 HD13 ILE 46 3HD1 ILE 46 -7.083 -3.828 1.633 345 H ARG 47 H ARG 47 -12.572 -5.239 1.125 346 HA ARG 47 HA ARG 47 -13.775 -7.662 1.319 347 HB2 ARG 47 1HB ARG 47 -14.924 -4.891 1.468 348 HB3 ARG 47 2HB ARG 47 -15.950 -6.301 1.699 349 HG2 ARG 47 1HG ARG 47 -14.840 -6.938 3.649 350 HG3 ARG 47 2HG ARG 47 -13.440 -5.926 3.289 351 HD2 ARG 47 1HD ARG 47 -14.732 -4.905 5.050 352 HD3 ARG 47 2HD ARG 47 -14.856 -3.924 3.590 353 HE ARG 47 HE ARG 47 -16.988 -5.838 3.949 354 HH11 ARG 47 2HH1 ARG 47 -15.868 -2.597 4.549 355 HH12 ARG 47 1HH1 ARG 47 -17.460 -1.948 4.769 356 HH21 ARG 47 2HH2 ARG 47 -19.088 -4.996 4.237 357 HH22 ARG 47 1HH2 ARG 47 -19.291 -3.314 4.592 358 H LYS 48 H LYS 48 -14.131 -5.353 -1.284 359 HA LYS 48 HA LYS 48 -16.405 -6.238 -2.557 360 HB2 LYS 48 1HB LYS 48 -14.995 -4.291 -3.241 361 HB3 LYS 48 2HB LYS 48 -13.843 -5.422 -3.939 362 HG2 LYS 48 1HG LYS 48 -15.551 -6.216 -5.490 363 HG3 LYS 48 2HG LYS 48 -16.715 -5.091 -4.785 364 HD2 LYS 48 1HD LYS 48 -15.950 -3.976 -6.686 365 HD3 LYS 48 2HD LYS 48 -14.999 -3.269 -5.378 366 HE2 LYS 48 1HE LYS 48 -13.149 -4.788 -5.921 367 HE3 LYS 48 2HE LYS 48 -14.101 -5.466 -7.241 368 HZ1 LYS 48 1HZ LYS 48 -14.209 -3.053 -8.057 369 HZ2 LYS 48 2HZ LYS 48 -12.767 -3.907 -8.279 370 HZ3 LYS 48 3HZ LYS 48 -12.898 -2.782 -7.022 371 H VAL 49 H VAL 49 -13.137 -7.583 -2.739 372 HA VAL 49 HA VAL 49 -13.905 -9.630 -4.615 373 HB VAL 49 HB VAL 49 -11.390 -9.718 -2.983 374 HG11 VAL 49 1HG1 VAL 49 -11.833 -11.600 -4.437 375 HG12 VAL 49 2HG1 VAL 49 -12.074 -10.517 -5.810 376 HG13 VAL 49 3HG1 VAL 49 -10.479 -10.663 -5.069 377 HG21 VAL 49 1HG2 VAL 49 -10.346 -8.298 -4.767 378 HG22 VAL 49 2HG2 VAL 49 -11.975 -7.898 -5.312 379 HG23 VAL 49 3HG2 VAL 49 -11.451 -7.442 -3.692 380 H LEU 50 H LEU 50 -13.297 -9.415 -1.146 381 HA LEU 50 HA LEU 50 -13.351 -12.134 -0.521 382 HB2 LEU 50 1HB LEU 50 -14.418 -9.889 1.181 383 HB3 LEU 50 2HB LEU 50 -13.859 -11.465 1.736 384 HG LEU 50 HG LEU 50 -12.076 -9.413 0.432 385 HD11 LEU 50 1HD1 LEU 50 -11.969 -8.313 2.351 386 HD12 LEU 50 2HD1 LEU 50 -11.511 -9.793 3.193 387 HD13 LEU 50 3HD1 LEU 50 -13.214 -9.367 3.023 388 HD21 LEU 50 1HD2 LEU 50 -11.671 -12.081 0.715 389 HD22 LEU 50 2HD2 LEU 50 -10.992 -11.471 2.225 390 HD23 LEU 50 3HD2 LEU 50 -10.387 -10.873 0.679 391 H GLY 51 H GLY 51 -16.042 -9.801 -0.212 392 HA2 GLY 51 1HA GLY 51 -18.017 -11.729 0.319 393 HA3 GLY 51 2HA GLY 51 -18.315 -10.104 -0.280 394 H ALA 52 H ALA 52 -16.344 -11.164 -2.542 395 HA ALA 52 HA ALA 52 -18.537 -11.981 -4.280 396 HB1 ALA 52 1HB ALA 52 -16.079 -10.533 -4.623 397 HB2 ALA 52 2HB ALA 52 -16.172 -11.870 -5.771 398 HB3 ALA 52 3HB ALA 52 -17.461 -10.668 -5.711 399 H ASN 53 H ASN 53 -15.572 -13.236 -2.901 400 HA ASN 53 HA ASN 53 -15.868 -15.733 -4.399 401 HB2 ASN 53 1HB ASN 53 -13.641 -14.437 -2.894 402 HB3 ASN 53 2HB ASN 53 -13.653 -16.195 -3.006 403 HD21 ASN 53 1HD2 ASN 53 -14.142 -13.364 -5.091 404 HD22 ASN 53 2HD2 ASN 53 -13.243 -13.985 -6.430 405 H ASN 54 H ASN 54 -17.537 -14.731 -2.046 406 HA ASN 54 HA ASN 54 -18.618 -15.638 -0.263 407 HB2 ASN 54 1HB ASN 54 -17.417 -18.141 -1.449 408 HB3 ASN 54 2HB ASN 54 -18.482 -18.172 -0.046 409 HD21 ASN 54 1HD2 ASN 54 -18.630 -19.046 -2.980 410 HD22 ASN 54 2HD2 ASN 54 -20.178 -18.471 -3.488 411 H CYS 55 H CYS 55 -15.971 -14.548 0.084 412 HA CYS 55 HA CYS 55 -14.793 -16.240 2.159 413 HB2 CYS 55 1HB CYS 55 -13.816 -13.702 0.836 414 HB3 CYS 55 2HB CYS 55 -12.958 -14.529 2.131 415 HG CYS 55 HG CYS 55 -13.030 -15.194 -1.122 416 H ASP 56 H ASP 56 -14.332 -15.417 4.259 417 HA ASP 56 HA ASP 56 -16.223 -13.324 5.102 418 HB2 ASP 56 1HB ASP 56 -14.978 -15.480 6.819 419 HB3 ASP 56 2HB ASP 56 -16.270 -14.374 7.277 420 H TYR 57 H TYR 57 -15.534 -11.597 6.277 421 HA TYR 57 HA TYR 57 -12.674 -11.474 6.960 422 HB2 TYR 57 1HB TYR 57 -12.857 -8.991 6.325 423 HB3 TYR 57 2HB TYR 57 -12.768 -10.160 5.013 424 HD1 TYR 57 2HD TYR 57 -14.798 -10.708 3.705 425 HD2 TYR 57 1HD TYR 57 -14.805 -7.644 6.657 426 HE1 TYR 57 2HE TYR 57 -16.877 -9.805 2.753 427 HE2 TYR 57 1HE TYR 57 -16.885 -6.732 5.714 428 HH TYR 57 HH TYR 57 -18.871 -8.358 3.730 429 H GLU 58 H GLU 58 -12.191 -10.611 8.906 430 HA GLU 58 HA GLU 58 -14.387 -9.379 10.435 431 HB2 GLU 58 1HB GLU 58 -13.938 -11.708 11.173 432 HB3 GLU 58 2HB GLU 58 -12.281 -11.247 11.535 433 HG2 GLU 58 1HG GLU 58 -13.271 -11.123 13.600 434 HG3 GLU 58 2HG GLU 58 -13.379 -9.453 13.048 435 H GLN 59 H GLN 59 -13.833 -7.284 10.482 436 HA GLN 59 HA GLN 59 -11.186 -6.307 10.462 437 HB2 GLN 59 1HB GLN 59 -13.510 -5.155 9.929 438 HB3 GLN 59 2HB GLN 59 -13.399 -4.670 11.616 439 HG2 GLN 59 1HG GLN 59 -10.982 -3.919 10.879 440 HG3 GLN 59 2HG GLN 59 -11.745 -3.856 9.291 441 HE21 GLN 59 1HE2 GLN 59 -11.404 -2.360 12.342 442 HE22 GLN 59 2HE2 GLN 59 -12.443 -1.011 12.054 443 H ARG 60 H ARG 60 -9.750 -6.514 12.037 444 HA ARG 60 HA ARG 60 -10.642 -6.804 14.797 445 HB2 ARG 60 1HB ARG 60 -7.948 -7.150 13.478 446 HB3 ARG 60 2HB ARG 60 -8.201 -7.291 15.212 447 HG2 ARG 60 1HG ARG 60 -9.749 -8.954 13.257 448 HG3 ARG 60 2HG ARG 60 -8.154 -9.436 13.840 449 HD2 ARG 60 1HD ARG 60 -8.968 -9.360 16.141 450 HD3 ARG 60 2HD ARG 60 -10.556 -8.850 15.569 451 HE ARG 60 HE ARG 60 -10.179 -11.169 14.256 452 HH11 ARG 60 2HH1 ARG 60 -9.870 -10.283 17.609 453 HH12 ARG 60 1HH1 ARG 60 -10.293 -11.857 18.198 454 HH21 ARG 60 2HH2 ARG 60 -10.737 -13.244 15.020 455 HH22 ARG 60 1HH2 ARG 60 -10.785 -13.540 16.725 456 H GLU 61 H GLU 61 -8.396 -4.785 12.915 457 HA GLU 61 HA GLU 61 -8.626 -2.739 15.024 458 HB2 GLU 61 1HB GLU 61 -6.233 -3.435 13.316 459 HB3 GLU 61 2HB GLU 61 -6.334 -1.995 14.319 460 HG2 GLU 61 1HG GLU 61 -6.699 -4.738 15.465 461 HG3 GLU 61 2HG GLU 61 -5.102 -4.021 15.254 462 H ARG 62 H ARG 62 -7.579 -0.579 13.894 463 HA ARG 62 HA ARG 62 -9.576 0.400 12.223 464 HB2 ARG 62 1HB ARG 62 -8.265 1.958 13.446 465 HB3 ARG 62 2HB ARG 62 -6.767 1.353 12.753 466 HG2 ARG 62 1HG ARG 62 -7.043 2.497 10.798 467 HG3 ARG 62 2HG ARG 62 -8.804 2.493 10.917 468 HD2 ARG 62 1HD ARG 62 -7.137 4.036 12.869 469 HD3 ARG 62 2HD ARG 62 -7.520 4.709 11.285 470 HE ARG 62 HE ARG 62 -9.299 4.418 13.515 471 HH11 ARG 62 2HH1 ARG 62 -9.090 4.629 10.047 472 HH12 ARG 62 1HH1 ARG 62 -10.707 5.219 9.854 473 HH21 ARG 62 2HH2 ARG 62 -11.431 5.194 13.275 474 HH22 ARG 62 1HH2 ARG 62 -12.038 5.541 11.692 475 H PHE 63 H PHE 63 -6.201 -0.309 11.297 476 HA PHE 63 HA PHE 63 -7.125 -0.645 8.526 477 HB2 PHE 63 1HB PHE 63 -4.526 0.241 9.725 478 HB3 PHE 63 2HB PHE 63 -4.540 -0.478 8.118 479 HD1 PHE 63 2HD PHE 63 -6.074 0.573 6.369 480 HD2 PHE 63 1HD PHE 63 -5.021 2.490 10.020 481 HE1 PHE 63 2HE PHE 63 -6.692 2.748 5.400 482 HE2 PHE 63 1HE PHE 63 -5.638 4.669 9.057 483 HZ PHE 63 HZ PHE 63 -6.474 4.800 6.744 484 H LEU 64 H LEU 64 -7.674 -2.766 10.112 485 HA LEU 64 HA LEU 64 -5.881 -4.799 9.028 486 HB2 LEU 64 1HB LEU 64 -5.201 -4.228 11.388 487 HB3 LEU 64 2HB LEU 64 -6.762 -4.861 11.905 488 HG LEU 64 HG LEU 64 -6.073 -7.052 10.828 489 HD11 LEU 64 1HD1 LEU 64 -4.112 -7.275 9.809 490 HD12 LEU 64 2HD1 LEU 64 -3.251 -6.516 11.148 491 HD13 LEU 64 3HD1 LEU 64 -3.963 -5.518 9.880 492 HD21 LEU 64 1HD2 LEU 64 -4.107 -6.565 12.960 493 HD22 LEU 64 2HD2 LEU 64 -5.394 -7.766 12.851 494 HD23 LEU 64 3HD2 LEU 64 -5.768 -6.115 13.347 495 H LEU 65 H LEU 65 -6.878 -6.713 8.516 496 HA LEU 65 HA LEU 65 -9.632 -7.158 9.355 497 HB2 LEU 65 1HB LEU 65 -8.760 -6.546 6.577 498 HB3 LEU 65 2HB LEU 65 -10.035 -7.740 6.812 499 HG LEU 65 HG LEU 65 -10.324 -5.083 8.126 500 HD11 LEU 65 1HD1 LEU 65 -9.641 -4.450 5.903 501 HD12 LEU 65 2HD1 LEU 65 -11.378 -4.196 6.076 502 HD13 LEU 65 3HD1 LEU 65 -10.775 -5.597 5.190 503 HD21 LEU 65 1HD2 LEU 65 -12.008 -7.346 7.274 504 HD22 LEU 65 2HD2 LEU 65 -12.711 -5.742 7.067 505 HD23 LEU 65 3HD2 LEU 65 -12.166 -6.268 8.660 506 H PHE 66 H PHE 66 -10.064 -9.261 9.662 507 HA PHE 66 HA PHE 66 -7.954 -11.178 9.087 508 HB2 PHE 66 1HB PHE 66 -9.054 -11.063 11.335 509 HB3 PHE 66 2HB PHE 66 -10.545 -11.618 10.581 510 HD1 PHE 66 2HD PHE 66 -7.036 -12.560 11.280 511 HD2 PHE 66 1HD PHE 66 -10.928 -13.896 10.192 512 HE1 PHE 66 2HE PHE 66 -6.318 -14.893 11.590 513 HE2 PHE 66 1HE PHE 66 -10.217 -16.231 10.501 514 HZ PHE 66 HZ PHE 66 -7.909 -16.732 11.200 515 H CYS 67 H CYS 67 -8.082 -11.597 6.908 516 HA CYS 67 HA CYS 67 -10.606 -12.308 5.689 517 HB2 CYS 67 1HB CYS 67 -7.782 -12.287 4.607 518 HB3 CYS 67 2HB CYS 67 -9.207 -12.672 3.649 519 HG CYS 67 HG CYS 67 -10.000 -9.881 4.939 520 H VAL 68 H VAL 68 -11.289 -14.317 5.111 521 HA VAL 68 HA VAL 68 -9.529 -16.609 5.394 522 HB VAL 68 HB VAL 68 -10.451 -16.254 7.676 523 HG11 VAL 68 1HG1 VAL 68 -12.795 -15.659 6.351 524 HG12 VAL 68 2HG1 VAL 68 -13.110 -17.249 7.049 525 HG13 VAL 68 3HG1 VAL 68 -12.617 -15.910 8.087 526 HG21 VAL 68 1HG2 VAL 68 -10.085 -18.444 7.782 527 HG22 VAL 68 2HG2 VAL 68 -11.773 -18.701 7.343 528 HG23 VAL 68 3HG2 VAL 68 -10.534 -18.651 6.089 529 H HIS 69 H HIS 69 -9.962 -18.057 3.860 530 HA HIS 69 HA HIS 69 -12.558 -17.880 2.483 531 HB2 HIS 69 1HB HIS 69 -10.849 -17.357 0.930 532 HB3 HIS 69 2HB HIS 69 -9.816 -18.662 1.506 533 HD1 HIS 69 1HD HIS 69 -10.274 -21.024 0.599 534 HD2 HIS 69 2HD HIS 69 -12.867 -18.129 -0.869 535 HE1 HIS 69 1HE HIS 69 -11.479 -22.113 -1.321 536 HE2 HIS 69 2HE HIS 69 -12.981 -20.315 -2.247 537 H GLY 70 H GLY 70 -13.885 -19.405 3.247 538 HA2 GLY 70 1HA GLY 70 -12.871 -22.170 3.324 539 HA3 GLY 70 2HA GLY 70 -13.782 -21.532 4.685 540 H ASP 71 H ASP 71 -14.375 -23.792 2.903 541 HA ASP 71 HA ASP 71 -16.990 -22.859 1.916 542 HB2 ASP 71 1HB ASP 71 -15.982 -23.386 -0.090 543 HB3 ASP 71 2HB ASP 71 -14.963 -24.631 0.627 544 H GLY 72 H GLY 72 -15.171 -25.708 3.037 545 HA2 GLY 72 1HA GLY 72 -16.964 -26.458 5.020 546 HA3 GLY 72 2HA GLY 72 -17.474 -27.286 3.557 547 H HIS 73 H HIS 73 -14.122 -26.559 4.222 548 HA HIS 73 HA HIS 73 -13.551 -29.166 5.307 549 HB2 HIS 73 1HB HIS 73 -13.114 -28.541 2.436 550 HB3 HIS 73 2HB HIS 73 -11.823 -29.402 3.268 551 HD1 HIS 73 1HD HIS 73 -12.146 -31.862 3.644 552 HD2 HIS 73 2HD HIS 73 -15.633 -29.962 2.425 553 HE1 HIS 73 1HE HIS 73 -13.797 -33.706 3.201 554 HE2 HIS 73 2HE HIS 73 -15.872 -32.537 2.383 555 H ALA 74 H ALA 74 -11.151 -29.462 5.611 556 HA ALA 74 HA ALA 74 -10.012 -26.905 6.452 557 HB1 ALA 74 1HB ALA 74 -10.046 -29.511 7.555 558 HB2 ALA 74 2HB ALA 74 -8.367 -29.101 7.204 559 HB3 ALA 74 3HB ALA 74 -9.337 -28.044 8.230 560 H GLU 75 H GLU 75 -9.940 -28.676 3.731 561 HA GLU 75 HA GLU 75 -7.074 -28.473 3.232 562 HB2 GLU 75 1HB GLU 75 -9.319 -29.566 1.528 563 HB3 GLU 75 2HB GLU 75 -7.619 -29.585 1.078 564 HG2 GLU 75 1HG GLU 75 -7.106 -31.025 2.954 565 HG3 GLU 75 2HG GLU 75 -8.784 -30.957 3.490 566 H ASN 76 H ASN 76 -10.084 -26.937 2.358 567 HA ASN 76 HA ASN 76 -8.687 -25.195 0.454 568 HB2 ASN 76 1HB ASN 76 -11.116 -24.416 -0.001 569 HB3 ASN 76 2HB ASN 76 -10.621 -26.002 -0.585 570 HD21 ASN 76 1HD2 ASN 76 -12.167 -24.398 2.158 571 HD22 ASN 76 2HD2 ASN 76 -13.249 -25.693 2.531 572 H LEU 77 H LEU 77 -9.552 -25.280 3.655 573 HA LEU 77 HA LEU 77 -10.377 -22.554 3.996 574 HB2 LEU 77 1HB LEU 77 -10.913 -24.515 5.517 575 HB3 LEU 77 2HB LEU 77 -9.263 -24.370 6.118 576 HG LEU 77 HG LEU 77 -10.045 -21.865 6.540 577 HD11 LEU 77 1HD1 LEU 77 -12.219 -21.500 6.332 578 HD12 LEU 77 2HD1 LEU 77 -12.552 -22.776 7.503 579 HD13 LEU 77 3HD1 LEU 77 -12.454 -23.160 5.785 580 HD21 LEU 77 1HD2 LEU 77 -9.289 -22.836 8.434 581 HD22 LEU 77 2HD2 LEU 77 -10.165 -24.339 8.147 582 HD23 LEU 77 3HD2 LEU 77 -11.010 -22.937 8.804 583 H VAL 78 H VAL 78 -9.187 -20.809 4.650 584 HA VAL 78 HA VAL 78 -6.381 -21.100 5.315 585 HB VAL 78 HB VAL 78 -7.218 -19.539 2.867 586 HG11 VAL 78 1HG1 VAL 78 -4.394 -19.951 3.765 587 HG12 VAL 78 2HG1 VAL 78 -5.058 -18.720 2.689 588 HG13 VAL 78 3HG1 VAL 78 -5.358 -18.631 4.425 589 HG21 VAL 78 1HG2 VAL 78 -5.581 -21.138 1.760 590 HG22 VAL 78 2HG2 VAL 78 -5.695 -22.107 3.229 591 HG23 VAL 78 3HG2 VAL 78 -7.134 -21.813 2.253 592 H GLN 79 H GLN 79 -5.804 -19.615 6.771 593 HA GLN 79 HA GLN 79 -7.544 -17.261 7.098 594 HB2 GLN 79 1HB GLN 79 -5.949 -18.773 9.172 595 HB3 GLN 79 2HB GLN 79 -6.830 -17.283 9.482 596 HG2 GLN 79 1HG GLN 79 -8.864 -18.300 9.407 597 HG3 GLN 79 2HG GLN 79 -8.321 -19.553 8.292 598 HE21 GLN 79 1HE2 GLN 79 -9.273 -21.150 9.579 599 HE22 GLN 79 2HE2 GLN 79 -8.557 -21.665 11.064 600 H TRP 80 H TRP 80 -6.653 -15.342 6.751 601 HA TRP 80 HA TRP 80 -3.838 -14.897 7.334 602 HB2 TRP 80 1HB TRP 80 -3.226 -14.151 5.170 603 HB3 TRP 80 2HB TRP 80 -4.056 -15.684 4.922 604 HD1 TRP 80 HD TRP 80 -4.362 -11.963 4.206 605 HE1 TRP 80 1HE TRP 80 -6.312 -11.584 2.569 606 HE3 TRP 80 3HE TRP 80 -6.355 -16.672 4.210 607 HZ2 TRP 80 2HZ TRP 80 -8.417 -13.081 1.431 608 HZ3 TRP 80 3HZ TRP 80 -8.337 -17.115 2.821 609 HH2 TRP 80 HH TRP 80 -9.345 -15.355 1.461 610 H GLU 81 H GLU 81 -3.307 -12.730 7.676 611 HA GLU 81 HA GLU 81 -5.628 -10.990 8.086 612 HB2 GLU 81 1HB GLU 81 -2.878 -11.116 9.269 613 HB3 GLU 81 2HB GLU 81 -3.782 -9.608 9.329 614 HG2 GLU 81 1HG GLU 81 -5.081 -12.119 10.264 615 HG3 GLU 81 2HG GLU 81 -3.899 -11.317 11.297 616 H MET 82 H MET 82 -6.015 -9.331 6.782 617 HA MET 82 HA MET 82 -3.943 -8.544 4.863 618 HB2 MET 82 1HB MET 82 -6.919 -8.501 4.865 619 HB3 MET 82 2HB MET 82 -6.090 -7.249 3.949 620 HG2 MET 82 1HG MET 82 -5.270 -10.080 3.562 621 HG3 MET 82 2HG MET 82 -6.779 -9.523 2.843 622 HE1 MET 82 1HE MET 82 -7.055 -8.565 0.854 623 HE2 MET 82 2HE MET 82 -6.539 -6.910 1.178 624 HE3 MET 82 3HE MET 82 -5.884 -7.782 -0.208 625 H GLU 83 H GLU 83 -2.685 -7.051 5.863 626 HA GLU 83 HA GLU 83 -3.986 -4.813 7.237 627 HB2 GLU 83 1HB GLU 83 -2.145 -6.062 8.381 628 HB3 GLU 83 2HB GLU 83 -1.046 -5.501 7.128 629 HG2 GLU 83 1HG GLU 83 -1.580 -3.169 7.781 630 HG3 GLU 83 2HG GLU 83 -2.539 -3.807 9.115 631 H VAL 84 H VAL 84 -4.233 -2.931 6.245 632 HA VAL 84 HA VAL 84 -3.258 -2.478 3.610 633 HB VAL 84 HB VAL 84 -4.602 -0.610 5.565 634 HG11 VAL 84 1HG1 VAL 84 -4.901 0.942 3.767 635 HG12 VAL 84 2HG1 VAL 84 -3.180 0.568 3.887 636 HG13 VAL 84 3HG1 VAL 84 -4.158 -0.169 2.617 637 HG21 VAL 84 1HG2 VAL 84 -6.099 -2.333 4.938 638 HG22 VAL 84 2HG2 VAL 84 -6.523 -0.932 3.953 639 HG23 VAL 84 3HG2 VAL 84 -5.595 -2.256 3.249 640 H CYS 85 H CYS 85 -1.040 -2.440 3.546 641 HA CYS 85 HA CYS 85 0.399 -0.607 5.299 642 HB2 CYS 85 1HB CYS 85 1.121 -3.034 4.628 643 HB3 CYS 85 2HB CYS 85 1.710 -2.254 3.165 644 HG CYS 85 HG CYS 85 3.899 -1.324 4.150 645 H LYS 86 H LYS 86 2.214 0.668 4.214 646 HA LYS 86 HA LYS 86 1.184 1.901 1.743 647 HB2 LYS 86 1HB LYS 86 2.060 4.035 2.517 648 HB3 LYS 86 2HB LYS 86 0.943 3.374 3.703 649 HG2 LYS 86 1HG LYS 86 2.661 2.827 5.190 650 HG3 LYS 86 2HG LYS 86 3.903 2.973 3.944 651 HD2 LYS 86 1HD LYS 86 2.246 5.350 4.683 652 HD3 LYS 86 2HD LYS 86 3.600 4.869 5.709 653 HE2 LYS 86 1HE LYS 86 3.884 5.276 2.743 654 HE3 LYS 86 2HE LYS 86 4.076 6.594 3.899 655 HZ1 LYS 86 1HZ LYS 86 5.960 4.670 3.139 656 HZ2 LYS 86 2HZ LYS 86 5.610 4.425 4.776 657 HZ3 LYS 86 3HZ LYS 86 6.146 5.938 4.244 658 H LEU 87 H LEU 87 2.760 2.779 0.285 659 HA LEU 87 HA LEU 87 5.259 1.257 0.337 660 HB2 LEU 87 1HB LEU 87 3.608 2.526 -1.787 661 HB3 LEU 87 2HB LEU 87 5.338 2.348 -2.069 662 HG LEU 87 HG LEU 87 3.492 0.060 -1.400 663 HD11 LEU 87 1HD1 LEU 87 2.845 -0.027 -3.517 664 HD12 LEU 87 2HD1 LEU 87 4.519 0.002 -4.068 665 HD13 LEU 87 3HD1 LEU 87 3.653 1.514 -3.800 666 HD21 LEU 87 1HD2 LEU 87 5.907 -0.201 -0.847 667 HD22 LEU 87 2HD2 LEU 87 6.277 0.054 -2.552 668 HD23 LEU 87 3HD2 LEU 87 5.319 -1.342 -2.057 669 HA PRO 88 HA PRO 88 7.873 4.701 1.081 670 HB2 PRO 88 1HB PRO 88 9.946 4.248 -0.612 671 HB3 PRO 88 2HB PRO 88 9.662 3.280 0.839 672 HG2 PRO 88 1HG PRO 88 8.965 2.675 -2.008 673 HG3 PRO 88 2HG PRO 88 9.655 1.605 -0.774 674 HD2 PRO 88 1HD PRO 88 7.027 1.572 -1.426 675 HD3 PRO 88 2HD PRO 88 7.608 1.216 0.213 676 H ARG 89 H ARG 89 5.970 4.625 -1.500 677 HA ARG 89 HA ARG 89 6.878 7.243 -2.433 678 HB2 ARG 89 1HB ARG 89 6.629 4.779 -4.091 679 HB3 ARG 89 2HB ARG 89 6.119 6.304 -4.803 680 HG2 ARG 89 1HG ARG 89 8.775 6.201 -3.482 681 HG3 ARG 89 2HG ARG 89 8.585 5.408 -5.047 682 HD2 ARG 89 1HD ARG 89 7.854 7.455 -6.061 683 HD3 ARG 89 2HD ARG 89 7.803 8.265 -4.496 684 HE ARG 89 HE ARG 89 10.084 7.909 -6.160 685 HH11 ARG 89 2HH1 ARG 89 9.060 8.098 -2.838 686 HH12 ARG 89 1HH1 ARG 89 10.593 8.663 -2.261 687 HH21 ARG 89 2HH2 ARG 89 12.107 8.653 -5.413 688 HH22 ARG 89 1HH2 ARG 89 12.325 8.979 -3.727 689 H LEU 90 H LEU 90 5.212 8.518 -1.972 690 HA LEU 90 HA LEU 90 2.682 8.013 -1.303 691 HB2 LEU 90 1HB LEU 90 3.892 10.234 -2.856 692 HB3 LEU 90 2HB LEU 90 2.134 10.164 -2.765 693 HG LEU 90 HG LEU 90 3.015 11.664 -1.079 694 HD11 LEU 90 1HD1 LEU 90 2.249 9.367 0.609 695 HD12 LEU 90 2HD1 LEU 90 1.126 9.806 -0.677 696 HD13 LEU 90 3HD1 LEU 90 1.585 11.000 0.537 697 HD21 LEU 90 1HD2 LEU 90 5.206 10.887 -0.701 698 HD22 LEU 90 2HD2 LEU 90 4.646 9.271 -0.269 699 HD23 LEU 90 3HD2 LEU 90 4.346 10.629 0.817 700 H SER 91 H SER 91 3.978 7.679 -4.513 701 HA SER 91 HA SER 91 2.075 7.755 -6.314 702 HB2 SER 91 1HB SER 91 2.915 5.748 -7.381 703 HB3 SER 91 2HB SER 91 4.266 6.598 -6.631 704 HG SER 91 HG SER 91 3.910 5.130 -4.801 705 H LEU 92 H LEU 92 2.129 5.258 -3.797 706 HA LEU 92 HA LEU 92 -0.673 5.141 -3.573 707 HB2 LEU 92 1HB LEU 92 -0.916 2.766 -4.426 708 HB3 LEU 92 2HB LEU 92 -0.802 4.044 -5.634 709 HG LEU 92 HG LEU 92 1.765 3.351 -5.560 710 HD11 LEU 92 1HD1 LEU 92 1.263 1.652 -3.768 711 HD12 LEU 92 2HD1 LEU 92 2.122 1.044 -5.183 712 HD13 LEU 92 3HD1 LEU 92 0.396 0.733 -4.999 713 HD21 LEU 92 1HD2 LEU 92 -0.507 2.105 -7.074 714 HD22 LEU 92 2HD2 LEU 92 1.173 1.681 -7.405 715 HD23 LEU 92 3HD2 LEU 92 0.628 3.347 -7.605 716 H ASN 93 H ASN 93 -1.228 2.798 -2.509 717 HA ASN 93 HA ASN 93 0.715 2.546 -0.322 718 HB2 ASN 93 1HB ASN 93 -2.239 1.935 -0.476 719 HB3 ASN 93 2HB ASN 93 -1.231 1.457 0.887 720 HD21 ASN 93 1HD2 ASN 93 0.374 3.595 1.248 721 HD22 ASN 93 2HD2 ASN 93 -0.560 4.985 1.675 722 H GLY 94 H GLY 94 0.989 0.375 0.635 723 HA2 GLY 94 1HA GLY 94 0.949 -1.684 -1.482 724 HA3 GLY 94 2HA GLY 94 2.178 -1.576 -0.231 725 H VAL 95 H VAL 95 0.006 -3.605 -1.123 726 HA VAL 95 HA VAL 95 -1.275 -3.998 1.491 727 HB VAL 95 HB VAL 95 -1.897 -5.352 -1.137 728 HG11 VAL 95 1HG1 VAL 95 -3.936 -6.105 0.009 729 HG12 VAL 95 2HG1 VAL 95 -2.475 -6.727 0.780 730 HG13 VAL 95 3HG1 VAL 95 -3.350 -5.379 1.506 731 HG21 VAL 95 1HG2 VAL 95 -2.491 -3.062 -1.354 732 HG22 VAL 95 2HG2 VAL 95 -3.980 -3.943 -1.015 733 HG23 VAL 95 3HG2 VAL 95 -3.191 -3.022 0.265 734 H ARG 96 H ARG 96 -0.075 -5.209 2.810 735 HA ARG 96 HA ARG 96 1.560 -7.370 1.721 736 HB2 ARG 96 1HB ARG 96 2.652 -5.879 3.295 737 HB3 ARG 96 2HB ARG 96 1.401 -6.180 4.494 738 HG2 ARG 96 1HG ARG 96 2.140 -8.377 4.871 739 HG3 ARG 96 2HG ARG 96 3.133 -8.378 3.413 740 HD2 ARG 96 1HD ARG 96 4.656 -6.792 4.386 741 HD3 ARG 96 2HD ARG 96 3.611 -6.591 5.792 742 HE ARG 96 HE ARG 96 5.513 -8.678 5.347 743 HH11 ARG 96 2HH1 ARG 96 2.504 -7.887 6.908 744 HH12 ARG 96 1HH1 ARG 96 2.671 -9.099 8.135 745 HH21 ARG 96 2HH2 ARG 96 5.745 -10.278 6.956 746 HH22 ARG 96 1HH2 ARG 96 4.516 -10.458 8.161 747 H PHE 97 H PHE 97 1.369 -9.516 2.360 748 HA PHE 97 HA PHE 97 -1.223 -10.205 3.573 749 HB2 PHE 97 1HB PHE 97 0.441 -11.512 1.452 750 HB3 PHE 97 2HB PHE 97 -0.649 -12.495 2.425 751 HD1 PHE 97 1HD PHE 97 -0.924 -9.109 0.880 752 HD2 PHE 97 2HD PHE 97 -2.532 -13.034 1.238 753 HE1 PHE 97 1HE PHE 97 -2.797 -8.472 -0.584 754 HE2 PHE 97 2HE PHE 97 -4.407 -12.403 -0.225 755 HZ PHE 97 HZ PHE 97 -4.541 -10.120 -1.139 756 H LYS 98 H LYS 98 -1.337 -11.732 5.196 757 HA LYS 98 HA LYS 98 1.198 -12.795 6.229 758 HB2 LYS 98 1HB LYS 98 0.831 -10.890 7.607 759 HB3 LYS 98 2HB LYS 98 -0.882 -11.251 7.772 760 HG2 LYS 98 1HG LYS 98 -0.047 -11.913 9.810 761 HG3 LYS 98 2HG LYS 98 -0.056 -13.431 8.908 762 HD2 LYS 98 1HD LYS 98 2.370 -12.804 8.278 763 HD3 LYS 98 2HD LYS 98 2.265 -11.676 9.632 764 HE2 LYS 98 1HE LYS 98 2.009 -13.386 11.193 765 HE3 LYS 98 2HE LYS 98 1.512 -14.556 9.971 766 HZ1 LYS 98 1HZ LYS 98 4.104 -13.622 9.383 767 HZ2 LYS 98 2HZ LYS 98 3.603 -15.197 9.743 768 HZ3 LYS 98 3HZ LYS 98 4.062 -14.150 10.990 769 H ARG 99 H ARG 99 1.072 -14.921 6.465 770 HA ARG 99 HA ARG 99 -1.483 -16.259 6.362 771 HB2 ARG 99 1HB ARG 99 0.630 -17.047 5.197 772 HB3 ARG 99 2HB ARG 99 1.221 -17.527 6.782 773 HG2 ARG 99 1HG ARG 99 -0.586 -19.094 7.037 774 HG3 ARG 99 2HG ARG 99 -1.319 -18.544 5.529 775 HD2 ARG 99 1HD ARG 99 -0.217 -20.443 4.836 776 HD3 ARG 99 2HD ARG 99 0.984 -19.196 4.499 777 HE ARG 99 HE ARG 99 2.356 -20.236 5.984 778 HH11 ARG 99 2HH1 ARG 99 -0.935 -21.044 6.785 779 HH12 ARG 99 1HH1 ARG 99 -0.495 -22.117 8.073 780 HH21 ARG 99 2HH2 ARG 99 2.947 -21.646 7.677 781 HH22 ARG 99 1HH2 ARG 99 1.712 -22.458 8.580 782 H ILE 100 H ILE 100 -2.523 -17.294 7.988 783 HA ILE 100 HA ILE 100 -1.292 -17.151 10.663 784 HB ILE 100 HB ILE 100 -4.137 -16.702 9.810 785 HG12 ILE 100 1HG1 ILE 100 -3.620 -14.846 11.672 786 HG13 ILE 100 2HG1 ILE 100 -1.971 -15.155 11.140 787 HG21 ILE 100 1HG2 ILE 100 -4.716 -16.716 12.244 788 HG22 ILE 100 2HG2 ILE 100 -4.341 -18.300 11.568 789 HG23 ILE 100 3HG2 ILE 100 -3.145 -17.457 12.552 790 HD11 ILE 100 1HD1 ILE 100 -3.041 -13.273 9.970 791 HD12 ILE 100 2HD1 ILE 100 -2.546 -14.568 8.880 792 HD13 ILE 100 3HD1 ILE 100 -4.243 -14.389 9.324 793 H SER 101 H SER 101 -3.237 -19.034 8.431 794 HA SER 101 HA SER 101 -2.366 -21.496 9.543 795 HB2 SER 101 1HB SER 101 -5.181 -20.595 10.161 796 HB3 SER 101 2HB SER 101 -4.701 -22.292 10.181 797 HG SER 101 HG SER 101 -2.905 -21.260 11.619 798 H GLY 102 H GLY 102 -3.292 -23.369 8.410 799 HA2 GLY 102 1HA GLY 102 -4.642 -24.246 6.617 800 HA3 GLY 102 2HA GLY 102 -4.608 -22.655 5.872 801 H THR 103 H THR 103 -4.043 -24.725 4.282 802 HA THR 103 HA THR 103 -1.252 -25.363 4.208 803 HB THR 103 HB THR 103 -1.728 -26.443 2.071 804 HG1 THR 103 1HG THR 103 -4.193 -26.329 1.604 805 HG21 THR 103 1HG2 THR 103 -2.247 -27.901 3.794 806 HG22 THR 103 2HG2 THR 103 -3.764 -27.853 2.895 807 HG23 THR 103 3HG2 THR 103 -3.583 -26.906 4.371 808 H SER 104 H SER 104 0.347 -24.529 2.930 809 HA SER 104 HA SER 104 0.294 -21.842 2.241 810 HB2 SER 104 1HB SER 104 2.093 -23.815 0.846 811 HB3 SER 104 2HB SER 104 2.441 -22.152 1.318 812 HG SER 104 HG SER 104 2.302 -22.880 3.519 813 H ILE 105 H ILE 105 0.039 -24.664 0.084 814 HA ILE 105 HA ILE 105 -0.127 -23.585 -2.367 815 HB ILE 105 HB ILE 105 -1.942 -25.696 -1.208 816 HG12 ILE 105 1HG1 ILE 105 0.428 -26.280 -1.266 817 HG13 ILE 105 2HG1 ILE 105 -0.458 -27.224 -2.459 818 HG21 ILE 105 1HG2 ILE 105 -2.990 -24.599 -3.162 819 HG22 ILE 105 2HG2 ILE 105 -1.569 -25.013 -4.120 820 HG23 ILE 105 3HG2 ILE 105 -2.586 -26.291 -3.454 821 HD11 ILE 105 1HD1 ILE 105 0.415 -24.911 -3.781 822 HD12 ILE 105 2HD1 ILE 105 1.778 -25.488 -2.822 823 HD13 ILE 105 3HD1 ILE 105 0.998 -26.563 -3.981 824 H ALA 106 H ALA 106 -3.078 -24.009 -0.402 825 HA ALA 106 HA ALA 106 -4.796 -22.520 -1.968 826 HB1 ALA 106 1HB ALA 106 -6.135 -22.204 0.110 827 HB2 ALA 106 2HB ALA 106 -5.648 -23.873 -0.189 828 HB3 ALA 106 3HB ALA 106 -4.798 -22.909 1.019 829 H PHE 107 H PHE 107 -2.675 -21.414 0.645 830 HA PHE 107 HA PHE 107 -3.484 -18.814 0.941 831 HB2 PHE 107 1HB PHE 107 -1.629 -20.000 2.188 832 HB3 PHE 107 2HB PHE 107 -0.580 -19.633 0.824 833 HD1 PHE 107 1HD PHE 107 -2.615 -18.135 3.514 834 HD2 PHE 107 2HD PHE 107 0.390 -17.502 0.567 835 HE1 PHE 107 1HE PHE 107 -2.121 -15.932 4.495 836 HE2 PHE 107 2HE PHE 107 0.889 -15.299 1.543 837 HZ PHE 107 HZ PHE 107 -0.367 -14.512 3.510 838 H LYS 108 H LYS 108 -0.891 -19.856 -1.278 839 HA LYS 108 HA LYS 108 -0.750 -17.365 -2.620 840 HB2 LYS 108 1HB LYS 108 0.234 -20.123 -3.346 841 HB3 LYS 108 2HB LYS 108 0.534 -18.710 -4.349 842 HG2 LYS 108 1HG LYS 108 2.033 -17.815 -2.888 843 HG3 LYS 108 2HG LYS 108 1.271 -18.556 -1.479 844 HD2 LYS 108 1HD LYS 108 2.533 -20.347 -3.489 845 HD3 LYS 108 2HD LYS 108 3.593 -19.413 -2.430 846 HE2 LYS 108 1HE LYS 108 3.318 -21.281 -1.147 847 HE3 LYS 108 2HE LYS 108 1.953 -20.325 -0.572 848 HZ1 LYS 108 1HZ LYS 108 1.676 -22.255 -2.796 849 HZ2 LYS 108 2HZ LYS 108 0.459 -21.575 -1.839 850 HZ3 LYS 108 3HZ LYS 108 1.506 -22.729 -1.180 851 H ASN 109 H ASN 109 -2.306 -20.450 -3.433 852 HA ASN 109 HA ASN 109 -3.222 -19.907 -5.965 853 HB2 ASN 109 1HB ASN 109 -4.200 -21.600 -3.724 854 HB3 ASN 109 2HB ASN 109 -5.315 -21.310 -5.056 855 HD21 ASN 109 1HD2 ASN 109 -2.483 -22.929 -4.008 856 HD22 ASN 109 2HD2 ASN 109 -2.191 -23.826 -5.456 857 H ILE 110 H ILE 110 -4.677 -18.962 -2.881 858 HA ILE 110 HA ILE 110 -6.877 -17.614 -4.188 859 HB ILE 110 HB ILE 110 -7.109 -18.758 -1.968 860 HG12 ILE 110 1HG1 ILE 110 -8.423 -16.846 -0.932 861 HG13 ILE 110 2HG1 ILE 110 -7.813 -15.833 -2.235 862 HG21 ILE 110 1HG2 ILE 110 -5.028 -16.825 -1.298 863 HG22 ILE 110 2HG2 ILE 110 -6.367 -16.846 -0.152 864 HG23 ILE 110 3HG2 ILE 110 -5.480 -18.330 -0.497 865 HD11 ILE 110 1HD1 ILE 110 -8.865 -17.344 -3.863 866 HD12 ILE 110 2HD1 ILE 110 -9.529 -18.285 -2.527 867 HD13 ILE 110 3HD1 ILE 110 -10.027 -16.609 -2.759 868 H ALA 111 H ALA 111 -3.718 -16.835 -3.059 869 HA ALA 111 HA ALA 111 -4.071 -14.060 -2.617 870 HB1 ALA 111 1HB ALA 111 -1.463 -15.148 -3.563 871 HB2 ALA 111 2HB ALA 111 -1.800 -13.958 -2.305 872 HB3 ALA 111 3HB ALA 111 -2.096 -15.670 -2.001 873 H SER 112 H SER 112 -3.555 -15.986 -5.475 874 HA SER 112 HA SER 112 -2.712 -13.892 -7.193 875 HB2 SER 112 1HB SER 112 -2.412 -16.337 -7.657 876 HB3 SER 112 2HB SER 112 -4.144 -16.443 -7.971 877 HG SER 112 HG SER 112 -3.530 -14.547 -9.486 878 H LYS 113 H LYS 113 -5.877 -15.349 -6.533 879 HA LYS 113 HA LYS 113 -7.351 -13.852 -8.398 880 HB2 LYS 113 1HB LYS 113 -8.113 -15.221 -5.824 881 HB3 LYS 113 2HB LYS 113 -9.297 -14.375 -6.813 882 HG2 LYS 113 1HG LYS 113 -7.548 -16.537 -7.938 883 HG3 LYS 113 2HG LYS 113 -9.077 -16.889 -7.131 884 HD2 LYS 113 1HD LYS 113 -8.962 -14.868 -9.337 885 HD3 LYS 113 2HD LYS 113 -9.032 -16.591 -9.711 886 HE2 LYS 113 1HE LYS 113 -11.158 -16.821 -8.893 887 HE3 LYS 113 2HE LYS 113 -10.975 -15.497 -7.743 888 HZ1 LYS 113 1HZ LYS 113 -11.000 -14.933 -10.632 889 HZ2 LYS 113 2HZ LYS 113 -11.435 -13.928 -9.343 890 HZ3 LYS 113 3HZ LYS 113 -12.460 -15.187 -9.816 891 H ILE 114 H ILE 114 -7.267 -13.392 -4.858 892 HA ILE 114 HA ILE 114 -8.595 -11.082 -4.548 893 HB ILE 114 HB ILE 114 -5.926 -11.648 -3.252 894 HG12 ILE 114 1HG1 ILE 114 -7.505 -13.496 -2.959 895 HG13 ILE 114 2HG1 ILE 114 -7.267 -12.640 -1.440 896 HG21 ILE 114 1HG2 ILE 114 -7.145 -10.306 -1.373 897 HG22 ILE 114 2HG2 ILE 114 -6.330 -9.456 -2.684 898 HG23 ILE 114 3HG2 ILE 114 -8.082 -9.657 -2.718 899 HD11 ILE 114 1HD1 ILE 114 -9.428 -11.352 -2.521 900 HD12 ILE 114 2HD1 ILE 114 -9.680 -13.028 -3.011 901 HD13 ILE 114 3HD1 ILE 114 -9.485 -12.628 -1.305 902 H ALA 115 H ALA 115 -5.238 -11.317 -5.668 903 HA ALA 115 HA ALA 115 -4.765 -8.544 -5.867 904 HB1 ALA 115 1HB ALA 115 -3.447 -10.612 -7.602 905 HB2 ALA 115 2HB ALA 115 -2.782 -9.094 -6.998 906 HB3 ALA 115 3HB ALA 115 -3.062 -10.437 -5.890 907 H ASN 116 H ASN 116 -5.158 -10.826 -8.583 908 HA ASN 116 HA ASN 116 -5.491 -9.070 -10.627 909 HB2 ASN 116 1HB ASN 116 -6.739 -11.753 -10.111 910 HB3 ASN 116 2HB ASN 116 -7.138 -10.853 -11.571 911 HD21 ASN 116 1HD2 ASN 116 -4.469 -12.212 -9.724 912 HD22 ASN 116 2HD2 ASN 116 -3.424 -12.467 -11.076 913 H GLU 117 H GLU 117 -8.016 -10.163 -8.391 914 HA GLU 117 HA GLU 117 -10.145 -8.765 -9.607 915 HB2 GLU 117 1HB GLU 117 -9.829 -9.607 -6.720 916 HB3 GLU 117 2HB GLU 117 -11.336 -9.125 -7.487 917 HG2 GLU 117 1HG GLU 117 -9.696 -11.583 -8.001 918 HG3 GLU 117 2HG GLU 117 -11.352 -11.476 -7.408 919 H LEU 118 H LEU 118 -7.742 -7.847 -7.226 920 HA LEU 118 HA LEU 118 -9.019 -5.260 -6.800 921 HB2 LEU 118 1HB LEU 118 -6.775 -6.750 -5.517 922 HB3 LEU 118 2HB LEU 118 -6.863 -4.999 -5.334 923 HG LEU 118 HG LEU 118 -9.273 -6.616 -4.666 924 HD11 LEU 118 1HD1 LEU 118 -8.414 -6.921 -2.369 925 HD12 LEU 118 2HD1 LEU 118 -6.826 -6.390 -2.921 926 HD13 LEU 118 3HD1 LEU 118 -7.534 -7.870 -3.568 927 HD21 LEU 118 1HD2 LEU 118 -9.889 -4.548 -4.112 928 HD22 LEU 118 2HD2 LEU 118 -8.238 -3.939 -4.235 929 HD23 LEU 118 3HD2 LEU 118 -8.791 -4.695 -2.739 930 H LYS 119 H LYS 119 -7.611 -6.225 -9.339 931 HA LYS 119 HA LYS 119 -6.178 -5.426 -10.928 932 HB2 LYS 119 1HB LYS 119 -7.151 -2.884 -9.623 933 HB3 LYS 119 2HB LYS 119 -6.176 -2.894 -11.087 934 HG2 LYS 119 1HG LYS 119 -8.800 -4.342 -10.851 935 HG3 LYS 119 2HG LYS 119 -8.654 -2.678 -11.424 936 HD2 LYS 119 1HD LYS 119 -7.065 -4.904 -12.661 937 HD3 LYS 119 2HD LYS 119 -8.719 -4.561 -13.172 938 HE2 LYS 119 1HE LYS 119 -8.082 -2.271 -13.721 939 HE3 LYS 119 2HE LYS 119 -6.436 -2.588 -13.176 940 HZ1 LYS 119 1HZ LYS 119 -6.823 -2.719 -15.638 941 HZ2 LYS 119 2HZ LYS 119 -7.721 -4.124 -15.359 942 HZ3 LYS 119 3HZ LYS 119 -6.081 -4.075 -14.950 943 H LEU 120 H LEU 120 -5.020 -6.078 -8.284 944 HA LEU 120 HA LEU 120 -2.963 -4.175 -7.734 945 HB2 LEU 120 1HB LEU 120 -3.213 -7.072 -6.942 946 HB3 LEU 120 2HB LEU 120 -2.033 -5.938 -6.290 947 HG LEU 120 HG LEU 120 -5.026 -5.826 -5.929 948 HD11 LEU 120 1HD1 LEU 120 -4.727 -6.968 -4.051 949 HD12 LEU 120 2HD1 LEU 120 -3.428 -5.891 -3.539 950 HD13 LEU 120 3HD1 LEU 120 -3.069 -7.279 -4.566 951 HD21 LEU 120 1HD2 LEU 120 -2.882 -3.843 -5.475 952 HD22 LEU 120 2HD2 LEU 120 -4.071 -4.031 -4.186 953 HD23 LEU 120 3HD2 LEU 120 -4.597 -3.607 -5.816 954 H SER 121 H SER 121 -0.605 -5.165 -7.619 955 HA SER 121 HA SER 121 0.382 -5.269 -10.207 956 HB2 SER 121 1HB SER 121 1.664 -4.793 -8.058 957 HB3 SER 121 2HB SER 121 1.768 -6.540 -7.843 958 HG SER 121 HG SER 121 3.583 -5.992 -8.934 959 H GLY 122 H GLY 122 0.318 -8.019 -7.925 960 HA2 GLY 122 1HA GLY 122 -0.394 -10.206 -8.388 961 HA3 GLY 122 2HA GLY 122 -0.493 -9.790 -10.093 962 HA PRO 123 HA PRO 123 4.182 -10.659 -9.180 963 HB2 PRO 123 1HB PRO 123 4.759 -11.735 -6.755 964 HB3 PRO 123 2HB PRO 123 4.742 -9.993 -7.054 965 HG2 PRO 123 1HG PRO 123 2.636 -11.724 -5.816 966 HG3 PRO 123 2HG PRO 123 3.205 -10.121 -5.313 967 HD2 PRO 123 1HD PRO 123 0.915 -10.480 -6.712 968 HD3 PRO 123 2HD PRO 123 1.926 -9.032 -6.892 969 H SER 124 H SER 124 5.480 -12.742 -8.839 970 HA SER 124 HA SER 124 4.149 -15.202 -8.429 971 HB2 SER 124 1HB SER 124 3.914 -16.041 -10.646 972 HB3 SER 124 2HB SER 124 3.156 -14.448 -10.647 973 HG SER 124 HG SER 124 5.460 -15.326 -11.917 974 H SER 125 H SER 125 5.624 -16.734 -8.016 975 HA SER 125 HA SER 125 8.401 -16.210 -8.852 976 HB2 SER 125 1HB SER 125 8.143 -15.997 -6.436 977 HB3 SER 125 2HB SER 125 7.391 -17.590 -6.352 978 HG SER 125 HG SER 125 9.351 -18.494 -7.029 979 H GLY 126 H GLY 126 9.738 -18.052 -9.306 980 HA2 GLY 126 1HA GLY 126 8.207 -20.201 -10.561 981 HA3 GLY 126 2HA GLY 126 9.908 -19.846 -10.825 Start of MODEL 10 1 H1 MET 1 H MET 1 12.681 29.485 -5.227 2 HA MET 1 HA MET 1 12.140 26.738 -4.696 3 HB2 MET 1 1HB MET 1 11.229 26.892 -2.492 4 HB3 MET 1 2HB MET 1 12.854 27.562 -2.436 5 HG2 MET 1 1HG MET 1 11.748 29.136 -1.234 6 HG3 MET 1 2HG MET 1 11.572 29.821 -2.848 7 HE1 MET 1 1HE MET 1 9.311 30.978 -0.774 8 HE2 MET 1 2HE MET 1 9.825 31.285 -2.433 9 HE3 MET 1 3HE MET 1 8.137 30.905 -2.089 10 H LYS 2 H LYS 2 10.206 26.261 -5.525 11 HA LYS 2 HA LYS 2 7.977 28.065 -5.374 12 HB2 LYS 2 1HB LYS 2 9.556 27.780 -7.883 13 HB3 LYS 2 2HB LYS 2 7.804 27.845 -8.023 14 HG2 LYS 2 1HG LYS 2 7.962 29.961 -6.585 15 HG3 LYS 2 2HG LYS 2 9.682 29.932 -6.981 16 HD2 LYS 2 1HD LYS 2 9.159 30.002 -9.354 17 HD3 LYS 2 2HD LYS 2 7.432 29.952 -8.993 18 HE2 LYS 2 1HE LYS 2 9.265 32.123 -7.999 19 HE3 LYS 2 2HE LYS 2 8.385 32.228 -9.523 20 HZ1 LYS 2 1HZ LYS 2 7.001 33.292 -8.029 21 HZ2 LYS 2 2HZ LYS 2 7.320 32.204 -6.774 22 HZ3 LYS 2 3HZ LYS 2 6.343 31.734 -8.073 23 H ASP 3 H ASP 3 6.406 26.709 -4.839 24 HA ASP 3 HA ASP 3 6.450 23.956 -5.765 25 HB2 ASP 3 1HB ASP 3 4.627 25.421 -3.848 26 HB3 ASP 3 2HB ASP 3 4.458 23.716 -4.257 27 H HIS 4 H HIS 4 5.810 23.792 -7.844 28 HA HIS 4 HA HIS 4 3.290 25.100 -8.616 29 HB2 HIS 4 1HB HIS 4 5.516 25.502 -9.901 30 HB3 HIS 4 2HB HIS 4 5.223 23.903 -10.578 31 HD1 HIS 4 1HD HIS 4 4.955 25.041 -12.926 32 HD2 HIS 4 2HD HIS 4 2.097 26.133 -10.114 33 HE1 HIS 4 1HE HIS 4 3.119 26.156 -14.232 34 HE2 HIS 4 2HE HIS 4 1.441 26.885 -12.501 35 H LEU 5 H LEU 5 2.224 23.766 -10.519 36 HA LEU 5 HA LEU 5 0.861 21.671 -9.601 37 HB2 LEU 5 1HB LEU 5 0.328 21.066 -11.775 38 HB3 LEU 5 2HB LEU 5 0.800 22.758 -11.920 39 HG LEU 5 HG LEU 5 2.620 20.442 -12.564 40 HD11 LEU 5 1HD1 LEU 5 0.871 22.101 -14.372 41 HD12 LEU 5 2HD1 LEU 5 0.773 20.362 -14.093 42 HD13 LEU 5 3HD1 LEU 5 2.169 21.044 -14.929 43 HD21 LEU 5 1HD2 LEU 5 3.635 22.654 -11.944 44 HD22 LEU 5 2HD2 LEU 5 2.831 23.340 -13.356 45 HD23 LEU 5 3HD2 LEU 5 4.038 22.069 -13.559 46 H ILE 6 H ILE 6 1.013 19.427 -9.484 47 HA ILE 6 HA ILE 6 3.770 18.406 -9.435 48 HB ILE 6 HB ILE 6 3.078 17.910 -7.335 49 HG12 ILE 6 1HG1 ILE 6 1.745 15.662 -8.862 50 HG13 ILE 6 2HG1 ILE 6 3.452 15.742 -8.437 51 HG21 ILE 6 1HG2 ILE 6 0.261 17.741 -8.392 52 HG22 ILE 6 2HG2 ILE 6 0.711 17.472 -6.709 53 HG23 ILE 6 3HG2 ILE 6 0.971 19.052 -7.450 54 HD11 ILE 6 1HD1 ILE 6 1.109 15.083 -6.773 55 HD12 ILE 6 2HD1 ILE 6 2.752 14.442 -6.736 56 HD13 ILE 6 3HD1 ILE 6 2.399 16.006 -6.002 57 H HIS 7 H HIS 7 4.141 16.198 -10.125 58 HA HIS 7 HA HIS 7 4.049 14.513 -11.651 59 HB2 HIS 7 1HB HIS 7 1.751 14.302 -10.378 60 HB3 HIS 7 2HB HIS 7 1.086 14.826 -11.922 61 HD1 HIS 7 1HD HIS 7 0.072 12.695 -12.752 62 HD2 HIS 7 2HD HIS 7 4.005 12.201 -11.507 63 HE1 HIS 7 1HE HIS 7 0.700 10.354 -13.420 64 HE2 HIS 7 2HE HIS 7 3.054 10.048 -12.581 65 H ASN 8 H ASN 8 4.863 16.725 -12.799 66 HA ASN 8 HA ASN 8 3.191 17.331 -15.109 67 HB2 ASN 8 1HB ASN 8 4.286 19.189 -13.918 68 HB3 ASN 8 2HB ASN 8 5.861 18.486 -14.273 69 HD21 ASN 8 1HD2 ASN 8 6.333 20.520 -15.280 70 HD22 ASN 8 2HD2 ASN 8 5.802 20.824 -16.896 71 H VAL 9 H VAL 9 4.365 14.690 -14.839 72 HA VAL 9 HA VAL 9 5.869 14.652 -17.359 73 HB VAL 9 HB VAL 9 7.306 12.818 -16.437 74 HG11 VAL 9 1HG1 VAL 9 7.722 15.467 -16.448 75 HG12 VAL 9 2HG1 VAL 9 7.895 15.149 -14.720 76 HG13 VAL 9 3HG1 VAL 9 8.920 14.304 -15.881 77 HG21 VAL 9 1HG2 VAL 9 6.129 12.044 -14.558 78 HG22 VAL 9 2HG2 VAL 9 7.536 12.876 -13.896 79 HG23 VAL 9 3HG2 VAL 9 5.960 13.667 -13.888 80 H HIS 10 H HIS 10 4.500 13.634 -18.681 81 HA HIS 10 HA HIS 10 3.508 10.997 -17.864 82 HB2 HIS 10 1HB HIS 10 1.705 12.744 -17.611 83 HB3 HIS 10 2HB HIS 10 1.796 12.995 -19.352 84 HD1 HIS 10 1HD HIS 10 1.969 10.041 -20.252 85 HD2 HIS 10 2HD HIS 10 -0.709 11.489 -17.425 86 HE1 HIS 10 1HE HIS 10 0.059 8.405 -20.235 87 HE2 HIS 10 2HE HIS 10 -1.588 9.348 -18.579 88 H LYS 11 H LYS 11 4.132 9.519 -19.279 89 HA LYS 11 HA LYS 11 4.983 10.350 -21.944 90 HB2 LYS 11 1HB LYS 11 5.476 7.970 -20.210 91 HB3 LYS 11 2HB LYS 11 5.630 7.782 -21.952 92 HG2 LYS 11 1HG LYS 11 7.081 9.899 -20.386 93 HG3 LYS 11 2HG LYS 11 7.752 8.302 -20.726 94 HD2 LYS 11 1HD LYS 11 7.747 8.700 -23.064 95 HD3 LYS 11 2HD LYS 11 6.750 10.145 -22.886 96 HE2 LYS 11 1HE LYS 11 8.985 10.865 -23.286 97 HE3 LYS 11 2HE LYS 11 8.627 11.173 -21.587 98 HZ1 LYS 11 1HZ LYS 11 9.943 8.663 -22.392 99 HZ2 LYS 11 2HZ LYS 11 9.990 9.460 -20.901 100 HZ3 LYS 11 3HZ LYS 11 10.853 10.079 -22.218 101 H GLU 12 H GLU 12 4.410 8.973 -23.811 102 HA GLU 12 HA GLU 12 1.570 8.267 -23.683 103 HB2 GLU 12 1HB GLU 12 3.417 9.036 -25.923 104 HB3 GLU 12 2HB GLU 12 1.892 8.228 -26.256 105 HG2 GLU 12 1HG GLU 12 0.657 10.017 -25.242 106 HG3 GLU 12 2HG GLU 12 2.146 10.798 -24.713 107 H GLU 13 H GLU 13 2.153 6.246 -22.565 108 HA GLU 13 HA GLU 13 2.627 4.129 -24.524 109 HB2 GLU 13 1HB GLU 13 4.270 4.654 -22.078 110 HB3 GLU 13 2HB GLU 13 4.015 2.996 -22.603 111 HG2 GLU 13 1HG GLU 13 5.186 5.186 -24.303 112 HG3 GLU 13 2HG GLU 13 6.113 3.959 -23.442 113 H HIS 14 H HIS 14 2.231 1.919 -23.428 114 HA HIS 14 HA HIS 14 -0.402 1.983 -22.335 115 HB2 HIS 14 1HB HIS 14 1.552 -0.278 -22.775 116 HB3 HIS 14 2HB HIS 14 -0.086 -0.514 -22.173 117 HD1 HIS 14 1HD HIS 14 -0.896 -1.819 -24.207 118 HD2 HIS 14 2HD HIS 14 0.622 1.932 -25.150 119 HE1 HIS 14 1HE HIS 14 -1.527 -1.422 -26.608 120 HE2 HIS 14 2HE HIS 14 -0.524 0.816 -27.182 121 H ALA 15 H ALA 15 2.641 0.651 -21.027 122 HA ALA 15 HA ALA 15 2.251 1.785 -18.456 123 HB1 ALA 15 1HB ALA 15 1.054 -0.827 -18.964 124 HB2 ALA 15 2HB ALA 15 2.145 -0.809 -17.578 125 HB3 ALA 15 3HB ALA 15 0.782 0.309 -17.643 126 H HIS 16 H HIS 16 4.298 2.226 -17.987 127 HA HIS 16 HA HIS 16 6.473 0.631 -18.974 128 HB2 HIS 16 1HB HIS 16 6.640 2.856 -16.940 129 HB3 HIS 16 2HB HIS 16 7.911 2.281 -18.015 130 HD1 HIS 16 1HD HIS 16 7.864 3.104 -20.456 131 HD2 HIS 16 2HD HIS 16 4.782 4.603 -18.108 132 HE1 HIS 16 1HE HIS 16 6.844 4.972 -21.797 133 HE2 HIS 16 2HE HIS 16 5.037 5.919 -20.320 134 H ALA 17 H ALA 17 8.121 -0.338 -17.635 135 HA ALA 17 HA ALA 17 6.964 -1.589 -15.251 136 HB1 ALA 17 1HB ALA 17 9.448 -2.769 -15.868 137 HB2 ALA 17 2HB ALA 17 7.835 -3.446 -16.093 138 HB3 ALA 17 3HB ALA 17 8.597 -2.532 -17.395 139 H HIS 18 H HIS 18 7.839 -1.392 -13.251 140 HA HIS 18 HA HIS 18 9.748 0.739 -12.847 141 HB2 HIS 18 1HB HIS 18 8.266 -1.041 -10.903 142 HB3 HIS 18 2HB HIS 18 9.341 0.268 -10.420 143 HD1 HIS 18 1HD HIS 18 7.605 1.774 -9.374 144 HD2 HIS 18 2HD HIS 18 6.658 0.674 -13.267 145 HE1 HIS 18 1HE HIS 18 5.639 3.204 -10.017 146 HE2 HIS 18 2HE HIS 18 5.030 2.460 -12.346 147 H ASN 19 H ASN 19 10.439 -2.002 -14.022 148 HA ASN 19 HA ASN 19 12.239 -3.392 -14.031 149 HB2 ASN 19 1HB ASN 19 13.334 -1.302 -12.140 150 HB3 ASN 19 2HB ASN 19 14.285 -2.631 -12.795 151 HD21 ASN 19 1HD2 ASN 19 12.089 -0.084 -13.929 152 HD22 ASN 19 2HD2 ASN 19 13.032 0.347 -15.312 153 H LYS 20 H LYS 20 10.288 -4.427 -12.631 154 HA LYS 20 HA LYS 20 11.388 -5.252 -10.033 155 HB2 LYS 20 1HB LYS 20 8.625 -5.989 -10.873 156 HB3 LYS 20 2HB LYS 20 9.245 -5.605 -9.272 157 HG2 LYS 20 1HG LYS 20 8.092 -3.703 -9.584 158 HG3 LYS 20 2HG LYS 20 9.541 -3.215 -10.467 159 HD2 LYS 20 1HD LYS 20 7.721 -2.696 -11.879 160 HD3 LYS 20 2HD LYS 20 8.430 -4.172 -12.537 161 HE2 LYS 20 1HE LYS 20 6.177 -4.668 -12.574 162 HE3 LYS 20 2HE LYS 20 6.675 -5.365 -11.033 163 HZ1 LYS 20 1HZ LYS 20 5.707 -2.595 -11.091 164 HZ2 LYS 20 2HZ LYS 20 5.615 -3.739 -9.849 165 HZ3 LYS 20 3HZ LYS 20 4.579 -3.853 -11.181 166 H ASP 21 H ASP 21 12.908 -6.588 -11.368 167 HA ASP 21 HA ASP 21 11.708 -9.230 -11.816 168 HB2 ASP 21 1HB ASP 21 12.053 -8.178 -14.016 169 HB3 ASP 21 2HB ASP 21 13.753 -7.929 -13.627 170 H TYR 22 H TYR 22 12.517 -9.746 -9.724 171 HA TYR 22 HA TYR 22 15.422 -10.230 -9.703 172 HB2 TYR 22 1HB TYR 22 14.994 -10.043 -7.086 173 HB3 TYR 22 2HB TYR 22 15.354 -8.627 -8.066 174 HD1 TYR 22 2HD TYR 22 13.116 -7.582 -9.188 175 HD2 TYR 22 1HD TYR 22 13.277 -9.820 -5.573 176 HE1 TYR 22 2HE TYR 22 11.014 -6.536 -8.453 177 HE2 TYR 22 1HE TYR 22 11.176 -8.781 -4.829 178 HH TYR 22 HH TYR 22 9.841 -6.825 -5.243 179 H ASP 23 H ASP 23 15.870 -11.830 -7.734 180 HA ASP 23 HA ASP 23 14.216 -14.178 -8.293 181 HB2 ASP 23 1HB ASP 23 16.507 -14.644 -8.634 182 HB3 ASP 23 2HB ASP 23 16.980 -13.818 -7.151 183 H ILE 24 H ILE 24 12.583 -12.937 -6.875 184 HA ILE 24 HA ILE 24 12.892 -12.674 -4.119 185 HB ILE 24 HB ILE 24 10.241 -13.535 -5.166 186 HG12 ILE 24 1HG1 ILE 24 10.145 -10.930 -5.825 187 HG13 ILE 24 2HG1 ILE 24 11.837 -11.250 -6.191 188 HG21 ILE 24 1HG2 ILE 24 11.250 -11.440 -3.261 189 HG22 ILE 24 2HG2 ILE 24 9.571 -11.519 -3.791 190 HG23 ILE 24 3HG2 ILE 24 10.278 -12.868 -2.902 191 HD11 ILE 24 1HD1 ILE 24 10.480 -13.369 -7.342 192 HD12 ILE 24 2HD1 ILE 24 9.462 -11.965 -7.661 193 HD13 ILE 24 3HD1 ILE 24 11.150 -11.963 -8.170 194 HA PRO 25 HA PRO 25 13.075 -16.847 -2.690 195 HB2 PRO 25 1HB PRO 25 12.488 -16.377 -0.081 196 HB3 PRO 25 2HB PRO 25 14.055 -15.986 -0.799 197 HG2 PRO 25 1HG PRO 25 11.723 -14.192 -0.248 198 HG3 PRO 25 2HG PRO 25 13.451 -13.895 0.020 199 HD2 PRO 25 1HD PRO 25 12.116 -12.903 -2.117 200 HD3 PRO 25 2HD PRO 25 13.830 -13.361 -2.190 201 H THR 26 H THR 26 11.622 -18.027 -0.774 202 HA THR 26 HA THR 26 8.856 -17.846 -1.774 203 HB THR 26 HB THR 26 9.988 -19.971 -2.341 204 HG1 THR 26 1HG THR 26 8.090 -20.861 -2.081 205 HG21 THR 26 1HG2 THR 26 9.910 -21.220 0.230 206 HG22 THR 26 2HG2 THR 26 10.933 -19.786 0.316 207 HG23 THR 26 3HG2 THR 26 11.274 -21.042 -0.873 208 H THR 27 H THR 27 9.671 -16.170 0.293 209 HA THR 27 HA THR 27 9.310 -17.124 2.886 210 HB THR 27 HB THR 27 10.167 -14.874 2.414 211 HG1 THR 27 1HG THR 27 8.603 -13.782 3.964 212 HG21 THR 27 1HG2 THR 27 8.353 -13.093 1.986 213 HG22 THR 27 2HG2 THR 27 7.376 -14.439 1.397 214 HG23 THR 27 3HG2 THR 27 8.912 -14.056 0.619 215 H GLU 28 H GLU 28 7.461 -16.682 4.341 216 HA GLU 28 HA GLU 28 5.012 -17.631 3.113 217 HB2 GLU 28 1HB GLU 28 5.708 -17.094 6.005 218 HB3 GLU 28 2HB GLU 28 4.199 -17.805 5.450 219 HG2 GLU 28 1HG GLU 28 6.867 -19.032 4.839 220 HG3 GLU 28 2HG GLU 28 5.975 -19.389 6.317 221 H ASN 29 H ASN 29 5.680 -15.045 2.299 222 HA ASN 29 HA ASN 29 3.310 -13.621 3.173 223 HB2 ASN 29 1HB ASN 29 6.038 -12.327 3.377 224 HB3 ASN 29 2HB ASN 29 4.491 -11.556 3.714 225 HD21 ASN 29 1HD2 ASN 29 7.106 -12.889 5.112 226 HD22 ASN 29 2HD2 ASN 29 6.423 -13.389 6.619 227 H LEU 30 H LEU 30 2.378 -12.596 1.513 228 HA LEU 30 HA LEU 30 3.894 -12.400 -0.993 229 HB2 LEU 30 1HB LEU 30 0.971 -12.608 -0.365 230 HB3 LEU 30 2HB LEU 30 1.526 -12.038 -1.937 231 HG LEU 30 HG LEU 30 2.207 -14.729 -0.756 232 HD11 LEU 30 1HD1 LEU 30 0.404 -15.648 -1.746 233 HD12 LEU 30 2HD1 LEU 30 0.434 -14.518 -3.099 234 HD13 LEU 30 3HD1 LEU 30 -0.264 -14.027 -1.556 235 HD21 LEU 30 1HD2 LEU 30 2.580 -14.991 -3.387 236 HD22 LEU 30 2HD2 LEU 30 3.857 -14.468 -2.288 237 HD23 LEU 30 3HD2 LEU 30 2.953 -13.275 -3.223 238 H TYR 31 H TYR 31 4.409 -10.485 -1.835 239 HA TYR 31 HA TYR 31 3.305 -8.079 -0.558 240 HB2 TYR 31 1HB TYR 31 5.787 -8.252 -2.270 241 HB3 TYR 31 2HB TYR 31 5.296 -6.924 -1.224 242 HD1 TYR 31 1HD TYR 31 4.639 -8.160 1.285 243 HD2 TYR 31 2HD TYR 31 7.741 -9.166 -1.448 244 HE1 TYR 31 1HE TYR 31 5.942 -9.129 3.131 245 HE2 TYR 31 2HE TYR 31 9.052 -10.140 0.391 246 HH TYR 31 HH TYR 31 8.916 -10.892 2.553 247 H PHE 32 H PHE 32 1.863 -6.941 -1.652 248 HA PHE 32 HA PHE 32 1.873 -7.109 -4.594 249 HB2 PHE 32 1HB PHE 32 -0.507 -6.635 -2.787 250 HB3 PHE 32 2HB PHE 32 -0.544 -6.768 -4.542 251 HD1 PHE 32 2HD PHE 32 -0.211 -8.926 -5.634 252 HD2 PHE 32 1HD PHE 32 -0.322 -8.572 -1.393 253 HE1 PHE 32 2HE PHE 32 -0.539 -11.357 -5.443 254 HE2 PHE 32 1HE PHE 32 -0.649 -11.003 -1.196 255 HZ PHE 32 HZ PHE 32 -0.759 -12.398 -3.222 256 H GLN 33 H GLN 33 1.290 -5.213 -5.764 257 HA GLN 33 HA GLN 33 1.311 -2.705 -4.253 258 HB2 GLN 33 1HB GLN 33 3.143 -3.315 -6.579 259 HB3 GLN 33 2HB GLN 33 2.953 -1.735 -5.831 260 HG2 GLN 33 1HG GLN 33 4.081 -2.346 -3.927 261 HG3 GLN 33 2HG GLN 33 3.735 -4.061 -4.143 262 HE21 GLN 33 1HE2 GLN 33 5.837 -1.441 -4.926 263 HE22 GLN 33 2HE2 GLN 33 7.048 -2.372 -5.734 264 H GLY 34 H GLY 34 -0.528 -1.738 -4.802 265 HA2 GLY 34 1HA GLY 34 -1.078 -0.816 -7.381 266 HA3 GLY 34 2HA GLY 34 -1.991 -2.299 -7.151 267 H SER 35 H SER 35 -1.431 0.927 -5.817 268 HA SER 35 HA SER 35 -3.683 0.828 -4.059 269 HB2 SER 35 1HB SER 35 -3.229 3.178 -3.647 270 HB3 SER 35 2HB SER 35 -1.706 2.291 -3.671 271 HG SER 35 HG SER 35 -1.385 4.063 -4.928 272 H SER 36 H SER 36 -5.753 1.198 -4.497 273 HA SER 36 HA SER 36 -6.492 2.025 -7.191 274 HB2 SER 36 1HB SER 36 -8.607 1.090 -6.778 275 HB3 SER 36 2HB SER 36 -7.509 0.024 -5.902 276 HG SER 36 HG SER 36 -9.528 0.974 -4.834 277 H GLY 37 H GLY 37 -5.387 3.957 -5.281 278 HA2 GLY 37 1HA GLY 37 -6.279 6.302 -5.705 279 HA3 GLY 37 2HA GLY 37 -7.730 5.713 -4.906 280 H SER 38 H SER 38 -7.742 5.427 -2.679 281 HA SER 38 HA SER 38 -5.440 6.621 -1.280 282 HB2 SER 38 1HB SER 38 -7.559 7.944 -1.191 283 HB3 SER 38 2HB SER 38 -8.325 6.588 -0.363 284 HG SER 38 HG SER 38 -5.929 7.593 0.670 285 H SER 39 H SER 39 -5.134 5.873 0.973 286 HA SER 39 HA SER 39 -4.874 3.072 1.075 287 HB2 SER 39 1HB SER 39 -4.889 4.674 3.599 288 HB3 SER 39 2HB SER 39 -3.790 3.391 3.090 289 HG SER 39 HG SER 39 -2.542 4.838 2.219 290 H GLY 40 H GLY 40 -7.328 5.267 2.291 291 HA2 GLY 40 1HA GLY 40 -8.657 3.415 3.979 292 HA3 GLY 40 2HA GLY 40 -9.346 4.894 3.326 293 H ASP 41 H ASP 41 -9.665 4.650 0.787 294 HA ASP 41 HA ASP 41 -11.845 3.168 0.272 295 HB2 ASP 41 1HB ASP 41 -9.599 3.544 -1.721 296 HB3 ASP 41 2HB ASP 41 -11.292 3.239 -2.101 297 H MET 42 H MET 42 -8.517 1.992 0.089 298 HA MET 42 HA MET 42 -8.831 -0.464 -1.067 299 HB2 MET 42 1HB MET 42 -7.100 0.297 1.287 300 HB3 MET 42 2HB MET 42 -6.958 -1.231 0.428 301 HG2 MET 42 1HG MET 42 -6.451 1.531 -0.638 302 HG3 MET 42 2HG MET 42 -5.287 0.228 -0.408 303 HE1 MET 42 1HE MET 42 -5.676 -2.056 -3.353 304 HE2 MET 42 2HE MET 42 -4.795 -1.575 -1.903 305 HE3 MET 42 3HE MET 42 -6.353 -2.390 -1.758 306 H MET 43 H MET 43 -8.917 0.037 2.468 307 HA MET 43 HA MET 43 -9.638 -2.342 3.419 308 HB2 MET 43 1HB MET 43 -11.081 0.209 4.160 309 HB3 MET 43 2HB MET 43 -10.977 -1.242 5.148 310 HG2 MET 43 1HG MET 43 -8.600 0.389 4.289 311 HG3 MET 43 2HG MET 43 -9.438 0.585 5.826 312 HE1 MET 43 1HE MET 43 -10.054 -1.271 7.211 313 HE2 MET 43 2HE MET 43 -9.502 -2.937 7.038 314 HE3 MET 43 3HE MET 43 -8.612 -1.816 8.068 315 H ARG 44 H ARG 44 -11.836 -0.175 1.697 316 HA ARG 44 HA ARG 44 -14.088 -1.939 1.970 317 HB2 ARG 44 1HB ARG 44 -13.603 0.548 0.335 318 HB3 ARG 44 2HB ARG 44 -15.107 -0.359 0.257 319 HG2 ARG 44 1HG ARG 44 -15.807 0.357 2.282 320 HG3 ARG 44 2HG ARG 44 -14.174 0.416 2.948 321 HD2 ARG 44 1HD ARG 44 -15.002 2.657 2.788 322 HD3 ARG 44 2HD ARG 44 -13.753 2.440 1.563 323 HE ARG 44 HE ARG 44 -15.339 2.739 -0.070 324 HH11 ARG 44 2HH1 ARG 44 -16.906 2.252 3.001 325 HH12 ARG 44 1HH1 ARG 44 -18.480 2.671 2.411 326 HH21 ARG 44 2HH2 ARG 44 -17.407 3.292 -0.858 327 HH22 ARG 44 1HH2 ARG 44 -18.764 3.261 0.216 328 H GLU 45 H GLU 45 -12.263 -0.805 -0.883 329 HA GLU 45 HA GLU 45 -13.289 -2.399 -2.820 330 HB2 GLU 45 1HB GLU 45 -11.372 -0.686 -2.952 331 HB3 GLU 45 2HB GLU 45 -10.311 -2.042 -2.596 332 HG2 GLU 45 1HG GLU 45 -10.418 -1.628 -4.979 333 HG3 GLU 45 2HG GLU 45 -11.107 -3.202 -4.584 334 H ILE 46 H ILE 46 -10.978 -3.352 -0.341 335 HA ILE 46 HA ILE 46 -10.380 -5.911 -1.374 336 HB ILE 46 HB ILE 46 -10.321 -5.010 1.508 337 HG12 ILE 46 1HG1 ILE 46 -7.885 -5.186 -0.206 338 HG13 ILE 46 2HG1 ILE 46 -8.946 -3.797 -0.416 339 HG21 ILE 46 1HG2 ILE 46 -9.386 -7.451 0.093 340 HG22 ILE 46 2HG2 ILE 46 -8.404 -6.820 1.415 341 HG23 ILE 46 3HG2 ILE 46 -10.084 -7.274 1.703 342 HD11 ILE 46 1HD1 ILE 46 -8.138 -4.496 2.345 343 HD12 ILE 46 2HD1 ILE 46 -6.922 -3.788 1.281 344 HD13 ILE 46 3HD1 ILE 46 -8.422 -2.919 1.607 345 H ARG 47 H ARG 47 -12.501 -5.018 1.356 346 HA ARG 47 HA ARG 47 -13.594 -7.432 1.959 347 HB2 ARG 47 1HB ARG 47 -15.154 -4.849 1.771 348 HB3 ARG 47 2HB ARG 47 -15.578 -6.253 2.742 349 HG2 ARG 47 1HG ARG 47 -12.923 -5.020 3.204 350 HG3 ARG 47 2HG ARG 47 -14.350 -4.143 3.762 351 HD2 ARG 47 1HD ARG 47 -14.175 -7.038 4.390 352 HD3 ARG 47 2HD ARG 47 -13.105 -5.945 5.269 353 HE ARG 47 HE ARG 47 -15.840 -6.319 5.755 354 HH11 ARG 47 2HH1 ARG 47 -13.513 -3.749 5.440 355 HH12 ARG 47 1HH1 ARG 47 -14.366 -2.671 6.494 356 HH21 ARG 47 2HH2 ARG 47 -16.973 -4.909 7.145 357 HH22 ARG 47 1HH2 ARG 47 -16.333 -3.332 7.464 358 H LYS 48 H LYS 48 -14.415 -5.372 -0.772 359 HA LYS 48 HA LYS 48 -16.732 -6.601 -1.663 360 HB2 LYS 48 1HB LYS 48 -15.814 -4.528 -2.623 361 HB3 LYS 48 2HB LYS 48 -14.500 -5.447 -3.346 362 HG2 LYS 48 1HG LYS 48 -16.327 -6.772 -4.544 363 HG3 LYS 48 2HG LYS 48 -17.411 -5.468 -4.056 364 HD2 LYS 48 1HD LYS 48 -16.719 -4.787 -6.162 365 HD3 LYS 48 2HD LYS 48 -15.612 -3.917 -5.097 366 HE2 LYS 48 1HE LYS 48 -14.143 -6.081 -5.427 367 HE3 LYS 48 2HE LYS 48 -15.102 -6.234 -6.899 368 HZ1 LYS 48 1HZ LYS 48 -13.327 -4.984 -7.603 369 HZ2 LYS 48 2HZ LYS 48 -13.184 -4.136 -6.147 370 HZ3 LYS 48 3HZ LYS 48 -14.439 -3.768 -7.220 371 H VAL 49 H VAL 49 -13.396 -7.319 -2.706 372 HA VAL 49 HA VAL 49 -13.918 -9.453 -4.373 373 HB VAL 49 HB VAL 49 -11.538 -9.509 -2.546 374 HG11 VAL 49 1HG1 VAL 49 -10.543 -10.048 -4.921 375 HG12 VAL 49 2HG1 VAL 49 -11.367 -11.291 -3.978 376 HG13 VAL 49 3HG1 VAL 49 -12.218 -10.464 -5.284 377 HG21 VAL 49 1HG2 VAL 49 -10.598 -8.001 -4.537 378 HG22 VAL 49 2HG2 VAL 49 -12.266 -7.427 -4.524 379 HG23 VAL 49 3HG2 VAL 49 -11.282 -7.312 -3.065 380 H LEU 50 H LEU 50 -13.101 -9.630 -0.905 381 HA LEU 50 HA LEU 50 -13.241 -12.319 -0.484 382 HB2 LEU 50 1HB LEU 50 -14.475 -10.308 1.383 383 HB3 LEU 50 2HB LEU 50 -13.772 -11.869 1.799 384 HG LEU 50 HG LEU 50 -12.264 -9.445 0.821 385 HD11 LEU 50 1HD1 LEU 50 -12.473 -10.741 3.533 386 HD12 LEU 50 2HD1 LEU 50 -13.014 -9.126 3.077 387 HD13 LEU 50 3HD1 LEU 50 -11.292 -9.504 3.103 388 HD21 LEU 50 1HD2 LEU 50 -11.088 -11.998 1.876 389 HD22 LEU 50 2HD2 LEU 50 -10.284 -10.684 1.018 390 HD23 LEU 50 3HD2 LEU 50 -11.395 -11.750 0.157 391 H GLY 51 H GLY 51 -16.026 -10.127 -0.019 392 HA2 GLY 51 1HA GLY 51 -17.981 -12.030 0.383 393 HA3 GLY 51 2HA GLY 51 -18.273 -10.465 -0.363 394 H ALA 52 H ALA 52 -16.687 -10.865 -2.690 395 HA ALA 52 HA ALA 52 -18.562 -12.078 -4.385 396 HB1 ALA 52 1HB ALA 52 -17.084 -10.401 -5.240 397 HB2 ALA 52 2HB ALA 52 -15.669 -11.381 -4.854 398 HB3 ALA 52 3HB ALA 52 -16.782 -11.901 -6.119 399 H ASN 53 H ASN 53 -15.576 -13.303 -2.953 400 HA ASN 53 HA ASN 53 -15.979 -15.893 -4.250 401 HB2 ASN 53 1HB ASN 53 -13.688 -14.621 -2.785 402 HB3 ASN 53 2HB ASN 53 -13.742 -16.369 -2.997 403 HD21 ASN 53 1HD2 ASN 53 -13.987 -13.339 -4.806 404 HD22 ASN 53 2HD2 ASN 53 -13.220 -13.929 -6.237 405 H ASN 54 H ASN 54 -17.943 -15.283 -2.416 406 HA ASN 54 HA ASN 54 -18.856 -15.837 -0.365 407 HB2 ASN 54 1HB ASN 54 -17.748 -18.561 -1.013 408 HB3 ASN 54 2HB ASN 54 -19.289 -18.155 -0.263 409 HD21 ASN 54 1HD2 ASN 54 -17.702 -18.909 -3.124 410 HD22 ASN 54 2HD2 ASN 54 -18.985 -18.558 -4.227 411 H CYS 55 H CYS 55 -16.344 -14.735 0.088 412 HA CYS 55 HA CYS 55 -15.150 -16.480 2.128 413 HB2 CYS 55 1HB CYS 55 -14.085 -14.104 0.610 414 HB3 CYS 55 2HB CYS 55 -13.286 -14.721 2.051 415 HG CYS 55 HG CYS 55 -13.459 -16.065 -1.042 416 H ASP 56 H ASP 56 -14.785 -15.728 4.226 417 HA ASP 56 HA ASP 56 -16.545 -13.516 5.018 418 HB2 ASP 56 1HB ASP 56 -16.899 -15.785 6.031 419 HB3 ASP 56 2HB ASP 56 -15.314 -15.637 6.786 420 H TYR 57 H TYR 57 -15.787 -12.247 6.956 421 HA TYR 57 HA TYR 57 -12.969 -12.032 7.420 422 HB2 TYR 57 1HB TYR 57 -13.123 -9.501 6.637 423 HB3 TYR 57 2HB TYR 57 -12.665 -10.782 5.520 424 HD1 TYR 57 2HD TYR 57 -14.453 -11.751 4.004 425 HD2 TYR 57 1HD TYR 57 -15.024 -8.175 6.237 426 HE1 TYR 57 2HE TYR 57 -16.311 -11.127 2.518 427 HE2 TYR 57 1HE TYR 57 -16.884 -7.541 4.758 428 HH TYR 57 HH TYR 57 -17.457 -8.264 2.109 429 H GLU 58 H GLU 58 -12.490 -10.810 9.228 430 HA GLU 58 HA GLU 58 -14.763 -9.505 10.569 431 HB2 GLU 58 1HB GLU 58 -13.757 -10.351 12.736 432 HB3 GLU 58 2HB GLU 58 -14.532 -11.560 11.722 433 HG2 GLU 58 1HG GLU 58 -12.401 -12.343 10.936 434 HG3 GLU 58 2HG GLU 58 -11.568 -11.049 11.795 435 H GLN 59 H GLN 59 -14.232 -7.407 10.399 436 HA GLN 59 HA GLN 59 -11.638 -6.357 10.317 437 HB2 GLN 59 1HB GLN 59 -14.058 -5.324 9.830 438 HB3 GLN 59 2HB GLN 59 -13.809 -4.671 11.444 439 HG2 GLN 59 1HG GLN 59 -11.469 -3.998 10.405 440 HG3 GLN 59 2HG GLN 59 -12.401 -4.066 8.910 441 HE21 GLN 59 1HE2 GLN 59 -11.316 -2.014 11.132 442 HE22 GLN 59 2HE2 GLN 59 -12.555 -0.811 11.095 443 H ARG 60 H ARG 60 -10.175 -6.569 11.878 444 HA ARG 60 HA ARG 60 -10.984 -6.673 14.665 445 HB2 ARG 60 1HB ARG 60 -8.290 -6.966 13.328 446 HB3 ARG 60 2HB ARG 60 -8.546 -7.090 15.063 447 HG2 ARG 60 1HG ARG 60 -10.177 -8.822 13.288 448 HG3 ARG 60 2HG ARG 60 -8.471 -9.218 13.508 449 HD2 ARG 60 1HD ARG 60 -8.998 -8.935 16.034 450 HD3 ARG 60 2HD ARG 60 -10.676 -9.139 15.530 451 HE ARG 60 HE ARG 60 -9.458 -11.246 14.379 452 HH11 ARG 60 2HH1 ARG 60 -9.427 -9.990 17.626 453 HH12 ARG 60 1HH1 ARG 60 -9.183 -11.539 18.362 454 HH21 ARG 60 2HH2 ARG 60 -9.137 -13.291 15.337 455 HH22 ARG 60 1HH2 ARG 60 -9.017 -13.416 17.059 456 H GLU 61 H GLU 61 -8.686 -4.755 12.724 457 HA GLU 61 HA GLU 61 -9.011 -2.576 14.682 458 HB2 GLU 61 1HB GLU 61 -6.605 -3.222 12.969 459 HB3 GLU 61 2HB GLU 61 -6.744 -1.832 14.037 460 HG2 GLU 61 1HG GLU 61 -7.167 -3.582 15.884 461 HG3 GLU 61 2HG GLU 61 -6.471 -4.724 14.735 462 H ARG 62 H ARG 62 -8.213 -0.410 13.556 463 HA ARG 62 HA ARG 62 -10.168 0.292 11.692 464 HB2 ARG 62 1HB ARG 62 -9.198 2.013 13.017 465 HB3 ARG 62 2HB ARG 62 -7.574 1.613 12.473 466 HG2 ARG 62 1HG ARG 62 -7.809 2.720 10.497 467 HG3 ARG 62 2HG ARG 62 -9.553 2.456 10.430 468 HD2 ARG 62 1HD ARG 62 -8.362 4.220 12.534 469 HD3 ARG 62 2HD ARG 62 -8.640 4.836 10.905 470 HE ARG 62 HE ARG 62 -10.637 4.194 12.894 471 HH11 ARG 62 2HH1 ARG 62 -9.970 4.798 9.531 472 HH12 ARG 62 1HH1 ARG 62 -11.602 5.237 9.152 473 HH21 ARG 62 2HH2 ARG 62 -12.790 4.771 12.407 474 HH22 ARG 62 1HH2 ARG 62 -13.205 5.223 10.788 475 H PHE 63 H PHE 63 -6.668 -0.143 11.160 476 HA PHE 63 HA PHE 63 -7.206 -0.408 8.285 477 HB2 PHE 63 1HB PHE 63 -4.742 0.323 9.850 478 HB3 PHE 63 2HB PHE 63 -4.636 -0.191 8.169 479 HD1 PHE 63 2HD PHE 63 -6.533 1.062 6.656 480 HD2 PHE 63 1HD PHE 63 -4.684 2.581 10.177 481 HE1 PHE 63 2HE PHE 63 -7.030 3.358 5.923 482 HE2 PHE 63 1HE PHE 63 -5.179 4.879 9.449 483 HZ PHE 63 HZ PHE 63 -6.352 5.270 7.319 484 H LEU 64 H LEU 64 -7.842 -2.559 10.010 485 HA LEU 64 HA LEU 64 -6.025 -4.586 8.930 486 HB2 LEU 64 1HB LEU 64 -5.502 -4.011 11.352 487 HB3 LEU 64 2HB LEU 64 -7.059 -4.735 11.749 488 HG LEU 64 HG LEU 64 -6.127 -6.827 10.541 489 HD11 LEU 64 1HD1 LEU 64 -4.036 -5.199 9.973 490 HD12 LEU 64 2HD1 LEU 64 -3.948 -6.959 10.025 491 HD13 LEU 64 3HD1 LEU 64 -3.450 -6.010 11.426 492 HD21 LEU 64 1HD2 LEU 64 -5.953 -7.638 12.607 493 HD22 LEU 64 2HD2 LEU 64 -6.205 -5.990 13.182 494 HD23 LEU 64 3HD2 LEU 64 -4.566 -6.610 12.972 495 H LEU 65 H LEU 65 -6.979 -6.572 8.480 496 HA LEU 65 HA LEU 65 -9.769 -7.007 9.141 497 HB2 LEU 65 1HB LEU 65 -8.803 -6.287 6.433 498 HB3 LEU 65 2HB LEU 65 -10.010 -7.566 6.546 499 HG LEU 65 HG LEU 65 -10.494 -4.938 7.890 500 HD11 LEU 65 1HD1 LEU 65 -11.595 -4.146 5.838 501 HD12 LEU 65 2HD1 LEU 65 -10.943 -5.535 4.970 502 HD13 LEU 65 3HD1 LEU 65 -9.851 -4.324 5.641 503 HD21 LEU 65 1HD2 LEU 65 -12.037 -6.702 8.392 504 HD22 LEU 65 2HD2 LEU 65 -12.238 -7.079 6.681 505 HD23 LEU 65 3HD2 LEU 65 -12.839 -5.550 7.324 506 H PHE 66 H PHE 66 -10.120 -9.099 9.517 507 HA PHE 66 HA PHE 66 -8.002 -10.997 9.012 508 HB2 PHE 66 1HB PHE 66 -9.534 -10.807 11.116 509 HB3 PHE 66 2HB PHE 66 -10.678 -11.734 10.151 510 HD1 PHE 66 2HD PHE 66 -7.166 -11.790 11.370 511 HD2 PHE 66 1HD PHE 66 -10.548 -14.044 10.106 512 HE1 PHE 66 2HE PHE 66 -6.019 -13.868 12.017 513 HE2 PHE 66 1HE PHE 66 -9.407 -16.126 10.752 514 HZ PHE 66 HZ PHE 66 -7.138 -16.039 11.707 515 H CYS 67 H CYS 67 -7.932 -11.369 6.820 516 HA CYS 67 HA CYS 67 -10.318 -12.056 5.351 517 HB2 CYS 67 1HB CYS 67 -7.423 -12.216 4.488 518 HB3 CYS 67 2HB CYS 67 -8.829 -12.299 3.434 519 HG CYS 67 HG CYS 67 -9.383 -9.558 4.844 520 H VAL 68 H VAL 68 -11.144 -14.024 5.118 521 HA VAL 68 HA VAL 68 -9.406 -16.366 5.339 522 HB VAL 68 HB VAL 68 -10.408 -15.924 7.596 523 HG11 VAL 68 1HG1 VAL 68 -12.625 -15.765 7.964 524 HG12 VAL 68 2HG1 VAL 68 -12.674 -15.308 6.260 525 HG13 VAL 68 3HG1 VAL 68 -13.022 -16.970 6.739 526 HG21 VAL 68 1HG2 VAL 68 -10.327 -18.355 6.089 527 HG22 VAL 68 2HG2 VAL 68 -10.030 -18.103 7.809 528 HG23 VAL 68 3HG2 VAL 68 -11.668 -18.417 7.234 529 H HIS 69 H HIS 69 -9.892 -17.907 3.896 530 HA HIS 69 HA HIS 69 -12.392 -17.603 2.374 531 HB2 HIS 69 1HB HIS 69 -10.591 -17.318 0.878 532 HB3 HIS 69 2HB HIS 69 -9.671 -18.635 1.601 533 HD1 HIS 69 1HD HIS 69 -9.474 -20.360 -0.162 534 HD2 HIS 69 2HD HIS 69 -13.309 -18.773 0.030 535 HE1 HIS 69 1HE HIS 69 -10.833 -21.684 -1.812 536 HE2 HIS 69 2HE HIS 69 -13.128 -20.650 -1.741 537 H GLY 70 H GLY 70 -13.713 -19.358 2.001 538 HA2 GLY 70 1HA GLY 70 -12.967 -21.859 3.384 539 HA3 GLY 70 2HA GLY 70 -14.567 -21.153 3.557 540 H ASP 71 H ASP 71 -13.381 -23.730 2.351 541 HA ASP 71 HA ASP 71 -14.915 -23.585 -0.160 542 HB2 ASP 71 1HB ASP 71 -12.297 -23.846 -0.250 543 HB3 ASP 71 2HB ASP 71 -12.657 -25.524 0.144 544 H GLY 72 H GLY 72 -13.647 -25.813 2.314 545 HA2 GLY 72 1HA GLY 72 -16.235 -27.093 2.512 546 HA3 GLY 72 2HA GLY 72 -14.979 -28.108 1.818 547 H HIS 73 H HIS 73 -12.783 -27.420 3.303 548 HA HIS 73 HA HIS 73 -13.491 -27.690 6.115 549 HB2 HIS 73 1HB HIS 73 -12.262 -29.848 4.463 550 HB3 HIS 73 2HB HIS 73 -11.686 -29.641 6.114 551 HD1 HIS 73 1HD HIS 73 -12.999 -30.807 7.863 552 HD2 HIS 73 2HD HIS 73 -15.193 -30.257 4.379 553 HE1 HIS 73 1HE HIS 73 -15.174 -32.013 8.241 554 HE2 HIS 73 2HE HIS 73 -16.450 -31.738 6.087 555 H ALA 74 H ALA 74 -11.317 -27.945 7.413 556 HA ALA 74 HA ALA 74 -9.896 -25.637 7.304 557 HB1 ALA 74 1HB ALA 74 -9.419 -28.287 8.465 558 HB2 ALA 74 2HB ALA 74 -7.967 -27.316 8.221 559 HB3 ALA 74 3HB ALA 74 -9.296 -26.686 9.194 560 H GLU 75 H GLU 75 -8.885 -28.702 5.788 561 HA GLU 75 HA GLU 75 -6.506 -28.077 4.690 562 HB2 GLU 75 1HB GLU 75 -8.802 -29.551 3.402 563 HB3 GLU 75 2HB GLU 75 -7.194 -29.481 2.695 564 HG2 GLU 75 1HG GLU 75 -7.895 -30.634 5.385 565 HG3 GLU 75 2HG GLU 75 -7.529 -31.548 3.923 566 H ASN 76 H ASN 76 -9.655 -27.135 3.353 567 HA ASN 76 HA ASN 76 -8.403 -25.603 1.238 568 HB2 ASN 76 1HB ASN 76 -11.332 -25.681 1.977 569 HB3 ASN 76 2HB ASN 76 -10.628 -25.186 0.440 570 HD21 ASN 76 1HD2 ASN 76 -11.149 -27.917 2.584 571 HD22 ASN 76 2HD2 ASN 76 -11.072 -29.132 1.357 572 H LEU 77 H LEU 77 -9.929 -25.049 4.336 573 HA LEU 77 HA LEU 77 -10.345 -22.277 4.121 574 HB2 LEU 77 1HB LEU 77 -11.127 -23.980 5.914 575 HB3 LEU 77 2HB LEU 77 -9.595 -23.601 6.699 576 HG LEU 77 HG LEU 77 -10.485 -21.120 6.419 577 HD11 LEU 77 1HD1 LEU 77 -12.836 -22.832 5.954 578 HD12 LEU 77 2HD1 LEU 77 -12.525 -21.166 5.466 579 HD13 LEU 77 3HD1 LEU 77 -13.055 -21.519 7.111 580 HD21 LEU 77 1HD2 LEU 77 -11.034 -23.173 8.516 581 HD22 LEU 77 2HD2 LEU 77 -11.700 -21.549 8.688 582 HD23 LEU 77 3HD2 LEU 77 -9.956 -21.778 8.561 583 H VAL 78 H VAL 78 -9.041 -20.554 4.340 584 HA VAL 78 HA VAL 78 -6.318 -20.952 5.358 585 HB VAL 78 HB VAL 78 -6.992 -19.574 2.755 586 HG11 VAL 78 1HG1 VAL 78 -4.324 -19.582 2.784 587 HG12 VAL 78 2HG1 VAL 78 -5.279 -18.243 3.426 588 HG13 VAL 78 3HG1 VAL 78 -4.616 -19.459 4.519 589 HG21 VAL 78 1HG2 VAL 78 -6.889 -21.818 2.224 590 HG22 VAL 78 2HG2 VAL 78 -5.214 -21.319 1.988 591 HG23 VAL 78 3HG2 VAL 78 -5.683 -22.165 3.463 592 H GLN 79 H GLN 79 -5.887 -19.509 6.882 593 HA GLN 79 HA GLN 79 -7.465 -17.037 6.975 594 HB2 GLN 79 1HB GLN 79 -5.906 -18.520 9.090 595 HB3 GLN 79 2HB GLN 79 -6.580 -16.916 9.346 596 HG2 GLN 79 1HG GLN 79 -8.761 -17.677 9.294 597 HG3 GLN 79 2HG GLN 79 -8.333 -19.148 8.421 598 HE21 GLN 79 1HE2 GLN 79 -9.249 -20.565 9.837 599 HE22 GLN 79 2HE2 GLN 79 -8.669 -20.818 11.444 600 H TRP 80 H TRP 80 -6.558 -15.121 6.599 601 HA TRP 80 HA TRP 80 -3.725 -14.695 7.048 602 HB2 TRP 80 1HB TRP 80 -3.118 -14.155 4.842 603 HB3 TRP 80 2HB TRP 80 -4.063 -15.632 4.676 604 HD1 TRP 80 HD TRP 80 -4.106 -11.935 3.794 605 HE1 TRP 80 1HE TRP 80 -6.052 -11.484 2.171 606 HE3 TRP 80 3HE TRP 80 -6.442 -16.476 4.045 607 HZ2 TRP 80 2HZ TRP 80 -8.282 -12.870 1.134 608 HZ3 TRP 80 3HZ TRP 80 -8.476 -16.832 2.707 609 HH2 TRP 80 HH TRP 80 -9.376 -15.065 1.283 610 H GLU 81 H GLU 81 -3.487 -12.763 7.948 611 HA GLU 81 HA GLU 81 -5.677 -10.875 7.916 612 HB2 GLU 81 1HB GLU 81 -2.973 -10.728 9.261 613 HB3 GLU 81 2HB GLU 81 -4.296 -9.598 9.512 614 HG2 GLU 81 1HG GLU 81 -5.598 -11.809 10.129 615 HG3 GLU 81 2HG GLU 81 -3.968 -12.384 10.474 616 H MET 82 H MET 82 -5.868 -9.207 6.580 617 HA MET 82 HA MET 82 -3.559 -8.468 4.926 618 HB2 MET 82 1HB MET 82 -6.520 -8.322 4.546 619 HB3 MET 82 2HB MET 82 -5.494 -7.191 3.674 620 HG2 MET 82 1HG MET 82 -4.231 -9.134 2.772 621 HG3 MET 82 2HG MET 82 -5.416 -10.193 3.534 622 HE1 MET 82 1HE MET 82 -4.620 -7.571 0.919 623 HE2 MET 82 2HE MET 82 -6.072 -7.438 -0.074 624 HE3 MET 82 3HE MET 82 -6.026 -6.697 1.527 625 H GLU 83 H GLU 83 -2.428 -6.960 6.037 626 HA GLU 83 HA GLU 83 -3.880 -4.717 7.242 627 HB2 GLU 83 1HB GLU 83 -2.268 -5.826 8.690 628 HB3 GLU 83 2HB GLU 83 -0.994 -5.577 7.504 629 HG2 GLU 83 1HG GLU 83 -0.957 -3.255 7.875 630 HG3 GLU 83 2HG GLU 83 -2.480 -3.295 8.762 631 H VAL 84 H VAL 84 -3.829 -2.720 6.410 632 HA VAL 84 HA VAL 84 -2.450 -2.319 3.882 633 HB VAL 84 HB VAL 84 -4.345 -0.497 5.372 634 HG11 VAL 84 1HG1 VAL 84 -2.740 -0.167 2.933 635 HG12 VAL 84 2HG1 VAL 84 -4.439 0.286 2.781 636 HG13 VAL 84 3HG1 VAL 84 -3.429 1.044 4.013 637 HG21 VAL 84 1HG2 VAL 84 -6.085 -1.396 4.212 638 HG22 VAL 84 2HG2 VAL 84 -5.081 -1.845 2.833 639 HG23 VAL 84 3HG2 VAL 84 -5.054 -2.824 4.299 640 H CYS 85 H CYS 85 -0.297 -2.047 4.356 641 HA CYS 85 HA CYS 85 0.815 -0.616 6.450 642 HB2 CYS 85 1HB CYS 85 1.877 -2.092 4.519 643 HB3 CYS 85 2HB CYS 85 2.155 -0.518 3.785 644 HG CYS 85 HG CYS 85 3.914 -2.043 6.069 645 H LYS 86 H LYS 86 2.359 1.385 5.806 646 HA LYS 86 HA LYS 86 0.767 3.388 4.376 647 HB2 LYS 86 1HB LYS 86 0.971 4.999 6.152 648 HB3 LYS 86 2HB LYS 86 0.250 3.536 6.811 649 HG2 LYS 86 1HG LYS 86 2.125 2.999 8.034 650 HG3 LYS 86 2HG LYS 86 3.200 3.937 6.995 651 HD2 LYS 86 1HD LYS 86 1.084 5.369 8.528 652 HD3 LYS 86 2HD LYS 86 2.516 4.801 9.390 653 HE2 LYS 86 1HE LYS 86 3.225 6.883 8.763 654 HE3 LYS 86 2HE LYS 86 3.767 5.943 7.373 655 HZ1 LYS 86 1HZ LYS 86 1.112 6.773 6.955 656 HZ2 LYS 86 2HZ LYS 86 2.495 7.170 6.065 657 HZ3 LYS 86 3HZ LYS 86 2.039 8.121 7.387 658 H LEU 87 H LEU 87 1.945 4.976 3.361 659 HA LEU 87 HA LEU 87 4.848 4.544 3.312 660 HB2 LEU 87 1HB LEU 87 2.851 5.514 1.336 661 HB3 LEU 87 2HB LEU 87 4.497 6.134 1.223 662 HG LEU 87 HG LEU 87 4.045 4.216 -0.278 663 HD11 LEU 87 1HD1 LEU 87 6.041 2.857 0.504 664 HD12 LEU 87 2HD1 LEU 87 6.118 3.956 1.881 665 HD13 LEU 87 3HD1 LEU 87 6.308 4.581 0.243 666 HD21 LEU 87 1HD2 LEU 87 3.590 2.065 0.512 667 HD22 LEU 87 2HD2 LEU 87 2.516 3.103 1.451 668 HD23 LEU 87 3HD2 LEU 87 4.003 2.487 2.174 669 HA PRO 88 HA PRO 88 5.801 8.446 5.076 670 HB2 PRO 88 1HB PRO 88 7.915 9.267 3.584 671 HB3 PRO 88 2HB PRO 88 8.020 7.946 4.754 672 HG2 PRO 88 1HG PRO 88 7.696 7.820 1.781 673 HG3 PRO 88 2HG PRO 88 8.736 6.845 2.836 674 HD2 PRO 88 1HD PRO 88 6.368 5.940 1.883 675 HD3 PRO 88 2HD PRO 88 7.007 5.458 3.468 676 H ARG 89 H ARG 89 5.914 8.607 1.513 677 HA ARG 89 HA ARG 89 4.748 11.302 1.666 678 HB2 ARG 89 1HB ARG 89 5.591 11.637 -0.604 679 HB3 ARG 89 2HB ARG 89 6.890 11.167 0.484 680 HG2 ARG 89 1HG ARG 89 6.718 8.856 -0.359 681 HG3 ARG 89 2HG ARG 89 5.485 9.393 -1.501 682 HD2 ARG 89 1HD ARG 89 7.000 10.660 -2.730 683 HD3 ARG 89 2HD ARG 89 8.161 10.731 -1.406 684 HE ARG 89 HE ARG 89 7.878 8.060 -2.175 685 HH11 ARG 89 2HH1 ARG 89 9.092 11.064 -3.449 686 HH12 ARG 89 1HH1 ARG 89 10.277 10.307 -4.461 687 HH21 ARG 89 2HH2 ARG 89 9.435 7.052 -3.503 688 HH22 ARG 89 1HH2 ARG 89 10.471 8.025 -4.491 689 H LEU 90 H LEU 90 3.098 9.046 2.052 690 HA LEU 90 HA LEU 90 1.237 7.971 1.267 691 HB2 LEU 90 1HB LEU 90 0.889 10.621 -0.126 692 HB3 LEU 90 2HB LEU 90 -0.385 9.450 0.208 693 HG LEU 90 HG LEU 90 1.166 10.596 2.486 694 HD11 LEU 90 1HD1 LEU 90 -1.270 12.011 1.519 695 HD12 LEU 90 2HD1 LEU 90 0.292 12.396 0.799 696 HD13 LEU 90 3HD1 LEU 90 0.048 12.597 2.533 697 HD21 LEU 90 1HD2 LEU 90 -0.603 8.730 2.588 698 HD22 LEU 90 2HD2 LEU 90 -1.771 10.023 2.316 699 HD23 LEU 90 3HD2 LEU 90 -0.725 10.064 3.735 700 H SER 91 H SER 91 3.603 7.536 -0.322 701 HA SER 91 HA SER 91 3.245 7.763 -3.062 702 HB2 SER 91 1HB SER 91 4.802 5.946 -1.293 703 HB3 SER 91 2HB SER 91 4.596 5.451 -2.973 704 HG SER 91 HG SER 91 6.073 7.521 -1.904 705 H LEU 92 H LEU 92 2.073 5.277 -0.843 706 HA LEU 92 HA LEU 92 -0.182 4.664 -2.402 707 HB2 LEU 92 1HB LEU 92 0.373 2.453 -3.206 708 HB3 LEU 92 2HB LEU 92 1.472 3.648 -3.891 709 HG LEU 92 HG LEU 92 3.018 2.886 -1.902 710 HD11 LEU 92 1HD1 LEU 92 2.494 0.217 -2.002 711 HD12 LEU 92 2HD1 LEU 92 0.870 0.899 -1.931 712 HD13 LEU 92 3HD1 LEU 92 2.044 1.288 -0.675 713 HD21 LEU 92 1HD2 LEU 92 3.549 0.825 -3.576 714 HD22 LEU 92 2HD2 LEU 92 4.050 2.492 -3.861 715 HD23 LEU 92 3HD2 LEU 92 2.587 1.867 -4.625 716 H ASN 93 H ASN 93 -0.908 2.217 -1.686 717 HA ASN 93 HA ASN 93 -0.693 2.245 1.250 718 HB2 ASN 93 1HB ASN 93 -2.898 0.897 1.054 719 HB3 ASN 93 2HB ASN 93 -2.948 2.634 0.770 720 HD21 ASN 93 1HD2 ASN 93 -2.790 -0.497 -0.825 721 HD22 ASN 93 2HD2 ASN 93 -3.550 0.007 -2.292 722 H GLY 94 H GLY 94 1.125 0.910 1.390 723 HA2 GLY 94 1HA GLY 94 1.686 -1.420 0.063 724 HA3 GLY 94 2HA GLY 94 2.119 -1.137 1.743 725 H VAL 95 H VAL 95 1.045 -3.502 0.088 726 HA VAL 95 HA VAL 95 -1.001 -4.286 2.055 727 HB VAL 95 HB VAL 95 -1.049 -5.096 -0.853 728 HG11 VAL 95 1HG1 VAL 95 -3.377 -5.296 0.990 729 HG12 VAL 95 2HG1 VAL 95 -2.947 -6.292 -0.401 730 HG13 VAL 95 3HG1 VAL 95 -2.088 -6.491 1.127 731 HG21 VAL 95 1HG2 VAL 95 -2.063 -3.185 -1.347 732 HG22 VAL 95 2HG2 VAL 95 -3.297 -3.512 -0.130 733 HG23 VAL 95 3HG2 VAL 95 -1.834 -2.632 0.312 734 H ARG 96 H ARG 96 0.072 -5.699 3.301 735 HA ARG 96 HA ARG 96 1.779 -7.711 2.015 736 HB2 ARG 96 1HB ARG 96 2.700 -6.290 3.881 737 HB3 ARG 96 2HB ARG 96 1.562 -7.084 4.960 738 HG2 ARG 96 1HG ARG 96 2.690 -9.075 4.915 739 HG3 ARG 96 2HG ARG 96 3.394 -8.764 3.327 740 HD2 ARG 96 1HD ARG 96 5.052 -7.391 4.191 741 HD3 ARG 96 2HD ARG 96 4.150 -7.068 5.671 742 HE ARG 96 HE ARG 96 5.911 -9.284 5.160 743 HH11 ARG 96 2HH1 ARG 96 3.231 -8.127 7.057 744 HH12 ARG 96 1HH1 ARG 96 3.519 -9.221 8.369 745 HH21 ARG 96 2HH2 ARG 96 6.301 -10.728 6.881 746 HH22 ARG 96 1HH2 ARG 96 5.267 -10.699 8.269 747 H PHE 97 H PHE 97 1.627 -9.930 2.681 748 HA PHE 97 HA PHE 97 -1.028 -10.663 3.726 749 HB2 PHE 97 1HB PHE 97 0.493 -11.754 1.378 750 HB3 PHE 97 2HB PHE 97 -0.670 -12.765 2.230 751 HD1 PHE 97 1HD PHE 97 -0.596 -9.215 1.070 752 HD2 PHE 97 2HD PHE 97 -2.667 -12.933 1.131 753 HE1 PHE 97 1HE PHE 97 -2.419 -8.217 -0.247 754 HE2 PHE 97 2HE PHE 97 -4.493 -11.941 -0.187 755 HZ PHE 97 HZ PHE 97 -4.370 -9.581 -0.878 756 H LYS 98 H LYS 98 -0.960 -11.827 5.521 757 HA LYS 98 HA LYS 98 1.503 -13.325 6.132 758 HB2 LYS 98 1HB LYS 98 1.209 -11.544 7.717 759 HB3 LYS 98 2HB LYS 98 -0.477 -11.976 7.970 760 HG2 LYS 98 1HG LYS 98 0.068 -13.872 9.209 761 HG3 LYS 98 2HG LYS 98 1.728 -13.899 8.610 762 HD2 LYS 98 1HD LYS 98 2.374 -12.116 9.973 763 HD3 LYS 98 2HD LYS 98 0.708 -11.596 10.239 764 HE2 LYS 98 1HE LYS 98 1.135 -12.614 12.242 765 HE3 LYS 98 2HE LYS 98 0.494 -13.981 11.333 766 HZ1 LYS 98 1HZ LYS 98 2.395 -15.047 11.627 767 HZ2 LYS 98 2HZ LYS 98 2.982 -13.764 12.560 768 HZ3 LYS 98 3HZ LYS 98 3.265 -13.795 10.892 769 H ARG 99 H ARG 99 1.367 -15.436 6.753 770 HA ARG 99 HA ARG 99 -1.157 -16.769 6.225 771 HB2 ARG 99 1HB ARG 99 1.069 -17.583 5.345 772 HB3 ARG 99 2HB ARG 99 1.472 -18.032 6.996 773 HG2 ARG 99 1HG ARG 99 -0.249 -19.657 7.071 774 HG3 ARG 99 2HG ARG 99 -0.960 -19.067 5.568 775 HD2 ARG 99 1HD ARG 99 0.190 -20.941 4.859 776 HD3 ARG 99 2HD ARG 99 1.352 -19.653 4.545 777 HE ARG 99 HE ARG 99 2.075 -20.427 6.992 778 HH11 ARG 99 2HH1 ARG 99 1.332 -22.274 4.137 779 HH12 ARG 99 1HH1 ARG 99 2.402 -23.575 4.542 780 HH21 ARG 99 2HH2 ARG 99 3.487 -22.133 7.537 781 HH22 ARG 99 1HH2 ARG 99 3.627 -23.494 6.476 782 H ILE 100 H ILE 100 -2.576 -16.853 7.842 783 HA ILE 100 HA ILE 100 -1.691 -16.939 10.603 784 HB ILE 100 HB ILE 100 -4.473 -16.901 9.427 785 HG12 ILE 100 1HG1 ILE 100 -2.879 -14.857 9.240 786 HG13 ILE 100 2HG1 ILE 100 -4.517 -14.603 9.831 787 HG21 ILE 100 1HG2 ILE 100 -4.671 -17.954 11.525 788 HG22 ILE 100 2HG2 ILE 100 -3.507 -16.860 12.272 789 HG23 ILE 100 3HG2 ILE 100 -5.099 -16.266 11.803 790 HD11 ILE 100 1HD1 ILE 100 -2.358 -13.606 11.031 791 HD12 ILE 100 2HD1 ILE 100 -3.823 -14.053 11.905 792 HD13 ILE 100 3HD1 ILE 100 -2.450 -15.158 11.862 793 H SER 101 H SER 101 -3.503 -18.996 8.353 794 HA SER 101 HA SER 101 -2.555 -21.385 9.568 795 HB2 SER 101 1HB SER 101 -4.449 -22.197 10.672 796 HB3 SER 101 2HB SER 101 -4.434 -20.496 11.136 797 HG SER 101 HG SER 101 -5.795 -20.513 8.956 798 H GLY 102 H GLY 102 -3.938 -23.332 8.679 799 HA2 GLY 102 1HA GLY 102 -5.215 -24.214 6.870 800 HA3 GLY 102 2HA GLY 102 -4.950 -22.715 5.992 801 H THR 103 H THR 103 -3.993 -23.376 4.158 802 HA THR 103 HA THR 103 -1.478 -24.886 4.432 803 HB THR 103 HB THR 103 -1.987 -25.803 2.112 804 HG1 THR 103 1HG THR 103 -4.465 -25.911 1.947 805 HG21 THR 103 1HG2 THR 103 -3.845 -27.383 3.182 806 HG22 THR 103 2HG2 THR 103 -3.309 -26.576 4.656 807 HG23 THR 103 3HG2 THR 103 -2.152 -27.465 3.666 808 H SER 104 H SER 104 0.087 -24.506 2.721 809 HA SER 104 HA SER 104 0.320 -21.729 2.109 810 HB2 SER 104 1HB SER 104 2.310 -22.782 0.660 811 HB3 SER 104 2HB SER 104 2.418 -22.598 2.410 812 HG SER 104 HG SER 104 2.218 -24.707 2.664 813 H ILE 105 H ILE 105 0.125 -24.614 0.020 814 HA ILE 105 HA ILE 105 0.046 -23.551 -2.451 815 HB ILE 105 HB ILE 105 -1.651 -25.759 -1.317 816 HG12 ILE 105 1HG1 ILE 105 0.689 -26.284 -1.468 817 HG13 ILE 105 2HG1 ILE 105 -0.134 -27.132 -2.773 818 HG21 ILE 105 1HG2 ILE 105 -2.293 -26.362 -3.594 819 HG22 ILE 105 2HG2 ILE 105 -2.897 -24.762 -3.165 820 HG23 ILE 105 3HG2 ILE 105 -1.485 -24.921 -4.209 821 HD11 ILE 105 1HD1 ILE 105 0.535 -25.139 -4.229 822 HD12 ILE 105 2HD1 ILE 105 1.651 -24.738 -2.923 823 HD13 ILE 105 3HD1 ILE 105 1.790 -26.285 -3.758 824 H ALA 106 H ALA 106 -2.957 -24.057 -0.587 825 HA ALA 106 HA ALA 106 -4.618 -22.576 -2.275 826 HB1 ALA 106 1HB ALA 106 -6.023 -23.640 -0.911 827 HB2 ALA 106 2HB ALA 106 -4.810 -23.781 0.362 828 HB3 ALA 106 3HB ALA 106 -5.767 -22.308 0.216 829 H PHE 107 H PHE 107 -2.780 -21.585 0.585 830 HA PHE 107 HA PHE 107 -3.740 -19.032 0.954 831 HB2 PHE 107 1HB PHE 107 -2.107 -20.084 2.451 832 HB3 PHE 107 2HB PHE 107 -0.871 -19.961 1.204 833 HD1 PHE 107 2HD PHE 107 0.034 -17.765 0.569 834 HD2 PHE 107 1HD PHE 107 -2.712 -18.213 3.790 835 HE1 PHE 107 2HE PHE 107 0.654 -15.535 1.403 836 HE2 PHE 107 1HE PHE 107 -2.096 -15.983 4.629 837 HZ PHE 107 HZ PHE 107 -0.410 -14.642 3.436 838 H LYS 108 H LYS 108 -1.418 -20.181 -1.429 839 HA LYS 108 HA LYS 108 -0.964 -17.503 -2.455 840 HB2 LYS 108 1HB LYS 108 0.028 -20.193 -3.418 841 HB3 LYS 108 2HB LYS 108 0.525 -18.639 -4.076 842 HG2 LYS 108 1HG LYS 108 1.835 -18.139 -2.281 843 HG3 LYS 108 2HG LYS 108 0.850 -19.080 -1.159 844 HD2 LYS 108 1HD LYS 108 2.892 -20.253 -1.383 845 HD3 LYS 108 2HD LYS 108 1.709 -21.146 -2.342 846 HE2 LYS 108 1HE LYS 108 3.345 -19.032 -3.662 847 HE3 LYS 108 2HE LYS 108 4.092 -20.587 -3.302 848 HZ1 LYS 108 1HZ LYS 108 2.315 -21.672 -4.549 849 HZ2 LYS 108 2HZ LYS 108 3.167 -20.580 -5.518 850 HZ3 LYS 108 3HZ LYS 108 1.639 -20.167 -4.922 851 H ASN 109 H ASN 109 -2.289 -20.569 -3.698 852 HA ASN 109 HA ASN 109 -3.081 -19.800 -6.199 853 HB2 ASN 109 1HB ASN 109 -4.238 -21.718 -4.211 854 HB3 ASN 109 2HB ASN 109 -5.107 -21.405 -5.711 855 HD21 ASN 109 1HD2 ASN 109 -2.411 -22.927 -4.239 856 HD22 ASN 109 2HD2 ASN 109 -1.805 -23.718 -5.651 857 H ILE 110 H ILE 110 -4.705 -19.152 -3.139 858 HA ILE 110 HA ILE 110 -6.956 -17.873 -4.418 859 HB ILE 110 HB ILE 110 -7.214 -19.089 -2.278 860 HG12 ILE 110 1HG1 ILE 110 -8.487 -17.230 -1.094 861 HG13 ILE 110 2HG1 ILE 110 -7.877 -16.144 -2.337 862 HG21 ILE 110 1HG2 ILE 110 -6.117 -18.574 -0.367 863 HG22 ILE 110 2HG2 ILE 110 -4.923 -17.944 -1.500 864 HG23 ILE 110 3HG2 ILE 110 -6.070 -16.849 -0.728 865 HD11 ILE 110 1HD1 ILE 110 -9.048 -18.463 -3.546 866 HD12 ILE 110 2HD1 ILE 110 -10.182 -17.713 -2.421 867 HD13 ILE 110 3HD1 ILE 110 -9.477 -16.762 -3.728 868 H ALA 111 H ALA 111 -3.912 -16.932 -3.016 869 HA ALA 111 HA ALA 111 -4.417 -14.215 -2.546 870 HB1 ALA 111 1HB ALA 111 -1.948 -15.812 -3.068 871 HB2 ALA 111 2HB ALA 111 -1.858 -14.051 -3.011 872 HB3 ALA 111 3HB ALA 111 -2.442 -14.950 -1.610 873 H SER 112 H SER 112 -3.539 -15.951 -5.475 874 HA SER 112 HA SER 112 -2.864 -13.758 -7.084 875 HB2 SER 112 1HB SER 112 -2.422 -16.111 -7.707 876 HB3 SER 112 2HB SER 112 -4.152 -16.363 -7.939 877 HG SER 112 HG SER 112 -3.694 -14.315 -9.387 878 H LYS 113 H LYS 113 -5.981 -15.348 -6.520 879 HA LYS 113 HA LYS 113 -7.503 -13.868 -8.344 880 HB2 LYS 113 1HB LYS 113 -8.241 -15.234 -5.758 881 HB3 LYS 113 2HB LYS 113 -9.434 -14.466 -6.797 882 HG2 LYS 113 1HG LYS 113 -7.575 -16.507 -7.931 883 HG3 LYS 113 2HG LYS 113 -8.983 -17.014 -6.994 884 HD2 LYS 113 1HD LYS 113 -9.307 -15.028 -9.204 885 HD3 LYS 113 2HD LYS 113 -9.162 -16.745 -9.585 886 HE2 LYS 113 1HE LYS 113 -11.093 -15.877 -7.485 887 HE3 LYS 113 2HE LYS 113 -11.512 -15.646 -9.182 888 HZ1 LYS 113 1HZ LYS 113 -11.581 -18.017 -7.644 889 HZ2 LYS 113 2HZ LYS 113 -10.537 -18.226 -8.958 890 HZ3 LYS 113 3HZ LYS 113 -12.141 -17.755 -9.219 891 H ILE 114 H ILE 114 -7.212 -13.385 -4.819 892 HA ILE 114 HA ILE 114 -8.660 -11.070 -4.557 893 HB ILE 114 HB ILE 114 -6.094 -11.711 -3.099 894 HG12 ILE 114 1HG1 ILE 114 -7.810 -13.511 -3.003 895 HG13 ILE 114 2HG1 ILE 114 -7.489 -12.782 -1.434 896 HG21 ILE 114 1HG2 ILE 114 -7.726 -10.381 -1.353 897 HG22 ILE 114 2HG2 ILE 114 -6.393 -9.661 -2.254 898 HG23 ILE 114 3HG2 ILE 114 -8.040 -9.545 -2.874 899 HD11 ILE 114 1HD1 ILE 114 -9.709 -12.671 -1.271 900 HD12 ILE 114 2HD1 ILE 114 -9.566 -11.272 -2.335 901 HD13 ILE 114 3HD1 ILE 114 -9.943 -12.857 -3.009 902 H ALA 115 H ALA 115 -5.168 -11.297 -5.227 903 HA ALA 115 HA ALA 115 -4.649 -8.566 -5.431 904 HB1 ALA 115 1HB ALA 115 -2.992 -10.497 -5.359 905 HB2 ALA 115 2HB ALA 115 -3.249 -10.635 -7.099 906 HB3 ALA 115 3HB ALA 115 -2.598 -9.143 -6.419 907 H ASN 116 H ASN 116 -5.281 -10.878 -8.077 908 HA ASN 116 HA ASN 116 -5.237 -9.183 -10.221 909 HB2 ASN 116 1HB ASN 116 -6.878 -11.623 -9.625 910 HB3 ASN 116 2HB ASN 116 -7.140 -10.733 -11.122 911 HD21 ASN 116 1HD2 ASN 116 -5.616 -13.298 -9.889 912 HD22 ASN 116 2HD2 ASN 116 -4.260 -13.401 -10.956 913 H GLU 117 H GLU 117 -8.027 -9.843 -8.117 914 HA GLU 117 HA GLU 117 -9.860 -8.182 -9.424 915 HB2 GLU 117 1HB GLU 117 -9.713 -8.926 -6.498 916 HB3 GLU 117 2HB GLU 117 -11.108 -8.199 -7.283 917 HG2 GLU 117 1HG GLU 117 -9.983 -10.949 -7.612 918 HG3 GLU 117 2HG GLU 117 -11.626 -10.458 -7.201 919 H LEU 118 H LEU 118 -7.530 -7.496 -6.860 920 HA LEU 118 HA LEU 118 -8.375 -4.734 -6.662 921 HB2 LEU 118 1HB LEU 118 -6.296 -6.409 -5.308 922 HB3 LEU 118 2HB LEU 118 -6.277 -4.654 -5.150 923 HG LEU 118 HG LEU 118 -8.761 -6.176 -4.477 924 HD11 LEU 118 1HD1 LEU 118 -7.597 -7.370 -2.978 925 HD12 LEU 118 2HD1 LEU 118 -7.572 -5.866 -2.059 926 HD13 LEU 118 3HD1 LEU 118 -6.193 -6.307 -3.066 927 HD21 LEU 118 1HD2 LEU 118 -7.953 -3.984 -2.772 928 HD22 LEU 118 2HD2 LEU 118 -9.442 -4.209 -3.691 929 HD23 LEU 118 3HD2 LEU 118 -8.025 -3.499 -4.466 930 H LYS 119 H LYS 119 -7.290 -5.791 -9.204 931 HA LYS 119 HA LYS 119 -5.620 -5.380 -10.752 932 HB2 LYS 119 1HB LYS 119 -6.720 -2.788 -9.761 933 HB3 LYS 119 2HB LYS 119 -5.377 -2.745 -10.896 934 HG2 LYS 119 1HG LYS 119 -7.304 -2.587 -12.213 935 HG3 LYS 119 2HG LYS 119 -6.774 -4.262 -12.376 936 HD2 LYS 119 1HD LYS 119 -8.400 -4.839 -10.541 937 HD3 LYS 119 2HD LYS 119 -9.026 -3.195 -10.683 938 HE2 LYS 119 1HE LYS 119 -10.439 -4.531 -12.014 939 HE3 LYS 119 2HE LYS 119 -9.376 -3.693 -13.144 940 HZ1 LYS 119 1HZ LYS 119 -8.413 -6.266 -12.234 941 HZ2 LYS 119 2HZ LYS 119 -8.422 -5.600 -13.789 942 HZ3 LYS 119 3HZ LYS 119 -9.819 -6.329 -13.173 943 H LEU 120 H LEU 120 -4.459 -6.074 -8.262 944 HA LEU 120 HA LEU 120 -2.374 -4.202 -7.633 945 HB2 LEU 120 1HB LEU 120 -2.941 -7.035 -6.810 946 HB3 LEU 120 2HB LEU 120 -1.484 -6.182 -6.301 947 HG LEU 120 HG LEU 120 -4.310 -5.325 -5.679 948 HD11 LEU 120 1HD1 LEU 120 -4.226 -6.915 -4.123 949 HD12 LEU 120 2HD1 LEU 120 -3.013 -5.918 -3.321 950 HD13 LEU 120 3HD1 LEU 120 -2.510 -7.215 -4.404 951 HD21 LEU 120 1HD2 LEU 120 -1.614 -4.172 -5.109 952 HD22 LEU 120 2HD2 LEU 120 -2.932 -3.937 -3.961 953 HD23 LEU 120 3HD2 LEU 120 -3.096 -3.364 -5.621 954 H SER 121 H SER 121 -0.059 -5.351 -7.455 955 HA SER 121 HA SER 121 0.987 -5.434 -10.023 956 HB2 SER 121 1HB SER 121 2.274 -5.056 -7.891 957 HB3 SER 121 2HB SER 121 2.208 -6.796 -7.613 958 HG SER 121 HG SER 121 3.906 -5.422 -9.143 959 H GLY 122 H GLY 122 0.656 -8.227 -7.818 960 HA2 GLY 122 1HA GLY 122 -0.191 -10.346 -8.386 961 HA3 GLY 122 2HA GLY 122 -0.126 -9.893 -10.082 962 HA PRO 123 HA PRO 123 4.392 -11.108 -8.838 963 HB2 PRO 123 1HB PRO 123 4.707 -12.254 -6.397 964 HB3 PRO 123 2HB PRO 123 4.834 -10.511 -6.664 965 HG2 PRO 123 1HG PRO 123 2.525 -12.104 -5.619 966 HG3 PRO 123 2HG PRO 123 3.164 -10.553 -5.045 967 HD2 PRO 123 1HD PRO 123 0.967 -10.730 -6.618 968 HD3 PRO 123 2HD PRO 123 2.088 -9.356 -6.695 969 H SER 124 H SER 124 1.541 -12.894 -8.298 970 HA SER 124 HA SER 124 2.531 -15.507 -8.060 971 HB2 SER 124 1HB SER 124 0.124 -14.699 -7.763 972 HB3 SER 124 2HB SER 124 -0.011 -14.783 -9.519 973 HG SER 124 HG SER 124 -0.328 -16.743 -7.814 974 H SER 125 H SER 125 1.130 -14.046 -10.999 975 HA SER 125 HA SER 125 2.368 -16.015 -12.680 976 HB2 SER 125 1HB SER 125 1.346 -14.758 -14.532 977 HB3 SER 125 2HB SER 125 0.176 -15.060 -13.248 978 HG SER 125 HG SER 125 1.302 -12.777 -12.658 979 H GLY 126 H GLY 126 4.596 -15.763 -12.300 980 HA2 GLY 126 1HA GLY 126 5.990 -14.165 -14.100 981 HA3 GLY 126 2HA GLY 126 5.967 -13.296 -12.573 Start of MODEL 11 1 H1 MET 1 H MET 1 -15.868 7.660 6.491 2 HA MET 1 HA MET 1 -17.118 10.138 7.464 3 HB2 MET 1 1HB MET 1 -14.233 9.581 6.907 4 HB3 MET 1 2HB MET 1 -14.866 11.195 6.611 5 HG2 MET 1 1HG MET 1 -15.694 11.203 8.973 6 HG3 MET 1 2HG MET 1 -14.808 9.700 9.216 7 HE1 MET 1 1HE MET 1 -13.516 13.035 10.855 8 HE2 MET 1 2HE MET 1 -14.551 11.619 11.042 9 HE3 MET 1 3HE MET 1 -12.813 11.484 11.313 10 H LYS 2 H LYS 2 -15.400 8.600 4.760 11 HA LYS 2 HA LYS 2 -15.593 8.821 2.504 12 HB2 LYS 2 1HB LYS 2 -17.986 8.167 3.271 13 HB3 LYS 2 2HB LYS 2 -18.389 9.840 2.909 14 HG2 LYS 2 1HG LYS 2 -17.862 9.573 0.622 15 HG3 LYS 2 2HG LYS 2 -17.086 8.014 0.911 16 HD2 LYS 2 1HD LYS 2 -19.381 7.240 1.746 17 HD3 LYS 2 2HD LYS 2 -20.011 8.699 0.977 18 HE2 LYS 2 1HE LYS 2 -18.261 6.794 -0.535 19 HE3 LYS 2 2HE LYS 2 -19.988 6.486 -0.359 20 HZ1 LYS 2 1HZ LYS 2 -20.470 8.571 -1.415 21 HZ2 LYS 2 2HZ LYS 2 -19.429 7.686 -2.412 22 HZ3 LYS 2 3HZ LYS 2 -18.828 8.973 -1.493 23 H ASP 3 H ASP 3 -14.440 11.003 3.796 24 HA ASP 3 HA ASP 3 -15.545 13.492 3.069 25 HB2 ASP 3 1HB ASP 3 -13.730 13.123 4.769 26 HB3 ASP 3 2HB ASP 3 -12.611 12.862 3.434 27 H HIS 4 H HIS 4 -15.801 14.349 1.125 28 HA HIS 4 HA HIS 4 -14.504 13.183 -1.179 29 HB2 HIS 4 1HB HIS 4 -16.484 15.452 -0.911 30 HB3 HIS 4 2HB HIS 4 -15.881 14.844 -2.449 31 HD1 HIS 4 1HD HIS 4 -18.729 14.570 -0.431 32 HD2 HIS 4 2HD HIS 4 -16.395 11.797 -2.462 33 HE1 HIS 4 1HE HIS 4 -20.188 12.541 -0.712 34 HE2 HIS 4 2HE HIS 4 -18.726 10.846 -1.868 35 H LEU 5 H LEU 5 -13.159 14.277 -2.642 36 HA LEU 5 HA LEU 5 -12.151 16.906 -1.929 37 HB2 LEU 5 1HB LEU 5 -9.812 16.168 -1.931 38 HB3 LEU 5 2HB LEU 5 -10.739 15.473 -0.603 39 HG LEU 5 HG LEU 5 -10.380 13.880 -3.100 40 HD11 LEU 5 1HD1 LEU 5 -8.164 13.927 -2.951 41 HD12 LEU 5 2HD1 LEU 5 -8.326 13.088 -1.409 42 HD13 LEU 5 3HD1 LEU 5 -8.215 14.847 -1.447 43 HD21 LEU 5 1HD2 LEU 5 -11.598 13.451 -0.666 44 HD22 LEU 5 2HD2 LEU 5 -10.053 12.618 -0.499 45 HD23 LEU 5 3HD2 LEU 5 -11.136 12.208 -1.830 46 H ILE 6 H ILE 6 -11.774 18.063 -3.706 47 HA ILE 6 HA ILE 6 -11.227 16.634 -6.222 48 HB ILE 6 HB ILE 6 -13.029 19.036 -5.896 49 HG12 ILE 6 1HG1 ILE 6 -13.736 16.256 -6.843 50 HG13 ILE 6 2HG1 ILE 6 -13.947 16.792 -5.180 51 HG21 ILE 6 1HG2 ILE 6 -12.626 17.493 -8.430 52 HG22 ILE 6 2HG2 ILE 6 -13.278 19.115 -8.206 53 HG23 ILE 6 3HG2 ILE 6 -11.551 18.822 -7.997 54 HD11 ILE 6 1HD1 ILE 6 -15.265 18.006 -7.596 55 HD12 ILE 6 2HD1 ILE 6 -16.025 16.917 -6.435 56 HD13 ILE 6 3HD1 ILE 6 -15.490 18.518 -5.924 57 H HIS 7 H HIS 7 -9.121 17.086 -6.526 58 HA HIS 7 HA HIS 7 -8.385 19.805 -7.124 59 HB2 HIS 7 1HB HIS 7 -7.145 18.352 -4.786 60 HB3 HIS 7 2HB HIS 7 -6.389 19.735 -5.570 61 HD1 HIS 7 1HD HIS 7 -8.453 21.789 -5.794 62 HD2 HIS 7 2HD HIS 7 -8.345 19.213 -2.537 63 HE1 HIS 7 1HE HIS 7 -9.723 22.962 -3.967 64 HE2 HIS 7 2HE HIS 7 -9.571 21.421 -1.980 65 H ASN 8 H ASN 8 -6.904 19.858 -8.709 66 HA ASN 8 HA ASN 8 -5.599 17.318 -9.419 67 HB2 ASN 8 1HB ASN 8 -5.337 18.565 -11.695 68 HB3 ASN 8 2HB ASN 8 -6.903 17.884 -11.261 69 HD21 ASN 8 1HD2 ASN 8 -5.012 20.836 -11.383 70 HD22 ASN 8 2HD2 ASN 8 -6.359 21.917 -11.456 71 H VAL 9 H VAL 9 -3.538 17.227 -8.839 72 HA VAL 9 HA VAL 9 -1.980 19.689 -8.604 73 HB VAL 9 HB VAL 9 -0.304 18.329 -7.461 74 HG11 VAL 9 1HG1 VAL 9 -3.109 18.471 -6.579 75 HG12 VAL 9 2HG1 VAL 9 -2.084 17.347 -5.684 76 HG13 VAL 9 3HG1 VAL 9 -1.639 19.050 -5.795 77 HG21 VAL 9 1HG2 VAL 9 -0.168 16.181 -8.059 78 HG22 VAL 9 2HG2 VAL 9 -1.503 15.903 -6.939 79 HG23 VAL 9 3HG2 VAL 9 -1.828 16.155 -8.654 80 H HIS 10 H HIS 10 -2.541 19.087 -11.217 81 HA HIS 10 HA HIS 10 -1.602 18.751 -13.265 82 HB2 HIS 10 1HB HIS 10 -0.054 20.470 -12.407 83 HB3 HIS 10 2HB HIS 10 0.970 19.204 -11.736 84 HD1 HIS 10 1HD HIS 10 2.777 18.365 -13.220 85 HD2 HIS 10 2HD HIS 10 -0.210 20.318 -15.347 86 HE1 HIS 10 1HE HIS 10 3.605 18.479 -15.591 87 HE2 HIS 10 2HE HIS 10 1.820 19.740 -16.843 88 H LYS 11 H LYS 11 -2.234 16.409 -11.943 89 HA LYS 11 HA LYS 11 -0.381 14.460 -11.551 90 HB2 LYS 11 1HB LYS 11 -2.973 14.129 -13.073 91 HB3 LYS 11 2HB LYS 11 -2.061 12.834 -12.310 92 HG2 LYS 11 1HG LYS 11 -2.478 13.756 -10.128 93 HG3 LYS 11 2HG LYS 11 -3.263 15.169 -10.838 94 HD2 LYS 11 1HD LYS 11 -5.049 13.814 -10.198 95 HD3 LYS 11 2HD LYS 11 -4.867 13.470 -11.920 96 HE2 LYS 11 1HE LYS 11 -3.590 11.457 -11.385 97 HE3 LYS 11 2HE LYS 11 -3.750 11.806 -9.664 98 HZ1 LYS 11 1HZ LYS 11 -5.583 10.517 -11.410 99 HZ2 LYS 11 2HZ LYS 11 -6.312 11.846 -10.661 100 HZ3 LYS 11 3HZ LYS 11 -5.610 10.626 -9.722 101 H GLU 12 H GLU 12 0.996 13.250 -12.733 102 HA GLU 12 HA GLU 12 0.829 13.322 -15.650 103 HB2 GLU 12 1HB GLU 12 2.330 15.159 -15.090 104 HB3 GLU 12 2HB GLU 12 3.298 14.091 -14.085 105 HG2 GLU 12 1HG GLU 12 4.082 12.883 -15.962 106 HG3 GLU 12 2HG GLU 12 2.908 13.652 -17.030 107 H GLU 13 H GLU 13 2.025 11.639 -16.697 108 HA GLU 13 HA GLU 13 1.941 9.176 -15.309 109 HB2 GLU 13 1HB GLU 13 2.969 8.239 -17.365 110 HB3 GLU 13 2HB GLU 13 1.557 9.235 -17.690 111 HG2 GLU 13 1HG GLU 13 3.285 11.128 -18.054 112 HG3 GLU 13 2HG GLU 13 4.436 9.805 -18.234 113 H HIS 14 H HIS 14 3.333 8.556 -13.804 114 HA HIS 14 HA HIS 14 6.183 9.213 -14.171 115 HB2 HIS 14 1HB HIS 14 4.484 9.172 -11.695 116 HB3 HIS 14 2HB HIS 14 6.224 8.923 -11.585 117 HD1 HIS 14 1HD HIS 14 7.083 11.062 -10.665 118 HD2 HIS 14 2HD HIS 14 4.348 11.670 -13.733 119 HE1 HIS 14 1HE HIS 14 7.080 13.542 -11.081 120 HE2 HIS 14 2HE HIS 14 5.355 13.896 -12.883 121 H ALA 15 H ALA 15 6.382 7.221 -15.361 122 HA ALA 15 HA ALA 15 6.391 4.843 -13.616 123 HB1 ALA 15 1HB ALA 15 6.099 3.508 -15.701 124 HB2 ALA 15 2HB ALA 15 4.724 4.540 -15.305 125 HB3 ALA 15 3HB ALA 15 5.850 5.020 -16.575 126 H HIS 16 H HIS 16 8.136 3.414 -13.781 127 HA HIS 16 HA HIS 16 10.429 4.333 -15.373 128 HB2 HIS 16 1HB HIS 16 10.398 3.647 -12.436 129 HB3 HIS 16 2HB HIS 16 11.879 3.642 -13.389 130 HD1 HIS 16 1HD HIS 16 12.431 6.037 -14.576 131 HD2 HIS 16 2HD HIS 16 9.748 6.072 -11.403 132 HE1 HIS 16 1HE HIS 16 12.334 8.428 -13.804 133 HE2 HIS 16 2HE HIS 16 10.770 8.409 -11.830 134 H ALA 17 H ALA 17 12.081 2.662 -15.694 135 HA ALA 17 HA ALA 17 11.219 0.370 -16.827 136 HB1 ALA 17 1HB ALA 17 13.747 0.169 -15.269 137 HB2 ALA 17 2HB ALA 17 13.399 -0.320 -16.928 138 HB3 ALA 17 3HB ALA 17 13.629 1.385 -16.541 139 H HIS 18 H HIS 18 9.697 -0.902 -15.918 140 HA HIS 18 HA HIS 18 9.495 -1.558 -13.200 141 HB2 HIS 18 1HB HIS 18 7.850 -3.173 -13.854 142 HB3 HIS 18 2HB HIS 18 7.679 -1.785 -14.925 143 HD1 HIS 18 1HD HIS 18 7.090 -5.036 -15.333 144 HD2 HIS 18 2HD HIS 18 9.919 -2.611 -17.169 145 HE1 HIS 18 1HE HIS 18 7.666 -6.191 -17.491 146 HE2 HIS 18 2HE HIS 18 9.442 -4.749 -18.544 147 H ASN 19 H ASN 19 11.201 -2.434 -12.173 148 HA ASN 19 HA ASN 19 12.262 -4.964 -13.248 149 HB2 ASN 19 1HB ASN 19 13.728 -2.660 -11.978 150 HB3 ASN 19 2HB ASN 19 14.407 -4.285 -11.982 151 HD21 ASN 19 1HD2 ASN 19 12.767 -2.135 -14.286 152 HD22 ASN 19 2HD2 ASN 19 13.887 -2.389 -15.577 153 H LYS 20 H LYS 20 11.476 -6.536 -12.010 154 HA LYS 20 HA LYS 20 11.640 -6.215 -9.089 155 HB2 LYS 20 1HB LYS 20 9.338 -7.160 -10.755 156 HB3 LYS 20 2HB LYS 20 9.561 -7.817 -9.139 157 HG2 LYS 20 1HG LYS 20 9.753 -5.235 -8.541 158 HG3 LYS 20 2HG LYS 20 8.758 -5.100 -9.993 159 HD2 LYS 20 1HD LYS 20 7.407 -7.042 -8.814 160 HD3 LYS 20 2HD LYS 20 8.136 -6.350 -7.364 161 HE2 LYS 20 1HE LYS 20 7.278 -4.104 -8.202 162 HE3 LYS 20 2HE LYS 20 6.313 -5.025 -9.355 163 HZ1 LYS 20 1HZ LYS 20 4.916 -5.728 -7.758 164 HZ2 LYS 20 2HZ LYS 20 5.462 -4.360 -6.927 165 HZ3 LYS 20 3HZ LYS 20 6.127 -5.877 -6.586 166 H ASP 21 H ASP 21 13.724 -7.312 -9.537 167 HA ASP 21 HA ASP 21 13.332 -10.222 -9.509 168 HB2 ASP 21 1HB ASP 21 14.123 -9.570 -11.758 169 HB3 ASP 21 2HB ASP 21 15.528 -8.799 -11.028 170 H TYR 22 H TYR 22 13.541 -10.088 -7.234 171 HA TYR 22 HA TYR 22 16.307 -9.612 -6.335 172 HB2 TYR 22 1HB TYR 22 15.048 -9.152 -4.057 173 HB3 TYR 22 2HB TYR 22 15.256 -7.875 -5.251 174 HD1 TYR 22 2HD TYR 22 13.261 -7.932 -7.112 175 HD2 TYR 22 1HD TYR 22 12.970 -9.266 -3.082 176 HE1 TYR 22 2HE TYR 22 10.826 -7.595 -7.182 177 HE2 TYR 22 1HE TYR 22 10.533 -8.934 -3.142 178 HH TYR 22 HH TYR 22 8.951 -7.432 -5.898 179 H ASP 23 H ASP 23 16.321 -10.599 -3.876 180 HA ASP 23 HA ASP 23 15.957 -13.443 -4.319 181 HB2 ASP 23 1HB ASP 23 17.056 -13.488 -1.950 182 HB3 ASP 23 2HB ASP 23 18.030 -13.050 -3.350 183 H ILE 24 H ILE 24 13.533 -12.963 -4.315 184 HA ILE 24 HA ILE 24 11.907 -12.195 -2.360 185 HB ILE 24 HB ILE 24 11.362 -14.960 -3.326 186 HG12 ILE 24 1HG1 ILE 24 12.358 -14.074 -5.299 187 HG13 ILE 24 2HG1 ILE 24 10.617 -13.938 -5.524 188 HG21 ILE 24 1HG2 ILE 24 9.130 -13.852 -3.783 189 HG22 ILE 24 2HG2 ILE 24 9.618 -13.963 -2.093 190 HG23 ILE 24 3HG2 ILE 24 9.776 -12.434 -2.957 191 HD11 ILE 24 1HD1 ILE 24 10.758 -11.746 -5.790 192 HD12 ILE 24 2HD1 ILE 24 11.694 -11.561 -4.307 193 HD13 ILE 24 3HD1 ILE 24 12.511 -11.935 -5.824 194 HA PRO 25 HA PRO 25 13.003 -14.284 1.371 195 HB2 PRO 25 1HB PRO 25 10.746 -13.747 2.781 196 HB3 PRO 25 2HB PRO 25 11.990 -12.532 2.459 197 HG2 PRO 25 1HG PRO 25 9.386 -12.995 1.056 198 HG3 PRO 25 2HG PRO 25 10.136 -11.465 1.548 199 HD2 PRO 25 1HD PRO 25 10.244 -12.389 -0.995 200 HD3 PRO 25 2HD PRO 25 11.550 -11.427 -0.272 201 H THR 26 H THR 26 12.951 -16.395 1.778 202 HA THR 26 HA THR 26 11.210 -18.211 0.584 203 HB THR 26 HB THR 26 12.079 -19.883 2.167 204 HG1 THR 26 1HG THR 26 12.158 -18.426 4.004 205 HG21 THR 26 1HG2 THR 26 14.356 -19.805 1.483 206 HG22 THR 26 2HG2 THR 26 14.314 -18.050 1.315 207 HG23 THR 26 3HG2 THR 26 13.416 -19.065 0.187 208 H THR 27 H THR 27 10.801 -16.278 3.399 209 HA THR 27 HA THR 27 9.021 -17.761 4.922 210 HB THR 27 HB THR 27 8.216 -15.679 5.849 211 HG1 THR 27 1HG THR 27 9.092 -13.690 4.772 212 HG21 THR 27 1HG2 THR 27 10.738 -14.519 5.727 213 HG22 THR 27 2HG2 THR 27 11.035 -16.237 5.461 214 HG23 THR 27 3HG2 THR 27 10.183 -15.703 6.909 215 H GLU 28 H GLU 28 6.635 -17.189 5.197 216 HA GLU 28 HA GLU 28 5.363 -17.431 2.571 217 HB2 GLU 28 1HB GLU 28 4.313 -17.999 5.348 218 HB3 GLU 28 2HB GLU 28 3.382 -18.197 3.869 219 HG2 GLU 28 1HG GLU 28 5.160 -19.807 3.103 220 HG3 GLU 28 2HG GLU 28 5.809 -19.735 4.740 221 H ASN 29 H ASN 29 5.786 -15.061 2.308 222 HA ASN 29 HA ASN 29 3.452 -13.575 3.266 223 HB2 ASN 29 1HB ASN 29 6.327 -12.688 3.503 224 HB3 ASN 29 2HB ASN 29 4.982 -11.552 3.549 225 HD21 ASN 29 1HD2 ASN 29 6.559 -14.197 5.177 226 HD22 ASN 29 2HD2 ASN 29 5.807 -13.960 6.714 227 H LEU 30 H LEU 30 2.399 -12.817 1.564 228 HA LEU 30 HA LEU 30 3.856 -12.387 -0.942 229 HB2 LEU 30 1HB LEU 30 0.926 -12.717 -0.336 230 HB3 LEU 30 2HB LEU 30 1.547 -12.289 -1.929 231 HG LEU 30 HG LEU 30 2.220 -14.839 -0.465 232 HD11 LEU 30 1HD1 LEU 30 0.687 -15.941 -1.980 233 HD12 LEU 30 2HD1 LEU 30 0.268 -14.397 -2.720 234 HD13 LEU 30 3HD1 LEU 30 -0.167 -14.716 -1.041 235 HD21 LEU 30 1HD2 LEU 30 3.008 -15.544 -2.703 236 HD22 LEU 30 2HD2 LEU 30 3.935 -14.202 -2.032 237 HD23 LEU 30 3HD2 LEU 30 2.730 -13.903 -3.286 238 H TYR 31 H TYR 31 4.093 -10.423 -1.832 239 HA TYR 31 HA TYR 31 2.805 -8.154 -0.466 240 HB2 TYR 31 1HB TYR 31 5.328 -8.017 -2.114 241 HB3 TYR 31 2HB TYR 31 4.700 -6.812 -0.996 242 HD1 TYR 31 1HD TYR 31 4.623 -7.427 1.488 243 HD2 TYR 31 2HD TYR 31 6.856 -9.633 -1.385 244 HE1 TYR 31 1HE TYR 31 5.989 -8.386 3.294 245 HE2 TYR 31 2HE TYR 31 8.227 -10.599 0.414 246 HH TYR 31 HH TYR 31 8.492 -10.804 2.619 247 H PHE 32 H PHE 32 1.516 -6.840 -1.595 248 HA PHE 32 HA PHE 32 1.581 -6.993 -4.533 249 HB2 PHE 32 1HB PHE 32 -0.953 -6.789 -2.899 250 HB3 PHE 32 2HB PHE 32 -0.822 -7.000 -4.642 251 HD1 PHE 32 1HD PHE 32 -0.414 -8.640 -1.380 252 HD2 PHE 32 2HD PHE 32 -0.442 -9.145 -5.606 253 HE1 PHE 32 1HE PHE 32 -0.498 -11.082 -1.084 254 HE2 PHE 32 2HE PHE 32 -0.527 -11.587 -5.318 255 HZ PHE 32 HZ PHE 32 -0.556 -12.558 -3.055 256 H GLN 33 H GLN 33 0.568 -5.119 -5.599 257 HA GLN 33 HA GLN 33 0.482 -2.698 -3.954 258 HB2 GLN 33 1HB GLN 33 2.091 -1.550 -5.134 259 HB3 GLN 33 2HB GLN 33 2.769 -3.172 -5.155 260 HG2 GLN 33 1HG GLN 33 3.019 -2.635 -7.342 261 HG3 GLN 33 2HG GLN 33 1.404 -3.337 -7.404 262 HE21 GLN 33 1HE2 GLN 33 2.696 -0.174 -6.442 263 HE22 GLN 33 2HE2 GLN 33 1.660 0.752 -7.469 264 H GLY 34 H GLY 34 -1.058 -1.269 -4.549 265 HA2 GLY 34 1HA GLY 34 -2.051 -0.594 -6.972 266 HA3 GLY 34 2HA GLY 34 -2.907 -2.087 -6.616 267 H SER 35 H SER 35 -1.970 0.765 -4.690 268 HA SER 35 HA SER 35 -4.357 0.709 -3.158 269 HB2 SER 35 1HB SER 35 -2.254 1.695 -2.320 270 HB3 SER 35 2HB SER 35 -2.381 2.974 -3.527 271 HG SER 35 HG SER 35 -3.201 3.493 -1.378 272 H SER 36 H SER 36 -6.021 2.336 -3.090 273 HA SER 36 HA SER 36 -6.618 3.409 -5.765 274 HB2 SER 36 1HB SER 36 -8.163 1.682 -4.572 275 HB3 SER 36 2HB SER 36 -8.682 3.065 -3.609 276 HG SER 36 HG SER 36 -9.802 3.743 -5.246 277 H GLY 37 H GLY 37 -4.913 4.771 -3.894 278 HA2 GLY 37 1HA GLY 37 -4.855 7.204 -3.847 279 HA3 GLY 37 2HA GLY 37 -6.566 7.176 -3.449 280 H SER 38 H SER 38 -7.191 6.383 -1.337 281 HA SER 38 HA SER 38 -5.104 6.933 0.661 282 HB2 SER 38 1HB SER 38 -8.098 7.262 0.702 283 HB3 SER 38 2HB SER 38 -7.157 7.237 2.193 284 HG SER 38 HG SER 38 -7.210 9.338 1.646 285 H SER 39 H SER 39 -5.407 5.759 2.773 286 HA SER 39 HA SER 39 -5.277 2.973 2.324 287 HB2 SER 39 1HB SER 39 -5.211 2.836 4.840 288 HB3 SER 39 2HB SER 39 -4.011 3.919 4.135 289 HG SER 39 HG SER 39 -5.384 4.657 6.017 290 H GLY 40 H GLY 40 -7.883 5.105 3.115 291 HA2 GLY 40 1HA GLY 40 -9.655 3.290 4.332 292 HA3 GLY 40 2HA GLY 40 -10.122 4.747 3.467 293 H ASP 41 H ASP 41 -9.751 4.448 0.958 294 HA ASP 41 HA ASP 41 -11.686 2.780 -0.018 295 HB2 ASP 41 1HB ASP 41 -9.170 3.554 -1.510 296 HB3 ASP 41 2HB ASP 41 -10.714 3.094 -2.223 297 H MET 42 H MET 42 -8.218 2.073 0.257 298 HA MET 42 HA MET 42 -7.918 -0.290 -0.981 299 HB2 MET 42 1HB MET 42 -6.835 0.786 1.563 300 HB3 MET 42 2HB MET 42 -6.592 -0.929 1.264 301 HG2 MET 42 1HG MET 42 -5.933 0.945 -0.931 302 HG3 MET 42 2HG MET 42 -4.868 0.922 0.473 303 HE1 MET 42 1HE MET 42 -6.490 -0.664 -2.324 304 HE2 MET 42 2HE MET 42 -4.998 -1.183 -3.108 305 HE3 MET 42 3HE MET 42 -6.041 -2.370 -2.324 306 H MET 43 H MET 43 -9.398 0.097 2.226 307 HA MET 43 HA MET 43 -9.892 -2.611 2.728 308 HB2 MET 43 1HB MET 43 -11.658 -0.344 3.642 309 HB3 MET 43 2HB MET 43 -11.386 -1.886 4.442 310 HG2 MET 43 1HG MET 43 -8.954 -1.154 4.651 311 HG3 MET 43 2HG MET 43 -9.530 0.454 4.217 312 HE1 MET 43 1HE MET 43 -9.519 -1.496 8.227 313 HE2 MET 43 2HE MET 43 -10.315 -2.492 7.008 314 HE3 MET 43 3HE MET 43 -8.669 -1.915 6.739 315 H ARG 44 H ARG 44 -12.404 -0.229 1.879 316 HA ARG 44 HA ARG 44 -14.442 -1.905 1.247 317 HB2 ARG 44 1HB ARG 44 -13.634 0.690 -0.056 318 HB3 ARG 44 2HB ARG 44 -15.124 -0.145 -0.475 319 HG2 ARG 44 1HG ARG 44 -16.139 0.392 1.476 320 HG3 ARG 44 2HG ARG 44 -14.634 0.357 2.397 321 HD2 ARG 44 1HD ARG 44 -15.496 2.624 2.259 322 HD3 ARG 44 2HD ARG 44 -13.973 2.487 1.382 323 HE ARG 44 HE ARG 44 -15.730 2.115 -0.583 324 HH11 ARG 44 2HH1 ARG 44 -15.641 4.483 1.968 325 HH12 ARG 44 1HH1 ARG 44 -16.445 5.705 1.039 326 HH21 ARG 44 2HH2 ARG 44 -16.789 3.715 -1.816 327 HH22 ARG 44 1HH2 ARG 44 -17.099 5.267 -1.113 328 H GLU 45 H GLU 45 -11.768 -0.985 -0.884 329 HA GLU 45 HA GLU 45 -12.691 -2.314 -3.188 330 HB2 GLU 45 1HB GLU 45 -10.711 -0.609 -2.805 331 HB3 GLU 45 2HB GLU 45 -9.765 -2.081 -2.634 332 HG2 GLU 45 1HG GLU 45 -10.160 -2.739 -4.829 333 HG3 GLU 45 2HG GLU 45 -11.543 -1.661 -5.002 334 H ILE 46 H ILE 46 -10.372 -3.342 -0.690 335 HA ILE 46 HA ILE 46 -9.770 -5.856 -1.704 336 HB ILE 46 HB ILE 46 -9.904 -4.898 1.151 337 HG12 ILE 46 1HG1 ILE 46 -7.390 -5.625 -0.278 338 HG13 ILE 46 2HG1 ILE 46 -8.185 -4.120 -0.727 339 HG21 ILE 46 1HG2 ILE 46 -10.115 -7.175 1.473 340 HG22 ILE 46 2HG2 ILE 46 -9.171 -7.571 0.038 341 HG23 ILE 46 3HG2 ILE 46 -8.365 -6.965 1.484 342 HD11 ILE 46 1HD1 ILE 46 -6.528 -3.650 0.922 343 HD12 ILE 46 2HD1 ILE 46 -8.117 -3.448 1.662 344 HD13 ILE 46 3HD1 ILE 46 -7.167 -4.897 1.992 345 H ARG 47 H ARG 47 -12.045 -5.233 0.977 346 HA ARG 47 HA ARG 47 -13.177 -7.679 1.251 347 HB2 ARG 47 1HB ARG 47 -14.333 -4.925 1.477 348 HB3 ARG 47 2HB ARG 47 -15.378 -6.324 1.685 349 HG2 ARG 47 1HG ARG 47 -14.708 -5.744 3.845 350 HG3 ARG 47 2HG ARG 47 -13.695 -7.124 3.416 351 HD2 ARG 47 1HD ARG 47 -12.638 -4.440 2.763 352 HD3 ARG 47 2HD ARG 47 -12.726 -4.860 4.473 353 HE ARG 47 HE ARG 47 -11.524 -6.949 2.979 354 HH11 ARG 47 2HH1 ARG 47 -10.905 -3.781 4.284 355 HH12 ARG 47 1HH1 ARG 47 -9.197 -4.031 4.427 356 HH21 ARG 47 2HH2 ARG 47 -9.276 -7.290 3.163 357 HH22 ARG 47 1HH2 ARG 47 -8.271 -6.027 3.789 358 H LYS 48 H LYS 48 -14.069 -5.251 -1.173 359 HA LYS 48 HA LYS 48 -16.265 -6.215 -2.361 360 HB2 LYS 48 1HB LYS 48 -14.829 -4.307 -3.165 361 HB3 LYS 48 2HB LYS 48 -13.811 -5.495 -3.969 362 HG2 LYS 48 1HG LYS 48 -15.686 -6.203 -5.342 363 HG3 LYS 48 2HG LYS 48 -16.741 -5.057 -4.512 364 HD2 LYS 48 1HD LYS 48 -16.191 -3.817 -6.353 365 HD3 LYS 48 2HD LYS 48 -14.883 -3.338 -5.270 366 HE2 LYS 48 1HE LYS 48 -13.352 -4.807 -6.326 367 HE3 LYS 48 2HE LYS 48 -14.640 -5.624 -7.211 368 HZ1 LYS 48 1HZ LYS 48 -13.787 -4.243 -8.806 369 HZ2 LYS 48 2HZ LYS 48 -13.415 -3.004 -7.717 370 HZ3 LYS 48 3HZ LYS 48 -15.019 -3.262 -8.188 371 H VAL 49 H VAL 49 -13.090 -7.706 -2.504 372 HA VAL 49 HA VAL 49 -13.892 -9.711 -4.414 373 HB VAL 49 HB VAL 49 -11.433 -9.716 -2.664 374 HG11 VAL 49 1HG1 VAL 49 -11.490 -11.815 -3.580 375 HG12 VAL 49 2HG1 VAL 49 -12.347 -11.281 -5.027 376 HG13 VAL 49 3HG1 VAL 49 -10.625 -10.944 -4.845 377 HG21 VAL 49 1HG2 VAL 49 -11.896 -7.649 -4.189 378 HG22 VAL 49 2HG2 VAL 49 -10.299 -8.398 -4.181 379 HG23 VAL 49 3HG2 VAL 49 -11.429 -8.746 -5.489 380 H LEU 50 H LEU 50 -13.235 -9.606 -0.929 381 HA LEU 50 HA LEU 50 -13.535 -12.287 -0.318 382 HB2 LEU 50 1HB LEU 50 -14.505 -9.988 1.370 383 HB3 LEU 50 2HB LEU 50 -14.057 -11.598 1.930 384 HG LEU 50 HG LEU 50 -12.129 -9.636 0.693 385 HD11 LEU 50 1HD1 LEU 50 -11.574 -8.834 2.748 386 HD12 LEU 50 2HD1 LEU 50 -12.075 -10.304 3.583 387 HD13 LEU 50 3HD1 LEU 50 -13.287 -9.151 3.025 388 HD21 LEU 50 1HD2 LEU 50 -10.973 -11.553 0.464 389 HD22 LEU 50 2HD2 LEU 50 -11.963 -12.417 1.641 390 HD23 LEU 50 3HD2 LEU 50 -10.671 -11.348 2.190 391 H GLY 51 H GLY 51 -16.091 -9.816 0.049 392 HA2 GLY 51 1HA GLY 51 -18.197 -11.567 0.521 393 HA3 GLY 51 2HA GLY 51 -18.371 -9.962 -0.174 394 H ALA 52 H ALA 52 -16.691 -10.679 -2.501 395 HA ALA 52 HA ALA 52 -18.790 -11.645 -4.179 396 HB1 ALA 52 1HB ALA 52 -16.602 -11.706 -5.777 397 HB2 ALA 52 2HB ALA 52 -17.566 -10.263 -5.460 398 HB3 ALA 52 3HB ALA 52 -16.088 -10.555 -4.543 399 H ASN 53 H ASN 53 -15.783 -13.007 -2.919 400 HA ASN 53 HA ASN 53 -16.304 -15.538 -4.274 401 HB2 ASN 53 1HB ASN 53 -13.959 -14.312 -2.903 402 HB3 ASN 53 2HB ASN 53 -14.070 -16.069 -2.918 403 HD21 ASN 53 1HD2 ASN 53 -14.287 -13.265 -5.066 404 HD22 ASN 53 2HD2 ASN 53 -13.545 -14.031 -6.425 405 H ASN 54 H ASN 54 -18.153 -14.752 -2.265 406 HA ASN 54 HA ASN 54 -19.091 -15.400 -0.271 407 HB2 ASN 54 1HB ASN 54 -18.112 -18.140 -1.062 408 HB3 ASN 54 2HB ASN 54 -19.597 -17.716 -0.216 409 HD21 ASN 54 1HD2 ASN 54 -20.965 -16.084 -1.552 410 HD22 ASN 54 2HD2 ASN 54 -21.210 -16.531 -3.203 411 H CYS 55 H CYS 55 -16.694 -14.338 0.337 412 HA CYS 55 HA CYS 55 -15.457 -16.236 2.216 413 HB2 CYS 55 1HB CYS 55 -14.354 -13.694 1.005 414 HB3 CYS 55 2HB CYS 55 -13.523 -14.663 2.215 415 HG CYS 55 HG CYS 55 -13.647 -15.055 -1.063 416 H ASP 56 H ASP 56 -14.592 -15.187 4.241 417 HA ASP 56 HA ASP 56 -16.412 -13.077 5.193 418 HB2 ASP 56 1HB ASP 56 -15.537 -15.541 6.717 419 HB3 ASP 56 2HB ASP 56 -16.481 -14.215 7.390 420 H TYR 57 H TYR 57 -15.600 -11.837 7.016 421 HA TYR 57 HA TYR 57 -12.822 -12.038 7.731 422 HB2 TYR 57 1HB TYR 57 -12.348 -9.662 6.925 423 HB3 TYR 57 2HB TYR 57 -12.399 -10.918 5.693 424 HD1 TYR 57 2HD TYR 57 -14.538 -11.176 4.337 425 HD2 TYR 57 1HD TYR 57 -13.749 -7.785 6.782 426 HE1 TYR 57 2HE TYR 57 -16.226 -9.892 3.091 427 HE2 TYR 57 1HE TYR 57 -15.436 -6.492 5.544 428 HH TYR 57 HH TYR 57 -16.956 -6.517 3.930 429 H GLU 58 H GLU 58 -12.298 -10.829 9.548 430 HA GLU 58 HA GLU 58 -14.535 -9.353 10.774 431 HB2 GLU 58 1HB GLU 58 -14.246 -10.407 12.773 432 HB3 GLU 58 2HB GLU 58 -13.664 -11.690 11.722 433 HG2 GLU 58 1HG GLU 58 -11.379 -11.050 12.129 434 HG3 GLU 58 2HG GLU 58 -11.904 -9.659 13.075 435 H GLN 59 H GLN 59 -14.129 -7.296 11.223 436 HA GLN 59 HA GLN 59 -11.546 -6.167 10.775 437 HB2 GLN 59 1HB GLN 59 -13.992 -5.151 10.545 438 HB3 GLN 59 2HB GLN 59 -13.667 -4.627 12.192 439 HG2 GLN 59 1HG GLN 59 -11.416 -3.784 11.103 440 HG3 GLN 59 2HG GLN 59 -12.406 -3.781 9.644 441 HE21 GLN 59 1HE2 GLN 59 -11.231 -1.543 11.072 442 HE22 GLN 59 2HE2 GLN 59 -12.541 -0.509 11.517 443 H ARG 60 H ARG 60 -9.979 -6.656 12.195 444 HA ARG 60 HA ARG 60 -10.488 -6.921 15.012 445 HB2 ARG 60 1HB ARG 60 -7.876 -6.850 13.490 446 HB3 ARG 60 2HB ARG 60 -8.057 -7.291 15.183 447 HG2 ARG 60 1HG ARG 60 -9.606 -8.785 13.124 448 HG3 ARG 60 2HG ARG 60 -7.887 -9.124 13.331 449 HD2 ARG 60 1HD ARG 60 -8.433 -9.341 15.828 450 HD3 ARG 60 2HD ARG 60 -10.117 -9.435 15.314 451 HE ARG 60 HE ARG 60 -8.918 -11.309 13.788 452 HH11 ARG 60 2HH1 ARG 60 -8.905 -10.667 17.210 453 HH12 ARG 60 1HH1 ARG 60 -8.687 -12.328 17.653 454 HH21 ARG 60 2HH2 ARG 60 -8.631 -13.499 14.359 455 HH22 ARG 60 1HH2 ARG 60 -8.531 -13.938 16.030 456 H GLU 61 H GLU 61 -9.021 -4.513 12.894 457 HA GLU 61 HA GLU 61 -9.228 -2.561 15.064 458 HB2 GLU 61 1HB GLU 61 -6.745 -2.947 13.383 459 HB3 GLU 61 2HB GLU 61 -7.002 -1.647 14.538 460 HG2 GLU 61 1HG GLU 61 -7.100 -3.248 16.357 461 HG3 GLU 61 2HG GLU 61 -6.912 -4.578 15.215 462 H ARG 62 H ARG 62 -8.340 -0.328 13.943 463 HA ARG 62 HA ARG 62 -10.364 0.474 12.219 464 HB2 ARG 62 1HB ARG 62 -9.232 2.166 13.410 465 HB3 ARG 62 2HB ARG 62 -7.658 1.635 12.835 466 HG2 ARG 62 1HG ARG 62 -7.888 2.676 10.811 467 HG3 ARG 62 2HG ARG 62 -9.651 2.599 10.850 468 HD2 ARG 62 1HD ARG 62 -9.584 4.269 12.721 469 HD3 ARG 62 2HD ARG 62 -7.857 4.443 12.415 470 HE ARG 62 HE ARG 62 -9.286 4.833 10.020 471 HH11 ARG 62 2HH1 ARG 62 -8.656 6.374 13.077 472 HH12 ARG 62 1HH1 ARG 62 -8.869 7.979 12.461 473 HH21 ARG 62 2HH2 ARG 62 -9.569 6.941 9.196 474 HH22 ARG 62 1HH2 ARG 62 -9.390 8.300 10.253 475 H PHE 63 H PHE 63 -6.956 -0.201 11.411 476 HA PHE 63 HA PHE 63 -7.793 -0.570 8.611 477 HB2 PHE 63 1HB PHE 63 -5.163 0.347 9.775 478 HB3 PHE 63 2HB PHE 63 -5.349 -0.134 8.091 479 HD1 PHE 63 2HD PHE 63 -7.529 1.046 6.971 480 HD2 PHE 63 1HD PHE 63 -5.179 2.595 10.163 481 HE1 PHE 63 2HE PHE 63 -8.264 3.324 6.402 482 HE2 PHE 63 1HE PHE 63 -5.911 4.876 9.600 483 HZ PHE 63 HZ PHE 63 -7.454 5.243 7.716 484 H LEU 64 H LEU 64 -8.156 -2.665 10.368 485 HA LEU 64 HA LEU 64 -6.283 -4.618 9.270 486 HB2 LEU 64 1HB LEU 64 -5.471 -3.943 11.527 487 HB3 LEU 64 2HB LEU 64 -6.990 -4.534 12.199 488 HG LEU 64 HG LEU 64 -6.391 -6.803 11.311 489 HD11 LEU 64 1HD1 LEU 64 -4.692 -5.765 9.678 490 HD12 LEU 64 2HD1 LEU 64 -4.279 -7.284 10.473 491 HD13 LEU 64 3HD1 LEU 64 -3.593 -5.768 11.057 492 HD21 LEU 64 1HD2 LEU 64 -5.526 -7.285 13.316 493 HD22 LEU 64 2HD2 LEU 64 -5.692 -5.560 13.648 494 HD23 LEU 64 3HD2 LEU 64 -4.149 -6.207 13.086 495 H LEU 65 H LEU 65 -7.237 -6.487 8.689 496 HA LEU 65 HA LEU 65 -9.846 -7.185 9.798 497 HB2 LEU 65 1HB LEU 65 -9.281 -6.523 6.940 498 HB3 LEU 65 2HB LEU 65 -10.508 -7.725 7.334 499 HG LEU 65 HG LEU 65 -10.719 -5.110 8.707 500 HD11 LEU 65 1HD1 LEU 65 -11.828 -4.087 6.775 501 HD12 LEU 65 2HD1 LEU 65 -11.348 -5.460 5.779 502 HD13 LEU 65 3HD1 LEU 65 -10.119 -4.397 6.465 503 HD21 LEU 65 1HD2 LEU 65 -13.089 -6.020 7.424 504 HD22 LEU 65 2HD2 LEU 65 -12.722 -5.952 9.148 505 HD23 LEU 65 3HD2 LEU 65 -12.319 -7.395 8.217 506 H PHE 66 H PHE 66 -10.209 -9.348 9.922 507 HA PHE 66 HA PHE 66 -7.963 -11.079 9.329 508 HB2 PHE 66 1HB PHE 66 -9.330 -11.146 11.481 509 HB3 PHE 66 2HB PHE 66 -10.605 -11.901 10.530 510 HD1 PHE 66 2HD PHE 66 -6.902 -12.337 10.741 511 HD2 PHE 66 1HD PHE 66 -10.750 -14.146 10.943 512 HE1 PHE 66 2HE PHE 66 -5.848 -14.534 11.079 513 HE2 PHE 66 1HE PHE 66 -9.701 -16.346 11.283 514 HZ PHE 66 HZ PHE 66 -7.247 -16.542 11.350 515 H CYS 67 H CYS 67 -7.920 -11.307 7.110 516 HA CYS 67 HA CYS 67 -10.243 -11.982 5.587 517 HB2 CYS 67 1HB CYS 67 -7.325 -12.225 4.825 518 HB3 CYS 67 2HB CYS 67 -8.692 -12.259 3.719 519 HG CYS 67 HG CYS 67 -9.036 -9.507 5.347 520 H VAL 68 H VAL 68 -11.140 -13.912 5.317 521 HA VAL 68 HA VAL 68 -9.505 -16.323 5.481 522 HB VAL 68 HB VAL 68 -10.363 -15.958 7.773 523 HG11 VAL 68 1HG1 VAL 68 -12.774 -16.221 8.201 524 HG12 VAL 68 2HG1 VAL 68 -12.416 -14.779 7.249 525 HG13 VAL 68 3HG1 VAL 68 -13.068 -16.218 6.463 526 HG21 VAL 68 1HG2 VAL 68 -10.953 -18.180 8.144 527 HG22 VAL 68 2HG2 VAL 68 -11.817 -18.309 6.612 528 HG23 VAL 68 3HG2 VAL 68 -10.055 -18.248 6.628 529 H HIS 69 H HIS 69 -10.115 -17.840 4.052 530 HA HIS 69 HA HIS 69 -12.609 -17.366 2.565 531 HB2 HIS 69 1HB HIS 69 -10.760 -17.245 1.080 532 HB3 HIS 69 2HB HIS 69 -10.009 -18.677 1.779 533 HD1 HIS 69 1HD HIS 69 -10.053 -20.427 0.037 534 HD2 HIS 69 2HD HIS 69 -13.618 -18.296 0.175 535 HE1 HIS 69 1HE HIS 69 -11.565 -21.536 -1.638 536 HE2 HIS 69 2HE HIS 69 -13.685 -20.177 -1.599 537 H GLY 70 H GLY 70 -14.208 -18.812 2.660 538 HA2 GLY 70 1HA GLY 70 -13.580 -21.492 3.736 539 HA3 GLY 70 2HA GLY 70 -15.001 -20.591 4.243 540 H ASP 71 H ASP 71 -14.486 -23.224 2.762 541 HA ASP 71 HA ASP 71 -16.438 -22.716 0.618 542 HB2 ASP 71 1HB ASP 71 -13.833 -24.155 0.497 543 HB3 ASP 71 2HB ASP 71 -15.176 -24.819 -0.430 544 H GLY 72 H GLY 72 -15.209 -24.847 3.100 545 HA2 GLY 72 1HA GLY 72 -17.648 -25.937 3.801 546 HA3 GLY 72 2HA GLY 72 -16.984 -27.016 2.583 547 H HIS 73 H HIS 73 -14.246 -26.742 3.292 548 HA HIS 73 HA HIS 73 -14.211 -27.899 5.999 549 HB2 HIS 73 1HB HIS 73 -12.964 -28.950 3.473 550 HB3 HIS 73 2HB HIS 73 -12.294 -29.361 5.049 551 HD1 HIS 73 1HD HIS 73 -13.309 -31.322 6.186 552 HD2 HIS 73 2HD HIS 73 -15.782 -29.780 3.225 553 HE1 HIS 73 1HE HIS 73 -15.248 -32.915 6.033 554 HE2 HIS 73 2HE HIS 73 -16.688 -32.008 4.176 555 H ALA 74 H ALA 74 -11.616 -28.255 6.456 556 HA ALA 74 HA ALA 74 -10.604 -25.533 6.533 557 HB1 ALA 74 1HB ALA 74 -8.829 -27.446 7.728 558 HB2 ALA 74 2HB ALA 74 -9.746 -26.144 8.487 559 HB3 ALA 74 3HB ALA 74 -10.484 -27.730 8.269 560 H GLU 75 H GLU 75 -9.938 -28.556 4.942 561 HA GLU 75 HA GLU 75 -7.310 -28.309 4.185 562 HB2 GLU 75 1HB GLU 75 -9.028 -30.164 3.654 563 HB3 GLU 75 2HB GLU 75 -9.402 -29.212 2.224 564 HG2 GLU 75 1HG GLU 75 -6.771 -29.306 1.934 565 HG3 GLU 75 2HG GLU 75 -6.977 -30.777 2.884 566 H ASN 76 H ASN 76 -10.145 -26.940 2.530 567 HA ASN 76 HA ASN 76 -8.447 -25.476 0.690 568 HB2 ASN 76 1HB ASN 76 -10.779 -24.552 -0.024 569 HB3 ASN 76 2HB ASN 76 -10.365 -26.223 -0.396 570 HD21 ASN 76 1HD2 ASN 76 -11.433 -24.687 2.610 571 HD22 ASN 76 2HD2 ASN 76 -12.834 -25.676 2.820 572 H LEU 77 H LEU 77 -10.000 -24.966 3.703 573 HA LEU 77 HA LEU 77 -10.429 -22.192 3.618 574 HB2 LEU 77 1HB LEU 77 -11.172 -23.924 5.363 575 HB3 LEU 77 2HB LEU 77 -9.587 -23.669 6.090 576 HG LEU 77 HG LEU 77 -10.403 -21.127 5.971 577 HD11 LEU 77 1HD1 LEU 77 -12.706 -22.516 5.210 578 HD12 LEU 77 2HD1 LEU 77 -12.578 -20.818 5.667 579 HD13 LEU 77 3HD1 LEU 77 -12.973 -22.031 6.884 580 HD21 LEU 77 1HD2 LEU 77 -9.835 -21.627 8.080 581 HD22 LEU 77 2HD2 LEU 77 -10.504 -23.256 7.979 582 HD23 LEU 77 3HD2 LEU 77 -11.563 -21.887 8.316 583 H VAL 78 H VAL 78 -9.192 -20.462 4.452 584 HA VAL 78 HA VAL 78 -6.418 -20.897 5.149 585 HB VAL 78 HB VAL 78 -7.163 -19.413 2.628 586 HG11 VAL 78 1HG1 VAL 78 -4.402 -19.665 3.794 587 HG12 VAL 78 2HG1 VAL 78 -4.935 -18.650 2.452 588 HG13 VAL 78 3HG1 VAL 78 -5.443 -18.274 4.099 589 HG21 VAL 78 1HG2 VAL 78 -5.735 -21.968 3.220 590 HG22 VAL 78 2HG2 VAL 78 -6.963 -21.626 2.001 591 HG23 VAL 78 3HG2 VAL 78 -5.313 -21.043 1.779 592 H GLN 79 H GLN 79 -5.946 -19.528 6.730 593 HA GLN 79 HA GLN 79 -7.540 -17.075 6.990 594 HB2 GLN 79 1HB GLN 79 -5.926 -18.615 9.026 595 HB3 GLN 79 2HB GLN 79 -6.725 -17.083 9.355 596 HG2 GLN 79 1HG GLN 79 -8.845 -18.010 9.205 597 HG3 GLN 79 2HG GLN 79 -8.274 -19.413 8.304 598 HE21 GLN 79 1HE2 GLN 79 -9.177 -20.895 9.692 599 HE22 GLN 79 2HE2 GLN 79 -8.585 -21.165 11.292 600 H TRP 80 H TRP 80 -6.628 -15.110 6.878 601 HA TRP 80 HA TRP 80 -3.803 -14.718 7.297 602 HB2 TRP 80 1HB TRP 80 -3.217 -13.980 5.113 603 HB3 TRP 80 2HB TRP 80 -4.024 -15.532 4.906 604 HD1 TRP 80 HD TRP 80 -4.346 -11.859 4.044 605 HE1 TRP 80 1HE TRP 80 -6.338 -11.536 2.446 606 HE3 TRP 80 3HE TRP 80 -6.385 -16.538 4.334 607 HZ2 TRP 80 2HZ TRP 80 -8.489 -13.063 1.442 608 HZ3 TRP 80 3HZ TRP 80 -8.410 -17.025 3.024 609 HH2 TRP 80 HH TRP 80 -9.439 -15.322 1.609 610 H GLU 81 H GLU 81 -3.357 -12.669 7.929 611 HA GLU 81 HA GLU 81 -5.624 -10.852 8.171 612 HB2 GLU 81 1HB GLU 81 -2.857 -10.807 9.383 613 HB3 GLU 81 2HB GLU 81 -4.061 -9.553 9.645 614 HG2 GLU 81 1HG GLU 81 -5.450 -10.971 10.866 615 HG3 GLU 81 2HG GLU 81 -4.649 -12.422 10.265 616 H MET 82 H MET 82 -5.706 -8.808 7.311 617 HA MET 82 HA MET 82 -3.530 -8.067 5.469 618 HB2 MET 82 1HB MET 82 -6.494 -8.104 5.025 619 HB3 MET 82 2HB MET 82 -5.493 -6.948 4.155 620 HG2 MET 82 1HG MET 82 -4.645 -9.784 4.119 621 HG3 MET 82 2HG MET 82 -6.079 -9.348 3.193 622 HE1 MET 82 1HE MET 82 -6.068 -8.189 0.947 623 HE2 MET 82 2HE MET 82 -5.787 -6.715 1.874 624 HE3 MET 82 3HE MET 82 -4.824 -7.048 0.435 625 H GLU 83 H GLU 83 -2.585 -6.264 6.137 626 HA GLU 83 HA GLU 83 -4.253 -4.193 7.408 627 HB2 GLU 83 1HB GLU 83 -2.770 -5.183 9.056 628 HB3 GLU 83 2HB GLU 83 -1.384 -4.931 8.005 629 HG2 GLU 83 1HG GLU 83 -2.175 -2.416 8.162 630 HG3 GLU 83 2HG GLU 83 -2.884 -2.990 9.670 631 H VAL 84 H VAL 84 -4.375 -2.366 6.298 632 HA VAL 84 HA VAL 84 -2.731 -1.911 3.992 633 HB VAL 84 HB VAL 84 -4.790 -0.128 5.299 634 HG11 VAL 84 1HG1 VAL 84 -4.564 1.383 3.610 635 HG12 VAL 84 2HG1 VAL 84 -2.901 0.796 3.677 636 HG13 VAL 84 3HG1 VAL 84 -4.008 0.174 2.453 637 HG21 VAL 84 1HG2 VAL 84 -6.208 -0.861 3.389 638 HG22 VAL 84 2HG2 VAL 84 -4.960 -2.033 2.967 639 HG23 VAL 84 3HG2 VAL 84 -5.801 -2.159 4.512 640 H CYS 85 H CYS 85 -0.625 -1.572 4.609 641 HA CYS 85 HA CYS 85 -0.126 0.937 6.058 642 HB2 CYS 85 1HB CYS 85 0.303 -1.286 7.362 643 HB3 CYS 85 2HB CYS 85 1.740 -1.393 6.354 644 HG CYS 85 HG CYS 85 1.132 1.424 8.167 645 H LYS 86 H LYS 86 1.818 2.029 5.493 646 HA LYS 86 HA LYS 86 2.737 1.364 2.783 647 HB2 LYS 86 1HB LYS 86 3.333 3.673 2.533 648 HB3 LYS 86 2HB LYS 86 1.703 3.607 3.190 649 HG2 LYS 86 1HG LYS 86 2.407 4.291 5.313 650 HG3 LYS 86 2HG LYS 86 4.100 3.938 4.960 651 HD2 LYS 86 1HD LYS 86 4.391 5.867 3.756 652 HD3 LYS 86 2HD LYS 86 2.694 5.953 3.279 653 HE2 LYS 86 1HE LYS 86 3.098 7.731 4.814 654 HE3 LYS 86 2HE LYS 86 2.146 6.510 5.657 655 HZ1 LYS 86 1HZ LYS 86 3.801 7.089 7.160 656 HZ2 LYS 86 2HZ LYS 86 5.009 7.154 5.979 657 HZ3 LYS 86 3HZ LYS 86 4.392 5.659 6.474 658 H LEU 87 H LEU 87 4.956 1.429 2.261 659 HA LEU 87 HA LEU 87 6.829 1.482 4.516 660 HB2 LEU 87 1HB LEU 87 7.954 -0.490 3.154 661 HB3 LEU 87 2HB LEU 87 6.750 -0.779 4.408 662 HG LEU 87 HG LEU 87 5.116 -0.648 2.306 663 HD11 LEU 87 1HD1 LEU 87 7.378 -2.069 1.012 664 HD12 LEU 87 2HD1 LEU 87 7.353 -0.307 0.937 665 HD13 LEU 87 3HD1 LEU 87 6.000 -1.237 0.292 666 HD21 LEU 87 1HD2 LEU 87 5.238 -3.104 2.208 667 HD22 LEU 87 2HD2 LEU 87 5.240 -2.498 3.865 668 HD23 LEU 87 3HD2 LEU 87 6.744 -3.052 3.125 669 HA PRO 88 HA PRO 88 9.374 3.854 1.835 670 HB2 PRO 88 1HB PRO 88 11.834 3.230 2.798 671 HB3 PRO 88 2HB PRO 88 10.697 4.267 3.667 672 HG2 PRO 88 1HG PRO 88 11.289 1.359 4.059 673 HG3 PRO 88 2HG PRO 88 11.063 2.629 5.276 674 HD2 PRO 88 1HD PRO 88 9.111 0.868 4.629 675 HD3 PRO 88 2HD PRO 88 8.765 2.535 5.130 676 H ARG 89 H ARG 89 10.056 0.423 2.194 677 HA ARG 89 HA ARG 89 11.991 -0.095 0.378 678 HB2 ARG 89 1HB ARG 89 9.418 -1.587 0.869 679 HB3 ARG 89 2HB ARG 89 10.681 -2.208 -0.185 680 HG2 ARG 89 1HG ARG 89 11.291 -1.414 2.635 681 HG3 ARG 89 2HG ARG 89 10.604 -2.996 2.260 682 HD2 ARG 89 1HD ARG 89 12.475 -3.659 1.048 683 HD3 ARG 89 2HD ARG 89 13.023 -2.001 0.805 684 HE ARG 89 HE ARG 89 13.549 -3.690 3.078 685 HH11 ARG 89 2HH1 ARG 89 13.386 -0.420 1.894 686 HH12 ARG 89 1HH1 ARG 89 14.455 0.210 3.103 687 HH21 ARG 89 2HH2 ARG 89 14.958 -2.873 4.675 688 HH22 ARG 89 1HH2 ARG 89 15.350 -1.187 4.684 689 H LEU 90 H LEU 90 8.547 -0.171 -0.557 690 HA LEU 90 HA LEU 90 9.361 0.524 -3.293 691 HB2 LEU 90 1HB LEU 90 6.882 -0.787 -2.203 692 HB3 LEU 90 2HB LEU 90 7.037 -0.254 -3.875 693 HG LEU 90 HG LEU 90 7.408 -2.715 -3.438 694 HD11 LEU 90 1HD1 LEU 90 9.282 -0.912 -4.889 695 HD12 LEU 90 2HD1 LEU 90 8.124 -2.083 -5.520 696 HD13 LEU 90 3HD1 LEU 90 9.641 -2.637 -4.810 697 HD21 LEU 90 1HD2 LEU 90 9.559 -3.397 -2.566 698 HD22 LEU 90 2HD2 LEU 90 8.705 -2.435 -1.360 699 HD23 LEU 90 3HD2 LEU 90 10.015 -1.715 -2.297 700 H SER 91 H SER 91 8.850 2.313 -0.867 701 HA SER 91 HA SER 91 7.606 4.182 -0.301 702 HB2 SER 91 1HB SER 91 8.533 4.625 -3.140 703 HB3 SER 91 2HB SER 91 7.797 5.902 -2.171 704 HG SER 91 HG SER 91 10.160 5.762 -2.121 705 H LEU 92 H LEU 92 5.737 2.334 -0.661 706 HA LEU 92 HA LEU 92 3.554 3.844 -1.816 707 HB2 LEU 92 1HB LEU 92 4.583 1.310 -2.972 708 HB3 LEU 92 2HB LEU 92 2.836 1.533 -2.905 709 HG LEU 92 HG LEU 92 4.596 3.610 -4.159 710 HD11 LEU 92 1HD1 LEU 92 5.303 1.810 -5.425 711 HD12 LEU 92 2HD1 LEU 92 3.909 2.388 -6.337 712 HD13 LEU 92 3HD1 LEU 92 3.755 0.975 -5.293 713 HD21 LEU 92 1HD2 LEU 92 2.212 3.334 -5.540 714 HD22 LEU 92 2HD2 LEU 92 2.599 4.577 -4.349 715 HD23 LEU 92 3HD2 LEU 92 1.759 3.108 -3.850 716 H ASN 93 H ASN 93 1.431 2.556 -1.486 717 HA ASN 93 HA ASN 93 1.444 1.646 1.278 718 HB2 ASN 93 1HB ASN 93 -1.064 1.841 -0.335 719 HB3 ASN 93 2HB ASN 93 -0.794 2.213 1.365 720 HD21 ASN 93 1HD2 ASN 93 -0.232 3.334 -1.916 721 HD22 ASN 93 2HD2 ASN 93 -0.098 5.010 -1.518 722 H GLY 94 H GLY 94 2.445 -0.015 -1.003 723 HA2 GLY 94 1HA GLY 94 0.987 -2.020 -1.964 724 HA3 GLY 94 2HA GLY 94 2.534 -2.339 -1.194 725 H VAL 95 H VAL 95 -0.072 -3.855 -1.344 726 HA VAL 95 HA VAL 95 -0.801 -3.998 1.483 727 HB VAL 95 HB VAL 95 -2.001 -5.422 -0.896 728 HG11 VAL 95 1HG1 VAL 95 -2.362 -5.713 1.984 729 HG12 VAL 95 2HG1 VAL 95 -3.869 -5.422 1.113 730 HG13 VAL 95 3HG1 VAL 95 -2.840 -6.784 0.667 731 HG21 VAL 95 1HG2 VAL 95 -2.493 -2.802 0.360 732 HG22 VAL 95 2HG2 VAL 95 -2.790 -3.343 -1.292 733 HG23 VAL 95 3HG2 VAL 95 -3.928 -3.759 -0.010 734 H ARG 96 H ARG 96 0.345 -5.308 2.735 735 HA ARG 96 HA ARG 96 1.732 -7.596 1.582 736 HB2 ARG 96 1HB ARG 96 3.049 -6.231 3.055 737 HB3 ARG 96 2HB ARG 96 1.827 -6.320 4.316 738 HG2 ARG 96 1HG ARG 96 2.267 -8.866 4.233 739 HG3 ARG 96 2HG ARG 96 3.761 -8.408 3.412 740 HD2 ARG 96 1HD ARG 96 4.042 -6.764 5.403 741 HD3 ARG 96 2HD ARG 96 2.871 -7.810 6.205 742 HE ARG 96 HE ARG 96 5.166 -9.141 5.033 743 HH11 ARG 96 2HH1 ARG 96 3.714 -7.754 7.877 744 HH12 ARG 96 1HH1 ARG 96 4.731 -8.622 8.979 745 HH21 ARG 96 2HH2 ARG 96 6.511 -10.290 6.473 746 HH22 ARG 96 1HH2 ARG 96 6.322 -10.064 8.179 747 H PHE 97 H PHE 97 1.494 -9.723 2.343 748 HA PHE 97 HA PHE 97 -1.077 -10.234 3.688 749 HB2 PHE 97 1HB PHE 97 0.393 -11.773 1.556 750 HB3 PHE 97 2HB PHE 97 -0.871 -12.517 2.531 751 HD1 PHE 97 1HD PHE 97 -0.559 -9.158 0.940 752 HD2 PHE 97 2HD PHE 97 -2.755 -12.790 1.249 753 HE1 PHE 97 1HE PHE 97 -2.262 -8.254 -0.588 754 HE2 PHE 97 2HE PHE 97 -4.461 -11.893 -0.280 755 HZ PHE 97 HZ PHE 97 -4.216 -9.623 -1.201 756 H LYS 98 H LYS 98 -1.192 -12.091 5.093 757 HA LYS 98 HA LYS 98 1.360 -13.130 6.068 758 HB2 LYS 98 1HB LYS 98 0.940 -11.193 7.477 759 HB3 LYS 98 2HB LYS 98 -0.690 -11.760 7.818 760 HG2 LYS 98 1HG LYS 98 0.114 -13.578 9.104 761 HG3 LYS 98 2HG LYS 98 1.772 -13.319 8.556 762 HD2 LYS 98 1HD LYS 98 2.014 -11.378 9.846 763 HD3 LYS 98 2HD LYS 98 0.272 -11.202 10.069 764 HE2 LYS 98 1HE LYS 98 1.210 -11.983 12.126 765 HE3 LYS 98 2HE LYS 98 0.302 -13.309 11.401 766 HZ1 LYS 98 1HZ LYS 98 2.779 -13.561 12.323 767 HZ2 LYS 98 2HZ LYS 98 3.120 -13.174 10.712 768 HZ3 LYS 98 3HZ LYS 98 2.156 -14.517 11.073 769 H ARG 99 H ARG 99 1.216 -15.262 6.214 770 HA ARG 99 HA ARG 99 -1.307 -16.604 6.041 771 HB2 ARG 99 1HB ARG 99 0.910 -17.378 5.043 772 HB3 ARG 99 2HB ARG 99 1.348 -17.884 6.669 773 HG2 ARG 99 1HG ARG 99 -0.499 -19.430 6.735 774 HG3 ARG 99 2HG ARG 99 -1.070 -18.860 5.166 775 HD2 ARG 99 1HD ARG 99 0.082 -20.704 4.488 776 HD3 ARG 99 2HD ARG 99 1.388 -19.521 4.443 777 HE ARG 99 HE ARG 99 2.379 -20.580 6.229 778 HH11 ARG 99 2HH1 ARG 99 -0.850 -21.800 5.777 779 HH12 ARG 99 1HH1 ARG 99 -0.649 -23.113 6.889 780 HH21 ARG 99 2HH2 ARG 99 2.656 -22.305 7.695 781 HH22 ARG 99 1HH2 ARG 99 1.345 -23.399 7.980 782 H ILE 100 H ILE 100 -2.593 -17.161 7.662 783 HA ILE 100 HA ILE 100 -1.538 -17.078 10.396 784 HB ILE 100 HB ILE 100 -4.413 -17.151 9.471 785 HG12 ILE 100 1HG1 ILE 100 -2.860 -15.068 9.024 786 HG13 ILE 100 2HG1 ILE 100 -4.500 -14.849 9.625 787 HG21 ILE 100 1HG2 ILE 100 -4.366 -18.045 11.638 788 HG22 ILE 100 2HG2 ILE 100 -3.132 -16.906 12.174 789 HG23 ILE 100 3HG2 ILE 100 -4.775 -16.344 11.865 790 HD11 ILE 100 1HD1 ILE 100 -1.992 -14.836 11.287 791 HD12 ILE 100 2HD1 ILE 100 -2.938 -13.426 10.808 792 HD13 ILE 100 3HD1 ILE 100 -3.634 -14.627 11.895 793 H SER 101 H SER 101 -3.565 -19.113 8.299 794 HA SER 101 HA SER 101 -2.475 -21.507 9.447 795 HB2 SER 101 1HB SER 101 -4.337 -22.352 10.573 796 HB3 SER 101 2HB SER 101 -4.366 -20.648 11.026 797 HG SER 101 HG SER 101 -5.750 -20.647 8.900 798 H GLY 102 H GLY 102 -3.749 -23.482 8.538 799 HA2 GLY 102 1HA GLY 102 -5.073 -24.359 6.738 800 HA3 GLY 102 2HA GLY 102 -4.793 -22.865 5.855 801 H THR 103 H THR 103 -3.782 -23.476 4.044 802 HA THR 103 HA THR 103 -1.271 -24.981 4.343 803 HB THR 103 HB THR 103 -1.756 -26.018 2.090 804 HG1 THR 103 1HG THR 103 -3.553 -24.479 1.689 805 HG21 THR 103 1HG2 THR 103 -2.969 -26.675 4.675 806 HG22 THR 103 2HG2 THR 103 -2.048 -27.690 3.565 807 HG23 THR 103 3HG2 THR 103 -3.770 -27.424 3.294 808 H SER 104 H SER 104 0.247 -24.659 2.553 809 HA SER 104 HA SER 104 0.476 -21.897 1.892 810 HB2 SER 104 1HB SER 104 2.388 -22.986 0.366 811 HB3 SER 104 2HB SER 104 2.576 -22.787 2.108 812 HG SER 104 HG SER 104 2.501 -24.880 2.352 813 H ILE 105 H ILE 105 0.155 -24.799 -0.159 814 HA ILE 105 HA ILE 105 -0.012 -23.781 -2.636 815 HB ILE 105 HB ILE 105 -1.680 -25.928 -1.367 816 HG12 ILE 105 1HG1 ILE 105 0.615 -26.515 -1.746 817 HG13 ILE 105 2HG1 ILE 105 -0.345 -27.331 -2.975 818 HG21 ILE 105 1HG2 ILE 105 -2.172 -24.576 -3.911 819 HG22 ILE 105 2HG2 ILE 105 -2.028 -26.328 -4.046 820 HG23 ILE 105 3HG2 ILE 105 -3.224 -25.623 -2.959 821 HD11 ILE 105 1HD1 ILE 105 1.506 -25.006 -3.265 822 HD12 ILE 105 2HD1 ILE 105 1.468 -26.527 -4.158 823 HD13 ILE 105 3HD1 ILE 105 0.233 -25.302 -4.449 824 H ALA 106 H ALA 106 -3.015 -24.252 -0.769 825 HA ALA 106 HA ALA 106 -4.662 -22.708 -2.374 826 HB1 ALA 106 1HB ALA 106 -5.001 -24.187 -0.104 827 HB2 ALA 106 2HB ALA 106 -5.322 -22.550 0.469 828 HB3 ALA 106 3HB ALA 106 -6.249 -23.210 -0.878 829 H PHE 107 H PHE 107 -2.722 -21.728 0.424 830 HA PHE 107 HA PHE 107 -3.592 -19.141 0.771 831 HB2 PHE 107 1HB PHE 107 -1.927 -20.279 2.213 832 HB3 PHE 107 2HB PHE 107 -0.723 -20.086 0.943 833 HD1 PHE 107 1HD PHE 107 -2.785 -18.316 3.418 834 HD2 PHE 107 2HD PHE 107 0.372 -18.005 0.580 835 HE1 PHE 107 1HE PHE 107 -2.195 -16.105 4.322 836 HE2 PHE 107 2HE PHE 107 0.968 -15.794 1.480 837 HZ PHE 107 HZ PHE 107 -0.315 -14.842 3.354 838 H LYS 108 H LYS 108 -1.091 -20.293 -1.473 839 HA LYS 108 HA LYS 108 -0.630 -17.699 -2.591 840 HB2 LYS 108 1HB LYS 108 0.248 -20.485 -3.262 841 HB3 LYS 108 2HB LYS 108 0.515 -19.185 -4.416 842 HG2 LYS 108 1HG LYS 108 2.479 -19.062 -3.304 843 HG3 LYS 108 2HG LYS 108 1.526 -18.006 -2.259 844 HD2 LYS 108 1HD LYS 108 2.487 -19.404 -0.707 845 HD3 LYS 108 2HD LYS 108 0.969 -20.249 -1.020 846 HE2 LYS 108 1HE LYS 108 3.533 -20.862 -2.475 847 HE3 LYS 108 2HE LYS 108 3.048 -21.682 -0.992 848 HZ1 LYS 108 1HZ LYS 108 2.248 -23.073 -2.624 849 HZ2 LYS 108 2HZ LYS 108 1.819 -21.810 -3.664 850 HZ3 LYS 108 3HZ LYS 108 0.882 -22.131 -2.292 851 H ASN 109 H ASN 109 -2.132 -20.666 -3.885 852 HA ASN 109 HA ASN 109 -2.975 -19.786 -6.323 853 HB2 ASN 109 1HB ASN 109 -4.197 -21.685 -4.350 854 HB3 ASN 109 2HB ASN 109 -5.053 -21.306 -5.842 855 HD21 ASN 109 1HD2 ASN 109 -2.154 -22.696 -4.477 856 HD22 ASN 109 2HD2 ASN 109 -1.700 -23.606 -5.874 857 H ILE 110 H ILE 110 -4.828 -19.492 -3.293 858 HA ILE 110 HA ILE 110 -6.934 -17.983 -4.428 859 HB ILE 110 HB ILE 110 -7.137 -19.216 -2.291 860 HG12 ILE 110 1HG1 ILE 110 -8.339 -17.367 -1.048 861 HG13 ILE 110 2HG1 ILE 110 -7.722 -16.252 -2.262 862 HG21 ILE 110 1HG2 ILE 110 -4.789 -18.030 -1.610 863 HG22 ILE 110 2HG2 ILE 110 -5.946 -17.060 -0.700 864 HG23 ILE 110 3HG2 ILE 110 -5.888 -18.808 -0.471 865 HD11 ILE 110 1HD1 ILE 110 -9.696 -16.681 -3.241 866 HD12 ILE 110 2HD1 ILE 110 -8.845 -18.100 -3.854 867 HD13 ILE 110 3HD1 ILE 110 -9.881 -18.238 -2.434 868 H ALA 111 H ALA 111 -3.863 -17.108 -2.982 869 HA ALA 111 HA ALA 111 -4.304 -14.383 -2.553 870 HB1 ALA 111 1HB ALA 111 -1.649 -14.544 -3.291 871 HB2 ALA 111 2HB ALA 111 -2.295 -14.758 -1.663 872 HB3 ALA 111 3HB ALA 111 -2.014 -16.163 -2.692 873 H SER 112 H SER 112 -3.491 -16.154 -5.471 874 HA SER 112 HA SER 112 -2.721 -14.002 -7.091 875 HB2 SER 112 1HB SER 112 -2.481 -16.462 -7.626 876 HB3 SER 112 2HB SER 112 -4.195 -16.466 -8.040 877 HG SER 112 HG SER 112 -2.100 -15.654 -9.515 878 H LYS 113 H LYS 113 -5.909 -15.447 -6.525 879 HA LYS 113 HA LYS 113 -7.360 -13.886 -8.342 880 HB2 LYS 113 1HB LYS 113 -8.063 -15.407 -5.862 881 HB3 LYS 113 2HB LYS 113 -9.270 -14.361 -6.599 882 HG2 LYS 113 1HG LYS 113 -9.695 -16.451 -7.519 883 HG3 LYS 113 2HG LYS 113 -8.763 -15.621 -8.769 884 HD2 LYS 113 1HD LYS 113 -6.758 -16.782 -8.114 885 HD3 LYS 113 2HD LYS 113 -7.582 -17.508 -6.732 886 HE2 LYS 113 1HE LYS 113 -8.743 -18.997 -8.035 887 HE3 LYS 113 2HE LYS 113 -8.704 -17.951 -9.454 888 HZ1 LYS 113 1HZ LYS 113 -6.666 -18.700 -10.068 889 HZ2 LYS 113 2HZ LYS 113 -7.209 -20.091 -9.272 890 HZ3 LYS 113 3HZ LYS 113 -6.161 -19.021 -8.485 891 H ILE 114 H ILE 114 -7.328 -13.484 -4.796 892 HA ILE 114 HA ILE 114 -8.588 -11.129 -4.494 893 HB ILE 114 HB ILE 114 -5.995 -11.817 -3.106 894 HG12 ILE 114 1HG1 ILE 114 -7.649 -13.615 -2.918 895 HG13 ILE 114 2HG1 ILE 114 -7.435 -12.802 -1.371 896 HG21 ILE 114 1HG2 ILE 114 -7.302 -9.444 -3.004 897 HG22 ILE 114 2HG2 ILE 114 -8.073 -10.315 -1.679 898 HG23 ILE 114 3HG2 ILE 114 -6.323 -10.102 -1.693 899 HD11 ILE 114 1HD1 ILE 114 -9.512 -11.422 -2.539 900 HD12 ILE 114 2HD1 ILE 114 -9.806 -13.098 -3.004 901 HD13 ILE 114 3HD1 ILE 114 -9.647 -12.671 -1.301 902 H ALA 115 H ALA 115 -5.186 -11.466 -5.450 903 HA ALA 115 HA ALA 115 -4.629 -8.704 -5.602 904 HB1 ALA 115 1HB ALA 115 -3.162 -11.017 -5.836 905 HB2 ALA 115 2HB ALA 115 -3.108 -10.344 -7.466 906 HB3 ALA 115 3HB ALA 115 -2.559 -9.380 -6.095 907 H ASN 116 H ASN 116 -5.093 -11.019 -8.283 908 HA ASN 116 HA ASN 116 -5.184 -9.268 -10.380 909 HB2 ASN 116 1HB ASN 116 -6.713 -11.827 -9.919 910 HB3 ASN 116 2HB ASN 116 -6.795 -10.948 -11.443 911 HD21 ASN 116 1HD2 ASN 116 -5.592 -13.589 -10.422 912 HD22 ASN 116 2HD2 ASN 116 -4.015 -13.599 -11.127 913 H GLU 117 H GLU 117 -7.987 -10.344 -8.458 914 HA GLU 117 HA GLU 117 -9.918 -8.786 -9.727 915 HB2 GLU 117 1HB GLU 117 -9.858 -9.561 -6.806 916 HB3 GLU 117 2HB GLU 117 -11.279 -9.112 -7.738 917 HG2 GLU 117 1HG GLU 117 -9.650 -11.613 -7.880 918 HG3 GLU 117 2HG GLU 117 -11.385 -11.426 -7.637 919 H LEU 118 H LEU 118 -7.669 -7.988 -7.145 920 HA LEU 118 HA LEU 118 -8.821 -5.333 -6.832 921 HB2 LEU 118 1HB LEU 118 -6.732 -6.917 -5.403 922 HB3 LEU 118 2HB LEU 118 -6.775 -5.165 -5.217 923 HG LEU 118 HG LEU 118 -9.259 -6.742 -4.713 924 HD11 LEU 118 1HD1 LEU 118 -6.843 -7.290 -3.384 925 HD12 LEU 118 2HD1 LEU 118 -8.467 -7.821 -2.949 926 HD13 LEU 118 3HD1 LEU 118 -7.820 -6.323 -2.279 927 HD21 LEU 118 1HD2 LEU 118 -8.682 -4.089 -4.644 928 HD22 LEU 118 2HD2 LEU 118 -8.420 -4.544 -2.960 929 HD23 LEU 118 3HD2 LEU 118 -9.977 -4.858 -3.727 930 H LYS 119 H LYS 119 -7.446 -6.239 -9.325 931 HA LYS 119 HA LYS 119 -5.750 -5.603 -10.754 932 HB2 LYS 119 1HB LYS 119 -7.078 -3.123 -9.728 933 HB3 LYS 119 2HB LYS 119 -5.732 -2.980 -10.851 934 HG2 LYS 119 1HG LYS 119 -8.021 -4.778 -11.506 935 HG3 LYS 119 2HG LYS 119 -8.170 -3.035 -11.740 936 HD2 LYS 119 1HD LYS 119 -5.778 -4.466 -12.815 937 HD3 LYS 119 2HD LYS 119 -7.312 -4.563 -13.683 938 HE2 LYS 119 1HE LYS 119 -6.059 -1.959 -12.842 939 HE3 LYS 119 2HE LYS 119 -5.740 -2.719 -14.401 940 HZ1 LYS 119 1HZ LYS 119 -8.424 -2.734 -14.307 941 HZ2 LYS 119 2HZ LYS 119 -7.501 -1.535 -15.063 942 HZ3 LYS 119 3HZ LYS 119 -8.079 -1.292 -13.492 943 H LEU 120 H LEU 120 -4.668 -6.313 -8.251 944 HA LEU 120 HA LEU 120 -2.742 -4.273 -7.525 945 HB2 LEU 120 1HB LEU 120 -3.024 -7.118 -6.568 946 HB3 LEU 120 2HB LEU 120 -1.968 -5.893 -5.869 947 HG LEU 120 HG LEU 120 -4.971 -5.658 -5.934 948 HD11 LEU 120 1HD1 LEU 120 -3.315 -7.341 -4.305 949 HD12 LEU 120 2HD1 LEU 120 -5.070 -7.169 -4.315 950 HD13 LEU 120 3HD1 LEU 120 -4.086 -6.102 -3.315 951 HD21 LEU 120 1HD2 LEU 120 -3.554 -4.283 -3.831 952 HD22 LEU 120 2HD2 LEU 120 -4.682 -3.649 -5.029 953 HD23 LEU 120 3HD2 LEU 120 -2.968 -3.794 -5.420 954 H SER 121 H SER 121 -0.416 -5.339 -7.099 955 HA SER 121 HA SER 121 0.906 -5.469 -9.482 956 HB2 SER 121 1HB SER 121 2.094 -5.211 -7.378 957 HB3 SER 121 2HB SER 121 1.653 -6.848 -6.891 958 HG SER 121 HG SER 121 3.095 -7.665 -8.253 959 H GLY 122 H GLY 122 -0.176 -8.269 -7.560 960 HA2 GLY 122 1HA GLY 122 -0.696 -10.415 -8.192 961 HA3 GLY 122 2HA GLY 122 -0.891 -9.796 -9.825 962 HA PRO 123 HA PRO 123 3.778 -10.986 -9.433 963 HB2 PRO 123 1HB PRO 123 4.528 -12.268 -7.161 964 HB3 PRO 123 2HB PRO 123 4.574 -10.509 -7.331 965 HG2 PRO 123 1HG PRO 123 2.509 -12.232 -6.016 966 HG3 PRO 123 2HG PRO 123 3.207 -10.700 -5.460 967 HD2 PRO 123 1HD PRO 123 0.777 -10.847 -6.646 968 HD3 PRO 123 2HD PRO 123 1.841 -9.437 -6.822 969 H SER 124 H SER 124 1.039 -12.772 -8.941 970 HA SER 124 HA SER 124 2.397 -15.313 -9.555 971 HB2 SER 124 1HB SER 124 1.114 -15.401 -7.470 972 HB3 SER 124 2HB SER 124 -0.332 -14.860 -8.322 973 HG SER 124 HG SER 124 1.071 -17.300 -8.656 974 H SER 125 H SER 125 2.056 -16.223 -11.478 975 HA SER 125 HA SER 125 0.704 -14.881 -13.538 976 HB2 SER 125 1HB SER 125 1.050 -16.987 -14.837 977 HB3 SER 125 2HB SER 125 2.515 -16.407 -14.045 978 HG SER 125 HG SER 125 0.912 -18.627 -13.432 979 H GLY 126 H GLY 126 -0.177 -17.900 -11.851 980 HA2 GLY 126 1HA GLY 126 -2.585 -18.429 -13.068 981 HA3 GLY 126 2HA GLY 126 -2.242 -18.800 -11.385 Start of MODEL 12 1 H1 MET 1 H MET 1 -27.360 1.005 1.901 2 HA MET 1 HA MET 1 -29.170 2.882 2.719 3 HB2 MET 1 1HB MET 1 -28.155 2.797 4.895 4 HB3 MET 1 2HB MET 1 -28.045 1.196 4.175 5 HG2 MET 1 1HG MET 1 -25.689 2.055 3.406 6 HG3 MET 1 2HG MET 1 -25.900 3.169 4.754 7 HE1 MET 1 1HE MET 1 -25.294 1.922 7.621 8 HE2 MET 1 2HE MET 1 -23.785 1.415 6.862 9 HE3 MET 1 3HE MET 1 -24.599 2.881 6.314 10 H LYS 2 H LYS 2 -29.263 5.039 2.883 11 HA LYS 2 HA LYS 2 -27.091 6.604 1.792 12 HB2 LYS 2 1HB LYS 2 -29.293 7.230 1.104 13 HB3 LYS 2 2HB LYS 2 -29.857 7.314 2.768 14 HG2 LYS 2 1HG LYS 2 -28.074 9.170 3.026 15 HG3 LYS 2 2HG LYS 2 -28.125 9.228 1.263 16 HD2 LYS 2 1HD LYS 2 -29.706 10.813 1.854 17 HD3 LYS 2 2HD LYS 2 -30.697 9.374 1.601 18 HE2 LYS 2 1HE LYS 2 -31.506 10.184 3.611 19 HE3 LYS 2 2HE LYS 2 -30.327 8.984 4.138 20 HZ1 LYS 2 1HZ LYS 2 -28.908 11.319 3.883 21 HZ2 LYS 2 2HZ LYS 2 -29.412 10.599 5.328 22 HZ3 LYS 2 3HZ LYS 2 -30.366 11.792 4.600 23 H ASP 3 H ASP 3 -25.446 6.468 3.320 24 HA ASP 3 HA ASP 3 -25.976 7.917 5.831 25 HB2 ASP 3 1HB ASP 3 -25.602 5.529 6.280 26 HB3 ASP 3 2HB ASP 3 -24.061 5.609 5.431 27 H HIS 4 H HIS 4 -23.930 8.846 6.789 28 HA HIS 4 HA HIS 4 -22.710 10.553 4.888 29 HB2 HIS 4 1HB HIS 4 -22.040 9.998 7.783 30 HB3 HIS 4 2HB HIS 4 -21.280 11.264 6.823 31 HD1 HIS 4 1HD HIS 4 -24.381 10.438 8.678 32 HD2 HIS 4 2HD HIS 4 -22.970 13.457 6.198 33 HE1 HIS 4 1HE HIS 4 -26.003 12.342 8.946 34 HE2 HIS 4 2HE HIS 4 -25.176 14.125 7.371 35 H LEU 5 H LEU 5 -20.506 10.699 4.277 36 HA LEU 5 HA LEU 5 -18.881 8.296 4.702 37 HB2 LEU 5 1HB LEU 5 -18.226 8.447 2.261 38 HB3 LEU 5 2HB LEU 5 -19.828 7.805 2.619 39 HG LEU 5 HG LEU 5 -19.615 9.394 0.641 40 HD11 LEU 5 1HD1 LEU 5 -21.673 8.848 2.325 41 HD12 LEU 5 2HD1 LEU 5 -21.809 9.805 0.851 42 HD13 LEU 5 3HD1 LEU 5 -21.614 10.608 2.408 43 HD21 LEU 5 1HD2 LEU 5 -19.411 11.691 0.994 44 HD22 LEU 5 2HD2 LEU 5 -18.165 10.992 2.028 45 HD23 LEU 5 3HD2 LEU 5 -19.686 11.545 2.730 46 H ILE 6 H ILE 6 -16.601 8.652 3.850 47 HA ILE 6 HA ILE 6 -15.655 11.175 4.897 48 HB ILE 6 HB ILE 6 -14.094 8.853 3.759 49 HG12 ILE 6 1HG1 ILE 6 -14.287 9.553 6.670 50 HG13 ILE 6 2HG1 ILE 6 -15.552 8.591 5.914 51 HG21 ILE 6 1HG2 ILE 6 -12.991 11.132 3.764 52 HG22 ILE 6 2HG2 ILE 6 -13.065 11.058 5.523 53 HG23 ILE 6 3HG2 ILE 6 -12.141 9.852 4.629 54 HD11 ILE 6 1HD1 ILE 6 -12.975 7.786 6.854 55 HD12 ILE 6 2HD1 ILE 6 -14.317 6.797 6.275 56 HD13 ILE 6 3HD1 ILE 6 -13.129 7.427 5.134 57 H HIS 7 H HIS 7 -14.834 12.850 3.772 58 HA HIS 7 HA HIS 7 -15.028 12.720 0.855 59 HB2 HIS 7 1HB HIS 7 -14.882 15.200 0.971 60 HB3 HIS 7 2HB HIS 7 -16.241 14.546 1.881 61 HD1 HIS 7 1HD HIS 7 -16.441 16.410 3.575 62 HD2 HIS 7 2HD HIS 7 -12.618 14.794 3.387 63 HE1 HIS 7 1HE HIS 7 -15.199 17.391 5.530 64 HE2 HIS 7 2HE HIS 7 -12.864 16.465 5.346 65 H ASN 8 H ASN 8 -13.344 14.530 -0.077 66 HA ASN 8 HA ASN 8 -10.753 14.569 1.027 67 HB2 ASN 8 1HB ASN 8 -11.169 12.089 0.212 68 HB3 ASN 8 2HB ASN 8 -10.785 12.775 -1.364 69 HD21 ASN 8 1HD2 ASN 8 -9.588 12.491 1.943 70 HD22 ASN 8 2HD2 ASN 8 -7.911 12.508 1.527 71 H VAL 9 H VAL 9 -9.087 15.184 -0.747 72 HA VAL 9 HA VAL 9 -10.391 16.737 -2.875 73 HB VAL 9 HB VAL 9 -8.564 18.503 -2.415 74 HG11 VAL 9 1HG1 VAL 9 -10.073 19.370 -0.417 75 HG12 VAL 9 2HG1 VAL 9 -10.664 19.328 -2.079 76 HG13 VAL 9 3HG1 VAL 9 -11.107 18.046 -0.951 77 HG21 VAL 9 1HG2 VAL 9 -7.158 17.551 -0.842 78 HG22 VAL 9 2HG2 VAL 9 -8.173 18.599 0.150 79 HG23 VAL 9 3HG2 VAL 9 -8.491 16.865 0.087 80 H HIS 10 H HIS 10 -9.642 14.853 -4.122 81 HA HIS 10 HA HIS 10 -6.851 14.353 -4.439 82 HB2 HIS 10 1HB HIS 10 -7.536 12.939 -6.331 83 HB3 HIS 10 2HB HIS 10 -8.515 12.618 -4.902 84 HD1 HIS 10 1HD HIS 10 -10.951 13.822 -4.932 85 HD2 HIS 10 2HD HIS 10 -8.969 13.509 -8.570 86 HE1 HIS 10 1HE HIS 10 -12.715 14.167 -6.691 87 HE2 HIS 10 2HE HIS 10 -11.508 13.888 -8.884 88 H LYS 11 H LYS 11 -5.443 15.042 -5.996 89 HA LYS 11 HA LYS 11 -6.172 17.489 -7.377 90 HB2 LYS 11 1HB LYS 11 -3.813 17.735 -7.828 91 HB3 LYS 11 2HB LYS 11 -4.027 17.297 -6.138 92 HG2 LYS 11 1HG LYS 11 -3.309 15.072 -6.533 93 HG3 LYS 11 2HG LYS 11 -3.371 15.296 -8.283 94 HD2 LYS 11 1HD LYS 11 -1.577 16.962 -6.544 95 HD3 LYS 11 2HD LYS 11 -1.075 15.379 -7.142 96 HE2 LYS 11 1HE LYS 11 -2.169 17.388 -9.058 97 HE3 LYS 11 2HE LYS 11 -0.512 17.562 -8.483 98 HZ1 LYS 11 1HZ LYS 11 -1.082 14.886 -9.291 99 HZ2 LYS 11 2HZ LYS 11 0.159 15.919 -9.794 100 HZ3 LYS 11 3HZ LYS 11 -1.352 15.983 -10.551 101 H GLU 12 H GLU 12 -5.481 17.806 -9.655 102 HA GLU 12 HA GLU 12 -6.320 15.508 -11.243 103 HB2 GLU 12 1HB GLU 12 -5.882 18.397 -12.018 104 HB3 GLU 12 2HB GLU 12 -6.477 17.144 -13.098 105 HG2 GLU 12 1HG GLU 12 -7.862 17.953 -10.555 106 HG3 GLU 12 2HG GLU 12 -8.230 18.635 -12.138 107 H GLU 13 H GLU 13 -5.166 14.874 -13.159 108 HA GLU 13 HA GLU 13 -2.558 15.812 -13.750 109 HB2 GLU 13 1HB GLU 13 -2.416 14.386 -11.521 110 HB3 GLU 13 2HB GLU 13 -2.436 13.040 -12.652 111 HG2 GLU 13 1HG GLU 13 -0.540 14.392 -13.836 112 HG3 GLU 13 2HG GLU 13 -0.376 15.151 -12.254 113 H HIS 14 H HIS 14 -1.519 14.558 -15.458 114 HA HIS 14 HA HIS 14 -2.904 12.384 -16.695 115 HB2 HIS 14 1HB HIS 14 -3.571 13.490 -18.744 116 HB3 HIS 14 2HB HIS 14 -4.335 14.299 -17.378 117 HD1 HIS 14 1HD HIS 14 -2.902 15.156 -20.425 118 HD2 HIS 14 2HD HIS 14 -2.376 16.584 -16.560 119 HE1 HIS 14 1HE HIS 14 -1.928 17.460 -20.686 120 HE2 HIS 14 2HE HIS 14 -1.539 18.271 -18.334 121 H ALA 15 H ALA 15 -1.110 11.216 -17.021 122 HA ALA 15 HA ALA 15 0.751 12.037 -19.035 123 HB1 ALA 15 1HB ALA 15 2.111 11.462 -16.451 124 HB2 ALA 15 2HB ALA 15 2.664 12.405 -17.835 125 HB3 ALA 15 3HB ALA 15 1.469 13.082 -16.729 126 H HIS 16 H HIS 16 2.406 10.339 -19.446 127 HA HIS 16 HA HIS 16 1.407 7.689 -18.630 128 HB2 HIS 16 1HB HIS 16 2.505 6.990 -20.890 129 HB3 HIS 16 2HB HIS 16 0.918 7.752 -20.901 130 HD1 HIS 16 1HD HIS 16 4.487 8.352 -21.831 131 HD2 HIS 16 2HD HIS 16 0.829 10.310 -22.037 132 HE1 HIS 16 1HE HIS 16 4.860 10.314 -23.359 133 HE2 HIS 16 2HE HIS 16 2.656 11.532 -23.401 134 H ALA 17 H ALA 17 2.859 6.172 -17.964 135 HA ALA 17 HA ALA 17 5.684 6.460 -18.356 136 HB1 ALA 17 1HB ALA 17 4.749 7.954 -16.293 137 HB2 ALA 17 2HB ALA 17 5.139 6.442 -15.472 138 HB3 ALA 17 3HB ALA 17 6.381 7.293 -16.391 139 H HIS 18 H HIS 18 6.075 4.406 -18.884 140 HA HIS 18 HA HIS 18 4.884 2.272 -17.250 141 HB2 HIS 18 1HB HIS 18 6.261 1.816 -19.881 142 HB3 HIS 18 2HB HIS 18 5.026 0.836 -19.095 143 HD1 HIS 18 1HD HIS 18 4.767 1.807 -22.037 144 HD2 HIS 18 2HD HIS 18 3.090 3.715 -18.749 145 HE1 HIS 18 1HE HIS 18 2.841 3.146 -22.946 146 HE2 HIS 18 2HE HIS 18 1.895 4.358 -20.951 147 H ASN 19 H ASN 19 6.402 2.432 -15.551 148 HA ASN 19 HA ASN 19 9.043 1.322 -16.232 149 HB2 ASN 19 1HB ASN 19 8.488 3.362 -14.065 150 HB3 ASN 19 2HB ASN 19 10.057 2.675 -14.473 151 HD21 ASN 19 1HD2 ASN 19 7.350 4.311 -16.084 152 HD22 ASN 19 2HD2 ASN 19 8.334 5.351 -17.051 153 H LYS 20 H LYS 20 6.887 -0.276 -15.584 154 HA LYS 20 HA LYS 20 7.325 -1.026 -12.777 155 HB2 LYS 20 1HB LYS 20 5.158 -1.959 -14.668 156 HB3 LYS 20 2HB LYS 20 5.260 -2.302 -12.946 157 HG2 LYS 20 1HG LYS 20 5.221 0.543 -13.776 158 HG3 LYS 20 2HG LYS 20 3.723 -0.380 -13.919 159 HD2 LYS 20 1HD LYS 20 3.480 0.335 -11.773 160 HD3 LYS 20 2HD LYS 20 4.420 -1.126 -11.459 161 HE2 LYS 20 1HE LYS 20 5.401 0.644 -10.200 162 HE3 LYS 20 2HE LYS 20 6.483 0.287 -11.545 163 HZ1 LYS 20 1HZ LYS 20 6.386 2.564 -11.603 164 HZ2 LYS 20 2HZ LYS 20 4.766 2.634 -11.120 165 HZ3 LYS 20 3HZ LYS 20 5.158 2.173 -12.699 166 H ASP 21 H ASP 21 9.410 -1.955 -13.339 167 HA ASP 21 HA ASP 21 9.104 -4.700 -14.336 168 HB2 ASP 21 1HB ASP 21 10.081 -3.298 -16.135 169 HB3 ASP 21 2HB ASP 21 11.403 -2.869 -15.054 170 H TYR 22 H TYR 22 9.077 -5.284 -12.103 171 HA TYR 22 HA TYR 22 11.757 -5.243 -10.882 172 HB2 TYR 22 1HB TYR 22 10.251 -5.428 -8.684 173 HB3 TYR 22 2HB TYR 22 10.729 -3.877 -9.366 174 HD1 TYR 22 2HD TYR 22 9.073 -2.778 -11.021 175 HD2 TYR 22 1HD TYR 22 7.997 -5.907 -8.346 176 HE1 TYR 22 2HE TYR 22 6.708 -2.138 -11.233 177 HE2 TYR 22 1HE TYR 22 5.628 -5.276 -8.552 178 HH TYR 22 HH TYR 22 4.310 -3.243 -9.149 179 H ASP 23 H ASP 23 11.909 -6.977 -9.112 180 HA ASP 23 HA ASP 23 10.426 -9.394 -9.886 181 HB2 ASP 23 1HB ASP 23 12.736 -9.295 -10.932 182 HB3 ASP 23 2HB ASP 23 13.387 -9.404 -9.300 183 H ILE 24 H ILE 24 9.239 -9.751 -8.110 184 HA ILE 24 HA ILE 24 10.554 -9.575 -5.485 185 HB ILE 24 HB ILE 24 7.606 -9.910 -5.698 186 HG12 ILE 24 1HG1 ILE 24 8.225 -8.184 -7.408 187 HG13 ILE 24 2HG1 ILE 24 7.215 -7.570 -6.103 188 HG21 ILE 24 1HG2 ILE 24 9.527 -8.514 -3.863 189 HG22 ILE 24 2HG2 ILE 24 7.790 -8.222 -3.791 190 HG23 ILE 24 3HG2 ILE 24 8.424 -9.842 -3.504 191 HD11 ILE 24 1HD1 ILE 24 8.742 -6.076 -5.515 192 HD12 ILE 24 2HD1 ILE 24 10.031 -7.280 -5.516 193 HD13 ILE 24 3HD1 ILE 24 9.574 -6.476 -7.018 194 HA PRO 25 HA PRO 25 10.477 -13.979 -5.194 195 HB2 PRO 25 1HB PRO 25 10.829 -14.185 -2.510 196 HB3 PRO 25 2HB PRO 25 12.133 -13.742 -3.619 197 HG2 PRO 25 1HG PRO 25 10.428 -11.981 -1.900 198 HG3 PRO 25 2HG PRO 25 12.176 -11.909 -2.189 199 HD2 PRO 25 1HD PRO 25 10.422 -10.272 -3.446 200 HD3 PRO 25 2HD PRO 25 11.924 -10.830 -4.211 201 H THR 26 H THR 26 9.490 -15.588 -3.393 202 HA THR 26 HA THR 26 6.672 -14.798 -3.033 203 HB THR 26 HB THR 26 6.016 -17.122 -3.420 204 HG1 THR 26 1HG THR 26 7.658 -18.437 -2.974 205 HG21 THR 26 1HG2 THR 26 5.779 -16.491 -5.543 206 HG22 THR 26 2HG2 THR 26 7.427 -17.030 -5.866 207 HG23 THR 26 3HG2 THR 26 7.123 -15.361 -5.385 208 H THR 27 H THR 27 8.402 -14.266 -1.010 209 HA THR 27 HA THR 27 8.919 -16.248 0.861 210 HB THR 27 HB THR 27 9.842 -14.023 1.122 211 HG1 THR 27 1HG THR 27 9.824 -14.857 3.104 212 HG21 THR 27 1HG2 THR 27 8.605 -12.085 1.512 213 HG22 THR 27 2HG2 THR 27 7.165 -12.984 1.991 214 HG23 THR 27 3HG2 THR 27 7.648 -12.930 0.296 215 H GLU 28 H GLU 28 7.847 -16.640 2.942 216 HA GLU 28 HA GLU 28 5.411 -17.749 2.833 217 HB2 GLU 28 1HB GLU 28 7.111 -17.373 4.844 218 HB3 GLU 28 2HB GLU 28 5.929 -16.152 5.295 219 HG2 GLU 28 1HG GLU 28 4.930 -18.862 4.628 220 HG3 GLU 28 2HG GLU 28 5.783 -18.646 6.156 221 H ASN 29 H ASN 29 6.041 -14.312 3.220 222 HA ASN 29 HA ASN 29 3.171 -13.753 3.335 223 HB2 ASN 29 1HB ASN 29 5.424 -11.748 3.496 224 HB3 ASN 29 2HB ASN 29 3.752 -11.536 4.007 225 HD21 ASN 29 1HD2 ASN 29 6.737 -13.256 4.692 226 HD22 ASN 29 2HD2 ASN 29 6.416 -13.521 6.368 227 H LEU 30 H LEU 30 2.067 -12.702 1.746 228 HA LEU 30 HA LEU 30 3.489 -12.352 -0.799 229 HB2 LEU 30 1HB LEU 30 0.648 -12.958 -0.088 230 HB3 LEU 30 2HB LEU 30 1.042 -12.262 -1.659 231 HG LEU 30 HG LEU 30 2.232 -14.838 -0.646 232 HD11 LEU 30 1HD1 LEU 30 -0.425 -14.476 -1.225 233 HD12 LEU 30 2HD1 LEU 30 0.451 -16.004 -1.311 234 HD13 LEU 30 3HD1 LEU 30 0.241 -15.026 -2.763 235 HD21 LEU 30 1HD2 LEU 30 3.187 -15.068 -2.701 236 HD22 LEU 30 2HD2 LEU 30 3.194 -13.308 -2.582 237 HD23 LEU 30 3HD2 LEU 30 1.937 -14.124 -3.513 238 H TYR 31 H TYR 31 3.705 -10.399 -1.698 239 HA TYR 31 HA TYR 31 2.308 -8.145 -0.420 240 HB2 TYR 31 1HB TYR 31 4.804 -7.903 -2.087 241 HB3 TYR 31 2HB TYR 31 4.156 -6.762 -0.913 242 HD1 TYR 31 1HD TYR 31 3.848 -7.974 1.533 243 HD2 TYR 31 2HD TYR 31 6.735 -8.961 -1.432 244 HE1 TYR 31 1HE TYR 31 5.297 -8.934 3.273 245 HE2 TYR 31 2HE TYR 31 8.192 -9.925 0.299 246 HH TYR 31 HH TYR 31 7.580 -10.983 2.840 247 H PHE 32 H PHE 32 1.638 -6.375 -1.776 248 HA PHE 32 HA PHE 32 1.541 -6.751 -4.633 249 HB2 PHE 32 1HB PHE 32 -1.083 -6.655 -3.141 250 HB3 PHE 32 2HB PHE 32 -0.838 -6.894 -4.868 251 HD1 PHE 32 1HD PHE 32 -0.340 -8.449 -1.549 252 HD2 PHE 32 2HD PHE 32 -0.523 -9.039 -5.761 253 HE1 PHE 32 1HE PHE 32 -0.335 -10.885 -1.205 254 HE2 PHE 32 2HE PHE 32 -0.518 -11.476 -5.423 255 HZ PHE 32 HZ PHE 32 -0.425 -12.402 -3.143 256 H GLN 33 H GLN 33 0.505 -4.915 -5.735 257 HA GLN 33 HA GLN 33 0.174 -2.521 -4.089 258 HB2 GLN 33 1HB GLN 33 1.842 -1.286 -5.074 259 HB3 GLN 33 2HB GLN 33 2.589 -2.878 -5.082 260 HG2 GLN 33 1HG GLN 33 1.803 -3.175 -7.415 261 HG3 GLN 33 2HG GLN 33 1.220 -1.512 -7.385 262 HE21 GLN 33 1HE2 GLN 33 2.621 0.121 -7.711 263 HE22 GLN 33 2HE2 GLN 33 4.312 -0.085 -7.995 264 H GLY 34 H GLY 34 -1.373 -1.165 -4.818 265 HA2 GLY 34 1HA GLY 34 -2.194 -0.380 -7.214 266 HA3 GLY 34 2HA GLY 34 -2.852 -2.010 -7.188 267 H SER 35 H SER 35 -2.730 0.891 -5.118 268 HA SER 35 HA SER 35 -5.092 0.252 -3.696 269 HB2 SER 35 1HB SER 35 -4.824 2.298 -2.611 270 HB3 SER 35 2HB SER 35 -3.175 1.928 -3.114 271 HG SER 35 HG SER 35 -3.624 4.037 -3.686 272 H SER 36 H SER 36 -7.054 1.674 -3.692 273 HA SER 36 HA SER 36 -7.834 2.306 -6.463 274 HB2 SER 36 1HB SER 36 -10.148 1.751 -5.790 275 HB3 SER 36 2HB SER 36 -9.058 0.382 -5.580 276 HG SER 36 HG SER 36 -9.458 0.418 -3.522 277 H GLY 37 H GLY 37 -6.580 4.076 -4.452 278 HA2 GLY 37 1HA GLY 37 -7.474 6.495 -4.892 279 HA3 GLY 37 2HA GLY 37 -8.762 5.936 -3.835 280 H SER 38 H SER 38 -8.402 5.746 -1.647 281 HA SER 38 HA SER 38 -5.833 6.838 -0.705 282 HB2 SER 38 1HB SER 38 -8.028 8.151 -0.324 283 HB3 SER 38 2HB SER 38 -8.387 6.921 0.888 284 HG SER 38 HG SER 38 -5.896 8.217 0.922 285 H SER 39 H SER 39 -5.625 6.244 1.797 286 HA SER 39 HA SER 39 -5.030 3.506 1.897 287 HB2 SER 39 1HB SER 39 -4.708 3.912 4.361 288 HB3 SER 39 2HB SER 39 -3.830 5.031 3.318 289 HG SER 39 HG SER 39 -4.801 6.490 4.482 290 H GLY 40 H GLY 40 -7.901 5.287 2.751 291 HA2 GLY 40 1HA GLY 40 -9.099 3.229 4.332 292 HA3 GLY 40 2HA GLY 40 -9.916 4.631 3.658 293 H ASP 41 H ASP 41 -9.760 4.381 1.023 294 HA ASP 41 HA ASP 41 -11.743 2.690 0.264 295 HB2 ASP 41 1HB ASP 41 -9.361 3.324 -1.487 296 HB3 ASP 41 2HB ASP 41 -10.995 2.935 -2.017 297 H MET 42 H MET 42 -8.283 1.930 0.350 298 HA MET 42 HA MET 42 -8.119 -0.484 -0.843 299 HB2 MET 42 1HB MET 42 -6.818 0.652 1.579 300 HB3 MET 42 2HB MET 42 -6.599 -1.066 1.274 301 HG2 MET 42 1HG MET 42 -6.128 0.821 -0.966 302 HG3 MET 42 2HG MET 42 -4.936 0.747 0.330 303 HE1 MET 42 1HE MET 42 -6.686 -0.683 -2.500 304 HE2 MET 42 2HE MET 42 -5.668 -1.996 -3.092 305 HE3 MET 42 3HE MET 42 -6.915 -2.321 -1.887 306 H MET 43 H MET 43 -8.910 -0.158 2.625 307 HA MET 43 HA MET 43 -9.509 -2.746 3.227 308 HB2 MET 43 1HB MET 43 -11.289 -0.534 4.212 309 HB3 MET 43 2HB MET 43 -10.731 -1.963 5.073 310 HG2 MET 43 1HG MET 43 -8.382 -0.914 4.781 311 HG3 MET 43 2HG MET 43 -9.277 0.574 4.481 312 HE1 MET 43 1HE MET 43 -10.412 -2.213 7.471 313 HE2 MET 43 2HE MET 43 -8.897 -2.444 6.599 314 HE3 MET 43 3HE MET 43 -8.877 -1.865 8.266 315 H ARG 44 H ARG 44 -11.980 -0.365 2.235 316 HA ARG 44 HA ARG 44 -14.109 -2.093 1.958 317 HB2 ARG 44 1HB ARG 44 -13.414 0.424 0.451 318 HB3 ARG 44 2HB ARG 44 -14.932 -0.429 0.208 319 HG2 ARG 44 1HG ARG 44 -15.766 0.185 2.234 320 HG3 ARG 44 2HG ARG 44 -14.173 0.273 2.987 321 HD2 ARG 44 1HD ARG 44 -14.671 2.500 2.854 322 HD3 ARG 44 2HD ARG 44 -13.862 2.275 1.304 323 HE ARG 44 HE ARG 44 -15.877 2.593 0.227 324 HH11 ARG 44 2HH1 ARG 44 -16.383 2.307 3.660 325 HH12 ARG 44 1HH1 ARG 44 -18.032 2.835 3.592 326 HH21 ARG 44 2HH2 ARG 44 -18.047 3.289 0.125 327 HH22 ARG 44 1HH2 ARG 44 -18.978 3.392 1.581 328 H GLU 45 H GLU 45 -12.019 -0.970 -0.712 329 HA GLU 45 HA GLU 45 -12.987 -2.510 -2.748 330 HB2 GLU 45 1HB GLU 45 -10.979 -0.804 -2.622 331 HB3 GLU 45 2HB GLU 45 -10.020 -2.270 -2.479 332 HG2 GLU 45 1HG GLU 45 -10.017 -1.781 -4.755 333 HG3 GLU 45 2HG GLU 45 -11.212 -3.064 -4.580 334 H ILE 46 H ILE 46 -10.815 -3.504 -0.165 335 HA ILE 46 HA ILE 46 -10.193 -6.059 -1.231 336 HB ILE 46 HB ILE 46 -10.099 -5.038 1.608 337 HG12 ILE 46 1HG1 ILE 46 -7.710 -5.663 -0.079 338 HG13 ILE 46 2HG1 ILE 46 -8.579 -4.159 -0.364 339 HG21 ILE 46 1HG2 ILE 46 -8.513 -7.029 1.887 340 HG22 ILE 46 2HG2 ILE 46 -10.245 -7.356 1.862 341 HG23 ILE 46 3HG2 ILE 46 -9.269 -7.666 0.427 342 HD11 ILE 46 1HD1 ILE 46 -7.860 -3.227 1.556 343 HD12 ILE 46 2HD1 ILE 46 -7.885 -4.755 2.437 344 HD13 ILE 46 3HD1 ILE 46 -6.546 -4.385 1.350 345 H ARG 47 H ARG 47 -12.174 -5.315 1.643 346 HA ARG 47 HA ARG 47 -13.338 -7.705 2.102 347 HB2 ARG 47 1HB ARG 47 -14.517 -4.941 2.257 348 HB3 ARG 47 2HB ARG 47 -15.437 -6.357 2.750 349 HG2 ARG 47 1HG ARG 47 -13.837 -6.881 4.453 350 HG3 ARG 47 2HG ARG 47 -12.752 -5.611 3.885 351 HD2 ARG 47 1HD ARG 47 -15.336 -5.382 5.367 352 HD3 ARG 47 2HD ARG 47 -13.787 -4.605 5.692 353 HE ARG 47 HE ARG 47 -14.329 -2.938 4.189 354 HH11 ARG 47 2HH1 ARG 47 -16.661 -5.517 4.022 355 HH12 ARG 47 1HH1 ARG 47 -17.784 -4.614 3.059 356 HH21 ARG 47 2HH2 ARG 47 -15.799 -1.739 2.922 357 HH22 ARG 47 1HH2 ARG 47 -17.292 -2.466 2.433 358 H LYS 48 H LYS 48 -13.973 -5.606 -0.595 359 HA LYS 48 HA LYS 48 -16.421 -6.747 -1.437 360 HB2 LYS 48 1HB LYS 48 -15.854 -4.616 -2.314 361 HB3 LYS 48 2HB LYS 48 -14.284 -5.180 -2.872 362 HG2 LYS 48 1HG LYS 48 -15.689 -6.770 -4.375 363 HG3 LYS 48 2HG LYS 48 -16.985 -5.612 -4.064 364 HD2 LYS 48 1HD LYS 48 -15.972 -3.953 -5.256 365 HD3 LYS 48 2HD LYS 48 -14.346 -4.528 -4.882 366 HE2 LYS 48 1HE LYS 48 -14.443 -5.111 -7.082 367 HE3 LYS 48 2HE LYS 48 -15.129 -6.573 -6.373 368 HZ1 LYS 48 1HZ LYS 48 -17.347 -5.273 -6.678 369 HZ2 LYS 48 2HZ LYS 48 -16.657 -6.092 -7.986 370 HZ3 LYS 48 3HZ LYS 48 -16.471 -4.417 -7.846 371 H VAL 49 H VAL 49 -13.064 -7.315 -2.476 372 HA VAL 49 HA VAL 49 -13.615 -9.300 -4.372 373 HB VAL 49 HB VAL 49 -11.109 -9.367 -2.728 374 HG11 VAL 49 1HG1 VAL 49 -10.094 -9.914 -4.891 375 HG12 VAL 49 2HG1 VAL 49 -11.393 -11.036 -4.479 376 HG13 VAL 49 3HG1 VAL 49 -11.671 -9.761 -5.666 377 HG21 VAL 49 1HG2 VAL 49 -12.148 -7.072 -4.136 378 HG22 VAL 49 2HG2 VAL 49 -10.709 -7.213 -3.125 379 HG23 VAL 49 3HG2 VAL 49 -10.625 -7.615 -4.840 380 H LEU 50 H LEU 50 -13.105 -9.488 -0.892 381 HA LEU 50 HA LEU 50 -12.884 -12.280 -0.673 382 HB2 LEU 50 1HB LEU 50 -14.103 -10.431 1.365 383 HB3 LEU 50 2HB LEU 50 -13.339 -11.992 1.657 384 HG LEU 50 HG LEU 50 -11.824 -9.622 0.587 385 HD11 LEU 50 1HD1 LEU 50 -11.467 -8.783 2.648 386 HD12 LEU 50 2HD1 LEU 50 -11.535 -10.365 3.425 387 HD13 LEU 50 3HD1 LEU 50 -13.027 -9.532 2.989 388 HD21 LEU 50 1HD2 LEU 50 -9.972 -10.891 0.792 389 HD22 LEU 50 2HD2 LEU 50 -11.120 -12.221 0.636 390 HD23 LEU 50 3HD2 LEU 50 -10.564 -11.718 2.233 391 H GLY 51 H GLY 51 -15.732 -10.203 -0.089 392 HA2 GLY 51 1HA GLY 51 -17.588 -12.235 0.316 393 HA3 GLY 51 2HA GLY 51 -17.977 -10.633 -0.295 394 H ALA 52 H ALA 52 -16.144 -11.138 -2.637 395 HA ALA 52 HA ALA 52 -18.146 -12.149 -4.400 396 HB1 ALA 52 1HB ALA 52 -16.061 -12.039 -6.020 397 HB2 ALA 52 2HB ALA 52 -16.886 -10.579 -5.474 398 HB3 ALA 52 3HB ALA 52 -15.386 -11.087 -4.697 399 H ASN 53 H ASN 53 -15.108 -13.421 -3.111 400 HA ASN 53 HA ASN 53 -15.557 -15.955 -4.502 401 HB2 ASN 53 1HB ASN 53 -13.205 -14.641 -3.229 402 HB3 ASN 53 2HB ASN 53 -13.245 -16.402 -3.253 403 HD21 ASN 53 1HD2 ASN 53 -13.560 -13.562 -5.328 404 HD22 ASN 53 2HD2 ASN 53 -12.893 -14.300 -6.740 405 H ASN 54 H ASN 54 -17.366 -15.296 -2.440 406 HA ASN 54 HA ASN 54 -18.250 -16.039 -0.466 407 HB2 ASN 54 1HB ASN 54 -16.912 -18.617 -1.314 408 HB3 ASN 54 2HB ASN 54 -18.306 -18.457 -0.249 409 HD21 ASN 54 1HD2 ASN 54 -20.168 -17.215 -1.269 410 HD22 ASN 54 2HD2 ASN 54 -20.555 -17.634 -2.900 411 H CYS 55 H CYS 55 -15.937 -14.677 0.036 412 HA CYS 55 HA CYS 55 -14.570 -16.305 2.073 413 HB2 CYS 55 1HB CYS 55 -13.626 -13.822 0.626 414 HB3 CYS 55 2HB CYS 55 -12.739 -14.625 1.917 415 HG CYS 55 HG CYS 55 -13.316 -15.747 -1.249 416 H ASP 56 H ASP 56 -14.399 -15.566 4.159 417 HA ASP 56 HA ASP 56 -16.188 -13.347 4.851 418 HB2 ASP 56 1HB ASP 56 -15.081 -15.618 6.512 419 HB3 ASP 56 2HB ASP 56 -16.060 -14.307 7.166 420 H TYR 57 H TYR 57 -15.551 -11.760 6.378 421 HA TYR 57 HA TYR 57 -12.675 -11.562 6.914 422 HB2 TYR 57 1HB TYR 57 -12.940 -9.048 6.366 423 HB3 TYR 57 2HB TYR 57 -12.784 -10.181 5.028 424 HD1 TYR 57 2HD TYR 57 -14.880 -10.905 3.808 425 HD2 TYR 57 1HD TYR 57 -14.836 -7.665 6.566 426 HE1 TYR 57 2HE TYR 57 -16.980 -10.064 2.845 427 HE2 TYR 57 1HE TYR 57 -16.937 -6.815 5.611 428 HH TYR 57 HH TYR 57 -18.692 -8.618 3.139 429 H GLU 58 H GLU 58 -12.125 -10.422 8.768 430 HA GLU 58 HA GLU 58 -14.339 -9.395 10.402 431 HB2 GLU 58 1HB GLU 58 -13.872 -11.673 11.164 432 HB3 GLU 58 2HB GLU 58 -12.172 -11.272 11.362 433 HG2 GLU 58 1HG GLU 58 -12.939 -11.111 13.514 434 HG3 GLU 58 2HG GLU 58 -13.065 -9.439 12.971 435 H GLN 59 H GLN 59 -13.848 -7.283 10.445 436 HA GLN 59 HA GLN 59 -11.252 -6.205 10.352 437 HB2 GLN 59 1HB GLN 59 -13.648 -5.136 9.969 438 HB3 GLN 59 2HB GLN 59 -13.457 -4.678 11.656 439 HG2 GLN 59 1HG GLN 59 -11.104 -3.843 10.771 440 HG3 GLN 59 2HG GLN 59 -11.999 -3.742 9.255 441 HE21 GLN 59 1HE2 GLN 59 -11.029 -1.465 10.230 442 HE22 GLN 59 2HE2 GLN 59 -12.283 -0.481 10.896 443 H ARG 60 H ARG 60 -9.726 -6.218 11.853 444 HA ARG 60 HA ARG 60 -10.465 -6.685 14.643 445 HB2 ARG 60 1HB ARG 60 -7.739 -6.713 13.334 446 HB3 ARG 60 2HB ARG 60 -8.096 -7.191 14.988 447 HG2 ARG 60 1HG ARG 60 -9.392 -8.549 12.652 448 HG3 ARG 60 2HG ARG 60 -7.800 -9.031 13.243 449 HD2 ARG 60 1HD ARG 60 -8.629 -9.845 15.219 450 HD3 ARG 60 2HD ARG 60 -10.021 -8.763 15.204 451 HE ARG 60 HE ARG 60 -11.180 -10.297 13.924 452 HH11 ARG 60 2HH1 ARG 60 -7.847 -11.252 14.237 453 HH12 ARG 60 1HH1 ARG 60 -8.108 -12.844 13.604 454 HH21 ARG 60 2HH2 ARG 60 -11.536 -12.390 13.089 455 HH22 ARG 60 1HH2 ARG 60 -10.206 -13.490 12.951 456 H GLU 61 H GLU 61 -8.523 -4.455 12.675 457 HA GLU 61 HA GLU 61 -8.830 -2.451 14.805 458 HB2 GLU 61 1HB GLU 61 -6.339 -2.643 13.126 459 HB3 GLU 61 2HB GLU 61 -6.588 -1.732 14.609 460 HG2 GLU 61 1HG GLU 61 -6.893 -3.978 15.755 461 HG3 GLU 61 2HG GLU 61 -6.247 -4.693 14.279 462 H ARG 62 H ARG 62 -7.834 -0.253 13.715 463 HA ARG 62 HA ARG 62 -9.781 0.646 11.959 464 HB2 ARG 62 1HB ARG 62 -8.559 2.263 13.187 465 HB3 ARG 62 2HB ARG 62 -7.018 1.675 12.576 466 HG2 ARG 62 1HG ARG 62 -7.243 2.752 10.568 467 HG3 ARG 62 2HG ARG 62 -9.006 2.751 10.642 468 HD2 ARG 62 1HD ARG 62 -8.572 4.960 11.068 469 HD3 ARG 62 2HD ARG 62 -8.600 4.317 12.709 470 HE ARG 62 HE ARG 62 -5.987 4.315 11.514 471 HH11 ARG 62 2HH1 ARG 62 -8.320 6.191 13.292 472 HH12 ARG 62 1HH1 ARG 62 -7.136 7.251 13.983 473 HH21 ARG 62 2HH2 ARG 62 -4.419 5.703 12.418 474 HH22 ARG 62 1HH2 ARG 62 -4.917 6.973 13.484 475 H PHE 63 H PHE 63 -6.382 -0.108 11.172 476 HA PHE 63 HA PHE 63 -7.208 -0.465 8.369 477 HB2 PHE 63 1HB PHE 63 -4.610 0.413 9.606 478 HB3 PHE 63 2HB PHE 63 -4.672 -0.205 7.959 479 HD1 PHE 63 2HD PHE 63 -6.455 0.932 6.411 480 HD2 PHE 63 1HD PHE 63 -4.878 2.668 9.963 481 HE1 PHE 63 2HE PHE 63 -7.089 3.165 5.597 482 HE2 PHE 63 1HE PHE 63 -5.510 4.904 9.155 483 HZ PHE 63 HZ PHE 63 -6.616 5.155 6.969 484 H LEU 64 H LEU 64 -7.730 -2.558 10.043 485 HA LEU 64 HA LEU 64 -5.871 -4.575 9.030 486 HB2 LEU 64 1HB LEU 64 -5.485 -3.815 11.513 487 HB3 LEU 64 2HB LEU 64 -6.871 -4.858 11.826 488 HG LEU 64 HG LEU 64 -4.660 -5.938 12.207 489 HD11 LEU 64 1HD1 LEU 64 -6.248 -7.199 9.980 490 HD12 LEU 64 2HD1 LEU 64 -6.733 -7.202 11.675 491 HD13 LEU 64 3HD1 LEU 64 -5.250 -8.019 11.181 492 HD21 LEU 64 1HD2 LEU 64 -3.143 -6.344 10.517 493 HD22 LEU 64 2HD2 LEU 64 -3.696 -4.717 10.121 494 HD23 LEU 64 3HD2 LEU 64 -4.337 -6.106 9.242 495 H LEU 65 H LEU 65 -6.903 -6.261 8.170 496 HA LEU 65 HA LEU 65 -9.642 -6.853 9.050 497 HB2 LEU 65 1HB LEU 65 -8.688 -6.165 6.327 498 HB3 LEU 65 2HB LEU 65 -9.896 -7.441 6.467 499 HG LEU 65 HG LEU 65 -10.333 -4.752 7.723 500 HD11 LEU 65 1HD1 LEU 65 -11.495 -4.044 5.711 501 HD12 LEU 65 2HD1 LEU 65 -11.025 -5.534 4.895 502 HD13 LEU 65 3HD1 LEU 65 -9.794 -4.362 5.366 503 HD21 LEU 65 1HD2 LEU 65 -11.735 -6.849 8.198 504 HD22 LEU 65 2HD2 LEU 65 -12.358 -6.637 6.562 505 HD23 LEU 65 3HD2 LEU 65 -12.584 -5.366 7.764 506 H PHE 66 H PHE 66 -9.935 -8.934 9.501 507 HA PHE 66 HA PHE 66 -7.823 -10.826 8.888 508 HB2 PHE 66 1HB PHE 66 -8.948 -10.661 11.149 509 HB3 PHE 66 2HB PHE 66 -10.383 -11.353 10.400 510 HD1 PHE 66 2HD PHE 66 -6.935 -11.994 11.456 511 HD2 PHE 66 1HD PHE 66 -10.475 -13.672 9.791 512 HE1 PHE 66 2HE PHE 66 -6.046 -14.254 11.852 513 HE2 PHE 66 1HE PHE 66 -9.592 -15.935 10.185 514 HZ PHE 66 HZ PHE 66 -7.374 -16.228 11.215 515 H CYS 67 H CYS 67 -7.949 -11.356 6.749 516 HA CYS 67 HA CYS 67 -10.483 -12.094 5.557 517 HB2 CYS 67 1HB CYS 67 -7.681 -12.161 4.418 518 HB3 CYS 67 2HB CYS 67 -9.159 -12.433 3.504 519 HG CYS 67 HG CYS 67 -8.515 -9.492 5.123 520 H VAL 68 H VAL 68 -11.190 -14.115 5.123 521 HA VAL 68 HA VAL 68 -9.392 -16.387 5.472 522 HB VAL 68 HB VAL 68 -10.326 -16.089 7.699 523 HG11 VAL 68 1HG1 VAL 68 -13.024 -16.754 7.426 524 HG12 VAL 68 2HG1 VAL 68 -12.351 -15.197 7.914 525 HG13 VAL 68 3HG1 VAL 68 -12.727 -15.505 6.218 526 HG21 VAL 68 1HG2 VAL 68 -11.940 -18.389 6.846 527 HG22 VAL 68 2HG2 VAL 68 -10.268 -18.409 6.287 528 HG23 VAL 68 3HG2 VAL 68 -10.620 -18.297 8.012 529 H HIS 69 H HIS 69 -9.904 -18.119 4.216 530 HA HIS 69 HA HIS 69 -12.386 -17.929 2.638 531 HB2 HIS 69 1HB HIS 69 -10.575 -17.452 1.156 532 HB3 HIS 69 2HB HIS 69 -9.623 -18.794 1.783 533 HD1 HIS 69 1HD HIS 69 -9.569 -20.694 0.220 534 HD2 HIS 69 2HD HIS 69 -13.154 -18.610 -0.028 535 HE1 HIS 69 1HE HIS 69 -10.907 -21.867 -1.557 536 HE2 HIS 69 2HE HIS 69 -13.038 -20.537 -1.749 537 H GLY 70 H GLY 70 -13.739 -19.577 2.890 538 HA2 GLY 70 1HA GLY 70 -12.645 -22.119 3.926 539 HA3 GLY 70 2HA GLY 70 -14.243 -21.505 4.323 540 H ASP 71 H ASP 71 -12.259 -22.906 1.785 541 HA ASP 71 HA ASP 71 -14.131 -23.049 -0.265 542 HB2 ASP 71 1HB ASP 71 -11.620 -23.697 -0.241 543 HB3 ASP 71 2HB ASP 71 -12.193 -25.286 0.258 544 H GLY 72 H GLY 72 -14.055 -24.699 2.734 545 HA2 GLY 72 1HA GLY 72 -16.572 -25.967 2.183 546 HA3 GLY 72 2HA GLY 72 -15.249 -27.119 2.295 547 H HIS 73 H HIS 73 -13.748 -26.457 4.310 548 HA HIS 73 HA HIS 73 -15.269 -25.595 6.607 549 HB2 HIS 73 1HB HIS 73 -14.712 -28.463 6.062 550 HB3 HIS 73 2HB HIS 73 -14.472 -27.904 7.715 551 HD1 HIS 73 1HD HIS 73 -16.512 -27.710 9.140 552 HD2 HIS 73 2HD HIS 73 -17.432 -28.027 5.101 553 HE1 HIS 73 1HE HIS 73 -19.014 -27.943 9.036 554 HE2 HIS 73 2HE HIS 73 -19.539 -28.219 6.588 555 H ALA 74 H ALA 74 -13.822 -26.130 8.673 556 HA ALA 74 HA ALA 74 -11.551 -24.574 8.525 557 HB1 ALA 74 1HB ALA 74 -12.667 -26.466 10.482 558 HB2 ALA 74 2HB ALA 74 -10.938 -26.150 10.632 559 HB3 ALA 74 3HB ALA 74 -12.088 -24.814 10.698 560 H GLU 75 H GLU 75 -11.965 -27.857 7.583 561 HA GLU 75 HA GLU 75 -9.317 -28.781 7.827 562 HB2 GLU 75 1HB GLU 75 -11.541 -30.047 7.265 563 HB3 GLU 75 2HB GLU 75 -11.101 -29.693 5.601 564 HG2 GLU 75 1HG GLU 75 -8.792 -30.710 6.356 565 HG3 GLU 75 2HG GLU 75 -9.802 -31.498 7.565 566 H ASN 76 H ASN 76 -11.003 -27.091 5.221 567 HA ASN 76 HA ASN 76 -8.413 -26.763 3.855 568 HB2 ASN 76 1HB ASN 76 -9.838 -26.375 1.783 569 HB3 ASN 76 2HB ASN 76 -9.809 -28.023 2.404 570 HD21 ASN 76 1HD2 ASN 76 -11.661 -28.959 3.053 571 HD22 ASN 76 2HD2 ASN 76 -13.208 -28.191 3.013 572 H LEU 77 H LEU 77 -9.851 -25.138 5.977 573 HA LEU 77 HA LEU 77 -10.546 -22.677 4.651 574 HB2 LEU 77 1HB LEU 77 -11.611 -23.436 6.758 575 HB3 LEU 77 2HB LEU 77 -10.071 -23.203 7.581 576 HG LEU 77 HG LEU 77 -10.349 -20.744 6.648 577 HD11 LEU 77 1HD1 LEU 77 -13.043 -20.545 7.188 578 HD12 LEU 77 2HD1 LEU 77 -12.933 -21.979 6.168 579 HD13 LEU 77 3HD1 LEU 77 -12.289 -20.441 5.597 580 HD21 LEU 77 1HD2 LEU 77 -12.134 -21.174 8.934 581 HD22 LEU 77 2HD2 LEU 77 -10.670 -20.199 8.801 582 HD23 LEU 77 3HD2 LEU 77 -10.550 -21.937 9.083 583 H VAL 78 H VAL 78 -9.343 -20.843 4.468 584 HA VAL 78 HA VAL 78 -6.547 -20.995 5.392 585 HB VAL 78 HB VAL 78 -7.664 -19.926 2.812 586 HG11 VAL 78 1HG1 VAL 78 -6.243 -18.207 2.985 587 HG12 VAL 78 2HG1 VAL 78 -5.390 -18.933 4.349 588 HG13 VAL 78 3HG1 VAL 78 -4.977 -19.400 2.699 589 HG21 VAL 78 1HG2 VAL 78 -5.345 -21.303 2.303 590 HG22 VAL 78 2HG2 VAL 78 -6.042 -22.202 3.650 591 HG23 VAL 78 3HG2 VAL 78 -6.978 -21.959 2.175 592 H GLN 79 H GLN 79 -6.027 -19.501 6.836 593 HA GLN 79 HA GLN 79 -7.623 -17.030 6.944 594 HB2 GLN 79 1HB GLN 79 -6.019 -18.372 9.128 595 HB3 GLN 79 2HB GLN 79 -6.927 -16.876 9.305 596 HG2 GLN 79 1HG GLN 79 -8.977 -17.953 9.172 597 HG3 GLN 79 2HG GLN 79 -8.284 -19.385 8.412 598 HE21 GLN 79 1HE2 GLN 79 -9.090 -20.829 9.880 599 HE22 GLN 79 2HE2 GLN 79 -8.555 -20.912 11.520 600 H TRP 80 H TRP 80 -6.664 -15.141 6.556 601 HA TRP 80 HA TRP 80 -3.809 -14.812 6.980 602 HB2 TRP 80 1HB TRP 80 -3.234 -14.246 4.768 603 HB3 TRP 80 2HB TRP 80 -4.215 -15.700 4.606 604 HD1 TRP 80 HD TRP 80 -4.209 -11.984 3.789 605 HE1 TRP 80 1HE TRP 80 -6.174 -11.474 2.206 606 HE3 TRP 80 3HE TRP 80 -6.606 -16.495 3.990 607 HZ2 TRP 80 2HZ TRP 80 -8.440 -12.807 1.179 608 HZ3 TRP 80 3HZ TRP 80 -8.666 -16.795 2.679 609 HH2 TRP 80 HH TRP 80 -9.563 -14.988 1.303 610 H GLU 81 H GLU 81 -3.324 -12.801 7.641 611 HA GLU 81 HA GLU 81 -5.496 -10.884 7.850 612 HB2 GLU 81 1HB GLU 81 -2.836 -11.240 9.133 613 HB3 GLU 81 2HB GLU 81 -3.477 -9.606 9.042 614 HG2 GLU 81 1HG GLU 81 -5.491 -10.318 10.210 615 HG3 GLU 81 2HG GLU 81 -4.873 -11.967 10.283 616 H MET 82 H MET 82 -5.268 -8.660 7.225 617 HA MET 82 HA MET 82 -3.209 -8.099 5.222 618 HB2 MET 82 1HB MET 82 -6.166 -8.131 4.773 619 HB3 MET 82 2HB MET 82 -5.180 -6.963 3.904 620 HG2 MET 82 1HG MET 82 -3.816 -8.812 3.021 621 HG3 MET 82 2HG MET 82 -4.878 -9.956 3.839 622 HE1 MET 82 1HE MET 82 -5.049 -6.759 1.909 623 HE2 MET 82 2HE MET 82 -4.719 -7.621 0.406 624 HE3 MET 82 3HE MET 82 -6.330 -6.971 0.715 625 H GLU 83 H GLU 83 -2.252 -6.262 5.767 626 HA GLU 83 HA GLU 83 -3.867 -4.169 7.072 627 HB2 GLU 83 1HB GLU 83 -2.158 -5.289 8.545 628 HB3 GLU 83 2HB GLU 83 -0.914 -4.640 7.487 629 HG2 GLU 83 1HG GLU 83 -1.730 -2.362 7.996 630 HG3 GLU 83 2HG GLU 83 -2.872 -3.064 9.141 631 H VAL 84 H VAL 84 -3.432 -2.010 6.528 632 HA VAL 84 HA VAL 84 -2.216 -1.692 3.884 633 HB VAL 84 HB VAL 84 -3.986 0.175 5.467 634 HG11 VAL 84 1HG1 VAL 84 -4.087 1.496 3.379 635 HG12 VAL 84 2HG1 VAL 84 -2.474 1.463 4.094 636 HG13 VAL 84 3HG1 VAL 84 -2.839 0.456 2.692 637 HG21 VAL 84 1HG2 VAL 84 -4.592 -1.339 2.933 638 HG22 VAL 84 2HG2 VAL 84 -5.049 -1.892 4.544 639 HG23 VAL 84 3HG2 VAL 84 -5.711 -0.386 3.908 640 H CYS 85 H CYS 85 -0.050 -1.467 4.182 641 HA CYS 85 HA CYS 85 0.876 0.549 6.107 642 HB2 CYS 85 1HB CYS 85 1.783 -1.852 6.120 643 HB3 CYS 85 2HB CYS 85 2.626 -1.415 4.639 644 HG CYS 85 HG CYS 85 4.292 -1.349 6.992 645 H LYS 86 H LYS 86 2.695 1.928 5.433 646 HA LYS 86 HA LYS 86 2.283 2.854 2.684 647 HB2 LYS 86 1HB LYS 86 2.010 4.440 4.614 648 HB3 LYS 86 2HB LYS 86 3.730 4.260 4.933 649 HG2 LYS 86 1HG LYS 86 2.885 5.059 2.200 650 HG3 LYS 86 2HG LYS 86 2.789 6.254 3.496 651 HD2 LYS 86 1HD LYS 86 5.293 4.673 3.240 652 HD3 LYS 86 2HD LYS 86 4.984 5.933 2.042 653 HE2 LYS 86 1HE LYS 86 6.073 7.178 3.608 654 HE3 LYS 86 2HE LYS 86 4.427 7.340 4.218 655 HZ1 LYS 86 1HZ LYS 86 6.685 6.143 5.453 656 HZ2 LYS 86 2HZ LYS 86 5.414 5.033 5.349 657 HZ3 LYS 86 3HZ LYS 86 5.177 6.519 6.121 658 H LEU 87 H LEU 87 4.027 3.299 1.297 659 HA LEU 87 HA LEU 87 6.592 2.079 2.074 660 HB2 LEU 87 1HB LEU 87 5.144 1.854 -0.558 661 HB3 LEU 87 2HB LEU 87 6.817 1.359 -0.306 662 HG LEU 87 HG LEU 87 4.702 0.171 1.425 663 HD11 LEU 87 1HD1 LEU 87 4.805 -0.068 -1.474 664 HD12 LEU 87 2HD1 LEU 87 3.550 -0.560 -0.338 665 HD13 LEU 87 3HD1 LEU 87 4.927 -1.619 -0.643 666 HD21 LEU 87 1HD2 LEU 87 6.678 -0.712 2.082 667 HD22 LEU 87 2HD2 LEU 87 7.448 -0.438 0.519 668 HD23 LEU 87 3HD2 LEU 87 6.365 -1.813 0.740 669 HA PRO 88 HA PRO 88 8.238 6.020 0.922 670 HB2 PRO 88 1HB PRO 88 10.860 5.316 0.937 671 HB3 PRO 88 2HB PRO 88 9.925 5.569 2.415 672 HG2 PRO 88 1HG PRO 88 10.636 3.008 1.040 673 HG3 PRO 88 2HG PRO 88 10.663 3.393 2.770 674 HD2 PRO 88 1HD PRO 88 8.645 2.002 1.618 675 HD3 PRO 88 2HD PRO 88 8.390 3.084 3.002 676 H ARG 89 H ARG 89 9.607 3.131 -0.660 677 HA ARG 89 HA ARG 89 10.422 4.586 -2.986 678 HB2 ARG 89 1HB ARG 89 10.407 1.724 -2.148 679 HB3 ARG 89 2HB ARG 89 10.561 2.086 -3.861 680 HG2 ARG 89 1HG ARG 89 12.514 3.507 -3.350 681 HG3 ARG 89 2HG ARG 89 12.383 3.026 -1.657 682 HD2 ARG 89 1HD ARG 89 12.476 0.610 -2.619 683 HD3 ARG 89 2HD ARG 89 13.163 1.396 -4.039 684 HE ARG 89 HE ARG 89 15.115 1.633 -2.888 685 HH11 ARG 89 2HH1 ARG 89 12.529 1.173 -0.603 686 HH12 ARG 89 1HH1 ARG 89 13.581 1.108 0.772 687 HH21 ARG 89 2HH2 ARG 89 16.510 1.549 -1.086 688 HH22 ARG 89 1HH2 ARG 89 15.845 1.323 0.497 689 H LEU 90 H LEU 90 8.235 1.781 -2.848 690 HA LEU 90 HA LEU 90 6.987 1.946 -5.211 691 HB2 LEU 90 1HB LEU 90 6.006 1.218 -2.505 692 HB3 LEU 90 2HB LEU 90 4.815 1.373 -3.795 693 HG LEU 90 HG LEU 90 5.545 -0.950 -3.444 694 HD11 LEU 90 1HD1 LEU 90 6.709 -0.416 -6.078 695 HD12 LEU 90 2HD1 LEU 90 5.141 0.341 -5.802 696 HD13 LEU 90 3HD1 LEU 90 5.320 -1.404 -5.625 697 HD21 LEU 90 1HD2 LEU 90 8.211 -0.269 -4.602 698 HD22 LEU 90 2HD2 LEU 90 7.721 -1.676 -3.658 699 HD23 LEU 90 3HD2 LEU 90 7.948 -0.117 -2.864 700 H SER 91 H SER 91 6.511 4.142 -2.531 701 HA SER 91 HA SER 91 5.436 6.138 -2.349 702 HB2 SER 91 1HB SER 91 5.556 7.573 -4.158 703 HB3 SER 91 2HB SER 91 6.723 6.345 -4.647 704 HG SER 91 HG SER 91 4.287 6.994 -5.737 705 H LEU 92 H LEU 92 3.903 3.684 -2.372 706 HA LEU 92 HA LEU 92 1.285 4.845 -2.722 707 HB2 LEU 92 1HB LEU 92 2.275 2.588 -4.425 708 HB3 LEU 92 2HB LEU 92 0.564 2.742 -4.033 709 HG LEU 92 HG LEU 92 2.232 4.760 -5.532 710 HD11 LEU 92 1HD1 LEU 92 0.466 2.534 -6.345 711 HD12 LEU 92 2HD1 LEU 92 1.862 3.236 -7.162 712 HD13 LEU 92 3HD1 LEU 92 0.299 4.049 -7.233 713 HD21 LEU 92 1HD2 LEU 92 -0.513 5.255 -5.833 714 HD22 LEU 92 2HD2 LEU 92 0.676 6.245 -4.986 715 HD23 LEU 92 3HD2 LEU 92 -0.243 5.023 -4.106 716 H ASN 93 H ASN 93 -0.444 3.208 -2.056 717 HA ASN 93 HA ASN 93 -0.079 2.390 0.528 718 HB2 ASN 93 1HB ASN 93 -1.944 1.314 -1.588 719 HB3 ASN 93 2HB ASN 93 -2.022 0.801 0.095 720 HD21 ASN 93 1HD2 ASN 93 -1.577 3.110 1.442 721 HD22 ASN 93 2HD2 ASN 93 -2.847 4.238 1.126 722 H GLY 94 H GLY 94 0.155 0.309 1.532 723 HA2 GLY 94 1HA GLY 94 1.619 -1.643 -0.133 724 HA3 GLY 94 2HA GLY 94 2.192 -1.178 1.461 725 H VAL 95 H VAL 95 0.130 -3.235 -0.319 726 HA VAL 95 HA VAL 95 -1.321 -4.121 2.057 727 HB VAL 95 HB VAL 95 -1.612 -5.320 -0.682 728 HG11 VAL 95 1HG1 VAL 95 -3.359 -5.088 1.755 729 HG12 VAL 95 2HG1 VAL 95 -3.985 -5.570 0.177 730 HG13 VAL 95 3HG1 VAL 95 -2.755 -6.551 0.976 731 HG21 VAL 95 1HG2 VAL 95 -3.142 -2.920 0.305 732 HG22 VAL 95 2HG2 VAL 95 -1.776 -2.821 -0.806 733 HG23 VAL 95 3HG2 VAL 95 -3.239 -3.683 -1.282 734 H ARG 96 H ARG 96 -0.320 -5.548 3.312 735 HA ARG 96 HA ARG 96 1.422 -7.562 2.063 736 HB2 ARG 96 1HB ARG 96 2.402 -6.046 3.809 737 HB3 ARG 96 2HB ARG 96 1.304 -6.772 4.976 738 HG2 ARG 96 1HG ARG 96 2.411 -8.796 4.961 739 HG3 ARG 96 2HG ARG 96 3.134 -8.505 3.378 740 HD2 ARG 96 1HD ARG 96 3.841 -7.048 5.923 741 HD3 ARG 96 2HD ARG 96 4.780 -8.353 5.199 742 HE ARG 96 HE ARG 96 4.365 -6.235 3.351 743 HH11 ARG 96 2HH1 ARG 96 6.248 -7.165 6.128 744 HH12 ARG 96 1HH1 ARG 96 7.591 -6.149 5.721 745 HH21 ARG 96 2HH2 ARG 96 6.127 -4.893 2.804 746 HH22 ARG 96 1HH2 ARG 96 7.521 -4.856 3.830 747 H PHE 97 H PHE 97 1.036 -9.705 2.305 748 HA PHE 97 HA PHE 97 -1.468 -10.438 3.660 749 HB2 PHE 97 1HB PHE 97 0.036 -11.695 1.368 750 HB3 PHE 97 2HB PHE 97 -1.247 -12.543 2.225 751 HD1 PHE 97 1HD PHE 97 -0.805 -9.077 0.907 752 HD2 PHE 97 2HD PHE 97 -3.200 -12.593 1.036 753 HE1 PHE 97 1HE PHE 97 -2.477 -7.987 -0.532 754 HE2 PHE 97 2HE PHE 97 -4.875 -11.509 -0.403 755 HZ PHE 97 HZ PHE 97 -4.515 -9.203 -1.189 756 H LYS 98 H LYS 98 -1.243 -11.352 5.580 757 HA LYS 98 HA LYS 98 1.195 -12.903 6.139 758 HB2 LYS 98 1HB LYS 98 1.139 -11.221 7.740 759 HB3 LYS 98 2HB LYS 98 -0.616 -11.246 7.853 760 HG2 LYS 98 1HG LYS 98 -0.423 -13.490 8.949 761 HG3 LYS 98 2HG LYS 98 1.324 -13.237 9.001 762 HD2 LYS 98 1HD LYS 98 1.025 -11.246 10.352 763 HD3 LYS 98 2HD LYS 98 -0.730 -11.401 10.236 764 HE2 LYS 98 1HE LYS 98 -0.618 -13.537 11.421 765 HE3 LYS 98 2HE LYS 98 1.136 -13.391 11.527 766 HZ1 LYS 98 1HZ LYS 98 0.172 -11.047 12.565 767 HZ2 LYS 98 2HZ LYS 98 0.791 -12.353 13.443 768 HZ3 LYS 98 3HZ LYS 98 -0.874 -12.227 13.178 769 H ARG 99 H ARG 99 1.053 -15.024 6.509 770 HA ARG 99 HA ARG 99 -1.481 -16.344 6.248 771 HB2 ARG 99 1HB ARG 99 0.786 -17.165 5.383 772 HB3 ARG 99 2HB ARG 99 1.114 -17.649 7.041 773 HG2 ARG 99 1HG ARG 99 0.271 -19.604 6.288 774 HG3 ARG 99 2HG ARG 99 -1.251 -18.832 6.738 775 HD2 ARG 99 1HD ARG 99 -0.915 -17.911 4.204 776 HD3 ARG 99 2HD ARG 99 -0.180 -19.510 4.088 777 HE ARG 99 HE ARG 99 -2.981 -18.903 4.580 778 HH11 ARG 99 2HH1 ARG 99 -0.452 -21.293 4.456 779 HH12 ARG 99 1HH1 ARG 99 -1.544 -22.630 4.317 780 HH21 ARG 99 2HH2 ARG 99 -4.428 -20.656 4.396 781 HH22 ARG 99 1HH2 ARG 99 -3.806 -22.267 4.282 782 H ILE 100 H ILE 100 -2.653 -17.420 7.781 783 HA ILE 100 HA ILE 100 -1.753 -17.116 10.572 784 HB ILE 100 HB ILE 100 -4.470 -16.732 9.363 785 HG12 ILE 100 1HG1 ILE 100 -4.230 -14.871 11.280 786 HG13 ILE 100 2HG1 ILE 100 -2.522 -15.161 10.969 787 HG21 ILE 100 1HG2 ILE 100 -5.256 -16.670 11.815 788 HG22 ILE 100 2HG2 ILE 100 -5.062 -18.237 11.032 789 HG23 ILE 100 3HG2 ILE 100 -3.825 -17.646 12.140 790 HD11 ILE 100 1HD1 ILE 100 -4.527 -14.450 8.845 791 HD12 ILE 100 2HD1 ILE 100 -3.490 -13.287 9.673 792 HD13 ILE 100 3HD1 ILE 100 -2.774 -14.552 8.673 793 H SER 101 H SER 101 -3.562 -19.101 8.278 794 HA SER 101 HA SER 101 -2.669 -21.528 9.398 795 HB2 SER 101 1HB SER 101 -4.854 -22.367 10.261 796 HB3 SER 101 2HB SER 101 -4.195 -21.043 11.221 797 HG SER 101 HG SER 101 -5.910 -20.381 9.127 798 H GLY 102 H GLY 102 -3.539 -23.406 8.293 799 HA2 GLY 102 1HA GLY 102 -5.122 -24.237 6.599 800 HA3 GLY 102 2HA GLY 102 -4.916 -22.698 5.776 801 H THR 103 H THR 103 -4.459 -24.188 3.947 802 HA THR 103 HA THR 103 -1.757 -25.327 4.022 803 HB THR 103 HB THR 103 -2.393 -26.358 1.823 804 HG1 THR 103 1HG THR 103 -4.837 -26.370 1.613 805 HG21 THR 103 1HG2 THR 103 -3.762 -26.932 4.404 806 HG22 THR 103 2HG2 THR 103 -2.604 -27.907 3.499 807 HG23 THR 103 3HG2 THR 103 -4.284 -27.815 2.970 808 H SER 104 H SER 104 -0.112 -24.290 3.116 809 HA SER 104 HA SER 104 -0.090 -21.768 2.134 810 HB2 SER 104 1HB SER 104 1.929 -22.750 0.654 811 HB3 SER 104 2HB SER 104 2.056 -22.508 2.397 812 HG SER 104 HG SER 104 1.008 -24.933 1.516 813 H ILE 105 H ILE 105 -0.205 -24.675 0.070 814 HA ILE 105 HA ILE 105 -0.330 -23.672 -2.413 815 HB ILE 105 HB ILE 105 -2.047 -25.841 -1.226 816 HG12 ILE 105 1HG1 ILE 105 0.248 -26.458 -1.303 817 HG13 ILE 105 2HG1 ILE 105 -0.508 -27.242 -2.686 818 HG21 ILE 105 1HG2 ILE 105 -1.798 -25.146 -4.150 819 HG22 ILE 105 2HG2 ILE 105 -2.695 -26.499 -3.463 820 HG23 ILE 105 3HG2 ILE 105 -3.220 -24.845 -3.150 821 HD11 ILE 105 1HD1 ILE 105 1.400 -24.957 -2.612 822 HD12 ILE 105 2HD1 ILE 105 1.425 -26.417 -3.602 823 HD13 ILE 105 3HD1 ILE 105 0.284 -25.123 -3.967 824 H ALA 106 H ALA 106 -3.246 -24.007 -0.382 825 HA ALA 106 HA ALA 106 -4.999 -22.674 -2.100 826 HB1 ALA 106 1HB ALA 106 -5.089 -23.777 0.518 827 HB2 ALA 106 2HB ALA 106 -5.814 -22.169 0.566 828 HB3 ALA 106 3HB ALA 106 -6.428 -23.380 -0.559 829 H PHE 107 H PHE 107 -2.884 -21.441 0.442 830 HA PHE 107 HA PHE 107 -3.841 -18.820 0.562 831 HB2 PHE 107 1HB PHE 107 -2.295 -19.662 2.225 832 HB3 PHE 107 2HB PHE 107 -1.046 -19.884 1.004 833 HD1 PHE 107 1HD PHE 107 -3.002 -17.367 2.859 834 HD2 PHE 107 2HD PHE 107 0.350 -18.100 0.339 835 HE1 PHE 107 1HE PHE 107 -2.179 -15.090 3.297 836 HE2 PHE 107 2HE PHE 107 1.178 -15.824 0.774 837 HZ PHE 107 HZ PHE 107 -0.086 -14.316 2.255 838 H LYS 108 H LYS 108 -1.121 -20.117 -1.341 839 HA LYS 108 HA LYS 108 -0.625 -17.701 -2.733 840 HB2 LYS 108 1HB LYS 108 0.220 -20.547 -3.039 841 HB3 LYS 108 2HB LYS 108 0.482 -19.450 -4.388 842 HG2 LYS 108 1HG LYS 108 2.463 -19.197 -3.309 843 HG3 LYS 108 2HG LYS 108 1.532 -17.938 -2.493 844 HD2 LYS 108 1HD LYS 108 2.375 -18.996 -0.661 845 HD3 LYS 108 2HD LYS 108 0.923 -19.973 -0.893 846 HE2 LYS 108 1HE LYS 108 2.106 -21.755 -1.771 847 HE3 LYS 108 2HE LYS 108 3.465 -20.745 -2.262 848 HZ1 LYS 108 1HZ LYS 108 3.675 -22.291 -0.211 849 HZ2 LYS 108 2HZ LYS 108 2.853 -21.054 0.597 850 HZ3 LYS 108 3HZ LYS 108 4.335 -20.734 -0.153 851 H ASN 109 H ASN 109 -2.404 -20.648 -3.603 852 HA ASN 109 HA ASN 109 -3.079 -19.986 -6.214 853 HB2 ASN 109 1HB ASN 109 -4.300 -21.730 -4.120 854 HB3 ASN 109 2HB ASN 109 -5.236 -21.392 -5.573 855 HD21 ASN 109 1HD2 ASN 109 -2.790 -23.255 -4.190 856 HD22 ASN 109 2HD2 ASN 109 -2.254 -24.062 -5.621 857 H ILE 110 H ILE 110 -4.899 -19.333 -3.226 858 HA ILE 110 HA ILE 110 -6.910 -17.813 -4.594 859 HB ILE 110 HB ILE 110 -7.287 -19.073 -2.446 860 HG12 ILE 110 1HG1 ILE 110 -8.703 -17.226 -1.439 861 HG13 ILE 110 2HG1 ILE 110 -8.002 -16.144 -2.638 862 HG21 ILE 110 1HG2 ILE 110 -5.135 -17.487 -1.579 863 HG22 ILE 110 2HG2 ILE 110 -6.551 -16.942 -0.682 864 HG23 ILE 110 3HG2 ILE 110 -6.078 -18.640 -0.636 865 HD11 ILE 110 1HD1 ILE 110 -10.189 -17.965 -2.896 866 HD12 ILE 110 2HD1 ILE 110 -9.604 -16.749 -4.032 867 HD13 ILE 110 3HD1 ILE 110 -8.925 -18.377 -4.054 868 H ALA 111 H ALA 111 -3.834 -17.138 -3.195 869 HA ALA 111 HA ALA 111 -4.185 -14.387 -2.635 870 HB1 ALA 111 1HB ALA 111 -1.663 -14.329 -2.790 871 HB2 ALA 111 2HB ALA 111 -2.342 -15.469 -1.628 872 HB3 ALA 111 3HB ALA 111 -1.738 -16.047 -3.181 873 H SER 112 H SER 112 -3.747 -16.141 -5.563 874 HA SER 112 HA SER 112 -2.710 -13.947 -7.100 875 HB2 SER 112 1HB SER 112 -2.374 -16.415 -7.620 876 HB3 SER 112 2HB SER 112 -4.045 -16.430 -8.186 877 HG SER 112 HG SER 112 -1.810 -15.487 -9.412 878 H LYS 113 H LYS 113 -5.870 -15.514 -6.736 879 HA LYS 113 HA LYS 113 -7.286 -14.035 -8.627 880 HB2 LYS 113 1HB LYS 113 -8.037 -15.513 -6.141 881 HB3 LYS 113 2HB LYS 113 -9.245 -14.497 -6.917 882 HG2 LYS 113 1HG LYS 113 -9.682 -16.476 -7.946 883 HG3 LYS 113 2HG LYS 113 -8.483 -15.822 -9.064 884 HD2 LYS 113 1HD LYS 113 -6.731 -17.091 -7.854 885 HD3 LYS 113 2HD LYS 113 -7.990 -17.807 -6.845 886 HE2 LYS 113 1HE LYS 113 -9.019 -18.410 -9.212 887 HE3 LYS 113 2HE LYS 113 -7.330 -18.288 -9.703 888 HZ1 LYS 113 1HZ LYS 113 -6.972 -19.808 -7.639 889 HZ2 LYS 113 2HZ LYS 113 -7.471 -20.478 -9.109 890 HZ3 LYS 113 3HZ LYS 113 -8.599 -20.205 -7.878 891 H ILE 114 H ILE 114 -7.082 -13.458 -5.111 892 HA ILE 114 HA ILE 114 -8.524 -11.148 -4.906 893 HB ILE 114 HB ILE 114 -5.921 -11.696 -3.474 894 HG12 ILE 114 1HG1 ILE 114 -7.570 -13.536 -3.278 895 HG13 ILE 114 2HG1 ILE 114 -7.284 -12.726 -1.742 896 HG21 ILE 114 1HG2 ILE 114 -6.777 -9.359 -3.333 897 HG22 ILE 114 2HG2 ILE 114 -8.247 -9.994 -2.597 898 HG23 ILE 114 3HG2 ILE 114 -6.697 -10.191 -1.780 899 HD11 ILE 114 1HD1 ILE 114 -9.420 -12.170 -1.544 900 HD12 ILE 114 2HD1 ILE 114 -9.490 -11.545 -3.192 901 HD13 ILE 114 3HD1 ILE 114 -9.730 -13.266 -2.890 902 H ALA 115 H ALA 115 -4.992 -11.250 -5.418 903 HA ALA 115 HA ALA 115 -4.540 -8.558 -5.787 904 HB1 ALA 115 1HB ALA 115 -2.754 -10.215 -5.613 905 HB2 ALA 115 2HB ALA 115 -3.162 -10.830 -7.216 906 HB3 ALA 115 3HB ALA 115 -2.539 -9.190 -7.032 907 H ASN 116 H ASN 116 -5.384 -10.965 -8.269 908 HA ASN 116 HA ASN 116 -5.327 -9.288 -10.488 909 HB2 ASN 116 1HB ASN 116 -6.763 -11.827 -9.828 910 HB3 ASN 116 2HB ASN 116 -7.208 -10.960 -11.295 911 HD21 ASN 116 1HD2 ASN 116 -5.056 -13.122 -9.880 912 HD22 ASN 116 2HD2 ASN 116 -3.906 -13.211 -11.166 913 H GLU 117 H GLU 117 -8.086 -10.108 -8.390 914 HA GLU 117 HA GLU 117 -9.983 -8.508 -9.692 915 HB2 GLU 117 1HB GLU 117 -9.887 -9.237 -6.760 916 HB3 GLU 117 2HB GLU 117 -11.305 -8.702 -7.650 917 HG2 GLU 117 1HG GLU 117 -10.679 -10.791 -9.156 918 HG3 GLU 117 2HG GLU 117 -9.943 -11.330 -7.648 919 H LEU 118 H LEU 118 -7.815 -7.794 -6.982 920 HA LEU 118 HA LEU 118 -8.787 -5.128 -6.628 921 HB2 LEU 118 1HB LEU 118 -6.492 -6.717 -5.572 922 HB3 LEU 118 2HB LEU 118 -6.505 -4.968 -5.354 923 HG LEU 118 HG LEU 118 -8.845 -6.617 -4.475 924 HD11 LEU 118 1HD1 LEU 118 -6.415 -7.305 -3.580 925 HD12 LEU 118 2HD1 LEU 118 -7.866 -7.357 -2.580 926 HD13 LEU 118 3HD1 LEU 118 -6.771 -5.979 -2.474 927 HD21 LEU 118 1HD2 LEU 118 -8.168 -4.500 -2.730 928 HD22 LEU 118 2HD2 LEU 118 -9.562 -4.630 -3.803 929 HD23 LEU 118 3HD2 LEU 118 -8.075 -3.876 -4.377 930 H LYS 119 H LYS 119 -7.243 -6.379 -9.158 931 HA LYS 119 HA LYS 119 -5.970 -5.569 -10.861 932 HB2 LYS 119 1HB LYS 119 -6.885 -2.947 -9.669 933 HB3 LYS 119 2HB LYS 119 -6.055 -3.090 -11.212 934 HG2 LYS 119 1HG LYS 119 -8.577 -4.612 -10.694 935 HG3 LYS 119 2HG LYS 119 -8.624 -2.916 -11.181 936 HD2 LYS 119 1HD LYS 119 -7.045 -4.955 -12.720 937 HD3 LYS 119 2HD LYS 119 -8.764 -4.695 -13.022 938 HE2 LYS 119 1HE LYS 119 -6.786 -2.435 -13.031 939 HE3 LYS 119 2HE LYS 119 -7.095 -3.406 -14.469 940 HZ1 LYS 119 1HZ LYS 119 -9.559 -2.827 -13.908 941 HZ2 LYS 119 2HZ LYS 119 -8.591 -1.720 -14.744 942 HZ3 LYS 119 3HZ LYS 119 -8.866 -1.519 -13.087 943 H LEU 120 H LEU 120 -4.696 -6.124 -8.286 944 HA LEU 120 HA LEU 120 -2.629 -4.131 -7.970 945 HB2 LEU 120 1HB LEU 120 -2.704 -6.888 -6.769 946 HB3 LEU 120 2HB LEU 120 -1.807 -5.483 -6.196 947 HG LEU 120 HG LEU 120 -4.814 -5.723 -6.170 948 HD11 LEU 120 1HD1 LEU 120 -2.832 -6.837 -4.420 949 HD12 LEU 120 2HD1 LEU 120 -4.588 -6.984 -4.362 950 HD13 LEU 120 3HD1 LEU 120 -3.791 -5.628 -3.566 951 HD21 LEU 120 1HD2 LEU 120 -4.727 -3.521 -5.870 952 HD22 LEU 120 2HD2 LEU 120 -2.968 -3.537 -5.744 953 HD23 LEU 120 3HD2 LEU 120 -3.957 -3.843 -4.316 954 H SER 121 H SER 121 -0.299 -4.891 -7.928 955 HA SER 121 HA SER 121 0.716 -5.396 -10.353 956 HB2 SER 121 1HB SER 121 1.703 -6.053 -7.620 957 HB3 SER 121 2HB SER 121 2.579 -6.741 -8.988 958 HG SER 121 HG SER 121 2.350 -4.357 -9.738 959 H GLY 122 H GLY 122 0.097 -8.008 -7.997 960 HA2 GLY 122 1HA GLY 122 -0.623 -10.173 -8.359 961 HA3 GLY 122 2HA GLY 122 -0.863 -9.764 -10.052 962 HA PRO 123 HA PRO 123 3.783 -11.063 -9.518 963 HB2 PRO 123 1HB PRO 123 4.377 -12.364 -7.211 964 HB3 PRO 123 2HB PRO 123 4.520 -10.612 -7.389 965 HG2 PRO 123 1HG PRO 123 2.319 -12.216 -6.146 966 HG3 PRO 123 2HG PRO 123 3.074 -10.717 -5.571 967 HD2 PRO 123 1HD PRO 123 0.687 -10.750 -6.851 968 HD3 PRO 123 2HD PRO 123 1.829 -9.397 -6.993 969 H SER 124 H SER 124 3.946 -12.741 -10.855 970 HA SER 124 HA SER 124 2.222 -14.961 -10.850 971 HB2 SER 124 1HB SER 124 4.847 -14.404 -12.223 972 HB3 SER 124 2HB SER 124 4.006 -15.940 -12.429 973 HG SER 124 HG SER 124 3.546 -14.169 -13.987 974 H SER 125 H SER 125 2.243 -16.805 -9.746 975 HA SER 125 HA SER 125 4.577 -18.177 -8.941 976 HB2 SER 125 1HB SER 125 4.405 -17.902 -6.504 977 HB3 SER 125 2HB SER 125 4.728 -16.357 -7.291 978 HG SER 125 HG SER 125 2.266 -16.234 -7.235 979 H GLY 126 H GLY 126 4.129 -20.234 -8.153 980 HA2 GLY 126 1HA GLY 126 1.343 -20.914 -7.572 981 HA3 GLY 126 2HA GLY 126 2.093 -21.701 -8.953 Start of MODEL 13 1 H1 MET 1 H MET 1 19.955 -39.875 -12.718 2 HA MET 1 HA MET 1 19.800 -40.135 -9.902 3 HB2 MET 1 1HB MET 1 22.109 -39.830 -9.286 4 HB3 MET 1 2HB MET 1 21.982 -41.265 -10.294 5 HG2 MET 1 1HG MET 1 22.631 -39.752 -12.237 6 HG3 MET 1 2HG MET 1 23.088 -38.575 -11.009 7 HE1 MET 1 1HE MET 1 23.750 -42.592 -10.398 8 HE2 MET 1 2HE MET 1 23.317 -42.193 -12.061 9 HE3 MET 1 3HE MET 1 24.962 -42.701 -11.674 10 H LYS 2 H LYS 2 19.178 -38.213 -9.175 11 HA LYS 2 HA LYS 2 20.285 -35.780 -10.352 12 HB2 LYS 2 1HB LYS 2 18.070 -34.771 -10.623 13 HB3 LYS 2 2HB LYS 2 18.237 -36.208 -11.624 14 HG2 LYS 2 1HG LYS 2 16.168 -36.586 -10.773 15 HG3 LYS 2 2HG LYS 2 17.135 -37.365 -9.519 16 HD2 LYS 2 1HD LYS 2 16.987 -35.406 -8.122 17 HD3 LYS 2 2HD LYS 2 16.164 -34.511 -9.402 18 HE2 LYS 2 1HE LYS 2 14.400 -36.381 -9.279 19 HE3 LYS 2 2HE LYS 2 15.142 -36.784 -7.732 20 HZ1 LYS 2 1HZ LYS 2 13.184 -35.210 -7.683 21 HZ2 LYS 2 2HZ LYS 2 14.209 -34.047 -8.359 22 HZ3 LYS 2 3HZ LYS 2 14.567 -34.711 -6.845 23 H ASP 3 H ASP 3 19.970 -33.887 -9.038 24 HA ASP 3 HA ASP 3 20.404 -34.292 -6.321 25 HB2 ASP 3 1HB ASP 3 20.074 -31.873 -6.067 26 HB3 ASP 3 2HB ASP 3 21.051 -32.234 -7.488 27 H HIS 4 H HIS 4 19.062 -35.048 -4.835 28 HA HIS 4 HA HIS 4 16.226 -34.262 -4.970 29 HB2 HIS 4 1HB HIS 4 15.919 -36.533 -3.697 30 HB3 HIS 4 2HB HIS 4 16.069 -36.520 -5.451 31 HD1 HIS 4 1HD HIS 4 17.499 -38.379 -6.198 32 HD2 HIS 4 2HD HIS 4 18.806 -36.800 -2.584 33 HE1 HIS 4 1HE HIS 4 19.548 -39.703 -5.588 34 HE2 HIS 4 2HE HIS 4 20.271 -38.787 -3.356 35 H LEU 5 H LEU 5 19.076 -34.683 -3.054 36 HA LEU 5 HA LEU 5 18.287 -34.788 -0.478 37 HB2 LEU 5 1HB LEU 5 20.131 -32.987 -0.082 38 HB3 LEU 5 2HB LEU 5 20.555 -34.582 -0.701 39 HG LEU 5 HG LEU 5 20.663 -33.642 -2.977 40 HD11 LEU 5 1HD1 LEU 5 19.252 -31.816 -3.049 41 HD12 LEU 5 2HD1 LEU 5 20.840 -31.053 -2.984 42 HD13 LEU 5 3HD1 LEU 5 19.852 -31.158 -1.527 43 HD21 LEU 5 1HD2 LEU 5 22.769 -32.588 -2.724 44 HD22 LEU 5 2HD2 LEU 5 22.638 -33.763 -1.415 45 HD23 LEU 5 3HD2 LEU 5 22.382 -32.048 -1.090 46 H ILE 6 H ILE 6 17.758 -33.252 1.163 47 HA ILE 6 HA ILE 6 16.683 -30.689 0.240 48 HB ILE 6 HB ILE 6 15.105 -32.636 1.926 49 HG12 ILE 6 1HG1 ILE 6 15.213 -33.194 -0.504 50 HG13 ILE 6 2HG1 ILE 6 13.589 -32.798 0.050 51 HG21 ILE 6 1HG2 ILE 6 14.667 -29.781 1.145 52 HG22 ILE 6 2HG2 ILE 6 13.299 -30.844 1.469 53 HG23 ILE 6 3HG2 ILE 6 14.499 -30.545 2.726 54 HD11 ILE 6 1HD1 ILE 6 13.709 -30.634 -0.950 55 HD12 ILE 6 2HD1 ILE 6 15.414 -30.858 -1.343 56 HD13 ILE 6 3HD1 ILE 6 14.187 -31.832 -2.153 57 H HIS 7 H HIS 7 16.842 -29.049 1.701 58 HA HIS 7 HA HIS 7 18.046 -29.726 4.304 59 HB2 HIS 7 1HB HIS 7 19.560 -28.508 2.757 60 HB3 HIS 7 2HB HIS 7 18.403 -27.180 2.707 61 HD1 HIS 7 1HD HIS 7 21.434 -27.194 3.856 62 HD2 HIS 7 2HD HIS 7 17.895 -27.138 6.032 63 HE1 HIS 7 1HE HIS 7 22.033 -26.204 6.089 64 HE2 HIS 7 2HE HIS 7 19.894 -26.258 7.418 65 H ASN 8 H ASN 8 16.001 -29.892 5.315 66 HA ASN 8 HA ASN 8 15.073 -27.517 6.503 67 HB2 ASN 8 1HB ASN 8 13.019 -27.095 5.470 68 HB3 ASN 8 2HB ASN 8 14.085 -27.423 4.107 69 HD21 ASN 8 1HD2 ASN 8 11.267 -27.632 4.088 70 HD22 ASN 8 2HD2 ASN 8 10.863 -29.285 3.788 71 H VAL 9 H VAL 9 13.211 -27.897 7.946 72 HA VAL 9 HA VAL 9 12.804 -30.749 8.549 73 HB VAL 9 HB VAL 9 12.880 -30.241 10.955 74 HG11 VAL 9 1HG1 VAL 9 14.994 -30.901 10.824 75 HG12 VAL 9 2HG1 VAL 9 15.075 -30.333 9.155 76 HG13 VAL 9 3HG1 VAL 9 15.492 -29.245 10.479 77 HG21 VAL 9 1HG2 VAL 9 12.507 -28.095 11.490 78 HG22 VAL 9 2HG2 VAL 9 14.239 -27.892 11.231 79 HG23 VAL 9 3HG2 VAL 9 13.103 -27.503 9.939 80 H HIS 10 H HIS 10 11.016 -29.295 7.050 81 HA HIS 10 HA HIS 10 8.852 -28.579 6.917 82 HB2 HIS 10 1HB HIS 10 8.733 -30.991 7.824 83 HB3 HIS 10 2HB HIS 10 8.336 -30.247 9.369 84 HD1 HIS 10 1HD HIS 10 5.920 -30.901 9.554 85 HD2 HIS 10 2HD HIS 10 6.814 -29.100 5.918 86 HE1 HIS 10 1HE HIS 10 3.704 -30.531 8.424 87 HE2 HIS 10 2HE HIS 10 4.276 -29.519 6.190 88 H LYS 11 H LYS 11 10.668 -27.002 8.606 89 HA LYS 11 HA LYS 11 8.612 -25.532 10.077 90 HB2 LYS 11 1HB LYS 11 11.253 -26.426 11.237 91 HB3 LYS 11 2HB LYS 11 10.248 -25.175 11.958 92 HG2 LYS 11 1HG LYS 11 8.967 -27.782 11.384 93 HG3 LYS 11 2HG LYS 11 10.131 -27.717 12.709 94 HD2 LYS 11 1HD LYS 11 8.257 -27.146 13.868 95 HD3 LYS 11 2HD LYS 11 8.723 -25.538 13.310 96 HE2 LYS 11 1HE LYS 11 7.183 -25.718 11.440 97 HE3 LYS 11 2HE LYS 11 6.759 -27.360 11.922 98 HZ1 LYS 11 1HZ LYS 11 5.285 -25.335 12.614 99 HZ2 LYS 11 2HZ LYS 11 6.411 -25.196 13.869 100 HZ3 LYS 11 3HZ LYS 11 5.528 -26.626 13.679 101 H GLU 12 H GLU 12 8.865 -23.336 10.048 102 HA GLU 12 HA GLU 12 11.328 -22.258 8.868 103 HB2 GLU 12 1HB GLU 12 9.738 -22.399 7.046 104 HB3 GLU 12 2HB GLU 12 8.508 -21.595 8.011 105 HG2 GLU 12 1HG GLU 12 9.245 -19.885 6.675 106 HG3 GLU 12 2HG GLU 12 10.231 -19.657 8.118 107 H GLU 13 H GLU 13 11.780 -21.714 11.100 108 HA GLU 13 HA GLU 13 11.096 -19.046 11.724 109 HB2 GLU 13 1HB GLU 13 8.981 -20.235 12.402 110 HB3 GLU 13 2HB GLU 13 9.925 -21.085 13.618 111 HG2 GLU 13 1HG GLU 13 10.584 -18.779 14.476 112 HG3 GLU 13 2HG GLU 13 9.280 -18.163 13.462 113 H HIS 14 H HIS 14 12.300 -18.213 13.475 114 HA HIS 14 HA HIS 14 14.463 -20.001 14.359 115 HB2 HIS 14 1HB HIS 14 14.356 -17.082 13.716 116 HB3 HIS 14 2HB HIS 14 15.541 -17.651 14.887 117 HD1 HIS 14 1HD HIS 14 17.415 -16.955 13.186 118 HD2 HIS 14 2HD HIS 14 14.903 -19.997 11.881 119 HE1 HIS 14 1HE HIS 14 18.577 -17.985 11.207 120 HE2 HIS 14 2HE HIS 14 16.999 -19.766 10.383 121 H ALA 15 H ALA 15 12.747 -17.097 15.531 122 HA ALA 15 HA ALA 15 11.951 -18.294 17.967 123 HB1 ALA 15 1HB ALA 15 13.497 -16.566 19.290 124 HB2 ALA 15 2HB ALA 15 13.993 -18.224 18.948 125 HB3 ALA 15 3HB ALA 15 14.563 -16.905 17.926 126 H HIS 16 H HIS 16 11.186 -16.558 19.566 127 HA HIS 16 HA HIS 16 10.391 -14.091 18.194 128 HB2 HIS 16 1HB HIS 16 8.086 -14.432 19.311 129 HB3 HIS 16 2HB HIS 16 8.443 -15.342 17.846 130 HD1 HIS 16 1HD HIS 16 8.329 -15.814 21.601 131 HD2 HIS 16 2HD HIS 16 8.242 -18.055 18.104 132 HE1 HIS 16 1HE HIS 16 7.816 -18.167 22.323 133 HE2 HIS 16 2HE HIS 16 7.853 -19.520 20.199 134 H ALA 17 H ALA 17 9.754 -12.375 19.616 135 HA ALA 17 HA ALA 17 10.184 -12.734 22.466 136 HB1 ALA 17 1HB ALA 17 12.348 -12.014 20.940 137 HB2 ALA 17 2HB ALA 17 11.735 -10.460 21.507 138 HB3 ALA 17 3HB ALA 17 12.162 -11.717 22.668 139 H HIS 18 H HIS 18 10.157 -10.303 23.443 140 HA HIS 18 HA HIS 18 7.537 -9.336 22.819 141 HB2 HIS 18 1HB HIS 18 8.395 -7.469 24.504 142 HB3 HIS 18 2HB HIS 18 7.926 -9.071 25.064 143 HD1 HIS 18 1HD HIS 18 10.783 -6.762 24.877 144 HD2 HIS 18 2HD HIS 18 10.149 -10.786 25.688 145 HE1 HIS 18 1HE HIS 18 12.902 -7.571 25.963 146 HE2 HIS 18 2HE HIS 18 12.526 -10.028 26.367 147 H ASN 19 H ASN 19 10.260 -8.962 21.150 148 HA ASN 19 HA ASN 19 9.565 -6.226 20.310 149 HB2 ASN 19 1HB ASN 19 12.350 -7.331 20.054 150 HB3 ASN 19 2HB ASN 19 11.823 -5.650 20.027 151 HD21 ASN 19 1HD2 ASN 19 12.358 -8.447 22.060 152 HD22 ASN 19 2HD2 ASN 19 12.498 -7.578 23.547 153 H LYS 20 H LYS 20 8.299 -6.801 18.584 154 HA LYS 20 HA LYS 20 9.219 -8.742 16.648 155 HB2 LYS 20 1HB LYS 20 7.095 -7.735 15.425 156 HB3 LYS 20 2HB LYS 20 6.934 -8.872 16.757 157 HG2 LYS 20 1HG LYS 20 7.012 -5.975 17.400 158 HG3 LYS 20 2HG LYS 20 5.549 -6.631 16.661 159 HD2 LYS 20 1HD LYS 20 6.759 -8.068 18.975 160 HD3 LYS 20 2HD LYS 20 5.849 -6.585 19.276 161 HE2 LYS 20 1HE LYS 20 3.870 -7.493 18.422 162 HE3 LYS 20 2HE LYS 20 4.719 -8.796 17.592 163 HZ1 LYS 20 1HZ LYS 20 5.040 -8.745 20.470 164 HZ2 LYS 20 2HZ LYS 20 4.764 -10.052 19.434 165 HZ3 LYS 20 3HZ LYS 20 3.472 -9.081 19.933 166 H ASP 21 H ASP 21 11.183 -7.017 16.657 167 HA ASP 21 HA ASP 21 10.837 -5.528 14.149 168 HB2 ASP 21 1HB ASP 21 10.754 -3.998 16.166 169 HB3 ASP 21 2HB ASP 21 12.426 -4.453 16.481 170 H TYR 22 H TYR 22 11.823 -7.767 13.647 171 HA TYR 22 HA TYR 22 14.755 -7.483 13.688 172 HB2 TYR 22 1HB TYR 22 14.538 -10.139 13.464 173 HB3 TYR 22 2HB TYR 22 14.618 -9.329 15.025 174 HD1 TYR 22 1HD TYR 22 12.447 -11.093 12.657 175 HD2 TYR 22 2HD TYR 22 12.661 -9.176 16.450 176 HE1 TYR 22 1HE TYR 22 10.288 -12.094 13.279 177 HE2 TYR 22 2HE TYR 22 10.503 -10.173 17.082 178 HH TYR 22 HH TYR 22 8.758 -12.334 14.866 179 H ASP 23 H ASP 23 15.598 -9.301 11.988 180 HA ASP 23 HA ASP 23 14.505 -8.405 9.447 181 HB2 ASP 23 1HB ASP 23 17.031 -9.778 10.297 182 HB3 ASP 23 2HB ASP 23 16.530 -9.840 8.609 183 H ILE 24 H ILE 24 12.510 -9.602 9.617 184 HA ILE 24 HA ILE 24 12.133 -12.276 9.990 185 HB ILE 24 HB ILE 24 10.710 -11.006 7.691 186 HG12 ILE 24 1HG1 ILE 24 10.751 -9.140 9.138 187 HG13 ILE 24 2HG1 ILE 24 9.206 -9.921 9.458 188 HG21 ILE 24 1HG2 ILE 24 10.010 -13.205 8.277 189 HG22 ILE 24 2HG2 ILE 24 9.919 -12.786 9.986 190 HG23 ILE 24 3HG2 ILE 24 8.767 -12.091 8.847 191 HD11 ILE 24 1HD1 ILE 24 9.740 -9.904 11.602 192 HD12 ILE 24 2HD1 ILE 24 11.002 -11.083 11.243 193 HD13 ILE 24 3HD1 ILE 24 11.379 -9.361 11.245 194 HA PRO 25 HA PRO 25 14.406 -14.325 6.808 195 HB2 PRO 25 1HB PRO 25 13.194 -16.748 6.980 196 HB3 PRO 25 2HB PRO 25 14.354 -16.167 8.180 197 HG2 PRO 25 1HG PRO 25 11.362 -16.168 8.285 198 HG3 PRO 25 2HG PRO 25 12.526 -16.588 9.555 199 HD2 PRO 25 1HD PRO 25 11.281 -14.186 9.456 200 HD3 PRO 25 2HD PRO 25 12.927 -14.382 10.091 201 H THR 26 H THR 26 13.492 -16.282 5.155 202 HA THR 26 HA THR 26 11.879 -14.772 3.294 203 HB THR 26 HB THR 26 13.846 -16.079 2.530 204 HG1 THR 26 1HG THR 26 12.634 -15.883 0.795 205 HG21 THR 26 1HG2 THR 26 12.651 -18.129 4.058 206 HG22 THR 26 2HG2 THR 26 14.137 -18.209 3.112 207 HG23 THR 26 3HG2 THR 26 12.597 -18.651 2.375 208 H THR 27 H THR 27 10.494 -15.535 5.655 209 HA THR 27 HA THR 27 8.963 -17.836 5.507 210 HB THR 27 HB THR 27 9.005 -16.170 7.408 211 HG1 THR 27 1HG THR 27 6.423 -16.974 6.499 212 HG21 THR 27 1HG2 THR 27 8.280 -14.091 7.074 213 HG22 THR 27 2HG2 THR 27 6.678 -14.711 6.675 214 HG23 THR 27 3HG2 THR 27 7.882 -14.492 5.404 215 H GLU 28 H GLU 28 6.656 -18.054 4.950 216 HA GLU 28 HA GLU 28 6.179 -17.429 2.255 217 HB2 GLU 28 1HB GLU 28 4.305 -18.358 4.433 218 HB3 GLU 28 2HB GLU 28 3.838 -18.222 2.744 219 HG2 GLU 28 1HG GLU 28 5.056 -20.034 2.110 220 HG3 GLU 28 2HG GLU 28 6.257 -19.812 3.381 221 H ASN 29 H ASN 29 6.632 -15.083 2.402 222 HA ASN 29 HA ASN 29 4.240 -13.568 3.220 223 HB2 ASN 29 1HB ASN 29 5.643 -11.650 3.592 224 HB3 ASN 29 2HB ASN 29 6.363 -13.016 4.439 225 HD21 ASN 29 1HD2 ASN 29 8.257 -13.945 3.630 226 HD22 ASN 29 2HD2 ASN 29 9.276 -13.102 2.518 227 H LEU 30 H LEU 30 3.202 -12.347 1.742 228 HA LEU 30 HA LEU 30 4.390 -12.181 -0.950 229 HB2 LEU 30 1HB LEU 30 1.626 -12.825 -0.041 230 HB3 LEU 30 2HB LEU 30 1.843 -11.987 -1.577 231 HG LEU 30 HG LEU 30 1.631 -14.295 -2.068 232 HD11 LEU 30 1HD1 LEU 30 4.597 -14.039 -2.136 233 HD12 LEU 30 2HD1 LEU 30 3.616 -12.881 -3.033 234 HD13 LEU 30 3HD1 LEU 30 3.483 -14.605 -3.381 235 HD21 LEU 30 1HD2 LEU 30 3.847 -14.854 -0.101 236 HD22 LEU 30 2HD2 LEU 30 2.927 -16.034 -1.035 237 HD23 LEU 30 3HD2 LEU 30 2.131 -15.095 0.230 238 H TYR 31 H TYR 31 4.676 -10.203 -1.742 239 HA TYR 31 HA TYR 31 3.298 -7.964 -0.415 240 HB2 TYR 31 1HB TYR 31 5.930 -7.887 -1.902 241 HB3 TYR 31 2HB TYR 31 5.195 -6.568 -0.997 242 HD1 TYR 31 1HD TYR 31 4.379 -7.786 1.494 243 HD2 TYR 31 2HD TYR 31 7.881 -8.492 -0.817 244 HE1 TYR 31 1HE TYR 31 5.564 -8.514 3.523 245 HE2 TYR 31 2HE TYR 31 9.075 -9.223 1.205 246 HH TYR 31 HH TYR 31 8.978 -9.054 3.563 247 H PHE 32 H PHE 32 1.681 -7.214 -1.606 248 HA PHE 32 HA PHE 32 1.956 -7.220 -4.535 249 HB2 PHE 32 1HB PHE 32 -0.599 -6.953 -2.944 250 HB3 PHE 32 2HB PHE 32 -0.445 -7.233 -4.675 251 HD1 PHE 32 1HD PHE 32 -0.177 -8.738 -1.348 252 HD2 PHE 32 2HD PHE 32 0.044 -9.418 -5.544 253 HE1 PHE 32 1HE PHE 32 -0.265 -11.165 -0.955 254 HE2 PHE 32 2HE PHE 32 -0.045 -11.846 -5.158 255 HZ PHE 32 HZ PHE 32 -0.200 -12.723 -2.862 256 H GLN 33 H GLN 33 1.166 -5.384 -5.720 257 HA GLN 33 HA GLN 33 0.907 -2.905 -4.178 258 HB2 GLN 33 1HB GLN 33 2.448 -1.748 -5.711 259 HB3 GLN 33 2HB GLN 33 3.252 -3.029 -4.813 260 HG2 GLN 33 1HG GLN 33 3.440 -4.393 -6.677 261 HG3 GLN 33 2HG GLN 33 2.168 -3.542 -7.550 262 HE21 GLN 33 1HE2 GLN 33 5.492 -3.815 -6.992 263 HE22 GLN 33 2HE2 GLN 33 6.009 -2.454 -7.921 264 H GLY 34 H GLY 34 -0.587 -1.522 -4.957 265 HA2 GLY 34 1HA GLY 34 -1.326 -0.972 -7.520 266 HA3 GLY 34 2HA GLY 34 -2.253 -2.412 -7.128 267 H SER 35 H SER 35 -1.566 0.885 -6.022 268 HA SER 35 HA SER 35 -3.755 0.997 -4.212 269 HB2 SER 35 1HB SER 35 -1.814 2.482 -3.984 270 HB3 SER 35 2HB SER 35 -2.208 3.246 -5.524 271 HG SER 35 HG SER 35 -3.094 3.906 -3.141 272 H SER 36 H SER 36 -5.842 1.357 -4.582 273 HA SER 36 HA SER 36 -6.656 2.124 -7.298 274 HB2 SER 36 1HB SER 36 -7.857 0.407 -5.184 275 HB3 SER 36 2HB SER 36 -8.964 1.299 -6.226 276 HG SER 36 HG SER 36 -7.149 0.253 -7.805 277 H GLY 37 H GLY 37 -5.746 4.096 -5.437 278 HA2 GLY 37 1HA GLY 37 -6.950 6.314 -5.673 279 HA3 GLY 37 2HA GLY 37 -8.260 5.514 -4.818 280 H SER 38 H SER 38 -8.167 5.285 -2.618 281 HA SER 38 HA SER 38 -5.879 6.594 -1.302 282 HB2 SER 38 1HB SER 38 -8.722 6.390 -0.282 283 HB3 SER 38 2HB SER 38 -7.399 7.288 0.463 284 HG SER 38 HG SER 38 -8.535 8.761 -0.703 285 H SER 39 H SER 39 -5.355 5.820 0.871 286 HA SER 39 HA SER 39 -4.982 3.037 0.936 287 HB2 SER 39 1HB SER 39 -4.883 4.799 3.380 288 HB3 SER 39 2HB SER 39 -3.925 3.361 3.028 289 HG SER 39 HG SER 39 -2.513 4.727 2.297 290 H GLY 40 H GLY 40 -7.407 5.120 2.412 291 HA2 GLY 40 1HA GLY 40 -8.549 3.190 4.132 292 HA3 GLY 40 2HA GLY 40 -9.344 4.646 3.551 293 H ASP 41 H ASP 41 -9.506 4.252 0.872 294 HA ASP 41 HA ASP 41 -11.779 2.833 0.463 295 HB2 ASP 41 1HB ASP 41 -9.516 3.581 -1.328 296 HB3 ASP 41 2HB ASP 41 -10.722 2.458 -1.952 297 H MET 42 H MET 42 -8.478 1.559 0.185 298 HA MET 42 HA MET 42 -8.832 -0.931 -0.785 299 HB2 MET 42 1HB MET 42 -7.048 0.167 1.325 300 HB3 MET 42 2HB MET 42 -7.126 -1.582 1.168 301 HG2 MET 42 1HG MET 42 -6.712 0.024 -1.292 302 HG3 MET 42 2HG MET 42 -5.370 -0.135 -0.160 303 HE1 MET 42 1HE MET 42 -6.237 -2.225 -3.543 304 HE2 MET 42 2HE MET 42 -5.508 -0.718 -2.991 305 HE3 MET 42 3HE MET 42 -4.526 -2.178 -3.119 306 H MET 43 H MET 43 -8.862 -0.415 2.745 307 HA MET 43 HA MET 43 -9.773 -2.752 3.663 308 HB2 MET 43 1HB MET 43 -10.908 -0.086 4.526 309 HB3 MET 43 2HB MET 43 -10.931 -1.569 5.469 310 HG2 MET 43 1HG MET 43 -8.440 -0.132 4.585 311 HG3 MET 43 2HG MET 43 -9.184 0.014 6.176 312 HE1 MET 43 1HE MET 43 -8.575 -1.750 8.203 313 HE2 MET 43 2HE MET 43 -9.998 -2.312 7.324 314 HE3 MET 43 3HE MET 43 -8.719 -3.449 7.751 315 H ARG 44 H ARG 44 -11.777 -0.338 2.044 316 HA ARG 44 HA ARG 44 -14.207 -1.825 2.390 317 HB2 ARG 44 1HB ARG 44 -13.452 0.607 0.788 318 HB3 ARG 44 2HB ARG 44 -15.033 -0.143 0.623 319 HG2 ARG 44 1HG ARG 44 -15.450 1.489 2.181 320 HG3 ARG 44 2HG ARG 44 -15.118 0.096 3.211 321 HD2 ARG 44 1HD ARG 44 -13.068 0.900 3.870 322 HD3 ARG 44 2HD ARG 44 -12.861 1.868 2.411 323 HE ARG 44 HE ARG 44 -15.015 2.893 3.890 324 HH11 ARG 44 2HH1 ARG 44 -11.549 2.610 4.048 325 HH12 ARG 44 1HH1 ARG 44 -11.344 4.046 4.996 326 HH21 ARG 44 2HH2 ARG 44 -14.759 4.785 5.137 327 HH22 ARG 44 1HH2 ARG 44 -13.171 5.282 5.616 328 H GLU 45 H GLU 45 -12.372 -0.920 -0.538 329 HA GLU 45 HA GLU 45 -13.666 -2.483 -2.375 330 HB2 GLU 45 1HB GLU 45 -11.879 -0.876 -2.928 331 HB3 GLU 45 2HB GLU 45 -10.687 -1.978 -2.254 332 HG2 GLU 45 1HG GLU 45 -10.927 -1.964 -4.766 333 HG3 GLU 45 2HG GLU 45 -10.988 -3.538 -3.976 334 H ILE 46 H ILE 46 -10.780 -3.460 -0.521 335 HA ILE 46 HA ILE 46 -10.335 -5.973 -1.354 336 HB ILE 46 HB ILE 46 -10.472 -5.145 1.547 337 HG12 ILE 46 1HG1 ILE 46 -7.994 -5.340 -0.146 338 HG13 ILE 46 2HG1 ILE 46 -8.968 -3.874 -0.140 339 HG21 ILE 46 1HG2 ILE 46 -9.548 -7.617 0.194 340 HG22 ILE 46 2HG2 ILE 46 -8.586 -7.012 1.542 341 HG23 ILE 46 3HG2 ILE 46 -10.290 -7.402 1.779 342 HD11 ILE 46 1HD1 ILE 46 -8.280 -3.272 1.912 343 HD12 ILE 46 2HD1 ILE 46 -8.228 -4.934 2.503 344 HD13 ILE 46 3HD1 ILE 46 -6.908 -4.307 1.516 345 H ARG 47 H ARG 47 -12.583 -5.344 1.348 346 HA ARG 47 HA ARG 47 -13.661 -7.792 1.720 347 HB2 ARG 47 1HB ARG 47 -15.269 -5.234 1.599 348 HB3 ARG 47 2HB ARG 47 -15.729 -6.708 2.442 349 HG2 ARG 47 1HG ARG 47 -14.284 -6.343 4.163 350 HG3 ARG 47 2HG ARG 47 -13.136 -5.457 3.157 351 HD2 ARG 47 1HD ARG 47 -14.084 -3.850 4.592 352 HD3 ARG 47 2HD ARG 47 -14.883 -3.621 3.037 353 HE ARG 47 HE ARG 47 -16.865 -4.389 3.958 354 HH11 ARG 47 2HH1 ARG 47 -14.237 -4.752 6.213 355 HH12 ARG 47 1HH1 ARG 47 -15.270 -5.075 7.565 356 HH21 ARG 47 2HH2 ARG 47 -18.236 -4.813 5.731 357 HH22 ARG 47 1HH2 ARG 47 -17.545 -5.111 7.290 358 H LYS 48 H LYS 48 -14.631 -5.501 -0.808 359 HA LYS 48 HA LYS 48 -16.775 -6.769 -1.924 360 HB2 LYS 48 1HB LYS 48 -15.608 -4.596 -2.643 361 HB3 LYS 48 2HB LYS 48 -14.584 -5.619 -3.641 362 HG2 LYS 48 1HG LYS 48 -17.548 -5.854 -3.864 363 HG3 LYS 48 2HG LYS 48 -16.716 -4.504 -4.640 364 HD2 LYS 48 1HD LYS 48 -15.628 -7.240 -5.054 365 HD3 LYS 48 2HD LYS 48 -17.120 -6.806 -5.891 366 HE2 LYS 48 1HE LYS 48 -16.030 -4.896 -6.906 367 HE3 LYS 48 2HE LYS 48 -14.554 -5.224 -5.999 368 HZ1 LYS 48 1HZ LYS 48 -13.922 -6.742 -7.476 369 HZ2 LYS 48 2HZ LYS 48 -15.130 -6.140 -8.495 370 HZ3 LYS 48 3HZ LYS 48 -15.441 -7.484 -7.516 371 H VAL 49 H VAL 49 -13.358 -7.400 -2.706 372 HA VAL 49 HA VAL 49 -13.809 -9.457 -4.556 373 HB VAL 49 HB VAL 49 -11.410 -9.312 -2.737 374 HG11 VAL 49 1HG1 VAL 49 -11.256 -11.243 -4.027 375 HG12 VAL 49 2HG1 VAL 49 -11.972 -10.470 -5.444 376 HG13 VAL 49 3HG1 VAL 49 -10.328 -10.062 -4.951 377 HG21 VAL 49 1HG2 VAL 49 -10.857 -7.979 -5.151 378 HG22 VAL 49 2HG2 VAL 49 -12.373 -7.310 -4.547 379 HG23 VAL 49 3HG2 VAL 49 -10.934 -7.291 -3.529 380 H LEU 50 H LEU 50 -13.161 -9.605 -1.063 381 HA LEU 50 HA LEU 50 -13.087 -12.351 -0.739 382 HB2 LEU 50 1HB LEU 50 -14.332 -10.399 1.187 383 HB3 LEU 50 2HB LEU 50 -13.652 -11.979 1.570 384 HG LEU 50 HG LEU 50 -12.031 -9.661 0.526 385 HD11 LEU 50 1HD1 LEU 50 -13.229 -9.813 3.010 386 HD12 LEU 50 2HD1 LEU 50 -11.834 -8.824 2.578 387 HD13 LEU 50 3HD1 LEU 50 -11.597 -10.420 3.291 388 HD21 LEU 50 1HD2 LEU 50 -10.445 -11.194 0.287 389 HD22 LEU 50 2HD2 LEU 50 -11.499 -12.448 0.942 390 HD23 LEU 50 3HD2 LEU 50 -10.503 -11.476 2.027 391 H GLY 51 H GLY 51 -15.939 -10.241 -0.322 392 HA2 GLY 51 1HA GLY 51 -17.835 -12.203 0.134 393 HA3 GLY 51 2HA GLY 51 -18.175 -10.661 -0.638 394 H ALA 52 H ALA 52 -16.555 -11.064 -2.952 395 HA ALA 52 HA ALA 52 -18.389 -12.340 -4.640 396 HB1 ALA 52 1HB ALA 52 -15.591 -11.355 -4.973 397 HB2 ALA 52 2HB ALA 52 -16.342 -12.305 -6.256 398 HB3 ALA 52 3HB ALA 52 -17.080 -10.791 -5.732 399 H ASN 53 H ASN 53 -15.373 -13.489 -3.195 400 HA ASN 53 HA ASN 53 -15.730 -16.109 -4.435 401 HB2 ASN 53 1HB ASN 53 -13.484 -14.734 -3.014 402 HB3 ASN 53 2HB ASN 53 -13.510 -16.494 -3.060 403 HD21 ASN 53 1HD2 ASN 53 -13.530 -13.599 -5.051 404 HD22 ASN 53 2HD2 ASN 53 -12.821 -14.331 -6.447 405 H ASN 54 H ASN 54 -17.701 -15.395 -2.574 406 HA ASN 54 HA ASN 54 -18.663 -15.972 -0.565 407 HB2 ASN 54 1HB ASN 54 -17.497 -18.577 -1.562 408 HB3 ASN 54 2HB ASN 54 -18.657 -18.470 -0.241 409 HD21 ASN 54 1HD2 ASN 54 -20.747 -17.535 -0.716 410 HD22 ASN 54 2HD2 ASN 54 -21.414 -17.716 -2.300 411 H CYS 55 H CYS 55 -16.124 -14.836 -0.142 412 HA CYS 55 HA CYS 55 -14.921 -16.494 1.953 413 HB2 CYS 55 1HB CYS 55 -13.962 -14.039 0.486 414 HB3 CYS 55 2HB CYS 55 -13.144 -14.661 1.913 415 HG CYS 55 HG CYS 55 -13.531 -16.300 -1.065 416 H ASP 56 H ASP 56 -14.208 -15.328 3.950 417 HA ASP 56 HA ASP 56 -16.249 -13.366 4.770 418 HB2 ASP 56 1HB ASP 56 -16.345 -15.709 5.806 419 HB3 ASP 56 2HB ASP 56 -14.863 -15.270 6.651 420 H TYR 57 H TYR 57 -15.572 -11.929 6.559 421 HA TYR 57 HA TYR 57 -12.743 -11.559 6.987 422 HB2 TYR 57 1HB TYR 57 -12.960 -9.103 6.190 423 HB3 TYR 57 2HB TYR 57 -12.720 -10.361 4.983 424 HD1 TYR 57 2HD TYR 57 -14.927 -11.350 3.949 425 HD2 TYR 57 1HD TYR 57 -14.666 -7.569 5.883 426 HE1 TYR 57 2HE TYR 57 -16.957 -10.614 2.772 427 HE2 TYR 57 1HE TYR 57 -16.696 -6.823 4.713 428 HH TYR 57 HH TYR 57 -18.119 -8.667 2.146 429 H GLU 58 H GLU 58 -12.297 -10.355 8.800 430 HA GLU 58 HA GLU 58 -14.570 -9.101 10.178 431 HB2 GLU 58 1HB GLU 58 -14.251 -11.310 11.165 432 HB3 GLU 58 2HB GLU 58 -12.546 -10.968 11.425 433 HG2 GLU 58 1HG GLU 58 -12.952 -9.553 13.182 434 HG3 GLU 58 2HG GLU 58 -14.581 -9.163 12.633 435 H GLN 59 H GLN 59 -14.012 -7.009 10.093 436 HA GLN 59 HA GLN 59 -11.361 -6.039 10.108 437 HB2 GLN 59 1HB GLN 59 -13.667 -4.933 9.400 438 HB3 GLN 59 2HB GLN 59 -13.601 -4.306 11.042 439 HG2 GLN 59 1HG GLN 59 -11.144 -3.657 10.289 440 HG3 GLN 59 2HG GLN 59 -11.904 -3.682 8.698 441 HE21 GLN 59 1HE2 GLN 59 -11.130 -1.355 9.038 442 HE22 GLN 59 2HE2 GLN 59 -12.305 -0.259 9.674 443 H ARG 60 H ARG 60 -10.002 -6.184 11.761 444 HA ARG 60 HA ARG 60 -11.018 -6.223 14.492 445 HB2 ARG 60 1HB ARG 60 -8.242 -6.671 13.381 446 HB3 ARG 60 2HB ARG 60 -8.663 -6.780 15.085 447 HG2 ARG 60 1HG ARG 60 -10.199 -8.433 13.154 448 HG3 ARG 60 2HG ARG 60 -8.546 -8.912 13.546 449 HD2 ARG 60 1HD ARG 60 -9.139 -8.861 15.943 450 HD3 ARG 60 2HD ARG 60 -10.802 -8.475 15.499 451 HE ARG 60 HE ARG 60 -10.187 -10.782 14.135 452 HH11 ARG 60 2HH1 ARG 60 -10.285 -9.772 17.466 453 HH12 ARG 60 1HH1 ARG 60 -10.679 -11.348 18.068 454 HH21 ARG 60 2HH2 ARG 60 -10.705 -12.862 14.916 455 HH22 ARG 60 1HH2 ARG 60 -10.917 -13.105 16.617 456 H GLU 61 H GLU 61 -8.550 -4.454 12.623 457 HA GLU 61 HA GLU 61 -8.813 -2.244 14.555 458 HB2 GLU 61 1HB GLU 61 -6.436 -2.952 12.826 459 HB3 GLU 61 2HB GLU 61 -6.524 -1.593 13.937 460 HG2 GLU 61 1HG GLU 61 -6.899 -3.263 15.779 461 HG3 GLU 61 2HG GLU 61 -6.503 -4.520 14.608 462 H ARG 62 H ARG 62 -7.899 -0.124 13.395 463 HA ARG 62 HA ARG 62 -9.845 0.654 11.546 464 HB2 ARG 62 1HB ARG 62 -8.790 2.340 12.848 465 HB3 ARG 62 2HB ARG 62 -7.189 1.862 12.299 466 HG2 ARG 62 1HG ARG 62 -7.388 2.956 10.310 467 HG3 ARG 62 2HG ARG 62 -9.143 2.781 10.264 468 HD2 ARG 62 1HD ARG 62 -8.930 5.028 10.706 469 HD3 ARG 62 2HD ARG 62 -9.062 4.369 12.336 470 HE ARG 62 HE ARG 62 -6.409 4.399 11.964 471 HH11 ARG 62 2HH1 ARG 62 -8.856 6.815 11.420 472 HH12 ARG 62 1HH1 ARG 62 -7.793 8.148 11.729 473 HH21 ARG 62 2HH2 ARG 62 -5.000 6.145 12.373 474 HH22 ARG 62 1HH2 ARG 62 -5.600 7.766 12.270 475 H PHE 63 H PHE 63 -6.420 -0.157 11.034 476 HA PHE 63 HA PHE 63 -6.994 -0.397 8.155 477 HB2 PHE 63 1HB PHE 63 -4.395 0.209 9.576 478 HB3 PHE 63 2HB PHE 63 -4.525 -0.100 7.848 479 HD1 PHE 63 2HD PHE 63 -6.205 1.418 6.555 480 HD2 PHE 63 1HD PHE 63 -4.532 2.372 10.351 481 HE1 PHE 63 2HE PHE 63 -6.688 3.799 6.166 482 HE2 PHE 63 1HE PHE 63 -5.013 4.754 9.968 483 HZ PHE 63 HZ PHE 63 -6.091 5.471 7.873 484 H LEU 64 H LEU 64 -7.667 -2.489 9.868 485 HA LEU 64 HA LEU 64 -5.862 -4.565 8.876 486 HB2 LEU 64 1HB LEU 64 -5.332 -3.913 11.283 487 HB3 LEU 64 2HB LEU 64 -6.887 -4.629 11.700 488 HG LEU 64 HG LEU 64 -5.908 -6.734 10.490 489 HD11 LEU 64 1HD1 LEU 64 -3.603 -6.950 10.405 490 HD12 LEU 64 2HD1 LEU 64 -3.332 -5.582 11.483 491 HD13 LEU 64 3HD1 LEU 64 -3.862 -5.305 9.824 492 HD21 LEU 64 1HD2 LEU 64 -6.084 -5.860 13.147 493 HD22 LEU 64 2HD2 LEU 64 -4.492 -6.602 12.985 494 HD23 LEU 64 3HD2 LEU 64 -5.940 -7.519 12.566 495 H LEU 65 H LEU 65 -6.847 -6.513 8.418 496 HA LEU 65 HA LEU 65 -9.641 -6.904 9.123 497 HB2 LEU 65 1HB LEU 65 -8.658 -6.295 6.393 498 HB3 LEU 65 2HB LEU 65 -9.887 -7.548 6.549 499 HG LEU 65 HG LEU 65 -10.345 -4.885 7.820 500 HD11 LEU 65 1HD1 LEU 65 -11.211 -3.951 5.814 501 HD12 LEU 65 2HD1 LEU 65 -10.959 -5.455 4.930 502 HD13 LEU 65 3HD1 LEU 65 -9.574 -4.505 5.466 503 HD21 LEU 65 1HD2 LEU 65 -12.383 -6.485 6.364 504 HD22 LEU 65 2HD2 LEU 65 -12.543 -5.500 7.819 505 HD23 LEU 65 3HD2 LEU 65 -11.792 -7.094 7.910 506 H PHE 66 H PHE 66 -10.032 -8.979 9.557 507 HA PHE 66 HA PHE 66 -7.941 -10.927 9.055 508 HB2 PHE 66 1HB PHE 66 -9.225 -10.659 11.261 509 HB3 PHE 66 2HB PHE 66 -10.564 -11.457 10.441 510 HD1 PHE 66 1HD PHE 66 -9.621 -13.636 9.039 511 HD2 PHE 66 2HD PHE 66 -8.041 -12.029 12.650 512 HE1 PHE 66 1HE PHE 66 -8.650 -15.830 9.586 513 HE2 PHE 66 2HE PHE 66 -7.066 -14.219 13.202 514 HZ PHE 66 HZ PHE 66 -7.369 -16.123 11.669 515 H CYS 67 H CYS 67 -8.004 -11.463 6.910 516 HA CYS 67 HA CYS 67 -10.514 -12.193 5.656 517 HB2 CYS 67 1HB CYS 67 -7.683 -12.225 4.589 518 HB3 CYS 67 2HB CYS 67 -9.127 -12.544 3.636 519 HG CYS 67 HG CYS 67 -9.912 -9.766 4.826 520 H VAL 68 H VAL 68 -11.226 -14.212 5.266 521 HA VAL 68 HA VAL 68 -9.427 -16.484 5.571 522 HB VAL 68 HB VAL 68 -10.376 -16.051 7.838 523 HG11 VAL 68 1HG1 VAL 68 -12.661 -15.395 6.627 524 HG12 VAL 68 2HG1 VAL 68 -13.016 -17.087 6.984 525 HG13 VAL 68 3HG1 VAL 68 -12.599 -15.977 8.291 526 HG21 VAL 68 1HG2 VAL 68 -11.461 -18.625 6.731 527 HG22 VAL 68 2HG2 VAL 68 -9.729 -18.335 6.897 528 HG23 VAL 68 3HG2 VAL 68 -10.767 -18.316 8.323 529 H HIS 69 H HIS 69 -9.828 -17.952 4.051 530 HA HIS 69 HA HIS 69 -12.348 -17.768 2.565 531 HB2 HIS 69 1HB HIS 69 -10.499 -17.582 1.100 532 HB3 HIS 69 2HB HIS 69 -9.642 -18.905 1.885 533 HD1 HIS 69 1HD HIS 69 -9.579 -20.873 0.409 534 HD2 HIS 69 2HD HIS 69 -13.153 -18.789 0.030 535 HE1 HIS 69 1HE HIS 69 -10.932 -22.160 -1.275 536 HE2 HIS 69 2HE HIS 69 -13.055 -20.833 -1.551 537 H GLY 70 H GLY 70 -13.812 -19.376 2.539 538 HA2 GLY 70 1HA GLY 70 -13.047 -21.944 3.779 539 HA3 GLY 70 2HA GLY 70 -14.540 -21.128 4.219 540 H ASP 71 H ASP 71 -12.817 -22.660 1.543 541 HA ASP 71 HA ASP 71 -14.755 -22.631 -0.411 542 HB2 ASP 71 1HB ASP 71 -12.690 -23.517 -1.060 543 HB3 ASP 71 2HB ASP 71 -12.636 -24.638 0.298 544 H GLY 72 H GLY 72 -14.419 -24.902 2.292 545 HA2 GLY 72 1HA GLY 72 -17.258 -25.451 2.196 546 HA3 GLY 72 2HA GLY 72 -16.244 -26.822 1.771 547 H HIS 73 H HIS 73 -14.151 -26.585 3.506 548 HA HIS 73 HA HIS 73 -15.204 -26.302 6.197 549 HB2 HIS 73 1HB HIS 73 -14.609 -28.922 4.917 550 HB3 HIS 73 2HB HIS 73 -14.108 -28.708 6.592 551 HD1 HIS 73 1HD HIS 73 -15.867 -29.019 8.335 552 HD2 HIS 73 2HD HIS 73 -17.478 -28.550 4.535 553 HE1 HIS 73 1HE HIS 73 -18.329 -29.461 8.590 554 HE2 HIS 73 2HE HIS 73 -19.269 -29.255 6.262 555 H ALA 74 H ALA 74 -13.372 -27.060 7.799 556 HA ALA 74 HA ALA 74 -11.275 -25.333 7.671 557 HB1 ALA 74 1HB ALA 74 -11.487 -28.017 8.998 558 HB2 ALA 74 2HB ALA 74 -10.060 -26.996 9.181 559 HB3 ALA 74 3HB ALA 74 -11.635 -26.413 9.718 560 H GLU 75 H GLU 75 -11.316 -28.662 6.441 561 HA GLU 75 HA GLU 75 -8.735 -29.070 5.713 562 HB2 GLU 75 1HB GLU 75 -11.186 -29.703 4.060 563 HB3 GLU 75 2HB GLU 75 -9.592 -30.393 3.790 564 HG2 GLU 75 1HG GLU 75 -9.736 -31.215 6.204 565 HG3 GLU 75 2HG GLU 75 -11.453 -30.831 6.096 566 H ASN 76 H ASN 76 -11.130 -27.223 3.850 567 HA ASN 76 HA ASN 76 -8.945 -26.208 2.163 568 HB2 ASN 76 1HB ASN 76 -11.911 -26.049 1.600 569 HB3 ASN 76 2HB ASN 76 -10.592 -25.709 0.483 570 HD21 ASN 76 1HD2 ASN 76 -12.374 -28.187 2.150 571 HD22 ASN 76 2HD2 ASN 76 -11.819 -29.512 1.190 572 H LEU 77 H LEU 77 -9.291 -25.180 4.763 573 HA LEU 77 HA LEU 77 -10.389 -22.500 4.229 574 HB2 LEU 77 1HB LEU 77 -11.419 -23.852 6.080 575 HB3 LEU 77 2HB LEU 77 -9.875 -23.745 6.922 576 HG LEU 77 HG LEU 77 -10.307 -21.142 6.556 577 HD11 LEU 77 1HD1 LEU 77 -13.010 -21.392 7.272 578 HD12 LEU 77 2HD1 LEU 77 -12.789 -22.358 5.813 579 HD13 LEU 77 3HD1 LEU 77 -12.338 -20.654 5.818 580 HD21 LEU 77 1HD2 LEU 77 -10.024 -21.540 8.742 581 HD22 LEU 77 2HD2 LEU 77 -10.909 -23.065 8.680 582 HD23 LEU 77 3HD2 LEU 77 -11.786 -21.539 8.811 583 H VAL 78 H VAL 78 -9.094 -20.757 4.385 584 HA VAL 78 HA VAL 78 -6.397 -21.118 5.504 585 HB VAL 78 HB VAL 78 -7.054 -19.730 2.902 586 HG11 VAL 78 1HG1 VAL 78 -5.255 -18.721 4.464 587 HG12 VAL 78 2HG1 VAL 78 -4.291 -20.120 3.985 588 HG13 VAL 78 3HG1 VAL 78 -4.863 -18.982 2.764 589 HG21 VAL 78 1HG2 VAL 78 -6.966 -21.969 2.352 590 HG22 VAL 78 2HG2 VAL 78 -5.284 -21.485 2.135 591 HG23 VAL 78 3HG2 VAL 78 -5.774 -22.339 3.598 592 H GLN 79 H GLN 79 -6.167 -19.757 7.142 593 HA GLN 79 HA GLN 79 -7.707 -17.275 7.192 594 HB2 GLN 79 1HB GLN 79 -5.986 -18.459 9.374 595 HB3 GLN 79 2HB GLN 79 -7.159 -17.160 9.540 596 HG2 GLN 79 1HG GLN 79 -8.436 -18.849 10.311 597 HG3 GLN 79 2HG GLN 79 -8.781 -19.040 8.593 598 HE21 GLN 79 1HE2 GLN 79 -8.000 -20.804 7.504 599 HE22 GLN 79 2HE2 GLN 79 -7.255 -22.148 8.293 600 H TRP 80 H TRP 80 -6.833 -15.336 6.849 601 HA TRP 80 HA TRP 80 -4.021 -14.849 7.325 602 HB2 TRP 80 1HB TRP 80 -3.361 -14.357 5.135 603 HB3 TRP 80 2HB TRP 80 -4.324 -15.820 4.945 604 HD1 TRP 80 HD TRP 80 -4.280 -12.128 4.052 605 HE1 TRP 80 1HE TRP 80 -6.181 -11.645 2.385 606 HE3 TRP 80 3HE TRP 80 -6.711 -16.620 4.271 607 HZ2 TRP 80 2HZ TRP 80 -8.416 -12.990 1.306 608 HZ3 TRP 80 3HZ TRP 80 -8.723 -16.940 2.891 609 HH2 TRP 80 HH TRP 80 -9.556 -15.162 1.440 610 H GLU 81 H GLU 81 -3.542 -12.689 7.616 611 HA GLU 81 HA GLU 81 -5.874 -10.912 7.732 612 HB2 GLU 81 1HB GLU 81 -3.178 -10.715 9.086 613 HB3 GLU 81 2HB GLU 81 -4.468 -9.532 9.247 614 HG2 GLU 81 1HG GLU 81 -5.838 -11.678 9.976 615 HG3 GLU 81 2HG GLU 81 -4.225 -12.247 10.403 616 H MET 82 H MET 82 -5.993 -9.066 6.577 617 HA MET 82 HA MET 82 -3.730 -8.462 4.794 618 HB2 MET 82 1HB MET 82 -6.681 -8.406 4.417 619 HB3 MET 82 2HB MET 82 -5.733 -7.188 3.575 620 HG2 MET 82 1HG MET 82 -4.353 -9.029 2.618 621 HG3 MET 82 2HG MET 82 -5.482 -10.174 3.339 622 HE1 MET 82 1HE MET 82 -5.465 -6.856 1.532 623 HE2 MET 82 2HE MET 82 -4.989 -7.766 0.098 624 HE3 MET 82 3HE MET 82 -6.593 -7.037 0.188 625 H GLU 83 H GLU 83 -2.591 -6.927 5.857 626 HA GLU 83 HA GLU 83 -4.033 -4.654 7.016 627 HB2 GLU 83 1HB GLU 83 -2.360 -5.817 8.424 628 HB3 GLU 83 2HB GLU 83 -1.113 -5.400 7.257 629 HG2 GLU 83 1HG GLU 83 -1.176 -3.147 7.800 630 HG3 GLU 83 2HG GLU 83 -2.772 -3.269 8.538 631 H VAL 84 H VAL 84 -3.653 -2.544 6.392 632 HA VAL 84 HA VAL 84 -2.535 -2.237 3.715 633 HB VAL 84 HB VAL 84 -4.041 -0.232 5.402 634 HG11 VAL 84 1HG1 VAL 84 -2.465 0.164 3.137 635 HG12 VAL 84 2HG1 VAL 84 -4.128 0.169 2.547 636 HG13 VAL 84 3HG1 VAL 84 -3.640 1.284 3.825 637 HG21 VAL 84 1HG2 VAL 84 -5.657 -1.810 4.972 638 HG22 VAL 84 2HG2 VAL 84 -5.804 -0.787 3.543 639 HG23 VAL 84 3HG2 VAL 84 -4.920 -2.309 3.450 640 H CYS 85 H CYS 85 -0.331 -2.199 3.974 641 HA CYS 85 HA CYS 85 1.005 -0.730 6.000 642 HB2 CYS 85 1HB CYS 85 1.823 -2.696 4.439 643 HB3 CYS 85 2HB CYS 85 2.340 -1.372 3.402 644 HG CYS 85 HG CYS 85 3.580 -2.373 6.376 645 H LYS 86 H LYS 86 2.833 0.869 5.151 646 HA LYS 86 HA LYS 86 1.873 2.701 3.122 647 HB2 LYS 86 1HB LYS 86 1.868 4.649 4.638 648 HB3 LYS 86 2HB LYS 86 0.629 3.474 5.060 649 HG2 LYS 86 1HG LYS 86 1.720 2.816 6.987 650 HG3 LYS 86 2HG LYS 86 3.287 3.397 6.419 651 HD2 LYS 86 1HD LYS 86 2.745 5.021 7.957 652 HD3 LYS 86 2HD LYS 86 2.100 5.732 6.476 653 HE2 LYS 86 1HE LYS 86 0.289 6.002 7.833 654 HE3 LYS 86 2HE LYS 86 -0.061 4.390 7.212 655 HZ1 LYS 86 1HZ LYS 86 0.867 5.194 9.875 656 HZ2 LYS 86 2HZ LYS 86 1.323 3.675 9.289 657 HZ3 LYS 86 3HZ LYS 86 -0.316 4.064 9.443 658 H LEU 87 H LEU 87 3.520 3.711 2.124 659 HA LEU 87 HA LEU 87 6.213 3.120 3.018 660 HB2 LEU 87 1HB LEU 87 5.156 4.497 0.556 661 HB3 LEU 87 2HB LEU 87 6.865 4.205 0.870 662 HG LEU 87 HG LEU 87 5.919 1.693 1.085 663 HD11 LEU 87 1HD1 LEU 87 4.224 2.938 -1.069 664 HD12 LEU 87 2HD1 LEU 87 3.621 2.489 0.526 665 HD13 LEU 87 3HD1 LEU 87 4.250 1.249 -0.560 666 HD21 LEU 87 1HD2 LEU 87 7.754 2.057 -0.283 667 HD22 LEU 87 2HD2 LEU 87 6.917 3.265 -1.258 668 HD23 LEU 87 3HD2 LEU 87 6.511 1.557 -1.430 669 HA PRO 88 HA PRO 88 7.160 7.005 4.827 670 HB2 PRO 88 1HB PRO 88 9.768 7.295 4.134 671 HB3 PRO 88 2HB PRO 88 9.220 6.130 5.345 672 HG2 PRO 88 1HG PRO 88 9.902 5.688 2.464 673 HG3 PRO 88 2HG PRO 88 10.321 4.702 3.877 674 HD2 PRO 88 1HD PRO 88 8.288 4.064 2.205 675 HD3 PRO 88 2HD PRO 88 8.251 3.689 3.940 676 H ARG 89 H ARG 89 6.879 6.619 1.547 677 HA ARG 89 HA ARG 89 7.291 9.498 1.080 678 HB2 ARG 89 1HB ARG 89 7.917 8.963 -1.244 679 HB3 ARG 89 2HB ARG 89 9.033 8.264 -0.079 680 HG2 ARG 89 1HG ARG 89 7.547 6.148 -0.317 681 HG3 ARG 89 2HG ARG 89 7.024 6.912 -1.820 682 HD2 ARG 89 1HD ARG 89 9.940 6.698 -1.223 683 HD3 ARG 89 2HD ARG 89 9.070 5.273 -1.790 684 HE ARG 89 HE ARG 89 8.352 7.084 -3.611 685 HH11 ARG 89 2HH1 ARG 89 11.469 6.294 -2.275 686 HH12 ARG 89 1HH1 ARG 89 12.338 6.726 -3.711 687 HH21 ARG 89 2HH2 ARG 89 9.486 7.655 -5.507 688 HH22 ARG 89 1HH2 ARG 89 11.209 7.500 -5.548 689 H LEU 90 H LEU 90 5.176 6.867 1.038 690 HA LEU 90 HA LEU 90 3.049 6.541 0.291 691 HB2 LEU 90 1HB LEU 90 3.226 9.481 0.757 692 HB3 LEU 90 2HB LEU 90 1.770 8.816 0.020 693 HG LEU 90 HG LEU 90 1.945 7.204 2.151 694 HD11 LEU 90 1HD1 LEU 90 4.032 8.577 2.813 695 HD12 LEU 90 2HD1 LEU 90 2.832 8.194 4.047 696 HD13 LEU 90 3HD1 LEU 90 2.866 9.800 3.319 697 HD21 LEU 90 1HD2 LEU 90 0.804 9.925 2.597 698 HD22 LEU 90 2HD2 LEU 90 0.124 8.342 2.976 699 HD23 LEU 90 3HD2 LEU 90 0.155 8.912 1.306 700 H SER 91 H SER 91 4.707 6.176 -1.742 701 HA SER 91 HA SER 91 3.800 7.811 -3.992 702 HB2 SER 91 1HB SER 91 6.123 6.017 -3.494 703 HB3 SER 91 2HB SER 91 5.538 6.140 -5.152 704 HG SER 91 HG SER 91 6.823 7.832 -5.108 705 H LEU 92 H LEU 92 3.082 4.895 -2.456 706 HA LEU 92 HA LEU 92 1.013 4.219 -4.218 707 HB2 LEU 92 1HB LEU 92 1.826 2.280 -5.324 708 HB3 LEU 92 2HB LEU 92 2.950 3.597 -5.656 709 HG LEU 92 HG LEU 92 4.207 2.498 -3.572 710 HD11 LEU 92 1HD1 LEU 92 3.883 0.263 -3.264 711 HD12 LEU 92 2HD1 LEU 92 3.257 0.014 -4.893 712 HD13 LEU 92 3HD1 LEU 92 2.233 0.746 -3.658 713 HD21 LEU 92 1HD2 LEU 92 4.647 1.014 -6.078 714 HD22 LEU 92 2HD2 LEU 92 5.777 1.940 -5.090 715 HD23 LEU 92 3HD2 LEU 92 4.696 2.772 -6.208 716 H ASN 93 H ASN 93 -0.396 3.417 -2.821 717 HA ASN 93 HA ASN 93 0.219 2.420 -0.289 718 HB2 ASN 93 1HB ASN 93 -1.974 3.047 -0.346 719 HB3 ASN 93 2HB ASN 93 -2.197 2.504 -2.006 720 HD21 ASN 93 1HD2 ASN 93 -2.161 0.098 -2.294 721 HD22 ASN 93 2HD2 ASN 93 -2.976 -0.846 -1.099 722 H GLY 94 H GLY 94 0.857 0.492 0.447 723 HA2 GLY 94 1HA GLY 94 1.008 -1.720 -1.490 724 HA3 GLY 94 2HA GLY 94 2.029 -1.541 -0.071 725 H VAL 95 H VAL 95 0.873 -3.942 -0.503 726 HA VAL 95 HA VAL 95 -0.947 -4.132 1.768 727 HB VAL 95 HB VAL 95 -1.617 -5.451 -0.864 728 HG11 VAL 95 1HG1 VAL 95 -2.421 -6.755 0.953 729 HG12 VAL 95 2HG1 VAL 95 -3.017 -5.326 1.799 730 HG13 VAL 95 3HG1 VAL 95 -3.799 -5.862 0.311 731 HG21 VAL 95 1HG2 VAL 95 -2.650 -2.932 0.404 732 HG22 VAL 95 2HG2 VAL 95 -2.046 -3.172 -1.236 733 HG23 VAL 95 3HG2 VAL 95 -3.603 -3.850 -0.762 734 H ARG 96 H ARG 96 0.178 -5.435 3.066 735 HA ARG 96 HA ARG 96 1.806 -7.577 1.976 736 HB2 ARG 96 1HB ARG 96 2.593 -6.118 3.853 737 HB3 ARG 96 2HB ARG 96 1.348 -6.834 4.868 738 HG2 ARG 96 1HG ARG 96 2.373 -9.009 4.661 739 HG3 ARG 96 2HG ARG 96 3.571 -8.366 3.536 740 HD2 ARG 96 1HD ARG 96 4.533 -6.993 5.242 741 HD3 ARG 96 2HD ARG 96 3.229 -7.383 6.363 742 HE ARG 96 HE ARG 96 4.775 -9.644 5.434 743 HH11 ARG 96 2HH1 ARG 96 4.375 -7.194 7.874 744 HH12 ARG 96 1HH1 ARG 96 5.258 -8.068 9.082 745 HH21 ARG 96 2HH2 ARG 96 5.938 -10.805 7.015 746 HH22 ARG 96 1HH2 ARG 96 6.147 -10.122 8.592 747 H PHE 97 H PHE 97 1.567 -9.776 2.511 748 HA PHE 97 HA PHE 97 -1.100 -10.521 3.516 749 HB2 PHE 97 1HB PHE 97 0.393 -11.474 1.105 750 HB3 PHE 97 2HB PHE 97 -0.679 -12.592 1.942 751 HD1 PHE 97 1HD PHE 97 -0.720 -9.074 0.693 752 HD2 PHE 97 2HD PHE 97 -2.829 -12.740 1.172 753 HE1 PHE 97 1HE PHE 97 -2.643 -8.121 -0.511 754 HE2 PHE 97 2HE PHE 97 -4.755 -11.793 -0.032 755 HZ PHE 97 HZ PHE 97 -4.663 -9.482 -0.876 756 H LYS 98 H LYS 98 -0.923 -11.541 5.389 757 HA LYS 98 HA LYS 98 1.437 -13.243 5.854 758 HB2 LYS 98 1HB LYS 98 1.422 -11.425 7.416 759 HB3 LYS 98 2HB LYS 98 -0.278 -11.683 7.788 760 HG2 LYS 98 1HG LYS 98 0.259 -13.812 8.837 761 HG3 LYS 98 2HG LYS 98 1.963 -13.588 8.436 762 HD2 LYS 98 1HD LYS 98 1.888 -12.861 10.628 763 HD3 LYS 98 2HD LYS 98 1.695 -11.349 9.738 764 HE2 LYS 98 1HE LYS 98 -0.762 -12.856 10.442 765 HE3 LYS 98 2HE LYS 98 0.094 -12.039 11.748 766 HZ1 LYS 98 1HZ LYS 98 -1.734 -10.818 10.350 767 HZ2 LYS 98 2HZ LYS 98 -0.445 -10.537 9.292 768 HZ3 LYS 98 3HZ LYS 98 -0.360 -9.993 10.892 769 H ARG 99 H ARG 99 1.162 -15.339 6.403 770 HA ARG 99 HA ARG 99 -1.561 -16.387 6.290 771 HB2 ARG 99 1HB ARG 99 0.244 -17.359 4.860 772 HB3 ARG 99 2HB ARG 99 1.054 -17.901 6.323 773 HG2 ARG 99 1HG ARG 99 -0.519 -19.522 6.759 774 HG3 ARG 99 2HG ARG 99 -1.775 -18.700 5.831 775 HD2 ARG 99 1HD ARG 99 -1.241 -20.449 4.431 776 HD3 ARG 99 2HD ARG 99 -0.197 -19.170 3.811 777 HE ARG 99 HE ARG 99 1.623 -20.385 4.475 778 HH11 ARG 99 2HH1 ARG 99 -1.215 -21.628 6.063 779 HH12 ARG 99 1HH1 ARG 99 -0.397 -22.997 6.739 780 HH21 ARG 99 2HH2 ARG 99 2.711 -22.185 5.359 781 HH22 ARG 99 1HH2 ARG 99 1.836 -23.313 6.338 782 H ILE 100 H ILE 100 -2.616 -17.171 8.003 783 HA ILE 100 HA ILE 100 -1.244 -17.159 10.584 784 HB ILE 100 HB ILE 100 -4.174 -17.270 9.873 785 HG12 ILE 100 1HG1 ILE 100 -2.431 -15.178 11.190 786 HG13 ILE 100 2HG1 ILE 100 -3.208 -15.068 9.614 787 HG21 ILE 100 1HG2 ILE 100 -4.730 -17.396 12.154 788 HG22 ILE 100 2HG2 ILE 100 -3.497 -18.633 11.909 789 HG23 ILE 100 3HG2 ILE 100 -3.068 -17.096 12.661 790 HD11 ILE 100 1HD1 ILE 100 -4.841 -15.430 12.088 791 HD12 ILE 100 2HD1 ILE 100 -4.251 -13.836 11.614 792 HD13 ILE 100 3HD1 ILE 100 -5.305 -14.744 10.531 793 H SER 101 H SER 101 -3.604 -19.244 8.900 794 HA SER 101 HA SER 101 -2.123 -21.605 9.681 795 HB2 SER 101 1HB SER 101 -4.821 -20.932 10.828 796 HB3 SER 101 2HB SER 101 -4.314 -22.610 10.635 797 HG SER 101 HG SER 101 -2.292 -21.470 11.763 798 H GLY 102 H GLY 102 -2.763 -23.496 8.548 799 HA2 GLY 102 1HA GLY 102 -4.557 -24.443 7.056 800 HA3 GLY 102 2HA GLY 102 -4.461 -22.910 6.202 801 H THR 103 H THR 103 -3.811 -23.680 4.238 802 HA THR 103 HA THR 103 -1.133 -24.908 4.168 803 HB THR 103 HB THR 103 -1.871 -26.051 2.038 804 HG1 THR 103 1HG THR 103 -3.879 -24.614 2.042 805 HG21 THR 103 1HG2 THR 103 -3.487 -26.939 4.418 806 HG22 THR 103 2HG2 THR 103 -1.733 -27.113 4.351 807 HG23 THR 103 3HG2 THR 103 -2.747 -27.932 3.163 808 H SER 104 H SER 104 0.323 -23.905 2.924 809 HA SER 104 HA SER 104 -0.011 -21.372 1.912 810 HB2 SER 104 1HB SER 104 2.207 -22.186 2.230 811 HB3 SER 104 2HB SER 104 1.944 -23.537 1.128 812 HG SER 104 HG SER 104 1.703 -21.940 -0.552 813 H ILE 105 H ILE 105 -0.388 -24.456 0.224 814 HA ILE 105 HA ILE 105 -0.618 -23.744 -2.377 815 HB ILE 105 HB ILE 105 -2.453 -25.626 -0.890 816 HG12 ILE 105 1HG1 ILE 105 -0.059 -26.191 -0.747 817 HG13 ILE 105 2HG1 ILE 105 -0.945 -27.370 -1.707 818 HG21 ILE 105 1HG2 ILE 105 -1.931 -25.445 -3.854 819 HG22 ILE 105 2HG2 ILE 105 -2.969 -26.615 -3.040 820 HG23 ILE 105 3HG2 ILE 105 -3.402 -24.905 -3.044 821 HD11 ILE 105 1HD1 ILE 105 0.751 -25.134 -2.792 822 HD12 ILE 105 2HD1 ILE 105 1.202 -26.838 -2.708 823 HD13 ILE 105 3HD1 ILE 105 -0.126 -26.327 -3.749 824 H ALA 106 H ALA 106 -3.493 -23.904 -0.267 825 HA ALA 106 HA ALA 106 -5.139 -22.446 -2.039 826 HB1 ALA 106 1HB ALA 106 -6.346 -22.125 0.386 827 HB2 ALA 106 2HB ALA 106 -6.538 -23.529 -0.665 828 HB3 ALA 106 3HB ALA 106 -5.368 -23.568 0.653 829 H PHE 107 H PHE 107 -2.860 -21.479 0.372 830 HA PHE 107 HA PHE 107 -3.856 -18.900 0.933 831 HB2 PHE 107 1HB PHE 107 -2.134 -20.067 2.295 832 HB3 PHE 107 2HB PHE 107 -0.978 -19.832 0.987 833 HD1 PHE 107 1HD PHE 107 -2.957 -18.152 3.587 834 HD2 PHE 107 2HD PHE 107 0.065 -17.720 0.621 835 HE1 PHE 107 1HE PHE 107 -2.360 -15.954 4.520 836 HE2 PHE 107 2HE PHE 107 0.668 -15.523 1.549 837 HZ PHE 107 HZ PHE 107 -0.545 -14.638 3.502 838 H LYS 108 H LYS 108 -1.389 -20.014 -1.374 839 HA LYS 108 HA LYS 108 -1.052 -17.401 -2.515 840 HB2 LYS 108 1HB LYS 108 -0.029 -20.145 -3.174 841 HB3 LYS 108 2HB LYS 108 0.193 -18.820 -4.309 842 HG2 LYS 108 1HG LYS 108 1.686 -17.735 -2.967 843 HG3 LYS 108 2HG LYS 108 1.001 -18.398 -1.481 844 HD2 LYS 108 1HD LYS 108 3.110 -19.436 -1.756 845 HD3 LYS 108 2HD LYS 108 1.907 -20.642 -2.218 846 HE2 LYS 108 1HE LYS 108 2.455 -20.533 -4.442 847 HE3 LYS 108 2HE LYS 108 3.031 -18.871 -4.330 848 HZ1 LYS 108 1HZ LYS 108 4.432 -21.301 -3.356 849 HZ2 LYS 108 2HZ LYS 108 4.968 -19.719 -3.089 850 HZ3 LYS 108 3HZ LYS 108 4.883 -20.329 -4.665 851 H ASN 109 H ASN 109 -2.524 -20.445 -3.627 852 HA ASN 109 HA ASN 109 -3.357 -19.749 -6.131 853 HB2 ASN 109 1HB ASN 109 -4.668 -21.448 -4.021 854 HB3 ASN 109 2HB ASN 109 -5.406 -21.237 -5.606 855 HD21 ASN 109 1HD2 ASN 109 -3.477 -23.185 -3.834 856 HD22 ASN 109 2HD2 ASN 109 -2.598 -23.966 -5.101 857 H ILE 110 H ILE 110 -5.083 -19.092 -3.093 858 HA ILE 110 HA ILE 110 -7.194 -17.655 -4.384 859 HB ILE 110 HB ILE 110 -7.403 -18.834 -2.168 860 HG12 ILE 110 1HG1 ILE 110 -8.828 -17.024 -1.161 861 HG13 ILE 110 2HG1 ILE 110 -8.190 -15.922 -2.377 862 HG21 ILE 110 1HG2 ILE 110 -6.526 -16.523 -0.639 863 HG22 ILE 110 2HG2 ILE 110 -6.218 -18.238 -0.375 864 HG23 ILE 110 3HG2 ILE 110 -5.203 -17.322 -1.488 865 HD11 ILE 110 1HD1 ILE 110 -10.470 -17.078 -2.759 866 HD12 ILE 110 2HD1 ILE 110 -9.323 -16.959 -4.095 867 HD13 ILE 110 3HD1 ILE 110 -9.491 -18.474 -3.209 868 H ALA 111 H ALA 111 -4.116 -16.826 -2.964 869 HA ALA 111 HA ALA 111 -4.498 -14.072 -2.594 870 HB1 ALA 111 1HB ALA 111 -2.087 -15.789 -3.026 871 HB2 ALA 111 2HB ALA 111 -1.934 -14.032 -2.972 872 HB3 ALA 111 3HB ALA 111 -2.588 -14.903 -1.585 873 H SER 112 H SER 112 -3.503 -15.932 -5.427 874 HA SER 112 HA SER 112 -2.739 -13.823 -7.085 875 HB2 SER 112 1HB SER 112 -2.234 -16.035 -7.800 876 HB3 SER 112 2HB SER 112 -3.924 -16.531 -7.701 877 HG SER 112 HG SER 112 -2.806 -14.680 -9.541 878 H LYS 113 H LYS 113 -5.922 -15.176 -6.411 879 HA LYS 113 HA LYS 113 -7.312 -13.686 -8.391 880 HB2 LYS 113 1HB LYS 113 -8.065 -15.332 -6.027 881 HB3 LYS 113 2HB LYS 113 -9.269 -14.215 -6.656 882 HG2 LYS 113 1HG LYS 113 -9.748 -16.174 -7.779 883 HG3 LYS 113 2HG LYS 113 -8.748 -15.298 -8.940 884 HD2 LYS 113 1HD LYS 113 -7.802 -17.403 -8.999 885 HD3 LYS 113 2HD LYS 113 -6.787 -16.589 -7.806 886 HE2 LYS 113 1HE LYS 113 -7.313 -18.703 -6.890 887 HE3 LYS 113 2HE LYS 113 -8.324 -17.536 -6.040 888 HZ1 LYS 113 1HZ LYS 113 -10.012 -18.168 -7.907 889 HZ2 LYS 113 2HZ LYS 113 -9.841 -19.148 -6.539 890 HZ3 LYS 113 3HZ LYS 113 -9.092 -19.586 -7.991 891 H ILE 114 H ILE 114 -7.189 -13.298 -4.844 892 HA ILE 114 HA ILE 114 -8.599 -10.976 -4.561 893 HB ILE 114 HB ILE 114 -6.057 -11.658 -3.077 894 HG12 ILE 114 1HG1 ILE 114 -7.805 -13.444 -3.056 895 HG13 ILE 114 2HG1 ILE 114 -7.469 -12.770 -1.465 896 HG21 ILE 114 1HG2 ILE 114 -7.493 -10.359 -1.268 897 HG22 ILE 114 2HG2 ILE 114 -6.419 -9.519 -2.386 898 HG23 ILE 114 3HG2 ILE 114 -8.151 -9.588 -2.711 899 HD11 ILE 114 1HD1 ILE 114 -9.738 -12.816 -1.406 900 HD12 ILE 114 2HD1 ILE 114 -9.496 -11.207 -2.086 901 HD13 ILE 114 3HD1 ILE 114 -9.902 -12.559 -3.143 902 H ALA 115 H ALA 115 -5.072 -11.162 -5.073 903 HA ALA 115 HA ALA 115 -4.531 -8.456 -5.235 904 HB1 ALA 115 1HB ALA 115 -2.679 -9.293 -6.895 905 HB2 ALA 115 2HB ALA 115 -2.627 -9.732 -5.187 906 HB3 ALA 115 3HB ALA 115 -3.236 -10.884 -6.375 907 H ASN 116 H ASN 116 -4.983 -10.620 -8.042 908 HA ASN 116 HA ASN 116 -4.990 -8.809 -10.066 909 HB2 ASN 116 1HB ASN 116 -6.517 -11.349 -9.646 910 HB3 ASN 116 2HB ASN 116 -6.858 -10.372 -11.071 911 HD21 ASN 116 1HD2 ASN 116 -5.282 -12.982 -10.201 912 HD22 ASN 116 2HD2 ASN 116 -3.900 -12.910 -11.236 913 H GLU 117 H GLU 117 -7.770 -9.641 -8.020 914 HA GLU 117 HA GLU 117 -9.623 -7.945 -9.296 915 HB2 GLU 117 1HB GLU 117 -9.562 -8.962 -6.450 916 HB3 GLU 117 2HB GLU 117 -10.942 -8.173 -7.201 917 HG2 GLU 117 1HG GLU 117 -9.778 -10.866 -7.762 918 HG3 GLU 117 2HG GLU 117 -11.440 -10.427 -7.371 919 H LEU 118 H LEU 118 -7.340 -7.420 -6.671 920 HA LEU 118 HA LEU 118 -8.296 -4.723 -6.204 921 HB2 LEU 118 1HB LEU 118 -6.195 -6.468 -4.991 922 HB3 LEU 118 2HB LEU 118 -6.173 -4.731 -4.696 923 HG LEU 118 HG LEU 118 -8.693 -6.226 -4.162 924 HD11 LEU 118 1HD1 LEU 118 -7.384 -7.706 -2.990 925 HD12 LEU 118 2HD1 LEU 118 -7.683 -6.471 -1.767 926 HD13 LEU 118 3HD1 LEU 118 -6.147 -6.500 -2.633 927 HD21 LEU 118 1HD2 LEU 118 -9.240 -4.276 -3.259 928 HD22 LEU 118 2HD2 LEU 118 -7.667 -3.627 -3.722 929 HD23 LEU 118 3HD2 LEU 118 -7.877 -4.388 -2.145 930 H LYS 119 H LYS 119 -7.167 -5.491 -8.828 931 HA LYS 119 HA LYS 119 -5.612 -4.807 -10.370 932 HB2 LYS 119 1HB LYS 119 -6.121 -2.240 -8.856 933 HB3 LYS 119 2HB LYS 119 -5.366 -2.334 -10.441 934 HG2 LYS 119 1HG LYS 119 -8.133 -3.353 -9.852 935 HG3 LYS 119 2HG LYS 119 -7.788 -1.730 -10.455 936 HD2 LYS 119 1HD LYS 119 -6.716 -2.699 -12.434 937 HD3 LYS 119 2HD LYS 119 -7.063 -4.320 -11.828 938 HE2 LYS 119 1HE LYS 119 -9.300 -2.373 -12.146 939 HE3 LYS 119 2HE LYS 119 -8.644 -3.166 -13.578 940 HZ1 LYS 119 1HZ LYS 119 -9.982 -4.390 -11.248 941 HZ2 LYS 119 2HZ LYS 119 -8.982 -5.306 -12.257 942 HZ3 LYS 119 3HZ LYS 119 -10.358 -4.552 -12.889 943 H LEU 120 H LEU 120 -4.363 -6.019 -8.170 944 HA LEU 120 HA LEU 120 -2.044 -4.342 -7.573 945 HB2 LEU 120 1HB LEU 120 -2.781 -7.079 -6.547 946 HB3 LEU 120 2HB LEU 120 -1.429 -6.097 -5.989 947 HG LEU 120 HG LEU 120 -4.332 -5.332 -5.697 948 HD11 LEU 120 1HD1 LEU 120 -4.446 -6.442 -3.766 949 HD12 LEU 120 2HD1 LEU 120 -2.825 -5.944 -3.282 950 HD13 LEU 120 3HD1 LEU 120 -3.039 -7.339 -4.340 951 HD21 LEU 120 1HD2 LEU 120 -3.642 -3.379 -4.863 952 HD22 LEU 120 2HD2 LEU 120 -2.098 -3.737 -5.637 953 HD23 LEU 120 3HD2 LEU 120 -2.344 -4.132 -3.935 954 H SER 121 H SER 121 0.126 -5.335 -7.721 955 HA SER 121 HA SER 121 0.941 -5.950 -10.205 956 HB2 SER 121 1HB SER 121 2.022 -6.791 -7.538 957 HB3 SER 121 2HB SER 121 2.790 -7.379 -9.013 958 HG SER 121 HG SER 121 3.703 -5.507 -9.185 959 H GLY 122 H GLY 122 0.422 -8.521 -7.778 960 HA2 GLY 122 1HA GLY 122 -0.568 -10.601 -8.047 961 HA3 GLY 122 2HA GLY 122 -0.920 -10.182 -9.717 962 HA PRO 123 HA PRO 123 3.645 -11.783 -9.687 963 HB2 PRO 123 1HB PRO 123 4.537 -12.872 -7.366 964 HB3 PRO 123 2HB PRO 123 4.722 -11.159 -7.756 965 HG2 PRO 123 1HG PRO 123 2.678 -12.497 -6.027 966 HG3 PRO 123 2HG PRO 123 3.573 -10.993 -5.741 967 HD2 PRO 123 1HD PRO 123 1.018 -11.020 -6.635 968 HD3 PRO 123 2HD PRO 123 2.177 -9.757 -7.096 969 H SER 124 H SER 124 3.684 -13.643 -10.768 970 HA SER 124 HA SER 124 3.122 -16.155 -9.530 971 HB2 SER 124 1HB SER 124 1.261 -16.773 -11.111 972 HB3 SER 124 2HB SER 124 0.819 -15.570 -9.899 973 HG SER 124 HG SER 124 0.829 -15.365 -12.597 974 H SER 125 H SER 125 4.088 -17.806 -10.604 975 HA SER 125 HA SER 125 4.806 -17.546 -13.398 976 HB2 SER 125 1HB SER 125 6.795 -17.325 -11.179 977 HB3 SER 125 2HB SER 125 7.264 -18.185 -12.646 978 HG SER 125 HG SER 125 7.437 -16.340 -13.623 979 H GLY 126 H GLY 126 4.685 -19.473 -14.359 980 HA2 GLY 126 1HA GLY 126 4.652 -21.860 -12.626 981 HA3 GLY 126 2HA GLY 126 3.805 -21.719 -14.159 Start of MODEL 14 1 H1 MET 1 H MET 1 13.988 -1.621 -70.174 2 HA MET 1 HA MET 1 11.571 -2.672 -69.639 3 HB2 MET 1 1HB MET 1 11.412 -3.393 -71.952 4 HB3 MET 1 2HB MET 1 12.274 -1.862 -71.862 5 HG2 MET 1 1HG MET 1 13.627 -2.952 -73.310 6 HG3 MET 1 2HG MET 1 14.374 -3.460 -71.797 7 HE1 MET 1 1HE MET 1 13.243 -4.140 -74.951 8 HE2 MET 1 2HE MET 1 14.290 -5.558 -74.934 9 HE3 MET 1 3HE MET 1 12.542 -5.754 -75.074 10 H LYS 2 H LYS 2 14.535 -4.520 -70.106 11 HA LYS 2 HA LYS 2 13.430 -7.088 -70.184 12 HB2 LYS 2 1HB LYS 2 16.103 -5.976 -69.440 13 HB3 LYS 2 2HB LYS 2 15.762 -7.666 -69.090 14 HG2 LYS 2 1HG LYS 2 15.202 -8.000 -71.479 15 HG3 LYS 2 2HG LYS 2 15.689 -6.331 -71.788 16 HD2 LYS 2 1HD LYS 2 17.622 -7.479 -72.305 17 HD3 LYS 2 2HD LYS 2 17.904 -7.061 -70.613 18 HE2 LYS 2 1HE LYS 2 16.542 -9.634 -71.217 19 HE3 LYS 2 2HE LYS 2 18.273 -9.518 -71.532 20 HZ1 LYS 2 1HZ LYS 2 17.886 -8.417 -69.035 21 HZ2 LYS 2 2HZ LYS 2 18.580 -9.918 -69.388 22 HZ3 LYS 2 3HZ LYS 2 16.926 -9.810 -69.055 23 H ASP 3 H ASP 3 13.179 -8.684 -68.581 24 HA ASP 3 HA ASP 3 13.189 -7.761 -65.797 25 HB2 ASP 3 1HB ASP 3 10.983 -8.789 -65.411 26 HB3 ASP 3 2HB ASP 3 10.894 -7.482 -66.589 27 H HIS 4 H HIS 4 12.850 -9.636 -64.263 28 HA HIS 4 HA HIS 4 13.344 -12.289 -65.142 29 HB2 HIS 4 1HB HIS 4 15.621 -12.543 -64.202 30 HB3 HIS 4 2HB HIS 4 15.583 -11.452 -65.584 31 HD1 HIS 4 1HD HIS 4 16.916 -9.410 -65.240 32 HD2 HIS 4 2HD HIS 4 15.443 -10.901 -61.653 33 HE1 HIS 4 1HE HIS 4 17.816 -7.882 -63.457 34 HE2 HIS 4 2HE HIS 4 16.981 -8.854 -61.288 35 H LEU 5 H LEU 5 13.966 -13.718 -63.203 36 HA LEU 5 HA LEU 5 12.759 -12.621 -60.750 37 HB2 LEU 5 1HB LEU 5 11.961 -15.022 -60.381 38 HB3 LEU 5 2HB LEU 5 11.096 -14.029 -61.551 39 HG LEU 5 HG LEU 5 11.502 -16.432 -62.206 40 HD11 LEU 5 1HD1 LEU 5 12.843 -14.962 -64.328 41 HD12 LEU 5 2HD1 LEU 5 11.422 -14.127 -63.703 42 HD13 LEU 5 3HD1 LEU 5 11.276 -15.771 -64.323 43 HD21 LEU 5 1HD2 LEU 5 13.911 -16.309 -61.303 44 HD22 LEU 5 2HD2 LEU 5 14.294 -15.555 -62.851 45 HD23 LEU 5 3HD2 LEU 5 13.619 -17.185 -62.806 46 H ILE 6 H ILE 6 13.483 -13.546 -58.764 47 HA ILE 6 HA ILE 6 16.068 -14.948 -58.967 48 HB ILE 6 HB ILE 6 15.319 -12.766 -57.019 49 HG12 ILE 6 1HG1 ILE 6 15.954 -11.982 -59.274 50 HG13 ILE 6 2HG1 ILE 6 17.139 -11.517 -58.059 51 HG21 ILE 6 1HG2 ILE 6 16.946 -13.426 -55.651 52 HG22 ILE 6 2HG2 ILE 6 16.993 -14.932 -56.567 53 HG23 ILE 6 3HG2 ILE 6 18.084 -13.611 -56.985 54 HD11 ILE 6 1HD1 ILE 6 17.564 -12.899 -60.468 55 HD12 ILE 6 2HD1 ILE 6 18.741 -12.498 -59.217 56 HD13 ILE 6 3HD1 ILE 6 17.881 -14.037 -59.159 57 H HIS 7 H HIS 7 16.364 -16.676 -57.670 58 HA HIS 7 HA HIS 7 14.082 -17.692 -56.234 59 HB2 HIS 7 1HB HIS 7 16.855 -18.784 -56.719 60 HB3 HIS 7 2HB HIS 7 15.642 -19.634 -55.767 61 HD1 HIS 7 1HD HIS 7 13.178 -19.142 -57.562 62 HD2 HIS 7 2HD HIS 7 16.904 -20.333 -58.961 63 HE1 HIS 7 1HE HIS 7 12.740 -20.264 -59.770 64 HE2 HIS 7 2HE HIS 7 14.999 -21.052 -60.557 65 H ASN 8 H ASN 8 13.927 -18.096 -54.034 66 HA ASN 8 HA ASN 8 16.002 -16.876 -52.340 67 HB2 ASN 8 1HB ASN 8 14.348 -15.877 -50.930 68 HB3 ASN 8 2HB ASN 8 13.949 -15.432 -52.586 69 HD21 ASN 8 1HD2 ASN 8 13.152 -17.637 -49.968 70 HD22 ASN 8 2HD2 ASN 8 11.518 -17.916 -50.454 71 H VAL 9 H VAL 9 15.980 -17.653 -50.094 72 HA VAL 9 HA VAL 9 14.717 -20.267 -49.713 73 HB VAL 9 HB VAL 9 16.827 -21.212 -48.820 74 HG11 VAL 9 1HG1 VAL 9 15.974 -21.301 -51.304 75 HG12 VAL 9 2HG1 VAL 9 17.448 -20.380 -51.612 76 HG13 VAL 9 3HG1 VAL 9 17.543 -21.973 -50.861 77 HG21 VAL 9 1HG2 VAL 9 18.314 -19.613 -48.232 78 HG22 VAL 9 2HG2 VAL 9 18.882 -19.851 -49.885 79 HG23 VAL 9 3HG2 VAL 9 17.800 -18.510 -49.509 80 H HIS 10 H HIS 10 13.508 -19.912 -47.963 81 HA HIS 10 HA HIS 10 14.580 -18.278 -45.780 82 HB2 HIS 10 1HB HIS 10 11.844 -19.020 -46.692 83 HB3 HIS 10 2HB HIS 10 12.079 -18.733 -44.970 84 HD1 HIS 10 1HD HIS 10 10.508 -16.934 -47.196 85 HD2 HIS 10 2HD HIS 10 14.139 -16.129 -45.344 86 HE1 HIS 10 1HE HIS 10 10.797 -14.440 -47.339 87 HE2 HIS 10 2HE HIS 10 13.040 -13.986 -46.287 88 H LYS 11 H LYS 11 14.973 -19.069 -43.774 89 HA LYS 11 HA LYS 11 14.286 -21.870 -43.224 90 HB2 LYS 11 1HB LYS 11 17.010 -20.600 -42.930 91 HB3 LYS 11 2HB LYS 11 16.567 -22.122 -42.168 92 HG2 LYS 11 1HG LYS 11 16.379 -21.674 -45.133 93 HG3 LYS 11 2HG LYS 11 17.835 -22.283 -44.341 94 HD2 LYS 11 1HD LYS 11 15.166 -23.589 -43.918 95 HD3 LYS 11 2HD LYS 11 16.171 -23.988 -45.313 96 HE2 LYS 11 1HE LYS 11 17.993 -24.632 -43.832 97 HE3 LYS 11 2HE LYS 11 17.029 -24.183 -42.427 98 HZ1 LYS 11 1HZ LYS 11 15.368 -25.884 -43.503 99 HZ2 LYS 11 2HZ LYS 11 16.626 -26.405 -42.500 100 HZ3 LYS 11 3HZ LYS 11 16.785 -26.512 -44.181 101 H GLU 12 H GLU 12 14.620 -22.414 -40.874 102 HA GLU 12 HA GLU 12 14.333 -20.092 -39.110 103 HB2 GLU 12 1HB GLU 12 12.058 -20.690 -39.579 104 HB3 GLU 12 2HB GLU 12 12.392 -22.395 -39.312 105 HG2 GLU 12 1HG GLU 12 12.542 -22.129 -37.002 106 HG3 GLU 12 2HG GLU 12 12.751 -20.383 -37.125 107 H GLU 13 H GLU 13 15.039 -20.406 -37.011 108 HA GLU 13 HA GLU 13 16.646 -22.820 -36.612 109 HB2 GLU 13 1HB GLU 13 16.690 -20.072 -35.399 110 HB3 GLU 13 2HB GLU 13 17.513 -21.415 -34.618 111 HG2 GLU 13 1HG GLU 13 18.021 -20.585 -37.461 112 HG3 GLU 13 2HG GLU 13 18.945 -19.985 -36.086 113 H HIS 14 H HIS 14 16.306 -24.243 -34.982 114 HA HIS 14 HA HIS 14 13.866 -23.856 -33.394 115 HB2 HIS 14 1HB HIS 14 15.322 -26.284 -34.384 116 HB3 HIS 14 2HB HIS 14 14.264 -26.408 -32.981 117 HD1 HIS 14 1HD HIS 14 12.498 -27.831 -34.140 118 HD2 HIS 14 2HD HIS 14 13.248 -24.233 -36.078 119 HE1 HIS 14 1HE HIS 14 10.675 -27.598 -35.856 120 HE2 HIS 14 2HE HIS 14 11.198 -25.456 -37.073 121 H ALA 15 H ALA 15 16.158 -22.489 -32.571 122 HA ALA 15 HA ALA 15 17.265 -24.038 -30.354 123 HB1 ALA 15 1HB ALA 15 19.074 -22.728 -30.483 124 HB2 ALA 15 2HB ALA 15 18.419 -22.231 -32.044 125 HB3 ALA 15 3HB ALA 15 18.116 -21.252 -30.608 126 H HIS 16 H HIS 16 16.801 -23.674 -28.252 127 HA HIS 16 HA HIS 16 14.954 -21.463 -27.632 128 HB2 HIS 16 1HB HIS 16 13.632 -23.410 -27.455 129 HB3 HIS 16 2HB HIS 16 14.929 -24.323 -26.691 130 HD1 HIS 16 1HD HIS 16 12.760 -21.302 -25.876 131 HD2 HIS 16 2HD HIS 16 14.663 -24.487 -24.006 132 HE1 HIS 16 1HE HIS 16 12.101 -21.151 -23.453 133 HE2 HIS 16 2HE HIS 16 13.332 -23.037 -22.327 134 H ALA 17 H ALA 17 15.011 -20.746 -25.365 135 HA ALA 17 HA ALA 17 17.615 -21.210 -24.076 136 HB1 ALA 17 1HB ALA 17 18.243 -19.111 -24.405 137 HB2 ALA 17 2HB ALA 17 16.755 -18.801 -25.300 138 HB3 ALA 17 3HB ALA 17 16.806 -18.539 -23.557 139 H HIS 18 H HIS 18 17.504 -21.628 -21.958 140 HA HIS 18 HA HIS 18 14.891 -21.444 -20.658 141 HB2 HIS 18 1HB HIS 18 17.371 -22.801 -19.597 142 HB3 HIS 18 2HB HIS 18 15.707 -23.037 -19.071 143 HD1 HIS 18 1HD HIS 18 14.825 -25.195 -19.857 144 HD2 HIS 18 2HD HIS 18 17.481 -23.540 -22.590 145 HE1 HIS 18 1HE HIS 18 14.931 -26.830 -21.765 146 HE2 HIS 18 2HE HIS 18 16.609 -25.849 -23.367 147 H ASN 19 H ASN 19 14.794 -19.263 -20.132 148 HA ASN 19 HA ASN 19 16.918 -17.948 -18.727 149 HB2 ASN 19 1HB ASN 19 14.054 -17.014 -18.907 150 HB3 ASN 19 2HB ASN 19 15.501 -16.035 -18.687 151 HD21 ASN 19 1HD2 ASN 19 13.474 -17.684 -20.928 152 HD22 ASN 19 2HD2 ASN 19 14.245 -17.123 -22.369 153 H LYS 20 H LYS 20 17.226 -19.381 -16.944 154 HA LYS 20 HA LYS 20 15.075 -19.582 -14.991 155 HB2 LYS 20 1HB LYS 20 17.882 -20.707 -14.944 156 HB3 LYS 20 2HB LYS 20 16.625 -21.052 -13.763 157 HG2 LYS 20 1HG LYS 20 16.174 -21.618 -16.664 158 HG3 LYS 20 2HG LYS 20 17.082 -22.746 -15.654 159 HD2 LYS 20 1HD LYS 20 15.103 -22.664 -14.056 160 HD3 LYS 20 2HD LYS 20 14.222 -21.858 -15.356 161 HE2 LYS 20 1HE LYS 20 13.657 -24.077 -15.680 162 HE3 LYS 20 2HE LYS 20 15.009 -23.870 -16.792 163 HZ1 LYS 20 1HZ LYS 20 15.845 -24.665 -14.171 164 HZ2 LYS 20 2HZ LYS 20 16.225 -25.340 -15.674 165 HZ3 LYS 20 3HZ LYS 20 14.801 -25.792 -14.881 166 H ASP 21 H ASP 21 15.178 -17.167 -14.754 167 HA ASP 21 HA ASP 21 17.052 -16.507 -12.591 168 HB2 ASP 21 1HB ASP 21 17.876 -15.474 -14.678 169 HB3 ASP 21 2HB ASP 21 16.327 -14.658 -14.874 170 H TYR 22 H TYR 22 15.302 -16.943 -11.167 171 HA TYR 22 HA TYR 22 13.254 -14.824 -11.152 172 HB2 TYR 22 1HB TYR 22 11.982 -16.716 -9.772 173 HB3 TYR 22 2HB TYR 22 11.884 -16.618 -11.527 174 HD1 TYR 22 2HD TYR 22 13.826 -17.955 -12.779 175 HD2 TYR 22 1HD TYR 22 12.447 -18.771 -8.838 176 HE1 TYR 22 2HE TYR 22 14.690 -20.251 -12.959 177 HE2 TYR 22 1HE TYR 22 13.308 -21.069 -9.006 178 HH TYR 22 HH TYR 22 13.972 -22.593 -11.677 179 H ASP 23 H ASP 23 12.334 -14.433 -8.949 180 HA ASP 23 HA ASP 23 14.346 -14.854 -6.842 181 HB2 ASP 23 1HB ASP 23 14.678 -12.597 -7.446 182 HB3 ASP 23 2HB ASP 23 12.951 -12.304 -7.627 183 H ILE 24 H ILE 24 13.435 -16.139 -5.382 184 HA ILE 24 HA ILE 24 10.592 -15.735 -4.729 185 HB ILE 24 HB ILE 24 11.999 -18.202 -3.855 186 HG12 ILE 24 1HG1 ILE 24 12.730 -17.901 -6.203 187 HG13 ILE 24 2HG1 ILE 24 11.674 -19.295 -6.005 188 HG21 ILE 24 1HG2 ILE 24 9.775 -18.099 -3.172 189 HG22 ILE 24 2HG2 ILE 24 9.235 -17.423 -4.708 190 HG23 ILE 24 3HG2 ILE 24 9.716 -19.117 -4.611 191 HD11 ILE 24 1HD1 ILE 24 9.992 -17.148 -6.616 192 HD12 ILE 24 2HD1 ILE 24 11.374 -17.012 -7.703 193 HD13 ILE 24 3HD1 ILE 24 10.435 -18.504 -7.652 194 HA PRO 25 HA PRO 25 11.838 -14.292 -0.747 195 HB2 PRO 25 1HB PRO 25 9.456 -14.588 0.522 196 HB3 PRO 25 2HB PRO 25 9.770 -13.295 -0.640 197 HG2 PRO 25 1HG PRO 25 8.349 -15.898 -1.042 198 HG3 PRO 25 2HG PRO 25 7.910 -14.282 -1.626 199 HD2 PRO 25 1HD PRO 25 9.115 -16.123 -3.203 200 HD3 PRO 25 2HD PRO 25 9.391 -14.379 -3.389 201 H THR 26 H THR 26 13.097 -15.474 0.542 202 HA THR 26 HA THR 26 12.863 -18.225 0.986 203 HB THR 26 HB THR 26 14.461 -17.880 2.867 204 HG1 THR 26 1HG THR 26 14.493 -15.138 2.165 205 HG21 THR 26 1HG2 THR 26 15.965 -16.297 1.131 206 HG22 THR 26 2HG2 THR 26 14.837 -17.167 0.090 207 HG23 THR 26 3HG2 THR 26 15.904 -18.059 1.174 208 H THR 27 H THR 27 11.219 -15.585 2.431 209 HA THR 27 HA THR 27 10.293 -17.278 4.651 210 HB THR 27 HB THR 27 9.732 -14.333 4.433 211 HG1 THR 27 1HG THR 27 11.915 -14.288 4.379 212 HG21 THR 27 1HG2 THR 27 9.761 -14.541 6.922 213 HG22 THR 27 2HG2 THR 27 9.968 -16.281 6.726 214 HG23 THR 27 3HG2 THR 27 8.502 -15.496 6.139 215 H GLU 28 H GLU 28 8.078 -17.495 5.085 216 HA GLU 28 HA GLU 28 6.414 -17.556 2.761 217 HB2 GLU 28 1HB GLU 28 4.645 -18.264 4.459 218 HB3 GLU 28 2HB GLU 28 6.052 -19.306 4.294 219 HG2 GLU 28 1HG GLU 28 6.998 -18.489 6.313 220 HG3 GLU 28 2HG GLU 28 5.797 -17.203 6.425 221 H ASN 29 H ASN 29 6.873 -15.086 2.578 222 HA ASN 29 HA ASN 29 4.533 -13.714 3.709 223 HB2 ASN 29 1HB ASN 29 7.239 -12.406 3.386 224 HB3 ASN 29 2HB ASN 29 5.805 -11.721 4.144 225 HD21 ASN 29 1HD2 ASN 29 5.009 -13.968 5.620 226 HD22 ASN 29 2HD2 ASN 29 6.166 -14.226 6.877 227 H LEU 30 H LEU 30 3.269 -12.999 2.137 228 HA LEU 30 HA LEU 30 4.421 -12.541 -0.521 229 HB2 LEU 30 1HB LEU 30 2.325 -14.047 0.106 230 HB3 LEU 30 2HB LEU 30 1.489 -12.504 -0.055 231 HG LEU 30 HG LEU 30 1.277 -13.618 -2.131 232 HD11 LEU 30 1HD1 LEU 30 3.587 -11.799 -2.680 233 HD12 LEU 30 2HD1 LEU 30 2.066 -11.159 -2.057 234 HD13 LEU 30 3HD1 LEU 30 2.096 -12.022 -3.595 235 HD21 LEU 30 1HD2 LEU 30 2.967 -14.725 -3.289 236 HD22 LEU 30 2HD2 LEU 30 3.277 -15.149 -1.605 237 HD23 LEU 30 3HD2 LEU 30 4.249 -13.908 -2.395 238 H TYR 31 H TYR 31 4.405 -10.586 -1.481 239 HA TYR 31 HA TYR 31 3.187 -8.364 0.022 240 HB2 TYR 31 1HB TYR 31 5.706 -8.515 -1.619 241 HB3 TYR 31 2HB TYR 31 4.935 -6.973 -1.262 242 HD1 TYR 31 1HD TYR 31 4.078 -7.241 1.490 243 HD2 TYR 31 2HD TYR 31 7.645 -8.638 -0.360 244 HE1 TYR 31 1HE TYR 31 5.227 -7.165 3.663 245 HE2 TYR 31 2HE TYR 31 8.804 -8.567 1.808 246 HH TYR 31 HH TYR 31 8.270 -8.609 4.183 247 H PHE 32 H PHE 32 2.023 -6.806 -1.071 248 HA PHE 32 HA PHE 32 1.698 -7.044 -3.957 249 HB2 PHE 32 1HB PHE 32 -0.499 -7.504 -1.953 250 HB3 PHE 32 2HB PHE 32 -0.854 -6.924 -3.577 251 HD1 PHE 32 2HD PHE 32 -0.160 -8.333 -5.542 252 HD2 PHE 32 1HD PHE 32 -0.092 -9.771 -1.537 253 HE1 PHE 32 2HE PHE 32 -0.121 -10.647 -6.378 254 HE2 PHE 32 1HE PHE 32 -0.053 -12.088 -2.366 255 HZ PHE 32 HZ PHE 32 -0.068 -12.528 -4.789 256 H GLN 33 H GLN 33 0.887 -5.178 -4.952 257 HA GLN 33 HA GLN 33 0.285 -2.879 -3.257 258 HB2 GLN 33 1HB GLN 33 2.030 -1.561 -3.920 259 HB3 GLN 33 2HB GLN 33 2.825 -3.128 -3.990 260 HG2 GLN 33 1HG GLN 33 2.010 -3.125 -6.461 261 HG3 GLN 33 2HG GLN 33 1.879 -1.384 -6.214 262 HE21 GLN 33 1HE2 GLN 33 3.510 -1.082 -7.779 263 HE22 GLN 33 2HE2 GLN 33 5.174 -1.342 -7.395 264 H GLY 34 H GLY 34 -1.029 -1.352 -4.212 265 HA2 GLY 34 1HA GLY 34 -1.570 -0.652 -6.716 266 HA3 GLY 34 2HA GLY 34 -2.342 -2.229 -6.663 267 H SER 35 H SER 35 -2.160 0.614 -4.514 268 HA SER 35 HA SER 35 -4.810 0.229 -3.543 269 HB2 SER 35 1HB SER 35 -4.482 2.428 -2.448 270 HB3 SER 35 2HB SER 35 -3.124 1.339 -2.169 271 HG SER 35 HG SER 35 -2.376 2.538 -4.263 272 H SER 36 H SER 36 -6.686 1.351 -3.999 273 HA SER 36 HA SER 36 -6.731 2.646 -6.625 274 HB2 SER 36 1HB SER 36 -8.267 0.715 -6.142 275 HB3 SER 36 2HB SER 36 -9.084 1.733 -4.957 276 HG SER 36 HG SER 36 -8.849 2.209 -7.745 277 H GLY 37 H GLY 37 -5.629 4.216 -4.653 278 HA2 GLY 37 1HA GLY 37 -6.388 6.666 -4.797 279 HA3 GLY 37 2HA GLY 37 -7.780 6.082 -3.897 280 H SER 38 H SER 38 -7.612 5.704 -1.720 281 HA SER 38 HA SER 38 -5.059 6.514 -0.492 282 HB2 SER 38 1HB SER 38 -7.855 6.741 0.649 283 HB3 SER 38 2HB SER 38 -6.372 7.277 1.437 284 HG SER 38 HG SER 38 -6.253 8.955 0.119 285 H SER 39 H SER 39 -5.021 5.669 1.917 286 HA SER 39 HA SER 39 -4.688 2.882 1.782 287 HB2 SER 39 1HB SER 39 -4.543 3.123 4.356 288 HB3 SER 39 2HB SER 39 -3.346 3.966 3.373 289 HG SER 39 HG SER 39 -4.712 5.083 5.172 290 H GLY 40 H GLY 40 -7.274 4.881 3.136 291 HA2 GLY 40 1HA GLY 40 -8.734 2.734 4.288 292 HA3 GLY 40 2HA GLY 40 -9.360 4.338 3.936 293 H ASP 41 H ASP 41 -9.228 4.555 1.265 294 HA ASP 41 HA ASP 41 -11.472 3.335 0.304 295 HB2 ASP 41 1HB ASP 41 -9.205 3.785 -1.598 296 HB3 ASP 41 2HB ASP 41 -10.916 4.159 -1.790 297 H MET 42 H MET 42 -8.188 2.071 0.296 298 HA MET 42 HA MET 42 -8.460 -0.084 -1.413 299 HB2 MET 42 1HB MET 42 -6.742 0.526 0.929 300 HB3 MET 42 2HB MET 42 -6.809 -1.153 0.412 301 HG2 MET 42 1HG MET 42 -6.435 0.144 -1.954 302 HG3 MET 42 2HG MET 42 -5.522 1.154 -0.834 303 HE1 MET 42 1HE MET 42 -4.691 -1.781 -3.286 304 HE2 MET 42 2HE MET 42 -4.784 -3.118 -2.139 305 HE3 MET 42 3HE MET 42 -6.193 -2.091 -2.413 306 H MET 43 H MET 43 -9.496 0.253 1.929 307 HA MET 43 HA MET 43 -10.139 -2.472 2.361 308 HB2 MET 43 1HB MET 43 -11.449 -0.118 3.717 309 HB3 MET 43 2HB MET 43 -11.236 -1.745 4.349 310 HG2 MET 43 1HG MET 43 -8.811 -0.192 3.632 311 HG3 MET 43 2HG MET 43 -9.691 0.255 5.091 312 HE1 MET 43 1HE MET 43 -10.841 -1.852 6.298 313 HE2 MET 43 2HE MET 43 -9.876 -3.211 6.875 314 HE3 MET 43 3HE MET 43 -9.561 -1.585 7.482 315 H ARG 44 H ARG 44 -11.661 0.013 0.579 316 HA ARG 44 HA ARG 44 -14.353 -0.874 0.778 317 HB2 ARG 44 1HB ARG 44 -13.166 0.611 -1.562 318 HB3 ARG 44 2HB ARG 44 -14.828 0.644 -0.987 319 HG2 ARG 44 1HG ARG 44 -12.564 1.633 0.708 320 HG3 ARG 44 2HG ARG 44 -13.350 2.662 -0.490 321 HD2 ARG 44 1HD ARG 44 -14.660 1.290 1.853 322 HD3 ARG 44 2HD ARG 44 -14.353 3.017 1.681 323 HE ARG 44 HE ARG 44 -15.924 2.104 -0.475 324 HH11 ARG 44 2HH1 ARG 44 -16.117 2.768 2.937 325 HH12 ARG 44 1HH1 ARG 44 -17.810 3.133 2.903 326 HH21 ARG 44 2HH2 ARG 44 -18.153 2.583 -0.533 327 HH22 ARG 44 1HH2 ARG 44 -18.967 3.028 0.928 328 H GLU 45 H GLU 45 -11.933 -1.251 -1.818 329 HA GLU 45 HA GLU 45 -13.519 -3.056 -3.327 330 HB2 GLU 45 1HB GLU 45 -11.854 -1.858 -4.510 331 HB3 GLU 45 2HB GLU 45 -10.595 -2.337 -3.379 332 HG2 GLU 45 1HG GLU 45 -10.157 -3.658 -5.214 333 HG3 GLU 45 2HG GLU 45 -11.099 -4.734 -4.184 334 H ILE 46 H ILE 46 -10.713 -3.545 -1.195 335 HA ILE 46 HA ILE 46 -10.238 -6.186 -1.367 336 HB ILE 46 HB ILE 46 -10.453 -4.557 1.161 337 HG12 ILE 46 1HG1 ILE 46 -7.960 -5.537 -0.216 338 HG13 ILE 46 2HG1 ILE 46 -8.741 -4.033 -0.692 339 HG21 ILE 46 1HG2 ILE 46 -9.894 -7.419 0.770 340 HG22 ILE 46 2HG2 ILE 46 -8.759 -6.558 1.809 341 HG23 ILE 46 3HG2 ILE 46 -10.480 -6.559 2.194 342 HD11 ILE 46 1HD1 ILE 46 -6.830 -4.338 1.261 343 HD12 ILE 46 2HD1 ILE 46 -7.877 -2.937 1.033 344 HD13 ILE 46 3HD1 ILE 46 -8.334 -4.203 2.172 345 H ARG 47 H ARG 47 -12.598 -4.929 0.999 346 HA ARG 47 HA ARG 47 -13.709 -7.349 1.736 347 HB2 ARG 47 1HB ARG 47 -14.776 -4.549 1.668 348 HB3 ARG 47 2HB ARG 47 -15.833 -5.877 2.127 349 HG2 ARG 47 1HG ARG 47 -14.424 -6.441 3.980 350 HG3 ARG 47 2HG ARG 47 -13.207 -5.271 3.465 351 HD2 ARG 47 1HD ARG 47 -14.459 -4.315 5.271 352 HD3 ARG 47 2HD ARG 47 -14.891 -3.470 3.786 353 HE ARG 47 HE ARG 47 -16.773 -5.421 4.004 354 HH11 ARG 47 2HH1 ARG 47 -15.635 -2.887 6.102 355 HH12 ARG 47 1HH1 ARG 47 -17.160 -2.682 6.898 356 HH21 ARG 47 2HH2 ARG 47 -18.786 -5.161 5.045 357 HH22 ARG 47 1HH2 ARG 47 -18.952 -3.976 6.296 358 H LYS 48 H LYS 48 -14.468 -5.305 -1.027 359 HA LYS 48 HA LYS 48 -16.821 -6.521 -1.883 360 HB2 LYS 48 1HB LYS 48 -15.576 -4.420 -2.775 361 HB3 LYS 48 2HB LYS 48 -14.748 -5.557 -3.831 362 HG2 LYS 48 1HG LYS 48 -17.002 -6.320 -4.620 363 HG3 LYS 48 2HG LYS 48 -17.695 -4.973 -3.714 364 HD2 LYS 48 1HD LYS 48 -17.463 -3.988 -5.766 365 HD3 LYS 48 2HD LYS 48 -15.892 -3.595 -5.065 366 HE2 LYS 48 1HE LYS 48 -15.045 -5.735 -6.138 367 HE3 LYS 48 2HE LYS 48 -16.563 -5.767 -7.034 368 HZ1 LYS 48 1HZ LYS 48 -14.246 -4.343 -7.639 369 HZ2 LYS 48 2HZ LYS 48 -15.433 -3.205 -7.244 370 HZ3 LYS 48 3HZ LYS 48 -15.719 -4.333 -8.472 371 H VAL 49 H VAL 49 -13.455 -7.416 -2.462 372 HA VAL 49 HA VAL 49 -14.088 -9.552 -4.261 373 HB VAL 49 HB VAL 49 -11.514 -9.565 -2.772 374 HG11 VAL 49 1HG1 VAL 49 -10.621 -10.300 -4.821 375 HG12 VAL 49 2HG1 VAL 49 -12.182 -11.110 -4.680 376 HG13 VAL 49 3HG1 VAL 49 -12.009 -9.705 -5.733 377 HG21 VAL 49 1HG2 VAL 49 -11.443 -7.291 -3.023 378 HG22 VAL 49 2HG2 VAL 49 -10.801 -7.791 -4.587 379 HG23 VAL 49 3HG2 VAL 49 -12.489 -7.303 -4.443 380 H LEU 50 H LEU 50 -13.138 -9.368 -0.843 381 HA LEU 50 HA LEU 50 -12.961 -12.050 -0.242 382 HB2 LEU 50 1HB LEU 50 -14.191 -9.952 1.537 383 HB3 LEU 50 2HB LEU 50 -13.436 -11.462 2.045 384 HG LEU 50 HG LEU 50 -11.968 -9.189 0.712 385 HD11 LEU 50 1HD1 LEU 50 -13.009 -9.133 3.236 386 HD12 LEU 50 2HD1 LEU 50 -11.593 -8.231 2.697 387 HD13 LEU 50 3HD1 LEU 50 -11.392 -9.781 3.515 388 HD21 LEU 50 1HD2 LEU 50 -10.068 -10.412 0.899 389 HD22 LEU 50 2HD2 LEU 50 -11.211 -11.745 0.742 390 HD23 LEU 50 3HD2 LEU 50 -10.625 -11.268 2.336 391 H GLY 51 H GLY 51 -15.879 -10.021 0.131 392 HA2 GLY 51 1HA GLY 51 -17.584 -12.223 0.698 393 HA3 GLY 51 2HA GLY 51 -18.101 -10.599 0.269 394 H ALA 52 H ALA 52 -16.332 -10.972 -2.235 395 HA ALA 52 HA ALA 52 -18.480 -11.906 -3.911 396 HB1 ALA 52 1HB ALA 52 -15.860 -10.584 -4.338 397 HB2 ALA 52 2HB ALA 52 -16.541 -11.507 -5.679 398 HB3 ALA 52 3HB ALA 52 -17.455 -10.175 -4.972 399 H ASN 53 H ASN 53 -15.359 -13.099 -2.831 400 HA ASN 53 HA ASN 53 -15.666 -15.497 -4.488 401 HB2 ASN 53 1HB ASN 53 -13.369 -14.150 -3.156 402 HB3 ASN 53 2HB ASN 53 -13.293 -15.901 -3.328 403 HD21 ASN 53 1HD2 ASN 53 -13.911 -12.946 -5.168 404 HD22 ASN 53 2HD2 ASN 53 -13.216 -13.513 -6.645 405 H ASN 54 H ASN 54 -17.404 -15.077 -2.244 406 HA ASN 54 HA ASN 54 -18.182 -16.085 -0.350 407 HB2 ASN 54 1HB ASN 54 -16.830 -18.398 -1.749 408 HB3 ASN 54 2HB ASN 54 -17.862 -18.592 -0.335 409 HD21 ASN 54 1HD2 ASN 54 -18.843 -19.987 -2.148 410 HD22 ASN 54 2HD2 ASN 54 -20.113 -19.239 -3.049 411 H CYS 55 H CYS 55 -16.076 -14.638 0.357 412 HA CYS 55 HA CYS 55 -14.526 -16.397 2.142 413 HB2 CYS 55 1HB CYS 55 -13.583 -13.698 1.189 414 HB3 CYS 55 2HB CYS 55 -12.640 -14.979 1.941 415 HG CYS 55 HG CYS 55 -13.790 -14.825 -1.264 416 H ASP 56 H ASP 56 -14.255 -15.770 4.269 417 HA ASP 56 HA ASP 56 -16.141 -13.729 5.193 418 HB2 ASP 56 1HB ASP 56 -14.659 -15.734 6.894 419 HB3 ASP 56 2HB ASP 56 -16.095 -14.809 7.321 420 H TYR 57 H TYR 57 -15.535 -11.957 6.341 421 HA TYR 57 HA TYR 57 -12.707 -11.656 7.055 422 HB2 TYR 57 1HB TYR 57 -12.962 -9.223 6.195 423 HB3 TYR 57 2HB TYR 57 -12.669 -10.505 5.026 424 HD1 TYR 57 2HD TYR 57 -14.690 -11.473 3.794 425 HD2 TYR 57 1HD TYR 57 -14.837 -7.834 5.995 426 HE1 TYR 57 2HE TYR 57 -16.711 -10.814 2.558 427 HE2 TYR 57 1HE TYR 57 -16.860 -7.166 4.765 428 HH TYR 57 HH TYR 57 -18.144 -7.626 2.944 429 H GLU 58 H GLU 58 -12.347 -10.569 8.922 430 HA GLU 58 HA GLU 58 -14.674 -9.317 10.226 431 HB2 GLU 58 1HB GLU 58 -14.026 -11.562 11.178 432 HB3 GLU 58 2HB GLU 58 -12.495 -10.841 11.657 433 HG2 GLU 58 1HG GLU 58 -13.691 -10.641 13.590 434 HG3 GLU 58 2HG GLU 58 -14.023 -9.084 12.834 435 H GLN 59 H GLN 59 -14.248 -7.196 10.057 436 HA GLN 59 HA GLN 59 -11.689 -6.037 10.003 437 HB2 GLN 59 1HB GLN 59 -14.092 -5.107 9.375 438 HB3 GLN 59 2HB GLN 59 -14.015 -4.464 11.010 439 HG2 GLN 59 1HG GLN 59 -11.640 -3.641 10.168 440 HG3 GLN 59 2HG GLN 59 -12.450 -3.735 8.605 441 HE21 GLN 59 1HE2 GLN 59 -11.484 -1.408 10.067 442 HE22 GLN 59 2HE2 GLN 59 -12.852 -0.376 10.287 443 H ARG 60 H ARG 60 -10.292 -6.293 11.633 444 HA ARG 60 HA ARG 60 -11.197 -6.283 14.388 445 HB2 ARG 60 1HB ARG 60 -8.385 -6.509 13.304 446 HB3 ARG 60 2HB ARG 60 -8.904 -6.856 14.948 447 HG2 ARG 60 1HG ARG 60 -9.854 -8.353 12.515 448 HG3 ARG 60 2HG ARG 60 -8.530 -8.872 13.560 449 HD2 ARG 60 1HD ARG 60 -11.160 -8.233 14.799 450 HD3 ARG 60 2HD ARG 60 -10.992 -9.750 13.916 451 HE ARG 60 HE ARG 60 -9.545 -10.526 15.553 452 HH11 ARG 60 2HH1 ARG 60 -10.359 -7.186 16.104 453 HH12 ARG 60 1HH1 ARG 60 -9.723 -7.161 17.715 454 HH21 ARG 60 2HH2 ARG 60 -8.703 -10.506 17.672 455 HH22 ARG 60 1HH2 ARG 60 -8.780 -9.050 18.606 456 H GLU 61 H GLU 61 -9.391 -4.228 12.183 457 HA GLU 61 HA GLU 61 -9.642 -2.035 14.103 458 HB2 GLU 61 1HB GLU 61 -7.065 -2.683 12.662 459 HB3 GLU 61 2HB GLU 61 -7.340 -1.311 13.725 460 HG2 GLU 61 1HG GLU 61 -7.704 -4.106 14.719 461 HG3 GLU 61 2HG GLU 61 -6.102 -3.375 14.635 462 H ARG 62 H ARG 62 -8.983 0.095 13.009 463 HA ARG 62 HA ARG 62 -10.668 0.650 10.913 464 HB2 ARG 62 1HB ARG 62 -9.237 2.686 10.534 465 HB3 ARG 62 2HB ARG 62 -9.769 2.449 12.193 466 HG2 ARG 62 1HG ARG 62 -7.568 1.471 12.726 467 HG3 ARG 62 2HG ARG 62 -7.045 1.819 11.077 468 HD2 ARG 62 1HD ARG 62 -7.434 4.202 11.455 469 HD3 ARG 62 2HD ARG 62 -7.974 3.857 13.098 470 HE ARG 62 HE ARG 62 -5.335 2.880 12.548 471 HH11 ARG 62 2HH1 ARG 62 -7.198 5.660 13.507 472 HH12 ARG 62 1HH1 ARG 62 -5.880 6.421 14.334 473 HH21 ARG 62 2HH2 ARG 62 -3.592 3.872 13.634 474 HH22 ARG 62 1HH2 ARG 62 -3.828 5.404 14.405 475 H PHE 63 H PHE 63 -7.275 -0.324 10.775 476 HA PHE 63 HA PHE 63 -7.582 -0.691 7.867 477 HB2 PHE 63 1HB PHE 63 -5.113 0.126 9.410 478 HB3 PHE 63 2HB PHE 63 -5.118 -0.305 7.703 479 HD1 PHE 63 2HD PHE 63 -6.922 1.035 6.276 480 HD2 PHE 63 1HD PHE 63 -5.220 2.348 9.949 481 HE1 PHE 63 2HE PHE 63 -7.462 3.362 5.690 482 HE2 PHE 63 1HE PHE 63 -5.759 4.678 9.370 483 HZ PHE 63 HZ PHE 63 -6.880 5.188 7.238 484 H LEU 64 H LEU 64 -8.201 -2.609 9.919 485 HA LEU 64 HA LEU 64 -6.313 -4.711 9.132 486 HB2 LEU 64 1HB LEU 64 -5.897 -3.795 11.480 487 HB3 LEU 64 2HB LEU 64 -7.428 -4.552 11.916 488 HG LEU 64 HG LEU 64 -6.274 -6.697 10.913 489 HD11 LEU 64 1HD1 LEU 64 -3.793 -5.667 12.075 490 HD12 LEU 64 2HD1 LEU 64 -4.228 -4.942 10.527 491 HD13 LEU 64 3HD1 LEU 64 -4.050 -6.691 10.663 492 HD21 LEU 64 1HD2 LEU 64 -6.573 -5.565 13.510 493 HD22 LEU 64 2HD2 LEU 64 -5.039 -6.432 13.444 494 HD23 LEU 64 3HD2 LEU 64 -6.541 -7.265 13.040 495 H LEU 65 H LEU 65 -7.282 -6.514 8.438 496 HA LEU 65 HA LEU 65 -10.007 -7.120 9.301 497 HB2 LEU 65 1HB LEU 65 -9.146 -6.429 6.549 498 HB3 LEU 65 2HB LEU 65 -10.299 -7.749 6.729 499 HG LEU 65 HG LEU 65 -10.875 -5.144 8.061 500 HD11 LEU 65 1HD1 LEU 65 -11.558 -4.056 6.169 501 HD12 LEU 65 2HD1 LEU 65 -11.775 -5.547 5.254 502 HD13 LEU 65 3HD1 LEU 65 -10.153 -4.919 5.542 503 HD21 LEU 65 1HD2 LEU 65 -13.136 -5.808 7.769 504 HD22 LEU 65 2HD2 LEU 65 -12.258 -7.222 8.353 505 HD23 LEU 65 3HD2 LEU 65 -12.684 -7.091 6.646 506 H PHE 66 H PHE 66 -10.216 -9.204 9.783 507 HA PHE 66 HA PHE 66 -8.047 -11.025 9.201 508 HB2 PHE 66 1HB PHE 66 -9.299 -10.885 11.418 509 HB3 PHE 66 2HB PHE 66 -10.633 -11.694 10.603 510 HD1 PHE 66 1HD PHE 66 -9.777 -13.849 9.197 511 HD2 PHE 66 2HD PHE 66 -7.940 -12.222 12.675 512 HE1 PHE 66 1HE PHE 66 -8.741 -16.031 9.666 513 HE2 PHE 66 2HE PHE 66 -6.900 -14.401 13.149 514 HZ PHE 66 HZ PHE 66 -7.299 -16.308 11.644 515 H CYS 67 H CYS 67 -8.108 -11.479 7.026 516 HA CYS 67 HA CYS 67 -10.560 -12.333 5.760 517 HB2 CYS 67 1HB CYS 67 -7.721 -12.284 4.714 518 HB3 CYS 67 2HB CYS 67 -9.157 -12.607 3.749 519 HG CYS 67 HG CYS 67 -9.368 -9.724 5.398 520 H VAL 68 H VAL 68 -11.172 -14.376 5.284 521 HA VAL 68 HA VAL 68 -9.317 -16.588 5.568 522 HB VAL 68 HB VAL 68 -10.227 -16.171 7.873 523 HG11 VAL 68 1HG1 VAL 68 -12.813 -17.333 6.924 524 HG12 VAL 68 2HG1 VAL 68 -12.464 -16.432 8.400 525 HG13 VAL 68 3HG1 VAL 68 -12.546 -15.591 6.851 526 HG21 VAL 68 1HG2 VAL 68 -9.408 -18.390 6.997 527 HG22 VAL 68 2HG2 VAL 68 -10.511 -18.473 8.370 528 HG23 VAL 68 3HG2 VAL 68 -11.099 -18.823 6.745 529 H HIS 69 H HIS 69 -9.706 -17.992 3.992 530 HA HIS 69 HA HIS 69 -12.403 -18.058 2.811 531 HB2 HIS 69 1HB HIS 69 -10.863 -17.247 1.179 532 HB3 HIS 69 2HB HIS 69 -9.690 -18.501 1.565 533 HD1 HIS 69 1HD HIS 69 -10.624 -21.040 0.998 534 HD2 HIS 69 2HD HIS 69 -12.400 -17.838 -0.967 535 HE1 HIS 69 1HE HIS 69 -11.771 -22.033 -1.008 536 HE2 HIS 69 2HE HIS 69 -12.766 -20.067 -2.227 537 H GLY 70 H GLY 70 -13.500 -19.923 2.825 538 HA2 GLY 70 1HA GLY 70 -12.424 -22.491 2.608 539 HA3 GLY 70 2HA GLY 70 -12.582 -22.136 4.322 540 H ASP 71 H ASP 71 -14.090 -23.521 1.749 541 HA ASP 71 HA ASP 71 -16.793 -22.734 2.212 542 HB2 ASP 71 1HB ASP 71 -16.392 -23.585 0.063 543 HB3 ASP 71 2HB ASP 71 -15.491 -24.968 0.679 544 H GLY 72 H GLY 72 -14.707 -25.275 3.436 545 HA2 GLY 72 1HA GLY 72 -15.871 -25.695 5.838 546 HA3 GLY 72 2HA GLY 72 -16.869 -26.663 4.763 547 H HIS 73 H HIS 73 -13.377 -26.102 4.602 548 HA HIS 73 HA HIS 73 -12.735 -28.691 5.662 549 HB2 HIS 73 1HB HIS 73 -12.909 -28.251 2.732 550 HB3 HIS 73 2HB HIS 73 -11.506 -29.141 3.315 551 HD1 HIS 73 1HD HIS 73 -13.220 -30.785 1.625 552 HD2 HIS 73 2HD HIS 73 -14.052 -30.291 5.666 553 HE1 HIS 73 1HE HIS 73 -14.662 -32.745 2.260 554 HE2 HIS 73 2HE HIS 73 -15.223 -32.380 4.688 555 H ALA 74 H ALA 74 -10.819 -28.535 6.620 556 HA ALA 74 HA ALA 74 -9.283 -26.254 6.725 557 HB1 ALA 74 1HB ALA 74 -7.503 -28.394 7.141 558 HB2 ALA 74 2HB ALA 74 -8.376 -27.456 8.353 559 HB3 ALA 74 3HB ALA 74 -9.086 -28.933 7.703 560 H GLU 75 H GLU 75 -9.119 -28.900 4.432 561 HA GLU 75 HA GLU 75 -6.634 -28.503 3.297 562 HB2 GLU 75 1HB GLU 75 -9.247 -29.368 2.072 563 HB3 GLU 75 2HB GLU 75 -7.751 -29.327 1.151 564 HG2 GLU 75 1HG GLU 75 -6.745 -30.868 2.808 565 HG3 GLU 75 2HG GLU 75 -8.315 -30.978 3.601 566 H ASN 76 H ASN 76 -9.693 -26.892 2.480 567 HA ASN 76 HA ASN 76 -8.260 -25.054 0.716 568 HB2 ASN 76 1HB ASN 76 -10.768 -24.217 0.455 569 HB3 ASN 76 2HB ASN 76 -10.176 -25.632 -0.409 570 HD21 ASN 76 1HD2 ASN 76 -12.095 -24.501 2.268 571 HD22 ASN 76 2HD2 ASN 76 -12.951 -25.978 2.536 572 H LEU 77 H LEU 77 -9.324 -25.247 3.908 573 HA LEU 77 HA LEU 77 -10.073 -22.564 4.393 574 HB2 LEU 77 1HB LEU 77 -10.371 -24.689 5.847 575 HB3 LEU 77 2HB LEU 77 -8.763 -24.298 6.452 576 HG LEU 77 HG LEU 77 -9.878 -21.950 6.907 577 HD11 LEU 77 1HD1 LEU 77 -12.126 -23.691 6.261 578 HD12 LEU 77 2HD1 LEU 77 -12.045 -21.933 6.369 579 HD13 LEU 77 3HD1 LEU 77 -12.279 -22.896 7.827 580 HD21 LEU 77 1HD2 LEU 77 -9.041 -22.900 8.790 581 HD22 LEU 77 2HD2 LEU 77 -9.801 -24.461 8.477 582 HD23 LEU 77 3HD2 LEU 77 -10.757 -23.129 9.130 583 H VAL 78 H VAL 78 -8.887 -20.779 4.541 584 HA VAL 78 HA VAL 78 -6.066 -20.965 5.291 585 HB VAL 78 HB VAL 78 -7.018 -19.521 2.813 586 HG11 VAL 78 1HG1 VAL 78 -5.062 -18.629 4.377 587 HG12 VAL 78 2HG1 VAL 78 -4.141 -19.827 3.465 588 HG13 VAL 78 3HG1 VAL 78 -4.981 -18.527 2.618 589 HG21 VAL 78 1HG2 VAL 78 -5.059 -21.220 2.011 590 HG22 VAL 78 2HG2 VAL 78 -5.832 -22.167 3.283 591 HG23 VAL 78 3HG2 VAL 78 -6.785 -21.574 1.923 592 H GLN 79 H GLN 79 -5.665 -19.541 6.840 593 HA GLN 79 HA GLN 79 -7.392 -17.169 7.052 594 HB2 GLN 79 1HB GLN 79 -5.814 -18.663 9.148 595 HB3 GLN 79 2HB GLN 79 -6.610 -17.124 9.445 596 HG2 GLN 79 1HG GLN 79 -8.698 -18.032 9.411 597 HG3 GLN 79 2HG GLN 79 -8.234 -19.336 8.319 598 HE21 GLN 79 1HE2 GLN 79 -8.985 -21.027 9.484 599 HE22 GLN 79 2HE2 GLN 79 -8.382 -21.475 11.040 600 H TRP 80 H TRP 80 -6.543 -15.185 6.898 601 HA TRP 80 HA TRP 80 -3.736 -14.704 7.396 602 HB2 TRP 80 1HB TRP 80 -3.128 -13.966 5.226 603 HB3 TRP 80 2HB TRP 80 -3.928 -15.517 4.990 604 HD1 TRP 80 HD TRP 80 -4.238 -11.840 4.152 605 HE1 TRP 80 1HE TRP 80 -6.213 -11.502 2.537 606 HE3 TRP 80 3HE TRP 80 -6.295 -16.514 4.396 607 HZ2 TRP 80 2HZ TRP 80 -8.360 -13.015 1.504 608 HZ3 TRP 80 3HZ TRP 80 -8.309 -16.987 3.063 609 HH2 TRP 80 HH TRP 80 -9.319 -15.272 1.648 610 H GLU 81 H GLU 81 -3.304 -12.592 7.907 611 HA GLU 81 HA GLU 81 -5.640 -10.872 8.221 612 HB2 GLU 81 1HB GLU 81 -2.852 -10.788 9.366 613 HB3 GLU 81 2HB GLU 81 -3.995 -9.468 9.571 614 HG2 GLU 81 1HG GLU 81 -5.484 -10.833 10.811 615 HG3 GLU 81 2HG GLU 81 -4.587 -12.294 10.402 616 H MET 82 H MET 82 -6.020 -9.150 6.985 617 HA MET 82 HA MET 82 -3.944 -8.335 5.075 618 HB2 MET 82 1HB MET 82 -6.920 -8.362 5.021 619 HB3 MET 82 2HB MET 82 -6.101 -7.091 4.122 620 HG2 MET 82 1HG MET 82 -5.197 -9.895 3.746 621 HG3 MET 82 2HG MET 82 -6.719 -9.393 3.014 622 HE1 MET 82 1HE MET 82 -6.838 -7.056 1.573 623 HE2 MET 82 2HE MET 82 -5.810 -7.177 0.145 624 HE3 MET 82 3HE MET 82 -6.787 -8.557 0.648 625 H GLU 83 H GLU 83 -2.745 -6.786 6.040 626 HA GLU 83 HA GLU 83 -4.124 -4.603 7.432 627 HB2 GLU 83 1HB GLU 83 -2.259 -5.793 8.591 628 HB3 GLU 83 2HB GLU 83 -1.165 -5.212 7.343 629 HG2 GLU 83 1HG GLU 83 -2.815 -3.313 8.965 630 HG3 GLU 83 2HG GLU 83 -1.279 -3.939 9.562 631 H VAL 84 H VAL 84 -3.949 -2.489 6.800 632 HA VAL 84 HA VAL 84 -2.768 -2.045 4.140 633 HB VAL 84 HB VAL 84 -4.954 -0.481 5.522 634 HG11 VAL 84 1HG1 VAL 84 -4.976 0.105 2.814 635 HG12 VAL 84 2HG1 VAL 84 -4.386 1.148 4.110 636 HG13 VAL 84 3HG1 VAL 84 -3.264 0.101 3.240 637 HG21 VAL 84 1HG2 VAL 84 -6.099 -1.482 3.304 638 HG22 VAL 84 2HG2 VAL 84 -4.964 -2.781 3.672 639 HG23 VAL 84 3HG2 VAL 84 -6.154 -2.284 4.874 640 H CYS 85 H CYS 85 -0.745 -1.310 4.486 641 HA CYS 85 HA CYS 85 -0.349 0.822 6.466 642 HB2 CYS 85 1HB CYS 85 1.074 -1.341 6.412 643 HB3 CYS 85 2HB CYS 85 1.863 -0.612 5.019 644 HG CYS 85 HG CYS 85 2.322 1.797 6.729 645 H LYS 86 H LYS 86 0.844 2.703 5.910 646 HA LYS 86 HA LYS 86 0.563 3.426 3.078 647 HB2 LYS 86 1HB LYS 86 -0.637 4.860 4.646 648 HB3 LYS 86 2HB LYS 86 0.849 5.166 5.535 649 HG2 LYS 86 1HG LYS 86 0.500 7.070 4.214 650 HG3 LYS 86 2HG LYS 86 1.765 6.155 3.391 651 HD2 LYS 86 1HD LYS 86 0.195 5.311 1.786 652 HD3 LYS 86 2HD LYS 86 -1.162 6.002 2.679 653 HE2 LYS 86 1HE LYS 86 1.039 7.760 1.667 654 HE3 LYS 86 2HE LYS 86 -0.246 7.231 0.582 655 HZ1 LYS 86 1HZ LYS 86 -0.683 9.396 1.645 656 HZ2 LYS 86 2HZ LYS 86 -0.704 8.636 3.156 657 HZ3 LYS 86 3HZ LYS 86 -1.870 8.243 1.995 658 H LEU 87 H LEU 87 2.269 4.064 1.861 659 HA LEU 87 HA LEU 87 4.904 4.146 3.177 660 HB2 LEU 87 1HB LEU 87 4.217 3.060 0.450 661 HB3 LEU 87 2HB LEU 87 5.849 3.217 1.098 662 HG LEU 87 HG LEU 87 3.713 1.474 2.320 663 HD11 LEU 87 1HD1 LEU 87 6.037 0.475 0.718 664 HD12 LEU 87 2HD1 LEU 87 4.508 0.888 -0.057 665 HD13 LEU 87 3HD1 LEU 87 4.558 -0.366 1.182 666 HD21 LEU 87 1HD2 LEU 87 6.521 0.852 2.780 667 HD22 LEU 87 2HD2 LEU 87 5.186 0.987 3.925 668 HD23 LEU 87 3HD2 LEU 87 6.049 2.434 3.403 669 HA PRO 88 HA PRO 88 4.392 8.253 1.255 670 HB2 PRO 88 1HB PRO 88 6.043 9.503 3.011 671 HB3 PRO 88 2HB PRO 88 4.340 9.178 3.357 672 HG2 PRO 88 1HG PRO 88 6.772 7.665 4.227 673 HG3 PRO 88 2HG PRO 88 5.333 8.105 5.165 674 HD2 PRO 88 1HD PRO 88 5.693 5.631 4.124 675 HD3 PRO 88 2HD PRO 88 4.087 6.366 4.307 676 H ARG 89 H ARG 89 6.883 6.033 1.479 677 HA ARG 89 HA ARG 89 9.009 7.699 0.474 678 HB2 ARG 89 1HB ARG 89 10.245 5.558 0.255 679 HB3 ARG 89 2HB ARG 89 9.589 5.813 1.866 680 HG2 ARG 89 1HG ARG 89 8.012 4.149 1.636 681 HG3 ARG 89 2HG ARG 89 8.037 4.227 -0.127 682 HD2 ARG 89 1HD ARG 89 9.208 2.291 0.203 683 HD3 ARG 89 2HD ARG 89 10.531 3.456 0.210 684 HE ARG 89 HE ARG 89 9.448 2.959 2.818 685 HH11 ARG 89 2HH1 ARG 89 11.686 1.829 0.403 686 HH12 ARG 89 1HH1 ARG 89 12.698 1.002 1.540 687 HH21 ARG 89 2HH2 ARG 89 10.773 1.874 4.325 688 HH22 ARG 89 1HH2 ARG 89 12.178 1.028 3.771 689 H LEU 90 H LEU 90 6.643 5.464 -0.842 690 HA LEU 90 HA LEU 90 7.595 6.140 -3.548 691 HB2 LEU 90 1HB LEU 90 6.185 3.625 -2.670 692 HB3 LEU 90 2HB LEU 90 6.732 3.994 -4.304 693 HG LEU 90 HG LEU 90 8.642 3.771 -1.993 694 HD11 LEU 90 1HD1 LEU 90 7.134 1.694 -2.500 695 HD12 LEU 90 2HD1 LEU 90 8.871 1.505 -2.264 696 HD13 LEU 90 3HD1 LEU 90 8.200 1.520 -3.895 697 HD21 LEU 90 1HD2 LEU 90 10.307 3.616 -3.623 698 HD22 LEU 90 2HD2 LEU 90 9.231 4.874 -4.231 699 HD23 LEU 90 3HD2 LEU 90 9.151 3.244 -4.902 700 H SER 91 H SER 91 5.486 7.270 -1.612 701 HA SER 91 HA SER 91 3.328 8.033 -1.662 702 HB2 SER 91 1HB SER 91 4.448 8.445 -4.397 703 HB3 SER 91 2HB SER 91 2.733 8.772 -4.148 704 HG SER 91 HG SER 91 4.562 9.813 -2.308 705 H LEU 92 H LEU 92 3.686 5.128 -2.044 706 HA LEU 92 HA LEU 92 1.022 4.583 -3.114 707 HB2 LEU 92 1HB LEU 92 3.586 3.514 -4.153 708 HB3 LEU 92 2HB LEU 92 2.226 2.400 -4.044 709 HG LEU 92 HG LEU 92 2.122 5.015 -5.539 710 HD11 LEU 92 1HD1 LEU 92 2.616 2.252 -6.638 711 HD12 LEU 92 2HD1 LEU 92 3.828 3.525 -6.499 712 HD13 LEU 92 3HD1 LEU 92 2.443 3.740 -7.569 713 HD21 LEU 92 1HD2 LEU 92 0.198 2.966 -4.850 714 HD22 LEU 92 2HD2 LEU 92 0.323 3.185 -6.595 715 HD23 LEU 92 3HD2 LEU 92 -0.056 4.561 -5.558 716 H ASN 93 H ASN 93 -0.093 3.448 -1.680 717 HA ASN 93 HA ASN 93 0.921 2.503 0.727 718 HB2 ASN 93 1HB ASN 93 -1.337 2.691 0.916 719 HB3 ASN 93 2HB ASN 93 -1.620 2.219 -0.757 720 HD21 ASN 93 1HD2 ASN 93 -1.507 -0.046 -1.278 721 HD22 ASN 93 2HD2 ASN 93 -1.909 -1.220 -0.075 722 H GLY 94 H GLY 94 0.677 0.148 1.470 723 HA2 GLY 94 1HA GLY 94 1.581 -1.724 -0.612 724 HA3 GLY 94 2HA GLY 94 2.552 -1.515 0.838 725 H VAL 95 H VAL 95 0.297 -3.435 -0.576 726 HA VAL 95 HA VAL 95 -0.980 -4.205 1.952 727 HB VAL 95 HB VAL 95 -1.676 -5.221 -0.800 728 HG11 VAL 95 1HG1 VAL 95 -3.929 -5.481 0.482 729 HG12 VAL 95 2HG1 VAL 95 -2.647 -6.672 0.710 730 HG13 VAL 95 3HG1 VAL 95 -2.905 -5.411 1.916 731 HG21 VAL 95 1HG2 VAL 95 -2.664 -2.792 0.669 732 HG22 VAL 95 2HG2 VAL 95 -2.022 -2.896 -0.970 733 HG23 VAL 95 3HG2 VAL 95 -3.606 -3.577 -0.598 734 H ARG 96 H ARG 96 0.010 -5.756 3.053 735 HA ARG 96 HA ARG 96 1.511 -7.810 1.580 736 HB2 ARG 96 1HB ARG 96 2.791 -8.174 3.570 737 HB3 ARG 96 2HB ARG 96 2.727 -6.440 3.289 738 HG2 ARG 96 1HG ARG 96 0.891 -6.294 4.954 739 HG3 ARG 96 2HG ARG 96 1.128 -8.009 5.297 740 HD2 ARG 96 1HD ARG 96 2.422 -7.049 6.935 741 HD3 ARG 96 2HD ARG 96 3.615 -7.288 5.659 742 HE ARG 96 HE ARG 96 2.705 -4.789 5.184 743 HH11 ARG 96 2HH1 ARG 96 3.936 -6.380 8.025 744 HH12 ARG 96 1HH1 ARG 96 4.601 -4.933 8.707 745 HH21 ARG 96 2HH2 ARG 96 3.576 -2.877 6.071 746 HH22 ARG 96 1HH2 ARG 96 4.394 -2.940 7.595 747 H PHE 97 H PHE 97 1.339 -10.019 2.238 748 HA PHE 97 HA PHE 97 -1.222 -10.645 3.554 749 HB2 PHE 97 1HB PHE 97 0.105 -11.828 1.143 750 HB3 PHE 97 2HB PHE 97 -0.953 -12.833 2.129 751 HD1 PHE 97 1HD PHE 97 -1.060 -9.328 0.840 752 HD2 PHE 97 2HD PHE 97 -3.043 -13.074 1.237 753 HE1 PHE 97 1HE PHE 97 -3.017 -8.413 -0.336 754 HE2 PHE 97 2HE PHE 97 -5.002 -12.165 0.060 755 HZ PHE 97 HZ PHE 97 -4.991 -9.832 -0.729 756 H LYS 98 H LYS 98 -1.022 -11.662 5.425 757 HA LYS 98 HA LYS 98 1.449 -13.169 5.957 758 HB2 LYS 98 1HB LYS 98 1.288 -11.439 7.548 759 HB3 LYS 98 2HB LYS 98 -0.442 -11.675 7.757 760 HG2 LYS 98 1HG LYS 98 -0.026 -13.801 8.876 761 HG3 LYS 98 2HG LYS 98 1.711 -13.581 8.654 762 HD2 LYS 98 1HD LYS 98 1.826 -11.874 10.207 763 HD3 LYS 98 2HD LYS 98 0.119 -11.463 10.035 764 HE2 LYS 98 1HE LYS 98 0.318 -12.497 12.144 765 HE3 LYS 98 2HE LYS 98 -0.385 -13.714 11.080 766 HZ1 LYS 98 1HZ LYS 98 2.020 -14.469 10.757 767 HZ2 LYS 98 2HZ LYS 98 1.264 -14.851 12.221 768 HZ3 LYS 98 3HZ LYS 98 2.363 -13.567 12.147 769 H ARG 99 H ARG 99 1.310 -15.306 6.074 770 HA ARG 99 HA ARG 99 -1.274 -16.597 6.037 771 HB2 ARG 99 1HB ARG 99 0.646 -17.357 4.628 772 HB3 ARG 99 2HB ARG 99 1.472 -17.856 6.098 773 HG2 ARG 99 1HG ARG 99 -0.142 -19.534 6.541 774 HG3 ARG 99 2HG ARG 99 -1.221 -18.915 5.290 775 HD2 ARG 99 1HD ARG 99 -0.247 -20.726 4.237 776 HD3 ARG 99 2HD ARG 99 0.772 -19.391 3.698 777 HE ARG 99 HE ARG 99 1.682 -20.781 6.070 778 HH11 ARG 99 2HH1 ARG 99 1.847 -20.496 2.605 779 HH12 ARG 99 1HH1 ARG 99 3.383 -21.289 2.482 780 HH21 ARG 99 2HH2 ARG 99 3.704 -21.827 5.922 781 HH22 ARG 99 1HH2 ARG 99 4.438 -22.047 4.369 782 H ILE 100 H ILE 100 -2.338 -16.892 7.880 783 HA ILE 100 HA ILE 100 -0.917 -17.158 10.395 784 HB ILE 100 HB ILE 100 -3.841 -16.968 9.703 785 HG12 ILE 100 1HG1 ILE 100 -2.074 -15.197 11.402 786 HG13 ILE 100 2HG1 ILE 100 -2.418 -14.907 9.700 787 HG21 ILE 100 1HG2 ILE 100 -4.256 -18.174 11.541 788 HG22 ILE 100 2HG2 ILE 100 -2.590 -18.055 12.105 789 HG23 ILE 100 3HG2 ILE 100 -3.725 -16.746 12.430 790 HD11 ILE 100 1HD1 ILE 100 -4.578 -14.275 10.105 791 HD12 ILE 100 2HD1 ILE 100 -4.687 -15.207 11.599 792 HD13 ILE 100 3HD1 ILE 100 -3.778 -13.696 11.566 793 H SER 101 H SER 101 -3.107 -19.095 8.387 794 HA SER 101 HA SER 101 -1.918 -21.530 9.358 795 HB2 SER 101 1HB SER 101 -4.766 -20.818 10.070 796 HB3 SER 101 2HB SER 101 -4.168 -22.477 10.069 797 HG SER 101 HG SER 101 -2.410 -21.136 11.431 798 H GLY 102 H GLY 102 -2.946 -23.470 8.302 799 HA2 GLY 102 1HA GLY 102 -4.252 -24.389 6.526 800 HA3 GLY 102 2HA GLY 102 -4.312 -22.795 5.789 801 H THR 103 H THR 103 -3.723 -24.748 4.120 802 HA THR 103 HA THR 103 -0.896 -25.271 3.964 803 HB THR 103 HB THR 103 -1.411 -26.363 1.821 804 HG1 THR 103 1HG THR 103 -3.374 -24.742 1.657 805 HG21 THR 103 1HG2 THR 103 -3.270 -27.935 2.797 806 HG22 THR 103 2HG2 THR 103 -3.004 -26.998 4.267 807 HG23 THR 103 3HG2 THR 103 -1.669 -27.887 3.534 808 H SER 104 H SER 104 0.565 -24.459 2.465 809 HA SER 104 HA SER 104 0.371 -21.750 1.823 810 HB2 SER 104 1HB SER 104 2.140 -23.507 0.178 811 HB3 SER 104 2HB SER 104 2.491 -21.954 0.937 812 HG SER 104 HG SER 104 3.453 -23.182 2.358 813 H ILE 105 H ILE 105 0.024 -24.592 -0.290 814 HA ILE 105 HA ILE 105 -0.337 -23.545 -2.734 815 HB ILE 105 HB ILE 105 -2.029 -25.668 -1.423 816 HG12 ILE 105 1HG1 ILE 105 0.239 -26.366 -1.604 817 HG13 ILE 105 2HG1 ILE 105 -0.614 -27.133 -2.940 818 HG21 ILE 105 1HG2 ILE 105 -2.848 -26.293 -3.592 819 HG22 ILE 105 2HG2 ILE 105 -3.222 -24.592 -3.316 820 HG23 ILE 105 3HG2 ILE 105 -1.878 -25.040 -4.366 821 HD11 ILE 105 1HD1 ILE 105 1.443 -26.348 -3.788 822 HD12 ILE 105 2HD1 ILE 105 0.199 -25.252 -4.390 823 HD13 ILE 105 3HD1 ILE 105 1.226 -24.764 -3.043 824 H ALA 106 H ALA 106 -3.142 -24.005 -0.574 825 HA ALA 106 HA ALA 106 -4.956 -22.505 -2.044 826 HB1 ALA 106 1HB ALA 106 -4.822 -23.058 0.912 827 HB2 ALA 106 2HB ALA 106 -6.191 -22.264 0.133 828 HB3 ALA 106 3HB ALA 106 -5.761 -23.916 -0.311 829 H PHE 107 H PHE 107 -2.788 -21.466 0.564 830 HA PHE 107 HA PHE 107 -3.606 -18.898 0.988 831 HB2 PHE 107 1HB PHE 107 -1.702 -20.050 2.136 832 HB3 PHE 107 2HB PHE 107 -0.709 -19.721 0.720 833 HD1 PHE 107 1HD PHE 107 -2.660 -18.101 3.417 834 HD2 PHE 107 2HD PHE 107 0.368 -17.662 0.458 835 HE1 PHE 107 1HE PHE 107 -2.075 -15.899 4.347 836 HE2 PHE 107 2HE PHE 107 0.958 -15.460 1.384 837 HZ PHE 107 HZ PHE 107 -0.263 -14.576 3.331 838 H LYS 108 H LYS 108 -1.393 -19.985 -1.573 839 HA LYS 108 HA LYS 108 -1.266 -17.370 -2.766 840 HB2 LYS 108 1HB LYS 108 -0.269 -20.077 -3.658 841 HB3 LYS 108 2HB LYS 108 -0.036 -18.607 -4.596 842 HG2 LYS 108 1HG LYS 108 1.516 -17.766 -3.158 843 HG3 LYS 108 2HG LYS 108 0.833 -18.597 -1.758 844 HD2 LYS 108 1HD LYS 108 2.789 -19.775 -2.092 845 HD3 LYS 108 2HD LYS 108 1.630 -20.749 -3.000 846 HE2 LYS 108 1HE LYS 108 3.553 -20.499 -4.371 847 HE3 LYS 108 2HE LYS 108 2.302 -19.456 -5.046 848 HZ1 LYS 108 1HZ LYS 108 4.518 -18.557 -3.285 849 HZ2 LYS 108 2HZ LYS 108 3.333 -17.565 -3.971 850 HZ3 LYS 108 3HZ LYS 108 4.455 -18.351 -4.963 851 H ASN 109 H ASN 109 -2.632 -20.509 -3.759 852 HA ASN 109 HA ASN 109 -3.742 -19.942 -6.152 853 HB2 ASN 109 1HB ASN 109 -4.647 -21.631 -3.871 854 HB3 ASN 109 2HB ASN 109 -5.782 -21.365 -5.191 855 HD21 ASN 109 1HD2 ASN 109 -2.893 -22.919 -4.175 856 HD22 ASN 109 2HD2 ASN 109 -2.622 -23.839 -5.613 857 H ILE 110 H ILE 110 -5.025 -18.962 -3.011 858 HA ILE 110 HA ILE 110 -7.306 -17.644 -4.214 859 HB ILE 110 HB ILE 110 -7.521 -18.744 -2.017 860 HG12 ILE 110 1HG1 ILE 110 -8.658 -16.849 -0.857 861 HG13 ILE 110 2HG1 ILE 110 -7.930 -15.746 -2.019 862 HG21 ILE 110 1HG2 ILE 110 -5.130 -17.915 -1.373 863 HG22 ILE 110 2HG2 ILE 110 -5.999 -16.516 -0.746 864 HG23 ILE 110 3HG2 ILE 110 -6.360 -18.127 -0.128 865 HD11 ILE 110 1HD1 ILE 110 -9.120 -16.882 -3.828 866 HD12 ILE 110 2HD1 ILE 110 -9.866 -17.960 -2.648 867 HD13 ILE 110 3HD1 ILE 110 -10.221 -16.233 -2.613 868 H ALA 111 H ALA 111 -4.141 -16.812 -3.019 869 HA ALA 111 HA ALA 111 -4.498 -14.043 -2.685 870 HB1 ALA 111 1HB ALA 111 -2.339 -14.061 -2.119 871 HB2 ALA 111 2HB ALA 111 -2.428 -15.811 -2.322 872 HB3 ALA 111 3HB ALA 111 -1.855 -14.797 -3.647 873 H SER 112 H SER 112 -3.872 -16.010 -5.514 874 HA SER 112 HA SER 112 -3.049 -14.007 -7.288 875 HB2 SER 112 1HB SER 112 -2.848 -16.382 -7.830 876 HB3 SER 112 2HB SER 112 -4.604 -16.542 -7.860 877 HG SER 112 HG SER 112 -4.527 -14.909 -9.575 878 H LYS 113 H LYS 113 -6.292 -15.218 -6.519 879 HA LYS 113 HA LYS 113 -7.677 -13.589 -8.365 880 HB2 LYS 113 1HB LYS 113 -8.775 -14.634 -5.756 881 HB3 LYS 113 2HB LYS 113 -9.672 -14.243 -7.217 882 HG2 LYS 113 1HG LYS 113 -7.568 -16.328 -7.394 883 HG3 LYS 113 2HG LYS 113 -9.075 -16.728 -6.567 884 HD2 LYS 113 1HD LYS 113 -9.657 -17.312 -8.694 885 HD3 LYS 113 2HD LYS 113 -10.123 -15.609 -8.731 886 HE2 LYS 113 1HE LYS 113 -7.837 -15.112 -9.649 887 HE3 LYS 113 2HE LYS 113 -7.596 -16.852 -9.803 888 HZ1 LYS 113 1HZ LYS 113 -10.057 -15.924 -10.965 889 HZ2 LYS 113 2HZ LYS 113 -8.867 -16.935 -11.616 890 HZ3 LYS 113 3HZ LYS 113 -8.683 -15.255 -11.692 891 H ILE 114 H ILE 114 -7.570 -13.274 -4.811 892 HA ILE 114 HA ILE 114 -8.746 -10.875 -4.446 893 HB ILE 114 HB ILE 114 -6.186 -11.728 -3.087 894 HG12 ILE 114 1HG1 ILE 114 -7.996 -13.409 -2.957 895 HG13 ILE 114 2HG1 ILE 114 -7.634 -12.704 -1.386 896 HG21 ILE 114 1HG2 ILE 114 -6.388 -9.546 -2.416 897 HG22 ILE 114 2HG2 ILE 114 -8.144 -9.546 -2.573 898 HG23 ILE 114 3HG2 ILE 114 -7.382 -10.346 -1.199 899 HD11 ILE 114 1HD1 ILE 114 -9.950 -11.980 -3.164 900 HD12 ILE 114 2HD1 ILE 114 -10.019 -12.949 -1.692 901 HD13 ILE 114 3HD1 ILE 114 -9.583 -11.242 -1.605 902 H ALA 115 H ALA 115 -5.305 -11.292 -5.265 903 HA ALA 115 HA ALA 115 -4.648 -8.574 -5.399 904 HB1 ALA 115 1HB ALA 115 -3.060 -10.531 -5.361 905 HB2 ALA 115 2HB ALA 115 -3.389 -10.725 -7.084 906 HB3 ALA 115 3HB ALA 115 -2.653 -9.237 -6.489 907 H ASN 116 H ASN 116 -5.179 -10.773 -8.164 908 HA ASN 116 HA ASN 116 -5.192 -8.970 -10.204 909 HB2 ASN 116 1HB ASN 116 -6.751 -11.498 -9.772 910 HB3 ASN 116 2HB ASN 116 -7.012 -10.540 -11.227 911 HD21 ASN 116 1HD2 ASN 116 -5.645 -13.208 -10.422 912 HD22 ASN 116 2HD2 ASN 116 -4.176 -13.168 -11.332 913 H GLU 117 H GLU 117 -8.027 -9.893 -8.257 914 HA GLU 117 HA GLU 117 -9.884 -8.217 -9.491 915 HB2 GLU 117 1HB GLU 117 -9.784 -9.110 -6.604 916 HB3 GLU 117 2HB GLU 117 -11.190 -8.423 -7.405 917 HG2 GLU 117 1HG GLU 117 -9.861 -11.060 -7.946 918 HG3 GLU 117 2HG GLU 117 -11.495 -10.764 -7.355 919 H LEU 118 H LEU 118 -7.778 -7.612 -6.700 920 HA LEU 118 HA LEU 118 -8.705 -4.907 -6.391 921 HB2 LEU 118 1HB LEU 118 -6.703 -6.656 -5.071 922 HB3 LEU 118 2HB LEU 118 -6.498 -4.913 -4.913 923 HG LEU 118 HG LEU 118 -9.148 -6.105 -4.252 924 HD11 LEU 118 1HD1 LEU 118 -7.212 -5.942 -2.039 925 HD12 LEU 118 2HD1 LEU 118 -6.991 -7.286 -3.159 926 HD13 LEU 118 3HD1 LEU 118 -8.529 -7.081 -2.319 927 HD21 LEU 118 1HD2 LEU 118 -8.292 -3.586 -4.255 928 HD22 LEU 118 2HD2 LEU 118 -7.768 -4.040 -2.633 929 HD23 LEU 118 3HD2 LEU 118 -9.468 -4.183 -3.084 930 H LYS 119 H LYS 119 -6.816 -6.313 -8.659 931 HA LYS 119 HA LYS 119 -5.297 -5.576 -10.184 932 HB2 LYS 119 1HB LYS 119 -6.657 -3.048 -9.322 933 HB3 LYS 119 2HB LYS 119 -5.292 -2.968 -10.428 934 HG2 LYS 119 1HG LYS 119 -7.065 -3.036 -11.881 935 HG3 LYS 119 2HG LYS 119 -6.631 -4.744 -11.779 936 HD2 LYS 119 1HD LYS 119 -8.502 -5.289 -10.585 937 HD3 LYS 119 2HD LYS 119 -8.618 -3.696 -9.833 938 HE2 LYS 119 1HE LYS 119 -9.657 -2.760 -11.691 939 HE3 LYS 119 2HE LYS 119 -9.090 -4.034 -12.771 940 HZ1 LYS 119 1HZ LYS 119 -11.368 -4.425 -12.421 941 HZ2 LYS 119 2HZ LYS 119 -11.249 -4.195 -10.750 942 HZ3 LYS 119 3HZ LYS 119 -10.569 -5.569 -11.465 943 H LEU 120 H LEU 120 -4.135 -6.277 -7.834 944 HA LEU 120 HA LEU 120 -2.228 -4.146 -7.186 945 HB2 LEU 120 1HB LEU 120 -2.407 -6.808 -5.817 946 HB3 LEU 120 2HB LEU 120 -1.728 -5.299 -5.207 947 HG LEU 120 HG LEU 120 -4.670 -5.657 -5.728 948 HD11 LEU 120 1HD1 LEU 120 -4.987 -6.725 -3.795 949 HD12 LEU 120 2HD1 LEU 120 -3.810 -5.725 -2.945 950 HD13 LEU 120 3HD1 LEU 120 -3.271 -7.122 -3.878 951 HD21 LEU 120 1HD2 LEU 120 -3.427 -3.812 -3.738 952 HD22 LEU 120 2HD2 LEU 120 -4.959 -3.671 -4.599 953 HD23 LEU 120 3HD2 LEU 120 -3.441 -3.372 -5.446 954 H SER 121 H SER 121 0.007 -5.322 -6.487 955 HA SER 121 HA SER 121 1.356 -5.888 -8.827 956 HB2 SER 121 1HB SER 121 1.949 -6.372 -5.936 957 HB3 SER 121 2HB SER 121 3.011 -7.087 -7.148 958 HG SER 121 HG SER 121 3.752 -5.031 -6.562 959 H GLY 122 H GLY 122 2.807 -8.137 -8.714 960 HA2 GLY 122 1HA GLY 122 1.107 -10.450 -8.319 961 HA3 GLY 122 2HA GLY 122 1.439 -10.067 -10.002 962 HA PRO 123 HA PRO 123 5.662 -11.235 -7.910 963 HB2 PRO 123 1HB PRO 123 5.467 -12.512 -5.522 964 HB3 PRO 123 2HB PRO 123 5.621 -10.757 -5.663 965 HG2 PRO 123 1HG PRO 123 3.167 -12.413 -5.221 966 HG3 PRO 123 2HG PRO 123 3.646 -10.894 -4.443 967 HD2 PRO 123 1HD PRO 123 1.838 -10.993 -6.455 968 HD3 PRO 123 2HD PRO 123 2.928 -9.611 -6.218 969 H SER 124 H SER 124 2.810 -13.024 -8.208 970 HA SER 124 HA SER 124 3.327 -15.630 -7.763 971 HB2 SER 124 1HB SER 124 1.823 -16.192 -9.524 972 HB3 SER 124 2HB SER 124 1.292 -14.627 -8.910 973 HG SER 124 HG SER 124 3.040 -14.122 -10.799 974 H SER 125 H SER 125 4.246 -17.377 -8.929 975 HA SER 125 HA SER 125 6.473 -16.563 -10.678 976 HB2 SER 125 1HB SER 125 6.237 -18.604 -8.522 977 HB3 SER 125 2HB SER 125 7.264 -18.995 -9.900 978 HG SER 125 HG SER 125 7.565 -16.470 -8.769 979 H GLY 126 H GLY 126 6.867 -17.681 -12.572 980 HA2 GLY 126 1HA GLY 126 4.787 -19.629 -13.356 981 HA3 GLY 126 2HA GLY 126 5.365 -18.380 -14.449 Start of MODEL 15 1 H1 MET 1 H MET 1 0.107 -8.520 -40.292 2 HA MET 1 HA MET 1 -1.442 -7.359 -42.514 3 HB2 MET 1 1HB MET 1 1.510 -7.889 -42.274 4 HB3 MET 1 2HB MET 1 0.729 -7.730 -43.842 5 HG2 MET 1 1HG MET 1 0.347 -5.498 -43.586 6 HG3 MET 1 2HG MET 1 0.274 -5.599 -41.828 7 HE1 MET 1 1HE MET 1 3.229 -3.194 -42.012 8 HE2 MET 1 2HE MET 1 1.530 -3.221 -42.485 9 HE3 MET 1 3HE MET 1 2.011 -3.812 -40.894 10 H LYS 2 H LYS 2 0.723 -10.085 -41.733 11 HA LYS 2 HA LYS 2 -0.677 -11.744 -43.683 12 HB2 LYS 2 1HB LYS 2 1.745 -12.371 -41.983 13 HB3 LYS 2 2HB LYS 2 1.107 -13.374 -43.280 14 HG2 LYS 2 1HG LYS 2 1.894 -11.993 -44.926 15 HG3 LYS 2 2HG LYS 2 1.870 -10.563 -43.891 16 HD2 LYS 2 1HD LYS 2 3.734 -11.762 -42.570 17 HD3 LYS 2 2HD LYS 2 3.890 -12.778 -44.006 18 HE2 LYS 2 1HE LYS 2 4.563 -10.993 -45.342 19 HE3 LYS 2 2HE LYS 2 3.906 -9.791 -44.233 20 HZ1 LYS 2 1HZ LYS 2 5.661 -10.621 -42.622 21 HZ2 LYS 2 2HZ LYS 2 6.204 -9.702 -43.934 22 HZ3 LYS 2 3HZ LYS 2 6.380 -11.384 -43.950 23 H ASP 3 H ASP 3 -2.114 -13.271 -43.162 24 HA ASP 3 HA ASP 3 -2.461 -13.914 -40.307 25 HB2 ASP 3 1HB ASP 3 -4.861 -14.419 -40.968 26 HB3 ASP 3 2HB ASP 3 -4.393 -12.722 -41.006 27 H HIS 4 H HIS 4 -0.973 -15.664 -40.495 28 HA HIS 4 HA HIS 4 -2.200 -18.145 -41.081 29 HB2 HIS 4 1HB HIS 4 -1.514 -17.206 -43.395 30 HB3 HIS 4 2HB HIS 4 0.132 -17.584 -42.895 31 HD1 HIS 4 1HD HIS 4 0.404 -19.422 -44.667 32 HD2 HIS 4 2HD HIS 4 -2.749 -20.078 -42.041 33 HE1 HIS 4 1HE HIS 4 -0.308 -21.803 -45.052 34 HE2 HIS 4 2HE HIS 4 -2.271 -22.151 -43.513 35 H LEU 5 H LEU 5 -1.121 -19.836 -40.133 36 HA LEU 5 HA LEU 5 1.409 -19.149 -38.788 37 HB2 LEU 5 1HB LEU 5 0.718 -20.917 -37.129 38 HB3 LEU 5 2HB LEU 5 -0.223 -19.427 -37.121 39 HG LEU 5 HG LEU 5 -1.469 -21.652 -36.871 40 HD11 LEU 5 1HD1 LEU 5 -2.119 -19.312 -38.540 41 HD12 LEU 5 2HD1 LEU 5 -2.967 -19.991 -37.151 42 HD13 LEU 5 3HD1 LEU 5 -3.159 -20.722 -38.744 43 HD21 LEU 5 1HD2 LEU 5 -1.228 -21.707 -39.866 44 HD22 LEU 5 2HD2 LEU 5 -1.936 -22.918 -38.796 45 HD23 LEU 5 3HD2 LEU 5 -0.189 -22.672 -38.817 46 H ILE 6 H ILE 6 2.837 -21.013 -38.326 47 HA ILE 6 HA ILE 6 2.534 -23.271 -40.157 48 HB ILE 6 HB ILE 6 5.012 -21.544 -40.087 49 HG12 ILE 6 1HG1 ILE 6 3.328 -22.091 -42.512 50 HG13 ILE 6 2HG1 ILE 6 2.879 -20.805 -41.397 51 HG21 ILE 6 1HG2 ILE 6 6.149 -23.238 -40.966 52 HG22 ILE 6 2HG2 ILE 6 4.765 -24.275 -40.621 53 HG23 ILE 6 3HG2 ILE 6 4.913 -23.497 -42.197 54 HD11 ILE 6 1HD1 ILE 6 4.906 -20.848 -43.443 55 HD12 ILE 6 2HD1 ILE 6 4.228 -19.485 -42.552 56 HD13 ILE 6 3HD1 ILE 6 5.578 -20.396 -41.877 57 H HIS 7 H HIS 7 3.355 -25.152 -39.389 58 HA HIS 7 HA HIS 7 3.775 -25.581 -36.721 59 HB2 HIS 7 1HB HIS 7 3.413 -27.342 -38.466 60 HB3 HIS 7 2HB HIS 7 5.105 -27.172 -38.922 61 HD1 HIS 7 1HD HIS 7 3.606 -29.734 -37.630 62 HD2 HIS 7 2HD HIS 7 6.229 -27.118 -35.749 63 HE1 HIS 7 1HE HIS 7 4.559 -31.017 -35.688 64 HE2 HIS 7 2HE HIS 7 6.078 -29.386 -34.516 65 H ASN 8 H ASN 8 6.386 -25.443 -39.153 66 HA ASN 8 HA ASN 8 8.258 -24.781 -36.987 67 HB2 ASN 8 1HB ASN 8 8.922 -26.740 -38.232 68 HB3 ASN 8 2HB ASN 8 8.737 -25.885 -39.761 69 HD21 ASN 8 1HD2 ASN 8 10.568 -25.913 -36.750 70 HD22 ASN 8 2HD2 ASN 8 12.015 -25.242 -37.414 71 H VAL 9 H VAL 9 8.944 -22.760 -36.803 72 HA VAL 9 HA VAL 9 8.928 -21.039 -39.196 73 HB VAL 9 HB VAL 9 8.221 -20.217 -36.376 74 HG11 VAL 9 1HG1 VAL 9 8.203 -18.030 -37.019 75 HG12 VAL 9 2HG1 VAL 9 9.494 -18.621 -38.067 76 HG13 VAL 9 3HG1 VAL 9 7.863 -18.413 -38.706 77 HG21 VAL 9 1HG2 VAL 9 6.554 -21.525 -37.904 78 HG22 VAL 9 2HG2 VAL 9 6.008 -20.104 -37.012 79 HG23 VAL 9 3HG2 VAL 9 6.397 -19.973 -38.727 80 H HIS 10 H HIS 10 11.084 -21.121 -39.657 81 HA HIS 10 HA HIS 10 13.028 -20.637 -37.540 82 HB2 HIS 10 1HB HIS 10 14.645 -20.904 -39.558 83 HB3 HIS 10 2HB HIS 10 13.802 -22.325 -38.949 84 HD1 HIS 10 1HD HIS 10 12.330 -23.563 -40.562 85 HD2 HIS 10 2HD HIS 10 13.535 -19.862 -42.015 86 HE1 HIS 10 1HE HIS 10 11.585 -23.508 -42.964 87 HE2 HIS 10 2HE HIS 10 12.401 -21.295 -43.845 88 H LYS 11 H LYS 11 12.505 -18.458 -37.075 89 HA LYS 11 HA LYS 11 13.569 -16.568 -39.060 90 HB2 LYS 11 1HB LYS 11 11.053 -16.280 -37.420 91 HB3 LYS 11 2HB LYS 11 11.844 -14.919 -38.202 92 HG2 LYS 11 1HG LYS 11 11.614 -16.220 -40.368 93 HG3 LYS 11 2HG LYS 11 10.528 -17.293 -39.482 94 HD2 LYS 11 1HD LYS 11 9.040 -15.784 -40.391 95 HD3 LYS 11 2HD LYS 11 9.345 -15.062 -38.809 96 HE2 LYS 11 1HE LYS 11 10.589 -13.345 -39.682 97 HE3 LYS 11 2HE LYS 11 11.095 -14.283 -41.087 98 HZ1 LYS 11 1HZ LYS 11 8.490 -12.954 -40.627 99 HZ2 LYS 11 2HZ LYS 11 8.708 -14.120 -41.832 100 HZ3 LYS 11 3HZ LYS 11 9.595 -12.681 -41.879 101 H GLU 12 H GLU 12 15.194 -15.405 -38.278 102 HA GLU 12 HA GLU 12 16.215 -15.643 -35.714 103 HB2 GLU 12 1HB GLU 12 17.641 -13.754 -36.242 104 HB3 GLU 12 2HB GLU 12 17.490 -14.796 -37.650 105 HG2 GLU 12 1HG GLU 12 15.670 -12.455 -37.352 106 HG3 GLU 12 2HG GLU 12 17.328 -12.212 -37.898 107 H GLU 13 H GLU 13 16.582 -13.698 -34.212 108 HA GLU 13 HA GLU 13 14.351 -11.864 -34.021 109 HB2 GLU 13 1HB GLU 13 13.853 -14.194 -32.860 110 HB3 GLU 13 2HB GLU 13 14.825 -13.498 -31.571 111 HG2 GLU 13 1HG GLU 13 13.316 -11.630 -31.380 112 HG3 GLU 13 2HG GLU 13 12.380 -12.207 -32.757 113 H HIS 14 H HIS 14 14.618 -10.350 -32.170 114 HA HIS 14 HA HIS 14 17.156 -10.206 -30.851 115 HB2 HIS 14 1HB HIS 14 18.068 -8.284 -31.912 116 HB3 HIS 14 2HB HIS 14 17.643 -9.400 -33.207 117 HD1 HIS 14 1HD HIS 14 17.606 -5.991 -32.687 118 HD2 HIS 14 2HD HIS 14 14.667 -8.654 -33.926 119 HE1 HIS 14 1HE HIS 14 15.901 -4.595 -33.899 120 HE2 HIS 14 2HE HIS 14 14.091 -6.215 -34.565 121 H ALA 15 H ALA 15 16.343 -9.736 -28.905 122 HA ALA 15 HA ALA 15 15.178 -7.163 -28.439 123 HB1 ALA 15 1HB ALA 15 13.288 -8.920 -27.237 124 HB2 ALA 15 2HB ALA 15 13.016 -7.652 -28.432 125 HB3 ALA 15 3HB ALA 15 13.392 -9.293 -28.958 126 H HIS 16 H HIS 16 15.995 -6.489 -26.574 127 HA HIS 16 HA HIS 16 16.920 -8.489 -24.635 128 HB2 HIS 16 1HB HIS 16 18.681 -7.023 -25.317 129 HB3 HIS 16 2HB HIS 16 17.674 -5.598 -25.078 130 HD1 HIS 16 1HD HIS 16 19.381 -8.313 -23.064 131 HD2 HIS 16 2HD HIS 16 17.836 -4.486 -22.589 132 HE1 HIS 16 1HE HIS 16 20.038 -7.607 -20.742 133 HE2 HIS 16 2HE HIS 16 19.019 -5.322 -20.446 134 H ALA 17 H ALA 17 16.657 -8.008 -22.336 135 HA ALA 17 HA ALA 17 14.271 -6.381 -21.764 136 HB1 ALA 17 1HB ALA 17 14.488 -9.196 -21.569 137 HB2 ALA 17 2HB ALA 17 14.395 -8.551 -19.930 138 HB3 ALA 17 3HB ALA 17 13.135 -8.166 -21.102 139 H HIS 18 H HIS 18 14.157 -5.473 -19.667 140 HA HIS 18 HA HIS 18 16.740 -4.824 -18.564 141 HB2 HIS 18 1HB HIS 18 13.927 -3.951 -17.917 142 HB3 HIS 18 2HB HIS 18 15.312 -3.443 -16.955 143 HD1 HIS 18 1HD HIS 18 15.663 -1.065 -17.563 144 HD2 HIS 18 2HD HIS 18 15.002 -3.444 -20.904 145 HE1 HIS 18 1HE HIS 18 15.990 0.451 -19.542 146 HE2 HIS 18 2HE HIS 18 15.501 -0.989 -21.550 147 H ASN 19 H ASN 19 15.142 -7.525 -18.268 148 HA ASN 19 HA ASN 19 15.210 -9.236 -16.762 149 HB2 ASN 19 1HB ASN 19 16.700 -7.405 -14.880 150 HB3 ASN 19 2HB ASN 19 16.720 -9.166 -14.918 151 HD21 ASN 19 1HD2 ASN 19 17.240 -9.872 -17.378 152 HD22 ASN 19 2HD2 ASN 19 18.725 -9.204 -17.954 153 H LYS 20 H LYS 20 12.890 -8.033 -16.867 154 HA LYS 20 HA LYS 20 12.100 -7.399 -14.105 155 HB2 LYS 20 1HB LYS 20 10.319 -6.980 -16.480 156 HB3 LYS 20 2HB LYS 20 10.326 -6.136 -14.937 157 HG2 LYS 20 1HG LYS 20 11.964 -4.697 -15.570 158 HG3 LYS 20 2HG LYS 20 12.730 -5.867 -16.648 159 HD2 LYS 20 1HD LYS 20 10.016 -4.884 -17.360 160 HD3 LYS 20 2HD LYS 20 11.376 -3.779 -17.570 161 HE2 LYS 20 1HE LYS 20 12.499 -5.754 -18.792 162 HE3 LYS 20 2HE LYS 20 10.872 -6.426 -18.884 163 HZ1 LYS 20 1HZ LYS 20 11.022 -3.673 -19.696 164 HZ2 LYS 20 2HZ LYS 20 10.299 -4.990 -20.472 165 HZ3 LYS 20 3HZ LYS 20 11.955 -4.701 -20.663 166 H ASP 21 H ASP 21 12.469 -10.071 -15.637 167 HA ASP 21 HA ASP 21 9.962 -11.245 -14.659 168 HB2 ASP 21 1HB ASP 21 10.137 -10.947 -17.245 169 HB3 ASP 21 2HB ASP 21 11.246 -12.312 -17.152 170 H TYR 22 H TYR 22 11.121 -11.901 -12.807 171 HA TYR 22 HA TYR 22 12.925 -14.175 -13.295 172 HB2 TYR 22 1HB TYR 22 13.924 -13.401 -10.983 173 HB3 TYR 22 2HB TYR 22 14.471 -12.668 -12.486 174 HD1 TYR 22 2HD TYR 22 12.895 -10.585 -13.223 175 HD2 TYR 22 1HD TYR 22 13.515 -11.954 -9.243 176 HE1 TYR 22 2HE TYR 22 12.279 -8.362 -12.369 177 HE2 TYR 22 1HE TYR 22 12.900 -9.736 -8.377 178 HH TYR 22 HH TYR 22 12.025 -7.733 -8.900 179 H ASP 23 H ASP 23 13.212 -15.382 -11.052 180 HA ASP 23 HA ASP 23 10.572 -16.291 -10.348 181 HB2 ASP 23 1HB ASP 23 12.520 -17.831 -10.650 182 HB3 ASP 23 2HB ASP 23 13.230 -17.149 -9.190 183 H ILE 24 H ILE 24 9.735 -14.395 -9.335 184 HA ILE 24 HA ILE 24 10.863 -13.048 -7.180 185 HB ILE 24 HB ILE 24 7.907 -13.497 -7.271 186 HG12 ILE 24 1HG1 ILE 24 8.334 -13.220 -9.587 187 HG13 ILE 24 2HG1 ILE 24 7.853 -11.629 -9.006 188 HG21 ILE 24 1HG2 ILE 24 8.719 -12.060 -5.538 189 HG22 ILE 24 2HG2 ILE 24 9.684 -11.136 -6.688 190 HG23 ILE 24 3HG2 ILE 24 7.923 -11.059 -6.752 191 HD11 ILE 24 1HD1 ILE 24 10.735 -12.408 -9.222 192 HD12 ILE 24 2HD1 ILE 24 9.834 -11.772 -10.599 193 HD13 ILE 24 3HD1 ILE 24 10.024 -10.797 -9.142 194 HA PRO 25 HA PRO 25 10.733 -16.000 -3.900 195 HB2 PRO 25 1HB PRO 25 11.027 -14.272 -1.827 196 HB3 PRO 25 2HB PRO 25 12.358 -14.720 -2.900 197 HG2 PRO 25 1HG PRO 25 10.637 -12.271 -2.938 198 HG3 PRO 25 2HG PRO 25 12.392 -12.409 -3.156 199 HD2 PRO 25 1HD PRO 25 10.683 -12.126 -5.237 200 HD3 PRO 25 2HD PRO 25 12.193 -13.050 -5.362 201 H THR 26 H THR 26 8.816 -16.936 -3.504 202 HA THR 26 HA THR 26 6.473 -15.391 -2.836 203 HB THR 26 HB THR 26 5.300 -17.535 -2.748 204 HG1 THR 26 1HG THR 26 7.184 -18.697 -1.868 205 HG21 THR 26 1HG2 THR 26 6.503 -18.327 -5.123 206 HG22 THR 26 2HG2 THR 26 6.832 -16.597 -5.025 207 HG23 THR 26 3HG2 THR 26 5.171 -17.185 -4.951 208 H THR 27 H THR 27 8.513 -15.022 -0.952 209 HA THR 27 HA THR 27 8.695 -16.512 1.283 210 HB THR 27 HB THR 27 8.145 -13.543 1.394 211 HG1 THR 27 1HG THR 27 10.042 -13.266 0.501 212 HG21 THR 27 1HG2 THR 27 10.087 -14.099 3.226 213 HG22 THR 27 2HG2 THR 27 9.093 -15.553 3.312 214 HG23 THR 27 3HG2 THR 27 8.367 -13.971 3.594 215 H GLU 28 H GLU 28 7.573 -16.695 3.274 216 HA GLU 28 HA GLU 28 5.001 -17.436 3.274 217 HB2 GLU 28 1HB GLU 28 6.789 -17.188 5.231 218 HB3 GLU 28 2HB GLU 28 5.797 -15.792 5.626 219 HG2 GLU 28 1HG GLU 28 3.858 -17.588 5.350 220 HG3 GLU 28 2HG GLU 28 5.171 -18.676 5.795 221 H ASN 29 H ASN 29 6.083 -14.094 3.793 222 HA ASN 29 HA ASN 29 3.313 -13.171 3.646 223 HB2 ASN 29 1HB ASN 29 5.756 -11.467 4.128 224 HB3 ASN 29 2HB ASN 29 4.080 -11.094 4.518 225 HD21 ASN 29 1HD2 ASN 29 6.741 -13.271 5.292 226 HD22 ASN 29 2HD2 ASN 29 6.272 -13.552 6.931 227 H LEU 30 H LEU 30 2.480 -12.180 1.913 228 HA LEU 30 HA LEU 30 4.265 -11.699 -0.370 229 HB2 LEU 30 1HB LEU 30 1.359 -12.357 -0.120 230 HB3 LEU 30 2HB LEU 30 1.964 -11.565 -1.574 231 HG LEU 30 HG LEU 30 1.738 -14.015 -1.809 232 HD11 LEU 30 1HD1 LEU 30 3.978 -12.385 -2.457 233 HD12 LEU 30 2HD1 LEU 30 3.315 -13.758 -3.342 234 HD13 LEU 30 3HD1 LEU 30 4.549 -14.017 -2.109 235 HD21 LEU 30 1HD2 LEU 30 2.556 -14.268 0.692 236 HD22 LEU 30 2HD2 LEU 30 4.129 -14.423 -0.091 237 HD23 LEU 30 3HD2 LEU 30 2.825 -15.538 -0.503 238 H TYR 31 H TYR 31 3.693 -9.849 -1.788 239 HA TYR 31 HA TYR 31 2.496 -7.602 -0.323 240 HB2 TYR 31 1HB TYR 31 4.949 -7.153 -1.986 241 HB3 TYR 31 2HB TYR 31 4.299 -6.174 -0.676 242 HD1 TYR 31 1HD TYR 31 4.289 -7.371 1.685 243 HD2 TYR 31 2HD TYR 31 6.813 -8.452 -1.565 244 HE1 TYR 31 1HE TYR 31 5.852 -8.432 3.260 245 HE2 TYR 31 2HE TYR 31 8.382 -9.517 0.000 246 HH TYR 31 HH TYR 31 7.595 -10.088 3.290 247 H PHE 32 H PHE 32 1.476 -6.058 -1.583 248 HA PHE 32 HA PHE 32 1.560 -6.268 -4.475 249 HB2 PHE 32 1HB PHE 32 -1.095 -6.556 -3.064 250 HB3 PHE 32 2HB PHE 32 -0.772 -6.699 -4.789 251 HD1 PHE 32 1HD PHE 32 -0.196 -8.305 -1.510 252 HD2 PHE 32 2HD PHE 32 -0.156 -8.753 -5.742 253 HE1 PHE 32 1HE PHE 32 0.100 -10.734 -1.246 254 HE2 PHE 32 2HE PHE 32 0.139 -11.182 -5.486 255 HZ PHE 32 HZ PHE 32 0.267 -12.176 -3.236 256 H GLN 33 H GLN 33 0.958 -4.397 -5.511 257 HA GLN 33 HA GLN 33 0.040 -2.183 -3.801 258 HB2 GLN 33 1HB GLN 33 1.561 -0.677 -4.805 259 HB3 GLN 33 2HB GLN 33 2.504 -2.107 -4.408 260 HG2 GLN 33 1HG GLN 33 2.675 -2.765 -6.631 261 HG3 GLN 33 2HG GLN 33 1.320 -1.755 -7.132 262 HE21 GLN 33 1HE2 GLN 33 2.314 -0.561 -8.663 263 HE22 GLN 33 2HE2 GLN 33 3.628 0.516 -8.354 264 H GLY 34 H GLY 34 -1.435 -0.773 -4.676 265 HA2 GLY 34 1HA GLY 34 -2.114 -0.117 -7.175 266 HA3 GLY 34 2HA GLY 34 -2.806 -1.729 -7.058 267 H SER 35 H SER 35 -2.645 1.136 -4.936 268 HA SER 35 HA SER 35 -5.231 0.648 -3.847 269 HB2 SER 35 1HB SER 35 -3.498 1.836 -2.575 270 HB3 SER 35 2HB SER 35 -3.527 3.150 -3.750 271 HG SER 35 HG SER 35 -5.151 2.711 -1.640 272 H SER 36 H SER 36 -7.161 1.746 -4.185 273 HA SER 36 HA SER 36 -7.378 3.017 -6.819 274 HB2 SER 36 1HB SER 36 -8.814 1.024 -6.264 275 HB3 SER 36 2HB SER 36 -9.621 2.018 -5.051 276 HG SER 36 HG SER 36 -9.932 3.517 -6.952 277 H GLY 37 H GLY 37 -6.270 4.568 -4.766 278 HA2 GLY 37 1HA GLY 37 -7.104 7.011 -4.902 279 HA3 GLY 37 2HA GLY 37 -8.452 6.374 -3.973 280 H SER 38 H SER 38 -8.241 6.076 -1.805 281 HA SER 38 HA SER 38 -5.703 6.985 -0.631 282 HB2 SER 38 1HB SER 38 -8.531 7.026 0.433 283 HB3 SER 38 2HB SER 38 -7.123 7.391 1.429 284 HG SER 38 HG SER 38 -8.249 9.216 0.363 285 H SER 39 H SER 39 -5.368 6.054 1.665 286 HA SER 39 HA SER 39 -4.850 3.317 1.436 287 HB2 SER 39 1HB SER 39 -5.101 4.950 3.974 288 HB3 SER 39 2HB SER 39 -4.286 3.394 3.821 289 HG SER 39 HG SER 39 -3.374 5.879 3.241 290 H GLY 40 H GLY 40 -7.590 5.045 2.802 291 HA2 GLY 40 1HA GLY 40 -8.806 2.929 4.180 292 HA3 GLY 40 2HA GLY 40 -9.646 4.323 3.517 293 H ASP 41 H ASP 41 -9.596 4.136 0.916 294 HA ASP 41 HA ASP 41 -11.516 2.482 0.085 295 HB2 ASP 41 1HB ASP 41 -9.029 3.302 -1.409 296 HB3 ASP 41 2HB ASP 41 -10.337 2.412 -2.184 297 H MET 42 H MET 42 -8.074 1.561 0.046 298 HA MET 42 HA MET 42 -8.094 -0.919 -0.978 299 HB2 MET 42 1HB MET 42 -6.620 0.248 1.337 300 HB3 MET 42 2HB MET 42 -6.472 -1.480 1.045 301 HG2 MET 42 1HG MET 42 -6.075 0.339 -1.258 302 HG3 MET 42 2HG MET 42 -4.820 0.290 -0.022 303 HE1 MET 42 1HE MET 42 -5.444 -1.597 -3.529 304 HE2 MET 42 2HE MET 42 -6.309 -2.945 -2.789 305 HE3 MET 42 3HE MET 42 -6.880 -1.293 -2.551 306 H MET 43 H MET 43 -8.727 -0.334 2.488 307 HA MET 43 HA MET 43 -9.398 -2.865 3.273 308 HB2 MET 43 1HB MET 43 -10.767 -0.316 4.148 309 HB3 MET 43 2HB MET 43 -10.780 -1.840 5.025 310 HG2 MET 43 1HG MET 43 -8.230 -1.629 5.047 311 HG3 MET 43 2HG MET 43 -8.501 0.049 4.584 312 HE1 MET 43 1HE MET 43 -10.228 -2.339 7.704 313 HE2 MET 43 2HE MET 43 -8.682 -2.694 6.934 314 HE3 MET 43 3HE MET 43 -8.720 -1.949 8.533 315 H ARG 44 H ARG 44 -11.531 -0.476 1.749 316 HA ARG 44 HA ARG 44 -13.861 -2.088 1.834 317 HB2 ARG 44 1HB ARG 44 -13.077 0.322 0.208 318 HB3 ARG 44 2HB ARG 44 -14.625 -0.482 -0.016 319 HG2 ARG 44 1HG ARG 44 -15.036 1.311 1.442 320 HG3 ARG 44 2HG ARG 44 -15.013 -0.132 2.458 321 HD2 ARG 44 1HD ARG 44 -12.943 0.395 3.375 322 HD3 ARG 44 2HD ARG 44 -12.525 1.480 2.049 323 HE ARG 44 HE ARG 44 -14.724 2.594 3.292 324 HH11 ARG 44 2HH1 ARG 44 -11.467 1.728 4.167 325 HH12 ARG 44 1HH1 ARG 44 -11.320 2.971 5.365 326 HH21 ARG 44 2HH2 ARG 44 -14.542 4.234 4.866 327 HH22 ARG 44 1HH2 ARG 44 -13.070 4.396 5.763 328 H GLU 45 H GLU 45 -11.912 -1.148 -1.007 329 HA GLU 45 HA GLU 45 -12.972 -2.786 -2.893 330 HB2 GLU 45 1HB GLU 45 -10.895 -1.140 -2.920 331 HB3 GLU 45 2HB GLU 45 -9.994 -2.643 -2.784 332 HG2 GLU 45 1HG GLU 45 -10.606 -3.365 -4.864 333 HG3 GLU 45 2HG GLU 45 -12.104 -2.436 -4.867 334 H ILE 46 H ILE 46 -10.260 -3.693 -0.762 335 HA ILE 46 HA ILE 46 -9.850 -6.276 -1.566 336 HB ILE 46 HB ILE 46 -9.803 -5.265 1.280 337 HG12 ILE 46 1HG1 ILE 46 -7.414 -5.643 -0.501 338 HG13 ILE 46 2HG1 ILE 46 -8.362 -4.163 -0.592 339 HG21 ILE 46 1HG2 ILE 46 -8.346 -7.638 0.135 340 HG22 ILE 46 2HG2 ILE 46 -8.432 -7.134 1.822 341 HG23 ILE 46 3HG2 ILE 46 -9.870 -7.756 1.014 342 HD11 ILE 46 1HD1 ILE 46 -6.651 -5.185 1.617 343 HD12 ILE 46 2HD1 ILE 46 -6.726 -3.576 0.897 344 HD13 ILE 46 3HD1 ILE 46 -8.003 -4.115 1.987 345 H ARG 47 H ARG 47 -11.849 -5.482 1.282 346 HA ARG 47 HA ARG 47 -12.995 -7.897 1.752 347 HB2 ARG 47 1HB ARG 47 -14.149 -5.128 1.974 348 HB3 ARG 47 2HB ARG 47 -15.070 -6.544 2.464 349 HG2 ARG 47 1HG ARG 47 -13.341 -7.128 4.076 350 HG3 ARG 47 2HG ARG 47 -12.390 -5.730 3.570 351 HD2 ARG 47 1HD ARG 47 -15.196 -5.495 4.627 352 HD3 ARG 47 2HD ARG 47 -13.779 -5.459 5.675 353 HE ARG 47 HE ARG 47 -13.238 -3.565 3.812 354 HH11 ARG 47 2HH1 ARG 47 -15.935 -4.164 5.930 355 HH12 ARG 47 1HH1 ARG 47 -16.360 -2.490 6.077 356 HH21 ARG 47 2HH2 ARG 47 -13.787 -1.359 3.997 357 HH22 ARG 47 1HH2 ARG 47 -15.137 -0.896 4.976 358 H LYS 48 H LYS 48 -13.995 -5.549 -0.692 359 HA LYS 48 HA LYS 48 -16.365 -6.579 -1.569 360 HB2 LYS 48 1HB LYS 48 -14.989 -4.576 -2.453 361 HB3 LYS 48 2HB LYS 48 -14.254 -5.745 -3.542 362 HG2 LYS 48 1HG LYS 48 -17.223 -5.579 -3.399 363 HG3 LYS 48 2HG LYS 48 -16.331 -4.337 -4.279 364 HD2 LYS 48 1HD LYS 48 -15.896 -7.273 -4.762 365 HD3 LYS 48 2HD LYS 48 -17.137 -6.352 -5.615 366 HE2 LYS 48 1HE LYS 48 -15.425 -4.826 -6.460 367 HE3 LYS 48 2HE LYS 48 -14.184 -5.729 -5.592 368 HZ1 LYS 48 1HZ LYS 48 -14.925 -7.707 -6.932 369 HZ2 LYS 48 2HZ LYS 48 -14.134 -6.490 -7.801 370 HZ3 LYS 48 3HZ LYS 48 -15.817 -6.635 -7.891 371 H VAL 49 H VAL 49 -13.168 -7.534 -2.836 372 HA VAL 49 HA VAL 49 -13.984 -9.559 -4.529 373 HB VAL 49 HB VAL 49 -11.461 -9.532 -2.867 374 HG11 VAL 49 1HG1 VAL 49 -12.306 -11.094 -5.287 375 HG12 VAL 49 2HG1 VAL 49 -10.604 -10.821 -4.905 376 HG13 VAL 49 3HG1 VAL 49 -11.637 -11.686 -3.766 377 HG21 VAL 49 1HG2 VAL 49 -11.988 -7.493 -4.317 378 HG22 VAL 49 2HG2 VAL 49 -10.427 -8.278 -4.557 379 HG23 VAL 49 3HG2 VAL 49 -11.742 -8.565 -5.696 380 H LEU 50 H LEU 50 -13.215 -9.756 -1.071 381 HA LEU 50 HA LEU 50 -13.356 -12.462 -0.650 382 HB2 LEU 50 1HB LEU 50 -14.542 -10.364 1.158 383 HB3 LEU 50 2HB LEU 50 -14.011 -11.978 1.626 384 HG LEU 50 HG LEU 50 -12.250 -9.704 0.712 385 HD11 LEU 50 1HD1 LEU 50 -13.311 -9.736 3.068 386 HD12 LEU 50 2HD1 LEU 50 -11.577 -9.458 2.914 387 HD13 LEU 50 3HD1 LEU 50 -12.176 -11.049 3.384 388 HD21 LEU 50 1HD2 LEU 50 -10.700 -11.214 0.231 389 HD22 LEU 50 2HD2 LEU 50 -11.815 -12.519 0.637 390 HD23 LEU 50 3HD2 LEU 50 -10.784 -11.819 1.886 391 H GLY 51 H GLY 51 -16.125 -10.248 -0.194 392 HA2 GLY 51 1HA GLY 51 -18.129 -12.048 0.209 393 HA3 GLY 51 2HA GLY 51 -18.360 -10.550 -0.681 394 H ALA 52 H ALA 52 -16.773 -11.123 -2.929 395 HA ALA 52 HA ALA 52 -18.602 -12.498 -4.547 396 HB1 ALA 52 1HB ALA 52 -15.877 -11.398 -4.897 397 HB2 ALA 52 2HB ALA 52 -16.418 -12.592 -6.077 398 HB3 ALA 52 3HB ALA 52 -17.347 -11.114 -5.830 399 H ASN 53 H ASN 53 -15.653 -13.566 -2.937 400 HA ASN 53 HA ASN 53 -16.035 -16.268 -4.011 401 HB2 ASN 53 1HB ASN 53 -13.706 -14.825 -2.793 402 HB3 ASN 53 2HB ASN 53 -13.748 -16.586 -2.774 403 HD21 ASN 53 1HD2 ASN 53 -14.307 -13.899 -5.025 404 HD22 ASN 53 2HD2 ASN 53 -13.504 -14.634 -6.367 405 H ASN 54 H ASN 54 -17.905 -15.399 -2.125 406 HA ASN 54 HA ASN 54 -18.741 -15.775 -0.009 407 HB2 ASN 54 1HB ASN 54 -17.700 -18.481 -0.868 408 HB3 ASN 54 2HB ASN 54 -18.782 -18.238 0.501 409 HD21 ASN 54 1HD2 ASN 54 -20.421 -19.447 -0.406 410 HD22 ASN 54 2HD2 ASN 54 -21.353 -18.890 -1.750 411 H CYS 55 H CYS 55 -16.240 -14.621 0.249 412 HA CYS 55 HA CYS 55 -14.938 -16.167 2.383 413 HB2 CYS 55 1HB CYS 55 -13.959 -13.900 0.648 414 HB3 CYS 55 2HB CYS 55 -13.084 -14.450 2.072 415 HG CYS 55 HG CYS 55 -13.702 -16.244 -0.772 416 H ASP 56 H ASP 56 -14.662 -15.329 4.418 417 HA ASP 56 HA ASP 56 -16.296 -12.970 5.036 418 HB2 ASP 56 1HB ASP 56 -16.745 -15.201 6.167 419 HB3 ASP 56 2HB ASP 56 -15.211 -14.985 7.005 420 H TYR 57 H TYR 57 -15.517 -11.474 6.679 421 HA TYR 57 HA TYR 57 -12.615 -11.406 7.037 422 HB2 TYR 57 1HB TYR 57 -12.791 -8.871 6.493 423 HB3 TYR 57 2HB TYR 57 -12.702 -10.022 5.164 424 HD1 TYR 57 2HD TYR 57 -14.849 -10.682 3.995 425 HD2 TYR 57 1HD TYR 57 -14.629 -7.416 6.714 426 HE1 TYR 57 2HE TYR 57 -16.937 -9.774 3.064 427 HE2 TYR 57 1HE TYR 57 -16.717 -6.500 5.792 428 HH TYR 57 HH TYR 57 -18.788 -7.537 4.544 429 H GLU 58 H GLU 58 -11.940 -10.416 8.904 430 HA GLU 58 HA GLU 58 -14.019 -9.235 10.617 431 HB2 GLU 58 1HB GLU 58 -13.460 -11.610 11.250 432 HB3 GLU 58 2HB GLU 58 -11.831 -11.059 11.615 433 HG2 GLU 58 1HG GLU 58 -12.499 -9.867 13.466 434 HG3 GLU 58 2HG GLU 58 -14.160 -9.715 12.899 435 H GLN 59 H GLN 59 -13.449 -7.144 10.645 436 HA GLN 59 HA GLN 59 -10.815 -6.171 10.421 437 HB2 GLN 59 1HB GLN 59 -13.182 -5.009 10.135 438 HB3 GLN 59 2HB GLN 59 -12.899 -4.550 11.809 439 HG2 GLN 59 1HG GLN 59 -10.598 -3.739 10.923 440 HG3 GLN 59 2HG GLN 59 -11.399 -3.767 9.352 441 HE21 GLN 59 1HE2 GLN 59 -10.625 -1.409 9.862 442 HE22 GLN 59 2HE2 GLN 59 -11.859 -0.377 10.492 443 H ARG 60 H ARG 60 -9.236 -6.348 11.854 444 HA ARG 60 HA ARG 60 -9.876 -6.720 14.678 445 HB2 ARG 60 1HB ARG 60 -7.288 -7.002 13.144 446 HB3 ARG 60 2HB ARG 60 -7.434 -7.243 14.879 447 HG2 ARG 60 1HG ARG 60 -9.250 -8.788 13.118 448 HG3 ARG 60 2HG ARG 60 -7.547 -9.249 13.163 449 HD2 ARG 60 1HD ARG 60 -8.551 -10.552 14.828 450 HD3 ARG 60 2HD ARG 60 -7.792 -9.225 15.705 451 HE ARG 60 HE ARG 60 -10.654 -9.645 15.306 452 HH11 ARG 60 2HH1 ARG 60 -8.068 -7.698 16.588 453 HH12 ARG 60 1HH1 ARG 60 -9.098 -6.797 17.651 454 HH21 ARG 60 2HH2 ARG 60 -12.020 -8.466 16.701 455 HH22 ARG 60 1HH2 ARG 60 -11.346 -7.236 17.715 456 H GLU 61 H GLU 61 -8.263 -4.472 12.519 457 HA GLU 61 HA GLU 61 -8.191 -2.516 14.700 458 HB2 GLU 61 1HB GLU 61 -5.886 -2.962 12.796 459 HB3 GLU 61 2HB GLU 61 -5.959 -1.777 14.093 460 HG2 GLU 61 1HG GLU 61 -6.227 -4.698 14.671 461 HG3 GLU 61 2HG GLU 61 -4.643 -3.954 14.463 462 H ARG 62 H ARG 62 -7.244 -0.340 13.516 463 HA ARG 62 HA ARG 62 -9.351 0.555 11.904 464 HB2 ARG 62 1HB ARG 62 -8.139 2.175 13.141 465 HB3 ARG 62 2HB ARG 62 -6.605 1.665 12.448 466 HG2 ARG 62 1HG ARG 62 -6.926 2.830 10.519 467 HG3 ARG 62 2HG ARG 62 -8.684 2.695 10.600 468 HD2 ARG 62 1HD ARG 62 -8.431 4.909 11.112 469 HD3 ARG 62 2HD ARG 62 -8.363 4.211 12.730 470 HE ARG 62 HE ARG 62 -5.789 4.462 11.481 471 HH11 ARG 62 2HH1 ARG 62 -8.226 6.092 13.359 472 HH12 ARG 62 1HH1 ARG 62 -7.116 7.225 14.056 473 HH21 ARG 62 2HH2 ARG 62 -4.318 5.948 12.392 474 HH22 ARG 62 1HH2 ARG 62 -4.894 7.143 13.504 475 H PHE 63 H PHE 63 -6.034 -0.377 11.039 476 HA PHE 63 HA PHE 63 -6.891 -0.490 8.222 477 HB2 PHE 63 1HB PHE 63 -4.134 -0.005 9.370 478 HB3 PHE 63 2HB PHE 63 -4.481 -0.206 7.656 479 HD1 PHE 63 2HD PHE 63 -6.368 1.412 6.741 480 HD2 PHE 63 1HD PHE 63 -3.998 2.124 10.205 481 HE1 PHE 63 2HE PHE 63 -6.820 3.823 6.551 482 HE2 PHE 63 1HE PHE 63 -4.447 4.536 10.020 483 HZ PHE 63 HZ PHE 63 -5.858 5.389 8.190 484 H LEU 64 H LEU 64 -7.422 -2.616 9.954 485 HA LEU 64 HA LEU 64 -5.729 -4.689 8.758 486 HB2 LEU 64 1HB LEU 64 -5.010 -4.201 11.109 487 HB3 LEU 64 2HB LEU 64 -6.603 -4.736 11.640 488 HG LEU 64 HG LEU 64 -4.669 -6.492 10.137 489 HD11 LEU 64 1HD1 LEU 64 -4.746 -7.475 12.666 490 HD12 LEU 64 2HD1 LEU 64 -4.783 -5.738 12.968 491 HD13 LEU 64 3HD1 LEU 64 -3.467 -6.441 12.028 492 HD21 LEU 64 1HD2 LEU 64 -6.494 -7.757 9.938 493 HD22 LEU 64 2HD2 LEU 64 -7.412 -6.755 11.062 494 HD23 LEU 64 3HD2 LEU 64 -6.362 -8.033 11.675 495 H LEU 65 H LEU 65 -6.759 -6.643 8.341 496 HA LEU 65 HA LEU 65 -9.522 -7.011 9.141 497 HB2 LEU 65 1HB LEU 65 -8.672 -6.396 6.347 498 HB3 LEU 65 2HB LEU 65 -10.019 -7.501 6.618 499 HG LEU 65 HG LEU 65 -9.993 -4.752 7.823 500 HD11 LEU 65 1HD1 LEU 65 -10.772 -5.556 5.035 501 HD12 LEU 65 2HD1 LEU 65 -9.697 -4.254 5.542 502 HD13 LEU 65 3HD1 LEU 65 -11.432 -4.128 5.831 503 HD21 LEU 65 1HD2 LEU 65 -12.316 -5.055 8.026 504 HD22 LEU 65 2HD2 LEU 65 -11.601 -6.585 8.537 505 HD23 LEU 65 3HD2 LEU 65 -12.315 -6.437 6.930 506 H PHE 66 H PHE 66 -9.744 -9.070 9.685 507 HA PHE 66 HA PHE 66 -7.773 -11.019 8.883 508 HB2 PHE 66 1HB PHE 66 -8.846 -10.823 11.200 509 HB3 PHE 66 2HB PHE 66 -10.268 -11.572 10.481 510 HD1 PHE 66 1HD PHE 66 -9.763 -13.792 9.139 511 HD2 PHE 66 2HD PHE 66 -7.297 -12.178 12.210 512 HE1 PHE 66 1HE PHE 66 -8.784 -16.018 9.518 513 HE2 PHE 66 2HE PHE 66 -6.314 -14.401 12.593 514 HZ PHE 66 HZ PHE 66 -7.057 -16.324 11.246 515 H CYS 67 H CYS 67 -8.038 -11.455 6.724 516 HA CYS 67 HA CYS 67 -10.647 -12.134 5.670 517 HB2 CYS 67 1HB CYS 67 -7.908 -12.149 4.385 518 HB3 CYS 67 2HB CYS 67 -9.415 -12.468 3.535 519 HG CYS 67 HG CYS 67 -8.523 -9.507 5.001 520 H VAL 68 H VAL 68 -11.356 -14.141 5.078 521 HA VAL 68 HA VAL 68 -9.586 -16.436 5.291 522 HB VAL 68 HB VAL 68 -10.326 -16.276 7.575 523 HG11 VAL 68 1HG1 VAL 68 -12.243 -15.237 8.014 524 HG12 VAL 68 2HG1 VAL 68 -12.804 -15.440 6.353 525 HG13 VAL 68 3HG1 VAL 68 -13.075 -16.717 7.538 526 HG21 VAL 68 1HG2 VAL 68 -10.202 -18.512 7.145 527 HG22 VAL 68 2HG2 VAL 68 -11.913 -18.402 7.557 528 HG23 VAL 68 3HG2 VAL 68 -11.414 -18.447 5.866 529 H HIS 69 H HIS 69 -10.084 -17.934 3.815 530 HA HIS 69 HA HIS 69 -12.597 -17.616 2.337 531 HB2 HIS 69 1HB HIS 69 -10.734 -17.515 0.874 532 HB3 HIS 69 2HB HIS 69 -9.961 -18.901 1.638 533 HD1 HIS 69 1HD HIS 69 -10.018 -20.835 0.118 534 HD2 HIS 69 2HD HIS 69 -13.473 -18.548 -0.184 535 HE1 HIS 69 1HE HIS 69 -11.458 -22.014 -1.573 536 HE2 HIS 69 2HE HIS 69 -13.506 -20.566 -1.803 537 H GLY 70 H GLY 70 -14.202 -19.008 2.646 538 HA2 GLY 70 1HA GLY 70 -13.540 -21.654 3.787 539 HA3 GLY 70 2HA GLY 70 -14.997 -20.760 4.195 540 H ASP 71 H ASP 71 -13.314 -22.014 1.313 541 HA ASP 71 HA ASP 71 -15.282 -22.056 -0.530 542 HB2 ASP 71 1HB ASP 71 -12.864 -23.096 -0.541 543 HB3 ASP 71 2HB ASP 71 -13.727 -24.589 -0.182 544 H GLY 72 H GLY 72 -14.865 -24.493 2.027 545 HA2 GLY 72 1HA GLY 72 -17.726 -25.007 1.975 546 HA3 GLY 72 2HA GLY 72 -16.706 -26.364 1.521 547 H HIS 73 H HIS 73 -14.601 -26.119 3.257 548 HA HIS 73 HA HIS 73 -15.644 -25.896 5.955 549 HB2 HIS 73 1HB HIS 73 -15.003 -28.498 4.644 550 HB3 HIS 73 2HB HIS 73 -14.572 -28.293 6.339 551 HD1 HIS 73 1HD HIS 73 -16.367 -28.802 7.970 552 HD2 HIS 73 2HD HIS 73 -17.886 -27.989 4.189 553 HE1 HIS 73 1HE HIS 73 -18.840 -29.230 8.132 554 HE2 HIS 73 2HE HIS 73 -19.724 -28.814 5.811 555 H ALA 74 H ALA 74 -13.723 -26.917 7.454 556 HA ALA 74 HA ALA 74 -11.626 -25.099 7.310 557 HB1 ALA 74 1HB ALA 74 -10.732 -27.457 8.652 558 HB2 ALA 74 2HB ALA 74 -11.233 -25.910 9.337 559 HB3 ALA 74 3HB ALA 74 -12.428 -27.173 9.042 560 H GLU 75 H GLU 75 -11.808 -28.434 6.136 561 HA GLU 75 HA GLU 75 -9.239 -28.995 5.465 562 HB2 GLU 75 1HB GLU 75 -11.455 -30.296 4.999 563 HB3 GLU 75 2HB GLU 75 -11.383 -29.503 3.432 564 HG2 GLU 75 1HG GLU 75 -8.911 -30.444 3.482 565 HG3 GLU 75 2HG GLU 75 -9.648 -31.615 4.574 566 H ASN 76 H ASN 76 -11.487 -27.014 3.561 567 HA ASN 76 HA ASN 76 -9.220 -26.150 1.896 568 HB2 ASN 76 1HB ASN 76 -10.950 -25.404 0.272 569 HB3 ASN 76 2HB ASN 76 -11.011 -27.135 0.592 570 HD21 ASN 76 1HD2 ASN 76 -13.057 -27.713 0.428 571 HD22 ASN 76 2HD2 ASN 76 -14.393 -26.934 1.198 572 H LEU 77 H LEU 77 -9.615 -25.098 4.509 573 HA LEU 77 HA LEU 77 -10.560 -22.368 3.953 574 HB2 LEU 77 1HB LEU 77 -11.612 -23.641 5.831 575 HB3 LEU 77 2HB LEU 77 -10.044 -23.637 6.636 576 HG LEU 77 HG LEU 77 -10.317 -21.010 6.294 577 HD11 LEU 77 1HD1 LEU 77 -12.914 -22.083 5.655 578 HD12 LEU 77 2HD1 LEU 77 -12.325 -20.424 5.553 579 HD13 LEU 77 3HD1 LEU 77 -12.994 -21.030 7.068 580 HD21 LEU 77 1HD2 LEU 77 -10.154 -22.546 8.399 581 HD22 LEU 77 2HD2 LEU 77 -11.885 -22.235 8.520 582 HD23 LEU 77 3HD2 LEU 77 -10.743 -20.891 8.553 583 H VAL 78 H VAL 78 -9.273 -20.595 4.433 584 HA VAL 78 HA VAL 78 -6.553 -21.073 5.388 585 HB VAL 78 HB VAL 78 -7.187 -19.743 2.752 586 HG11 VAL 78 1HG1 VAL 78 -4.716 -19.401 2.611 587 HG12 VAL 78 2HG1 VAL 78 -5.519 -18.414 3.833 588 HG13 VAL 78 3HG1 VAL 78 -4.611 -19.849 4.313 589 HG21 VAL 78 1HG2 VAL 78 -6.100 -22.359 3.558 590 HG22 VAL 78 2HG2 VAL 78 -6.968 -21.891 2.096 591 HG23 VAL 78 3HG2 VAL 78 -5.245 -21.548 2.246 592 H GLN 79 H GLN 79 -6.238 -19.688 6.991 593 HA GLN 79 HA GLN 79 -7.724 -17.175 7.048 594 HB2 GLN 79 1HB GLN 79 -5.958 -18.382 9.183 595 HB3 GLN 79 2HB GLN 79 -7.066 -17.030 9.376 596 HG2 GLN 79 1HG GLN 79 -8.409 -18.629 10.204 597 HG3 GLN 79 2HG GLN 79 -8.789 -18.875 8.500 598 HE21 GLN 79 1HE2 GLN 79 -9.311 -20.938 10.012 599 HE22 GLN 79 2HE2 GLN 79 -8.127 -22.186 9.859 600 H TRP 80 H TRP 80 -6.832 -15.268 6.609 601 HA TRP 80 HA TRP 80 -3.980 -14.845 6.960 602 HB2 TRP 80 1HB TRP 80 -3.463 -14.307 4.735 603 HB3 TRP 80 2HB TRP 80 -4.437 -15.768 4.598 604 HD1 TRP 80 HD TRP 80 -4.483 -12.050 3.782 605 HE1 TRP 80 1HE TRP 80 -6.481 -11.560 2.235 606 HE3 TRP 80 3HE TRP 80 -6.822 -16.589 4.017 607 HZ2 TRP 80 2HZ TRP 80 -8.749 -12.919 1.245 608 HZ3 TRP 80 3HZ TRP 80 -8.901 -16.912 2.741 609 HH2 TRP 80 HH TRP 80 -9.843 -15.114 1.385 610 H GLU 81 H GLU 81 -3.575 -12.837 7.656 611 HA GLU 81 HA GLU 81 -5.797 -10.971 7.827 612 HB2 GLU 81 1HB GLU 81 -3.116 -11.204 9.131 613 HB3 GLU 81 2HB GLU 81 -3.917 -9.640 9.107 614 HG2 GLU 81 1HG GLU 81 -5.882 -10.667 10.189 615 HG3 GLU 81 2HG GLU 81 -4.996 -12.188 10.287 616 H MET 82 H MET 82 -5.872 -8.960 6.900 617 HA MET 82 HA MET 82 -3.720 -8.317 4.992 618 HB2 MET 82 1HB MET 82 -6.678 -8.367 4.643 619 HB3 MET 82 2HB MET 82 -5.775 -7.113 3.804 620 HG2 MET 82 1HG MET 82 -4.375 -8.853 2.767 621 HG3 MET 82 2HG MET 82 -5.359 -10.082 3.558 622 HE1 MET 82 1HE MET 82 -5.909 -6.902 0.912 623 HE2 MET 82 2HE MET 82 -4.614 -8.083 0.717 624 HE3 MET 82 3HE MET 82 -6.007 -8.114 -0.366 625 H GLU 83 H GLU 83 -2.659 -6.820 6.233 626 HA GLU 83 HA GLU 83 -4.212 -4.571 7.299 627 HB2 GLU 83 1HB GLU 83 -2.612 -5.830 8.787 628 HB3 GLU 83 2HB GLU 83 -1.302 -5.203 7.797 629 HG2 GLU 83 1HG GLU 83 -2.095 -2.900 8.352 630 HG3 GLU 83 2HG GLU 83 -3.222 -3.631 9.493 631 H VAL 84 H VAL 84 -4.066 -2.575 6.467 632 HA VAL 84 HA VAL 84 -2.584 -2.207 4.015 633 HB VAL 84 HB VAL 84 -4.332 -0.263 5.531 634 HG11 VAL 84 1HG1 VAL 84 -3.124 -0.139 2.773 635 HG12 VAL 84 2HG1 VAL 84 -4.404 0.934 3.342 636 HG13 VAL 84 3HG1 VAL 84 -2.823 0.952 4.125 637 HG21 VAL 84 1HG2 VAL 84 -4.946 -1.986 3.132 638 HG22 VAL 84 2HG2 VAL 84 -5.556 -2.237 4.768 639 HG23 VAL 84 3HG2 VAL 84 -6.031 -0.802 3.860 640 H CYS 85 H CYS 85 -0.607 -1.392 3.875 641 HA CYS 85 HA CYS 85 0.284 0.695 5.665 642 HB2 CYS 85 1HB CYS 85 2.320 -0.520 6.371 643 HB3 CYS 85 2HB CYS 85 0.850 -1.272 6.978 644 HG CYS 85 HG CYS 85 2.528 -2.397 4.218 645 H LYS 86 H LYS 86 1.292 2.133 4.445 646 HA LYS 86 HA LYS 86 2.106 1.533 1.772 647 HB2 LYS 86 1HB LYS 86 2.516 3.830 1.530 648 HB3 LYS 86 2HB LYS 86 1.184 3.751 2.677 649 HG2 LYS 86 1HG LYS 86 4.006 3.900 3.651 650 HG3 LYS 86 2HG LYS 86 3.156 5.357 3.127 651 HD2 LYS 86 1HD LYS 86 2.539 5.403 5.309 652 HD3 LYS 86 2HD LYS 86 1.279 4.313 4.727 653 HE2 LYS 86 1HE LYS 86 3.054 2.465 5.247 654 HE3 LYS 86 2HE LYS 86 3.751 3.704 6.290 655 HZ1 LYS 86 1HZ LYS 86 1.665 2.010 6.893 656 HZ2 LYS 86 2HZ LYS 86 0.945 3.524 6.672 657 HZ3 LYS 86 3HZ LYS 86 2.191 3.337 7.801 658 H LEU 87 H LEU 87 4.340 2.422 1.038 659 HA LEU 87 HA LEU 87 6.442 1.698 2.947 660 HB2 LEU 87 1HB LEU 87 6.193 0.601 0.151 661 HB3 LEU 87 2HB LEU 87 7.597 0.395 1.196 662 HG LEU 87 HG LEU 87 5.753 -0.660 2.801 663 HD11 LEU 87 1HD1 LEU 87 3.933 -0.187 1.183 664 HD12 LEU 87 2HD1 LEU 87 4.091 -1.896 1.589 665 HD13 LEU 87 3HD1 LEU 87 4.705 -1.295 0.049 666 HD21 LEU 87 1HD2 LEU 87 6.741 -2.656 2.348 667 HD22 LEU 87 2HD2 LEU 87 7.874 -1.599 1.506 668 HD23 LEU 87 3HD2 LEU 87 6.620 -2.448 0.601 669 HA PRO 88 HA PRO 88 8.458 5.267 1.358 670 HB2 PRO 88 1HB PRO 88 11.034 4.643 1.946 671 HB3 PRO 88 2HB PRO 88 9.855 5.113 3.176 672 HG2 PRO 88 1HG PRO 88 10.788 2.379 2.393 673 HG3 PRO 88 2HG PRO 88 10.511 3.045 4.013 674 HD2 PRO 88 1HD PRO 88 8.723 1.431 2.777 675 HD3 PRO 88 2HD PRO 88 8.232 2.720 3.895 676 H ARG 89 H ARG 89 10.172 2.232 0.578 677 HA ARG 89 HA ARG 89 11.541 3.164 -1.663 678 HB2 ARG 89 1HB ARG 89 11.706 0.777 -2.322 679 HB3 ARG 89 2HB ARG 89 12.120 1.056 -0.636 680 HG2 ARG 89 1HG ARG 89 9.557 0.480 -0.298 681 HG3 ARG 89 2HG ARG 89 9.816 -0.386 -1.814 682 HD2 ARG 89 1HD ARG 89 11.607 -0.708 0.582 683 HD3 ARG 89 2HD ARG 89 10.179 -1.708 0.316 684 HE ARG 89 HE ARG 89 12.688 -1.829 -1.118 685 HH11 ARG 89 2HH1 ARG 89 9.316 -2.694 -1.069 686 HH12 ARG 89 1HH1 ARG 89 9.505 -4.014 -2.175 687 HH21 ARG 89 2HH2 ARG 89 12.949 -3.564 -2.575 688 HH22 ARG 89 1HH2 ARG 89 11.572 -4.509 -3.030 689 H LEU 90 H LEU 90 8.344 1.652 -1.419 690 HA LEU 90 HA LEU 90 7.884 1.863 -4.262 691 HB2 LEU 90 1HB LEU 90 6.219 0.962 -1.933 692 HB3 LEU 90 2HB LEU 90 5.533 1.143 -3.546 693 HG LEU 90 HG LEU 90 7.905 -0.627 -3.020 694 HD11 LEU 90 1HD1 LEU 90 5.323 -1.955 -3.299 695 HD12 LEU 90 2HD1 LEU 90 5.479 -1.021 -1.811 696 HD13 LEU 90 3HD1 LEU 90 6.656 -2.279 -2.189 697 HD21 LEU 90 1HD2 LEU 90 5.840 -1.093 -5.107 698 HD22 LEU 90 2HD2 LEU 90 7.571 -1.432 -5.129 699 HD23 LEU 90 3HD2 LEU 90 6.992 0.219 -5.353 700 H SER 91 H SER 91 7.065 3.641 -1.365 701 HA SER 91 HA SER 91 6.137 5.694 -1.040 702 HB2 SER 91 1HB SER 91 6.458 6.061 -4.028 703 HB3 SER 91 2HB SER 91 6.263 7.333 -2.822 704 HG SER 91 HG SER 91 8.289 7.049 -2.161 705 H LEU 92 H LEU 92 4.490 3.366 -1.646 706 HA LEU 92 HA LEU 92 2.008 4.772 -2.140 707 HB2 LEU 92 1HB LEU 92 3.194 2.834 -4.038 708 HB3 LEU 92 2HB LEU 92 1.467 2.684 -3.721 709 HG LEU 92 HG LEU 92 2.854 5.151 -4.772 710 HD11 LEU 92 1HD1 LEU 92 2.830 3.942 -6.669 711 HD12 LEU 92 2HD1 LEU 92 1.123 4.385 -6.694 712 HD13 LEU 92 3HD1 LEU 92 1.617 2.814 -6.063 713 HD21 LEU 92 1HD2 LEU 92 0.436 4.923 -3.402 714 HD22 LEU 92 2HD2 LEU 92 -0.008 5.026 -5.106 715 HD23 LEU 92 3HD2 LEU 92 0.986 6.288 -4.375 716 H ASN 93 H ASN 93 0.104 3.259 -1.842 717 HA ASN 93 HA ASN 93 0.244 2.019 0.645 718 HB2 ASN 93 1HB ASN 93 -1.747 1.811 -1.607 719 HB3 ASN 93 2HB ASN 93 -1.963 0.927 -0.099 720 HD21 ASN 93 1HD2 ASN 93 -1.272 2.595 1.823 721 HD22 ASN 93 2HD2 ASN 93 -2.231 4.032 1.800 722 H GLY 94 H GLY 94 0.700 0.004 1.341 723 HA2 GLY 94 1HA GLY 94 1.293 -2.028 -0.722 724 HA3 GLY 94 2HA GLY 94 2.298 -1.806 0.702 725 H VAL 95 H VAL 95 0.013 -3.737 -0.605 726 HA VAL 95 HA VAL 95 -1.341 -4.339 1.922 727 HB VAL 95 HB VAL 95 -1.854 -5.420 -0.853 728 HG11 VAL 95 1HG1 VAL 95 -2.714 -7.096 0.432 729 HG12 VAL 95 2HG1 VAL 95 -2.998 -6.041 1.818 730 HG13 VAL 95 3HG1 VAL 95 -4.093 -5.998 0.436 731 HG21 VAL 95 1HG2 VAL 95 -2.893 -3.478 -1.187 732 HG22 VAL 95 2HG2 VAL 95 -4.068 -3.991 0.024 733 HG23 VAL 95 3HG2 VAL 95 -2.688 -3.000 0.499 734 H ARG 96 H ARG 96 -0.197 -5.651 3.199 735 HA ARG 96 HA ARG 96 1.447 -7.760 2.038 736 HB2 ARG 96 1HB ARG 96 2.427 -6.398 3.813 737 HB3 ARG 96 2HB ARG 96 1.119 -6.844 4.900 738 HG2 ARG 96 1HG ARG 96 1.958 -8.925 5.285 739 HG3 ARG 96 2HG ARG 96 2.726 -9.029 3.700 740 HD2 ARG 96 1HD ARG 96 4.365 -8.852 5.526 741 HD3 ARG 96 2HD ARG 96 4.461 -7.496 4.403 742 HE ARG 96 HE ARG 96 3.756 -6.081 6.080 743 HH11 ARG 96 2HH1 ARG 96 3.414 -9.395 7.091 744 HH12 ARG 96 1HH1 ARG 96 3.101 -8.994 8.747 745 HH21 ARG 96 2HH2 ARG 96 3.345 -5.540 8.257 746 HH22 ARG 96 1HH2 ARG 96 3.060 -6.801 9.409 747 H PHE 97 H PHE 97 1.280 -9.960 2.707 748 HA PHE 97 HA PHE 97 -1.398 -10.699 3.691 749 HB2 PHE 97 1HB PHE 97 0.227 -11.812 1.430 750 HB3 PHE 97 2HB PHE 97 -0.913 -12.850 2.280 751 HD1 PHE 97 1HD PHE 97 -0.725 -9.541 0.583 752 HD2 PHE 97 2HD PHE 97 -3.108 -12.923 1.581 753 HE1 PHE 97 1HE PHE 97 -2.554 -8.657 -0.806 754 HE2 PHE 97 2HE PHE 97 -4.940 -12.046 0.193 755 HZ PHE 97 HZ PHE 97 -4.665 -9.911 -1.003 756 H LYS 98 H LYS 98 -1.183 -11.445 5.693 757 HA LYS 98 HA LYS 98 1.220 -12.946 6.430 758 HB2 LYS 98 1HB LYS 98 0.463 -11.034 7.848 759 HB3 LYS 98 2HB LYS 98 -1.005 -11.933 8.209 760 HG2 LYS 98 1HG LYS 98 0.107 -13.486 9.509 761 HG3 LYS 98 2HG LYS 98 1.668 -13.148 8.759 762 HD2 LYS 98 1HD LYS 98 2.041 -11.294 10.051 763 HD3 LYS 98 2HD LYS 98 0.320 -10.955 10.250 764 HE2 LYS 98 1HE LYS 98 1.098 -11.669 12.364 765 HE3 LYS 98 2HE LYS 98 0.206 -13.030 11.686 766 HZ1 LYS 98 1HZ LYS 98 3.052 -12.763 12.235 767 HZ2 LYS 98 2HZ LYS 98 2.641 -13.596 10.821 768 HZ3 LYS 98 3HZ LYS 98 2.056 -14.128 12.317 769 H ARG 99 H ARG 99 1.180 -15.087 6.429 770 HA ARG 99 HA ARG 99 -1.255 -16.544 6.063 771 HB2 ARG 99 1HB ARG 99 1.017 -17.161 5.117 772 HB3 ARG 99 2HB ARG 99 1.452 -17.692 6.736 773 HG2 ARG 99 1HG ARG 99 -0.107 -19.441 6.703 774 HG3 ARG 99 2HG ARG 99 -0.961 -18.763 5.315 775 HD2 ARG 99 1HD ARG 99 0.308 -20.603 4.514 776 HD3 ARG 99 2HD ARG 99 1.131 -19.140 3.976 777 HE ARG 99 HE ARG 99 2.945 -19.803 5.179 778 HH11 ARG 99 2HH1 ARG 99 0.126 -21.374 6.484 779 HH12 ARG 99 1HH1 ARG 99 1.022 -22.325 7.622 780 HH21 ARG 99 2HH2 ARG 99 4.136 -21.050 6.672 781 HH22 ARG 99 1HH2 ARG 99 3.303 -22.139 7.729 782 H ILE 100 H ILE 100 -2.598 -16.450 7.797 783 HA ILE 100 HA ILE 100 -1.731 -16.626 10.496 784 HB ILE 100 HB ILE 100 -4.482 -17.076 9.334 785 HG12 ILE 100 1HG1 ILE 100 -3.311 -14.804 9.025 786 HG13 ILE 100 2HG1 ILE 100 -4.923 -14.800 9.731 787 HG21 ILE 100 1HG2 ILE 100 -4.695 -18.016 11.413 788 HG22 ILE 100 2HG2 ILE 100 -3.447 -16.994 12.124 789 HG23 ILE 100 3HG2 ILE 100 -5.046 -16.329 11.789 790 HD11 ILE 100 1HD1 ILE 100 -4.182 -13.802 11.559 791 HD12 ILE 100 2HD1 ILE 100 -2.921 -15.015 11.780 792 HD13 ILE 100 3HD1 ILE 100 -2.626 -13.614 10.751 793 H SER 101 H SER 101 -3.502 -18.941 8.439 794 HA SER 101 HA SER 101 -2.034 -21.174 9.399 795 HB2 SER 101 1HB SER 101 -4.637 -20.519 10.702 796 HB3 SER 101 2HB SER 101 -4.286 -22.214 10.364 797 HG SER 101 HG SER 101 -2.265 -20.720 11.553 798 H GLY 102 H GLY 102 -2.866 -23.235 8.521 799 HA2 GLY 102 1HA GLY 102 -4.576 -24.260 7.052 800 HA3 GLY 102 2HA GLY 102 -4.534 -22.768 6.125 801 H THR 103 H THR 103 -4.007 -23.845 4.212 802 HA THR 103 HA THR 103 -1.365 -25.137 4.149 803 HB THR 103 HB THR 103 -2.035 -26.168 2.049 804 HG1 THR 103 1HG THR 103 -3.433 -24.491 1.308 805 HG21 THR 103 1HG2 THR 103 -2.820 -27.775 3.383 806 HG22 THR 103 2HG2 THR 103 -4.419 -27.050 3.215 807 HG23 THR 103 3HG2 THR 103 -3.380 -26.594 4.566 808 H SER 104 H SER 104 0.137 -24.584 2.534 809 HA SER 104 HA SER 104 0.250 -21.823 1.909 810 HB2 SER 104 1HB SER 104 1.912 -24.033 0.683 811 HB3 SER 104 2HB SER 104 2.332 -22.324 0.802 812 HG SER 104 HG SER 104 2.217 -24.273 2.832 813 H ILE 105 H ILE 105 -0.287 -24.706 -0.099 814 HA ILE 105 HA ILE 105 -0.424 -23.666 -2.599 815 HB ILE 105 HB ILE 105 -2.289 -25.698 -1.377 816 HG12 ILE 105 1HG1 ILE 105 0.195 -26.176 -1.463 817 HG13 ILE 105 2HG1 ILE 105 -0.825 -27.341 -2.300 818 HG21 ILE 105 1HG2 ILE 105 -1.825 -25.196 -4.310 819 HG22 ILE 105 2HG2 ILE 105 -2.956 -26.334 -3.580 820 HG23 ILE 105 3HG2 ILE 105 -3.223 -24.598 -3.417 821 HD11 ILE 105 1HD1 ILE 105 -0.042 -26.760 -4.349 822 HD12 ILE 105 2HD1 ILE 105 0.283 -25.091 -3.877 823 HD13 ILE 105 3HD1 ILE 105 1.379 -26.379 -3.377 824 H ALA 106 H ALA 106 -3.402 -24.093 -0.686 825 HA ALA 106 HA ALA 106 -5.054 -22.508 -2.227 826 HB1 ALA 106 1HB ALA 106 -5.912 -22.150 0.422 827 HB2 ALA 106 2HB ALA 106 -6.486 -23.337 -0.750 828 HB3 ALA 106 3HB ALA 106 -5.173 -23.750 0.352 829 H PHE 107 H PHE 107 -2.883 -21.559 0.385 830 HA PHE 107 HA PHE 107 -3.700 -18.960 0.826 831 HB2 PHE 107 1HB PHE 107 -1.873 -20.255 2.031 832 HB3 PHE 107 2HB PHE 107 -0.800 -19.788 0.716 833 HD1 PHE 107 1HD PHE 107 -2.977 -18.431 3.388 834 HD2 PHE 107 2HD PHE 107 0.247 -17.701 0.707 835 HE1 PHE 107 1HE PHE 107 -2.514 -16.302 4.531 836 HE2 PHE 107 2HE PHE 107 0.716 -15.571 1.846 837 HZ PHE 107 HZ PHE 107 -0.664 -14.869 3.761 838 H LYS 108 H LYS 108 -1.365 -20.121 -1.591 839 HA LYS 108 HA LYS 108 -1.052 -17.516 -2.762 840 HB2 LYS 108 1HB LYS 108 -0.123 -20.273 -3.544 841 HB3 LYS 108 2HB LYS 108 0.160 -18.871 -4.567 842 HG2 LYS 108 1HG LYS 108 1.635 -17.911 -3.074 843 HG3 LYS 108 2HG LYS 108 0.997 -18.818 -1.701 844 HD2 LYS 108 1HD LYS 108 3.144 -19.721 -2.250 845 HD3 LYS 108 2HD LYS 108 1.920 -20.894 -2.742 846 HE2 LYS 108 1HE LYS 108 2.178 -20.371 -5.015 847 HE3 LYS 108 2HE LYS 108 3.029 -18.868 -4.660 848 HZ1 LYS 108 1HZ LYS 108 4.298 -21.272 -3.661 849 HZ2 LYS 108 2HZ LYS 108 4.977 -19.928 -4.431 850 HZ3 LYS 108 3HZ LYS 108 4.241 -21.144 -5.347 851 H ASN 109 H ASN 109 -2.641 -20.543 -3.736 852 HA ASN 109 HA ASN 109 -3.564 -19.877 -6.224 853 HB2 ASN 109 1HB ASN 109 -4.672 -21.583 -4.032 854 HB3 ASN 109 2HB ASN 109 -5.666 -21.280 -5.454 855 HD21 ASN 109 1HD2 ASN 109 -2.735 -22.723 -4.257 856 HD22 ASN 109 2HD2 ASN 109 -2.421 -23.711 -5.638 857 H ILE 110 H ILE 110 -5.009 -19.022 -3.107 858 HA ILE 110 HA ILE 110 -7.188 -17.591 -4.340 859 HB ILE 110 HB ILE 110 -7.435 -18.738 -2.150 860 HG12 ILE 110 1HG1 ILE 110 -8.564 -16.767 -0.998 861 HG13 ILE 110 2HG1 ILE 110 -7.943 -15.767 -2.307 862 HG21 ILE 110 1HG2 ILE 110 -5.095 -17.901 -1.417 863 HG22 ILE 110 2HG2 ILE 110 -5.965 -16.466 -0.878 864 HG23 ILE 110 3HG2 ILE 110 -6.374 -18.046 -0.211 865 HD11 ILE 110 1HD1 ILE 110 -10.112 -16.270 -2.957 866 HD12 ILE 110 2HD1 ILE 110 -9.130 -17.424 -3.860 867 HD13 ILE 110 3HD1 ILE 110 -9.991 -17.942 -2.412 868 H ALA 111 H ALA 111 -4.198 -16.763 -2.632 869 HA ALA 111 HA ALA 111 -4.439 -14.048 -2.369 870 HB1 ALA 111 1HB ALA 111 -2.249 -15.938 -2.517 871 HB2 ALA 111 2HB ALA 111 -1.809 -14.362 -3.175 872 HB3 ALA 111 3HB ALA 111 -2.426 -14.488 -1.528 873 H SER 112 H SER 112 -3.336 -15.813 -5.250 874 HA SER 112 HA SER 112 -2.702 -13.667 -6.876 875 HB2 SER 112 1HB SER 112 -2.405 -16.162 -7.349 876 HB3 SER 112 2HB SER 112 -4.079 -16.149 -7.903 877 HG SER 112 HG SER 112 -3.430 -14.471 -9.386 878 H LYS 113 H LYS 113 -5.848 -15.276 -6.493 879 HA LYS 113 HA LYS 113 -7.291 -13.753 -8.330 880 HB2 LYS 113 1HB LYS 113 -8.212 -15.047 -5.758 881 HB3 LYS 113 2HB LYS 113 -9.293 -14.406 -6.988 882 HG2 LYS 113 1HG LYS 113 -8.734 -16.066 -8.520 883 HG3 LYS 113 2HG LYS 113 -7.250 -16.489 -7.662 884 HD2 LYS 113 1HD LYS 113 -8.494 -17.494 -5.877 885 HD3 LYS 113 2HD LYS 113 -10.019 -16.903 -6.541 886 HE2 LYS 113 1HE LYS 113 -8.204 -18.767 -8.051 887 HE3 LYS 113 2HE LYS 113 -9.458 -19.346 -6.956 888 HZ1 LYS 113 1HZ LYS 113 -10.126 -17.441 -9.102 889 HZ2 LYS 113 2HZ LYS 113 -11.129 -18.551 -8.313 890 HZ3 LYS 113 3HZ LYS 113 -9.994 -19.093 -9.444 891 H ILE 114 H ILE 114 -7.236 -13.329 -4.785 892 HA ILE 114 HA ILE 114 -8.659 -11.026 -4.534 893 HB ILE 114 HB ILE 114 -6.104 -11.626 -3.038 894 HG12 ILE 114 1HG1 ILE 114 -7.784 -13.471 -3.002 895 HG13 ILE 114 2HG1 ILE 114 -7.489 -12.765 -1.416 896 HG21 ILE 114 1HG2 ILE 114 -8.135 -10.307 -1.506 897 HG22 ILE 114 2HG2 ILE 114 -6.481 -9.798 -1.839 898 HG23 ILE 114 3HG2 ILE 114 -7.776 -9.374 -2.958 899 HD11 ILE 114 1HD1 ILE 114 -9.564 -11.773 -1.329 900 HD12 ILE 114 2HD1 ILE 114 -9.761 -11.788 -3.082 901 HD13 ILE 114 3HD1 ILE 114 -9.907 -13.287 -2.165 902 H ALA 115 H ALA 115 -5.281 -11.313 -5.525 903 HA ALA 115 HA ALA 115 -4.755 -8.521 -5.586 904 HB1 ALA 115 1HB ALA 115 -2.661 -9.085 -6.248 905 HB2 ALA 115 2HB ALA 115 -3.169 -10.665 -5.652 906 HB3 ALA 115 3HB ALA 115 -3.228 -10.314 -7.379 907 H ASN 116 H ASN 116 -5.084 -10.817 -8.303 908 HA ASN 116 HA ASN 116 -5.164 -9.083 -10.395 909 HB2 ASN 116 1HB ASN 116 -6.712 -11.631 -9.945 910 HB3 ASN 116 2HB ASN 116 -6.784 -10.754 -11.471 911 HD21 ASN 116 1HD2 ASN 116 -5.527 -13.366 -10.295 912 HD22 ASN 116 2HD2 ASN 116 -3.972 -13.393 -11.047 913 H GLU 117 H GLU 117 -7.895 -9.968 -8.312 914 HA GLU 117 HA GLU 117 -9.845 -8.458 -9.677 915 HB2 GLU 117 1HB GLU 117 -9.749 -9.277 -6.768 916 HB3 GLU 117 2HB GLU 117 -11.172 -8.676 -7.608 917 HG2 GLU 117 1HG GLU 117 -9.749 -11.284 -7.955 918 HG3 GLU 117 2HG GLU 117 -11.445 -10.986 -7.578 919 H LEU 118 H LEU 118 -7.616 -7.665 -7.068 920 HA LEU 118 HA LEU 118 -8.726 -5.011 -6.739 921 HB2 LEU 118 1HB LEU 118 -6.411 -6.469 -5.498 922 HB3 LEU 118 2HB LEU 118 -6.715 -4.760 -5.193 923 HG LEU 118 HG LEU 118 -8.835 -6.811 -4.660 924 HD11 LEU 118 1HD1 LEU 118 -6.480 -7.211 -3.529 925 HD12 LEU 118 2HD1 LEU 118 -7.986 -7.413 -2.633 926 HD13 LEU 118 3HD1 LEU 118 -7.048 -5.930 -2.458 927 HD21 LEU 118 1HD2 LEU 118 -9.948 -5.102 -3.766 928 HD22 LEU 118 2HD2 LEU 118 -8.757 -4.051 -4.533 929 HD23 LEU 118 3HD2 LEU 118 -8.537 -4.557 -2.858 930 H LYS 119 H LYS 119 -7.473 -5.927 -9.310 931 HA LYS 119 HA LYS 119 -5.855 -5.273 -10.826 932 HB2 LYS 119 1HB LYS 119 -7.085 -2.727 -9.782 933 HB3 LYS 119 2HB LYS 119 -5.978 -2.743 -11.149 934 HG2 LYS 119 1HG LYS 119 -8.496 -4.381 -11.066 935 HG3 LYS 119 2HG LYS 119 -8.430 -2.738 -11.710 936 HD2 LYS 119 1HD LYS 119 -6.554 -3.572 -13.213 937 HD3 LYS 119 2HD LYS 119 -7.029 -5.200 -12.724 938 HE2 LYS 119 1HE LYS 119 -9.036 -3.258 -13.815 939 HE3 LYS 119 2HE LYS 119 -8.023 -4.218 -14.891 940 HZ1 LYS 119 1HZ LYS 119 -8.979 -6.185 -14.169 941 HZ2 LYS 119 2HZ LYS 119 -10.303 -5.133 -14.230 942 HZ3 LYS 119 3HZ LYS 119 -9.585 -5.504 -12.744 943 H LEU 120 H LEU 120 -4.679 -5.824 -8.286 944 HA LEU 120 HA LEU 120 -2.795 -3.701 -7.732 945 HB2 LEU 120 1HB LEU 120 -2.988 -6.512 -6.661 946 HB3 LEU 120 2HB LEU 120 -1.873 -5.278 -6.077 947 HG LEU 120 HG LEU 120 -4.881 -5.101 -5.920 948 HD11 LEU 120 1HD1 LEU 120 -4.441 -5.398 -3.461 949 HD12 LEU 120 2HD1 LEU 120 -2.813 -5.918 -3.893 950 HD13 LEU 120 3HD1 LEU 120 -4.209 -6.837 -4.455 951 HD21 LEU 120 1HD2 LEU 120 -2.707 -3.213 -5.458 952 HD22 LEU 120 2HD2 LEU 120 -3.788 -3.387 -4.076 953 HD23 LEU 120 3HD2 LEU 120 -4.437 -2.928 -5.651 954 H SER 121 H SER 121 -0.412 -4.593 -7.395 955 HA SER 121 HA SER 121 0.787 -4.815 -9.842 956 HB2 SER 121 1HB SER 121 1.934 -4.363 -7.649 957 HB3 SER 121 2HB SER 121 1.876 -6.096 -7.326 958 HG SER 121 HG SER 121 3.313 -6.458 -8.900 959 H GLY 122 H GLY 122 0.172 -7.540 -7.618 960 HA2 GLY 122 1HA GLY 122 -0.271 -9.755 -8.056 961 HA3 GLY 122 2HA GLY 122 -0.613 -9.289 -9.716 962 HA PRO 123 HA PRO 123 4.152 -10.092 -9.536 963 HB2 PRO 123 1HB PRO 123 5.129 -11.136 -7.228 964 HB3 PRO 123 2HB PRO 123 5.027 -9.397 -7.528 965 HG2 PRO 123 1HG PRO 123 3.182 -11.160 -5.964 966 HG3 PRO 123 2HG PRO 123 3.789 -9.543 -5.565 967 HD2 PRO 123 1HD PRO 123 1.314 -9.960 -6.582 968 HD3 PRO 123 2HD PRO 123 2.253 -8.494 -6.927 969 H SER 124 H SER 124 1.626 -12.069 -8.546 970 HA SER 124 HA SER 124 3.076 -14.575 -8.779 971 HB2 SER 124 1HB SER 124 1.072 -14.065 -7.195 972 HB3 SER 124 2HB SER 124 0.082 -14.358 -8.625 973 HG SER 124 HG SER 124 1.994 -16.269 -8.243 974 H SER 125 H SER 125 0.348 -13.007 -10.456 975 HA SER 125 HA SER 125 1.255 -14.227 -12.956 976 HB2 SER 125 1HB SER 125 -1.019 -14.952 -13.530 977 HB3 SER 125 2HB SER 125 -0.466 -15.743 -12.054 978 HG SER 125 HG SER 125 -1.720 -14.319 -10.859 979 H GLY 126 H GLY 126 0.718 -13.076 -14.814 980 HA2 GLY 126 1HA GLY 126 0.599 -11.013 -15.885 981 HA3 GLY 126 2HA GLY 126 -1.067 -11.159 -15.346 Start of MODEL 16 1 H1 MET 1 H MET 1 25.708 -24.308 -63.739 2 HA MET 1 HA MET 1 23.122 -23.105 -63.869 3 HB2 MET 1 1HB MET 1 22.088 -25.081 -62.524 4 HB3 MET 1 2HB MET 1 22.159 -25.173 -64.279 5 HG2 MET 1 1HG MET 1 24.234 -26.508 -64.076 6 HG3 MET 1 2HG MET 1 24.026 -26.495 -62.326 7 HE1 MET 1 1HE MET 1 23.165 -27.883 -65.658 8 HE2 MET 1 2HE MET 1 23.971 -29.143 -64.723 9 HE3 MET 1 3HE MET 1 22.308 -29.373 -65.263 10 H LYS 2 H LYS 2 22.574 -22.141 -61.960 11 HA LYS 2 HA LYS 2 23.841 -22.912 -59.480 12 HB2 LYS 2 1HB LYS 2 24.540 -20.359 -60.909 13 HB3 LYS 2 2HB LYS 2 24.658 -20.486 -59.159 14 HG2 LYS 2 1HG LYS 2 26.185 -22.426 -59.467 15 HG3 LYS 2 2HG LYS 2 26.153 -22.112 -61.204 16 HD2 LYS 2 1HD LYS 2 27.092 -19.905 -60.852 17 HD3 LYS 2 2HD LYS 2 27.038 -20.134 -59.102 18 HE2 LYS 2 1HE LYS 2 28.662 -21.902 -59.233 19 HE3 LYS 2 2HE LYS 2 28.622 -21.866 -60.995 20 HZ1 LYS 2 1HZ LYS 2 30.401 -20.550 -60.731 21 HZ2 LYS 2 2HZ LYS 2 30.009 -20.126 -59.142 22 HZ3 LYS 2 3HZ LYS 2 29.261 -19.335 -60.437 23 H ASP 3 H ASP 3 22.169 -22.915 -58.137 24 HA ASP 3 HA ASP 3 20.530 -20.521 -57.897 25 HB2 ASP 3 1HB ASP 3 18.432 -21.915 -57.867 26 HB3 ASP 3 2HB ASP 3 19.198 -21.769 -59.447 27 H HIS 4 H HIS 4 20.485 -20.008 -55.821 28 HA HIS 4 HA HIS 4 20.211 -22.129 -53.821 29 HB2 HIS 4 1HB HIS 4 22.664 -21.265 -54.209 30 HB3 HIS 4 2HB HIS 4 22.115 -19.886 -53.261 31 HD1 HIS 4 1HD HIS 4 24.220 -22.258 -52.484 32 HD2 HIS 4 2HD HIS 4 20.365 -21.675 -51.048 33 HE1 HIS 4 1HE HIS 4 24.148 -23.426 -50.258 34 HE2 HIS 4 2HE HIS 4 21.781 -23.132 -49.448 35 H LEU 5 H LEU 5 18.796 -21.642 -52.253 36 HA LEU 5 HA LEU 5 17.898 -18.843 -52.041 37 HB2 LEU 5 1HB LEU 5 16.238 -21.303 -51.531 38 HB3 LEU 5 2HB LEU 5 15.684 -19.630 -51.547 39 HG LEU 5 HG LEU 5 16.771 -21.032 -53.981 40 HD11 LEU 5 1HD1 LEU 5 13.860 -20.559 -53.555 41 HD12 LEU 5 2HD1 LEU 5 14.615 -21.984 -52.842 42 HD13 LEU 5 3HD1 LEU 5 14.674 -21.735 -54.587 43 HD21 LEU 5 1HD2 LEU 5 14.893 -18.971 -54.517 44 HD22 LEU 5 2HD2 LEU 5 16.605 -19.037 -54.934 45 HD23 LEU 5 3HD2 LEU 5 16.098 -18.341 -53.394 46 H ILE 6 H ILE 6 18.200 -17.922 -50.129 47 HA ILE 6 HA ILE 6 18.110 -19.550 -47.702 48 HB ILE 6 HB ILE 6 20.406 -17.703 -48.364 49 HG12 ILE 6 1HG1 ILE 6 20.580 -20.638 -47.727 50 HG13 ILE 6 2HG1 ILE 6 20.297 -20.081 -49.372 51 HG21 ILE 6 1HG2 ILE 6 21.257 -18.754 -46.142 52 HG22 ILE 6 2HG2 ILE 6 20.131 -17.399 -46.093 53 HG23 ILE 6 3HG2 ILE 6 19.544 -19.042 -45.837 54 HD11 ILE 6 1HD1 ILE 6 22.659 -19.325 -47.669 55 HD12 ILE 6 2HD1 ILE 6 22.656 -20.555 -48.934 56 HD13 ILE 6 3HD1 ILE 6 22.384 -18.863 -49.348 57 H HIS 7 H HIS 7 16.934 -18.593 -46.180 58 HA HIS 7 HA HIS 7 16.517 -15.681 -46.364 59 HB2 HIS 7 1HB HIS 7 14.610 -17.777 -45.304 60 HB3 HIS 7 2HB HIS 7 14.302 -16.044 -45.366 61 HD1 HIS 7 1HD HIS 7 15.223 -15.445 -48.232 62 HD2 HIS 7 2HD HIS 7 12.871 -18.703 -47.179 63 HE1 HIS 7 1HE HIS 7 14.008 -16.104 -50.333 64 HE2 HIS 7 2HE HIS 7 12.527 -18.024 -49.650 65 H ASN 8 H ASN 8 16.955 -14.464 -44.622 66 HA ASN 8 HA ASN 8 18.159 -15.756 -42.326 67 HB2 ASN 8 1HB ASN 8 17.741 -12.791 -42.639 68 HB3 ASN 8 2HB ASN 8 18.996 -13.633 -41.735 69 HD21 ASN 8 1HD2 ASN 8 17.940 -12.549 -44.847 70 HD22 ASN 8 2HD2 ASN 8 19.421 -12.849 -45.684 71 H VAL 9 H VAL 9 15.423 -16.301 -42.553 72 HA VAL 9 HA VAL 9 14.376 -14.886 -40.190 73 HB VAL 9 HB VAL 9 13.098 -14.135 -42.094 74 HG11 VAL 9 1HG1 VAL 9 13.689 -16.360 -43.356 75 HG12 VAL 9 2HG1 VAL 9 12.132 -16.885 -42.713 76 HG13 VAL 9 3HG1 VAL 9 12.225 -15.460 -43.749 77 HG21 VAL 9 1HG2 VAL 9 11.741 -16.061 -40.243 78 HG22 VAL 9 2HG2 VAL 9 11.718 -14.297 -40.225 79 HG23 VAL 9 3HG2 VAL 9 10.824 -15.178 -41.464 80 H HIS 10 H HIS 10 15.123 -16.531 -38.817 81 HA HIS 10 HA HIS 10 13.312 -18.686 -38.439 82 HB2 HIS 10 1HB HIS 10 15.927 -19.236 -39.775 83 HB3 HIS 10 2HB HIS 10 15.317 -20.405 -38.608 84 HD1 HIS 10 1HD HIS 10 14.988 -19.348 -42.086 85 HD2 HIS 10 2HD HIS 10 12.720 -21.498 -39.348 86 HE1 HIS 10 1HE HIS 10 13.279 -20.586 -43.454 87 HE2 HIS 10 2HE HIS 10 11.865 -21.813 -41.769 88 H LYS 11 H LYS 11 13.309 -19.269 -36.348 89 HA LYS 11 HA LYS 11 15.608 -18.439 -34.699 90 HB2 LYS 11 1HB LYS 11 12.654 -18.259 -34.202 91 HB3 LYS 11 2HB LYS 11 13.773 -18.357 -32.848 92 HG2 LYS 11 1HG LYS 11 13.401 -16.074 -33.154 93 HG3 LYS 11 2HG LYS 11 14.971 -16.374 -33.904 94 HD2 LYS 11 1HD LYS 11 13.757 -14.983 -35.396 95 HD3 LYS 11 2HD LYS 11 13.751 -16.603 -36.098 96 HE2 LYS 11 1HE LYS 11 11.511 -16.972 -35.493 97 HE3 LYS 11 2HE LYS 11 11.507 -15.619 -34.362 98 HZ1 LYS 11 1HZ LYS 11 12.122 -14.479 -36.759 99 HZ2 LYS 11 2HZ LYS 11 10.605 -14.459 -36.012 100 HZ3 LYS 11 3HZ LYS 11 10.961 -15.640 -37.169 101 H GLU 12 H GLU 12 16.574 -19.969 -33.525 102 HA GLU 12 HA GLU 12 15.126 -22.306 -32.620 103 HB2 GLU 12 1HB GLU 12 17.134 -22.395 -34.820 104 HB3 GLU 12 2HB GLU 12 17.151 -23.697 -33.639 105 HG2 GLU 12 1HG GLU 12 14.670 -23.955 -34.115 106 HG3 GLU 12 2HG GLU 12 14.943 -22.909 -35.508 107 H GLU 13 H GLU 13 16.670 -23.802 -31.383 108 HA GLU 13 HA GLU 13 18.822 -22.252 -30.113 109 HB2 GLU 13 1HB GLU 13 18.126 -22.886 -27.924 110 HB3 GLU 13 2HB GLU 13 16.713 -22.231 -28.741 111 HG2 GLU 13 1HG GLU 13 17.162 -25.164 -28.844 112 HG3 GLU 13 2HG GLU 13 16.598 -24.451 -27.333 113 H HIS 14 H HIS 14 20.183 -23.734 -28.665 114 HA HIS 14 HA HIS 14 20.835 -26.109 -30.237 115 HB2 HIS 14 1HB HIS 14 22.344 -24.527 -28.162 116 HB3 HIS 14 2HB HIS 14 22.910 -26.092 -28.737 117 HD1 HIS 14 1HD HIS 14 24.599 -25.863 -30.511 118 HD2 HIS 14 2HD HIS 14 21.836 -22.762 -30.619 119 HE1 HIS 14 1HE HIS 14 25.319 -24.387 -32.415 120 HE2 HIS 14 2HE HIS 14 23.683 -22.472 -32.407 121 H ALA 15 H ALA 15 20.731 -25.298 -26.761 122 HA ALA 15 HA ALA 15 19.137 -27.610 -26.163 123 HB1 ALA 15 1HB ALA 15 22.056 -27.724 -25.898 124 HB2 ALA 15 2HB ALA 15 21.162 -28.233 -24.465 125 HB3 ALA 15 3HB ALA 15 20.872 -29.026 -26.013 126 H HIS 16 H HIS 16 18.186 -27.493 -24.155 127 HA HIS 16 HA HIS 16 19.054 -25.352 -22.349 128 HB2 HIS 16 1HB HIS 16 16.695 -24.648 -22.038 129 HB3 HIS 16 2HB HIS 16 17.280 -24.361 -23.674 130 HD1 HIS 16 1HD HIS 16 15.023 -26.677 -21.733 131 HD2 HIS 16 2HD HIS 16 15.875 -25.641 -25.665 132 HE1 HIS 16 1HE HIS 16 13.248 -27.793 -23.122 133 HE2 HIS 16 2HE HIS 16 13.834 -27.222 -25.504 134 H ALA 17 H ALA 17 18.391 -25.613 -20.166 135 HA ALA 17 HA ALA 17 17.340 -28.283 -19.504 136 HB1 ALA 17 1HB ALA 17 18.914 -28.425 -17.638 137 HB2 ALA 17 2HB ALA 17 19.756 -28.295 -19.183 138 HB3 ALA 17 3HB ALA 17 19.632 -26.889 -18.125 139 H HIS 18 H HIS 18 15.582 -28.183 -18.281 140 HA HIS 18 HA HIS 18 14.744 -25.692 -17.107 141 HB2 HIS 18 1HB HIS 18 12.833 -27.268 -16.257 142 HB3 HIS 18 2HB HIS 18 12.930 -26.850 -17.965 143 HD1 HIS 18 1HD HIS 18 11.768 -28.993 -18.744 144 HD2 HIS 18 2HD HIS 18 15.206 -29.679 -16.515 145 HE1 HIS 18 1HE HIS 18 12.279 -31.438 -19.032 146 HE2 HIS 18 2HE HIS 18 14.314 -31.848 -17.606 147 H ASN 19 H ASN 19 15.799 -25.074 -15.316 148 HA ASN 19 HA ASN 19 16.148 -27.058 -13.166 149 HB2 ASN 19 1HB ASN 19 17.754 -24.619 -13.910 150 HB3 ASN 19 2HB ASN 19 17.878 -25.357 -12.316 151 HD21 ASN 19 1HD2 ASN 19 18.576 -25.676 -15.686 152 HD22 ASN 19 2HD2 ASN 19 19.614 -27.051 -15.555 153 H LYS 20 H LYS 20 15.919 -26.255 -10.959 154 HA LYS 20 HA LYS 20 13.616 -24.503 -10.744 155 HB2 LYS 20 1HB LYS 20 15.083 -26.275 -8.802 156 HB3 LYS 20 2HB LYS 20 13.849 -25.142 -8.264 157 HG2 LYS 20 1HG LYS 20 12.540 -26.965 -8.530 158 HG3 LYS 20 2HG LYS 20 12.462 -26.352 -10.183 159 HD2 LYS 20 1HD LYS 20 14.716 -28.159 -9.551 160 HD3 LYS 20 2HD LYS 20 13.109 -28.887 -9.577 161 HE2 LYS 20 1HE LYS 20 12.833 -28.528 -11.815 162 HE3 LYS 20 2HE LYS 20 13.850 -27.088 -11.820 163 HZ1 LYS 20 1HZ LYS 20 15.736 -28.750 -11.359 164 HZ2 LYS 20 2HZ LYS 20 15.126 -28.637 -12.932 165 HZ3 LYS 20 3HZ LYS 20 14.657 -29.919 -11.933 166 H ASP 21 H ASP 21 15.084 -22.693 -11.533 167 HA ASP 21 HA ASP 21 16.217 -21.341 -9.180 168 HB2 ASP 21 1HB ASP 21 17.932 -22.293 -10.878 169 HB3 ASP 21 2HB ASP 21 17.406 -20.971 -11.915 170 H TYR 22 H TYR 22 13.637 -20.937 -9.903 171 HA TYR 22 HA TYR 22 13.536 -18.557 -11.590 172 HB2 TYR 22 1HB TYR 22 11.241 -19.959 -10.212 173 HB3 TYR 22 2HB TYR 22 11.144 -18.795 -11.528 174 HD1 TYR 22 1HD TYR 22 12.405 -22.193 -10.689 175 HD2 TYR 22 2HD TYR 22 11.138 -19.523 -13.751 176 HE1 TYR 22 1HE TYR 22 12.466 -24.037 -12.315 177 HE2 TYR 22 2HE TYR 22 11.195 -21.361 -15.384 178 HH TYR 22 HH TYR 22 12.578 -23.687 -15.488 179 H ASP 23 H ASP 23 11.629 -17.016 -10.600 180 HA ASP 23 HA ASP 23 12.843 -15.944 -8.181 181 HB2 ASP 23 1HB ASP 23 11.534 -13.944 -8.628 182 HB3 ASP 23 2HB ASP 23 12.369 -14.446 -10.095 183 H ILE 24 H ILE 24 11.518 -18.324 -7.711 184 HA ILE 24 HA ILE 24 8.834 -17.968 -6.861 185 HB ILE 24 HB ILE 24 10.523 -20.028 -5.542 186 HG12 ILE 24 1HG1 ILE 24 9.990 -21.335 -7.828 187 HG13 ILE 24 2HG1 ILE 24 10.208 -19.714 -8.480 188 HG21 ILE 24 1HG2 ILE 24 7.765 -19.874 -6.716 189 HG22 ILE 24 2HG2 ILE 24 8.499 -21.410 -6.261 190 HG23 ILE 24 3HG2 ILE 24 8.238 -20.163 -5.042 191 HD11 ILE 24 1HD1 ILE 24 12.170 -21.584 -7.359 192 HD12 ILE 24 2HD1 ILE 24 12.356 -20.337 -8.593 193 HD13 ILE 24 3HD1 ILE 24 12.373 -19.897 -6.885 194 HA PRO 25 HA PRO 25 9.477 -15.819 -3.059 195 HB2 PRO 25 1HB PRO 25 7.066 -16.336 -1.922 196 HB3 PRO 25 2HB PRO 25 7.279 -15.175 -3.238 197 HG2 PRO 25 1HG PRO 25 6.321 -18.009 -3.348 198 HG3 PRO 25 2HG PRO 25 5.691 -16.582 -4.190 199 HD2 PRO 25 1HD PRO 25 7.305 -18.390 -5.397 200 HD3 PRO 25 2HD PRO 25 7.321 -16.665 -5.817 201 H THR 26 H THR 26 10.765 -16.575 -1.507 202 HA THR 26 HA THR 26 10.277 -19.250 -0.406 203 HB THR 26 HB THR 26 12.552 -19.091 0.532 204 HG1 THR 26 1HG THR 26 12.715 -16.834 0.754 205 HG21 THR 26 1HG2 THR 26 11.862 -19.166 -2.260 206 HG22 THR 26 2HG2 THR 26 13.106 -20.067 -1.394 207 HG23 THR 26 3HG2 THR 26 13.468 -18.470 -2.048 208 H THR 27 H THR 27 8.670 -16.925 0.333 209 HA THR 27 HA THR 27 9.172 -17.003 3.224 210 HB THR 27 HB THR 27 8.203 -14.457 1.966 211 HG1 THR 27 1HG THR 27 10.925 -14.780 2.600 212 HG21 THR 27 1HG2 THR 27 9.680 -13.754 4.099 213 HG22 THR 27 2HG2 THR 27 9.184 -15.370 4.603 214 HG23 THR 27 3HG2 THR 27 7.967 -14.158 4.203 215 H GLU 28 H GLU 28 7.306 -16.690 4.534 216 HA GLU 28 HA GLU 28 4.889 -17.661 3.279 217 HB2 GLU 28 1HB GLU 28 5.775 -17.206 6.105 218 HB3 GLU 28 2HB GLU 28 4.068 -17.429 5.752 219 HG2 GLU 28 1HG GLU 28 4.875 -19.548 6.333 220 HG3 GLU 28 2HG GLU 28 4.723 -19.567 4.577 221 H ASN 29 H ASN 29 5.492 -15.160 2.306 222 HA ASN 29 HA ASN 29 3.136 -13.681 3.124 223 HB2 ASN 29 1HB ASN 29 5.926 -12.551 3.371 224 HB3 ASN 29 2HB ASN 29 4.487 -11.539 3.292 225 HD21 ASN 29 1HD2 ASN 29 6.366 -13.703 5.209 226 HD22 ASN 29 2HD2 ASN 29 5.502 -13.482 6.688 227 H LEU 30 H LEU 30 2.619 -11.922 1.632 228 HA LEU 30 HA LEU 30 3.965 -12.138 -0.971 229 HB2 LEU 30 1HB LEU 30 1.112 -12.615 -0.316 230 HB3 LEU 30 2HB LEU 30 1.469 -11.757 -1.813 231 HG LEU 30 HG LEU 30 2.428 -14.522 -1.076 232 HD11 LEU 30 1HD1 LEU 30 -0.046 -14.036 -1.748 233 HD12 LEU 30 2HD1 LEU 30 0.823 -15.386 -2.476 234 HD13 LEU 30 3HD1 LEU 30 0.632 -13.877 -3.368 235 HD21 LEU 30 1HD2 LEU 30 2.725 -13.941 -3.829 236 HD22 LEU 30 2HD2 LEU 30 3.981 -14.288 -2.640 237 HD23 LEU 30 3HD2 LEU 30 3.469 -12.623 -2.922 238 H TYR 31 H TYR 31 3.877 -10.284 -2.275 239 HA TYR 31 HA TYR 31 2.792 -7.869 -0.993 240 HB2 TYR 31 1HB TYR 31 5.383 -7.795 -2.509 241 HB3 TYR 31 2HB TYR 31 4.755 -6.641 -1.338 242 HD1 TYR 31 1HD TYR 31 4.439 -7.617 1.101 243 HD2 TYR 31 2HD TYR 31 7.049 -9.247 -1.837 244 HE1 TYR 31 1HE TYR 31 5.752 -8.699 2.877 245 HE2 TYR 31 2HE TYR 31 8.369 -10.335 -0.069 246 HH TYR 31 HH TYR 31 8.331 -10.954 2.140 247 H PHE 32 H PHE 32 1.818 -6.424 -2.326 248 HA PHE 32 HA PHE 32 2.025 -6.832 -5.222 249 HB2 PHE 32 1HB PHE 32 -0.592 -6.530 -3.735 250 HB3 PHE 32 2HB PHE 32 -0.402 -6.656 -5.480 251 HD1 PHE 32 1HD PHE 32 -0.160 -8.472 -2.294 252 HD2 PHE 32 2HD PHE 32 -0.060 -8.761 -6.539 253 HE1 PHE 32 1HE PHE 32 -0.330 -10.921 -2.128 254 HE2 PHE 32 2HE PHE 32 -0.231 -11.210 -6.380 255 HZ PHE 32 HZ PHE 32 -0.367 -12.293 -4.172 256 H GLN 33 H GLN 33 0.991 -4.990 -6.440 257 HA GLN 33 HA GLN 33 1.059 -2.471 -4.942 258 HB2 GLN 33 1HB GLN 33 2.830 -3.285 -7.190 259 HB3 GLN 33 2HB GLN 33 2.254 -1.623 -7.172 260 HG2 GLN 33 1HG GLN 33 3.080 -1.729 -4.672 261 HG3 GLN 33 2HG GLN 33 4.101 -3.015 -5.313 262 HE21 GLN 33 1HE2 GLN 33 3.299 0.379 -5.521 263 HE22 GLN 33 2HE2 GLN 33 4.756 0.876 -6.303 264 H GLY 34 H GLY 34 -0.812 -1.479 -5.270 265 HA2 GLY 34 1HA GLY 34 -1.875 -0.398 -7.445 266 HA3 GLY 34 2HA GLY 34 -2.365 -2.071 -7.669 267 H SER 35 H SER 35 -2.360 0.393 -5.090 268 HA SER 35 HA SER 35 -4.757 -0.734 -3.934 269 HB2 SER 35 1HB SER 35 -3.488 1.886 -3.149 270 HB3 SER 35 2HB SER 35 -4.451 0.794 -2.154 271 HG SER 35 HG SER 35 -1.772 0.759 -2.701 272 H SER 36 H SER 36 -6.602 0.750 -3.384 273 HA SER 36 HA SER 36 -7.577 1.936 -5.812 274 HB2 SER 36 1HB SER 36 -9.011 0.618 -4.234 275 HB3 SER 36 2HB SER 36 -8.873 1.941 -3.077 276 HG SER 36 HG SER 36 -9.780 2.398 -5.707 277 H GLY 37 H GLY 37 -5.365 3.349 -5.114 278 HA2 GLY 37 1HA GLY 37 -4.876 5.637 -5.227 279 HA3 GLY 37 2HA GLY 37 -6.504 5.990 -4.669 280 H SER 38 H SER 38 -6.965 5.555 -2.369 281 HA SER 38 HA SER 38 -4.665 6.356 -0.750 282 HB2 SER 38 1HB SER 38 -7.613 6.326 -0.055 283 HB3 SER 38 2HB SER 38 -6.324 6.992 0.946 284 HG SER 38 HG SER 38 -5.941 8.213 -1.232 285 H SER 39 H SER 39 -4.900 5.512 1.640 286 HA SER 39 HA SER 39 -4.613 2.646 1.469 287 HB2 SER 39 1HB SER 39 -4.131 4.694 3.616 288 HB3 SER 39 2HB SER 39 -4.133 2.974 4.006 289 HG SER 39 HG SER 39 -2.094 3.217 3.442 290 H GLY 40 H GLY 40 -7.053 4.877 2.401 291 HA2 GLY 40 1HA GLY 40 -8.467 3.158 4.201 292 HA3 GLY 40 2HA GLY 40 -9.086 4.627 3.461 293 H ASP 41 H ASP 41 -9.141 4.186 0.853 294 HA ASP 41 HA ASP 41 -11.406 2.812 0.305 295 HB2 ASP 41 1HB ASP 41 -8.974 3.183 -1.444 296 HB3 ASP 41 2HB ASP 41 -10.488 2.511 -2.044 297 H MET 42 H MET 42 -8.140 1.454 0.383 298 HA MET 42 HA MET 42 -8.490 -1.046 -0.618 299 HB2 MET 42 1HB MET 42 -6.818 0.053 1.578 300 HB3 MET 42 2HB MET 42 -6.941 -1.697 1.469 301 HG2 MET 42 1HG MET 42 -6.320 -0.193 -1.010 302 HG3 MET 42 2HG MET 42 -5.060 -0.337 0.214 303 HE1 MET 42 1HE MET 42 -6.869 -3.078 -2.666 304 HE2 MET 42 2HE MET 42 -6.534 -1.347 -2.653 305 HE3 MET 42 3HE MET 42 -5.272 -2.486 -3.125 306 H MET 43 H MET 43 -8.843 -0.365 2.870 307 HA MET 43 HA MET 43 -9.810 -2.653 3.840 308 HB2 MET 43 1HB MET 43 -11.270 -0.086 4.436 309 HB3 MET 43 2HB MET 43 -10.991 -1.449 5.511 310 HG2 MET 43 1HG MET 43 -8.461 -0.807 5.036 311 HG3 MET 43 2HG MET 43 -9.191 0.771 4.749 312 HE1 MET 43 1HE MET 43 -9.964 -2.173 7.354 313 HE2 MET 43 2HE MET 43 -8.217 -1.952 7.248 314 HE3 MET 43 3HE MET 43 -9.072 -1.523 8.731 315 H ARG 44 H ARG 44 -11.571 -0.503 1.704 316 HA ARG 44 HA ARG 44 -13.997 -2.092 1.898 317 HB2 ARG 44 1HB ARG 44 -13.249 0.434 0.452 318 HB3 ARG 44 2HB ARG 44 -14.729 -0.428 0.052 319 HG2 ARG 44 1HG ARG 44 -15.744 0.116 2.014 320 HG3 ARG 44 2HG ARG 44 -14.224 0.195 2.907 321 HD2 ARG 44 1HD ARG 44 -14.814 2.420 2.794 322 HD3 ARG 44 2HD ARG 44 -13.759 2.259 1.390 323 HE ARG 44 HE ARG 44 -16.249 1.767 0.407 324 HH11 ARG 44 2HH1 ARG 44 -14.810 4.369 2.218 325 HH12 ARG 44 1HH1 ARG 44 -15.846 5.584 1.545 326 HH21 ARG 44 2HH2 ARG 44 -17.619 3.357 -0.485 327 HH22 ARG 44 1HH2 ARG 44 -17.444 5.007 0.008 328 H GLU 45 H GLU 45 -11.913 -1.012 -0.795 329 HA GLU 45 HA GLU 45 -12.863 -2.520 -2.832 330 HB2 GLU 45 1HB GLU 45 -10.796 -0.927 -2.698 331 HB3 GLU 45 2HB GLU 45 -9.894 -2.412 -2.429 332 HG2 GLU 45 1HG GLU 45 -10.836 -3.302 -4.545 333 HG3 GLU 45 2HG GLU 45 -11.577 -1.728 -4.826 334 H ILE 46 H ILE 46 -10.827 -3.641 -0.190 335 HA ILE 46 HA ILE 46 -10.264 -6.207 -1.211 336 HB ILE 46 HB ILE 46 -10.464 -5.354 1.680 337 HG12 ILE 46 1HG1 ILE 46 -7.935 -5.618 0.072 338 HG13 ILE 46 2HG1 ILE 46 -8.853 -4.116 0.076 339 HG21 ILE 46 1HG2 ILE 46 -9.052 -7.707 0.430 340 HG22 ILE 46 2HG2 ILE 46 -9.016 -7.263 2.135 341 HG23 ILE 46 3HG2 ILE 46 -10.528 -7.780 1.391 342 HD11 ILE 46 1HD1 ILE 46 -8.050 -5.378 2.656 343 HD12 ILE 46 2HD1 ILE 46 -6.889 -4.429 1.727 344 HD13 ILE 46 3HD1 ILE 46 -8.387 -3.686 2.289 345 H ARG 47 H ARG 47 -12.545 -5.351 1.400 346 HA ARG 47 HA ARG 47 -13.830 -7.699 1.767 347 HB2 ARG 47 1HB ARG 47 -14.955 -4.906 1.698 348 HB3 ARG 47 2HB ARG 47 -15.939 -6.292 2.149 349 HG2 ARG 47 1HG ARG 47 -14.616 -6.731 4.057 350 HG3 ARG 47 2HG ARG 47 -13.359 -5.612 3.527 351 HD2 ARG 47 1HD ARG 47 -14.775 -4.695 5.335 352 HD3 ARG 47 2HD ARG 47 -14.828 -3.732 3.859 353 HE ARG 47 HE ARG 47 -16.937 -5.686 4.095 354 HH11 ARG 47 2HH1 ARG 47 -15.927 -2.423 4.767 355 HH12 ARG 47 1HH1 ARG 47 -17.542 -1.809 4.888 356 HH21 ARG 47 2HH2 ARG 47 -19.069 -4.890 4.253 357 HH22 ARG 47 1HH2 ARG 47 -19.329 -3.213 4.597 358 H LYS 48 H LYS 48 -14.493 -5.389 -0.838 359 HA LYS 48 HA LYS 48 -16.706 -6.536 -1.998 360 HB2 LYS 48 1HB LYS 48 -15.880 -4.452 -2.830 361 HB3 LYS 48 2HB LYS 48 -14.338 -5.171 -3.276 362 HG2 LYS 48 1HG LYS 48 -15.933 -6.680 -4.780 363 HG3 LYS 48 2HG LYS 48 -16.942 -5.235 -4.677 364 HD2 LYS 48 1HD LYS 48 -14.035 -5.121 -5.441 365 HD3 LYS 48 2HD LYS 48 -15.316 -5.367 -6.631 366 HE2 LYS 48 1HE LYS 48 -14.973 -3.063 -6.659 367 HE3 LYS 48 2HE LYS 48 -16.379 -3.260 -5.614 368 HZ1 LYS 48 1HZ LYS 48 -13.593 -2.977 -4.630 369 HZ2 LYS 48 2HZ LYS 48 -15.001 -3.005 -3.692 370 HZ3 LYS 48 3HZ LYS 48 -14.702 -1.703 -4.730 371 H VAL 49 H VAL 49 -13.300 -7.361 -2.583 372 HA VAL 49 HA VAL 49 -13.908 -9.456 -4.428 373 HB VAL 49 HB VAL 49 -11.335 -9.190 -2.885 374 HG11 VAL 49 1HG1 VAL 49 -11.494 -11.203 -4.175 375 HG12 VAL 49 2HG1 VAL 49 -12.041 -10.308 -5.594 376 HG13 VAL 49 3HG1 VAL 49 -10.392 -10.102 -5.002 377 HG21 VAL 49 1HG2 VAL 49 -11.386 -7.922 -5.507 378 HG22 VAL 49 2HG2 VAL 49 -12.448 -7.135 -4.339 379 HG23 VAL 49 3HG2 VAL 49 -10.734 -7.334 -3.977 380 H LEU 50 H LEU 50 -13.381 -9.262 -0.970 381 HA LEU 50 HA LEU 50 -12.995 -11.996 -0.446 382 HB2 LEU 50 1HB LEU 50 -14.261 -9.900 1.313 383 HB3 LEU 50 2HB LEU 50 -13.646 -11.462 1.850 384 HG LEU 50 HG LEU 50 -12.029 -9.152 0.779 385 HD11 LEU 50 1HD1 LEU 50 -12.986 -9.211 3.194 386 HD12 LEU 50 2HD1 LEU 50 -11.293 -8.795 2.934 387 HD13 LEU 50 3HD1 LEU 50 -11.729 -10.418 3.467 388 HD21 LEU 50 1HD2 LEU 50 -10.073 -10.514 1.175 389 HD22 LEU 50 2HD2 LEU 50 -11.143 -11.330 0.035 390 HD23 LEU 50 3HD2 LEU 50 -11.080 -11.856 1.717 391 H GLY 51 H GLY 51 -15.966 -10.060 0.002 392 HA2 GLY 51 1HA GLY 51 -17.671 -12.213 0.520 393 HA3 GLY 51 2HA GLY 51 -18.181 -10.651 -0.105 394 H ALA 52 H ALA 52 -16.401 -11.042 -2.492 395 HA ALA 52 HA ALA 52 -18.350 -12.136 -4.221 396 HB1 ALA 52 1HB ALA 52 -17.151 -10.947 -5.658 397 HB2 ALA 52 2HB ALA 52 -15.857 -10.762 -4.473 398 HB3 ALA 52 3HB ALA 52 -15.869 -12.155 -5.554 399 H ASN 53 H ASN 53 -15.358 -13.432 -2.858 400 HA ASN 53 HA ASN 53 -15.856 -15.999 -4.177 401 HB2 ASN 53 1HB ASN 53 -13.466 -14.675 -2.996 402 HB3 ASN 53 2HB ASN 53 -13.537 -16.433 -2.915 403 HD21 ASN 53 1HD2 ASN 53 -13.950 -13.753 -5.190 404 HD22 ASN 53 2HD2 ASN 53 -13.265 -14.573 -6.548 405 H ASN 54 H ASN 54 -17.547 -15.095 -2.015 406 HA ASN 54 HA ASN 54 -18.459 -15.806 -0.052 407 HB2 ASN 54 1HB ASN 54 -17.339 -18.283 -1.297 408 HB3 ASN 54 2HB ASN 54 -17.990 -18.379 0.336 409 HD21 ASN 54 1HD2 ASN 54 -19.002 -19.686 -1.982 410 HD22 ASN 54 2HD2 ASN 54 -20.606 -19.101 -2.245 411 H CYS 55 H CYS 55 -16.011 -14.498 0.257 412 HA CYS 55 HA CYS 55 -14.712 -16.006 2.424 413 HB2 CYS 55 1HB CYS 55 -13.659 -13.639 0.860 414 HB3 CYS 55 2HB CYS 55 -12.786 -14.519 2.108 415 HG CYS 55 HG CYS 55 -13.615 -15.600 -1.020 416 H ASP 56 H ASP 56 -14.886 -15.312 4.458 417 HA ASP 56 HA ASP 56 -16.424 -12.897 4.971 418 HB2 ASP 56 1HB ASP 56 -15.573 -15.248 6.633 419 HB3 ASP 56 2HB ASP 56 -16.140 -13.771 7.410 420 H TYR 57 H TYR 57 -15.732 -11.429 6.734 421 HA TYR 57 HA TYR 57 -12.842 -11.252 7.117 422 HB2 TYR 57 1HB TYR 57 -13.067 -8.730 6.591 423 HB3 TYR 57 2HB TYR 57 -12.967 -9.858 5.244 424 HD1 TYR 57 2HD TYR 57 -15.045 -10.461 3.993 425 HD2 TYR 57 1HD TYR 57 -14.989 -7.376 6.923 426 HE1 TYR 57 2HE TYR 57 -17.150 -9.570 3.086 427 HE2 TYR 57 1HE TYR 57 -17.095 -6.477 6.025 428 HH TYR 57 HH TYR 57 -19.158 -8.024 4.280 429 H GLU 58 H GLU 58 -12.291 -10.527 9.091 430 HA GLU 58 HA GLU 58 -14.410 -9.324 10.748 431 HB2 GLU 58 1HB GLU 58 -13.959 -11.655 11.410 432 HB3 GLU 58 2HB GLU 58 -12.264 -11.253 11.648 433 HG2 GLU 58 1HG GLU 58 -12.679 -10.033 13.557 434 HG3 GLU 58 2HG GLU 58 -14.364 -9.743 13.131 435 H GLN 59 H GLN 59 -13.863 -7.230 10.854 436 HA GLN 59 HA GLN 59 -11.257 -6.201 10.705 437 HB2 GLN 59 1HB GLN 59 -13.646 -5.070 10.493 438 HB3 GLN 59 2HB GLN 59 -13.363 -4.697 12.188 439 HG2 GLN 59 1HG GLN 59 -11.040 -3.862 11.230 440 HG3 GLN 59 2HG GLN 59 -12.001 -3.678 9.764 441 HE21 GLN 59 1HE2 GLN 59 -10.888 -1.492 10.918 442 HE22 GLN 59 2HE2 GLN 59 -12.113 -0.506 11.634 443 H ARG 60 H ARG 60 -9.661 -6.318 12.124 444 HA ARG 60 HA ARG 60 -10.277 -6.886 14.928 445 HB2 ARG 60 1HB ARG 60 -7.722 -7.075 13.331 446 HB3 ARG 60 2HB ARG 60 -7.794 -7.328 15.070 447 HG2 ARG 60 1HG ARG 60 -9.436 -8.915 13.117 448 HG3 ARG 60 2HG ARG 60 -7.825 -9.401 13.647 449 HD2 ARG 60 1HD ARG 60 -9.240 -10.555 15.089 450 HD3 ARG 60 2HD ARG 60 -8.761 -9.142 16.028 451 HE ARG 60 HE ARG 60 -11.179 -8.699 14.579 452 HH11 ARG 60 2HH1 ARG 60 -9.853 -10.164 17.446 453 HH12 ARG 60 1HH1 ARG 60 -11.330 -10.050 18.345 454 HH21 ARG 60 2HH2 ARG 60 -13.129 -8.544 15.752 455 HH22 ARG 60 1HH2 ARG 60 -13.193 -9.130 17.380 456 H GLU 61 H GLU 61 -8.241 -4.700 12.991 457 HA GLU 61 HA GLU 61 -8.338 -2.788 15.231 458 HB2 GLU 61 1HB GLU 61 -6.063 -3.388 13.341 459 HB3 GLU 61 2HB GLU 61 -6.111 -1.958 14.362 460 HG2 GLU 61 1HG GLU 61 -6.372 -3.552 16.320 461 HG3 GLU 61 2HG GLU 61 -5.925 -4.832 15.194 462 H ARG 62 H ARG 62 -7.494 -0.528 14.230 463 HA ARG 62 HA ARG 62 -9.586 0.509 12.756 464 HB2 ARG 62 1HB ARG 62 -8.205 2.025 13.942 465 HB3 ARG 62 2HB ARG 62 -6.753 1.461 13.126 466 HG2 ARG 62 1HG ARG 62 -7.164 2.686 11.242 467 HG3 ARG 62 2HG ARG 62 -8.912 2.681 11.488 468 HD2 ARG 62 1HD ARG 62 -7.097 4.130 13.381 469 HD3 ARG 62 2HD ARG 62 -7.594 4.875 11.863 470 HE ARG 62 HE ARG 62 -9.790 3.855 13.403 471 HH11 ARG 62 2HH1 ARG 62 -7.655 6.563 12.926 472 HH12 ARG 62 1HH1 ARG 62 -8.761 7.719 13.594 473 HH21 ARG 62 2HH2 ARG 62 -11.254 5.366 14.284 474 HH22 ARG 62 1HH2 ARG 62 -10.807 7.037 14.367 475 H PHE 63 H PHE 63 -6.292 -0.074 11.505 476 HA PHE 63 HA PHE 63 -7.448 -0.280 8.809 477 HB2 PHE 63 1HB PHE 63 -4.719 0.511 9.797 478 HB3 PHE 63 2HB PHE 63 -4.973 0.012 8.128 479 HD1 PHE 63 2HD PHE 63 -6.855 1.262 6.843 480 HD2 PHE 63 1HD PHE 63 -4.991 2.724 10.380 481 HE1 PHE 63 2HE PHE 63 -7.563 3.547 6.268 482 HE2 PHE 63 1HE PHE 63 -5.698 5.011 9.811 483 HZ PHE 63 HZ PHE 63 -6.985 5.425 7.752 484 H LEU 64 H LEU 64 -7.888 -2.504 10.195 485 HA LEU 64 HA LEU 64 -6.139 -4.430 8.887 486 HB2 LEU 64 1HB LEU 64 -5.178 -4.097 11.125 487 HB3 LEU 64 2HB LEU 64 -6.728 -4.530 11.843 488 HG LEU 64 HG LEU 64 -6.500 -6.797 10.891 489 HD11 LEU 64 1HD1 LEU 64 -4.978 -7.309 9.360 490 HD12 LEU 64 2HD1 LEU 64 -3.672 -6.690 10.371 491 HD13 LEU 64 3HD1 LEU 64 -4.547 -5.600 9.296 492 HD21 LEU 64 1HD2 LEU 64 -4.810 -5.606 12.940 493 HD22 LEU 64 2HD2 LEU 64 -4.135 -7.091 12.268 494 HD23 LEU 64 3HD2 LEU 64 -5.753 -7.096 12.973 495 H LEU 65 H LEU 65 -7.126 -6.382 8.418 496 HA LEU 65 HA LEU 65 -9.827 -6.868 9.398 497 HB2 LEU 65 1HB LEU 65 -9.118 -6.142 6.611 498 HB3 LEU 65 2HB LEU 65 -10.314 -7.416 6.838 499 HG LEU 65 HG LEU 65 -10.657 -4.788 8.224 500 HD11 LEU 65 1HD1 LEU 65 -11.744 -3.825 6.357 501 HD12 LEU 65 2HD1 LEU 65 -11.639 -5.322 5.431 502 HD13 LEU 65 3HD1 LEU 65 -10.179 -4.397 5.781 503 HD21 LEU 65 1HD2 LEU 65 -12.097 -6.726 8.766 504 HD22 LEU 65 2HD2 LEU 65 -12.627 -6.767 7.084 505 HD23 LEU 65 3HD2 LEU 65 -12.993 -5.365 8.091 506 H PHE 66 H PHE 66 -10.090 -8.954 9.842 507 HA PHE 66 HA PHE 66 -8.042 -10.844 9.077 508 HB2 PHE 66 1HB PHE 66 -9.146 -10.713 11.373 509 HB3 PHE 66 2HB PHE 66 -10.559 -11.450 10.624 510 HD1 PHE 66 1HD PHE 66 -9.851 -13.589 9.096 511 HD2 PHE 66 2HD PHE 66 -7.792 -12.142 12.529 512 HE1 PHE 66 1HE PHE 66 -8.875 -15.820 9.447 513 HE2 PHE 66 2HE PHE 66 -6.812 -14.370 12.885 514 HZ PHE 66 HZ PHE 66 -7.352 -16.212 11.342 515 H CYS 67 H CYS 67 -8.224 -11.330 6.935 516 HA CYS 67 HA CYS 67 -10.802 -12.044 5.809 517 HB2 CYS 67 1HB CYS 67 -8.087 -12.140 4.484 518 HB3 CYS 67 2HB CYS 67 -9.657 -12.159 3.689 519 HG CYS 67 HG CYS 67 -9.402 -9.466 5.567 520 H VAL 68 H VAL 68 -11.408 -14.065 5.114 521 HA VAL 68 HA VAL 68 -9.574 -16.303 5.429 522 HB VAL 68 HB VAL 68 -10.511 -16.209 7.640 523 HG11 VAL 68 1HG1 VAL 68 -13.022 -15.688 6.168 524 HG12 VAL 68 2HG1 VAL 68 -13.149 -16.653 7.640 525 HG13 VAL 68 3HG1 VAL 68 -12.449 -15.035 7.703 526 HG21 VAL 68 1HG2 VAL 68 -12.251 -18.361 6.818 527 HG22 VAL 68 2HG2 VAL 68 -10.724 -18.404 5.937 528 HG23 VAL 68 3HG2 VAL 68 -10.725 -18.425 7.700 529 H HIS 69 H HIS 69 -9.953 -17.901 3.996 530 HA HIS 69 HA HIS 69 -12.376 -17.665 2.339 531 HB2 HIS 69 1HB HIS 69 -10.472 -17.275 0.971 532 HB3 HIS 69 2HB HIS 69 -9.594 -18.626 1.680 533 HD1 HIS 69 1HD HIS 69 -9.418 -20.479 0.070 534 HD2 HIS 69 2HD HIS 69 -13.037 -18.471 -0.297 535 HE1 HIS 69 1HE HIS 69 -10.666 -21.670 -1.760 536 HE2 HIS 69 2HE HIS 69 -12.816 -20.385 -2.022 537 H GLY 70 H GLY 70 -13.827 -19.237 2.509 538 HA2 GLY 70 1HA GLY 70 -12.918 -21.858 3.529 539 HA3 GLY 70 2HA GLY 70 -14.478 -21.153 3.924 540 H ASP 71 H ASP 71 -12.840 -23.257 1.893 541 HA ASP 71 HA ASP 71 -14.722 -23.055 -0.312 542 HB2 ASP 71 1HB ASP 71 -12.328 -23.514 -0.748 543 HB3 ASP 71 2HB ASP 71 -12.475 -25.030 0.137 544 H GLY 72 H GLY 72 -13.947 -25.243 2.347 545 HA2 GLY 72 1HA GLY 72 -16.619 -26.307 2.313 546 HA3 GLY 72 2HA GLY 72 -15.417 -27.467 1.767 547 H HIS 73 H HIS 73 -13.311 -27.093 3.382 548 HA HIS 73 HA HIS 73 -14.303 -27.184 6.137 549 HB2 HIS 73 1HB HIS 73 -13.040 -29.412 4.620 550 HB3 HIS 73 2HB HIS 73 -12.567 -29.207 6.304 551 HD1 HIS 73 1HD HIS 73 -14.102 -30.167 8.018 552 HD2 HIS 73 2HD HIS 73 -15.918 -29.814 4.298 553 HE1 HIS 73 1HE HIS 73 -16.335 -31.301 8.250 554 HE2 HIS 73 2HE HIS 73 -17.380 -31.149 5.963 555 H ALA 74 H ALA 74 -12.167 -27.690 7.571 556 HA ALA 74 HA ALA 74 -10.637 -25.363 7.488 557 HB1 ALA 74 1HB ALA 74 -9.061 -27.181 8.854 558 HB2 ALA 74 2HB ALA 74 -10.309 -26.145 9.548 559 HB3 ALA 74 3HB ALA 74 -10.702 -27.795 9.064 560 H GLU 75 H GLU 75 -9.882 -28.623 6.312 561 HA GLU 75 HA GLU 75 -7.259 -28.401 5.619 562 HB2 GLU 75 1HB GLU 75 -9.490 -29.700 4.051 563 HB3 GLU 75 2HB GLU 75 -7.784 -29.925 3.690 564 HG2 GLU 75 1HG GLU 75 -7.426 -30.908 5.879 565 HG3 GLU 75 2HG GLU 75 -9.119 -30.639 6.291 566 H ASN 76 H ASN 76 -10.022 -27.278 3.689 567 HA ASN 76 HA ASN 76 -8.232 -26.027 1.767 568 HB2 ASN 76 1HB ASN 76 -11.258 -26.059 1.859 569 HB3 ASN 76 2HB ASN 76 -10.267 -25.501 0.514 570 HD21 ASN 76 1HD2 ASN 76 -12.242 -27.808 1.110 571 HD22 ASN 76 2HD2 ASN 76 -11.455 -29.176 0.407 572 H LEU 77 H LEU 77 -9.947 -25.209 4.600 573 HA LEU 77 HA LEU 77 -10.491 -22.488 4.125 574 HB2 LEU 77 1HB LEU 77 -11.347 -23.939 6.010 575 HB3 LEU 77 2HB LEU 77 -9.784 -23.697 6.787 576 HG LEU 77 HG LEU 77 -10.293 -21.202 6.667 577 HD11 LEU 77 1HD1 LEU 77 -13.006 -21.146 6.812 578 HD12 LEU 77 2HD1 LEU 77 -12.746 -22.332 5.533 579 HD13 LEU 77 3HD1 LEU 77 -12.063 -20.712 5.385 580 HD21 LEU 77 1HD2 LEU 77 -11.542 -23.234 8.427 581 HD22 LEU 77 2HD2 LEU 77 -12.108 -21.570 8.576 582 HD23 LEU 77 3HD2 LEU 77 -10.401 -21.946 8.812 583 H VAL 78 H VAL 78 -9.317 -20.644 4.438 584 HA VAL 78 HA VAL 78 -6.554 -20.895 5.387 585 HB VAL 78 HB VAL 78 -7.362 -19.586 2.787 586 HG11 VAL 78 1HG1 VAL 78 -4.526 -19.672 3.282 587 HG12 VAL 78 2HG1 VAL 78 -5.552 -18.297 2.870 588 HG13 VAL 78 3HG1 VAL 78 -5.355 -18.778 4.555 589 HG21 VAL 78 1HG2 VAL 78 -6.912 -21.607 1.959 590 HG22 VAL 78 2HG2 VAL 78 -5.224 -21.291 2.357 591 HG23 VAL 78 3HG2 VAL 78 -6.247 -22.171 3.492 592 H GLN 79 H GLN 79 -6.367 -19.531 7.029 593 HA GLN 79 HA GLN 79 -7.947 -17.059 7.025 594 HB2 GLN 79 1HB GLN 79 -6.587 -18.595 9.235 595 HB3 GLN 79 2HB GLN 79 -7.249 -16.982 9.468 596 HG2 GLN 79 1HG GLN 79 -9.449 -17.715 9.096 597 HG3 GLN 79 2HG GLN 79 -8.907 -19.253 8.426 598 HE21 GLN 79 1HE2 GLN 79 -9.039 -20.925 9.729 599 HE22 GLN 79 2HE2 GLN 79 -9.049 -20.876 11.456 600 H TRP 80 H TRP 80 -7.014 -15.137 6.758 601 HA TRP 80 HA TRP 80 -4.211 -14.748 7.424 602 HB2 TRP 80 1HB TRP 80 -3.528 -14.002 5.265 603 HB3 TRP 80 2HB TRP 80 -4.322 -15.557 5.029 604 HD1 TRP 80 HD TRP 80 -4.679 -11.858 4.218 605 HE1 TRP 80 1HE TRP 80 -6.576 -11.557 2.504 606 HE3 TRP 80 3HE TRP 80 -6.566 -16.609 4.253 607 HZ2 TRP 80 2HZ TRP 80 -8.604 -13.126 1.324 608 HZ3 TRP 80 3HZ TRP 80 -8.486 -17.127 2.804 609 HH2 TRP 80 HH TRP 80 -9.483 -15.420 1.371 610 H GLU 81 H GLU 81 -3.669 -12.613 7.833 611 HA GLU 81 HA GLU 81 -5.960 -10.799 8.064 612 HB2 GLU 81 1HB GLU 81 -3.329 -11.024 9.479 613 HB3 GLU 81 2HB GLU 81 -4.181 -9.487 9.470 614 HG2 GLU 81 1HG GLU 81 -6.192 -10.785 10.338 615 HG3 GLU 81 2HG GLU 81 -5.057 -12.097 10.651 616 H MET 82 H MET 82 -6.199 -9.222 6.638 617 HA MET 82 HA MET 82 -3.947 -8.481 4.932 618 HB2 MET 82 1HB MET 82 -6.916 -7.994 4.746 619 HB3 MET 82 2HB MET 82 -5.765 -7.211 3.672 620 HG2 MET 82 1HG MET 82 -4.956 -9.525 3.064 621 HG3 MET 82 2HG MET 82 -6.369 -10.139 3.919 622 HE1 MET 82 1HE MET 82 -5.005 -8.300 0.773 623 HE2 MET 82 2HE MET 82 -6.462 -7.584 0.083 624 HE3 MET 82 3HE MET 82 -5.821 -6.980 1.612 625 H GLU 83 H GLU 83 -2.696 -7.057 6.045 626 HA GLU 83 HA GLU 83 -3.992 -4.749 7.306 627 HB2 GLU 83 1HB GLU 83 -2.329 -6.101 8.603 628 HB3 GLU 83 2HB GLU 83 -1.094 -5.587 7.462 629 HG2 GLU 83 1HG GLU 83 -1.132 -3.397 8.203 630 HG3 GLU 83 2HG GLU 83 -2.734 -3.561 8.919 631 H VAL 84 H VAL 84 -3.824 -2.741 6.508 632 HA VAL 84 HA VAL 84 -2.438 -2.403 3.963 633 HB VAL 84 HB VAL 84 -4.292 -0.498 5.399 634 HG11 VAL 84 1HG1 VAL 84 -4.014 -0.234 2.516 635 HG12 VAL 84 2HG1 VAL 84 -3.927 0.995 3.780 636 HG13 VAL 84 3HG1 VAL 84 -2.500 0.041 3.377 637 HG21 VAL 84 1HG2 VAL 84 -4.774 -2.608 3.321 638 HG22 VAL 84 2HG2 VAL 84 -5.622 -2.342 4.844 639 HG23 VAL 84 3HG2 VAL 84 -5.853 -1.224 3.500 640 H CYS 85 H CYS 85 -0.398 -1.741 4.015 641 HA CYS 85 HA CYS 85 0.385 0.229 6.062 642 HB2 CYS 85 1HB CYS 85 2.697 -0.689 5.824 643 HB3 CYS 85 2HB CYS 85 1.540 -1.844 6.474 644 HG CYS 85 HG CYS 85 1.696 -3.620 4.583 645 H LYS 86 H LYS 86 1.611 1.985 5.443 646 HA LYS 86 HA LYS 86 1.913 2.365 2.535 647 HB2 LYS 86 1HB LYS 86 0.171 3.795 3.641 648 HB3 LYS 86 2HB LYS 86 1.454 4.527 4.596 649 HG2 LYS 86 1HG LYS 86 2.538 5.237 2.470 650 HG3 LYS 86 2HG LYS 86 1.116 4.645 1.609 651 HD2 LYS 86 1HD LYS 86 -0.225 6.331 2.388 652 HD3 LYS 86 2HD LYS 86 0.708 6.533 3.873 653 HE2 LYS 86 1HE LYS 86 1.315 8.433 2.751 654 HE3 LYS 86 2HE LYS 86 2.573 7.330 2.195 655 HZ1 LYS 86 1HZ LYS 86 0.716 8.736 0.658 656 HZ2 LYS 86 2HZ LYS 86 0.354 7.091 0.497 657 HZ3 LYS 86 3HZ LYS 86 1.905 7.656 0.126 658 H LEU 87 H LEU 87 3.833 3.101 1.761 659 HA LEU 87 HA LEU 87 5.869 4.052 3.615 660 HB2 LEU 87 1HB LEU 87 7.509 2.456 2.421 661 HB3 LEU 87 2HB LEU 87 6.499 1.837 3.726 662 HG LEU 87 HG LEU 87 6.760 0.334 1.723 663 HD11 LEU 87 1HD1 LEU 87 4.745 0.562 3.443 664 HD12 LEU 87 2HD1 LEU 87 4.723 -0.589 2.107 665 HD13 LEU 87 3HD1 LEU 87 3.872 0.948 1.960 666 HD21 LEU 87 1HD2 LEU 87 5.633 0.812 -0.292 667 HD22 LEU 87 2HD2 LEU 87 6.560 2.262 0.090 668 HD23 LEU 87 3HD2 LEU 87 4.824 2.218 0.401 669 HA PRO 88 HA PRO 88 6.872 6.723 0.273 670 HB2 PRO 88 1HB PRO 88 9.465 7.272 0.860 671 HB3 PRO 88 2HB PRO 88 8.111 7.929 1.786 672 HG2 PRO 88 1HG PRO 88 9.873 5.589 2.406 673 HG3 PRO 88 2HG PRO 88 9.290 6.868 3.487 674 HD2 PRO 88 1HD PRO 88 8.162 4.408 3.399 675 HD3 PRO 88 2HD PRO 88 7.227 5.874 3.755 676 H ARG 89 H ARG 89 8.593 3.771 0.798 677 HA ARG 89 HA ARG 89 10.492 3.734 -1.187 678 HB2 ARG 89 1HB ARG 89 8.719 1.587 -0.063 679 HB3 ARG 89 2HB ARG 89 9.847 1.222 -1.362 680 HG2 ARG 89 1HG ARG 89 10.886 2.637 1.031 681 HG3 ARG 89 2HG ARG 89 10.498 0.922 1.173 682 HD2 ARG 89 1HD ARG 89 11.937 0.483 -0.797 683 HD3 ARG 89 2HD ARG 89 12.384 2.189 -0.810 684 HE ARG 89 HE ARG 89 13.019 1.439 1.695 685 HH11 ARG 89 2HH1 ARG 89 13.739 0.071 -1.424 686 HH12 ARG 89 1HH1 ARG 89 15.257 -0.600 -0.925 687 HH21 ARG 89 2HH2 ARG 89 15.016 0.561 2.364 688 HH22 ARG 89 1HH2 ARG 89 15.981 -0.321 1.230 689 H LEU 90 H LEU 90 7.013 3.250 -1.491 690 HA LEU 90 HA LEU 90 7.310 3.496 -4.406 691 HB2 LEU 90 1HB LEU 90 5.236 1.745 -3.120 692 HB3 LEU 90 2HB LEU 90 5.696 1.823 -4.819 693 HG LEU 90 HG LEU 90 7.701 0.918 -2.799 694 HD11 LEU 90 1HD1 LEU 90 5.425 -0.287 -2.545 695 HD12 LEU 90 2HD1 LEU 90 6.896 -1.248 -2.687 696 HD13 LEU 90 3HD1 LEU 90 5.841 -1.039 -4.085 697 HD21 LEU 90 1HD2 LEU 90 8.635 -0.250 -4.635 698 HD22 LEU 90 2HD2 LEU 90 8.227 1.361 -5.225 699 HD23 LEU 90 3HD2 LEU 90 7.188 -0.011 -5.615 700 H SER 91 H SER 91 6.481 5.235 -2.010 701 HA SER 91 HA SER 91 4.835 6.728 -1.436 702 HB2 SER 91 1HB SER 91 5.930 7.450 -3.734 703 HB3 SER 91 2HB SER 91 4.308 7.136 -4.351 704 HG SER 91 HG SER 91 4.982 9.340 -3.393 705 H LEU 92 H LEU 92 3.889 4.010 -1.681 706 HA LEU 92 HA LEU 92 1.057 4.595 -2.020 707 HB2 LEU 92 1HB LEU 92 2.535 2.453 -3.523 708 HB3 LEU 92 2HB LEU 92 0.793 2.397 -3.262 709 HG LEU 92 HG LEU 92 2.219 4.624 -4.711 710 HD11 LEU 92 1HD1 LEU 92 2.490 3.059 -6.304 711 HD12 LEU 92 2HD1 LEU 92 0.778 3.355 -6.605 712 HD13 LEU 92 3HD1 LEU 92 1.273 1.986 -5.610 713 HD21 LEU 92 1HD2 LEU 92 -0.114 5.062 -5.533 714 HD22 LEU 92 2HD2 LEU 92 0.155 5.395 -3.822 715 HD23 LEU 92 3HD2 LEU 92 -0.682 3.921 -4.314 716 H ASN 93 H ASN 93 -0.134 2.304 -1.545 717 HA ASN 93 HA ASN 93 1.119 1.242 0.902 718 HB2 ASN 93 1HB ASN 93 -1.038 1.131 1.958 719 HB3 ASN 93 2HB ASN 93 -0.830 2.762 1.329 720 HD21 ASN 93 1HD2 ASN 93 -1.707 3.063 -0.936 721 HD22 ASN 93 2HD2 ASN 93 -3.248 2.354 -1.262 722 H GLY 94 H GLY 94 1.943 -0.615 -0.017 723 HA2 GLY 94 1HA GLY 94 0.475 -2.289 -1.785 724 HA3 GLY 94 2HA GLY 94 1.947 -2.726 -0.929 725 H VAL 95 H VAL 95 0.010 -4.606 -1.299 726 HA VAL 95 HA VAL 95 -1.320 -4.810 1.321 727 HB VAL 95 HB VAL 95 -1.981 -6.499 -1.079 728 HG11 VAL 95 1HG1 VAL 95 -3.126 -7.510 0.575 729 HG12 VAL 95 2HG1 VAL 95 -3.063 -6.094 1.627 730 HG13 VAL 95 3HG1 VAL 95 -4.263 -6.184 0.336 731 HG21 VAL 95 1HG2 VAL 95 -3.998 -4.743 -1.072 732 HG22 VAL 95 2HG2 VAL 95 -2.701 -3.684 -0.518 733 HG23 VAL 95 3HG2 VAL 95 -2.550 -4.532 -2.057 734 H ARG 96 H ARG 96 -0.178 -5.987 2.710 735 HA ARG 96 HA ARG 96 1.474 -8.191 1.722 736 HB2 ARG 96 1HB ARG 96 2.271 -6.336 3.362 737 HB3 ARG 96 2HB ARG 96 1.397 -7.262 4.575 738 HG2 ARG 96 1HG ARG 96 2.796 -9.143 4.287 739 HG3 ARG 96 2HG ARG 96 3.504 -8.478 2.814 740 HD2 ARG 96 1HD ARG 96 3.788 -7.269 5.562 741 HD3 ARG 96 2HD ARG 96 4.990 -8.303 4.791 742 HE ARG 96 HE ARG 96 4.240 -5.990 3.243 743 HH11 ARG 96 2HH1 ARG 96 6.383 -7.269 5.670 744 HH12 ARG 96 1HH1 ARG 96 7.619 -6.088 5.388 745 HH21 ARG 96 2HH2 ARG 96 5.860 -4.430 2.862 746 HH22 ARG 96 1HH2 ARG 96 7.320 -4.473 3.791 747 H PHE 97 H PHE 97 0.906 -10.252 1.971 748 HA PHE 97 HA PHE 97 -1.497 -10.851 3.529 749 HB2 PHE 97 1HB PHE 97 -0.009 -12.467 1.451 750 HB3 PHE 97 2HB PHE 97 -1.439 -13.031 2.308 751 HD1 PHE 97 1HD PHE 97 -0.389 -9.977 0.431 752 HD2 PHE 97 2HD PHE 97 -3.398 -12.903 1.139 753 HE1 PHE 97 1HE PHE 97 -1.818 -8.912 -1.266 754 HE2 PHE 97 2HE PHE 97 -4.832 -11.844 -0.557 755 HZ PHE 97 HZ PHE 97 -4.042 -9.846 -1.762 756 H LYS 98 H LYS 98 -1.554 -12.372 5.153 757 HA LYS 98 HA LYS 98 0.991 -13.597 5.954 758 HB2 LYS 98 1HB LYS 98 0.614 -11.514 7.270 759 HB3 LYS 98 2HB LYS 98 -0.893 -12.201 7.863 760 HG2 LYS 98 1HG LYS 98 0.423 -14.079 8.832 761 HG3 LYS 98 2HG LYS 98 1.893 -13.219 8.368 762 HD2 LYS 98 1HD LYS 98 1.612 -11.602 9.959 763 HD3 LYS 98 2HD LYS 98 -0.148 -11.738 9.942 764 HE2 LYS 98 1HE LYS 98 -0.153 -13.545 11.376 765 HE3 LYS 98 2HE LYS 98 1.494 -14.015 10.958 766 HZ1 LYS 98 1HZ LYS 98 0.565 -11.976 12.849 767 HZ2 LYS 98 2HZ LYS 98 2.040 -11.724 12.060 768 HZ3 LYS 98 3HZ LYS 98 1.815 -13.106 13.010 769 H ARG 99 H ARG 99 0.688 -15.718 5.983 770 HA ARG 99 HA ARG 99 -1.914 -16.893 6.154 771 HB2 ARG 99 1HB ARG 99 -0.275 -17.975 4.778 772 HB3 ARG 99 2HB ARG 99 0.861 -18.080 6.116 773 HG2 ARG 99 1HG ARG 99 -0.832 -19.566 7.264 774 HG3 ARG 99 2HG ARG 99 -1.682 -19.625 5.719 775 HD2 ARG 99 1HD ARG 99 -0.292 -21.540 5.794 776 HD3 ARG 99 2HD ARG 99 0.483 -20.403 4.691 777 HE ARG 99 HE ARG 99 1.664 -19.865 7.064 778 HH11 ARG 99 2HH1 ARG 99 1.152 -22.796 5.256 779 HH12 ARG 99 1HH1 ARG 99 2.587 -23.566 5.847 780 HH21 ARG 99 2HH2 ARG 99 3.556 -20.868 7.849 781 HH22 ARG 99 1HH2 ARG 99 3.953 -22.469 7.323 782 H ILE 100 H ILE 100 -3.006 -17.234 7.963 783 HA ILE 100 HA ILE 100 -1.577 -17.339 10.511 784 HB ILE 100 HB ILE 100 -4.530 -17.092 9.932 785 HG12 ILE 100 1HG1 ILE 100 -2.444 -15.103 10.840 786 HG13 ILE 100 2HG1 ILE 100 -3.368 -15.067 9.343 787 HG21 ILE 100 1HG2 ILE 100 -4.964 -17.012 12.200 788 HG22 ILE 100 2HG2 ILE 100 -3.728 -18.264 12.105 789 HG23 ILE 100 3HG2 ILE 100 -3.292 -16.633 12.612 790 HD11 ILE 100 1HD1 ILE 100 -5.206 -14.208 10.340 791 HD12 ILE 100 2HD1 ILE 100 -4.900 -15.032 11.869 792 HD13 ILE 100 3HD1 ILE 100 -3.987 -13.583 11.451 793 H SER 101 H SER 101 -4.195 -19.117 8.866 794 HA SER 101 HA SER 101 -3.274 -21.550 10.247 795 HB2 SER 101 1HB SER 101 -6.166 -20.963 9.594 796 HB3 SER 101 2HB SER 101 -5.530 -22.276 10.584 797 HG SER 101 HG SER 101 -4.920 -19.663 11.347 798 H GLY 102 H GLY 102 -4.311 -20.018 7.342 799 HA2 GLY 102 1HA GLY 102 -5.045 -22.221 5.781 800 HA3 GLY 102 2HA GLY 102 -4.363 -20.725 5.160 801 H THR 103 H THR 103 -3.418 -22.256 3.576 802 HA THR 103 HA THR 103 -0.842 -23.259 4.583 803 HB THR 103 HB THR 103 -0.956 -25.155 3.030 804 HG1 THR 103 1HG THR 103 -3.334 -23.880 2.301 805 HG21 THR 103 1HG2 THR 103 -3.190 -26.151 4.169 806 HG22 THR 103 2HG2 THR 103 -2.884 -24.779 5.234 807 HG23 THR 103 3HG2 THR 103 -1.645 -26.013 5.009 808 H SER 104 H SER 104 0.918 -22.923 3.279 809 HA SER 104 HA SER 104 1.202 -20.770 1.720 810 HB2 SER 104 1HB SER 104 2.965 -22.184 0.402 811 HB3 SER 104 2HB SER 104 3.194 -21.906 2.128 812 HG SER 104 HG SER 104 1.752 -24.051 2.008 813 H ILE 105 H ILE 105 0.531 -23.983 0.319 814 HA ILE 105 HA ILE 105 0.208 -23.277 -2.311 815 HB ILE 105 HB ILE 105 -1.262 -25.359 -0.704 816 HG12 ILE 105 1HG1 ILE 105 1.036 -25.901 -0.883 817 HG13 ILE 105 2HG1 ILE 105 0.238 -26.857 -2.127 818 HG21 ILE 105 1HG2 ILE 105 -1.907 -24.364 -3.308 819 HG22 ILE 105 2HG2 ILE 105 -1.340 -26.029 -3.434 820 HG23 ILE 105 3HG2 ILE 105 -2.695 -25.637 -2.376 821 HD11 ILE 105 1HD1 ILE 105 2.072 -26.049 -3.243 822 HD12 ILE 105 2HD1 ILE 105 0.846 -24.853 -3.666 823 HD13 ILE 105 3HD1 ILE 105 2.030 -24.496 -2.409 824 H ALA 106 H ALA 106 -2.606 -23.828 -0.195 825 HA ALA 106 HA ALA 106 -4.407 -22.445 -1.859 826 HB1 ALA 106 1HB ALA 106 -5.498 -22.367 0.698 827 HB2 ALA 106 2HB ALA 106 -5.761 -23.605 -0.531 828 HB3 ALA 106 3HB ALA 106 -4.495 -23.818 0.679 829 H PHE 107 H PHE 107 -1.966 -21.254 0.084 830 HA PHE 107 HA PHE 107 -3.305 -18.806 0.863 831 HB2 PHE 107 1HB PHE 107 -1.589 -19.854 2.318 832 HB3 PHE 107 2HB PHE 107 -0.380 -19.551 1.074 833 HD1 PHE 107 1HD PHE 107 -2.778 -17.866 3.342 834 HD2 PHE 107 2HD PHE 107 0.735 -17.505 0.967 835 HE1 PHE 107 1HE PHE 107 -2.367 -15.635 4.295 836 HE2 PHE 107 2HE PHE 107 1.152 -15.274 1.916 837 HZ PHE 107 HZ PHE 107 -0.399 -14.336 3.583 838 H LYS 108 H LYS 108 -0.961 -19.885 -1.531 839 HA LYS 108 HA LYS 108 -0.658 -17.190 -2.589 840 HB2 LYS 108 1HB LYS 108 0.516 -19.757 -3.663 841 HB3 LYS 108 2HB LYS 108 1.029 -18.116 -4.033 842 HG2 LYS 108 1HG LYS 108 2.184 -17.889 -2.092 843 HG3 LYS 108 2HG LYS 108 1.104 -18.958 -1.194 844 HD2 LYS 108 1HD LYS 108 3.209 -20.066 -1.407 845 HD3 LYS 108 2HD LYS 108 2.068 -20.875 -2.484 846 HE2 LYS 108 1HE LYS 108 3.741 -18.653 -3.555 847 HE3 LYS 108 2HE LYS 108 4.485 -20.230 -3.298 848 HZ1 LYS 108 1HZ LYS 108 3.526 -19.828 -5.565 849 HZ2 LYS 108 2HZ LYS 108 1.991 -19.870 -4.856 850 HZ3 LYS 108 3HZ LYS 108 2.988 -21.235 -4.794 851 H ASN 109 H ASN 109 -1.993 -20.320 -3.559 852 HA ASN 109 HA ASN 109 -2.716 -19.703 -6.173 853 HB2 ASN 109 1HB ASN 109 -3.810 -21.606 -4.126 854 HB3 ASN 109 2HB ASN 109 -4.625 -21.418 -5.676 855 HD21 ASN 109 1HD2 ASN 109 -1.856 -22.632 -4.026 856 HD22 ASN 109 2HD2 ASN 109 -1.162 -23.475 -5.364 857 H ILE 110 H ILE 110 -4.214 -18.826 -3.148 858 HA ILE 110 HA ILE 110 -6.582 -17.776 -4.485 859 HB ILE 110 HB ILE 110 -6.838 -18.965 -2.334 860 HG12 ILE 110 1HG1 ILE 110 -8.206 -17.161 -1.200 861 HG13 ILE 110 2HG1 ILE 110 -7.584 -16.037 -2.403 862 HG21 ILE 110 1HG2 ILE 110 -4.661 -18.124 -1.396 863 HG22 ILE 110 2HG2 ILE 110 -5.481 -16.600 -1.062 864 HG23 ILE 110 3HG2 ILE 110 -6.029 -18.084 -0.284 865 HD11 ILE 110 1HD1 ILE 110 -9.681 -16.691 -3.195 866 HD12 ILE 110 2HD1 ILE 110 -8.529 -17.637 -4.139 867 HD13 ILE 110 3HD1 ILE 110 -9.399 -18.386 -2.801 868 H ALA 111 H ALA 111 -3.763 -16.633 -2.686 869 HA ALA 111 HA ALA 111 -4.417 -13.932 -2.497 870 HB1 ALA 111 1HB ALA 111 -1.833 -15.428 -2.566 871 HB2 ALA 111 2HB ALA 111 -1.830 -13.664 -2.586 872 HB3 ALA 111 3HB ALA 111 -2.576 -14.529 -1.242 873 H SER 112 H SER 112 -3.272 -15.800 -5.204 874 HA SER 112 HA SER 112 -2.366 -13.662 -6.817 875 HB2 SER 112 1HB SER 112 -1.961 -16.187 -7.122 876 HB3 SER 112 2HB SER 112 -3.541 -16.217 -7.904 877 HG SER 112 HG SER 112 -2.626 -15.449 -9.619 878 H LYS 113 H LYS 113 -5.511 -15.184 -6.385 879 HA LYS 113 HA LYS 113 -6.807 -13.854 -8.531 880 HB2 LYS 113 1HB LYS 113 -7.662 -15.446 -6.169 881 HB3 LYS 113 2HB LYS 113 -8.869 -14.414 -6.924 882 HG2 LYS 113 1HG LYS 113 -9.090 -16.544 -7.911 883 HG3 LYS 113 2HG LYS 113 -8.292 -15.521 -9.108 884 HD2 LYS 113 1HD LYS 113 -6.105 -16.467 -8.051 885 HD3 LYS 113 2HD LYS 113 -7.166 -17.748 -7.458 886 HE2 LYS 113 1HE LYS 113 -7.805 -18.347 -9.673 887 HE3 LYS 113 2HE LYS 113 -7.026 -16.918 -10.350 888 HZ1 LYS 113 1HZ LYS 113 -5.743 -19.323 -9.200 889 HZ2 LYS 113 2HZ LYS 113 -4.893 -17.880 -9.434 890 HZ3 LYS 113 3HZ LYS 113 -5.569 -18.687 -10.758 891 H ILE 114 H ILE 114 -7.176 -13.344 -5.016 892 HA ILE 114 HA ILE 114 -8.669 -11.097 -4.950 893 HB ILE 114 HB ILE 114 -6.213 -11.553 -3.252 894 HG12 ILE 114 1HG1 ILE 114 -7.847 -13.429 -3.244 895 HG13 ILE 114 2HG1 ILE 114 -7.706 -12.636 -1.678 896 HG21 ILE 114 1HG2 ILE 114 -7.701 -10.222 -1.595 897 HG22 ILE 114 2HG2 ILE 114 -6.783 -9.354 -2.825 898 HG23 ILE 114 3HG2 ILE 114 -8.506 -9.646 -3.055 899 HD11 ILE 114 1HD1 ILE 114 -9.757 -11.327 -2.269 900 HD12 ILE 114 2HD1 ILE 114 -9.931 -12.376 -3.677 901 HD13 ILE 114 3HD1 ILE 114 -10.001 -13.060 -2.053 902 H ALA 115 H ALA 115 -5.395 -11.336 -6.078 903 HA ALA 115 HA ALA 115 -4.873 -8.511 -6.040 904 HB1 ALA 115 1HB ALA 115 -2.849 -9.098 -7.311 905 HB2 ALA 115 2HB ALA 115 -3.033 -10.074 -5.853 906 HB3 ALA 115 3HB ALA 115 -3.424 -10.761 -7.429 907 H ASN 116 H ASN 116 -5.912 -10.879 -8.443 908 HA ASN 116 HA ASN 116 -5.763 -9.179 -10.691 909 HB2 ASN 116 1HB ASN 116 -6.682 -10.917 -11.873 910 HB3 ASN 116 2HB ASN 116 -6.148 -11.800 -10.446 911 HD21 ASN 116 1HD2 ASN 116 -7.609 -13.325 -10.125 912 HD22 ASN 116 2HD2 ASN 116 -9.317 -13.082 -10.037 913 H GLU 117 H GLU 117 -8.289 -9.791 -8.318 914 HA GLU 117 HA GLU 117 -10.312 -8.317 -9.687 915 HB2 GLU 117 1HB GLU 117 -10.105 -9.118 -6.779 916 HB3 GLU 117 2HB GLU 117 -11.545 -8.465 -7.548 917 HG2 GLU 117 1HG GLU 117 -10.314 -10.876 -8.753 918 HG3 GLU 117 2HG GLU 117 -11.169 -11.061 -7.223 919 H LEU 118 H LEU 118 -7.949 -7.563 -7.187 920 HA LEU 118 HA LEU 118 -8.965 -4.875 -6.837 921 HB2 LEU 118 1HB LEU 118 -6.538 -6.280 -5.736 922 HB3 LEU 118 2HB LEU 118 -6.994 -4.626 -5.330 923 HG LEU 118 HG LEU 118 -8.826 -6.952 -4.813 924 HD11 LEU 118 1HD1 LEU 118 -7.953 -7.202 -2.635 925 HD12 LEU 118 2HD1 LEU 118 -6.917 -5.786 -2.805 926 HD13 LEU 118 3HD1 LEU 118 -6.567 -7.249 -3.724 927 HD21 LEU 118 1HD2 LEU 118 -8.808 -4.071 -4.283 928 HD22 LEU 118 2HD2 LEU 118 -9.225 -5.067 -2.888 929 HD23 LEU 118 3HD2 LEU 118 -10.158 -5.201 -4.379 930 H LYS 119 H LYS 119 -7.738 -5.967 -9.423 931 HA LYS 119 HA LYS 119 -6.303 -5.299 -11.073 932 HB2 LYS 119 1HB LYS 119 -7.236 -2.718 -9.839 933 HB3 LYS 119 2HB LYS 119 -6.185 -2.733 -11.249 934 HG2 LYS 119 1HG LYS 119 -8.207 -2.611 -12.278 935 HG3 LYS 119 2HG LYS 119 -8.035 -4.365 -12.181 936 HD2 LYS 119 1HD LYS 119 -10.199 -4.000 -11.409 937 HD3 LYS 119 2HD LYS 119 -9.260 -4.132 -9.920 938 HE2 LYS 119 1HE LYS 119 -10.737 -2.269 -9.693 939 HE3 LYS 119 2HE LYS 119 -9.102 -1.641 -9.889 940 HZ1 LYS 119 1HZ LYS 119 -11.398 -1.420 -11.655 941 HZ2 LYS 119 2HZ LYS 119 -9.911 -1.686 -12.417 942 HZ3 LYS 119 3HZ LYS 119 -10.115 -0.345 -11.405 943 H LEU 120 H LEU 120 -4.984 -6.067 -8.662 944 HA LEU 120 HA LEU 120 -2.909 -4.178 -8.076 945 HB2 LEU 120 1HB LEU 120 -3.296 -7.082 -7.394 946 HB3 LEU 120 2HB LEU 120 -1.886 -6.156 -6.881 947 HG LEU 120 HG LEU 120 -4.726 -5.457 -6.143 948 HD11 LEU 120 1HD1 LEU 120 -3.273 -6.313 -3.897 949 HD12 LEU 120 2HD1 LEU 120 -3.033 -7.536 -5.144 950 HD13 LEU 120 3HD1 LEU 120 -4.666 -7.091 -4.649 951 HD21 LEU 120 1HD2 LEU 120 -2.470 -3.899 -6.101 952 HD22 LEU 120 2HD2 LEU 120 -2.516 -4.555 -4.464 953 HD23 LEU 120 3HD2 LEU 120 -3.900 -3.663 -5.096 954 H SER 121 H SER 121 -0.579 -4.775 -8.308 955 HA SER 121 HA SER 121 0.226 -4.910 -10.912 956 HB2 SER 121 1HB SER 121 1.615 -4.416 -8.801 957 HB3 SER 121 2HB SER 121 1.889 -6.156 -8.728 958 HG SER 121 HG SER 121 2.679 -4.321 -10.722 959 H GLY 122 H GLY 122 0.490 -7.679 -8.668 960 HA2 GLY 122 1HA GLY 122 -0.195 -9.889 -9.134 961 HA3 GLY 122 2HA GLY 122 -0.323 -9.467 -10.835 962 HA PRO 123 HA PRO 123 4.386 -10.167 -9.941 963 HB2 PRO 123 1HB PRO 123 4.998 -11.286 -7.544 964 HB3 PRO 123 2HB PRO 123 4.917 -9.538 -7.796 965 HG2 PRO 123 1HG PRO 123 2.874 -11.378 -6.611 966 HG3 PRO 123 2HG PRO 123 3.383 -9.770 -6.063 967 HD2 PRO 123 1HD PRO 123 1.110 -10.175 -7.478 968 HD3 PRO 123 2HD PRO 123 2.068 -8.687 -7.616 969 H SER 124 H SER 124 1.771 -12.220 -9.373 970 HA SER 124 HA SER 124 2.894 -14.737 -9.077 971 HB2 SER 124 1HB SER 124 0.829 -15.570 -10.254 972 HB3 SER 124 2HB SER 124 0.510 -14.464 -8.918 973 HG SER 124 HG SER 124 0.666 -12.855 -10.852 974 H SER 125 H SER 125 3.317 -16.423 -10.605 975 HA SER 125 HA SER 125 5.043 -15.704 -12.669 976 HB2 SER 125 1HB SER 125 4.700 -17.986 -11.434 977 HB3 SER 125 2HB SER 125 3.571 -18.318 -12.747 978 HG SER 125 HG SER 125 6.128 -17.353 -13.365 979 H GLY 126 H GLY 126 4.365 -14.418 -14.289 980 HA2 GLY 126 1HA GLY 126 3.461 -14.109 -16.419 981 HA3 GLY 126 2HA GLY 126 2.457 -15.530 -16.174 Start of MODEL 17 1 H1 MET 1 H MET 1 -26.767 -1.529 -34.128 2 HA MET 1 HA MET 1 -28.272 -2.782 -36.228 3 HB2 MET 1 1HB MET 1 -28.692 -0.532 -34.896 4 HB3 MET 1 2HB MET 1 -27.740 0.155 -36.206 5 HG2 MET 1 1HG MET 1 -30.183 -1.539 -36.645 6 HG3 MET 1 2HG MET 1 -30.220 0.218 -36.523 7 HE1 MET 1 1HE MET 1 -31.204 -1.656 -39.181 8 HE2 MET 1 2HE MET 1 -31.523 0.034 -38.787 9 HE3 MET 1 3HE MET 1 -30.793 -0.388 -40.337 10 H LYS 2 H LYS 2 -25.514 -0.524 -36.170 11 HA LYS 2 HA LYS 2 -24.206 -1.832 -38.329 12 HB2 LYS 2 1HB LYS 2 -26.141 -0.474 -39.399 13 HB3 LYS 2 2HB LYS 2 -25.148 0.932 -39.037 14 HG2 LYS 2 1HG LYS 2 -23.432 0.223 -40.478 15 HG3 LYS 2 2HG LYS 2 -24.100 -1.406 -40.600 16 HD2 LYS 2 1HD LYS 2 -24.689 -0.381 -42.622 17 HD3 LYS 2 2HD LYS 2 -26.154 -0.287 -41.640 18 HE2 LYS 2 1HE LYS 2 -26.010 1.852 -42.498 19 HE3 LYS 2 2HE LYS 2 -25.215 2.031 -40.935 20 HZ1 LYS 2 1HZ LYS 2 -23.085 1.896 -41.993 21 HZ2 LYS 2 2HZ LYS 2 -23.995 3.087 -42.776 22 HZ3 LYS 2 3HZ LYS 2 -23.788 1.572 -43.498 23 H ASP 3 H ASP 3 -22.086 -1.204 -38.509 24 HA ASP 3 HA ASP 3 -20.103 -0.289 -37.874 25 HB2 ASP 3 1HB ASP 3 -21.639 2.239 -37.279 26 HB3 ASP 3 2HB ASP 3 -19.952 2.085 -37.762 27 H HIS 4 H HIS 4 -21.415 -1.763 -35.923 28 HA HIS 4 HA HIS 4 -20.786 -0.276 -33.458 29 HB2 HIS 4 1HB HIS 4 -22.258 -2.137 -32.398 30 HB3 HIS 4 2HB HIS 4 -23.045 -0.810 -33.247 31 HD1 HIS 4 1HD HIS 4 -25.102 -2.403 -33.612 32 HD2 HIS 4 2HD HIS 4 -21.598 -3.599 -35.497 33 HE1 HIS 4 1HE HIS 4 -25.799 -4.150 -35.281 34 HE2 HIS 4 2HE HIS 4 -23.652 -4.920 -36.350 35 H LEU 5 H LEU 5 -19.252 -1.052 -32.133 36 HA LEU 5 HA LEU 5 -18.263 -3.783 -32.581 37 HB2 LEU 5 1HB LEU 5 -15.969 -2.614 -31.947 38 HB3 LEU 5 2HB LEU 5 -16.532 -2.754 -33.611 39 HG LEU 5 HG LEU 5 -15.582 -0.537 -33.081 40 HD11 LEU 5 1HD1 LEU 5 -18.361 0.212 -33.516 41 HD12 LEU 5 2HD1 LEU 5 -17.840 -1.137 -34.524 42 HD13 LEU 5 3HD1 LEU 5 -16.958 0.389 -34.571 43 HD21 LEU 5 1HD2 LEU 5 -17.959 0.270 -31.543 44 HD22 LEU 5 2HD2 LEU 5 -16.275 0.773 -31.384 45 HD23 LEU 5 3HD2 LEU 5 -16.808 -0.758 -30.688 46 H ILE 6 H ILE 6 -16.469 -4.159 -30.730 47 HA ILE 6 HA ILE 6 -17.360 -3.047 -28.188 48 HB ILE 6 HB ILE 6 -17.330 -6.029 -28.665 49 HG12 ILE 6 1HG1 ILE 6 -19.710 -4.257 -28.093 50 HG13 ILE 6 2HG1 ILE 6 -19.256 -4.779 -29.712 51 HG21 ILE 6 1HG2 ILE 6 -18.382 -6.043 -26.373 52 HG22 ILE 6 2HG2 ILE 6 -16.679 -5.594 -26.431 53 HG23 ILE 6 3HG2 ILE 6 -17.912 -4.348 -26.239 54 HD11 ILE 6 1HD1 ILE 6 -19.384 -7.161 -28.669 55 HD12 ILE 6 2HD1 ILE 6 -20.383 -6.359 -27.457 56 HD13 ILE 6 3HD1 ILE 6 -20.855 -6.319 -29.156 57 H HIS 7 H HIS 7 -15.689 -2.699 -26.873 58 HA HIS 7 HA HIS 7 -13.147 -4.057 -27.482 59 HB2 HIS 7 1HB HIS 7 -13.523 -1.396 -26.095 60 HB3 HIS 7 2HB HIS 7 -11.998 -2.113 -26.607 61 HD1 HIS 7 1HD HIS 7 -12.054 -2.619 -29.394 62 HD2 HIS 7 2HD HIS 7 -14.369 0.464 -27.847 63 HE1 HIS 7 1HE HIS 7 -12.540 -1.102 -31.340 64 HE2 HIS 7 2HE HIS 7 -13.870 0.801 -30.362 65 H ASN 8 H ASN 8 -14.528 -5.662 -26.026 66 HA ASN 8 HA ASN 8 -13.818 -5.152 -23.214 67 HB2 ASN 8 1HB ASN 8 -16.152 -5.447 -23.283 68 HB3 ASN 8 2HB ASN 8 -16.041 -6.749 -24.465 69 HD21 ASN 8 1HD2 ASN 8 -15.819 -5.879 -21.128 70 HD22 ASN 8 2HD2 ASN 8 -15.754 -7.486 -20.496 71 H VAL 9 H VAL 9 -11.788 -5.982 -23.069 72 HA VAL 9 HA VAL 9 -11.552 -8.877 -23.295 73 HB VAL 9 HB VAL 9 -9.415 -8.752 -24.508 74 HG11 VAL 9 1HG1 VAL 9 -10.326 -8.437 -26.692 75 HG12 VAL 9 2HG1 VAL 9 -11.601 -9.109 -25.674 76 HG13 VAL 9 3HG1 VAL 9 -11.602 -7.390 -26.070 77 HG21 VAL 9 1HG2 VAL 9 -9.186 -6.461 -25.808 78 HG22 VAL 9 2HG2 VAL 9 -9.992 -5.838 -24.368 79 HG23 VAL 9 3HG2 VAL 9 -8.459 -6.697 -24.219 80 H HIS 10 H HIS 10 -10.798 -9.527 -21.400 81 HA HIS 10 HA HIS 10 -9.231 -7.715 -19.747 82 HB2 HIS 10 1HB HIS 10 -9.558 -9.373 -17.973 83 HB3 HIS 10 2HB HIS 10 -11.094 -8.944 -18.721 84 HD1 HIS 10 1HD HIS 10 -8.842 -11.794 -18.077 85 HD2 HIS 10 2HD HIS 10 -12.206 -10.995 -20.381 86 HE1 HIS 10 1HE HIS 10 -9.718 -14.041 -18.791 87 HE2 HIS 10 2HE HIS 10 -11.703 -13.529 -20.254 88 H LYS 11 H LYS 11 -7.266 -7.705 -20.896 89 HA LYS 11 HA LYS 11 -5.712 -10.195 -20.626 90 HB2 LYS 11 1HB LYS 11 -6.175 -9.757 -22.984 91 HB3 LYS 11 2HB LYS 11 -5.524 -8.131 -22.828 92 HG2 LYS 11 1HG LYS 11 -3.672 -9.095 -23.656 93 HG3 LYS 11 2HG LYS 11 -3.412 -9.550 -21.971 94 HD2 LYS 11 1HD LYS 11 -4.988 -11.320 -23.804 95 HD3 LYS 11 2HD LYS 11 -3.224 -11.364 -23.810 96 HE2 LYS 11 1HE LYS 11 -3.278 -11.793 -21.369 97 HE3 LYS 11 2HE LYS 11 -5.037 -11.863 -21.452 98 HZ1 LYS 11 1HZ LYS 11 -4.049 -13.580 -23.403 99 HZ2 LYS 11 2HZ LYS 11 -4.862 -13.991 -21.979 100 HZ3 LYS 11 3HZ LYS 11 -3.173 -13.900 -21.991 101 H GLU 12 H GLU 12 -3.729 -10.044 -19.703 102 HA GLU 12 HA GLU 12 -3.113 -7.760 -18.155 103 HB2 GLU 12 1HB GLU 12 -1.211 -8.954 -17.402 104 HB3 GLU 12 2HB GLU 12 -2.464 -10.159 -17.662 105 HG2 GLU 12 1HG GLU 12 -0.448 -9.548 -19.786 106 HG3 GLU 12 2HG GLU 12 -0.081 -10.660 -18.468 107 H GLU 13 H GLU 13 -1.621 -6.149 -18.419 108 HA GLU 13 HA GLU 13 0.202 -6.132 -20.648 109 HB2 GLU 13 1HB GLU 13 -0.696 -4.317 -21.861 110 HB3 GLU 13 2HB GLU 13 -2.049 -5.403 -21.581 111 HG2 GLU 13 1HG GLU 13 -2.751 -3.993 -19.687 112 HG3 GLU 13 2HG GLU 13 -1.436 -2.880 -20.060 113 H HIS 14 H HIS 14 1.135 -3.719 -20.785 114 HA HIS 14 HA HIS 14 2.469 -2.188 -19.758 115 HB2 HIS 14 1HB HIS 14 0.051 -2.274 -18.003 116 HB3 HIS 14 2HB HIS 14 1.456 -1.360 -17.463 117 HD1 HIS 14 1HD HIS 14 1.144 1.025 -17.984 118 HD2 HIS 14 2HD HIS 14 -0.428 -1.411 -20.960 119 HE1 HIS 14 1HE HIS 14 0.248 2.594 -19.734 120 HE2 HIS 14 2HE HIS 14 -0.775 1.098 -21.483 121 H ALA 15 H ALA 15 3.139 -4.897 -19.367 122 HA ALA 15 HA ALA 15 4.751 -4.641 -16.967 123 HB1 ALA 15 1HB ALA 15 3.281 -7.218 -17.217 124 HB2 ALA 15 2HB ALA 15 3.951 -6.433 -15.786 125 HB3 ALA 15 3HB ALA 15 2.456 -5.833 -16.502 126 H HIS 16 H HIS 16 6.721 -4.960 -17.765 127 HA HIS 16 HA HIS 16 7.435 -7.457 -18.954 128 HB2 HIS 16 1HB HIS 16 7.986 -6.814 -21.132 129 HB3 HIS 16 2HB HIS 16 6.443 -6.009 -20.858 130 HD1 HIS 16 1HD HIS 16 9.874 -5.369 -21.864 131 HD2 HIS 16 2HD HIS 16 6.771 -3.170 -20.190 132 HE1 HIS 16 1HE HIS 16 10.495 -2.957 -22.212 133 HE2 HIS 16 2HE HIS 16 8.645 -1.646 -21.115 134 H ALA 17 H ALA 17 9.828 -7.336 -19.716 135 HA ALA 17 HA ALA 17 11.965 -7.198 -18.895 136 HB1 ALA 17 1HB ALA 17 12.692 -4.717 -18.699 137 HB2 ALA 17 2HB ALA 17 12.189 -5.348 -20.268 138 HB3 ALA 17 3HB ALA 17 11.073 -4.374 -19.311 139 H HIS 18 H HIS 18 10.569 -8.027 -16.837 140 HA HIS 18 HA HIS 18 10.455 -6.330 -14.582 141 HB2 HIS 18 1HB HIS 18 10.542 -9.338 -14.836 142 HB3 HIS 18 2HB HIS 18 10.333 -8.508 -13.297 143 HD1 HIS 18 1HD HIS 18 7.957 -9.111 -12.778 144 HD2 HIS 18 2HD HIS 18 8.407 -7.567 -16.609 145 HE1 HIS 18 1HE HIS 18 5.621 -8.797 -13.655 146 HE2 HIS 18 2HE HIS 18 5.920 -7.942 -16.005 147 H ASN 19 H ASN 19 13.098 -7.400 -16.231 148 HA ASN 19 HA ASN 19 15.304 -7.788 -15.720 149 HB2 ASN 19 1HB ASN 19 14.496 -5.396 -14.086 150 HB3 ASN 19 2HB ASN 19 16.156 -5.984 -14.064 151 HD21 ASN 19 1HD2 ASN 19 13.706 -5.601 -16.603 152 HD22 ASN 19 2HD2 ASN 19 14.703 -4.665 -17.659 153 H LYS 20 H LYS 20 13.824 -9.674 -14.434 154 HA LYS 20 HA LYS 20 14.235 -9.789 -11.634 155 HB2 LYS 20 1HB LYS 20 13.883 -12.141 -13.493 156 HB3 LYS 20 2HB LYS 20 13.503 -12.070 -11.777 157 HG2 LYS 20 1HG LYS 20 12.132 -10.157 -13.586 158 HG3 LYS 20 2HG LYS 20 11.640 -11.852 -13.633 159 HD2 LYS 20 1HD LYS 20 11.536 -11.634 -11.051 160 HD3 LYS 20 2HD LYS 20 11.490 -9.898 -11.367 161 HE2 LYS 20 1HE LYS 20 9.547 -10.306 -12.882 162 HE3 LYS 20 2HE LYS 20 9.552 -11.987 -12.352 163 HZ1 LYS 20 1HZ LYS 20 8.026 -10.264 -11.188 164 HZ2 LYS 20 2HZ LYS 20 9.430 -9.844 -10.344 165 HZ3 LYS 20 3HZ LYS 20 8.835 -11.426 -10.262 166 H ASP 21 H ASP 21 16.429 -9.260 -11.305 167 HA ASP 21 HA ASP 21 18.245 -11.520 -11.766 168 HB2 ASP 21 1HB ASP 21 18.728 -9.769 -13.447 169 HB3 ASP 21 2HB ASP 21 18.996 -8.614 -12.145 170 H TYR 22 H TYR 22 16.827 -11.043 -9.426 171 HA TYR 22 HA TYR 22 19.029 -10.444 -7.587 172 HB2 TYR 22 1HB TYR 22 16.991 -9.463 -6.132 173 HB3 TYR 22 2HB TYR 22 17.988 -8.461 -7.181 174 HD1 TYR 22 1HD TYR 22 15.360 -10.857 -8.240 175 HD2 TYR 22 2HD TYR 22 16.464 -6.773 -7.787 176 HE1 TYR 22 1HE TYR 22 13.355 -10.182 -9.494 177 HE2 TYR 22 2HE TYR 22 14.461 -6.086 -9.039 178 HH TYR 22 HH TYR 22 12.034 -8.434 -10.053 179 H ASP 23 H ASP 23 18.663 -11.305 -5.406 180 HA ASP 23 HA ASP 23 17.237 -13.856 -5.556 181 HB2 ASP 23 1HB ASP 23 19.476 -12.807 -3.858 182 HB3 ASP 23 2HB ASP 23 18.529 -14.186 -3.306 183 H ILE 24 H ILE 24 15.157 -12.745 -5.334 184 HA ILE 24 HA ILE 24 14.496 -11.339 -2.949 185 HB ILE 24 HB ILE 24 12.376 -12.725 -4.514 186 HG12 ILE 24 1HG1 ILE 24 12.652 -10.517 -6.020 187 HG13 ILE 24 2HG1 ILE 24 14.343 -10.788 -5.612 188 HG21 ILE 24 1HG2 ILE 24 12.709 -10.017 -3.246 189 HG22 ILE 24 2HG2 ILE 24 11.327 -10.449 -4.251 190 HG23 ILE 24 3HG2 ILE 24 11.635 -11.325 -2.751 191 HD11 ILE 24 1HD1 ILE 24 13.227 -13.269 -6.399 192 HD12 ILE 24 2HD1 ILE 24 12.776 -12.054 -7.595 193 HD13 ILE 24 3HD1 ILE 24 14.475 -12.314 -7.199 194 HA PRO 25 HA PRO 25 13.941 -14.751 -0.202 195 HB2 PRO 25 1HB PRO 25 12.477 -13.472 1.693 196 HB3 PRO 25 2HB PRO 25 14.216 -13.224 1.492 197 HG2 PRO 25 1HG PRO 25 11.938 -11.542 0.521 198 HG3 PRO 25 2HG PRO 25 13.465 -11.035 1.266 199 HD2 PRO 25 1HD PRO 25 13.045 -10.938 -1.407 200 HD3 PRO 25 2HD PRO 25 14.643 -11.254 -0.702 201 H THR 26 H THR 26 12.576 -16.395 -0.437 202 HA THR 26 HA THR 26 9.885 -15.953 -1.409 203 HB THR 26 HB THR 26 11.205 -17.794 -2.346 204 HG1 THR 26 1HG THR 26 9.057 -18.223 -2.459 205 HG21 THR 26 1HG2 THR 26 12.357 -18.251 -0.090 206 HG22 THR 26 2HG2 THR 26 11.964 -19.633 -1.113 207 HG23 THR 26 3HG2 THR 26 10.944 -19.242 0.272 208 H THR 27 H THR 27 10.252 -14.898 1.152 209 HA THR 27 HA THR 27 9.618 -16.469 3.324 210 HB THR 27 HB THR 27 8.294 -13.797 3.034 211 HG1 THR 27 1HG THR 27 10.276 -12.789 3.366 212 HG21 THR 27 1HG2 THR 27 9.041 -15.592 5.167 213 HG22 THR 27 2HG2 THR 27 8.017 -14.157 5.218 214 HG23 THR 27 3HG2 THR 27 9.764 -14.001 5.403 215 H GLU 28 H GLU 28 7.555 -16.681 4.490 216 HA GLU 28 HA GLU 28 5.512 -17.675 2.724 217 HB2 GLU 28 1HB GLU 28 5.750 -17.558 5.729 218 HB3 GLU 28 2HB GLU 28 4.341 -18.213 4.908 219 HG2 GLU 28 1HG GLU 28 5.602 -20.090 5.379 220 HG3 GLU 28 2HG GLU 28 6.012 -19.743 3.700 221 H ASN 29 H ASN 29 5.743 -15.011 2.238 222 HA ASN 29 HA ASN 29 3.122 -14.045 3.070 223 HB2 ASN 29 1HB ASN 29 5.716 -12.612 3.604 224 HB3 ASN 29 2HB ASN 29 4.201 -11.730 3.438 225 HD21 ASN 29 1HD2 ASN 29 5.627 -14.464 5.178 226 HD22 ASN 29 2HD2 ASN 29 4.783 -14.184 6.659 227 H LEU 30 H LEU 30 2.061 -13.069 1.451 228 HA LEU 30 HA LEU 30 3.523 -12.629 -1.051 229 HB2 LEU 30 1HB LEU 30 0.734 -13.334 -0.345 230 HB3 LEU 30 2HB LEU 30 0.970 -12.347 -1.786 231 HG LEU 30 HG LEU 30 0.783 -14.754 -2.283 232 HD11 LEU 30 1HD1 LEU 30 3.182 -13.144 -2.952 233 HD12 LEU 30 2HD1 LEU 30 1.902 -13.762 -3.996 234 HD13 LEU 30 3HD1 LEU 30 3.172 -14.844 -3.424 235 HD21 LEU 30 1HD2 LEU 30 1.718 -16.145 -0.809 236 HD22 LEU 30 2HD2 LEU 30 2.805 -14.902 -0.190 237 HD23 LEU 30 3HD2 LEU 30 3.236 -15.808 -1.641 238 H TYR 31 H TYR 31 3.837 -10.654 -1.860 239 HA TYR 31 HA TYR 31 2.494 -8.397 -0.530 240 HB2 TYR 31 1HB TYR 31 4.995 -8.112 -2.164 241 HB3 TYR 31 2HB TYR 31 4.400 -7.089 -0.861 242 HD1 TYR 31 1HD TYR 31 3.902 -8.994 1.291 243 HD2 TYR 31 2HD TYR 31 7.097 -8.850 -1.515 244 HE1 TYR 31 1HE TYR 31 5.349 -10.181 2.887 245 HE2 TYR 31 2HE TYR 31 8.552 -10.038 0.072 246 HH TYR 31 HH TYR 31 8.622 -10.307 2.658 247 H PHE 32 H PHE 32 1.364 -6.938 -1.697 248 HA PHE 32 HA PHE 32 1.429 -7.150 -4.627 249 HB2 PHE 32 1HB PHE 32 -1.103 -6.892 -2.994 250 HB3 PHE 32 2HB PHE 32 -0.990 -7.021 -4.746 251 HD1 PHE 32 2HD PHE 32 0.125 -9.172 -5.665 252 HD2 PHE 32 1HD PHE 32 -1.433 -8.788 -1.722 253 HE1 PHE 32 2HE PHE 32 -0.039 -11.621 -5.495 254 HE2 PHE 32 1HE PHE 32 -1.598 -11.236 -1.546 255 HZ PHE 32 HZ PHE 32 -0.902 -12.656 -3.434 256 H GLN 33 H GLN 33 0.531 -5.250 -5.727 257 HA GLN 33 HA GLN 33 0.432 -2.817 -4.108 258 HB2 GLN 33 1HB GLN 33 2.254 -3.171 -6.495 259 HB3 GLN 33 2HB GLN 33 1.973 -1.656 -5.648 260 HG2 GLN 33 1HG GLN 33 2.823 -2.845 -3.569 261 HG3 GLN 33 2HG GLN 33 3.386 -4.108 -4.661 262 HE21 GLN 33 1HE2 GLN 33 5.232 -2.915 -3.169 263 HE22 GLN 33 2HE2 GLN 33 6.201 -1.836 -4.107 264 H GLY 34 H GLY 34 -0.741 -1.123 -5.025 265 HA2 GLY 34 1HA GLY 34 -1.609 -0.458 -7.402 266 HA3 GLY 34 2HA GLY 34 -2.500 -1.962 -7.216 267 H SER 35 H SER 35 -1.898 1.123 -5.550 268 HA SER 35 HA SER 35 -4.217 0.950 -3.919 269 HB2 SER 35 1HB SER 35 -2.149 2.371 -3.488 270 HB3 SER 35 2HB SER 35 -2.788 3.498 -4.685 271 HG SER 35 HG SER 35 -3.541 3.096 -2.096 272 H SER 36 H SER 36 -6.267 1.291 -4.438 273 HA SER 36 HA SER 36 -6.921 2.370 -7.057 274 HB2 SER 36 1HB SER 36 -7.986 0.285 -5.898 275 HB3 SER 36 2HB SER 36 -8.968 1.479 -5.048 276 HG SER 36 HG SER 36 -10.158 1.308 -6.784 277 H GLY 37 H GLY 37 -5.855 4.150 -5.001 278 HA2 GLY 37 1HA GLY 37 -6.827 6.516 -5.312 279 HA3 GLY 37 2HA GLY 37 -8.193 5.847 -4.432 280 H SER 38 H SER 38 -8.048 5.517 -2.231 281 HA SER 38 HA SER 38 -5.649 6.660 -0.958 282 HB2 SER 38 1HB SER 38 -7.769 7.966 -0.675 283 HB3 SER 38 2HB SER 38 -8.453 6.582 0.177 284 HG SER 38 HG SER 38 -7.550 8.133 1.607 285 H SER 39 H SER 39 -5.189 5.832 1.243 286 HA SER 39 HA SER 39 -4.870 3.049 1.233 287 HB2 SER 39 1HB SER 39 -4.750 4.962 3.577 288 HB3 SER 39 2HB SER 39 -4.123 3.314 3.573 289 HG SER 39 HG SER 39 -3.037 4.380 1.499 290 H GLY 40 H GLY 40 -7.220 5.106 2.913 291 HA2 GLY 40 1HA GLY 40 -8.479 3.048 4.376 292 HA3 GLY 40 2HA GLY 40 -9.190 4.605 3.980 293 H ASP 41 H ASP 41 -9.643 4.696 1.433 294 HA ASP 41 HA ASP 41 -11.889 3.354 0.859 295 HB2 ASP 41 1HB ASP 41 -9.668 4.184 -0.996 296 HB3 ASP 41 2HB ASP 41 -11.152 3.461 -1.608 297 H MET 42 H MET 42 -8.624 2.100 0.314 298 HA MET 42 HA MET 42 -9.111 -0.204 -1.063 299 HB2 MET 42 1HB MET 42 -7.183 0.314 1.196 300 HB3 MET 42 2HB MET 42 -7.190 -1.194 0.291 301 HG2 MET 42 1HG MET 42 -6.691 1.560 -0.811 302 HG3 MET 42 2HG MET 42 -5.499 0.285 -0.572 303 HE1 MET 42 1HE MET 42 -5.050 -1.363 -3.385 304 HE2 MET 42 2HE MET 42 -5.162 -1.563 -1.637 305 HE3 MET 42 3HE MET 42 -6.276 -2.428 -2.696 306 H MET 43 H MET 43 -9.031 -0.018 2.503 307 HA MET 43 HA MET 43 -9.744 -2.479 3.263 308 HB2 MET 43 1HB MET 43 -10.988 0.073 4.300 309 HB3 MET 43 2HB MET 43 -11.050 -1.479 5.125 310 HG2 MET 43 1HG MET 43 -8.492 -1.413 5.027 311 HG3 MET 43 2HG MET 43 -8.690 0.296 4.643 312 HE1 MET 43 1HE MET 43 -8.710 -2.481 6.994 313 HE2 MET 43 2HE MET 43 -8.976 -1.800 8.599 314 HE3 MET 43 3HE MET 43 -10.353 -2.213 7.577 315 H ARG 44 H ARG 44 -12.006 -0.084 1.956 316 HA ARG 44 HA ARG 44 -14.306 -1.738 2.198 317 HB2 ARG 44 1HB ARG 44 -13.665 0.806 0.758 318 HB3 ARG 44 2HB ARG 44 -15.152 -0.050 0.372 319 HG2 ARG 44 1HG ARG 44 -15.821 1.465 1.984 320 HG3 ARG 44 2HG ARG 44 -15.571 -0.014 2.914 321 HD2 ARG 44 1HD ARG 44 -13.549 0.755 3.808 322 HD3 ARG 44 2HD ARG 44 -13.389 2.017 2.588 323 HE ARG 44 HE ARG 44 -15.643 2.725 3.887 324 HH11 ARG 44 2HH1 ARG 44 -12.443 1.892 4.974 325 HH12 ARG 44 1HH1 ARG 44 -12.514 2.905 6.377 326 HH21 ARG 44 2HH2 ARG 44 -15.749 4.063 5.731 327 HH22 ARG 44 1HH2 ARG 44 -14.395 4.139 6.808 328 H GLU 45 H GLU 45 -12.069 -1.032 -0.456 329 HA GLU 45 HA GLU 45 -13.428 -2.485 -2.448 330 HB2 GLU 45 1HB GLU 45 -11.512 -0.800 -2.713 331 HB3 GLU 45 2HB GLU 45 -10.438 -2.142 -2.345 332 HG2 GLU 45 1HG GLU 45 -10.570 -1.891 -4.715 333 HG3 GLU 45 2HG GLU 45 -11.398 -3.379 -4.260 334 H ILE 46 H ILE 46 -10.577 -3.408 -0.512 335 HA ILE 46 HA ILE 46 -10.130 -5.941 -1.363 336 HB ILE 46 HB ILE 46 -10.125 -5.013 1.511 337 HG12 ILE 46 1HG1 ILE 46 -7.666 -5.403 -0.134 338 HG13 ILE 46 2HG1 ILE 46 -8.640 -3.967 -0.428 339 HG21 ILE 46 1HG2 ILE 46 -8.224 -7.005 1.221 340 HG22 ILE 46 2HG2 ILE 46 -9.781 -7.150 2.034 341 HG23 ILE 46 3HG2 ILE 46 -9.625 -7.615 0.340 342 HD11 ILE 46 1HD1 ILE 46 -6.799 -4.543 1.714 343 HD12 ILE 46 2HD1 ILE 46 -7.516 -3.009 1.220 344 HD13 ILE 46 3HD1 ILE 46 -8.383 -4.072 2.328 345 H ARG 47 H ARG 47 -12.524 -5.027 1.108 346 HA ARG 47 HA ARG 47 -13.515 -7.509 1.753 347 HB2 ARG 47 1HB ARG 47 -14.978 -4.881 1.483 348 HB3 ARG 47 2HB ARG 47 -15.690 -6.321 2.199 349 HG2 ARG 47 1HG ARG 47 -14.046 -6.318 3.958 350 HG3 ARG 47 2HG ARG 47 -13.196 -4.968 3.203 351 HD2 ARG 47 1HD ARG 47 -15.441 -3.721 3.425 352 HD3 ARG 47 2HD ARG 47 -15.862 -4.992 4.572 353 HE ARG 47 HE ARG 47 -13.339 -3.683 5.083 354 HH11 ARG 47 2HH1 ARG 47 -16.768 -3.710 5.687 355 HH12 ARG 47 1HH1 ARG 47 -16.646 -2.818 7.167 356 HH21 ARG 47 2HH2 ARG 47 -13.166 -2.507 7.030 357 HH22 ARG 47 1HH2 ARG 47 -14.597 -2.134 7.929 358 H LYS 48 H LYS 48 -14.433 -5.445 -0.976 359 HA LYS 48 HA LYS 48 -16.549 -6.919 -1.986 360 HB2 LYS 48 1HB LYS 48 -15.971 -4.731 -2.864 361 HB3 LYS 48 2HB LYS 48 -14.444 -5.346 -3.480 362 HG2 LYS 48 1HG LYS 48 -16.948 -6.638 -4.416 363 HG3 LYS 48 2HG LYS 48 -16.549 -5.034 -5.035 364 HD2 LYS 48 1HD LYS 48 -14.737 -5.783 -6.192 365 HD3 LYS 48 2HD LYS 48 -14.381 -7.056 -5.023 366 HE2 LYS 48 1HE LYS 48 -15.130 -8.336 -6.755 367 HE3 LYS 48 2HE LYS 48 -16.661 -8.034 -5.936 368 HZ1 LYS 48 1HZ LYS 48 -17.407 -7.128 -7.795 369 HZ2 LYS 48 2HZ LYS 48 -15.912 -7.346 -8.556 370 HZ3 LYS 48 3HZ LYS 48 -16.224 -5.922 -7.697 371 H VAL 49 H VAL 49 -13.076 -7.324 -2.559 372 HA VAL 49 HA VAL 49 -13.268 -9.374 -4.474 373 HB VAL 49 HB VAL 49 -10.998 -9.217 -2.516 374 HG11 VAL 49 1HG1 VAL 49 -11.380 -10.097 -5.346 375 HG12 VAL 49 2HG1 VAL 49 -9.785 -9.590 -4.788 376 HG13 VAL 49 3HG1 VAL 49 -10.607 -10.940 -4.005 377 HG21 VAL 49 1HG2 VAL 49 -10.564 -7.103 -3.033 378 HG22 VAL 49 2HG2 VAL 49 -10.430 -7.557 -4.732 379 HG23 VAL 49 3HG2 VAL 49 -11.984 -7.043 -4.077 380 H LEU 50 H LEU 50 -13.023 -9.472 -0.943 381 HA LEU 50 HA LEU 50 -12.779 -12.252 -0.662 382 HB2 LEU 50 1HB LEU 50 -14.186 -10.435 1.276 383 HB3 LEU 50 2HB LEU 50 -13.339 -11.940 1.624 384 HG LEU 50 HG LEU 50 -11.928 -9.485 0.606 385 HD11 LEU 50 1HD1 LEU 50 -11.995 -8.524 2.604 386 HD12 LEU 50 2HD1 LEU 50 -11.511 -10.020 3.402 387 HD13 LEU 50 3HD1 LEU 50 -13.215 -9.709 3.073 388 HD21 LEU 50 1HD2 LEU 50 -10.877 -11.778 0.440 389 HD22 LEU 50 2HD2 LEU 50 -10.860 -11.800 2.204 390 HD23 LEU 50 3HD2 LEU 50 -9.954 -10.565 1.327 391 H GLY 51 H GLY 51 -15.698 -10.231 -0.258 392 HA2 GLY 51 1HA GLY 51 -17.546 -12.266 0.066 393 HA3 GLY 51 2HA GLY 51 -17.913 -10.700 -0.642 394 H ALA 52 H ALA 52 -16.171 -10.999 -2.917 395 HA ALA 52 HA ALA 52 -17.950 -12.240 -4.710 396 HB1 ALA 52 1HB ALA 52 -15.172 -11.160 -4.949 397 HB2 ALA 52 2HB ALA 52 -15.904 -12.037 -6.293 398 HB3 ALA 52 3HB ALA 52 -16.670 -10.573 -5.674 399 H ASN 53 H ASN 53 -14.871 -13.316 -3.322 400 HA ASN 53 HA ASN 53 -15.136 -15.901 -4.650 401 HB2 ASN 53 1HB ASN 53 -12.938 -14.470 -3.224 402 HB3 ASN 53 2HB ASN 53 -12.891 -16.229 -3.274 403 HD21 ASN 53 1HD2 ASN 53 -13.227 -13.380 -5.334 404 HD22 ASN 53 2HD2 ASN 53 -12.429 -14.061 -6.707 405 H ASN 54 H ASN 54 -17.105 -15.303 -2.720 406 HA ASN 54 HA ASN 54 -18.060 -16.039 -0.772 407 HB2 ASN 54 1HB ASN 54 -16.762 -18.445 -2.007 408 HB3 ASN 54 2HB ASN 54 -17.602 -18.598 -0.467 409 HD21 ASN 54 1HD2 ASN 54 -19.670 -19.073 -0.566 410 HD22 ASN 54 2HD2 ASN 54 -20.713 -18.805 -1.917 411 H CYS 55 H CYS 55 -15.770 -14.639 -0.188 412 HA CYS 55 HA CYS 55 -14.489 -16.229 1.932 413 HB2 CYS 55 1HB CYS 55 -13.509 -13.734 0.529 414 HB3 CYS 55 2HB CYS 55 -12.670 -14.541 1.848 415 HG CYS 55 HG CYS 55 -13.145 -15.691 -1.330 416 H ASP 56 H ASP 56 -14.010 -15.126 3.951 417 HA ASP 56 HA ASP 56 -16.018 -13.059 4.572 418 HB2 ASP 56 1HB ASP 56 -14.910 -15.289 6.281 419 HB3 ASP 56 2HB ASP 56 -15.847 -13.950 6.938 420 H TYR 57 H TYR 57 -15.396 -11.729 6.547 421 HA TYR 57 HA TYR 57 -12.560 -11.353 6.966 422 HB2 TYR 57 1HB TYR 57 -12.750 -8.886 6.348 423 HB3 TYR 57 2HB TYR 57 -12.690 -10.028 5.011 424 HD1 TYR 57 2HD TYR 57 -14.860 -10.660 3.868 425 HD2 TYR 57 1HD TYR 57 -14.567 -7.411 6.599 426 HE1 TYR 57 2HE TYR 57 -16.950 -9.725 2.970 427 HE2 TYR 57 1HE TYR 57 -16.657 -6.467 5.709 428 HH TYR 57 HH TYR 57 -18.128 -7.644 2.835 429 H GLU 58 H GLU 58 -12.086 -10.174 8.819 430 HA GLU 58 HA GLU 58 -14.343 -9.089 10.342 431 HB2 GLU 58 1HB GLU 58 -14.023 -11.387 11.127 432 HB3 GLU 58 2HB GLU 58 -12.324 -11.056 11.433 433 HG2 GLU 58 1HG GLU 58 -13.130 -10.790 13.532 434 HG3 GLU 58 2HG GLU 58 -13.336 -9.142 12.944 435 H GLN 59 H GLN 59 -13.766 -7.004 10.443 436 HA GLN 59 HA GLN 59 -11.136 -6.026 10.457 437 HB2 GLN 59 1HB GLN 59 -13.486 -4.862 10.046 438 HB3 GLN 59 2HB GLN 59 -13.307 -4.439 11.743 439 HG2 GLN 59 1HG GLN 59 -10.907 -3.685 10.908 440 HG3 GLN 59 2HG GLN 59 -11.775 -3.521 9.383 441 HE21 GLN 59 1HE2 GLN 59 -10.623 -1.382 10.770 442 HE22 GLN 59 2HE2 GLN 59 -11.887 -0.329 11.298 443 H ARG 60 H ARG 60 -9.662 -6.295 11.987 444 HA ARG 60 HA ARG 60 -10.498 -6.700 14.755 445 HB2 ARG 60 1HB ARG 60 -7.848 -7.047 13.350 446 HB3 ARG 60 2HB ARG 60 -8.049 -7.235 15.087 447 HG2 ARG 60 1HG ARG 60 -9.643 -8.819 13.095 448 HG3 ARG 60 2HG ARG 60 -8.075 -9.349 13.708 449 HD2 ARG 60 1HD ARG 60 -9.617 -10.408 15.105 450 HD3 ARG 60 2HD ARG 60 -9.085 -9.009 16.037 451 HE ARG 60 HE ARG 60 -11.480 -8.614 14.461 452 HH11 ARG 60 2HH1 ARG 60 -10.129 -9.500 17.545 453 HH12 ARG 60 1HH1 ARG 60 -11.576 -9.141 18.428 454 HH21 ARG 60 2HH2 ARG 60 -13.390 -8.138 15.613 455 HH22 ARG 60 1HH2 ARG 60 -13.431 -8.367 17.328 456 H GLU 61 H GLU 61 -8.391 -4.583 12.841 457 HA GLU 61 HA GLU 61 -8.472 -2.650 15.062 458 HB2 GLU 61 1HB GLU 61 -6.170 -3.453 13.304 459 HB3 GLU 61 2HB GLU 61 -6.203 -1.879 14.086 460 HG2 GLU 61 1HG GLU 61 -6.545 -4.420 15.638 461 HG3 GLU 61 2HG GLU 61 -4.954 -3.763 15.257 462 H ARG 62 H ARG 62 -7.465 -0.446 13.979 463 HA ARG 62 HA ARG 62 -9.535 0.607 12.444 464 HB2 ARG 62 1HB ARG 62 -8.088 2.553 12.109 465 HB3 ARG 62 2HB ARG 62 -8.020 1.994 13.775 466 HG2 ARG 62 1HG ARG 62 -5.891 0.911 13.351 467 HG3 ARG 62 2HG ARG 62 -5.966 1.397 11.656 468 HD2 ARG 62 1HD ARG 62 -4.663 3.082 12.463 469 HD3 ARG 62 2HD ARG 62 -6.252 3.795 12.739 470 HE ARG 62 HE ARG 62 -5.319 2.270 14.974 471 HH11 ARG 62 2HH1 ARG 62 -5.138 5.362 13.383 472 HH12 ARG 62 1HH1 ARG 62 -4.720 6.226 14.826 473 HH21 ARG 62 2HH2 ARG 62 -4.769 3.396 16.880 474 HH22 ARG 62 1HH2 ARG 62 -4.509 5.107 16.814 475 H PHE 63 H PHE 63 -6.318 -0.506 11.432 476 HA PHE 63 HA PHE 63 -7.322 -0.595 8.664 477 HB2 PHE 63 1HB PHE 63 -4.550 0.095 9.649 478 HB3 PHE 63 2HB PHE 63 -4.932 -0.236 7.963 479 HD1 PHE 63 2HD PHE 63 -6.852 1.209 6.942 480 HD2 PHE 63 1HD PHE 63 -4.637 2.261 10.421 481 HE1 PHE 63 2HE PHE 63 -7.474 3.567 6.621 482 HE2 PHE 63 1HE PHE 63 -5.256 4.621 10.106 483 HZ PHE 63 HZ PHE 63 -6.675 5.277 8.203 484 H LEU 64 H LEU 64 -7.811 -2.763 10.125 485 HA LEU 64 HA LEU 64 -6.003 -4.735 8.967 486 HB2 LEU 64 1HB LEU 64 -5.166 -4.328 11.240 487 HB3 LEU 64 2HB LEU 64 -6.756 -4.726 11.887 488 HG LEU 64 HG LEU 64 -6.472 -7.029 10.960 489 HD11 LEU 64 1HD1 LEU 64 -4.827 -6.520 9.238 490 HD12 LEU 64 2HD1 LEU 64 -4.222 -7.753 10.343 491 HD13 LEU 64 3HD1 LEU 64 -3.648 -6.091 10.477 492 HD21 LEU 64 1HD2 LEU 64 -4.262 -6.266 12.855 493 HD22 LEU 64 2HD2 LEU 64 -5.135 -7.795 12.761 494 HD23 LEU 64 3HD2 LEU 64 -5.959 -6.343 13.329 495 H LEU 65 H LEU 65 -6.997 -6.615 8.377 496 HA LEU 65 HA LEU 65 -9.730 -7.118 9.275 497 HB2 LEU 65 1HB LEU 65 -8.883 -6.526 6.475 498 HB3 LEU 65 2HB LEU 65 -10.200 -7.663 6.759 499 HG LEU 65 HG LEU 65 -10.346 -4.978 8.039 500 HD11 LEU 65 1HD1 LEU 65 -9.816 -4.184 5.927 501 HD12 LEU 65 2HD1 LEU 65 -11.576 -4.279 5.880 502 HD13 LEU 65 3HD1 LEU 65 -10.605 -5.533 5.110 503 HD21 LEU 65 1HD2 LEU 65 -12.088 -6.465 8.605 504 HD22 LEU 65 2HD2 LEU 65 -12.291 -6.987 6.932 505 HD23 LEU 65 3HD2 LEU 65 -12.769 -5.358 7.412 506 H PHE 66 H PHE 66 -10.002 -9.197 9.740 507 HA PHE 66 HA PHE 66 -7.928 -11.094 9.060 508 HB2 PHE 66 1HB PHE 66 -8.978 -11.001 11.328 509 HB3 PHE 66 2HB PHE 66 -10.483 -11.562 10.607 510 HD1 PHE 66 2HD PHE 66 -6.961 -12.485 11.246 511 HD2 PHE 66 1HD PHE 66 -10.857 -13.842 10.199 512 HE1 PHE 66 2HE PHE 66 -6.223 -14.815 11.534 513 HE2 PHE 66 1HE PHE 66 -10.125 -16.174 10.486 514 HZ PHE 66 HZ PHE 66 -7.806 -16.663 11.153 515 H CYS 67 H CYS 67 -8.083 -11.539 6.892 516 HA CYS 67 HA CYS 67 -10.613 -12.257 5.700 517 HB2 CYS 67 1HB CYS 67 -7.803 -12.325 4.582 518 HB3 CYS 67 2HB CYS 67 -9.267 -12.621 3.651 519 HG CYS 67 HG CYS 67 -9.594 -9.749 5.186 520 H VAL 68 H VAL 68 -11.394 -14.252 5.369 521 HA VAL 68 HA VAL 68 -9.617 -16.559 5.693 522 HB VAL 68 HB VAL 68 -10.706 -16.156 7.884 523 HG11 VAL 68 1HG1 VAL 68 -12.926 -15.525 6.379 524 HG12 VAL 68 2HG1 VAL 68 -13.333 -17.099 7.064 525 HG13 VAL 68 3HG1 VAL 68 -12.890 -15.761 8.126 526 HG21 VAL 68 1HG2 VAL 68 -10.841 -18.368 8.280 527 HG22 VAL 68 2HG2 VAL 68 -12.030 -18.630 7.005 528 HG23 VAL 68 3HG2 VAL 68 -10.318 -18.510 6.602 529 H HIS 69 H HIS 69 -9.991 -18.136 4.255 530 HA HIS 69 HA HIS 69 -12.312 -17.835 2.487 531 HB2 HIS 69 1HB HIS 69 -10.206 -17.829 1.317 532 HB3 HIS 69 2HB HIS 69 -9.695 -19.305 2.130 533 HD1 HIS 69 1HD HIS 69 -10.063 -21.391 0.852 534 HD2 HIS 69 2HD HIS 69 -12.574 -18.334 -0.417 535 HE1 HIS 69 1HE HIS 69 -11.310 -22.322 -1.123 536 HE2 HIS 69 2HE HIS 69 -12.761 -20.426 -1.927 537 H GLY 70 H GLY 70 -14.009 -19.066 2.948 538 HA2 GLY 70 1HA GLY 70 -13.513 -21.751 4.080 539 HA3 GLY 70 2HA GLY 70 -14.926 -20.775 4.457 540 H ASP 71 H ASP 71 -14.382 -23.505 3.130 541 HA ASP 71 HA ASP 71 -16.276 -23.084 0.920 542 HB2 ASP 71 1HB ASP 71 -13.913 -23.463 0.107 543 HB3 ASP 71 2HB ASP 71 -14.005 -25.072 0.817 544 H GLY 72 H GLY 72 -15.011 -25.171 3.435 545 HA2 GLY 72 1HA GLY 72 -17.455 -26.288 4.124 546 HA3 GLY 72 2HA GLY 72 -16.731 -27.379 2.952 547 H HIS 73 H HIS 73 -14.059 -27.207 3.638 548 HA HIS 73 HA HIS 73 -14.033 -28.181 6.418 549 HB2 HIS 73 1HB HIS 73 -12.868 -29.396 3.938 550 HB3 HIS 73 2HB HIS 73 -12.093 -29.681 5.494 551 HD1 HIS 73 1HD HIS 73 -12.992 -31.578 6.815 552 HD2 HIS 73 2HD HIS 73 -15.697 -30.253 3.954 553 HE1 HIS 73 1HE HIS 73 -14.916 -33.194 6.910 554 HE2 HIS 73 2HE HIS 73 -16.501 -32.422 5.112 555 H ALA 74 H ALA 74 -11.603 -28.401 7.142 556 HA ALA 74 HA ALA 74 -10.513 -25.743 7.005 557 HB1 ALA 74 1HB ALA 74 -8.743 -27.568 8.309 558 HB2 ALA 74 2HB ALA 74 -9.719 -26.275 9.006 559 HB3 ALA 74 3HB ALA 74 -10.399 -27.892 8.822 560 H GLU 75 H GLU 75 -9.860 -28.821 5.532 561 HA GLU 75 HA GLU 75 -7.231 -28.696 4.811 562 HB2 GLU 75 1HB GLU 75 -9.491 -29.529 2.983 563 HB3 GLU 75 2HB GLU 75 -7.805 -30.002 2.831 564 HG2 GLU 75 1HG GLU 75 -8.599 -31.849 3.866 565 HG3 GLU 75 2HG GLU 75 -8.212 -30.886 5.291 566 H ASN 76 H ASN 76 -9.920 -27.298 2.929 567 HA ASN 76 HA ASN 76 -8.055 -25.823 1.271 568 HB2 ASN 76 1HB ASN 76 -10.419 -24.893 0.444 569 HB3 ASN 76 2HB ASN 76 -9.792 -26.454 -0.079 570 HD21 ASN 76 1HD2 ASN 76 -11.656 -25.044 2.590 571 HD22 ASN 76 2HD2 ASN 76 -12.800 -26.334 2.698 572 H LEU 77 H LEU 77 -9.799 -25.329 4.154 573 HA LEU 77 HA LEU 77 -10.316 -22.573 4.033 574 HB2 LEU 77 1HB LEU 77 -11.092 -24.311 5.748 575 HB3 LEU 77 2HB LEU 77 -9.548 -24.022 6.546 576 HG LEU 77 HG LEU 77 -10.415 -21.498 6.389 577 HD11 LEU 77 1HD1 LEU 77 -12.599 -21.220 6.072 578 HD12 LEU 77 2HD1 LEU 77 -13.004 -22.546 7.161 579 HD13 LEU 77 3HD1 LEU 77 -12.629 -22.877 5.470 580 HD21 LEU 77 1HD2 LEU 77 -11.280 -21.803 8.696 581 HD22 LEU 77 2HD2 LEU 77 -9.706 -22.551 8.427 582 HD23 LEU 77 3HD2 LEU 77 -11.161 -23.548 8.470 583 H VAL 78 H VAL 78 -9.125 -20.785 4.520 584 HA VAL 78 HA VAL 78 -6.405 -21.096 5.526 585 HB VAL 78 HB VAL 78 -7.042 -19.806 2.872 586 HG11 VAL 78 1HG1 VAL 78 -5.511 -18.302 3.668 587 HG12 VAL 78 2HG1 VAL 78 -4.725 -19.486 4.713 588 HG13 VAL 78 3HG1 VAL 78 -4.428 -19.508 2.974 589 HG21 VAL 78 1HG2 VAL 78 -6.663 -21.975 2.303 590 HG22 VAL 78 2HG2 VAL 78 -4.989 -21.423 2.363 591 HG23 VAL 78 3HG2 VAL 78 -5.679 -22.295 3.732 592 H GLN 79 H GLN 79 -5.900 -19.523 6.914 593 HA GLN 79 HA GLN 79 -7.621 -17.135 6.970 594 HB2 GLN 79 1HB GLN 79 -6.127 -18.542 9.184 595 HB3 GLN 79 2HB GLN 79 -6.893 -16.970 9.378 596 HG2 GLN 79 1HG GLN 79 -9.011 -17.834 9.292 597 HG3 GLN 79 2HG GLN 79 -8.517 -19.240 8.351 598 HE21 GLN 79 1HE2 GLN 79 -9.332 -20.814 9.626 599 HE22 GLN 79 2HE2 GLN 79 -8.814 -21.117 11.245 600 H TRP 80 H TRP 80 -6.716 -15.275 6.419 601 HA TRP 80 HA TRP 80 -3.889 -14.813 7.014 602 HB2 TRP 80 1HB TRP 80 -3.323 -14.136 4.819 603 HB3 TRP 80 2HB TRP 80 -4.199 -15.651 4.622 604 HD1 TRP 80 HD TRP 80 -4.366 -11.972 3.759 605 HE1 TRP 80 1HE TRP 80 -6.375 -11.556 2.203 606 HE3 TRP 80 3HE TRP 80 -6.628 -16.543 4.114 607 HZ2 TRP 80 2HZ TRP 80 -8.621 -12.977 1.253 608 HZ3 TRP 80 3HZ TRP 80 -8.703 -16.933 2.850 609 HH2 TRP 80 HH TRP 80 -9.677 -15.186 1.451 610 H GLU 81 H GLU 81 -3.324 -12.638 7.272 611 HA GLU 81 HA GLU 81 -5.626 -10.834 7.581 612 HB2 GLU 81 1HB GLU 81 -2.992 -11.046 9.006 613 HB3 GLU 81 2HB GLU 81 -3.896 -9.538 9.026 614 HG2 GLU 81 1HG GLU 81 -5.857 -11.160 9.763 615 HG3 GLU 81 2HG GLU 81 -4.497 -12.132 10.323 616 H MET 82 H MET 82 -5.711 -8.929 6.523 617 HA MET 82 HA MET 82 -3.393 -8.210 4.851 618 HB2 MET 82 1HB MET 82 -6.329 -8.216 4.245 619 HB3 MET 82 2HB MET 82 -5.261 -7.105 3.399 620 HG2 MET 82 1HG MET 82 -3.919 -8.997 2.619 621 HG3 MET 82 2HG MET 82 -5.010 -10.103 3.452 622 HE1 MET 82 1HE MET 82 -5.234 -7.941 -0.381 623 HE2 MET 82 2HE MET 82 -6.273 -6.974 0.666 624 HE3 MET 82 3HE MET 82 -4.604 -7.300 1.136 625 H GLU 83 H GLU 83 -2.447 -6.560 5.897 626 HA GLU 83 HA GLU 83 -4.129 -4.459 7.057 627 HB2 GLU 83 1HB GLU 83 -2.463 -5.347 8.562 628 HB3 GLU 83 2HB GLU 83 -1.191 -5.081 7.379 629 HG2 GLU 83 1HG GLU 83 -1.530 -2.668 7.555 630 HG3 GLU 83 2HG GLU 83 -2.799 -2.937 8.749 631 H VAL 84 H VAL 84 -4.140 -2.400 6.319 632 HA VAL 84 HA VAL 84 -2.809 -1.911 3.767 633 HB VAL 84 HB VAL 84 -4.872 -0.229 5.198 634 HG11 VAL 84 1HG1 VAL 84 -4.625 0.055 2.313 635 HG12 VAL 84 2HG1 VAL 84 -4.680 1.290 3.572 636 HG13 VAL 84 3HG1 VAL 84 -3.152 0.504 3.172 637 HG21 VAL 84 1HG2 VAL 84 -5.985 -2.210 4.651 638 HG22 VAL 84 2HG2 VAL 84 -6.337 -1.137 3.296 639 HG23 VAL 84 3HG2 VAL 84 -5.109 -2.391 3.131 640 H CYS 85 H CYS 85 -0.704 -1.421 4.269 641 HA CYS 85 HA CYS 85 0.196 0.147 6.385 642 HB2 CYS 85 1HB CYS 85 1.479 -1.304 4.599 643 HB3 CYS 85 2HB CYS 85 1.618 0.233 3.753 644 HG CYS 85 HG CYS 85 3.581 -0.919 5.999 645 H LYS 86 H LYS 86 1.392 2.294 6.042 646 HA LYS 86 HA LYS 86 -0.184 4.090 4.328 647 HB2 LYS 86 1HB LYS 86 -0.993 4.238 6.661 648 HB3 LYS 86 2HB LYS 86 0.633 4.659 7.185 649 HG2 LYS 86 1HG LYS 86 0.360 6.585 5.426 650 HG3 LYS 86 2HG LYS 86 -1.359 6.282 5.686 651 HD2 LYS 86 1HD LYS 86 0.393 6.547 8.074 652 HD3 LYS 86 2HD LYS 86 -0.002 8.010 7.168 653 HE2 LYS 86 1HE LYS 86 -2.390 7.492 7.401 654 HE3 LYS 86 2HE LYS 86 -1.981 6.050 8.328 655 HZ1 LYS 86 1HZ LYS 86 -1.705 7.248 10.163 656 HZ2 LYS 86 2HZ LYS 86 -2.436 8.536 9.346 657 HZ3 LYS 86 3HZ LYS 86 -0.750 8.405 9.381 658 H LEU 87 H LEU 87 1.153 4.986 2.913 659 HA LEU 87 HA LEU 87 3.978 5.279 3.541 660 HB2 LEU 87 1HB LEU 87 2.321 5.374 1.074 661 HB3 LEU 87 2HB LEU 87 3.857 6.238 1.078 662 HG LEU 87 HG LEU 87 4.813 3.940 1.883 663 HD11 LEU 87 1HD1 LEU 87 2.700 2.750 0.199 664 HD12 LEU 87 2HD1 LEU 87 2.250 3.170 1.851 665 HD13 LEU 87 3HD1 LEU 87 3.594 2.067 1.558 666 HD21 LEU 87 1HD2 LEU 87 5.688 3.834 -0.172 667 HD22 LEU 87 2HD2 LEU 87 4.728 5.275 -0.507 668 HD23 LEU 87 3HD2 LEU 87 4.106 3.681 -0.938 669 HA PRO 88 HA PRO 88 3.984 9.592 4.344 670 HB2 PRO 88 1HB PRO 88 6.236 10.421 3.073 671 HB3 PRO 88 2HB PRO 88 6.268 9.454 4.553 672 HG2 PRO 88 1HG PRO 88 6.607 8.578 1.710 673 HG3 PRO 88 2HG PRO 88 7.521 8.088 3.149 674 HD2 PRO 88 1HD PRO 88 5.558 6.560 2.080 675 HD3 PRO 88 2HD PRO 88 5.904 6.590 3.821 676 H ARG 89 H ARG 89 4.825 8.927 0.940 677 HA ARG 89 HA ARG 89 3.489 11.399 0.138 678 HB2 ARG 89 1HB ARG 89 5.385 9.507 -1.209 679 HB3 ARG 89 2HB ARG 89 4.401 10.598 -2.174 680 HG2 ARG 89 1HG ARG 89 6.242 11.896 -1.932 681 HG3 ARG 89 2HG ARG 89 5.374 12.381 -0.474 682 HD2 ARG 89 1HD ARG 89 6.687 10.307 0.535 683 HD3 ARG 89 2HD ARG 89 7.798 10.691 -0.779 684 HE ARG 89 HE ARG 89 7.024 12.928 0.886 685 HH11 ARG 89 2HH1 ARG 89 9.330 10.387 0.299 686 HH12 ARG 89 1HH1 ARG 89 10.605 11.162 1.179 687 HH21 ARG 89 2HH2 ARG 89 8.695 13.959 2.047 688 HH22 ARG 89 1HH2 ARG 89 10.243 13.194 2.174 689 H LEU 90 H LEU 90 2.027 9.012 1.091 690 HA LEU 90 HA LEU 90 0.403 7.506 0.407 691 HB2 LEU 90 1HB LEU 90 -0.379 10.194 -0.682 692 HB3 LEU 90 2HB LEU 90 -1.459 8.803 -0.751 693 HG LEU 90 HG LEU 90 -2.079 10.167 1.116 694 HD11 LEU 90 1HD1 LEU 90 -0.717 8.165 2.723 695 HD12 LEU 90 2HD1 LEU 90 -1.484 7.485 1.288 696 HD13 LEU 90 3HD1 LEU 90 -2.440 8.414 2.442 697 HD21 LEU 90 1HD2 LEU 90 0.139 11.288 1.344 698 HD22 LEU 90 2HD2 LEU 90 0.724 9.847 2.175 699 HD23 LEU 90 3HD2 LEU 90 -0.587 10.798 2.874 700 H SER 91 H SER 91 2.643 7.391 -1.359 701 HA SER 91 HA SER 91 1.912 7.537 -4.074 702 HB2 SER 91 1HB SER 91 4.066 6.080 -2.569 703 HB3 SER 91 2HB SER 91 3.836 5.792 -4.294 704 HG SER 91 HG SER 91 5.041 7.505 -4.493 705 H LEU 92 H LEU 92 1.434 5.089 -1.635 706 HA LEU 92 HA LEU 92 -0.594 3.784 -3.082 707 HB2 LEU 92 1HB LEU 92 0.454 1.677 -3.599 708 HB3 LEU 92 2HB LEU 92 1.301 2.986 -4.421 709 HG LEU 92 HG LEU 92 2.858 2.797 -2.267 710 HD11 LEU 92 1HD1 LEU 92 2.234 -0.089 -2.655 711 HD12 LEU 92 2HD1 LEU 92 1.243 0.861 -1.548 712 HD13 LEU 92 3HD1 LEU 92 2.981 0.732 -1.284 713 HD21 LEU 92 1HD2 LEU 92 4.139 2.522 -4.076 714 HD22 LEU 92 2HD2 LEU 92 2.875 1.659 -4.952 715 HD23 LEU 92 3HD2 LEU 92 3.910 0.792 -3.816 716 H ASN 93 H ASN 93 -1.212 1.655 -1.997 717 HA ASN 93 HA ASN 93 -0.788 1.960 0.895 718 HB2 ASN 93 1HB ASN 93 -2.927 1.105 1.257 719 HB3 ASN 93 2HB ASN 93 -3.137 2.048 -0.216 720 HD21 ASN 93 1HD2 ASN 93 -2.898 0.823 -2.266 721 HD22 ASN 93 2HD2 ASN 93 -3.537 -0.782 -2.317 722 H GLY 94 H GLY 94 0.678 0.618 1.711 723 HA2 GLY 94 1HA GLY 94 1.670 -1.675 0.432 724 HA3 GLY 94 2HA GLY 94 1.891 -1.283 2.131 725 H VAL 95 H VAL 95 0.602 -3.487 0.010 726 HA VAL 95 HA VAL 95 -1.272 -4.508 2.045 727 HB VAL 95 HB VAL 95 -1.345 -5.019 -0.933 728 HG11 VAL 95 1HG1 VAL 95 -2.816 -6.639 -0.538 729 HG12 VAL 95 2HG1 VAL 95 -2.403 -6.514 1.173 730 HG13 VAL 95 3HG1 VAL 95 -3.763 -5.598 0.523 731 HG21 VAL 95 1HG2 VAL 95 -3.592 -3.625 0.324 732 HG22 VAL 95 2HG2 VAL 95 -2.084 -2.711 0.325 733 HG23 VAL 95 3HG2 VAL 95 -2.759 -3.297 -1.196 734 H ARG 96 H ARG 96 -0.323 -6.093 3.148 735 HA ARG 96 HA ARG 96 1.417 -7.974 1.702 736 HB2 ARG 96 1HB ARG 96 1.271 -7.438 4.674 737 HB3 ARG 96 2HB ARG 96 2.407 -8.512 3.869 738 HG2 ARG 96 1HG ARG 96 2.319 -5.659 3.038 739 HG3 ARG 96 2HG ARG 96 3.087 -6.077 4.570 740 HD2 ARG 96 1HD ARG 96 4.413 -7.803 3.271 741 HD3 ARG 96 2HD ARG 96 3.805 -7.028 1.809 742 HE ARG 96 HE ARG 96 5.785 -5.984 3.646 743 HH11 ARG 96 2HH1 ARG 96 3.585 -5.319 1.032 744 HH12 ARG 96 1HH1 ARG 96 4.415 -3.885 0.524 745 HH21 ARG 96 2HH2 ARG 96 6.888 -4.099 2.987 746 HH22 ARG 96 1HH2 ARG 96 6.295 -3.193 1.636 747 H PHE 97 H PHE 97 1.346 -10.242 2.450 748 HA PHE 97 HA PHE 97 -1.331 -11.025 3.391 749 HB2 PHE 97 1HB PHE 97 0.171 -11.925 0.973 750 HB3 PHE 97 2HB PHE 97 -0.829 -13.101 1.820 751 HD1 PHE 97 1HD PHE 97 -1.140 -9.538 0.739 752 HD2 PHE 97 2HD PHE 97 -2.913 -13.403 0.934 753 HE1 PHE 97 1HE PHE 97 -3.127 -8.681 -0.430 754 HE2 PHE 97 2HE PHE 97 -4.903 -12.552 -0.236 755 HZ PHE 97 HZ PHE 97 -5.012 -10.189 -0.921 756 H LYS 98 H LYS 98 -1.095 -11.962 5.304 757 HA LYS 98 HA LYS 98 1.282 -13.630 5.784 758 HB2 LYS 98 1HB LYS 98 0.570 -11.540 7.254 759 HB3 LYS 98 2HB LYS 98 -0.483 -12.726 8.013 760 HG2 LYS 98 1HG LYS 98 2.439 -13.270 7.665 761 HG3 LYS 98 2HG LYS 98 1.844 -12.308 9.020 762 HD2 LYS 98 1HD LYS 98 0.602 -14.962 8.428 763 HD3 LYS 98 2HD LYS 98 2.148 -14.889 9.278 764 HE2 LYS 98 1HE LYS 98 -0.264 -13.320 10.155 765 HE3 LYS 98 2HE LYS 98 0.054 -14.962 10.714 766 HZ1 LYS 98 1HZ LYS 98 2.394 -13.460 11.022 767 HZ2 LYS 98 2HZ LYS 98 1.422 -14.140 12.227 768 HZ3 LYS 98 3HZ LYS 98 1.121 -12.566 11.687 769 H ARG 99 H ARG 99 1.071 -15.736 6.325 770 HA ARG 99 HA ARG 99 -1.584 -16.902 6.090 771 HB2 ARG 99 1HB ARG 99 0.176 -17.944 4.805 772 HB3 ARG 99 2HB ARG 99 1.165 -18.143 6.245 773 HG2 ARG 99 1HG ARG 99 -0.434 -19.726 7.155 774 HG3 ARG 99 2HG ARG 99 -1.479 -19.495 5.751 775 HD2 ARG 99 1HD ARG 99 -0.254 -21.505 5.400 776 HD3 ARG 99 2HD ARG 99 0.421 -20.284 4.322 777 HE ARG 99 HE ARG 99 2.390 -20.338 5.523 778 HH11 ARG 99 2HH1 ARG 99 -0.075 -22.161 7.174 779 HH12 ARG 99 1HH1 ARG 99 1.028 -22.883 8.298 780 HH21 ARG 99 2HH2 ARG 99 3.852 -21.283 6.998 781 HH22 ARG 99 1HH2 ARG 99 3.262 -22.382 8.198 782 H ILE 100 H ILE 100 -2.584 -16.412 8.032 783 HA ILE 100 HA ILE 100 -1.363 -16.875 10.567 784 HB ILE 100 HB ILE 100 -4.217 -16.365 9.753 785 HG12 ILE 100 1HG1 ILE 100 -3.563 -14.318 11.336 786 HG13 ILE 100 2HG1 ILE 100 -1.942 -14.753 10.805 787 HG21 ILE 100 1HG2 ILE 100 -4.690 -16.097 12.179 788 HG22 ILE 100 2HG2 ILE 100 -4.334 -17.757 11.703 789 HG23 ILE 100 3HG2 ILE 100 -3.105 -16.792 12.521 790 HD11 ILE 100 1HD1 ILE 100 -2.939 -12.998 9.426 791 HD12 ILE 100 2HD1 ILE 100 -2.596 -14.456 8.494 792 HD13 ILE 100 3HD1 ILE 100 -4.249 -14.094 8.989 793 H SER 101 H SER 101 -3.503 -18.722 8.472 794 HA SER 101 HA SER 101 -2.771 -21.174 9.751 795 HB2 SER 101 1HB SER 101 -4.710 -20.017 11.136 796 HB3 SER 101 2HB SER 101 -5.720 -20.694 9.859 797 HG SER 101 HG SER 101 -3.923 -22.505 10.770 798 H GLY 102 H GLY 102 -3.808 -23.062 8.704 799 HA2 GLY 102 1HA GLY 102 -5.146 -23.931 6.887 800 HA3 GLY 102 2HA GLY 102 -4.867 -22.424 6.028 801 H THR 103 H THR 103 -4.041 -23.386 4.189 802 HA THR 103 HA THR 103 -1.453 -24.757 4.528 803 HB THR 103 HB THR 103 -1.923 -25.738 2.234 804 HG1 THR 103 1HG THR 103 -3.802 -25.345 1.320 805 HG21 THR 103 1HG2 THR 103 -2.227 -27.458 3.642 806 HG22 THR 103 2HG2 THR 103 -3.951 -27.152 3.437 807 HG23 THR 103 3HG2 THR 103 -3.090 -26.461 4.811 808 H SER 104 H SER 104 0.170 -24.348 2.926 809 HA SER 104 HA SER 104 0.391 -21.605 2.241 810 HB2 SER 104 1HB SER 104 2.382 -22.679 0.805 811 HB3 SER 104 2HB SER 104 2.487 -22.474 2.554 812 HG SER 104 HG SER 104 2.739 -24.701 1.247 813 H ILE 105 H ILE 105 0.197 -24.505 0.171 814 HA ILE 105 HA ILE 105 0.137 -23.476 -2.308 815 HB ILE 105 HB ILE 105 -1.622 -25.629 -1.159 816 HG12 ILE 105 1HG1 ILE 105 0.729 -26.178 -1.268 817 HG13 ILE 105 2HG1 ILE 105 -0.115 -27.076 -2.524 818 HG21 ILE 105 1HG2 ILE 105 -2.802 -24.620 -3.053 819 HG22 ILE 105 2HG2 ILE 105 -1.379 -24.862 -4.065 820 HG23 ILE 105 3HG2 ILE 105 -2.253 -26.254 -3.425 821 HD11 ILE 105 1HD1 ILE 105 1.871 -26.287 -3.497 822 HD12 ILE 105 2HD1 ILE 105 0.589 -25.245 -4.114 823 HD13 ILE 105 3HD1 ILE 105 1.650 -24.671 -2.828 824 H ALA 106 H ALA 106 -2.907 -23.934 -0.501 825 HA ALA 106 HA ALA 106 -4.497 -22.400 -2.212 826 HB1 ALA 106 1HB ALA 106 -5.360 -22.322 0.570 827 HB2 ALA 106 2HB ALA 106 -6.157 -23.006 -0.847 828 HB3 ALA 106 3HB ALA 106 -4.937 -23.943 0.015 829 H PHE 107 H PHE 107 -2.818 -21.491 0.782 830 HA PHE 107 HA PHE 107 -3.707 -18.954 1.196 831 HB2 PHE 107 1HB PHE 107 -2.066 -20.004 2.654 832 HB3 PHE 107 2HB PHE 107 -0.849 -19.928 1.384 833 HD1 PHE 107 1HD PHE 107 -2.840 -17.938 3.754 834 HD2 PHE 107 2HD PHE 107 0.372 -17.936 0.962 835 HE1 PHE 107 1HE PHE 107 -2.137 -15.726 4.569 836 HE2 PHE 107 2HE PHE 107 1.081 -15.725 1.774 837 HZ PHE 107 HZ PHE 107 -0.173 -14.617 3.580 838 H LYS 108 H LYS 108 -1.363 -19.998 -1.225 839 HA LYS 108 HA LYS 108 -1.011 -17.280 -2.196 840 HB2 LYS 108 1HB LYS 108 0.155 -19.926 -3.071 841 HB3 LYS 108 2HB LYS 108 0.505 -18.399 -3.871 842 HG2 LYS 108 1HG LYS 108 1.789 -17.626 -2.147 843 HG3 LYS 108 2HG LYS 108 0.939 -18.590 -0.936 844 HD2 LYS 108 1HD LYS 108 3.114 -19.528 -1.184 845 HD3 LYS 108 2HD LYS 108 1.981 -20.628 -1.974 846 HE2 LYS 108 1HE LYS 108 2.619 -19.884 -4.127 847 HE3 LYS 108 2HE LYS 108 3.485 -18.496 -3.471 848 HZ1 LYS 108 1HZ LYS 108 4.593 -20.880 -4.148 849 HZ2 LYS 108 2HZ LYS 108 4.457 -21.001 -2.467 850 HZ3 LYS 108 3HZ LYS 108 5.308 -19.711 -3.155 851 H ASN 109 H ASN 109 -2.169 -20.390 -3.496 852 HA ASN 109 HA ASN 109 -2.949 -19.657 -6.002 853 HB2 ASN 109 1HB ASN 109 -4.064 -21.601 -4.023 854 HB3 ASN 109 2HB ASN 109 -4.959 -21.303 -5.510 855 HD21 ASN 109 1HD2 ASN 109 -2.267 -22.827 -4.073 856 HD22 ASN 109 2HD2 ASN 109 -1.637 -23.572 -5.499 857 H ILE 110 H ILE 110 -4.547 -18.905 -2.975 858 HA ILE 110 HA ILE 110 -6.825 -17.708 -4.325 859 HB ILE 110 HB ILE 110 -7.190 -18.943 -2.233 860 HG12 ILE 110 1HG1 ILE 110 -8.462 -17.113 -1.027 861 HG13 ILE 110 2HG1 ILE 110 -7.762 -15.977 -2.175 862 HG21 ILE 110 1HG2 ILE 110 -6.156 -16.877 -0.461 863 HG22 ILE 110 2HG2 ILE 110 -6.006 -18.631 -0.366 864 HG23 ILE 110 3HG2 ILE 110 -4.893 -17.705 -1.372 865 HD11 ILE 110 1HD1 ILE 110 -10.043 -17.682 -2.461 866 HD12 ILE 110 2HD1 ILE 110 -9.467 -16.391 -3.516 867 HD13 ILE 110 3HD1 ILE 110 -8.857 -18.033 -3.718 868 H ALA 111 H ALA 111 -3.847 -16.748 -2.801 869 HA ALA 111 HA ALA 111 -4.449 -14.021 -2.379 870 HB1 ALA 111 1HB ALA 111 -2.281 -15.700 -1.902 871 HB2 ALA 111 2HB ALA 111 -1.664 -14.461 -2.996 872 HB3 ALA 111 3HB ALA 111 -2.420 -13.995 -1.472 873 H SER 112 H SER 112 -3.030 -15.760 -5.117 874 HA SER 112 HA SER 112 -2.331 -13.546 -6.676 875 HB2 SER 112 1HB SER 112 -1.777 -16.041 -7.035 876 HB3 SER 112 2HB SER 112 -3.331 -16.127 -7.865 877 HG SER 112 HG SER 112 -2.561 -14.950 -9.469 878 H LYS 113 H LYS 113 -5.391 -15.208 -6.256 879 HA LYS 113 HA LYS 113 -6.744 -13.955 -8.418 880 HB2 LYS 113 1HB LYS 113 -7.905 -15.157 -5.898 881 HB3 LYS 113 2HB LYS 113 -8.786 -14.807 -7.379 882 HG2 LYS 113 1HG LYS 113 -6.452 -16.690 -7.331 883 HG3 LYS 113 2HG LYS 113 -8.096 -17.218 -6.965 884 HD2 LYS 113 1HD LYS 113 -8.848 -16.460 -9.149 885 HD3 LYS 113 2HD LYS 113 -7.232 -15.850 -9.513 886 HE2 LYS 113 1HE LYS 113 -7.188 -17.887 -10.577 887 HE3 LYS 113 2HE LYS 113 -6.513 -18.312 -9.005 888 HZ1 LYS 113 1HZ LYS 113 -8.191 -19.900 -9.717 889 HZ2 LYS 113 2HZ LYS 113 -9.348 -18.670 -9.815 890 HZ3 LYS 113 3HZ LYS 113 -8.688 -19.093 -8.316 891 H ILE 114 H ILE 114 -7.163 -13.467 -4.905 892 HA ILE 114 HA ILE 114 -8.765 -11.318 -4.807 893 HB ILE 114 HB ILE 114 -6.233 -11.606 -3.185 894 HG12 ILE 114 1HG1 ILE 114 -7.623 -13.574 -2.973 895 HG13 ILE 114 2HG1 ILE 114 -7.771 -12.619 -1.502 896 HG21 ILE 114 1HG2 ILE 114 -8.581 -10.287 -2.013 897 HG22 ILE 114 2HG2 ILE 114 -6.869 -9.884 -1.887 898 HG23 ILE 114 3HG2 ILE 114 -7.788 -9.392 -3.309 899 HD11 ILE 114 1HD1 ILE 114 -9.752 -12.720 -3.764 900 HD12 ILE 114 2HD1 ILE 114 -9.922 -13.480 -2.181 901 HD13 ILE 114 3HD1 ILE 114 -9.899 -11.722 -2.317 902 H ALA 115 H ALA 115 -5.311 -11.209 -5.575 903 HA ALA 115 HA ALA 115 -5.035 -8.420 -5.704 904 HB1 ALA 115 1HB ALA 115 -2.926 -8.823 -6.410 905 HB2 ALA 115 2HB ALA 115 -3.309 -10.462 -5.884 906 HB3 ALA 115 3HB ALA 115 -3.433 -10.032 -7.590 907 H ASN 116 H ASN 116 -5.656 -10.774 -8.308 908 HA ASN 116 HA ASN 116 -5.747 -9.134 -10.485 909 HB2 ASN 116 1HB ASN 116 -6.736 -10.872 -11.573 910 HB3 ASN 116 2HB ASN 116 -6.346 -11.731 -10.086 911 HD21 ASN 116 1HD2 ASN 116 -7.947 -12.969 -9.464 912 HD22 ASN 116 2HD2 ASN 116 -9.631 -12.594 -9.567 913 H GLU 117 H GLU 117 -8.422 -9.762 -8.228 914 HA GLU 117 HA GLU 117 -10.289 -8.078 -9.507 915 HB2 GLU 117 1HB GLU 117 -10.281 -8.666 -6.555 916 HB3 GLU 117 2HB GLU 117 -11.661 -8.378 -7.605 917 HG2 GLU 117 1HG GLU 117 -10.650 -10.555 -8.792 918 HG3 GLU 117 2HG GLU 117 -10.115 -10.842 -7.137 919 H LEU 118 H LEU 118 -7.944 -7.517 -6.929 920 HA LEU 118 HA LEU 118 -8.793 -4.788 -6.532 921 HB2 LEU 118 1HB LEU 118 -6.695 -6.566 -5.389 922 HB3 LEU 118 2HB LEU 118 -6.512 -4.822 -5.211 923 HG LEU 118 HG LEU 118 -9.038 -6.186 -4.351 924 HD11 LEU 118 1HD1 LEU 118 -8.043 -6.308 -2.072 925 HD12 LEU 118 2HD1 LEU 118 -6.470 -5.970 -2.792 926 HD13 LEU 118 3HD1 LEU 118 -7.339 -7.441 -3.227 927 HD21 LEU 118 1HD2 LEU 118 -8.023 -3.534 -4.342 928 HD22 LEU 118 2HD2 LEU 118 -8.166 -4.074 -2.669 929 HD23 LEU 118 3HD2 LEU 118 -9.571 -4.124 -3.735 930 H LYS 119 H LYS 119 -7.566 -5.942 -9.133 931 HA LYS 119 HA LYS 119 -6.049 -5.330 -10.741 932 HB2 LYS 119 1HB LYS 119 -6.787 -2.596 -9.681 933 HB3 LYS 119 2HB LYS 119 -6.119 -2.941 -11.270 934 HG2 LYS 119 1HG LYS 119 -8.750 -4.025 -10.295 935 HG3 LYS 119 2HG LYS 119 -8.579 -2.535 -11.226 936 HD2 LYS 119 1HD LYS 119 -7.324 -5.017 -12.285 937 HD3 LYS 119 2HD LYS 119 -9.078 -4.851 -12.399 938 HE2 LYS 119 1HE LYS 119 -8.751 -2.668 -13.521 939 HE3 LYS 119 2HE LYS 119 -7.010 -2.940 -13.483 940 HZ1 LYS 119 1HZ LYS 119 -8.462 -5.135 -14.622 941 HZ2 LYS 119 2HZ LYS 119 -7.125 -4.295 -15.229 942 HZ3 LYS 119 3HZ LYS 119 -8.686 -3.694 -15.480 943 H LEU 120 H LEU 120 -4.726 -6.070 -8.409 944 HA LEU 120 HA LEU 120 -2.706 -4.061 -7.853 945 HB2 LEU 120 1HB LEU 120 -3.074 -6.882 -6.859 946 HB3 LEU 120 2HB LEU 120 -1.777 -5.807 -6.341 947 HG LEU 120 HG LEU 120 -4.696 -5.176 -5.951 948 HD11 LEU 120 1HD1 LEU 120 -3.039 -6.034 -3.664 949 HD12 LEU 120 2HD1 LEU 120 -3.553 -7.297 -4.781 950 HD13 LEU 120 3HD1 LEU 120 -4.755 -6.283 -3.983 951 HD21 LEU 120 1HD2 LEU 120 -4.018 -3.374 -4.725 952 HD22 LEU 120 2HD2 LEU 120 -2.702 -3.447 -5.898 953 HD23 LEU 120 3HD2 LEU 120 -2.480 -4.113 -4.279 954 H SER 121 H SER 121 -0.371 -5.157 -7.663 955 HA SER 121 HA SER 121 0.694 -5.325 -10.175 956 HB2 SER 121 1HB SER 121 1.820 -5.249 -7.791 957 HB3 SER 121 2HB SER 121 1.935 -6.994 -8.022 958 HG SER 121 HG SER 121 3.400 -5.011 -9.143 959 H GLY 122 H GLY 122 -0.104 -8.106 -8.086 960 HA2 GLY 122 1HA GLY 122 -0.737 -10.249 -8.627 961 HA3 GLY 122 2HA GLY 122 -1.082 -9.663 -10.248 962 HA PRO 123 HA PRO 123 3.585 -11.001 -10.127 963 HB2 PRO 123 1HB PRO 123 4.289 -12.578 -8.032 964 HB3 PRO 123 2HB PRO 123 4.434 -10.816 -8.000 965 HG2 PRO 123 1HG PRO 123 2.289 -12.562 -6.852 966 HG3 PRO 123 2HG PRO 123 3.082 -11.146 -6.136 967 HD2 PRO 123 1HD PRO 123 0.633 -11.019 -7.284 968 HD3 PRO 123 2HD PRO 123 1.774 -9.660 -7.317 969 H SER 124 H SER 124 4.576 -13.050 -10.716 970 HA SER 124 HA SER 124 2.854 -15.402 -10.625 971 HB2 SER 124 1HB SER 124 3.882 -14.243 -13.227 972 HB3 SER 124 2HB SER 124 3.014 -15.768 -13.051 973 HG SER 124 HG SER 124 1.310 -14.386 -12.064 974 H SER 125 H SER 125 3.966 -17.366 -11.354 975 HA SER 125 HA SER 125 6.878 -17.153 -10.951 976 HB2 SER 125 1HB SER 125 4.926 -19.299 -10.118 977 HB3 SER 125 2HB SER 125 6.668 -19.567 -10.146 978 HG SER 125 HG SER 125 5.765 -17.286 -8.837 979 H GLY 126 H GLY 126 7.866 -17.342 -12.857 980 HA2 GLY 126 1HA GLY 126 8.496 -19.302 -14.373 981 HA3 GLY 126 2HA GLY 126 6.793 -19.277 -14.806 Start of MODEL 18 1 H1 MET 1 H MET 1 -5.676 -9.190 -66.764 2 HA MET 1 HA MET 1 -7.890 -9.862 -64.938 3 HB2 MET 1 1HB MET 1 -5.337 -11.289 -65.521 4 HB3 MET 1 2HB MET 1 -5.959 -11.340 -63.877 5 HG2 MET 1 1HG MET 1 -6.783 -13.263 -64.933 6 HG3 MET 1 2HG MET 1 -8.139 -12.140 -64.860 7 HE1 MET 1 1HE MET 1 -6.476 -14.438 -68.075 8 HE2 MET 1 2HE MET 1 -6.914 -14.691 -66.385 9 HE3 MET 1 3HE MET 1 -8.168 -14.652 -67.626 10 H LYS 2 H LYS 2 -7.923 -8.840 -63.033 11 HA LYS 2 HA LYS 2 -5.692 -7.042 -62.411 12 HB2 LYS 2 1HB LYS 2 -8.566 -7.101 -61.488 13 HB3 LYS 2 2HB LYS 2 -7.359 -6.017 -60.808 14 HG2 LYS 2 1HG LYS 2 -7.018 -5.009 -63.006 15 HG3 LYS 2 2HG LYS 2 -8.226 -6.099 -63.691 16 HD2 LYS 2 1HD LYS 2 -9.437 -4.152 -63.314 17 HD3 LYS 2 2HD LYS 2 -9.794 -5.120 -61.881 18 HE2 LYS 2 1HE LYS 2 -7.754 -3.882 -60.857 19 HE3 LYS 2 2HE LYS 2 -8.022 -2.724 -62.159 20 HZ1 LYS 2 1HZ LYS 2 -10.130 -3.552 -60.244 21 HZ2 LYS 2 2HZ LYS 2 -10.201 -2.287 -61.363 22 HZ3 LYS 2 3HZ LYS 2 -9.161 -2.181 -60.033 23 H ASP 3 H ASP 3 -4.838 -6.907 -60.291 24 HA ASP 3 HA ASP 3 -5.544 -8.998 -58.394 25 HB2 ASP 3 1HB ASP 3 -3.314 -9.887 -58.207 26 HB3 ASP 3 2HB ASP 3 -3.800 -9.974 -59.898 27 H HIS 4 H HIS 4 -4.041 -8.767 -56.386 28 HA HIS 4 HA HIS 4 -3.519 -5.912 -55.895 29 HB2 HIS 4 1HB HIS 4 -4.555 -7.675 -53.706 30 HB3 HIS 4 2HB HIS 4 -4.650 -5.924 -53.864 31 HD1 HIS 4 1HD HIS 4 -6.892 -5.091 -54.466 32 HD2 HIS 4 2HD HIS 4 -6.287 -8.980 -55.798 33 HE1 HIS 4 1HE HIS 4 -9.069 -5.789 -55.515 34 HE2 HIS 4 2HE HIS 4 -8.705 -8.174 -56.238 35 H LEU 5 H LEU 5 -2.743 -9.253 -55.176 36 HA LEU 5 HA LEU 5 -1.046 -10.173 -53.899 37 HB2 LEU 5 1HB LEU 5 0.595 -8.247 -55.525 38 HB3 LEU 5 2HB LEU 5 1.062 -9.844 -54.943 39 HG LEU 5 HG LEU 5 -0.996 -9.287 -57.079 40 HD11 LEU 5 1HD1 LEU 5 0.593 -9.529 -58.640 41 HD12 LEU 5 2HD1 LEU 5 1.438 -10.782 -57.732 42 HD13 LEU 5 3HD1 LEU 5 1.701 -9.083 -57.342 43 HD21 LEU 5 1HD2 LEU 5 -0.404 -11.876 -57.353 44 HD22 LEU 5 2HD2 LEU 5 -1.723 -11.300 -56.333 45 HD23 LEU 5 3HD2 LEU 5 -0.168 -11.720 -55.612 46 H ILE 6 H ILE 6 -2.212 -8.198 -52.370 47 HA ILE 6 HA ILE 6 -0.730 -6.116 -51.411 48 HB ILE 6 HB ILE 6 -2.309 -8.036 -49.695 49 HG12 ILE 6 1HG1 ILE 6 -3.625 -7.189 -51.589 50 HG13 ILE 6 2HG1 ILE 6 -4.196 -6.512 -50.068 51 HG21 ILE 6 1HG2 ILE 6 -1.833 -6.717 -47.977 52 HG22 ILE 6 2HG2 ILE 6 -0.754 -5.784 -49.012 53 HG23 ILE 6 3HG2 ILE 6 -2.446 -5.314 -48.852 54 HD11 ILE 6 1HD1 ILE 6 -2.353 -5.092 -51.973 55 HD12 ILE 6 2HD1 ILE 6 -4.103 -4.879 -51.916 56 HD13 ILE 6 3HD1 ILE 6 -3.114 -4.426 -50.528 57 H HIS 7 H HIS 7 0.940 -5.809 -49.994 58 HA HIS 7 HA HIS 7 2.803 -7.961 -49.701 59 HB2 HIS 7 1HB HIS 7 3.255 -5.409 -49.992 60 HB3 HIS 7 2HB HIS 7 3.049 -5.348 -48.244 61 HD1 HIS 7 1HD HIS 7 5.438 -6.327 -50.884 62 HD2 HIS 7 2HD HIS 7 5.047 -6.762 -46.771 63 HE1 HIS 7 1HE HIS 7 7.701 -7.060 -50.067 64 HE2 HIS 7 2HE HIS 7 7.417 -7.399 -47.588 65 H ASN 8 H ASN 8 2.763 -9.449 -48.163 66 HA ASN 8 HA ASN 8 1.043 -9.283 -45.908 67 HB2 ASN 8 1HB ASN 8 3.307 -11.224 -46.423 68 HB3 ASN 8 2HB ASN 8 2.001 -11.435 -45.261 69 HD21 ASN 8 1HD2 ASN 8 -0.230 -11.299 -46.246 70 HD22 ASN 8 2HD2 ASN 8 -0.458 -12.117 -47.751 71 H VAL 9 H VAL 9 1.886 -9.726 -43.648 72 HA VAL 9 HA VAL 9 4.432 -8.385 -43.100 73 HB VAL 9 HB VAL 9 3.244 -7.210 -41.147 74 HG11 VAL 9 1HG1 VAL 9 3.896 -6.412 -43.696 75 HG12 VAL 9 2HG1 VAL 9 2.224 -5.875 -43.527 76 HG13 VAL 9 3HG1 VAL 9 3.442 -5.348 -42.365 77 HG21 VAL 9 1HG2 VAL 9 1.065 -8.608 -42.095 78 HG22 VAL 9 2HG2 VAL 9 1.018 -7.252 -40.968 79 HG23 VAL 9 3HG2 VAL 9 0.793 -6.972 -42.695 80 H HIS 10 H HIS 10 5.555 -9.879 -42.038 81 HA HIS 10 HA HIS 10 4.177 -11.682 -40.189 82 HB2 HIS 10 1HB HIS 10 5.762 -12.538 -41.987 83 HB3 HIS 10 2HB HIS 10 7.068 -11.828 -41.043 84 HD1 HIS 10 1HD HIS 10 8.213 -13.591 -39.763 85 HD2 HIS 10 2HD HIS 10 4.119 -14.264 -39.972 86 HE1 HIS 10 1HE HIS 10 7.808 -15.689 -38.437 87 HE2 HIS 10 2HE HIS 10 5.336 -16.123 -38.649 88 H LYS 11 H LYS 11 4.737 -11.881 -38.035 89 HA LYS 11 HA LYS 11 6.339 -9.659 -36.956 90 HB2 LYS 11 1HB LYS 11 5.041 -9.875 -34.907 91 HB3 LYS 11 2HB LYS 11 3.972 -9.644 -36.284 92 HG2 LYS 11 1HG LYS 11 3.838 -12.236 -36.286 93 HG3 LYS 11 2HG LYS 11 4.422 -12.086 -34.627 94 HD2 LYS 11 1HD LYS 11 2.101 -12.093 -34.395 95 HD3 LYS 11 2HD LYS 11 2.517 -10.379 -34.336 96 HE2 LYS 11 1HE LYS 11 1.936 -10.153 -36.698 97 HE3 LYS 11 2HE LYS 11 1.544 -11.870 -36.772 98 HZ1 LYS 11 1HZ LYS 11 0.038 -9.670 -35.595 99 HZ2 LYS 11 2HZ LYS 11 -0.017 -11.148 -34.775 100 HZ3 LYS 11 3HZ LYS 11 -0.515 -11.058 -36.389 101 H GLU 12 H GLU 12 8.126 -10.086 -35.815 102 HA GLU 12 HA GLU 12 9.100 -12.767 -35.657 103 HB2 GLU 12 1HB GLU 12 10.143 -10.102 -34.735 104 HB3 GLU 12 2HB GLU 12 10.962 -11.595 -34.298 105 HG2 GLU 12 1HG GLU 12 11.443 -12.105 -36.552 106 HG3 GLU 12 2HG GLU 12 10.347 -10.857 -37.142 107 H GLU 13 H GLU 13 8.593 -14.199 -34.151 108 HA GLU 13 HA GLU 13 7.010 -13.784 -31.941 109 HB2 GLU 13 1HB GLU 13 7.595 -16.001 -32.921 110 HB3 GLU 13 2HB GLU 13 9.178 -15.877 -32.166 111 HG2 GLU 13 1HG GLU 13 8.151 -15.854 -29.966 112 HG3 GLU 13 2HG GLU 13 6.550 -15.917 -30.699 113 H HIS 14 H HIS 14 7.363 -13.491 -29.741 114 HA HIS 14 HA HIS 14 10.084 -12.749 -28.921 115 HB2 HIS 14 1HB HIS 14 9.174 -10.818 -27.673 116 HB3 HIS 14 2HB HIS 14 8.931 -10.662 -29.410 117 HD1 HIS 14 1HD HIS 14 7.200 -10.075 -26.409 118 HD2 HIS 14 2HD HIS 14 6.137 -11.779 -30.046 119 HE1 HIS 14 1HE HIS 14 4.691 -9.942 -26.505 120 HE2 HIS 14 2HE HIS 14 4.065 -11.056 -28.676 121 H ALA 15 H ALA 15 10.206 -14.751 -27.840 122 HA ALA 15 HA ALA 15 9.260 -14.693 -25.155 123 HB1 ALA 15 1HB ALA 15 8.242 -17.189 -26.146 124 HB2 ALA 15 2HB ALA 15 7.414 -15.924 -25.237 125 HB3 ALA 15 3HB ALA 15 7.489 -15.839 -26.997 126 H HIS 16 H HIS 16 10.456 -16.008 -23.845 127 HA HIS 16 HA HIS 16 12.228 -17.972 -25.124 128 HB2 HIS 16 1HB HIS 16 13.208 -16.167 -22.923 129 HB3 HIS 16 2HB HIS 16 14.152 -17.175 -24.015 130 HD1 HIS 16 1HD HIS 16 12.914 -13.781 -23.577 131 HD2 HIS 16 2HD HIS 16 14.186 -16.140 -26.752 132 HE1 HIS 16 1HE HIS 16 13.396 -12.179 -25.455 133 HE2 HIS 16 2HE HIS 16 14.082 -13.636 -27.391 134 H ALA 17 H ALA 17 12.660 -19.794 -23.938 135 HA ALA 17 HA ALA 17 10.895 -20.897 -22.251 136 HB1 ALA 17 1HB ALA 17 12.569 -22.335 -22.931 137 HB2 ALA 17 2HB ALA 17 13.859 -21.241 -22.426 138 HB3 ALA 17 3HB ALA 17 12.934 -22.131 -21.217 139 H HIS 18 H HIS 18 9.947 -19.947 -20.556 140 HA HIS 18 HA HIS 18 11.434 -18.261 -18.740 141 HB2 HIS 18 1HB HIS 18 9.323 -17.785 -17.707 142 HB3 HIS 18 2HB HIS 18 9.070 -17.786 -19.449 143 HD1 HIS 18 1HD HIS 18 7.409 -18.827 -16.567 144 HD2 HIS 18 2HD HIS 18 8.230 -20.685 -20.191 145 HE1 HIS 18 1HE HIS 18 5.729 -20.688 -16.765 146 HE2 HIS 18 2HE HIS 18 6.300 -21.851 -18.925 147 H ASN 19 H ASN 19 12.747 -19.251 -17.341 148 HA ASN 19 HA ASN 19 11.663 -21.530 -15.818 149 HB2 ASN 19 1HB ASN 19 14.580 -21.083 -16.480 150 HB3 ASN 19 2HB ASN 19 13.871 -22.494 -15.699 151 HD21 ASN 19 1HD2 ASN 19 14.890 -21.179 -18.583 152 HD22 ASN 19 2HD2 ASN 19 14.151 -22.305 -19.666 153 H LYS 20 H LYS 20 12.575 -21.774 -13.639 154 HA LYS 20 HA LYS 20 13.054 -19.141 -12.427 155 HB2 LYS 20 1HB LYS 20 12.058 -21.709 -11.178 156 HB3 LYS 20 2HB LYS 20 12.297 -20.193 -10.319 157 HG2 LYS 20 1HG LYS 20 10.038 -20.155 -10.729 158 HG3 LYS 20 2HG LYS 20 10.665 -19.231 -12.096 159 HD2 LYS 20 1HD LYS 20 9.017 -20.797 -12.894 160 HD3 LYS 20 2HD LYS 20 10.611 -21.302 -13.460 161 HE2 LYS 20 1HE LYS 20 9.635 -22.411 -10.883 162 HE3 LYS 20 2HE LYS 20 8.889 -23.004 -12.366 163 HZ1 LYS 20 1HZ LYS 20 10.608 -24.391 -12.463 164 HZ2 LYS 20 2HZ LYS 20 11.489 -23.545 -11.293 165 HZ3 LYS 20 3HZ LYS 20 11.551 -23.061 -12.913 166 H ASP 21 H ASP 21 15.257 -18.935 -12.596 167 HA ASP 21 HA ASP 21 16.832 -20.860 -11.022 168 HB2 ASP 21 1HB ASP 21 18.469 -21.054 -12.616 169 HB3 ASP 21 2HB ASP 21 17.078 -20.810 -13.668 170 H TYR 22 H TYR 22 15.592 -18.177 -10.478 171 HA TYR 22 HA TYR 22 18.024 -16.632 -9.894 172 HB2 TYR 22 1HB TYR 22 16.234 -14.808 -9.381 173 HB3 TYR 22 2HB TYR 22 16.613 -15.196 -11.055 174 HD1 TYR 22 2HD TYR 22 15.067 -16.799 -12.290 175 HD2 TYR 22 1HD TYR 22 14.040 -15.004 -8.571 176 HE1 TYR 22 2HE TYR 22 12.694 -17.279 -12.720 177 HE2 TYR 22 1HE TYR 22 11.664 -15.480 -8.991 178 HH TYR 22 HH TYR 22 10.163 -16.039 -10.650 179 H ASP 23 H ASP 23 17.952 -15.380 -7.817 180 HA ASP 23 HA ASP 23 17.330 -17.204 -5.661 181 HB2 ASP 23 1HB ASP 23 18.451 -14.427 -5.345 182 HB3 ASP 23 2HB ASP 23 18.660 -15.819 -4.286 183 H ILE 24 H ILE 24 15.292 -17.269 -4.966 184 HA ILE 24 HA ILE 24 13.841 -14.725 -4.650 185 HB ILE 24 HB ILE 24 12.377 -17.313 -4.596 186 HG12 ILE 24 1HG1 ILE 24 12.198 -16.757 -7.228 187 HG13 ILE 24 2HG1 ILE 24 13.855 -16.241 -6.933 188 HG21 ILE 24 1HG2 ILE 24 11.081 -15.377 -4.201 189 HG22 ILE 24 2HG2 ILE 24 11.817 -14.519 -5.553 190 HG23 ILE 24 3HG2 ILE 24 10.726 -15.871 -5.856 191 HD11 ILE 24 1HD1 ILE 24 12.661 -18.967 -6.596 192 HD12 ILE 24 2HD1 ILE 24 14.012 -18.469 -7.615 193 HD13 ILE 24 3HD1 ILE 24 14.200 -18.519 -5.862 194 HA PRO 25 HA PRO 25 14.002 -15.360 -0.284 195 HB2 PRO 25 1HB PRO 25 12.037 -13.625 0.420 196 HB3 PRO 25 2HB PRO 25 13.641 -13.098 -0.104 197 HG2 PRO 25 1HG PRO 25 11.092 -13.249 -1.667 198 HG3 PRO 25 2HG PRO 25 12.318 -11.969 -1.648 199 HD2 PRO 25 1HD PRO 25 12.178 -13.823 -3.617 200 HD3 PRO 25 2HD PRO 25 13.714 -13.111 -3.083 201 H THR 26 H THR 26 13.230 -17.101 0.716 202 HA THR 26 HA THR 26 10.585 -18.118 0.098 203 HB THR 26 HB THR 26 11.197 -20.042 1.484 204 HG1 THR 26 1HG THR 26 12.690 -18.482 2.790 205 HG21 THR 26 1HG2 THR 26 12.649 -19.146 -0.844 206 HG22 THR 26 2HG2 THR 26 12.099 -20.768 -0.423 207 HG23 THR 26 3HG2 THR 26 13.657 -20.186 0.162 208 H THR 27 H THR 27 10.445 -15.659 1.375 209 HA THR 27 HA THR 27 10.034 -15.991 4.195 210 HB THR 27 HB THR 27 9.186 -13.706 4.173 211 HG1 THR 27 1HG THR 27 9.334 -13.983 1.338 212 HG21 THR 27 1HG2 THR 27 11.164 -12.593 3.034 213 HG22 THR 27 2HG2 THR 27 11.656 -14.208 2.524 214 HG23 THR 27 3HG2 THR 27 11.550 -13.819 4.241 215 H GLU 28 H GLU 28 7.944 -15.507 5.246 216 HA GLU 28 HA GLU 28 5.784 -16.901 3.844 217 HB2 GLU 28 1HB GLU 28 6.122 -16.222 6.770 218 HB3 GLU 28 2HB GLU 28 4.753 -17.092 6.092 219 HG2 GLU 28 1HG GLU 28 6.303 -18.855 5.324 220 HG3 GLU 28 2HG GLU 28 7.622 -17.999 6.122 221 H ASN 29 H ASN 29 6.304 -14.268 3.031 222 HA ASN 29 HA ASN 29 3.733 -13.053 3.648 223 HB2 ASN 29 1HB ASN 29 6.352 -11.579 4.011 224 HB3 ASN 29 2HB ASN 29 4.758 -10.831 4.056 225 HD21 ASN 29 1HD2 ASN 29 6.848 -13.172 5.633 226 HD22 ASN 29 2HD2 ASN 29 6.101 -13.067 7.188 227 H LEU 30 H LEU 30 2.810 -12.319 1.848 228 HA LEU 30 HA LEU 30 4.466 -12.066 -0.558 229 HB2 LEU 30 1HB LEU 30 1.613 -12.709 -0.033 230 HB3 LEU 30 2HB LEU 30 2.014 -11.913 -1.553 231 HG LEU 30 HG LEU 30 1.829 -14.415 -1.651 232 HD11 LEU 30 1HD1 LEU 30 4.149 -14.609 -2.827 233 HD12 LEU 30 2HD1 LEU 30 4.233 -12.875 -2.516 234 HD13 LEU 30 3HD1 LEU 30 2.911 -13.534 -3.479 235 HD21 LEU 30 1HD2 LEU 30 4.444 -14.319 -0.152 236 HD22 LEU 30 2HD2 LEU 30 3.640 -15.754 -0.790 237 HD23 LEU 30 3HD2 LEU 30 2.907 -14.846 0.534 238 H TYR 31 H TYR 31 3.850 -10.344 -2.117 239 HA TYR 31 HA TYR 31 2.961 -7.898 -0.738 240 HB2 TYR 31 1HB TYR 31 5.165 -8.085 -2.802 241 HB3 TYR 31 2HB TYR 31 4.615 -6.618 -1.999 242 HD1 TYR 31 1HD TYR 31 4.397 -7.444 0.792 243 HD2 TYR 31 2HD TYR 31 7.352 -8.431 -2.106 244 HE1 TYR 31 1HE TYR 31 6.032 -7.814 2.592 245 HE2 TYR 31 2HE TYR 31 8.994 -8.804 -0.314 246 HH TYR 31 HH TYR 31 8.068 -8.662 3.086 247 H PHE 32 H PHE 32 1.911 -6.328 -2.034 248 HA PHE 32 HA PHE 32 1.287 -6.911 -4.787 249 HB2 PHE 32 1HB PHE 32 -0.916 -6.970 -2.714 250 HB3 PHE 32 2HB PHE 32 -1.150 -7.026 -4.458 251 HD1 PHE 32 2HD PHE 32 0.101 -8.971 -5.686 252 HD2 PHE 32 1HD PHE 32 -0.828 -8.939 -1.533 253 HE1 PHE 32 2HE PHE 32 0.282 -11.424 -5.631 254 HE2 PHE 32 1HE PHE 32 -0.649 -11.393 -1.470 255 HZ PHE 32 HZ PHE 32 -0.094 -12.638 -3.521 256 H GLN 33 H GLN 33 1.328 -5.018 -5.784 257 HA GLN 33 HA GLN 33 0.481 -2.623 -4.290 258 HB2 GLN 33 1HB GLN 33 2.508 -2.823 -6.525 259 HB3 GLN 33 2HB GLN 33 2.030 -1.341 -5.707 260 HG2 GLN 33 1HG GLN 33 3.271 -3.681 -4.289 261 HG3 GLN 33 2HG GLN 33 4.202 -2.345 -4.965 262 HE21 GLN 33 1HE2 GLN 33 3.517 -0.152 -4.219 263 HE22 GLN 33 2HE2 GLN 33 3.083 0.019 -2.556 264 H GLY 34 H GLY 34 -0.959 -1.235 -5.210 265 HA2 GLY 34 1HA GLY 34 -1.658 -0.583 -7.667 266 HA3 GLY 34 2HA GLY 34 -2.314 -2.212 -7.610 267 H SER 35 H SER 35 -2.232 0.407 -5.201 268 HA SER 35 HA SER 35 -4.835 -0.116 -4.260 269 HB2 SER 35 1HB SER 35 -2.937 2.195 -3.951 270 HB3 SER 35 2HB SER 35 -4.571 2.283 -3.294 271 HG SER 35 HG SER 35 -3.188 -0.035 -2.712 272 H SER 36 H SER 36 -6.632 1.502 -4.282 273 HA SER 36 HA SER 36 -6.945 2.595 -6.999 274 HB2 SER 36 1HB SER 36 -8.483 0.712 -6.290 275 HB3 SER 36 2HB SER 36 -9.175 1.824 -5.110 276 HG SER 36 HG SER 36 -8.988 2.702 -7.748 277 H GLY 37 H GLY 37 -5.664 4.022 -4.859 278 HA2 GLY 37 1HA GLY 37 -6.253 6.544 -5.038 279 HA3 GLY 37 2HA GLY 37 -7.665 6.042 -4.119 280 H SER 38 H SER 38 -7.521 5.854 -1.952 281 HA SER 38 HA SER 38 -4.872 6.345 -0.763 282 HB2 SER 38 1HB SER 38 -7.643 7.165 0.072 283 HB3 SER 38 2HB SER 38 -6.328 7.105 1.246 284 HG SER 38 HG SER 38 -6.840 8.945 -0.687 285 H SER 39 H SER 39 -4.968 5.603 1.698 286 HA SER 39 HA SER 39 -4.940 2.797 1.669 287 HB2 SER 39 1HB SER 39 -4.752 4.872 3.823 288 HB3 SER 39 2HB SER 39 -4.916 3.174 4.270 289 HG SER 39 HG SER 39 -2.757 3.546 4.107 290 H GLY 40 H GLY 40 -7.470 5.064 2.317 291 HA2 GLY 40 1HA GLY 40 -9.164 3.399 3.861 292 HA3 GLY 40 2HA GLY 40 -9.668 4.806 2.937 293 H ASP 41 H ASP 41 -9.553 4.344 0.443 294 HA ASP 41 HA ASP 41 -11.592 2.759 -0.318 295 HB2 ASP 41 1HB ASP 41 -9.053 3.416 -1.800 296 HB3 ASP 41 2HB ASP 41 -10.360 2.511 -2.558 297 H MET 42 H MET 42 -8.228 1.700 0.026 298 HA MET 42 HA MET 42 -8.254 -0.817 -0.965 299 HB2 MET 42 1HB MET 42 -6.917 0.417 1.385 300 HB3 MET 42 2HB MET 42 -6.865 -1.336 1.264 301 HG2 MET 42 1HG MET 42 -6.145 0.240 -1.141 302 HG3 MET 42 2HG MET 42 -5.005 0.206 0.202 303 HE1 MET 42 1HE MET 42 -4.819 -2.068 -3.162 304 HE2 MET 42 2HE MET 42 -6.422 -2.670 -2.741 305 HE3 MET 42 3HE MET 42 -6.118 -0.933 -2.789 306 H MET 43 H MET 43 -8.927 -0.257 2.495 307 HA MET 43 HA MET 43 -9.889 -2.714 3.170 308 HB2 MET 43 1HB MET 43 -11.034 -0.085 4.129 309 HB3 MET 43 2HB MET 43 -11.155 -1.631 4.957 310 HG2 MET 43 1HG MET 43 -8.561 -0.230 4.365 311 HG3 MET 43 2HG MET 43 -9.442 -0.094 5.885 312 HE1 MET 43 1HE MET 43 -8.795 -1.743 7.941 313 HE2 MET 43 2HE MET 43 -10.282 -2.238 7.132 314 HE3 MET 43 3HE MET 43 -9.078 -3.446 7.583 315 H ARG 44 H ARG 44 -11.762 -0.051 1.752 316 HA ARG 44 HA ARG 44 -14.266 -1.289 1.776 317 HB2 ARG 44 1HB ARG 44 -13.029 0.881 0.126 318 HB3 ARG 44 2HB ARG 44 -14.607 0.249 -0.325 319 HG2 ARG 44 1HG ARG 44 -15.113 2.079 1.003 320 HG3 ARG 44 2HG ARG 44 -15.262 0.716 2.115 321 HD2 ARG 44 1HD ARG 44 -13.389 1.291 3.289 322 HD3 ARG 44 2HD ARG 44 -12.617 2.047 1.895 323 HE ARG 44 HE ARG 44 -14.687 3.701 2.416 324 HH11 ARG 44 2HH1 ARG 44 -12.148 2.368 4.390 325 HH12 ARG 44 1HH1 ARG 44 -12.094 3.726 5.465 326 HH21 ARG 44 2HH2 ARG 44 -14.625 5.494 3.825 327 HH22 ARG 44 1HH2 ARG 44 -13.503 5.503 5.144 328 H GLU 45 H GLU 45 -12.131 -0.923 -1.063 329 HA GLU 45 HA GLU 45 -13.463 -2.606 -2.783 330 HB2 GLU 45 1HB GLU 45 -11.322 -1.118 -3.100 331 HB3 GLU 45 2HB GLU 45 -10.470 -2.618 -2.762 332 HG2 GLU 45 1HG GLU 45 -10.653 -2.390 -5.120 333 HG3 GLU 45 2HG GLU 45 -11.736 -3.685 -4.615 334 H ILE 46 H ILE 46 -10.686 -3.513 -0.735 335 HA ILE 46 HA ILE 46 -10.436 -6.151 -1.259 336 HB ILE 46 HB ILE 46 -10.415 -4.943 1.509 337 HG12 ILE 46 1HG1 ILE 46 -8.012 -5.513 -0.205 338 HG13 ILE 46 2HG1 ILE 46 -8.894 -3.999 -0.370 339 HG21 ILE 46 1HG2 ILE 46 -8.599 -6.963 1.543 340 HG22 ILE 46 2HG2 ILE 46 -10.256 -7.093 2.131 341 HG23 ILE 46 3HG2 ILE 46 -9.853 -7.639 0.504 342 HD11 ILE 46 1HD1 ILE 46 -6.915 -4.725 1.539 343 HD12 ILE 46 2HD1 ILE 46 -7.720 -3.173 1.306 344 HD13 ILE 46 3HD1 ILE 46 -8.426 -4.380 2.380 345 H ARG 47 H ARG 47 -12.581 -4.940 1.326 346 HA ARG 47 HA ARG 47 -13.814 -7.201 2.124 347 HB2 ARG 47 1HB ARG 47 -14.961 -4.460 1.653 348 HB3 ARG 47 2HB ARG 47 -15.943 -5.759 2.319 349 HG2 ARG 47 1HG ARG 47 -14.335 -5.995 4.168 350 HG3 ARG 47 2HG ARG 47 -13.418 -4.636 3.513 351 HD2 ARG 47 1HD ARG 47 -15.164 -3.116 3.946 352 HD3 ARG 47 2HD ARG 47 -16.332 -4.411 4.206 353 HE ARG 47 HE ARG 47 -14.263 -4.614 6.104 354 HH11 ARG 47 2HH1 ARG 47 -16.996 -2.619 5.287 355 HH12 ARG 47 1HH1 ARG 47 -17.278 -2.110 6.919 356 HH21 ARG 47 2HH2 ARG 47 -14.623 -3.951 8.256 357 HH22 ARG 47 1HH2 ARG 47 -15.926 -2.867 8.607 358 H LYS 48 H LYS 48 -14.808 -5.286 -0.707 359 HA LYS 48 HA LYS 48 -16.933 -6.881 -1.533 360 HB2 LYS 48 1HB LYS 48 -16.655 -4.746 -2.543 361 HB3 LYS 48 2HB LYS 48 -15.026 -5.132 -3.081 362 HG2 LYS 48 1HG LYS 48 -16.251 -7.010 -4.436 363 HG3 LYS 48 2HG LYS 48 -17.648 -5.951 -4.226 364 HD2 LYS 48 1HD LYS 48 -16.789 -4.327 -5.569 365 HD3 LYS 48 2HD LYS 48 -15.120 -4.688 -5.122 366 HE2 LYS 48 1HE LYS 48 -14.909 -6.330 -6.703 367 HE3 LYS 48 2HE LYS 48 -16.628 -6.717 -6.689 368 HZ1 LYS 48 1HZ LYS 48 -16.953 -5.379 -8.406 369 HZ2 LYS 48 2HZ LYS 48 -15.281 -5.147 -8.521 370 HZ3 LYS 48 3HZ LYS 48 -16.223 -4.074 -7.614 371 H VAL 49 H VAL 49 -13.499 -7.071 -2.419 372 HA VAL 49 HA VAL 49 -13.644 -9.134 -4.273 373 HB VAL 49 HB VAL 49 -11.384 -8.834 -2.302 374 HG11 VAL 49 1HG1 VAL 49 -11.680 -10.686 -4.204 375 HG12 VAL 49 2HG1 VAL 49 -10.966 -9.399 -5.177 376 HG13 VAL 49 3HG1 VAL 49 -10.111 -10.014 -3.762 377 HG21 VAL 49 1HG2 VAL 49 -10.877 -6.818 -3.087 378 HG22 VAL 49 2HG2 VAL 49 -10.955 -7.397 -4.751 379 HG23 VAL 49 3HG2 VAL 49 -12.414 -6.811 -3.952 380 H LEU 50 H LEU 50 -12.877 -9.428 -0.799 381 HA LEU 50 HA LEU 50 -12.743 -12.164 -0.603 382 HB2 LEU 50 1HB LEU 50 -14.064 -10.435 1.473 383 HB3 LEU 50 2HB LEU 50 -13.173 -11.936 1.721 384 HG LEU 50 HG LEU 50 -11.988 -9.291 0.880 385 HD11 LEU 50 1HD1 LEU 50 -11.750 -10.795 3.481 386 HD12 LEU 50 2HD1 LEU 50 -12.750 -9.366 3.222 387 HD13 LEU 50 3HD1 LEU 50 -10.995 -9.252 3.082 388 HD21 LEU 50 1HD2 LEU 50 -10.210 -10.430 0.206 389 HD22 LEU 50 2HD2 LEU 50 -11.020 -11.951 0.583 390 HD23 LEU 50 3HD2 LEU 50 -10.055 -11.136 1.815 391 H GLY 51 H GLY 51 -15.663 -10.170 -0.109 392 HA2 GLY 51 1HA GLY 51 -17.471 -12.242 0.316 393 HA3 GLY 51 2HA GLY 51 -17.888 -10.673 -0.356 394 H ALA 52 H ALA 52 -16.231 -10.940 -2.707 395 HA ALA 52 HA ALA 52 -18.075 -12.144 -4.448 396 HB1 ALA 52 1HB ALA 52 -16.331 -11.835 -6.178 397 HB2 ALA 52 2HB ALA 52 -16.619 -10.385 -5.215 398 HB3 ALA 52 3HB ALA 52 -15.195 -11.379 -4.908 399 H ASN 53 H ASN 53 -15.010 -13.308 -3.115 400 HA ASN 53 HA ASN 53 -15.317 -15.858 -4.492 401 HB2 ASN 53 1HB ASN 53 -13.118 -14.545 -2.940 402 HB3 ASN 53 2HB ASN 53 -13.108 -16.296 -3.131 403 HD21 ASN 53 1HD2 ASN 53 -13.167 -13.248 -4.882 404 HD22 ASN 53 2HD2 ASN 53 -12.423 -13.849 -6.321 405 H ASN 54 H ASN 54 -17.275 -15.176 -2.517 406 HA ASN 54 HA ASN 54 -18.280 -15.945 -0.611 407 HB2 ASN 54 1HB ASN 54 -16.995 -18.469 -1.672 408 HB3 ASN 54 2HB ASN 54 -18.216 -18.444 -0.404 409 HD21 ASN 54 1HD2 ASN 54 -20.335 -17.922 -0.918 410 HD22 ASN 54 2HD2 ASN 54 -20.913 -17.920 -2.546 411 H CYS 55 H CYS 55 -15.938 -14.672 0.033 412 HA CYS 55 HA CYS 55 -14.735 -16.392 2.097 413 HB2 CYS 55 1HB CYS 55 -13.649 -13.910 0.753 414 HB3 CYS 55 2HB CYS 55 -12.859 -14.742 2.086 415 HG CYS 55 HG CYS 55 -13.190 -15.735 -1.144 416 H ASP 56 H ASP 56 -14.243 -15.407 4.162 417 HA ASP 56 HA ASP 56 -16.188 -13.309 4.863 418 HB2 ASP 56 1HB ASP 56 -16.580 -15.508 5.934 419 HB3 ASP 56 2HB ASP 56 -14.977 -15.423 6.658 420 H TYR 57 H TYR 57 -15.570 -11.763 6.488 421 HA TYR 57 HA TYR 57 -12.700 -11.488 6.976 422 HB2 TYR 57 1HB TYR 57 -13.026 -8.974 6.411 423 HB3 TYR 57 2HB TYR 57 -12.797 -10.118 5.093 424 HD1 TYR 57 2HD TYR 57 -14.908 -11.000 3.922 425 HD2 TYR 57 1HD TYR 57 -14.897 -7.576 6.449 426 HE1 TYR 57 2HE TYR 57 -17.009 -10.241 2.893 427 HE2 TYR 57 1HE TYR 57 -16.999 -6.809 5.428 428 HH TYR 57 HH TYR 57 -18.333 -7.092 3.526 429 H GLU 58 H GLU 58 -12.188 -10.482 8.879 430 HA GLU 58 HA GLU 58 -14.424 -9.439 10.485 431 HB2 GLU 58 1HB GLU 58 -13.900 -11.679 11.279 432 HB3 GLU 58 2HB GLU 58 -12.199 -11.257 11.423 433 HG2 GLU 58 1HG GLU 58 -12.869 -11.057 13.592 434 HG3 GLU 58 2HG GLU 58 -13.103 -9.403 13.028 435 H GLN 59 H GLN 59 -14.008 -7.310 10.510 436 HA GLN 59 HA GLN 59 -11.426 -6.166 10.436 437 HB2 GLN 59 1HB GLN 59 -13.829 -5.171 9.931 438 HB3 GLN 59 2HB GLN 59 -13.719 -4.661 11.611 439 HG2 GLN 59 1HG GLN 59 -11.355 -3.786 10.798 440 HG3 GLN 59 2HG GLN 59 -12.187 -3.754 9.244 441 HE21 GLN 59 1HE2 GLN 59 -11.186 -1.561 10.902 442 HE22 GLN 59 2HE2 GLN 59 -12.545 -0.540 11.207 443 H ARG 60 H ARG 60 -9.957 -6.241 11.992 444 HA ARG 60 HA ARG 60 -10.794 -6.571 14.768 445 HB2 ARG 60 1HB ARG 60 -8.050 -6.681 13.501 446 HB3 ARG 60 2HB ARG 60 -8.395 -7.001 15.196 447 HG2 ARG 60 1HG ARG 60 -9.644 -8.573 12.963 448 HG3 ARG 60 2HG ARG 60 -8.106 -9.015 13.707 449 HD2 ARG 60 1HD ARG 60 -9.181 -9.207 15.874 450 HD3 ARG 60 2HD ARG 60 -10.714 -8.678 15.183 451 HE ARG 60 HE ARG 60 -9.788 -10.951 13.801 452 HH11 ARG 60 2HH1 ARG 60 -11.123 -10.009 16.876 453 HH12 ARG 60 1HH1 ARG 60 -11.855 -11.550 17.177 454 HH21 ARG 60 2HH2 ARG 60 -10.747 -12.984 14.187 455 HH22 ARG 60 1HH2 ARG 60 -11.640 -13.242 15.647 456 H GLU 61 H GLU 61 -8.747 -4.420 12.813 457 HA GLU 61 HA GLU 61 -9.065 -2.374 14.909 458 HB2 GLU 61 1HB GLU 61 -6.653 -2.799 13.135 459 HB3 GLU 61 2HB GLU 61 -6.840 -1.517 14.323 460 HG2 GLU 61 1HG GLU 61 -7.118 -4.323 15.245 461 HG3 GLU 61 2HG GLU 61 -5.506 -3.728 14.852 462 H ARG 62 H ARG 62 -8.165 -0.167 13.743 463 HA ARG 62 HA ARG 62 -10.236 0.623 12.039 464 HB2 ARG 62 1HB ARG 62 -9.080 2.273 13.334 465 HB3 ARG 62 2HB ARG 62 -7.540 1.859 12.593 466 HG2 ARG 62 1HG ARG 62 -7.985 3.018 10.682 467 HG3 ARG 62 2HG ARG 62 -9.731 2.800 10.826 468 HD2 ARG 62 1HD ARG 62 -8.317 4.441 12.870 469 HD3 ARG 62 2HD ARG 62 -8.599 5.137 11.275 470 HE ARG 62 HE ARG 62 -11.033 4.206 11.939 471 HH11 ARG 62 2HH1 ARG 62 -8.729 6.185 13.640 472 HH12 ARG 62 1HH1 ARG 62 -9.935 7.054 14.530 473 HH21 ARG 62 2HH2 ARG 62 -12.631 5.343 13.104 474 HH22 ARG 62 1HH2 ARG 62 -12.154 6.573 14.225 475 H PHE 63 H PHE 63 -6.792 0.131 11.242 476 HA PHE 63 HA PHE 63 -7.576 -0.189 8.426 477 HB2 PHE 63 1HB PHE 63 -4.885 0.494 9.628 478 HB3 PHE 63 2HB PHE 63 -5.198 0.290 7.908 479 HD1 PHE 63 2HD PHE 63 -7.025 1.817 6.888 480 HD2 PHE 63 1HD PHE 63 -5.065 2.584 10.587 481 HE1 PHE 63 2HE PHE 63 -7.641 4.193 6.717 482 HE2 PHE 63 1HE PHE 63 -5.678 4.962 10.423 483 HZ PHE 63 HZ PHE 63 -6.967 5.769 8.486 484 H LEU 64 H LEU 64 -8.106 -2.362 9.943 485 HA LEU 64 HA LEU 64 -6.185 -4.297 8.903 486 HB2 LEU 64 1HB LEU 64 -5.453 -3.905 11.181 487 HB3 LEU 64 2HB LEU 64 -7.084 -4.201 11.779 488 HG LEU 64 HG LEU 64 -6.895 -6.550 11.032 489 HD11 LEU 64 1HD1 LEU 64 -3.972 -6.028 10.595 490 HD12 LEU 64 2HD1 LEU 64 -5.140 -5.974 9.275 491 HD13 LEU 64 3HD1 LEU 64 -4.911 -7.464 10.189 492 HD21 LEU 64 1HD2 LEU 64 -4.498 -6.256 12.706 493 HD22 LEU 64 2HD2 LEU 64 -5.989 -7.153 12.999 494 HD23 LEU 64 3HD2 LEU 64 -5.932 -5.415 13.295 495 H LEU 65 H LEU 65 -7.058 -6.326 8.467 496 HA LEU 65 HA LEU 65 -9.819 -6.879 9.158 497 HB2 LEU 65 1HB LEU 65 -8.910 -6.147 6.426 498 HB3 LEU 65 2HB LEU 65 -10.101 -7.436 6.582 499 HG LEU 65 HG LEU 65 -10.548 -4.757 7.855 500 HD11 LEU 65 1HD1 LEU 65 -11.999 -4.939 5.435 501 HD12 LEU 65 2HD1 LEU 65 -10.302 -5.240 5.062 502 HD13 LEU 65 3HD1 LEU 65 -10.772 -3.757 5.892 503 HD21 LEU 65 1HD2 LEU 65 -12.941 -5.702 7.025 504 HD22 LEU 65 2HD2 LEU 65 -12.255 -6.007 8.621 505 HD23 LEU 65 3HD2 LEU 65 -12.086 -7.212 7.343 506 H PHE 66 H PHE 66 -9.998 -8.964 9.629 507 HA PHE 66 HA PHE 66 -7.834 -10.773 9.029 508 HB2 PHE 66 1HB PHE 66 -9.014 -10.769 11.225 509 HB3 PHE 66 2HB PHE 66 -10.464 -11.346 10.409 510 HD1 PHE 66 2HD PHE 66 -6.929 -12.211 11.120 511 HD2 PHE 66 1HD PHE 66 -10.797 -13.623 10.043 512 HE1 PHE 66 2HE PHE 66 -6.157 -14.529 11.402 513 HE2 PHE 66 1HE PHE 66 -10.032 -15.944 10.325 514 HZ PHE 66 HZ PHE 66 -7.709 -16.400 11.004 515 H CYS 67 H CYS 67 -7.765 -11.380 6.934 516 HA CYS 67 HA CYS 67 -10.175 -12.050 5.484 517 HB2 CYS 67 1HB CYS 67 -7.276 -12.299 4.653 518 HB3 CYS 67 2HB CYS 67 -8.670 -12.455 3.591 519 HG CYS 67 HG CYS 67 -9.118 -9.603 4.943 520 H VAL 68 H VAL 68 -10.928 -14.044 5.015 521 HA VAL 68 HA VAL 68 -9.294 -16.397 5.465 522 HB VAL 68 HB VAL 68 -10.194 -16.009 7.698 523 HG11 VAL 68 1HG1 VAL 68 -12.189 -15.065 7.944 524 HG12 VAL 68 2HG1 VAL 68 -12.557 -15.305 6.235 525 HG13 VAL 68 3HG1 VAL 68 -12.931 -16.571 7.406 526 HG21 VAL 68 1HG2 VAL 68 -11.718 -18.294 6.472 527 HG22 VAL 68 2HG2 VAL 68 -9.970 -18.330 6.705 528 HG23 VAL 68 3HG2 VAL 68 -11.043 -18.178 8.097 529 H HIS 69 H HIS 69 -9.819 -18.000 4.097 530 HA HIS 69 HA HIS 69 -12.155 -17.596 2.379 531 HB2 HIS 69 1HB HIS 69 -10.140 -17.857 1.132 532 HB3 HIS 69 2HB HIS 69 -9.657 -19.262 2.076 533 HD1 HIS 69 1HD HIS 69 -9.972 -21.374 0.851 534 HD2 HIS 69 2HD HIS 69 -12.764 -18.514 -0.284 535 HE1 HIS 69 1HE HIS 69 -11.368 -22.468 -0.932 536 HE2 HIS 69 2HE HIS 69 -12.996 -20.690 -1.663 537 H GLY 70 H GLY 70 -13.947 -18.705 2.770 538 HA2 GLY 70 1HA GLY 70 -13.693 -21.339 4.089 539 HA3 GLY 70 2HA GLY 70 -15.000 -20.217 4.436 540 H ASP 71 H ASP 71 -14.607 -23.042 3.131 541 HA ASP 71 HA ASP 71 -16.582 -22.559 1.006 542 HB2 ASP 71 1HB ASP 71 -14.214 -23.076 0.167 543 HB3 ASP 71 2HB ASP 71 -14.474 -24.701 0.795 544 H GLY 72 H GLY 72 -15.262 -24.735 3.432 545 HA2 GLY 72 1HA GLY 72 -17.421 -25.704 4.607 546 HA3 GLY 72 2HA GLY 72 -17.495 -26.587 3.090 547 H HIS 73 H HIS 73 -14.475 -26.602 3.026 548 HA HIS 73 HA HIS 73 -14.046 -28.664 5.086 549 HB2 HIS 73 1HB HIS 73 -13.190 -28.689 2.189 550 HB3 HIS 73 2HB HIS 73 -12.553 -29.801 3.398 551 HD1 HIS 73 1HD HIS 73 -13.567 -31.970 2.701 552 HD2 HIS 73 2HD HIS 73 -16.369 -28.908 2.883 553 HE1 HIS 73 1HE HIS 73 -15.796 -33.076 2.334 554 HE2 HIS 73 2HE HIS 73 -17.467 -31.191 2.363 555 H ALA 74 H ALA 74 -12.509 -28.088 6.459 556 HA ALA 74 HA ALA 74 -10.952 -25.882 6.469 557 HB1 ALA 74 1HB ALA 74 -11.080 -28.218 7.981 558 HB2 ALA 74 2HB ALA 74 -9.388 -28.075 7.500 559 HB3 ALA 74 3HB ALA 74 -10.175 -26.752 8.361 560 H GLU 75 H GLU 75 -10.246 -28.895 4.787 561 HA GLU 75 HA GLU 75 -7.624 -28.632 4.101 562 HB2 GLU 75 1HB GLU 75 -9.863 -29.504 2.267 563 HB3 GLU 75 2HB GLU 75 -8.155 -29.831 2.010 564 HG2 GLU 75 1HG GLU 75 -9.612 -30.743 4.468 565 HG3 GLU 75 2HG GLU 75 -9.552 -31.700 2.989 566 H ASN 76 H ASN 76 -10.373 -27.060 2.501 567 HA ASN 76 HA ASN 76 -8.579 -25.557 0.774 568 HB2 ASN 76 1HB ASN 76 -10.834 -24.564 -0.016 569 HB3 ASN 76 2HB ASN 76 -10.485 -26.247 -0.398 570 HD21 ASN 76 1HD2 ASN 76 -11.951 -24.310 2.187 571 HD22 ASN 76 2HD2 ASN 76 -13.270 -25.387 2.477 572 H LEU 77 H LEU 77 -10.188 -25.198 3.766 573 HA LEU 77 HA LEU 77 -10.588 -22.412 3.818 574 HB2 LEU 77 1HB LEU 77 -11.468 -24.166 5.430 575 HB3 LEU 77 2HB LEU 77 -9.884 -24.106 6.200 576 HG LEU 77 HG LEU 77 -10.461 -21.515 6.317 577 HD11 LEU 77 1HD1 LEU 77 -13.125 -22.070 7.066 578 HD12 LEU 77 2HD1 LEU 77 -12.903 -22.685 5.429 579 HD13 LEU 77 3HD1 LEU 77 -12.549 -20.996 5.791 580 HD21 LEU 77 1HD2 LEU 77 -11.198 -23.775 8.128 581 HD22 LEU 77 2HD2 LEU 77 -11.631 -22.121 8.563 582 HD23 LEU 77 3HD2 LEU 77 -9.939 -22.553 8.310 583 H VAL 78 H VAL 78 -9.304 -20.721 4.410 584 HA VAL 78 HA VAL 78 -6.622 -21.195 5.416 585 HB VAL 78 HB VAL 78 -7.084 -19.820 2.766 586 HG11 VAL 78 1HG1 VAL 78 -5.415 -18.544 3.761 587 HG12 VAL 78 2HG1 VAL 78 -4.706 -19.934 4.585 588 HG13 VAL 78 3HG1 VAL 78 -4.506 -19.744 2.843 589 HG21 VAL 78 1HG2 VAL 78 -7.056 -22.132 2.365 590 HG22 VAL 78 2HG2 VAL 78 -5.408 -21.601 2.029 591 HG23 VAL 78 3HG2 VAL 78 -5.780 -22.410 3.551 592 H GLN 79 H GLN 79 -6.037 -19.637 6.794 593 HA GLN 79 HA GLN 79 -7.607 -17.145 6.792 594 HB2 GLN 79 1HB GLN 79 -6.236 -18.549 9.092 595 HB3 GLN 79 2HB GLN 79 -7.069 -17.004 9.208 596 HG2 GLN 79 1HG GLN 79 -9.152 -17.952 8.982 597 HG3 GLN 79 2HG GLN 79 -8.528 -19.382 8.161 598 HE21 GLN 79 1HE2 GLN 79 -9.453 -20.876 9.486 599 HE22 GLN 79 2HE2 GLN 79 -9.015 -21.086 11.144 600 H TRP 80 H TRP 80 -6.584 -15.221 6.712 601 HA TRP 80 HA TRP 80 -3.758 -14.996 7.276 602 HB2 TRP 80 1HB TRP 80 -3.031 -14.337 5.120 603 HB3 TRP 80 2HB TRP 80 -3.969 -15.807 4.870 604 HD1 TRP 80 HD TRP 80 -3.925 -12.112 4.033 605 HE1 TRP 80 1HE TRP 80 -5.811 -11.603 2.357 606 HE3 TRP 80 3HE TRP 80 -6.378 -16.595 4.185 607 HZ2 TRP 80 2HZ TRP 80 -8.043 -12.927 1.247 608 HZ3 TRP 80 3HZ TRP 80 -8.380 -16.892 2.787 609 HH2 TRP 80 HH TRP 80 -9.194 -15.094 1.349 610 H GLU 81 H GLU 81 -3.289 -13.029 8.058 611 HA GLU 81 HA GLU 81 -5.416 -11.079 8.230 612 HB2 GLU 81 1HB GLU 81 -2.765 -11.476 9.521 613 HB3 GLU 81 2HB GLU 81 -3.398 -9.838 9.460 614 HG2 GLU 81 1HG GLU 81 -5.422 -10.564 10.602 615 HG3 GLU 81 2HG GLU 81 -4.811 -12.217 10.646 616 H MET 82 H MET 82 -5.731 -9.592 6.724 617 HA MET 82 HA MET 82 -3.432 -8.686 5.127 618 HB2 MET 82 1HB MET 82 -5.662 -9.776 4.154 619 HB3 MET 82 2HB MET 82 -6.223 -8.113 4.267 620 HG2 MET 82 1HG MET 82 -3.599 -8.595 2.978 621 HG3 MET 82 2HG MET 82 -5.050 -9.073 2.099 622 HE1 MET 82 1HE MET 82 -5.766 -7.970 0.524 623 HE2 MET 82 2HE MET 82 -6.315 -6.294 0.477 624 HE3 MET 82 3HE MET 82 -4.670 -6.698 -0.017 625 H GLU 83 H GLU 83 -2.637 -6.924 6.131 626 HA GLU 83 HA GLU 83 -4.533 -4.828 6.951 627 HB2 GLU 83 1HB GLU 83 -3.225 -5.476 8.819 628 HB3 GLU 83 2HB GLU 83 -1.743 -5.491 7.873 629 HG2 GLU 83 1HG GLU 83 -1.572 -3.180 7.864 630 HG3 GLU 83 2HG GLU 83 -3.276 -2.954 8.251 631 H VAL 84 H VAL 84 -4.075 -2.641 6.436 632 HA VAL 84 HA VAL 84 -2.550 -2.356 3.947 633 HB VAL 84 HB VAL 84 -4.580 -0.481 5.170 634 HG11 VAL 84 1HG1 VAL 84 -3.424 -0.429 2.390 635 HG12 VAL 84 2HG1 VAL 84 -4.468 0.774 3.152 636 HG13 VAL 84 3HG1 VAL 84 -2.812 0.555 3.719 637 HG21 VAL 84 1HG2 VAL 84 -5.885 -2.246 4.486 638 HG22 VAL 84 2HG2 VAL 84 -5.828 -1.283 3.009 639 HG23 VAL 84 3HG2 VAL 84 -4.786 -2.695 3.182 640 H CYS 85 H CYS 85 -0.649 -1.364 3.949 641 HA CYS 85 HA CYS 85 -0.068 0.586 6.073 642 HB2 CYS 85 1HB CYS 85 1.476 -1.829 5.266 643 HB3 CYS 85 2HB CYS 85 2.389 -0.386 5.689 644 HG CYS 85 HG CYS 85 0.007 -1.576 7.811 645 H LYS 86 H LYS 86 2.191 1.671 5.428 646 HA LYS 86 HA LYS 86 2.057 2.371 2.571 647 HB2 LYS 86 1HB LYS 86 2.346 4.693 3.064 648 HB3 LYS 86 2HB LYS 86 1.005 4.112 4.043 649 HG2 LYS 86 1HG LYS 86 3.756 4.169 5.195 650 HG3 LYS 86 2HG LYS 86 2.815 5.658 5.086 651 HD2 LYS 86 1HD LYS 86 0.948 4.119 6.167 652 HD3 LYS 86 2HD LYS 86 2.360 3.232 6.745 653 HE2 LYS 86 1HE LYS 86 1.833 4.798 8.434 654 HE3 LYS 86 2HE LYS 86 3.241 5.443 7.593 655 HZ1 LYS 86 1HZ LYS 86 0.974 6.812 8.091 656 HZ2 LYS 86 2HZ LYS 86 0.724 6.312 6.495 657 HZ3 LYS 86 3HZ LYS 86 2.099 7.213 6.893 658 H LEU 87 H LEU 87 4.060 3.387 1.755 659 HA LEU 87 HA LEU 87 6.450 2.604 3.274 660 HB2 LEU 87 1HB LEU 87 5.885 2.035 0.370 661 HB3 LEU 87 2HB LEU 87 7.474 1.873 1.116 662 HG LEU 87 HG LEU 87 5.188 0.357 2.282 663 HD11 LEU 87 1HD1 LEU 87 4.737 -0.549 0.279 664 HD12 LEU 87 2HD1 LEU 87 6.226 -1.452 0.553 665 HD13 LEU 87 3HD1 LEU 87 6.251 0.010 -0.432 666 HD21 LEU 87 1HD2 LEU 87 7.793 -0.901 1.850 667 HD22 LEU 87 2HD2 LEU 87 6.805 -0.805 3.307 668 HD23 LEU 87 3HD2 LEU 87 7.849 0.544 2.858 669 HA PRO 88 HA PRO 88 7.668 6.745 2.312 670 HB2 PRO 88 1HB PRO 88 10.259 6.536 3.097 671 HB3 PRO 88 2HB PRO 88 8.915 6.652 4.240 672 HG2 PRO 88 1HG PRO 88 10.410 4.230 3.312 673 HG3 PRO 88 2HG PRO 88 9.880 4.659 4.949 674 HD2 PRO 88 1HD PRO 88 8.537 2.890 3.400 675 HD3 PRO 88 2HD PRO 88 7.722 3.943 4.574 676 H ARG 89 H ARG 89 9.942 4.144 1.416 677 HA ARG 89 HA ARG 89 11.136 5.644 -0.692 678 HB2 ARG 89 1HB ARG 89 11.305 2.848 0.314 679 HB3 ARG 89 2HB ARG 89 11.840 3.150 -1.334 680 HG2 ARG 89 1HG ARG 89 13.482 4.716 -0.589 681 HG3 ARG 89 2HG ARG 89 12.854 4.664 1.059 682 HD2 ARG 89 1HD ARG 89 14.840 3.320 0.950 683 HD3 ARG 89 2HD ARG 89 13.449 2.256 1.151 684 HE ARG 89 HE ARG 89 13.767 2.285 -1.517 685 HH11 ARG 89 2HH1 ARG 89 15.998 1.765 1.105 686 HH12 ARG 89 1HH1 ARG 89 17.024 0.706 0.195 687 HH21 ARG 89 2HH2 ARG 89 15.109 0.892 -2.725 688 HH22 ARG 89 1HH2 ARG 89 16.517 0.211 -1.984 689 H LEU 90 H LEU 90 9.031 2.761 -0.757 690 HA LEU 90 HA LEU 90 8.609 2.698 -3.505 691 HB2 LEU 90 1HB LEU 90 7.145 1.670 -1.132 692 HB3 LEU 90 2HB LEU 90 6.313 1.656 -2.686 693 HG LEU 90 HG LEU 90 8.567 0.449 -3.434 694 HD11 LEU 90 1HD1 LEU 90 8.379 -0.925 -0.860 695 HD12 LEU 90 2HD1 LEU 90 9.064 0.697 -0.763 696 HD13 LEU 90 3HD1 LEU 90 9.794 -0.506 -1.826 697 HD21 LEU 90 1HD2 LEU 90 7.076 -1.608 -2.221 698 HD22 LEU 90 2HD2 LEU 90 7.001 -1.053 -3.894 699 HD23 LEU 90 3HD2 LEU 90 5.927 -0.352 -2.681 700 H SER 91 H SER 91 7.293 4.793 -1.098 701 HA SER 91 HA SER 91 5.771 6.488 -1.156 702 HB2 SER 91 1HB SER 91 6.679 6.536 -4.043 703 HB3 SER 91 2HB SER 91 5.729 7.809 -3.277 704 HG SER 91 HG SER 91 8.195 7.906 -3.348 705 H LEU 92 H LEU 92 4.672 3.904 -1.429 706 HA LEU 92 HA LEU 92 2.126 4.597 -2.607 707 HB2 LEU 92 1HB LEU 92 3.968 2.606 -3.803 708 HB3 LEU 92 2HB LEU 92 2.260 2.179 -3.724 709 HG LEU 92 HG LEU 92 3.384 4.625 -5.088 710 HD11 LEU 92 1HD1 LEU 92 2.827 3.486 -7.163 711 HD12 LEU 92 2HD1 LEU 92 2.306 2.065 -6.258 712 HD13 LEU 92 3HD1 LEU 92 4.000 2.553 -6.232 713 HD21 LEU 92 1HD2 LEU 92 0.739 3.833 -5.877 714 HD22 LEU 92 2HD2 LEU 92 1.302 5.380 -5.243 715 HD23 LEU 92 3HD2 LEU 92 0.802 4.101 -4.135 716 H ASN 93 H ASN 93 0.571 2.638 -2.336 717 HA ASN 93 HA ASN 93 0.522 1.991 0.421 718 HB2 ASN 93 1HB ASN 93 -1.122 1.068 -1.933 719 HB3 ASN 93 2HB ASN 93 -1.413 0.482 -0.298 720 HD21 ASN 93 1HD2 ASN 93 -1.204 2.578 1.279 721 HD22 ASN 93 2HD2 ASN 93 -2.326 3.821 0.850 722 H GLY 94 H GLY 94 0.872 0.059 1.488 723 HA2 GLY 94 1HA GLY 94 2.316 -1.991 -0.077 724 HA3 GLY 94 2HA GLY 94 2.737 -1.557 1.574 725 H VAL 95 H VAL 95 0.896 -3.600 -0.409 726 HA VAL 95 HA VAL 95 -0.828 -4.452 1.803 727 HB VAL 95 HB VAL 95 -0.882 -5.366 -1.075 728 HG11 VAL 95 1HG1 VAL 95 -3.198 -5.563 0.782 729 HG12 VAL 95 2HG1 VAL 95 -2.757 -6.584 -0.588 730 HG13 VAL 95 3HG1 VAL 95 -1.890 -6.735 0.941 731 HG21 VAL 95 1HG2 VAL 95 -1.952 -3.495 -1.608 732 HG22 VAL 95 2HG2 VAL 95 -3.145 -3.792 -0.344 733 HG23 VAL 95 3HG2 VAL 95 -1.678 -2.886 0.025 734 H ARG 96 H ARG 96 -0.073 -6.000 3.078 735 HA ARG 96 HA ARG 96 1.673 -8.064 1.908 736 HB2 ARG 96 1HB ARG 96 1.684 -6.680 4.550 737 HB3 ARG 96 2HB ARG 96 2.223 -8.352 4.487 738 HG2 ARG 96 1HG ARG 96 3.961 -7.806 2.940 739 HG3 ARG 96 2HG ARG 96 3.347 -6.161 2.760 740 HD2 ARG 96 1HD ARG 96 4.094 -7.143 5.474 741 HD3 ARG 96 2HD ARG 96 5.372 -6.684 4.349 742 HE ARG 96 HE ARG 96 3.698 -4.566 4.267 743 HH11 ARG 96 2HH1 ARG 96 5.217 -6.304 6.873 744 HH12 ARG 96 1HH1 ARG 96 5.306 -4.924 7.916 745 HH21 ARG 96 2HH2 ARG 96 3.808 -2.741 5.631 746 HH22 ARG 96 1HH2 ARG 96 4.503 -2.898 7.209 747 H PHE 97 H PHE 97 1.341 -10.225 2.469 748 HA PHE 97 HA PHE 97 -1.299 -10.789 3.649 749 HB2 PHE 97 1HB PHE 97 0.206 -12.094 1.402 750 HB3 PHE 97 2HB PHE 97 -1.007 -12.998 2.303 751 HD1 PHE 97 1HD PHE 97 -0.788 -9.533 0.927 752 HD2 PHE 97 2HD PHE 97 -2.984 -13.171 1.169 753 HE1 PHE 97 1HE PHE 97 -2.554 -8.556 -0.481 754 HE2 PHE 97 2HE PHE 97 -4.753 -12.200 -0.240 755 HZ PHE 97 HZ PHE 97 -4.539 -9.891 -1.067 756 H LYS 98 H LYS 98 -1.059 -11.473 5.672 757 HA LYS 98 HA LYS 98 1.287 -13.061 6.400 758 HB2 LYS 98 1HB LYS 98 0.884 -11.233 7.883 759 HB3 LYS 98 2HB LYS 98 -0.819 -11.647 8.035 760 HG2 LYS 98 1HG LYS 98 0.235 -12.315 10.041 761 HG3 LYS 98 2HG LYS 98 -0.100 -13.788 9.128 762 HD2 LYS 98 1HD LYS 98 2.295 -13.540 8.234 763 HD3 LYS 98 2HD LYS 98 2.527 -12.399 9.561 764 HE2 LYS 98 1HE LYS 98 1.332 -15.053 10.173 765 HE3 LYS 98 2HE LYS 98 3.059 -14.976 9.829 766 HZ1 LYS 98 1HZ LYS 98 2.225 -12.938 11.650 767 HZ2 LYS 98 2HZ LYS 98 3.460 -14.081 11.809 768 HZ3 LYS 98 3HZ LYS 98 1.874 -14.486 12.237 769 H ARG 99 H ARG 99 1.185 -15.194 6.612 770 HA ARG 99 HA ARG 99 -1.363 -16.543 6.360 771 HB2 ARG 99 1HB ARG 99 0.649 -17.324 5.137 772 HB3 ARG 99 2HB ARG 99 1.411 -17.703 6.676 773 HG2 ARG 99 1HG ARG 99 0.050 -19.519 7.059 774 HG3 ARG 99 2HG ARG 99 -1.231 -18.912 6.008 775 HD2 ARG 99 1HD ARG 99 -0.379 -20.553 4.670 776 HD3 ARG 99 2HD ARG 99 0.628 -19.199 4.159 777 HE ARG 99 HE ARG 99 1.460 -21.522 5.672 778 HH11 ARG 99 2HH1 ARG 99 2.216 -18.281 4.647 779 HH12 ARG 99 1HH1 ARG 99 3.921 -18.460 4.898 780 HH21 ARG 99 2HH2 ARG 99 3.703 -21.769 6.006 781 HH22 ARG 99 1HH2 ARG 99 4.766 -20.445 5.670 782 H ILE 100 H ILE 100 -2.445 -17.615 7.922 783 HA ILE 100 HA ILE 100 -1.228 -17.682 10.607 784 HB ILE 100 HB ILE 100 -4.082 -17.114 9.827 785 HG12 ILE 100 1HG1 ILE 100 -3.435 -15.230 11.618 786 HG13 ILE 100 2HG1 ILE 100 -1.823 -15.582 11.007 787 HG21 ILE 100 1HG2 ILE 100 -4.509 -17.052 12.303 788 HG22 ILE 100 2HG2 ILE 100 -4.250 -18.658 11.623 789 HG23 ILE 100 3HG2 ILE 100 -2.955 -17.860 12.516 790 HD11 ILE 100 1HD1 ILE 100 -4.151 -14.869 9.246 791 HD12 ILE 100 2HD1 ILE 100 -2.992 -13.697 9.876 792 HD13 ILE 100 3HD1 ILE 100 -2.450 -14.980 8.795 793 H SER 101 H SER 101 -3.634 -19.217 8.489 794 HA SER 101 HA SER 101 -2.816 -21.827 9.453 795 HB2 SER 101 1HB SER 101 -4.851 -22.519 10.359 796 HB3 SER 101 2HB SER 101 -4.734 -20.856 10.935 797 HG SER 101 HG SER 101 -5.916 -20.541 8.721 798 H GLY 102 H GLY 102 -4.049 -23.589 8.253 799 HA2 GLY 102 1HA GLY 102 -5.295 -24.235 6.305 800 HA3 GLY 102 2HA GLY 102 -4.911 -22.676 5.591 801 H THR 103 H THR 103 -4.187 -23.759 3.700 802 HA THR 103 HA THR 103 -1.588 -25.113 4.022 803 HB THR 103 HB THR 103 -2.055 -26.112 1.753 804 HG1 THR 103 1HG THR 103 -3.805 -25.484 0.759 805 HG21 THR 103 1HG2 THR 103 -3.944 -27.647 2.732 806 HG22 THR 103 2HG2 THR 103 -3.630 -26.742 4.213 807 HG23 THR 103 3HG2 THR 103 -2.331 -27.656 3.445 808 H SER 104 H SER 104 0.110 -24.544 2.669 809 HA SER 104 HA SER 104 0.341 -21.866 1.944 810 HB2 SER 104 1HB SER 104 2.260 -22.948 0.408 811 HB3 SER 104 2HB SER 104 2.422 -22.789 2.157 812 HG SER 104 HG SER 104 1.200 -25.088 1.135 813 H ILE 105 H ILE 105 -0.105 -24.692 -0.181 814 HA ILE 105 HA ILE 105 -0.187 -23.495 -2.629 815 HB ILE 105 HB ILE 105 -1.825 -25.780 -1.562 816 HG12 ILE 105 1HG1 ILE 105 0.527 -26.251 -1.783 817 HG13 ILE 105 2HG1 ILE 105 -0.319 -27.071 -3.091 818 HG21 ILE 105 1HG2 ILE 105 -1.714 -24.830 -4.422 819 HG22 ILE 105 2HG2 ILE 105 -2.522 -26.284 -3.837 820 HG23 ILE 105 3HG2 ILE 105 -3.106 -24.693 -3.348 821 HD11 ILE 105 1HD1 ILE 105 0.277 -25.031 -4.505 822 HD12 ILE 105 2HD1 ILE 105 1.416 -24.637 -3.216 823 HD13 ILE 105 3HD1 ILE 105 1.569 -26.159 -4.094 824 H ALA 106 H ALA 106 -3.076 -24.066 -0.611 825 HA ALA 106 HA ALA 106 -4.828 -22.552 -2.204 826 HB1 ALA 106 1HB ALA 106 -5.641 -24.192 -0.615 827 HB2 ALA 106 2HB ALA 106 -5.017 -23.233 0.728 828 HB3 ALA 106 3HB ALA 106 -6.336 -22.609 -0.262 829 H PHE 107 H PHE 107 -2.726 -21.673 0.470 830 HA PHE 107 HA PHE 107 -3.749 -19.160 1.085 831 HB2 PHE 107 1HB PHE 107 -2.042 -20.228 2.454 832 HB3 PHE 107 2HB PHE 107 -0.878 -20.109 1.138 833 HD1 PHE 107 1HD PHE 107 -2.721 -18.247 3.701 834 HD2 PHE 107 2HD PHE 107 0.231 -18.044 0.642 835 HE1 PHE 107 1HE PHE 107 -2.009 -16.045 4.539 836 HE2 PHE 107 2HE PHE 107 0.948 -15.842 1.474 837 HZ PHE 107 HZ PHE 107 -0.172 -14.841 3.426 838 H LYS 108 H LYS 108 -1.421 -20.115 -1.400 839 HA LYS 108 HA LYS 108 -1.130 -17.393 -2.343 840 HB2 LYS 108 1HB LYS 108 -0.040 -20.028 -3.338 841 HB3 LYS 108 2HB LYS 108 0.284 -18.488 -4.122 842 HG2 LYS 108 1HG LYS 108 1.426 -17.670 -2.181 843 HG3 LYS 108 2HG LYS 108 0.967 -19.102 -1.256 844 HD2 LYS 108 1HD LYS 108 2.197 -20.334 -3.251 845 HD3 LYS 108 2HD LYS 108 3.028 -18.782 -3.378 846 HE2 LYS 108 1HE LYS 108 2.763 -20.091 -0.709 847 HE3 LYS 108 2HE LYS 108 3.974 -20.684 -1.844 848 HZ1 LYS 108 1HZ LYS 108 3.806 -18.071 -0.508 849 HZ2 LYS 108 2HZ LYS 108 4.589 -18.185 -2.003 850 HZ3 LYS 108 3HZ LYS 108 5.138 -19.099 -0.690 851 H ASN 109 H ASN 109 -2.348 -20.454 -3.709 852 HA ASN 109 HA ASN 109 -3.237 -19.701 -6.141 853 HB2 ASN 109 1HB ASN 109 -4.310 -21.588 -4.105 854 HB3 ASN 109 2HB ASN 109 -5.341 -21.214 -5.484 855 HD21 ASN 109 1HD2 ASN 109 -2.618 -22.927 -4.360 856 HD22 ASN 109 2HD2 ASN 109 -2.182 -23.674 -5.855 857 H ILE 110 H ILE 110 -4.844 -19.010 -3.071 858 HA ILE 110 HA ILE 110 -7.067 -17.682 -4.323 859 HB ILE 110 HB ILE 110 -7.318 -18.817 -2.151 860 HG12 ILE 110 1HG1 ILE 110 -8.415 -16.828 -0.948 861 HG13 ILE 110 2HG1 ILE 110 -7.854 -15.855 -2.303 862 HG21 ILE 110 1HG2 ILE 110 -4.961 -17.894 -1.438 863 HG22 ILE 110 2HG2 ILE 110 -5.925 -16.580 -0.768 864 HG23 ILE 110 3HG2 ILE 110 -6.204 -18.237 -0.235 865 HD11 ILE 110 1HD1 ILE 110 -10.068 -16.415 -2.805 866 HD12 ILE 110 2HD1 ILE 110 -9.087 -17.502 -3.789 867 HD13 ILE 110 3HD1 ILE 110 -9.846 -18.093 -2.311 868 H ALA 111 H ALA 111 -4.117 -16.694 -2.641 869 HA ALA 111 HA ALA 111 -4.537 -13.979 -2.408 870 HB1 ALA 111 1HB ALA 111 -2.084 -13.740 -2.500 871 HB2 ALA 111 2HB ALA 111 -2.599 -15.062 -1.452 872 HB3 ALA 111 3HB ALA 111 -1.962 -15.408 -3.060 873 H SER 112 H SER 112 -3.709 -15.844 -5.256 874 HA SER 112 HA SER 112 -2.946 -13.693 -6.919 875 HB2 SER 112 1HB SER 112 -2.350 -15.902 -7.604 876 HB3 SER 112 2HB SER 112 -4.026 -16.447 -7.535 877 HG SER 112 HG SER 112 -4.472 -15.050 -9.287 878 H LYS 113 H LYS 113 -6.055 -15.337 -6.442 879 HA LYS 113 HA LYS 113 -7.543 -13.958 -8.352 880 HB2 LYS 113 1HB LYS 113 -8.395 -15.111 -5.692 881 HB3 LYS 113 2HB LYS 113 -9.517 -14.534 -6.918 882 HG2 LYS 113 1HG LYS 113 -7.495 -16.695 -7.440 883 HG3 LYS 113 2HG LYS 113 -9.130 -17.017 -6.857 884 HD2 LYS 113 1HD LYS 113 -8.592 -15.413 -9.344 885 HD3 LYS 113 2HD LYS 113 -8.751 -17.170 -9.370 886 HE2 LYS 113 1HE LYS 113 -10.855 -15.485 -8.072 887 HE3 LYS 113 2HE LYS 113 -10.832 -15.678 -9.825 888 HZ1 LYS 113 1HZ LYS 113 -11.398 -17.856 -9.688 889 HZ2 LYS 113 2HZ LYS 113 -12.142 -17.324 -8.265 890 HZ3 LYS 113 3HZ LYS 113 -10.638 -18.096 -8.196 891 H ILE 114 H ILE 114 -7.119 -13.220 -4.895 892 HA ILE 114 HA ILE 114 -8.676 -10.919 -4.789 893 HB ILE 114 HB ILE 114 -6.166 -11.536 -3.227 894 HG12 ILE 114 1HG1 ILE 114 -8.029 -13.204 -3.060 895 HG13 ILE 114 2HG1 ILE 114 -7.630 -12.423 -1.535 896 HG21 ILE 114 1HG2 ILE 114 -6.373 -9.370 -2.641 897 HG22 ILE 114 2HG2 ILE 114 -8.056 -9.281 -3.157 898 HG23 ILE 114 3HG2 ILE 114 -7.650 -9.986 -1.592 899 HD11 ILE 114 1HD1 ILE 114 -10.006 -11.949 -3.301 900 HD12 ILE 114 2HD1 ILE 114 -9.970 -12.502 -1.626 901 HD13 ILE 114 3HD1 ILE 114 -9.542 -10.836 -2.014 902 H ALA 115 H ALA 115 -5.206 -11.242 -5.488 903 HA ALA 115 HA ALA 115 -4.603 -8.534 -5.761 904 HB1 ALA 115 1HB ALA 115 -3.077 -10.652 -5.766 905 HB2 ALA 115 2HB ALA 115 -3.275 -10.548 -7.516 906 HB3 ALA 115 3HB ALA 115 -2.576 -9.195 -6.625 907 H ASN 116 H ASN 116 -5.455 -10.880 -8.309 908 HA ASN 116 HA ASN 116 -5.397 -9.218 -10.498 909 HB2 ASN 116 1HB ASN 116 -7.059 -11.618 -9.813 910 HB3 ASN 116 2HB ASN 116 -7.367 -10.743 -11.310 911 HD21 ASN 116 1HD2 ASN 116 -6.069 -13.419 -10.397 912 HD22 ASN 116 2HD2 ASN 116 -4.667 -13.516 -11.402 913 H GLU 117 H GLU 117 -8.107 -9.752 -8.265 914 HA GLU 117 HA GLU 117 -9.946 -8.069 -9.565 915 HB2 GLU 117 1HB GLU 117 -9.753 -8.822 -6.643 916 HB3 GLU 117 2HB GLU 117 -11.142 -8.047 -7.391 917 HG2 GLU 117 1HG GLU 117 -10.145 -10.837 -7.685 918 HG3 GLU 117 2HG GLU 117 -11.776 -10.254 -7.359 919 H LEU 118 H LEU 118 -7.731 -7.440 -6.856 920 HA LEU 118 HA LEU 118 -8.449 -4.669 -6.690 921 HB2 LEU 118 1HB LEU 118 -6.306 -6.358 -5.444 922 HB3 LEU 118 2HB LEU 118 -6.335 -4.609 -5.231 923 HG LEU 118 HG LEU 118 -8.768 -6.195 -4.543 924 HD11 LEU 118 1HD1 LEU 118 -7.819 -7.315 -2.885 925 HD12 LEU 118 2HD1 LEU 118 -7.148 -5.824 -2.225 926 HD13 LEU 118 3HD1 LEU 118 -6.239 -6.745 -3.424 927 HD21 LEU 118 1HD2 LEU 118 -7.659 -3.528 -4.056 928 HD22 LEU 118 2HD2 LEU 118 -8.364 -4.295 -2.633 929 HD23 LEU 118 3HD2 LEU 118 -9.336 -4.074 -4.090 930 H LYS 119 H LYS 119 -6.977 -6.175 -9.085 931 HA LYS 119 HA LYS 119 -5.478 -5.638 -10.715 932 HB2 LYS 119 1HB LYS 119 -6.472 -2.959 -9.789 933 HB3 LYS 119 2HB LYS 119 -5.264 -3.074 -11.062 934 HG2 LYS 119 1HG LYS 119 -7.916 -4.485 -11.177 935 HG3 LYS 119 2HG LYS 119 -7.642 -2.869 -11.833 936 HD2 LYS 119 1HD LYS 119 -6.031 -5.291 -12.623 937 HD3 LYS 119 2HD LYS 119 -7.459 -4.738 -13.500 938 HE2 LYS 119 1HE LYS 119 -6.326 -2.521 -13.767 939 HE3 LYS 119 2HE LYS 119 -4.874 -3.246 -13.079 940 HZ1 LYS 119 1HZ LYS 119 -4.441 -4.373 -14.957 941 HZ2 LYS 119 2HZ LYS 119 -5.404 -3.189 -15.686 942 HZ3 LYS 119 3HZ LYS 119 -6.068 -4.693 -15.291 943 H LEU 120 H LEU 120 -4.353 -6.210 -8.154 944 HA LEU 120 HA LEU 120 -2.171 -4.322 -7.799 945 HB2 LEU 120 1HB LEU 120 -2.727 -6.925 -6.383 946 HB3 LEU 120 2HB LEU 120 -1.528 -5.721 -5.916 947 HG LEU 120 HG LEU 120 -4.502 -5.218 -5.941 948 HD11 LEU 120 1HD1 LEU 120 -2.825 -5.682 -3.497 949 HD12 LEU 120 2HD1 LEU 120 -3.656 -7.003 -4.319 950 HD13 LEU 120 3HD1 LEU 120 -4.582 -5.661 -3.648 951 HD21 LEU 120 1HD2 LEU 120 -3.637 -3.391 -4.308 952 HD22 LEU 120 2HD2 LEU 120 -3.502 -3.139 -6.049 953 HD23 LEU 120 3HD2 LEU 120 -2.093 -3.651 -5.119 954 H SER 121 H SER 121 0.004 -5.675 -7.228 955 HA SER 121 HA SER 121 1.003 -6.510 -9.728 956 HB2 SER 121 1HB SER 121 3.068 -6.982 -8.566 957 HB3 SER 121 2HB SER 121 2.372 -5.515 -7.879 958 HG SER 121 HG SER 121 1.574 -7.844 -6.649 959 H GLY 122 H GLY 122 2.532 -8.719 -9.377 960 HA2 GLY 122 1HA GLY 122 0.847 -10.896 -8.424 961 HA3 GLY 122 2HA GLY 122 1.139 -10.849 -10.156 962 HA PRO 123 HA PRO 123 5.488 -11.549 -8.185 963 HB2 PRO 123 1HB PRO 123 5.596 -11.850 -5.489 964 HB3 PRO 123 2HB PRO 123 5.742 -10.279 -6.287 965 HG2 PRO 123 1HG PRO 123 3.355 -11.525 -4.977 966 HG3 PRO 123 2HG PRO 123 3.941 -9.854 -4.879 967 HD2 PRO 123 1HD PRO 123 1.886 -10.586 -6.483 968 HD3 PRO 123 2HD PRO 123 3.006 -9.275 -6.905 969 H SER 124 H SER 124 2.654 -13.200 -7.746 970 HA SER 124 HA SER 124 3.688 -15.592 -6.530 971 HB2 SER 124 1HB SER 124 1.332 -15.013 -6.254 972 HB3 SER 124 2HB SER 124 1.090 -15.078 -8.000 973 HG SER 124 HG SER 124 0.455 -17.010 -6.855 974 H SER 125 H SER 125 2.729 -14.630 -9.812 975 HA SER 125 HA SER 125 2.967 -15.733 -11.820 976 HB2 SER 125 1HB SER 125 5.725 -15.714 -10.596 977 HB3 SER 125 2HB SER 125 5.436 -16.251 -12.251 978 HG SER 125 HG SER 125 5.829 -13.815 -11.498 979 H GLY 126 H GLY 126 1.879 -17.483 -9.948 980 HA2 GLY 126 1HA GLY 126 2.520 -19.992 -11.140 981 HA3 GLY 126 2HA GLY 126 3.156 -19.892 -9.505 Start of MODEL 19 1 H1 MET 1 H MET 1 1.706 -49.565 -23.348 2 HA MET 1 HA MET 1 0.795 -48.172 -25.431 3 HB2 MET 1 1HB MET 1 0.387 -51.092 -24.830 4 HB3 MET 1 2HB MET 1 -0.120 -50.390 -26.361 5 HG2 MET 1 1HG MET 1 2.682 -50.383 -25.263 6 HG3 MET 1 2HG MET 1 2.067 -51.443 -26.529 7 HE1 MET 1 1HE MET 1 2.305 -50.609 -29.252 8 HE2 MET 1 2HE MET 1 0.725 -50.447 -28.486 9 HE3 MET 1 3HE MET 1 1.371 -49.128 -29.464 10 H LYS 2 H LYS 2 -0.826 -47.250 -23.376 11 HA LYS 2 HA LYS 2 -3.525 -48.152 -24.101 12 HB2 LYS 2 1HB LYS 2 -2.598 -47.912 -21.646 13 HB3 LYS 2 2HB LYS 2 -2.997 -46.216 -21.884 14 HG2 LYS 2 1HG LYS 2 -5.269 -46.641 -22.056 15 HG3 LYS 2 2HG LYS 2 -5.021 -48.345 -22.444 16 HD2 LYS 2 1HD LYS 2 -4.126 -48.652 -20.125 17 HD3 LYS 2 2HD LYS 2 -4.626 -46.996 -19.777 18 HE2 LYS 2 1HE LYS 2 -6.445 -49.227 -20.682 19 HE3 LYS 2 2HE LYS 2 -6.285 -48.645 -19.025 20 HZ1 LYS 2 1HZ LYS 2 -6.812 -46.380 -20.372 21 HZ2 LYS 2 2HZ LYS 2 -7.978 -47.318 -19.583 22 HZ3 LYS 2 3HZ LYS 2 -7.729 -47.502 -21.246 23 H ASP 3 H ASP 3 -1.847 -45.090 -23.362 24 HA ASP 3 HA ASP 3 -2.852 -43.838 -25.732 25 HB2 ASP 3 1HB ASP 3 -4.156 -42.075 -24.565 26 HB3 ASP 3 2HB ASP 3 -4.879 -43.674 -24.414 27 H HIS 4 H HIS 4 -2.397 -41.339 -25.540 28 HA HIS 4 HA HIS 4 -0.194 -40.662 -23.803 29 HB2 HIS 4 1HB HIS 4 1.477 -40.347 -25.458 30 HB3 HIS 4 2HB HIS 4 0.814 -41.953 -25.748 31 HD1 HIS 4 1HD HIS 4 -0.231 -42.385 -28.002 32 HD2 HIS 4 2HD HIS 4 0.662 -38.376 -27.380 33 HE1 HIS 4 1HE HIS 4 -0.581 -41.266 -30.227 34 HE2 HIS 4 2HE HIS 4 0.047 -38.856 -29.846 35 H LEU 5 H LEU 5 0.693 -38.406 -24.512 36 HA LEU 5 HA LEU 5 -1.339 -36.750 -25.778 37 HB2 LEU 5 1HB LEU 5 -1.218 -35.143 -23.830 38 HB3 LEU 5 2HB LEU 5 -2.143 -36.622 -23.580 39 HG LEU 5 HG LEU 5 -0.644 -35.795 -21.675 40 HD11 LEU 5 1HD1 LEU 5 -0.281 -37.995 -20.918 41 HD12 LEU 5 2HD1 LEU 5 -0.145 -38.623 -22.560 42 HD13 LEU 5 3HD1 LEU 5 -1.707 -38.077 -21.952 43 HD21 LEU 5 1HD2 LEU 5 1.659 -36.239 -21.758 44 HD22 LEU 5 2HD2 LEU 5 1.300 -35.423 -23.280 45 HD23 LEU 5 3HD2 LEU 5 1.514 -37.174 -23.246 46 H ILE 6 H ILE 6 -0.531 -34.345 -25.667 47 HA ILE 6 HA ILE 6 2.391 -34.271 -25.975 48 HB ILE 6 HB ILE 6 0.424 -33.060 -27.922 49 HG12 ILE 6 1HG1 ILE 6 0.642 -35.494 -28.175 50 HG13 ILE 6 2HG1 ILE 6 1.369 -34.648 -29.537 51 HG21 ILE 6 1HG2 ILE 6 3.280 -32.620 -27.412 52 HG22 ILE 6 2HG2 ILE 6 2.860 -32.896 -29.101 53 HG23 ILE 6 3HG2 ILE 6 2.094 -31.584 -28.205 54 HD11 ILE 6 1HD1 ILE 6 2.571 -36.433 -27.585 55 HD12 ILE 6 2HD1 ILE 6 3.120 -35.972 -29.197 56 HD13 ILE 6 3HD1 ILE 6 3.478 -34.938 -27.814 57 H HIS 7 H HIS 7 3.376 -32.325 -25.471 58 HA HIS 7 HA HIS 7 1.623 -30.318 -24.213 59 HB2 HIS 7 1HB HIS 7 4.453 -31.104 -23.493 60 HB3 HIS 7 2HB HIS 7 3.566 -29.774 -22.755 61 HD1 HIS 7 1HD HIS 7 0.850 -31.188 -22.327 62 HD2 HIS 7 2HD HIS 7 4.543 -32.854 -21.403 63 HE1 HIS 7 1HE HIS 7 0.382 -32.933 -20.578 64 HE2 HIS 7 2HE HIS 7 2.641 -33.868 -19.972 65 H ASN 8 H ASN 8 2.801 -28.119 -24.036 66 HA ASN 8 HA ASN 8 3.577 -27.383 -26.737 67 HB2 ASN 8 1HB ASN 8 1.907 -26.020 -25.567 68 HB3 ASN 8 2HB ASN 8 3.072 -25.670 -24.293 69 HD21 ASN 8 1HD2 ASN 8 3.937 -23.745 -24.447 70 HD22 ASN 8 2HD2 ASN 8 4.262 -22.881 -25.908 71 H VAL 9 H VAL 9 5.651 -27.628 -27.254 72 HA VAL 9 HA VAL 9 7.671 -26.400 -25.538 73 HB VAL 9 HB VAL 9 9.194 -28.365 -25.884 74 HG11 VAL 9 1HG1 VAL 9 6.722 -28.515 -24.204 75 HG12 VAL 9 2HG1 VAL 9 7.910 -29.819 -24.171 76 HG13 VAL 9 3HG1 VAL 9 8.384 -28.182 -23.719 77 HG21 VAL 9 1HG2 VAL 9 7.157 -30.353 -26.154 78 HG22 VAL 9 2HG2 VAL 9 7.075 -29.242 -27.522 79 HG23 VAL 9 3HG2 VAL 9 8.582 -30.081 -27.156 80 H HIS 10 H HIS 10 8.589 -24.950 -26.828 81 HA HIS 10 HA HIS 10 8.562 -25.069 -29.649 82 HB2 HIS 10 1HB HIS 10 8.890 -23.049 -27.978 83 HB3 HIS 10 2HB HIS 10 10.596 -23.422 -28.202 84 HD1 HIS 10 1HD HIS 10 7.677 -23.117 -30.638 85 HD2 HIS 10 2HD HIS 10 11.565 -21.760 -30.086 86 HE1 HIS 10 1HE HIS 10 8.175 -21.673 -32.636 87 HE2 HIS 10 2HE HIS 10 10.562 -20.932 -32.322 88 H LYS 11 H LYS 11 9.834 -26.118 -31.021 89 HA LYS 11 HA LYS 11 12.039 -27.689 -30.049 90 HB2 LYS 11 1HB LYS 11 10.659 -27.357 -32.685 91 HB3 LYS 11 2HB LYS 11 12.233 -28.140 -32.629 92 HG2 LYS 11 1HG LYS 11 10.596 -29.848 -32.554 93 HG3 LYS 11 2HG LYS 11 11.286 -29.722 -30.934 94 HD2 LYS 11 1HD LYS 11 8.981 -29.883 -30.566 95 HD3 LYS 11 2HD LYS 11 9.320 -28.156 -30.428 96 HE2 LYS 11 1HE LYS 11 8.709 -28.024 -32.907 97 HE3 LYS 11 2HE LYS 11 8.037 -29.641 -32.703 98 HZ1 LYS 11 1HZ LYS 11 7.130 -27.095 -31.542 99 HZ2 LYS 11 2HZ LYS 11 6.799 -28.543 -30.731 100 HZ3 LYS 11 3HZ LYS 11 6.227 -28.305 -32.306 101 H GLU 12 H GLU 12 14.207 -27.578 -30.810 102 HA GLU 12 HA GLU 12 16.156 -26.404 -31.044 103 HB2 GLU 12 1HB GLU 12 15.169 -26.703 -33.418 104 HB3 GLU 12 2HB GLU 12 14.812 -24.984 -33.325 105 HG2 GLU 12 1HG GLU 12 17.158 -24.481 -33.011 106 HG3 GLU 12 2HG GLU 12 17.546 -26.200 -33.007 107 H GLU 13 H GLU 13 14.931 -25.282 -29.015 108 HA GLU 13 HA GLU 13 14.737 -22.401 -29.520 109 HB2 GLU 13 1HB GLU 13 13.905 -22.365 -27.115 110 HB3 GLU 13 2HB GLU 13 12.869 -23.159 -28.293 111 HG2 GLU 13 1HG GLU 13 13.347 -25.275 -27.482 112 HG3 GLU 13 2HG GLU 13 14.830 -24.744 -26.691 113 H HIS 14 H HIS 14 16.699 -21.485 -29.491 114 HA HIS 14 HA HIS 14 18.767 -22.398 -27.689 115 HB2 HIS 14 1HB HIS 14 18.791 -20.012 -29.546 116 HB3 HIS 14 2HB HIS 14 20.188 -20.766 -28.784 117 HD1 HIS 14 1HD HIS 14 21.389 -22.397 -30.199 118 HD2 HIS 14 2HD HIS 14 17.436 -21.932 -31.391 119 HE1 HIS 14 1HE HIS 14 21.141 -23.803 -32.270 120 HE2 HIS 14 2HE HIS 14 18.765 -23.439 -33.021 121 H ALA 15 H ALA 15 16.452 -21.421 -26.377 122 HA ALA 15 HA ALA 15 17.446 -18.922 -25.173 123 HB1 ALA 15 1HB ALA 15 15.225 -18.755 -26.232 124 HB2 ALA 15 2HB ALA 15 14.629 -19.998 -25.131 125 HB3 ALA 15 3HB ALA 15 15.176 -18.446 -24.496 126 H HIS 16 H HIS 16 18.732 -19.621 -23.539 127 HA HIS 16 HA HIS 16 17.409 -21.034 -21.353 128 HB2 HIS 16 1HB HIS 16 19.567 -22.396 -21.059 129 HB3 HIS 16 2HB HIS 16 18.467 -22.888 -22.343 130 HD1 HIS 16 1HD HIS 16 19.715 -23.515 -24.368 131 HD2 HIS 16 2HD HIS 16 21.573 -20.410 -22.326 132 HE1 HIS 16 1HE HIS 16 21.758 -22.948 -25.720 133 HE2 HIS 16 2HE HIS 16 22.912 -21.125 -24.421 134 H ALA 17 H ALA 17 18.320 -20.645 -19.302 135 HA ALA 17 HA ALA 17 20.687 -19.150 -18.891 136 HB1 ALA 17 1HB ALA 17 19.703 -17.032 -18.146 137 HB2 ALA 17 2HB ALA 17 19.395 -17.330 -19.857 138 HB3 ALA 17 3HB ALA 17 18.115 -17.590 -18.673 139 H HIS 18 H HIS 18 21.326 -19.340 -16.816 140 HA HIS 18 HA HIS 18 19.368 -20.432 -14.908 141 HB2 HIS 18 1HB HIS 18 21.525 -21.203 -13.704 142 HB3 HIS 18 2HB HIS 18 21.022 -22.066 -15.154 143 HD1 HIS 18 1HD HIS 18 23.476 -22.827 -15.555 144 HD2 HIS 18 2HD HIS 18 22.912 -18.712 -15.656 145 HE1 HIS 18 1HE HIS 18 25.576 -21.885 -16.568 146 HE2 HIS 18 2HE HIS 18 25.247 -19.388 -16.541 147 H ASN 19 H ASN 19 18.614 -18.428 -14.168 148 HA ASN 19 HA ASN 19 20.574 -16.690 -12.847 149 HB2 ASN 19 1HB ASN 19 17.659 -16.163 -13.467 150 HB3 ASN 19 2HB ASN 19 18.807 -15.000 -12.812 151 HD21 ASN 19 1HD2 ASN 19 17.666 -16.620 -15.619 152 HD22 ASN 19 2HD2 ASN 19 18.635 -15.771 -16.770 153 H LYS 20 H LYS 20 20.158 -19.058 -11.546 154 HA LYS 20 HA LYS 20 18.125 -18.752 -9.521 155 HB2 LYS 20 1HB LYS 20 19.517 -20.771 -8.545 156 HB3 LYS 20 2HB LYS 20 18.447 -20.989 -9.924 157 HG2 LYS 20 1HG LYS 20 20.176 -21.227 -11.406 158 HG3 LYS 20 2HG LYS 20 21.296 -20.285 -10.419 159 HD2 LYS 20 1HD LYS 20 22.079 -22.464 -10.184 160 HD3 LYS 20 2HD LYS 20 21.096 -22.232 -8.736 161 HE2 LYS 20 1HE LYS 20 19.398 -23.594 -9.513 162 HE3 LYS 20 2HE LYS 20 19.857 -23.377 -11.202 163 HZ1 LYS 20 1HZ LYS 20 20.510 -25.536 -10.668 164 HZ2 LYS 20 2HZ LYS 20 21.137 -25.091 -9.162 165 HZ3 LYS 20 3HZ LYS 20 21.947 -24.647 -10.579 166 H ASP 21 H ASP 21 19.608 -16.511 -9.410 167 HA ASP 21 HA ASP 21 21.024 -16.819 -6.856 168 HB2 ASP 21 1HB ASP 21 22.622 -16.593 -8.821 169 HB3 ASP 21 2HB ASP 21 21.993 -14.960 -9.027 170 H TYR 22 H TYR 22 19.202 -16.024 -5.782 171 HA TYR 22 HA TYR 22 18.781 -13.134 -6.118 172 HB2 TYR 22 1HB TYR 22 16.337 -13.848 -5.280 173 HB3 TYR 22 2HB TYR 22 16.762 -13.742 -6.985 174 HD1 TYR 22 2HD TYR 22 17.155 -15.782 -8.296 175 HD2 TYR 22 1HD TYR 22 15.917 -15.973 -4.230 176 HE1 TYR 22 2HE TYR 22 16.533 -18.142 -8.602 177 HE2 TYR 22 1HE TYR 22 15.292 -18.333 -4.525 178 HH TYR 22 HH TYR 22 15.573 -20.154 -5.905 179 H ASP 23 H ASP 23 17.672 -12.176 -4.164 180 HA ASP 23 HA ASP 23 18.679 -13.484 -1.722 181 HB2 ASP 23 1HB ASP 23 19.134 -11.328 -0.787 182 HB3 ASP 23 2HB ASP 23 19.840 -11.355 -2.401 183 H ILE 24 H ILE 24 17.089 -14.263 -0.519 184 HA ILE 24 HA ILE 24 14.597 -12.706 -0.306 185 HB ILE 24 HB ILE 24 14.494 -15.657 0.060 186 HG12 ILE 24 1HG1 ILE 24 15.755 -15.321 -2.056 187 HG13 ILE 24 2HG1 ILE 24 14.178 -16.060 -2.310 188 HG21 ILE 24 1HG2 ILE 24 12.250 -15.240 -1.037 189 HG22 ILE 24 2HG2 ILE 24 12.498 -14.497 0.542 190 HG23 ILE 24 3HG2 ILE 24 12.622 -13.520 -0.921 191 HD11 ILE 24 1HD1 ILE 24 15.252 -13.707 -3.471 192 HD12 ILE 24 2HD1 ILE 24 13.696 -14.481 -3.773 193 HD13 ILE 24 3HD1 ILE 24 13.844 -13.263 -2.506 194 HA PRO 25 HA PRO 25 15.429 -12.748 4.029 195 HB2 PRO 25 1HB PRO 25 12.960 -12.025 4.894 196 HB3 PRO 25 2HB PRO 25 14.085 -10.889 4.142 197 HG2 PRO 25 1HG PRO 25 11.760 -12.334 2.930 198 HG3 PRO 25 2HG PRO 25 12.255 -10.644 2.727 199 HD2 PRO 25 1HD PRO 25 12.804 -12.553 0.888 200 HD3 PRO 25 2HD PRO 25 13.882 -11.174 1.183 201 H THR 26 H THR 26 14.397 -13.644 6.074 202 HA THR 26 HA THR 26 13.558 -16.391 5.535 203 HB THR 26 HB THR 26 15.476 -16.055 7.043 204 HG1 THR 26 1HG THR 26 13.536 -17.675 7.372 205 HG21 THR 26 1HG2 THR 26 15.230 -14.112 8.231 206 HG22 THR 26 2HG2 THR 26 14.666 -15.266 9.440 207 HG23 THR 26 3HG2 THR 26 13.502 -14.353 8.480 208 H THR 27 H THR 27 11.675 -14.210 5.215 209 HA THR 27 HA THR 27 9.803 -14.750 7.423 210 HB THR 27 HB THR 27 8.559 -12.727 6.443 211 HG1 THR 27 1HG THR 27 10.291 -12.898 4.578 212 HG21 THR 27 1HG2 THR 27 9.620 -11.327 7.930 213 HG22 THR 27 2HG2 THR 27 11.229 -11.895 7.483 214 HG23 THR 27 3HG2 THR 27 10.190 -12.895 8.499 215 H GLU 28 H GLU 28 7.704 -15.403 6.994 216 HA GLU 28 HA GLU 28 7.267 -16.439 4.276 217 HB2 GLU 28 1HB GLU 28 6.134 -17.319 6.934 218 HB3 GLU 28 2HB GLU 28 5.601 -17.955 5.384 219 HG2 GLU 28 1HG GLU 28 7.123 -19.528 6.176 220 HG3 GLU 28 2HG GLU 28 8.031 -18.592 4.990 221 H ASN 29 H ASN 29 6.529 -14.330 3.583 222 HA ASN 29 HA ASN 29 3.674 -14.050 3.933 223 HB2 ASN 29 1HB ASN 29 5.535 -11.784 4.685 224 HB3 ASN 29 2HB ASN 29 3.783 -11.664 4.560 225 HD21 ASN 29 1HD2 ASN 29 6.448 -12.936 6.390 226 HD22 ASN 29 2HD2 ASN 29 5.547 -13.332 7.809 227 H LEU 30 H LEU 30 2.694 -12.717 2.332 228 HA LEU 30 HA LEU 30 4.383 -12.388 -0.044 229 HB2 LEU 30 1HB LEU 30 1.521 -12.987 0.422 230 HB3 LEU 30 2HB LEU 30 1.915 -12.028 -1.003 231 HG LEU 30 HG LEU 30 1.687 -14.440 -1.479 232 HD11 LEU 30 1HD1 LEU 30 4.097 -14.636 -2.482 233 HD12 LEU 30 2HD1 LEU 30 4.229 -12.960 -1.952 234 HD13 LEU 30 3HD1 LEU 30 2.966 -13.428 -3.090 235 HD21 LEU 30 1HD2 LEU 30 2.460 -15.822 0.100 236 HD22 LEU 30 2HD2 LEU 30 3.557 -14.607 0.757 237 HD23 LEU 30 3HD2 LEU 30 4.039 -15.566 -0.643 238 H TYR 31 H TYR 31 4.024 -10.517 -1.426 239 HA TYR 31 HA TYR 31 2.966 -8.166 -0.020 240 HB2 TYR 31 1HB TYR 31 5.664 -8.377 -1.366 241 HB3 TYR 31 2HB TYR 31 4.924 -6.853 -0.890 242 HD1 TYR 31 1HD TYR 31 3.911 -7.171 1.712 243 HD2 TYR 31 2HD TYR 31 7.386 -8.969 0.040 244 HE1 TYR 31 1HE TYR 31 4.867 -7.406 3.966 245 HE2 TYR 31 2HE TYR 31 8.351 -9.209 2.289 246 HH TYR 31 HH TYR 31 7.654 -7.642 4.766 247 H PHE 32 H PHE 32 1.567 -7.093 -1.236 248 HA PHE 32 HA PHE 32 1.788 -7.318 -4.166 249 HB2 PHE 32 1HB PHE 32 -0.737 -7.116 -2.511 250 HB3 PHE 32 2HB PHE 32 -0.670 -7.155 -4.270 251 HD1 PHE 32 1HD PHE 32 0.072 -9.122 -1.225 252 HD2 PHE 32 2HD PHE 32 -0.586 -9.187 -5.429 253 HE1 PHE 32 1HE PHE 32 -0.028 -11.580 -1.168 254 HE2 PHE 32 2HE PHE 32 -0.688 -11.645 -5.379 255 HZ PHE 32 HZ PHE 32 -0.409 -12.844 -3.246 256 H GLN 33 H GLN 33 1.033 -5.495 -5.395 257 HA GLN 33 HA GLN 33 0.849 -2.980 -3.890 258 HB2 GLN 33 1HB GLN 33 2.384 -1.877 -5.400 259 HB3 GLN 33 2HB GLN 33 3.176 -3.274 -4.683 260 HG2 GLN 33 1HG GLN 33 3.817 -3.536 -6.844 261 HG3 GLN 33 2HG GLN 33 2.315 -4.460 -6.868 262 HE21 GLN 33 1HE2 GLN 33 3.340 -1.076 -7.212 263 HE22 GLN 33 2HE2 GLN 33 2.359 -0.742 -8.594 264 H GLY 34 H GLY 34 -0.800 -1.747 -4.524 265 HA2 GLY 34 1HA GLY 34 -1.612 -1.066 -7.032 266 HA3 GLY 34 2HA GLY 34 -2.441 -2.587 -6.735 267 H SER 35 H SER 35 -1.743 0.323 -4.792 268 HA SER 35 HA SER 35 -4.150 0.189 -3.335 269 HB2 SER 35 1HB SER 35 -3.570 2.358 -2.470 270 HB3 SER 35 2HB SER 35 -2.076 1.438 -2.648 271 HG SER 35 HG SER 35 -3.069 3.324 -4.524 272 H SER 36 H SER 36 -5.965 1.637 -3.398 273 HA SER 36 HA SER 36 -6.644 2.423 -6.147 274 HB2 SER 36 1HB SER 36 -8.083 0.727 -4.921 275 HB3 SER 36 2HB SER 36 -8.572 2.041 -3.852 276 HG SER 36 HG SER 36 -9.223 3.156 -5.834 277 H GLY 37 H GLY 37 -5.011 4.103 -4.517 278 HA2 GLY 37 1HA GLY 37 -5.160 6.528 -4.743 279 HA3 GLY 37 2HA GLY 37 -6.836 6.407 -4.232 280 H SER 38 H SER 38 -7.235 5.686 -2.004 281 HA SER 38 HA SER 38 -5.093 6.630 -0.217 282 HB2 SER 38 1HB SER 38 -7.311 7.911 -0.330 283 HB3 SER 38 2HB SER 38 -8.024 6.521 0.489 284 HG SER 38 HG SER 38 -5.706 7.676 1.556 285 H SER 39 H SER 39 -5.519 5.723 2.125 286 HA SER 39 HA SER 39 -5.137 2.892 1.933 287 HB2 SER 39 1HB SER 39 -4.690 2.967 4.304 288 HB3 SER 39 2HB SER 39 -3.925 4.370 3.557 289 HG SER 39 HG SER 39 -5.462 5.672 4.401 290 H GLY 40 H GLY 40 -7.707 5.015 3.086 291 HA2 GLY 40 1HA GLY 40 -9.315 3.077 4.327 292 HA3 GLY 40 2HA GLY 40 -9.890 4.595 3.654 293 H ASP 41 H ASP 41 -10.033 4.585 1.182 294 HA ASP 41 HA ASP 41 -12.002 3.040 0.252 295 HB2 ASP 41 1HB ASP 41 -9.581 3.742 -1.421 296 HB3 ASP 41 2HB ASP 41 -11.204 3.406 -2.017 297 H MET 42 H MET 42 -8.578 2.103 0.159 298 HA MET 42 HA MET 42 -8.706 -0.268 -1.196 299 HB2 MET 42 1HB MET 42 -7.010 0.698 1.062 300 HB3 MET 42 2HB MET 42 -6.892 -0.991 0.589 301 HG2 MET 42 1HG MET 42 -6.403 1.405 -1.163 302 HG3 MET 42 2HG MET 42 -5.192 0.297 -0.522 303 HE1 MET 42 1HE MET 42 -4.852 -1.844 -0.959 304 HE2 MET 42 2HE MET 42 -5.981 -2.939 -1.757 305 HE3 MET 42 3HE MET 42 -4.643 -2.236 -2.666 306 H MET 43 H MET 43 -9.153 0.126 2.320 307 HA MET 43 HA MET 43 -9.664 -2.461 3.045 308 HB2 MET 43 1HB MET 43 -11.110 -0.008 4.061 309 HB3 MET 43 2HB MET 43 -11.026 -1.560 4.883 310 HG2 MET 43 1HG MET 43 -8.527 -1.280 4.916 311 HG3 MET 43 2HG MET 43 -8.788 0.371 4.358 312 HE1 MET 43 1HE MET 43 -9.125 -2.258 6.861 313 HE2 MET 43 2HE MET 43 -9.166 -1.436 8.420 314 HE3 MET 43 3HE MET 43 -10.668 -1.759 7.554 315 H ARG 44 H ARG 44 -11.887 -0.175 1.533 316 HA ARG 44 HA ARG 44 -14.183 -1.841 1.722 317 HB2 ARG 44 1HB ARG 44 -13.491 0.589 0.093 318 HB3 ARG 44 2HB ARG 44 -14.997 -0.278 -0.174 319 HG2 ARG 44 1HG ARG 44 -15.729 1.260 1.319 320 HG3 ARG 44 2HG ARG 44 -15.196 0.015 2.451 321 HD2 ARG 44 1HD ARG 44 -14.159 1.833 3.362 322 HD3 ARG 44 2HD ARG 44 -12.903 1.305 2.243 323 HE ARG 44 HE ARG 44 -14.244 3.033 0.727 324 HH11 ARG 44 2HH1 ARG 44 -13.143 3.280 4.021 325 HH12 ARG 44 1HH1 ARG 44 -12.935 4.999 3.960 326 HH21 ARG 44 2HH2 ARG 44 -13.975 5.296 0.635 327 HH22 ARG 44 1HH2 ARG 44 -13.410 6.145 2.034 328 H GLU 45 H GLU 45 -11.852 -1.192 -0.877 329 HA GLU 45 HA GLU 45 -13.057 -2.809 -2.832 330 HB2 GLU 45 1HB GLU 45 -11.097 -1.076 -2.988 331 HB3 GLU 45 2HB GLU 45 -10.083 -2.482 -2.694 332 HG2 GLU 45 1HG GLU 45 -10.973 -3.575 -4.660 333 HG3 GLU 45 2HG GLU 45 -12.074 -2.227 -4.937 334 H ILE 46 H ILE 46 -10.190 -3.540 -0.834 335 HA ILE 46 HA ILE 46 -9.723 -6.123 -1.508 336 HB ILE 46 HB ILE 46 -9.688 -5.043 1.313 337 HG12 ILE 46 1HG1 ILE 46 -7.294 -5.318 -0.474 338 HG13 ILE 46 2HG1 ILE 46 -8.338 -3.908 -0.622 339 HG21 ILE 46 1HG2 ILE 46 -9.557 -7.396 1.463 340 HG22 ILE 46 2HG2 ILE 46 -8.471 -7.498 0.078 341 HG23 ILE 46 3HG2 ILE 46 -7.899 -6.810 1.597 342 HD11 ILE 46 1HD1 ILE 46 -6.206 -4.069 1.021 343 HD12 ILE 46 2HD1 ILE 46 -7.585 -3.000 1.281 344 HD13 ILE 46 3HD1 ILE 46 -7.503 -4.552 2.114 345 H ARG 47 H ARG 47 -11.929 -5.160 1.128 346 HA ARG 47 HA ARG 47 -12.908 -7.680 1.741 347 HB2 ARG 47 1HB ARG 47 -14.176 -4.953 1.928 348 HB3 ARG 47 2HB ARG 47 -14.983 -6.403 2.510 349 HG2 ARG 47 1HG ARG 47 -13.108 -6.820 4.036 350 HG3 ARG 47 2HG ARG 47 -12.337 -5.336 3.470 351 HD2 ARG 47 1HD ARG 47 -15.081 -5.433 4.709 352 HD3 ARG 47 2HD ARG 47 -13.606 -5.123 5.623 353 HE ARG 47 HE ARG 47 -14.051 -3.378 3.359 354 HH11 ARG 47 2HH1 ARG 47 -14.474 -3.887 6.776 355 HH12 ARG 47 1HH1 ARG 47 -14.674 -2.204 7.135 356 HH21 ARG 47 2HH2 ARG 47 -14.313 -1.159 3.818 357 HH22 ARG 47 1HH2 ARG 47 -14.583 -0.653 5.451 358 H LYS 48 H LYS 48 -14.058 -5.357 -0.671 359 HA LYS 48 HA LYS 48 -16.390 -6.501 -1.508 360 HB2 LYS 48 1HB LYS 48 -15.316 -4.405 -2.403 361 HB3 LYS 48 2HB LYS 48 -14.292 -5.430 -3.400 362 HG2 LYS 48 1HG LYS 48 -16.432 -6.399 -4.351 363 HG3 LYS 48 2HG LYS 48 -17.267 -5.065 -3.553 364 HD2 LYS 48 1HD LYS 48 -16.871 -4.324 -5.753 365 HD3 LYS 48 2HD LYS 48 -15.642 -3.528 -4.767 366 HE2 LYS 48 1HE LYS 48 -13.971 -5.084 -5.474 367 HE3 LYS 48 2HE LYS 48 -15.174 -6.093 -6.276 368 HZ1 LYS 48 1HZ LYS 48 -14.315 -4.923 -8.027 369 HZ2 LYS 48 2HZ LYS 48 -14.050 -3.517 -7.125 370 HZ3 LYS 48 3HZ LYS 48 -15.617 -3.925 -7.613 371 H VAL 49 H VAL 49 -13.155 -7.299 -2.781 372 HA VAL 49 HA VAL 49 -13.919 -9.342 -4.505 373 HB VAL 49 HB VAL 49 -11.345 -9.341 -2.934 374 HG11 VAL 49 1HG1 VAL 49 -11.392 -11.300 -4.160 375 HG12 VAL 49 2HG1 VAL 49 -12.275 -10.564 -5.499 376 HG13 VAL 49 3HG1 VAL 49 -10.566 -10.197 -5.259 377 HG21 VAL 49 1HG2 VAL 49 -10.450 -7.984 -4.849 378 HG22 VAL 49 2HG2 VAL 49 -12.120 -7.709 -5.345 379 HG23 VAL 49 3HG2 VAL 49 -11.557 -7.125 -3.779 380 H LEU 50 H LEU 50 -12.918 -9.555 -1.099 381 HA LEU 50 HA LEU 50 -12.948 -12.268 -0.722 382 HB2 LEU 50 1HB LEU 50 -14.104 -10.292 1.233 383 HB3 LEU 50 2HB LEU 50 -13.384 -11.859 1.596 384 HG LEU 50 HG LEU 50 -11.892 -9.464 0.524 385 HD11 LEU 50 1HD1 LEU 50 -11.681 -10.639 3.278 386 HD12 LEU 50 2HD1 LEU 50 -12.802 -9.332 2.898 387 HD13 LEU 50 3HD1 LEU 50 -11.068 -9.095 2.686 388 HD21 LEU 50 1HD2 LEU 50 -10.723 -11.970 1.691 389 HD22 LEU 50 2HD2 LEU 50 -9.927 -10.718 0.738 390 HD23 LEU 50 3HD2 LEU 50 -11.069 -11.820 -0.032 391 H GLY 51 H GLY 51 -15.746 -10.153 -0.029 392 HA2 GLY 51 1HA GLY 51 -17.659 -12.016 0.491 393 HA3 GLY 51 2HA GLY 51 -17.998 -10.520 -0.368 394 H ALA 52 H ALA 52 -16.549 -11.035 -2.724 395 HA ALA 52 HA ALA 52 -18.445 -12.454 -4.223 396 HB1 ALA 52 1HB ALA 52 -15.932 -11.083 -4.727 397 HB2 ALA 52 2HB ALA 52 -16.170 -12.479 -5.779 398 HB3 ALA 52 3HB ALA 52 -17.381 -11.198 -5.727 399 H ASN 53 H ASN 53 -15.307 -13.426 -2.914 400 HA ASN 53 HA ASN 53 -15.680 -16.129 -3.969 401 HB2 ASN 53 1HB ASN 53 -13.347 -14.610 -2.864 402 HB3 ASN 53 2HB ASN 53 -13.320 -16.371 -2.831 403 HD21 ASN 53 1HD2 ASN 53 -13.821 -13.619 -4.987 404 HD22 ASN 53 2HD2 ASN 53 -13.165 -14.376 -6.395 405 H ASN 54 H ASN 54 -17.500 -15.417 -2.004 406 HA ASN 54 HA ASN 54 -18.235 -15.869 0.132 407 HB2 ASN 54 1HB ASN 54 -16.965 -18.550 -0.430 408 HB3 ASN 54 2HB ASN 54 -18.408 -18.217 0.524 409 HD21 ASN 54 1HD2 ASN 54 -17.270 -19.210 -2.424 410 HD22 ASN 54 2HD2 ASN 54 -18.704 -18.987 -3.362 411 H CYS 55 H CYS 55 -15.771 -14.565 0.269 412 HA CYS 55 HA CYS 55 -14.273 -16.019 2.328 413 HB2 CYS 55 1HB CYS 55 -13.606 -13.632 0.613 414 HB3 CYS 55 2HB CYS 55 -12.632 -14.078 2.009 415 HG CYS 55 HG CYS 55 -13.080 -15.859 -0.869 416 H ASP 56 H ASP 56 -14.549 -15.544 4.399 417 HA ASP 56 HA ASP 56 -16.147 -13.231 5.136 418 HB2 ASP 56 1HB ASP 56 -14.987 -15.286 7.015 419 HB3 ASP 56 2HB ASP 56 -16.382 -14.242 7.273 420 H TYR 57 H TYR 57 -15.409 -11.435 6.109 421 HA TYR 57 HA TYR 57 -12.567 -11.372 6.887 422 HB2 TYR 57 1HB TYR 57 -12.677 -8.915 6.228 423 HB3 TYR 57 2HB TYR 57 -12.711 -10.077 4.907 424 HD1 TYR 57 2HD TYR 57 -14.792 -10.477 3.659 425 HD2 TYR 57 1HD TYR 57 -14.572 -7.516 6.705 426 HE1 TYR 57 2HE TYR 57 -16.870 -9.465 2.817 427 HE2 TYR 57 1HE TYR 57 -16.650 -6.496 5.873 428 HH TYR 57 HH TYR 57 -18.236 -6.551 4.322 429 H GLU 58 H GLU 58 -12.028 -10.328 8.764 430 HA GLU 58 HA GLU 58 -14.230 -9.160 10.328 431 HB2 GLU 58 1HB GLU 58 -13.819 -11.410 11.168 432 HB3 GLU 58 2HB GLU 58 -12.105 -11.058 11.336 433 HG2 GLU 58 1HG GLU 58 -12.795 -10.779 13.487 434 HG3 GLU 58 2HG GLU 58 -12.968 -9.131 12.885 435 H GLN 59 H GLN 59 -13.764 -7.076 10.555 436 HA GLN 59 HA GLN 59 -11.098 -6.056 10.427 437 HB2 GLN 59 1HB GLN 59 -13.436 -4.952 9.832 438 HB3 GLN 59 2HB GLN 59 -13.339 -4.406 11.501 439 HG2 GLN 59 1HG GLN 59 -10.930 -3.652 10.762 440 HG3 GLN 59 2HG GLN 59 -11.666 -3.671 9.160 441 HE21 GLN 59 1HE2 GLN 59 -10.693 -1.359 10.348 442 HE22 GLN 59 2HE2 GLN 59 -12.017 -0.300 10.678 443 H ARG 60 H ARG 60 -9.680 -6.121 12.028 444 HA ARG 60 HA ARG 60 -10.613 -6.387 14.781 445 HB2 ARG 60 1HB ARG 60 -7.863 -6.646 13.554 446 HB3 ARG 60 2HB ARG 60 -8.200 -6.832 15.270 447 HG2 ARG 60 1HG ARG 60 -9.592 -8.504 13.208 448 HG3 ARG 60 2HG ARG 60 -8.008 -8.943 13.850 449 HD2 ARG 60 1HD ARG 60 -8.874 -9.075 16.077 450 HD3 ARG 60 2HD ARG 60 -10.423 -8.404 15.568 451 HE ARG 60 HE ARG 60 -10.129 -10.667 14.069 452 HH11 ARG 60 2HH1 ARG 60 -10.109 -9.944 17.474 453 HH12 ARG 60 1HH1 ARG 60 -10.735 -11.490 17.939 454 HH21 ARG 60 2HH2 ARG 60 -10.955 -12.707 14.669 455 HH22 ARG 60 1HH2 ARG 60 -11.215 -13.062 16.343 456 H GLU 61 H GLU 61 -8.238 -4.421 12.985 457 HA GLU 61 HA GLU 61 -8.551 -2.336 15.042 458 HB2 GLU 61 1HB GLU 61 -6.244 -2.650 13.119 459 HB3 GLU 61 2HB GLU 61 -6.338 -1.567 14.501 460 HG2 GLU 61 1HG GLU 61 -6.577 -4.507 14.921 461 HG3 GLU 61 2HG GLU 61 -4.991 -3.786 14.655 462 H ARG 62 H ARG 62 -7.629 -0.140 13.847 463 HA ARG 62 HA ARG 62 -9.771 0.686 12.214 464 HB2 ARG 62 1HB ARG 62 -8.523 2.777 11.952 465 HB3 ARG 62 2HB ARG 62 -8.518 2.241 13.627 466 HG2 ARG 62 1HG ARG 62 -6.262 1.455 13.431 467 HG3 ARG 62 2HG ARG 62 -6.256 1.779 11.696 468 HD2 ARG 62 1HD ARG 62 -5.209 3.667 12.425 469 HD3 ARG 62 2HD ARG 62 -6.882 4.215 12.523 470 HE ARG 62 HE ARG 62 -6.091 3.025 14.963 471 HH11 ARG 62 2HH1 ARG 62 -5.664 5.906 13.056 472 HH12 ARG 62 1HH1 ARG 62 -5.347 6.921 14.424 473 HH21 ARG 62 2HH2 ARG 62 -5.675 4.351 16.772 474 HH22 ARG 62 1HH2 ARG 62 -5.353 6.036 16.537 475 H PHE 63 H PHE 63 -6.426 -0.201 11.462 476 HA PHE 63 HA PHE 63 -7.175 -0.274 8.613 477 HB2 PHE 63 1HB PHE 63 -4.518 0.429 9.869 478 HB3 PHE 63 2HB PHE 63 -4.734 0.127 8.149 479 HD1 PHE 63 2HD PHE 63 -6.726 1.541 7.074 480 HD2 PHE 63 1HD PHE 63 -4.551 2.605 10.575 481 HE1 PHE 63 2HE PHE 63 -7.347 3.898 6.740 482 HE2 PHE 63 1HE PHE 63 -5.169 4.964 10.246 483 HZ PHE 63 HZ PHE 63 -6.568 5.613 8.326 484 H LEU 64 H LEU 64 -7.608 -2.440 10.332 485 HA LEU 64 HA LEU 64 -5.760 -4.394 9.164 486 HB2 LEU 64 1HB LEU 64 -4.983 -4.028 11.425 487 HB3 LEU 64 2HB LEU 64 -6.608 -4.290 12.055 488 HG LEU 64 HG LEU 64 -6.476 -6.645 11.294 489 HD11 LEU 64 1HD1 LEU 64 -4.741 -7.510 10.154 490 HD12 LEU 64 2HD1 LEU 64 -3.552 -6.520 10.999 491 HD13 LEU 64 3HD1 LEU 64 -4.483 -5.834 9.667 492 HD21 LEU 64 1HD2 LEU 64 -4.106 -6.066 13.033 493 HD22 LEU 64 2HD2 LEU 64 -5.273 -7.383 13.142 494 HD23 LEU 64 3HD2 LEU 64 -5.746 -5.745 13.595 495 H LEU 65 H LEU 65 -6.716 -6.213 8.426 496 HA LEU 65 HA LEU 65 -9.485 -6.770 9.215 497 HB2 LEU 65 1HB LEU 65 -8.444 -6.436 6.416 498 HB3 LEU 65 2HB LEU 65 -9.923 -7.326 6.773 499 HG LEU 65 HG LEU 65 -9.665 -4.524 7.759 500 HD11 LEU 65 1HD1 LEU 65 -9.996 -5.361 4.906 501 HD12 LEU 65 2HD1 LEU 65 -9.021 -4.058 5.584 502 HD13 LEU 65 3HD1 LEU 65 -10.776 -3.899 5.512 503 HD21 LEU 65 1HD2 LEU 65 -12.128 -4.633 7.067 504 HD22 LEU 65 2HD2 LEU 65 -11.625 -5.584 8.465 505 HD23 LEU 65 3HD2 LEU 65 -11.871 -6.370 6.904 506 H PHE 66 H PHE 66 -9.955 -8.890 9.442 507 HA PHE 66 HA PHE 66 -7.773 -10.783 8.957 508 HB2 PHE 66 1HB PHE 66 -8.853 -10.536 11.250 509 HB3 PHE 66 2HB PHE 66 -10.282 -11.292 10.553 510 HD1 PHE 66 1HD PHE 66 -9.631 -13.517 9.139 511 HD2 PHE 66 2HD PHE 66 -7.487 -11.916 12.449 512 HE1 PHE 66 1HE PHE 66 -8.675 -15.739 9.590 513 HE2 PHE 66 2HE PHE 66 -6.527 -14.136 12.905 514 HZ PHE 66 HZ PHE 66 -7.120 -16.050 11.474 515 H CYS 67 H CYS 67 -7.932 -11.498 6.900 516 HA CYS 67 HA CYS 67 -10.525 -12.205 5.790 517 HB2 CYS 67 1HB CYS 67 -7.754 -12.275 4.578 518 HB3 CYS 67 2HB CYS 67 -9.240 -12.645 3.711 519 HG CYS 67 HG CYS 67 -8.913 -9.617 5.219 520 H VAL 68 H VAL 68 -11.168 -14.258 5.229 521 HA VAL 68 HA VAL 68 -9.384 -16.505 5.734 522 HB VAL 68 HB VAL 68 -10.461 -16.112 7.909 523 HG11 VAL 68 1HG1 VAL 68 -13.100 -16.991 7.393 524 HG12 VAL 68 2HG1 VAL 68 -12.570 -15.432 8.027 525 HG13 VAL 68 3HG1 VAL 68 -12.759 -15.660 6.288 526 HG21 VAL 68 1HG2 VAL 68 -9.868 -18.383 7.280 527 HG22 VAL 68 2HG2 VAL 68 -11.351 -18.380 8.236 528 HG23 VAL 68 3HG2 VAL 68 -11.430 -18.591 6.487 529 H HIS 69 H HIS 69 -9.786 -18.221 4.439 530 HA HIS 69 HA HIS 69 -12.168 -18.056 2.712 531 HB2 HIS 69 1HB HIS 69 -10.123 -17.738 1.442 532 HB3 HIS 69 2HB HIS 69 -9.434 -19.209 2.123 533 HD1 HIS 69 1HD HIS 69 -9.853 -21.327 0.871 534 HD2 HIS 69 2HD HIS 69 -12.384 -18.258 -0.327 535 HE1 HIS 69 1HE HIS 69 -11.094 -22.220 -1.126 536 HE2 HIS 69 2HE HIS 69 -12.558 -20.315 -1.885 537 H GLY 70 H GLY 70 -13.615 -19.376 3.692 538 HA2 GLY 70 1HA GLY 70 -12.709 -22.099 4.383 539 HA3 GLY 70 2HA GLY 70 -14.076 -21.285 5.131 540 H ASP 71 H ASP 71 -12.921 -22.561 2.029 541 HA ASP 71 HA ASP 71 -15.019 -22.454 0.390 542 HB2 ASP 71 1HB ASP 71 -13.078 -24.637 0.951 543 HB3 ASP 71 2HB ASP 71 -14.460 -25.029 -0.068 544 H GLY 72 H GLY 72 -14.831 -24.573 3.211 545 HA2 GLY 72 1HA GLY 72 -17.626 -24.582 3.605 546 HA3 GLY 72 2HA GLY 72 -17.155 -26.064 2.788 547 H HIS 73 H HIS 73 -14.606 -26.347 4.054 548 HA HIS 73 HA HIS 73 -15.320 -26.692 6.880 549 HB2 HIS 73 1HB HIS 73 -14.353 -28.815 4.979 550 HB3 HIS 73 2HB HIS 73 -14.085 -28.952 6.715 551 HD1 HIS 73 1HD HIS 73 -15.830 -31.005 5.253 552 HD2 HIS 73 2HD HIS 73 -17.314 -27.595 7.104 553 HE1 HIS 73 1HE HIS 73 -18.242 -31.509 5.756 554 HE2 HIS 73 2HE HIS 73 -19.141 -29.400 6.798 555 H ALA 74 H ALA 74 -13.697 -26.306 8.295 556 HA ALA 74 HA ALA 74 -11.545 -24.751 7.697 557 HB1 ALA 74 1HB ALA 74 -10.778 -26.480 9.846 558 HB2 ALA 74 2HB ALA 74 -11.299 -24.795 9.902 559 HB3 ALA 74 3HB ALA 74 -12.493 -26.090 9.980 560 H GLU 75 H GLU 75 -11.804 -28.204 7.339 561 HA GLU 75 HA GLU 75 -9.244 -29.110 7.308 562 HB2 GLU 75 1HB GLU 75 -11.445 -29.747 5.339 563 HB3 GLU 75 2HB GLU 75 -9.951 -30.664 5.469 564 HG2 GLU 75 1HG GLU 75 -10.495 -31.253 7.766 565 HG3 GLU 75 2HG GLU 75 -11.979 -30.308 7.664 566 H ASN 76 H ASN 76 -10.866 -27.415 4.641 567 HA ASN 76 HA ASN 76 -8.219 -26.982 3.421 568 HB2 ASN 76 1HB ASN 76 -9.516 -26.657 1.274 569 HB3 ASN 76 2HB ASN 76 -9.525 -28.296 1.916 570 HD21 ASN 76 1HD2 ASN 76 -11.414 -28.702 3.464 571 HD22 ASN 76 2HD2 ASN 76 -12.956 -28.140 2.925 572 H LEU 77 H LEU 77 -9.347 -25.353 5.497 573 HA LEU 77 HA LEU 77 -10.180 -22.913 4.120 574 HB2 LEU 77 1HB LEU 77 -11.466 -23.559 6.065 575 HB3 LEU 77 2HB LEU 77 -10.005 -23.599 7.050 576 HG LEU 77 HG LEU 77 -10.625 -21.017 5.758 577 HD11 LEU 77 1HD1 LEU 77 -12.843 -21.983 6.537 578 HD12 LEU 77 2HD1 LEU 77 -12.387 -20.408 7.183 579 HD13 LEU 77 3HD1 LEU 77 -12.199 -21.854 8.174 580 HD21 LEU 77 1HD2 LEU 77 -9.382 -22.062 8.236 581 HD22 LEU 77 2HD2 LEU 77 -10.144 -20.474 8.320 582 HD23 LEU 77 3HD2 LEU 77 -8.853 -20.772 7.156 583 H VAL 78 H VAL 78 -9.136 -20.879 4.582 584 HA VAL 78 HA VAL 78 -6.357 -21.105 5.509 585 HB VAL 78 HB VAL 78 -7.242 -19.698 2.986 586 HG11 VAL 78 1HG1 VAL 78 -4.520 -19.818 4.280 587 HG12 VAL 78 2HG1 VAL 78 -4.880 -19.112 2.703 588 HG13 VAL 78 3HG1 VAL 78 -5.556 -18.396 4.166 589 HG21 VAL 78 1HG2 VAL 78 -5.790 -22.240 3.549 590 HG22 VAL 78 2HG2 VAL 78 -7.024 -21.893 2.338 591 HG23 VAL 78 3HG2 VAL 78 -5.374 -21.316 2.106 592 H GLN 79 H GLN 79 -5.817 -19.580 6.931 593 HA GLN 79 HA GLN 79 -7.577 -17.235 7.179 594 HB2 GLN 79 1HB GLN 79 -5.901 -18.660 9.247 595 HB3 GLN 79 2HB GLN 79 -6.719 -17.131 9.539 596 HG2 GLN 79 1HG GLN 79 -8.797 -18.084 9.564 597 HG3 GLN 79 2HG GLN 79 -8.313 -19.428 8.531 598 HE21 GLN 79 1HE2 GLN 79 -9.158 -20.979 9.890 599 HE22 GLN 79 2HE2 GLN 79 -8.450 -21.369 11.417 600 H TRP 80 H TRP 80 -6.750 -15.329 6.658 601 HA TRP 80 HA TRP 80 -3.929 -14.779 7.137 602 HB2 TRP 80 1HB TRP 80 -3.396 -14.159 4.928 603 HB3 TRP 80 2HB TRP 80 -4.264 -15.682 4.759 604 HD1 TRP 80 HD TRP 80 -4.554 -11.966 3.976 605 HE1 TRP 80 1HE TRP 80 -6.545 -11.603 2.386 606 HE3 TRP 80 3HE TRP 80 -6.567 -16.664 4.109 607 HZ2 TRP 80 2HZ TRP 80 -8.686 -13.108 1.328 608 HZ3 TRP 80 3HZ TRP 80 -8.587 -17.119 2.780 609 HH2 TRP 80 HH TRP 80 -9.623 -15.376 1.420 610 H GLU 81 H GLU 81 -3.646 -12.785 7.913 611 HA GLU 81 HA GLU 81 -5.938 -11.015 8.068 612 HB2 GLU 81 1HB GLU 81 -3.278 -11.186 9.401 613 HB3 GLU 81 2HB GLU 81 -4.068 -9.617 9.342 614 HG2 GLU 81 1HG GLU 81 -6.008 -10.513 10.474 615 HG3 GLU 81 2HG GLU 81 -5.294 -12.125 10.467 616 H MET 82 H MET 82 -6.328 -9.501 6.607 617 HA MET 82 HA MET 82 -4.189 -8.640 4.817 618 HB2 MET 82 1HB MET 82 -7.170 -8.584 4.728 619 HB3 MET 82 2HB MET 82 -6.286 -7.388 3.790 620 HG2 MET 82 1HG MET 82 -5.654 -10.305 3.573 621 HG3 MET 82 2HG MET 82 -6.970 -9.577 2.653 622 HE1 MET 82 1HE MET 82 -5.599 -8.542 -0.347 623 HE2 MET 82 2HE MET 82 -6.942 -8.608 0.795 624 HE3 MET 82 3HE MET 82 -5.973 -7.140 0.657 625 H GLU 83 H GLU 83 -2.983 -7.158 5.922 626 HA GLU 83 HA GLU 83 -4.365 -4.901 7.181 627 HB2 GLU 83 1HB GLU 83 -2.761 -5.828 8.647 628 HB3 GLU 83 2HB GLU 83 -1.555 -5.962 7.374 629 HG2 GLU 83 1HG GLU 83 -0.801 -4.166 8.605 630 HG3 GLU 83 2HG GLU 83 -1.681 -3.391 7.290 631 H VAL 84 H VAL 84 -4.181 -2.836 6.466 632 HA VAL 84 HA VAL 84 -3.057 -2.470 3.806 633 HB VAL 84 HB VAL 84 -4.684 -0.583 5.516 634 HG11 VAL 84 1HG1 VAL 84 -4.586 0.987 3.881 635 HG12 VAL 84 2HG1 VAL 84 -3.028 0.216 3.577 636 HG13 VAL 84 3HG1 VAL 84 -4.429 -0.205 2.592 637 HG21 VAL 84 1HG2 VAL 84 -5.598 -2.836 4.386 638 HG22 VAL 84 2HG2 VAL 84 -6.569 -1.371 4.538 639 HG23 VAL 84 3HG2 VAL 84 -5.757 -1.737 3.016 640 H CYS 85 H CYS 85 -0.854 -2.343 4.062 641 HA CYS 85 HA CYS 85 0.229 -0.399 5.954 642 HB2 CYS 85 1HB CYS 85 1.128 -2.818 5.545 643 HB3 CYS 85 2HB CYS 85 1.909 -2.099 4.142 644 HG CYS 85 HG CYS 85 3.290 -0.172 5.716 645 H LYS 86 H LYS 86 1.907 1.103 5.237 646 HA LYS 86 HA LYS 86 1.324 2.121 2.538 647 HB2 LYS 86 1HB LYS 86 1.784 4.305 3.311 648 HB3 LYS 86 2HB LYS 86 0.809 3.562 4.572 649 HG2 LYS 86 1HG LYS 86 3.774 3.425 4.788 650 HG3 LYS 86 2HG LYS 86 2.956 4.946 5.155 651 HD2 LYS 86 1HD LYS 86 1.434 3.537 6.664 652 HD3 LYS 86 2HD LYS 86 2.659 2.278 6.503 653 HE2 LYS 86 1HE LYS 86 4.334 3.704 7.458 654 HE3 LYS 86 2HE LYS 86 3.234 5.082 7.447 655 HZ1 LYS 86 1HZ LYS 86 3.238 2.727 9.213 656 HZ2 LYS 86 2HZ LYS 86 1.793 3.562 8.935 657 HZ3 LYS 86 3HZ LYS 86 3.117 4.366 9.616 658 H LEU 87 H LEU 87 2.994 2.731 1.171 659 HA LEU 87 HA LEU 87 5.600 1.565 1.839 660 HB2 LEU 87 1HB LEU 87 4.274 2.266 -0.764 661 HB3 LEU 87 2HB LEU 87 5.990 1.878 -0.660 662 HG LEU 87 HG LEU 87 3.734 0.026 0.106 663 HD11 LEU 87 1HD1 LEU 87 5.515 -0.613 -2.146 664 HD12 LEU 87 2HD1 LEU 87 4.390 0.718 -2.417 665 HD13 LEU 87 3HD1 LEU 87 3.781 -0.872 -1.955 666 HD21 LEU 87 1HD2 LEU 87 5.897 -1.538 -0.210 667 HD22 LEU 87 2HD2 LEU 87 5.399 -0.866 1.343 668 HD23 LEU 87 3HD2 LEU 87 6.667 -0.075 0.405 669 HA PRO 88 HA PRO 88 7.662 5.432 2.068 670 HB2 PRO 88 1HB PRO 88 10.058 4.850 0.932 671 HB3 PRO 88 2HB PRO 88 9.582 4.259 2.528 672 HG2 PRO 88 1HG PRO 88 9.511 2.850 -0.112 673 HG3 PRO 88 2HG PRO 88 10.038 2.240 1.467 674 HD2 PRO 88 1HD PRO 88 7.602 1.677 0.428 675 HD3 PRO 88 2HD PRO 88 7.881 1.839 2.174 676 H ARG 89 H ARG 89 6.231 4.523 -0.608 677 HA ARG 89 HA ARG 89 7.224 6.818 -2.137 678 HB2 ARG 89 1HB ARG 89 7.125 3.978 -3.014 679 HB3 ARG 89 2HB ARG 89 6.651 5.200 -4.186 680 HG2 ARG 89 1HG ARG 89 8.766 6.189 -4.188 681 HG3 ARG 89 2HG ARG 89 9.233 5.398 -2.681 682 HD2 ARG 89 1HD ARG 89 9.380 3.273 -3.760 683 HD3 ARG 89 2HD ARG 89 8.663 3.913 -5.238 684 HE ARG 89 HE ARG 89 10.857 5.422 -5.007 685 HH11 ARG 89 2HH1 ARG 89 10.390 1.982 -4.742 686 HH12 ARG 89 1HH1 ARG 89 11.977 1.591 -5.316 687 HH21 ARG 89 2HH2 ARG 89 12.949 4.920 -5.764 688 HH22 ARG 89 1HH2 ARG 89 13.432 3.263 -5.897 689 H LEU 90 H LEU 90 5.526 8.145 -2.135 690 HA LEU 90 HA LEU 90 2.941 7.804 -1.620 691 HB2 LEU 90 1HB LEU 90 4.251 9.508 -3.697 692 HB3 LEU 90 2HB LEU 90 2.495 9.510 -3.538 693 HG LEU 90 HG LEU 90 3.449 11.389 -2.351 694 HD11 LEU 90 1HD1 LEU 90 2.621 9.434 -0.236 695 HD12 LEU 90 2HD1 LEU 90 1.478 10.024 -1.443 696 HD13 LEU 90 3HD1 LEU 90 2.273 11.160 -0.353 697 HD21 LEU 90 1HD2 LEU 90 5.647 10.097 -1.933 698 HD22 LEU 90 2HD2 LEU 90 4.844 9.521 -0.472 699 HD23 LEU 90 3HD2 LEU 90 5.093 11.250 -0.719 700 H SER 91 H SER 91 4.527 6.682 -4.514 701 HA SER 91 HA SER 91 2.749 6.242 -6.407 702 HB2 SER 91 1HB SER 91 4.876 5.162 -6.580 703 HB3 SER 91 2HB SER 91 4.543 4.140 -5.181 704 HG SER 91 HG SER 91 4.223 3.342 -7.514 705 H LEU 92 H LEU 92 2.760 4.355 -3.397 706 HA LEU 92 HA LEU 92 -0.039 4.172 -3.248 707 HB2 LEU 92 1HB LEU 92 -0.258 1.721 -3.663 708 HB3 LEU 92 2HB LEU 92 0.032 2.697 -5.102 709 HG LEU 92 HG LEU 92 2.550 1.985 -4.581 710 HD11 LEU 92 1HD1 LEU 92 1.230 -0.571 -3.866 711 HD12 LEU 92 2HD1 LEU 92 1.438 0.628 -2.590 712 HD13 LEU 92 3HD1 LEU 92 2.842 0.025 -3.470 713 HD21 LEU 92 1HD2 LEU 92 1.129 1.619 -6.639 714 HD22 LEU 92 2HD2 LEU 92 0.658 0.074 -5.930 715 HD23 LEU 92 3HD2 LEU 92 2.351 0.389 -6.313 716 H ASN 93 H ASN 93 -0.717 2.463 -1.589 717 HA ASN 93 HA ASN 93 1.142 2.641 0.629 718 HB2 ASN 93 1HB ASN 93 -1.566 1.324 0.712 719 HB3 ASN 93 2HB ASN 93 -0.677 2.087 2.027 720 HD21 ASN 93 1HD2 ASN 93 -2.482 2.673 -0.917 721 HD22 ASN 93 2HD2 ASN 93 -2.908 4.308 -0.555 722 H GLY 94 H GLY 94 -0.368 0.154 -1.370 723 HA2 GLY 94 1HA GLY 94 0.556 -1.934 -1.883 724 HA3 GLY 94 2HA GLY 94 1.730 -1.706 -0.595 725 H VAL 95 H VAL 95 0.058 -4.033 -1.224 726 HA VAL 95 HA VAL 95 -1.370 -4.232 1.348 727 HB VAL 95 HB VAL 95 -2.130 -5.569 -1.254 728 HG11 VAL 95 1HG1 VAL 95 -3.066 -5.900 1.558 729 HG12 VAL 95 2HG1 VAL 95 -4.221 -6.083 0.237 730 HG13 VAL 95 3HG1 VAL 95 -2.793 -7.116 0.312 731 HG21 VAL 95 1HG2 VAL 95 -4.279 -4.096 -0.365 732 HG22 VAL 95 2HG2 VAL 95 -2.903 -3.053 -0.007 733 HG23 VAL 95 3HG2 VAL 95 -3.168 -3.630 -1.652 734 H ARG 96 H ARG 96 -0.228 -5.495 2.656 735 HA ARG 96 HA ARG 96 1.331 -7.705 1.527 736 HB2 ARG 96 1HB ARG 96 2.617 -7.688 3.515 737 HB3 ARG 96 2HB ARG 96 2.373 -5.999 3.090 738 HG2 ARG 96 1HG ARG 96 0.664 -5.770 4.766 739 HG3 ARG 96 2HG ARG 96 0.741 -7.496 5.127 740 HD2 ARG 96 1HD ARG 96 1.962 -6.291 6.811 741 HD3 ARG 96 2HD ARG 96 3.101 -7.199 5.818 742 HE ARG 96 HE ARG 96 2.837 -4.601 4.781 743 HH11 ARG 96 2HH1 ARG 96 4.151 -6.277 7.535 744 HH12 ARG 96 1HH1 ARG 96 5.394 -5.104 7.820 745 HH21 ARG 96 2HH2 ARG 96 4.469 -3.050 5.146 746 HH22 ARG 96 1HH2 ARG 96 5.573 -3.268 6.462 747 H PHE 97 H PHE 97 1.090 -9.822 2.206 748 HA PHE 97 HA PHE 97 -1.419 -10.386 3.638 749 HB2 PHE 97 1HB PHE 97 0.089 -11.970 1.557 750 HB3 PHE 97 2HB PHE 97 -1.224 -12.654 2.510 751 HD1 PHE 97 1HD PHE 97 -0.650 -9.476 0.632 752 HD2 PHE 97 2HD PHE 97 -3.199 -12.802 1.371 753 HE1 PHE 97 1HE PHE 97 -2.278 -8.581 -0.981 754 HE2 PHE 97 2HE PHE 97 -4.832 -11.914 -0.241 755 HZ PHE 97 HZ PHE 97 -4.372 -9.801 -1.420 756 H LYS 98 H LYS 98 -1.461 -12.252 5.050 757 HA LYS 98 HA LYS 98 1.137 -13.167 6.032 758 HB2 LYS 98 1HB LYS 98 0.559 -11.219 7.412 759 HB3 LYS 98 2HB LYS 98 -0.990 -11.953 7.807 760 HG2 LYS 98 1HG LYS 98 0.104 -13.734 9.000 761 HG3 LYS 98 2HG LYS 98 1.689 -13.137 8.506 762 HD2 LYS 98 1HD LYS 98 1.417 -12.350 10.698 763 HD3 LYS 98 2HD LYS 98 1.038 -10.960 9.678 764 HE2 LYS 98 1HE LYS 98 -1.403 -11.782 9.868 765 HE3 LYS 98 2HE LYS 98 -0.817 -12.723 11.239 766 HZ1 LYS 98 1HZ LYS 98 -0.037 -9.935 11.238 767 HZ2 LYS 98 2HZ LYS 98 -0.606 -10.901 12.505 768 HZ3 LYS 98 3HZ LYS 98 -1.697 -10.207 11.415 769 H ARG 99 H ARG 99 1.066 -15.307 6.046 770 HA ARG 99 HA ARG 99 -1.434 -16.729 6.028 771 HB2 ARG 99 1HB ARG 99 0.425 -17.515 4.661 772 HB3 ARG 99 2HB ARG 99 1.420 -17.723 6.095 773 HG2 ARG 99 1HG ARG 99 0.181 -19.564 6.831 774 HG3 ARG 99 2HG ARG 99 -1.168 -19.194 5.754 775 HD2 ARG 99 1HD ARG 99 -0.077 -21.011 4.749 776 HD3 ARG 99 2HD ARG 99 0.465 -19.600 3.841 777 HE ARG 99 HE ARG 99 2.059 -21.246 5.634 778 HH11 ARG 99 2HH1 ARG 99 1.814 -18.366 3.692 779 HH12 ARG 99 1HH1 ARG 99 3.527 -18.121 3.608 780 HH21 ARG 99 2HH2 ARG 99 4.316 -20.933 5.529 781 HH22 ARG 99 1HH2 ARG 99 4.949 -19.582 4.652 782 H ILE 100 H ILE 100 -2.496 -16.692 7.935 783 HA ILE 100 HA ILE 100 -1.110 -17.007 10.447 784 HB ILE 100 HB ILE 100 -4.062 -16.865 9.826 785 HG12 ILE 100 1HG1 ILE 100 -2.109 -14.830 10.921 786 HG13 ILE 100 2HG1 ILE 100 -2.901 -14.782 9.350 787 HG21 ILE 100 1HG2 ILE 100 -3.395 -18.122 11.930 788 HG22 ILE 100 2HG2 ILE 100 -2.796 -16.579 12.535 789 HG23 ILE 100 3HG2 ILE 100 -4.503 -16.766 12.136 790 HD11 ILE 100 1HD1 ILE 100 -3.814 -13.300 11.222 791 HD12 ILE 100 2HD1 ILE 100 -4.963 -14.244 10.274 792 HD13 ILE 100 3HD1 ILE 100 -4.491 -14.788 11.884 793 H SER 101 H SER 101 -3.413 -18.906 8.522 794 HA SER 101 HA SER 101 -2.298 -21.365 9.510 795 HB2 SER 101 1HB SER 101 -5.078 -20.512 10.325 796 HB3 SER 101 2HB SER 101 -4.558 -22.197 10.333 797 HG SER 101 HG SER 101 -2.685 -20.885 11.588 798 H GLY 102 H GLY 102 -3.549 -23.284 8.586 799 HA2 GLY 102 1HA GLY 102 -5.098 -24.043 6.874 800 HA3 GLY 102 2HA GLY 102 -4.772 -22.553 6.002 801 H THR 103 H THR 103 -3.830 -23.116 4.150 802 HA THR 103 HA THR 103 -1.404 -24.764 4.297 803 HB THR 103 HB THR 103 -2.056 -25.795 2.087 804 HG1 THR 103 1HG THR 103 -3.895 -24.104 1.983 805 HG21 THR 103 1HG2 THR 103 -3.202 -26.377 4.732 806 HG22 THR 103 2HG2 THR 103 -2.315 -27.424 3.625 807 HG23 THR 103 3HG2 THR 103 -4.037 -27.136 3.378 808 H SER 104 H SER 104 0.107 -24.408 2.584 809 HA SER 104 HA SER 104 0.328 -21.686 1.828 810 HB2 SER 104 1HB SER 104 2.186 -22.825 0.270 811 HB3 SER 104 2HB SER 104 2.423 -22.594 2.002 812 HG SER 104 HG SER 104 2.163 -24.692 2.340 813 H ILE 105 H ILE 105 -0.036 -24.610 -0.185 814 HA ILE 105 HA ILE 105 -0.276 -23.613 -2.664 815 HB ILE 105 HB ILE 105 -1.988 -25.726 -1.373 816 HG12 ILE 105 1HG1 ILE 105 0.282 -26.409 -1.550 817 HG13 ILE 105 2HG1 ILE 105 -0.559 -27.183 -2.889 818 HG21 ILE 105 1HG2 ILE 105 -2.754 -26.383 -3.576 819 HG22 ILE 105 2HG2 ILE 105 -3.224 -24.717 -3.245 820 HG23 ILE 105 3HG2 ILE 105 -1.859 -25.052 -4.309 821 HD11 ILE 105 1HD1 ILE 105 0.232 -25.163 -4.267 822 HD12 ILE 105 2HD1 ILE 105 1.367 -24.901 -2.942 823 HD13 ILE 105 3HD1 ILE 105 1.400 -26.415 -3.846 824 H ALA 106 H ALA 106 -3.194 -24.040 -0.653 825 HA ALA 106 HA ALA 106 -4.903 -22.531 -2.250 826 HB1 ALA 106 1HB ALA 106 -5.541 -24.082 -0.373 827 HB2 ALA 106 2HB ALA 106 -5.145 -22.771 0.740 828 HB3 ALA 106 3HB ALA 106 -6.437 -22.564 -0.442 829 H PHE 107 H PHE 107 -2.925 -21.536 0.520 830 HA PHE 107 HA PHE 107 -3.787 -18.958 0.886 831 HB2 PHE 107 1HB PHE 107 -2.083 -20.048 2.290 832 HB3 PHE 107 2HB PHE 107 -0.920 -19.920 0.975 833 HD1 PHE 107 1HD PHE 107 -2.772 -18.087 3.544 834 HD2 PHE 107 2HD PHE 107 0.118 -17.819 0.430 835 HE1 PHE 107 1HE PHE 107 -2.105 -15.863 4.359 836 HE2 PHE 107 2HE PHE 107 0.790 -15.595 1.241 837 HZ PHE 107 HZ PHE 107 -0.321 -14.615 3.208 838 H LYS 108 H LYS 108 -1.485 -20.144 -1.525 839 HA LYS 108 HA LYS 108 -1.088 -17.509 -2.642 840 HB2 LYS 108 1HB LYS 108 -0.096 -20.261 -3.324 841 HB3 LYS 108 2HB LYS 108 0.134 -18.924 -4.442 842 HG2 LYS 108 1HG LYS 108 1.604 -17.833 -3.051 843 HG3 LYS 108 2HG LYS 108 0.979 -18.619 -1.599 844 HD2 LYS 108 1HD LYS 108 3.096 -19.588 -1.993 845 HD3 LYS 108 2HD LYS 108 1.916 -20.781 -2.540 846 HE2 LYS 108 1HE LYS 108 2.383 -20.408 -4.774 847 HE3 LYS 108 2HE LYS 108 3.031 -18.796 -4.475 848 HZ1 LYS 108 1HZ LYS 108 4.503 -21.036 -4.860 849 HZ2 LYS 108 2HZ LYS 108 4.521 -20.879 -3.176 850 HZ3 LYS 108 3HZ LYS 108 5.066 -19.607 -4.149 851 H ASN 109 H ASN 109 -2.459 -20.575 -3.847 852 HA ASN 109 HA ASN 109 -3.366 -19.862 -6.293 853 HB2 ASN 109 1HB ASN 109 -4.519 -21.642 -4.183 854 HB3 ASN 109 2HB ASN 109 -5.456 -21.336 -5.642 855 HD21 ASN 109 1HD2 ASN 109 -2.760 -22.946 -4.268 856 HD22 ASN 109 2HD2 ASN 109 -2.276 -23.814 -5.682 857 H ILE 110 H ILE 110 -4.968 -19.137 -3.217 858 HA ILE 110 HA ILE 110 -7.183 -17.800 -4.431 859 HB ILE 110 HB ILE 110 -7.315 -18.825 -2.182 860 HG12 ILE 110 1HG1 ILE 110 -8.470 -16.870 -1.077 861 HG13 ILE 110 2HG1 ILE 110 -7.877 -15.863 -2.394 862 HG21 ILE 110 1HG2 ILE 110 -4.963 -17.906 -1.594 863 HG22 ILE 110 2HG2 ILE 110 -5.845 -16.471 -1.073 864 HG23 ILE 110 3HG2 ILE 110 -6.182 -18.032 -0.327 865 HD11 ILE 110 1HD1 ILE 110 -9.347 -16.716 -3.887 866 HD12 ILE 110 2HD1 ILE 110 -9.368 -18.308 -3.128 867 HD13 ILE 110 3HD1 ILE 110 -10.280 -16.978 -2.414 868 H ALA 111 H ALA 111 -4.185 -16.734 -2.868 869 HA ALA 111 HA ALA 111 -4.537 -14.028 -2.748 870 HB1 ALA 111 1HB ALA 111 -2.141 -13.790 -2.915 871 HB2 ALA 111 2HB ALA 111 -2.525 -15.233 -1.975 872 HB3 ALA 111 3HB ALA 111 -2.002 -15.387 -3.653 873 H SER 112 H SER 112 -3.676 -15.941 -5.595 874 HA SER 112 HA SER 112 -3.050 -13.972 -7.403 875 HB2 SER 112 1HB SER 112 -2.945 -16.389 -7.901 876 HB3 SER 112 2HB SER 112 -4.707 -16.445 -7.961 877 HG SER 112 HG SER 112 -2.891 -15.329 -9.770 878 H LYS 113 H LYS 113 -6.312 -15.313 -6.868 879 HA LYS 113 HA LYS 113 -7.733 -13.647 -8.545 880 HB2 LYS 113 1HB LYS 113 -8.541 -14.844 -5.892 881 HB3 LYS 113 2HB LYS 113 -9.668 -14.046 -6.981 882 HG2 LYS 113 1HG LYS 113 -9.556 -15.731 -8.549 883 HG3 LYS 113 2HG LYS 113 -7.983 -16.295 -7.983 884 HD2 LYS 113 1HD LYS 113 -9.073 -17.083 -5.897 885 HD3 LYS 113 2HD LYS 113 -10.634 -16.620 -6.580 886 HE2 LYS 113 1HE LYS 113 -10.546 -18.862 -7.105 887 HE3 LYS 113 2HE LYS 113 -9.896 -18.130 -8.572 888 HZ1 LYS 113 1HZ LYS 113 -7.800 -18.862 -8.122 889 HZ2 LYS 113 2HZ LYS 113 -8.683 -20.112 -7.402 890 HZ3 LYS 113 3HZ LYS 113 -8.026 -18.882 -6.445 891 H ILE 114 H ILE 114 -7.440 -13.174 -5.018 892 HA ILE 114 HA ILE 114 -8.577 -10.749 -4.699 893 HB ILE 114 HB ILE 114 -5.951 -11.557 -3.443 894 HG12 ILE 114 1HG1 ILE 114 -7.779 -13.219 -3.165 895 HG13 ILE 114 2HG1 ILE 114 -7.284 -12.486 -1.643 896 HG21 ILE 114 1HG2 ILE 114 -6.009 -9.509 -2.564 897 HG22 ILE 114 2HG2 ILE 114 -7.648 -9.222 -3.143 898 HG23 ILE 114 3HG2 ILE 114 -7.388 -10.068 -1.618 899 HD11 ILE 114 1HD1 ILE 114 -9.658 -11.549 -3.226 900 HD12 ILE 114 2HD1 ILE 114 -9.748 -12.770 -1.955 901 HD13 ILE 114 3HD1 ILE 114 -9.223 -11.131 -1.569 902 H ALA 115 H ALA 115 -5.189 -11.239 -5.682 903 HA ALA 115 HA ALA 115 -4.521 -8.535 -5.977 904 HB1 ALA 115 1HB ALA 115 -3.413 -10.999 -7.308 905 HB2 ALA 115 2HB ALA 115 -2.707 -9.391 -7.482 906 HB3 ALA 115 3HB ALA 115 -2.780 -10.155 -5.894 907 H ASN 116 H ASN 116 -5.233 -10.862 -8.593 908 HA ASN 116 HA ASN 116 -5.320 -9.194 -10.732 909 HB2 ASN 116 1HB ASN 116 -6.914 -11.632 -10.038 910 HB3 ASN 116 2HB ASN 116 -7.296 -10.744 -11.509 911 HD21 ASN 116 1HD2 ASN 116 -5.403 -13.126 -10.158 912 HD22 ASN 116 2HD2 ASN 116 -4.228 -13.279 -11.416 913 H GLU 117 H GLU 117 -7.893 -9.679 -8.355 914 HA GLU 117 HA GLU 117 -9.744 -7.941 -9.674 915 HB2 GLU 117 1HB GLU 117 -9.771 -8.840 -6.790 916 HB3 GLU 117 2HB GLU 117 -11.130 -8.219 -7.715 917 HG2 GLU 117 1HG GLU 117 -10.473 -10.290 -9.267 918 HG3 GLU 117 2HG GLU 117 -9.899 -10.900 -7.716 919 H LEU 118 H LEU 118 -7.421 -7.605 -7.047 920 HA LEU 118 HA LEU 118 -8.201 -4.862 -6.534 921 HB2 LEU 118 1HB LEU 118 -6.249 -6.781 -5.352 922 HB3 LEU 118 2HB LEU 118 -6.033 -5.055 -5.066 923 HG LEU 118 HG LEU 118 -8.657 -6.363 -4.461 924 HD11 LEU 118 1HD1 LEU 118 -6.736 -6.112 -2.245 925 HD12 LEU 118 2HD1 LEU 118 -6.418 -7.415 -3.390 926 HD13 LEU 118 3HD1 LEU 118 -7.968 -7.336 -2.552 927 HD21 LEU 118 1HD2 LEU 118 -9.069 -4.502 -3.197 928 HD22 LEU 118 2HD2 LEU 118 -8.032 -3.805 -4.443 929 HD23 LEU 118 3HD2 LEU 118 -7.361 -4.212 -2.863 930 H LYS 119 H LYS 119 -7.020 -5.797 -9.154 931 HA LYS 119 HA LYS 119 -5.439 -5.168 -10.685 932 HB2 LYS 119 1HB LYS 119 -6.280 -2.684 -9.258 933 HB3 LYS 119 2HB LYS 119 -4.963 -2.576 -10.419 934 HG2 LYS 119 1HG LYS 119 -7.688 -3.695 -11.037 935 HG3 LYS 119 2HG LYS 119 -7.181 -2.037 -11.370 936 HD2 LYS 119 1HD LYS 119 -5.213 -3.175 -12.634 937 HD3 LYS 119 2HD LYS 119 -6.266 -4.591 -12.634 938 HE2 LYS 119 1HE LYS 119 -6.867 -3.605 -14.618 939 HE3 LYS 119 2HE LYS 119 -8.045 -2.884 -13.521 940 HZ1 LYS 119 1HZ LYS 119 -5.479 -1.532 -14.031 941 HZ2 LYS 119 2HZ LYS 119 -6.954 -0.869 -13.536 942 HZ3 LYS 119 3HZ LYS 119 -6.750 -1.378 -15.136 943 H LEU 120 H LEU 120 -4.305 -6.345 -8.366 944 HA LEU 120 HA LEU 120 -1.946 -4.756 -7.740 945 HB2 LEU 120 1HB LEU 120 -2.678 -7.523 -6.798 946 HB3 LEU 120 2HB LEU 120 -1.418 -6.482 -6.139 947 HG LEU 120 HG LEU 120 -4.365 -5.851 -6.031 948 HD11 LEU 120 1HD1 LEU 120 -4.578 -6.990 -4.117 949 HD12 LEU 120 2HD1 LEU 120 -2.975 -6.525 -3.547 950 HD13 LEU 120 3HD1 LEU 120 -3.155 -7.876 -4.666 951 HD21 LEU 120 1HD2 LEU 120 -3.768 -3.871 -5.222 952 HD22 LEU 120 2HD2 LEU 120 -2.101 -4.248 -5.657 953 HD23 LEU 120 3HD2 LEU 120 -2.697 -4.622 -4.039 954 H SER 121 H SER 121 0.166 -5.382 -8.206 955 HA SER 121 HA SER 121 0.884 -6.200 -10.637 956 HB2 SER 121 1HB SER 121 2.327 -5.626 -8.488 957 HB3 SER 121 2HB SER 121 2.511 -7.379 -8.425 958 HG SER 121 HG SER 121 3.440 -5.551 -10.320 959 H GLY 122 H GLY 122 0.659 -8.517 -7.927 960 HA2 GLY 122 1HA GLY 122 -0.255 -10.670 -7.997 961 HA3 GLY 122 2HA GLY 122 -0.395 -10.530 -9.743 962 HA PRO 123 HA PRO 123 4.190 -11.774 -8.744 963 HB2 PRO 123 1HB PRO 123 4.626 -12.713 -6.234 964 HB3 PRO 123 2HB PRO 123 4.812 -11.009 -6.669 965 HG2 PRO 123 1HG PRO 123 2.514 -12.383 -5.329 966 HG3 PRO 123 2HG PRO 123 3.262 -10.821 -4.946 967 HD2 PRO 123 1HD PRO 123 0.953 -11.025 -6.345 968 HD3 PRO 123 2HD PRO 123 2.126 -9.722 -6.623 969 H SER 124 H SER 124 1.305 -13.297 -8.362 970 HA SER 124 HA SER 124 1.518 -15.819 -7.537 971 HB2 SER 124 1HB SER 124 -0.325 -14.666 -9.001 972 HB3 SER 124 2HB SER 124 0.507 -15.459 -10.338 973 HG SER 124 HG SER 124 -1.103 -16.815 -9.556 974 H SER 125 H SER 125 2.747 -17.559 -7.855 975 HA SER 125 HA SER 125 4.767 -17.455 -9.968 976 HB2 SER 125 1HB SER 125 5.568 -17.858 -7.688 977 HB3 SER 125 2HB SER 125 4.529 -19.277 -7.560 978 HG SER 125 HG SER 125 5.803 -19.867 -9.620 979 H GLY 126 H GLY 126 2.273 -19.622 -8.673 980 HA2 GLY 126 1HA GLY 126 1.946 -20.780 -11.325 981 HA3 GLY 126 2HA GLY 126 2.460 -21.887 -10.061 Start of MODEL 20 1 H1 MET 1 H MET 1 27.426 -28.123 10.002 2 HA MET 1 HA MET 1 28.481 -29.385 7.584 3 HB2 MET 1 1HB MET 1 26.780 -31.132 8.031 4 HB3 MET 1 2HB MET 1 27.892 -30.902 9.374 5 HG2 MET 1 1HG MET 1 26.243 -29.649 10.592 6 HG3 MET 1 2HG MET 1 25.140 -29.700 9.219 7 HE1 MET 1 1HE MET 1 23.733 -31.165 8.614 8 HE2 MET 1 2HE MET 1 23.564 -32.867 9.042 9 HE3 MET 1 3HE MET 1 22.865 -31.623 10.079 10 H LYS 2 H LYS 2 27.071 -29.844 5.785 11 HA LYS 2 HA LYS 2 25.803 -28.995 4.073 12 HB2 LYS 2 1HB LYS 2 24.231 -30.290 5.649 13 HB3 LYS 2 2HB LYS 2 23.653 -28.709 6.160 14 HG2 LYS 2 1HG LYS 2 22.965 -28.196 3.895 15 HG3 LYS 2 2HG LYS 2 23.611 -29.739 3.330 16 HD2 LYS 2 1HD LYS 2 21.277 -30.049 3.575 17 HD3 LYS 2 2HD LYS 2 22.026 -30.851 4.958 18 HE2 LYS 2 1HE LYS 2 21.413 -29.112 6.426 19 HE3 LYS 2 2HE LYS 2 21.022 -28.022 5.097 20 HZ1 LYS 2 1HZ LYS 2 19.260 -29.594 6.467 21 HZ2 LYS 2 2HZ LYS 2 19.480 -30.425 5.011 22 HZ3 LYS 2 3HZ LYS 2 18.963 -28.815 4.994 23 H ASP 3 H ASP 3 27.378 -26.991 5.195 24 HA ASP 3 HA ASP 3 27.579 -24.729 5.462 25 HB2 ASP 3 1HB ASP 3 25.299 -24.424 3.535 26 HB3 ASP 3 2HB ASP 3 26.792 -23.496 3.645 27 H HIS 4 H HIS 4 26.002 -25.835 7.456 28 HA HIS 4 HA HIS 4 23.997 -23.718 7.886 29 HB2 HIS 4 1HB HIS 4 22.814 -25.789 7.641 30 HB3 HIS 4 2HB HIS 4 23.922 -26.617 8.732 31 HD1 HIS 4 1HD HIS 4 20.828 -24.631 8.665 32 HD2 HIS 4 2HD HIS 4 23.593 -25.893 11.498 33 HE1 HIS 4 1HE HIS 4 19.712 -24.288 10.893 34 HE2 HIS 4 2HE HIS 4 21.436 -24.979 12.594 35 H LEU 5 H LEU 5 25.453 -22.366 8.955 36 HA LEU 5 HA LEU 5 26.270 -23.322 11.618 37 HB2 LEU 5 1HB LEU 5 27.817 -21.888 9.535 38 HB3 LEU 5 2HB LEU 5 28.087 -21.416 11.212 39 HG LEU 5 HG LEU 5 29.753 -23.026 10.499 40 HD11 LEU 5 1HD1 LEU 5 29.692 -23.638 12.631 41 HD12 LEU 5 2HD1 LEU 5 28.611 -24.951 12.166 42 HD13 LEU 5 3HD1 LEU 5 27.944 -23.411 12.705 43 HD21 LEU 5 1HD2 LEU 5 27.516 -24.259 9.222 44 HD22 LEU 5 2HD2 LEU 5 28.271 -25.419 10.316 45 HD23 LEU 5 3HD2 LEU 5 29.233 -24.633 9.063 46 H ILE 6 H ILE 6 26.302 -21.739 13.291 47 HA ILE 6 HA ILE 6 24.355 -19.602 12.837 48 HB ILE 6 HB ILE 6 25.456 -20.702 15.426 49 HG12 ILE 6 1HG1 ILE 6 22.669 -21.007 14.310 50 HG13 ILE 6 2HG1 ILE 6 23.939 -22.190 14.019 51 HG21 ILE 6 1HG2 ILE 6 22.985 -19.085 15.371 52 HG22 ILE 6 2HG2 ILE 6 24.261 -19.170 16.584 53 HG23 ILE 6 3HG2 ILE 6 24.501 -18.219 15.119 54 HD11 ILE 6 1HD1 ILE 6 23.152 -23.175 15.856 55 HD12 ILE 6 2HD1 ILE 6 24.036 -21.920 16.726 56 HD13 ILE 6 3HD1 ILE 6 22.315 -21.718 16.395 57 H HIS 7 H HIS 7 25.049 -17.608 12.490 58 HA HIS 7 HA HIS 7 27.110 -16.424 14.091 59 HB2 HIS 7 1HB HIS 7 28.500 -17.599 12.442 60 HB3 HIS 7 2HB HIS 7 27.629 -16.804 11.134 61 HD1 HIS 7 1HD HIS 7 30.396 -16.330 13.519 62 HD2 HIS 7 2HD HIS 7 28.166 -13.995 10.905 63 HE1 HIS 7 1HE HIS 7 31.688 -14.188 13.263 64 HE2 HIS 7 2HE HIS 7 30.277 -12.758 11.744 65 H ASN 8 H ASN 8 26.229 -14.526 14.550 66 HA ASN 8 HA ASN 8 24.947 -13.011 12.373 67 HB2 ASN 8 1HB ASN 8 23.990 -13.563 15.152 68 HB3 ASN 8 2HB ASN 8 23.581 -12.021 14.406 69 HD21 ASN 8 1HD2 ASN 8 23.781 -15.384 13.281 70 HD22 ASN 8 2HD2 ASN 8 22.202 -15.420 12.581 71 H VAL 9 H VAL 9 25.757 -11.046 12.038 72 HA VAL 9 HA VAL 9 26.970 -9.554 14.224 73 HB VAL 9 HB VAL 9 28.967 -9.021 12.732 74 HG11 VAL 9 1HG1 VAL 9 28.555 -11.693 14.039 75 HG12 VAL 9 2HG1 VAL 9 30.115 -11.207 13.374 76 HG13 VAL 9 3HG1 VAL 9 29.380 -10.271 14.675 77 HG21 VAL 9 1HG2 VAL 9 28.308 -11.651 11.435 78 HG22 VAL 9 2HG2 VAL 9 27.858 -10.106 10.714 79 HG23 VAL 9 3HG2 VAL 9 29.558 -10.490 10.988 80 H HIS 10 H HIS 10 26.171 -7.570 14.129 81 HA HIS 10 HA HIS 10 24.851 -6.586 11.784 82 HB2 HIS 10 1HB HIS 10 23.798 -5.844 13.707 83 HB3 HIS 10 2HB HIS 10 25.315 -5.568 14.558 84 HD1 HIS 10 1HD HIS 10 23.366 -4.044 11.669 85 HD2 HIS 10 2HD HIS 10 26.035 -2.960 14.662 86 HE1 HIS 10 1HE HIS 10 23.573 -1.543 11.511 87 HE2 HIS 10 2HE HIS 10 25.259 -0.919 13.275 88 H LYS 11 H LYS 11 25.745 -5.527 10.153 89 HA LYS 11 HA LYS 11 27.957 -3.701 10.611 90 HB2 LYS 11 1HB LYS 11 28.183 -6.234 9.028 91 HB3 LYS 11 2HB LYS 11 29.104 -4.820 8.535 92 HG2 LYS 11 1HG LYS 11 29.220 -6.003 11.298 93 HG3 LYS 11 2HG LYS 11 30.334 -6.427 9.996 94 HD2 LYS 11 1HD LYS 11 29.951 -3.547 10.626 95 HD3 LYS 11 2HD LYS 11 30.893 -4.524 11.754 96 HE2 LYS 11 1HE LYS 11 32.565 -3.866 10.354 97 HE3 LYS 11 2HE LYS 11 32.052 -5.328 9.512 98 HZ1 LYS 11 1HZ LYS 11 30.429 -3.461 8.456 99 HZ2 LYS 11 2HZ LYS 11 31.882 -3.974 7.759 100 HZ3 LYS 11 3HZ LYS 11 31.846 -2.568 8.699 101 H GLU 12 H GLU 12 28.578 -2.624 8.451 102 HA GLU 12 HA GLU 12 26.300 -1.379 7.395 103 HB2 GLU 12 1HB GLU 12 29.189 -1.452 6.596 104 HB3 GLU 12 2HB GLU 12 28.012 -0.662 5.556 105 HG2 GLU 12 1HG GLU 12 28.789 1.080 6.840 106 HG3 GLU 12 2HG GLU 12 27.322 0.608 7.696 107 H GLU 13 H GLU 13 25.301 -1.509 5.370 108 HA GLU 13 HA GLU 13 25.503 -4.152 4.122 109 HB2 GLU 13 1HB GLU 13 23.295 -3.115 4.987 110 HB3 GLU 13 2HB GLU 13 23.365 -2.123 3.537 111 HG2 GLU 13 1HG GLU 13 23.630 -4.372 2.296 112 HG3 GLU 13 2HG GLU 13 23.004 -5.078 3.785 113 H HIS 14 H HIS 14 25.959 -4.444 1.984 114 HA HIS 14 HA HIS 14 26.455 -2.060 0.344 115 HB2 HIS 14 1HB HIS 14 28.460 -3.591 -0.542 116 HB3 HIS 14 2HB HIS 14 28.661 -2.450 0.784 117 HD1 HIS 14 1HD HIS 14 28.769 -6.044 -0.030 118 HD2 HIS 14 2HD HIS 14 28.740 -3.667 3.377 119 HE1 HIS 14 1HE HIS 14 29.485 -7.554 1.849 120 HE2 HIS 14 2HE HIS 14 29.377 -6.116 3.914 121 H ALA 15 H ALA 15 24.644 -2.428 -0.904 122 HA ALA 15 HA ALA 15 23.457 -4.596 -1.877 123 HB1 ALA 15 1HB ALA 15 22.473 -2.818 -2.838 124 HB2 ALA 15 2HB ALA 15 23.996 -1.952 -3.041 125 HB3 ALA 15 3HB ALA 15 23.532 -3.202 -4.195 126 H HIS 16 H HIS 16 23.912 -6.358 -3.035 127 HA HIS 16 HA HIS 16 26.592 -6.848 -3.907 128 HB2 HIS 16 1HB HIS 16 24.054 -8.463 -4.209 129 HB3 HIS 16 2HB HIS 16 25.648 -9.032 -4.696 130 HD1 HIS 16 1HD HIS 16 23.817 -10.323 -2.442 131 HD2 HIS 16 2HD HIS 16 27.072 -7.815 -1.831 132 HE1 HIS 16 1HE HIS 16 24.624 -10.824 -0.113 133 HE2 HIS 16 2HE HIS 16 26.540 -9.234 0.265 134 H ALA 17 H ALA 17 26.933 -7.868 -6.144 135 HA ALA 17 HA ALA 17 26.655 -5.944 -8.108 136 HB1 ALA 17 1HB ALA 17 28.299 -7.566 -8.465 137 HB2 ALA 17 2HB ALA 17 27.159 -8.897 -8.266 138 HB3 ALA 17 3HB ALA 17 27.094 -7.889 -9.712 139 H HIS 18 H HIS 18 25.582 -6.528 -10.338 140 HA HIS 18 HA HIS 18 22.731 -6.712 -9.801 141 HB2 HIS 18 1HB HIS 18 24.401 -5.781 -12.102 142 HB3 HIS 18 2HB HIS 18 22.723 -6.231 -12.392 143 HD1 HIS 18 1HD HIS 18 21.937 -3.857 -12.888 144 HD2 HIS 18 2HD HIS 18 23.728 -4.260 -9.161 145 HE1 HIS 18 1HE HIS 18 21.448 -1.711 -11.672 146 HE2 HIS 18 2HE HIS 18 22.614 -1.944 -9.451 147 H ASN 19 H ASN 19 24.439 -9.100 -9.635 148 HA ASN 19 HA ASN 19 23.610 -10.695 -11.929 149 HB2 ASN 19 1HB ASN 19 25.463 -11.149 -9.610 150 HB3 ASN 19 2HB ASN 19 24.876 -12.514 -10.556 151 HD21 ASN 19 1HD2 ASN 19 27.487 -10.827 -10.188 152 HD22 ASN 19 2HD2 ASN 19 28.068 -10.696 -11.810 153 H LYS 20 H LYS 20 22.987 -13.079 -11.166 154 HA LYS 20 HA LYS 20 20.507 -12.747 -9.689 155 HB2 LYS 20 1HB LYS 20 20.329 -15.273 -10.360 156 HB3 LYS 20 2HB LYS 20 20.092 -14.019 -11.570 157 HG2 LYS 20 1HG LYS 20 22.838 -15.074 -11.197 158 HG3 LYS 20 2HG LYS 20 21.652 -16.110 -11.993 159 HD2 LYS 20 1HD LYS 20 22.100 -13.260 -12.837 160 HD3 LYS 20 2HD LYS 20 23.070 -14.589 -13.478 161 HE2 LYS 20 1HE LYS 20 21.153 -15.637 -14.420 162 HE3 LYS 20 2HE LYS 20 20.060 -14.550 -13.565 163 HZ1 LYS 20 1HZ LYS 20 20.503 -12.832 -14.991 164 HZ2 LYS 20 2HZ LYS 20 20.624 -14.143 -16.052 165 HZ3 LYS 20 3HZ LYS 20 22.025 -13.423 -15.435 166 H ASP 21 H ASP 21 22.619 -12.409 -8.001 167 HA ASP 21 HA ASP 21 22.408 -14.797 -6.305 168 HB2 ASP 21 1HB ASP 21 24.643 -14.672 -7.507 169 HB3 ASP 21 2HB ASP 21 24.967 -13.217 -6.569 170 H TYR 22 H TYR 22 20.837 -13.705 -5.085 171 HA TYR 22 HA TYR 22 21.924 -11.560 -3.386 172 HB2 TYR 22 1HB TYR 22 19.357 -10.909 -3.275 173 HB3 TYR 22 2HB TYR 22 20.400 -10.305 -4.558 174 HD1 TYR 22 2HD TYR 22 20.506 -11.867 -6.700 175 HD2 TYR 22 1HD TYR 22 17.333 -11.850 -3.865 176 HE1 TYR 22 2HE TYR 22 19.003 -12.840 -8.385 177 HE2 TYR 22 1HE TYR 22 15.821 -12.825 -5.542 178 HH TYR 22 HH TYR 22 15.576 -13.159 -7.827 179 H ASP 23 H ASP 23 20.476 -11.299 -1.363 180 HA ASP 23 HA ASP 23 20.202 -13.960 -0.187 181 HB2 ASP 23 1HB ASP 23 19.934 -12.529 1.958 182 HB3 ASP 23 2HB ASP 23 21.522 -12.624 1.202 183 H ILE 24 H ILE 24 18.195 -14.109 -1.617 184 HA ILE 24 HA ILE 24 15.881 -12.669 -1.266 185 HB ILE 24 HB ILE 24 15.742 -15.657 -1.473 186 HG12 ILE 24 1HG1 ILE 24 15.992 -14.968 -4.060 187 HG13 ILE 24 2HG1 ILE 24 17.049 -13.756 -3.345 188 HG21 ILE 24 1HG2 ILE 24 13.653 -14.434 -1.447 189 HG22 ILE 24 2HG2 ILE 24 14.212 -13.401 -2.761 190 HG23 ILE 24 3HG2 ILE 24 13.928 -15.117 -3.050 191 HD11 ILE 24 1HD1 ILE 24 17.583 -16.488 -3.898 192 HD12 ILE 24 2HD1 ILE 24 18.665 -15.254 -3.251 193 HD13 ILE 24 3HD1 ILE 24 17.690 -16.233 -2.156 194 HA PRO 25 HA PRO 25 14.700 -13.342 2.935 195 HB2 PRO 25 1HB PRO 25 12.115 -12.538 2.729 196 HB3 PRO 25 2HB PRO 25 13.475 -11.409 2.731 197 HG2 PRO 25 1HG PRO 25 11.912 -12.489 0.417 198 HG3 PRO 25 2HG PRO 25 12.471 -10.833 0.714 199 HD2 PRO 25 1HD PRO 25 13.753 -12.524 -0.968 200 HD3 PRO 25 2HD PRO 25 14.608 -11.288 -0.022 201 H THR 26 H THR 26 14.437 -15.343 3.696 202 HA THR 26 HA THR 26 12.799 -17.290 2.354 203 HB THR 26 HB THR 26 13.494 -18.835 4.112 204 HG1 THR 26 1HG THR 26 15.173 -17.700 5.601 205 HG21 THR 26 1HG2 THR 26 16.122 -17.922 3.897 206 HG22 THR 26 2HG2 THR 26 15.311 -17.323 2.449 207 HG23 THR 26 3HG2 THR 26 15.299 -19.047 2.817 208 H THR 27 H THR 27 11.195 -15.176 3.066 209 HA THR 27 HA THR 27 9.792 -15.909 5.513 210 HB THR 27 HB THR 27 8.344 -13.929 4.963 211 HG1 THR 27 1HG THR 27 8.946 -12.618 3.263 212 HG21 THR 27 1HG2 THR 27 10.256 -13.732 6.482 213 HG22 THR 27 2HG2 THR 27 10.044 -12.261 5.533 214 HG23 THR 27 3HG2 THR 27 11.315 -13.407 5.111 215 H GLU 28 H GLU 28 7.363 -15.979 5.418 216 HA GLU 28 HA GLU 28 6.501 -17.466 3.024 217 HB2 GLU 28 1HB GLU 28 5.692 -17.814 5.913 218 HB3 GLU 28 2HB GLU 28 4.874 -18.600 4.570 219 HG2 GLU 28 1HG GLU 28 6.820 -19.851 4.014 220 HG3 GLU 28 2HG GLU 28 7.804 -18.930 5.149 221 H ASN 29 H ASN 29 6.309 -14.707 3.050 222 HA ASN 29 HA ASN 29 3.396 -14.330 3.243 223 HB2 ASN 29 1HB ASN 29 5.491 -12.225 3.825 224 HB3 ASN 29 2HB ASN 29 3.745 -12.011 3.915 225 HD21 ASN 29 1HD2 ASN 29 6.500 -13.644 5.336 226 HD22 ASN 29 2HD2 ASN 29 5.775 -13.928 6.879 227 H LEU 30 H LEU 30 2.470 -12.886 1.703 228 HA LEU 30 HA LEU 30 4.085 -12.650 -0.743 229 HB2 LEU 30 1HB LEU 30 1.167 -13.041 -0.236 230 HB3 LEU 30 2HB LEU 30 1.703 -12.306 -1.746 231 HG LEU 30 HG LEU 30 2.502 -15.046 -0.764 232 HD11 LEU 30 1HD1 LEU 30 0.823 -14.613 -3.172 233 HD12 LEU 30 2HD1 LEU 30 0.053 -14.477 -1.592 234 HD13 LEU 30 3HD1 LEU 30 0.869 -15.972 -2.048 235 HD21 LEU 30 1HD2 LEU 30 3.085 -13.521 -3.293 236 HD22 LEU 30 2HD2 LEU 30 3.289 -15.267 -3.143 237 HD23 LEU 30 3HD2 LEU 30 4.238 -14.177 -2.130 238 H TYR 31 H TYR 31 3.812 -10.756 -2.070 239 HA TYR 31 HA TYR 31 2.903 -8.387 -0.574 240 HB2 TYR 31 1HB TYR 31 5.235 -8.312 -2.475 241 HB3 TYR 31 2HB TYR 31 4.786 -7.140 -1.240 242 HD1 TYR 31 1HD TYR 31 4.606 -8.414 1.215 243 HD2 TYR 31 2HD TYR 31 7.183 -9.438 -2.012 244 HE1 TYR 31 1HE TYR 31 6.154 -9.484 2.799 245 HE2 TYR 31 2HE TYR 31 8.737 -10.512 -0.437 246 HH TYR 31 HH TYR 31 9.310 -10.426 1.931 247 H PHE 32 H PHE 32 1.943 -6.741 -1.759 248 HA PHE 32 HA PHE 32 1.691 -6.985 -4.635 249 HB2 PHE 32 1HB PHE 32 -0.818 -6.989 -2.955 250 HB3 PHE 32 2HB PHE 32 -0.692 -7.176 -4.701 251 HD1 PHE 32 1HD PHE 32 -0.095 -8.815 -1.459 252 HD2 PHE 32 2HD PHE 32 -0.242 -9.285 -5.687 253 HE1 PHE 32 1HE PHE 32 -0.022 -11.259 -1.186 254 HE2 PHE 32 2HE PHE 32 -0.170 -11.730 -5.421 255 HZ PHE 32 HZ PHE 32 -0.060 -12.720 -3.169 256 H GLN 33 H GLN 33 1.288 -5.058 -5.622 257 HA GLN 33 HA GLN 33 0.671 -2.761 -3.888 258 HB2 GLN 33 1HB GLN 33 2.267 -1.399 -5.095 259 HB3 GLN 33 2HB GLN 33 3.081 -2.820 -4.452 260 HG2 GLN 33 1HG GLN 33 2.617 -3.830 -6.794 261 HG3 GLN 33 2HG GLN 33 2.399 -2.149 -7.278 262 HE21 GLN 33 1HE2 GLN 33 4.177 -0.676 -6.862 263 HE22 GLN 33 2HE2 GLN 33 5.797 -1.275 -6.914 264 H GLY 34 H GLY 34 -0.875 -1.416 -4.611 265 HA2 GLY 34 1HA GLY 34 -1.507 -0.560 -7.090 266 HA3 GLY 34 2HA GLY 34 -2.275 -2.140 -7.039 267 H SER 35 H SER 35 -2.008 0.811 -5.057 268 HA SER 35 HA SER 35 -4.398 0.386 -3.627 269 HB2 SER 35 1HB SER 35 -4.190 2.717 -2.932 270 HB3 SER 35 2HB SER 35 -2.610 1.936 -2.891 271 HG SER 35 HG SER 35 -3.418 4.073 -4.324 272 H SER 36 H SER 36 -6.363 1.704 -3.748 273 HA SER 36 HA SER 36 -7.063 2.351 -6.537 274 HB2 SER 36 1HB SER 36 -8.158 0.294 -5.435 275 HB3 SER 36 2HB SER 36 -9.063 1.459 -4.468 276 HG SER 36 HG SER 36 -9.604 0.633 -6.908 277 H GLY 37 H GLY 37 -5.935 4.259 -4.823 278 HA2 GLY 37 1HA GLY 37 -6.847 6.586 -5.047 279 HA3 GLY 37 2HA GLY 37 -8.263 5.972 -4.207 280 H SER 38 H SER 38 -8.203 5.661 -1.995 281 HA SER 38 HA SER 38 -5.825 6.770 -0.654 282 HB2 SER 38 1HB SER 38 -8.744 6.896 0.122 283 HB3 SER 38 2HB SER 38 -7.431 7.370 1.199 284 HG SER 38 HG SER 38 -6.793 8.840 -0.546 285 H SER 39 H SER 39 -5.331 5.920 1.477 286 HA SER 39 HA SER 39 -5.084 3.167 1.555 287 HB2 SER 39 1HB SER 39 -3.658 4.485 2.944 288 HB3 SER 39 2HB SER 39 -5.030 5.206 3.784 289 HG SER 39 HG SER 39 -5.497 3.039 4.548 290 H GLY 40 H GLY 40 -7.588 5.219 2.979 291 HA2 GLY 40 1HA GLY 40 -8.922 3.285 4.490 292 HA3 GLY 40 2HA GLY 40 -9.670 4.720 3.804 293 H ASP 41 H ASP 41 -10.017 4.506 1.325 294 HA ASP 41 HA ASP 41 -12.028 2.860 0.725 295 HB2 ASP 41 1HB ASP 41 -11.531 4.308 -1.005 296 HB3 ASP 41 2HB ASP 41 -9.813 3.919 -0.978 297 H MET 42 H MET 42 -8.611 1.947 0.439 298 HA MET 42 HA MET 42 -8.658 -0.476 -0.715 299 HB2 MET 42 1HB MET 42 -7.205 0.154 1.861 300 HB3 MET 42 2HB MET 42 -6.815 -1.166 0.766 301 HG2 MET 42 1HG MET 42 -6.681 1.765 0.094 302 HG3 MET 42 2HG MET 42 -5.309 0.736 0.495 303 HE1 MET 42 1HE MET 42 -5.228 -1.754 -2.511 304 HE2 MET 42 2HE MET 42 -4.551 -1.320 -0.941 305 HE3 MET 42 3HE MET 42 -6.173 -2.006 -1.044 306 H MET 43 H MET 43 -9.497 0.104 2.693 307 HA MET 43 HA MET 43 -10.048 -2.525 3.420 308 HB2 MET 43 1HB MET 43 -11.605 -0.163 4.454 309 HB3 MET 43 2HB MET 43 -11.184 -1.644 5.303 310 HG2 MET 43 1HG MET 43 -8.731 -0.807 4.848 311 HG3 MET 43 2HG MET 43 -9.535 0.758 4.742 312 HE1 MET 43 1HE MET 43 -10.345 -2.391 7.155 313 HE2 MET 43 2HE MET 43 -8.613 -2.283 6.841 314 HE3 MET 43 3HE MET 43 -9.241 -1.935 8.453 315 H ARG 44 H ARG 44 -12.167 -0.082 1.972 316 HA ARG 44 HA ARG 44 -14.504 -1.701 2.018 317 HB2 ARG 44 1HB ARG 44 -13.728 0.814 0.567 318 HB3 ARG 44 2HB ARG 44 -15.247 0.002 0.213 319 HG2 ARG 44 1HG ARG 44 -16.178 0.566 2.208 320 HG3 ARG 44 2HG ARG 44 -14.630 0.576 3.054 321 HD2 ARG 44 1HD ARG 44 -15.535 2.829 2.871 322 HD3 ARG 44 2HD ARG 44 -14.039 2.675 1.950 323 HE ARG 44 HE ARG 44 -15.219 3.210 0.079 324 HH11 ARG 44 2HH1 ARG 44 -17.436 1.973 2.461 325 HH12 ARG 44 1HH1 ARG 44 -18.844 2.273 1.497 326 HH21 ARG 44 2HH2 ARG 44 -17.065 3.610 -1.200 327 HH22 ARG 44 1HH2 ARG 44 -18.632 3.204 -0.586 328 H GLU 45 H GLU 45 -12.087 -0.974 -0.475 329 HA GLU 45 HA GLU 45 -13.303 -2.408 -2.564 330 HB2 GLU 45 1HB GLU 45 -11.435 -0.746 -2.797 331 HB3 GLU 45 2HB GLU 45 -10.341 -1.971 -2.170 332 HG2 GLU 45 1HG GLU 45 -10.926 -3.431 -4.059 333 HG3 GLU 45 2HG GLU 45 -11.962 -2.157 -4.699 334 H ILE 46 H ILE 46 -10.523 -3.373 -0.545 335 HA ILE 46 HA ILE 46 -10.063 -5.895 -1.355 336 HB ILE 46 HB ILE 46 -10.260 -5.044 1.536 337 HG12 ILE 46 1HG1 ILE 46 -7.692 -5.299 0.034 338 HG13 ILE 46 2HG1 ILE 46 -8.687 -3.874 -0.250 339 HG21 ILE 46 1HG2 ILE 46 -8.513 -6.893 1.793 340 HG22 ILE 46 2HG2 ILE 46 -10.194 -7.381 1.584 341 HG23 ILE 46 3HG2 ILE 46 -9.076 -7.467 0.223 342 HD11 ILE 46 1HD1 ILE 46 -6.955 -4.501 1.963 343 HD12 ILE 46 2HD1 ILE 46 -7.699 -2.968 1.510 344 HD13 ILE 46 3HD1 ILE 46 -8.586 -4.116 2.511 345 H ARG 47 H ARG 47 -12.397 -5.205 1.259 346 HA ARG 47 HA ARG 47 -13.483 -7.667 1.622 347 HB2 ARG 47 1HB ARG 47 -14.950 -5.025 1.554 348 HB3 ARG 47 2HB ARG 47 -15.614 -6.512 2.216 349 HG2 ARG 47 1HG ARG 47 -14.153 -6.511 4.020 350 HG3 ARG 47 2HG ARG 47 -13.021 -5.416 3.225 351 HD2 ARG 47 1HD ARG 47 -14.252 -4.281 5.002 352 HD3 ARG 47 2HD ARG 47 -14.629 -3.594 3.423 353 HE ARG 47 HE ARG 47 -16.519 -5.580 4.042 354 HH11 ARG 47 2HH1 ARG 47 -15.556 -2.384 5.033 355 HH12 ARG 47 1HH1 ARG 47 -17.141 -1.932 5.569 356 HH21 ARG 47 2HH2 ARG 47 -18.609 -4.996 4.745 357 HH22 ARG 47 1HH2 ARG 47 -18.876 -3.419 5.406 358 H LYS 48 H LYS 48 -14.553 -5.303 -0.815 359 HA LYS 48 HA LYS 48 -16.647 -6.503 -1.995 360 HB2 LYS 48 1HB LYS 48 -15.461 -4.399 -2.746 361 HB3 LYS 48 2HB LYS 48 -14.341 -5.433 -3.624 362 HG2 LYS 48 1HG LYS 48 -17.254 -5.775 -4.108 363 HG3 LYS 48 2HG LYS 48 -16.439 -4.368 -4.796 364 HD2 LYS 48 1HD LYS 48 -15.252 -7.091 -5.137 365 HD3 LYS 48 2HD LYS 48 -16.595 -6.583 -6.164 366 HE2 LYS 48 1HE LYS 48 -14.705 -5.980 -7.387 367 HE3 LYS 48 2HE LYS 48 -15.192 -4.477 -6.604 368 HZ1 LYS 48 1HZ LYS 48 -13.199 -6.251 -5.347 369 HZ2 LYS 48 2HZ LYS 48 -13.444 -4.594 -5.112 370 HZ3 LYS 48 3HZ LYS 48 -12.735 -5.149 -6.544 371 H VAL 49 H VAL 49 -13.258 -7.402 -2.542 372 HA VAL 49 HA VAL 49 -13.814 -9.455 -4.418 373 HB VAL 49 HB VAL 49 -11.390 -9.377 -2.633 374 HG11 VAL 49 1HG1 VAL 49 -10.328 -10.626 -4.263 375 HG12 VAL 49 2HG1 VAL 49 -11.966 -11.281 -4.307 376 HG13 VAL 49 3HG1 VAL 49 -11.447 -10.119 -5.528 377 HG21 VAL 49 1HG2 VAL 49 -11.955 -7.729 -5.093 378 HG22 VAL 49 2HG2 VAL 49 -11.625 -7.139 -3.464 379 HG23 VAL 49 3HG2 VAL 49 -10.352 -7.939 -4.387 380 H LEU 50 H LEU 50 -13.068 -9.538 -0.939 381 HA LEU 50 HA LEU 50 -13.121 -12.262 -0.521 382 HB2 LEU 50 1HB LEU 50 -14.277 -10.214 1.360 383 HB3 LEU 50 2HB LEU 50 -13.625 -11.797 1.779 384 HG LEU 50 HG LEU 50 -11.937 -9.605 0.593 385 HD11 LEU 50 1HD1 LEU 50 -13.174 -9.462 3.057 386 HD12 LEU 50 2HD1 LEU 50 -11.734 -8.577 2.556 387 HD13 LEU 50 3HD1 LEU 50 -11.573 -10.101 3.428 388 HD21 LEU 50 1HD2 LEU 50 -11.336 -12.164 0.689 389 HD22 LEU 50 2HD2 LEU 50 -10.957 -11.785 2.370 390 HD23 LEU 50 3HD2 LEU 50 -10.131 -10.931 1.065 391 H GLY 51 H GLY 51 -15.890 -10.058 -0.022 392 HA2 GLY 51 1HA GLY 51 -17.834 -11.964 0.452 393 HA3 GLY 51 2HA GLY 51 -18.146 -10.400 -0.284 394 H ALA 52 H ALA 52 -16.626 -10.798 -2.655 395 HA ALA 52 HA ALA 52 -18.539 -11.968 -4.317 396 HB1 ALA 52 1HB ALA 52 -16.495 -10.362 -4.796 397 HB2 ALA 52 2HB ALA 52 -15.714 -11.883 -5.232 398 HB3 ALA 52 3HB ALA 52 -17.188 -11.380 -6.059 399 H ASN 53 H ASN 53 -15.519 -13.291 -3.018 400 HA ASN 53 HA ASN 53 -16.118 -15.886 -4.225 401 HB2 ASN 53 1HB ASN 53 -13.680 -14.636 -3.023 402 HB3 ASN 53 2HB ASN 53 -13.807 -16.393 -3.054 403 HD21 ASN 53 1HD2 ASN 53 -13.888 -13.509 -5.069 404 HD22 ASN 53 2HD2 ASN 53 -13.334 -14.281 -6.512 405 H ASN 54 H ASN 54 -17.895 -15.110 -2.235 406 HA ASN 54 HA ASN 54 -18.718 -15.630 -0.151 407 HB2 ASN 54 1HB ASN 54 -17.641 -18.373 -0.796 408 HB3 ASN 54 2HB ASN 54 -19.100 -17.963 0.102 409 HD21 ASN 54 1HD2 ASN 54 -17.608 -17.986 -3.068 410 HD22 ASN 54 2HD2 ASN 54 -19.081 -17.976 -3.970 411 H CYS 55 H CYS 55 -16.188 -14.512 0.121 412 HA CYS 55 HA CYS 55 -14.773 -16.190 2.052 413 HB2 CYS 55 1HB CYS 55 -14.033 -13.517 0.842 414 HB3 CYS 55 2HB CYS 55 -13.026 -14.435 1.955 415 HG CYS 55 HG CYS 55 -13.979 -15.557 -1.135 416 H ASP 56 H ASP 56 -14.392 -15.561 4.178 417 HA ASP 56 HA ASP 56 -16.308 -13.591 5.211 418 HB2 ASP 56 1HB ASP 56 -14.780 -15.505 6.944 419 HB3 ASP 56 2HB ASP 56 -16.361 -14.779 7.217 420 H TYR 57 H TYR 57 -15.677 -11.820 6.324 421 HA TYR 57 HA TYR 57 -12.841 -11.536 7.020 422 HB2 TYR 57 1HB TYR 57 -12.960 -9.159 6.167 423 HB3 TYR 57 2HB TYR 57 -12.968 -10.406 4.925 424 HD1 TYR 57 2HD TYR 57 -15.090 -10.959 3.750 425 HD2 TYR 57 1HD TYR 57 -14.805 -7.679 6.445 426 HE1 TYR 57 2HE TYR 57 -17.158 -10.015 2.810 427 HE2 TYR 57 1HE TYR 57 -16.873 -6.727 5.514 428 HH TYR 57 HH TYR 57 -18.149 -7.532 2.668 429 H GLU 58 H GLU 58 -12.441 -10.415 8.871 430 HA GLU 58 HA GLU 58 -14.705 -9.090 10.193 431 HB2 GLU 58 1HB GLU 58 -13.705 -10.086 12.368 432 HB3 GLU 58 2HB GLU 58 -14.727 -11.100 11.359 433 HG2 GLU 58 1HG GLU 58 -12.666 -12.042 10.333 434 HG3 GLU 58 2HG GLU 58 -11.723 -11.128 11.509 435 H GLN 59 H GLN 59 -14.046 -7.025 10.154 436 HA GLN 59 HA GLN 59 -11.400 -6.125 10.201 437 HB2 GLN 59 1HB GLN 59 -13.712 -4.917 9.691 438 HB3 GLN 59 2HB GLN 59 -13.539 -4.408 11.366 439 HG2 GLN 59 1HG GLN 59 -11.109 -3.769 10.528 440 HG3 GLN 59 2HG GLN 59 -11.946 -3.671 8.980 441 HE21 GLN 59 1HE2 GLN 59 -10.871 -1.421 9.848 442 HE22 GLN 59 2HE2 GLN 59 -12.067 -0.329 10.449 443 H ARG 60 H ARG 60 -10.010 -6.594 11.782 444 HA ARG 60 HA ARG 60 -10.889 -6.765 14.540 445 HB2 ARG 60 1HB ARG 60 -8.301 -7.326 13.118 446 HB3 ARG 60 2HB ARG 60 -8.367 -7.244 14.873 447 HG2 ARG 60 1HG ARG 60 -10.249 -9.017 13.376 448 HG3 ARG 60 2HG ARG 60 -8.592 -9.532 13.699 449 HD2 ARG 60 1HD ARG 60 -9.076 -8.914 16.135 450 HD3 ARG 60 2HD ARG 60 -10.772 -8.880 15.658 451 HE ARG 60 HE ARG 60 -9.992 -11.290 14.778 452 HH11 ARG 60 2HH1 ARG 60 -9.574 -9.680 17.837 453 HH12 ARG 60 1HH1 ARG 60 -9.564 -11.149 18.756 454 HH21 ARG 60 2HH2 ARG 60 -9.981 -13.230 15.978 455 HH22 ARG 60 1HH2 ARG 60 -9.795 -13.167 17.698 456 H GLU 61 H GLU 61 -8.548 -4.846 12.666 457 HA GLU 61 HA GLU 61 -8.604 -2.841 14.825 458 HB2 GLU 61 1HB GLU 61 -6.411 -3.411 12.823 459 HB3 GLU 61 2HB GLU 61 -6.379 -2.123 14.019 460 HG2 GLU 61 1HG GLU 61 -6.662 -5.010 14.781 461 HG3 GLU 61 2HG GLU 61 -5.094 -4.237 14.560 462 H ARG 62 H ARG 62 -7.637 -0.653 13.682 463 HA ARG 62 HA ARG 62 -9.785 0.369 12.199 464 HB2 ARG 62 1HB ARG 62 -8.463 1.886 13.473 465 HB3 ARG 62 2HB ARG 62 -6.986 1.390 12.657 466 HG2 ARG 62 1HG ARG 62 -7.419 2.649 10.802 467 HG3 ARG 62 2HG ARG 62 -9.168 2.575 11.026 468 HD2 ARG 62 1HD ARG 62 -8.733 4.761 11.597 469 HD3 ARG 62 2HD ARG 62 -8.661 3.972 13.172 470 HE ARG 62 HE ARG 62 -6.104 3.880 12.429 471 HH11 ARG 62 2HH1 ARG 62 -8.417 6.480 12.327 472 HH12 ARG 62 1HH1 ARG 62 -7.226 7.722 12.535 473 HH21 ARG 62 2HH2 ARG 62 -4.527 5.505 12.704 474 HH22 ARG 62 1HH2 ARG 62 -5.014 7.166 12.748 475 H PHE 63 H PHE 63 -6.441 -0.250 11.113 476 HA PHE 63 HA PHE 63 -7.459 -0.404 8.357 477 HB2 PHE 63 1HB PHE 63 -4.774 0.360 9.482 478 HB3 PHE 63 2HB PHE 63 -4.958 -0.113 7.796 479 HD1 PHE 63 2HD PHE 63 -6.586 1.201 6.360 480 HD2 PHE 63 1HD PHE 63 -5.244 2.534 10.173 481 HE1 PHE 63 2HE PHE 63 -7.254 3.499 5.788 482 HE2 PHE 63 1HE PHE 63 -5.910 4.834 9.608 483 HZ PHE 63 HZ PHE 63 -6.916 5.319 7.412 484 H LEU 64 H LEU 64 -7.943 -2.633 9.774 485 HA LEU 64 HA LEU 64 -6.106 -4.553 8.554 486 HB2 LEU 64 1HB LEU 64 -5.433 -4.204 10.925 487 HB3 LEU 64 2HB LEU 64 -7.029 -4.769 11.415 488 HG LEU 64 HG LEU 64 -6.463 -6.944 10.234 489 HD11 LEU 64 1HD1 LEU 64 -3.598 -6.320 10.583 490 HD12 LEU 64 2HD1 LEU 64 -4.392 -5.622 9.173 491 HD13 LEU 64 3HD1 LEU 64 -4.401 -7.368 9.414 492 HD21 LEU 64 1HD2 LEU 64 -5.203 -7.788 12.134 493 HD22 LEU 64 2HD2 LEU 64 -6.463 -6.677 12.672 494 HD23 LEU 64 3HD2 LEU 64 -4.783 -6.142 12.608 495 H LEU 65 H LEU 65 -7.023 -6.626 8.182 496 HA LEU 65 HA LEU 65 -9.829 -7.039 8.780 497 HB2 LEU 65 1HB LEU 65 -8.788 -6.444 6.053 498 HB3 LEU 65 2HB LEU 65 -10.092 -7.618 6.226 499 HG LEU 65 HG LEU 65 -10.298 -4.840 7.355 500 HD11 LEU 65 1HD1 LEU 65 -11.371 -4.105 5.355 501 HD12 LEU 65 2HD1 LEU 65 -11.256 -5.710 4.636 502 HD13 LEU 65 3HD1 LEU 65 -9.795 -4.761 4.912 503 HD21 LEU 65 1HD2 LEU 65 -12.029 -6.021 8.257 504 HD22 LEU 65 2HD2 LEU 65 -12.114 -7.149 6.903 505 HD23 LEU 65 3HD2 LEU 65 -12.776 -5.522 6.739 506 H PHE 66 H PHE 66 -10.120 -9.106 9.277 507 HA PHE 66 HA PHE 66 -8.023 -11.018 8.851 508 HB2 PHE 66 1HB PHE 66 -9.627 -10.823 10.875 509 HB3 PHE 66 2HB PHE 66 -10.769 -11.701 9.864 510 HD1 PHE 66 2HD PHE 66 -7.248 -11.911 11.066 511 HD2 PHE 66 1HD PHE 66 -10.786 -13.998 9.953 512 HE1 PHE 66 2HE PHE 66 -6.204 -14.034 11.741 513 HE2 PHE 66 1HE PHE 66 -9.748 -16.125 10.627 514 HZ PHE 66 HZ PHE 66 -7.454 -16.145 11.521 515 H CYS 67 H CYS 67 -7.833 -11.408 6.667 516 HA CYS 67 HA CYS 67 -10.132 -12.123 5.078 517 HB2 CYS 67 1HB CYS 67 -7.177 -12.190 4.430 518 HB3 CYS 67 2HB CYS 67 -8.471 -12.468 3.271 519 HG CYS 67 HG CYS 67 -8.722 -9.568 4.928 520 H VAL 68 H VAL 68 -11.012 -14.073 5.104 521 HA VAL 68 HA VAL 68 -9.271 -16.425 5.276 522 HB VAL 68 HB VAL 68 -10.045 -16.159 7.537 523 HG11 VAL 68 1HG1 VAL 68 -12.641 -16.369 7.840 524 HG12 VAL 68 2HG1 VAL 68 -11.896 -14.797 7.541 525 HG13 VAL 68 3HG1 VAL 68 -12.676 -15.671 6.222 526 HG21 VAL 68 1HG2 VAL 68 -10.329 -18.427 6.086 527 HG22 VAL 68 2HG2 VAL 68 -10.580 -18.327 7.829 528 HG23 VAL 68 3HG2 VAL 68 -11.959 -18.241 6.734 529 H HIS 69 H HIS 69 -9.825 -18.024 3.914 530 HA HIS 69 HA HIS 69 -12.453 -17.851 2.592 531 HB2 HIS 69 1HB HIS 69 -10.836 -17.163 0.976 532 HB3 HIS 69 2HB HIS 69 -9.754 -18.487 1.399 533 HD1 HIS 69 1HD HIS 69 -10.106 -20.700 0.228 534 HD2 HIS 69 2HD HIS 69 -13.119 -17.951 -0.559 535 HE1 HIS 69 1HE HIS 69 -11.474 -21.713 -1.623 536 HE2 HIS 69 2HE HIS 69 -13.240 -19.994 -2.140 537 H GLY 70 H GLY 70 -13.579 -19.449 3.558 538 HA2 GLY 70 1HA GLY 70 -12.323 -22.124 3.624 539 HA3 GLY 70 2HA GLY 70 -13.472 -21.566 4.832 540 H ASP 71 H ASP 71 -15.450 -20.456 3.318 541 HA ASP 71 HA ASP 71 -17.341 -20.976 2.165 542 HB2 ASP 71 1HB ASP 71 -15.395 -21.323 0.384 543 HB3 ASP 71 2HB ASP 71 -15.926 -22.999 0.493 544 H GLY 72 H GLY 72 -16.411 -22.618 4.482 545 HA2 GLY 72 1HA GLY 72 -17.421 -24.309 5.693 546 HA3 GLY 72 2HA GLY 72 -18.474 -24.611 4.319 547 H HIS 73 H HIS 73 -14.959 -24.626 4.208 548 HA HIS 73 HA HIS 73 -14.953 -27.550 4.065 549 HB2 HIS 73 1HB HIS 73 -14.237 -25.666 1.875 550 HB3 HIS 73 2HB HIS 73 -13.221 -27.090 2.083 551 HD1 HIS 73 1HD HIS 73 -14.610 -27.103 -0.479 552 HD2 HIS 73 2HD HIS 73 -16.486 -28.463 2.969 553 HE1 HIS 73 1HE HIS 73 -16.463 -28.607 -1.271 554 HE2 HIS 73 2HE HIS 73 -17.638 -29.350 0.830 555 H ALA 74 H ALA 74 -13.688 -27.993 5.766 556 HA ALA 74 HA ALA 74 -11.710 -26.427 6.886 557 HB1 ALA 74 1HB ALA 74 -12.216 -29.373 6.900 558 HB2 ALA 74 2HB ALA 74 -10.780 -28.714 7.684 559 HB3 ALA 74 3HB ALA 74 -12.384 -28.200 8.207 560 H GLU 75 H GLU 75 -11.510 -28.634 4.166 561 HA GLU 75 HA GLU 75 -8.666 -28.663 4.005 562 HB2 GLU 75 1HB GLU 75 -9.037 -29.620 1.748 563 HB3 GLU 75 2HB GLU 75 -9.938 -30.456 3.005 564 HG2 GLU 75 1HG GLU 75 -11.875 -28.882 2.324 565 HG3 GLU 75 2HG GLU 75 -10.940 -28.654 0.847 566 H ASN 76 H ASN 76 -11.203 -26.691 2.572 567 HA ASN 76 HA ASN 76 -9.177 -25.110 1.153 568 HB2 ASN 76 1HB ASN 76 -12.191 -25.052 0.881 569 HB3 ASN 76 2HB ASN 76 -11.044 -24.160 -0.114 570 HD21 ASN 76 1HD2 ASN 76 -12.801 -26.990 0.222 571 HD22 ASN 76 2HD2 ASN 76 -12.041 -27.916 -1.023 572 H LEU 77 H LEU 77 -9.348 -24.884 3.965 573 HA LEU 77 HA LEU 77 -10.512 -22.197 4.286 574 HB2 LEU 77 1HB LEU 77 -11.526 -23.841 5.752 575 HB3 LEU 77 2HB LEU 77 -9.938 -24.313 6.355 576 HG LEU 77 HG LEU 77 -9.925 -21.693 6.991 577 HD11 LEU 77 1HD1 LEU 77 -12.445 -21.806 8.108 578 HD12 LEU 77 2HD1 LEU 77 -12.693 -22.383 6.460 579 HD13 LEU 77 3HD1 LEU 77 -11.952 -20.808 6.740 580 HD21 LEU 77 1HD2 LEU 77 -9.382 -22.962 8.769 581 HD22 LEU 77 2HD2 LEU 77 -10.582 -24.198 8.388 582 HD23 LEU 77 3HD2 LEU 77 -11.071 -22.717 9.214 583 H VAL 78 H VAL 78 -9.159 -20.555 4.586 584 HA VAL 78 HA VAL 78 -6.511 -21.060 5.737 585 HB VAL 78 HB VAL 78 -6.955 -19.457 3.214 586 HG11 VAL 78 1HG1 VAL 78 -4.732 -18.851 3.254 587 HG12 VAL 78 2HG1 VAL 78 -5.140 -18.792 4.970 588 HG13 VAL 78 3HG1 VAL 78 -4.277 -20.184 4.315 589 HG21 VAL 78 1HG2 VAL 78 -5.222 -21.337 2.472 590 HG22 VAL 78 2HG2 VAL 78 -6.074 -22.242 3.723 591 HG23 VAL 78 3HG2 VAL 78 -6.967 -21.565 2.361 592 H GLN 79 H GLN 79 -5.851 -19.529 7.134 593 HA GLN 79 HA GLN 79 -7.532 -17.125 7.384 594 HB2 GLN 79 1HB GLN 79 -5.939 -18.638 9.456 595 HB3 GLN 79 2HB GLN 79 -6.693 -17.078 9.756 596 HG2 GLN 79 1HG GLN 79 -8.815 -17.939 9.732 597 HG3 GLN 79 2HG GLN 79 -8.366 -19.304 8.710 598 HE21 GLN 79 1HE2 GLN 79 -9.189 -20.890 9.990 599 HE22 GLN 79 2HE2 GLN 79 -8.568 -21.277 11.556 600 H TRP 80 H TRP 80 -6.627 -15.274 6.810 601 HA TRP 80 HA TRP 80 -3.844 -14.739 7.442 602 HB2 TRP 80 1HB TRP 80 -3.100 -14.305 5.252 603 HB3 TRP 80 2HB TRP 80 -3.986 -15.822 5.117 604 HD1 TRP 80 HD TRP 80 -4.074 -12.194 3.994 605 HE1 TRP 80 1HE TRP 80 -5.919 -11.909 2.221 606 HE3 TRP 80 3HE TRP 80 -6.299 -16.779 4.394 607 HZ2 TRP 80 2HZ TRP 80 -8.038 -13.427 1.137 608 HZ3 TRP 80 3HZ TRP 80 -8.230 -17.283 2.954 609 HH2 TRP 80 HH TRP 80 -9.080 -15.640 1.360 610 H GLU 81 H GLU 81 -3.418 -12.590 7.747 611 HA GLU 81 HA GLU 81 -5.742 -10.806 7.602 612 HB2 GLU 81 1HB GLU 81 -3.252 -10.833 9.278 613 HB3 GLU 81 2HB GLU 81 -4.171 -9.347 9.078 614 HG2 GLU 81 1HG GLU 81 -5.624 -11.803 9.900 615 HG3 GLU 81 2HG GLU 81 -4.609 -10.985 11.087 616 H MET 82 H MET 82 -5.587 -8.725 6.716 617 HA MET 82 HA MET 82 -3.210 -8.219 5.057 618 HB2 MET 82 1HB MET 82 -6.094 -8.243 4.260 619 HB3 MET 82 2HB MET 82 -4.989 -7.140 3.453 620 HG2 MET 82 1HG MET 82 -3.609 -8.982 2.734 621 HG3 MET 82 2HG MET 82 -4.611 -10.118 3.634 622 HE1 MET 82 1HE MET 82 -5.749 -7.799 -0.135 623 HE2 MET 82 2HE MET 82 -6.374 -7.125 1.371 624 HE3 MET 82 3HE MET 82 -4.635 -7.307 1.141 625 H GLU 83 H GLU 83 -2.298 -6.530 6.067 626 HA GLU 83 HA GLU 83 -4.015 -4.329 6.975 627 HB2 GLU 83 1HB GLU 83 -2.493 -5.268 8.652 628 HB3 GLU 83 2HB GLU 83 -1.120 -4.932 7.606 629 HG2 GLU 83 1HG GLU 83 -1.649 -2.522 7.752 630 HG3 GLU 83 2HG GLU 83 -2.937 -2.908 8.893 631 H VAL 84 H VAL 84 -3.640 -2.204 6.346 632 HA VAL 84 HA VAL 84 -2.206 -1.935 3.808 633 HB VAL 84 HB VAL 84 -4.157 -0.049 5.138 634 HG11 VAL 84 1HG1 VAL 84 -3.064 0.055 2.332 635 HG12 VAL 84 2HG1 VAL 84 -4.115 1.233 3.120 636 HG13 VAL 84 3HG1 VAL 84 -2.450 1.030 3.667 637 HG21 VAL 84 1HG2 VAL 84 -5.839 -0.977 3.933 638 HG22 VAL 84 2HG2 VAL 84 -4.785 -1.413 2.588 639 HG23 VAL 84 3HG2 VAL 84 -4.808 -2.404 4.047 640 H CYS 85 H CYS 85 -0.120 -1.437 4.097 641 HA CYS 85 HA CYS 85 0.559 0.629 6.081 642 HB2 CYS 85 1HB CYS 85 1.589 -1.767 6.149 643 HB3 CYS 85 2HB CYS 85 2.586 -1.189 4.819 644 HG CYS 85 HG CYS 85 3.642 -1.106 7.636 645 H LYS 86 H LYS 86 2.658 1.833 5.416 646 HA LYS 86 HA LYS 86 2.333 2.699 2.618 647 HB2 LYS 86 1HB LYS 86 1.784 4.314 4.556 648 HB3 LYS 86 2HB LYS 86 3.524 4.399 4.796 649 HG2 LYS 86 1HG LYS 86 3.880 5.423 2.732 650 HG3 LYS 86 2HG LYS 86 2.295 4.946 2.120 651 HD2 LYS 86 1HD LYS 86 1.861 7.133 2.606 652 HD3 LYS 86 2HD LYS 86 1.473 6.412 4.169 653 HE2 LYS 86 1HE LYS 86 4.236 7.402 3.546 654 HE3 LYS 86 2HE LYS 86 2.980 8.497 4.121 655 HZ1 LYS 86 1HZ LYS 86 4.614 7.099 5.717 656 HZ2 LYS 86 2HZ LYS 86 3.273 6.070 5.664 657 HZ3 LYS 86 3HZ LYS 86 3.092 7.669 6.185 658 H LEU 87 H LEU 87 4.267 3.462 1.525 659 HA LEU 87 HA LEU 87 6.710 2.156 2.530 660 HB2 LEU 87 1HB LEU 87 5.584 2.356 -0.241 661 HB3 LEU 87 2HB LEU 87 7.302 2.069 0.026 662 HG LEU 87 HG LEU 87 6.032 0.007 -0.445 663 HD11 LEU 87 1HD1 LEU 87 8.016 0.389 1.368 664 HD12 LEU 87 2HD1 LEU 87 7.396 -1.186 0.875 665 HD13 LEU 87 3HD1 LEU 87 6.800 -0.427 2.351 666 HD21 LEU 87 1HD2 LEU 87 4.089 1.083 1.134 667 HD22 LEU 87 2HD2 LEU 87 4.820 -0.100 2.219 668 HD23 LEU 87 3HD2 LEU 87 4.181 -0.613 0.656 669 HA PRO 88 HA PRO 88 8.478 6.209 2.453 670 HB2 PRO 88 1HB PRO 88 11.073 5.464 2.743 671 HB3 PRO 88 2HB PRO 88 9.911 5.437 4.075 672 HG2 PRO 88 1HG PRO 88 10.863 3.186 2.348 673 HG3 PRO 88 2HG PRO 88 10.609 3.219 4.102 674 HD2 PRO 88 1HD PRO 88 8.818 2.125 2.391 675 HD3 PRO 88 2HD PRO 88 8.333 2.916 3.904 676 H ARG 89 H ARG 89 10.143 3.671 0.577 677 HA ARG 89 HA ARG 89 11.187 5.600 -1.297 678 HB2 ARG 89 1HB ARG 89 11.410 2.649 -0.915 679 HB3 ARG 89 2HB ARG 89 11.772 3.312 -2.503 680 HG2 ARG 89 1HG ARG 89 13.536 4.642 -1.642 681 HG3 ARG 89 2HG ARG 89 13.063 4.301 0.024 682 HD2 ARG 89 1HD ARG 89 13.544 1.878 -0.452 683 HD3 ARG 89 2HD ARG 89 14.242 2.394 -1.987 684 HE ARG 89 HE ARG 89 15.475 3.884 -0.001 685 HH11 ARG 89 2HH1 ARG 89 15.194 0.538 -0.920 686 HH12 ARG 89 1HH1 ARG 89 16.744 0.098 -0.283 687 HH21 ARG 89 2HH2 ARG 89 17.517 3.317 0.842 688 HH22 ARG 89 1HH2 ARG 89 18.064 1.679 0.720 689 H LEU 90 H LEU 90 9.173 2.686 -1.747 690 HA LEU 90 HA LEU 90 8.324 3.193 -4.318 691 HB2 LEU 90 1HB LEU 90 7.118 1.724 -2.018 692 HB3 LEU 90 2HB LEU 90 6.182 1.934 -3.497 693 HG LEU 90 HG LEU 90 8.902 0.635 -3.406 694 HD11 LEU 90 1HD1 LEU 90 6.561 -0.391 -2.332 695 HD12 LEU 90 2HD1 LEU 90 8.000 -1.300 -2.793 696 HD13 LEU 90 3HD1 LEU 90 6.667 -1.123 -3.933 697 HD21 LEU 90 1HD2 LEU 90 8.096 1.641 -5.560 698 HD22 LEU 90 2HD2 LEU 90 6.756 0.495 -5.516 699 HD23 LEU 90 3HD2 LEU 90 8.417 -0.093 -5.618 700 H SER 91 H SER 91 7.042 4.444 -1.289 701 HA SER 91 HA SER 91 5.635 6.173 -0.829 702 HB2 SER 91 1HB SER 91 6.006 6.890 -3.748 703 HB3 SER 91 2HB SER 91 5.364 7.948 -2.492 704 HG SER 91 HG SER 91 7.349 8.037 -1.548 705 H LEU 92 H LEU 92 4.479 3.724 -1.332 706 HA LEU 92 HA LEU 92 1.842 4.552 -2.223 707 HB2 LEU 92 1HB LEU 92 3.550 2.598 -3.653 708 HB3 LEU 92 2HB LEU 92 1.845 2.191 -3.466 709 HG LEU 92 HG LEU 92 2.908 4.688 -4.787 710 HD11 LEU 92 1HD1 LEU 92 3.254 3.381 -6.551 711 HD12 LEU 92 2HD1 LEU 92 1.506 3.164 -6.632 712 HD13 LEU 92 3HD1 LEU 92 2.500 1.996 -5.762 713 HD21 LEU 92 1HD2 LEU 92 0.426 4.223 -3.639 714 HD22 LEU 92 2HD2 LEU 92 0.176 3.922 -5.359 715 HD23 LEU 92 3HD2 LEU 92 0.826 5.471 -4.819 716 H ASN 93 H ASN 93 0.320 2.502 -2.008 717 HA ASN 93 HA ASN 93 0.498 1.713 0.737 718 HB2 ASN 93 1HB ASN 93 -1.450 1.101 -1.481 719 HB3 ASN 93 2HB ASN 93 -1.589 0.358 0.110 720 HD21 ASN 93 1HD2 ASN 93 -0.999 2.327 1.817 721 HD22 ASN 93 2HD2 ASN 93 -2.120 3.633 1.665 722 H GLY 94 H GLY 94 1.142 -0.181 1.606 723 HA2 GLY 94 1HA GLY 94 2.147 -2.222 -0.274 724 HA3 GLY 94 2HA GLY 94 2.819 -1.920 1.321 725 H VAL 95 H VAL 95 0.541 -3.686 -0.501 726 HA VAL 95 HA VAL 95 -0.900 -4.614 1.864 727 HB VAL 95 HB VAL 95 -1.303 -5.365 -1.035 728 HG11 VAL 95 1HG1 VAL 95 -2.114 -6.792 1.097 729 HG12 VAL 95 2HG1 VAL 95 -3.468 -5.669 0.946 730 HG13 VAL 95 3HG1 VAL 95 -3.017 -6.698 -0.415 731 HG21 VAL 95 1HG2 VAL 95 -3.447 -3.925 -0.542 732 HG22 VAL 95 2HG2 VAL 95 -2.399 -3.174 0.662 733 HG23 VAL 95 3HG2 VAL 95 -1.937 -3.160 -1.040 734 H ARG 96 H ARG 96 0.111 -6.135 3.007 735 HA ARG 96 HA ARG 96 1.566 -8.247 1.565 736 HB2 ARG 96 1HB ARG 96 2.972 -7.016 3.113 737 HB3 ARG 96 2HB ARG 96 1.826 -7.288 4.419 738 HG2 ARG 96 1HG ARG 96 2.431 -9.491 4.676 739 HG3 ARG 96 2HG ARG 96 3.035 -9.628 3.023 740 HD2 ARG 96 1HD ARG 96 4.898 -9.643 4.547 741 HD3 ARG 96 2HD ARG 96 4.913 -8.136 3.632 742 HE ARG 96 HE ARG 96 4.702 -7.018 5.603 743 HH11 ARG 96 2HH1 ARG 96 3.540 -10.269 6.051 744 HH12 ARG 96 1HH1 ARG 96 3.263 -10.075 7.751 745 HH21 ARG 96 2HH2 ARG 96 4.341 -6.750 7.839 746 HH22 ARG 96 1HH2 ARG 96 3.718 -8.073 8.766 747 H PHE 97 H PHE 97 1.357 -10.432 2.303 748 HA PHE 97 HA PHE 97 -1.208 -10.953 3.656 749 HB2 PHE 97 1HB PHE 97 0.137 -12.432 1.396 750 HB3 PHE 97 2HB PHE 97 -1.182 -13.125 2.332 751 HD1 PHE 97 1HD PHE 97 -0.442 -9.881 0.634 752 HD2 PHE 97 2HD PHE 97 -3.240 -13.008 1.346 753 HE1 PHE 97 1HE PHE 97 -2.066 -8.757 -0.833 754 HE2 PHE 97 2HE PHE 97 -4.868 -11.890 -0.121 755 HZ PHE 97 HZ PHE 97 -4.282 -9.762 -1.213 756 H LYS 98 H LYS 98 -1.184 -12.200 5.421 757 HA LYS 98 HA LYS 98 1.295 -13.671 6.039 758 HB2 LYS 98 1HB LYS 98 1.083 -11.716 7.482 759 HB3 LYS 98 2HB LYS 98 -0.541 -12.209 7.946 760 HG2 LYS 98 1HG LYS 98 0.277 -14.085 9.144 761 HG3 LYS 98 2HG LYS 98 1.899 -13.883 8.478 762 HD2 LYS 98 1HD LYS 98 2.390 -12.115 9.855 763 HD3 LYS 98 2HD LYS 98 0.701 -11.628 10.011 764 HE2 LYS 98 1HE LYS 98 1.256 -12.495 12.112 765 HE3 LYS 98 2HE LYS 98 0.382 -13.803 11.315 766 HZ1 LYS 98 1HZ LYS 98 3.253 -13.587 11.914 767 HZ2 LYS 98 2HZ LYS 98 2.747 -14.538 10.610 768 HZ3 LYS 98 3HZ LYS 98 2.200 -14.885 12.173 769 H ARG 99 H ARG 99 0.935 -15.782 5.916 770 HA ARG 99 HA ARG 99 -1.686 -16.913 6.105 771 HB2 ARG 99 1HB ARG 99 -0.034 -17.893 4.615 772 HB3 ARG 99 2HB ARG 99 1.039 -18.213 5.971 773 HG2 ARG 99 1HG ARG 99 -0.963 -19.613 6.871 774 HG3 ARG 99 2HG ARG 99 -1.482 -19.595 5.184 775 HD2 ARG 99 1HD ARG 99 -0.209 -21.545 5.369 776 HD3 ARG 99 2HD ARG 99 0.894 -20.377 4.641 777 HE ARG 99 HE ARG 99 1.457 -20.105 7.241 778 HH11 ARG 99 2HH1 ARG 99 1.102 -22.933 5.242 779 HH12 ARG 99 1HH1 ARG 99 2.227 -23.881 6.158 780 HH21 ARG 99 2HH2 ARG 99 2.940 -21.343 8.454 781 HH22 ARG 99 1HH2 ARG 99 3.271 -22.976 7.985 782 H ILE 100 H ILE 100 -2.450 -16.433 8.172 783 HA ILE 100 HA ILE 100 -1.029 -17.000 10.555 784 HB ILE 100 HB ILE 100 -3.982 -16.629 10.061 785 HG12 ILE 100 1HG1 ILE 100 -1.894 -14.800 11.267 786 HG13 ILE 100 2HG1 ILE 100 -2.550 -14.661 9.640 787 HG21 ILE 100 1HG2 ILE 100 -2.699 -17.728 12.337 788 HG22 ILE 100 2HG2 ILE 100 -3.272 -16.116 12.763 789 HG23 ILE 100 3HG2 ILE 100 -4.400 -17.313 12.129 790 HD11 ILE 100 1HD1 ILE 100 -3.502 -13.105 11.378 791 HD12 ILE 100 2HD1 ILE 100 -4.672 -14.042 10.447 792 HD13 ILE 100 3HD1 ILE 100 -4.269 -14.522 12.095 793 H SER 101 H SER 101 -3.392 -18.820 8.662 794 HA SER 101 HA SER 101 -2.515 -21.267 9.975 795 HB2 SER 101 1HB SER 101 -4.605 -20.234 11.143 796 HB3 SER 101 2HB SER 101 -5.474 -20.813 9.722 797 HG SER 101 HG SER 101 -4.041 -22.832 10.427 798 H GLY 102 H GLY 102 -3.149 -23.204 8.822 799 HA2 GLY 102 1HA GLY 102 -4.028 -24.333 6.932 800 HA3 GLY 102 2HA GLY 102 -4.209 -22.784 6.123 801 H THR 103 H THR 103 -3.213 -24.219 4.393 802 HA THR 103 HA THR 103 -0.297 -24.396 4.656 803 HB THR 103 HB THR 103 -0.396 -25.732 2.559 804 HG1 THR 103 1HG THR 103 -2.642 -24.691 2.139 805 HG21 THR 103 1HG2 THR 103 -0.370 -27.327 4.136 806 HG22 THR 103 2HG2 THR 103 -2.095 -27.499 3.811 807 HG23 THR 103 3HG2 THR 103 -1.545 -26.475 5.137 808 H SER 104 H SER 104 0.870 -23.987 2.473 809 HA SER 104 HA SER 104 0.408 -21.241 1.798 810 HB2 SER 104 1HB SER 104 2.685 -21.873 1.900 811 HB3 SER 104 2HB SER 104 2.419 -23.300 0.898 812 HG SER 104 HG SER 104 3.296 -21.822 -0.451 813 H ILE 105 H ILE 105 0.092 -24.336 0.113 814 HA ILE 105 HA ILE 105 -0.390 -23.685 -2.448 815 HB ILE 105 HB ILE 105 -1.952 -25.602 -0.728 816 HG12 ILE 105 1HG1 ILE 105 0.346 -26.239 -1.030 817 HG13 ILE 105 2HG1 ILE 105 -0.636 -27.272 -2.064 818 HG21 ILE 105 1HG2 ILE 105 -2.081 -25.334 -3.728 819 HG22 ILE 105 2HG2 ILE 105 -2.884 -26.563 -2.752 820 HG23 ILE 105 3HG2 ILE 105 -3.358 -24.871 -2.604 821 HD11 ILE 105 1HD1 ILE 105 -0.088 -25.474 -3.874 822 HD12 ILE 105 2HD1 ILE 105 1.262 -25.105 -2.800 823 HD13 ILE 105 3HD1 ILE 105 1.084 -26.728 -3.467 824 H ALA 106 H ALA 106 -3.097 -23.839 -0.126 825 HA ALA 106 HA ALA 106 -4.888 -22.434 -1.801 826 HB1 ALA 106 1HB ALA 106 -4.899 -23.444 0.968 827 HB2 ALA 106 2HB ALA 106 -5.991 -22.100 0.633 828 HB3 ALA 106 3HB ALA 106 -6.115 -23.590 -0.302 829 H PHE 107 H PHE 107 -2.545 -21.411 0.564 830 HA PHE 107 HA PHE 107 -3.504 -18.847 1.132 831 HB2 PHE 107 1HB PHE 107 -1.645 -19.969 2.343 832 HB3 PHE 107 2HB PHE 107 -0.612 -19.713 0.941 833 HD1 PHE 107 1HD PHE 107 -2.578 -17.954 3.539 834 HD2 PHE 107 2HD PHE 107 0.527 -17.693 0.640 835 HE1 PHE 107 1HE PHE 107 -1.955 -15.740 4.412 836 HE2 PHE 107 2HE PHE 107 1.156 -15.478 1.509 837 HZ PHE 107 HZ PHE 107 -0.085 -14.499 3.397 838 H LYS 108 H LYS 108 -1.114 -19.853 -1.312 839 HA LYS 108 HA LYS 108 -1.003 -17.253 -2.505 840 HB2 LYS 108 1HB LYS 108 0.061 -19.954 -3.313 841 HB3 LYS 108 2HB LYS 108 0.247 -18.534 -4.335 842 HG2 LYS 108 1HG LYS 108 1.751 -17.544 -2.929 843 HG3 LYS 108 2HG LYS 108 1.113 -18.356 -1.497 844 HD2 LYS 108 1HD LYS 108 3.212 -19.348 -1.894 845 HD3 LYS 108 2HD LYS 108 2.028 -20.508 -2.501 846 HE2 LYS 108 1HE LYS 108 3.562 -20.465 -4.221 847 HE3 LYS 108 2HE LYS 108 2.387 -19.268 -4.764 848 HZ1 LYS 108 1HZ LYS 108 4.996 -18.735 -3.455 849 HZ2 LYS 108 2HZ LYS 108 3.841 -17.544 -3.781 850 HZ3 LYS 108 3HZ LYS 108 4.569 -18.386 -5.054 851 H ASN 109 H ASN 109 -2.401 -20.374 -3.489 852 HA ASN 109 HA ASN 109 -3.408 -19.832 -5.939 853 HB2 ASN 109 1HB ASN 109 -4.517 -21.413 -3.648 854 HB3 ASN 109 2HB ASN 109 -5.479 -21.222 -5.112 855 HD21 ASN 109 1HD2 ASN 109 -3.499 -23.266 -3.617 856 HD22 ASN 109 2HD2 ASN 109 -2.774 -24.059 -4.969 857 H ILE 110 H ILE 110 -4.912 -18.900 -2.862 858 HA ILE 110 HA ILE 110 -7.070 -17.512 -4.170 859 HB ILE 110 HB ILE 110 -7.309 -18.607 -1.935 860 HG12 ILE 110 1HG1 ILE 110 -8.581 -16.683 -0.910 861 HG13 ILE 110 2HG1 ILE 110 -7.921 -15.657 -2.179 862 HG21 ILE 110 1HG2 ILE 110 -5.052 -16.996 -1.340 863 HG22 ILE 110 2HG2 ILE 110 -6.380 -16.479 -0.302 864 HG23 ILE 110 3HG2 ILE 110 -5.871 -18.167 -0.306 865 HD11 ILE 110 1HD1 ILE 110 -9.099 -17.989 -3.341 866 HD12 ILE 110 2HD1 ILE 110 -10.248 -17.205 -2.256 867 HD13 ILE 110 3HD1 ILE 110 -9.513 -16.291 -3.572 868 H ALA 111 H ALA 111 -3.913 -16.731 -2.978 869 HA ALA 111 HA ALA 111 -4.210 -13.962 -2.598 870 HB1 ALA 111 1HB ALA 111 -2.272 -15.028 -1.732 871 HB2 ALA 111 2HB ALA 111 -1.808 -15.625 -3.325 872 HB3 ALA 111 3HB ALA 111 -1.726 -13.899 -2.972 873 H SER 112 H SER 112 -3.348 -15.859 -5.463 874 HA SER 112 HA SER 112 -2.692 -13.783 -7.189 875 HB2 SER 112 1HB SER 112 -2.411 -16.229 -7.660 876 HB3 SER 112 2HB SER 112 -4.146 -16.323 -7.961 877 HG SER 112 HG SER 112 -2.221 -14.812 -9.393 878 H LYS 113 H LYS 113 -5.863 -15.330 -6.707 879 HA LYS 113 HA LYS 113 -7.338 -13.802 -8.492 880 HB2 LYS 113 1HB LYS 113 -8.037 -15.229 -5.948 881 HB3 LYS 113 2HB LYS 113 -9.252 -14.268 -6.780 882 HG2 LYS 113 1HG LYS 113 -9.089 -15.626 -8.736 883 HG3 LYS 113 2HG LYS 113 -7.695 -16.489 -8.082 884 HD2 LYS 113 1HD LYS 113 -10.336 -16.483 -6.657 885 HD3 LYS 113 2HD LYS 113 -10.000 -17.626 -7.960 886 HE2 LYS 113 1HE LYS 113 -7.822 -18.087 -6.588 887 HE3 LYS 113 2HE LYS 113 -8.751 -17.400 -5.256 888 HZ1 LYS 113 1HZ LYS 113 -10.287 -19.306 -6.697 889 HZ2 LYS 113 2HZ LYS 113 -9.891 -19.275 -5.053 890 HZ3 LYS 113 3HZ LYS 113 -8.837 -19.995 -6.163 891 H ILE 114 H ILE 114 -7.089 -13.274 -4.970 892 HA ILE 114 HA ILE 114 -8.448 -10.910 -4.758 893 HB ILE 114 HB ILE 114 -5.918 -11.636 -3.276 894 HG12 ILE 114 1HG1 ILE 114 -7.589 -13.364 -3.015 895 HG13 ILE 114 2HG1 ILE 114 -7.512 -12.427 -1.527 896 HG21 ILE 114 1HG2 ILE 114 -7.233 -9.215 -3.285 897 HG22 ILE 114 2HG2 ILE 114 -7.892 -10.033 -1.870 898 HG23 ILE 114 3HG2 ILE 114 -6.150 -9.804 -2.024 899 HD11 ILE 114 1HD1 ILE 114 -9.487 -11.120 -2.420 900 HD12 ILE 114 2HD1 ILE 114 -9.630 -12.380 -3.647 901 HD13 ILE 114 3HD1 ILE 114 -9.788 -12.790 -1.939 902 H ALA 115 H ALA 115 -5.041 -11.336 -5.644 903 HA ALA 115 HA ALA 115 -4.378 -8.608 -5.803 904 HB1 ALA 115 1HB ALA 115 -3.120 -11.113 -6.379 905 HB2 ALA 115 2HB ALA 115 -2.816 -9.979 -7.697 906 HB3 ALA 115 3HB ALA 115 -2.382 -9.546 -6.043 907 H ASN 116 H ASN 116 -5.364 -10.901 -8.345 908 HA ASN 116 HA ASN 116 -5.283 -9.124 -10.494 909 HB2 ASN 116 1HB ASN 116 -6.808 -11.653 -9.956 910 HB3 ASN 116 2HB ASN 116 -7.125 -10.728 -11.421 911 HD21 ASN 116 1HD2 ASN 116 -5.831 -13.397 -10.797 912 HD22 ASN 116 2HD2 ASN 116 -4.349 -13.356 -11.684 913 H GLU 117 H GLU 117 -7.935 -9.902 -8.272 914 HA GLU 117 HA GLU 117 -9.875 -8.278 -9.529 915 HB2 GLU 117 1HB GLU 117 -9.712 -9.141 -6.636 916 HB3 GLU 117 2HB GLU 117 -11.141 -8.507 -7.440 917 HG2 GLU 117 1HG GLU 117 -9.780 -11.143 -7.840 918 HG3 GLU 117 2HG GLU 117 -11.454 -10.816 -7.397 919 H LEU 118 H LEU 118 -7.565 -7.672 -6.927 920 HA LEU 118 HA LEU 118 -8.507 -4.962 -6.550 921 HB2 LEU 118 1HB LEU 118 -6.439 -6.698 -5.293 922 HB3 LEU 118 2HB LEU 118 -6.312 -4.951 -5.100 923 HG LEU 118 HG LEU 118 -8.896 -6.272 -4.423 924 HD11 LEU 118 1HD1 LEU 118 -7.231 -6.111 -2.103 925 HD12 LEU 118 2HD1 LEU 118 -6.469 -7.147 -3.308 926 HD13 LEU 118 3HD1 LEU 118 -8.106 -7.497 -2.755 927 HD21 LEU 118 1HD2 LEU 118 -8.011 -3.709 -4.332 928 HD22 LEU 118 2HD2 LEU 118 -7.665 -4.247 -2.688 929 HD23 LEU 118 3HD2 LEU 118 -9.307 -4.356 -3.325 930 H LYS 119 H LYS 119 -7.417 -5.800 -9.165 931 HA LYS 119 HA LYS 119 -5.811 -5.209 -10.714 932 HB2 LYS 119 1HB LYS 119 -6.796 -2.674 -9.439 933 HB3 LYS 119 2HB LYS 119 -5.618 -2.616 -10.744 934 HG2 LYS 119 1HG LYS 119 -8.272 -4.014 -10.962 935 HG3 LYS 119 2HG LYS 119 -8.000 -2.338 -11.445 936 HD2 LYS 119 1HD LYS 119 -6.051 -3.346 -12.849 937 HD3 LYS 119 2HD LYS 119 -6.940 -4.859 -12.658 938 HE2 LYS 119 1HE LYS 119 -8.969 -3.620 -13.521 939 HE3 LYS 119 2HE LYS 119 -7.876 -2.305 -13.948 940 HZ1 LYS 119 1HZ LYS 119 -7.459 -3.366 -15.829 941 HZ2 LYS 119 2HZ LYS 119 -8.406 -4.686 -15.361 942 HZ3 LYS 119 3HZ LYS 119 -6.764 -4.639 -14.956 943 H LEU 120 H LEU 120 -4.555 -6.139 -8.378 944 HA LEU 120 HA LEU 120 -2.403 -4.272 -7.787 945 HB2 LEU 120 1HB LEU 120 -2.846 -7.084 -6.796 946 HB3 LEU 120 2HB LEU 120 -1.662 -5.934 -6.178 947 HG LEU 120 HG LEU 120 -4.653 -5.582 -6.006 948 HD11 LEU 120 1HD1 LEU 120 -3.381 -5.892 -3.478 949 HD12 LEU 120 2HD1 LEU 120 -2.952 -7.263 -4.501 950 HD13 LEU 120 3HD1 LEU 120 -4.648 -6.877 -4.210 951 HD21 LEU 120 1HD2 LEU 120 -3.645 -3.967 -4.135 952 HD22 LEU 120 2HD2 LEU 120 -3.934 -3.442 -5.793 953 HD23 LEU 120 3HD2 LEU 120 -2.312 -3.919 -5.289 954 H SER 121 H SER 121 -0.135 -5.274 -7.716 955 HA SER 121 HA SER 121 0.831 -5.698 -10.227 956 HB2 SER 121 1HB SER 121 2.120 -5.325 -8.032 957 HB3 SER 121 2HB SER 121 2.083 -7.080 -7.859 958 HG SER 121 HG SER 121 2.982 -7.028 -10.110 959 H GLY 122 H GLY 122 -0.127 -8.210 -7.903 960 HA2 GLY 122 1HA GLY 122 -0.639 -10.428 -8.193 961 HA3 GLY 122 2HA GLY 122 -1.143 -9.970 -9.813 962 HA PRO 123 HA PRO 123 3.526 -11.255 -10.086 963 HB2 PRO 123 1HB PRO 123 4.520 -12.563 -7.926 964 HB3 PRO 123 2HB PRO 123 4.616 -10.808 -8.114 965 HG2 PRO 123 1HG PRO 123 2.676 -12.439 -6.521 966 HG3 PRO 123 2HG PRO 123 3.506 -10.937 -6.074 967 HD2 PRO 123 1HD PRO 123 0.935 -10.984 -6.922 968 HD3 PRO 123 2HD PRO 123 2.024 -9.621 -7.250 969 H SER 124 H SER 124 2.327 -12.684 -11.484 970 HA SER 124 HA SER 124 2.200 -15.452 -10.476 971 HB2 SER 124 1HB SER 124 0.427 -15.851 -12.164 972 HB3 SER 124 2HB SER 124 -0.035 -14.620 -10.989 973 HG SER 124 HG SER 124 0.872 -14.227 -13.647 974 H SER 125 H SER 125 3.639 -16.774 -11.346 975 HA SER 125 HA SER 125 4.216 -16.797 -14.145 976 HB2 SER 125 1HB SER 125 5.639 -14.888 -13.288 977 HB3 SER 125 2HB SER 125 6.527 -16.077 -12.334 978 HG SER 125 HG SER 125 7.015 -15.415 -14.787 979 H GLY 126 H GLY 126 5.315 -18.664 -14.797 980 HA2 GLY 126 1HA GLY 126 6.755 -20.438 -13.255 981 HA3 GLY 126 2HA GLY 126 5.071 -20.879 -13.011
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