NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
552490 | 2lvo | 18582 | 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 HT1 MET 1 -18.770 -10.836 14.572 2 H2 MET 1 HT2 MET 1 -18.440 -12.286 13.764 3 H3 MET 1 HT3 MET 1 -17.752 -10.835 13.222 4 HA MET 1 HA MET 1 -17.240 -11.789 15.945 5 HB2 MET 1 HB2 MET 1 -15.306 -13.020 15.226 6 HB3 MET 1 HB1 MET 1 -16.702 -13.638 14.357 7 HG2 MET 1 HG2 MET 1 -16.048 -12.317 12.396 8 HG3 MET 1 HG1 MET 1 -14.634 -11.736 13.273 9 HE1 MET 1 HE1 MET 1 -12.984 -14.145 10.699 10 HE2 MET 1 HE2 MET 1 -13.008 -12.518 11.384 11 HE3 MET 1 HE3 MET 1 -14.369 -13.091 10.417 12 H GLN 2 HN GLN 2 -15.183 -10.905 16.731 13 HA GLN 2 HA GLN 2 -14.715 -8.250 15.572 14 HB2 GLN 2 HB2 GLN 2 -14.063 -9.371 18.303 15 HB3 GLN 2 HB1 GLN 2 -13.673 -7.739 17.774 16 HG2 GLN 2 HG2 GLN 2 -16.491 -8.623 17.554 17 HG3 GLN 2 HG1 GLN 2 -15.852 -8.299 19.163 18 HE21 GLN 2 HE21 GLN 2 -17.891 -6.912 17.546 19 HE22 GLN 2 HE22 GLN 2 -17.359 -5.265 17.465 20 H ILE 3 HN ILE 3 -12.701 -7.521 15.009 21 HA ILE 3 HA ILE 3 -10.445 -9.393 15.249 22 HB ILE 3 HB ILE 3 -9.662 -8.740 12.986 23 HG12 ILE 3 HG12 ILE 3 -12.435 -7.672 12.479 24 HG13 ILE 3 HG11 ILE 3 -11.118 -6.620 12.991 25 HG21 ILE 3 HG21 ILE 3 -11.248 -10.140 11.725 26 HG22 ILE 3 HG22 ILE 3 -12.371 -10.058 13.082 27 HG23 ILE 3 HG23 ILE 3 -10.807 -10.851 13.280 28 HD11 ILE 3 HD11 ILE 3 -11.073 -8.349 10.530 29 HD12 ILE 3 HD12 ILE 3 -9.856 -7.168 11.016 30 HD13 ILE 3 HD13 ILE 3 -11.471 -6.632 10.556 31 H PHE 4 HN PHE 4 -8.328 -8.234 14.749 32 HA PHE 4 HA PHE 4 -8.471 -5.500 15.850 33 HB2 PHE 4 HB2 PHE 4 -6.258 -7.539 16.179 34 HB3 PHE 4 HB1 PHE 4 -6.259 -5.912 16.844 35 HD1 PHE 4 HD1 PHE 4 -7.766 -5.326 18.685 36 HD2 PHE 4 HD2 PHE 4 -7.494 -9.306 17.209 37 HE1 PHE 4 HE1 PHE 4 -8.862 -6.156 20.725 38 HE2 PHE 4 HE2 PHE 4 -8.591 -10.146 19.246 39 HZ PHE 4 HZ PHE 4 -9.280 -8.567 21.007 40 H VAL 5 HN VAL 5 -7.868 -3.965 14.478 41 HA VAL 5 HA VAL 5 -6.208 -4.692 12.172 42 HB VAL 5 HB VAL 5 -7.684 -2.098 12.638 43 HG11 VAL 5 HG11 VAL 5 -7.440 -1.842 10.197 44 HG12 VAL 5 HG12 VAL 5 -6.481 -3.320 10.160 45 HG13 VAL 5 HG13 VAL 5 -5.886 -1.907 11.031 46 HG21 VAL 5 HG21 VAL 5 -9.289 -3.929 12.584 47 HG22 VAL 5 HG22 VAL 5 -8.580 -4.521 11.081 48 HG23 VAL 5 HG23 VAL 5 -9.404 -2.961 11.115 49 H LYS 6 HN LYS 6 -4.134 -4.241 12.199 50 HA LYS 6 HA LYS 6 -3.075 -2.373 14.193 51 HB2 LYS 6 HB2 LYS 6 -2.294 -4.873 13.587 52 HB3 LYS 6 HB1 LYS 6 -1.279 -3.982 12.467 53 HG2 LYS 6 HG2 LYS 6 -0.293 -2.735 14.279 54 HG3 LYS 6 HG1 LYS 6 -1.376 -3.512 15.437 55 HD2 LYS 6 HD2 LYS 6 -0.399 -5.713 14.721 56 HD3 LYS 6 HD1 LYS 6 0.795 -4.806 13.797 57 HE2 LYS 6 HE2 LYS 6 1.644 -3.781 15.796 58 HE3 LYS 6 HE1 LYS 6 0.362 -4.510 16.762 59 HZ1 LYS 6 HZ1 LYS 6 2.544 -5.671 16.895 60 HZ2 LYS 6 HZ2 LYS 6 2.380 -6.080 15.255 61 HZ3 LYS 6 HZ3 LYS 6 1.266 -6.662 16.386 62 H THR 7 HN THR 7 -2.048 -0.513 13.625 63 HA THR 7 HA THR 7 -1.800 0.056 10.744 64 HB THR 7 HB THR 7 -2.041 2.495 11.485 65 HG1 THR 7 HG1 THR 7 -3.429 1.448 13.710 66 HG21 THR 7 HG21 THR 7 -4.411 0.644 11.798 67 HG22 THR 7 HG22 THR 7 -3.813 1.310 10.278 68 HG23 THR 7 HG23 THR 7 -4.499 2.381 11.502 69 H LEU 8 HN LEU 8 -0.110 1.625 10.193 70 HA LEU 8 HA LEU 8 2.373 0.964 11.406 71 HB2 LEU 8 HB2 LEU 8 1.663 3.068 9.368 72 HB3 LEU 8 HB1 LEU 8 3.301 2.637 9.817 73 HG LEU 8 HG LEU 8 1.359 0.650 8.652 74 HD11 LEU 8 HD11 LEU 8 1.697 2.512 7.083 75 HD12 LEU 8 HD12 LEU 8 2.425 1.013 6.506 76 HD13 LEU 8 HD13 LEU 8 3.440 2.275 7.201 77 HD21 LEU 8 HD21 LEU 8 3.345 -0.641 8.183 78 HD22 LEU 8 HD22 LEU 8 3.295 -0.237 9.899 79 HD23 LEU 8 HD23 LEU 8 4.368 0.648 8.818 80 H THR 9 HN THR 9 0.034 3.318 12.128 81 HA THR 9 HA THR 9 1.879 5.223 13.282 82 HB THR 9 HB THR 9 -0.789 5.710 14.134 83 HG1 THR 9 HG1 THR 9 -1.754 5.775 11.991 84 HG21 THR 9 HG21 THR 9 0.890 7.422 13.659 85 HG22 THR 9 HG22 THR 9 -0.558 7.687 12.685 86 HG23 THR 9 HG23 THR 9 0.877 6.974 11.954 87 H GLY 10 HN GLY 10 0.363 2.356 14.270 88 HA2 GLY 10 HA2 GLY 10 0.708 1.280 16.322 89 HA3 GLY 10 HA1 GLY 10 1.205 2.813 17.020 90 H LYS 11 HN LYS 11 -1.715 1.891 15.275 91 HA LYS 11 HA LYS 11 -3.312 2.523 17.661 92 HB2 LYS 11 HB2 LYS 11 -3.489 4.419 16.189 93 HB3 LYS 11 HB1 LYS 11 -3.750 3.384 14.797 94 HG2 LYS 11 HG2 LYS 11 -5.904 2.663 15.841 95 HG3 LYS 11 HG1 LYS 11 -5.649 3.902 17.071 96 HD2 LYS 11 HD2 LYS 11 -5.512 5.599 15.278 97 HD3 LYS 11 HD1 LYS 11 -5.879 4.342 14.097 98 HE2 LYS 11 HE2 LYS 11 -8.029 3.943 15.178 99 HE3 LYS 11 HE1 LYS 11 -7.659 5.178 16.381 100 HZ1 LYS 11 HZ1 LYS 11 -7.500 6.781 14.507 101 HZ2 LYS 11 HZ2 LYS 11 -9.047 6.138 14.728 102 HZ3 LYS 11 HZ3 LYS 11 -8.072 5.570 13.466 103 H THR 12 HN THR 12 -4.312 0.694 18.261 104 HA THR 12 HA THR 12 -4.862 -1.370 16.282 105 HB THR 12 HB THR 12 -5.543 -1.598 19.203 106 HG1 THR 12 HG1 THR 12 -3.396 -0.938 19.207 107 HG21 THR 12 HG21 THR 12 -6.264 -3.378 17.659 108 HG22 THR 12 HG22 THR 12 -5.070 -3.958 18.822 109 HG23 THR 12 HG23 THR 12 -4.587 -3.609 17.160 110 H ILE 13 HN ILE 13 -6.649 -1.017 15.132 111 HA ILE 13 HA ILE 13 -9.012 0.158 16.378 112 HB ILE 13 HB ILE 13 -8.827 -0.743 13.515 113 HG12 ILE 13 HG12 ILE 13 -8.042 2.016 14.460 114 HG13 ILE 13 HG11 ILE 13 -6.858 0.738 14.204 115 HG21 ILE 13 HG21 ILE 13 -10.352 1.504 14.824 116 HG22 ILE 13 HG22 ILE 13 -11.016 -0.081 14.429 117 HG23 ILE 13 HG23 ILE 13 -10.472 0.993 13.140 118 HD11 ILE 13 HD11 ILE 13 -7.500 0.593 11.865 119 HD12 ILE 13 HD12 ILE 13 -7.018 2.236 12.288 120 HD13 ILE 13 HD13 ILE 13 -8.727 1.835 12.117 121 H THR 14 HN THR 14 -10.778 -0.994 16.954 122 HA THR 14 HA THR 14 -10.763 -3.860 16.324 123 HB THR 14 HB THR 14 -12.729 -2.860 18.289 124 HG1 THR 14 HG1 THR 14 -10.341 -3.160 19.540 125 HG21 THR 14 HG21 THR 14 -12.386 -5.244 17.830 126 HG22 THR 14 HG22 THR 14 -11.992 -4.854 19.503 127 HG23 THR 14 HG23 THR 14 -10.701 -5.099 18.327 128 H LEU 15 HN LEU 15 -12.018 -4.427 14.675 129 HA LEU 15 HA LEU 15 -14.547 -2.972 14.299 130 HB2 LEU 15 HB2 LEU 15 -12.536 -3.887 12.274 131 HB3 LEU 15 HB1 LEU 15 -14.217 -3.671 11.829 132 HG LEU 15 HG LEU 15 -12.476 -1.499 13.003 133 HD11 LEU 15 HD11 LEU 15 -12.440 -0.571 10.740 134 HD12 LEU 15 HD12 LEU 15 -13.299 -1.993 10.145 135 HD13 LEU 15 HD13 LEU 15 -11.670 -2.158 10.801 136 HD21 LEU 15 HD21 LEU 15 -14.766 -1.070 13.487 137 HD22 LEU 15 HD22 LEU 15 -15.260 -1.528 11.857 138 HD23 LEU 15 HD23 LEU 15 -14.327 -0.054 12.114 139 H GLU 16 HN GLU 16 -16.264 -4.188 13.330 140 HA GLU 16 HA GLU 16 -16.086 -7.026 14.031 141 HB2 GLU 16 HB2 GLU 16 -17.815 -5.581 15.158 142 HB3 GLU 16 HB1 GLU 16 -18.599 -5.415 13.592 143 HG2 GLU 16 HG2 GLU 16 -19.334 -7.575 13.574 144 HG3 GLU 16 HG1 GLU 16 -18.011 -8.149 14.589 145 H VAL 17 HN VAL 17 -16.099 -8.482 12.518 146 HA VAL 17 HA VAL 17 -17.342 -7.947 9.923 147 HB VAL 17 HB VAL 17 -15.382 -9.010 8.771 148 HG11 VAL 17 HG11 VAL 17 -13.957 -7.008 8.784 149 HG12 VAL 17 HG12 VAL 17 -14.809 -6.425 10.214 150 HG13 VAL 17 HG13 VAL 17 -15.670 -6.600 8.685 151 HG21 VAL 17 HG21 VAL 17 -14.379 -10.135 10.658 152 HG22 VAL 17 HG22 VAL 17 -14.054 -8.591 11.443 153 HG23 VAL 17 HG23 VAL 17 -13.215 -9.012 9.951 154 H GLU 18 HN GLU 18 -17.054 -10.178 8.617 155 HA GLU 18 HA GLU 18 -17.474 -12.399 10.489 156 HB2 GLU 18 HB2 GLU 18 -19.280 -11.478 8.270 157 HB3 GLU 18 HB1 GLU 18 -19.252 -13.171 8.744 158 HG2 GLU 18 HG2 GLU 18 -19.776 -10.910 10.662 159 HG3 GLU 18 HG1 GLU 18 -21.046 -11.794 9.816 160 HA PRO 19 HA PRO 19 -14.609 -14.727 8.087 161 HB2 PRO 19 HB2 PRO 19 -16.711 -16.839 7.885 162 HB3 PRO 19 HB1 PRO 19 -15.034 -16.967 8.447 163 HG2 PRO 19 HG2 PRO 19 -17.038 -16.986 10.169 164 HG3 PRO 19 HG1 PRO 19 -15.517 -16.147 10.537 165 HD2 PRO 19 HD2 PRO 19 -18.156 -15.018 9.762 166 HD3 PRO 19 HD1 PRO 19 -16.918 -14.361 10.850 167 H SER 20 HN SER 20 -17.922 -14.562 6.883 168 HA SER 20 HA SER 20 -17.120 -15.229 4.179 169 HB2 SER 20 HB2 SER 20 -19.835 -14.275 5.059 170 HB3 SER 20 HB1 SER 20 -19.424 -15.301 3.685 171 HG SER 20 HG SER 20 -18.810 -16.925 5.165 172 H ASP 21 HN ASP 21 -16.647 -12.519 5.854 173 HA ASP 21 HA ASP 21 -17.765 -10.581 4.039 174 HB2 ASP 21 HB2 ASP 21 -17.022 -10.375 6.617 175 HB3 ASP 21 HB1 ASP 21 -15.541 -9.804 5.856 176 H THR 22 HN THR 22 -16.641 -9.301 2.574 177 HA THR 22 HA THR 22 -14.324 -10.607 1.398 178 HB THR 22 HB THR 22 -15.619 -8.139 0.278 179 HG1 THR 22 HG1 THR 22 -17.380 -9.476 0.683 180 HG21 THR 22 HG21 THR 22 -14.407 -10.601 -0.989 181 HG22 THR 22 HG22 THR 22 -13.628 -9.025 -0.833 182 HG23 THR 22 HG23 THR 22 -15.052 -9.207 -1.858 183 H ILE 23 HN ILE 23 -12.329 -9.630 1.102 184 HA ILE 23 HA ILE 23 -11.319 -7.960 3.074 185 HB ILE 23 HB ILE 23 -10.272 -8.335 0.260 186 HG12 ILE 23 HG12 ILE 23 -10.500 -10.444 1.497 187 HG13 ILE 23 HG11 ILE 23 -8.806 -10.036 1.255 188 HG21 ILE 23 HG21 ILE 23 -8.107 -7.639 1.123 189 HG22 ILE 23 HG22 ILE 23 -8.818 -7.346 2.709 190 HG23 ILE 23 HG23 ILE 23 -9.301 -6.359 1.328 191 HD11 ILE 23 HD11 ILE 23 -10.405 -9.753 3.782 192 HD12 ILE 23 HD12 ILE 23 -8.767 -9.137 3.571 193 HD13 ILE 23 HD13 ILE 23 -9.080 -10.870 3.468 194 H GLU 24 HN GLU 24 -12.526 -7.140 -0.137 195 HA GLU 24 HA GLU 24 -11.883 -4.436 -0.192 196 HB2 GLU 24 HB2 GLU 24 -12.704 -5.663 -2.135 197 HB3 GLU 24 HB1 GLU 24 -14.275 -5.853 -1.372 198 HG2 GLU 24 HG2 GLU 24 -14.382 -3.312 -1.334 199 HG3 GLU 24 HG1 GLU 24 -13.009 -3.359 -2.439 200 H ASN 25 HN ASN 25 -14.719 -6.072 1.158 201 HA ASN 25 HA ASN 25 -16.130 -3.721 1.869 202 HB2 ASN 25 HB2 ASN 25 -17.095 -6.071 1.696 203 HB3 ASN 25 HB1 ASN 25 -16.366 -6.386 3.266 204 HD21 ASN 25 HD21 ASN 25 -18.266 -6.685 4.354 205 HD22 ASN 25 HD22 ASN 25 -19.398 -5.402 4.651 206 H VAL 26 HN VAL 26 -13.806 -5.760 3.559 207 HA VAL 26 HA VAL 26 -14.032 -4.600 6.107 208 HB VAL 26 HB VAL 26 -11.557 -5.803 4.844 209 HG11 VAL 26 HG11 VAL 26 -10.994 -4.546 6.821 210 HG12 VAL 26 HG12 VAL 26 -10.897 -6.270 7.183 211 HG13 VAL 26 HG13 VAL 26 -12.284 -5.328 7.733 212 HG21 VAL 26 HG21 VAL 26 -13.404 -7.364 4.759 213 HG22 VAL 26 HG22 VAL 26 -13.747 -7.093 6.467 214 HG23 VAL 26 HG23 VAL 26 -12.243 -7.876 5.983 215 H LYS 27 HN LYS 27 -11.993 -3.801 3.328 216 HA LYS 27 HA LYS 27 -10.562 -1.703 4.566 217 HB2 LYS 27 HB2 LYS 27 -11.175 -2.246 1.657 218 HB3 LYS 27 HB1 LYS 27 -10.102 -0.961 2.200 219 HG2 LYS 27 HG2 LYS 27 -8.831 -2.841 3.424 220 HG3 LYS 27 HG1 LYS 27 -9.726 -3.925 2.357 221 HD2 LYS 27 HD2 LYS 27 -8.008 -1.628 1.414 222 HD3 LYS 27 HD1 LYS 27 -7.480 -3.308 1.494 223 HE2 LYS 27 HE2 LYS 27 -9.182 -3.959 -0.093 224 HE3 LYS 27 HE1 LYS 27 -9.830 -2.319 -0.115 225 HZ1 LYS 27 HZ1 LYS 27 -7.819 -1.533 -1.129 226 HZ2 LYS 27 HZ2 LYS 27 -8.404 -2.846 -2.034 227 HZ3 LYS 27 HZ3 LYS 27 -7.089 -3.053 -0.984 228 H ALA 28 HN ALA 28 -13.651 -1.840 2.895 229 HA ALA 28 HA ALA 28 -14.070 0.946 2.661 230 HB1 ALA 28 HB1 ALA 28 -15.367 -0.749 1.412 231 HB2 ALA 28 HB2 ALA 28 -16.395 0.399 2.267 232 HB3 ALA 28 HB3 ALA 28 -16.155 -1.223 2.917 233 H LYS 29 HN LYS 29 -14.726 -1.400 5.194 234 HA LYS 29 HA LYS 29 -16.221 0.305 6.894 235 HB2 LYS 29 HB2 LYS 29 -14.562 -2.154 7.504 236 HB3 LYS 29 HB1 LYS 29 -15.602 -1.359 8.676 237 HG2 LYS 29 HG2 LYS 29 -17.556 -1.854 7.327 238 HG3 LYS 29 HG1 LYS 29 -16.535 -2.577 6.084 239 HD2 LYS 29 HD2 LYS 29 -15.827 -4.311 7.626 240 HD3 LYS 29 HD1 LYS 29 -16.762 -3.568 8.925 241 HE2 LYS 29 HE2 LYS 29 -18.822 -3.947 7.622 242 HE3 LYS 29 HE1 LYS 29 -17.865 -4.741 6.374 243 HZ1 LYS 29 HZ1 LYS 29 -17.613 -6.599 7.606 244 HZ2 LYS 29 HZ2 LYS 29 -19.050 -6.061 8.330 245 HZ3 LYS 29 HZ3 LYS 29 -17.568 -5.765 9.085 246 H ILE 30 HN ILE 30 -12.795 -0.332 6.475 247 HA ILE 30 HA ILE 30 -11.908 1.125 8.760 248 HB ILE 30 HB ILE 30 -10.370 0.459 6.238 249 HG12 ILE 30 HG12 ILE 30 -10.438 -1.029 8.872 250 HG13 ILE 30 HG11 ILE 30 -11.334 -1.521 7.440 251 HG21 ILE 30 HG21 ILE 30 -9.323 2.231 7.549 252 HG22 ILE 30 HG22 ILE 30 -8.378 0.746 7.629 253 HG23 ILE 30 HG23 ILE 30 -9.392 1.218 8.991 254 HD11 ILE 30 HD11 ILE 30 -9.179 -1.722 6.234 255 HD12 ILE 30 HD12 ILE 30 -9.345 -2.828 7.598 256 HD13 ILE 30 HD13 ILE 30 -8.350 -1.380 7.751 257 H GLN 31 HN GLN 31 -12.461 1.905 5.371 258 HA GLN 31 HA GLN 31 -11.326 4.473 5.326 259 HB2 GLN 31 HB2 GLN 31 -11.912 3.415 3.258 260 HB3 GLN 31 HB1 GLN 31 -13.591 3.248 3.749 261 HG2 GLN 31 HG2 GLN 31 -13.786 5.720 3.729 262 HG3 GLN 31 HG1 GLN 31 -12.149 5.800 3.078 263 HE21 GLN 31 HE21 GLN 31 -12.874 6.787 1.193 264 HE22 GLN 31 HE22 GLN 31 -13.723 5.909 -0.032 265 H ASP 32 HN ASP 32 -14.384 3.298 6.488 266 HA ASP 32 HA ASP 32 -15.654 5.839 6.742 267 HB2 ASP 32 HB2 ASP 32 -16.981 3.815 6.578 268 HB3 ASP 32 HB1 ASP 32 -16.227 3.159 8.028 269 H LYS 33 HN LYS 33 -13.503 3.963 8.714 270 HA LYS 33 HA LYS 33 -14.010 5.567 11.088 271 HB2 LYS 33 HB2 LYS 33 -12.207 3.209 10.552 272 HB3 LYS 33 HB1 LYS 33 -12.237 4.062 12.088 273 HG2 LYS 33 HG2 LYS 33 -14.818 3.081 11.008 274 HG3 LYS 33 HG1 LYS 33 -13.679 1.889 11.640 275 HD2 LYS 33 HD2 LYS 33 -13.592 3.096 13.763 276 HD3 LYS 33 HD1 LYS 33 -14.704 4.310 13.128 277 HE2 LYS 33 HE2 LYS 33 -16.462 2.692 12.959 278 HE3 LYS 33 HE1 LYS 33 -15.360 1.378 13.363 279 HZ1 LYS 33 HZ1 LYS 33 -16.635 1.931 15.287 280 HZ2 LYS 33 HZ2 LYS 33 -16.245 3.571 15.153 281 HZ3 LYS 33 HZ3 LYS 33 -15.045 2.449 15.553 282 H GLU 34 HN GLU 34 -11.209 4.810 9.009 283 HA GLU 34 HA GLU 34 -9.673 6.891 10.321 284 HB2 GLU 34 HB2 GLU 34 -8.920 5.053 8.049 285 HB3 GLU 34 HB1 GLU 34 -7.821 6.132 8.898 286 HG2 GLU 34 HG2 GLU 34 -9.251 3.734 10.002 287 HG3 GLU 34 HG1 GLU 34 -7.517 3.943 9.767 288 H GLY 35 HN GLY 35 -11.250 6.407 7.220 289 HA2 GLY 35 HA2 GLY 35 -12.030 8.248 5.926 290 HA3 GLY 35 HA1 GLY 35 -10.764 9.243 6.631 291 H ILE 36 HN ILE 36 -9.102 6.618 6.025 292 HA ILE 36 HA ILE 36 -7.965 7.648 3.596 293 HB ILE 36 HB ILE 36 -7.285 5.088 5.047 294 HG12 ILE 36 HG12 ILE 36 -5.943 7.782 5.337 295 HG13 ILE 36 HG11 ILE 36 -7.172 7.192 6.454 296 HG21 ILE 36 HG21 ILE 36 -5.760 6.757 3.048 297 HG22 ILE 36 HG22 ILE 36 -6.396 5.128 2.811 298 HG23 ILE 36 HG23 ILE 36 -5.080 5.401 3.954 299 HD11 ILE 36 HD11 ILE 36 -4.971 6.815 7.353 300 HD12 ILE 36 HD12 ILE 36 -4.498 5.928 5.904 301 HD13 ILE 36 HD13 ILE 36 -5.736 5.273 6.976 302 HA PRO 37 HA PRO 37 -10.633 5.350 0.838 303 HB2 PRO 37 HB2 PRO 37 -8.365 5.771 -1.038 304 HB3 PRO 37 HB1 PRO 37 -10.079 6.188 -1.227 305 HG2 PRO 37 HG2 PRO 37 -8.265 8.067 -0.776 306 HG3 PRO 37 HG1 PRO 37 -9.879 8.151 -0.047 307 HD2 PRO 37 HD2 PRO 37 -7.286 7.393 1.208 308 HD3 PRO 37 HD1 PRO 37 -8.651 8.304 1.887 309 HA PRO 38 HA PRO 38 -9.024 1.216 1.152 310 HB2 PRO 38 HB2 PRO 38 -10.678 0.667 -1.249 311 HB3 PRO 38 HB1 PRO 38 -10.728 -0.088 0.355 312 HG2 PRO 38 HG2 PRO 38 -12.636 1.572 -0.416 313 HG3 PRO 38 HG1 PRO 38 -12.039 1.562 1.256 314 HD2 PRO 38 HD2 PRO 38 -11.441 3.490 -0.944 315 HD3 PRO 38 HD1 PRO 38 -11.721 3.795 0.782 316 H ASP 39 HN ASP 39 -8.812 3.109 -1.716 317 HA ASP 39 HA ASP 39 -7.318 1.343 -3.341 318 HB2 ASP 39 HB2 ASP 39 -8.283 4.037 -3.484 319 HB3 ASP 39 HB1 ASP 39 -6.584 4.014 -3.945 320 H GLN 40 HN GLN 40 -6.467 3.523 -0.763 321 HA GLN 40 HA GLN 40 -3.605 3.104 -1.284 322 HB2 GLN 40 HB2 GLN 40 -4.912 5.000 0.674 323 HB3 GLN 40 HB1 GLN 40 -3.211 4.953 0.241 324 HG2 GLN 40 HG2 GLN 40 -3.702 5.696 -1.992 325 HG3 GLN 40 HG1 GLN 40 -5.434 5.603 -1.680 326 HE21 GLN 40 HE21 GLN 40 -3.791 7.878 -2.504 327 HE22 GLN 40 HE22 GLN 40 -4.024 9.094 -1.298 328 H GLN 41 HN GLN 41 -5.859 1.436 0.117 329 HA GLN 41 HA GLN 41 -4.518 0.977 2.680 330 HB2 GLN 41 HB2 GLN 41 -7.207 0.169 1.596 331 HB3 GLN 41 HB1 GLN 41 -6.550 -0.522 3.069 332 HG2 GLN 41 HG2 GLN 41 -6.408 1.800 3.985 333 HG3 GLN 41 HG1 GLN 41 -7.284 2.346 2.554 334 HE21 GLN 41 HE21 GLN 41 -9.114 3.006 3.653 335 HE22 GLN 41 HE22 GLN 41 -10.193 1.883 4.412 336 H ARG 42 HN ARG 42 -2.958 -0.491 2.628 337 HA ARG 42 HA ARG 42 -3.267 -2.827 0.864 338 HB2 ARG 42 HB2 ARG 42 -0.754 -1.889 2.266 339 HB3 ARG 42 HB1 ARG 42 -0.874 -3.131 1.028 340 HG2 ARG 42 HG2 ARG 42 -1.671 -1.344 -0.544 341 HG3 ARG 42 HG1 ARG 42 -1.257 -0.166 0.706 342 HD2 ARG 42 HD2 ARG 42 0.590 -0.298 -0.799 343 HD3 ARG 42 HD1 ARG 42 1.065 -1.102 0.699 344 HE ARG 42 HE ARG 42 0.202 -3.177 -0.722 345 HH11 ARG 42 HH11 ARG 42 2.323 -0.528 -1.614 346 HH12 ARG 42 HH12 ARG 42 3.129 -1.448 -2.854 347 HH21 ARG 42 HH21 ARG 42 1.254 -4.366 -2.352 348 HH22 ARG 42 HH22 ARG 42 2.523 -3.620 -3.278 349 H LEU 43 HN LEU 43 -4.399 -4.297 2.034 350 HA LEU 43 HA LEU 43 -3.915 -4.636 4.858 351 HB2 LEU 43 HB2 LEU 43 -5.918 -5.552 2.916 352 HB3 LEU 43 HB1 LEU 43 -5.534 -6.712 4.171 353 HG LEU 43 HG LEU 43 -6.495 -3.887 4.642 354 HD11 LEU 43 HD11 LEU 43 -7.922 -6.528 4.927 355 HD12 LEU 43 HD12 LEU 43 -8.246 -5.292 3.712 356 HD13 LEU 43 HD13 LEU 43 -8.557 -4.957 5.415 357 HD21 LEU 43 HD21 LEU 43 -6.789 -4.733 6.988 358 HD22 LEU 43 HD22 LEU 43 -5.115 -4.534 6.471 359 HD23 LEU 43 HD23 LEU 43 -5.836 -6.144 6.526 360 H ILE 44 HN ILE 44 -2.556 -5.978 5.750 361 HA ILE 44 HA ILE 44 -1.510 -8.228 4.167 362 HB ILE 44 HB ILE 44 -0.097 -6.204 5.850 363 HG12 ILE 44 HG12 ILE 44 1.675 -6.735 4.045 364 HG13 ILE 44 HG11 ILE 44 0.380 -7.604 3.234 365 HG21 ILE 44 HG21 ILE 44 0.402 -8.283 7.024 366 HG22 ILE 44 HG22 ILE 44 1.828 -7.669 6.187 367 HG23 ILE 44 HG23 ILE 44 0.921 -9.022 5.508 368 HD11 ILE 44 HD11 ILE 44 0.559 -5.404 2.318 369 HD12 ILE 44 HD12 ILE 44 0.442 -4.681 3.922 370 HD13 ILE 44 HD13 ILE 44 -0.945 -5.520 3.228 371 H PHE 45 HN PHE 45 -1.396 -10.186 5.158 372 HA PHE 45 HA PHE 45 -2.138 -10.349 7.999 373 HB2 PHE 45 HB2 PHE 45 -4.097 -10.808 6.449 374 HB3 PHE 45 HB1 PHE 45 -3.212 -12.221 5.886 375 HD1 PHE 45 HD1 PHE 45 -4.376 -10.663 9.066 376 HD2 PHE 45 HD2 PHE 45 -3.640 -14.242 6.884 377 HE1 PHE 45 HE1 PHE 45 -5.333 -11.979 10.908 378 HE2 PHE 45 HE2 PHE 45 -4.597 -15.564 8.724 379 HZ PHE 45 HZ PHE 45 -5.446 -14.434 10.737 380 H ALA 46 HN ALA 46 -0.521 -11.285 9.012 381 HA ALA 46 HA ALA 46 1.177 -12.677 9.573 382 HB1 ALA 46 HB1 ALA 46 1.157 -14.953 8.774 383 HB2 ALA 46 HB2 ALA 46 0.096 -14.512 7.436 384 HB3 ALA 46 HB3 ALA 46 -0.496 -14.432 9.095 385 H GLY 47 HN GLY 47 1.326 -10.758 7.203 386 HA2 GLY 47 HA2 GLY 47 3.418 -10.030 6.307 387 HA3 GLY 47 HA1 GLY 47 3.952 -11.703 6.288 388 H LYS 48 HN LYS 48 0.950 -11.987 5.146 389 HA LYS 48 HA LYS 48 1.870 -11.720 2.365 390 HB2 LYS 48 HB2 LYS 48 -0.473 -13.325 3.411 391 HB3 LYS 48 HB1 LYS 48 0.157 -13.345 1.770 392 HG2 LYS 48 HG2 LYS 48 2.339 -14.173 2.792 393 HG3 LYS 48 HG1 LYS 48 1.402 -14.459 4.261 394 HD2 LYS 48 HD2 LYS 48 0.884 -15.653 1.537 395 HD3 LYS 48 HD1 LYS 48 1.542 -16.491 2.943 396 HE2 LYS 48 HE2 LYS 48 -0.564 -16.029 4.155 397 HE3 LYS 48 HE1 LYS 48 -1.216 -15.297 2.688 398 HZ1 LYS 48 HZ1 LYS 48 -0.980 -17.405 1.558 399 HZ2 LYS 48 HZ2 LYS 48 -1.920 -17.595 2.950 400 HZ3 LYS 48 HZ3 LYS 48 -0.312 -18.111 2.943 401 H GLN 49 HN GLN 49 0.525 -10.798 0.792 402 HA GLN 49 HA GLN 49 -1.083 -8.633 1.819 403 HB2 GLN 49 HB2 GLN 49 0.542 -8.853 -0.340 404 HB3 GLN 49 HB1 GLN 49 -1.027 -9.115 -1.088 405 HG2 GLN 49 HG2 GLN 49 -1.827 -7.007 -0.144 406 HG3 GLN 49 HG1 GLN 49 -0.249 -6.738 0.587 407 HE21 GLN 49 HE21 GLN 49 -0.698 -8.136 -2.589 408 HE22 GLN 49 HE22 GLN 49 -0.068 -6.798 -3.476 409 H LEU 50 HN LEU 50 -3.242 -8.318 1.534 410 HA LEU 50 HA LEU 50 -4.783 -10.703 0.784 411 HB2 LEU 50 HB2 LEU 50 -5.794 -8.246 2.217 412 HB3 LEU 50 HB1 LEU 50 -6.598 -9.797 2.068 413 HG LEU 50 HG LEU 50 -4.127 -9.203 3.697 414 HD11 LEU 50 HD11 LEU 50 -5.484 -9.579 5.602 415 HD12 LEU 50 HD12 LEU 50 -6.832 -10.139 4.616 416 HD13 LEU 50 HD13 LEU 50 -6.357 -8.444 4.575 417 HD21 LEU 50 HD21 LEU 50 -4.438 -11.565 4.482 418 HD22 LEU 50 HD22 LEU 50 -3.850 -11.394 2.830 419 HD23 LEU 50 HD23 LEU 50 -5.541 -11.797 3.128 420 H GLU 51 HN GLU 51 -5.781 -10.723 -1.121 421 HA GLU 51 HA GLU 51 -5.845 -8.349 -2.754 422 HB2 GLU 51 HB2 GLU 51 -6.970 -11.113 -3.264 423 HB3 GLU 51 HB1 GLU 51 -6.881 -9.822 -4.452 424 HG2 GLU 51 HG2 GLU 51 -4.452 -9.843 -4.311 425 HG3 GLU 51 HG1 GLU 51 -4.526 -11.118 -3.095 426 H ASP 52 HN ASP 52 -7.670 -7.282 -3.534 427 HA ASP 52 HA ASP 52 -9.693 -6.705 -1.749 428 HB2 ASP 52 HB2 ASP 52 -9.660 -6.415 -4.752 429 HB3 ASP 52 HB1 ASP 52 -10.888 -5.702 -3.716 430 H GLY 53 HN GLY 53 -9.945 -8.785 -4.635 431 HA2 GLY 53 HA2 GLY 53 -12.643 -9.552 -3.953 432 HA3 GLY 53 HA1 GLY 53 -11.713 -10.118 -5.327 433 H ARG 54 HN ARG 54 -11.231 -10.332 -1.798 434 HA ARG 54 HA ARG 54 -11.391 -13.257 -2.011 435 HB2 ARG 54 HB2 ARG 54 -9.239 -11.815 -0.443 436 HB3 ARG 54 HB1 ARG 54 -9.439 -13.553 -0.590 437 HG2 ARG 54 HG2 ARG 54 -8.876 -11.787 -2.947 438 HG3 ARG 54 HG1 ARG 54 -7.605 -12.497 -1.951 439 HD2 ARG 54 HD2 ARG 54 -8.397 -14.724 -2.477 440 HD3 ARG 54 HD1 ARG 54 -9.744 -14.051 -3.396 441 HE ARG 54 HE ARG 54 -7.308 -13.046 -4.411 442 HH11 ARG 54 HH11 ARG 54 -9.148 -16.029 -4.309 443 HH12 ARG 54 HH12 ARG 54 -8.532 -16.599 -5.826 444 HH21 ARG 54 HH21 ARG 54 -6.486 -13.796 -6.371 445 HH22 ARG 54 HH22 ARG 54 -7.012 -15.334 -7.002 446 H THR 55 HN THR 55 -11.965 -14.276 0.022 447 HA THR 55 HA THR 55 -13.354 -12.388 1.796 448 HB THR 55 HB THR 55 -14.676 -14.312 2.573 449 HG1 THR 55 HG1 THR 55 -13.059 -15.746 0.700 450 HG21 THR 55 HG21 THR 55 -14.644 -14.110 -0.440 451 HG22 THR 55 HG22 THR 55 -15.447 -12.978 0.646 452 HG23 THR 55 HG23 THR 55 -15.990 -14.652 0.564 453 H LEU 56 HN LEU 56 -13.412 -13.019 4.134 454 HA LEU 56 HA LEU 56 -10.796 -13.228 5.145 455 HB2 LEU 56 HB2 LEU 56 -13.433 -13.633 6.551 456 HB3 LEU 56 HB1 LEU 56 -11.893 -13.416 7.356 457 HG LEU 56 HG LEU 56 -13.379 -11.381 5.695 458 HD11 LEU 56 HD11 LEU 56 -12.603 -11.449 8.603 459 HD12 LEU 56 HD12 LEU 56 -14.226 -11.679 7.955 460 HD13 LEU 56 HD13 LEU 56 -13.420 -10.120 7.783 461 HD21 LEU 56 HD21 LEU 56 -11.548 -9.844 6.256 462 HD22 LEU 56 HD22 LEU 56 -11.009 -11.178 5.238 463 HD23 LEU 56 HD23 LEU 56 -10.654 -11.189 6.965 464 H SER 57 HN SER 57 -13.168 -15.637 4.365 465 HA SER 57 HA SER 57 -12.007 -17.735 5.934 466 HB2 SER 57 HB2 SER 57 -13.854 -17.985 3.551 467 HB3 SER 57 HB1 SER 57 -13.559 -19.201 4.796 468 HG SER 57 HG SER 57 -14.584 -16.630 5.419 469 H ASP 58 HN ASP 58 -11.322 -16.309 2.880 470 HA ASP 58 HA ASP 58 -10.151 -18.492 1.530 471 HB2 ASP 58 HB2 ASP 58 -9.963 -15.520 1.291 472 HB3 ASP 58 HB1 ASP 58 -8.761 -16.499 0.460 473 H TYR 59 HN TYR 59 -8.708 -15.958 3.548 474 HA TYR 59 HA TYR 59 -6.145 -17.339 3.532 475 HB2 TYR 59 HB2 TYR 59 -6.951 -14.765 4.900 476 HB3 TYR 59 HB1 TYR 59 -5.312 -15.389 4.760 477 HD1 TYR 59 HD1 TYR 59 -4.191 -15.426 2.551 478 HD2 TYR 59 HD2 TYR 59 -8.003 -13.619 3.091 479 HE1 TYR 59 HE1 TYR 59 -3.917 -14.226 0.423 480 HE2 TYR 59 HE2 TYR 59 -7.742 -12.413 0.963 481 HH TYR 59 HH TYR 59 -5.342 -13.196 -1.303 482 H ASN 60 HN ASN 60 -8.896 -17.793 5.112 483 HA ASN 60 HA ASN 60 -9.549 -18.832 7.005 484 HB2 ASN 60 HB2 ASN 60 -7.665 -20.384 6.313 485 HB3 ASN 60 HB1 ASN 60 -6.656 -19.540 7.484 486 HD21 ASN 60 HD21 ASN 60 -6.409 -21.479 8.635 487 HD22 ASN 60 HD22 ASN 60 -7.668 -22.081 9.658 488 H ILE 61 HN ILE 61 -9.535 -16.280 7.347 489 HA ILE 61 HA ILE 61 -7.943 -15.539 9.669 490 HB ILE 61 HB ILE 61 -10.016 -13.933 8.157 491 HG12 ILE 61 HG12 ILE 61 -6.996 -13.825 7.981 492 HG13 ILE 61 HG11 ILE 61 -8.044 -14.585 6.788 493 HG21 ILE 61 HG21 ILE 61 -9.106 -12.005 9.305 494 HG22 ILE 61 HG22 ILE 61 -7.921 -13.019 10.129 495 HG23 ILE 61 HG23 ILE 61 -9.640 -13.203 10.483 496 HD11 ILE 61 HD11 ILE 61 -8.046 -11.667 7.519 497 HD12 ILE 61 HD12 ILE 61 -9.061 -12.437 6.300 498 HD13 ILE 61 HD13 ILE 61 -7.313 -12.375 6.080 499 H GLN 62 HN GLN 62 -8.659 -16.306 11.536 500 HA GLN 62 HA GLN 62 -11.483 -16.795 11.982 501 HB2 GLN 62 HB2 GLN 62 -9.041 -17.316 13.686 502 HB3 GLN 62 HB1 GLN 62 -10.680 -17.733 14.165 503 HG2 GLN 62 HG2 GLN 62 -10.623 -19.611 12.994 504 HG3 GLN 62 HG1 GLN 62 -10.094 -18.761 11.542 505 HE21 GLN 62 HE21 GLN 62 -7.905 -18.621 11.080 506 HE22 GLN 62 HE22 GLN 62 -6.725 -19.594 11.886 507 H LYS 63 HN LYS 63 -11.891 -16.304 14.598 508 HA LYS 63 HA LYS 63 -12.148 -13.445 14.620 509 HB2 LYS 63 HB2 LYS 63 -13.428 -13.751 16.659 510 HB3 LYS 63 HB1 LYS 63 -13.952 -14.907 15.445 511 HG2 LYS 63 HG2 LYS 63 -12.400 -16.569 16.601 512 HG3 LYS 63 HG1 LYS 63 -12.342 -15.403 17.926 513 HD2 LYS 63 HD2 LYS 63 -14.897 -15.469 17.847 514 HD3 LYS 63 HD1 LYS 63 -14.707 -16.913 16.852 515 HE2 LYS 63 HE2 LYS 63 -14.879 -17.838 18.951 516 HE3 LYS 63 HE1 LYS 63 -13.130 -17.689 18.787 517 HZ1 LYS 63 HZ1 LYS 63 -13.253 -15.594 20.026 518 HZ2 LYS 63 HZ2 LYS 63 -13.840 -16.902 20.931 519 HZ3 LYS 63 HZ3 LYS 63 -14.922 -15.812 20.226 520 H GLU 64 HN GLU 64 -11.332 -12.024 16.164 521 HA GLU 64 HA GLU 64 -9.820 -11.097 17.558 522 HB2 GLU 64 HB2 GLU 64 -9.391 -13.955 18.417 523 HB3 GLU 64 HB1 GLU 64 -8.590 -12.585 19.174 524 HG2 GLU 64 HG2 GLU 64 -10.444 -11.932 20.270 525 HG3 GLU 64 HG1 GLU 64 -11.522 -12.394 18.952 526 H SER 65 HN SER 65 -9.109 -12.354 14.830 527 HA SER 65 HA SER 65 -6.273 -12.801 15.046 528 HB2 SER 65 HB2 SER 65 -7.939 -12.361 12.556 529 HB3 SER 65 HB1 SER 65 -6.315 -13.044 12.628 530 HG SER 65 HG SER 65 -8.769 -14.196 13.228 531 H THR 66 HN THR 66 -4.651 -11.467 14.027 532 HA THR 66 HA THR 66 -5.350 -8.620 14.170 533 HB THR 66 HB THR 66 -2.539 -9.670 14.039 534 HG1 THR 66 HG1 THR 66 -4.352 -9.739 16.212 535 HG21 THR 66 HG21 THR 66 -2.971 -7.234 13.864 536 HG22 THR 66 HG22 THR 66 -2.039 -7.658 15.300 537 HG23 THR 66 HG23 THR 66 -3.756 -7.285 15.444 538 H LEU 67 HN LEU 67 -5.470 -7.450 12.376 539 HA LEU 67 HA LEU 67 -4.216 -8.495 9.919 540 HB2 LEU 67 HB2 LEU 67 -6.723 -6.922 10.408 541 HB3 LEU 67 HB1 LEU 67 -5.907 -6.803 8.862 542 HG LEU 67 HG LEU 67 -6.083 -9.380 8.797 543 HD11 LEU 67 HD11 LEU 67 -7.911 -10.346 10.034 544 HD12 LEU 67 HD12 LEU 67 -8.256 -8.796 10.800 545 HD13 LEU 67 HD13 LEU 67 -6.748 -9.638 11.155 546 HD21 LEU 67 HD21 LEU 67 -8.554 -7.670 8.570 547 HD22 LEU 67 HD22 LEU 67 -8.309 -9.247 7.817 548 HD23 LEU 67 HD23 LEU 67 -7.315 -7.873 7.330 549 H HIS 68 HN HIS 68 -2.693 -7.290 8.961 550 HA HIS 68 HA HIS 68 -1.950 -4.780 10.247 551 HB2 HIS 68 HB2 HIS 68 -0.488 -6.416 8.161 552 HB3 HIS 68 HB1 HIS 68 0.162 -5.025 9.020 553 HD2 HIS 68 HD2 HIS 68 0.303 -5.513 11.918 554 HE1 HIS 68 HE1 HIS 68 0.854 -9.654 11.265 555 HE2 HIS 68 HE2 HIS 68 1.226 -7.737 12.878 556 H LEU 69 HN LEU 69 -2.436 -2.865 9.389 557 HA LEU 69 HA LEU 69 -3.283 -2.790 6.576 558 HB2 LEU 69 HB2 LEU 69 -4.935 -2.063 8.280 559 HB3 LEU 69 HB1 LEU 69 -3.831 -0.790 8.766 560 HG LEU 69 HG LEU 69 -3.981 0.117 6.423 561 HD11 LEU 69 HD11 LEU 69 -6.059 -0.594 5.182 562 HD12 LEU 69 HD12 LEU 69 -6.102 -2.004 6.242 563 HD13 LEU 69 HD13 LEU 69 -4.722 -1.743 5.175 564 HD21 LEU 69 HD21 LEU 69 -6.465 -0.037 8.119 565 HD22 LEU 69 HD22 LEU 69 -6.250 1.080 6.770 566 HD23 LEU 69 HD23 LEU 69 -5.196 1.188 8.181 567 H VAL 70 HN VAL 70 -1.598 -2.299 5.335 568 HA VAL 70 HA VAL 70 0.346 -0.306 6.232 569 HB VAL 70 HB VAL 70 0.329 -2.199 3.874 570 HG11 VAL 70 HG11 VAL 70 2.438 -0.200 4.669 571 HG12 VAL 70 HG12 VAL 70 1.448 -0.150 3.212 572 HG13 VAL 70 HG13 VAL 70 2.624 -1.444 3.434 573 HG21 VAL 70 HG21 VAL 70 0.752 -3.294 5.977 574 HG22 VAL 70 HG22 VAL 70 1.980 -2.099 6.391 575 HG23 VAL 70 HG23 VAL 70 2.249 -3.212 5.049 576 H LEU 71 HN LEU 71 0.511 1.695 5.336 577 HA LEU 71 HA LEU 71 -1.601 2.489 3.496 578 HB2 LEU 71 HB2 LEU 71 0.440 4.137 4.996 579 HB3 LEU 71 HB1 LEU 71 -0.827 4.794 3.982 580 HG LEU 71 HG LEU 71 -1.196 3.280 6.563 581 HD11 LEU 71 HD11 LEU 71 -1.731 6.140 5.789 582 HD12 LEU 71 HD12 LEU 71 -0.476 5.561 6.883 583 HD13 LEU 71 HD13 LEU 71 -2.176 5.400 7.325 584 HD21 LEU 71 HD21 LEU 71 -3.599 3.807 6.258 585 HD22 LEU 71 HD22 LEU 71 -2.976 2.649 5.086 586 HD23 LEU 71 HD23 LEU 71 -3.238 4.328 4.611 587 H ARG 72 HN ARG 72 -1.220 3.463 1.508 588 HA ARG 72 HA ARG 72 1.463 2.958 0.401 589 HB2 ARG 72 HB2 ARG 72 -0.060 1.613 -0.787 590 HB3 ARG 72 HB1 ARG 72 -1.296 2.861 -0.798 591 HG2 ARG 72 HG2 ARG 72 -0.018 4.152 -2.402 592 HG3 ARG 72 HG1 ARG 72 1.276 2.952 -2.358 593 HD2 ARG 72 HD2 ARG 72 -1.506 2.104 -3.030 594 HD3 ARG 72 HD1 ARG 72 -0.517 2.889 -4.259 595 HE ARG 72 HE ARG 72 1.137 0.981 -3.407 596 HH11 ARG 72 HH11 ARG 72 -2.261 0.827 -4.187 597 HH12 ARG 72 HH12 ARG 72 -2.192 -0.786 -4.817 598 HH21 ARG 72 HH21 ARG 72 1.263 -1.149 -4.275 599 HH22 ARG 72 HH22 ARG 72 -0.183 -1.910 -4.865 600 H LEU 73 HN LEU 73 2.617 4.597 -0.334 601 HA LEU 73 HA LEU 73 1.315 7.091 -1.099 602 HB2 LEU 73 HB2 LEU 73 3.299 6.775 1.126 603 HB3 LEU 73 HB1 LEU 73 3.247 8.265 0.203 604 HG LEU 73 HG LEU 73 0.640 8.040 0.858 605 HD11 LEU 73 HD11 LEU 73 1.486 5.944 2.220 606 HD12 LEU 73 HD12 LEU 73 0.229 7.011 2.852 607 HD13 LEU 73 HD13 LEU 73 1.893 7.182 3.408 608 HD21 LEU 73 HD21 LEU 73 1.107 9.636 2.660 609 HD22 LEU 73 HD22 LEU 73 2.024 10.006 1.200 610 HD23 LEU 73 HD23 LEU 73 2.820 9.228 2.569 611 H ARG 74 HN ARG 74 2.048 7.521 -3.054 612 HA ARG 74 HA ARG 74 4.573 6.416 -3.949 613 HB2 ARG 74 HB2 ARG 74 2.444 8.001 -5.392 614 HB3 ARG 74 HB1 ARG 74 3.898 7.377 -6.158 615 HG2 ARG 74 HG2 ARG 74 1.601 5.827 -5.001 616 HG3 ARG 74 HG1 ARG 74 2.176 5.855 -6.669 617 HD2 ARG 74 HD2 ARG 74 4.382 4.939 -5.672 618 HD3 ARG 74 HD1 ARG 74 3.391 4.528 -4.274 619 HE ARG 74 HE ARG 74 2.619 3.590 -6.945 620 HH11 ARG 74 HH11 ARG 74 3.619 2.899 -3.644 621 HH12 ARG 74 HH12 ARG 74 3.345 1.195 -3.795 622 HH21 ARG 74 HH21 ARG 74 2.217 1.347 -7.116 623 HH22 ARG 74 HH22 ARG 74 2.559 0.305 -5.764 624 H GLY 75 HN GLY 75 4.152 8.797 -2.039 625 HA2 GLY 75 HA2 GLY 75 5.470 10.944 -3.478 626 HA3 GLY 75 HA1 GLY 75 4.930 10.982 -1.803 627 H GLY 76 HN GLY 76 6.813 11.726 -0.913 628 HA2 GLY 76 HA2 GLY 76 8.749 11.138 0.301 629 HA3 GLY 76 HA1 GLY 76 8.967 9.755 -0.767 630 H1 SER 453 HT1 SER 453 19.454 11.244 16.711 631 H2 SER 453 HT2 SER 453 20.791 10.309 17.147 632 H3 SER 453 HT3 SER 453 20.532 11.809 17.882 633 HA SER 453 HA SER 453 19.924 10.043 19.375 634 HB2 SER 453 HB2 SER 453 17.340 11.244 18.425 635 HB3 SER 453 HB1 SER 453 17.908 10.991 20.077 636 HG SER 453 HG SER 453 18.616 12.958 20.002 637 H ASN 454 HN ASN 454 17.767 10.060 16.529 638 HA ASN 454 HA ASN 454 16.696 8.414 15.392 639 HB2 ASN 454 HB2 ASN 454 18.602 6.547 16.823 640 HB3 ASN 454 HB1 ASN 454 17.592 6.121 15.445 641 HD21 ASN 454 HD21 ASN 454 20.540 6.188 15.889 642 HD22 ASN 454 HD22 ASN 454 21.157 7.115 14.567 643 H SER 455 HN SER 455 16.090 9.141 18.322 644 HA SER 455 HA SER 455 15.019 6.939 19.647 645 HB2 SER 455 HB2 SER 455 13.632 9.549 19.922 646 HB3 SER 455 HB1 SER 455 14.242 8.459 21.164 647 HG SER 455 HG SER 455 15.631 10.119 21.225 648 H GLN 456 HN GLN 456 13.325 9.339 17.628 649 HA GLN 456 HA GLN 456 10.868 7.869 17.688 650 HB2 GLN 456 HB2 GLN 456 11.658 10.089 15.796 651 HB3 GLN 456 HB1 GLN 456 10.029 9.553 16.169 652 HG2 GLN 456 HG2 GLN 456 11.926 10.849 18.114 653 HG3 GLN 456 HG1 GLN 456 10.604 11.659 17.277 654 HE21 GLN 456 HE21 GLN 456 11.043 11.393 20.110 655 HE22 GLN 456 HE22 GLN 456 9.672 10.566 20.759 656 H LEU 457 HN LEU 457 13.561 8.190 15.456 657 HA LEU 457 HA LEU 457 12.414 6.921 13.232 658 HB2 LEU 457 HB2 LEU 457 15.288 7.096 14.123 659 HB3 LEU 457 HB1 LEU 457 14.789 6.448 12.572 660 HG LEU 457 HG LEU 457 14.252 9.272 13.492 661 HD11 LEU 457 HD11 LEU 457 16.015 9.953 11.989 662 HD12 LEU 457 HD12 LEU 457 16.328 8.274 11.547 663 HD13 LEU 457 HD13 LEU 457 16.655 8.831 13.188 664 HD21 LEU 457 HD21 LEU 457 12.623 8.513 11.881 665 HD22 LEU 457 HD22 LEU 457 13.901 7.914 10.824 666 HD23 LEU 457 HD23 LEU 457 13.731 9.646 11.107 667 H ASN 458 HN ASN 458 14.440 5.564 15.836 668 HA ASN 458 HA ASN 458 14.384 2.912 14.873 669 HB2 ASN 458 HB2 ASN 458 15.076 4.195 17.478 670 HB3 ASN 458 HB1 ASN 458 14.837 2.451 17.442 671 HD21 ASN 458 HD21 ASN 458 17.259 4.002 17.938 672 HD22 ASN 458 HD22 ASN 458 18.408 3.457 16.761 673 H ALA 459 HN ALA 459 12.303 4.662 17.110 674 HA ALA 459 HA ALA 459 10.745 2.480 17.969 675 HB1 ALA 459 HB1 ALA 459 10.752 4.654 19.103 676 HB2 ALA 459 HB2 ALA 459 9.116 4.154 18.674 677 HB3 ALA 459 HB3 ALA 459 9.946 5.379 17.714 678 H MET 460 HN MET 460 10.403 4.731 15.263 679 HA MET 460 HA MET 460 7.911 3.748 14.355 680 HB2 MET 460 HB2 MET 460 10.098 5.380 13.111 681 HB3 MET 460 HB1 MET 460 8.750 4.814 12.133 682 HG2 MET 460 HG2 MET 460 7.221 5.904 13.806 683 HG3 MET 460 HG1 MET 460 8.654 6.635 14.522 684 HE1 MET 460 HE1 MET 460 9.960 8.919 11.634 685 HE2 MET 460 HE2 MET 460 10.450 7.257 11.955 686 HE3 MET 460 HE3 MET 460 10.204 8.375 13.296 687 H ALA 461 HN ALA 461 11.258 2.950 13.537 688 HA ALA 461 HA ALA 461 10.701 1.159 11.436 689 HB1 ALA 461 HB1 ALA 461 13.032 1.114 13.355 690 HB2 ALA 461 HB2 ALA 461 12.944 2.064 11.873 691 HB3 ALA 461 HB3 ALA 461 12.954 0.303 11.793 692 H HIS 462 HN HIS 462 10.904 0.758 14.922 693 HA HIS 462 HA HIS 462 10.706 -2.056 15.008 694 HB2 HIS 462 HB2 HIS 462 11.266 -0.257 16.865 695 HB3 HIS 462 HB1 HIS 462 9.539 -0.358 17.177 696 HD2 HIS 462 HD2 HIS 462 10.086 -3.814 16.370 697 HE1 HIS 462 HE1 HIS 462 11.505 -3.518 20.345 698 HE2 HIS 462 HE2 HIS 462 10.607 -5.087 18.567 699 H GLN 463 HN GLN 463 8.328 0.510 14.791 700 HA GLN 463 HA GLN 463 6.041 -1.034 15.363 701 HB2 GLN 463 HB2 GLN 463 6.116 1.465 15.315 702 HB3 GLN 463 HB1 GLN 463 6.214 1.391 13.562 703 HG2 GLN 463 HG2 GLN 463 3.954 1.874 14.296 704 HG3 GLN 463 HG1 GLN 463 4.027 0.313 13.476 705 HE21 GLN 463 HE21 GLN 463 3.618 -1.542 14.617 706 HE22 GLN 463 HE22 GLN 463 2.991 -1.541 16.230 707 H ILE 464 HN ILE 464 7.846 -0.437 12.397 708 HA ILE 464 HA ILE 464 5.988 -1.695 10.647 709 HB ILE 464 HB ILE 464 8.961 -1.268 10.282 710 HG12 ILE 464 HG12 ILE 464 6.577 0.380 9.419 711 HG13 ILE 464 HG11 ILE 464 7.785 0.838 10.615 712 HG21 ILE 464 HG21 ILE 464 8.499 -1.518 7.882 713 HG22 ILE 464 HG22 ILE 464 6.823 -1.925 8.256 714 HG23 ILE 464 HG23 ILE 464 8.128 -2.987 8.785 715 HD11 ILE 464 HD11 ILE 464 8.285 0.419 7.675 716 HD12 ILE 464 HD12 ILE 464 9.488 0.893 8.877 717 HD13 ILE 464 HD13 ILE 464 8.147 1.972 8.498 718 H GLN 465 HN GLN 465 8.758 -2.792 12.515 719 HA GLN 465 HA GLN 465 8.981 -5.385 11.433 720 HB2 GLN 465 HB2 GLN 465 10.584 -4.121 13.026 721 HB3 GLN 465 HB1 GLN 465 9.558 -4.736 14.316 722 HG2 GLN 465 HG2 GLN 465 11.395 -6.216 14.107 723 HG3 GLN 465 HG1 GLN 465 9.985 -7.040 13.444 724 HE21 GLN 465 HE21 GLN 465 11.123 -8.404 12.130 725 HE22 GLN 465 HE22 GLN 465 11.986 -7.866 10.727 726 H GLU 466 HN GLU 466 6.782 -3.950 13.654 727 HA GLU 466 HA GLU 466 5.736 -6.450 14.660 728 HB2 GLU 466 HB2 GLU 466 5.233 -3.551 15.122 729 HB3 GLU 466 HB1 GLU 466 3.945 -4.682 15.517 730 HG2 GLU 466 HG2 GLU 466 6.650 -5.318 16.522 731 HG3 GLU 466 HG1 GLU 466 5.814 -3.952 17.260 732 H MET 467 HN MET 467 5.483 -4.897 11.802 733 HA MET 467 HA MET 467 2.690 -5.743 11.359 734 HB2 MET 467 HB2 MET 467 4.335 -3.736 9.796 735 HB3 MET 467 HB1 MET 467 2.669 -4.180 9.458 736 HG2 MET 467 HG2 MET 467 3.367 -3.119 12.147 737 HG3 MET 467 HG1 MET 467 3.246 -2.007 10.788 738 HE1 MET 467 HE1 MET 467 0.969 -2.973 8.992 739 HE2 MET 467 HE2 MET 467 1.071 -1.326 9.614 740 HE3 MET 467 HE3 MET 467 -0.444 -2.216 9.732 741 H PHE 468 HN PHE 468 5.961 -5.710 10.058 742 HA PHE 468 HA PHE 468 5.231 -7.947 8.289 743 HB2 PHE 468 HB2 PHE 468 6.784 -5.511 7.806 744 HB3 PHE 468 HB1 PHE 468 7.604 -6.981 7.294 745 HD1 PHE 468 HD1 PHE 468 4.434 -5.098 6.943 746 HD2 PHE 468 HD2 PHE 468 7.026 -8.047 5.303 747 HE1 PHE 468 HE1 PHE 468 3.072 -5.152 4.895 748 HE2 PHE 468 HE2 PHE 468 5.669 -8.103 3.252 749 HZ PHE 468 HZ PHE 468 3.691 -6.655 3.048 750 HA PRO 469 HA PRO 469 8.203 -9.682 11.311 751 HB2 PRO 469 HB2 PRO 469 6.641 -12.104 11.221 752 HB3 PRO 469 HB1 PRO 469 6.809 -10.957 12.559 753 HG2 PRO 469 HG2 PRO 469 4.495 -11.367 11.171 754 HG3 PRO 469 HG1 PRO 469 4.886 -9.879 12.052 755 HD2 PRO 469 HD2 PRO 469 5.066 -10.441 9.123 756 HD3 PRO 469 HD1 PRO 469 4.554 -8.962 9.967 757 H GLN 470 HN GLN 470 8.504 -9.636 8.398 758 HA GLN 470 HA GLN 470 9.960 -12.160 8.120 759 HB2 GLN 470 HB2 GLN 470 9.165 -12.501 5.849 760 HB3 GLN 470 HB1 GLN 470 7.812 -12.480 6.972 761 HG2 GLN 470 HG2 GLN 470 7.665 -9.964 6.321 762 HG3 GLN 470 HG1 GLN 470 8.595 -10.475 4.911 763 HE21 GLN 470 HE21 GLN 470 6.869 -10.001 3.524 764 HE22 GLN 470 HE22 GLN 470 5.452 -10.994 3.451 765 H VAL 471 HN VAL 471 10.013 -8.861 7.996 766 HA VAL 471 HA VAL 471 12.095 -8.796 5.930 767 HB VAL 471 HB VAL 471 10.241 -7.226 5.575 768 HG11 VAL 471 HG11 VAL 471 9.828 -5.368 7.053 769 HG12 VAL 471 HG12 VAL 471 11.104 -5.913 8.143 770 HG13 VAL 471 HG13 VAL 471 9.646 -6.884 7.937 771 HG21 VAL 471 HG21 VAL 471 12.431 -6.610 4.735 772 HG22 VAL 471 HG22 VAL 471 12.841 -5.870 6.284 773 HG23 VAL 471 HG23 VAL 471 11.566 -5.173 5.282 774 HA PRO 472 HA PRO 472 15.171 -8.530 9.131 775 HB2 PRO 472 HB2 PRO 472 16.730 -7.085 7.052 776 HB3 PRO 472 HB1 PRO 472 17.159 -8.540 7.974 777 HG2 PRO 472 HG2 PRO 472 16.502 -8.708 5.417 778 HG3 PRO 472 HG1 PRO 472 15.981 -9.943 6.580 779 HD2 PRO 472 HD2 PRO 472 14.403 -7.717 5.367 780 HD3 PRO 472 HD1 PRO 472 13.915 -9.384 5.728 781 H TYR 473 HN TYR 473 15.443 -7.086 10.695 782 HA TYR 473 HA TYR 473 14.261 -4.584 10.743 783 HB2 TYR 473 HB2 TYR 473 15.020 -6.023 12.696 784 HB3 TYR 473 HB1 TYR 473 16.627 -5.361 12.442 785 HD1 TYR 473 HD2 TYR 473 13.206 -4.613 13.545 786 HD2 TYR 473 HD1 TYR 473 17.149 -3.086 13.067 787 HE1 TYR 473 HE2 TYR 473 12.631 -2.700 14.979 788 HE2 TYR 473 HE1 TYR 473 16.588 -1.173 14.504 789 HH TYR 473 HH TYR 473 14.540 0.065 15.221 790 H HIS 474 HN HIS 474 17.614 -5.422 9.958 791 HA HIS 474 HA HIS 474 18.551 -2.754 9.897 792 HB2 HIS 474 HB2 HIS 474 20.501 -3.645 8.670 793 HB3 HIS 474 HB1 HIS 474 20.131 -4.570 10.117 794 HD2 HIS 474 HD2 HIS 474 20.003 -4.967 6.229 795 HE1 HIS 474 HE1 HIS 474 19.654 -8.764 8.058 796 HE2 HIS 474 HE2 HIS 474 20.102 -7.538 5.889 797 H LEU 475 HN LEU 475 16.729 -4.605 7.605 798 HA LEU 475 HA LEU 475 17.425 -2.878 5.387 799 HB2 LEU 475 HB2 LEU 475 15.483 -5.158 5.703 800 HB3 LEU 475 HB1 LEU 475 15.516 -4.172 4.255 801 HG LEU 475 HG LEU 475 17.752 -5.903 5.305 802 HD11 LEU 475 HD11 LEU 475 15.944 -7.117 4.198 803 HD12 LEU 475 HD12 LEU 475 17.428 -7.151 3.248 804 HD13 LEU 475 HD13 LEU 475 16.109 -6.076 2.786 805 HD21 LEU 475 HD21 LEU 475 18.797 -3.989 4.380 806 HD22 LEU 475 HD22 LEU 475 17.680 -3.957 3.014 807 HD23 LEU 475 HD23 LEU 475 18.872 -5.250 3.150 808 H VAL 476 HN VAL 476 15.038 -3.068 7.870 809 HA VAL 476 HA VAL 476 13.094 -1.374 6.651 810 HB VAL 476 HB VAL 476 13.529 -1.905 9.599 811 HG11 VAL 476 HG11 VAL 476 11.192 -1.286 9.857 812 HG12 VAL 476 HG12 VAL 476 11.073 -0.967 8.127 813 HG13 VAL 476 HG13 VAL 476 12.113 0.037 9.136 814 HG21 VAL 476 HG21 VAL 476 11.753 -3.358 7.644 815 HG22 VAL 476 HG22 VAL 476 11.836 -3.648 9.381 816 HG23 VAL 476 HG23 VAL 476 13.235 -3.990 8.363 817 H LEU 477 HN LEU 477 15.703 -0.895 8.988 818 HA LEU 477 HA LEU 477 15.300 1.859 9.397 819 HB2 LEU 477 HB2 LEU 477 17.419 -0.103 9.977 820 HB3 LEU 477 HB1 LEU 477 17.953 1.562 9.860 821 HG LEU 477 HG LEU 477 15.771 0.593 11.710 822 HD11 LEU 477 HD11 LEU 477 17.434 0.954 13.492 823 HD12 LEU 477 HD12 LEU 477 18.658 1.260 12.260 824 HD13 LEU 477 HD13 LEU 477 17.906 -0.331 12.380 825 HD21 LEU 477 HD21 LEU 477 15.460 2.906 11.128 826 HD22 LEU 477 HD22 LEU 477 17.163 3.251 11.421 827 HD23 LEU 477 HD23 LEU 477 16.108 2.817 12.765 828 H GLN 478 HN GLN 478 16.631 0.142 6.772 829 HA GLN 478 HA GLN 478 18.491 1.960 5.758 830 HB2 GLN 478 HB2 GLN 478 18.373 -0.266 4.865 831 HB3 GLN 478 HB1 GLN 478 16.708 -0.025 4.349 832 HG2 GLN 478 HG2 GLN 478 17.528 1.744 2.795 833 HG3 GLN 478 HG1 GLN 478 19.171 1.283 3.228 834 HE21 GLN 478 HE21 GLN 478 16.598 -1.057 2.962 835 HE22 GLN 478 HE22 GLN 478 17.176 -1.811 1.517 836 H ASP 479 HN ASP 479 15.059 1.581 4.773 837 HA ASP 479 HA ASP 479 15.178 4.045 3.285 838 HB2 ASP 479 HB2 ASP 479 13.782 2.146 2.530 839 HB3 ASP 479 HB1 ASP 479 12.760 2.361 3.951 840 H LEU 480 HN LEU 480 14.423 3.144 6.499 841 HA LEU 480 HA LEU 480 12.633 5.197 7.193 842 HB2 LEU 480 HB2 LEU 480 14.041 3.138 8.534 843 HB3 LEU 480 HB1 LEU 480 14.396 4.631 9.379 844 HG LEU 480 HG LEU 480 12.500 3.490 10.388 845 HD11 LEU 480 HD11 LEU 480 11.702 6.007 8.941 846 HD12 LEU 480 HD12 LEU 480 12.523 5.905 10.499 847 HD13 LEU 480 HD13 LEU 480 10.869 5.315 10.333 848 HD21 LEU 480 HD21 LEU 480 11.681 2.271 8.473 849 HD22 LEU 480 HD22 LEU 480 11.207 3.773 7.682 850 HD23 LEU 480 HD23 LEU 480 10.385 3.255 9.154 851 H GLN 481 HN GLN 481 15.963 5.228 6.469 852 HA GLN 481 HA GLN 481 16.441 7.813 7.726 853 HB2 GLN 481 HB2 GLN 481 18.171 5.829 6.263 854 HB3 GLN 481 HB1 GLN 481 18.746 7.452 6.621 855 HG2 GLN 481 HG2 GLN 481 18.722 7.085 8.918 856 HG3 GLN 481 HG1 GLN 481 17.662 5.683 8.777 857 HE21 GLN 481 HE21 GLN 481 19.168 4.541 10.057 858 HE22 GLN 481 HE22 GLN 481 20.620 3.905 9.369 859 H LEU 482 HN LEU 482 15.441 6.497 4.753 860 HA LEU 482 HA LEU 482 16.334 8.761 3.153 861 HB2 LEU 482 HB2 LEU 482 15.229 6.070 2.609 862 HB3 LEU 482 HB1 LEU 482 14.766 7.325 1.479 863 HG LEU 482 HG LEU 482 16.685 6.135 0.633 864 HD11 LEU 482 HD11 LEU 482 18.117 7.960 0.143 865 HD12 LEU 482 HD12 LEU 482 17.641 8.814 1.608 866 HD13 LEU 482 HD13 LEU 482 16.485 8.609 0.294 867 HD21 LEU 482 HD21 LEU 482 17.607 5.283 2.695 868 HD22 LEU 482 HD22 LEU 482 18.036 6.913 3.212 869 HD23 LEU 482 HD23 LEU 482 18.844 6.187 1.823 870 H THR 483 HN THR 483 13.198 7.082 3.232 871 HA THR 483 HA THR 483 11.794 9.490 2.589 872 HB THR 483 HB THR 483 9.750 8.101 2.883 873 HG1 THR 483 HG1 THR 483 11.022 5.702 3.090 874 HG21 THR 483 HG21 THR 483 10.204 6.549 1.037 875 HG22 THR 483 HG22 THR 483 11.935 6.805 1.248 876 HG23 THR 483 HG23 THR 483 10.904 8.137 0.726 877 H ARG 484 HN ARG 484 12.355 7.590 5.478 878 HA ARG 484 HA ARG 484 12.053 7.987 7.690 879 HB2 ARG 484 HB2 ARG 484 11.692 10.864 6.818 880 HB3 ARG 484 HB1 ARG 484 11.947 10.328 8.473 881 HG2 ARG 484 HG2 ARG 484 14.155 10.073 8.187 882 HG3 ARG 484 HG1 ARG 484 13.966 9.404 6.565 883 HD2 ARG 484 HD2 ARG 484 13.449 11.735 5.781 884 HD3 ARG 484 HD1 ARG 484 13.930 12.301 7.382 885 HE ARG 484 HE ARG 484 15.871 10.659 5.975 886 HH11 ARG 484 HH11 ARG 484 14.751 13.904 6.692 887 HH12 ARG 484 HH12 ARG 484 16.293 14.637 6.376 888 HH21 ARG 484 HH21 ARG 484 17.887 11.633 5.525 889 HH22 ARG 484 HH22 ARG 484 18.069 13.351 5.704 890 H SER 485 HN SER 485 9.830 7.424 5.844 891 HA SER 485 HA SER 485 7.634 8.178 7.640 892 HB2 SER 485 HB2 SER 485 7.290 9.630 5.783 893 HB3 SER 485 HB1 SER 485 7.729 8.379 4.626 894 HG SER 485 HG SER 485 5.480 8.025 6.299 895 H VAL 486 HN VAL 486 7.087 6.305 8.544 896 HA VAL 486 HA VAL 486 7.696 3.760 7.696 897 HB VAL 486 HB VAL 486 5.858 2.974 9.207 898 HG11 VAL 486 HG11 VAL 486 7.746 5.075 10.260 899 HG12 VAL 486 HG12 VAL 486 8.079 3.353 10.071 900 HG13 VAL 486 HG13 VAL 486 6.890 3.897 11.255 901 HG21 VAL 486 HG21 VAL 486 4.290 4.831 8.835 902 HG22 VAL 486 HG22 VAL 486 5.409 5.928 9.647 903 HG23 VAL 486 HG23 VAL 486 4.653 4.613 10.549 904 H GLU 487 HN GLU 487 4.957 5.742 6.823 905 HA GLU 487 HA GLU 487 3.366 3.727 5.659 906 HB2 GLU 487 HB2 GLU 487 3.469 6.651 4.905 907 HB3 GLU 487 HB1 GLU 487 2.127 5.543 4.659 908 HG2 GLU 487 HG2 GLU 487 1.352 6.518 6.529 909 HG3 GLU 487 HG1 GLU 487 2.391 5.334 7.319 910 H ILE 488 HN ILE 488 5.449 6.174 4.090 911 HA ILE 488 HA ILE 488 5.250 5.081 1.497 912 HB ILE 488 HB ILE 488 7.605 6.672 2.519 913 HG12 ILE 488 HG12 ILE 488 4.970 7.735 1.478 914 HG13 ILE 488 HG11 ILE 488 5.478 7.776 3.162 915 HG21 ILE 488 HG21 ILE 488 6.339 6.446 -0.211 916 HG22 ILE 488 HG22 ILE 488 7.873 5.734 0.293 917 HG23 ILE 488 HG23 ILE 488 7.700 7.488 0.205 918 HD11 ILE 488 HD11 ILE 488 5.812 9.927 2.136 919 HD12 ILE 488 HD12 ILE 488 6.790 9.201 0.861 920 HD13 ILE 488 HD13 ILE 488 7.373 9.205 2.525 921 H THR 489 HN THR 489 7.354 4.413 4.189 922 HA THR 489 HA THR 489 9.375 3.004 2.815 923 HB THR 489 HB THR 489 8.489 2.814 5.701 924 HG1 THR 489 HG1 THR 489 10.457 4.321 4.307 925 HG21 THR 489 HG21 THR 489 9.688 0.806 5.226 926 HG22 THR 489 HG22 THR 489 10.805 1.890 6.053 927 HG23 THR 489 HG23 THR 489 10.909 1.680 4.306 928 H THR 490 HN THR 490 6.713 1.712 4.832 929 HA THR 490 HA THR 490 7.144 -0.964 4.147 930 HB THR 490 HB THR 490 4.406 0.069 4.822 931 HG1 THR 490 HG1 THR 490 5.668 1.140 6.307 932 HG21 THR 490 HG21 THR 490 4.710 -2.341 4.434 933 HG22 THR 490 HG22 THR 490 4.295 -2.007 6.115 934 HG23 THR 490 HG23 THR 490 5.962 -2.380 5.675 935 H ASP 491 HN ASP 491 5.234 1.555 2.581 936 HA ASP 491 HA ASP 491 3.844 -0.095 0.758 937 HB2 ASP 491 HB2 ASP 491 3.166 2.218 1.133 938 HB3 ASP 491 HB1 ASP 491 4.703 2.800 0.507 939 H ASN 492 HN ASN 492 6.868 1.747 0.452 940 HA ASN 492 HA ASN 492 7.473 0.885 -2.164 941 HB2 ASN 492 HB2 ASN 492 8.906 2.295 -0.011 942 HB3 ASN 492 HB1 ASN 492 9.940 1.392 -1.114 943 HD21 ASN 492 HD21 ASN 492 7.764 4.050 -0.753 944 HD22 ASN 492 HD22 ASN 492 8.078 4.786 -2.289 945 H ILE 493 HN ILE 493 8.243 -0.470 1.007 946 HA ILE 493 HA ILE 493 10.037 -2.468 0.171 947 HB ILE 493 HB ILE 493 8.098 -2.419 2.491 948 HG12 ILE 493 HG12 ILE 493 11.109 -2.149 2.392 949 HG13 ILE 493 HG11 ILE 493 9.985 -0.801 2.526 950 HG21 ILE 493 HG21 ILE 493 9.274 -4.352 3.408 951 HG22 ILE 493 HG22 ILE 493 10.252 -4.462 1.944 952 HG23 ILE 493 HG23 ILE 493 8.513 -4.744 1.867 953 HD11 ILE 493 HD11 ILE 493 10.266 -3.027 4.538 954 HD12 ILE 493 HD12 ILE 493 9.243 -1.598 4.679 955 HD13 ILE 493 HD13 ILE 493 10.997 -1.426 4.674 956 H LEU 494 HN LEU 494 6.524 -2.432 0.451 957 HA LEU 494 HA LEU 494 6.121 -5.112 -0.378 958 HB2 LEU 494 HB2 LEU 494 4.486 -2.766 0.246 959 HB3 LEU 494 HB1 LEU 494 3.787 -3.800 -0.985 960 HG LEU 494 HG LEU 494 4.769 -5.069 1.530 961 HD11 LEU 494 HD11 LEU 494 2.577 -4.688 2.574 962 HD12 LEU 494 HD12 LEU 494 2.178 -3.557 1.280 963 HD13 LEU 494 HD13 LEU 494 3.506 -3.200 2.383 964 HD21 LEU 494 HD21 LEU 494 3.354 -5.855 -0.766 965 HD22 LEU 494 HD22 LEU 494 2.204 -5.896 0.579 966 HD23 LEU 494 HD23 LEU 494 3.711 -6.815 0.672 967 H GLU 495 HN GLU 495 6.874 -2.250 -2.078 968 HA GLU 495 HA GLU 495 5.779 -3.181 -4.604 969 HB2 GLU 495 HB2 GLU 495 7.343 -0.726 -3.826 970 HB3 GLU 495 HB1 GLU 495 6.948 -1.100 -5.495 971 HG2 GLU 495 HG2 GLU 495 5.002 -0.604 -3.258 972 HG3 GLU 495 HG1 GLU 495 5.368 0.474 -4.602 973 H GLY 496 HN GLY 496 8.559 -3.715 -2.822 974 HA2 GLY 496 HA2 GLY 496 10.202 -5.278 -3.537 975 HA3 GLY 496 HA1 GLY 496 9.884 -4.812 -5.201 976 H ARG 497 HN ARG 497 10.196 -2.212 -2.981 977 HA ARG 497 HA ARG 497 12.505 -1.216 -4.326 978 HB2 ARG 497 HB2 ARG 497 10.700 0.157 -3.159 979 HB3 ARG 497 HB1 ARG 497 11.480 -0.283 -1.646 980 HG2 ARG 497 HG2 ARG 497 12.265 1.868 -2.253 981 HG3 ARG 497 HG1 ARG 497 13.586 0.731 -2.534 982 HD2 ARG 497 HD2 ARG 497 13.377 2.328 -4.370 983 HD3 ARG 497 HD1 ARG 497 13.051 0.682 -4.910 984 HE ARG 497 HE ARG 497 10.835 2.489 -4.216 985 HH11 ARG 497 HH11 ARG 497 12.520 0.509 -6.578 986 HH12 ARG 497 HH12 ARG 497 11.244 0.607 -7.747 987 HH21 ARG 497 HH21 ARG 497 9.179 2.638 -5.773 988 HH22 ARG 497 HH22 ARG 497 9.355 1.837 -7.302 989 H ILE 498 HN ILE 498 11.904 -2.938 -1.364 990 HA ILE 498 HA ILE 498 14.782 -3.029 -0.789 991 HB ILE 498 HB ILE 498 12.350 -3.283 0.952 992 HG12 ILE 498 HG12 ILE 498 13.908 -1.952 2.494 993 HG13 ILE 498 HG11 ILE 498 14.990 -1.832 1.112 994 HG21 ILE 498 HG21 ILE 498 13.532 -5.361 1.384 995 HG22 ILE 498 HG22 ILE 498 13.690 -4.271 2.761 996 HG23 ILE 498 HG23 ILE 498 15.034 -4.475 1.639 997 HD11 ILE 498 HD11 ILE 498 12.169 -0.797 1.247 998 HD12 ILE 498 HD12 ILE 498 13.237 -0.691 -0.152 999 HD13 ILE 498 HD13 ILE 498 13.646 0.164 1.335 1000 H GLN 499 HN GLN 499 15.832 -4.921 -1.033 1001 HA GLN 499 HA GLN 499 14.560 -7.057 -2.387 1002 HB2 GLN 499 HB2 GLN 499 17.283 -6.825 -1.112 1003 HB3 GLN 499 HB1 GLN 499 16.758 -8.244 -2.011 1004 HG2 GLN 499 HG2 GLN 499 16.908 -5.449 -3.119 1005 HG3 GLN 499 HG1 GLN 499 18.125 -6.700 -3.352 1006 HE21 GLN 499 HE21 GLN 499 16.442 -5.240 -5.279 1007 HE22 GLN 499 HE22 GLN 499 15.616 -6.461 -6.179 1008 H VAL 500 HN VAL 500 12.983 -8.063 -1.305 1009 HA VAL 500 HA VAL 500 12.991 -8.731 1.426 1010 HB VAL 500 HB VAL 500 11.140 -10.304 0.841 1011 HG11 VAL 500 HG11 VAL 500 10.627 -7.989 1.330 1012 HG12 VAL 500 HG12 VAL 500 9.580 -8.573 0.037 1013 HG13 VAL 500 HG13 VAL 500 10.953 -7.535 -0.344 1014 HG21 VAL 500 HG21 VAL 500 11.698 -9.395 -1.982 1015 HG22 VAL 500 HG22 VAL 500 10.311 -10.354 -1.464 1016 HG23 VAL 500 HG23 VAL 500 11.939 -11.022 -1.348 1017 HA PRO 501 HA PRO 501 15.567 -12.261 1.908 1018 HB2 PRO 501 HB2 PRO 501 13.201 -13.668 3.061 1019 HB3 PRO 501 HB1 PRO 501 14.822 -13.439 3.744 1020 HG2 PRO 501 HG2 PRO 501 12.778 -12.033 4.647 1021 HG3 PRO 501 HG1 PRO 501 14.382 -11.295 4.448 1022 HD2 PRO 501 HD2 PRO 501 11.944 -10.993 2.758 1023 HD3 PRO 501 HD1 PRO 501 13.197 -9.803 3.161 1024 H PHE 502 HN PHE 502 16.017 -13.113 -0.034 1025 HA PHE 502 HA PHE 502 14.072 -14.987 -1.201 1026 HB2 PHE 502 HB2 PHE 502 14.501 -13.048 -2.649 1027 HB3 PHE 502 HB1 PHE 502 16.229 -13.377 -2.593 1028 HD1 PHE 502 HD1 PHE 502 12.996 -14.913 -3.610 1029 HD2 PHE 502 HD2 PHE 502 17.202 -14.719 -4.210 1030 HE1 PHE 502 HE1 PHE 502 12.778 -16.361 -5.589 1031 HE2 PHE 502 HE2 PHE 502 16.992 -16.161 -6.191 1032 HZ PHE 502 HZ PHE 502 14.776 -16.982 -6.885 1033 HA PRO 503 HA PRO 503 17.160 -18.011 -0.046 1034 HB2 PRO 503 HB2 PRO 503 15.969 -20.127 -1.331 1035 HB3 PRO 503 HB1 PRO 503 15.465 -19.530 0.260 1036 HG2 PRO 503 HG2 PRO 503 14.260 -19.019 -2.411 1037 HG3 PRO 503 HG1 PRO 503 13.469 -19.313 -0.849 1038 HD2 PRO 503 HD2 PRO 503 13.705 -16.843 -1.900 1039 HD3 PRO 503 HD1 PRO 503 13.735 -17.139 -0.150 1040 H THR 504 HN THR 504 19.049 -18.036 -1.035 1041 HA THR 504 HA THR 504 19.118 -18.463 -3.940 1042 HB THR 504 HB THR 504 19.900 -16.212 -3.429 1043 HG1 THR 504 HG1 THR 504 21.704 -18.169 -4.324 1044 HG21 THR 504 HG21 THR 504 20.572 -16.474 -1.125 1045 HG22 THR 504 HG22 THR 504 21.947 -15.887 -2.062 1046 HG23 THR 504 HG23 THR 504 21.862 -17.583 -1.591 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 -18.398 -10.884 14.274 2 H2 MET 1 HT2 MET 1 -18.259 -12.528 13.910 3 H3 MET 1 HT3 MET 1 -17.443 -11.379 12.971 4 HA MET 1 HA MET 1 -16.939 -11.873 15.840 5 HB2 MET 1 HB2 MET 1 -14.941 -13.045 15.204 6 HB3 MET 1 HB1 MET 1 -16.292 -13.778 14.356 7 HG2 MET 1 HG2 MET 1 -15.675 -12.477 12.342 8 HG3 MET 1 HG1 MET 1 -14.262 -11.877 13.209 9 HE1 MET 1 HE1 MET 1 -12.662 -14.392 10.671 10 HE2 MET 1 HE2 MET 1 -12.658 -12.741 11.284 11 HE3 MET 1 HE3 MET 1 -14.047 -13.341 10.383 12 H GLN 2 HN GLN 2 -14.814 -10.908 16.474 13 HA GLN 2 HA GLN 2 -14.537 -8.284 15.173 14 HB2 GLN 2 HB2 GLN 2 -13.566 -9.017 17.933 15 HB3 GLN 2 HB1 GLN 2 -13.805 -7.410 17.263 16 HG2 GLN 2 HG2 GLN 2 -16.048 -9.349 17.727 17 HG3 GLN 2 HG1 GLN 2 -15.515 -8.175 18.927 18 HE21 GLN 2 HE21 GLN 2 -18.046 -8.534 17.392 19 HE22 GLN 2 HE22 GLN 2 -18.346 -6.988 16.668 20 H ILE 3 HN ILE 3 -12.564 -7.503 14.564 21 HA ILE 3 HA ILE 3 -10.241 -9.287 14.917 22 HB ILE 3 HB ILE 3 -9.420 -8.537 12.682 23 HG12 ILE 3 HG12 ILE 3 -12.257 -7.621 12.201 24 HG13 ILE 3 HG11 ILE 3 -10.949 -6.516 12.607 25 HG21 ILE 3 HG21 ILE 3 -10.864 -10.043 11.378 26 HG22 ILE 3 HG22 ILE 3 -12.024 -10.054 12.709 27 HG23 ILE 3 HG23 ILE 3 -10.407 -10.725 12.938 28 HD11 ILE 3 HD11 ILE 3 -10.968 -8.334 10.211 29 HD12 ILE 3 HD12 ILE 3 -9.773 -7.094 10.594 30 HD13 ILE 3 HD13 ILE 3 -11.428 -6.630 10.193 31 H PHE 4 HN PHE 4 -8.143 -8.103 14.692 32 HA PHE 4 HA PHE 4 -8.460 -5.333 15.641 33 HB2 PHE 4 HB2 PHE 4 -6.369 -7.372 16.427 34 HB3 PHE 4 HB1 PHE 4 -6.351 -5.682 16.921 35 HD1 PHE 4 HD1 PHE 4 -8.342 -4.819 18.258 36 HD2 PHE 4 HD2 PHE 4 -7.554 -8.957 17.657 37 HE1 PHE 4 HE1 PHE 4 -9.767 -5.367 20.188 38 HE2 PHE 4 HE2 PHE 4 -8.979 -9.511 19.584 39 HZ PHE 4 HZ PHE 4 -10.087 -7.715 20.851 40 H VAL 5 HN VAL 5 -8.099 -4.172 13.847 41 HA VAL 5 HA VAL 5 -5.848 -4.842 12.115 42 HB VAL 5 HB VAL 5 -7.785 -2.534 11.833 43 HG11 VAL 5 HG11 VAL 5 -7.082 -2.545 9.490 44 HG12 VAL 5 HG12 VAL 5 -5.950 -3.854 9.833 45 HG13 VAL 5 HG13 VAL 5 -5.718 -2.270 10.572 46 HG21 VAL 5 HG21 VAL 5 -9.076 -4.558 11.806 47 HG22 VAL 5 HG22 VAL 5 -7.948 -5.318 10.686 48 HG23 VAL 5 HG23 VAL 5 -8.934 -3.958 10.155 49 H LYS 6 HN LYS 6 -3.930 -3.828 12.220 50 HA LYS 6 HA LYS 6 -3.746 -1.503 14.017 51 HB2 LYS 6 HB2 LYS 6 -1.773 -3.684 13.379 52 HB3 LYS 6 HB1 LYS 6 -1.285 -2.178 14.147 53 HG2 LYS 6 HG2 LYS 6 -3.468 -3.072 15.631 54 HG3 LYS 6 HG1 LYS 6 -2.509 -4.517 15.298 55 HD2 LYS 6 HD2 LYS 6 -0.522 -3.414 16.185 56 HD3 LYS 6 HD1 LYS 6 -1.460 -1.951 16.489 57 HE2 LYS 6 HE2 LYS 6 -1.217 -3.186 18.547 58 HE3 LYS 6 HE1 LYS 6 -2.901 -3.230 18.027 59 HZ1 LYS 6 HZ1 LYS 6 -2.237 -5.392 18.761 60 HZ2 LYS 6 HZ2 LYS 6 -0.901 -5.400 17.728 61 HZ3 LYS 6 HZ3 LYS 6 -2.462 -5.449 17.088 62 H THR 7 HN THR 7 -2.748 0.317 13.358 63 HA THR 7 HA THR 7 -2.107 0.484 10.503 64 HB THR 7 HB THR 7 -2.412 2.875 10.699 65 HG1 THR 7 HG1 THR 7 -2.514 3.903 12.598 66 HG21 THR 7 HG21 THR 7 -4.768 2.990 11.479 67 HG22 THR 7 HG22 THR 7 -4.598 1.355 12.122 68 HG23 THR 7 HG23 THR 7 -4.459 1.640 10.388 69 H LEU 8 HN LEU 8 -0.303 2.125 10.018 70 HA LEU 8 HA LEU 8 2.048 1.302 11.460 71 HB2 LEU 8 HB2 LEU 8 1.698 3.269 9.190 72 HB3 LEU 8 HB1 LEU 8 3.243 2.709 9.804 73 HG LEU 8 HG LEU 8 1.176 0.845 8.647 74 HD11 LEU 8 HD11 LEU 8 3.531 2.117 7.264 75 HD12 LEU 8 HD12 LEU 8 1.830 2.461 6.941 76 HD13 LEU 8 HD13 LEU 8 2.489 0.862 6.594 77 HD21 LEU 8 HD21 LEU 8 2.891 -0.112 10.156 78 HD22 LEU 8 HD22 LEU 8 4.140 0.514 9.082 79 HD23 LEU 8 HD23 LEU 8 3.011 -0.709 8.500 80 H THR 9 HN THR 9 -0.210 3.299 12.357 81 HA THR 9 HA THR 9 1.523 5.453 13.330 82 HB THR 9 HB THR 9 -1.316 5.661 13.977 83 HG1 THR 9 HG1 THR 9 -0.595 5.703 11.215 84 HG21 THR 9 HG21 THR 9 0.217 7.540 14.127 85 HG22 THR 9 HG22 THR 9 -1.026 7.877 12.921 86 HG23 THR 9 HG23 THR 9 0.595 7.399 12.410 87 H GLY 10 HN GLY 10 0.534 2.480 14.268 88 HA2 GLY 10 HA2 GLY 10 0.759 1.439 16.327 89 HA3 GLY 10 HA1 GLY 10 1.088 3.009 17.048 90 H LYS 11 HN LYS 11 -1.739 2.261 15.118 91 HA LYS 11 HA LYS 11 -3.403 2.657 17.516 92 HB2 LYS 11 HB2 LYS 11 -3.627 4.413 15.786 93 HB3 LYS 11 HB1 LYS 11 -4.093 3.187 14.617 94 HG2 LYS 11 HG2 LYS 11 -6.052 2.657 16.078 95 HG3 LYS 11 HG1 LYS 11 -5.616 4.054 17.064 96 HD2 LYS 11 HD2 LYS 11 -5.863 5.510 15.115 97 HD3 LYS 11 HD1 LYS 11 -6.280 4.115 14.120 98 HE2 LYS 11 HE2 LYS 11 -8.234 3.705 15.558 99 HE3 LYS 11 HE1 LYS 11 -7.825 5.144 16.493 100 HZ1 LYS 11 HZ1 LYS 11 -8.006 6.388 14.329 101 HZ2 LYS 11 HZ2 LYS 11 -9.455 5.795 14.954 102 HZ3 LYS 11 HZ3 LYS 11 -8.706 4.997 13.662 103 H THR 12 HN THR 12 -5.017 1.228 17.967 104 HA THR 12 HA THR 12 -5.115 -1.201 16.307 105 HB THR 12 HB THR 12 -5.965 -0.971 19.199 106 HG1 THR 12 HG1 THR 12 -3.707 -0.552 18.987 107 HG21 THR 12 HG21 THR 12 -6.911 -2.866 17.969 108 HG22 THR 12 HG22 THR 12 -5.742 -3.415 19.167 109 HG23 THR 12 HG23 THR 12 -5.296 -3.354 17.464 110 H ILE 13 HN ILE 13 -6.864 -1.297 15.061 111 HA ILE 13 HA ILE 13 -9.325 0.031 15.968 112 HB ILE 13 HB ILE 13 -8.693 -0.919 13.173 113 HG12 ILE 13 HG12 ILE 13 -8.537 1.940 14.119 114 HG13 ILE 13 HG11 ILE 13 -7.127 0.883 14.117 115 HG21 ILE 13 HG21 ILE 13 -10.749 1.056 14.158 116 HG22 ILE 13 HG22 ILE 13 -11.076 -0.628 13.743 117 HG23 ILE 13 HG23 ILE 13 -10.526 0.496 12.499 118 HD11 ILE 13 HD11 ILE 13 -7.302 0.598 11.730 119 HD12 ILE 13 HD12 ILE 13 -7.250 2.315 12.130 120 HD13 ILE 13 HD13 ILE 13 -8.782 1.556 11.695 121 H THR 14 HN THR 14 -10.867 -1.233 16.750 122 HA THR 14 HA THR 14 -10.865 -4.087 16.178 123 HB THR 14 HB THR 14 -12.864 -2.671 17.926 124 HG1 THR 14 HG1 THR 14 -10.213 -3.467 18.636 125 HG21 THR 14 HG21 THR 14 -13.193 -5.063 17.437 126 HG22 THR 14 HG22 THR 14 -12.848 -4.788 19.145 127 HG23 THR 14 HG23 THR 14 -11.586 -5.407 18.079 128 H LEU 15 HN LEU 15 -11.797 -4.597 14.279 129 HA LEU 15 HA LEU 15 -14.239 -3.158 13.504 130 HB2 LEU 15 HB2 LEU 15 -12.230 -4.690 11.866 131 HB3 LEU 15 HB1 LEU 15 -13.755 -4.118 11.223 132 HG LEU 15 HG LEU 15 -11.606 -2.334 12.366 133 HD11 LEU 15 HD11 LEU 15 -10.875 -3.433 10.308 134 HD12 LEU 15 HD12 LEU 15 -11.151 -1.710 10.059 135 HD13 LEU 15 HD13 LEU 15 -12.339 -2.884 9.495 136 HD21 LEU 15 HD21 LEU 15 -12.947 -0.576 11.169 137 HD22 LEU 15 HD22 LEU 15 -13.719 -1.272 12.591 138 HD23 LEU 15 HD23 LEU 15 -14.219 -1.782 10.979 139 H GLU 16 HN GLU 16 -16.061 -4.244 12.878 140 HA GLU 16 HA GLU 16 -16.257 -7.001 13.821 141 HB2 GLU 16 HB2 GLU 16 -17.860 -5.188 14.584 142 HB3 GLU 16 HB1 GLU 16 -18.507 -5.186 12.950 143 HG2 GLU 16 HG2 GLU 16 -19.428 -7.290 13.169 144 HG3 GLU 16 HG1 GLU 16 -18.350 -7.733 14.490 145 H VAL 17 HN VAL 17 -16.125 -8.587 12.410 146 HA VAL 17 HA VAL 17 -17.245 -8.269 9.726 147 HB VAL 17 HB VAL 17 -15.177 -9.424 8.792 148 HG11 VAL 17 HG11 VAL 17 -15.628 -7.105 8.293 149 HG12 VAL 17 HG12 VAL 17 -13.901 -7.336 8.559 150 HG13 VAL 17 HG13 VAL 17 -14.896 -6.605 9.817 151 HG21 VAL 17 HG21 VAL 17 -14.201 -10.149 10.884 152 HG22 VAL 17 HG22 VAL 17 -14.007 -8.475 11.402 153 HG23 VAL 17 HG23 VAL 17 -13.081 -9.088 10.031 154 H GLU 18 HN GLU 18 -17.496 -10.315 8.611 155 HA GLU 18 HA GLU 18 -17.703 -12.588 10.484 156 HB2 GLU 18 HB2 GLU 18 -19.424 -11.674 8.197 157 HB3 GLU 18 HB1 GLU 18 -19.397 -13.375 8.639 158 HG2 GLU 18 HG2 GLU 18 -20.079 -11.116 10.507 159 HG3 GLU 18 HG1 GLU 18 -21.251 -12.145 9.684 160 HA PRO 19 HA PRO 19 -14.894 -15.042 8.101 161 HB2 PRO 19 HB2 PRO 19 -17.058 -17.022 7.588 162 HB3 PRO 19 HB1 PRO 19 -15.454 -17.264 8.308 163 HG2 PRO 19 HG2 PRO 19 -17.633 -17.289 9.814 164 HG3 PRO 19 HG1 PRO 19 -16.122 -16.557 10.389 165 HD2 PRO 19 HD2 PRO 19 -18.603 -15.234 9.413 166 HD3 PRO 19 HD1 PRO 19 -17.475 -14.728 10.687 167 H SER 20 HN SER 20 -18.071 -14.488 6.723 168 HA SER 20 HA SER 20 -17.112 -14.979 4.015 169 HB2 SER 20 HB2 SER 20 -19.874 -14.015 4.677 170 HB3 SER 20 HB1 SER 20 -19.351 -15.081 3.372 171 HG SER 20 HG SER 20 -20.480 -16.029 5.291 172 H ASP 21 HN ASP 21 -16.589 -12.523 5.933 173 HA ASP 21 HA ASP 21 -17.636 -10.289 4.478 174 HB2 ASP 21 HB2 ASP 21 -16.158 -10.690 6.904 175 HB3 ASP 21 HB1 ASP 21 -15.303 -9.517 5.912 176 H THR 22 HN THR 22 -17.001 -9.826 2.495 177 HA THR 22 HA THR 22 -14.643 -10.769 1.284 178 HB THR 22 HB THR 22 -15.926 -8.302 0.223 179 HG1 THR 22 HG1 THR 22 -17.857 -9.202 -0.074 180 HG21 THR 22 HG21 THR 22 -15.262 -10.975 -1.013 181 HG22 THR 22 HG22 THR 22 -14.224 -9.550 -1.044 182 HG23 THR 22 HG23 THR 22 -15.778 -9.524 -1.877 183 H ILE 23 HN ILE 23 -12.672 -9.771 0.893 184 HA ILE 23 HA ILE 23 -11.650 -8.021 2.790 185 HB ILE 23 HB ILE 23 -10.637 -8.500 -0.015 186 HG12 ILE 23 HG12 ILE 23 -10.787 -10.562 1.256 187 HG13 ILE 23 HG11 ILE 23 -9.098 -10.093 1.098 188 HG21 ILE 23 HG21 ILE 23 -8.467 -7.742 0.831 189 HG22 ILE 23 HG22 ILE 23 -9.215 -7.346 2.380 190 HG23 ILE 23 HG23 ILE 23 -9.682 -6.465 0.924 191 HD11 ILE 23 HD11 ILE 23 -10.844 -9.805 3.530 192 HD12 ILE 23 HD12 ILE 23 -9.212 -9.153 3.394 193 HD13 ILE 23 HD13 ILE 23 -9.473 -10.894 3.314 194 H GLU 24 HN GLU 24 -13.102 -7.328 -0.352 195 HA GLU 24 HA GLU 24 -12.448 -4.608 -0.510 196 HB2 GLU 24 HB2 GLU 24 -13.402 -5.980 -2.366 197 HB3 GLU 24 HB1 GLU 24 -14.962 -5.924 -1.554 198 HG2 GLU 24 HG2 GLU 24 -14.681 -3.370 -1.656 199 HG3 GLU 24 HG1 GLU 24 -13.441 -3.704 -2.861 200 H ASN 25 HN ASN 25 -14.989 -6.294 1.225 201 HA ASN 25 HA ASN 25 -16.543 -3.998 1.875 202 HB2 ASN 25 HB2 ASN 25 -17.299 -6.439 1.984 203 HB3 ASN 25 HB1 ASN 25 -16.408 -6.542 3.500 204 HD21 ASN 25 HD21 ASN 25 -18.076 -6.795 4.891 205 HD22 ASN 25 HD22 ASN 25 -19.331 -5.619 5.120 206 H VAL 26 HN VAL 26 -13.830 -5.657 3.327 207 HA VAL 26 HA VAL 26 -13.850 -4.309 5.815 208 HB VAL 26 HB VAL 26 -11.426 -5.442 4.404 209 HG11 VAL 26 HG11 VAL 26 -10.902 -4.075 6.342 210 HG12 VAL 26 HG12 VAL 26 -10.581 -5.775 6.681 211 HG13 VAL 26 HG13 VAL 26 -12.030 -5.006 7.326 212 HG21 VAL 26 HG21 VAL 26 -13.192 -7.122 4.466 213 HG22 VAL 26 HG22 VAL 26 -13.404 -6.855 6.196 214 HG23 VAL 26 HG23 VAL 26 -11.898 -7.542 5.588 215 H LYS 27 HN LYS 27 -12.324 -3.657 2.703 216 HA LYS 27 HA LYS 27 -10.732 -1.470 3.437 217 HB2 LYS 27 HB2 LYS 27 -12.160 -1.718 0.787 218 HB3 LYS 27 HB1 LYS 27 -10.632 -0.919 1.113 219 HG2 LYS 27 HG2 LYS 27 -10.851 -3.842 1.624 220 HG3 LYS 27 HG1 LYS 27 -10.732 -3.276 -0.040 221 HD2 LYS 27 HD2 LYS 27 -8.790 -2.428 2.095 222 HD3 LYS 27 HD1 LYS 27 -8.558 -3.886 1.131 223 HE2 LYS 27 HE2 LYS 27 -8.850 -1.091 0.036 224 HE3 LYS 27 HE1 LYS 27 -7.329 -1.953 0.231 225 HZ1 LYS 27 HZ1 LYS 27 -8.215 -2.028 -2.050 226 HZ2 LYS 27 HZ2 LYS 27 -9.564 -2.885 -1.495 227 HZ3 LYS 27 HZ3 LYS 27 -8.024 -3.570 -1.381 228 H ALA 28 HN ALA 28 -14.121 -1.709 2.521 229 HA ALA 28 HA ALA 28 -14.649 1.075 2.418 230 HB1 ALA 28 HB1 ALA 28 -16.081 -0.541 1.298 231 HB2 ALA 28 HB2 ALA 28 -17.009 0.415 2.453 232 HB3 ALA 28 HB3 ALA 28 -16.536 -1.235 2.853 233 H LYS 29 HN LYS 29 -14.938 -1.378 4.938 234 HA LYS 29 HA LYS 29 -16.233 0.210 6.857 235 HB2 LYS 29 HB2 LYS 29 -14.486 -2.236 7.092 236 HB3 LYS 29 HB1 LYS 29 -15.216 -1.471 8.498 237 HG2 LYS 29 HG2 LYS 29 -17.416 -1.899 7.680 238 HG3 LYS 29 HG1 LYS 29 -16.788 -2.446 6.124 239 HD2 LYS 29 HD2 LYS 29 -15.818 -4.398 7.134 240 HD3 LYS 29 HD1 LYS 29 -16.208 -3.812 8.755 241 HE2 LYS 29 HE2 LYS 29 -18.562 -4.021 8.319 242 HE3 LYS 29 HE1 LYS 29 -18.259 -4.429 6.632 243 HZ1 LYS 29 HZ1 LYS 29 -18.785 -6.353 8.068 244 HZ2 LYS 29 HZ2 LYS 29 -17.357 -6.082 8.929 245 HZ3 LYS 29 HZ3 LYS 29 -17.292 -6.498 7.281 246 H ILE 30 HN ILE 30 -12.805 -0.270 6.136 247 HA ILE 30 HA ILE 30 -11.851 1.260 8.343 248 HB ILE 30 HB ILE 30 -10.461 0.649 5.723 249 HG12 ILE 30 HG12 ILE 30 -10.273 -0.801 8.373 250 HG13 ILE 30 HG11 ILE 30 -11.225 -1.357 7.001 251 HG21 ILE 30 HG21 ILE 30 -9.417 2.498 6.921 252 HG22 ILE 30 HG22 ILE 30 -8.389 1.065 6.960 253 HG23 ILE 30 HG23 ILE 30 -9.329 1.515 8.382 254 HD11 ILE 30 HD11 ILE 30 -9.118 -2.538 7.129 255 HD12 ILE 30 HD12 ILE 30 -8.236 -1.012 7.064 256 HD13 ILE 30 HD13 ILE 30 -9.178 -1.546 5.672 257 H GLN 31 HN GLN 31 -12.664 1.978 5.003 258 HA GLN 31 HA GLN 31 -11.672 4.622 4.930 259 HB2 GLN 31 HB2 GLN 31 -12.192 3.383 2.898 260 HB3 GLN 31 HB1 GLN 31 -13.891 3.321 3.345 261 HG2 GLN 31 HG2 GLN 31 -13.591 5.954 3.378 262 HG3 GLN 31 HG1 GLN 31 -12.296 5.563 2.247 263 HE21 GLN 31 HE21 GLN 31 -13.342 6.523 0.523 264 HE22 GLN 31 HE22 GLN 31 -14.739 5.827 -0.223 265 H ASP 32 HN ASP 32 -14.685 3.238 6.041 266 HA ASP 32 HA ASP 32 -16.164 5.651 6.168 267 HB2 ASP 32 HB2 ASP 32 -17.121 3.330 6.200 268 HB3 ASP 32 HB1 ASP 32 -16.562 3.182 7.863 269 H LYS 33 HN LYS 33 -14.172 3.934 8.536 270 HA LYS 33 HA LYS 33 -14.749 5.906 10.579 271 HB2 LYS 33 HB2 LYS 33 -13.144 3.371 10.515 272 HB3 LYS 33 HB1 LYS 33 -12.972 4.502 11.850 273 HG2 LYS 33 HG2 LYS 33 -15.425 4.337 12.225 274 HG3 LYS 33 HG1 LYS 33 -15.477 3.065 11.002 275 HD2 LYS 33 HD2 LYS 33 -14.138 1.619 12.316 276 HD3 LYS 33 HD1 LYS 33 -13.667 2.929 13.404 277 HE2 LYS 33 HE2 LYS 33 -15.964 3.095 14.206 278 HE3 LYS 33 HE1 LYS 33 -16.447 1.795 13.118 279 HZ1 LYS 33 HZ1 LYS 33 -15.017 0.287 14.303 280 HZ2 LYS 33 HZ2 LYS 33 -16.065 1.031 15.399 281 HZ3 LYS 33 HZ3 LYS 33 -14.455 1.531 15.299 282 H GLU 34 HN GLU 34 -11.676 4.634 9.297 283 HA GLU 34 HA GLU 34 -10.128 6.765 10.290 284 HB2 GLU 34 HB2 GLU 34 -9.517 4.802 8.081 285 HB3 GLU 34 HB1 GLU 34 -8.339 5.865 8.839 286 HG2 GLU 34 HG2 GLU 34 -9.836 3.587 10.096 287 HG3 GLU 34 HG1 GLU 34 -8.101 3.719 9.810 288 H GLY 35 HN GLY 35 -11.759 6.294 7.232 289 HA2 GLY 35 HA2 GLY 35 -12.391 8.008 5.766 290 HA3 GLY 35 HA1 GLY 35 -11.283 9.097 6.591 291 H ILE 36 HN ILE 36 -9.634 6.324 6.067 292 HA ILE 36 HA ILE 36 -8.025 7.478 4.001 293 HB ILE 36 HB ILE 36 -7.922 4.704 5.202 294 HG12 ILE 36 HG12 ILE 36 -6.232 7.114 5.890 295 HG13 ILE 36 HG11 ILE 36 -7.658 6.639 6.804 296 HG21 ILE 36 HG21 ILE 36 -5.849 6.223 3.621 297 HG22 ILE 36 HG22 ILE 36 -6.778 4.835 3.054 298 HG23 ILE 36 HG23 ILE 36 -5.625 4.643 4.373 299 HD11 ILE 36 HD11 ILE 36 -5.671 5.853 7.905 300 HD12 ILE 36 HD12 ILE 36 -5.148 5.027 6.438 301 HD13 ILE 36 HD13 ILE 36 -6.592 4.479 7.291 302 HA PRO 37 HA PRO 37 -10.405 6.019 0.512 303 HB2 PRO 37 HB2 PRO 37 -7.710 6.148 -0.766 304 HB3 PRO 37 HB1 PRO 37 -9.245 6.859 -1.300 305 HG2 PRO 37 HG2 PRO 37 -7.372 8.387 -0.248 306 HG3 PRO 37 HG1 PRO 37 -9.084 8.649 0.138 307 HD2 PRO 37 HD2 PRO 37 -6.949 7.395 1.793 308 HD3 PRO 37 HD1 PRO 37 -8.302 8.432 2.287 309 HA PRO 38 HA PRO 38 -9.716 1.622 0.763 310 HB2 PRO 38 HB2 PRO 38 -10.985 1.632 -1.932 311 HB3 PRO 38 HB1 PRO 38 -11.435 0.725 -0.475 312 HG2 PRO 38 HG2 PRO 38 -12.869 2.796 -1.278 313 HG3 PRO 38 HG1 PRO 38 -12.579 2.490 0.447 314 HD2 PRO 38 HD2 PRO 38 -11.337 4.520 -1.345 315 HD3 PRO 38 HD1 PRO 38 -11.783 4.641 0.368 316 H ASP 39 HN ASP 39 -8.887 3.411 -2.181 317 HA ASP 39 HA ASP 39 -7.238 1.292 -3.213 318 HB2 ASP 39 HB2 ASP 39 -7.527 4.181 -4.058 319 HB3 ASP 39 HB1 ASP 39 -6.536 2.998 -4.903 320 H GLN 40 HN GLN 40 -6.801 3.336 -0.696 321 HA GLN 40 HA GLN 40 -3.885 3.459 -1.097 322 HB2 GLN 40 HB2 GLN 40 -5.576 5.514 -0.487 323 HB3 GLN 40 HB1 GLN 40 -5.066 5.005 1.117 324 HG2 GLN 40 HG2 GLN 40 -2.711 5.230 0.379 325 HG3 GLN 40 HG1 GLN 40 -3.295 5.876 -1.153 326 HE21 GLN 40 HE21 GLN 40 -1.605 7.128 0.834 327 HE22 GLN 40 HE22 GLN 40 -2.429 8.566 1.342 328 H GLN 41 HN GLN 41 -6.059 1.509 0.159 329 HA GLN 41 HA GLN 41 -4.701 1.041 2.720 330 HB2 GLN 41 HB2 GLN 41 -7.310 -0.051 1.668 331 HB3 GLN 41 HB1 GLN 41 -6.628 -0.407 3.244 332 HG2 GLN 41 HG2 GLN 41 -6.913 1.865 3.945 333 HG3 GLN 41 HG1 GLN 41 -7.432 2.338 2.324 334 HE21 GLN 41 HE21 GLN 41 -9.440 3.085 3.109 335 HE22 GLN 41 HE22 GLN 41 -10.679 1.973 3.586 336 H ARG 42 HN ARG 42 -3.142 -0.452 2.674 337 HA ARG 42 HA ARG 42 -3.487 -2.756 0.865 338 HB2 ARG 42 HB2 ARG 42 -0.967 -1.538 2.009 339 HB3 ARG 42 HB1 ARG 42 -1.005 -3.046 1.107 340 HG2 ARG 42 HG2 ARG 42 -1.911 -1.824 -0.831 341 HG3 ARG 42 HG1 ARG 42 -1.772 -0.322 0.084 342 HD2 ARG 42 HD2 ARG 42 0.234 -0.205 -0.944 343 HD3 ARG 42 HD1 ARG 42 0.728 -1.273 0.369 344 HE ARG 42 HE ARG 42 -0.073 -3.029 -1.493 345 HH11 ARG 42 HH11 ARG 42 2.119 -0.289 -1.600 346 HH12 ARG 42 HH12 ARG 42 2.993 -0.899 -2.988 347 HH21 ARG 42 HH21 ARG 42 1.097 -3.824 -3.290 348 HH22 ARG 42 HH22 ARG 42 2.428 -2.906 -3.921 349 H LEU 43 HN LEU 43 -4.433 -4.313 2.034 350 HA LEU 43 HA LEU 43 -3.829 -4.606 4.868 351 HB2 LEU 43 HB2 LEU 43 -5.878 -5.844 3.047 352 HB3 LEU 43 HB1 LEU 43 -5.611 -6.435 4.675 353 HG LEU 43 HG LEU 43 -6.337 -3.571 4.081 354 HD11 LEU 43 HD11 LEU 43 -8.170 -5.851 4.815 355 HD12 LEU 43 HD12 LEU 43 -8.107 -5.038 3.251 356 HD13 LEU 43 HD13 LEU 43 -8.623 -4.152 4.686 357 HD21 LEU 43 HD21 LEU 43 -7.032 -3.617 6.460 358 HD22 LEU 43 HD22 LEU 43 -5.304 -3.897 6.236 359 HD23 LEU 43 HD23 LEU 43 -6.379 -5.252 6.587 360 H ILE 44 HN ILE 44 -2.577 -6.116 5.706 361 HA ILE 44 HA ILE 44 -1.747 -8.367 4.008 362 HB ILE 44 HB ILE 44 -0.027 -6.439 5.526 363 HG12 ILE 44 HG12 ILE 44 1.444 -7.051 3.445 364 HG13 ILE 44 HG11 ILE 44 -0.065 -7.679 2.801 365 HG21 ILE 44 HG21 ILE 44 0.528 -8.586 6.528 366 HG22 ILE 44 HG22 ILE 44 1.846 -8.016 5.503 367 HG23 ILE 44 HG23 ILE 44 0.765 -9.285 4.926 368 HD11 ILE 44 HD11 ILE 44 0.243 -5.456 2.008 369 HD12 ILE 44 HD12 ILE 44 0.512 -4.856 3.645 370 HD13 ILE 44 HD13 ILE 44 -1.080 -5.449 3.172 371 H PHE 45 HN PHE 45 -1.585 -10.304 4.976 372 HA PHE 45 HA PHE 45 -1.713 -10.525 7.885 373 HB2 PHE 45 HB2 PHE 45 -4.074 -10.660 7.044 374 HB3 PHE 45 HB1 PHE 45 -3.602 -12.047 6.068 375 HD1 PHE 45 HD1 PHE 45 -3.683 -10.850 9.588 376 HD2 PHE 45 HD2 PHE 45 -3.745 -14.181 6.943 377 HE1 PHE 45 HE1 PHE 45 -4.127 -12.345 11.490 378 HE2 PHE 45 HE2 PHE 45 -4.191 -15.684 8.841 379 HZ PHE 45 HZ PHE 45 -4.382 -14.767 11.116 380 H ALA 46 HN ALA 46 -0.401 -12.113 8.596 381 HA ALA 46 HA ALA 46 1.151 -13.765 8.595 382 HB1 ALA 46 HB1 ALA 46 -0.413 -14.844 6.250 383 HB2 ALA 46 HB2 ALA 46 -0.758 -15.163 7.950 384 HB3 ALA 46 HB3 ALA 46 0.746 -15.739 7.233 385 H GLY 47 HN GLY 47 1.443 -11.333 6.879 386 HA2 GLY 47 HA2 GLY 47 3.305 -10.512 5.767 387 HA3 GLY 47 HA1 GLY 47 3.896 -12.156 5.599 388 H LYS 48 HN LYS 48 0.658 -11.650 4.583 389 HA LYS 48 HA LYS 48 1.530 -11.349 1.783 390 HB2 LYS 48 HB2 LYS 48 -0.822 -13.079 2.456 391 HB3 LYS 48 HB1 LYS 48 0.211 -13.121 1.036 392 HG2 LYS 48 HG2 LYS 48 2.018 -14.068 2.419 393 HG3 LYS 48 HG1 LYS 48 0.918 -14.083 3.798 394 HD2 LYS 48 HD2 LYS 48 -0.618 -15.529 2.453 395 HD3 LYS 48 HD1 LYS 48 0.645 -15.629 1.226 396 HE2 LYS 48 HE2 LYS 48 0.769 -16.603 4.074 397 HE3 LYS 48 HE1 LYS 48 0.797 -17.579 2.605 398 HZ1 LYS 48 HZ1 LYS 48 2.902 -15.687 3.503 399 HZ2 LYS 48 HZ2 LYS 48 2.922 -16.518 2.032 400 HZ3 LYS 48 HZ3 LYS 48 3.005 -17.375 3.485 401 H GLN 49 HN GLN 49 0.126 -10.219 0.430 402 HA GLN 49 HA GLN 49 -1.652 -8.411 1.806 403 HB2 GLN 49 HB2 GLN 49 -0.096 -7.891 -0.223 404 HB3 GLN 49 HB1 GLN 49 -1.407 -8.551 -1.187 405 HG2 GLN 49 HG2 GLN 49 -2.928 -6.884 -0.314 406 HG3 GLN 49 HG1 GLN 49 -1.671 -6.258 0.748 407 HE21 GLN 49 HE21 GLN 49 -2.839 -6.468 -2.506 408 HE22 GLN 49 HE22 GLN 49 -1.824 -5.235 -3.170 409 H LEU 50 HN LEU 50 -3.842 -8.301 1.653 410 HA LEU 50 HA LEU 50 -5.174 -10.755 0.821 411 HB2 LEU 50 HB2 LEU 50 -6.485 -8.375 2.104 412 HB3 LEU 50 HB1 LEU 50 -7.009 -10.048 2.131 413 HG LEU 50 HG LEU 50 -4.595 -8.943 3.572 414 HD11 LEU 50 HD11 LEU 50 -7.227 -9.899 4.683 415 HD12 LEU 50 HD12 LEU 50 -6.762 -8.209 4.500 416 HD13 LEU 50 HD13 LEU 50 -5.858 -9.258 5.590 417 HD21 LEU 50 HD21 LEU 50 -4.528 -11.143 4.655 418 HD22 LEU 50 HD22 LEU 50 -4.252 -11.250 2.919 419 HD23 LEU 50 HD23 LEU 50 -5.819 -11.698 3.592 420 H GLU 51 HN GLU 51 -6.130 -10.921 -1.095 421 HA GLU 51 HA GLU 51 -6.442 -8.610 -2.775 422 HB2 GLU 51 HB2 GLU 51 -7.319 -11.466 -3.257 423 HB3 GLU 51 HB1 GLU 51 -7.250 -10.191 -4.466 424 HG2 GLU 51 HG2 GLU 51 -4.726 -10.093 -3.572 425 HG3 GLU 51 HG1 GLU 51 -5.083 -11.792 -3.277 426 H ASP 52 HN ASP 52 -8.240 -7.556 -3.306 427 HA ASP 52 HA ASP 52 -10.319 -7.262 -1.533 428 HB2 ASP 52 HB2 ASP 52 -9.981 -6.517 -4.410 429 HB3 ASP 52 HB1 ASP 52 -11.503 -6.197 -3.585 430 H GLY 53 HN GLY 53 -10.203 -9.417 -4.317 431 HA2 GLY 53 HA2 GLY 53 -13.038 -9.998 -4.125 432 HA3 GLY 53 HA1 GLY 53 -11.906 -10.696 -5.269 433 H ARG 54 HN ARG 54 -11.092 -10.783 -1.896 434 HA ARG 54 HA ARG 54 -11.804 -13.647 -1.865 435 HB2 ARG 54 HB2 ARG 54 -9.496 -12.299 -0.453 436 HB3 ARG 54 HB1 ARG 54 -9.880 -14.012 -0.394 437 HG2 ARG 54 HG2 ARG 54 -9.157 -12.531 -2.901 438 HG3 ARG 54 HG1 ARG 54 -8.010 -13.428 -1.908 439 HD2 ARG 54 HD2 ARG 54 -10.088 -15.216 -2.334 440 HD3 ARG 54 HD1 ARG 54 -9.911 -14.384 -3.879 441 HE ARG 54 HE ARG 54 -8.169 -16.338 -2.822 442 HH11 ARG 54 HH11 ARG 54 -8.134 -13.321 -4.594 443 HH12 ARG 54 HH12 ARG 54 -6.569 -13.597 -5.300 444 HH21 ARG 54 HH21 ARG 54 -6.147 -16.737 -3.795 445 HH22 ARG 54 HH22 ARG 54 -5.449 -15.550 -4.852 446 H THR 55 HN THR 55 -11.980 -14.529 0.384 447 HA THR 55 HA THR 55 -13.408 -12.602 2.097 448 HB THR 55 HB THR 55 -14.485 -14.681 3.091 449 HG1 THR 55 HG1 THR 55 -13.192 -15.827 0.820 450 HG21 THR 55 HG21 THR 55 -14.999 -14.055 0.185 451 HG22 THR 55 HG22 THR 55 -15.712 -13.235 1.578 452 HG23 THR 55 HG23 THR 55 -16.103 -14.926 1.247 453 H LEU 56 HN LEU 56 -13.299 -13.245 4.489 454 HA LEU 56 HA LEU 56 -10.602 -13.273 5.293 455 HB2 LEU 56 HB2 LEU 56 -13.057 -13.858 6.948 456 HB3 LEU 56 HB1 LEU 56 -11.474 -13.437 7.573 457 HG LEU 56 HG LEU 56 -13.263 -11.642 5.933 458 HD11 LEU 56 HD11 LEU 56 -12.485 -11.561 8.841 459 HD12 LEU 56 HD12 LEU 56 -14.074 -11.967 8.192 460 HD13 LEU 56 HD13 LEU 56 -13.429 -10.338 7.991 461 HD21 LEU 56 HD21 LEU 56 -11.614 -9.895 6.438 462 HD22 LEU 56 HD22 LEU 56 -10.927 -11.185 5.454 463 HD23 LEU 56 HD23 LEU 56 -10.568 -11.106 7.178 464 H SER 57 HN SER 57 -12.959 -15.827 4.891 465 HA SER 57 HA SER 57 -11.494 -17.824 6.290 466 HB2 SER 57 HB2 SER 57 -13.620 -18.122 4.154 467 HB3 SER 57 HB1 SER 57 -13.045 -19.409 5.215 468 HG SER 57 HG SER 57 -15.007 -17.771 5.692 469 H ASP 58 HN ASP 58 -11.167 -16.389 3.189 470 HA ASP 58 HA ASP 58 -9.938 -18.591 1.846 471 HB2 ASP 58 HB2 ASP 58 -10.095 -15.646 1.295 472 HB3 ASP 58 HB1 ASP 58 -9.030 -16.674 0.342 473 H TYR 59 HN TYR 59 -8.872 -16.296 4.134 474 HA TYR 59 HA TYR 59 -6.079 -17.097 3.673 475 HB2 TYR 59 HB2 TYR 59 -7.216 -14.582 4.901 476 HB3 TYR 59 HB1 TYR 59 -5.511 -15.009 4.979 477 HD1 TYR 59 HD1 TYR 59 -4.151 -15.049 2.914 478 HD2 TYR 59 HD2 TYR 59 -8.192 -13.724 2.883 479 HE1 TYR 59 HE1 TYR 59 -3.786 -14.004 0.717 480 HE2 TYR 59 HE2 TYR 59 -7.839 -12.684 0.686 481 HH TYR 59 HH TYR 59 -4.954 -13.224 -1.167 482 H ASN 60 HN ASN 60 -8.530 -18.071 5.327 483 HA ASN 60 HA ASN 60 -8.959 -19.117 7.288 484 HB2 ASN 60 HB2 ASN 60 -6.564 -20.061 6.387 485 HB3 ASN 60 HB1 ASN 60 -6.134 -19.533 8.011 486 HD21 ASN 60 HD21 ASN 60 -6.227 -22.210 6.972 487 HD22 ASN 60 HD22 ASN 60 -7.363 -23.079 7.940 488 H ILE 61 HN ILE 61 -8.861 -16.336 7.493 489 HA ILE 61 HA ILE 61 -7.319 -15.606 9.816 490 HB ILE 61 HB ILE 61 -9.540 -14.071 8.452 491 HG12 ILE 61 HG12 ILE 61 -6.540 -13.831 8.116 492 HG13 ILE 61 HG11 ILE 61 -7.631 -14.582 6.957 493 HG21 ILE 61 HG21 ILE 61 -8.569 -12.116 9.578 494 HG22 ILE 61 HG22 ILE 61 -7.420 -13.171 10.401 495 HG23 ILE 61 HG23 ILE 61 -9.146 -13.319 10.730 496 HD11 ILE 61 HD11 ILE 61 -7.705 -11.698 7.803 497 HD12 ILE 61 HD12 ILE 61 -8.741 -12.458 6.597 498 HD13 ILE 61 HD13 ILE 61 -7.008 -12.315 6.306 499 H GLN 62 HN GLN 62 -7.890 -16.070 11.815 500 HA GLN 62 HA GLN 62 -10.597 -16.937 12.413 501 HB2 GLN 62 HB2 GLN 62 -8.382 -16.689 14.428 502 HB3 GLN 62 HB1 GLN 62 -9.738 -17.805 14.418 503 HG2 GLN 62 HG2 GLN 62 -8.751 -19.100 12.670 504 HG3 GLN 62 HG1 GLN 62 -7.475 -17.910 12.437 505 HE21 GLN 62 HE21 GLN 62 -5.760 -19.179 12.882 506 HE22 GLN 62 HE22 GLN 62 -5.463 -19.896 14.427 507 H LYS 63 HN LYS 63 -11.114 -16.179 14.901 508 HA LYS 63 HA LYS 63 -11.671 -13.362 14.619 509 HB2 LYS 63 HB2 LYS 63 -12.974 -13.622 16.662 510 HB3 LYS 63 HB1 LYS 63 -13.368 -14.905 15.526 511 HG2 LYS 63 HG2 LYS 63 -11.784 -16.380 16.778 512 HG3 LYS 63 HG1 LYS 63 -11.650 -15.099 17.984 513 HD2 LYS 63 HD2 LYS 63 -14.114 -15.201 18.284 514 HD3 LYS 63 HD1 LYS 63 -14.153 -16.576 17.180 515 HE2 LYS 63 HE2 LYS 63 -14.144 -17.510 19.335 516 HE3 LYS 63 HE1 LYS 63 -12.495 -17.687 18.742 517 HZ1 LYS 63 HZ1 LYS 63 -12.039 -15.528 19.972 518 HZ2 LYS 63 HZ2 LYS 63 -12.281 -16.912 20.914 519 HZ3 LYS 63 HZ3 LYS 63 -13.527 -15.781 20.749 520 H GLU 64 HN GLU 64 -11.098 -11.761 16.190 521 HA GLU 64 HA GLU 64 -9.624 -10.592 17.450 522 HB2 GLU 64 HB2 GLU 64 -9.321 -13.292 18.774 523 HB3 GLU 64 HB1 GLU 64 -8.674 -11.791 19.431 524 HG2 GLU 64 HG2 GLU 64 -10.729 -10.988 20.005 525 HG3 GLU 64 HG1 GLU 64 -11.556 -11.874 18.727 526 H SER 65 HN SER 65 -8.658 -11.489 14.999 527 HA SER 65 HA SER 65 -5.860 -12.187 15.519 528 HB2 SER 65 HB2 SER 65 -7.284 -12.049 12.853 529 HB3 SER 65 HB1 SER 65 -5.716 -12.783 13.191 530 HG SER 65 HG SER 65 -8.266 -13.760 13.601 531 H THR 66 HN THR 66 -4.178 -10.904 14.702 532 HA THR 66 HA THR 66 -4.874 -8.101 14.445 533 HB THR 66 HB THR 66 -2.068 -9.162 14.337 534 HG1 THR 66 HG1 THR 66 -2.039 -9.383 16.533 535 HG21 THR 66 HG21 THR 66 -2.467 -6.762 13.969 536 HG22 THR 66 HG22 THR 66 -1.550 -7.057 15.446 537 HG23 THR 66 HG23 THR 66 -3.267 -6.665 15.537 538 H LEU 67 HN LEU 67 -5.054 -7.099 12.570 539 HA LEU 67 HA LEU 67 -3.894 -8.343 10.170 540 HB2 LEU 67 HB2 LEU 67 -6.333 -6.682 10.635 541 HB3 LEU 67 HB1 LEU 67 -5.541 -6.588 9.075 542 HG LEU 67 HG LEU 67 -5.746 -9.185 9.090 543 HD11 LEU 67 HD11 LEU 67 -7.671 -10.028 10.308 544 HD12 LEU 67 HD12 LEU 67 -7.923 -8.443 11.038 545 HD13 LEU 67 HD13 LEU 67 -6.473 -9.370 11.423 546 HD21 LEU 67 HD21 LEU 67 -8.125 -7.371 8.713 547 HD22 LEU 67 HD22 LEU 67 -7.984 -9.013 8.083 548 HD23 LEU 67 HD23 LEU 67 -6.889 -7.752 7.511 549 H HIS 68 HN HIS 68 -2.629 -7.143 8.796 550 HA HIS 68 HA HIS 68 -1.532 -4.698 9.975 551 HB2 HIS 68 HB2 HIS 68 -0.396 -6.327 7.694 552 HB3 HIS 68 HB1 HIS 68 0.431 -5.099 8.646 553 HD2 HIS 68 HD2 HIS 68 0.388 -5.979 11.557 554 HE1 HIS 68 HE1 HIS 68 1.058 -9.950 10.264 555 HE2 HIS 68 HE2 HIS 68 1.336 -8.308 12.174 556 H LEU 69 HN LEU 69 -1.838 -2.759 9.087 557 HA LEU 69 HA LEU 69 -2.965 -2.649 6.370 558 HB2 LEU 69 HB2 LEU 69 -4.591 -1.950 8.039 559 HB3 LEU 69 HB1 LEU 69 -3.442 -0.817 8.723 560 HG LEU 69 HG LEU 69 -3.474 0.416 6.541 561 HD11 LEU 69 HD11 LEU 69 -5.396 0.020 5.055 562 HD12 LEU 69 HD12 LEU 69 -5.784 -1.434 5.975 563 HD13 LEU 69 HD13 LEU 69 -4.266 -1.334 5.084 564 HD21 LEU 69 HD21 LEU 69 -6.044 0.143 8.085 565 HD22 LEU 69 HD22 LEU 69 -5.689 1.443 6.949 566 HD23 LEU 69 HD23 LEU 69 -4.717 1.257 8.406 567 H VAL 70 HN VAL 70 -1.469 -2.011 4.990 568 HA VAL 70 HA VAL 70 0.614 -0.141 5.847 569 HB VAL 70 HB VAL 70 0.344 -1.716 3.276 570 HG11 VAL 70 HG11 VAL 70 2.706 -0.163 4.311 571 HG12 VAL 70 HG12 VAL 70 1.627 0.377 3.028 572 HG13 VAL 70 HG13 VAL 70 2.618 -1.063 2.799 573 HG21 VAL 70 HG21 VAL 70 0.705 -3.165 5.188 574 HG22 VAL 70 HG22 VAL 70 2.085 -2.188 5.689 575 HG23 VAL 70 HG23 VAL 70 2.153 -3.101 4.182 576 H LEU 71 HN LEU 71 0.703 1.929 5.146 577 HA LEU 71 HA LEU 71 -1.485 2.856 3.437 578 HB2 LEU 71 HB2 LEU 71 0.388 4.401 5.232 579 HB3 LEU 71 HB1 LEU 71 -0.912 5.102 4.291 580 HG LEU 71 HG LEU 71 -1.234 3.150 6.574 581 HD11 LEU 71 HD11 LEU 71 -1.850 6.094 6.347 582 HD12 LEU 71 HD12 LEU 71 -0.590 5.358 7.339 583 HD13 LEU 71 HD13 LEU 71 -2.289 5.062 7.709 584 HD21 LEU 71 HD21 LEU 71 -3.645 3.624 6.316 585 HD22 LEU 71 HD22 LEU 71 -2.960 2.790 4.922 586 HD23 LEU 71 HD23 LEU 71 -3.284 4.522 4.840 587 H ARG 72 HN ARG 72 -1.097 3.305 1.402 588 HA ARG 72 HA ARG 72 1.653 3.469 0.438 589 HB2 ARG 72 HB2 ARG 72 -0.165 2.040 -0.637 590 HB3 ARG 72 HB1 ARG 72 -0.903 3.539 -1.184 591 HG2 ARG 72 HG2 ARG 72 0.977 4.052 -2.552 592 HG3 ARG 72 HG1 ARG 72 1.911 2.721 -1.861 593 HD2 ARG 72 HD2 ARG 72 -0.001 1.227 -2.718 594 HD3 ARG 72 HD1 ARG 72 -0.437 2.610 -3.716 595 HE ARG 72 HE ARG 72 2.317 1.650 -3.864 596 HH11 ARG 72 HH11 ARG 72 -0.879 1.786 -5.291 597 HH12 ARG 72 HH12 ARG 72 -0.330 1.347 -6.878 598 HH21 ARG 72 HH21 ARG 72 3.044 1.025 -5.961 599 HH22 ARG 72 HH22 ARG 72 1.882 0.912 -7.254 600 H LEU 73 HN LEU 73 2.497 5.246 -0.669 601 HA LEU 73 HA LEU 73 0.835 7.642 -0.912 602 HB2 LEU 73 HB2 LEU 73 3.377 7.464 0.681 603 HB3 LEU 73 HB1 LEU 73 2.794 8.982 0.039 604 HG LEU 73 HG LEU 73 0.584 8.186 1.346 605 HD11 LEU 73 HD11 LEU 73 1.917 6.132 2.095 606 HD12 LEU 73 HD12 LEU 73 1.035 7.038 3.327 607 HD13 LEU 73 HD13 LEU 73 2.777 7.247 3.157 608 HD21 LEU 73 HD21 LEU 73 1.684 10.339 1.591 609 HD22 LEU 73 HD22 LEU 73 2.960 9.596 2.553 610 HD23 LEU 73 HD23 LEU 73 1.311 9.654 3.173 611 H ARG 74 HN ARG 74 2.678 9.460 -1.667 612 HA ARG 74 HA ARG 74 4.236 8.254 -3.835 613 HB2 ARG 74 HB2 ARG 74 2.213 10.478 -4.147 614 HB3 ARG 74 HB1 ARG 74 3.400 10.054 -5.370 615 HG2 ARG 74 HG2 ARG 74 1.588 7.934 -4.336 616 HG3 ARG 74 HG1 ARG 74 0.954 9.125 -5.474 617 HD2 ARG 74 HD2 ARG 74 2.361 8.439 -7.174 618 HD3 ARG 74 HD1 ARG 74 3.527 7.727 -6.062 619 HE ARG 74 HE ARG 74 2.392 5.763 -6.197 620 HH11 ARG 74 HH11 ARG 74 0.240 8.323 -7.265 621 HH12 ARG 74 HH12 ARG 74 -1.011 7.230 -7.765 622 HH21 ARG 74 HH21 ARG 74 0.753 4.337 -6.878 623 HH22 ARG 74 HH22 ARG 74 -0.723 4.972 -7.544 624 H GLY 75 HN GLY 75 3.337 11.388 -2.394 625 HA2 GLY 75 HA2 GLY 75 5.855 12.592 -3.005 626 HA3 GLY 75 HA1 GLY 75 4.593 13.274 -1.996 627 H GLY 76 HN GLY 76 7.452 11.303 -2.075 628 HA2 GLY 76 HA2 GLY 76 8.266 12.070 0.514 629 HA3 GLY 76 HA1 GLY 76 7.572 10.452 0.574 630 H1 SER 453 HT1 SER 453 21.130 10.484 16.397 631 H2 SER 453 HT2 SER 453 21.942 9.002 16.409 632 H3 SER 453 HT3 SER 453 22.320 10.179 17.556 633 HA SER 453 HA SER 453 21.018 8.701 18.730 634 HB2 SER 453 HB2 SER 453 18.648 10.014 18.574 635 HB3 SER 453 HB1 SER 453 20.059 10.652 19.423 636 HG SER 453 HG SER 453 19.301 12.221 18.010 637 H ASN 454 HN ASN 454 18.824 9.656 16.083 638 HA ASN 454 HA ASN 454 17.358 8.479 14.804 639 HB2 ASN 454 HB2 ASN 454 19.331 6.226 15.269 640 HB3 ASN 454 HB1 ASN 454 18.015 6.179 14.101 641 HD21 ASN 454 HD21 ASN 454 20.792 5.888 13.576 642 HD22 ASN 454 HD22 ASN 454 21.257 7.174 12.518 643 H SER 455 HN SER 455 16.891 8.657 17.620 644 HA SER 455 HA SER 455 16.042 6.196 18.719 645 HB2 SER 455 HB2 SER 455 14.559 8.212 19.947 646 HB3 SER 455 HB1 SER 455 16.130 7.600 20.475 647 HG SER 455 HG SER 455 15.638 10.020 19.770 648 H GLN 456 HN GLN 456 14.301 8.838 17.098 649 HA GLN 456 HA GLN 456 11.736 7.660 17.301 650 HB2 GLN 456 HB2 GLN 456 12.765 9.655 15.274 651 HB3 GLN 456 HB1 GLN 456 11.071 9.265 15.550 652 HG2 GLN 456 HG2 GLN 456 12.968 10.593 17.472 653 HG3 GLN 456 HG1 GLN 456 11.598 11.329 16.643 654 HE21 GLN 456 HE21 GLN 456 12.210 11.085 19.495 655 HE22 GLN 456 HE22 GLN 456 10.845 10.293 20.204 656 H LEU 457 HN LEU 457 14.250 7.546 14.846 657 HA LEU 457 HA LEU 457 12.804 6.132 12.892 658 HB2 LEU 457 HB2 LEU 457 15.776 6.094 13.426 659 HB3 LEU 457 HB1 LEU 457 14.997 5.552 11.953 660 HG LEU 457 HG LEU 457 14.971 8.393 12.978 661 HD11 LEU 457 HD11 LEU 457 16.482 8.838 11.089 662 HD12 LEU 457 HD12 LEU 457 16.567 7.103 10.773 663 HD13 LEU 457 HD13 LEU 457 17.195 7.755 12.288 664 HD21 LEU 457 HD21 LEU 457 13.000 7.917 11.672 665 HD22 LEU 457 HD22 LEU 457 13.976 7.178 10.403 666 HD23 LEU 457 HD23 LEU 457 14.105 8.908 10.720 667 H ASN 458 HN ASN 458 14.828 5.051 15.585 668 HA ASN 458 HA ASN 458 14.771 2.299 14.985 669 HB2 ASN 458 HB2 ASN 458 15.944 3.888 16.941 670 HB3 ASN 458 HB1 ASN 458 14.828 2.868 17.846 671 HD21 ASN 458 HD21 ASN 458 15.135 0.641 17.860 672 HD22 ASN 458 HD22 ASN 458 16.629 -0.083 17.378 673 H ALA 459 HN ALA 459 12.747 4.284 17.110 674 HA ALA 459 HA ALA 459 11.070 2.212 18.013 675 HB1 ALA 459 HB1 ALA 459 11.272 4.410 19.105 676 HB2 ALA 459 HB2 ALA 459 9.596 3.967 18.782 677 HB3 ALA 459 HB3 ALA 459 10.413 5.144 17.750 678 H MET 460 HN MET 460 10.739 4.502 15.316 679 HA MET 460 HA MET 460 8.175 3.679 14.500 680 HB2 MET 460 HB2 MET 460 10.424 5.163 13.229 681 HB3 MET 460 HB1 MET 460 9.145 4.557 12.188 682 HG2 MET 460 HG2 MET 460 7.501 5.741 13.655 683 HG3 MET 460 HG1 MET 460 8.870 6.468 14.495 684 HE1 MET 460 HE1 MET 460 10.430 8.836 11.892 685 HE2 MET 460 HE2 MET 460 10.971 7.220 12.342 686 HE3 MET 460 HE3 MET 460 10.369 8.323 13.579 687 H ALA 461 HN ALA 461 11.395 2.507 13.691 688 HA ALA 461 HA ALA 461 10.598 0.725 11.640 689 HB1 ALA 461 HB1 ALA 461 13.022 0.598 13.432 690 HB2 ALA 461 HB2 ALA 461 12.913 1.463 11.899 691 HB3 ALA 461 HB3 ALA 461 12.798 -0.296 11.928 692 H HIS 462 HN HIS 462 10.811 0.472 15.132 693 HA HIS 462 HA HIS 462 10.558 -2.318 15.369 694 HB2 HIS 462 HB2 HIS 462 11.043 -0.443 17.166 695 HB3 HIS 462 HB1 HIS 462 9.298 -0.496 17.383 696 HD2 HIS 462 HD2 HIS 462 8.516 -3.444 17.696 697 HE1 HIS 462 HE1 HIS 462 11.940 -3.938 20.123 698 HE2 HIS 462 HE2 HIS 462 9.815 -5.025 19.283 699 H GLN 463 HN GLN 463 8.197 0.268 15.039 700 HA GLN 463 HA GLN 463 5.881 -1.278 15.474 701 HB2 GLN 463 HB2 GLN 463 5.776 1.145 15.527 702 HB3 GLN 463 HB1 GLN 463 6.292 1.244 13.851 703 HG2 GLN 463 HG2 GLN 463 3.917 1.663 14.044 704 HG3 GLN 463 HG1 GLN 463 4.210 0.177 13.143 705 HE21 GLN 463 HE21 GLN 463 3.562 -1.773 14.002 706 HE22 GLN 463 HE22 GLN 463 2.542 -1.886 15.391 707 H ILE 464 HN ILE 464 7.731 -0.507 12.558 708 HA ILE 464 HA ILE 464 6.005 -1.812 10.732 709 HB ILE 464 HB ILE 464 8.972 -1.299 10.459 710 HG12 ILE 464 HG12 ILE 464 6.579 0.363 9.630 711 HG13 ILE 464 HG11 ILE 464 7.747 0.767 10.886 712 HG21 ILE 464 HG21 ILE 464 8.555 -1.449 8.044 713 HG22 ILE 464 HG22 ILE 464 6.872 -1.867 8.365 714 HG23 ILE 464 HG23 ILE 464 8.160 -2.962 8.868 715 HD11 ILE 464 HD11 ILE 464 8.150 2.025 8.849 716 HD12 ILE 464 HD12 ILE 464 8.332 0.522 7.947 717 HD13 ILE 464 HD13 ILE 464 9.495 0.944 9.202 718 H GLN 465 HN GLN 465 8.760 -2.885 12.656 719 HA GLN 465 HA GLN 465 9.059 -5.435 11.485 720 HB2 GLN 465 HB2 GLN 465 10.570 -4.116 13.177 721 HB3 GLN 465 HB1 GLN 465 9.624 -4.970 14.388 722 HG2 GLN 465 HG2 GLN 465 11.647 -6.180 13.953 723 HG3 GLN 465 HG1 GLN 465 10.271 -7.104 13.351 724 HE21 GLN 465 HE21 GLN 465 11.586 -8.267 11.942 725 HE22 GLN 465 HE22 GLN 465 12.218 -7.563 10.490 726 H GLU 466 HN GLU 466 6.773 -4.157 13.725 727 HA GLU 466 HA GLU 466 5.866 -6.722 14.674 728 HB2 GLU 466 HB2 GLU 466 4.946 -3.891 15.053 729 HB3 GLU 466 HB1 GLU 466 3.924 -5.232 15.554 730 HG2 GLU 466 HG2 GLU 466 6.731 -4.702 16.513 731 HG3 GLU 466 HG1 GLU 466 5.249 -4.366 17.407 732 H MET 467 HN MET 467 5.296 -4.671 12.013 733 HA MET 467 HA MET 467 2.721 -5.879 11.372 734 HB2 MET 467 HB2 MET 467 4.249 -3.913 9.671 735 HB3 MET 467 HB1 MET 467 2.528 -4.262 9.640 736 HG2 MET 467 HG2 MET 467 3.999 -2.891 11.880 737 HG3 MET 467 HG1 MET 467 3.012 -2.099 10.655 738 HE1 MET 467 HE1 MET 467 0.503 -3.731 10.246 739 HE2 MET 467 HE2 MET 467 0.452 -2.011 10.625 740 HE3 MET 467 HE3 MET 467 -0.581 -3.138 11.505 741 H PHE 468 HN PHE 468 6.006 -5.647 10.125 742 HA PHE 468 HA PHE 468 5.452 -7.971 8.404 743 HB2 PHE 468 HB2 PHE 468 6.983 -5.461 7.888 744 HB3 PHE 468 HB1 PHE 468 7.549 -6.951 7.143 745 HD1 PHE 468 HD1 PHE 468 4.367 -5.059 7.614 746 HD2 PHE 468 HD2 PHE 468 6.774 -7.458 5.054 747 HE1 PHE 468 HE1 PHE 468 2.716 -4.781 5.816 748 HE2 PHE 468 HE2 PHE 468 5.124 -7.187 3.248 749 HZ PHE 468 HZ PHE 468 3.096 -5.848 3.625 750 HA PRO 469 HA PRO 469 8.742 -9.254 11.359 751 HB2 PRO 469 HB2 PRO 469 7.320 -11.756 11.608 752 HB3 PRO 469 HB1 PRO 469 7.555 -10.507 12.839 753 HG2 PRO 469 HG2 PRO 469 5.139 -11.127 11.752 754 HG3 PRO 469 HG1 PRO 469 5.549 -9.546 12.444 755 HD2 PRO 469 HD2 PRO 469 5.459 -10.376 9.576 756 HD3 PRO 469 HD1 PRO 469 4.937 -8.857 10.331 757 H GLN 470 HN GLN 470 8.525 -9.519 8.375 758 HA GLN 470 HA GLN 470 10.164 -11.938 8.122 759 HB2 GLN 470 HB2 GLN 470 9.109 -12.347 5.892 760 HB3 GLN 470 HB1 GLN 470 8.030 -12.586 7.258 761 HG2 GLN 470 HG2 GLN 470 7.036 -10.389 6.852 762 HG3 GLN 470 HG1 GLN 470 8.116 -10.161 5.479 763 HE21 GLN 470 HE21 GLN 470 6.389 -9.956 4.052 764 HE22 GLN 470 HE22 GLN 470 5.422 -11.305 3.569 765 H VAL 471 HN VAL 471 10.614 -8.957 8.271 766 HA VAL 471 HA VAL 471 12.281 -8.787 5.863 767 HB VAL 471 HB VAL 471 10.351 -7.311 5.530 768 HG11 VAL 471 HG11 VAL 471 9.996 -5.350 6.953 769 HG12 VAL 471 HG12 VAL 471 11.263 -5.915 8.042 770 HG13 VAL 471 HG13 VAL 471 9.782 -6.855 7.850 771 HG21 VAL 471 HG21 VAL 471 12.459 -6.640 4.557 772 HG22 VAL 471 HG22 VAL 471 12.925 -5.831 6.054 773 HG23 VAL 471 HG23 VAL 471 11.574 -5.214 5.102 774 HA PRO 472 HA PRO 472 15.583 -8.356 8.810 775 HB2 PRO 472 HB2 PRO 472 16.783 -6.727 6.614 776 HB3 PRO 472 HB1 PRO 472 17.473 -8.093 7.512 777 HG2 PRO 472 HG2 PRO 472 16.626 -8.428 5.042 778 HG3 PRO 472 HG1 PRO 472 16.328 -9.668 6.278 779 HD2 PRO 472 HD2 PRO 472 14.439 -7.672 5.117 780 HD3 PRO 472 HD1 PRO 472 14.151 -9.356 5.603 781 H TYR 473 HN TYR 473 15.581 -7.021 10.451 782 HA TYR 473 HA TYR 473 14.342 -4.565 10.632 783 HB2 TYR 473 HB2 TYR 473 15.205 -6.146 12.479 784 HB3 TYR 473 HB1 TYR 473 16.723 -5.269 12.334 785 HD1 TYR 473 HD2 TYR 473 13.125 -4.883 13.120 786 HD2 TYR 473 HD1 TYR 473 17.008 -3.168 13.396 787 HE1 TYR 473 HE2 TYR 473 12.258 -3.187 14.671 788 HE2 TYR 473 HE1 TYR 473 16.152 -1.470 14.956 789 HH TYR 473 HH TYR 473 13.655 -0.416 15.342 790 H HIS 474 HN HIS 474 17.741 -5.216 9.844 791 HA HIS 474 HA HIS 474 18.562 -2.511 10.007 792 HB2 HIS 474 HB2 HIS 474 20.598 -3.210 8.866 793 HB3 HIS 474 HB1 HIS 474 20.172 -4.352 10.132 794 HD2 HIS 474 HD2 HIS 474 20.598 -4.186 6.293 795 HE1 HIS 474 HE1 HIS 474 19.769 -8.183 7.400 796 HE2 HIS 474 HE2 HIS 474 20.647 -6.673 5.562 797 H LEU 475 HN LEU 475 16.955 -4.318 7.516 798 HA LEU 475 HA LEU 475 17.589 -2.432 5.435 799 HB2 LEU 475 HB2 LEU 475 15.819 -4.833 5.640 800 HB3 LEU 475 HB1 LEU 475 15.588 -3.712 4.312 801 HG LEU 475 HG LEU 475 18.162 -5.174 4.929 802 HD11 LEU 475 HD11 LEU 475 16.386 -6.659 4.115 803 HD12 LEU 475 HD12 LEU 475 17.689 -6.476 2.943 804 HD13 LEU 475 HD13 LEU 475 16.168 -5.615 2.712 805 HD21 LEU 475 HD21 LEU 475 18.680 -3.094 3.886 806 HD22 LEU 475 HD22 LEU 475 17.380 -3.290 2.712 807 HD23 LEU 475 HD23 LEU 475 18.792 -4.343 2.648 808 H VAL 476 HN VAL 476 15.027 -2.988 7.732 809 HA VAL 476 HA VAL 476 13.138 -1.169 6.671 810 HB VAL 476 HB VAL 476 13.509 -1.860 9.593 811 HG11 VAL 476 HG11 VAL 476 11.092 -1.447 9.724 812 HG12 VAL 476 HG12 VAL 476 11.087 -0.988 8.022 813 HG13 VAL 476 HG13 VAL 476 11.979 -0.019 9.193 814 HG21 VAL 476 HG21 VAL 476 11.977 -3.359 7.472 815 HG22 VAL 476 HG22 VAL 476 11.892 -3.679 9.204 816 HG23 VAL 476 HG23 VAL 476 13.408 -3.923 8.336 817 H LEU 477 HN LEU 477 15.708 -0.887 9.077 818 HA LEU 477 HA LEU 477 15.335 1.823 9.737 819 HB2 LEU 477 HB2 LEU 477 17.733 0.008 9.854 820 HB3 LEU 477 HB1 LEU 477 17.818 1.681 10.369 821 HG LEU 477 HG LEU 477 15.885 -0.311 11.553 822 HD11 LEU 477 HD11 LEU 477 17.454 -0.442 13.449 823 HD12 LEU 477 HD12 LEU 477 18.625 0.491 12.520 824 HD13 LEU 477 HD13 LEU 477 18.132 -1.104 11.963 825 HD21 LEU 477 HD21 LEU 477 15.210 1.973 11.886 826 HD22 LEU 477 HD22 LEU 477 16.836 2.423 12.407 827 HD23 LEU 477 HD23 LEU 477 15.856 1.344 13.403 828 H GLN 478 HN GLN 478 16.956 0.254 7.086 829 HA GLN 478 HA GLN 478 18.524 2.408 6.196 830 HB2 GLN 478 HB2 GLN 478 18.922 0.148 5.407 831 HB3 GLN 478 HB1 GLN 478 17.331 0.094 4.661 832 HG2 GLN 478 HG2 GLN 478 18.728 2.358 3.650 833 HG3 GLN 478 HG1 GLN 478 19.785 0.951 3.547 834 HE21 GLN 478 HE21 GLN 478 16.311 0.646 3.385 835 HE22 GLN 478 HE22 GLN 478 16.230 0.249 1.706 836 H ASP 479 HN ASP 479 15.249 1.353 5.239 837 HA ASP 479 HA ASP 479 14.943 3.531 3.400 838 HB2 ASP 479 HB2 ASP 479 13.728 1.217 3.413 839 HB3 ASP 479 HB1 ASP 479 12.604 2.018 4.507 840 H LEU 480 HN LEU 480 14.279 2.991 6.763 841 HA LEU 480 HA LEU 480 12.437 5.038 7.249 842 HB2 LEU 480 HB2 LEU 480 14.028 3.262 8.795 843 HB3 LEU 480 HB1 LEU 480 14.287 4.874 9.425 844 HG LEU 480 HG LEU 480 12.548 4.009 10.725 845 HD11 LEU 480 HD11 LEU 480 11.016 5.459 8.585 846 HD12 LEU 480 HD12 LEU 480 12.108 6.272 9.704 847 HD13 LEU 480 HD13 LEU 480 10.699 5.410 10.320 848 HD21 LEU 480 HD21 LEU 480 12.069 2.043 9.407 849 HD22 LEU 480 HD22 LEU 480 11.270 3.028 8.185 850 HD23 LEU 480 HD23 LEU 480 10.575 2.891 9.800 851 H GLN 481 HN GLN 481 15.885 5.099 6.750 852 HA GLN 481 HA GLN 481 16.110 7.883 7.555 853 HB2 GLN 481 HB2 GLN 481 18.170 6.005 6.386 854 HB3 GLN 481 HB1 GLN 481 18.498 7.606 7.039 855 HG2 GLN 481 HG2 GLN 481 17.799 6.883 9.240 856 HG3 GLN 481 HG1 GLN 481 17.372 5.295 8.607 857 HE21 GLN 481 HE21 GLN 481 18.765 4.134 9.831 858 HE22 GLN 481 HE22 GLN 481 20.485 4.229 9.686 859 H LEU 482 HN LEU 482 15.167 6.234 4.827 860 HA LEU 482 HA LEU 482 16.195 8.249 2.967 861 HB2 LEU 482 HB2 LEU 482 15.263 5.463 2.728 862 HB3 LEU 482 HB1 LEU 482 14.771 6.518 1.420 863 HG LEU 482 HG LEU 482 16.847 5.266 0.940 864 HD11 LEU 482 HD11 LEU 482 18.151 7.184 0.139 865 HD12 LEU 482 HD12 LEU 482 17.154 8.255 1.122 866 HD13 LEU 482 HD13 LEU 482 16.431 7.348 -0.206 867 HD21 LEU 482 HD21 LEU 482 17.776 5.178 3.187 868 HD22 LEU 482 HD22 LEU 482 18.017 6.926 3.169 869 HD23 LEU 482 HD23 LEU 482 18.924 5.897 2.060 870 H THR 483 HN THR 483 13.090 6.562 3.519 871 HA THR 483 HA THR 483 11.638 8.729 2.283 872 HB THR 483 HB THR 483 9.627 7.346 3.132 873 HG1 THR 483 HG1 THR 483 11.189 5.078 3.187 874 HG21 THR 483 HG21 THR 483 9.893 5.727 1.288 875 HG22 THR 483 HG22 THR 483 11.593 6.178 1.160 876 HG23 THR 483 HG23 THR 483 10.338 7.365 0.807 877 H ARG 484 HN ARG 484 12.256 7.539 5.527 878 HA ARG 484 HA ARG 484 11.936 8.417 7.594 879 HB2 ARG 484 HB2 ARG 484 11.671 10.977 6.012 880 HB3 ARG 484 HB1 ARG 484 11.779 10.908 7.767 881 HG2 ARG 484 HG2 ARG 484 13.992 10.321 7.749 882 HG3 ARG 484 HG1 ARG 484 13.891 9.558 6.163 883 HD2 ARG 484 HD2 ARG 484 13.563 11.873 5.214 884 HD3 ARG 484 HD1 ARG 484 13.992 12.492 6.808 885 HE ARG 484 HE ARG 484 15.780 10.893 5.091 886 HH11 ARG 484 HH11 ARG 484 15.279 13.317 7.569 887 HH12 ARG 484 HH12 ARG 484 16.966 13.684 7.728 888 HH21 ARG 484 HH21 ARG 484 18.002 11.383 5.286 889 HH22 ARG 484 HH22 ARG 484 18.518 12.590 6.418 890 H SER 485 HN SER 485 9.709 7.366 6.100 891 HA SER 485 HA SER 485 7.566 8.382 7.767 892 HB2 SER 485 HB2 SER 485 7.667 9.572 5.407 893 HB3 SER 485 HB1 SER 485 6.945 8.063 4.849 894 HG SER 485 HG SER 485 5.315 8.426 6.545 895 H VAL 486 HN VAL 486 7.141 6.520 8.779 896 HA VAL 486 HA VAL 486 7.645 3.948 8.065 897 HB VAL 486 HB VAL 486 5.637 3.303 9.520 898 HG11 VAL 486 HG11 VAL 486 7.671 5.161 10.733 899 HG12 VAL 486 HG12 VAL 486 7.996 3.489 10.278 900 HG13 VAL 486 HG13 VAL 486 6.813 3.846 11.537 901 HG21 VAL 486 HG21 VAL 486 4.323 5.337 9.193 902 HG22 VAL 486 HG22 VAL 486 5.598 6.291 9.955 903 HG23 VAL 486 HG23 VAL 486 4.704 5.100 10.900 904 H GLU 487 HN GLU 487 4.835 5.825 7.123 905 HA GLU 487 HA GLU 487 3.251 3.776 6.084 906 HB2 GLU 487 HB2 GLU 487 3.490 6.630 5.118 907 HB3 GLU 487 HB1 GLU 487 2.154 5.539 4.788 908 HG2 GLU 487 HG2 GLU 487 1.314 6.819 6.493 909 HG3 GLU 487 HG1 GLU 487 1.933 5.419 7.364 910 H ILE 488 HN ILE 488 5.448 5.957 4.314 911 HA ILE 488 HA ILE 488 5.218 4.502 1.874 912 HB ILE 488 HB ILE 488 7.542 6.307 2.457 913 HG12 ILE 488 HG12 ILE 488 4.684 7.141 1.934 914 HG13 ILE 488 HG11 ILE 488 5.658 7.539 3.340 915 HG21 ILE 488 HG21 ILE 488 5.854 5.831 -0.002 916 HG22 ILE 488 HG22 ILE 488 7.452 5.150 0.309 917 HG23 ILE 488 HG23 ILE 488 7.262 6.890 0.095 918 HD11 ILE 488 HD11 ILE 488 6.020 8.543 0.531 919 HD12 ILE 488 HD12 ILE 488 7.171 8.819 1.837 920 HD13 ILE 488 HD13 ILE 488 5.534 9.464 1.955 921 H THR 489 HN THR 489 7.345 4.372 4.619 922 HA THR 489 HA THR 489 9.464 2.911 3.468 923 HB THR 489 HB THR 489 8.528 2.821 6.345 924 HG1 THR 489 HG1 THR 489 10.181 4.639 4.916 925 HG21 THR 489 HG21 THR 489 10.244 1.454 6.720 926 HG22 THR 489 HG22 THR 489 11.355 2.639 6.034 927 HG23 THR 489 HG23 THR 489 10.600 1.431 4.993 928 H THR 490 HN THR 490 6.538 1.858 5.198 929 HA THR 490 HA THR 490 7.136 -0.921 4.957 930 HB THR 490 HB THR 490 4.384 0.240 5.385 931 HG1 THR 490 HG1 THR 490 5.702 1.247 6.897 932 HG21 THR 490 HG21 THR 490 4.494 -2.176 5.064 933 HG22 THR 490 HG22 THR 490 4.081 -1.795 6.735 934 HG23 THR 490 HG23 THR 490 5.718 -2.301 6.326 935 H ASP 491 HN ASP 491 5.283 1.413 3.094 936 HA ASP 491 HA ASP 491 4.031 -0.392 1.322 937 HB2 ASP 491 HB2 ASP 491 3.422 2.028 1.600 938 HB3 ASP 491 HB1 ASP 491 4.889 2.447 0.718 939 H ASN 492 HN ASN 492 7.069 1.356 1.229 940 HA ASN 492 HA ASN 492 8.013 0.715 -1.285 941 HB2 ASN 492 HB2 ASN 492 9.233 1.462 1.291 942 HB3 ASN 492 HB1 ASN 492 10.307 0.603 0.194 943 HD21 ASN 492 HD21 ASN 492 10.664 3.263 1.014 944 HD22 ASN 492 HD22 ASN 492 10.500 4.273 -0.382 945 H ILE 493 HN ILE 493 7.953 -1.276 1.606 946 HA ILE 493 HA ILE 493 9.662 -3.334 0.693 947 HB ILE 493 HB ILE 493 7.362 -3.588 2.642 948 HG12 ILE 493 HG12 ILE 493 10.278 -2.994 3.205 949 HG13 ILE 493 HG11 ILE 493 8.989 -1.796 3.243 950 HG21 ILE 493 HG21 ILE 493 8.610 -5.496 3.528 951 HG22 ILE 493 HG22 ILE 493 9.837 -5.280 2.280 952 HG23 ILE 493 HG23 ILE 493 8.194 -5.735 1.828 953 HD11 ILE 493 HD11 ILE 493 9.210 -4.207 5.029 954 HD12 ILE 493 HD12 ILE 493 7.918 -3.010 5.069 955 HD13 ILE 493 HD13 ILE 493 9.566 -2.539 5.476 956 H LEU 494 HN LEU 494 6.158 -2.875 0.527 957 HA LEU 494 HA LEU 494 5.630 -5.343 -0.802 958 HB2 LEU 494 HB2 LEU 494 4.035 -2.815 -0.444 959 HB3 LEU 494 HB1 LEU 494 3.416 -4.200 -1.322 960 HG LEU 494 HG LEU 494 4.321 -4.358 1.550 961 HD11 LEU 494 HD11 LEU 494 1.940 -4.288 2.136 962 HD12 LEU 494 HD12 LEU 494 1.553 -3.893 0.460 963 HD13 LEU 494 HD13 LEU 494 2.499 -2.766 1.436 964 HD21 LEU 494 HD21 LEU 494 3.699 -6.303 -0.333 965 HD22 LEU 494 HD22 LEU 494 2.253 -6.164 0.682 966 HD23 LEU 494 HD23 LEU 494 3.823 -6.517 1.415 967 H GLU 495 HN GLU 495 6.269 -2.050 -1.803 968 HA GLU 495 HA GLU 495 5.615 -2.265 -4.515 969 HB2 GLU 495 HB2 GLU 495 7.570 -0.512 -3.038 970 HB3 GLU 495 HB1 GLU 495 7.313 -0.371 -4.771 971 HG2 GLU 495 HG2 GLU 495 5.248 0.010 -2.621 972 HG3 GLU 495 HG1 GLU 495 5.997 1.272 -3.600 973 H GLY 496 HN GLY 496 8.693 -2.788 -2.838 974 HA2 GLY 496 HA2 GLY 496 9.924 -4.791 -3.725 975 HA3 GLY 496 HA1 GLY 496 9.718 -4.051 -5.305 976 H ARG 497 HN ARG 497 10.319 -1.959 -2.635 977 HA ARG 497 HA ARG 497 12.835 -1.139 -3.796 978 HB2 ARG 497 HB2 ARG 497 11.153 0.442 -2.784 979 HB3 ARG 497 HB1 ARG 497 11.578 -0.209 -1.209 980 HG2 ARG 497 HG2 ARG 497 13.069 1.452 -1.127 981 HG3 ARG 497 HG1 ARG 497 14.023 0.469 -2.240 982 HD2 ARG 497 HD2 ARG 497 13.757 2.804 -3.007 983 HD3 ARG 497 HD1 ARG 497 13.085 1.630 -4.139 984 HE ARG 497 HE ARG 497 10.975 2.343 -2.552 985 HH11 ARG 497 HH11 ARG 497 13.233 4.102 -4.563 986 HH12 ARG 497 HH12 ARG 497 12.100 5.356 -4.953 987 HH21 ARG 497 HH21 ARG 497 9.488 3.988 -3.057 988 HH22 ARG 497 HH22 ARG 497 9.968 5.296 -4.098 989 H ILE 498 HN ILE 498 11.778 -2.392 -0.642 990 HA ILE 498 HA ILE 498 14.465 -2.897 0.235 991 HB ILE 498 HB ILE 498 11.759 -3.552 1.399 992 HG12 ILE 498 HG12 ILE 498 12.837 -2.156 3.307 993 HG13 ILE 498 HG11 ILE 498 14.005 -1.670 2.085 994 HG21 ILE 498 HG21 ILE 498 13.104 -5.445 1.969 995 HG22 ILE 498 HG22 ILE 498 12.967 -4.419 3.398 996 HG23 ILE 498 HG23 ILE 498 14.448 -4.408 2.442 997 HD11 ILE 498 HD11 ILE 498 11.028 -1.248 1.952 998 HD12 ILE 498 HD12 ILE 498 12.196 -0.757 0.725 999 HD13 ILE 498 HD13 ILE 498 12.242 -0.026 2.330 1000 H GLN 499 HN GLN 499 15.613 -4.716 0.014 1001 HA GLN 499 HA GLN 499 14.661 -6.753 -1.753 1002 HB2 GLN 499 HB2 GLN 499 17.218 -6.652 -0.146 1003 HB3 GLN 499 HB1 GLN 499 16.879 -7.737 -1.489 1004 HG2 GLN 499 HG2 GLN 499 17.066 -4.735 -1.646 1005 HG3 GLN 499 HG1 GLN 499 18.300 -5.878 -2.173 1006 HE21 GLN 499 HE21 GLN 499 15.252 -4.407 -2.899 1007 HE22 GLN 499 HE22 GLN 499 15.103 -5.027 -4.506 1008 H VAL 500 HN VAL 500 13.078 -7.966 -0.916 1009 HA VAL 500 HA VAL 500 12.879 -8.852 1.747 1010 HB VAL 500 HB VAL 500 11.183 -10.458 0.884 1011 HG11 VAL 500 HG11 VAL 500 10.523 -8.199 1.458 1012 HG12 VAL 500 HG12 VAL 500 9.617 -8.752 0.050 1013 HG13 VAL 500 HG13 VAL 500 10.966 -7.634 -0.151 1014 HG21 VAL 500 HG21 VAL 500 11.965 -9.347 -1.811 1015 HG22 VAL 500 HG22 VAL 500 10.579 -10.390 -1.494 1016 HG23 VAL 500 HG23 VAL 500 12.216 -11.001 -1.252 1017 HA PRO 501 HA PRO 501 15.589 -12.309 2.142 1018 HB2 PRO 501 HB2 PRO 501 13.272 -13.829 3.245 1019 HB3 PRO 501 HB1 PRO 501 14.856 -13.497 3.974 1020 HG2 PRO 501 HG2 PRO 501 12.693 -12.233 4.820 1021 HG3 PRO 501 HG1 PRO 501 14.254 -11.397 4.682 1022 HD2 PRO 501 HD2 PRO 501 11.876 -11.253 2.885 1023 HD3 PRO 501 HD1 PRO 501 12.997 -9.971 3.386 1024 H PHE 502 HN PHE 502 16.235 -13.563 0.536 1025 HA PHE 502 HA PHE 502 14.234 -15.177 -0.891 1026 HB2 PHE 502 HB2 PHE 502 15.859 -13.127 -1.945 1027 HB3 PHE 502 HB1 PHE 502 16.559 -14.638 -2.511 1028 HD1 PHE 502 HD1 PHE 502 13.051 -13.472 -1.977 1029 HD2 PHE 502 HD2 PHE 502 15.939 -15.053 -4.666 1030 HE1 PHE 502 HE1 PHE 502 11.336 -13.593 -3.738 1031 HE2 PHE 502 HE2 PHE 502 14.233 -15.182 -6.433 1032 HZ PHE 502 HZ PHE 502 11.929 -14.449 -5.971 1033 HA PRO 503 HA PRO 503 16.798 -18.588 0.231 1034 HB2 PRO 503 HB2 PRO 503 16.036 -20.390 -1.664 1035 HB3 PRO 503 HB1 PRO 503 15.010 -19.951 -0.286 1036 HG2 PRO 503 HG2 PRO 503 14.880 -19.020 -3.106 1037 HG3 PRO 503 HG1 PRO 503 13.566 -19.431 -1.986 1038 HD2 PRO 503 HD2 PRO 503 14.305 -16.870 -2.524 1039 HD3 PRO 503 HD1 PRO 503 13.599 -17.376 -0.977 1040 H THR 504 HN THR 504 18.663 -17.225 -0.498 1041 HA THR 504 HA THR 504 20.057 -18.607 -2.661 1042 HB THR 504 HB THR 504 19.093 -16.524 -3.634 1043 HG1 THR 504 HG1 THR 504 21.646 -17.336 -3.694 1044 HG21 THR 504 HG21 THR 504 19.124 -15.121 -1.639 1045 HG22 THR 504 HG22 THR 504 20.014 -14.354 -2.954 1046 HG23 THR 504 HG23 THR 504 20.890 -15.142 -1.642 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 -18.344 -11.074 13.965 2 H2 MET 1 HT2 MET 1 -18.101 -12.614 13.302 3 H3 MET 1 HT3 MET 1 -17.282 -11.276 12.665 4 HA MET 1 HA MET 1 -16.946 -12.192 15.442 5 HB2 MET 1 HB2 MET 1 -14.893 -13.285 14.764 6 HB3 MET 1 HB1 MET 1 -16.233 -13.954 13.851 7 HG2 MET 1 HG2 MET 1 -15.577 -12.402 11.980 8 HG3 MET 1 HG1 MET 1 -14.113 -12.054 12.897 9 HE1 MET 1 HE1 MET 1 -12.672 -14.355 10.122 10 HE2 MET 1 HE2 MET 1 -12.581 -12.794 10.940 11 HE3 MET 1 HE3 MET 1 -13.965 -13.174 9.916 12 H GLN 2 HN GLN 2 -14.855 -11.331 16.306 13 HA GLN 2 HA GLN 2 -14.572 -8.565 15.383 14 HB2 GLN 2 HB2 GLN 2 -13.622 -9.808 17.969 15 HB3 GLN 2 HB1 GLN 2 -13.618 -8.096 17.573 16 HG2 GLN 2 HG2 GLN 2 -16.035 -9.848 17.944 17 HG3 GLN 2 HG1 GLN 2 -15.455 -8.600 19.045 18 HE21 GLN 2 HE21 GLN 2 -18.026 -8.893 17.680 19 HE22 GLN 2 HE22 GLN 2 -18.251 -7.434 16.782 20 H ILE 3 HN ILE 3 -12.726 -7.756 14.589 21 HA ILE 3 HA ILE 3 -10.306 -9.432 14.723 22 HB ILE 3 HB ILE 3 -9.666 -8.684 12.468 23 HG12 ILE 3 HG12 ILE 3 -12.481 -7.670 12.114 24 HG13 ILE 3 HG11 ILE 3 -11.162 -6.608 12.592 25 HG21 ILE 3 HG21 ILE 3 -11.256 -10.076 11.198 26 HG22 ILE 3 HG22 ILE 3 -12.329 -10.089 12.596 27 HG23 ILE 3 HG23 ILE 3 -10.737 -10.839 12.702 28 HD11 ILE 3 HD11 ILE 3 -11.234 -8.250 10.074 29 HD12 ILE 3 HD12 ILE 3 -9.978 -7.108 10.549 30 HD13 ILE 3 HD13 ILE 3 -11.604 -6.530 10.191 31 H PHE 4 HN PHE 4 -8.312 -8.239 14.638 32 HA PHE 4 HA PHE 4 -8.645 -5.447 15.519 33 HB2 PHE 4 HB2 PHE 4 -6.480 -7.411 16.310 34 HB3 PHE 4 HB1 PHE 4 -6.617 -5.747 16.871 35 HD1 PHE 4 HD1 PHE 4 -8.594 -5.099 18.276 36 HD2 PHE 4 HD2 PHE 4 -7.664 -9.150 17.362 37 HE1 PHE 4 HE1 PHE 4 -10.005 -5.844 20.151 38 HE2 PHE 4 HE2 PHE 4 -9.072 -9.900 19.232 39 HZ PHE 4 HZ PHE 4 -10.245 -8.246 20.631 40 H VAL 5 HN VAL 5 -7.894 -4.007 14.131 41 HA VAL 5 HA VAL 5 -5.880 -4.856 12.170 42 HB VAL 5 HB VAL 5 -7.510 -2.315 12.115 43 HG11 VAL 5 HG11 VAL 5 -6.916 -2.257 9.764 44 HG12 VAL 5 HG12 VAL 5 -6.039 -3.780 9.928 45 HG13 VAL 5 HG13 VAL 5 -5.462 -2.336 10.761 46 HG21 VAL 5 HG21 VAL 5 -8.120 -4.972 10.823 47 HG22 VAL 5 HG22 VAL 5 -8.967 -3.462 10.491 48 HG23 VAL 5 HG23 VAL 5 -9.049 -4.183 12.099 49 H LYS 6 HN LYS 6 -3.838 -4.290 12.510 50 HA LYS 6 HA LYS 6 -3.247 -2.157 14.422 51 HB2 LYS 6 HB2 LYS 6 -2.146 -4.616 14.125 52 HB3 LYS 6 HB1 LYS 6 -1.035 -3.657 13.157 53 HG2 LYS 6 HG2 LYS 6 -0.133 -3.776 15.340 54 HG3 LYS 6 HG1 LYS 6 -0.770 -2.141 15.141 55 HD2 LYS 6 HD2 LYS 6 -2.696 -2.650 16.448 56 HD3 LYS 6 HD1 LYS 6 -2.323 -4.375 16.438 57 HE2 LYS 6 HE2 LYS 6 -0.279 -3.905 17.739 58 HE3 LYS 6 HE1 LYS 6 -0.729 -2.199 17.793 59 HZ1 LYS 6 HZ1 LYS 6 -1.364 -3.426 19.808 60 HZ2 LYS 6 HZ2 LYS 6 -2.374 -4.416 18.888 61 HZ3 LYS 6 HZ3 LYS 6 -2.705 -2.761 19.017 62 H THR 7 HN THR 7 -2.354 -0.249 13.865 63 HA THR 7 HA THR 7 -1.812 0.191 11.006 64 HB THR 7 HB THR 7 -2.224 2.625 11.560 65 HG1 THR 7 HG1 THR 7 -3.547 1.631 13.866 66 HG21 THR 7 HG21 THR 7 -4.558 0.780 12.057 67 HG22 THR 7 HG22 THR 7 -3.898 1.154 10.465 68 HG23 THR 7 HG23 THR 7 -4.623 2.431 11.441 69 H LEU 8 HN LEU 8 -0.279 2.065 10.629 70 HA LEU 8 HA LEU 8 2.220 1.488 11.841 71 HB2 LEU 8 HB2 LEU 8 1.319 3.625 9.927 72 HB3 LEU 8 HB1 LEU 8 2.978 3.489 10.478 73 HG LEU 8 HG LEU 8 1.600 1.170 9.157 74 HD11 LEU 8 HD11 LEU 8 3.046 3.440 7.807 75 HD12 LEU 8 HD12 LEU 8 1.350 3.003 7.608 76 HD13 LEU 8 HD13 LEU 8 2.614 1.915 7.033 77 HD21 LEU 8 HD21 LEU 8 3.869 0.508 8.633 78 HD22 LEU 8 HD22 LEU 8 3.716 0.798 10.366 79 HD23 LEU 8 HD23 LEU 8 4.494 1.999 9.336 80 H THR 9 HN THR 9 -0.322 3.624 12.627 81 HA THR 9 HA THR 9 1.318 5.484 14.113 82 HB THR 9 HB THR 9 -1.450 5.691 14.808 83 HG1 THR 9 HG1 THR 9 -2.265 5.969 12.627 84 HG21 THR 9 HG21 THR 9 0.148 7.553 14.707 85 HG22 THR 9 HG22 THR 9 -1.252 7.865 13.684 86 HG23 THR 9 HG23 THR 9 0.273 7.356 12.961 87 H GLY 10 HN GLY 10 0.315 2.392 14.641 88 HA2 GLY 10 HA2 GLY 10 0.517 1.101 16.557 89 HA3 GLY 10 HA1 GLY 10 0.834 2.568 17.470 90 H LYS 11 HN LYS 11 -1.955 2.439 15.453 91 HA LYS 11 HA LYS 11 -3.641 2.378 17.856 92 HB2 LYS 11 HB2 LYS 11 -3.923 4.408 16.639 93 HB3 LYS 11 HB1 LYS 11 -4.027 3.555 15.106 94 HG2 LYS 11 HG2 LYS 11 -6.169 2.558 15.868 95 HG3 LYS 11 HG1 LYS 11 -6.077 3.575 17.310 96 HD2 LYS 11 HD2 LYS 11 -6.109 5.573 15.937 97 HD3 LYS 11 HD1 LYS 11 -6.078 4.592 14.470 98 HE2 LYS 11 HE2 LYS 11 -8.246 3.624 15.081 99 HE3 LYS 11 HE1 LYS 11 -8.288 4.631 16.526 100 HZ1 LYS 11 HZ1 LYS 11 -9.558 5.760 14.941 101 HZ2 LYS 11 HZ2 LYS 11 -8.448 5.474 13.694 102 HZ3 LYS 11 HZ3 LYS 11 -8.073 6.565 14.931 103 H THR 12 HN THR 12 -4.927 0.674 18.199 104 HA THR 12 HA THR 12 -5.149 -1.341 16.101 105 HB THR 12 HB THR 12 -6.254 -1.673 18.869 106 HG1 THR 12 HG1 THR 12 -4.193 -1.047 19.345 107 HG21 THR 12 HG21 THR 12 -6.718 -3.409 17.218 108 HG22 THR 12 HG22 THR 12 -5.636 -4.020 18.469 109 HG23 THR 12 HG23 THR 12 -4.993 -3.575 16.888 110 H ILE 13 HN ILE 13 -6.798 -1.066 14.752 111 HA ILE 13 HA ILE 13 -9.247 0.232 15.649 112 HB ILE 13 HB ILE 13 -8.771 -0.894 12.896 113 HG12 ILE 13 HG12 ILE 13 -8.049 1.903 13.793 114 HG13 ILE 13 HG11 ILE 13 -6.870 0.606 13.625 115 HG21 ILE 13 HG21 ILE 13 -10.472 1.370 13.940 116 HG22 ILE 13 HG22 ILE 13 -11.040 -0.211 13.401 117 HG23 ILE 13 HG23 ILE 13 -10.320 0.908 12.244 118 HD11 ILE 13 HD11 ILE 13 -7.430 0.422 11.251 119 HD12 ILE 13 HD12 ILE 13 -6.863 2.036 11.676 120 HD13 ILE 13 HD13 ILE 13 -8.585 1.743 11.428 121 H THR 14 HN THR 14 -10.866 -0.909 16.462 122 HA THR 14 HA THR 14 -10.979 -3.774 16.118 123 HB THR 14 HB THR 14 -13.132 -2.192 17.472 124 HG1 THR 14 HG1 THR 14 -11.824 -2.085 19.339 125 HG21 THR 14 HG21 THR 14 -13.337 -4.630 17.315 126 HG22 THR 14 HG22 THR 14 -13.139 -4.112 18.989 127 HG23 THR 14 HG23 THR 14 -11.778 -4.814 18.116 128 H LEU 15 HN LEU 15 -12.195 -4.800 14.634 129 HA LEU 15 HA LEU 15 -14.395 -3.303 13.385 130 HB2 LEU 15 HB2 LEU 15 -12.225 -4.885 12.047 131 HB3 LEU 15 HB1 LEU 15 -13.769 -4.619 11.266 132 HG LEU 15 HG LEU 15 -11.864 -2.452 12.148 133 HD11 LEU 15 HD11 LEU 15 -11.376 -2.147 9.824 134 HD12 LEU 15 HD12 LEU 15 -12.550 -3.378 9.367 135 HD13 LEU 15 HD13 LEU 15 -11.087 -3.835 10.237 136 HD21 LEU 15 HD21 LEU 15 -14.129 -1.650 12.244 137 HD22 LEU 15 HD22 LEU 15 -14.484 -2.338 10.661 138 HD23 LEU 15 HD23 LEU 15 -13.358 -0.990 10.802 139 H GLU 16 HN GLU 16 -16.212 -4.387 12.978 140 HA GLU 16 HA GLU 16 -16.352 -7.163 13.917 141 HB2 GLU 16 HB2 GLU 16 -17.840 -5.546 15.032 142 HB3 GLU 16 HB1 GLU 16 -18.538 -5.116 13.476 143 HG2 GLU 16 HG2 GLU 16 -19.523 -7.271 13.241 144 HG3 GLU 16 HG1 GLU 16 -18.658 -7.878 14.656 145 H VAL 17 HN VAL 17 -16.005 -8.500 12.239 146 HA VAL 17 HA VAL 17 -17.651 -8.130 9.829 147 HB VAL 17 HB VAL 17 -15.752 -8.890 8.408 148 HG11 VAL 17 HG11 VAL 17 -14.486 -6.736 8.469 149 HG12 VAL 17 HG12 VAL 17 -15.375 -6.319 9.935 150 HG13 VAL 17 HG13 VAL 17 -16.239 -6.549 8.415 151 HG21 VAL 17 HG21 VAL 17 -14.432 -9.976 10.159 152 HG22 VAL 17 HG22 VAL 17 -14.092 -8.402 10.878 153 HG23 VAL 17 HG23 VAL 17 -13.475 -8.788 9.274 154 H GLU 18 HN GLU 18 -18.105 -10.092 8.694 155 HA GLU 18 HA GLU 18 -17.792 -12.468 10.391 156 HB2 GLU 18 HB2 GLU 18 -19.903 -11.573 8.475 157 HB3 GLU 18 HB1 GLU 18 -19.665 -13.298 8.718 158 HG2 GLU 18 HG2 GLU 18 -20.174 -11.339 10.943 159 HG3 GLU 18 HG1 GLU 18 -21.431 -12.281 10.147 160 HA PRO 19 HA PRO 19 -15.115 -14.564 7.587 161 HB2 PRO 19 HB2 PRO 19 -17.069 -16.805 7.450 162 HB3 PRO 19 HB1 PRO 19 -15.361 -16.824 7.926 163 HG2 PRO 19 HG2 PRO 19 -17.273 -17.062 9.741 164 HG3 PRO 19 HG1 PRO 19 -15.799 -16.130 10.072 165 HD2 PRO 19 HD2 PRO 19 -18.543 -15.160 9.435 166 HD3 PRO 19 HD1 PRO 19 -17.331 -14.483 10.542 167 H SER 20 HN SER 20 -18.523 -14.498 6.741 168 HA SER 20 HA SER 20 -18.132 -15.182 3.985 169 HB2 SER 20 HB2 SER 20 -20.641 -13.885 4.452 170 HB3 SER 20 HB1 SER 20 -20.324 -15.597 4.160 171 HG SER 20 HG SER 20 -21.349 -15.179 6.202 172 H ASP 21 HN ASP 21 -17.337 -12.419 5.598 173 HA ASP 21 HA ASP 21 -18.361 -10.507 3.701 174 HB2 ASP 21 HB2 ASP 21 -17.825 -10.102 6.206 175 HB3 ASP 21 HB1 ASP 21 -16.162 -9.912 5.659 176 H THR 22 HN THR 22 -16.950 -9.050 2.505 177 HA THR 22 HA THR 22 -14.744 -10.561 1.273 178 HB THR 22 HB THR 22 -15.827 -8.102 -0.005 179 HG1 THR 22 HG1 THR 22 -17.510 -9.857 0.870 180 HG21 THR 22 HG21 THR 22 -15.432 -9.350 -2.034 181 HG22 THR 22 HG22 THR 22 -15.142 -10.825 -1.113 182 HG23 THR 22 HG23 THR 22 -14.009 -9.478 -1.002 183 H ILE 23 HN ILE 23 -12.725 -9.612 0.977 184 HA ILE 23 HA ILE 23 -11.745 -7.909 2.934 185 HB ILE 23 HB ILE 23 -10.592 -8.287 0.168 186 HG12 ILE 23 HG12 ILE 23 -10.960 -10.443 1.221 187 HG13 ILE 23 HG11 ILE 23 -9.238 -10.081 1.224 188 HG21 ILE 23 HG21 ILE 23 -8.451 -7.737 1.181 189 HG22 ILE 23 HG22 ILE 23 -9.237 -7.487 2.741 190 HG23 ILE 23 HG23 ILE 23 -9.596 -6.413 1.389 191 HD11 ILE 23 HD11 ILE 23 -11.142 -9.901 3.544 192 HD12 ILE 23 HD12 ILE 23 -9.473 -9.332 3.585 193 HD13 ILE 23 HD13 ILE 23 -9.815 -11.042 3.325 194 H GLU 24 HN GLU 24 -12.910 -7.139 -0.301 195 HA GLU 24 HA GLU 24 -12.181 -4.459 -0.459 196 HB2 GLU 24 HB2 GLU 24 -13.161 -5.887 -2.285 197 HB3 GLU 24 HB1 GLU 24 -14.734 -5.666 -1.532 198 HG2 GLU 24 HG2 GLU 24 -14.410 -3.194 -1.822 199 HG3 GLU 24 HG1 GLU 24 -12.988 -3.573 -2.795 200 H ASN 25 HN ASN 25 -15.035 -5.962 0.976 201 HA ASN 25 HA ASN 25 -16.391 -3.558 1.614 202 HB2 ASN 25 HB2 ASN 25 -17.418 -5.861 1.471 203 HB3 ASN 25 HB1 ASN 25 -16.667 -6.215 3.023 204 HD21 ASN 25 HD21 ASN 25 -18.593 -6.513 4.075 205 HD22 ASN 25 HD22 ASN 25 -19.682 -5.206 4.428 206 H VAL 26 HN VAL 26 -14.017 -5.523 3.272 207 HA VAL 26 HA VAL 26 -14.226 -4.335 5.825 208 HB VAL 26 HB VAL 26 -11.797 -5.610 4.550 209 HG11 VAL 26 HG11 VAL 26 -11.234 -4.277 6.521 210 HG12 VAL 26 HG12 VAL 26 -11.035 -6.001 6.840 211 HG13 VAL 26 HG13 VAL 26 -12.448 -5.147 7.458 212 HG21 VAL 26 HG21 VAL 26 -13.709 -7.115 4.546 213 HG22 VAL 26 HG22 VAL 26 -13.952 -6.827 6.269 214 HG23 VAL 26 HG23 VAL 26 -12.495 -7.648 5.709 215 H LYS 27 HN LYS 27 -12.358 -3.560 2.947 216 HA LYS 27 HA LYS 27 -10.722 -1.552 4.036 217 HB2 LYS 27 HB2 LYS 27 -11.795 -1.684 1.211 218 HB3 LYS 27 HB1 LYS 27 -10.363 -0.818 1.750 219 HG2 LYS 27 HG2 LYS 27 -10.083 -3.539 2.517 220 HG3 LYS 27 HG1 LYS 27 -10.575 -3.490 0.824 221 HD2 LYS 27 HD2 LYS 27 -8.261 -1.961 2.015 222 HD3 LYS 27 HD1 LYS 27 -8.126 -3.461 1.096 223 HE2 LYS 27 HE2 LYS 27 -9.674 -1.436 -0.300 224 HE3 LYS 27 HE1 LYS 27 -8.041 -0.891 0.074 225 HZ1 LYS 27 HZ1 LYS 27 -7.997 -1.936 -2.034 226 HZ2 LYS 27 HZ2 LYS 27 -8.827 -3.299 -1.476 227 HZ3 LYS 27 HZ3 LYS 27 -7.240 -2.992 -0.956 228 H ALA 28 HN ALA 28 -13.960 -1.473 2.667 229 HA ALA 28 HA ALA 28 -14.279 1.343 2.689 230 HB1 ALA 28 HB1 ALA 28 -15.687 -0.080 1.310 231 HB2 ALA 28 HB2 ALA 28 -16.680 0.856 2.429 232 HB3 ALA 28 HB3 ALA 28 -16.355 -0.847 2.751 233 H LYS 29 HN LYS 29 -14.866 -1.199 5.041 234 HA LYS 29 HA LYS 29 -16.309 0.368 6.901 235 HB2 LYS 29 HB2 LYS 29 -14.723 -2.179 7.177 236 HB3 LYS 29 HB1 LYS 29 -15.561 -1.442 8.537 237 HG2 LYS 29 HG2 LYS 29 -17.679 -1.719 7.491 238 HG3 LYS 29 HG1 LYS 29 -16.930 -2.181 5.964 239 HD2 LYS 29 HD2 LYS 29 -16.071 -4.222 6.999 240 HD3 LYS 29 HD1 LYS 29 -16.805 -3.760 8.537 241 HE2 LYS 29 HE2 LYS 29 -19.015 -3.812 7.496 242 HE3 LYS 29 HE1 LYS 29 -18.287 -4.259 5.957 243 HZ1 LYS 29 HZ1 LYS 29 -19.263 -6.116 7.307 244 HZ2 LYS 29 HZ2 LYS 29 -17.989 -5.908 8.396 245 HZ3 LYS 29 HZ3 LYS 29 -17.665 -6.355 6.789 246 H ILE 30 HN ILE 30 -12.884 -0.188 6.374 247 HA ILE 30 HA ILE 30 -12.009 1.110 8.756 248 HB ILE 30 HB ILE 30 -10.543 0.601 6.154 249 HG12 ILE 30 HG12 ILE 30 -10.395 -0.795 8.835 250 HG13 ILE 30 HG11 ILE 30 -11.249 -1.409 7.424 251 HG21 ILE 30 HG21 ILE 30 -9.552 2.499 7.341 252 HG22 ILE 30 HG22 ILE 30 -8.483 1.097 7.377 253 HG23 ILE 30 HG23 ILE 30 -9.426 1.524 8.805 254 HD11 ILE 30 HD11 ILE 30 -9.135 -2.524 7.651 255 HD12 ILE 30 HD12 ILE 30 -8.283 -0.980 7.682 256 HD13 ILE 30 HD13 ILE 30 -9.108 -1.504 6.214 257 H GLN 31 HN GLN 31 -12.708 2.148 5.478 258 HA GLN 31 HA GLN 31 -11.709 4.786 5.713 259 HB2 GLN 31 HB2 GLN 31 -12.178 3.678 3.552 260 HB3 GLN 31 HB1 GLN 31 -13.899 3.743 3.902 261 HG2 GLN 31 HG2 GLN 31 -13.824 6.171 3.909 262 HG3 GLN 31 HG1 GLN 31 -12.089 6.125 3.603 263 HE21 GLN 31 HE21 GLN 31 -12.326 7.289 1.702 264 HE22 GLN 31 HE22 GLN 31 -12.946 6.562 0.261 265 H ASP 32 HN ASP 32 -14.624 3.244 6.753 266 HA ASP 32 HA ASP 32 -16.219 5.584 7.028 267 HB2 ASP 32 HB2 ASP 32 -17.000 3.144 6.962 268 HB3 ASP 32 HB1 ASP 32 -16.525 3.062 8.655 269 H LYS 33 HN LYS 33 -13.801 4.046 8.993 270 HA LYS 33 HA LYS 33 -14.460 5.781 11.259 271 HB2 LYS 33 HB2 LYS 33 -12.544 3.454 11.101 272 HB3 LYS 33 HB1 LYS 33 -12.930 4.361 12.555 273 HG2 LYS 33 HG2 LYS 33 -15.311 3.647 12.265 274 HG3 LYS 33 HG1 LYS 33 -14.764 2.583 10.966 275 HD2 LYS 33 HD2 LYS 33 -13.286 1.426 12.540 276 HD3 LYS 33 HD1 LYS 33 -13.821 2.500 13.836 277 HE2 LYS 33 HE2 LYS 33 -16.163 1.687 13.383 278 HE3 LYS 33 HE1 LYS 33 -15.453 0.458 12.339 279 HZ1 LYS 33 HZ1 LYS 33 -15.908 -0.306 14.626 280 HZ2 LYS 33 HZ2 LYS 33 -14.778 0.801 15.210 281 HZ3 LYS 33 HZ3 LYS 33 -14.281 -0.461 14.198 282 H GLU 34 HN GLU 34 -11.598 4.803 9.347 283 HA GLU 34 HA GLU 34 -10.044 6.967 10.496 284 HB2 GLU 34 HB2 GLU 34 -9.225 5.084 8.285 285 HB3 GLU 34 HB1 GLU 34 -8.172 6.059 9.301 286 HG2 GLU 34 HG2 GLU 34 -9.811 3.677 10.120 287 HG3 GLU 34 HG1 GLU 34 -8.054 3.802 10.050 288 H GLY 35 HN GLY 35 -11.481 6.167 7.378 289 HA2 GLY 35 HA2 GLY 35 -12.242 7.757 5.819 290 HA3 GLY 35 HA1 GLY 35 -11.249 8.972 6.606 291 H ILE 36 HN ILE 36 -9.556 6.118 6.091 292 HA ILE 36 HA ILE 36 -7.891 7.369 4.107 293 HB ILE 36 HB ILE 36 -7.728 4.598 5.304 294 HG12 ILE 36 HG12 ILE 36 -6.110 7.056 5.996 295 HG13 ILE 36 HG11 ILE 36 -7.523 6.537 6.907 296 HG21 ILE 36 HG21 ILE 36 -5.672 6.166 3.748 297 HG22 ILE 36 HG22 ILE 36 -6.556 4.756 3.165 298 HG23 ILE 36 HG23 ILE 36 -5.419 4.591 4.503 299 HD11 ILE 36 HD11 ILE 36 -5.458 5.839 7.980 300 HD12 ILE 36 HD12 ILE 36 -4.996 4.950 6.528 301 HD13 ILE 36 HD13 ILE 36 -6.407 4.445 7.460 302 HA PRO 37 HA PRO 37 -10.163 5.799 0.592 303 HB2 PRO 37 HB2 PRO 37 -7.552 6.231 -0.764 304 HB3 PRO 37 HB1 PRO 37 -9.157 6.865 -1.175 305 HG2 PRO 37 HG2 PRO 37 -7.315 8.440 -0.119 306 HG3 PRO 37 HG1 PRO 37 -9.026 8.590 0.333 307 HD2 PRO 37 HD2 PRO 37 -6.775 7.354 1.853 308 HD3 PRO 37 HD1 PRO 37 -8.144 8.321 2.441 309 HA PRO 38 HA PRO 38 -8.998 1.523 0.654 310 HB2 PRO 38 HB2 PRO 38 -10.290 0.818 -1.698 311 HB3 PRO 38 HB1 PRO 38 -11.059 0.919 -0.105 312 HG2 PRO 38 HG2 PRO 38 -11.062 2.884 -2.324 313 HG3 PRO 38 HG1 PRO 38 -12.363 2.443 -1.200 314 HD2 PRO 38 HD2 PRO 38 -10.970 4.717 -0.912 315 HD3 PRO 38 HD1 PRO 38 -11.542 3.788 0.488 316 H ASP 39 HN ASP 39 -8.380 3.555 -2.144 317 HA ASP 39 HA ASP 39 -6.854 1.703 -3.633 318 HB2 ASP 39 HB2 ASP 39 -7.176 4.657 -3.628 319 HB3 ASP 39 HB1 ASP 39 -5.757 4.002 -4.436 320 H GLN 40 HN GLN 40 -6.024 3.864 -1.011 321 HA GLN 40 HA GLN 40 -3.211 3.024 -1.207 322 HB2 GLN 40 HB2 GLN 40 -4.458 5.311 0.335 323 HB3 GLN 40 HB1 GLN 40 -2.740 4.942 0.267 324 HG2 GLN 40 HG2 GLN 40 -2.528 5.659 -1.903 325 HG3 GLN 40 HG1 GLN 40 -4.235 5.409 -2.265 326 HE21 GLN 40 HE21 GLN 40 -4.476 7.468 -3.115 327 HE22 GLN 40 HE22 GLN 40 -4.495 8.879 -2.115 328 H GLN 41 HN GLN 41 -5.611 1.590 -0.103 329 HA GLN 41 HA GLN 41 -4.735 1.228 2.684 330 HB2 GLN 41 HB2 GLN 41 -7.242 1.723 1.685 331 HB3 GLN 41 HB1 GLN 41 -7.248 -0.028 1.832 332 HG2 GLN 41 HG2 GLN 41 -6.469 0.301 4.206 333 HG3 GLN 41 HG1 GLN 41 -6.841 2.012 3.992 334 HE21 GLN 41 HE21 GLN 41 -8.998 2.640 3.678 335 HE22 GLN 41 HE22 GLN 41 -10.316 1.594 4.085 336 H ARG 42 HN ARG 42 -3.298 -0.426 2.788 337 HA ARG 42 HA ARG 42 -3.848 -2.807 1.138 338 HB2 ARG 42 HB2 ARG 42 -1.205 -2.128 2.418 339 HB3 ARG 42 HB1 ARG 42 -1.519 -3.295 1.139 340 HG2 ARG 42 HG2 ARG 42 -2.162 -1.392 -0.339 341 HG3 ARG 42 HG1 ARG 42 -1.634 -0.292 0.936 342 HD2 ARG 42 HD2 ARG 42 0.187 -0.473 -0.554 343 HD3 ARG 42 HD1 ARG 42 0.606 -1.469 0.842 344 HE ARG 42 HE ARG 42 -0.495 -3.277 -0.785 345 HH11 ARG 42 HH11 ARG 42 1.958 -0.832 -1.352 346 HH12 ARG 42 HH12 ARG 42 2.679 -1.712 -2.680 347 HH21 ARG 42 HH21 ARG 42 0.469 -4.417 -2.501 348 HH22 ARG 42 HH22 ARG 42 1.840 -3.734 -3.320 349 H LEU 43 HN LEU 43 -4.516 -4.575 2.158 350 HA LEU 43 HA LEU 43 -4.178 -4.724 5.072 351 HB2 LEU 43 HB2 LEU 43 -6.235 -5.791 3.182 352 HB3 LEU 43 HB1 LEU 43 -5.970 -6.600 4.714 353 HG LEU 43 HG LEU 43 -6.670 -3.672 4.485 354 HD11 LEU 43 HD11 LEU 43 -8.488 -6.014 5.035 355 HD12 LEU 43 HD12 LEU 43 -8.472 -5.046 3.562 356 HD13 LEU 43 HD13 LEU 43 -8.938 -4.311 5.094 357 HD21 LEU 43 HD21 LEU 43 -7.264 -3.944 6.858 358 HD22 LEU 43 HD22 LEU 43 -5.558 -4.266 6.558 359 HD23 LEU 43 HD23 LEU 43 -6.678 -5.606 6.801 360 H ILE 44 HN ILE 44 -2.788 -6.130 5.865 361 HA ILE 44 HA ILE 44 -1.983 -8.400 4.165 362 HB ILE 44 HB ILE 44 -0.348 -6.599 5.921 363 HG12 ILE 44 HG12 ILE 44 1.228 -6.993 3.890 364 HG13 ILE 44 HG11 ILE 44 -0.211 -7.641 3.110 365 HG21 ILE 44 HG21 ILE 44 0.160 -8.798 6.783 366 HG22 ILE 44 HG22 ILE 44 1.518 -8.210 5.819 367 HG23 ILE 44 HG23 ILE 44 0.412 -9.409 5.148 368 HD11 ILE 44 HD11 ILE 44 0.089 -5.337 2.503 369 HD12 ILE 44 HD12 ILE 44 0.139 -4.858 4.198 370 HD13 ILE 44 HD13 ILE 44 -1.351 -5.499 3.505 371 H PHE 45 HN PHE 45 -1.979 -10.395 5.007 372 HA PHE 45 HA PHE 45 -2.432 -10.736 7.888 373 HB2 PHE 45 HB2 PHE 45 -4.632 -10.932 6.823 374 HB3 PHE 45 HB1 PHE 45 -3.991 -12.111 5.683 375 HD1 PHE 45 HD1 PHE 45 -4.619 -11.544 9.296 376 HD2 PHE 45 HD2 PHE 45 -4.015 -14.379 6.185 377 HE1 PHE 45 HE1 PHE 45 -5.216 -13.360 10.843 378 HE2 PHE 45 HE2 PHE 45 -4.606 -16.203 7.727 379 HZ PHE 45 HZ PHE 45 -5.210 -15.698 10.059 380 H ALA 46 HN ALA 46 -1.114 -12.207 8.731 381 HA ALA 46 HA ALA 46 0.413 -13.861 8.977 382 HB1 ALA 46 HB1 ALA 46 0.302 -15.819 7.532 383 HB2 ALA 46 HB2 ALA 46 -0.725 -14.936 6.401 384 HB3 ALA 46 HB3 ALA 46 -1.311 -15.299 8.025 385 H GLY 47 HN GLY 47 0.800 -11.447 7.033 386 HA2 GLY 47 HA2 GLY 47 2.979 -10.670 6.456 387 HA3 GLY 47 HA1 GLY 47 3.469 -12.335 6.192 388 H LYS 48 HN LYS 48 0.502 -12.024 4.799 389 HA LYS 48 HA LYS 48 1.648 -11.233 2.196 390 HB2 LYS 48 HB2 LYS 48 -0.430 -13.380 2.699 391 HB3 LYS 48 HB1 LYS 48 0.184 -12.894 1.128 392 HG2 LYS 48 HG2 LYS 48 2.356 -13.766 1.630 393 HG3 LYS 48 HG1 LYS 48 1.893 -14.077 3.306 394 HD2 LYS 48 HD2 LYS 48 0.543 -15.361 0.938 395 HD3 LYS 48 HD1 LYS 48 1.895 -16.093 1.805 396 HE2 LYS 48 HE2 LYS 48 0.571 -16.006 3.883 397 HE3 LYS 48 HE1 LYS 48 -0.787 -15.349 2.972 398 HZ1 LYS 48 HZ1 LYS 48 -0.806 -17.376 1.640 399 HZ2 LYS 48 HZ2 LYS 48 -1.045 -17.708 3.279 400 HZ3 LYS 48 HZ3 LYS 48 0.459 -18.011 2.568 401 H GLN 49 HN GLN 49 0.284 -10.092 0.782 402 HA GLN 49 HA GLN 49 -1.739 -8.532 2.111 403 HB2 GLN 49 HB2 GLN 49 -0.052 -7.784 0.266 404 HB3 GLN 49 HB1 GLN 49 -1.252 -8.425 -0.844 405 HG2 GLN 49 HG2 GLN 49 -2.902 -6.949 0.521 406 HG3 GLN 49 HG1 GLN 49 -1.438 -6.099 1.009 407 HE21 GLN 49 HE21 GLN 49 -3.592 -6.842 -1.595 408 HE22 GLN 49 HE22 GLN 49 -2.960 -5.687 -2.717 409 H LEU 50 HN LEU 50 -3.901 -8.529 1.754 410 HA LEU 50 HA LEU 50 -4.994 -10.966 0.603 411 HB2 LEU 50 HB2 LEU 50 -6.540 -8.738 1.904 412 HB3 LEU 50 HB1 LEU 50 -7.007 -10.417 1.722 413 HG LEU 50 HG LEU 50 -4.749 -9.476 3.489 414 HD11 LEU 50 HD11 LEU 50 -6.934 -8.634 4.254 415 HD12 LEU 50 HD12 LEU 50 -6.243 -9.826 5.355 416 HD13 LEU 50 HD13 LEU 50 -7.547 -10.289 4.263 417 HD21 LEU 50 HD21 LEU 50 -4.228 -11.656 3.227 418 HD22 LEU 50 HD22 LEU 50 -5.863 -12.099 2.740 419 HD23 LEU 50 HD23 LEU 50 -5.487 -11.865 4.445 420 H GLU 51 HN GLU 51 -6.670 -10.960 -0.967 421 HA GLU 51 HA GLU 51 -6.478 -8.717 -2.837 422 HB2 GLU 51 HB2 GLU 51 -7.785 -11.426 -3.157 423 HB3 GLU 51 HB1 GLU 51 -7.598 -10.225 -4.425 424 HG2 GLU 51 HG2 GLU 51 -5.437 -10.736 -4.773 425 HG3 GLU 51 HG1 GLU 51 -5.124 -11.040 -3.064 426 H ASP 52 HN ASP 52 -8.236 -7.517 -3.479 427 HA ASP 52 HA ASP 52 -10.262 -7.043 -1.605 428 HB2 ASP 52 HB2 ASP 52 -9.908 -6.240 -4.483 429 HB3 ASP 52 HB1 ASP 52 -11.326 -5.751 -3.560 430 H GLY 53 HN GLY 53 -10.170 -9.114 -4.426 431 HA2 GLY 53 HA2 GLY 53 -13.031 -9.664 -4.218 432 HA3 GLY 53 HA1 GLY 53 -11.958 -10.222 -5.490 433 H ARG 54 HN ARG 54 -11.528 -10.550 -1.989 434 HA ARG 54 HA ARG 54 -12.006 -13.441 -2.220 435 HB2 ARG 54 HB2 ARG 54 -9.590 -12.162 -0.913 436 HB3 ARG 54 HB1 ARG 54 -10.017 -13.861 -0.780 437 HG2 ARG 54 HG2 ARG 54 -9.430 -12.484 -3.384 438 HG3 ARG 54 HG1 ARG 54 -8.225 -13.350 -2.431 439 HD2 ARG 54 HD2 ARG 54 -9.636 -15.382 -2.595 440 HD3 ARG 54 HD1 ARG 54 -10.723 -14.496 -3.665 441 HE ARG 54 HE ARG 54 -7.880 -14.815 -4.355 442 HH11 ARG 54 HH11 ARG 54 -11.269 -15.331 -5.098 443 HH12 ARG 54 HH12 ARG 54 -10.963 -15.850 -6.725 444 HH21 ARG 54 HH21 ARG 54 -7.475 -15.499 -6.496 445 HH22 ARG 54 HH22 ARG 54 -8.803 -15.953 -7.519 446 H THR 55 HN THR 55 -12.287 -14.468 -0.067 447 HA THR 55 HA THR 55 -13.604 -12.581 1.772 448 HB THR 55 HB THR 55 -14.835 -14.521 2.654 449 HG1 THR 55 HG1 THR 55 -13.302 -15.936 0.703 450 HG21 THR 55 HG21 THR 55 -14.985 -14.249 -0.353 451 HG22 THR 55 HG22 THR 55 -15.856 -13.278 0.833 452 HG23 THR 55 HG23 THR 55 -16.222 -14.995 0.662 453 H LEU 56 HN LEU 56 -13.565 -13.372 4.114 454 HA LEU 56 HA LEU 56 -10.863 -13.509 4.966 455 HB2 LEU 56 HB2 LEU 56 -13.399 -13.998 6.537 456 HB3 LEU 56 HB1 LEU 56 -11.815 -13.703 7.226 457 HG LEU 56 HG LEU 56 -13.310 -11.712 5.516 458 HD11 LEU 56 HD11 LEU 56 -13.019 -11.811 8.513 459 HD12 LEU 56 HD12 LEU 56 -14.495 -12.154 7.612 460 HD13 LEU 56 HD13 LEU 56 -13.798 -10.534 7.579 461 HD21 LEU 56 HD21 LEU 56 -11.667 -10.126 6.436 462 HD22 LEU 56 HD22 LEU 56 -10.911 -11.387 5.464 463 HD23 LEU 56 HD23 LEU 56 -10.834 -11.464 7.225 464 H SER 57 HN SER 57 -13.345 -15.848 4.377 465 HA SER 57 HA SER 57 -12.219 -18.047 5.750 466 HB2 SER 57 HB2 SER 57 -13.691 -19.061 3.607 467 HB3 SER 57 HB1 SER 57 -14.298 -18.729 5.230 468 HG SER 57 HG SER 57 -14.381 -17.052 2.939 469 H ASP 58 HN ASP 58 -11.521 -16.533 2.727 470 HA ASP 58 HA ASP 58 -10.331 -18.752 1.412 471 HB2 ASP 58 HB2 ASP 58 -10.243 -15.786 0.977 472 HB3 ASP 58 HB1 ASP 58 -9.204 -16.859 0.047 473 H TYR 59 HN TYR 59 -9.211 -16.678 3.903 474 HA TYR 59 HA TYR 59 -6.462 -17.638 3.445 475 HB2 TYR 59 HB2 TYR 59 -7.313 -15.105 4.856 476 HB3 TYR 59 HB1 TYR 59 -5.657 -15.633 4.602 477 HD1 TYR 59 HD1 TYR 59 -4.671 -15.557 2.343 478 HD2 TYR 59 HD2 TYR 59 -8.573 -14.043 3.113 479 HE1 TYR 59 HE1 TYR 59 -4.605 -14.325 0.217 480 HE2 TYR 59 HE2 TYR 59 -8.518 -12.808 0.986 481 HH TYR 59 HH TYR 59 -6.180 -13.367 -1.425 482 H ASN 60 HN ASN 60 -8.950 -18.544 5.072 483 HA ASN 60 HA ASN 60 -9.372 -19.639 7.018 484 HB2 ASN 60 HB2 ASN 60 -6.381 -19.811 6.880 485 HB3 ASN 60 HB1 ASN 60 -7.233 -20.418 8.294 486 HD21 ASN 60 HD21 ASN 60 -5.659 -21.833 6.290 487 HD22 ASN 60 HD22 ASN 60 -6.714 -23.030 5.616 488 H ILE 61 HN ILE 61 -9.270 -16.761 7.067 489 HA ILE 61 HA ILE 61 -8.003 -15.952 9.511 490 HB ILE 61 HB ILE 61 -10.083 -14.487 7.877 491 HG12 ILE 61 HG12 ILE 61 -7.072 -14.228 7.857 492 HG13 ILE 61 HG11 ILE 61 -8.017 -15.049 6.624 493 HG21 ILE 61 HG21 ILE 61 -9.238 -12.480 9.017 494 HG22 ILE 61 HG22 ILE 61 -8.184 -13.494 10.001 495 HG23 ILE 61 HG23 ILE 61 -9.936 -13.637 10.150 496 HD11 ILE 61 HD11 ILE 61 -8.142 -12.119 7.300 497 HD12 ILE 61 HD12 ILE 61 -9.124 -12.934 6.083 498 HD13 ILE 61 HD13 ILE 61 -7.375 -12.843 5.885 499 H GLN 62 HN GLN 62 -8.731 -16.584 11.396 500 HA GLN 62 HA GLN 62 -11.573 -17.133 11.777 501 HB2 GLN 62 HB2 GLN 62 -9.149 -17.702 13.491 502 HB3 GLN 62 HB1 GLN 62 -10.799 -18.087 13.963 503 HG2 GLN 62 HG2 GLN 62 -10.829 -19.940 12.734 504 HG3 GLN 62 HG1 GLN 62 -10.133 -19.124 11.337 505 HE21 GLN 62 HE21 GLN 62 -7.919 -19.156 11.027 506 HE22 GLN 62 HE22 GLN 62 -6.869 -20.195 11.929 507 H LYS 63 HN LYS 63 -12.050 -16.613 14.345 508 HA LYS 63 HA LYS 63 -12.209 -13.753 14.380 509 HB2 LYS 63 HB2 LYS 63 -13.539 -14.017 16.372 510 HB3 LYS 63 HB1 LYS 63 -14.050 -15.205 15.182 511 HG2 LYS 63 HG2 LYS 63 -12.910 -16.955 16.348 512 HG3 LYS 63 HG1 LYS 63 -12.185 -15.795 17.466 513 HD2 LYS 63 HD2 LYS 63 -14.388 -15.215 18.317 514 HD3 LYS 63 HD1 LYS 63 -15.139 -16.316 17.162 515 HE2 LYS 63 HE2 LYS 63 -13.931 -18.185 18.216 516 HE3 LYS 63 HE1 LYS 63 -13.284 -17.068 19.416 517 HZ1 LYS 63 HZ1 LYS 63 -16.161 -17.656 18.966 518 HZ2 LYS 63 HZ2 LYS 63 -15.550 -16.576 20.116 519 HZ3 LYS 63 HZ3 LYS 63 -15.227 -18.229 20.255 520 H GLU 64 HN GLU 64 -11.441 -12.371 16.018 521 HA GLU 64 HA GLU 64 -9.936 -11.484 17.448 522 HB2 GLU 64 HB2 GLU 64 -9.514 -14.359 18.273 523 HB3 GLU 64 HB1 GLU 64 -8.839 -12.971 19.118 524 HG2 GLU 64 HG2 GLU 64 -10.945 -12.228 19.819 525 HG3 GLU 64 HG1 GLU 64 -11.789 -13.247 18.655 526 H SER 65 HN SER 65 -9.204 -12.202 14.755 527 HA SER 65 HA SER 65 -6.362 -12.854 14.987 528 HB2 SER 65 HB2 SER 65 -8.092 -12.509 12.521 529 HB3 SER 65 HB1 SER 65 -6.411 -13.046 12.534 530 HG SER 65 HG SER 65 -8.734 -14.407 13.200 531 H THR 66 HN THR 66 -4.752 -11.457 14.256 532 HA THR 66 HA THR 66 -5.563 -8.647 14.191 533 HB THR 66 HB THR 66 -2.734 -9.652 14.425 534 HG1 THR 66 HG1 THR 66 -3.921 -10.627 16.102 535 HG21 THR 66 HG21 THR 66 -3.068 -7.257 13.968 536 HG22 THR 66 HG22 THR 66 -2.373 -7.526 15.565 537 HG23 THR 66 HG23 THR 66 -4.084 -7.130 15.404 538 H LEU 67 HN LEU 67 -5.434 -7.477 12.403 539 HA LEU 67 HA LEU 67 -4.030 -8.617 10.075 540 HB2 LEU 67 HB2 LEU 67 -6.566 -7.072 10.357 541 HB3 LEU 67 HB1 LEU 67 -5.614 -6.827 8.907 542 HG LEU 67 HG LEU 67 -5.701 -9.384 8.637 543 HD11 LEU 67 HD11 LEU 67 -7.622 -10.483 9.654 544 HD12 LEU 67 HD12 LEU 67 -7.993 -9.017 10.562 545 HD13 LEU 67 HD13 LEU 67 -6.501 -9.903 10.886 546 HD21 LEU 67 HD21 LEU 67 -8.197 -7.717 8.354 547 HD22 LEU 67 HD22 LEU 67 -7.896 -9.252 7.542 548 HD23 LEU 67 HD23 LEU 67 -6.887 -7.853 7.180 549 H HIS 68 HN HIS 68 -2.748 -7.246 8.803 550 HA HIS 68 HA HIS 68 -1.797 -4.879 10.249 551 HB2 HIS 68 HB2 HIS 68 -0.498 -6.321 7.929 552 HB3 HIS 68 HB1 HIS 68 0.232 -5.082 8.942 553 HD2 HIS 68 HD2 HIS 68 -0.063 -6.144 11.861 554 HE1 HIS 68 HE1 HIS 68 1.282 -9.874 10.389 555 HE2 HIS 68 HE2 HIS 68 1.126 -8.377 12.422 556 H LEU 69 HN LEU 69 -2.285 -2.908 9.546 557 HA LEU 69 HA LEU 69 -3.395 -2.635 6.839 558 HB2 LEU 69 HB2 LEU 69 -4.766 -1.887 8.791 559 HB3 LEU 69 HB1 LEU 69 -3.539 -0.683 9.138 560 HG LEU 69 HG LEU 69 -3.965 0.349 6.921 561 HD11 LEU 69 HD11 LEU 69 -6.301 -0.411 5.989 562 HD12 LEU 69 HD12 LEU 69 -5.848 -1.945 6.729 563 HD13 LEU 69 HD13 LEU 69 -4.815 -1.220 5.496 564 HD21 LEU 69 HD21 LEU 69 -6.356 0.053 8.733 565 HD22 LEU 69 HD22 LEU 69 -6.176 1.288 7.489 566 HD23 LEU 69 HD23 LEU 69 -5.074 1.254 8.864 567 H VAL 70 HN VAL 70 -1.731 -2.282 5.488 568 HA VAL 70 HA VAL 70 0.379 -0.421 6.279 569 HB VAL 70 HB VAL 70 0.156 -2.197 3.842 570 HG11 VAL 70 HG11 VAL 70 2.323 -0.353 4.800 571 HG12 VAL 70 HG12 VAL 70 1.552 -0.415 3.215 572 HG13 VAL 70 HG13 VAL 70 2.651 -1.701 3.714 573 HG21 VAL 70 HG21 VAL 70 0.389 -3.487 5.873 574 HG22 VAL 70 HG22 VAL 70 1.760 -2.499 6.373 575 HG23 VAL 70 HG23 VAL 70 1.894 -3.538 4.955 576 H LEU 71 HN LEU 71 0.587 1.554 5.450 577 HA LEU 71 HA LEU 71 -1.480 2.545 3.670 578 HB2 LEU 71 HB2 LEU 71 0.791 4.005 5.032 579 HB3 LEU 71 HB1 LEU 71 -0.524 4.756 4.146 580 HG LEU 71 HG LEU 71 -0.811 3.177 6.705 581 HD11 LEU 71 HD11 LEU 71 -0.999 6.135 6.167 582 HD12 LEU 71 HD12 LEU 71 0.271 5.316 7.075 583 HD13 LEU 71 HD13 LEU 71 -1.379 5.347 7.697 584 HD21 LEU 71 HD21 LEU 71 -3.124 4.018 6.668 585 HD22 LEU 71 HD22 LEU 71 -2.776 2.941 5.315 586 HD23 LEU 71 HD23 LEU 71 -2.839 4.686 5.061 587 H ARG 72 HN ARG 72 -0.793 3.984 1.838 588 HA ARG 72 HA ARG 72 1.768 3.173 0.657 589 HB2 ARG 72 HB2 ARG 72 0.405 1.650 -0.453 590 HB3 ARG 72 HB1 ARG 72 -0.985 2.724 -0.440 591 HG2 ARG 72 HG2 ARG 72 0.119 4.115 -2.155 592 HG3 ARG 72 HG1 ARG 72 1.446 2.951 -2.205 593 HD2 ARG 72 HD2 ARG 72 -1.186 1.726 -2.483 594 HD3 ARG 72 HD1 ARG 72 -0.821 2.887 -3.758 595 HE ARG 72 HE ARG 72 1.422 1.329 -3.567 596 HH11 ARG 72 HH11 ARG 72 -1.982 0.691 -4.110 597 HH12 ARG 72 HH12 ARG 72 -1.691 -0.681 -5.129 598 HH21 ARG 72 HH21 ARG 72 1.817 -0.452 -4.925 599 HH22 ARG 72 HH22 ARG 72 0.466 -1.350 -5.569 600 H LEU 73 HN LEU 73 2.808 4.771 -0.339 601 HA LEU 73 HA LEU 73 1.358 7.148 -1.231 602 HB2 LEU 73 HB2 LEU 73 3.684 7.170 0.689 603 HB3 LEU 73 HB1 LEU 73 3.172 8.581 -0.214 604 HG LEU 73 HG LEU 73 0.839 7.957 0.957 605 HD11 LEU 73 HD11 LEU 73 2.017 6.017 2.102 606 HD12 LEU 73 HD12 LEU 73 1.083 7.106 3.131 607 HD13 LEU 73 HD13 LEU 73 2.840 7.237 3.075 608 HD21 LEU 73 HD21 LEU 73 1.948 10.123 1.027 609 HD22 LEU 73 HD22 LEU 73 3.090 9.515 2.224 610 HD23 LEU 73 HD23 LEU 73 1.381 9.662 2.632 611 H ARG 74 HN ARG 74 1.922 7.457 -3.263 612 HA ARG 74 HA ARG 74 4.388 6.325 -4.284 613 HB2 ARG 74 HB2 ARG 74 2.149 7.804 -5.671 614 HB3 ARG 74 HB1 ARG 74 3.531 7.091 -6.487 615 HG2 ARG 74 HG2 ARG 74 1.608 5.507 -4.804 616 HG3 ARG 74 HG1 ARG 74 1.423 5.742 -6.544 617 HD2 ARG 74 HD2 ARG 74 3.780 4.805 -6.759 618 HD3 ARG 74 HD1 ARG 74 3.620 4.303 -5.076 619 HE ARG 74 HE ARG 74 1.508 3.129 -5.954 620 HH11 ARG 74 HH11 ARG 74 4.482 3.516 -7.764 621 HH12 ARG 74 HH12 ARG 74 4.223 2.106 -8.738 622 HH21 ARG 74 HH21 ARG 74 1.164 1.269 -7.220 623 HH22 ARG 74 HH22 ARG 74 2.325 0.820 -8.428 624 H GLY 75 HN GLY 75 3.600 9.136 -2.784 625 HA2 GLY 75 HA2 GLY 75 5.625 10.662 -4.297 626 HA3 GLY 75 HA1 GLY 75 4.264 11.404 -3.468 627 H GLY 76 HN GLY 76 7.469 10.269 -3.196 628 HA2 GLY 76 HA2 GLY 76 7.425 10.714 -0.281 629 HA3 GLY 76 HA1 GLY 76 8.633 9.759 -1.135 630 H1 SER 453 HT1 SER 453 22.340 11.506 16.156 631 H2 SER 453 HT2 SER 453 21.020 11.153 15.165 632 H3 SER 453 HT3 SER 453 22.321 10.075 15.253 633 HA SER 453 HA SER 453 21.844 9.718 17.613 634 HB2 SER 453 HB2 SER 453 19.170 10.579 17.746 635 HB3 SER 453 HB1 SER 453 20.549 11.258 18.616 636 HG SER 453 HG SER 453 19.665 12.921 17.461 637 H ASN 454 HN ASN 454 19.243 9.973 15.181 638 HA ASN 454 HA ASN 454 17.931 8.449 14.153 639 HB2 ASN 454 HB2 ASN 454 20.317 6.821 14.847 640 HB3 ASN 454 HB1 ASN 454 18.864 5.947 14.383 641 HD21 ASN 454 HD21 ASN 454 19.844 5.190 12.502 642 HD22 ASN 454 HD22 ASN 454 20.120 6.217 11.135 643 H SER 455 HN SER 455 17.878 8.969 17.171 644 HA SER 455 HA SER 455 16.877 6.690 18.462 645 HB2 SER 455 HB2 SER 455 15.869 9.348 19.302 646 HB3 SER 455 HB1 SER 455 16.637 8.077 20.258 647 HG SER 455 HG SER 455 18.260 9.446 20.158 648 H GLN 456 HN GLN 456 15.279 9.247 16.608 649 HA GLN 456 HA GLN 456 12.633 8.306 17.207 650 HB2 GLN 456 HB2 GLN 456 13.768 10.339 15.308 651 HB3 GLN 456 HB1 GLN 456 12.088 9.845 15.178 652 HG2 GLN 456 HG2 GLN 456 13.300 10.890 17.718 653 HG3 GLN 456 HG1 GLN 456 12.517 11.918 16.518 654 HE21 GLN 456 HE21 GLN 456 11.804 11.332 19.308 655 HE22 GLN 456 HE22 GLN 456 10.186 10.727 19.259 656 H LEU 457 HN LEU 457 14.906 7.979 14.543 657 HA LEU 457 HA LEU 457 13.194 6.628 12.763 658 HB2 LEU 457 HB2 LEU 457 16.198 6.461 13.026 659 HB3 LEU 457 HB1 LEU 457 15.270 5.892 11.653 660 HG LEU 457 HG LEU 457 15.427 8.771 12.550 661 HD11 LEU 457 HD11 LEU 457 16.780 9.096 10.527 662 HD12 LEU 457 HD12 LEU 457 16.769 7.354 10.255 663 HD13 LEU 457 HD13 LEU 457 17.560 8.017 11.684 664 HD21 LEU 457 HD21 LEU 457 13.333 8.285 11.437 665 HD22 LEU 457 HD22 LEU 457 14.192 7.501 10.111 666 HD23 LEU 457 HD23 LEU 457 14.372 9.236 10.378 667 H ASN 458 HN ASN 458 15.358 5.485 15.306 668 HA ASN 458 HA ASN 458 15.179 2.735 14.805 669 HB2 ASN 458 HB2 ASN 458 16.024 4.441 17.046 670 HB3 ASN 458 HB1 ASN 458 15.419 2.862 17.533 671 HD21 ASN 458 HD21 ASN 458 18.102 3.876 17.745 672 HD22 ASN 458 HD22 ASN 458 19.103 2.813 16.823 673 H ALA 459 HN ALA 459 13.210 4.835 16.869 674 HA ALA 459 HA ALA 459 11.548 2.812 17.902 675 HB1 ALA 459 HB1 ALA 459 11.812 5.069 18.886 676 HB2 ALA 459 HB2 ALA 459 10.128 4.591 18.676 677 HB3 ALA 459 HB3 ALA 459 10.870 5.727 17.547 678 H MET 460 HN MET 460 11.160 5.028 15.164 679 HA MET 460 HA MET 460 8.585 4.189 14.411 680 HB2 MET 460 HB2 MET 460 10.822 5.571 12.974 681 HB3 MET 460 HB1 MET 460 9.390 5.058 12.088 682 HG2 MET 460 HG2 MET 460 8.036 6.342 13.783 683 HG3 MET 460 HG1 MET 460 9.558 7.017 14.356 684 HE1 MET 460 HE1 MET 460 10.814 9.047 11.293 685 HE2 MET 460 HE2 MET 460 11.258 7.407 11.759 686 HE3 MET 460 HE3 MET 460 11.073 8.654 12.992 687 H ALA 461 HN ALA 461 11.789 2.991 13.557 688 HA ALA 461 HA ALA 461 10.966 1.188 11.543 689 HB1 ALA 461 HB1 ALA 461 13.370 1.058 13.363 690 HB2 ALA 461 HB2 ALA 461 13.291 1.857 11.792 691 HB3 ALA 461 HB3 ALA 461 13.142 0.101 11.897 692 H HIS 462 HN HIS 462 11.243 0.921 15.040 693 HA HIS 462 HA HIS 462 10.866 -1.858 15.262 694 HB2 HIS 462 HB2 HIS 462 11.659 -0.384 17.114 695 HB3 HIS 462 HB1 HIS 462 10.031 0.273 17.247 696 HD2 HIS 462 HD2 HIS 462 8.126 -1.437 18.383 697 HE1 HIS 462 HE1 HIS 462 10.974 -4.293 19.659 698 HE2 HIS 462 HE2 HIS 462 8.514 -3.686 19.616 699 H GLN 463 HN GLN 463 8.604 0.828 14.999 700 HA GLN 463 HA GLN 463 6.244 -0.546 15.613 701 HB2 GLN 463 HB2 GLN 463 6.350 1.898 15.414 702 HB3 GLN 463 HB1 GLN 463 6.635 1.753 13.685 703 HG2 GLN 463 HG2 GLN 463 4.324 2.340 14.150 704 HG3 GLN 463 HG1 GLN 463 4.434 0.752 13.390 705 HE21 GLN 463 HE21 GLN 463 3.969 -1.089 14.611 706 HE22 GLN 463 HE22 GLN 463 3.109 -0.994 16.110 707 H ILE 464 HN ILE 464 7.972 -0.175 12.555 708 HA ILE 464 HA ILE 464 6.048 -1.572 10.986 709 HB ILE 464 HB ILE 464 8.989 -1.147 10.432 710 HG12 ILE 464 HG12 ILE 464 6.592 0.465 9.530 711 HG13 ILE 464 HG11 ILE 464 7.745 0.965 10.764 712 HG21 ILE 464 HG21 ILE 464 8.356 -1.502 8.071 713 HG22 ILE 464 HG22 ILE 464 6.723 -1.913 8.594 714 HG23 ILE 464 HG23 ILE 464 8.083 -2.930 9.069 715 HD11 ILE 464 HD11 ILE 464 8.239 2.064 8.688 716 HD12 ILE 464 HD12 ILE 464 8.319 0.518 7.846 717 HD13 ILE 464 HD13 ILE 464 9.526 0.923 9.066 718 H GLN 465 HN GLN 465 9.091 -2.454 12.557 719 HA GLN 465 HA GLN 465 9.277 -5.110 11.705 720 HB2 GLN 465 HB2 GLN 465 10.973 -3.648 12.969 721 HB3 GLN 465 HB1 GLN 465 10.149 -4.176 14.429 722 HG2 GLN 465 HG2 GLN 465 12.013 -5.584 14.146 723 HG3 GLN 465 HG1 GLN 465 10.598 -6.535 13.707 724 HE21 GLN 465 HE21 GLN 465 11.913 -7.940 12.517 725 HE22 GLN 465 HE22 GLN 465 12.524 -7.499 10.955 726 H GLU 466 HN GLU 466 7.337 -3.647 14.200 727 HA GLU 466 HA GLU 466 6.675 -5.976 15.648 728 HB2 GLU 466 HB2 GLU 466 5.448 -3.259 15.363 729 HB3 GLU 466 HB1 GLU 466 4.549 -4.526 16.185 730 HG2 GLU 466 HG2 GLU 466 7.315 -3.619 16.946 731 HG3 GLU 466 HG1 GLU 466 5.826 -3.065 17.707 732 H MET 467 HN MET 467 5.343 -4.522 12.739 733 HA MET 467 HA MET 467 3.186 -6.491 12.700 734 HB2 MET 467 HB2 MET 467 3.773 -4.070 11.007 735 HB3 MET 467 HB1 MET 467 2.501 -5.216 10.607 736 HG2 MET 467 HG2 MET 467 1.491 -4.780 12.831 737 HG3 MET 467 HG1 MET 467 2.705 -3.528 13.085 738 HE1 MET 467 HE1 MET 467 2.985 -2.200 10.216 739 HE2 MET 467 HE2 MET 467 2.853 -1.302 11.730 740 HE3 MET 467 HE3 MET 467 1.810 -0.894 10.370 741 H PHE 468 HN PHE 468 6.092 -5.587 10.941 742 HA PHE 468 HA PHE 468 5.822 -8.065 9.370 743 HB2 PHE 468 HB2 PHE 468 6.944 -5.376 8.623 744 HB3 PHE 468 HB1 PHE 468 7.443 -6.830 7.768 745 HD1 PHE 468 HD1 PHE 468 4.562 -4.678 8.584 746 HD2 PHE 468 HD2 PHE 468 6.050 -7.845 6.160 747 HE1 PHE 468 HE1 PHE 468 2.576 -4.508 7.144 748 HE2 PHE 468 HE2 PHE 468 4.068 -7.678 4.717 749 HZ PHE 468 HZ PHE 468 2.326 -6.002 5.211 750 HA PRO 469 HA PRO 469 9.661 -8.613 11.778 751 HB2 PRO 469 HB2 PRO 469 9.116 -11.051 12.778 752 HB3 PRO 469 HB1 PRO 469 8.399 -9.588 13.480 753 HG2 PRO 469 HG2 PRO 469 7.166 -11.643 11.750 754 HG3 PRO 469 HG1 PRO 469 6.445 -10.664 13.039 755 HD2 PRO 469 HD2 PRO 469 6.260 -10.184 10.275 756 HD3 PRO 469 HD1 PRO 469 5.795 -9.071 11.575 757 H GLN 470 HN GLN 470 8.526 -9.627 8.959 758 HA GLN 470 HA GLN 470 10.383 -11.848 8.552 759 HB2 GLN 470 HB2 GLN 470 9.199 -12.183 6.422 760 HB3 GLN 470 HB1 GLN 470 8.103 -12.225 7.795 761 HG2 GLN 470 HG2 GLN 470 7.669 -9.750 7.270 762 HG3 GLN 470 HG1 GLN 470 8.427 -10.093 5.715 763 HE21 GLN 470 HE21 GLN 470 6.574 -9.755 4.535 764 HE22 GLN 470 HE22 GLN 470 5.220 -10.829 4.578 765 H VAL 471 HN VAL 471 10.910 -8.812 8.693 766 HA VAL 471 HA VAL 471 12.610 -8.741 6.303 767 HB VAL 471 HB VAL 471 10.695 -7.274 5.882 768 HG11 VAL 471 HG11 VAL 471 10.322 -5.261 7.234 769 HG12 VAL 471 HG12 VAL 471 11.530 -5.826 8.387 770 HG13 VAL 471 HG13 VAL 471 10.042 -6.744 8.143 771 HG21 VAL 471 HG21 VAL 471 12.797 -6.608 4.914 772 HG22 VAL 471 HG22 VAL 471 13.260 -5.777 6.400 773 HG23 VAL 471 HG23 VAL 471 11.914 -5.170 5.434 774 HA PRO 472 HA PRO 472 15.884 -8.135 9.257 775 HB2 PRO 472 HB2 PRO 472 17.076 -6.541 7.038 776 HB3 PRO 472 HB1 PRO 472 17.774 -7.883 7.965 777 HG2 PRO 472 HG2 PRO 472 16.949 -8.244 5.482 778 HG3 PRO 472 HG1 PRO 472 16.703 -9.489 6.724 779 HD2 PRO 472 HD2 PRO 472 14.728 -7.604 5.530 780 HD3 PRO 472 HD1 PRO 472 14.513 -9.279 6.079 781 H TYR 473 HN TYR 473 16.096 -6.683 10.815 782 HA TYR 473 HA TYR 473 14.695 -4.290 10.937 783 HB2 TYR 473 HB2 TYR 473 15.752 -5.721 12.816 784 HB3 TYR 473 HB1 TYR 473 17.196 -4.756 12.542 785 HD1 TYR 473 HD2 TYR 473 13.594 -4.505 13.408 786 HD2 TYR 473 HD1 TYR 473 17.415 -2.640 13.550 787 HE1 TYR 473 HE2 TYR 473 12.683 -2.773 14.898 788 HE2 TYR 473 HE1 TYR 473 16.520 -0.905 15.045 789 HH TYR 473 HH TYR 473 14.080 0.095 15.469 790 H HIS 474 HN HIS 474 18.076 -4.850 10.034 791 HA HIS 474 HA HIS 474 18.790 -2.117 9.957 792 HB2 HIS 474 HB2 HIS 474 20.742 -2.891 8.589 793 HB3 HIS 474 HB1 HIS 474 20.549 -3.715 10.130 794 HD2 HIS 474 HD2 HIS 474 20.576 -4.450 6.348 795 HE1 HIS 474 HE1 HIS 474 20.069 -8.090 8.438 796 HE2 HIS 474 HE2 HIS 474 20.750 -7.036 6.238 797 H LEU 475 HN LEU 475 17.131 -4.163 7.684 798 HA LEU 475 HA LEU 475 17.593 -2.448 5.429 799 HB2 LEU 475 HB2 LEU 475 15.696 -4.725 5.927 800 HB3 LEU 475 HB1 LEU 475 15.618 -3.769 4.460 801 HG LEU 475 HG LEU 475 17.902 -5.513 5.381 802 HD11 LEU 475 HD11 LEU 475 16.011 -6.655 4.310 803 HD12 LEU 475 HD12 LEU 475 17.469 -6.721 3.322 804 HD13 LEU 475 HD13 LEU 475 16.175 -5.596 2.912 805 HD21 LEU 475 HD21 LEU 475 18.963 -3.615 4.454 806 HD22 LEU 475 HD22 LEU 475 17.773 -3.490 3.160 807 HD23 LEU 475 HD23 LEU 475 18.928 -4.823 3.167 808 H VAL 476 HN VAL 476 15.202 -2.746 7.946 809 HA VAL 476 HA VAL 476 13.277 -0.983 6.829 810 HB VAL 476 HB VAL 476 13.764 -1.513 9.772 811 HG11 VAL 476 HG11 VAL 476 11.353 -1.010 9.978 812 HG12 VAL 476 HG12 VAL 476 11.322 -0.585 8.266 813 HG13 VAL 476 HG13 VAL 476 12.293 0.362 9.394 814 HG21 VAL 476 HG21 VAL 476 12.011 -3.041 7.848 815 HG22 VAL 476 HG22 VAL 476 12.113 -3.305 9.589 816 HG23 VAL 476 HG23 VAL 476 13.513 -3.627 8.565 817 H LEU 477 HN LEU 477 15.972 -0.584 9.088 818 HA LEU 477 HA LEU 477 15.653 2.170 9.570 819 HB2 LEU 477 HB2 LEU 477 17.992 0.297 9.743 820 HB3 LEU 477 HB1 LEU 477 18.181 2.009 10.074 821 HG LEU 477 HG LEU 477 16.210 0.265 11.548 822 HD11 LEU 477 HD11 LEU 477 17.865 0.226 13.366 823 HD12 LEU 477 HD12 LEU 477 19.038 0.989 12.294 824 HD13 LEU 477 HD13 LEU 477 18.427 -0.623 11.927 825 HD21 LEU 477 HD21 LEU 477 15.675 2.595 11.694 826 HD22 LEU 477 HD22 LEU 477 17.354 3.012 12.034 827 HD23 LEU 477 HD23 LEU 477 16.412 2.110 13.221 828 H GLN 478 HN GLN 478 17.128 0.390 6.978 829 HA GLN 478 HA GLN 478 18.703 2.418 5.842 830 HB2 GLN 478 HB2 GLN 478 19.052 0.163 5.152 831 HB3 GLN 478 HB1 GLN 478 17.371 -0.026 4.677 832 HG2 GLN 478 HG2 GLN 478 18.292 2.089 3.137 833 HG3 GLN 478 HG1 GLN 478 19.630 0.939 3.156 834 HE21 GLN 478 HE21 GLN 478 16.228 0.092 3.401 835 HE22 GLN 478 HE22 GLN 478 16.135 -0.725 1.884 836 H ASP 479 HN ASP 479 15.335 1.449 5.226 837 HA ASP 479 HA ASP 479 14.932 3.474 3.239 838 HB2 ASP 479 HB2 ASP 479 13.630 1.334 3.341 839 HB3 ASP 479 HB1 ASP 479 12.830 1.948 4.784 840 H LEU 480 HN LEU 480 14.368 3.186 6.696 841 HA LEU 480 HA LEU 480 12.742 5.423 7.088 842 HB2 LEU 480 HB2 LEU 480 14.326 3.647 8.727 843 HB3 LEU 480 HB1 LEU 480 14.434 5.294 9.318 844 HG LEU 480 HG LEU 480 12.668 4.190 10.494 845 HD11 LEU 480 HD11 LEU 480 12.327 6.555 9.702 846 HD12 LEU 480 HD12 LEU 480 10.866 5.664 10.128 847 HD13 LEU 480 HD13 LEU 480 11.296 5.892 8.433 848 HD21 LEU 480 HD21 LEU 480 12.266 2.393 8.881 849 HD22 LEU 480 HD22 LEU 480 11.457 3.539 7.813 850 HD23 LEU 480 HD23 LEU 480 10.767 3.166 9.394 851 H GLN 481 HN GLN 481 16.184 5.188 6.567 852 HA GLN 481 HA GLN 481 16.608 7.979 7.267 853 HB2 GLN 481 HB2 GLN 481 18.508 5.864 6.236 854 HB3 GLN 481 HB1 GLN 481 18.980 7.502 6.671 855 HG2 GLN 481 HG2 GLN 481 18.421 7.145 8.953 856 HG3 GLN 481 HG1 GLN 481 17.652 5.603 8.587 857 HE21 GLN 481 HE21 GLN 481 18.959 3.828 8.046 858 HE22 GLN 481 HE22 GLN 481 20.629 3.766 8.501 859 H LEU 482 HN LEU 482 15.336 6.463 4.689 860 HA LEU 482 HA LEU 482 16.518 8.324 2.741 861 HB2 LEU 482 HB2 LEU 482 15.831 5.544 2.600 862 HB3 LEU 482 HB1 LEU 482 14.877 6.433 1.429 863 HG LEU 482 HG LEU 482 16.928 5.565 0.433 864 HD11 LEU 482 HD11 LEU 482 17.809 7.702 -0.480 865 HD12 LEU 482 HD12 LEU 482 16.819 8.563 0.700 866 HD13 LEU 482 HD13 LEU 482 16.054 7.566 -0.536 867 HD21 LEU 482 HD21 LEU 482 18.321 5.562 2.444 868 HD22 LEU 482 HD22 LEU 482 18.368 7.324 2.412 869 HD23 LEU 482 HD23 LEU 482 19.109 6.400 1.107 870 H THR 483 HN THR 483 13.392 6.795 3.548 871 HA THR 483 HA THR 483 11.965 8.957 2.220 872 HB THR 483 HB THR 483 9.932 7.678 2.805 873 HG1 THR 483 HG1 THR 483 11.184 5.396 3.622 874 HG21 THR 483 HG21 THR 483 10.379 5.704 1.417 875 HG22 THR 483 HG22 THR 483 12.111 5.991 1.569 876 HG23 THR 483 HG23 THR 483 11.096 7.156 0.721 877 H ARG 484 HN ARG 484 12.566 7.722 5.448 878 HA ARG 484 HA ARG 484 12.344 8.612 7.518 879 HB2 ARG 484 HB2 ARG 484 11.960 11.143 5.921 880 HB3 ARG 484 HB1 ARG 484 11.943 11.120 7.679 881 HG2 ARG 484 HG2 ARG 484 14.180 10.678 7.838 882 HG3 ARG 484 HG1 ARG 484 14.250 9.889 6.263 883 HD2 ARG 484 HD2 ARG 484 14.054 12.023 5.145 884 HD3 ARG 484 HD1 ARG 484 13.847 12.842 6.691 885 HE ARG 484 HE ARG 484 16.121 12.426 7.192 886 HH11 ARG 484 HH11 ARG 484 15.224 11.537 3.923 887 HH12 ARG 484 HH12 ARG 484 16.860 11.514 3.350 888 HH21 ARG 484 HH21 ARG 484 18.269 12.390 6.430 889 HH22 ARG 484 HH22 ARG 484 18.588 12.008 4.770 890 H SER 485 HN SER 485 10.086 7.532 5.953 891 HA SER 485 HA SER 485 7.976 8.351 7.774 892 HB2 SER 485 HB2 SER 485 8.055 9.577 5.334 893 HB3 SER 485 HB1 SER 485 7.051 8.175 4.977 894 HG SER 485 HG SER 485 5.755 8.813 6.835 895 H VAL 486 HN VAL 486 7.335 6.493 8.622 896 HA VAL 486 HA VAL 486 7.879 3.962 7.566 897 HB VAL 486 HB VAL 486 6.422 3.052 9.288 898 HG11 VAL 486 HG11 VAL 486 7.847 5.438 10.432 899 HG12 VAL 486 HG12 VAL 486 8.681 3.999 9.845 900 HG13 VAL 486 HG13 VAL 486 7.557 3.875 11.198 901 HG21 VAL 486 HG21 VAL 486 4.540 4.583 9.088 902 HG22 VAL 486 HG22 VAL 486 5.521 5.896 9.736 903 HG23 VAL 486 HG23 VAL 486 5.111 4.517 10.756 904 H GLU 487 HN GLU 487 5.279 6.136 6.952 905 HA GLU 487 HA GLU 487 3.338 4.311 6.019 906 HB2 GLU 487 HB2 GLU 487 3.762 7.169 5.139 907 HB3 GLU 487 HB1 GLU 487 2.278 6.238 4.994 908 HG2 GLU 487 HG2 GLU 487 1.722 7.328 6.872 909 HG3 GLU 487 HG1 GLU 487 2.678 6.062 7.643 910 H ILE 488 HN ILE 488 6.201 5.649 4.585 911 HA ILE 488 HA ILE 488 5.450 4.645 1.932 912 HB ILE 488 HB ILE 488 7.972 6.156 2.615 913 HG12 ILE 488 HG12 ILE 488 5.390 7.374 1.618 914 HG13 ILE 488 HG11 ILE 488 5.889 7.411 3.304 915 HG21 ILE 488 HG21 ILE 488 6.449 5.882 0.025 916 HG22 ILE 488 HG22 ILE 488 7.893 4.966 0.457 917 HG23 ILE 488 HG23 ILE 488 7.985 6.716 0.257 918 HD11 ILE 488 HD11 ILE 488 7.450 8.597 1.023 919 HD12 ILE 488 HD12 ILE 488 7.831 8.721 2.741 920 HD13 ILE 488 HD13 ILE 488 6.380 9.494 2.098 921 H THR 489 HN THR 489 7.642 4.143 4.580 922 HA THR 489 HA THR 489 9.539 2.479 3.372 923 HB THR 489 HB THR 489 8.570 2.394 6.235 924 HG1 THR 489 HG1 THR 489 10.579 3.943 4.921 925 HG21 THR 489 HG21 THR 489 9.871 0.472 5.960 926 HG22 THR 489 HG22 THR 489 11.026 1.662 6.562 927 HG23 THR 489 HG23 THR 489 10.979 1.267 4.843 928 H THR 490 HN THR 490 6.697 1.552 5.308 929 HA THR 490 HA THR 490 6.936 -1.203 4.933 930 HB THR 490 HB THR 490 4.230 0.032 5.210 931 HG1 THR 490 HG1 THR 490 5.270 1.338 6.634 932 HG21 THR 490 HG21 THR 490 4.497 -2.411 5.302 933 HG22 THR 490 HG22 THR 490 3.961 -1.769 6.855 934 HG23 THR 490 HG23 THR 490 5.648 -2.235 6.624 935 H ASP 491 HN ASP 491 5.358 1.262 2.982 936 HA ASP 491 HA ASP 491 4.039 -0.527 1.209 937 HB2 ASP 491 HB2 ASP 491 3.462 1.903 1.520 938 HB3 ASP 491 HB1 ASP 491 4.924 2.307 0.627 939 H ASN 492 HN ASN 492 7.097 1.227 1.111 940 HA ASN 492 HA ASN 492 8.017 0.529 -1.403 941 HB2 ASN 492 HB2 ASN 492 9.279 1.340 1.143 942 HB3 ASN 492 HB1 ASN 492 10.335 0.489 0.021 943 HD21 ASN 492 HD21 ASN 492 10.897 3.050 0.691 944 HD22 ASN 492 HD22 ASN 492 10.580 4.094 -0.659 945 H ILE 493 HN ILE 493 8.167 -1.313 1.598 946 HA ILE 493 HA ILE 493 9.782 -3.428 0.631 947 HB ILE 493 HB ILE 493 7.721 -3.538 2.843 948 HG12 ILE 493 HG12 ILE 493 10.688 -2.980 3.048 949 HG13 ILE 493 HG11 ILE 493 9.442 -1.739 3.115 950 HG21 ILE 493 HG21 ILE 493 8.982 -5.422 3.687 951 HG22 ILE 493 HG22 ILE 493 10.152 -5.261 2.376 952 HG23 ILE 493 HG23 ILE 493 8.491 -5.738 2.022 953 HD11 ILE 493 HD11 ILE 493 10.190 -2.309 5.337 954 HD12 ILE 493 HD12 ILE 493 9.806 -4.008 5.058 955 HD13 ILE 493 HD13 ILE 493 8.513 -2.810 5.120 956 H LEU 494 HN LEU 494 6.287 -2.927 0.765 957 HA LEU 494 HA LEU 494 5.587 -5.499 -0.214 958 HB2 LEU 494 HB2 LEU 494 4.123 -2.900 0.073 959 HB3 LEU 494 HB1 LEU 494 3.381 -4.247 -0.767 960 HG LEU 494 HG LEU 494 4.379 -4.401 2.079 961 HD11 LEU 494 HD11 LEU 494 2.068 -4.216 2.760 962 HD12 LEU 494 HD12 LEU 494 1.565 -4.023 1.082 963 HD13 LEU 494 HD13 LEU 494 2.544 -2.777 1.856 964 HD21 LEU 494 HD21 LEU 494 3.823 -6.419 0.320 965 HD22 LEU 494 HD22 LEU 494 2.278 -6.208 1.159 966 HD23 LEU 494 HD23 LEU 494 3.747 -6.547 2.078 967 H GLU 495 HN GLU 495 6.139 -2.366 -1.741 968 HA GLU 495 HA GLU 495 5.293 -3.108 -4.333 969 HB2 GLU 495 HB2 GLU 495 7.279 -0.987 -3.496 970 HB3 GLU 495 HB1 GLU 495 6.568 -1.130 -5.098 971 HG2 GLU 495 HG2 GLU 495 5.085 -0.581 -2.538 972 HG3 GLU 495 HG1 GLU 495 5.467 0.592 -3.798 973 H GLY 496 HN GLY 496 8.542 -2.892 -2.916 974 HA2 GLY 496 HA2 GLY 496 9.897 -4.971 -3.497 975 HA3 GLY 496 HA1 GLY 496 9.534 -4.530 -5.160 976 H ARG 497 HN ARG 497 10.171 -2.110 -2.726 977 HA ARG 497 HA ARG 497 12.468 -1.214 -4.253 978 HB2 ARG 497 HB2 ARG 497 10.589 0.202 -3.033 979 HB3 ARG 497 HB1 ARG 497 11.673 0.037 -1.661 980 HG2 ARG 497 HG2 ARG 497 12.565 1.930 -2.470 981 HG3 ARG 497 HG1 ARG 497 13.419 0.832 -3.557 982 HD2 ARG 497 HD2 ARG 497 12.456 2.626 -4.839 983 HD3 ARG 497 HD1 ARG 497 11.600 1.130 -5.212 984 HE ARG 497 HE ARG 497 10.077 2.186 -3.262 985 HH11 ARG 497 HH11 ARG 497 11.373 3.578 -6.210 986 HH12 ARG 497 HH12 ARG 497 10.057 4.688 -6.410 987 HH21 ARG 497 HH21 ARG 497 8.347 3.641 -3.525 988 HH22 ARG 497 HH22 ARG 497 8.344 4.737 -4.874 989 H ILE 498 HN ILE 498 11.739 -2.747 -1.210 990 HA ILE 498 HA ILE 498 14.576 -2.783 -0.478 991 HB ILE 498 HB ILE 498 12.051 -3.324 1.072 992 HG12 ILE 498 HG12 ILE 498 13.437 -1.777 2.689 993 HG13 ILE 498 HG11 ILE 498 14.321 -1.379 1.220 994 HG21 ILE 498 HG21 ILE 498 13.552 -5.166 1.603 995 HG22 ILE 498 HG22 ILE 498 13.387 -4.073 2.976 996 HG23 ILE 498 HG23 ILE 498 14.840 -4.021 1.978 997 HD11 ILE 498 HD11 ILE 498 12.624 0.258 1.568 998 HD12 ILE 498 HD12 ILE 498 11.388 -0.987 1.740 999 HD13 ILE 498 HD13 ILE 498 12.167 -0.731 0.180 1000 H GLN 499 HN GLN 499 15.745 -4.620 -0.626 1001 HA GLN 499 HA GLN 499 14.641 -6.836 -2.047 1002 HB2 GLN 499 HB2 GLN 499 17.345 -6.604 -0.714 1003 HB3 GLN 499 HB1 GLN 499 16.879 -7.803 -1.914 1004 HG2 GLN 499 HG2 GLN 499 17.227 -4.844 -2.302 1005 HG3 GLN 499 HG1 GLN 499 18.171 -6.148 -3.018 1006 HE21 GLN 499 HE21 GLN 499 16.610 -3.928 -4.209 1007 HE22 GLN 499 HE22 GLN 499 15.500 -4.680 -5.301 1008 H VAL 500 HN VAL 500 13.146 -7.912 -0.938 1009 HA VAL 500 HA VAL 500 13.326 -8.615 1.804 1010 HB VAL 500 HB VAL 500 11.401 -10.123 1.290 1011 HG11 VAL 500 HG11 VAL 500 11.003 -7.812 1.904 1012 HG12 VAL 500 HG12 VAL 500 9.832 -8.326 0.690 1013 HG13 VAL 500 HG13 VAL 500 11.196 -7.310 0.225 1014 HG21 VAL 500 HG21 VAL 500 11.816 -9.130 -1.528 1015 HG22 VAL 500 HG22 VAL 500 10.399 -10.014 -0.962 1016 HG23 VAL 500 HG23 VAL 500 11.981 -10.794 -0.963 1017 HA PRO 501 HA PRO 501 15.681 -12.360 2.047 1018 HB2 PRO 501 HB2 PRO 501 13.160 -13.835 2.707 1019 HB3 PRO 501 HB1 PRO 501 14.722 -13.833 3.552 1020 HG2 PRO 501 HG2 PRO 501 12.686 -12.479 4.534 1021 HG3 PRO 501 HG1 PRO 501 14.330 -11.811 4.578 1022 HD2 PRO 501 HD2 PRO 501 12.049 -11.074 2.820 1023 HD3 PRO 501 HD1 PRO 501 13.339 -10.057 3.489 1024 H PHE 502 HN PHE 502 16.410 -13.194 0.210 1025 HA PHE 502 HA PHE 502 14.493 -14.516 -1.594 1026 HB2 PHE 502 HB2 PHE 502 15.802 -12.371 -2.325 1027 HB3 PHE 502 HB1 PHE 502 17.160 -13.475 -2.501 1028 HD1 PHE 502 HD1 PHE 502 13.527 -13.529 -3.382 1029 HD2 PHE 502 HD2 PHE 502 17.551 -14.108 -4.656 1030 HE1 PHE 502 HE1 PHE 502 12.728 -14.127 -5.631 1031 HE2 PHE 502 HE2 PHE 502 16.757 -14.713 -6.899 1032 HZ PHE 502 HZ PHE 502 14.345 -14.720 -7.390 1033 HA PRO 503 HA PRO 503 16.760 -18.220 -0.613 1034 HB2 PRO 503 HB2 PRO 503 15.718 -19.778 -2.619 1035 HB3 PRO 503 HB1 PRO 503 14.857 -19.422 -1.110 1036 HG2 PRO 503 HG2 PRO 503 14.546 -18.184 -3.793 1037 HG3 PRO 503 HG1 PRO 503 13.309 -18.621 -2.596 1038 HD2 PRO 503 HD2 PRO 503 14.161 -16.080 -2.938 1039 HD3 PRO 503 HD1 PRO 503 13.630 -16.709 -1.367 1040 H THR 504 HN THR 504 18.862 -18.122 -1.075 1041 HA THR 504 HA THR 504 19.839 -18.933 -3.623 1042 HB THR 504 HB THR 504 19.361 -16.448 -3.945 1043 HG1 THR 504 HG1 THR 504 21.962 -17.551 -4.246 1044 HG21 THR 504 HG21 THR 504 20.048 -15.695 -1.708 1045 HG22 THR 504 HG22 THR 504 20.936 -14.855 -2.979 1046 HG23 THR 504 HG23 THR 504 21.712 -16.152 -2.070 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 -18.517 -11.082 14.212 2 H2 MET 1 HT2 MET 1 -18.492 -12.740 13.855 3 H3 MET 1 HT3 MET 1 -17.670 -11.647 12.858 4 HA MET 1 HA MET 1 -17.028 -12.229 15.687 5 HB2 MET 1 HB2 MET 1 -15.095 -13.398 14.905 6 HB3 MET 1 HB1 MET 1 -16.479 -14.047 14.041 7 HG2 MET 1 HG2 MET 1 -15.899 -12.689 12.090 8 HG3 MET 1 HG1 MET 1 -14.507 -12.048 12.961 9 HE1 MET 1 HE1 MET 1 -12.614 -14.288 10.461 10 HE2 MET 1 HE2 MET 1 -12.710 -12.712 11.248 11 HE3 MET 1 HE3 MET 1 -13.994 -13.232 10.155 12 H GLN 2 HN GLN 2 -15.355 -11.036 16.568 13 HA GLN 2 HA GLN 2 -14.912 -8.471 15.263 14 HB2 GLN 2 HB2 GLN 2 -14.386 -9.477 18.056 15 HB3 GLN 2 HB1 GLN 2 -13.855 -7.898 17.493 16 HG2 GLN 2 HG2 GLN 2 -16.718 -8.681 17.222 17 HG3 GLN 2 HG1 GLN 2 -16.096 -8.137 18.779 18 HE21 GLN 2 HE21 GLN 2 -18.055 -6.927 16.955 19 HE22 GLN 2 HE22 GLN 2 -17.449 -5.335 16.616 20 H ILE 3 HN ILE 3 -12.977 -7.706 14.610 21 HA ILE 3 HA ILE 3 -10.621 -9.445 14.961 22 HB ILE 3 HB ILE 3 -9.845 -8.728 12.705 23 HG12 ILE 3 HG12 ILE 3 -12.688 -7.822 12.246 24 HG13 ILE 3 HG11 ILE 3 -11.388 -6.705 12.643 25 HG21 ILE 3 HG21 ILE 3 -11.364 -10.223 11.437 26 HG22 ILE 3 HG22 ILE 3 -12.441 -10.250 12.834 27 HG23 ILE 3 HG23 ILE 3 -10.810 -10.909 12.965 28 HD11 ILE 3 HD11 ILE 3 -11.494 -8.500 10.230 29 HD12 ILE 3 HD12 ILE 3 -10.195 -7.376 10.627 30 HD13 ILE 3 HD13 ILE 3 -11.805 -6.764 10.253 31 H PHE 4 HN PHE 4 -8.556 -8.284 14.726 32 HA PHE 4 HA PHE 4 -8.817 -5.503 15.661 33 HB2 PHE 4 HB2 PHE 4 -6.772 -7.613 16.366 34 HB3 PHE 4 HB1 PHE 4 -6.576 -5.909 16.764 35 HD1 PHE 4 HD1 PHE 4 -8.051 -4.836 18.399 36 HD2 PHE 4 HD2 PHE 4 -8.286 -9.008 17.582 37 HE1 PHE 4 HE1 PHE 4 -9.334 -5.170 20.474 38 HE2 PHE 4 HE2 PHE 4 -9.567 -9.345 19.654 39 HZ PHE 4 HZ PHE 4 -10.093 -7.428 21.101 40 H VAL 5 HN VAL 5 -8.333 -4.155 14.082 41 HA VAL 5 HA VAL 5 -6.275 -4.874 12.119 42 HB VAL 5 HB VAL 5 -8.109 -2.472 12.071 43 HG11 VAL 5 HG11 VAL 5 -7.567 -2.402 9.696 44 HG12 VAL 5 HG12 VAL 5 -6.521 -3.810 9.883 45 HG13 VAL 5 HG13 VAL 5 -6.106 -2.289 10.676 46 HG21 VAL 5 HG21 VAL 5 -9.459 -4.499 12.078 47 HG22 VAL 5 HG22 VAL 5 -8.499 -5.157 10.755 48 HG23 VAL 5 HG23 VAL 5 -9.499 -3.728 10.492 49 H LYS 6 HN LYS 6 -4.279 -4.280 12.682 50 HA LYS 6 HA LYS 6 -3.907 -1.956 14.411 51 HB2 LYS 6 HB2 LYS 6 -2.771 -4.325 14.632 52 HB3 LYS 6 HB1 LYS 6 -1.647 -3.659 13.457 53 HG2 LYS 6 HG2 LYS 6 -1.027 -1.895 14.933 54 HG3 LYS 6 HG1 LYS 6 -2.314 -2.314 16.062 55 HD2 LYS 6 HD2 LYS 6 -1.214 -4.500 16.438 56 HD3 LYS 6 HD1 LYS 6 0.107 -3.985 15.389 57 HE2 LYS 6 HE2 LYS 6 0.789 -3.619 17.651 58 HE3 LYS 6 HE1 LYS 6 0.460 -2.044 16.929 59 HZ1 LYS 6 HZ1 LYS 6 -0.543 -1.968 19.010 60 HZ2 LYS 6 HZ2 LYS 6 -1.154 -3.536 18.899 61 HZ3 LYS 6 HZ3 LYS 6 -1.838 -2.298 17.969 62 H THR 7 HN THR 7 -3.005 -0.106 13.777 63 HA THR 7 HA THR 7 -2.309 0.142 10.933 64 HB THR 7 HB THR 7 -2.646 2.606 11.307 65 HG1 THR 7 HG1 THR 7 -3.658 1.693 13.823 66 HG21 THR 7 HG21 THR 7 -5.027 0.879 11.988 67 HG22 THR 7 HG22 THR 7 -4.418 1.177 10.360 68 HG23 THR 7 HG23 THR 7 -5.076 2.507 11.311 69 H LEU 8 HN LEU 8 -0.587 1.763 10.434 70 HA LEU 8 HA LEU 8 1.815 1.116 11.782 71 HB2 LEU 8 HB2 LEU 8 1.163 3.233 9.739 72 HB3 LEU 8 HB1 LEU 8 2.789 2.923 10.318 73 HG LEU 8 HG LEU 8 1.104 0.803 8.992 74 HD11 LEU 8 HD11 LEU 8 3.177 2.582 7.715 75 HD12 LEU 8 HD12 LEU 8 1.436 2.697 7.456 76 HD13 LEU 8 HD13 LEU 8 2.312 1.255 6.941 77 HD21 LEU 8 HD21 LEU 8 3.261 -0.289 8.654 78 HD22 LEU 8 HD22 LEU 8 2.948 -0.006 10.367 79 HD23 LEU 8 HD23 LEU 8 4.069 1.037 9.492 80 H THR 9 HN THR 9 -0.590 3.255 12.657 81 HA THR 9 HA THR 9 1.194 5.184 13.917 82 HB THR 9 HB THR 9 -1.692 5.393 14.462 83 HG1 THR 9 HG1 THR 9 -2.137 6.049 12.277 84 HG21 THR 9 HG21 THR 9 0.021 7.151 14.929 85 HG22 THR 9 HG22 THR 9 -1.303 7.709 13.908 86 HG23 THR 9 HG23 THR 9 0.259 7.317 13.190 87 H GLY 10 HN GLY 10 0.175 2.187 14.661 88 HA2 GLY 10 HA2 GLY 10 0.504 1.073 16.696 89 HA3 GLY 10 HA1 GLY 10 0.559 2.629 17.511 90 H LYS 11 HN LYS 11 -2.067 2.868 15.650 91 HA LYS 11 HA LYS 11 -3.852 2.332 17.859 92 HB2 LYS 11 HB2 LYS 11 -4.183 4.384 16.612 93 HB3 LYS 11 HB1 LYS 11 -4.314 3.491 15.103 94 HG2 LYS 11 HG2 LYS 11 -6.370 2.410 16.000 95 HG3 LYS 11 HG1 LYS 11 -6.268 3.486 17.393 96 HD2 LYS 11 HD2 LYS 11 -6.392 5.420 15.873 97 HD3 LYS 11 HD1 LYS 11 -6.545 4.310 14.510 98 HE2 LYS 11 HE2 LYS 11 -8.610 3.422 15.441 99 HE3 LYS 11 HE1 LYS 11 -8.459 4.491 16.833 100 HZ1 LYS 11 HZ1 LYS 11 -9.965 5.494 15.340 101 HZ2 LYS 11 HZ2 LYS 11 -8.947 5.252 14.009 102 HZ3 LYS 11 HZ3 LYS 11 -8.528 6.373 15.208 103 H THR 12 HN THR 12 -5.208 0.645 18.037 104 HA THR 12 HA THR 12 -5.304 -1.252 15.785 105 HB THR 12 HB THR 12 -5.815 -1.975 18.664 106 HG1 THR 12 HG1 THR 12 -3.738 -1.859 18.998 107 HG21 THR 12 HG21 THR 12 -6.595 -3.539 16.924 108 HG22 THR 12 HG22 THR 12 -5.301 -4.229 17.904 109 HG23 THR 12 HG23 THR 12 -4.954 -3.623 16.285 110 H ILE 13 HN ILE 13 -7.161 -1.114 14.752 111 HA ILE 13 HA ILE 13 -9.552 -0.119 16.082 112 HB ILE 13 HB ILE 13 -9.425 -1.014 13.215 113 HG12 ILE 13 HG12 ILE 13 -8.740 1.795 14.032 114 HG13 ILE 13 HG11 ILE 13 -7.483 0.567 13.937 115 HG21 ILE 13 HG21 ILE 13 -10.961 1.186 14.597 116 HG22 ILE 13 HG22 ILE 13 -11.596 -0.406 14.182 117 HG23 ILE 13 HG23 ILE 13 -11.111 0.710 12.905 118 HD11 ILE 13 HD11 ILE 13 -7.988 0.204 11.595 119 HD12 ILE 13 HD12 ILE 13 -7.630 1.904 11.899 120 HD13 ILE 13 HD13 ILE 13 -9.299 1.380 11.680 121 H THR 14 HN THR 14 -11.366 -1.296 16.475 122 HA THR 14 HA THR 14 -11.206 -4.194 15.971 123 HB THR 14 HB THR 14 -13.101 -3.097 17.990 124 HG1 THR 14 HG1 THR 14 -10.575 -2.380 18.027 125 HG21 THR 14 HG21 THR 14 -13.002 -5.498 17.564 126 HG22 THR 14 HG22 THR 14 -12.427 -5.140 19.193 127 HG23 THR 14 HG23 THR 14 -11.272 -5.502 17.910 128 H LEU 15 HN LEU 15 -12.617 -4.981 14.530 129 HA LEU 15 HA LEU 15 -15.100 -3.475 14.052 130 HB2 LEU 15 HB2 LEU 15 -13.249 -4.643 11.981 131 HB3 LEU 15 HB1 LEU 15 -14.868 -4.069 11.633 132 HG LEU 15 HG LEU 15 -12.659 -2.337 12.743 133 HD11 LEU 15 HD11 LEU 15 -12.512 -1.409 10.481 134 HD12 LEU 15 HD12 LEU 15 -13.663 -2.618 9.915 135 HD13 LEU 15 HD13 LEU 15 -12.082 -3.119 10.514 136 HD21 LEU 15 HD21 LEU 15 -14.892 -1.534 13.279 137 HD22 LEU 15 HD22 LEU 15 -15.364 -1.668 11.585 138 HD23 LEU 15 HD23 LEU 15 -14.137 -0.498 12.070 139 H GLU 16 HN GLU 16 -16.874 -4.624 13.332 140 HA GLU 16 HA GLU 16 -16.875 -7.461 14.032 141 HB2 GLU 16 HB2 GLU 16 -18.584 -5.921 15.007 142 HB3 GLU 16 HB1 GLU 16 -19.187 -5.609 13.390 143 HG2 GLU 16 HG2 GLU 16 -20.644 -7.171 14.378 144 HG3 GLU 16 HG1 GLU 16 -19.679 -8.057 13.197 145 H VAL 17 HN VAL 17 -16.559 -8.879 12.434 146 HA VAL 17 HA VAL 17 -17.730 -8.305 9.797 147 HB VAL 17 HB VAL 17 -15.669 -9.374 8.766 148 HG11 VAL 17 HG11 VAL 17 -14.381 -7.281 8.789 149 HG12 VAL 17 HG12 VAL 17 -15.348 -6.710 10.147 150 HG13 VAL 17 HG13 VAL 17 -16.108 -6.987 8.579 151 HG21 VAL 17 HG21 VAL 17 -14.741 -10.349 10.790 152 HG22 VAL 17 HG22 VAL 17 -14.526 -8.744 11.487 153 HG23 VAL 17 HG23 VAL 17 -13.590 -9.223 10.071 154 H GLU 18 HN GLU 18 -17.996 -10.215 8.462 155 HA GLU 18 HA GLU 18 -18.387 -12.634 10.097 156 HB2 GLU 18 HB2 GLU 18 -19.808 -11.710 7.590 157 HB3 GLU 18 HB1 GLU 18 -20.090 -13.254 8.380 158 HG2 GLU 18 HG2 GLU 18 -20.596 -10.529 9.550 159 HG3 GLU 18 HG1 GLU 18 -21.811 -11.666 8.967 160 HA PRO 19 HA PRO 19 -15.486 -14.954 7.697 161 HB2 PRO 19 HB2 PRO 19 -17.614 -16.955 7.130 162 HB3 PRO 19 HB1 PRO 19 -16.031 -17.175 7.899 163 HG2 PRO 19 HG2 PRO 19 -18.247 -17.245 9.340 164 HG3 PRO 19 HG1 PRO 19 -16.770 -16.482 9.958 165 HD2 PRO 19 HD2 PRO 19 -19.236 -15.203 8.874 166 HD3 PRO 19 HD1 PRO 19 -18.196 -14.695 10.221 167 H SER 20 HN SER 20 -18.654 -14.423 6.317 168 HA SER 20 HA SER 20 -17.759 -14.952 3.615 169 HB2 SER 20 HB2 SER 20 -20.380 -13.704 3.937 170 HB3 SER 20 HB1 SER 20 -19.950 -15.237 3.178 171 HG SER 20 HG SER 20 -20.834 -16.084 4.888 172 H ASP 21 HN ASP 21 -17.170 -12.445 5.564 173 HA ASP 21 HA ASP 21 -17.969 -10.267 3.837 174 HB2 ASP 21 HB2 ASP 21 -17.335 -10.439 6.523 175 HB3 ASP 21 HB1 ASP 21 -15.910 -9.667 5.837 176 H THR 22 HN THR 22 -16.782 -9.351 2.282 177 HA THR 22 HA THR 22 -14.287 -10.607 1.533 178 HB THR 22 HB THR 22 -14.446 -8.964 -0.420 179 HG1 THR 22 HG1 THR 22 -17.018 -8.507 -0.387 180 HG21 THR 22 HG21 THR 22 -16.689 -10.931 0.032 181 HG22 THR 22 HG22 THR 22 -15.103 -11.292 -0.649 182 HG23 THR 22 HG23 THR 22 -16.227 -10.257 -1.531 183 H ILE 23 HN ILE 23 -12.359 -9.436 1.090 184 HA ILE 23 HA ILE 23 -11.548 -7.668 3.103 185 HB ILE 23 HB ILE 23 -10.293 -8.009 0.374 186 HG12 ILE 23 HG12 ILE 23 -10.573 -10.182 1.433 187 HG13 ILE 23 HG11 ILE 23 -8.874 -9.727 1.454 188 HG21 ILE 23 HG21 ILE 23 -8.212 -7.350 1.470 189 HG22 ILE 23 HG22 ILE 23 -9.084 -7.108 2.984 190 HG23 ILE 23 HG23 ILE 23 -9.432 -6.081 1.593 191 HD11 ILE 23 HD11 ILE 23 -10.809 -9.640 3.752 192 HD12 ILE 23 HD12 ILE 23 -9.167 -9.000 3.809 193 HD13 ILE 23 HD13 ILE 23 -9.433 -10.724 3.548 194 H GLU 24 HN GLU 24 -12.943 -7.142 -0.047 195 HA GLU 24 HA GLU 24 -12.381 -4.421 -0.418 196 HB2 GLU 24 HB2 GLU 24 -13.543 -6.251 -1.956 197 HB3 GLU 24 HB1 GLU 24 -15.009 -5.553 -1.284 198 HG2 GLU 24 HG2 GLU 24 -12.916 -3.832 -2.561 199 HG3 GLU 24 HG1 GLU 24 -14.131 -4.668 -3.523 200 H ASN 25 HN ASN 25 -15.081 -6.057 1.206 201 HA ASN 25 HA ASN 25 -16.427 -3.630 1.903 202 HB2 ASN 25 HB2 ASN 25 -17.523 -5.902 1.680 203 HB3 ASN 25 HB1 ASN 25 -16.789 -6.319 3.227 204 HD21 ASN 25 HD21 ASN 25 -18.589 -6.487 4.436 205 HD22 ASN 25 HD22 ASN 25 -19.686 -5.173 4.738 206 H VAL 26 HN VAL 26 -14.113 -5.754 3.494 207 HA VAL 26 HA VAL 26 -14.273 -4.678 6.081 208 HB VAL 26 HB VAL 26 -11.849 -5.832 4.676 209 HG11 VAL 26 HG11 VAL 26 -11.200 -4.512 6.631 210 HG12 VAL 26 HG12 VAL 26 -10.956 -6.233 6.921 211 HG13 VAL 26 HG13 VAL 26 -12.348 -5.411 7.626 212 HG21 VAL 26 HG21 VAL 26 -13.685 -7.413 4.761 213 HG22 VAL 26 HG22 VAL 26 -13.901 -7.111 6.483 214 HG23 VAL 26 HG23 VAL 26 -12.433 -7.897 5.905 215 H LYS 27 HN LYS 27 -12.315 -3.774 3.275 216 HA LYS 27 HA LYS 27 -10.909 -1.656 4.497 217 HB2 LYS 27 HB2 LYS 27 -11.599 -2.239 1.619 218 HB3 LYS 27 HB1 LYS 27 -10.636 -0.846 2.091 219 HG2 LYS 27 HG2 LYS 27 -9.114 -2.526 3.271 220 HG3 LYS 27 HG1 LYS 27 -9.963 -3.755 2.333 221 HD2 LYS 27 HD2 LYS 27 -8.692 -1.345 1.060 222 HD3 LYS 27 HD1 LYS 27 -7.806 -2.844 1.344 223 HE2 LYS 27 HE2 LYS 27 -9.301 -4.066 -0.072 224 HE3 LYS 27 HE1 LYS 27 -10.382 -2.680 -0.208 225 HZ1 LYS 27 HZ1 LYS 27 -7.608 -2.333 -1.062 226 HZ2 LYS 27 HZ2 LYS 27 -9.024 -1.648 -1.686 227 HZ3 LYS 27 HZ3 LYS 27 -8.626 -3.255 -2.058 228 H ALA 28 HN ALA 28 -14.023 -1.823 2.859 229 HA ALA 28 HA ALA 28 -14.516 0.948 2.686 230 HB1 ALA 28 HB1 ALA 28 -15.791 -0.716 1.421 231 HB2 ALA 28 HB2 ALA 28 -16.853 0.334 2.359 232 HB3 ALA 28 HB3 ALA 28 -16.512 -1.305 2.918 233 H LYS 29 HN LYS 29 -15.041 -1.423 5.218 234 HA LYS 29 HA LYS 29 -16.564 0.234 6.935 235 HB2 LYS 29 HB2 LYS 29 -14.879 -2.224 7.429 236 HB3 LYS 29 HB1 LYS 29 -15.750 -1.406 8.718 237 HG2 LYS 29 HG2 LYS 29 -17.861 -1.826 7.618 238 HG3 LYS 29 HG1 LYS 29 -17.029 -2.542 6.239 239 HD2 LYS 29 HD2 LYS 29 -16.237 -4.368 7.603 240 HD3 LYS 29 HD1 LYS 29 -16.903 -3.620 9.054 241 HE2 LYS 29 HE2 LYS 29 -19.156 -3.872 8.185 242 HE3 LYS 29 HE1 LYS 29 -18.526 -4.534 6.682 243 HZ1 LYS 29 HZ1 LYS 29 -17.916 -6.513 7.708 244 HZ2 LYS 29 HZ2 LYS 29 -19.399 -6.142 8.432 245 HZ3 LYS 29 HZ3 LYS 29 -17.960 -5.844 9.270 246 H ILE 30 HN ILE 30 -13.105 -0.373 6.566 247 HA ILE 30 HA ILE 30 -12.259 1.205 8.766 248 HB ILE 30 HB ILE 30 -10.735 0.556 6.232 249 HG12 ILE 30 HG12 ILE 30 -10.723 -0.899 8.887 250 HG13 ILE 30 HG11 ILE 30 -11.605 -1.441 7.462 251 HG21 ILE 30 HG21 ILE 30 -9.751 2.393 7.510 252 HG22 ILE 30 HG22 ILE 30 -8.731 0.955 7.563 253 HG23 ILE 30 HG23 ILE 30 -9.728 1.382 8.955 254 HD11 ILE 30 HD11 ILE 30 -9.536 -2.657 7.679 255 HD12 ILE 30 HD12 ILE 30 -8.621 -1.148 7.710 256 HD13 ILE 30 HD13 ILE 30 -9.481 -1.628 6.248 257 H GLN 31 HN GLN 31 -13.001 1.880 5.417 258 HA GLN 31 HA GLN 31 -11.955 4.513 5.293 259 HB2 GLN 31 HB2 GLN 31 -12.459 3.196 3.287 260 HB3 GLN 31 HB1 GLN 31 -14.166 3.200 3.698 261 HG2 GLN 31 HG2 GLN 31 -13.999 5.750 3.555 262 HG3 GLN 31 HG1 GLN 31 -12.464 5.466 2.736 263 HE21 GLN 31 HE21 GLN 31 -13.266 6.383 0.839 264 HE22 GLN 31 HE22 GLN 31 -14.388 5.544 -0.175 265 H ASP 32 HN ASP 32 -14.854 3.162 6.593 266 HA ASP 32 HA ASP 32 -16.242 5.706 6.722 267 HB2 ASP 32 HB2 ASP 32 -17.509 3.643 6.317 268 HB3 ASP 32 HB1 ASP 32 -16.960 2.992 7.855 269 H LYS 33 HN LYS 33 -14.356 3.617 8.774 270 HA LYS 33 HA LYS 33 -15.008 5.044 11.203 271 HB2 LYS 33 HB2 LYS 33 -13.106 2.800 10.555 272 HB3 LYS 33 HB1 LYS 33 -13.175 3.542 12.147 273 HG2 LYS 33 HG2 LYS 33 -15.728 2.608 10.984 274 HG3 LYS 33 HG1 LYS 33 -14.575 1.381 11.506 275 HD2 LYS 33 HD2 LYS 33 -14.483 2.406 13.723 276 HD3 LYS 33 HD1 LYS 33 -15.626 3.643 13.199 277 HE2 LYS 33 HE2 LYS 33 -17.316 1.930 12.808 278 HE3 LYS 33 HE1 LYS 33 -16.173 0.679 13.299 279 HZ1 LYS 33 HZ1 LYS 33 -16.190 1.458 15.501 280 HZ2 LYS 33 HZ2 LYS 33 -17.815 1.443 15.030 281 HZ3 LYS 33 HZ3 LYS 33 -16.962 2.905 15.086 282 H GLU 34 HN GLU 34 -12.012 4.511 9.344 283 HA GLU 34 HA GLU 34 -10.691 6.657 10.787 284 HB2 GLU 34 HB2 GLU 34 -9.645 4.912 8.556 285 HB3 GLU 34 HB1 GLU 34 -8.691 5.982 9.574 286 HG2 GLU 34 HG2 GLU 34 -10.219 3.569 10.524 287 HG3 GLU 34 HG1 GLU 34 -8.481 3.640 10.238 288 H GLY 35 HN GLY 35 -11.844 5.964 7.536 289 HA2 GLY 35 HA2 GLY 35 -12.640 7.649 6.065 290 HA3 GLY 35 HA1 GLY 35 -11.654 8.827 6.924 291 H ILE 36 HN ILE 36 -9.887 6.075 6.473 292 HA ILE 36 HA ILE 36 -8.138 7.299 4.578 293 HB ILE 36 HB ILE 36 -8.153 4.468 5.647 294 HG12 ILE 36 HG12 ILE 36 -6.505 6.846 6.540 295 HG13 ILE 36 HG11 ILE 36 -7.949 6.273 7.370 296 HG21 ILE 36 HG21 ILE 36 -5.952 6.004 4.267 297 HG22 ILE 36 HG22 ILE 36 -6.882 4.678 3.569 298 HG23 ILE 36 HG23 ILE 36 -5.818 4.382 4.945 299 HD11 ILE 36 HD11 ILE 36 -5.985 5.464 8.489 300 HD12 ILE 36 HD12 ILE 36 -5.375 4.764 6.990 301 HD13 ILE 36 HD13 ILE 36 -6.831 4.108 7.741 302 HA PRO 37 HA PRO 37 -10.212 5.937 0.853 303 HB2 PRO 37 HB2 PRO 37 -7.476 6.176 -0.281 304 HB3 PRO 37 HB1 PRO 37 -8.987 6.936 -0.812 305 HG2 PRO 37 HG2 PRO 37 -7.116 8.351 0.413 306 HG3 PRO 37 HG1 PRO 37 -8.840 8.639 0.717 307 HD2 PRO 37 HD2 PRO 37 -6.838 7.235 2.420 308 HD3 PRO 37 HD1 PRO 37 -8.188 8.287 2.892 309 HA PRO 38 HA PRO 38 -9.185 1.577 1.104 310 HB2 PRO 38 HB2 PRO 38 -10.781 1.370 -1.371 311 HB3 PRO 38 HB1 PRO 38 -11.034 0.587 0.199 312 HG2 PRO 38 HG2 PRO 38 -12.625 2.547 -0.653 313 HG3 PRO 38 HG1 PRO 38 -12.199 2.357 1.060 314 HD2 PRO 38 HD2 PRO 38 -11.146 4.306 -0.941 315 HD3 PRO 38 HD1 PRO 38 -11.513 4.535 0.782 316 H ASP 39 HN ASP 39 -8.612 3.655 -1.576 317 HA ASP 39 HA ASP 39 -7.290 1.802 -3.276 318 HB2 ASP 39 HB2 ASP 39 -6.521 4.673 -3.370 319 HB3 ASP 39 HB1 ASP 39 -6.936 3.581 -4.685 320 H GLN 40 HN GLN 40 -6.334 3.689 -0.527 321 HA GLN 40 HA GLN 40 -3.510 3.019 -0.991 322 HB2 GLN 40 HB2 GLN 40 -4.893 5.150 0.593 323 HB3 GLN 40 HB1 GLN 40 -3.264 4.656 1.035 324 HG2 GLN 40 HG2 GLN 40 -2.419 5.295 -1.105 325 HG3 GLN 40 HG1 GLN 40 -4.047 5.598 -1.709 326 HE21 GLN 40 HE21 GLN 40 -1.641 7.321 -1.406 327 HE22 GLN 40 HE22 GLN 40 -2.181 8.695 -0.503 328 H GLN 41 HN GLN 41 -5.991 1.555 0.322 329 HA GLN 41 HA GLN 41 -4.821 0.930 2.911 330 HB2 GLN 41 HB2 GLN 41 -7.418 0.152 1.600 331 HB3 GLN 41 HB1 GLN 41 -6.882 -0.543 3.120 332 HG2 GLN 41 HG2 GLN 41 -6.779 1.805 4.022 333 HG3 GLN 41 HG1 GLN 41 -7.598 2.313 2.545 334 HE21 GLN 41 HE21 GLN 41 -9.472 2.975 3.560 335 HE22 GLN 41 HE22 GLN 41 -10.570 1.858 4.297 336 H ARG 42 HN ARG 42 -3.016 -0.301 2.514 337 HA ARG 42 HA ARG 42 -3.375 -2.753 0.936 338 HB2 ARG 42 HB2 ARG 42 -0.820 -1.619 2.102 339 HB3 ARG 42 HB1 ARG 42 -0.951 -2.956 0.969 340 HG2 ARG 42 HG2 ARG 42 -2.027 -1.270 -0.622 341 HG3 ARG 42 HG1 ARG 42 -1.409 -0.034 0.474 342 HD2 ARG 42 HD2 ARG 42 0.462 -0.131 -0.752 343 HD3 ARG 42 HD1 ARG 42 0.782 -1.642 0.096 344 HE ARG 42 HE ARG 42 -0.810 -2.316 -2.050 345 HH11 ARG 42 HH11 ARG 42 2.330 -0.761 -1.648 346 HH12 ARG 42 HH12 ARG 42 2.943 -1.395 -3.155 347 HH21 ARG 42 HH21 ARG 42 0.033 -3.095 -4.027 348 HH22 ARG 42 HH22 ARG 42 1.659 -2.688 -4.483 349 H LEU 43 HN LEU 43 -4.349 -4.213 2.213 350 HA LEU 43 HA LEU 43 -3.670 -4.403 5.028 351 HB2 LEU 43 HB2 LEU 43 -5.790 -5.548 3.278 352 HB3 LEU 43 HB1 LEU 43 -5.402 -6.378 4.769 353 HG LEU 43 HG LEU 43 -6.198 -3.473 4.650 354 HD11 LEU 43 HD11 LEU 43 -7.900 -5.880 5.275 355 HD12 LEU 43 HD12 LEU 43 -8.022 -4.878 3.829 356 HD13 LEU 43 HD13 LEU 43 -8.397 -4.192 5.410 357 HD21 LEU 43 HD21 LEU 43 -6.643 -3.835 7.059 358 HD22 LEU 43 HD22 LEU 43 -4.943 -4.026 6.632 359 HD23 LEU 43 HD23 LEU 43 -5.947 -5.447 6.915 360 H ILE 44 HN ILE 44 -2.297 -5.762 5.865 361 HA ILE 44 HA ILE 44 -1.439 -8.093 4.278 362 HB ILE 44 HB ILE 44 0.154 -6.104 5.850 363 HG12 ILE 44 HG12 ILE 44 1.783 -6.752 3.917 364 HG13 ILE 44 HG11 ILE 44 0.357 -7.484 3.190 365 HG21 ILE 44 HG21 ILE 44 0.682 -8.163 7.001 366 HG22 ILE 44 HG22 ILE 44 2.049 -7.663 6.003 367 HG23 ILE 44 HG23 ILE 44 0.996 -8.971 5.465 368 HD11 ILE 44 HD11 ILE 44 -0.775 -5.329 3.224 369 HD12 ILE 44 HD12 ILE 44 0.751 -5.239 2.345 370 HD13 ILE 44 HD13 ILE 44 0.639 -4.594 3.982 371 H PHE 45 HN PHE 45 -1.467 -10.030 5.266 372 HA PHE 45 HA PHE 45 -1.997 -10.113 8.158 373 HB2 PHE 45 HB2 PHE 45 -4.079 -10.550 6.841 374 HB3 PHE 45 HB1 PHE 45 -3.272 -11.923 6.093 375 HD1 PHE 45 HD1 PHE 45 -4.124 -10.577 9.464 376 HD2 PHE 45 HD2 PHE 45 -3.541 -14.017 7.022 377 HE1 PHE 45 HE1 PHE 45 -4.852 -12.017 11.317 378 HE2 PHE 45 HE2 PHE 45 -4.272 -15.460 8.875 379 HZ PHE 45 HZ PHE 45 -4.927 -14.460 11.030 380 H ALA 46 HN ALA 46 -0.341 -11.051 9.087 381 HA ALA 46 HA ALA 46 1.357 -12.460 9.589 382 HB1 ALA 46 HB1 ALA 46 1.235 -14.770 8.828 383 HB2 ALA 46 HB2 ALA 46 0.018 -14.322 7.633 384 HB3 ALA 46 HB3 ALA 46 -0.346 -14.193 9.354 385 H GLY 47 HN GLY 47 1.476 -10.613 7.211 386 HA2 GLY 47 HA2 GLY 47 3.542 -10.036 6.162 387 HA3 GLY 47 HA1 GLY 47 3.953 -11.742 6.118 388 H LYS 48 HN LYS 48 0.918 -11.929 5.170 389 HA LYS 48 HA LYS 48 1.642 -11.703 2.332 390 HB2 LYS 48 HB2 LYS 48 -0.797 -13.089 3.433 391 HB3 LYS 48 HB1 LYS 48 -0.038 -13.314 1.867 392 HG2 LYS 48 HG2 LYS 48 1.932 -14.293 3.041 393 HG3 LYS 48 HG1 LYS 48 1.008 -14.204 4.543 394 HD2 LYS 48 HD2 LYS 48 0.228 -15.743 2.065 395 HD3 LYS 48 HD1 LYS 48 0.876 -16.436 3.551 396 HE2 LYS 48 HE2 LYS 48 -1.068 -15.642 4.784 397 HE3 LYS 48 HE1 LYS 48 -1.711 -14.908 3.316 398 HZ1 LYS 48 HZ1 LYS 48 -1.902 -17.085 2.327 399 HZ2 LYS 48 HZ2 LYS 48 -2.730 -17.057 3.801 400 HZ3 LYS 48 HZ3 LYS 48 -1.220 -17.809 3.695 401 H GLN 49 HN GLN 49 0.511 -10.437 0.929 402 HA GLN 49 HA GLN 49 -1.173 -8.393 2.047 403 HB2 GLN 49 HB2 GLN 49 0.377 -7.850 0.236 404 HB3 GLN 49 HB1 GLN 49 -0.428 -8.994 -0.824 405 HG2 GLN 49 HG2 GLN 49 -2.480 -7.632 -0.686 406 HG3 GLN 49 HG1 GLN 49 -1.611 -6.468 0.307 407 HE21 GLN 49 HE21 GLN 49 -0.088 -8.126 -2.358 408 HE22 GLN 49 HE22 GLN 49 0.029 -6.749 -3.396 409 H LEU 50 HN LEU 50 -3.358 -8.139 1.815 410 HA LEU 50 HA LEU 50 -4.828 -10.525 0.993 411 HB2 LEU 50 HB2 LEU 50 -5.937 -8.036 2.282 412 HB3 LEU 50 HB1 LEU 50 -6.695 -9.611 2.181 413 HG LEU 50 HG LEU 50 -4.318 -8.863 3.874 414 HD11 LEU 50 HD11 LEU 50 -7.088 -9.788 4.611 415 HD12 LEU 50 HD12 LEU 50 -6.492 -8.134 4.731 416 HD13 LEU 50 HD13 LEU 50 -5.783 -9.400 5.732 417 HD21 LEU 50 HD21 LEU 50 -4.504 -11.194 4.725 418 HD22 LEU 50 HD22 LEU 50 -3.926 -11.073 3.064 419 HD23 LEU 50 HD23 LEU 50 -5.595 -11.544 3.386 420 H GLU 51 HN GLU 51 -6.091 -10.612 -0.764 421 HA GLU 51 HA GLU 51 -6.055 -8.343 -2.586 422 HB2 GLU 51 HB2 GLU 51 -7.271 -11.070 -3.037 423 HB3 GLU 51 HB1 GLU 51 -6.859 -9.873 -4.255 424 HG2 GLU 51 HG2 GLU 51 -4.716 -10.506 -4.330 425 HG3 GLU 51 HG1 GLU 51 -4.609 -10.704 -2.578 426 H ASP 52 HN ASP 52 -7.902 -7.415 -3.482 427 HA ASP 52 HA ASP 52 -9.989 -6.837 -1.733 428 HB2 ASP 52 HB2 ASP 52 -9.525 -6.411 -4.648 429 HB3 ASP 52 HB1 ASP 52 -11.131 -6.103 -3.998 430 H GLY 53 HN GLY 53 -9.977 -9.005 -4.542 431 HA2 GLY 53 HA2 GLY 53 -12.718 -9.805 -4.083 432 HA3 GLY 53 HA1 GLY 53 -11.662 -10.382 -5.358 433 H ARG 54 HN ARG 54 -11.323 -10.467 -1.818 434 HA ARG 54 HA ARG 54 -11.526 -13.393 -1.888 435 HB2 ARG 54 HB2 ARG 54 -9.282 -11.918 -0.485 436 HB3 ARG 54 HB1 ARG 54 -9.545 -13.654 -0.474 437 HG2 ARG 54 HG2 ARG 54 -9.024 -12.128 -3.001 438 HG3 ARG 54 HG1 ARG 54 -7.725 -12.761 -1.993 439 HD2 ARG 54 HD2 ARG 54 -8.737 -15.025 -2.228 440 HD3 ARG 54 HD1 ARG 54 -9.888 -14.336 -3.374 441 HE ARG 54 HE ARG 54 -7.205 -13.722 -4.115 442 HH11 ARG 54 HH11 ARG 54 -9.538 -16.349 -4.147 443 HH12 ARG 54 HH12 ARG 54 -8.834 -17.113 -5.534 444 HH21 ARG 54 HH21 ARG 54 -6.296 -14.721 -5.923 445 HH22 ARG 54 HH22 ARG 54 -6.992 -16.182 -6.555 446 H THR 55 HN THR 55 -11.930 -14.305 0.250 447 HA THR 55 HA THR 55 -13.358 -12.381 1.953 448 HB THR 55 HB THR 55 -14.462 -14.400 2.931 449 HG1 THR 55 HG1 THR 55 -12.919 -15.689 0.900 450 HG21 THR 55 HG21 THR 55 -14.706 -14.092 -0.064 451 HG22 THR 55 HG22 THR 55 -15.556 -13.140 1.152 452 HG23 THR 55 HG23 THR 55 -15.895 -14.862 0.987 453 H LEU 56 HN LEU 56 -13.382 -13.132 4.363 454 HA LEU 56 HA LEU 56 -10.720 -12.986 5.311 455 HB2 LEU 56 HB2 LEU 56 -13.264 -13.688 6.775 456 HB3 LEU 56 HB1 LEU 56 -11.734 -13.313 7.545 457 HG LEU 56 HG LEU 56 -13.216 -11.382 5.764 458 HD11 LEU 56 HD11 LEU 56 -13.200 -11.545 8.772 459 HD12 LEU 56 HD12 LEU 56 -14.569 -11.922 7.726 460 HD13 LEU 56 HD13 LEU 56 -13.945 -10.274 7.804 461 HD21 LEU 56 HD21 LEU 56 -11.756 -9.727 6.886 462 HD22 LEU 56 HD22 LEU 56 -10.860 -10.903 5.925 463 HD23 LEU 56 HD23 LEU 56 -10.913 -11.057 7.682 464 H SER 57 HN SER 57 -12.993 -15.634 4.910 465 HA SER 57 HA SER 57 -11.437 -17.576 6.279 466 HB2 SER 57 HB2 SER 57 -13.449 -18.153 4.111 467 HB3 SER 57 HB1 SER 57 -13.023 -19.154 5.501 468 HG SER 57 HG SER 57 -15.046 -17.708 5.475 469 H ASP 58 HN ASP 58 -11.104 -16.070 3.259 470 HA ASP 58 HA ASP 58 -9.914 -18.185 1.777 471 HB2 ASP 58 HB2 ASP 58 -10.194 -15.252 1.467 472 HB3 ASP 58 HB1 ASP 58 -8.821 -15.983 0.644 473 H TYR 59 HN TYR 59 -8.801 -16.043 4.227 474 HA TYR 59 HA TYR 59 -6.041 -16.960 3.786 475 HB2 TYR 59 HB2 TYR 59 -6.994 -14.427 5.132 476 HB3 TYR 59 HB1 TYR 59 -5.313 -14.927 4.983 477 HD1 TYR 59 HD1 TYR 59 -4.280 -15.056 2.696 478 HD2 TYR 59 HD2 TYR 59 -8.111 -13.329 3.367 479 HE1 TYR 59 HE1 TYR 59 -4.143 -13.917 0.519 480 HE2 TYR 59 HE2 TYR 59 -7.983 -12.189 1.195 481 HH TYR 59 HH TYR 59 -5.507 -12.898 -1.123 482 H ASN 60 HN ASN 60 -8.499 -17.931 5.392 483 HA ASN 60 HA ASN 60 -8.899 -19.057 7.317 484 HB2 ASN 60 HB2 ASN 60 -5.878 -19.111 7.360 485 HB3 ASN 60 HB1 ASN 60 -6.865 -19.937 8.562 486 HD21 ASN 60 HD21 ASN 60 -5.737 -19.935 5.297 487 HD22 ASN 60 HD22 ASN 60 -6.368 -21.482 4.859 488 H ILE 61 HN ILE 61 -8.829 -16.157 7.399 489 HA ILE 61 HA ILE 61 -7.624 -15.352 9.864 490 HB ILE 61 HB ILE 61 -9.758 -13.965 8.225 491 HG12 ILE 61 HG12 ILE 61 -6.767 -13.521 8.303 492 HG13 ILE 61 HG11 ILE 61 -7.619 -14.379 7.026 493 HG21 ILE 61 HG21 ILE 61 -9.093 -11.942 9.433 494 HG22 ILE 61 HG22 ILE 61 -7.966 -12.889 10.404 495 HG23 ILE 61 HG23 ILE 61 -9.701 -13.176 10.536 496 HD11 ILE 61 HD11 ILE 61 -7.967 -11.480 7.749 497 HD12 ILE 61 HD12 ILE 61 -8.845 -12.336 6.482 498 HD13 ILE 61 HD13 ILE 61 -7.100 -12.117 6.350 499 H GLN 62 HN GLN 62 -8.377 -15.688 11.828 500 HA GLN 62 HA GLN 62 -11.157 -16.585 12.144 501 HB2 GLN 62 HB2 GLN 62 -8.913 -16.835 14.154 502 HB3 GLN 62 HB1 GLN 62 -10.463 -17.665 14.166 503 HG2 GLN 62 HG2 GLN 62 -9.801 -18.863 12.116 504 HG3 GLN 62 HG1 GLN 62 -8.222 -18.084 12.201 505 HE21 GLN 62 HE21 GLN 62 -6.800 -18.662 13.859 506 HE22 GLN 62 HE22 GLN 62 -6.990 -20.128 14.757 507 H LYS 63 HN LYS 63 -11.544 -16.117 14.801 508 HA LYS 63 HA LYS 63 -12.033 -13.288 14.805 509 HB2 LYS 63 HB2 LYS 63 -13.140 -13.704 16.976 510 HB3 LYS 63 HB1 LYS 63 -13.731 -14.767 15.709 511 HG2 LYS 63 HG2 LYS 63 -12.320 -16.573 16.578 512 HG3 LYS 63 HG1 LYS 63 -11.759 -15.499 17.859 513 HD2 LYS 63 HD2 LYS 63 -14.012 -15.312 18.730 514 HD3 LYS 63 HD1 LYS 63 -14.634 -16.296 17.404 515 HE2 LYS 63 HE2 LYS 63 -13.306 -18.189 18.185 516 HE3 LYS 63 HE1 LYS 63 -12.662 -17.209 19.500 517 HZ1 LYS 63 HZ1 LYS 63 -14.453 -18.608 20.269 518 HZ2 LYS 63 HZ2 LYS 63 -15.511 -17.960 19.122 519 HZ3 LYS 63 HZ3 LYS 63 -14.916 -16.984 20.368 520 H GLU 64 HN GLU 64 -11.272 -11.786 16.296 521 HA GLU 64 HA GLU 64 -9.765 -10.712 17.589 522 HB2 GLU 64 HB2 GLU 64 -9.221 -13.497 18.616 523 HB3 GLU 64 HB1 GLU 64 -8.468 -12.053 19.281 524 HG2 GLU 64 HG2 GLU 64 -10.740 -11.169 19.766 525 HG3 GLU 64 HG1 GLU 64 -11.402 -12.718 19.244 526 H SER 65 HN SER 65 -8.991 -12.231 14.956 527 HA SER 65 HA SER 65 -6.157 -12.522 15.182 528 HB2 SER 65 HB2 SER 65 -7.970 -12.330 12.767 529 HB3 SER 65 HB1 SER 65 -6.243 -12.675 12.679 530 HG SER 65 HG SER 65 -7.412 -14.309 14.468 531 H THR 66 HN THR 66 -4.547 -11.146 14.339 532 HA THR 66 HA THR 66 -5.366 -8.334 14.314 533 HB THR 66 HB THR 66 -2.523 -9.288 14.443 534 HG1 THR 66 HG1 THR 66 -4.486 -9.745 16.260 535 HG21 THR 66 HG21 THR 66 -2.925 -6.892 14.102 536 HG22 THR 66 HG22 THR 66 -2.216 -7.196 15.689 537 HG23 THR 66 HG23 THR 66 -3.941 -6.855 15.546 538 H LEU 67 HN LEU 67 -5.488 -7.299 12.465 539 HA LEU 67 HA LEU 67 -4.038 -8.326 10.116 540 HB2 LEU 67 HB2 LEU 67 -6.530 -6.672 10.433 541 HB3 LEU 67 HB1 LEU 67 -5.644 -6.676 8.920 542 HG LEU 67 HG LEU 67 -5.920 -9.240 8.993 543 HD11 LEU 67 HD11 LEU 67 -7.924 -10.009 10.185 544 HD12 LEU 67 HD12 LEU 67 -8.067 -8.427 10.948 545 HD13 LEU 67 HD13 LEU 67 -6.669 -9.446 11.291 546 HD21 LEU 67 HD21 LEU 67 -8.317 -7.460 8.576 547 HD22 LEU 67 HD22 LEU 67 -8.103 -9.082 7.919 548 HD23 LEU 67 HD23 LEU 67 -7.042 -7.774 7.397 549 H HIS 68 HN HIS 68 -2.696 -6.952 8.930 550 HA HIS 68 HA HIS 68 -1.920 -4.510 10.363 551 HB2 HIS 68 HB2 HIS 68 -0.377 -6.066 8.277 552 HB3 HIS 68 HB1 HIS 68 0.227 -4.720 9.237 553 HD2 HIS 68 HD2 HIS 68 0.143 -5.384 12.140 554 HE1 HIS 68 HE1 HIS 68 0.937 -9.443 11.245 555 HE2 HIS 68 HE2 HIS 68 0.732 -7.721 13.092 556 H LEU 69 HN LEU 69 -2.495 -2.618 9.543 557 HA LEU 69 HA LEU 69 -3.304 -2.483 6.728 558 HB2 LEU 69 HB2 LEU 69 -4.911 -1.701 8.420 559 HB3 LEU 69 HB1 LEU 69 -3.746 -0.514 8.975 560 HG LEU 69 HG LEU 69 -3.841 0.571 6.735 561 HD11 LEU 69 HD11 LEU 69 -5.771 -0.020 5.279 562 HD12 LEU 69 HD12 LEU 69 -6.012 -1.463 6.266 563 HD13 LEU 69 HD13 LEU 69 -4.517 -1.259 5.353 564 HD21 LEU 69 HD21 LEU 69 -6.396 0.291 8.306 565 HD22 LEU 69 HD22 LEU 69 -6.167 1.473 7.018 566 HD23 LEU 69 HD23 LEU 69 -5.158 1.538 8.462 567 H VAL 70 HN VAL 70 -1.787 -1.890 5.363 568 HA VAL 70 HA VAL 70 0.254 0.044 6.230 569 HB VAL 70 HB VAL 70 0.317 -1.906 3.916 570 HG11 VAL 70 HG11 VAL 70 2.390 0.016 4.949 571 HG12 VAL 70 HG12 VAL 70 1.648 -0.018 3.350 572 HG13 VAL 70 HG13 VAL 70 2.742 -1.312 3.841 573 HG21 VAL 70 HG21 VAL 70 0.441 -3.054 6.047 574 HG22 VAL 70 HG22 VAL 70 1.747 -1.989 6.569 575 HG23 VAL 70 HG23 VAL 70 2.000 -3.105 5.226 576 H LEU 71 HN LEU 71 0.635 1.887 5.023 577 HA LEU 71 HA LEU 71 -1.481 2.611 3.149 578 HB2 LEU 71 HB2 LEU 71 0.590 4.283 4.579 579 HB3 LEU 71 HB1 LEU 71 -0.559 4.926 3.419 580 HG LEU 71 HG LEU 71 -1.266 3.612 6.049 581 HD11 LEU 71 HD11 LEU 71 -1.327 6.500 5.186 582 HD12 LEU 71 HD12 LEU 71 -0.275 5.782 6.406 583 HD13 LEU 71 HD13 LEU 71 -2.012 5.871 6.686 584 HD21 LEU 71 HD21 LEU 71 -3.547 4.465 5.533 585 HD22 LEU 71 HD22 LEU 71 -3.001 3.189 4.444 586 HD23 LEU 71 HD23 LEU 71 -2.981 4.872 3.914 587 H ARG 72 HN ARG 72 -0.501 4.326 1.446 588 HA ARG 72 HA ARG 72 2.020 3.397 0.339 589 HB2 ARG 72 HB2 ARG 72 0.375 1.803 -0.557 590 HB3 ARG 72 HB1 ARG 72 -0.601 3.126 -1.166 591 HG2 ARG 72 HG2 ARG 72 1.134 3.737 -2.734 592 HG3 ARG 72 HG1 ARG 72 2.197 2.490 -2.077 593 HD2 ARG 72 HD2 ARG 72 0.360 0.837 -2.679 594 HD3 ARG 72 HD1 ARG 72 -0.357 2.146 -3.617 595 HE ARG 72 HE ARG 72 2.404 1.253 -4.124 596 HH11 ARG 72 HH11 ARG 72 -0.872 1.818 -5.216 597 HH12 ARG 72 HH12 ARG 72 -0.513 1.524 -6.887 598 HH21 ARG 72 HH21 ARG 72 2.894 0.815 -6.323 599 HH22 ARG 72 HH22 ARG 72 1.628 0.945 -7.517 600 H LEU 73 HN LEU 73 2.957 4.876 -1.063 601 HA LEU 73 HA LEU 73 1.435 7.334 -1.602 602 HB2 LEU 73 HB2 LEU 73 4.169 7.067 -0.385 603 HB3 LEU 73 HB1 LEU 73 3.721 8.507 -1.275 604 HG LEU 73 HG LEU 73 1.663 8.491 0.388 605 HD11 LEU 73 HD11 LEU 73 2.602 6.290 1.358 606 HD12 LEU 73 HD12 LEU 73 2.003 7.530 2.459 607 HD13 LEU 73 HD13 LEU 73 3.738 7.343 2.202 608 HD21 LEU 73 HD21 LEU 73 3.266 10.298 0.158 609 HD22 LEU 73 HD22 LEU 73 4.437 9.405 1.127 610 HD23 LEU 73 HD23 LEU 73 2.941 9.977 1.861 611 H ARG 74 HN ARG 74 2.407 8.638 -3.368 612 HA ARG 74 HA ARG 74 3.755 6.887 -5.322 613 HB2 ARG 74 HB2 ARG 74 1.682 9.039 -5.761 614 HB3 ARG 74 HB1 ARG 74 2.620 8.323 -7.063 615 HG2 ARG 74 HG2 ARG 74 1.693 6.125 -6.517 616 HG3 ARG 74 HG1 ARG 74 0.740 6.858 -5.225 617 HD2 ARG 74 HD2 ARG 74 -0.386 8.276 -6.882 618 HD3 ARG 74 HD1 ARG 74 0.542 7.503 -8.164 619 HE ARG 74 HE ARG 74 -1.036 5.725 -6.497 620 HH11 ARG 74 HH11 ARG 74 -0.832 7.564 -9.459 621 HH12 ARG 74 HH12 ARG 74 -2.110 6.696 -10.243 622 HH21 ARG 74 HH21 ARG 74 -2.707 4.544 -7.541 623 HH22 ARG 74 HH22 ARG 74 -3.159 4.966 -9.162 624 H GLY 75 HN GLY 75 4.431 9.264 -3.294 625 HA2 GLY 75 HA2 GLY 75 6.588 10.255 -4.958 626 HA3 GLY 75 HA1 GLY 75 5.428 11.470 -4.442 627 H GLY 76 HN GLY 76 8.365 10.406 -3.779 628 HA2 GLY 76 HA2 GLY 76 8.624 11.687 -1.324 629 HA3 GLY 76 HA1 GLY 76 8.382 9.974 -0.991 630 H1 SER 453 HT1 SER 453 21.415 10.052 15.463 631 H2 SER 453 HT2 SER 453 22.479 8.907 16.109 632 H3 SER 453 HT3 SER 453 22.457 10.482 16.719 633 HA SER 453 HA SER 453 21.350 8.871 18.171 634 HB2 SER 453 HB2 SER 453 19.224 10.727 17.196 635 HB3 SER 453 HB1 SER 453 19.803 10.443 18.839 636 HG SER 453 HG SER 453 20.515 12.370 17.133 637 H ASN 454 HN ASN 454 19.105 9.718 15.522 638 HA ASN 454 HA ASN 454 17.510 8.528 14.427 639 HB2 ASN 454 HB2 ASN 454 19.594 6.416 14.909 640 HB3 ASN 454 HB1 ASN 454 18.081 6.017 14.104 641 HD21 ASN 454 HD21 ASN 454 19.446 5.447 12.311 642 HD22 ASN 454 HD22 ASN 454 19.999 6.681 11.235 643 H SER 455 HN SER 455 17.317 8.847 17.341 644 HA SER 455 HA SER 455 16.395 6.568 18.643 645 HB2 SER 455 HB2 SER 455 15.158 9.197 19.288 646 HB3 SER 455 HB1 SER 455 15.869 7.992 20.363 647 HG SER 455 HG SER 455 17.604 9.157 20.318 648 H GLN 456 HN GLN 456 14.425 9.144 17.135 649 HA GLN 456 HA GLN 456 11.996 7.739 17.486 650 HB2 GLN 456 HB2 GLN 456 12.751 10.064 15.728 651 HB3 GLN 456 HB1 GLN 456 11.121 9.406 15.782 652 HG2 GLN 456 HG2 GLN 456 12.652 10.652 18.051 653 HG3 GLN 456 HG1 GLN 456 11.229 11.296 17.238 654 HE21 GLN 456 HE21 GLN 456 11.749 10.592 20.070 655 HE22 GLN 456 HE22 GLN 456 10.486 9.496 20.505 656 H LEU 457 HN LEU 457 14.386 7.746 14.947 657 HA LEU 457 HA LEU 457 12.799 6.521 12.948 658 HB2 LEU 457 HB2 LEU 457 15.792 6.397 13.327 659 HB3 LEU 457 HB1 LEU 457 14.931 5.949 11.868 660 HG LEU 457 HG LEU 457 15.201 8.719 13.041 661 HD11 LEU 457 HD11 LEU 457 16.357 9.196 10.943 662 HD12 LEU 457 HD12 LEU 457 16.163 7.514 10.450 663 HD13 LEU 457 HD13 LEU 457 17.164 7.914 11.846 664 HD21 LEU 457 HD21 LEU 457 13.622 7.815 10.634 665 HD22 LEU 457 HD22 LEU 457 13.930 9.490 11.091 666 HD23 LEU 457 HD23 LEU 457 12.960 8.454 12.139 667 H ASN 458 HN ASN 458 14.987 5.249 15.414 668 HA ASN 458 HA ASN 458 14.784 2.528 14.721 669 HB2 ASN 458 HB2 ASN 458 16.455 3.663 16.296 670 HB3 ASN 458 HB1 ASN 458 15.198 3.579 17.522 671 HD21 ASN 458 HD21 ASN 458 17.895 2.288 17.200 672 HD22 ASN 458 HD22 ASN 458 17.599 0.604 17.450 673 H ALA 459 HN ALA 459 12.914 4.568 16.911 674 HA ALA 459 HA ALA 459 11.277 2.553 17.992 675 HB1 ALA 459 HB1 ALA 459 11.494 4.764 19.001 676 HB2 ALA 459 HB2 ALA 459 9.804 4.376 18.684 677 HB3 ALA 459 HB3 ALA 459 10.669 5.485 17.620 678 H MET 460 HN MET 460 10.815 4.707 15.207 679 HA MET 460 HA MET 460 8.224 3.768 14.551 680 HB2 MET 460 HB2 MET 460 10.314 5.299 13.025 681 HB3 MET 460 HB1 MET 460 8.842 4.756 12.234 682 HG2 MET 460 HG2 MET 460 7.581 5.940 14.083 683 HG3 MET 460 HG1 MET 460 9.121 6.678 14.516 684 HE1 MET 460 HE1 MET 460 9.985 8.814 11.385 685 HE2 MET 460 HE2 MET 460 10.556 7.196 11.788 686 HE3 MET 460 HE3 MET 460 10.412 8.418 13.051 687 H ALA 461 HN ALA 461 11.461 2.782 13.574 688 HA ALA 461 HA ALA 461 10.718 1.020 11.512 689 HB1 ALA 461 HB1 ALA 461 13.110 0.877 13.347 690 HB2 ALA 461 HB2 ALA 461 13.021 1.755 11.819 691 HB3 ALA 461 HB3 ALA 461 12.920 -0.006 11.832 692 H HIS 462 HN HIS 462 11.000 0.596 15.000 693 HA HIS 462 HA HIS 462 10.664 -2.198 15.068 694 HB2 HIS 462 HB2 HIS 462 11.401 -0.580 16.949 695 HB3 HIS 462 HB1 HIS 462 9.680 -0.374 17.249 696 HD2 HIS 462 HD2 HIS 462 10.560 -3.960 16.300 697 HE1 HIS 462 HE1 HIS 462 10.327 -3.782 20.520 698 HE2 HIS 462 HE2 HIS 462 10.336 -5.313 18.499 699 H GLN 463 HN GLN 463 8.391 0.471 14.931 700 HA GLN 463 HA GLN 463 6.049 -0.991 15.498 701 HB2 GLN 463 HB2 GLN 463 6.122 1.474 15.495 702 HB3 GLN 463 HB1 GLN 463 6.375 1.464 13.756 703 HG2 GLN 463 HG2 GLN 463 4.076 1.978 14.251 704 HG3 GLN 463 HG1 GLN 463 4.180 0.408 13.454 705 HE21 GLN 463 HE21 GLN 463 3.751 -1.466 14.647 706 HE22 GLN 463 HE22 GLN 463 2.928 -1.406 16.166 707 H ILE 464 HN ILE 464 7.804 -0.329 12.514 708 HA ILE 464 HA ILE 464 5.950 -1.600 10.769 709 HB ILE 464 HB ILE 464 8.899 -1.059 10.369 710 HG12 ILE 464 HG12 ILE 464 6.482 0.519 9.459 711 HG13 ILE 464 HG11 ILE 464 7.516 0.955 10.815 712 HG21 ILE 464 HG21 ILE 464 8.377 -1.248 7.960 713 HG22 ILE 464 HG22 ILE 464 6.746 -1.769 8.379 714 HG23 ILE 464 HG23 ILE 464 8.130 -2.763 8.832 715 HD11 ILE 464 HD11 ILE 464 8.086 2.258 8.879 716 HD12 ILE 464 HD12 ILE 464 8.322 0.795 7.923 717 HD13 ILE 464 HD13 ILE 464 9.411 1.160 9.262 718 H GLN 465 HN GLN 465 8.805 -2.648 12.534 719 HA GLN 465 HA GLN 465 9.140 -5.182 11.388 720 HB2 GLN 465 HB2 GLN 465 10.707 -3.966 12.978 721 HB3 GLN 465 HB1 GLN 465 9.661 -4.502 14.285 722 HG2 GLN 465 HG2 GLN 465 11.482 -6.009 14.163 723 HG3 GLN 465 HG1 GLN 465 10.063 -6.849 13.540 724 HE21 GLN 465 HE21 GLN 465 11.182 -8.293 12.299 725 HE22 GLN 465 HE22 GLN 465 12.064 -7.837 10.880 726 H GLU 466 HN GLU 466 6.899 -3.995 13.771 727 HA GLU 466 HA GLU 466 6.032 -6.580 14.647 728 HB2 GLU 466 HB2 GLU 466 5.114 -3.771 15.084 729 HB3 GLU 466 HB1 GLU 466 4.040 -5.101 15.509 730 HG2 GLU 466 HG2 GLU 466 6.862 -4.833 16.513 731 HG3 GLU 466 HG1 GLU 466 5.441 -4.254 17.384 732 H MET 467 HN MET 467 5.325 -4.545 11.998 733 HA MET 467 HA MET 467 2.769 -5.827 11.433 734 HB2 MET 467 HB2 MET 467 4.216 -3.864 9.659 735 HB3 MET 467 HB1 MET 467 2.498 -4.227 9.696 736 HG2 MET 467 HG2 MET 467 3.918 -2.968 12.015 737 HG3 MET 467 HG1 MET 467 3.244 -2.021 10.694 738 HE1 MET 467 HE1 MET 467 0.641 -2.868 9.853 739 HE2 MET 467 HE2 MET 467 0.799 -1.267 10.571 740 HE3 MET 467 HE3 MET 467 -0.522 -2.327 11.062 741 H PHE 468 HN PHE 468 6.035 -5.575 10.122 742 HA PHE 468 HA PHE 468 5.455 -7.842 8.330 743 HB2 PHE 468 HB2 PHE 468 7.252 -5.460 8.066 744 HB3 PHE 468 HB1 PHE 468 7.665 -6.948 7.224 745 HD1 PHE 468 HD1 PHE 468 4.236 -5.680 7.779 746 HD2 PHE 468 HD2 PHE 468 7.426 -6.211 5.023 747 HE1 PHE 468 HE1 PHE 468 2.736 -5.052 5.934 748 HE2 PHE 468 HE2 PHE 468 5.936 -5.583 3.170 749 HZ PHE 468 HZ PHE 468 3.584 -5.004 3.632 750 HA PRO 469 HA PRO 469 8.415 -9.602 11.313 751 HB2 PRO 469 HB2 PRO 469 7.350 -12.067 11.415 752 HB3 PRO 469 HB1 PRO 469 6.603 -10.704 12.268 753 HG2 PRO 469 HG2 PRO 469 5.802 -11.989 9.712 754 HG3 PRO 469 HG1 PRO 469 4.796 -11.361 11.031 755 HD2 PRO 469 HD2 PRO 469 5.331 -10.009 8.678 756 HD3 PRO 469 HD1 PRO 469 4.797 -9.252 10.190 757 H GLN 470 HN GLN 470 8.042 -9.885 8.059 758 HA GLN 470 HA GLN 470 9.959 -12.104 7.827 759 HB2 GLN 470 HB2 GLN 470 9.131 -12.579 5.703 760 HB3 GLN 470 HB1 GLN 470 7.688 -12.111 6.588 761 HG2 GLN 470 HG2 GLN 470 9.145 -10.009 5.080 762 HG3 GLN 470 HG1 GLN 470 8.212 -11.196 4.171 763 HE21 GLN 470 HE21 GLN 470 6.758 -9.670 3.455 764 HE22 GLN 470 HE22 GLN 470 5.569 -8.964 4.493 765 H VAL 471 HN VAL 471 10.020 -8.857 8.034 766 HA VAL 471 HA VAL 471 12.111 -8.556 5.994 767 HB VAL 471 HB VAL 471 10.184 -6.993 5.835 768 HG11 VAL 471 HG11 VAL 471 9.953 -5.179 7.448 769 HG12 VAL 471 HG12 VAL 471 11.206 -5.904 8.454 770 HG13 VAL 471 HG13 VAL 471 9.676 -6.747 8.202 771 HG21 VAL 471 HG21 VAL 471 12.302 -6.339 4.885 772 HG22 VAL 471 HG22 VAL 471 12.852 -5.731 6.445 773 HG23 VAL 471 HG23 VAL 471 11.521 -4.932 5.609 774 HA PRO 472 HA PRO 472 15.124 -8.449 9.277 775 HB2 PRO 472 HB2 PRO 472 16.828 -7.017 7.339 776 HB3 PRO 472 HB1 PRO 472 17.091 -8.586 8.121 777 HG2 PRO 472 HG2 PRO 472 16.510 -8.397 5.529 778 HG3 PRO 472 HG1 PRO 472 15.926 -9.740 6.533 779 HD2 PRO 472 HD2 PRO 472 14.450 -7.327 5.570 780 HD3 PRO 472 HD1 PRO 472 13.905 -9.011 5.712 781 H TYR 473 HN TYR 473 15.602 -7.019 10.835 782 HA TYR 473 HA TYR 473 14.422 -4.499 10.951 783 HB2 TYR 473 HB2 TYR 473 15.384 -6.100 12.806 784 HB3 TYR 473 HB1 TYR 473 16.832 -5.121 12.612 785 HD1 TYR 473 HD2 TYR 473 13.291 -5.071 13.598 786 HD2 TYR 473 HD1 TYR 473 16.930 -2.888 13.478 787 HE1 TYR 473 HE2 TYR 473 12.332 -3.410 15.133 788 HE2 TYR 473 HE1 TYR 473 15.985 -1.215 15.012 789 HH TYR 473 HH TYR 473 13.961 -0.412 15.849 790 H HIS 474 HN HIS 474 17.708 -5.428 10.040 791 HA HIS 474 HA HIS 474 18.748 -2.796 10.031 792 HB2 HIS 474 HB2 HIS 474 20.683 -3.690 8.921 793 HB3 HIS 474 HB1 HIS 474 20.161 -4.838 10.144 794 HD2 HIS 474 HD2 HIS 474 20.387 -4.518 6.264 795 HE1 HIS 474 HE1 HIS 474 19.617 -8.544 7.301 796 HE2 HIS 474 HE2 HIS 474 20.373 -6.985 5.457 797 H LEU 475 HN LEU 475 16.792 -4.510 7.755 798 HA LEU 475 HA LEU 475 17.485 -2.761 5.555 799 HB2 LEU 475 HB2 LEU 475 15.477 -4.977 5.884 800 HB3 LEU 475 HB1 LEU 475 15.469 -3.939 4.472 801 HG LEU 475 HG LEU 475 17.660 -5.822 5.337 802 HD11 LEU 475 HD11 LEU 475 15.712 -6.797 4.170 803 HD12 LEU 475 HD12 LEU 475 17.214 -6.940 3.259 804 HD13 LEU 475 HD13 LEU 475 16.025 -5.718 2.812 805 HD21 LEU 475 HD21 LEU 475 18.811 -3.929 4.531 806 HD22 LEU 475 HD22 LEU 475 17.652 -3.686 3.225 807 HD23 LEU 475 HD23 LEU 475 18.750 -5.065 3.183 808 H VAL 476 HN VAL 476 15.026 -3.053 8.008 809 HA VAL 476 HA VAL 476 13.199 -1.173 6.917 810 HB VAL 476 HB VAL 476 13.563 -1.805 9.852 811 HG11 VAL 476 HG11 VAL 476 11.190 -1.245 10.006 812 HG12 VAL 476 HG12 VAL 476 11.159 -0.888 8.278 813 HG13 VAL 476 HG13 VAL 476 12.126 0.105 9.368 814 HG21 VAL 476 HG21 VAL 476 11.945 -3.288 7.785 815 HG22 VAL 476 HG22 VAL 476 11.857 -3.554 9.527 816 HG23 VAL 476 HG23 VAL 476 13.353 -3.895 8.654 817 H LEU 477 HN LEU 477 15.839 -0.960 9.256 818 HA LEU 477 HA LEU 477 15.584 1.785 9.840 819 HB2 LEU 477 HB2 LEU 477 17.852 -0.172 10.040 820 HB3 LEU 477 HB1 LEU 477 18.097 1.523 10.415 821 HG LEU 477 HG LEU 477 16.036 -0.203 11.786 822 HD11 LEU 477 HD11 LEU 477 17.619 -0.268 13.672 823 HD12 LEU 477 HD12 LEU 477 18.836 0.501 12.653 824 HD13 LEU 477 HD13 LEU 477 18.233 -1.106 12.247 825 HD21 LEU 477 HD21 LEU 477 17.168 2.532 12.351 826 HD22 LEU 477 HD22 LEU 477 16.178 1.618 13.487 827 HD23 LEU 477 HD23 LEU 477 15.502 2.124 11.938 828 H GLN 478 HN GLN 478 16.958 0.088 7.166 829 HA GLN 478 HA GLN 478 18.681 2.083 6.166 830 HB2 GLN 478 HB2 GLN 478 18.747 -0.255 5.409 831 HB3 GLN 478 HB1 GLN 478 17.155 -0.075 4.693 832 HG2 GLN 478 HG2 GLN 478 18.208 1.784 3.286 833 HG3 GLN 478 HG1 GLN 478 19.752 1.114 3.807 834 HE21 GLN 478 HE21 GLN 478 16.812 -0.703 3.136 835 HE22 GLN 478 HE22 GLN 478 17.433 -1.546 1.761 836 H ASP 479 HN ASP 479 15.345 1.223 5.251 837 HA ASP 479 HA ASP 479 15.029 3.427 3.484 838 HB2 ASP 479 HB2 ASP 479 13.711 1.226 3.508 839 HB3 ASP 479 HB1 ASP 479 12.761 1.952 4.799 840 H LEU 480 HN LEU 480 14.403 2.925 6.891 841 HA LEU 480 HA LEU 480 12.743 5.124 7.390 842 HB2 LEU 480 HB2 LEU 480 14.226 3.208 8.925 843 HB3 LEU 480 HB1 LEU 480 14.465 4.801 9.614 844 HG LEU 480 HG LEU 480 12.613 3.634 10.695 845 HD11 LEU 480 HD11 LEU 480 11.786 5.996 9.016 846 HD12 LEU 480 HD12 LEU 480 12.475 6.030 10.638 847 HD13 LEU 480 HD13 LEU 480 10.864 5.364 10.379 848 HD21 LEU 480 HD21 LEU 480 11.937 2.240 8.795 849 HD22 LEU 480 HD22 LEU 480 11.292 3.669 7.985 850 HD23 LEU 480 HD23 LEU 480 10.572 3.110 9.495 851 H GLN 481 HN GLN 481 16.175 4.879 6.901 852 HA GLN 481 HA GLN 481 16.637 7.639 7.713 853 HB2 GLN 481 HB2 GLN 481 18.513 5.511 6.667 854 HB3 GLN 481 HB1 GLN 481 19.012 7.131 7.133 855 HG2 GLN 481 HG2 GLN 481 18.397 6.742 9.409 856 HG3 GLN 481 HG1 GLN 481 17.663 5.192 8.994 857 HE21 GLN 481 HE21 GLN 481 18.986 3.431 8.544 858 HE22 GLN 481 HE22 GLN 481 20.669 3.410 8.961 859 H LEU 482 HN LEU 482 15.334 6.274 5.107 860 HA LEU 482 HA LEU 482 16.645 8.086 3.193 861 HB2 LEU 482 HB2 LEU 482 15.640 5.350 3.001 862 HB3 LEU 482 HB1 LEU 482 15.058 6.383 1.711 863 HG LEU 482 HG LEU 482 17.099 5.148 1.090 864 HD11 LEU 482 HD11 LEU 482 18.339 7.037 0.192 865 HD12 LEU 482 HD12 LEU 482 17.498 8.127 1.294 866 HD13 LEU 482 HD13 LEU 482 16.601 7.285 0.030 867 HD21 LEU 482 HD21 LEU 482 18.182 5.002 3.247 868 HD22 LEU 482 HD22 LEU 482 18.384 6.752 3.298 869 HD23 LEU 482 HD23 LEU 482 19.253 5.800 2.094 870 H THR 483 HN THR 483 13.412 6.647 3.771 871 HA THR 483 HA THR 483 12.184 8.973 2.514 872 HB THR 483 HB THR 483 10.058 7.720 2.857 873 HG1 THR 483 HG1 THR 483 11.224 5.317 3.412 874 HG21 THR 483 HG21 THR 483 10.569 5.897 1.252 875 HG22 THR 483 HG22 THR 483 12.288 6.225 1.476 876 HG23 THR 483 HG23 THR 483 11.243 7.453 0.765 877 H ARG 484 HN ARG 484 12.538 7.464 5.644 878 HA ARG 484 HA ARG 484 12.129 8.146 7.764 879 HB2 ARG 484 HB2 ARG 484 11.741 10.898 6.570 880 HB3 ARG 484 HB1 ARG 484 12.052 10.526 8.259 881 HG2 ARG 484 HG2 ARG 484 14.260 9.721 7.714 882 HG3 ARG 484 HG1 ARG 484 13.954 9.966 5.994 883 HD2 ARG 484 HD2 ARG 484 13.498 12.415 6.644 884 HD3 ARG 484 HD1 ARG 484 14.313 12.016 8.155 885 HE ARG 484 HE ARG 484 16.317 11.655 6.956 886 HH11 ARG 484 HH11 ARG 484 13.709 12.822 4.938 887 HH12 ARG 484 HH12 ARG 484 14.758 13.359 3.669 888 HH21 ARG 484 HH21 ARG 484 17.703 12.360 5.284 889 HH22 ARG 484 HH22 ARG 484 17.029 13.101 3.870 890 H SER 485 HN SER 485 9.992 7.246 5.998 891 HA SER 485 HA SER 485 7.735 8.192 7.598 892 HB2 SER 485 HB2 SER 485 7.275 9.522 5.743 893 HB3 SER 485 HB1 SER 485 7.986 8.373 4.615 894 HG SER 485 HG SER 485 5.510 8.070 5.999 895 H VAL 486 HN VAL 486 6.831 6.459 8.482 896 HA VAL 486 HA VAL 486 7.487 3.824 7.777 897 HB VAL 486 HB VAL 486 5.697 3.106 9.296 898 HG11 VAL 486 HG11 VAL 486 7.147 5.472 10.459 899 HG12 VAL 486 HG12 VAL 486 7.901 3.909 10.147 900 HG13 VAL 486 HG13 VAL 486 6.578 4.035 11.306 901 HG21 VAL 486 HG21 VAL 486 3.962 4.692 8.757 902 HG22 VAL 486 HG22 VAL 486 4.943 6.026 9.359 903 HG23 VAL 486 HG23 VAL 486 4.334 4.806 10.478 904 H GLU 487 HN GLU 487 5.002 5.967 6.678 905 HA GLU 487 HA GLU 487 3.249 4.074 5.545 906 HB2 GLU 487 HB2 GLU 487 3.761 6.954 4.767 907 HB3 GLU 487 HB1 GLU 487 2.377 5.995 4.260 908 HG2 GLU 487 HG2 GLU 487 1.399 7.031 5.998 909 HG3 GLU 487 HG1 GLU 487 2.134 5.713 6.903 910 H ILE 488 HN ILE 488 6.038 5.831 4.227 911 HA ILE 488 HA ILE 488 5.716 4.595 1.625 912 HB ILE 488 HB ILE 488 8.111 6.170 2.566 913 HG12 ILE 488 HG12 ILE 488 5.619 7.247 1.228 914 HG13 ILE 488 HG11 ILE 488 6.010 7.459 2.930 915 HG21 ILE 488 HG21 ILE 488 6.953 5.671 -0.175 916 HG22 ILE 488 HG22 ILE 488 8.403 4.920 0.492 917 HG23 ILE 488 HG23 ILE 488 8.373 6.656 0.178 918 HD11 ILE 488 HD11 ILE 488 7.599 8.506 0.600 919 HD12 ILE 488 HD12 ILE 488 8.027 8.701 2.299 920 HD13 ILE 488 HD13 ILE 488 6.558 9.447 1.667 921 H THR 489 HN THR 489 7.763 4.230 4.458 922 HA THR 489 HA THR 489 9.719 2.542 3.372 923 HB THR 489 HB THR 489 8.688 2.708 6.206 924 HG1 THR 489 HG1 THR 489 10.763 3.967 4.735 925 HG21 THR 489 HG21 THR 489 9.767 0.632 6.163 926 HG22 THR 489 HG22 THR 489 11.033 1.744 6.686 927 HG23 THR 489 HG23 THR 489 10.985 1.184 5.015 928 H THR 490 HN THR 490 6.759 1.648 5.176 929 HA THR 490 HA THR 490 7.156 -1.131 4.888 930 HB THR 490 HB THR 490 4.414 0.060 5.141 931 HG1 THR 490 HG1 THR 490 5.429 1.269 6.655 932 HG21 THR 490 HG21 THR 490 4.619 -2.362 5.085 933 HG22 THR 490 HG22 THR 490 4.117 -1.831 6.689 934 HG23 THR 490 HG23 THR 490 5.789 -2.314 6.403 935 H ASP 491 HN ASP 491 5.567 1.284 2.904 936 HA ASP 491 HA ASP 491 4.275 -0.495 1.115 937 HB2 ASP 491 HB2 ASP 491 3.650 1.882 1.307 938 HB3 ASP 491 HB1 ASP 491 5.220 2.345 0.655 939 H ASN 492 HN ASN 492 7.389 1.152 1.107 940 HA ASN 492 HA ASN 492 8.332 0.452 -1.403 941 HB2 ASN 492 HB2 ASN 492 9.587 1.199 1.175 942 HB3 ASN 492 HB1 ASN 492 10.633 0.392 0.013 943 HD21 ASN 492 HD21 ASN 492 11.012 3.016 0.878 944 HD22 ASN 492 HD22 ASN 492 10.748 4.082 -0.462 945 H ILE 493 HN ILE 493 8.174 -1.472 1.520 946 HA ILE 493 HA ILE 493 9.879 -3.567 0.602 947 HB ILE 493 HB ILE 493 7.714 -3.757 2.705 948 HG12 ILE 493 HG12 ILE 493 10.645 -3.160 3.143 949 HG13 ILE 493 HG11 ILE 493 9.410 -1.907 3.073 950 HG21 ILE 493 HG21 ILE 493 9.078 -5.597 3.584 951 HG22 ILE 493 HG22 ILE 493 10.197 -5.404 2.235 952 HG23 ILE 493 HG23 ILE 493 8.536 -5.912 1.936 953 HD11 ILE 493 HD11 ILE 493 9.571 -4.148 5.075 954 HD12 ILE 493 HD12 ILE 493 8.280 -2.952 4.987 955 HD13 ILE 493 HD13 ILE 493 9.926 -2.447 5.365 956 H LEU 494 HN LEU 494 6.390 -3.007 0.545 957 HA LEU 494 HA LEU 494 5.748 -5.573 -0.544 958 HB2 LEU 494 HB2 LEU 494 4.282 -3.670 0.674 959 HB3 LEU 494 HB1 LEU 494 3.912 -3.289 -0.998 960 HG LEU 494 HG LEU 494 3.405 -5.879 -1.143 961 HD11 LEU 494 HD11 LEU 494 2.248 -6.507 1.054 962 HD12 LEU 494 HD12 LEU 494 3.253 -5.253 1.784 963 HD13 LEU 494 HD13 LEU 494 4.009 -6.632 0.983 964 HD21 LEU 494 HD21 LEU 494 1.819 -4.021 -1.520 965 HD22 LEU 494 HD22 LEU 494 1.499 -3.982 0.216 966 HD23 LEU 494 HD23 LEU 494 1.086 -5.414 -0.729 967 H GLU 495 HN GLU 495 6.274 -2.343 -1.860 968 HA GLU 495 HA GLU 495 5.594 -2.924 -4.538 969 HB2 GLU 495 HB2 GLU 495 7.349 -0.818 -3.283 970 HB3 GLU 495 HB1 GLU 495 7.078 -0.897 -5.018 971 HG2 GLU 495 HG2 GLU 495 4.952 -0.545 -2.913 972 HG3 GLU 495 HG1 GLU 495 5.611 0.719 -3.953 973 H GLY 496 HN GLY 496 8.748 -2.787 -2.903 974 HA2 GLY 496 HA2 GLY 496 10.261 -4.681 -3.455 975 HA3 GLY 496 HA1 GLY 496 9.828 -4.393 -5.135 976 H ARG 497 HN ARG 497 10.442 -1.853 -2.783 977 HA ARG 497 HA ARG 497 12.551 -0.795 -4.482 978 HB2 ARG 497 HB2 ARG 497 10.728 0.577 -3.274 979 HB3 ARG 497 HB1 ARG 497 11.693 0.335 -1.827 980 HG2 ARG 497 HG2 ARG 497 12.663 2.258 -2.438 981 HG3 ARG 497 HG1 ARG 497 13.574 1.237 -3.554 982 HD2 ARG 497 HD2 ARG 497 12.669 3.163 -4.725 983 HD3 ARG 497 HD1 ARG 497 11.902 1.681 -5.301 984 HE ARG 497 HE ARG 497 10.238 2.588 -3.326 985 HH11 ARG 497 HH11 ARG 497 11.545 3.996 -6.263 986 HH12 ARG 497 HH12 ARG 497 10.158 4.998 -6.542 987 HH21 ARG 497 HH21 ARG 497 8.409 3.914 -3.704 988 HH22 ARG 497 HH22 ARG 497 8.391 4.966 -5.090 989 H ILE 498 HN ILE 498 12.158 -2.693 -1.700 990 HA ILE 498 HA ILE 498 15.032 -2.543 -1.099 991 HB ILE 498 HB ILE 498 12.864 -3.461 0.798 992 HG12 ILE 498 HG12 ILE 498 14.311 -0.805 0.788 993 HG13 ILE 498 HG11 ILE 498 12.656 -1.037 0.240 994 HG21 ILE 498 HG21 ILE 498 15.083 -4.397 1.219 995 HG22 ILE 498 HG22 ILE 498 14.608 -3.275 2.496 996 HG23 ILE 498 HG23 ILE 498 15.762 -2.769 1.264 997 HD11 ILE 498 HD11 ILE 498 13.713 -1.419 3.028 998 HD12 ILE 498 HD12 ILE 498 12.074 -1.822 2.517 999 HD13 ILE 498 HD13 ILE 498 12.630 -0.151 2.458 1000 H GLN 499 HN GLN 499 16.152 -4.348 -1.481 1001 HA GLN 499 HA GLN 499 14.992 -6.571 -2.735 1002 HB2 GLN 499 HB2 GLN 499 17.693 -5.945 -1.638 1003 HB3 GLN 499 HB1 GLN 499 17.323 -7.617 -2.041 1004 HG2 GLN 499 HG2 GLN 499 17.169 -5.259 -3.901 1005 HG3 GLN 499 HG1 GLN 499 18.405 -6.518 -3.903 1006 HE21 GLN 499 HE21 GLN 499 16.372 -5.629 -5.922 1007 HE22 GLN 499 HE22 GLN 499 15.552 -7.081 -6.377 1008 H VAL 500 HN VAL 500 13.944 -8.230 -1.963 1009 HA VAL 500 HA VAL 500 13.632 -8.623 0.867 1010 HB VAL 500 HB VAL 500 12.104 -10.466 0.215 1011 HG11 VAL 500 HG11 VAL 500 11.249 -8.200 0.443 1012 HG12 VAL 500 HG12 VAL 500 10.406 -9.049 -0.851 1013 HG13 VAL 500 HG13 VAL 500 11.650 -7.862 -1.242 1014 HG21 VAL 500 HG21 VAL 500 12.856 -9.692 -2.605 1015 HG22 VAL 500 HG22 VAL 500 11.551 -10.789 -2.157 1016 HG23 VAL 500 HG23 VAL 500 13.224 -11.222 -1.809 1017 HA PRO 501 HA PRO 501 16.620 -11.784 1.626 1018 HB2 PRO 501 HB2 PRO 501 14.520 -13.470 2.861 1019 HB3 PRO 501 HB1 PRO 501 15.994 -12.799 3.582 1020 HG2 PRO 501 HG2 PRO 501 13.601 -11.835 4.205 1021 HG3 PRO 501 HG1 PRO 501 15.022 -10.782 4.056 1022 HD2 PRO 501 HD2 PRO 501 12.771 -11.187 2.138 1023 HD3 PRO 501 HD1 PRO 501 13.634 -9.698 2.570 1024 H PHE 502 HN PHE 502 17.236 -12.756 -0.233 1025 HA PHE 502 HA PHE 502 15.620 -15.036 -1.157 1026 HB2 PHE 502 HB2 PHE 502 15.566 -13.148 -2.773 1027 HB3 PHE 502 HB1 PHE 502 17.323 -13.204 -2.870 1028 HD1 PHE 502 HD1 PHE 502 14.292 -15.283 -3.430 1029 HD2 PHE 502 HD2 PHE 502 18.358 -14.550 -4.457 1030 HE1 PHE 502 HE1 PHE 502 14.127 -16.934 -5.244 1031 HE2 PHE 502 HE2 PHE 502 18.198 -16.202 -6.275 1032 HZ PHE 502 HZ PHE 502 16.081 -17.395 -6.670 1033 HA PRO 503 HA PRO 503 19.315 -17.272 -0.036 1034 HB2 PRO 503 HB2 PRO 503 18.607 -19.647 -1.223 1035 HB3 PRO 503 HB1 PRO 503 17.988 -19.113 0.351 1036 HG2 PRO 503 HG2 PRO 503 16.701 -18.961 -2.327 1037 HG3 PRO 503 HG1 PRO 503 15.994 -19.391 -0.756 1038 HD2 PRO 503 HD2 PRO 503 15.657 -16.952 -1.844 1039 HD3 PRO 503 HD1 PRO 503 15.794 -17.194 -0.091 1040 H THR 504 HN THR 504 21.187 -16.992 -1.050 1041 HA THR 504 HA THR 504 21.439 -17.827 -3.829 1042 HB THR 504 HB THR 504 20.997 -15.405 -3.948 1043 HG1 THR 504 HG1 THR 504 23.412 -16.568 -4.706 1044 HG21 THR 504 HG21 THR 504 21.818 -14.721 -1.760 1045 HG22 THR 504 HG22 THR 504 22.642 -13.812 -3.025 1046 HG23 THR 504 HG23 THR 504 23.467 -15.148 -2.223 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 -18.676 -11.268 14.152 2 H2 MET 1 HT2 MET 1 -18.332 -12.804 13.543 3 H3 MET 1 HT3 MET 1 -17.659 -11.438 12.814 4 HA MET 1 HA MET 1 -17.124 -12.208 15.611 5 HB2 MET 1 HB2 MET 1 -15.099 -13.259 14.952 6 HB3 MET 1 HB1 MET 1 -16.354 -13.937 13.925 7 HG2 MET 1 HG2 MET 1 -15.647 -12.495 12.097 8 HG3 MET 1 HG1 MET 1 -14.420 -11.763 13.132 9 HE1 MET 1 HE1 MET 1 -13.634 -13.093 10.241 10 HE2 MET 1 HE2 MET 1 -12.102 -13.771 10.800 11 HE3 MET 1 HE3 MET 1 -12.633 -12.193 11.378 12 H GLN 2 HN GLN 2 -14.935 -11.235 16.226 13 HA GLN 2 HA GLN 2 -14.873 -8.464 15.218 14 HB2 GLN 2 HB2 GLN 2 -13.952 -9.518 17.903 15 HB3 GLN 2 HB1 GLN 2 -13.982 -7.834 17.404 16 HG2 GLN 2 HG2 GLN 2 -16.419 -9.578 17.664 17 HG3 GLN 2 HG1 GLN 2 -15.834 -8.483 18.916 18 HE21 GLN 2 HE21 GLN 2 -18.378 -8.449 17.581 19 HE22 GLN 2 HE22 GLN 2 -18.501 -6.920 16.784 20 H ILE 3 HN ILE 3 -12.936 -7.538 14.662 21 HA ILE 3 HA ILE 3 -10.506 -9.177 14.899 22 HB ILE 3 HB ILE 3 -9.767 -8.348 12.663 23 HG12 ILE 3 HG12 ILE 3 -12.670 -7.708 12.149 24 HG13 ILE 3 HG11 ILE 3 -11.510 -6.479 12.645 25 HG21 ILE 3 HG21 ILE 3 -11.060 -9.978 11.368 26 HG22 ILE 3 HG22 ILE 3 -12.235 -10.077 12.679 27 HG23 ILE 3 HG23 ILE 3 -10.577 -10.618 12.939 28 HD11 ILE 3 HD11 ILE 3 -11.332 -8.172 10.165 29 HD12 ILE 3 HD12 ILE 3 -10.172 -6.936 10.659 30 HD13 ILE 3 HD13 ILE 3 -11.825 -6.483 10.241 31 H PHE 4 HN PHE 4 -8.515 -7.886 14.692 32 HA PHE 4 HA PHE 4 -8.958 -5.097 15.539 33 HB2 PHE 4 HB2 PHE 4 -6.837 -7.031 16.500 34 HB3 PHE 4 HB1 PHE 4 -6.892 -5.321 16.913 35 HD1 PHE 4 HD1 PHE 4 -8.911 -4.459 18.179 36 HD2 PHE 4 HD2 PHE 4 -8.045 -8.604 17.729 37 HE1 PHE 4 HE1 PHE 4 -10.369 -4.970 20.094 38 HE2 PHE 4 HE2 PHE 4 -9.502 -9.119 19.643 39 HZ PHE 4 HZ PHE 4 -10.668 -7.302 20.826 40 H VAL 5 HN VAL 5 -8.334 -3.787 13.973 41 HA VAL 5 HA VAL 5 -6.148 -4.603 12.200 42 HB VAL 5 HB VAL 5 -8.096 -2.303 11.911 43 HG11 VAL 5 HG11 VAL 5 -7.223 -2.102 9.637 44 HG12 VAL 5 HG12 VAL 5 -6.065 -3.391 9.960 45 HG13 VAL 5 HG13 VAL 5 -5.945 -1.862 10.829 46 HG21 VAL 5 HG21 VAL 5 -9.138 -4.527 11.706 47 HG22 VAL 5 HG22 VAL 5 -7.984 -4.932 10.436 48 HG23 VAL 5 HG23 VAL 5 -9.152 -3.636 10.184 49 H LYS 6 HN LYS 6 -4.181 -3.820 12.507 50 HA LYS 6 HA LYS 6 -3.888 -1.425 14.186 51 HB2 LYS 6 HB2 LYS 6 -2.124 -3.800 13.690 52 HB3 LYS 6 HB1 LYS 6 -1.423 -2.284 14.237 53 HG2 LYS 6 HG2 LYS 6 -3.319 -2.477 16.068 54 HG3 LYS 6 HG1 LYS 6 -3.184 -4.193 15.674 55 HD2 LYS 6 HD2 LYS 6 -0.754 -4.068 16.086 56 HD3 LYS 6 HD1 LYS 6 -0.938 -2.377 16.547 57 HE2 LYS 6 HE2 LYS 6 -0.901 -3.538 18.577 58 HE3 LYS 6 HE1 LYS 6 -2.610 -3.213 18.286 59 HZ1 LYS 6 HZ1 LYS 6 -1.860 -5.561 19.010 60 HZ2 LYS 6 HZ2 LYS 6 -1.426 -5.753 17.387 61 HZ3 LYS 6 HZ3 LYS 6 -3.032 -5.410 17.798 62 H THR 7 HN THR 7 -2.833 0.329 13.467 63 HA THR 7 HA THR 7 -2.097 0.351 10.629 64 HB THR 7 HB THR 7 -2.139 2.914 11.069 65 HG1 THR 7 HG1 THR 7 -3.779 2.006 13.225 66 HG21 THR 7 HG21 THR 7 -4.665 1.258 11.103 67 HG22 THR 7 HG22 THR 7 -3.792 1.821 9.677 68 HG23 THR 7 HG23 THR 7 -4.592 2.982 10.736 69 H LEU 8 HN LEU 8 -0.248 1.804 10.074 70 HA LEU 8 HA LEU 8 2.082 1.047 11.458 71 HB2 LEU 8 HB2 LEU 8 1.613 3.234 9.432 72 HB3 LEU 8 HB1 LEU 8 3.199 2.747 9.997 73 HG LEU 8 HG LEU 8 1.333 0.771 8.712 74 HD11 LEU 8 HD11 LEU 8 3.393 2.455 7.297 75 HD12 LEU 8 HD12 LEU 8 1.649 2.697 7.188 76 HD13 LEU 8 HD13 LEU 8 2.373 1.206 6.585 77 HD21 LEU 8 HD21 LEU 8 3.343 -0.463 8.299 78 HD22 LEU 8 HD22 LEU 8 3.315 -0.007 10.003 79 HD23 LEU 8 HD23 LEU 8 4.339 0.874 8.870 80 H THR 9 HN THR 9 -0.136 3.603 11.939 81 HA THR 9 HA THR 9 1.644 5.342 13.372 82 HB THR 9 HB THR 9 -0.896 6.127 14.049 83 HG1 THR 9 HG1 THR 9 -1.928 5.902 11.840 84 HG21 THR 9 HG21 THR 9 0.858 7.550 13.098 85 HG22 THR 9 HG22 THR 9 -0.668 7.772 12.244 86 HG23 THR 9 HG23 THR 9 0.616 6.803 11.520 87 H GLY 10 HN GLY 10 0.091 2.454 14.107 88 HA2 GLY 10 HA2 GLY 10 0.341 1.328 16.162 89 HA3 GLY 10 HA1 GLY 10 0.592 2.874 16.956 90 H LYS 11 HN LYS 11 -2.033 3.222 14.976 91 HA LYS 11 HA LYS 11 -3.836 3.138 17.233 92 HB2 LYS 11 HB2 LYS 11 -3.844 4.955 15.487 93 HB3 LYS 11 HB1 LYS 11 -4.475 3.774 14.348 94 HG2 LYS 11 HG2 LYS 11 -6.432 3.457 15.841 95 HG3 LYS 11 HG1 LYS 11 -5.811 4.759 16.860 96 HD2 LYS 11 HD2 LYS 11 -5.870 6.253 14.858 97 HD3 LYS 11 HD1 LYS 11 -6.670 4.953 13.973 98 HE2 LYS 11 HE2 LYS 11 -8.504 4.985 15.595 99 HE3 LYS 11 HE1 LYS 11 -7.705 6.287 16.474 100 HZ1 LYS 11 HZ1 LYS 11 -7.845 7.583 14.342 101 HZ2 LYS 11 HZ2 LYS 11 -9.318 7.291 15.112 102 HZ3 LYS 11 HZ3 LYS 11 -8.884 6.380 13.751 103 H THR 12 HN THR 12 -5.176 1.522 17.729 104 HA THR 12 HA THR 12 -5.440 -0.682 15.797 105 HB THR 12 HB THR 12 -5.985 -0.820 18.764 106 HG1 THR 12 HG1 THR 12 -3.700 -0.330 17.928 107 HG21 THR 12 HG21 THR 12 -7.043 -2.579 17.452 108 HG22 THR 12 HG22 THR 12 -5.709 -3.244 18.397 109 HG23 THR 12 HG23 THR 12 -5.507 -2.945 16.671 110 H ILE 13 HN ILE 13 -7.299 -0.782 14.763 111 HA ILE 13 HA ILE 13 -9.687 0.454 15.965 112 HB ILE 13 HB ILE 13 -9.491 -0.393 13.091 113 HG12 ILE 13 HG12 ILE 13 -8.676 2.356 14.013 114 HG13 ILE 13 HG11 ILE 13 -7.493 1.064 13.841 115 HG21 ILE 13 HG21 ILE 13 -10.977 1.833 14.482 116 HG22 ILE 13 HG22 ILE 13 -11.663 0.294 13.965 117 HG23 ILE 13 HG23 ILE 13 -11.072 1.442 12.764 118 HD11 ILE 13 HD11 ILE 13 -8.098 0.839 11.483 119 HD12 ILE 13 HD12 ILE 13 -7.534 2.464 11.873 120 HD13 ILE 13 HD13 ILE 13 -9.258 2.155 11.663 121 H THR 14 HN THR 14 -11.577 -0.701 16.210 122 HA THR 14 HA THR 14 -11.365 -3.610 15.816 123 HB THR 14 HB THR 14 -13.492 -2.227 17.446 124 HG1 THR 14 HG1 THR 14 -10.903 -2.155 17.963 125 HG21 THR 14 HG21 THR 14 -13.916 -4.559 16.950 126 HG22 THR 14 HG22 THR 14 -13.475 -4.408 18.650 127 HG23 THR 14 HG23 THR 14 -12.296 -5.003 17.485 128 H LEU 15 HN LEU 15 -12.780 -4.673 14.491 129 HA LEU 15 HA LEU 15 -15.039 -3.165 13.399 130 HB2 LEU 15 HB2 LEU 15 -12.923 -4.543 11.749 131 HB3 LEU 15 HB1 LEU 15 -14.457 -3.981 11.111 132 HG LEU 15 HG LEU 15 -12.855 -1.951 12.534 133 HD11 LEU 15 HD11 LEU 15 -11.348 -1.586 10.677 134 HD12 LEU 15 HD12 LEU 15 -12.001 -2.994 9.839 135 HD13 LEU 15 HD13 LEU 15 -11.109 -3.200 11.346 136 HD21 LEU 15 HD21 LEU 15 -13.617 -0.575 10.655 137 HD22 LEU 15 HD22 LEU 15 -14.960 -1.408 11.438 138 HD23 LEU 15 HD23 LEU 15 -14.330 -2.002 9.902 139 H GLU 16 HN GLU 16 -16.818 -4.372 12.975 140 HA GLU 16 HA GLU 16 -16.729 -7.163 13.774 141 HB2 GLU 16 HB2 GLU 16 -18.555 -5.524 14.490 142 HB3 GLU 16 HB1 GLU 16 -19.163 -5.639 12.846 143 HG2 GLU 16 HG2 GLU 16 -19.494 -8.031 13.113 144 HG3 GLU 16 HG1 GLU 16 -18.842 -7.949 14.747 145 H VAL 17 HN VAL 17 -16.333 -8.683 12.335 146 HA VAL 17 HA VAL 17 -17.320 -8.330 9.589 147 HB VAL 17 HB VAL 17 -15.237 -9.494 8.790 148 HG11 VAL 17 HG11 VAL 17 -13.848 -7.481 8.813 149 HG12 VAL 17 HG12 VAL 17 -14.843 -6.807 10.104 150 HG13 VAL 17 HG13 VAL 17 -15.538 -7.086 8.507 151 HG21 VAL 17 HG21 VAL 17 -14.480 -10.466 10.861 152 HG22 VAL 17 HG22 VAL 17 -14.313 -8.871 11.593 153 HG23 VAL 17 HG23 VAL 17 -13.248 -9.350 10.269 154 H GLU 18 HN GLU 18 -17.740 -10.277 8.465 155 HA GLU 18 HA GLU 18 -18.207 -12.559 10.269 156 HB2 GLU 18 HB2 GLU 18 -19.587 -11.679 7.728 157 HB3 GLU 18 HB1 GLU 18 -19.880 -13.239 8.486 158 HG2 GLU 18 HG2 GLU 18 -20.414 -10.522 9.658 159 HG3 GLU 18 HG1 GLU 18 -21.603 -11.719 9.143 160 HA PRO 19 HA PRO 19 -15.478 -15.235 8.040 161 HB2 PRO 19 HB2 PRO 19 -17.712 -17.086 7.398 162 HB3 PRO 19 HB1 PRO 19 -16.206 -17.399 8.283 163 HG2 PRO 19 HG2 PRO 19 -18.529 -17.257 9.553 164 HG3 PRO 19 HG1 PRO 19 -17.039 -16.613 10.272 165 HD2 PRO 19 HD2 PRO 19 -19.300 -15.148 8.989 166 HD3 PRO 19 HD1 PRO 19 -18.322 -14.705 10.403 167 H SER 20 HN SER 20 -18.499 -14.377 6.542 168 HA SER 20 HA SER 20 -17.549 -15.005 3.862 169 HB2 SER 20 HB2 SER 20 -19.972 -13.877 3.485 170 HB3 SER 20 HB1 SER 20 -19.757 -15.579 3.897 171 HG SER 20 HG SER 20 -20.957 -13.635 5.323 172 H ASP 21 HN ASP 21 -16.843 -12.584 5.831 173 HA ASP 21 HA ASP 21 -17.560 -10.275 4.300 174 HB2 ASP 21 HB2 ASP 21 -16.456 -10.752 6.841 175 HB3 ASP 21 HB1 ASP 21 -15.232 -9.852 5.951 176 H THR 22 HN THR 22 -16.573 -9.427 2.608 177 HA THR 22 HA THR 22 -14.251 -10.747 1.504 178 HB THR 22 HB THR 22 -14.860 -8.523 -0.078 179 HG1 THR 22 HG1 THR 22 -16.971 -8.205 0.043 180 HG21 THR 22 HG21 THR 22 -15.795 -11.388 -0.279 181 HG22 THR 22 HG22 THR 22 -14.308 -10.713 -0.945 182 HG23 THR 22 HG23 THR 22 -15.868 -10.209 -1.590 183 H ILE 23 HN ILE 23 -12.284 -9.710 1.029 184 HA ILE 23 HA ILE 23 -11.239 -8.029 2.986 185 HB ILE 23 HB ILE 23 -10.236 -8.382 0.160 186 HG12 ILE 23 HG12 ILE 23 -10.433 -10.528 1.275 187 HG13 ILE 23 HG11 ILE 23 -8.733 -10.085 1.168 188 HG21 ILE 23 HG21 ILE 23 -8.061 -7.713 1.027 189 HG22 ILE 23 HG22 ILE 23 -8.765 -7.457 2.624 190 HG23 ILE 23 HG23 ILE 23 -9.254 -6.437 1.271 191 HD11 ILE 23 HD11 ILE 23 -10.501 -9.916 3.595 192 HD12 ILE 23 HD12 ILE 23 -8.846 -9.312 3.518 193 HD13 ILE 23 HD13 ILE 23 -9.165 -11.035 3.317 194 H GLU 24 HN GLU 24 -12.412 -7.233 -0.267 195 HA GLU 24 HA GLU 24 -11.860 -4.491 -0.227 196 HB2 GLU 24 HB2 GLU 24 -12.549 -5.843 -2.228 197 HB3 GLU 24 HB1 GLU 24 -14.190 -5.837 -1.603 198 HG2 GLU 24 HG2 GLU 24 -13.353 -3.160 -1.631 199 HG3 GLU 24 HG1 GLU 24 -12.844 -3.862 -3.167 200 H ASN 25 HN ASN 25 -14.617 -6.320 0.976 201 HA ASN 25 HA ASN 25 -16.285 -4.122 1.598 202 HB2 ASN 25 HB2 ASN 25 -16.902 -6.620 1.455 203 HB3 ASN 25 HB1 ASN 25 -16.299 -6.727 3.107 204 HD21 ASN 25 HD21 ASN 25 -18.015 -6.907 4.370 205 HD22 ASN 25 HD22 ASN 25 -19.419 -5.883 4.306 206 H VAL 26 HN VAL 26 -13.829 -5.889 3.422 207 HA VAL 26 HA VAL 26 -14.270 -4.638 5.911 208 HB VAL 26 HB VAL 26 -11.680 -5.787 4.846 209 HG11 VAL 26 HG11 VAL 26 -11.364 -4.338 6.806 210 HG12 VAL 26 HG12 VAL 26 -11.042 -6.030 7.187 211 HG13 VAL 26 HG13 VAL 26 -12.558 -5.286 7.691 212 HG21 VAL 26 HG21 VAL 26 -13.456 -7.438 4.778 213 HG22 VAL 26 HG22 VAL 26 -13.889 -7.076 6.449 214 HG23 VAL 26 HG23 VAL 26 -12.333 -7.818 6.082 215 H LYS 27 HN LYS 27 -12.198 -3.821 3.160 216 HA LYS 27 HA LYS 27 -10.843 -1.662 4.370 217 HB2 LYS 27 HB2 LYS 27 -11.499 -1.955 1.432 218 HB3 LYS 27 HB1 LYS 27 -10.203 -0.997 2.134 219 HG2 LYS 27 HG2 LYS 27 -9.572 -3.409 3.122 220 HG3 LYS 27 HG1 LYS 27 -10.366 -3.894 1.625 221 HD2 LYS 27 HD2 LYS 27 -8.031 -2.006 1.894 222 HD3 LYS 27 HD1 LYS 27 -7.982 -3.650 1.262 223 HE2 LYS 27 HE2 LYS 27 -9.728 -2.789 -0.447 224 HE3 LYS 27 HE1 LYS 27 -9.162 -1.189 0.028 225 HZ1 LYS 27 HZ1 LYS 27 -6.847 -2.141 -0.456 226 HZ2 LYS 27 HZ2 LYS 27 -7.833 -1.734 -1.770 227 HZ3 LYS 27 HZ3 LYS 27 -7.675 -3.355 -1.307 228 H ALA 28 HN ALA 28 -13.943 -1.923 2.758 229 HA ALA 28 HA ALA 28 -14.457 0.846 2.484 230 HB1 ALA 28 HB1 ALA 28 -15.713 -0.864 1.252 231 HB2 ALA 28 HB2 ALA 28 -16.789 0.193 2.166 232 HB3 ALA 28 HB3 ALA 28 -16.429 -1.427 2.763 233 H LYS 29 HN LYS 29 -15.004 -1.484 5.061 234 HA LYS 29 HA LYS 29 -16.562 0.186 6.737 235 HB2 LYS 29 HB2 LYS 29 -14.744 -2.100 7.542 236 HB3 LYS 29 HB1 LYS 29 -16.038 -1.418 8.515 237 HG2 LYS 29 HG2 LYS 29 -17.667 -2.161 6.820 238 HG3 LYS 29 HG1 LYS 29 -16.348 -2.904 5.915 239 HD2 LYS 29 HD2 LYS 29 -15.835 -4.242 8.000 240 HD3 LYS 29 HD1 LYS 29 -17.363 -3.649 8.655 241 HE2 LYS 29 HE2 LYS 29 -18.454 -4.573 6.564 242 HE3 LYS 29 HE1 LYS 29 -16.920 -5.376 6.232 243 HZ1 LYS 29 HZ1 LYS 29 -17.432 -6.046 8.810 244 HZ2 LYS 29 HZ2 LYS 29 -17.741 -7.032 7.464 245 HZ3 LYS 29 HZ3 LYS 29 -18.971 -6.069 8.114 246 H ILE 30 HN ILE 30 -13.105 -0.329 6.352 247 HA ILE 30 HA ILE 30 -12.297 1.234 8.590 248 HB ILE 30 HB ILE 30 -10.730 0.552 6.091 249 HG12 ILE 30 HG12 ILE 30 -10.751 -0.831 8.782 250 HG13 ILE 30 HG11 ILE 30 -11.606 -1.415 7.361 251 HG21 ILE 30 HG21 ILE 30 -9.755 2.417 7.322 252 HG22 ILE 30 HG22 ILE 30 -8.747 0.977 7.458 253 HG23 ILE 30 HG23 ILE 30 -9.779 1.463 8.804 254 HD11 ILE 30 HD11 ILE 30 -9.498 -2.588 7.719 255 HD12 ILE 30 HD12 ILE 30 -8.628 -1.060 7.577 256 HD13 ILE 30 HD13 ILE 30 -9.505 -1.707 6.190 257 H GLN 31 HN GLN 31 -12.909 1.880 5.197 258 HA GLN 31 HA GLN 31 -11.894 4.508 5.092 259 HB2 GLN 31 HB2 GLN 31 -12.327 3.294 3.051 260 HB3 GLN 31 HB1 GLN 31 -14.030 3.123 3.458 261 HG2 GLN 31 HG2 GLN 31 -14.180 5.641 3.354 262 HG3 GLN 31 HG1 GLN 31 -12.561 5.622 2.657 263 HE21 GLN 31 HE21 GLN 31 -13.356 6.533 0.737 264 HE22 GLN 31 HE22 GLN 31 -14.256 5.596 -0.405 265 H ASP 32 HN ASP 32 -14.976 3.185 6.102 266 HA ASP 32 HA ASP 32 -16.311 5.712 6.230 267 HB2 ASP 32 HB2 ASP 32 -17.414 3.427 5.999 268 HB3 ASP 32 HB1 ASP 32 -17.107 3.212 7.719 269 H LYS 33 HN LYS 33 -14.369 3.825 8.436 270 HA LYS 33 HA LYS 33 -15.140 5.428 10.723 271 HB2 LYS 33 HB2 LYS 33 -13.258 3.113 10.360 272 HB3 LYS 33 HB1 LYS 33 -13.292 4.039 11.855 273 HG2 LYS 33 HG2 LYS 33 -15.798 3.543 11.895 274 HG3 LYS 33 HG1 LYS 33 -15.446 2.330 10.663 275 HD2 LYS 33 HD2 LYS 33 -13.920 1.194 12.151 276 HD3 LYS 33 HD1 LYS 33 -14.095 2.467 13.358 277 HE2 LYS 33 HE2 LYS 33 -16.538 1.903 13.459 278 HE3 LYS 33 HE1 LYS 33 -16.186 0.504 12.443 279 HZ1 LYS 33 HZ1 LYS 33 -14.696 -0.329 14.147 280 HZ2 LYS 33 HZ2 LYS 33 -16.232 -0.063 14.800 281 HZ3 LYS 33 HZ3 LYS 33 -14.985 1.034 15.110 282 H GLU 34 HN GLU 34 -12.084 4.838 8.958 283 HA GLU 34 HA GLU 34 -10.852 7.062 10.374 284 HB2 GLU 34 HB2 GLU 34 -9.769 5.063 8.397 285 HB3 GLU 34 HB1 GLU 34 -8.810 6.365 9.086 286 HG2 GLU 34 HG2 GLU 34 -10.171 4.186 10.649 287 HG3 GLU 34 HG1 GLU 34 -8.460 4.230 10.229 288 H GLY 35 HN GLY 35 -12.000 6.314 7.141 289 HA2 GLY 35 HA2 GLY 35 -12.582 7.887 5.511 290 HA3 GLY 35 HA1 GLY 35 -11.767 9.129 6.451 291 H ILE 36 HN ILE 36 -10.442 6.041 5.414 292 HA ILE 36 HA ILE 36 -8.413 7.499 3.862 293 HB ILE 36 HB ILE 36 -8.236 4.748 5.117 294 HG12 ILE 36 HG12 ILE 36 -6.789 7.296 5.866 295 HG13 ILE 36 HG11 ILE 36 -8.206 6.681 6.709 296 HG21 ILE 36 HG21 ILE 36 -6.147 6.356 3.647 297 HG22 ILE 36 HG22 ILE 36 -6.923 4.879 3.072 298 HG23 ILE 36 HG23 ILE 36 -5.867 4.829 4.483 299 HD11 ILE 36 HD11 ILE 36 -6.162 6.130 7.889 300 HD12 ILE 36 HD12 ILE 36 -5.552 5.283 6.468 301 HD13 ILE 36 HD13 ILE 36 -6.969 4.668 7.321 302 HA PRO 37 HA PRO 37 -10.299 5.840 0.162 303 HB2 PRO 37 HB2 PRO 37 -7.507 6.070 -0.854 304 HB3 PRO 37 HB1 PRO 37 -9.008 6.725 -1.531 305 HG2 PRO 37 HG2 PRO 37 -7.256 8.298 -0.315 306 HG3 PRO 37 HG1 PRO 37 -9.006 8.556 -0.154 307 HD2 PRO 37 HD2 PRO 37 -7.076 7.419 1.802 308 HD3 PRO 37 HD1 PRO 37 -8.532 8.396 2.078 309 HA PRO 38 HA PRO 38 -9.332 1.500 0.724 310 HB2 PRO 38 HB2 PRO 38 -10.656 1.267 -1.926 311 HB3 PRO 38 HB1 PRO 38 -11.029 0.444 -0.400 312 HG2 PRO 38 HG2 PRO 38 -12.587 2.383 -1.329 313 HG3 PRO 38 HG1 PRO 38 -12.276 2.185 0.407 314 HD2 PRO 38 HD2 PRO 38 -11.168 4.197 -1.486 315 HD3 PRO 38 HD1 PRO 38 -11.603 4.366 0.225 316 H ASP 39 HN ASP 39 -8.669 3.268 -2.230 317 HA ASP 39 HA ASP 39 -7.073 1.347 -3.518 318 HB2 ASP 39 HB2 ASP 39 -7.898 3.184 -4.798 319 HB3 ASP 39 HB1 ASP 39 -7.169 4.355 -3.705 320 H GLN 40 HN GLN 40 -6.384 3.647 -0.987 321 HA GLN 40 HA GLN 40 -3.520 3.069 -1.157 322 HB2 GLN 40 HB2 GLN 40 -5.026 5.078 0.525 323 HB3 GLN 40 HB1 GLN 40 -3.278 4.894 0.492 324 HG2 GLN 40 HG2 GLN 40 -3.221 5.534 -1.838 325 HG3 GLN 40 HG1 GLN 40 -4.979 5.644 -1.873 326 HE21 GLN 40 HE21 GLN 40 -3.045 7.690 -2.478 327 HE22 GLN 40 HE22 GLN 40 -3.324 8.987 -1.368 328 H GLN 41 HN GLN 41 -5.844 1.355 -0.030 329 HA GLN 41 HA GLN 41 -4.780 0.963 2.678 330 HB2 GLN 41 HB2 GLN 41 -7.354 0.103 1.374 331 HB3 GLN 41 HB1 GLN 41 -6.826 -0.526 2.925 332 HG2 GLN 41 HG2 GLN 41 -6.756 1.868 3.730 333 HG3 GLN 41 HG1 GLN 41 -7.587 2.294 2.234 334 HE21 GLN 41 HE21 GLN 41 -9.466 2.957 3.193 335 HE22 GLN 41 HE22 GLN 41 -10.552 1.866 3.987 336 H ARG 42 HN ARG 42 -2.992 -0.298 2.409 337 HA ARG 42 HA ARG 42 -3.269 -2.778 0.866 338 HB2 ARG 42 HB2 ARG 42 -0.781 -1.687 2.199 339 HB3 ARG 42 HB1 ARG 42 -0.864 -2.988 1.021 340 HG2 ARG 42 HG2 ARG 42 -1.776 -1.257 -0.600 341 HG3 ARG 42 HG1 ARG 42 -1.281 -0.046 0.580 342 HD2 ARG 42 HD2 ARG 42 0.545 -0.156 -0.857 343 HD3 ARG 42 HD1 ARG 42 1.021 -1.207 0.478 344 HE ARG 42 HE ARG 42 0.003 -3.016 -1.122 345 HH11 ARG 42 HH11 ARG 42 2.081 -0.299 -1.930 346 HH12 ARG 42 HH12 ARG 42 2.663 -1.036 -3.405 347 HH21 ARG 42 HH21 ARG 42 0.799 -3.982 -3.032 348 HH22 ARG 42 HH22 ARG 42 1.961 -3.134 -4.002 349 H LEU 43 HN LEU 43 -4.321 -4.233 2.102 350 HA LEU 43 HA LEU 43 -3.808 -4.388 4.951 351 HB2 LEU 43 HB2 LEU 43 -5.800 -5.599 3.094 352 HB3 LEU 43 HB1 LEU 43 -5.492 -6.388 4.627 353 HG LEU 43 HG LEU 43 -6.368 -3.509 4.352 354 HD11 LEU 43 HD11 LEU 43 -7.989 -5.954 5.053 355 HD12 LEU 43 HD12 LEU 43 -8.104 -5.029 3.557 356 HD13 LEU 43 HD13 LEU 43 -8.560 -4.287 5.091 357 HD21 LEU 43 HD21 LEU 43 -6.865 -3.741 6.759 358 HD22 LEU 43 HD22 LEU 43 -5.149 -3.923 6.400 359 HD23 LEU 43 HD23 LEU 43 -6.135 -5.346 6.736 360 H ILE 44 HN ILE 44 -2.578 -5.833 5.936 361 HA ILE 44 HA ILE 44 -1.563 -8.113 4.378 362 HB ILE 44 HB ILE 44 -0.049 -6.079 5.965 363 HG12 ILE 44 HG12 ILE 44 1.639 -6.756 4.079 364 HG13 ILE 44 HG11 ILE 44 0.216 -7.458 3.319 365 HG21 ILE 44 HG21 ILE 44 0.481 -8.129 7.146 366 HG22 ILE 44 HG22 ILE 44 1.867 -7.604 6.190 367 HG23 ILE 44 HG23 ILE 44 0.859 -8.934 5.624 368 HD11 ILE 44 HD11 ILE 44 -0.880 -5.285 3.357 369 HD12 ILE 44 HD12 ILE 44 0.655 -5.219 2.494 370 HD13 ILE 44 HD13 ILE 44 0.538 -4.577 4.132 371 H PHE 45 HN PHE 45 -1.376 -10.018 5.434 372 HA PHE 45 HA PHE 45 -1.929 -10.108 8.313 373 HB2 PHE 45 HB2 PHE 45 -4.058 -10.550 7.065 374 HB3 PHE 45 HB1 PHE 45 -3.268 -11.917 6.288 375 HD1 PHE 45 HD1 PHE 45 -3.943 -10.593 9.707 376 HD2 PHE 45 HD2 PHE 45 -3.561 -14.002 7.194 377 HE1 PHE 45 HE1 PHE 45 -4.601 -12.040 11.584 378 HE2 PHE 45 HE2 PHE 45 -4.220 -15.460 9.066 379 HZ PHE 45 HZ PHE 45 -4.738 -14.478 11.264 380 H ALA 46 HN ALA 46 -0.348 -11.175 9.245 381 HA ALA 46 HA ALA 46 1.324 -12.632 9.690 382 HB1 ALA 46 HB1 ALA 46 1.268 -14.855 8.713 383 HB2 ALA 46 HB2 ALA 46 0.110 -14.309 7.500 384 HB3 ALA 46 HB3 ALA 46 -0.349 -14.349 9.201 385 H GLY 47 HN GLY 47 1.458 -10.601 7.388 386 HA2 GLY 47 HA2 GLY 47 3.531 -9.862 6.484 387 HA3 GLY 47 HA1 GLY 47 4.072 -11.531 6.439 388 H LYS 48 HN LYS 48 0.951 -11.437 5.269 389 HA LYS 48 HA LYS 48 1.921 -11.104 2.503 390 HB2 LYS 48 HB2 LYS 48 -0.095 -13.105 3.552 391 HB3 LYS 48 HB1 LYS 48 0.276 -12.857 1.852 392 HG2 LYS 48 HG2 LYS 48 2.480 -13.684 2.115 393 HG3 LYS 48 HG1 LYS 48 2.349 -13.657 3.874 394 HD2 LYS 48 HD2 LYS 48 0.586 -15.365 2.134 395 HD3 LYS 48 HD1 LYS 48 2.137 -15.926 2.763 396 HE2 LYS 48 HE2 LYS 48 1.328 -15.477 5.055 397 HE3 LYS 48 HE1 LYS 48 -0.233 -14.999 4.390 398 HZ1 LYS 48 HZ1 LYS 48 1.010 -17.683 4.398 399 HZ2 LYS 48 HZ2 LYS 48 -0.277 -17.303 3.373 400 HZ3 LYS 48 HZ3 LYS 48 -0.478 -17.214 5.050 401 H GLN 49 HN GLN 49 0.623 -10.049 1.065 402 HA GLN 49 HA GLN 49 -1.275 -8.223 2.166 403 HB2 GLN 49 HB2 GLN 49 0.338 -8.193 -0.025 404 HB3 GLN 49 HB1 GLN 49 -1.214 -8.550 -0.755 405 HG2 GLN 49 HG2 GLN 49 -2.153 -6.564 0.414 406 HG3 GLN 49 HG1 GLN 49 -0.520 -6.171 0.942 407 HE21 GLN 49 HE21 GLN 49 -1.332 -7.519 -2.195 408 HE22 GLN 49 HE22 GLN 49 -0.893 -6.121 -3.113 409 H LEU 50 HN LEU 50 -3.452 -8.099 1.843 410 HA LEU 50 HA LEU 50 -4.760 -10.605 1.081 411 HB2 LEU 50 HB2 LEU 50 -6.063 -8.194 2.333 412 HB3 LEU 50 HB1 LEU 50 -6.656 -9.842 2.294 413 HG LEU 50 HG LEU 50 -4.321 -8.822 3.913 414 HD11 LEU 50 HD11 LEU 50 -6.980 -9.908 4.825 415 HD12 LEU 50 HD12 LEU 50 -6.582 -8.193 4.723 416 HD13 LEU 50 HD13 LEU 50 -5.697 -9.239 5.833 417 HD21 LEU 50 HD21 LEU 50 -4.284 -11.084 4.888 418 HD22 LEU 50 HD22 LEU 50 -3.876 -11.082 3.173 419 HD23 LEU 50 HD23 LEU 50 -5.479 -11.598 3.696 420 H GLU 51 HN GLU 51 -5.742 -10.780 -0.823 421 HA GLU 51 HA GLU 51 -5.923 -8.502 -2.570 422 HB2 GLU 51 HB2 GLU 51 -7.014 -11.287 -3.012 423 HB3 GLU 51 HB1 GLU 51 -6.701 -10.071 -4.239 424 HG2 GLU 51 HG2 GLU 51 -4.323 -10.218 -3.826 425 HG3 GLU 51 HG1 GLU 51 -4.599 -11.365 -2.517 426 H ASP 52 HN ASP 52 -7.653 -7.293 -2.997 427 HA ASP 52 HA ASP 52 -9.758 -7.013 -1.255 428 HB2 ASP 52 HB2 ASP 52 -9.387 -6.167 -4.105 429 HB3 ASP 52 HB1 ASP 52 -10.879 -5.807 -3.252 430 H GLY 53 HN GLY 53 -9.699 -8.930 -4.234 431 HA2 GLY 53 HA2 GLY 53 -12.509 -9.578 -3.991 432 HA3 GLY 53 HA1 GLY 53 -11.416 -10.141 -5.238 433 H ARG 54 HN ARG 54 -11.032 -10.467 -1.725 434 HA ARG 54 HA ARG 54 -11.479 -13.363 -2.014 435 HB2 ARG 54 HB2 ARG 54 -9.306 -12.221 -0.269 436 HB3 ARG 54 HB1 ARG 54 -9.589 -13.908 -0.666 437 HG2 ARG 54 HG2 ARG 54 -8.814 -11.849 -2.697 438 HG3 ARG 54 HG1 ARG 54 -7.645 -12.821 -1.802 439 HD2 ARG 54 HD2 ARG 54 -8.676 -14.860 -2.696 440 HD3 ARG 54 HD1 ARG 54 -9.821 -13.874 -3.605 441 HE ARG 54 HE ARG 54 -6.900 -13.771 -4.043 442 HH11 ARG 54 HH11 ARG 54 -10.192 -13.836 -5.258 443 HH12 ARG 54 HH12 ARG 54 -9.716 -13.686 -6.916 444 HH21 ARG 54 HH21 ARG 54 -6.273 -13.534 -6.203 445 HH22 ARG 54 HH22 ARG 54 -7.467 -13.528 -7.462 446 H THR 55 HN THR 55 -11.672 -14.400 0.198 447 HA THR 55 HA THR 55 -13.303 -12.650 1.913 448 HB THR 55 HB THR 55 -13.552 -15.443 2.568 449 HG1 THR 55 HG1 THR 55 -12.923 -15.670 0.302 450 HG21 THR 55 HG21 THR 55 -15.485 -13.466 1.351 451 HG22 THR 55 HG22 THR 55 -15.225 -13.741 3.074 452 HG23 THR 55 HG23 THR 55 -15.922 -15.014 2.071 453 H LEU 56 HN LEU 56 -13.174 -13.129 4.268 454 HA LEU 56 HA LEU 56 -10.528 -13.041 5.201 455 HB2 LEU 56 HB2 LEU 56 -13.048 -13.730 6.714 456 HB3 LEU 56 HB1 LEU 56 -11.518 -13.293 7.448 457 HG LEU 56 HG LEU 56 -13.196 -11.486 5.703 458 HD11 LEU 56 HD11 LEU 56 -12.750 -11.520 8.680 459 HD12 LEU 56 HD12 LEU 56 -14.257 -11.870 7.833 460 HD13 LEU 56 HD13 LEU 56 -13.579 -10.243 7.788 461 HD21 LEU 56 HD21 LEU 56 -11.635 -9.728 6.491 462 HD22 LEU 56 HD22 LEU 56 -10.863 -10.936 5.465 463 HD23 LEU 56 HD23 LEU 56 -10.631 -10.985 7.212 464 H SER 57 HN SER 57 -12.724 -15.682 4.709 465 HA SER 57 HA SER 57 -11.396 -17.650 6.230 466 HB2 SER 57 HB2 SER 57 -12.708 -18.997 4.209 467 HB3 SER 57 HB1 SER 57 -13.442 -18.475 5.728 468 HG SER 57 HG SER 57 -14.713 -17.546 4.240 469 H ASP 58 HN ASP 58 -10.846 -16.327 3.061 470 HA ASP 58 HA ASP 58 -9.383 -18.471 1.933 471 HB2 ASP 58 HB2 ASP 58 -9.515 -15.525 1.337 472 HB3 ASP 58 HB1 ASP 58 -8.428 -16.589 0.452 473 H TYR 59 HN TYR 59 -8.541 -15.993 4.192 474 HA TYR 59 HA TYR 59 -5.702 -16.707 3.907 475 HB2 TYR 59 HB2 TYR 59 -6.991 -14.224 5.042 476 HB3 TYR 59 HB1 TYR 59 -5.264 -14.564 5.134 477 HD1 TYR 59 HD1 TYR 59 -3.980 -14.847 2.972 478 HD2 TYR 59 HD2 TYR 59 -7.924 -13.260 3.106 479 HE1 TYR 59 HE1 TYR 59 -3.665 -13.882 0.735 480 HE2 TYR 59 HE2 TYR 59 -7.614 -12.289 0.871 481 HH TYR 59 HH TYR 59 -4.949 -13.105 -1.128 482 H ASN 60 HN ASN 60 -8.137 -17.799 5.511 483 HA ASN 60 HA ASN 60 -8.491 -18.888 7.466 484 HB2 ASN 60 HB2 ASN 60 -5.880 -19.420 6.765 485 HB3 ASN 60 HB1 ASN 60 -5.725 -18.865 8.428 486 HD21 ASN 60 HD21 ASN 60 -6.706 -21.383 6.351 487 HD22 ASN 60 HD22 ASN 60 -7.227 -22.494 7.573 488 H ILE 61 HN ILE 61 -8.534 -15.967 7.458 489 HA ILE 61 HA ILE 61 -7.395 -15.013 9.884 490 HB ILE 61 HB ILE 61 -9.658 -13.859 8.244 491 HG12 ILE 61 HG12 ILE 61 -6.729 -13.102 8.292 492 HG13 ILE 61 HG11 ILE 61 -7.457 -14.146 7.076 493 HG21 ILE 61 HG21 ILE 61 -9.186 -11.760 9.393 494 HG22 ILE 61 HG22 ILE 61 -7.949 -12.557 10.363 495 HG23 ILE 61 HG23 ILE 61 -9.642 -13.013 10.547 496 HD11 ILE 61 HD11 ILE 61 -8.224 -11.284 7.600 497 HD12 ILE 61 HD12 ILE 61 -8.883 -12.331 6.342 498 HD13 ILE 61 HD13 ILE 61 -7.187 -11.849 6.292 499 H GLN 62 HN GLN 62 -8.006 -15.559 11.836 500 HA GLN 62 HA GLN 62 -10.680 -16.643 12.268 501 HB2 GLN 62 HB2 GLN 62 -8.144 -16.712 13.895 502 HB3 GLN 62 HB1 GLN 62 -9.684 -17.299 14.508 503 HG2 GLN 62 HG2 GLN 62 -9.575 -19.190 13.319 504 HG3 GLN 62 HG1 GLN 62 -8.949 -18.372 11.888 505 HE21 GLN 62 HE21 GLN 62 -6.806 -18.368 11.490 506 HE22 GLN 62 HE22 GLN 62 -5.638 -19.180 12.479 507 H LYS 63 HN LYS 63 -11.235 -16.182 14.820 508 HA LYS 63 HA LYS 63 -12.000 -13.427 14.808 509 HB2 LYS 63 HB2 LYS 63 -13.254 -13.907 16.768 510 HB3 LYS 63 HB1 LYS 63 -13.398 -15.314 15.730 511 HG2 LYS 63 HG2 LYS 63 -12.440 -16.663 17.232 512 HG3 LYS 63 HG1 LYS 63 -11.180 -15.490 17.618 513 HD2 LYS 63 HD2 LYS 63 -12.852 -14.237 18.972 514 HD3 LYS 63 HD1 LYS 63 -14.001 -15.543 18.682 515 HE2 LYS 63 HE2 LYS 63 -12.634 -17.105 19.853 516 HE3 LYS 63 HE1 LYS 63 -11.300 -15.956 19.945 517 HZ1 LYS 63 HZ1 LYS 63 -12.669 -14.547 21.365 518 HZ2 LYS 63 HZ2 LYS 63 -12.462 -16.086 22.042 519 HZ3 LYS 63 HZ3 LYS 63 -13.926 -15.681 21.300 520 H GLU 64 HN GLU 64 -11.371 -11.794 16.171 521 HA GLU 64 HA GLU 64 -10.004 -10.527 17.447 522 HB2 GLU 64 HB2 GLU 64 -9.428 -13.194 18.724 523 HB3 GLU 64 HB1 GLU 64 -8.771 -11.678 19.324 524 HG2 GLU 64 HG2 GLU 64 -10.886 -10.868 19.915 525 HG3 GLU 64 HG1 GLU 64 -11.713 -12.102 18.968 526 H SER 65 HN SER 65 -8.982 -12.009 14.969 527 HA SER 65 HA SER 65 -6.148 -12.214 15.457 528 HB2 SER 65 HB2 SER 65 -7.729 -12.291 12.878 529 HB3 SER 65 HB1 SER 65 -6.004 -12.627 13.013 530 HG SER 65 HG SER 65 -7.693 -14.040 14.713 531 H THR 66 HN THR 66 -4.545 -10.845 14.617 532 HA THR 66 HA THR 66 -5.395 -8.070 14.418 533 HB THR 66 HB THR 66 -2.567 -9.121 14.544 534 HG1 THR 66 HG1 THR 66 -2.773 -9.285 16.669 535 HG21 THR 66 HG21 THR 66 -2.804 -6.785 13.840 536 HG22 THR 66 HG22 THR 66 -2.071 -6.899 15.440 537 HG23 THR 66 HG23 THR 66 -3.768 -6.448 15.277 538 H LEU 67 HN LEU 67 -5.512 -7.018 12.585 539 HA LEU 67 HA LEU 67 -4.201 -8.129 10.197 540 HB2 LEU 67 HB2 LEU 67 -6.702 -6.548 10.623 541 HB3 LEU 67 HB1 LEU 67 -5.853 -6.379 9.101 542 HG LEU 67 HG LEU 67 -6.020 -8.926 8.910 543 HD11 LEU 67 HD11 LEU 67 -7.863 -9.955 10.140 544 HD12 LEU 67 HD12 LEU 67 -8.090 -8.462 11.049 545 HD13 LEU 67 HD13 LEU 67 -6.599 -9.386 11.231 546 HD21 LEU 67 HD21 LEU 67 -8.510 -7.231 8.836 547 HD22 LEU 67 HD22 LEU 67 -8.312 -8.789 8.036 548 HD23 LEU 67 HD23 LEU 67 -7.328 -7.411 7.542 549 H HIS 68 HN HIS 68 -2.821 -6.845 9.004 550 HA HIS 68 HA HIS 68 -1.992 -4.363 10.331 551 HB2 HIS 68 HB2 HIS 68 -0.484 -5.829 8.167 552 HB3 HIS 68 HB1 HIS 68 0.141 -4.641 9.307 553 HD2 HIS 68 HD2 HIS 68 -0.659 -5.907 12.115 554 HE1 HIS 68 HE1 HIS 68 1.108 -9.461 10.652 555 HE2 HIS 68 HE2 HIS 68 0.529 -8.130 12.729 556 H LEU 69 HN LEU 69 -2.515 -2.467 9.457 557 HA LEU 69 HA LEU 69 -3.383 -2.433 6.648 558 HB2 LEU 69 HB2 LEU 69 -5.043 -1.660 8.283 559 HB3 LEU 69 HB1 LEU 69 -3.919 -0.442 8.855 560 HG LEU 69 HG LEU 69 -3.980 0.616 6.600 561 HD11 LEU 69 HD11 LEU 69 -5.800 -0.023 5.069 562 HD12 LEU 69 HD12 LEU 69 -6.144 -1.419 6.092 563 HD13 LEU 69 HD13 LEU 69 -4.594 -1.297 5.261 564 HD21 LEU 69 HD21 LEU 69 -6.577 0.297 8.092 565 HD22 LEU 69 HD22 LEU 69 -6.311 1.492 6.823 566 HD23 LEU 69 HD23 LEU 69 -5.358 1.553 8.305 567 H VAL 70 HN VAL 70 -1.638 -2.062 5.435 568 HA VAL 70 HA VAL 70 0.301 -0.044 6.257 569 HB VAL 70 HB VAL 70 0.274 -1.966 3.927 570 HG11 VAL 70 HG11 VAL 70 2.344 0.052 4.764 571 HG12 VAL 70 HG12 VAL 70 1.487 -0.034 3.226 572 HG13 VAL 70 HG13 VAL 70 2.665 -1.278 3.652 573 HG21 VAL 70 HG21 VAL 70 0.604 -3.081 6.039 574 HG22 VAL 70 HG22 VAL 70 1.860 -1.929 6.490 575 HG23 VAL 70 HG23 VAL 70 2.127 -3.043 5.151 576 H LEU 71 HN LEU 71 0.279 1.966 5.496 577 HA LEU 71 HA LEU 71 -1.704 2.750 3.562 578 HB2 LEU 71 HB2 LEU 71 0.456 4.370 4.917 579 HB3 LEU 71 HB1 LEU 71 -0.855 5.028 3.958 580 HG LEU 71 HG LEU 71 -1.228 3.487 6.529 581 HD11 LEU 71 HD11 LEU 71 -0.096 5.629 6.895 582 HD12 LEU 71 HD12 LEU 71 -1.731 5.620 7.555 583 HD13 LEU 71 HD13 LEU 71 -1.397 6.454 6.037 584 HD21 LEU 71 HD21 LEU 71 -3.517 4.320 6.418 585 HD22 LEU 71 HD22 LEU 71 -3.134 3.341 5.004 586 HD23 LEU 71 HD23 LEU 71 -3.170 5.099 4.875 587 H ARG 72 HN ARG 72 -1.051 4.136 1.676 588 HA ARG 72 HA ARG 72 1.498 3.195 0.535 589 HB2 ARG 72 HB2 ARG 72 -0.383 1.959 -0.449 590 HB3 ARG 72 HB1 ARG 72 -1.177 3.469 -0.866 591 HG2 ARG 72 HG2 ARG 72 0.517 3.992 -2.473 592 HG3 ARG 72 HG1 ARG 72 1.485 2.606 -1.966 593 HD2 ARG 72 HD2 ARG 72 -0.765 1.317 -2.561 594 HD3 ARG 72 HD1 ARG 72 -0.972 2.708 -3.620 595 HE ARG 72 HE ARG 72 1.447 1.030 -3.714 596 HH11 ARG 72 HH11 ARG 72 -1.235 2.633 -5.297 597 HH12 ARG 72 HH12 ARG 72 -0.733 2.170 -6.891 598 HH21 ARG 72 HH21 ARG 72 2.104 0.409 -5.817 599 HH22 ARG 72 HH22 ARG 72 1.157 0.919 -7.190 600 H LEU 73 HN LEU 73 2.781 4.733 -0.222 601 HA LEU 73 HA LEU 73 1.644 7.303 -1.038 602 HB2 LEU 73 HB2 LEU 73 3.712 6.867 1.091 603 HB3 LEU 73 HB1 LEU 73 3.670 8.362 0.178 604 HG LEU 73 HG LEU 73 1.105 8.273 0.980 605 HD11 LEU 73 HD11 LEU 73 1.535 6.141 2.213 606 HD12 LEU 73 HD12 LEU 73 0.896 7.448 3.210 607 HD13 LEU 73 HD13 LEU 73 2.612 7.046 3.280 608 HD21 LEU 73 HD21 LEU 73 2.728 10.114 1.276 609 HD22 LEU 73 HD22 LEU 73 3.374 9.280 2.690 610 HD23 LEU 73 HD23 LEU 73 1.710 9.861 2.694 611 H ARG 74 HN ARG 74 2.568 8.106 -2.811 612 HA ARG 74 HA ARG 74 5.116 6.921 -3.699 613 HB2 ARG 74 HB2 ARG 74 2.586 7.445 -5.216 614 HB3 ARG 74 HB1 ARG 74 4.128 7.497 -6.059 615 HG2 ARG 74 HG2 ARG 74 4.588 5.202 -5.181 616 HG3 ARG 74 HG1 ARG 74 2.932 5.172 -4.576 617 HD2 ARG 74 HD2 ARG 74 2.021 5.218 -6.730 618 HD3 ARG 74 HD1 ARG 74 3.531 5.778 -7.452 619 HE ARG 74 HE ARG 74 3.631 3.156 -6.215 620 HH11 ARG 74 HH11 ARG 74 3.093 4.964 -9.164 621 HH12 ARG 74 HH12 ARG 74 3.536 3.649 -10.200 622 HH21 ARG 74 HH21 ARG 74 4.212 1.418 -7.571 623 HH22 ARG 74 HH22 ARG 74 4.182 1.635 -9.301 624 H GLY 75 HN GLY 75 4.337 9.410 -2.209 625 HA2 GLY 75 HA2 GLY 75 5.997 11.221 -3.803 626 HA3 GLY 75 HA1 GLY 75 4.419 11.794 -3.273 627 H GLY 76 HN GLY 76 7.569 10.666 -2.181 628 HA2 GLY 76 HA2 GLY 76 6.980 11.815 0.471 629 HA3 GLY 76 HA1 GLY 76 8.156 10.544 0.179 630 H1 SER 453 HT1 SER 453 22.476 8.708 17.500 631 H2 SER 453 HT2 SER 453 22.193 10.342 17.167 632 H3 SER 453 HT3 SER 453 21.716 9.159 16.067 633 HA SER 453 HA SER 453 20.670 9.197 18.804 634 HB2 SER 453 HB2 SER 453 19.188 10.477 16.529 635 HB3 SER 453 HB1 SER 453 18.979 10.709 18.264 636 HG SER 453 HG SER 453 20.245 12.302 16.747 637 H ASN 454 HN ASN 454 19.048 9.045 15.656 638 HA ASN 454 HA ASN 454 17.736 7.483 14.666 639 HB2 ASN 454 HB2 ASN 454 20.054 5.964 15.687 640 HB3 ASN 454 HB1 ASN 454 18.635 4.996 15.303 641 HD21 ASN 454 HD21 ASN 454 19.663 4.002 13.573 642 HD22 ASN 454 HD22 ASN 454 19.986 4.828 12.091 643 H SER 455 HN SER 455 17.270 8.275 17.563 644 HA SER 455 HA SER 455 16.159 6.107 18.956 645 HB2 SER 455 HB2 SER 455 14.932 8.700 19.497 646 HB3 SER 455 HB1 SER 455 15.887 7.663 20.561 647 HG SER 455 HG SER 455 17.133 9.426 20.269 648 H GLN 456 HN GLN 456 14.596 8.670 17.036 649 HA GLN 456 HA GLN 456 11.973 7.659 17.277 650 HB2 GLN 456 HB2 GLN 456 13.268 9.485 15.255 651 HB3 GLN 456 HB1 GLN 456 11.564 9.069 15.193 652 HG2 GLN 456 HG2 GLN 456 12.915 10.402 17.529 653 HG3 GLN 456 HG1 GLN 456 12.012 11.240 16.268 654 HE21 GLN 456 HE21 GLN 456 11.834 9.400 19.154 655 HE22 GLN 456 HE22 GLN 456 10.113 9.425 19.321 656 H LEU 457 HN LEU 457 14.511 7.188 14.885 657 HA LEU 457 HA LEU 457 13.003 5.706 13.028 658 HB2 LEU 457 HB2 LEU 457 15.970 5.587 13.567 659 HB3 LEU 457 HB1 LEU 457 15.166 4.998 12.124 660 HG LEU 457 HG LEU 457 15.348 7.882 13.008 661 HD11 LEU 457 HD11 LEU 457 16.717 8.141 10.991 662 HD12 LEU 457 HD12 LEU 457 16.628 6.402 10.716 663 HD13 LEU 457 HD13 LEU 457 17.446 7.027 12.148 664 HD21 LEU 457 HD21 LEU 457 13.233 7.494 11.901 665 HD22 LEU 457 HD22 LEU 457 14.047 6.655 10.580 666 HD23 LEU 457 HD23 LEU 457 14.316 8.380 10.827 667 H ASN 458 HN ASN 458 14.981 4.711 15.797 668 HA ASN 458 HA ASN 458 14.844 1.937 15.391 669 HB2 ASN 458 HB2 ASN 458 15.631 3.731 17.546 670 HB3 ASN 458 HB1 ASN 458 14.860 2.272 18.159 671 HD21 ASN 458 HD21 ASN 458 17.642 3.190 18.317 672 HD22 ASN 458 HD22 ASN 458 18.589 1.909 17.642 673 H ALA 459 HN ALA 459 12.735 4.124 17.205 674 HA ALA 459 HA ALA 459 10.977 2.173 18.213 675 HB1 ALA 459 HB1 ALA 459 11.105 4.470 19.073 676 HB2 ALA 459 HB2 ALA 459 9.456 4.014 18.650 677 HB3 ALA 459 HB3 ALA 459 10.384 5.060 17.576 678 H MET 460 HN MET 460 10.923 4.089 15.247 679 HA MET 460 HA MET 460 8.403 3.244 14.313 680 HB2 MET 460 HB2 MET 460 10.833 4.286 12.855 681 HB3 MET 460 HB1 MET 460 9.301 3.966 12.060 682 HG2 MET 460 HG2 MET 460 8.205 5.605 13.492 683 HG3 MET 460 HG1 MET 460 9.736 5.919 14.305 684 HE1 MET 460 HE1 MET 460 9.510 9.229 12.381 685 HE2 MET 460 HE2 MET 460 9.924 8.435 13.900 686 HE3 MET 460 HE3 MET 460 8.268 8.379 13.299 687 H ALA 461 HN ALA 461 11.678 2.058 13.644 688 HA ALA 461 HA ALA 461 10.985 0.055 11.811 689 HB1 ALA 461 HB1 ALA 461 13.301 0.100 13.743 690 HB2 ALA 461 HB2 ALA 461 13.281 0.819 12.134 691 HB3 ALA 461 HB3 ALA 461 13.164 -0.931 12.319 692 H HIS 462 HN HIS 462 11.211 0.008 15.334 693 HA HIS 462 HA HIS 462 10.829 -2.741 15.722 694 HB2 HIS 462 HB2 HIS 462 11.574 -1.199 17.503 695 HB3 HIS 462 HB1 HIS 462 9.976 -0.460 17.525 696 HD2 HIS 462 HD2 HIS 462 11.426 -4.080 18.157 697 HE1 HIS 462 HE1 HIS 462 8.121 -3.350 20.693 698 HE2 HIS 462 HE2 HIS 462 9.801 -5.079 19.914 699 H GLN 463 HN GLN 463 8.512 -0.078 15.430 700 HA GLN 463 HA GLN 463 6.174 -1.528 15.972 701 HB2 GLN 463 HB2 GLN 463 6.157 0.894 15.927 702 HB3 GLN 463 HB1 GLN 463 6.612 0.907 14.228 703 HG2 GLN 463 HG2 GLN 463 4.266 1.408 14.460 704 HG3 GLN 463 HG1 GLN 463 4.471 -0.149 13.660 705 HE21 GLN 463 HE21 GLN 463 3.903 -2.036 14.747 706 HE22 GLN 463 HE22 GLN 463 2.899 -2.014 16.157 707 H ILE 464 HN ILE 464 7.954 -0.987 12.980 708 HA ILE 464 HA ILE 464 6.080 -2.282 11.286 709 HB ILE 464 HB ILE 464 9.033 -1.760 10.889 710 HG12 ILE 464 HG12 ILE 464 6.576 -0.349 9.820 711 HG13 ILE 464 HG11 ILE 464 7.619 0.254 11.102 712 HG21 ILE 464 HG21 ILE 464 8.656 -2.226 8.523 713 HG22 ILE 464 HG22 ILE 464 6.976 -2.644 8.861 714 HG23 ILE 464 HG23 ILE 464 8.279 -3.641 9.507 715 HD11 ILE 464 HD11 ILE 464 8.034 1.312 8.923 716 HD12 ILE 464 HD12 ILE 464 8.500 -0.258 8.271 717 HD13 ILE 464 HD13 ILE 464 9.451 0.480 9.561 718 H GLN 465 HN GLN 465 9.036 -3.362 12.937 719 HA GLN 465 HA GLN 465 9.131 -5.957 11.869 720 HB2 GLN 465 HB2 GLN 465 10.949 -4.790 13.175 721 HB3 GLN 465 HB1 GLN 465 10.046 -5.170 14.636 722 HG2 GLN 465 HG2 GLN 465 11.527 -6.913 14.570 723 HG3 GLN 465 HG1 GLN 465 10.151 -7.611 13.717 724 HE21 GLN 465 HE21 GLN 465 10.218 -7.587 11.372 725 HE22 GLN 465 HE22 GLN 465 11.751 -7.671 10.565 726 H GLU 466 HN GLU 466 7.340 -4.648 14.590 727 HA GLU 466 HA GLU 466 6.554 -7.081 15.758 728 HB2 GLU 466 HB2 GLU 466 5.426 -4.302 15.802 729 HB3 GLU 466 HB1 GLU 466 4.559 -5.624 16.571 730 HG2 GLU 466 HG2 GLU 466 7.401 -4.863 17.196 731 HG3 GLU 466 HG1 GLU 466 5.994 -4.332 18.117 732 H MET 467 HN MET 467 5.471 -5.482 12.905 733 HA MET 467 HA MET 467 3.142 -7.265 12.750 734 HB2 MET 467 HB2 MET 467 3.771 -4.713 11.261 735 HB3 MET 467 HB1 MET 467 2.375 -5.731 10.933 736 HG2 MET 467 HG2 MET 467 1.575 -5.372 13.214 737 HG3 MET 467 HG1 MET 467 2.971 -4.347 13.539 738 HE1 MET 467 HE1 MET 467 3.138 -2.688 10.648 739 HE2 MET 467 HE2 MET 467 3.494 -2.171 12.296 740 HE3 MET 467 HE3 MET 467 2.355 -1.253 11.313 741 H PHE 468 HN PHE 468 5.984 -6.147 10.982 742 HA PHE 468 HA PHE 468 5.632 -8.368 9.084 743 HB2 PHE 468 HB2 PHE 468 7.014 -5.701 8.836 744 HB3 PHE 468 HB1 PHE 468 7.358 -7.021 7.727 745 HD1 PHE 468 HD1 PHE 468 4.581 -4.949 9.051 746 HD2 PHE 468 HD2 PHE 468 6.031 -7.366 5.866 747 HE1 PHE 468 HE1 PHE 468 2.653 -4.287 7.676 748 HE2 PHE 468 HE2 PHE 468 4.107 -6.711 4.485 749 HZ PHE 468 HZ PHE 468 2.416 -5.167 5.389 750 HA PRO 469 HA PRO 469 9.303 -9.709 11.401 751 HB2 PRO 469 HB2 PRO 469 8.655 -12.298 11.590 752 HB3 PRO 469 HB1 PRO 469 7.842 -11.085 12.594 753 HG2 PRO 469 HG2 PRO 469 6.858 -12.503 10.188 754 HG3 PRO 469 HG1 PRO 469 5.978 -11.970 11.631 755 HD2 PRO 469 HD2 PRO 469 6.068 -10.634 9.166 756 HD3 PRO 469 HD1 PRO 469 5.480 -9.972 10.703 757 H GLN 470 HN GLN 470 8.175 -10.234 8.292 758 HA GLN 470 HA GLN 470 10.180 -12.183 7.526 759 HB2 GLN 470 HB2 GLN 470 9.175 -12.086 5.314 760 HB3 GLN 470 HB1 GLN 470 7.932 -12.302 6.538 761 HG2 GLN 470 HG2 GLN 470 7.258 -10.020 6.360 762 HG3 GLN 470 HG1 GLN 470 8.636 -9.640 5.326 763 HE21 GLN 470 HE21 GLN 470 7.307 -8.879 3.673 764 HE22 GLN 470 HE22 GLN 470 6.357 -9.937 2.691 765 H VAL 471 HN VAL 471 10.122 -8.860 7.922 766 HA VAL 471 HA VAL 471 12.155 -8.488 5.835 767 HB VAL 471 HB VAL 471 10.246 -6.988 5.589 768 HG11 VAL 471 HG11 VAL 471 9.770 -5.245 7.233 769 HG12 VAL 471 HG12 VAL 471 10.974 -5.941 8.318 770 HG13 VAL 471 HG13 VAL 471 9.525 -6.857 7.904 771 HG21 VAL 471 HG21 VAL 471 12.388 -6.177 4.841 772 HG22 VAL 471 HG22 VAL 471 12.773 -5.597 6.460 773 HG23 VAL 471 HG23 VAL 471 11.472 -4.842 5.542 774 HA PRO 472 HA PRO 472 15.216 -8.396 9.072 775 HB2 PRO 472 HB2 PRO 472 16.804 -6.915 7.060 776 HB3 PRO 472 HB1 PRO 472 17.179 -8.430 7.899 777 HG2 PRO 472 HG2 PRO 472 16.523 -8.414 5.329 778 HG3 PRO 472 HG1 PRO 472 15.999 -9.717 6.417 779 HD2 PRO 472 HD2 PRO 472 14.436 -7.411 5.345 780 HD3 PRO 472 HD1 PRO 472 13.937 -9.094 5.613 781 H TYR 473 HN TYR 473 15.674 -7.011 10.634 782 HA TYR 473 HA TYR 473 14.500 -4.524 10.895 783 HB2 TYR 473 HB2 TYR 473 15.616 -6.153 12.625 784 HB3 TYR 473 HB1 TYR 473 17.036 -5.150 12.359 785 HD1 TYR 473 HD2 TYR 473 13.518 -5.096 13.513 786 HD2 TYR 473 HD1 TYR 473 17.234 -3.029 13.395 787 HE1 TYR 473 HE2 TYR 473 12.672 -3.494 15.175 788 HE2 TYR 473 HE1 TYR 473 16.402 -1.423 15.061 789 HH TYR 473 HH TYR 473 14.079 -0.566 15.807 790 H HIS 474 HN HIS 474 17.849 -5.269 9.931 791 HA HIS 474 HA HIS 474 18.734 -2.595 9.894 792 HB2 HIS 474 HB2 HIS 474 20.671 -3.386 8.681 793 HB3 HIS 474 HB1 HIS 474 20.272 -4.522 9.958 794 HD2 HIS 474 HD2 HIS 474 20.687 -4.375 6.144 795 HE1 HIS 474 HE1 HIS 474 19.487 -8.291 7.193 796 HE2 HIS 474 HE2 HIS 474 20.520 -6.848 5.385 797 H LEU 475 HN LEU 475 17.069 -4.516 7.471 798 HA LEU 475 HA LEU 475 17.564 -2.704 5.322 799 HB2 LEU 475 HB2 LEU 475 15.596 -4.941 5.729 800 HB3 LEU 475 HB1 LEU 475 15.516 -3.909 4.312 801 HG LEU 475 HG LEU 475 17.763 -5.761 5.105 802 HD11 LEU 475 HD11 LEU 475 17.257 -6.868 3.022 803 HD12 LEU 475 HD12 LEU 475 16.034 -5.659 2.636 804 HD13 LEU 475 HD13 LEU 475 15.792 -6.756 3.994 805 HD21 LEU 475 HD21 LEU 475 18.848 -3.822 4.266 806 HD22 LEU 475 HD22 LEU 475 17.665 -3.638 2.971 807 HD23 LEU 475 HD23 LEU 475 18.802 -4.987 2.942 808 H VAL 476 HN VAL 476 15.034 -3.098 7.722 809 HA VAL 476 HA VAL 476 13.216 -1.211 6.674 810 HB VAL 476 HB VAL 476 13.626 -1.948 9.583 811 HG11 VAL 476 HG11 VAL 476 11.261 -0.762 8.134 812 HG12 VAL 476 HG12 VAL 476 12.261 0.026 9.355 813 HG13 VAL 476 HG13 VAL 476 11.237 -1.339 9.799 814 HG21 VAL 476 HG21 VAL 476 11.844 -3.219 7.507 815 HG22 VAL 476 HG22 VAL 476 11.852 -3.605 9.228 816 HG23 VAL 476 HG23 VAL 476 13.274 -3.943 8.243 817 H LEU 477 HN LEU 477 15.773 -0.952 9.112 818 HA LEU 477 HA LEU 477 15.434 1.783 9.678 819 HB2 LEU 477 HB2 LEU 477 17.644 -0.186 10.056 820 HB3 LEU 477 HB1 LEU 477 17.985 1.516 10.294 821 HG LEU 477 HG LEU 477 15.846 -0.023 11.769 822 HD11 LEU 477 HD11 LEU 477 17.373 0.150 13.696 823 HD12 LEU 477 HD12 LEU 477 18.609 0.815 12.628 824 HD13 LEU 477 HD13 LEU 477 18.037 -0.835 12.391 825 HD21 LEU 477 HD21 LEU 477 15.291 2.311 11.629 826 HD22 LEU 477 HD22 LEU 477 16.932 2.772 12.083 827 HD23 LEU 477 HD23 LEU 477 15.885 1.974 13.254 828 H GLN 478 HN GLN 478 17.036 0.138 7.084 829 HA GLN 478 HA GLN 478 18.715 2.254 6.239 830 HB2 GLN 478 HB2 GLN 478 19.028 -0.102 5.548 831 HB3 GLN 478 HB1 GLN 478 17.551 -0.004 4.600 832 HG2 GLN 478 HG2 GLN 478 18.682 1.931 3.376 833 HG3 GLN 478 HG1 GLN 478 20.172 1.372 4.133 834 HE21 GLN 478 HE21 GLN 478 17.560 -0.712 3.067 835 HE22 GLN 478 HE22 GLN 478 18.444 -1.473 1.794 836 H ASP 479 HN ASP 479 15.559 1.132 4.988 837 HA ASP 479 HA ASP 479 15.332 3.302 3.160 838 HB2 ASP 479 HB2 ASP 479 14.163 1.047 2.984 839 HB3 ASP 479 HB1 ASP 479 13.022 1.662 4.177 840 H LEU 480 HN LEU 480 14.539 2.889 6.499 841 HA LEU 480 HA LEU 480 12.575 4.853 6.815 842 HB2 LEU 480 HB2 LEU 480 14.135 3.212 8.494 843 HB3 LEU 480 HB1 LEU 480 14.386 4.853 9.053 844 HG LEU 480 HG LEU 480 12.604 3.951 10.332 845 HD11 LEU 480 HD11 LEU 480 11.196 5.573 8.229 846 HD12 LEU 480 HD12 LEU 480 12.339 6.284 9.366 847 HD13 LEU 480 HD13 LEU 480 10.874 5.503 9.961 848 HD21 LEU 480 HD21 LEU 480 12.058 2.083 8.833 849 HD22 LEU 480 HD22 LEU 480 11.248 3.210 7.744 850 HD23 LEU 480 HD23 LEU 480 10.619 2.949 9.370 851 H GLN 481 HN GLN 481 15.986 5.107 6.279 852 HA GLN 481 HA GLN 481 16.145 7.884 7.098 853 HB2 GLN 481 HB2 GLN 481 18.193 6.263 5.573 854 HB3 GLN 481 HB1 GLN 481 18.466 7.750 6.472 855 HG2 GLN 481 HG2 GLN 481 18.186 6.678 8.544 856 HG3 GLN 481 HG1 GLN 481 17.493 5.241 7.794 857 HE21 GLN 481 HE21 GLN 481 18.962 3.849 8.698 858 HE22 GLN 481 HE22 GLN 481 20.632 3.800 8.240 859 H LEU 482 HN LEU 482 15.124 6.188 4.404 860 HA LEU 482 HA LEU 482 15.795 8.315 2.505 861 HB2 LEU 482 HB2 LEU 482 15.092 5.447 2.294 862 HB3 LEU 482 HB1 LEU 482 14.468 6.479 1.024 863 HG LEU 482 HG LEU 482 16.591 5.410 0.396 864 HD11 LEU 482 HD11 LEU 482 17.780 7.476 -0.295 865 HD12 LEU 482 HD12 LEU 482 16.691 8.400 0.738 866 HD13 LEU 482 HD13 LEU 482 16.050 7.506 -0.639 867 HD21 LEU 482 HD21 LEU 482 17.619 5.235 2.584 868 HD22 LEU 482 HD22 LEU 482 17.728 6.991 2.697 869 HD23 LEU 482 HD23 LEU 482 18.677 6.125 1.488 870 H THR 483 HN THR 483 12.952 6.320 3.351 871 HA THR 483 HA THR 483 11.140 8.181 2.150 872 HB THR 483 HB THR 483 9.448 6.712 3.529 873 HG1 THR 483 HG1 THR 483 11.373 4.700 3.344 874 HG21 THR 483 HG21 THR 483 9.560 4.987 1.753 875 HG22 THR 483 HG22 THR 483 11.107 5.656 1.236 876 HG23 THR 483 HG23 THR 483 9.641 6.628 1.115 877 H ARG 484 HN ARG 484 12.256 7.509 5.406 878 HA ARG 484 HA ARG 484 12.125 8.639 7.365 879 HB2 ARG 484 HB2 ARG 484 11.304 10.941 5.589 880 HB3 ARG 484 HB1 ARG 484 11.767 11.081 7.276 881 HG2 ARG 484 HG2 ARG 484 13.973 10.862 6.841 882 HG3 ARG 484 HG1 ARG 484 13.710 9.748 5.496 883 HD2 ARG 484 HD2 ARG 484 13.044 11.571 4.067 884 HD3 ARG 484 HD1 ARG 484 13.136 12.706 5.410 885 HE ARG 484 HE ARG 484 15.577 12.199 5.436 886 HH11 ARG 484 HH11 ARG 484 13.720 11.680 2.510 887 HH12 ARG 484 HH12 ARG 484 15.072 11.938 1.460 888 HH21 ARG 484 HH21 ARG 484 17.356 12.530 4.052 889 HH22 ARG 484 HH22 ARG 484 17.145 12.416 2.333 890 H SER 485 HN SER 485 9.735 7.332 6.118 891 HA SER 485 HA SER 485 7.853 8.032 8.151 892 HB2 SER 485 HB2 SER 485 7.641 9.580 5.905 893 HB3 SER 485 HB1 SER 485 6.552 8.252 5.511 894 HG SER 485 HG SER 485 5.482 8.642 7.511 895 H VAL 486 HN VAL 486 7.283 6.087 8.806 896 HA VAL 486 HA VAL 486 7.704 3.679 7.546 897 HB VAL 486 HB VAL 486 6.083 2.697 9.158 898 HG11 VAL 486 HG11 VAL 486 7.957 4.718 10.379 899 HG12 VAL 486 HG12 VAL 486 8.441 3.146 9.745 900 HG13 VAL 486 HG13 VAL 486 7.362 3.241 11.136 901 HG21 VAL 486 HG21 VAL 486 4.453 4.520 9.201 902 HG22 VAL 486 HG22 VAL 486 5.640 5.569 9.976 903 HG23 VAL 486 HG23 VAL 486 5.032 4.149 10.826 904 H GLU 487 HN GLU 487 4.967 5.811 7.210 905 HA GLU 487 HA GLU 487 3.101 4.028 6.121 906 HB2 GLU 487 HB2 GLU 487 3.423 6.955 5.455 907 HB3 GLU 487 HB1 GLU 487 1.962 5.991 5.286 908 HG2 GLU 487 HG2 GLU 487 1.458 6.973 7.246 909 HG3 GLU 487 HG1 GLU 487 2.399 5.632 7.896 910 H ILE 488 HN ILE 488 5.775 5.756 4.675 911 HA ILE 488 HA ILE 488 5.028 4.877 1.992 912 HB ILE 488 HB ILE 488 7.581 6.315 2.625 913 HG12 ILE 488 HG12 ILE 488 4.894 7.667 2.322 914 HG13 ILE 488 HG11 ILE 488 5.771 7.506 3.835 915 HG21 ILE 488 HG21 ILE 488 5.690 6.372 0.278 916 HG22 ILE 488 HG22 ILE 488 7.255 5.562 0.349 917 HG23 ILE 488 HG23 ILE 488 7.169 7.322 0.413 918 HD11 ILE 488 HD11 ILE 488 6.623 9.062 1.409 919 HD12 ILE 488 HD12 ILE 488 7.616 8.827 2.847 920 HD13 ILE 488 HD13 ILE 488 6.093 9.711 2.960 921 H THR 489 HN THR 489 7.349 4.282 4.513 922 HA THR 489 HA THR 489 9.283 2.823 3.121 923 HB THR 489 HB THR 489 8.498 2.227 5.968 924 HG1 THR 489 HG1 THR 489 10.071 4.414 5.003 925 HG21 THR 489 HG21 THR 489 10.266 0.855 4.918 926 HG22 THR 489 HG22 THR 489 10.872 1.824 6.260 927 HG23 THR 489 HG23 THR 489 11.187 2.328 4.599 928 H THR 490 HN THR 490 6.601 1.568 5.103 929 HA THR 490 HA THR 490 7.022 -1.132 4.495 930 HB THR 490 HB THR 490 4.261 -0.167 5.064 931 HG1 THR 490 HG1 THR 490 5.335 1.155 6.466 932 HG21 THR 490 HG21 THR 490 4.747 -2.566 4.968 933 HG22 THR 490 HG22 THR 490 4.294 -2.077 6.600 934 HG23 THR 490 HG23 THR 490 5.989 -2.367 6.205 935 H ASP 491 HN ASP 491 5.090 1.341 2.897 936 HA ASP 491 HA ASP 491 3.735 -0.384 1.112 937 HB2 ASP 491 HB2 ASP 491 2.839 1.794 1.340 938 HB3 ASP 491 HB1 ASP 491 4.395 2.555 1.025 939 H ASN 492 HN ASN 492 6.668 1.571 0.796 940 HA ASN 492 HA ASN 492 7.286 0.884 -1.843 941 HB2 ASN 492 HB2 ASN 492 8.918 1.892 0.464 942 HB3 ASN 492 HB1 ASN 492 9.699 1.459 -1.054 943 HD21 ASN 492 HD21 ASN 492 6.460 2.713 -1.070 944 HD22 ASN 492 HD22 ASN 492 6.851 4.280 -1.683 945 H ILE 493 HN ILE 493 7.810 -0.831 1.149 946 HA ILE 493 HA ILE 493 9.685 -2.723 0.172 947 HB ILE 493 HB ILE 493 7.659 -2.980 2.412 948 HG12 ILE 493 HG12 ILE 493 10.639 -2.453 2.504 949 HG13 ILE 493 HG11 ILE 493 9.388 -1.231 2.721 950 HG21 ILE 493 HG21 ILE 493 8.917 -4.912 3.175 951 HG22 ILE 493 HG22 ILE 493 10.018 -4.762 1.806 952 HG23 ILE 493 HG23 ILE 493 8.327 -5.181 1.534 953 HD11 ILE 493 HD11 ILE 493 9.956 -3.584 4.506 954 HD12 ILE 493 HD12 ILE 493 8.586 -2.493 4.701 955 HD13 ILE 493 HD13 ILE 493 10.232 -1.879 4.864 956 H LEU 494 HN LEU 494 6.164 -2.661 0.399 957 HA LEU 494 HA LEU 494 5.722 -5.224 -0.746 958 HB2 LEU 494 HB2 LEU 494 3.929 -2.805 -0.472 959 HB3 LEU 494 HB1 LEU 494 3.379 -4.367 -1.050 960 HG LEU 494 HG LEU 494 4.671 -4.091 1.652 961 HD11 LEU 494 HD11 LEU 494 2.356 -4.009 2.566 962 HD12 LEU 494 HD12 LEU 494 1.781 -3.668 0.934 963 HD13 LEU 494 HD13 LEU 494 2.862 -2.529 1.741 964 HD21 LEU 494 HD21 LEU 494 3.940 -6.260 0.199 965 HD22 LEU 494 HD22 LEU 494 2.486 -5.976 1.173 966 HD23 LEU 494 HD23 LEU 494 4.052 -6.218 1.960 967 H GLU 495 HN GLU 495 6.136 -2.008 -2.012 968 HA GLU 495 HA GLU 495 5.237 -2.434 -4.649 969 HB2 GLU 495 HB2 GLU 495 7.178 -0.481 -3.425 970 HB3 GLU 495 HB1 GLU 495 6.814 -0.472 -5.145 971 HG2 GLU 495 HG2 GLU 495 4.701 -0.235 -3.028 972 HG3 GLU 495 HG1 GLU 495 5.529 1.154 -3.732 973 H GLY 496 HN GLY 496 8.402 -2.784 -3.126 974 HA2 GLY 496 HA2 GLY 496 9.735 -4.695 -3.984 975 HA3 GLY 496 HA1 GLY 496 9.354 -4.104 -5.594 976 H ARG 497 HN ARG 497 10.010 -1.743 -3.163 977 HA ARG 497 HA ARG 497 12.328 -0.828 -4.595 978 HB2 ARG 497 HB2 ARG 497 10.769 0.753 -3.525 979 HB3 ARG 497 HB1 ARG 497 11.177 0.088 -1.950 980 HG2 ARG 497 HG2 ARG 497 12.696 1.705 -1.821 981 HG3 ARG 497 HG1 ARG 497 13.628 0.771 -2.994 982 HD2 ARG 497 HD2 ARG 497 13.446 3.027 -3.786 983 HD3 ARG 497 HD1 ARG 497 12.456 1.990 -4.811 984 HE ARG 497 HE ARG 497 11.156 3.392 -2.596 985 HH11 ARG 497 HH11 ARG 497 11.740 3.165 -6.047 986 HH12 ARG 497 HH12 ARG 497 10.343 4.107 -6.469 987 HH21 ARG 497 HH21 ARG 497 9.333 4.624 -3.149 988 HH22 ARG 497 HH22 ARG 497 8.992 4.955 -4.823 989 H ILE 498 HN ILE 498 11.669 -2.516 -1.607 990 HA ILE 498 HA ILE 498 14.535 -2.723 -1.034 991 HB ILE 498 HB ILE 498 12.103 -3.280 0.676 992 HG12 ILE 498 HG12 ILE 498 13.509 -1.582 2.139 993 HG13 ILE 498 HG11 ILE 498 14.207 -1.154 0.581 994 HG21 ILE 498 HG21 ILE 498 13.780 -4.993 1.133 995 HG22 ILE 498 HG22 ILE 498 13.637 -3.875 2.489 996 HG23 ILE 498 HG23 ILE 498 15.000 -3.742 1.379 997 HD11 ILE 498 HD11 ILE 498 11.354 -0.912 1.470 998 HD12 ILE 498 HD12 ILE 498 11.833 -0.812 -0.222 999 HD13 ILE 498 HD13 ILE 498 12.455 0.359 0.940 1000 H GLN 499 HN GLN 499 15.572 -4.651 -1.148 1001 HA GLN 499 HA GLN 499 14.429 -6.718 -2.699 1002 HB2 GLN 499 HB2 GLN 499 16.904 -7.009 -1.007 1003 HB3 GLN 499 HB1 GLN 499 16.517 -7.825 -2.514 1004 HG2 GLN 499 HG2 GLN 499 17.304 -4.953 -2.115 1005 HG3 GLN 499 HG1 GLN 499 18.176 -6.207 -2.994 1006 HE21 GLN 499 HE21 GLN 499 17.212 -3.563 -3.832 1007 HE22 GLN 499 HE22 GLN 499 16.186 -3.837 -5.202 1008 H VAL 500 HN VAL 500 13.120 -8.267 -2.080 1009 HA VAL 500 HA VAL 500 12.548 -8.757 0.679 1010 HB VAL 500 HB VAL 500 11.126 -10.670 -0.341 1011 HG11 VAL 500 HG11 VAL 500 10.214 -8.573 0.512 1012 HG12 VAL 500 HG12 VAL 500 9.361 -9.090 -0.945 1013 HG13 VAL 500 HG13 VAL 500 10.550 -7.790 -1.032 1014 HG21 VAL 500 HG21 VAL 500 11.669 -9.079 -2.847 1015 HG22 VAL 500 HG22 VAL 500 10.590 -10.464 -2.679 1016 HG23 VAL 500 HG23 VAL 500 12.332 -10.678 -2.512 1017 HA PRO 501 HA PRO 501 15.415 -11.962 1.636 1018 HB2 PRO 501 HB2 PRO 501 13.132 -13.325 2.967 1019 HB3 PRO 501 HB1 PRO 501 14.695 -12.828 3.639 1020 HG2 PRO 501 HG2 PRO 501 12.512 -11.496 4.244 1021 HG3 PRO 501 HG1 PRO 501 14.037 -10.642 3.929 1022 HD2 PRO 501 HD2 PRO 501 11.657 -10.969 2.152 1023 HD3 PRO 501 HD1 PRO 501 12.683 -9.544 2.417 1024 H PHE 502 HN PHE 502 15.991 -13.148 -0.069 1025 HA PHE 502 HA PHE 502 14.357 -15.490 -0.715 1026 HB2 PHE 502 HB2 PHE 502 15.204 -13.332 -2.544 1027 HB3 PHE 502 HB1 PHE 502 15.533 -14.962 -3.125 1028 HD1 PHE 502 HD1 PHE 502 12.883 -12.652 -2.036 1029 HD2 PHE 502 HD2 PHE 502 13.792 -16.396 -3.837 1030 HE1 PHE 502 HE1 PHE 502 10.537 -12.872 -2.742 1031 HE2 PHE 502 HE2 PHE 502 11.449 -16.623 -4.552 1032 HZ PHE 502 HZ PHE 502 9.820 -14.861 -4.005 1033 HA PRO 503 HA PRO 503 18.120 -17.605 0.239 1034 HB2 PRO 503 HB2 PRO 503 17.640 -19.846 -1.330 1035 HB3 PRO 503 HB1 PRO 503 17.024 -19.602 0.314 1036 HG2 PRO 503 HG2 PRO 503 15.653 -19.197 -2.290 1037 HG3 PRO 503 HG1 PRO 503 15.021 -19.847 -0.765 1038 HD2 PRO 503 HD2 PRO 503 14.473 -17.352 -1.550 1039 HD3 PRO 503 HD1 PRO 503 14.725 -17.755 0.162 1040 H THR 504 HN THR 504 19.981 -16.881 -0.606 1041 HA THR 504 HA THR 504 20.854 -17.775 -3.157 1042 HB THR 504 HB THR 504 19.408 -15.861 -3.847 1043 HG1 THR 504 HG1 THR 504 22.154 -16.046 -4.372 1044 HG21 THR 504 HG21 THR 504 19.705 -14.349 -1.993 1045 HG22 THR 504 HG22 THR 504 20.278 -13.563 -3.464 1046 HG23 THR 504 HG23 THR 504 21.433 -14.233 -2.312 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 -18.564 -11.156 14.873 2 H2 MET 1 HT2 MET 1 -18.316 -12.634 14.084 3 H3 MET 1 HT3 MET 1 -17.770 -11.192 13.382 4 HA MET 1 HA MET 1 -16.803 -12.085 16.011 5 HB2 MET 1 HB2 MET 1 -14.943 -13.192 15.009 6 HB3 MET 1 HB1 MET 1 -16.389 -13.842 14.252 7 HG2 MET 1 HG2 MET 1 -16.010 -12.388 12.315 8 HG3 MET 1 HG1 MET 1 -14.539 -11.782 13.076 9 HE1 MET 1 HE1 MET 1 -13.071 -13.998 10.222 10 HE2 MET 1 HE2 MET 1 -13.041 -12.416 11.000 11 HE3 MET 1 HE3 MET 1 -14.493 -12.956 10.157 12 H GLN 2 HN GLN 2 -14.598 -11.125 16.373 13 HA GLN 2 HA GLN 2 -14.531 -8.423 15.208 14 HB2 GLN 2 HB2 GLN 2 -13.409 -9.307 17.868 15 HB3 GLN 2 HB1 GLN 2 -13.531 -7.658 17.271 16 HG2 GLN 2 HG2 GLN 2 -15.938 -9.385 17.707 17 HG3 GLN 2 HG1 GLN 2 -15.235 -8.399 18.986 18 HE21 GLN 2 HE21 GLN 2 -17.850 -8.283 17.615 19 HE22 GLN 2 HE22 GLN 2 -17.984 -6.660 17.033 20 H ILE 3 HN ILE 3 -12.570 -7.539 14.583 21 HA ILE 3 HA ILE 3 -10.224 -9.315 14.638 22 HB ILE 3 HB ILE 3 -9.604 -8.409 12.376 23 HG12 ILE 3 HG12 ILE 3 -12.526 -7.690 12.132 24 HG13 ILE 3 HG11 ILE 3 -11.293 -6.500 12.534 25 HG21 ILE 3 HG21 ILE 3 -11.030 -9.971 11.138 26 HG22 ILE 3 HG22 ILE 3 -12.101 -10.088 12.534 27 HG23 ILE 3 HG23 ILE 3 -10.439 -10.669 12.646 28 HD11 ILE 3 HD11 ILE 3 -11.368 -8.160 10.022 29 HD12 ILE 3 HD12 ILE 3 -10.169 -6.931 10.424 30 HD13 ILE 3 HD13 ILE 3 -11.850 -6.470 10.161 31 H PHE 4 HN PHE 4 -8.183 -8.191 14.564 32 HA PHE 4 HA PHE 4 -8.440 -5.436 15.570 33 HB2 PHE 4 HB2 PHE 4 -6.277 -7.493 16.047 34 HB3 PHE 4 HB1 PHE 4 -6.205 -5.829 16.613 35 HD1 PHE 4 HD1 PHE 4 -8.196 -5.052 18.101 36 HD2 PHE 4 HD2 PHE 4 -7.162 -9.120 17.416 37 HE1 PHE 4 HE1 PHE 4 -9.383 -5.698 20.158 38 HE2 PHE 4 HE2 PHE 4 -8.346 -9.773 19.472 39 HZ PHE 4 HZ PHE 4 -9.456 -8.061 20.845 40 H VAL 5 HN VAL 5 -8.135 -4.081 13.917 41 HA VAL 5 HA VAL 5 -6.161 -4.663 11.860 42 HB VAL 5 HB VAL 5 -7.913 -2.214 12.156 43 HG11 VAL 5 HG11 VAL 5 -7.455 -1.875 9.785 44 HG12 VAL 5 HG12 VAL 5 -6.424 -3.305 9.770 45 HG13 VAL 5 HG13 VAL 5 -5.959 -1.893 10.719 46 HG21 VAL 5 HG21 VAL 5 -9.412 -3.251 10.543 47 HG22 VAL 5 HG22 VAL 5 -9.260 -4.262 11.979 48 HG23 VAL 5 HG23 VAL 5 -8.395 -4.692 10.504 49 H LYS 6 HN LYS 6 -4.114 -4.170 12.225 50 HA LYS 6 HA LYS 6 -3.449 -2.074 14.155 51 HB2 LYS 6 HB2 LYS 6 -2.445 -4.520 14.001 52 HB3 LYS 6 HB1 LYS 6 -1.383 -3.772 12.818 53 HG2 LYS 6 HG2 LYS 6 -0.856 -2.043 14.590 54 HG3 LYS 6 HG1 LYS 6 -1.674 -3.115 15.730 55 HD2 LYS 6 HD2 LYS 6 -0.119 -4.939 14.940 56 HD3 LYS 6 HD1 LYS 6 0.787 -3.685 14.088 57 HE2 LYS 6 HE2 LYS 6 1.927 -3.845 16.092 58 HE3 LYS 6 HE1 LYS 6 0.828 -2.501 16.391 59 HZ1 LYS 6 HZ1 LYS 6 0.752 -3.930 18.262 60 HZ2 LYS 6 HZ2 LYS 6 0.523 -5.303 17.305 61 HZ3 LYS 6 HZ3 LYS 6 -0.703 -4.148 17.429 62 H THR 7 HN THR 7 -2.430 -0.217 13.607 63 HA THR 7 HA THR 7 -1.864 0.181 10.751 64 HB THR 7 HB THR 7 -2.138 2.644 11.282 65 HG1 THR 7 HG1 THR 7 -3.385 1.597 13.630 66 HG21 THR 7 HG21 THR 7 -4.541 0.852 11.643 67 HG22 THR 7 HG22 THR 7 -3.870 1.399 10.108 68 HG23 THR 7 HG23 THR 7 -4.596 2.565 11.215 69 H LEU 8 HN LEU 8 -0.162 1.860 10.341 70 HA LEU 8 HA LEU 8 2.250 1.107 11.625 71 HB2 LEU 8 HB2 LEU 8 1.759 3.461 9.804 72 HB3 LEU 8 HB1 LEU 8 3.305 2.708 10.150 73 HG LEU 8 HG LEU 8 1.052 1.215 8.827 74 HD11 LEU 8 HD11 LEU 8 3.039 3.110 7.699 75 HD12 LEU 8 HD12 LEU 8 1.375 2.787 7.209 76 HD13 LEU 8 HD13 LEU 8 2.657 1.651 6.785 77 HD21 LEU 8 HD21 LEU 8 2.720 -0.347 8.216 78 HD22 LEU 8 HD22 LEU 8 2.952 -0.016 9.932 79 HD23 LEU 8 HD23 LEU 8 4.017 0.726 8.738 80 H THR 9 HN THR 9 -0.096 3.455 12.355 81 HA THR 9 HA THR 9 1.679 5.239 13.776 82 HB THR 9 HB THR 9 -0.924 5.814 14.560 83 HG1 THR 9 HG1 THR 9 -2.181 5.563 12.739 84 HG21 THR 9 HG21 THR 9 0.641 6.884 12.207 85 HG22 THR 9 HG22 THR 9 0.744 7.451 13.874 86 HG23 THR 9 HG23 THR 9 -0.745 7.675 12.958 87 H GLY 10 HN GLY 10 0.218 2.281 14.392 88 HA2 GLY 10 HA2 GLY 10 0.643 1.067 16.394 89 HA3 GLY 10 HA1 GLY 10 0.709 2.590 17.269 90 H LYS 11 HN LYS 11 -1.831 3.132 15.460 91 HA LYS 11 HA LYS 11 -3.708 2.671 17.546 92 HB2 LYS 11 HB2 LYS 11 -3.882 4.584 15.976 93 HB3 LYS 11 HB1 LYS 11 -4.211 3.465 14.662 94 HG2 LYS 11 HG2 LYS 11 -6.259 2.744 15.790 95 HG3 LYS 11 HG1 LYS 11 -5.929 3.875 17.102 96 HD2 LYS 11 HD2 LYS 11 -6.072 5.748 15.532 97 HD3 LYS 11 HD1 LYS 11 -6.385 4.620 14.210 98 HE2 LYS 11 HE2 LYS 11 -8.471 3.959 15.173 99 HE3 LYS 11 HE1 LYS 11 -8.127 4.839 16.661 100 HZ1 LYS 11 HZ1 LYS 11 -8.090 6.889 15.199 101 HZ2 LYS 11 HZ2 LYS 11 -9.598 6.179 15.464 102 HZ3 LYS 11 HZ3 LYS 11 -8.799 5.936 13.987 103 H THR 12 HN THR 12 -5.032 0.998 17.894 104 HA THR 12 HA THR 12 -5.116 -1.135 15.864 105 HB THR 12 HB THR 12 -5.827 -1.514 18.765 106 HG1 THR 12 HG1 THR 12 -3.452 -0.767 17.882 107 HG21 THR 12 HG21 THR 12 -6.427 -3.287 17.169 108 HG22 THR 12 HG22 THR 12 -5.180 -3.829 18.293 109 HG23 THR 12 HG23 THR 12 -4.745 -3.376 16.646 110 H ILE 13 HN ILE 13 -6.929 -1.040 14.719 111 HA ILE 13 HA ILE 13 -9.378 -0.014 15.964 112 HB ILE 13 HB ILE 13 -8.997 -0.664 13.046 113 HG12 ILE 13 HG12 ILE 13 -8.619 2.070 14.266 114 HG13 ILE 13 HG11 ILE 13 -7.268 0.974 13.992 115 HG21 ILE 13 HG21 ILE 13 -10.877 1.196 14.492 116 HG22 ILE 13 HG22 ILE 13 -11.295 -0.369 13.793 117 HG23 ILE 13 HG23 ILE 13 -10.803 0.961 12.745 118 HD11 ILE 13 HD11 ILE 13 -7.744 0.964 11.610 119 HD12 ILE 13 HD12 ILE 13 -7.495 2.607 12.200 120 HD13 ILE 13 HD13 ILE 13 -9.127 2.027 11.872 121 H THR 14 HN THR 14 -10.854 -1.399 16.665 122 HA THR 14 HA THR 14 -10.767 -4.170 15.728 123 HB THR 14 HB THR 14 -12.423 -3.074 18.002 124 HG1 THR 14 HG1 THR 14 -9.741 -3.316 17.814 125 HG21 THR 14 HG21 THR 14 -13.078 -5.287 17.203 126 HG22 THR 14 HG22 THR 14 -12.328 -5.407 18.795 127 HG23 THR 14 HG23 THR 14 -11.412 -5.851 17.354 128 H LEU 15 HN LEU 15 -12.099 -4.717 14.135 129 HA LEU 15 HA LEU 15 -14.611 -3.209 13.843 130 HB2 LEU 15 HB2 LEU 15 -12.824 -4.440 11.757 131 HB3 LEU 15 HB1 LEU 15 -14.462 -3.927 11.417 132 HG LEU 15 HG LEU 15 -12.273 -2.096 12.401 133 HD11 LEU 15 HD11 LEU 15 -11.721 -2.815 10.195 134 HD12 LEU 15 HD12 LEU 15 -12.386 -1.186 10.083 135 HD13 LEU 15 HD13 LEU 15 -13.378 -2.577 9.644 136 HD21 LEU 15 HD21 LEU 15 -14.448 -1.296 13.057 137 HD22 LEU 15 HD22 LEU 15 -15.080 -1.567 11.432 138 HD23 LEU 15 HD23 LEU 15 -13.860 -0.324 11.709 139 H GLU 16 HN GLU 16 -16.451 -4.321 13.138 140 HA GLU 16 HA GLU 16 -16.537 -7.095 14.021 141 HB2 GLU 16 HB2 GLU 16 -18.181 -5.305 14.790 142 HB3 GLU 16 HB1 GLU 16 -18.852 -5.364 13.167 143 HG2 GLU 16 HG2 GLU 16 -19.209 -7.834 13.542 144 HG3 GLU 16 HG1 GLU 16 -18.813 -7.541 15.235 145 H VAL 17 HN VAL 17 -16.330 -8.649 12.580 146 HA VAL 17 HA VAL 17 -17.479 -8.306 9.894 147 HB VAL 17 HB VAL 17 -15.484 -9.512 8.946 148 HG11 VAL 17 HG11 VAL 17 -14.006 -7.496 8.945 149 HG12 VAL 17 HG12 VAL 17 -15.084 -6.775 10.141 150 HG13 VAL 17 HG13 VAL 17 -15.691 -7.173 8.533 151 HG21 VAL 17 HG21 VAL 17 -14.584 -10.444 10.987 152 HG22 VAL 17 HG22 VAL 17 -14.294 -8.828 11.634 153 HG23 VAL 17 HG23 VAL 17 -13.381 -9.397 10.235 154 H GLU 18 HN GLU 18 -17.230 -10.564 8.724 155 HA GLU 18 HA GLU 18 -17.618 -12.789 10.578 156 HB2 GLU 18 HB2 GLU 18 -19.675 -11.674 8.710 157 HB3 GLU 18 HB1 GLU 18 -19.619 -13.414 8.960 158 HG2 GLU 18 HG2 GLU 18 -19.902 -11.375 11.157 159 HG3 GLU 18 HG1 GLU 18 -21.238 -12.254 10.420 160 HA PRO 19 HA PRO 19 -15.324 -15.225 7.686 161 HB2 PRO 19 HB2 PRO 19 -17.646 -17.094 7.485 162 HB3 PRO 19 HB1 PRO 19 -15.952 -17.436 7.886 163 HG2 PRO 19 HG2 PRO 19 -17.789 -17.440 9.773 164 HG3 PRO 19 HG1 PRO 19 -16.180 -16.749 10.069 165 HD2 PRO 19 HD2 PRO 19 -18.767 -15.355 9.578 166 HD3 PRO 19 HD1 PRO 19 -17.433 -14.915 10.661 167 H SER 20 HN SER 20 -18.653 -14.515 6.813 168 HA SER 20 HA SER 20 -18.251 -15.089 4.015 169 HB2 SER 20 HB2 SER 20 -20.637 -13.808 4.132 170 HB3 SER 20 HB1 SER 20 -20.435 -15.528 4.462 171 HG SER 20 HG SER 20 -21.528 -13.986 6.084 172 H ASP 21 HN ASP 21 -17.373 -12.535 5.943 173 HA ASP 21 HA ASP 21 -18.106 -10.357 4.230 174 HB2 ASP 21 HB2 ASP 21 -17.384 -10.433 6.806 175 HB3 ASP 21 HB1 ASP 21 -15.808 -10.084 6.103 176 H THR 22 HN THR 22 -16.793 -9.185 2.840 177 HA THR 22 HA THR 22 -14.579 -10.729 1.704 178 HB THR 22 HB THR 22 -15.044 -8.576 0.024 179 HG1 THR 22 HG1 THR 22 -17.605 -9.605 0.604 180 HG21 THR 22 HG21 THR 22 -16.299 -11.320 -0.106 181 HG22 THR 22 HG22 THR 22 -14.665 -10.916 -0.634 182 HG23 THR 22 HG23 THR 22 -16.057 -10.219 -1.463 183 H ILE 23 HN ILE 23 -12.594 -9.733 1.183 184 HA ILE 23 HA ILE 23 -11.501 -8.061 3.125 185 HB ILE 23 HB ILE 23 -10.503 -8.428 0.294 186 HG12 ILE 23 HG12 ILE 23 -10.792 -10.595 1.354 187 HG13 ILE 23 HG11 ILE 23 -9.074 -10.215 1.271 188 HG21 ILE 23 HG21 ILE 23 -8.317 -7.850 1.173 189 HG22 ILE 23 HG22 ILE 23 -8.999 -7.640 2.787 190 HG23 ILE 23 HG23 ILE 23 -9.466 -6.549 1.483 191 HD11 ILE 23 HD11 ILE 23 -10.842 -9.997 3.695 192 HD12 ILE 23 HD12 ILE 23 -9.144 -9.522 3.631 193 HD13 ILE 23 HD13 ILE 23 -9.599 -11.209 3.393 194 H GLU 24 HN GLU 24 -12.797 -7.297 -0.071 195 HA GLU 24 HA GLU 24 -12.106 -4.598 -0.195 196 HB2 GLU 24 HB2 GLU 24 -13.066 -6.024 -2.047 197 HB3 GLU 24 HB1 GLU 24 -14.641 -5.807 -1.298 198 HG2 GLU 24 HG2 GLU 24 -14.176 -3.294 -1.503 199 HG3 GLU 24 HG1 GLU 24 -12.901 -3.766 -2.623 200 H ASN 25 HN ASN 25 -14.941 -6.180 1.217 201 HA ASN 25 HA ASN 25 -16.335 -3.814 1.870 202 HB2 ASN 25 HB2 ASN 25 -17.274 -6.176 1.793 203 HB3 ASN 25 HB1 ASN 25 -16.534 -6.421 3.374 204 HD21 ASN 25 HD21 ASN 25 -18.418 -6.680 4.479 205 HD22 ASN 25 HD22 ASN 25 -19.555 -5.387 4.728 206 H VAL 26 HN VAL 26 -13.936 -5.738 3.572 207 HA VAL 26 HA VAL 26 -14.109 -4.441 6.070 208 HB VAL 26 HB VAL 26 -11.675 -5.736 4.818 209 HG11 VAL 26 HG11 VAL 26 -11.086 -4.343 6.715 210 HG12 VAL 26 HG12 VAL 26 -10.927 -6.047 7.141 211 HG13 VAL 26 HG13 VAL 26 -12.324 -5.125 7.699 212 HG21 VAL 26 HG21 VAL 26 -13.531 -7.287 4.865 213 HG22 VAL 26 HG22 VAL 26 -13.845 -6.908 6.559 214 HG23 VAL 26 HG23 VAL 26 -12.355 -7.735 6.100 215 H LYS 27 HN LYS 27 -12.193 -3.821 3.174 216 HA LYS 27 HA LYS 27 -10.632 -1.703 4.158 217 HB2 LYS 27 HB2 LYS 27 -11.624 -2.102 1.324 218 HB3 LYS 27 HB1 LYS 27 -10.256 -1.116 1.818 219 HG2 LYS 27 HG2 LYS 27 -9.975 -3.820 2.774 220 HG3 LYS 27 HG1 LYS 27 -10.205 -3.777 1.026 221 HD2 LYS 27 HD2 LYS 27 -8.212 -2.040 2.461 222 HD3 LYS 27 HD1 LYS 27 -7.815 -3.642 1.838 223 HE2 LYS 27 HE2 LYS 27 -9.035 -1.536 0.082 224 HE3 LYS 27 HE1 LYS 27 -7.298 -1.595 0.370 225 HZ1 LYS 27 HZ1 LYS 27 -8.952 -3.778 -0.797 226 HZ2 LYS 27 HZ2 LYS 27 -7.285 -3.859 -0.487 227 HZ3 LYS 27 HZ3 LYS 27 -7.873 -2.774 -1.634 228 H ALA 28 HN ALA 28 -13.839 -1.805 2.716 229 HA ALA 28 HA ALA 28 -14.253 0.971 2.480 230 HB1 ALA 28 HB1 ALA 28 -15.645 -0.688 1.337 231 HB2 ALA 28 HB2 ALA 28 -16.624 0.416 2.303 232 HB3 ALA 28 HB3 ALA 28 -16.297 -1.214 2.890 233 H LYS 29 HN LYS 29 -14.820 -1.314 5.106 234 HA LYS 29 HA LYS 29 -16.194 0.459 6.820 235 HB2 LYS 29 HB2 LYS 29 -14.546 -1.998 7.448 236 HB3 LYS 29 HB1 LYS 29 -15.547 -1.150 8.621 237 HG2 LYS 29 HG2 LYS 29 -17.536 -1.672 7.400 238 HG3 LYS 29 HG1 LYS 29 -16.599 -2.346 6.067 239 HD2 LYS 29 HD2 LYS 29 -15.752 -4.093 7.597 240 HD3 LYS 29 HD1 LYS 29 -16.785 -3.440 8.871 241 HE2 LYS 29 HE2 LYS 29 -18.745 -3.813 7.359 242 HE3 LYS 29 HE1 LYS 29 -17.659 -4.642 6.249 243 HZ1 LYS 29 HZ1 LYS 29 -17.712 -5.545 9.030 244 HZ2 LYS 29 HZ2 LYS 29 -17.481 -6.443 7.605 245 HZ3 LYS 29 HZ3 LYS 29 -19.032 -5.930 8.050 246 H ILE 30 HN ILE 30 -12.776 -0.261 6.363 247 HA ILE 30 HA ILE 30 -11.849 1.311 8.541 248 HB ILE 30 HB ILE 30 -10.349 0.576 6.015 249 HG12 ILE 30 HG12 ILE 30 -10.437 -0.862 8.681 250 HG13 ILE 30 HG11 ILE 30 -11.287 -1.389 7.233 251 HG21 ILE 30 HG21 ILE 30 -9.290 2.373 7.275 252 HG22 ILE 30 HG22 ILE 30 -8.341 0.892 7.383 253 HG23 ILE 30 HG23 ILE 30 -9.346 1.395 8.741 254 HD11 ILE 30 HD11 ILE 30 -9.278 -2.669 7.509 255 HD12 ILE 30 HD12 ILE 30 -8.307 -1.200 7.597 256 HD13 ILE 30 HD13 ILE 30 -9.118 -1.633 6.091 257 H GLN 31 HN GLN 31 -12.566 1.937 5.171 258 HA GLN 31 HA GLN 31 -11.509 4.579 5.082 259 HB2 GLN 31 HB2 GLN 31 -11.902 3.234 3.059 260 HB3 GLN 31 HB1 GLN 31 -13.633 3.267 3.371 261 HG2 GLN 31 HG2 GLN 31 -13.394 5.814 3.260 262 HG3 GLN 31 HG1 GLN 31 -11.831 5.494 2.510 263 HE21 GLN 31 HE21 GLN 31 -12.467 6.392 0.560 264 HE22 GLN 31 HE22 GLN 31 -13.576 5.595 -0.505 265 H ASP 32 HN ASP 32 -14.510 3.159 6.071 266 HA ASP 32 HA ASP 32 -16.053 5.552 6.124 267 HB2 ASP 32 HB2 ASP 32 -17.217 3.472 5.979 268 HB3 ASP 32 HB1 ASP 32 -16.389 2.832 7.392 269 H LYS 33 HN LYS 33 -14.032 3.854 8.433 270 HA LYS 33 HA LYS 33 -14.790 5.655 10.579 271 HB2 LYS 33 HB2 LYS 33 -12.849 3.344 10.508 272 HB3 LYS 33 HB1 LYS 33 -13.252 4.271 11.948 273 HG2 LYS 33 HG2 LYS 33 -15.228 2.685 10.310 274 HG3 LYS 33 HG1 LYS 33 -14.469 2.138 11.806 275 HD2 LYS 33 HD2 LYS 33 -15.538 3.851 13.070 276 HD3 LYS 33 HD1 LYS 33 -16.105 4.658 11.608 277 HE2 LYS 33 HE2 LYS 33 -17.068 2.028 11.468 278 HE3 LYS 33 HE1 LYS 33 -17.342 2.554 13.125 279 HZ1 LYS 33 HZ1 LYS 33 -18.405 4.576 12.187 280 HZ2 LYS 33 HZ2 LYS 33 -19.231 3.144 11.826 281 HZ3 LYS 33 HZ3 LYS 33 -18.279 3.889 10.640 282 H GLU 34 HN GLU 34 -11.795 4.867 8.789 283 HA GLU 34 HA GLU 34 -10.425 7.061 10.118 284 HB2 GLU 34 HB2 GLU 34 -9.560 4.855 8.281 285 HB3 GLU 34 HB1 GLU 34 -8.510 6.238 8.568 286 HG2 GLU 34 HG2 GLU 34 -9.568 4.312 10.624 287 HG3 GLU 34 HG1 GLU 34 -7.903 4.462 10.061 288 H GLY 35 HN GLY 35 -11.526 6.225 6.859 289 HA2 GLY 35 HA2 GLY 35 -12.308 7.970 5.392 290 HA3 GLY 35 HA1 GLY 35 -11.144 9.055 6.140 291 H ILE 36 HN ILE 36 -9.343 6.492 5.939 292 HA ILE 36 HA ILE 36 -7.859 7.365 3.697 293 HB ILE 36 HB ILE 36 -7.669 4.732 5.170 294 HG12 ILE 36 HG12 ILE 36 -6.006 7.220 5.572 295 HG13 ILE 36 HG11 ILE 36 -7.422 6.848 6.547 296 HG21 ILE 36 HG21 ILE 36 -6.557 4.635 3.016 297 HG22 ILE 36 HG22 ILE 36 -5.361 4.678 4.312 298 HG23 ILE 36 HG23 ILE 36 -5.694 6.132 3.371 299 HD11 ILE 36 HD11 ILE 36 -5.362 6.213 7.671 300 HD12 ILE 36 HD12 ILE 36 -4.948 5.149 6.327 301 HD13 ILE 36 HD13 ILE 36 -6.360 4.801 7.323 302 HA PRO 37 HA PRO 37 -10.335 5.451 0.486 303 HB2 PRO 37 HB2 PRO 37 -7.824 5.808 -1.065 304 HB3 PRO 37 HB1 PRO 37 -9.467 6.367 -1.431 305 HG2 PRO 37 HG2 PRO 37 -7.593 8.062 -0.635 306 HG3 PRO 37 HG1 PRO 37 -9.280 8.233 -0.117 307 HD2 PRO 37 HD2 PRO 37 -6.938 7.214 1.416 308 HD3 PRO 37 HD1 PRO 37 -8.320 8.183 1.967 309 HA PRO 38 HA PRO 38 -9.076 1.196 0.653 310 HB2 PRO 38 HB2 PRO 38 -10.255 0.970 -2.066 311 HB3 PRO 38 HB1 PRO 38 -10.658 0.081 -0.585 312 HG2 PRO 38 HG2 PRO 38 -12.281 1.942 -1.548 313 HG3 PRO 38 HG1 PRO 38 -12.045 1.726 0.199 314 HD2 PRO 38 HD2 PRO 38 -10.935 3.829 -1.605 315 HD3 PRO 38 HD1 PRO 38 -11.508 3.959 0.071 316 H ASP 39 HN ASP 39 -8.382 3.187 -2.126 317 HA ASP 39 HA ASP 39 -6.581 1.441 -3.434 318 HB2 ASP 39 HB2 ASP 39 -7.062 4.405 -3.569 319 HB3 ASP 39 HB1 ASP 39 -5.765 3.648 -4.487 320 H GLN 40 HN GLN 40 -6.265 3.314 -0.609 321 HA GLN 40 HA GLN 40 -3.326 3.144 -0.779 322 HB2 GLN 40 HB2 GLN 40 -4.991 4.981 0.957 323 HB3 GLN 40 HB1 GLN 40 -3.237 4.978 0.832 324 HG2 GLN 40 HG2 GLN 40 -3.422 5.604 -1.536 325 HG3 GLN 40 HG1 GLN 40 -5.176 5.657 -1.369 326 HE21 GLN 40 HE21 GLN 40 -3.291 7.745 -2.120 327 HE22 GLN 40 HE22 GLN 40 -3.516 9.032 -0.988 328 H GLN 41 HN GLN 41 -5.575 1.270 0.182 329 HA GLN 41 HA GLN 41 -4.555 0.794 2.901 330 HB2 GLN 41 HB2 GLN 41 -7.158 0.020 1.595 331 HB3 GLN 41 HB1 GLN 41 -6.625 -0.637 3.130 332 HG2 GLN 41 HG2 GLN 41 -6.546 1.713 3.996 333 HG3 GLN 41 HG1 GLN 41 -7.335 2.205 2.495 334 HE21 GLN 41 HE21 GLN 41 -9.233 2.867 3.481 335 HE22 GLN 41 HE22 GLN 41 -10.350 1.740 4.174 336 H ARG 42 HN ARG 42 -2.972 -0.692 2.843 337 HA ARG 42 HA ARG 42 -3.345 -3.027 1.080 338 HB2 ARG 42 HB2 ARG 42 -0.780 -2.105 2.386 339 HB3 ARG 42 HB1 ARG 42 -0.954 -3.368 1.176 340 HG2 ARG 42 HG2 ARG 42 -1.813 -1.567 -0.378 341 HG3 ARG 42 HG1 ARG 42 -1.264 -0.402 0.828 342 HD2 ARG 42 HD2 ARG 42 0.477 -0.611 -0.770 343 HD3 ARG 42 HD1 ARG 42 1.008 -1.469 0.675 344 HE ARG 42 HE ARG 42 -0.120 -3.438 -0.784 345 HH11 ARG 42 HH11 ARG 42 2.293 -0.991 -1.535 346 HH12 ARG 42 HH12 ARG 42 3.032 -1.953 -2.794 347 HH21 ARG 42 HH21 ARG 42 0.868 -4.683 -2.417 348 HH22 ARG 42 HH22 ARG 42 2.239 -4.047 -3.273 349 H LEU 43 HN LEU 43 -4.500 -4.429 2.325 350 HA LEU 43 HA LEU 43 -3.859 -4.782 5.125 351 HB2 LEU 43 HB2 LEU 43 -5.986 -5.812 3.298 352 HB3 LEU 43 HB1 LEU 43 -5.677 -6.644 4.809 353 HG LEU 43 HG LEU 43 -6.389 -3.717 4.604 354 HD11 LEU 43 HD11 LEU 43 -8.250 -5.080 3.844 355 HD12 LEU 43 HD12 LEU 43 -8.598 -4.390 5.430 356 HD13 LEU 43 HD13 LEU 43 -8.128 -6.084 5.289 357 HD21 LEU 43 HD21 LEU 43 -6.834 -3.976 7.029 358 HD22 LEU 43 HD22 LEU 43 -5.140 -4.209 6.606 359 HD23 LEU 43 HD23 LEU 43 -6.161 -5.604 6.946 360 H ILE 44 HN ILE 44 -2.291 -6.041 5.753 361 HA ILE 44 HA ILE 44 -1.630 -8.426 4.162 362 HB ILE 44 HB ILE 44 0.076 -6.596 5.825 363 HG12 ILE 44 HG12 ILE 44 1.591 -7.076 3.747 364 HG13 ILE 44 HG11 ILE 44 0.095 -7.651 3.019 365 HG21 ILE 44 HG21 ILE 44 0.579 -8.796 6.699 366 HG22 ILE 44 HG22 ILE 44 1.920 -8.230 5.701 367 HG23 ILE 44 HG23 ILE 44 0.789 -9.427 5.066 368 HD11 ILE 44 HD11 ILE 44 0.458 -5.373 2.392 369 HD12 ILE 44 HD12 ILE 44 0.639 -4.892 4.079 370 HD13 ILE 44 HD13 ILE 44 -0.925 -5.452 3.484 371 H PHE 45 HN PHE 45 -1.671 -10.391 5.109 372 HA PHE 45 HA PHE 45 -2.116 -10.513 8.009 373 HB2 PHE 45 HB2 PHE 45 -4.282 -10.763 6.807 374 HB3 PHE 45 HB1 PHE 45 -3.616 -12.152 5.955 375 HD1 PHE 45 HD1 PHE 45 -4.160 -10.913 9.429 376 HD2 PHE 45 HD2 PHE 45 -4.015 -14.252 6.799 377 HE1 PHE 45 HE1 PHE 45 -4.895 -12.383 11.259 378 HE2 PHE 45 HE2 PHE 45 -4.751 -15.729 8.623 379 HZ PHE 45 HZ PHE 45 -5.191 -14.797 10.860 380 H ALA 46 HN ALA 46 -0.495 -11.565 8.843 381 HA ALA 46 HA ALA 46 1.043 -13.144 9.315 382 HB1 ALA 46 HB1 ALA 46 0.716 -15.405 8.572 383 HB2 ALA 46 HB2 ALA 46 -0.367 -14.867 7.288 384 HB3 ALA 46 HB3 ALA 46 -0.845 -14.689 8.976 385 H GLY 47 HN GLY 47 1.447 -11.227 7.021 386 HA2 GLY 47 HA2 GLY 47 3.720 -10.960 6.203 387 HA3 GLY 47 HA1 GLY 47 3.753 -12.684 5.895 388 H LYS 48 HN LYS 48 0.908 -12.346 4.709 389 HA LYS 48 HA LYS 48 1.855 -11.266 2.133 390 HB2 LYS 48 HB2 LYS 48 0.253 -13.718 2.760 391 HB3 LYS 48 HB1 LYS 48 0.028 -12.911 1.216 392 HG2 LYS 48 HG2 LYS 48 1.823 -13.916 0.406 393 HG3 LYS 48 HG1 LYS 48 2.820 -13.204 1.676 394 HD2 LYS 48 HD2 LYS 48 1.159 -15.671 2.134 395 HD3 LYS 48 HD1 LYS 48 2.802 -15.751 1.493 396 HE2 LYS 48 HE2 LYS 48 3.621 -14.570 3.483 397 HE3 LYS 48 HE1 LYS 48 1.978 -14.522 4.122 398 HZ1 LYS 48 HZ1 LYS 48 1.973 -16.947 4.133 399 HZ2 LYS 48 HZ2 LYS 48 3.221 -16.335 5.093 400 HZ3 LYS 48 HZ3 LYS 48 3.563 -16.967 3.562 401 H GLN 49 HN GLN 49 0.327 -10.263 0.769 402 HA GLN 49 HA GLN 49 -1.601 -8.706 2.251 403 HB2 GLN 49 HB2 GLN 49 -0.029 -7.846 0.430 404 HB3 GLN 49 HB1 GLN 49 -1.128 -8.590 -0.719 405 HG2 GLN 49 HG2 GLN 49 -2.954 -7.210 0.316 406 HG3 GLN 49 HG1 GLN 49 -1.698 -6.349 1.200 407 HE21 GLN 49 HE21 GLN 49 -3.144 -6.922 -1.907 408 HE22 GLN 49 HE22 GLN 49 -2.354 -5.626 -2.736 409 H LEU 50 HN LEU 50 -3.798 -8.556 1.804 410 HA LEU 50 HA LEU 50 -4.959 -11.003 0.701 411 HB2 LEU 50 HB2 LEU 50 -6.524 -8.859 2.083 412 HB3 LEU 50 HB1 LEU 50 -6.842 -10.581 2.004 413 HG LEU 50 HG LEU 50 -4.599 -9.336 3.600 414 HD11 LEU 50 HD11 LEU 50 -7.242 -10.421 4.565 415 HD12 LEU 50 HD12 LEU 50 -6.813 -8.713 4.469 416 HD13 LEU 50 HD13 LEU 50 -5.940 -9.781 5.567 417 HD21 LEU 50 HD21 LEU 50 -5.093 -12.006 2.760 418 HD22 LEU 50 HD22 LEU 50 -5.353 -11.916 4.502 419 HD23 LEU 50 HD23 LEU 50 -3.815 -11.397 3.811 420 H GLU 51 HN GLU 51 -6.324 -11.002 -1.032 421 HA GLU 51 HA GLU 51 -6.329 -8.602 -2.671 422 HB2 GLU 51 HB2 GLU 51 -7.318 -11.410 -3.160 423 HB3 GLU 51 HB1 GLU 51 -7.500 -10.111 -4.324 424 HG2 GLU 51 HG2 GLU 51 -5.045 -9.876 -4.389 425 HG3 GLU 51 HG1 GLU 51 -4.914 -11.250 -3.291 426 H ASP 52 HN ASP 52 -8.175 -7.528 -3.383 427 HA ASP 52 HA ASP 52 -10.254 -7.231 -1.505 428 HB2 ASP 52 HB2 ASP 52 -9.792 -6.222 -4.284 429 HB3 ASP 52 HB1 ASP 52 -11.368 -5.994 -3.536 430 H GLY 53 HN GLY 53 -9.946 -9.253 -4.326 431 HA2 GLY 53 HA2 GLY 53 -12.787 -9.885 -4.358 432 HA3 GLY 53 HA1 GLY 53 -11.573 -10.498 -5.464 433 H ARG 54 HN ARG 54 -11.204 -10.633 -1.979 434 HA ARG 54 HA ARG 54 -11.751 -13.530 -2.066 435 HB2 ARG 54 HB2 ARG 54 -9.548 -12.270 -0.430 436 HB3 ARG 54 HB1 ARG 54 -9.851 -13.982 -0.676 437 HG2 ARG 54 HG2 ARG 54 -9.073 -12.099 -2.877 438 HG3 ARG 54 HG1 ARG 54 -7.915 -13.040 -1.936 439 HD2 ARG 54 HD2 ARG 54 -8.843 -15.096 -2.727 440 HD3 ARG 54 HD1 ARG 54 -10.196 -14.254 -3.481 441 HE ARG 54 HE ARG 54 -7.440 -13.755 -4.400 442 HH11 ARG 54 HH11 ARG 54 -10.721 -14.826 -5.026 443 HH12 ARG 54 HH12 ARG 54 -10.486 -14.953 -6.738 444 HH21 ARG 54 HH21 ARG 54 -7.135 -13.902 -6.639 445 HH22 ARG 54 HH22 ARG 54 -8.439 -14.429 -7.657 446 H THR 55 HN THR 55 -12.166 -14.457 0.098 447 HA THR 55 HA THR 55 -13.655 -12.529 1.747 448 HB THR 55 HB THR 55 -14.870 -14.488 2.623 449 HG1 THR 55 HG1 THR 55 -13.277 -15.940 0.733 450 HG21 THR 55 HG21 THR 55 -14.828 -14.311 -0.398 451 HG22 THR 55 HG22 THR 55 -15.815 -13.340 0.697 452 HG23 THR 55 HG23 THR 55 -16.101 -15.074 0.558 453 H LEU 56 HN LEU 56 -13.733 -13.206 4.138 454 HA LEU 56 HA LEU 56 -11.076 -13.250 5.133 455 HB2 LEU 56 HB2 LEU 56 -13.715 -13.625 6.553 456 HB3 LEU 56 HB1 LEU 56 -12.173 -13.438 7.368 457 HG LEU 56 HG LEU 56 -13.456 -11.371 5.577 458 HD11 LEU 56 HD11 LEU 56 -13.183 -11.486 8.575 459 HD12 LEU 56 HD12 LEU 56 -14.678 -11.640 7.651 460 HD13 LEU 56 HD13 LEU 56 -13.791 -10.116 7.648 461 HD21 LEU 56 HD21 LEU 56 -11.696 -9.893 6.480 462 HD22 LEU 56 HD22 LEU 56 -11.053 -11.205 5.496 463 HD23 LEU 56 HD23 LEU 56 -10.951 -11.289 7.255 464 H SER 57 HN SER 57 -13.433 -15.705 4.490 465 HA SER 57 HA SER 57 -12.239 -17.754 6.077 466 HB2 SER 57 HB2 SER 57 -14.086 -18.018 3.688 467 HB3 SER 57 HB1 SER 57 -13.738 -19.269 4.882 468 HG SER 57 HG SER 57 -15.276 -16.929 5.132 469 H ASP 58 HN ASP 58 -11.637 -16.421 2.953 470 HA ASP 58 HA ASP 58 -10.366 -18.586 1.694 471 HB2 ASP 58 HB2 ASP 58 -10.340 -15.626 1.346 472 HB3 ASP 58 HB1 ASP 58 -9.089 -16.563 0.538 473 H TYR 59 HN TYR 59 -9.203 -16.195 3.976 474 HA TYR 59 HA TYR 59 -6.515 -17.348 3.791 475 HB2 TYR 59 HB2 TYR 59 -7.424 -14.758 5.058 476 HB3 TYR 59 HB1 TYR 59 -5.759 -15.329 4.979 477 HD1 TYR 59 HD1 TYR 59 -4.672 -15.599 2.724 478 HD2 TYR 59 HD2 TYR 59 -8.393 -13.607 3.239 479 HE1 TYR 59 HE1 TYR 59 -4.404 -14.541 0.520 480 HE2 TYR 59 HE2 TYR 59 -8.138 -12.544 1.038 481 HH TYR 59 HH TYR 59 -5.843 -13.568 -1.239 482 H ASN 60 HN ASN 60 -9.100 -18.160 5.331 483 HA ASN 60 HA ASN 60 -9.635 -19.192 7.282 484 HB2 ASN 60 HB2 ASN 60 -6.747 -19.711 6.919 485 HB3 ASN 60 HB1 ASN 60 -7.377 -19.998 8.539 486 HD21 ASN 60 HD21 ASN 60 -6.428 -21.764 6.269 487 HD22 ASN 60 HD22 ASN 60 -7.689 -22.937 6.104 488 H ILE 61 HN ILE 61 -9.566 -16.429 7.448 489 HA ILE 61 HA ILE 61 -8.131 -15.646 9.822 490 HB ILE 61 HB ILE 61 -10.218 -14.170 8.207 491 HG12 ILE 61 HG12 ILE 61 -7.227 -13.766 8.333 492 HG13 ILE 61 HG11 ILE 61 -8.037 -14.703 7.083 493 HG21 ILE 61 HG21 ILE 61 -9.499 -12.166 9.410 494 HG22 ILE 61 HG22 ILE 61 -8.417 -13.145 10.399 495 HG23 ILE 61 HG23 ILE 61 -10.162 -13.368 10.520 496 HD11 ILE 61 HD11 ILE 61 -8.500 -11.783 7.635 497 HD12 ILE 61 HD12 ILE 61 -9.216 -12.732 6.331 498 HD13 ILE 61 HD13 ILE 61 -7.477 -12.436 6.357 499 H GLN 62 HN GLN 62 -8.829 -15.804 11.832 500 HA GLN 62 HA GLN 62 -11.624 -16.587 12.297 501 HB2 GLN 62 HB2 GLN 62 -9.140 -17.025 13.962 502 HB3 GLN 62 HB1 GLN 62 -10.764 -17.430 14.495 503 HG2 GLN 62 HG2 GLN 62 -10.762 -19.338 13.375 504 HG3 GLN 62 HG1 GLN 62 -10.151 -18.571 11.908 505 HE21 GLN 62 HE21 GLN 62 -8.014 -18.729 11.417 506 HE22 GLN 62 HE22 GLN 62 -6.869 -19.603 12.380 507 H LYS 63 HN LYS 63 -11.784 -16.059 14.992 508 HA LYS 63 HA LYS 63 -12.163 -13.210 14.963 509 HB2 LYS 63 HB2 LYS 63 -13.266 -13.506 17.079 510 HB3 LYS 63 HB1 LYS 63 -13.789 -14.796 16.007 511 HG2 LYS 63 HG2 LYS 63 -12.354 -16.371 17.106 512 HG3 LYS 63 HG1 LYS 63 -11.639 -15.089 18.086 513 HD2 LYS 63 HD2 LYS 63 -14.035 -14.670 18.910 514 HD3 LYS 63 HD1 LYS 63 -14.394 -16.260 18.235 515 HE2 LYS 63 HE2 LYS 63 -12.674 -17.255 19.646 516 HE3 LYS 63 HE1 LYS 63 -12.267 -15.665 20.287 517 HZ1 LYS 63 HZ1 LYS 63 -14.533 -15.508 21.160 518 HZ2 LYS 63 HZ2 LYS 63 -13.692 -16.821 21.815 519 HZ3 LYS 63 HZ3 LYS 63 -14.853 -17.076 20.614 520 H GLU 64 HN GLU 64 -11.217 -11.721 16.360 521 HA GLU 64 HA GLU 64 -9.581 -10.708 17.547 522 HB2 GLU 64 HB2 GLU 64 -9.141 -13.502 18.594 523 HB3 GLU 64 HB1 GLU 64 -8.292 -12.090 19.206 524 HG2 GLU 64 HG2 GLU 64 -10.304 -11.129 20.018 525 HG3 GLU 64 HG1 GLU 64 -11.287 -12.331 19.181 526 H SER 65 HN SER 65 -9.083 -11.987 14.867 527 HA SER 65 HA SER 65 -6.274 -12.633 14.908 528 HB2 SER 65 HB2 SER 65 -8.083 -12.084 12.540 529 HB3 SER 65 HB1 SER 65 -6.488 -12.838 12.485 530 HG SER 65 HG SER 65 -8.938 -13.898 13.216 531 H THR 66 HN THR 66 -4.600 -11.368 14.029 532 HA THR 66 HA THR 66 -5.138 -8.497 14.148 533 HB THR 66 HB THR 66 -2.416 -9.765 13.929 534 HG1 THR 66 HG1 THR 66 -4.186 -10.052 15.937 535 HG21 THR 66 HG21 THR 66 -2.575 -7.328 13.619 536 HG22 THR 66 HG22 THR 66 -1.703 -7.738 15.095 537 HG23 THR 66 HG23 THR 66 -3.376 -7.187 15.183 538 H LEU 67 HN LEU 67 -5.318 -7.333 12.370 539 HA LEU 67 HA LEU 67 -4.205 -8.390 9.852 540 HB2 LEU 67 HB2 LEU 67 -6.641 -6.757 10.473 541 HB3 LEU 67 HB1 LEU 67 -5.880 -6.601 8.902 542 HG LEU 67 HG LEU 67 -6.118 -9.177 8.771 543 HD11 LEU 67 HD11 LEU 67 -8.010 -10.078 10.023 544 HD12 LEU 67 HD12 LEU 67 -8.164 -8.552 10.893 545 HD13 LEU 67 HD13 LEU 67 -6.721 -9.543 11.101 546 HD21 LEU 67 HD21 LEU 67 -8.513 -7.350 8.632 547 HD22 LEU 67 HD22 LEU 67 -8.407 -8.949 7.895 548 HD23 LEU 67 HD23 LEU 67 -7.344 -7.653 7.347 549 H HIS 68 HN HIS 68 -2.580 -7.270 8.956 550 HA HIS 68 HA HIS 68 -1.787 -4.767 10.223 551 HB2 HIS 68 HB2 HIS 68 -0.379 -6.512 8.190 552 HB3 HIS 68 HB1 HIS 68 0.304 -5.061 8.914 553 HD2 HIS 68 HD2 HIS 68 0.454 -5.318 11.866 554 HE1 HIS 68 HE1 HIS 68 1.094 -9.481 11.494 555 HE2 HIS 68 HE2 HIS 68 1.486 -7.437 12.938 556 H LEU 69 HN LEU 69 -2.461 -2.895 9.420 557 HA LEU 69 HA LEU 69 -3.244 -2.764 6.604 558 HB2 LEU 69 HB2 LEU 69 -4.860 -1.979 8.276 559 HB3 LEU 69 HB1 LEU 69 -3.697 -0.801 8.853 560 HG LEU 69 HG LEU 69 -3.755 0.278 6.600 561 HD11 LEU 69 HD11 LEU 69 -5.637 -0.262 5.116 562 HD12 LEU 69 HD12 LEU 69 -6.031 -1.643 6.140 563 HD13 LEU 69 HD13 LEU 69 -4.496 -1.597 5.271 564 HD21 LEU 69 HD21 LEU 69 -6.351 0.068 8.113 565 HD22 LEU 69 HD22 LEU 69 -5.991 1.299 6.902 566 HD23 LEU 69 HD23 LEU 69 -5.049 1.224 8.391 567 H VAL 70 HN VAL 70 -1.508 -2.413 5.373 568 HA VAL 70 HA VAL 70 0.521 -0.497 6.194 569 HB VAL 70 HB VAL 70 0.289 -2.498 3.964 570 HG11 VAL 70 HG11 VAL 70 2.254 -0.226 4.128 571 HG12 VAL 70 HG12 VAL 70 1.166 -0.627 2.800 572 HG13 VAL 70 HG13 VAL 70 2.531 -1.681 3.169 573 HG21 VAL 70 HG21 VAL 70 1.117 -3.274 6.109 574 HG22 VAL 70 HG22 VAL 70 2.361 -2.023 6.099 575 HG23 VAL 70 HG23 VAL 70 2.398 -3.315 4.898 576 H LEU 71 HN LEU 71 0.699 1.518 5.381 577 HA LEU 71 HA LEU 71 -1.414 2.472 3.627 578 HB2 LEU 71 HB2 LEU 71 0.511 3.700 5.512 579 HB3 LEU 71 HB1 LEU 71 0.086 4.668 4.113 580 HG LEU 71 HG LEU 71 -2.030 3.456 5.874 581 HD11 LEU 71 HD11 LEU 71 -0.733 6.158 6.196 582 HD12 LEU 71 HD12 LEU 71 -0.564 4.796 7.303 583 HD13 LEU 71 HD13 LEU 71 -2.137 5.563 7.084 584 HD21 LEU 71 HD21 LEU 71 -3.317 5.390 4.978 585 HD22 LEU 71 HD22 LEU 71 -2.821 4.224 3.752 586 HD23 LEU 71 HD23 LEU 71 -1.951 5.750 3.923 587 H ARG 72 HN ARG 72 -1.001 3.662 1.713 588 HA ARG 72 HA ARG 72 1.638 3.164 0.512 589 HB2 ARG 72 HB2 ARG 72 0.287 1.548 -0.534 590 HB3 ARG 72 HB1 ARG 72 -1.101 2.625 -0.609 591 HG2 ARG 72 HG2 ARG 72 0.111 3.993 -2.286 592 HG3 ARG 72 HG1 ARG 72 1.408 2.796 -2.270 593 HD2 ARG 72 HD2 ARG 72 -1.395 1.914 -2.769 594 HD3 ARG 72 HD1 ARG 72 -0.492 2.692 -4.065 595 HE ARG 72 HE ARG 72 1.150 0.714 -3.035 596 HH11 ARG 72 HH11 ARG 72 -1.978 0.921 -4.601 597 HH12 ARG 72 HH12 ARG 72 -1.839 -0.617 -5.386 598 HH21 ARG 72 HH21 ARG 72 1.356 -1.315 -4.104 599 HH22 ARG 72 HH22 ARG 72 0.053 -1.892 -5.101 600 H LEU 73 HN LEU 73 2.493 4.775 -0.687 601 HA LEU 73 HA LEU 73 0.858 7.099 -1.370 602 HB2 LEU 73 HB2 LEU 73 3.368 7.166 0.295 603 HB3 LEU 73 HB1 LEU 73 2.802 8.563 -0.598 604 HG LEU 73 HG LEU 73 0.564 7.838 0.818 605 HD11 LEU 73 HD11 LEU 73 1.868 6.181 2.079 606 HD12 LEU 73 HD12 LEU 73 1.251 7.475 3.107 607 HD13 LEU 73 HD13 LEU 73 2.947 7.465 2.623 608 HD21 LEU 73 HD21 LEU 73 1.371 10.096 0.505 609 HD22 LEU 73 HD22 LEU 73 2.738 9.783 1.574 610 HD23 LEU 73 HD23 LEU 73 1.097 9.787 2.220 611 H ARG 74 HN ARG 74 1.304 7.821 -3.360 612 HA ARG 74 HA ARG 74 3.488 6.550 -4.805 613 HB2 ARG 74 HB2 ARG 74 1.185 8.279 -5.722 614 HB3 ARG 74 HB1 ARG 74 2.441 7.689 -6.799 615 HG2 ARG 74 HG2 ARG 74 0.435 6.060 -5.263 616 HG3 ARG 74 HG1 ARG 74 0.575 6.239 -7.015 617 HD2 ARG 74 HD2 ARG 74 2.872 5.209 -6.804 618 HD3 ARG 74 HD1 ARG 74 2.452 4.819 -5.137 619 HE ARG 74 HE ARG 74 0.516 3.882 -7.041 620 HH11 ARG 74 HH11 ARG 74 3.518 3.144 -5.395 621 HH12 ARG 74 HH12 ARG 74 3.397 1.433 -5.687 622 HH21 ARG 74 HH21 ARG 74 0.362 1.625 -7.405 623 HH22 ARG 74 HH22 ARG 74 1.619 0.578 -6.815 624 H GLY 75 HN GLY 75 2.616 9.591 -3.445 625 HA2 GLY 75 HA2 GLY 75 5.000 10.837 -4.657 626 HA3 GLY 75 HA1 GLY 75 3.595 11.725 -4.081 627 H GLY 76 HN GLY 76 6.548 11.726 -3.352 628 HA2 GLY 76 HA2 GLY 76 6.108 11.936 -0.498 629 HA3 GLY 76 HA1 GLY 76 7.257 10.693 -0.980 630 H1 SER 453 HT1 SER 453 21.144 9.725 15.735 631 H2 SER 453 HT2 SER 453 22.380 8.919 16.557 632 H3 SER 453 HT3 SER 453 22.172 10.585 16.759 633 HA SER 453 HA SER 453 21.352 9.276 18.647 634 HB2 SER 453 HB2 SER 453 18.862 10.426 17.617 635 HB3 SER 453 HB1 SER 453 19.832 10.907 19.011 636 HG SER 453 HG SER 453 19.611 12.231 16.822 637 H ASN 454 HN ASN 454 19.127 9.037 15.870 638 HA ASN 454 HA ASN 454 17.825 7.375 15.072 639 HB2 ASN 454 HB2 ASN 454 19.773 5.717 16.655 640 HB3 ASN 454 HB1 ASN 454 18.414 4.979 15.813 641 HD21 ASN 454 HD21 ASN 454 19.695 3.857 14.394 642 HD22 ASN 454 HD22 ASN 454 20.588 4.623 13.128 643 H SER 455 HN SER 455 17.321 8.727 17.727 644 HA SER 455 HA SER 455 16.016 6.945 19.457 645 HB2 SER 455 HB2 SER 455 15.102 9.782 19.168 646 HB3 SER 455 HB1 SER 455 15.373 8.838 20.634 647 HG SER 455 HG SER 455 17.268 9.731 20.693 648 H GLN 456 HN GLN 456 14.741 9.044 16.881 649 HA GLN 456 HA GLN 456 12.084 7.973 17.132 650 HB2 GLN 456 HB2 GLN 456 13.408 9.921 15.272 651 HB3 GLN 456 HB1 GLN 456 11.819 9.273 14.889 652 HG2 GLN 456 HG2 GLN 456 12.561 10.774 17.382 653 HG3 GLN 456 HG1 GLN 456 11.652 11.413 16.013 654 HE21 GLN 456 HE21 GLN 456 10.905 11.151 18.823 655 HE22 GLN 456 HE22 GLN 456 9.450 10.219 18.839 656 H LEU 457 HN LEU 457 14.849 7.514 15.024 657 HA LEU 457 HA LEU 457 13.676 6.020 12.999 658 HB2 LEU 457 HB2 LEU 457 16.444 5.998 14.165 659 HB3 LEU 457 HB1 LEU 457 16.004 4.946 12.835 660 HG LEU 457 HG LEU 457 15.713 7.944 12.716 661 HD11 LEU 457 HD11 LEU 457 17.768 7.892 11.346 662 HD12 LEU 457 HD12 LEU 457 17.989 6.202 11.800 663 HD13 LEU 457 HD13 LEU 457 18.050 7.461 13.031 664 HD21 LEU 457 HD21 LEU 457 14.318 6.789 11.137 665 HD22 LEU 457 HD22 LEU 457 15.666 5.765 10.637 666 HD23 LEU 457 HD23 LEU 457 15.690 7.491 10.280 667 H ASN 458 HN ASN 458 15.181 4.857 16.016 668 HA ASN 458 HA ASN 458 14.631 2.120 15.534 669 HB2 ASN 458 HB2 ASN 458 15.474 3.726 17.897 670 HB3 ASN 458 HB1 ASN 458 14.823 2.119 18.193 671 HD21 ASN 458 HD21 ASN 458 17.534 3.260 18.503 672 HD22 ASN 458 HD22 ASN 458 18.573 2.200 17.617 673 H ALA 459 HN ALA 459 12.835 4.669 17.148 674 HA ALA 459 HA ALA 459 10.838 3.055 18.313 675 HB1 ALA 459 HB1 ALA 459 11.229 5.355 19.015 676 HB2 ALA 459 HB2 ALA 459 9.555 5.138 18.511 677 HB3 ALA 459 HB3 ALA 459 10.702 5.940 17.438 678 H MET 460 HN MET 460 11.025 4.724 15.198 679 HA MET 460 HA MET 460 8.400 3.982 14.364 680 HB2 MET 460 HB2 MET 460 10.799 5.010 12.850 681 HB3 MET 460 HB1 MET 460 9.241 4.706 12.094 682 HG2 MET 460 HG2 MET 460 8.189 6.357 13.503 683 HG3 MET 460 HG1 MET 460 9.698 6.612 14.378 684 HE1 MET 460 HE1 MET 460 9.352 9.967 12.431 685 HE2 MET 460 HE2 MET 460 9.631 9.208 13.999 686 HE3 MET 460 HE3 MET 460 8.074 9.019 13.192 687 H ALA 461 HN ALA 461 11.642 2.722 13.720 688 HA ALA 461 HA ALA 461 10.907 0.762 11.849 689 HB1 ALA 461 HB1 ALA 461 13.220 0.704 13.778 690 HB2 ALA 461 HB2 ALA 461 13.219 1.488 12.199 691 HB3 ALA 461 HB3 ALA 461 13.054 -0.264 12.314 692 H HIS 462 HN HIS 462 11.165 0.636 15.381 693 HA HIS 462 HA HIS 462 10.689 -2.103 15.707 694 HB2 HIS 462 HB2 HIS 462 11.367 -0.230 17.425 695 HB3 HIS 462 HB1 HIS 462 9.630 -0.135 17.694 696 HD2 HIS 462 HD2 HIS 462 8.464 -2.568 18.675 697 HE1 HIS 462 HE1 HIS 462 12.188 -4.040 20.030 698 HE2 HIS 462 HE2 HIS 462 9.694 -4.470 19.936 699 H GLN 463 HN GLN 463 8.506 0.589 15.202 700 HA GLN 463 HA GLN 463 6.110 -0.796 15.849 701 HB2 GLN 463 HB2 GLN 463 6.438 1.725 15.720 702 HB3 GLN 463 HB1 GLN 463 6.359 1.555 13.973 703 HG2 GLN 463 HG2 GLN 463 4.218 2.238 14.985 704 HG3 GLN 463 HG1 GLN 463 4.116 0.721 14.093 705 HE21 GLN 463 HE21 GLN 463 3.684 -1.170 15.178 706 HE22 GLN 463 HE22 GLN 463 3.196 -1.209 16.837 707 H ILE 464 HN ILE 464 7.898 -0.223 12.858 708 HA ILE 464 HA ILE 464 6.001 -1.484 11.145 709 HB ILE 464 HB ILE 464 8.954 -0.980 10.712 710 HG12 ILE 464 HG12 ILE 464 6.508 0.587 9.861 711 HG13 ILE 464 HG11 ILE 464 7.668 1.075 11.091 712 HG21 ILE 464 HG21 ILE 464 8.457 -1.247 8.325 713 HG22 ILE 464 HG22 ILE 464 6.796 -1.690 8.724 714 HG23 ILE 464 HG23 ILE 464 8.133 -2.725 9.230 715 HD11 ILE 464 HD11 ILE 464 8.038 2.257 9.004 716 HD12 ILE 464 HD12 ILE 464 8.252 0.723 8.162 717 HD13 ILE 464 HD13 ILE 464 9.410 1.222 9.396 718 H GLN 465 HN GLN 465 8.761 -2.546 13.002 719 HA GLN 465 HA GLN 465 9.128 -5.095 11.901 720 HB2 GLN 465 HB2 GLN 465 10.523 -3.729 13.655 721 HB3 GLN 465 HB1 GLN 465 9.524 -4.574 14.827 722 HG2 GLN 465 HG2 GLN 465 11.626 -5.721 14.506 723 HG3 GLN 465 HG1 GLN 465 10.286 -6.717 13.937 724 HE21 GLN 465 HE21 GLN 465 11.633 -7.923 12.604 725 HE22 GLN 465 HE22 GLN 465 12.276 -7.285 11.129 726 H GLU 466 HN GLU 466 6.682 -3.847 13.985 727 HA GLU 466 HA GLU 466 5.773 -6.422 14.932 728 HB2 GLU 466 HB2 GLU 466 4.413 -3.718 15.069 729 HB3 GLU 466 HB1 GLU 466 3.937 -5.159 15.955 730 HG2 GLU 466 HG2 GLU 466 6.648 -3.920 16.276 731 HG3 GLU 466 HG1 GLU 466 5.253 -3.388 17.213 732 H MET 467 HN MET 467 5.283 -4.379 12.234 733 HA MET 467 HA MET 467 2.747 -5.589 11.477 734 HB2 MET 467 HB2 MET 467 4.431 -3.587 9.956 735 HB3 MET 467 HB1 MET 467 2.756 -4.013 9.634 736 HG2 MET 467 HG2 MET 467 3.559 -2.856 12.269 737 HG3 MET 467 HG1 MET 467 3.290 -1.818 10.870 738 HE1 MET 467 HE1 MET 467 1.000 -1.344 9.783 739 HE2 MET 467 HE2 MET 467 -0.457 -2.294 10.083 740 HE3 MET 467 HE3 MET 467 0.935 -3.039 9.299 741 H PHE 468 HN PHE 468 6.115 -5.472 10.440 742 HA PHE 468 HA PHE 468 5.569 -7.750 8.652 743 HB2 PHE 468 HB2 PHE 468 6.847 -5.211 8.112 744 HB3 PHE 468 HB1 PHE 468 7.956 -6.543 7.801 745 HD1 PHE 468 HD1 PHE 468 4.307 -5.955 7.257 746 HD2 PHE 468 HD2 PHE 468 8.050 -7.108 5.593 747 HE1 PHE 468 HE1 PHE 468 3.222 -6.340 5.084 748 HE2 PHE 468 HE2 PHE 468 6.972 -7.492 3.418 749 HZ PHE 468 HZ PHE 468 4.552 -7.105 3.160 750 HA PRO 469 HA PRO 469 8.661 -9.215 11.691 751 HB2 PRO 469 HB2 PRO 469 7.274 -11.636 12.076 752 HB3 PRO 469 HB1 PRO 469 7.197 -10.211 13.121 753 HG2 PRO 469 HG2 PRO 469 5.118 -11.272 11.551 754 HG3 PRO 469 HG1 PRO 469 5.124 -9.745 12.449 755 HD2 PRO 469 HD2 PRO 469 5.533 -10.222 9.560 756 HD3 PRO 469 HD1 PRO 469 4.917 -8.782 10.396 757 H GLN 470 HN GLN 470 8.670 -9.452 8.745 758 HA GLN 470 HA GLN 470 10.177 -11.960 8.564 759 HB2 GLN 470 HB2 GLN 470 9.273 -12.270 6.238 760 HB3 GLN 470 HB1 GLN 470 8.102 -12.521 7.526 761 HG2 GLN 470 HG2 GLN 470 7.178 -10.299 7.128 762 HG3 GLN 470 HG1 GLN 470 8.370 -10.026 5.859 763 HE21 GLN 470 HE21 GLN 470 6.704 -9.699 4.356 764 HE22 GLN 470 HE22 GLN 470 5.794 -11.018 3.707 765 H VAL 471 HN VAL 471 10.450 -8.827 8.584 766 HA VAL 471 HA VAL 471 12.363 -8.737 6.353 767 HB VAL 471 HB VAL 471 10.455 -7.210 5.973 768 HG11 VAL 471 HG11 VAL 471 10.048 -5.299 7.373 769 HG12 VAL 471 HG12 VAL 471 11.392 -5.736 8.428 770 HG13 VAL 471 HG13 VAL 471 9.958 -6.761 8.358 771 HG21 VAL 471 HG21 VAL 471 12.607 -6.613 5.036 772 HG22 VAL 471 HG22 VAL 471 13.062 -5.804 6.536 773 HG23 VAL 471 HG23 VAL 471 11.748 -5.162 5.550 774 HA PRO 472 HA PRO 472 15.507 -8.334 9.470 775 HB2 PRO 472 HB2 PRO 472 16.861 -6.722 7.361 776 HB3 PRO 472 HB1 PRO 472 17.460 -8.124 8.267 777 HG2 PRO 472 HG2 PRO 472 16.742 -8.370 5.740 778 HG3 PRO 472 HG1 PRO 472 16.376 -9.641 6.926 779 HD2 PRO 472 HD2 PRO 472 14.557 -7.606 5.722 780 HD3 PRO 472 HD1 PRO 472 14.235 -9.296 6.162 781 H TYR 473 HN TYR 473 15.593 -6.943 11.083 782 HA TYR 473 HA TYR 473 14.297 -4.495 11.162 783 HB2 TYR 473 HB2 TYR 473 14.924 -5.878 13.131 784 HB3 TYR 473 HB1 TYR 473 16.599 -5.390 12.910 785 HD1 TYR 473 HD2 TYR 473 13.239 -3.765 13.218 786 HD2 TYR 473 HD1 TYR 473 17.361 -3.697 14.282 787 HE1 TYR 473 HE2 TYR 473 12.842 -1.786 14.617 788 HE2 TYR 473 HE1 TYR 473 16.965 -1.721 15.687 789 HH TYR 473 HH TYR 473 15.422 0.064 15.948 790 H HIS 474 HN HIS 474 17.675 -5.209 10.424 791 HA HIS 474 HA HIS 474 18.568 -2.526 10.507 792 HB2 HIS 474 HB2 HIS 474 20.592 -3.292 9.481 793 HB3 HIS 474 HB1 HIS 474 20.066 -4.522 10.621 794 HD2 HIS 474 HD2 HIS 474 20.418 -4.000 6.764 795 HE1 HIS 474 HE1 HIS 474 19.859 -8.113 7.581 796 HE2 HIS 474 HE2 HIS 474 20.466 -6.411 5.807 797 H LEU 475 HN LEU 475 16.947 -4.386 8.041 798 HA LEU 475 HA LEU 475 17.593 -2.594 5.904 799 HB2 LEU 475 HB2 LEU 475 15.604 -4.822 6.211 800 HB3 LEU 475 HB1 LEU 475 15.585 -3.784 4.798 801 HG LEU 475 HG LEU 475 17.813 -5.620 5.675 802 HD11 LEU 475 HD11 LEU 475 15.940 -6.702 4.539 803 HD12 LEU 475 HD12 LEU 475 17.398 -6.720 3.547 804 HD13 LEU 475 HD13 LEU 475 16.105 -5.574 3.195 805 HD21 LEU 475 HD21 LEU 475 18.924 -3.701 4.847 806 HD22 LEU 475 HD22 LEU 475 17.763 -3.503 3.535 807 HD23 LEU 475 HD23 LEU 475 18.892 -4.856 3.517 808 H VAL 476 HN VAL 476 15.023 -2.887 8.251 809 HA VAL 476 HA VAL 476 13.240 -1.017 7.092 810 HB VAL 476 HB VAL 476 13.569 -1.652 10.034 811 HG11 VAL 476 HG11 VAL 476 12.203 0.324 9.569 812 HG12 VAL 476 HG12 VAL 476 11.227 -0.996 10.212 813 HG13 VAL 476 HG13 VAL 476 11.190 -0.631 8.487 814 HG21 VAL 476 HG21 VAL 476 11.859 -3.027 7.960 815 HG22 VAL 476 HG22 VAL 476 11.820 -3.342 9.695 816 HG23 VAL 476 HG23 VAL 476 13.271 -3.710 8.764 817 H LEU 477 HN LEU 477 15.834 -0.768 9.474 818 HA LEU 477 HA LEU 477 15.574 1.977 10.040 819 HB2 LEU 477 HB2 LEU 477 17.866 0.042 10.235 820 HB3 LEU 477 HB1 LEU 477 18.072 1.733 10.644 821 HG LEU 477 HG LEU 477 16.017 -0.034 11.969 822 HD11 LEU 477 HD11 LEU 477 17.617 -0.137 13.857 823 HD12 LEU 477 HD12 LEU 477 18.843 0.581 12.810 824 HD13 LEU 477 HD13 LEU 477 18.167 -1.002 12.422 825 HD21 LEU 477 HD21 LEU 477 15.545 2.320 12.157 826 HD22 LEU 477 HD22 LEU 477 17.205 2.652 12.656 827 HD23 LEU 477 HD23 LEU 477 16.135 1.725 13.708 828 H GLN 478 HN GLN 478 17.109 0.249 7.444 829 HA GLN 478 HA GLN 478 18.765 2.301 6.463 830 HB2 GLN 478 HB2 GLN 478 18.957 -0.081 5.812 831 HB3 GLN 478 HB1 GLN 478 17.451 0.062 4.916 832 HG2 GLN 478 HG2 GLN 478 18.566 1.869 3.562 833 HG3 GLN 478 HG1 GLN 478 20.078 1.400 4.339 834 HE21 GLN 478 HE21 GLN 478 17.487 -0.774 3.386 835 HE22 GLN 478 HE22 GLN 478 18.382 -1.603 2.165 836 H ASP 479 HN ASP 479 15.547 1.244 5.308 837 HA ASP 479 HA ASP 479 15.303 3.388 3.464 838 HB2 ASP 479 HB2 ASP 479 14.034 1.229 3.310 839 HB3 ASP 479 HB1 ASP 479 13.041 1.780 4.656 840 H LEU 480 HN LEU 480 14.285 2.959 6.807 841 HA LEU 480 HA LEU 480 12.552 5.119 7.073 842 HB2 LEU 480 HB2 LEU 480 13.767 3.258 8.774 843 HB3 LEU 480 HB1 LEU 480 14.222 4.824 9.412 844 HG LEU 480 HG LEU 480 12.224 4.037 10.524 845 HD11 LEU 480 HD11 LEU 480 11.554 6.266 8.611 846 HD12 LEU 480 HD12 LEU 480 12.422 6.441 10.133 847 HD13 LEU 480 HD13 LEU 480 10.738 5.919 10.136 848 HD21 LEU 480 HD21 LEU 480 10.151 3.629 9.330 849 HD22 LEU 480 HD22 LEU 480 11.422 2.546 8.760 850 HD23 LEU 480 HD23 LEU 480 10.956 3.943 7.793 851 H GLN 481 HN GLN 481 16.028 5.084 6.869 852 HA GLN 481 HA GLN 481 16.371 7.764 7.857 853 HB2 GLN 481 HB2 GLN 481 18.193 5.786 6.507 854 HB3 GLN 481 HB1 GLN 481 18.707 7.436 6.833 855 HG2 GLN 481 HG2 GLN 481 18.474 7.128 9.180 856 HG3 GLN 481 HG1 GLN 481 17.689 5.567 8.952 857 HE21 GLN 481 HE21 GLN 481 18.913 3.773 8.495 858 HE22 GLN 481 HE22 GLN 481 20.642 3.764 8.610 859 H LEU 482 HN LEU 482 15.578 6.316 4.851 860 HA LEU 482 HA LEU 482 16.361 8.689 3.334 861 HB2 LEU 482 HB2 LEU 482 15.594 5.899 2.610 862 HB3 LEU 482 HB1 LEU 482 15.362 7.169 1.425 863 HG LEU 482 HG LEU 482 17.452 6.158 0.947 864 HD11 LEU 482 HD11 LEU 482 18.948 7.977 1.037 865 HD12 LEU 482 HD12 LEU 482 18.197 8.622 2.496 866 HD13 LEU 482 HD13 LEU 482 17.331 8.677 0.960 867 HD21 LEU 482 HD21 LEU 482 17.833 5.007 3.039 868 HD22 LEU 482 HD22 LEU 482 18.154 6.540 3.851 869 HD23 LEU 482 HD23 LEU 482 19.254 5.958 2.600 870 H THR 483 HN THR 483 13.450 6.641 3.733 871 HA THR 483 HA THR 483 11.756 8.534 2.423 872 HB THR 483 HB THR 483 9.923 7.077 3.543 873 HG1 THR 483 HG1 THR 483 11.538 4.936 3.736 874 HG21 THR 483 HG21 THR 483 10.262 5.296 1.870 875 HG22 THR 483 HG22 THR 483 11.892 5.900 1.579 876 HG23 THR 483 HG23 THR 483 10.496 6.905 1.186 877 H ARG 484 HN ARG 484 12.399 7.703 5.791 878 HA ARG 484 HA ARG 484 12.004 8.774 7.748 879 HB2 ARG 484 HB2 ARG 484 11.537 11.178 5.968 880 HB3 ARG 484 HB1 ARG 484 11.724 11.234 7.716 881 HG2 ARG 484 HG2 ARG 484 13.954 11.043 7.611 882 HG3 ARG 484 HG1 ARG 484 13.894 9.861 6.303 883 HD2 ARG 484 HD2 ARG 484 13.260 11.818 4.797 884 HD3 ARG 484 HD1 ARG 484 13.762 12.857 6.133 885 HE ARG 484 HE ARG 484 15.854 11.111 5.707 886 HH11 ARG 484 HH11 ARG 484 14.138 13.525 3.837 887 HH12 ARG 484 HH12 ARG 484 15.512 13.927 2.856 888 HH21 ARG 484 HH21 ARG 484 17.665 11.640 4.432 889 HH22 ARG 484 HH22 ARG 484 17.522 12.845 3.193 890 H SER 485 HN SER 485 9.848 7.530 6.130 891 HA SER 485 HA SER 485 7.614 8.483 7.727 892 HB2 SER 485 HB2 SER 485 7.130 9.792 5.837 893 HB3 SER 485 HB1 SER 485 7.711 8.563 4.720 894 HG SER 485 HG SER 485 5.375 8.309 6.333 895 H VAL 486 HN VAL 486 6.892 6.719 8.690 896 HA VAL 486 HA VAL 486 7.596 4.106 8.048 897 HB VAL 486 HB VAL 486 5.708 3.407 9.554 898 HG11 VAL 486 HG11 VAL 486 7.560 5.543 10.599 899 HG12 VAL 486 HG12 VAL 486 7.944 3.832 10.412 900 HG13 VAL 486 HG13 VAL 486 6.717 4.338 11.573 901 HG21 VAL 486 HG21 VAL 486 4.175 5.252 9.065 902 HG22 VAL 486 HG22 VAL 486 5.291 6.382 9.832 903 HG23 VAL 486 HG23 VAL 486 4.506 5.128 10.792 904 H GLU 487 HN GLU 487 4.847 6.013 7.008 905 HA GLU 487 HA GLU 487 3.273 3.915 5.974 906 HB2 GLU 487 HB2 GLU 487 3.361 6.736 4.917 907 HB3 GLU 487 HB1 GLU 487 2.007 5.616 4.875 908 HG2 GLU 487 HG2 GLU 487 1.299 6.767 6.659 909 HG3 GLU 487 HG1 GLU 487 2.457 5.773 7.541 910 H ILE 488 HN ILE 488 5.547 6.123 4.352 911 HA ILE 488 HA ILE 488 5.290 4.904 1.805 912 HB ILE 488 HB ILE 488 7.659 6.500 2.797 913 HG12 ILE 488 HG12 ILE 488 5.118 7.496 1.479 914 HG13 ILE 488 HG11 ILE 488 5.523 7.703 3.179 915 HG21 ILE 488 HG21 ILE 488 6.564 6.034 0.019 916 HG22 ILE 488 HG22 ILE 488 8.035 5.329 0.690 917 HG23 ILE 488 HG23 ILE 488 7.934 7.070 0.424 918 HD11 ILE 488 HD11 ILE 488 7.043 8.845 0.850 919 HD12 ILE 488 HD12 ILE 488 7.463 9.047 2.550 920 HD13 ILE 488 HD13 ILE 488 5.960 9.727 1.926 921 H THR 489 HN THR 489 7.352 4.305 4.564 922 HA THR 489 HA THR 489 9.314 2.729 3.331 923 HB THR 489 HB THR 489 8.282 2.552 6.165 924 HG1 THR 489 HG1 THR 489 10.376 4.052 4.943 925 HG21 THR 489 HG21 THR 489 9.544 0.554 5.593 926 HG22 THR 489 HG22 THR 489 10.502 1.576 6.665 927 HG23 THR 489 HG23 THR 489 10.849 1.538 4.936 928 H THR 490 HN THR 490 6.291 1.711 4.968 929 HA THR 490 HA THR 490 6.686 -1.038 4.534 930 HB THR 490 HB THR 490 4.020 -0.947 4.656 931 HG1 THR 490 HG1 THR 490 4.064 1.410 4.541 932 HG21 THR 490 HG21 THR 490 5.512 -1.992 6.287 933 HG22 THR 490 HG22 THR 490 4.249 -1.066 7.097 934 HG23 THR 490 HG23 THR 490 5.882 -0.412 6.974 935 H ASP 491 HN ASP 491 5.074 1.434 2.578 936 HA ASP 491 HA ASP 491 4.080 -0.392 0.636 937 HB2 ASP 491 HB2 ASP 491 3.254 1.975 0.985 938 HB3 ASP 491 HB1 ASP 491 4.722 2.528 0.184 939 H ASN 492 HN ASN 492 7.001 1.526 0.986 940 HA ASN 492 HA ASN 492 8.206 1.146 -1.476 941 HB2 ASN 492 HB2 ASN 492 9.023 1.945 1.187 942 HB3 ASN 492 HB1 ASN 492 10.276 0.980 0.417 943 HD21 ASN 492 HD21 ASN 492 11.331 3.163 0.728 944 HD22 ASN 492 HD22 ASN 492 11.192 4.271 -0.598 945 H ILE 493 HN ILE 493 8.361 -0.915 1.412 946 HA ILE 493 HA ILE 493 10.075 -2.867 0.298 947 HB ILE 493 HB ILE 493 8.053 -3.186 2.522 948 HG12 ILE 493 HG12 ILE 493 11.018 -2.648 2.735 949 HG13 ILE 493 HG11 ILE 493 9.798 -1.382 2.820 950 HG21 ILE 493 HG21 ILE 493 9.442 -5.077 3.240 951 HG22 ILE 493 HG22 ILE 493 10.452 -4.871 1.809 952 HG23 ILE 493 HG23 ILE 493 8.759 -5.337 1.635 953 HD11 ILE 493 HD11 ILE 493 8.853 -2.406 4.803 954 HD12 ILE 493 HD12 ILE 493 10.570 -2.073 5.030 955 HD13 ILE 493 HD13 ILE 493 10.024 -3.719 4.703 956 H LEU 494 HN LEU 494 6.543 -2.670 0.535 957 HA LEU 494 HA LEU 494 6.081 -5.231 -0.624 958 HB2 LEU 494 HB2 LEU 494 4.473 -2.965 0.321 959 HB3 LEU 494 HB1 LEU 494 3.744 -3.874 -0.990 960 HG LEU 494 HG LEU 494 4.823 -5.486 1.246 961 HD11 LEU 494 HD11 LEU 494 2.155 -4.212 1.634 962 HD12 LEU 494 HD12 LEU 494 3.608 -3.378 2.189 963 HD13 LEU 494 HD13 LEU 494 3.214 -4.980 2.814 964 HD21 LEU 494 HD21 LEU 494 3.337 -5.981 -0.956 965 HD22 LEU 494 HD22 LEU 494 2.069 -5.779 0.266 966 HD23 LEU 494 HD23 LEU 494 3.334 -6.993 0.493 967 H GLU 495 HN GLU 495 6.362 -1.989 -1.964 968 HA GLU 495 HA GLU 495 5.298 -2.687 -4.524 969 HB2 GLU 495 HB2 GLU 495 6.811 -0.327 -3.463 970 HB3 GLU 495 HB1 GLU 495 6.528 -0.499 -5.190 971 HG2 GLU 495 HG2 GLU 495 4.457 -0.293 -3.017 972 HG3 GLU 495 HG1 GLU 495 4.817 0.895 -4.269 973 H GLY 496 HN GLY 496 8.524 -2.586 -3.140 974 HA2 GLY 496 HA2 GLY 496 10.021 -4.324 -4.110 975 HA3 GLY 496 HA1 GLY 496 9.518 -3.722 -5.681 976 H ARG 497 HN ARG 497 10.272 -1.703 -2.897 977 HA ARG 497 HA ARG 497 12.367 -0.412 -4.462 978 HB2 ARG 497 HB2 ARG 497 10.649 0.937 -3.249 979 HB3 ARG 497 HB1 ARG 497 11.286 0.318 -1.733 980 HG2 ARG 497 HG2 ARG 497 12.494 2.206 -1.762 981 HG3 ARG 497 HG1 ARG 497 13.541 1.291 -2.849 982 HD2 ARG 497 HD2 ARG 497 12.990 3.536 -3.716 983 HD3 ARG 497 HD1 ARG 497 12.446 2.236 -4.777 984 HE ARG 497 HE ARG 497 10.454 3.179 -2.902 985 HH11 ARG 497 HH11 ARG 497 11.857 3.598 -6.074 986 HH12 ARG 497 HH12 ARG 497 10.436 4.327 -6.749 987 HH21 ARG 497 HH21 ARG 497 8.582 4.137 -3.775 988 HH22 ARG 497 HH22 ARG 497 8.569 4.640 -5.439 989 H ILE 498 HN ILE 498 11.899 -2.025 -1.359 990 HA ILE 498 HA ILE 498 14.748 -2.068 -0.826 991 HB ILE 498 HB ILE 498 12.337 -2.990 0.738 992 HG12 ILE 498 HG12 ILE 498 13.517 -1.438 2.451 993 HG13 ILE 498 HG11 ILE 498 14.430 -0.858 1.063 994 HG21 ILE 498 HG21 ILE 498 14.045 -4.693 1.048 995 HG22 ILE 498 HG22 ILE 498 13.826 -3.750 2.522 996 HG23 ILE 498 HG23 ILE 498 15.220 -3.452 1.482 997 HD11 ILE 498 HD11 ILE 498 11.436 -0.791 1.352 998 HD12 ILE 498 HD12 ILE 498 12.359 -0.188 -0.024 999 HD13 ILE 498 HD13 ILE 498 12.533 0.576 1.556 1000 H GLN 499 HN GLN 499 16.049 -3.825 -1.047 1001 HA GLN 499 HA GLN 499 15.191 -5.899 -2.793 1002 HB2 GLN 499 HB2 GLN 499 17.735 -5.762 -1.165 1003 HB3 GLN 499 HB1 GLN 499 17.443 -6.767 -2.578 1004 HG2 GLN 499 HG2 GLN 499 17.574 -3.763 -2.519 1005 HG3 GLN 499 HG1 GLN 499 18.793 -4.855 -3.167 1006 HE21 GLN 499 HE21 GLN 499 17.203 -2.693 -4.408 1007 HE22 GLN 499 HE22 GLN 499 16.441 -3.423 -5.778 1008 H VAL 500 HN VAL 500 14.002 -7.548 -2.228 1009 HA VAL 500 HA VAL 500 13.646 -8.379 0.481 1010 HB VAL 500 HB VAL 500 12.170 -10.121 -0.467 1011 HG11 VAL 500 HG11 VAL 500 11.268 -7.902 -0.030 1012 HG12 VAL 500 HG12 VAL 500 10.505 -8.611 -1.453 1013 HG13 VAL 500 HG13 VAL 500 11.746 -7.372 -1.643 1014 HG21 VAL 500 HG21 VAL 500 13.398 -10.637 -2.495 1015 HG22 VAL 500 HG22 VAL 500 13.071 -9.025 -3.132 1016 HG23 VAL 500 HG23 VAL 500 11.747 -10.164 -2.892 1017 HA PRO 501 HA PRO 501 16.577 -11.676 0.820 1018 HB2 PRO 501 HB2 PRO 501 14.544 -13.604 1.716 1019 HB3 PRO 501 HB1 PRO 501 15.884 -12.885 2.627 1020 HG2 PRO 501 HG2 PRO 501 13.335 -12.250 3.124 1021 HG3 PRO 501 HG1 PRO 501 14.657 -11.077 3.288 1022 HD2 PRO 501 HD2 PRO 501 12.678 -11.381 1.071 1023 HD3 PRO 501 HD1 PRO 501 13.303 -9.903 1.831 1024 H PHE 502 HN PHE 502 16.545 -11.709 -1.620 1025 HA PHE 502 HA PHE 502 15.138 -13.807 -2.963 1026 HB2 PHE 502 HB2 PHE 502 15.860 -11.696 -4.070 1027 HB3 PHE 502 HB1 PHE 502 17.536 -12.193 -3.876 1028 HD1 PHE 502 HD1 PHE 502 14.339 -13.087 -5.513 1029 HD2 PHE 502 HD2 PHE 502 18.563 -13.606 -5.442 1030 HE1 PHE 502 HE1 PHE 502 14.225 -14.271 -7.667 1031 HE2 PHE 502 HE2 PHE 502 18.459 -14.790 -7.596 1032 HZ PHE 502 HZ PHE 502 16.290 -15.121 -8.706 1033 HA PRO 503 HA PRO 503 17.846 -17.173 -1.846 1034 HB2 PRO 503 HB2 PRO 503 17.012 -18.311 -4.455 1035 HB3 PRO 503 HB1 PRO 503 16.855 -18.991 -2.825 1036 HG2 PRO 503 HG2 PRO 503 14.738 -18.076 -4.132 1037 HG3 PRO 503 HG1 PRO 503 14.915 -17.868 -2.378 1038 HD2 PRO 503 HD2 PRO 503 15.305 -15.873 -4.560 1039 HD3 PRO 503 HD1 PRO 503 14.608 -15.661 -2.941 1040 H THR 504 HN THR 504 19.944 -16.590 -2.033 1041 HA THR 504 HA THR 504 21.275 -17.112 -4.541 1042 HB THR 504 HB THR 504 20.562 -14.658 -4.583 1043 HG1 THR 504 HG1 THR 504 23.218 -15.574 -4.873 1044 HG21 THR 504 HG21 THR 504 21.037 -14.148 -2.224 1045 HG22 THR 504 HG22 THR 504 21.918 -13.081 -3.316 1046 HG23 THR 504 HG23 THR 504 22.756 -14.415 -2.522 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 -18.884 -10.905 14.416 2 H2 MET 1 HT2 MET 1 -18.643 -12.482 13.850 3 H3 MET 1 HT3 MET 1 -17.964 -11.172 13.022 4 HA MET 1 HA MET 1 -17.274 -11.864 15.809 5 HB2 MET 1 HB2 MET 1 -15.316 -12.977 15.029 6 HB3 MET 1 HB1 MET 1 -16.673 -13.674 14.159 7 HG2 MET 1 HG2 MET 1 -16.126 -12.259 12.222 8 HG3 MET 1 HG1 MET 1 -14.734 -11.631 13.102 9 HE1 MET 1 HE1 MET 1 -12.944 -13.863 10.479 10 HE2 MET 1 HE2 MET 1 -13.017 -12.278 11.252 11 HE3 MET 1 HE3 MET 1 -14.351 -12.829 10.238 12 H GLN 2 HN GLN 2 -15.051 -10.909 16.290 13 HA GLN 2 HA GLN 2 -14.897 -8.250 15.027 14 HB2 GLN 2 HB2 GLN 2 -13.851 -8.804 17.781 15 HB3 GLN 2 HB1 GLN 2 -14.372 -7.279 17.084 16 HG2 GLN 2 HG2 GLN 2 -16.272 -9.528 17.675 17 HG3 GLN 2 HG1 GLN 2 -15.861 -8.285 18.854 18 HE21 GLN 2 HE21 GLN 2 -18.396 -8.993 17.525 19 HE22 GLN 2 HE22 GLN 2 -18.961 -7.523 16.807 20 H ILE 3 HN ILE 3 -12.954 -7.480 14.379 21 HA ILE 3 HA ILE 3 -10.606 -9.226 14.764 22 HB ILE 3 HB ILE 3 -9.784 -8.391 12.546 23 HG12 ILE 3 HG12 ILE 3 -12.650 -7.552 12.089 24 HG13 ILE 3 HG11 ILE 3 -11.367 -6.418 12.501 25 HG21 ILE 3 HG21 ILE 3 -11.097 -9.947 11.225 26 HG22 ILE 3 HG22 ILE 3 -12.359 -9.955 12.458 27 HG23 ILE 3 HG23 ILE 3 -10.764 -10.617 12.823 28 HD11 ILE 3 HD11 ILE 3 -11.390 -8.198 10.072 29 HD12 ILE 3 HD12 ILE 3 -10.186 -6.971 10.471 30 HD13 ILE 3 HD13 ILE 3 -11.842 -6.494 10.097 31 H PHE 4 HN PHE 4 -8.527 -8.062 14.665 32 HA PHE 4 HA PHE 4 -8.837 -5.295 15.630 33 HB2 PHE 4 HB2 PHE 4 -6.774 -7.360 16.424 34 HB3 PHE 4 HB1 PHE 4 -6.772 -5.681 16.956 35 HD1 PHE 4 HD1 PHE 4 -8.551 -4.851 18.442 36 HD2 PHE 4 HD2 PHE 4 -8.235 -8.967 17.406 37 HE1 PHE 4 HE1 PHE 4 -10.032 -5.434 20.319 38 HE2 PHE 4 HE2 PHE 4 -9.713 -9.556 19.281 39 HZ PHE 4 HZ PHE 4 -10.618 -7.783 20.737 40 H VAL 5 HN VAL 5 -8.245 -3.943 14.100 41 HA VAL 5 HA VAL 5 -6.096 -4.676 12.246 42 HB VAL 5 HB VAL 5 -7.938 -2.276 12.140 43 HG11 VAL 5 HG11 VAL 5 -7.229 -2.160 9.783 44 HG12 VAL 5 HG12 VAL 5 -6.105 -3.488 10.074 45 HG13 VAL 5 HG13 VAL 5 -5.882 -1.947 10.901 46 HG21 VAL 5 HG21 VAL 5 -9.199 -4.377 11.979 47 HG22 VAL 5 HG22 VAL 5 -8.163 -4.887 10.645 48 HG23 VAL 5 HG23 VAL 5 -9.212 -3.480 10.460 49 H LYS 6 HN LYS 6 -4.127 -3.767 12.360 50 HA LYS 6 HA LYS 6 -3.771 -1.562 14.281 51 HB2 LYS 6 HB2 LYS 6 -2.395 -4.061 13.953 52 HB3 LYS 6 HB1 LYS 6 -1.270 -2.733 13.703 53 HG2 LYS 6 HG2 LYS 6 -1.984 -1.781 15.871 54 HG3 LYS 6 HG1 LYS 6 -2.993 -3.208 16.120 55 HD2 LYS 6 HD2 LYS 6 -1.002 -4.630 15.998 56 HD3 LYS 6 HD1 LYS 6 0.004 -3.203 15.752 57 HE2 LYS 6 HE2 LYS 6 0.124 -3.886 18.065 58 HE3 LYS 6 HE1 LYS 6 -0.717 -2.342 17.945 59 HZ1 LYS 6 HZ1 LYS 6 -1.720 -4.057 19.470 60 HZ2 LYS 6 HZ2 LYS 6 -2.162 -4.924 18.085 61 HZ3 LYS 6 HZ3 LYS 6 -2.777 -3.365 18.342 62 H THR 7 HN THR 7 -3.036 0.316 13.566 63 HA THR 7 HA THR 7 -2.180 0.494 10.775 64 HB THR 7 HB THR 7 -2.437 3.025 11.274 65 HG1 THR 7 HG1 THR 7 -4.039 3.351 12.978 66 HG21 THR 7 HG21 THR 7 -4.861 1.225 11.258 67 HG22 THR 7 HG22 THR 7 -3.961 1.756 9.839 68 HG23 THR 7 HG23 THR 7 -4.841 2.931 10.815 69 H LEU 8 HN LEU 8 -0.524 2.317 10.405 70 HA LEU 8 HA LEU 8 1.893 1.572 11.674 71 HB2 LEU 8 HB2 LEU 8 1.207 3.843 9.821 72 HB3 LEU 8 HB1 LEU 8 2.840 3.480 10.349 73 HG LEU 8 HG LEU 8 1.103 1.498 8.887 74 HD11 LEU 8 HD11 LEU 8 2.372 2.057 6.890 75 HD12 LEU 8 HD12 LEU 8 3.211 3.337 7.767 76 HD13 LEU 8 HD13 LEU 8 1.474 3.455 7.478 77 HD21 LEU 8 HD21 LEU 8 2.796 0.346 10.026 78 HD22 LEU 8 HD22 LEU 8 3.994 1.598 9.697 79 HD23 LEU 8 HD23 LEU 8 3.424 0.558 8.392 80 H THR 9 HN THR 9 -0.506 3.810 12.561 81 HA THR 9 HA THR 9 1.254 5.577 14.023 82 HB THR 9 HB THR 9 -1.286 6.128 14.909 83 HG1 THR 9 HG1 THR 9 -2.705 5.757 13.277 84 HG21 THR 9 HG21 THR 9 0.159 7.841 14.123 85 HG22 THR 9 HG22 THR 9 -1.266 7.884 13.084 86 HG23 THR 9 HG23 THR 9 0.226 7.140 12.506 87 H GLY 10 HN GLY 10 0.432 2.512 14.554 88 HA2 GLY 10 HA2 GLY 10 0.597 1.198 16.441 89 HA3 GLY 10 HA1 GLY 10 0.945 2.651 17.368 90 H LYS 11 HN LYS 11 -1.893 2.367 15.389 91 HA LYS 11 HA LYS 11 -3.538 2.453 17.819 92 HB2 LYS 11 HB2 LYS 11 -3.788 4.357 16.304 93 HB3 LYS 11 HB1 LYS 11 -4.161 3.271 14.977 94 HG2 LYS 11 HG2 LYS 11 -6.168 2.521 16.294 95 HG3 LYS 11 HG1 LYS 11 -5.835 3.858 17.401 96 HD2 LYS 11 HD2 LYS 11 -5.909 5.385 15.402 97 HD3 LYS 11 HD1 LYS 11 -6.489 4.010 14.463 98 HE2 LYS 11 HE2 LYS 11 -8.496 3.902 15.631 99 HE3 LYS 11 HE1 LYS 11 -7.867 4.828 16.991 100 HZ1 LYS 11 HZ1 LYS 11 -7.710 6.741 15.372 101 HZ2 LYS 11 HZ2 LYS 11 -9.266 6.274 15.835 102 HZ3 LYS 11 HZ3 LYS 11 -8.665 5.820 14.318 103 H THR 12 HN THR 12 -5.063 0.914 18.206 104 HA THR 12 HA THR 12 -5.266 -1.267 16.241 105 HB THR 12 HB THR 12 -5.826 -1.472 19.203 106 HG1 THR 12 HG1 THR 12 -3.627 -0.999 18.927 107 HG21 THR 12 HG21 THR 12 -6.881 -3.186 17.804 108 HG22 THR 12 HG22 THR 12 -5.603 -3.878 18.803 109 HG23 THR 12 HG23 THR 12 -5.314 -3.572 17.090 110 H ILE 13 HN ILE 13 -7.096 -1.148 15.138 111 HA ILE 13 HA ILE 13 -9.482 -0.008 16.430 112 HB ILE 13 HB ILE 13 -9.310 -0.601 13.495 113 HG12 ILE 13 HG12 ILE 13 -8.390 2.014 14.680 114 HG13 ILE 13 HG11 ILE 13 -7.263 0.718 14.299 115 HG21 ILE 13 HG21 ILE 13 -10.715 1.542 15.088 116 HG22 ILE 13 HG22 ILE 13 -11.450 0.062 14.475 117 HG23 ILE 13 HG23 ILE 13 -10.857 1.281 13.349 118 HD11 ILE 13 HD11 ILE 13 -7.952 0.801 11.965 119 HD12 ILE 13 HD12 ILE 13 -7.352 2.364 12.518 120 HD13 ILE 13 HD13 ILE 13 -9.087 2.095 12.344 121 H THR 14 HN THR 14 -11.187 -1.272 16.877 122 HA THR 14 HA THR 14 -11.094 -4.075 16.065 123 HB THR 14 HB THR 14 -13.165 -2.893 17.898 124 HG1 THR 14 HG1 THR 14 -11.473 -2.289 19.074 125 HG21 THR 14 HG21 THR 14 -13.471 -5.202 17.173 126 HG22 THR 14 HG22 THR 14 -13.095 -5.141 18.895 127 HG23 THR 14 HG23 THR 14 -11.851 -5.609 17.736 128 H LEU 15 HN LEU 15 -12.355 -4.825 14.467 129 HA LEU 15 HA LEU 15 -14.671 -3.188 13.668 130 HB2 LEU 15 HB2 LEU 15 -12.363 -4.065 12.108 131 HB3 LEU 15 HB1 LEU 15 -13.897 -4.474 11.361 132 HG LEU 15 HG LEU 15 -13.160 -1.687 12.255 133 HD11 LEU 15 HD11 LEU 15 -12.786 -1.214 9.886 134 HD12 LEU 15 HD12 LEU 15 -13.019 -2.922 9.512 135 HD13 LEU 15 HD13 LEU 15 -11.649 -2.414 10.498 136 HD21 LEU 15 HD21 LEU 15 -15.563 -2.144 12.124 137 HD22 LEU 15 HD22 LEU 15 -15.362 -2.718 10.469 138 HD23 LEU 15 HD23 LEU 15 -15.045 -1.028 10.861 139 H GLU 16 HN GLU 16 -16.492 -4.256 12.959 140 HA GLU 16 HA GLU 16 -16.640 -7.060 13.736 141 HB2 GLU 16 HB2 GLU 16 -18.342 -5.482 14.596 142 HB3 GLU 16 HB1 GLU 16 -18.856 -5.160 12.944 143 HG2 GLU 16 HG2 GLU 16 -19.548 -7.460 12.676 144 HG3 GLU 16 HG1 GLU 16 -18.955 -7.848 14.291 145 H VAL 17 HN VAL 17 -16.536 -8.610 12.319 146 HA VAL 17 HA VAL 17 -17.539 -8.252 9.601 147 HB VAL 17 HB VAL 17 -15.467 -9.386 8.695 148 HG11 VAL 17 HG11 VAL 17 -14.123 -7.319 8.597 149 HG12 VAL 17 HG12 VAL 17 -15.136 -6.624 9.864 150 HG13 VAL 17 HG13 VAL 17 -15.835 -7.025 8.296 151 HG21 VAL 17 HG21 VAL 17 -14.567 -10.235 10.774 152 HG22 VAL 17 HG22 VAL 17 -14.356 -8.595 11.382 153 HG23 VAL 17 HG23 VAL 17 -13.398 -9.156 10.013 154 H GLU 18 HN GLU 18 -17.088 -10.496 8.438 155 HA GLU 18 HA GLU 18 -17.441 -12.733 10.283 156 HB2 GLU 18 HB2 GLU 18 -19.425 -11.758 8.265 157 HB3 GLU 18 HB1 GLU 18 -19.257 -13.491 8.506 158 HG2 GLU 18 HG2 GLU 18 -19.862 -11.505 10.686 159 HG3 GLU 18 HG1 GLU 18 -21.065 -12.482 9.849 160 HA PRO 19 HA PRO 19 -14.648 -14.957 7.684 161 HB2 PRO 19 HB2 PRO 19 -16.839 -16.983 7.395 162 HB3 PRO 19 HB1 PRO 19 -15.130 -17.222 7.812 163 HG2 PRO 19 HG2 PRO 19 -16.970 -17.327 9.689 164 HG3 PRO 19 HG1 PRO 19 -15.418 -16.518 9.991 165 HD2 PRO 19 HD2 PRO 19 -18.100 -15.327 9.516 166 HD3 PRO 19 HD1 PRO 19 -16.766 -14.746 10.531 167 H SER 20 HN SER 20 -18.002 -14.894 6.472 168 HA SER 20 HA SER 20 -17.135 -15.246 3.743 169 HB2 SER 20 HB2 SER 20 -19.908 -14.527 4.684 170 HB3 SER 20 HB1 SER 20 -19.443 -15.335 3.186 171 HG SER 20 HG SER 20 -20.160 -16.501 5.375 172 H ASP 21 HN ASP 21 -16.682 -12.662 5.535 173 HA ASP 21 HA ASP 21 -17.929 -10.640 3.882 174 HB2 ASP 21 HB2 ASP 21 -17.208 -10.557 6.450 175 HB3 ASP 21 HB1 ASP 21 -15.715 -9.943 5.752 176 H THR 22 HN THR 22 -16.963 -9.416 2.331 177 HA THR 22 HA THR 22 -14.611 -10.514 1.094 178 HB THR 22 HB THR 22 -15.932 -7.949 0.246 179 HG1 THR 22 HG1 THR 22 -17.735 -9.013 -0.039 180 HG21 THR 22 HG21 THR 22 -14.745 -10.237 -1.332 181 HG22 THR 22 HG22 THR 22 -13.902 -8.739 -0.931 182 HG23 THR 22 HG23 THR 22 -15.320 -8.702 -1.979 183 H ILE 23 HN ILE 23 -12.588 -9.628 0.992 184 HA ILE 23 HA ILE 23 -11.627 -8.037 3.062 185 HB ILE 23 HB ILE 23 -10.410 -8.353 0.311 186 HG12 ILE 23 HG12 ILE 23 -10.818 -10.525 1.339 187 HG13 ILE 23 HG11 ILE 23 -9.095 -10.176 1.337 188 HG21 ILE 23 HG21 ILE 23 -9.424 -6.509 1.567 189 HG22 ILE 23 HG22 ILE 23 -8.285 -7.845 1.393 190 HG23 ILE 23 HG23 ILE 23 -9.118 -7.592 2.926 191 HD11 ILE 23 HD11 ILE 23 -10.971 -9.993 3.677 192 HD12 ILE 23 HD12 ILE 23 -9.284 -9.481 3.704 193 HD13 ILE 23 HD13 ILE 23 -9.687 -11.175 3.423 194 H GLU 24 HN GLU 24 -12.620 -7.125 -0.200 195 HA GLU 24 HA GLU 24 -11.846 -4.440 -0.149 196 HB2 GLU 24 HB2 GLU 24 -12.601 -5.791 -2.138 197 HB3 GLU 24 HB1 GLU 24 -14.252 -5.575 -1.578 198 HG2 GLU 24 HG2 GLU 24 -12.912 -3.039 -1.717 199 HG3 GLU 24 HG1 GLU 24 -12.778 -3.897 -3.252 200 H ASN 25 HN ASN 25 -14.769 -6.031 1.031 201 HA ASN 25 HA ASN 25 -16.198 -3.641 1.640 202 HB2 ASN 25 HB2 ASN 25 -17.287 -5.863 1.372 203 HB3 ASN 25 HB1 ASN 25 -16.531 -6.385 2.873 204 HD21 ASN 25 HD21 ASN 25 -18.316 -6.684 4.085 205 HD22 ASN 25 HD22 ASN 25 -19.444 -5.426 4.488 206 H VAL 26 HN VAL 26 -14.014 -5.746 3.442 207 HA VAL 26 HA VAL 26 -14.350 -4.635 5.988 208 HB VAL 26 HB VAL 26 -11.805 -5.777 4.802 209 HG11 VAL 26 HG11 VAL 26 -11.418 -4.502 6.858 210 HG12 VAL 26 HG12 VAL 26 -11.154 -6.228 7.106 211 HG13 VAL 26 HG13 VAL 26 -12.636 -5.468 7.689 212 HG21 VAL 26 HG21 VAL 26 -13.674 -7.339 4.634 213 HG22 VAL 26 HG22 VAL 26 -14.013 -7.136 6.353 214 HG23 VAL 26 HG23 VAL 26 -12.502 -7.885 5.835 215 H LYS 27 HN LYS 27 -12.249 -3.712 3.305 216 HA LYS 27 HA LYS 27 -10.883 -1.639 4.664 217 HB2 LYS 27 HB2 LYS 27 -11.370 -1.988 1.699 218 HB3 LYS 27 HB1 LYS 27 -10.190 -0.900 2.420 219 HG2 LYS 27 HG2 LYS 27 -9.354 -3.127 3.560 220 HG3 LYS 27 HG1 LYS 27 -10.142 -3.858 2.162 221 HD2 LYS 27 HD2 LYS 27 -8.101 -1.648 1.973 222 HD3 LYS 27 HD1 LYS 27 -7.700 -3.362 1.867 223 HE2 LYS 27 HE2 LYS 27 -9.221 -3.565 -0.062 224 HE3 LYS 27 HE1 LYS 27 -9.537 -1.833 0.030 225 HZ1 LYS 27 HZ1 LYS 27 -7.622 -2.955 -1.477 226 HZ2 LYS 27 HZ2 LYS 27 -6.738 -2.549 -0.087 227 HZ3 LYS 27 HZ3 LYS 27 -7.583 -1.347 -0.929 228 H ALA 28 HN ALA 28 -13.940 -1.807 2.998 229 HA ALA 28 HA ALA 28 -14.382 0.968 2.680 230 HB1 ALA 28 HB1 ALA 28 -15.683 -0.740 1.479 231 HB2 ALA 28 HB2 ALA 28 -16.722 0.382 2.357 232 HB3 ALA 28 HB3 ALA 28 -16.424 -1.231 3.001 233 H LYS 29 HN LYS 29 -14.980 -1.314 5.291 234 HA LYS 29 HA LYS 29 -16.481 0.439 6.940 235 HB2 LYS 29 HB2 LYS 29 -14.741 -1.845 7.877 236 HB3 LYS 29 HB1 LYS 29 -16.149 -1.170 8.687 237 HG2 LYS 29 HG2 LYS 29 -17.539 -1.958 6.782 238 HG3 LYS 29 HG1 LYS 29 -16.109 -2.759 6.131 239 HD2 LYS 29 HD2 LYS 29 -15.965 -3.906 8.433 240 HD3 LYS 29 HD1 LYS 29 -17.638 -3.377 8.639 241 HE2 LYS 29 HE2 LYS 29 -18.043 -4.461 6.345 242 HE3 LYS 29 HE1 LYS 29 -16.493 -5.257 6.602 243 HZ1 LYS 29 HZ1 LYS 29 -17.963 -6.787 7.442 244 HZ2 LYS 29 HZ2 LYS 29 -19.023 -5.610 8.054 245 HZ3 LYS 29 HZ3 LYS 29 -17.568 -5.927 8.855 246 H ILE 30 HN ILE 30 -13.059 -0.195 6.500 247 HA ILE 30 HA ILE 30 -12.153 1.331 8.724 248 HB ILE 30 HB ILE 30 -10.657 0.708 6.166 249 HG12 ILE 30 HG12 ILE 30 -10.704 -0.807 8.784 250 HG13 ILE 30 HG11 ILE 30 -11.517 -1.317 7.310 251 HG21 ILE 30 HG21 ILE 30 -9.634 2.493 7.475 252 HG22 ILE 30 HG22 ILE 30 -8.650 1.030 7.534 253 HG23 ILE 30 HG23 ILE 30 -9.660 1.471 8.913 254 HD11 ILE 30 HD11 ILE 30 -9.456 -2.534 7.607 255 HD12 ILE 30 HD12 ILE 30 -8.546 -1.026 7.694 256 HD13 ILE 30 HD13 ILE 30 -9.340 -1.494 6.190 257 H GLN 31 HN GLN 31 -12.991 2.033 5.406 258 HA GLN 31 HA GLN 31 -11.928 4.670 5.324 259 HB2 GLN 31 HB2 GLN 31 -12.397 3.482 3.261 260 HB3 GLN 31 HB1 GLN 31 -14.099 3.348 3.684 261 HG2 GLN 31 HG2 GLN 31 -14.366 5.745 3.497 262 HG3 GLN 31 HG1 GLN 31 -12.645 5.935 3.165 263 HE21 GLN 31 HE21 GLN 31 -13.180 6.962 1.215 264 HE22 GLN 31 HE22 GLN 31 -13.683 6.053 -0.167 265 H ASP 32 HN ASP 32 -14.942 3.265 6.393 266 HA ASP 32 HA ASP 32 -16.332 5.754 6.643 267 HB2 ASP 32 HB2 ASP 32 -17.544 3.617 6.406 268 HB3 ASP 32 HB1 ASP 32 -16.904 3.084 7.958 269 H LYS 33 HN LYS 33 -14.473 3.683 8.789 270 HA LYS 33 HA LYS 33 -14.963 5.261 11.129 271 HB2 LYS 33 HB2 LYS 33 -13.288 2.896 10.441 272 HB3 LYS 33 HB1 LYS 33 -12.873 3.809 11.882 273 HG2 LYS 33 HG2 LYS 33 -15.127 3.460 12.753 274 HG3 LYS 33 HG1 LYS 33 -15.538 2.541 11.303 275 HD2 LYS 33 HD2 LYS 33 -13.879 0.870 11.837 276 HD3 LYS 33 HD1 LYS 33 -13.320 1.820 13.213 277 HE2 LYS 33 HE2 LYS 33 -16.150 0.840 12.986 278 HE3 LYS 33 HE1 LYS 33 -14.871 -0.139 13.703 279 HZ1 LYS 33 HZ1 LYS 33 -14.482 1.637 15.309 280 HZ2 LYS 33 HZ2 LYS 33 -16.075 1.077 15.389 281 HZ3 LYS 33 HZ3 LYS 33 -15.735 2.547 14.628 282 H GLU 34 HN GLU 34 -11.934 4.571 9.383 283 HA GLU 34 HA GLU 34 -10.627 6.811 10.630 284 HB2 GLU 34 HB2 GLU 34 -9.740 4.731 8.647 285 HB3 GLU 34 HB1 GLU 34 -8.699 6.054 9.150 286 HG2 GLU 34 HG2 GLU 34 -9.940 4.049 11.018 287 HG3 GLU 34 HG1 GLU 34 -8.296 3.957 10.385 288 H GLY 35 HN GLY 35 -11.505 5.934 7.292 289 HA2 GLY 35 HA2 GLY 35 -12.368 7.568 5.767 290 HA3 GLY 35 HA1 GLY 35 -11.486 8.806 6.648 291 H ILE 36 HN ILE 36 -10.030 5.764 5.734 292 HA ILE 36 HA ILE 36 -8.171 7.241 4.023 293 HB ILE 36 HB ILE 36 -7.898 4.384 4.967 294 HG12 ILE 36 HG12 ILE 36 -6.716 6.846 6.268 295 HG13 ILE 36 HG11 ILE 36 -8.132 5.998 6.876 296 HG21 ILE 36 HG21 ILE 36 -5.852 6.379 4.001 297 HG22 ILE 36 HG22 ILE 36 -6.497 5.028 3.071 298 HG23 ILE 36 HG23 ILE 36 -5.526 4.723 4.510 299 HD11 ILE 36 HD11 ILE 36 -6.198 5.335 8.125 300 HD12 ILE 36 HD12 ILE 36 -5.342 4.903 6.644 301 HD13 ILE 36 HD13 ILE 36 -6.754 3.974 7.151 302 HA PRO 37 HA PRO 37 -10.198 5.722 0.334 303 HB2 PRO 37 HB2 PRO 37 -7.421 5.911 -0.755 304 HB3 PRO 37 HB1 PRO 37 -8.930 6.597 -1.389 305 HG2 PRO 37 HG2 PRO 37 -7.165 8.152 -0.203 306 HG3 PRO 37 HG1 PRO 37 -8.905 8.375 0.073 307 HD2 PRO 37 HD2 PRO 37 -6.860 7.135 1.856 308 HD3 PRO 37 HD1 PRO 37 -8.250 8.159 2.267 309 HA PRO 38 HA PRO 38 -9.432 1.349 0.663 310 HB2 PRO 38 HB2 PRO 38 -10.669 1.257 -2.032 311 HB3 PRO 38 HB1 PRO 38 -11.146 0.426 -0.539 312 HG2 PRO 38 HG2 PRO 38 -12.561 2.460 -1.475 313 HG3 PRO 38 HG1 PRO 38 -12.311 2.229 0.267 314 HD2 PRO 38 HD2 PRO 38 -10.996 4.169 -1.584 315 HD3 PRO 38 HD1 PRO 38 -11.522 4.384 0.098 316 H ASP 39 HN ASP 39 -8.445 3.193 -2.177 317 HA ASP 39 HA ASP 39 -6.897 1.036 -3.284 318 HB2 ASP 39 HB2 ASP 39 -6.218 2.574 -4.977 319 HB3 ASP 39 HB1 ASP 39 -7.916 2.889 -4.645 320 H GLN 40 HN GLN 40 -6.386 3.448 -0.911 321 HA GLN 40 HA GLN 40 -3.475 3.170 -1.061 322 HB2 GLN 40 HB2 GLN 40 -5.227 4.974 0.623 323 HB3 GLN 40 HB1 GLN 40 -3.473 4.920 0.732 324 HG2 GLN 40 HG2 GLN 40 -3.513 5.453 -1.781 325 HG3 GLN 40 HG1 GLN 40 -5.189 5.920 -1.503 326 HE21 GLN 40 HE21 GLN 40 -2.928 7.552 -2.315 327 HE22 GLN 40 HE22 GLN 40 -2.771 8.796 -1.125 328 H GLN 41 HN GLN 41 -6.014 1.610 0.306 329 HA GLN 41 HA GLN 41 -4.749 1.010 2.858 330 HB2 GLN 41 HB2 GLN 41 -7.381 0.212 1.631 331 HB3 GLN 41 HB1 GLN 41 -6.802 -0.449 3.151 332 HG2 GLN 41 HG2 GLN 41 -6.666 1.944 3.970 333 HG3 GLN 41 HG1 GLN 41 -7.585 2.376 2.527 334 HE21 GLN 41 HE21 GLN 41 -9.442 2.997 3.576 335 HE22 GLN 41 HE22 GLN 41 -10.457 1.880 4.424 336 H ARG 42 HN ARG 42 -3.211 -0.491 2.880 337 HA ARG 42 HA ARG 42 -3.549 -2.857 1.155 338 HB2 ARG 42 HB2 ARG 42 -0.976 -1.906 2.426 339 HB3 ARG 42 HB1 ARG 42 -1.163 -3.138 1.186 340 HG2 ARG 42 HG2 ARG 42 -2.084 -1.288 -0.293 341 HG3 ARG 42 HG1 ARG 42 -1.468 -0.166 0.920 342 HD2 ARG 42 HD2 ARG 42 0.173 -0.378 -0.807 343 HD3 ARG 42 HD1 ARG 42 0.782 -1.201 0.634 344 HE ARG 42 HE ARG 42 -0.439 -3.186 -0.760 345 HH11 ARG 42 HH11 ARG 42 2.061 -0.840 -1.531 346 HH12 ARG 42 HH12 ARG 42 2.770 -1.838 -2.777 347 HH21 ARG 42 HH21 ARG 42 0.521 -4.503 -2.346 348 HH22 ARG 42 HH22 ARG 42 1.907 -3.922 -3.221 349 H LEU 43 HN LEU 43 -4.471 -4.423 2.330 350 HA LEU 43 HA LEU 43 -3.978 -4.581 5.193 351 HB2 LEU 43 HB2 LEU 43 -5.984 -5.754 3.329 352 HB3 LEU 43 HB1 LEU 43 -5.654 -6.599 4.828 353 HG LEU 43 HG LEU 43 -6.567 -3.722 4.652 354 HD11 LEU 43 HD11 LEU 43 -8.109 -6.223 5.329 355 HD12 LEU 43 HD12 LEU 43 -8.311 -5.233 3.884 356 HD13 LEU 43 HD13 LEU 43 -8.712 -4.573 5.468 357 HD21 LEU 43 HD21 LEU 43 -6.212 -5.602 6.985 358 HD22 LEU 43 HD22 LEU 43 -6.989 -4.021 7.070 359 HD23 LEU 43 HD23 LEU 43 -5.281 -4.142 6.653 360 H ILE 44 HN ILE 44 -2.619 -5.933 6.100 361 HA ILE 44 HA ILE 44 -1.600 -8.189 4.508 362 HB ILE 44 HB ILE 44 -0.141 -6.199 6.198 363 HG12 ILE 44 HG12 ILE 44 1.573 -6.694 4.310 364 HG13 ILE 44 HG11 ILE 44 0.222 -7.487 3.509 365 HG21 ILE 44 HG21 ILE 44 0.434 -8.256 7.304 366 HG22 ILE 44 HG22 ILE 44 1.808 -7.717 6.335 367 HG23 ILE 44 HG23 ILE 44 0.781 -9.032 5.759 368 HD11 ILE 44 HD11 ILE 44 0.387 -5.277 2.675 369 HD12 ILE 44 HD12 ILE 44 0.437 -4.599 4.301 370 HD13 ILE 44 HD13 ILE 44 -1.043 -5.351 3.704 371 H PHE 45 HN PHE 45 -1.622 -10.137 5.405 372 HA PHE 45 HA PHE 45 -2.145 -10.378 8.292 373 HB2 PHE 45 HB2 PHE 45 -4.261 -10.758 7.110 374 HB3 PHE 45 HB1 PHE 45 -3.485 -11.955 6.081 375 HD1 PHE 45 HD1 PHE 45 -4.272 -11.232 9.642 376 HD2 PHE 45 HD2 PHE 45 -3.503 -14.193 6.679 377 HE1 PHE 45 HE1 PHE 45 -4.863 -12.997 11.252 378 HE2 PHE 45 HE2 PHE 45 -4.091 -15.961 8.286 379 HZ PHE 45 HZ PHE 45 -4.776 -15.364 10.578 380 H ALA 46 HN ALA 46 -0.604 -11.526 9.212 381 HA ALA 46 HA ALA 46 1.055 -13.017 9.607 382 HB1 ALA 46 HB1 ALA 46 1.009 -15.176 8.526 383 HB2 ALA 46 HB2 ALA 46 -0.056 -14.554 7.265 384 HB3 ALA 46 HB3 ALA 46 -0.634 -14.674 8.927 385 H GLY 47 HN GLY 47 1.225 -10.864 7.393 386 HA2 GLY 47 HA2 GLY 47 3.335 -10.061 6.610 387 HA3 GLY 47 HA1 GLY 47 3.886 -11.722 6.488 388 H LYS 48 HN LYS 48 0.786 -11.515 5.245 389 HA LYS 48 HA LYS 48 1.814 -11.026 2.522 390 HB2 LYS 48 HB2 LYS 48 -0.288 -13.070 3.275 391 HB3 LYS 48 HB1 LYS 48 0.368 -12.786 1.670 392 HG2 LYS 48 HG2 LYS 48 2.519 -13.615 2.340 393 HG3 LYS 48 HG1 LYS 48 1.981 -13.760 4.014 394 HD2 LYS 48 HD2 LYS 48 0.688 -15.234 1.732 395 HD3 LYS 48 HD1 LYS 48 2.016 -15.897 2.682 396 HE2 LYS 48 HE2 LYS 48 0.638 -15.596 4.723 397 HE3 LYS 48 HE1 LYS 48 -0.699 -15.079 3.695 398 HZ1 LYS 48 HZ1 LYS 48 0.646 -17.715 3.497 399 HZ2 LYS 48 HZ2 LYS 48 -0.733 -17.219 2.651 400 HZ3 LYS 48 HZ3 LYS 48 -0.803 -17.445 4.324 401 H GLN 49 HN GLN 49 0.415 -9.996 1.078 402 HA GLN 49 HA GLN 49 -1.552 -8.318 2.353 403 HB2 GLN 49 HB2 GLN 49 0.056 -7.688 0.414 404 HB3 GLN 49 HB1 GLN 49 -1.142 -8.453 -0.615 405 HG2 GLN 49 HG2 GLN 49 -2.829 -6.910 0.540 406 HG3 GLN 49 HG1 GLN 49 -1.415 -6.009 1.084 407 HE21 GLN 49 HE21 GLN 49 -3.323 -6.965 -1.663 408 HE22 GLN 49 HE22 GLN 49 -2.665 -5.817 -2.772 409 H LEU 50 HN LEU 50 -3.716 -8.310 2.061 410 HA LEU 50 HA LEU 50 -4.882 -10.805 1.110 411 HB2 LEU 50 HB2 LEU 50 -6.326 -8.476 2.360 412 HB3 LEU 50 HB1 LEU 50 -6.864 -10.140 2.255 413 HG LEU 50 HG LEU 50 -4.542 -9.187 3.930 414 HD11 LEU 50 HD11 LEU 50 -7.282 -10.044 4.831 415 HD12 LEU 50 HD12 LEU 50 -6.757 -8.367 4.695 416 HD13 LEU 50 HD13 LEU 50 -5.959 -9.450 5.836 417 HD21 LEU 50 HD21 LEU 50 -5.777 -11.856 3.416 418 HD22 LEU 50 HD22 LEU 50 -5.036 -11.513 4.977 419 HD23 LEU 50 HD23 LEU 50 -4.074 -11.405 3.503 420 H GLU 51 HN GLU 51 -5.752 -10.979 -0.853 421 HA GLU 51 HA GLU 51 -5.911 -8.758 -2.623 422 HB2 GLU 51 HB2 GLU 51 -7.076 -11.536 -2.867 423 HB3 GLU 51 HB1 GLU 51 -7.057 -10.349 -4.161 424 HG2 GLU 51 HG2 GLU 51 -4.559 -10.342 -3.976 425 HG3 GLU 51 HG1 GLU 51 -4.710 -11.709 -2.871 426 H ASP 52 HN ASP 52 -7.578 -7.481 -3.126 427 HA ASP 52 HA ASP 52 -9.662 -7.082 -1.307 428 HB2 ASP 52 HB2 ASP 52 -9.868 -6.133 -4.143 429 HB3 ASP 52 HB1 ASP 52 -10.302 -5.296 -2.656 430 H GLY 53 HN GLY 53 -9.524 -8.981 -4.249 431 HA2 GLY 53 HA2 GLY 53 -12.406 -9.341 -4.324 432 HA3 GLY 53 HA1 GLY 53 -11.240 -10.026 -5.440 433 H ARG 54 HN ARG 54 -10.890 -10.414 -1.965 434 HA ARG 54 HA ARG 54 -11.824 -13.199 -2.233 435 HB2 ARG 54 HB2 ARG 54 -9.519 -12.468 -0.449 436 HB3 ARG 54 HB1 ARG 54 -9.994 -14.056 -1.027 437 HG2 ARG 54 HG2 ARG 54 -8.922 -11.894 -2.806 438 HG3 ARG 54 HG1 ARG 54 -7.913 -13.121 -2.036 439 HD2 ARG 54 HD2 ARG 54 -9.070 -14.872 -3.220 440 HD3 ARG 54 HD1 ARG 54 -10.223 -13.711 -3.881 441 HE ARG 54 HE ARG 54 -7.336 -13.649 -4.526 442 HH11 ARG 54 HH11 ARG 54 -10.704 -13.463 -5.501 443 HH12 ARG 54 HH12 ARG 54 -10.328 -13.102 -7.152 444 HH21 ARG 54 HH21 ARG 54 -6.852 -13.160 -6.678 445 HH22 ARG 54 HH22 ARG 54 -8.133 -12.930 -7.829 446 H THR 55 HN THR 55 -11.992 -14.193 0.071 447 HA THR 55 HA THR 55 -13.406 -12.229 1.758 448 HB THR 55 HB THR 55 -14.632 -14.167 2.699 449 HG1 THR 55 HG1 THR 55 -13.102 -15.590 0.749 450 HG21 THR 55 HG21 THR 55 -14.782 -13.993 -0.317 451 HG22 THR 55 HG22 THR 55 -15.600 -12.918 0.818 452 HG23 THR 55 HG23 THR 55 -16.040 -14.624 0.749 453 H LEU 56 HN LEU 56 -13.410 -12.930 4.148 454 HA LEU 56 HA LEU 56 -10.733 -13.018 5.053 455 HB2 LEU 56 HB2 LEU 56 -13.331 -13.448 6.532 456 HB3 LEU 56 HB1 LEU 56 -11.768 -13.304 7.312 457 HG LEU 56 HG LEU 56 -12.934 -11.138 5.571 458 HD11 LEU 56 HD11 LEU 56 -13.046 -11.405 8.571 459 HD12 LEU 56 HD12 LEU 56 -14.414 -11.545 7.467 460 HD13 LEU 56 HD13 LEU 56 -13.569 -10.006 7.631 461 HD21 LEU 56 HD21 LEU 56 -11.299 -9.736 6.768 462 HD22 LEU 56 HD22 LEU 56 -10.530 -11.019 5.834 463 HD23 LEU 56 HD23 LEU 56 -10.686 -11.174 7.584 464 H SER 57 HN SER 57 -13.179 -15.438 4.526 465 HA SER 57 HA SER 57 -11.933 -17.558 5.927 466 HB2 SER 57 HB2 SER 57 -13.432 -18.896 4.182 467 HB3 SER 57 HB1 SER 57 -14.148 -18.023 5.537 468 HG SER 57 HG SER 57 -13.761 -16.804 3.004 469 H ASP 58 HN ASP 58 -11.282 -16.082 2.894 470 HA ASP 58 HA ASP 58 -10.147 -18.300 1.543 471 HB2 ASP 58 HB2 ASP 58 -10.002 -15.334 1.200 472 HB3 ASP 58 HB1 ASP 58 -8.848 -16.347 0.340 473 H TYR 59 HN TYR 59 -8.868 -15.935 3.791 474 HA TYR 59 HA TYR 59 -6.218 -17.178 3.586 475 HB2 TYR 59 HB2 TYR 59 -7.070 -14.558 4.834 476 HB3 TYR 59 HB1 TYR 59 -5.421 -15.177 4.831 477 HD1 TYR 59 HD1 TYR 59 -4.141 -15.281 2.746 478 HD2 TYR 59 HD2 TYR 59 -8.050 -13.604 2.856 479 HE1 TYR 59 HE1 TYR 59 -3.747 -14.233 0.558 480 HE2 TYR 59 HE2 TYR 59 -7.664 -12.548 0.669 481 HH TYR 59 HH TYR 59 -4.972 -13.345 -1.303 482 H ASN 60 HN ASN 60 -8.845 -17.854 5.122 483 HA ASN 60 HA ASN 60 -9.433 -18.933 7.020 484 HB2 ASN 60 HB2 ASN 60 -6.450 -19.350 7.107 485 HB3 ASN 60 HB1 ASN 60 -7.530 -20.037 8.316 486 HD21 ASN 60 HD21 ASN 60 -5.787 -21.276 6.279 487 HD22 ASN 60 HD22 ASN 60 -6.821 -22.321 5.367 488 H ILE 61 HN ILE 61 -9.052 -16.073 7.136 489 HA ILE 61 HA ILE 61 -7.823 -15.432 9.648 490 HB ILE 61 HB ILE 61 -9.735 -13.769 7.996 491 HG12 ILE 61 HG12 ILE 61 -6.709 -13.728 8.060 492 HG13 ILE 61 HG11 ILE 61 -7.681 -14.445 6.781 493 HG21 ILE 61 HG21 ILE 61 -8.779 -11.862 9.219 494 HG22 ILE 61 HG22 ILE 61 -7.834 -12.980 10.201 495 HG23 ILE 61 HG23 ILE 61 -9.594 -12.996 10.297 496 HD11 ILE 61 HD11 ILE 61 -7.634 -11.538 7.549 497 HD12 ILE 61 HD12 ILE 61 -8.626 -12.248 6.275 498 HD13 ILE 61 HD13 ILE 61 -6.868 -12.262 6.136 499 H GLN 62 HN GLN 62 -8.681 -15.888 11.552 500 HA GLN 62 HA GLN 62 -11.581 -16.258 11.752 501 HB2 GLN 62 HB2 GLN 62 -9.300 -17.210 13.485 502 HB3 GLN 62 HB1 GLN 62 -10.993 -17.404 13.926 503 HG2 GLN 62 HG2 GLN 62 -11.294 -19.115 12.506 504 HG3 GLN 62 HG1 GLN 62 -10.309 -18.374 11.245 505 HE21 GLN 62 HE21 GLN 62 -8.129 -18.798 11.155 506 HE22 GLN 62 HE22 GLN 62 -7.383 -20.062 12.076 507 H LYS 63 HN LYS 63 -11.977 -15.916 14.419 508 HA LYS 63 HA LYS 63 -12.060 -13.067 14.622 509 HB2 LYS 63 HB2 LYS 63 -13.191 -13.507 16.787 510 HB3 LYS 63 HB1 LYS 63 -13.932 -14.338 15.429 511 HG2 LYS 63 HG2 LYS 63 -12.929 -16.418 16.081 512 HG3 LYS 63 HG1 LYS 63 -12.012 -15.618 17.358 513 HD2 LYS 63 HD2 LYS 63 -14.186 -14.954 18.392 514 HD3 LYS 63 HD1 LYS 63 -15.000 -15.952 17.187 515 HE2 LYS 63 HE2 LYS 63 -13.775 -17.914 17.989 516 HE3 LYS 63 HE1 LYS 63 -12.966 -16.917 19.195 517 HZ1 LYS 63 HZ1 LYS 63 -15.009 -16.558 20.312 518 HZ2 LYS 63 HZ2 LYS 63 -14.905 -18.220 20.015 519 HZ3 LYS 63 HZ3 LYS 63 -15.908 -17.253 19.060 520 H GLU 64 HN GLU 64 -11.286 -11.815 16.399 521 HA GLU 64 HA GLU 64 -9.735 -11.019 17.839 522 HB2 GLU 64 HB2 GLU 64 -9.435 -13.950 18.380 523 HB3 GLU 64 HB1 GLU 64 -8.338 -12.798 19.121 524 HG2 GLU 64 HG2 GLU 64 -9.873 -12.873 20.765 525 HG3 GLU 64 HG1 GLU 64 -10.646 -11.639 19.771 526 H SER 65 HN SER 65 -8.992 -12.341 15.006 527 HA SER 65 HA SER 65 -6.143 -12.556 15.237 528 HB2 SER 65 HB2 SER 65 -7.759 -12.270 12.701 529 HB3 SER 65 HB1 SER 65 -6.149 -12.972 12.880 530 HG SER 65 HG SER 65 -8.642 -14.063 13.401 531 H THR 66 HN THR 66 -4.589 -11.177 14.322 532 HA THR 66 HA THR 66 -5.366 -8.370 14.349 533 HB THR 66 HB THR 66 -2.550 -9.391 14.099 534 HG1 THR 66 HG1 THR 66 -4.272 -9.481 16.316 535 HG21 THR 66 HG21 THR 66 -2.927 -6.988 13.811 536 HG22 THR 66 HG22 THR 66 -2.018 -7.318 15.285 537 HG23 THR 66 HG23 THR 66 -3.734 -6.926 15.377 538 H LEU 67 HN LEU 67 -5.292 -7.072 12.614 539 HA LEU 67 HA LEU 67 -4.235 -8.185 10.095 540 HB2 LEU 67 HB2 LEU 67 -6.706 -6.562 10.637 541 HB3 LEU 67 HB1 LEU 67 -5.943 -6.518 9.061 542 HG LEU 67 HG LEU 67 -6.169 -9.107 9.147 543 HD11 LEU 67 HD11 LEU 67 -8.146 -9.858 10.405 544 HD12 LEU 67 HD12 LEU 67 -8.253 -8.269 11.161 545 HD13 LEU 67 HD13 LEU 67 -6.855 -9.297 11.467 546 HD21 LEU 67 HD21 LEU 67 -8.367 -8.953 8.118 547 HD22 LEU 67 HD22 LEU 67 -7.340 -7.621 7.587 548 HD23 LEU 67 HD23 LEU 67 -8.590 -7.342 8.800 549 H HIS 68 HN HIS 68 -2.655 -7.044 9.180 550 HA HIS 68 HA HIS 68 -1.873 -4.522 10.400 551 HB2 HIS 68 HB2 HIS 68 -0.558 -6.241 8.285 552 HB3 HIS 68 HB1 HIS 68 0.139 -4.768 8.945 553 HD2 HIS 68 HD2 HIS 68 0.724 -4.963 11.778 554 HE1 HIS 68 HE1 HIS 68 1.123 -9.167 11.527 555 HE2 HIS 68 HE2 HIS 68 1.830 -7.081 12.779 556 H LEU 69 HN LEU 69 -2.454 -2.604 9.567 557 HA LEU 69 HA LEU 69 -3.382 -2.558 6.780 558 HB2 LEU 69 HB2 LEU 69 -5.012 -1.821 8.480 559 HB3 LEU 69 HB1 LEU 69 -3.899 -0.564 8.986 560 HG LEU 69 HG LEU 69 -4.073 0.487 6.763 561 HD11 LEU 69 HD11 LEU 69 -5.900 -0.275 5.253 562 HD12 LEU 69 HD12 LEU 69 -6.042 -1.732 6.238 563 HD13 LEU 69 HD13 LEU 69 -4.543 -1.398 5.368 564 HD21 LEU 69 HD21 LEU 69 -5.534 1.272 8.507 565 HD22 LEU 69 HD22 LEU 69 -6.688 -0.017 8.169 566 HD23 LEU 69 HD23 LEU 69 -6.412 1.254 6.979 567 H VAL 70 HN VAL 70 -1.699 -2.130 5.525 568 HA VAL 70 HA VAL 70 0.250 -0.108 6.328 569 HB VAL 70 HB VAL 70 0.177 -2.146 4.103 570 HG11 VAL 70 HG11 VAL 70 2.194 0.056 4.516 571 HG12 VAL 70 HG12 VAL 70 1.132 -0.161 3.126 572 HG13 VAL 70 HG13 VAL 70 2.420 -1.323 3.441 573 HG21 VAL 70 HG21 VAL 70 0.823 -3.008 6.262 574 HG22 VAL 70 HG22 VAL 70 2.020 -1.727 6.452 575 HG23 VAL 70 HG23 VAL 70 2.231 -2.955 5.203 576 H LEU 71 HN LEU 71 0.372 1.861 5.412 577 HA LEU 71 HA LEU 71 -1.672 2.588 3.464 578 HB2 LEU 71 HB2 LEU 71 0.286 4.397 4.884 579 HB3 LEU 71 HB1 LEU 71 -1.157 4.877 4.016 580 HG LEU 71 HG LEU 71 -1.103 3.329 6.611 581 HD11 LEU 71 HD11 LEU 71 -0.462 5.649 6.916 582 HD12 LEU 71 HD12 LEU 71 -2.081 5.372 7.559 583 HD13 LEU 71 HD13 LEU 71 -1.874 6.181 6.005 584 HD21 LEU 71 HD21 LEU 71 -3.537 3.659 6.596 585 HD22 LEU 71 HD22 LEU 71 -2.996 2.680 5.233 586 HD23 LEU 71 HD23 LEU 71 -3.420 4.374 4.987 587 H ARG 72 HN ARG 72 -1.045 3.803 1.528 588 HA ARG 72 HA ARG 72 1.754 3.324 0.776 589 HB2 ARG 72 HB2 ARG 72 1.214 2.247 -1.160 590 HB3 ARG 72 HB1 ARG 72 -0.170 1.771 -0.193 591 HG2 ARG 72 HG2 ARG 72 -1.415 3.704 -1.221 592 HG3 ARG 72 HG1 ARG 72 -0.049 3.884 -2.326 593 HD2 ARG 72 HD2 ARG 72 -1.876 1.508 -2.023 594 HD3 ARG 72 HD1 ARG 72 -1.701 2.559 -3.426 595 HE ARG 72 HE ARG 72 0.783 1.359 -2.836 596 HH11 ARG 72 HH11 ARG 72 -2.396 0.522 -4.046 597 HH12 ARG 72 HH12 ARG 72 -1.823 -0.788 -5.027 598 HH21 ARG 72 HH21 ARG 72 1.551 -0.367 -4.145 599 HH22 ARG 72 HH22 ARG 72 0.421 -1.288 -5.087 600 H LEU 73 HN LEU 73 2.750 4.833 -0.447 601 HA LEU 73 HA LEU 73 1.214 7.224 -1.199 602 HB2 LEU 73 HB2 LEU 73 3.745 7.056 0.407 603 HB3 LEU 73 HB1 LEU 73 3.418 8.466 -0.578 604 HG LEU 73 HG LEU 73 1.171 8.566 0.732 605 HD11 LEU 73 HD11 LEU 73 2.851 6.791 2.490 606 HD12 LEU 73 HD12 LEU 73 1.231 6.480 1.865 607 HD13 LEU 73 HD13 LEU 73 1.481 7.734 3.080 608 HD21 LEU 73 HD21 LEU 73 2.945 10.229 0.879 609 HD22 LEU 73 HD22 LEU 73 3.803 9.224 2.046 610 HD23 LEU 73 HD23 LEU 73 2.237 9.919 2.464 611 H ARG 74 HN ARG 74 1.390 7.511 -3.304 612 HA ARG 74 HA ARG 74 3.499 6.231 -4.803 613 HB2 ARG 74 HB2 ARG 74 1.106 7.875 -5.615 614 HB3 ARG 74 HB1 ARG 74 2.288 7.279 -6.772 615 HG2 ARG 74 HG2 ARG 74 0.569 5.598 -4.955 616 HG3 ARG 74 HG1 ARG 74 0.360 5.815 -6.694 617 HD2 ARG 74 HD2 ARG 74 2.755 4.911 -6.890 618 HD3 ARG 74 HD1 ARG 74 2.542 4.367 -5.228 619 HE ARG 74 HE ARG 74 0.410 3.530 -6.946 620 HH11 ARG 74 HH11 ARG 74 3.650 2.775 -5.871 621 HH12 ARG 74 HH12 ARG 74 3.528 1.082 -6.268 622 HH21 ARG 74 HH21 ARG 74 0.249 1.312 -7.485 623 HH22 ARG 74 HH22 ARG 74 1.600 0.264 -7.191 624 H GLY 75 HN GLY 75 3.250 9.094 -3.186 625 HA2 GLY 75 HA2 GLY 75 5.292 10.336 -4.916 626 HA3 GLY 75 HA1 GLY 75 4.039 11.283 -4.127 627 H GLY 76 HN GLY 76 7.178 10.682 -3.941 628 HA2 GLY 76 HA2 GLY 76 7.358 11.537 -1.219 629 HA3 GLY 76 HA1 GLY 76 7.856 9.860 -1.426 630 H1 SER 453 HT1 SER 453 22.198 9.268 16.019 631 H2 SER 453 HT2 SER 453 23.264 7.959 16.121 632 H3 SER 453 HT3 SER 453 23.466 9.291 17.137 633 HA SER 453 HA SER 453 22.517 7.511 18.370 634 HB2 SER 453 HB2 SER 453 20.283 8.656 18.945 635 HB3 SER 453 HB1 SER 453 21.756 9.605 19.138 636 HG SER 453 HG SER 453 20.273 10.851 18.033 637 H ASN 454 HN ASN 454 20.086 8.565 15.992 638 HA ASN 454 HA ASN 454 18.574 7.450 14.721 639 HB2 ASN 454 HB2 ASN 454 20.606 5.313 15.181 640 HB3 ASN 454 HB1 ASN 454 19.049 4.857 14.502 641 HD21 ASN 454 HD21 ASN 454 20.261 4.214 12.643 642 HD22 ASN 454 HD22 ASN 454 20.736 5.398 11.473 643 H SER 455 HN SER 455 18.477 7.586 17.744 644 HA SER 455 HA SER 455 17.194 5.365 18.817 645 HB2 SER 455 HB2 SER 455 16.219 7.945 19.813 646 HB3 SER 455 HB1 SER 455 17.067 6.657 20.669 647 HG SER 455 HG SER 455 18.245 8.692 20.442 648 H GLN 456 HN GLN 456 15.789 8.258 17.296 649 HA GLN 456 HA GLN 456 13.100 7.436 17.598 650 HB2 GLN 456 HB2 GLN 456 14.341 9.414 15.682 651 HB3 GLN 456 HB1 GLN 456 12.610 9.193 15.896 652 HG2 GLN 456 HG2 GLN 456 14.571 10.129 17.978 653 HG3 GLN 456 HG1 GLN 456 13.362 11.110 17.150 654 HE21 GLN 456 HE21 GLN 456 13.752 10.588 19.999 655 HE22 GLN 456 HE22 GLN 456 12.260 9.928 20.570 656 H LEU 457 HN LEU 457 15.491 6.970 15.062 657 HA LEU 457 HA LEU 457 13.725 5.958 13.106 658 HB2 LEU 457 HB2 LEU 457 16.677 5.486 13.513 659 HB3 LEU 457 HB1 LEU 457 15.784 4.956 12.101 660 HG LEU 457 HG LEU 457 16.263 7.812 12.957 661 HD11 LEU 457 HD11 LEU 457 17.511 7.934 10.840 662 HD12 LEU 457 HD12 LEU 457 17.262 6.202 10.613 663 HD13 LEU 457 HD13 LEU 457 18.215 6.784 11.978 664 HD21 LEU 457 HD21 LEU 457 14.082 7.710 11.991 665 HD22 LEU 457 HD22 LEU 457 14.654 6.689 10.673 666 HD23 LEU 457 HD23 LEU 457 15.181 8.368 10.779 667 H ASN 458 HN ASN 458 15.661 4.434 15.632 668 HA ASN 458 HA ASN 458 15.063 1.763 14.990 669 HB2 ASN 458 HB2 ASN 458 16.140 3.203 17.352 670 HB3 ASN 458 HB1 ASN 458 15.474 1.599 17.639 671 HD21 ASN 458 HD21 ASN 458 18.247 2.629 17.747 672 HD22 ASN 458 HD22 ASN 458 19.149 1.594 16.695 673 H ALA 459 HN ALA 459 13.410 4.129 17.015 674 HA ALA 459 HA ALA 459 11.522 2.385 18.166 675 HB1 ALA 459 HB1 ALA 459 12.008 4.668 18.991 676 HB2 ALA 459 HB2 ALA 459 10.284 4.374 18.757 677 HB3 ALA 459 HB3 ALA 459 11.185 5.326 17.575 678 H MET 460 HN MET 460 11.394 4.430 15.271 679 HA MET 460 HA MET 460 8.750 3.682 14.546 680 HB2 MET 460 HB2 MET 460 11.000 4.971 13.007 681 HB3 MET 460 HB1 MET 460 9.429 4.646 12.290 682 HG2 MET 460 HG2 MET 460 8.382 6.026 14.044 683 HG3 MET 460 HG1 MET 460 9.988 6.409 14.659 684 HE1 MET 460 HE1 MET 460 11.544 8.588 11.877 685 HE2 MET 460 HE2 MET 460 11.788 6.867 12.173 686 HE3 MET 460 HE3 MET 460 11.688 7.989 13.529 687 H ALA 461 HN ALA 461 11.943 2.446 13.747 688 HA ALA 461 HA ALA 461 11.156 0.707 11.670 689 HB1 ALA 461 HB1 ALA 461 13.497 0.489 13.559 690 HB2 ALA 461 HB2 ALA 461 13.483 1.327 12.009 691 HB3 ALA 461 HB3 ALA 461 13.297 -0.425 12.065 692 H HIS 462 HN HIS 462 11.408 0.295 15.175 693 HA HIS 462 HA HIS 462 10.915 -2.460 15.287 694 HB2 HIS 462 HB2 HIS 462 11.657 -0.904 17.182 695 HB3 HIS 462 HB1 HIS 462 9.958 -0.483 17.360 696 HD2 HIS 462 HD2 HIS 462 8.289 -2.729 18.091 697 HE1 HIS 462 HE1 HIS 462 11.570 -4.833 19.730 698 HE2 HIS 462 HE2 HIS 462 9.057 -4.815 19.420 699 H GLN 463 HN GLN 463 8.754 0.293 15.056 700 HA GLN 463 HA GLN 463 6.332 -1.064 15.529 701 HB2 GLN 463 HB2 GLN 463 6.546 1.389 15.570 702 HB3 GLN 463 HB1 GLN 463 6.845 1.395 13.839 703 HG2 GLN 463 HG2 GLN 463 4.565 2.042 14.330 704 HG3 GLN 463 HG1 GLN 463 4.600 0.515 13.450 705 HE21 GLN 463 HE21 GLN 463 3.968 -1.371 14.480 706 HE22 GLN 463 HE22 GLN 463 3.130 -1.364 15.994 707 H ILE 464 HN ILE 464 8.239 -0.512 12.621 708 HA ILE 464 HA ILE 464 6.322 -1.660 10.834 709 HB ILE 464 HB ILE 464 9.272 -1.109 10.477 710 HG12 ILE 464 HG12 ILE 464 6.825 0.377 9.505 711 HG13 ILE 464 HG11 ILE 464 7.842 0.869 10.855 712 HG21 ILE 464 HG21 ILE 464 8.838 -1.347 8.061 713 HG22 ILE 464 HG22 ILE 464 7.202 -1.896 8.425 714 HG23 ILE 464 HG23 ILE 464 8.589 -2.856 8.939 715 HD11 ILE 464 HD11 ILE 464 8.300 2.123 8.808 716 HD12 ILE 464 HD12 ILE 464 8.749 0.622 8.000 717 HD13 ILE 464 HD13 ILE 464 9.705 1.212 9.360 718 H GLN 465 HN GLN 465 9.094 -2.818 12.642 719 HA GLN 465 HA GLN 465 9.391 -5.332 11.433 720 HB2 GLN 465 HB2 GLN 465 10.821 -4.052 13.247 721 HB3 GLN 465 HB1 GLN 465 9.846 -4.990 14.370 722 HG2 GLN 465 HG2 GLN 465 11.933 -6.116 13.928 723 HG3 GLN 465 HG1 GLN 465 10.588 -7.052 13.277 724 HE21 GLN 465 HE21 GLN 465 11.805 -8.123 11.767 725 HE22 GLN 465 HE22 GLN 465 12.486 -7.350 10.374 726 H GLU 466 HN GLU 466 7.135 -4.124 13.785 727 HA GLU 466 HA GLU 466 6.127 -6.681 14.590 728 HB2 GLU 466 HB2 GLU 466 5.184 -3.846 14.966 729 HB3 GLU 466 HB1 GLU 466 4.217 -5.214 15.498 730 HG2 GLU 466 HG2 GLU 466 7.064 -4.852 16.356 731 HG3 GLU 466 HG1 GLU 466 5.723 -4.094 17.211 732 H MET 467 HN MET 467 5.653 -4.610 11.932 733 HA MET 467 HA MET 467 3.029 -5.664 11.246 734 HB2 MET 467 HB2 MET 467 4.773 -3.838 9.584 735 HB3 MET 467 HB1 MET 467 3.046 -4.117 9.405 736 HG2 MET 467 HG2 MET 467 4.262 -2.867 11.853 737 HG3 MET 467 HG1 MET 467 3.727 -1.936 10.457 738 HE1 MET 467 HE1 MET 467 1.175 -2.921 9.408 739 HE2 MET 467 HE2 MET 467 1.277 -1.262 9.995 740 HE3 MET 467 HE3 MET 467 -0.083 -2.279 10.465 741 H PHE 468 HN PHE 468 6.359 -5.742 10.062 742 HA PHE 468 HA PHE 468 5.634 -8.077 8.414 743 HB2 PHE 468 HB2 PHE 468 7.585 -5.853 7.834 744 HB3 PHE 468 HB1 PHE 468 7.628 -7.389 6.978 745 HD1 PHE 468 HD2 PHE 468 5.365 -8.127 5.912 746 HD2 PHE 468 HD1 PHE 468 6.332 -4.129 6.978 747 HE1 PHE 468 HE2 PHE 468 3.669 -7.305 4.335 748 HE2 PHE 468 HE1 PHE 468 4.634 -3.293 5.402 749 HZ PHE 468 HZ PHE 468 3.299 -4.884 4.078 750 HA PRO 469 HA PRO 469 8.745 -9.564 11.418 751 HB2 PRO 469 HB2 PRO 469 7.284 -12.038 11.525 752 HB3 PRO 469 HB1 PRO 469 7.414 -10.796 12.779 753 HG2 PRO 469 HG2 PRO 469 5.107 -11.416 11.437 754 HG3 PRO 469 HG1 PRO 469 5.423 -9.874 12.254 755 HD2 PRO 469 HD2 PRO 469 5.583 -10.542 9.354 756 HD3 PRO 469 HD1 PRO 469 5.033 -9.051 10.147 757 H GLN 470 HN GLN 470 8.977 -9.633 8.517 758 HA GLN 470 HA GLN 470 10.609 -12.026 8.314 759 HB2 GLN 470 HB2 GLN 470 9.656 -12.555 6.044 760 HB3 GLN 470 HB1 GLN 470 8.592 -12.900 7.399 761 HG2 GLN 470 HG2 GLN 470 7.250 -11.007 6.946 762 HG3 GLN 470 HG1 GLN 470 8.426 -10.365 5.798 763 HE21 GLN 470 HE21 GLN 470 6.005 -12.817 6.351 764 HE22 GLN 470 HE22 GLN 470 5.776 -13.236 4.689 765 H VAL 471 HN VAL 471 10.686 -8.929 8.259 766 HA VAL 471 HA VAL 471 12.300 -8.718 5.807 767 HB VAL 471 HB VAL 471 10.348 -7.226 5.759 768 HG11 VAL 471 HG11 VAL 471 10.189 -5.320 7.301 769 HG12 VAL 471 HG12 VAL 471 11.524 -5.988 8.241 770 HG13 VAL 471 HG13 VAL 471 10.000 -6.869 8.122 771 HG21 VAL 471 HG21 VAL 471 12.351 -6.517 4.601 772 HG22 VAL 471 HG22 VAL 471 12.970 -5.772 6.074 773 HG23 VAL 471 HG23 VAL 471 11.529 -5.120 5.295 774 HA PRO 472 HA PRO 472 15.831 -8.439 8.487 775 HB2 PRO 472 HB2 PRO 472 16.917 -6.834 6.221 776 HB3 PRO 472 HB1 PRO 472 17.611 -8.248 7.038 777 HG2 PRO 472 HG2 PRO 472 16.557 -8.483 4.636 778 HG3 PRO 472 HG1 PRO 472 16.311 -9.741 5.863 779 HD2 PRO 472 HD2 PRO 472 14.419 -7.639 4.914 780 HD3 PRO 472 HD1 PRO 472 14.101 -9.326 5.369 781 H TYR 473 HN TYR 473 15.948 -7.118 10.134 782 HA TYR 473 HA TYR 473 14.838 -4.596 10.355 783 HB2 TYR 473 HB2 TYR 473 15.536 -6.170 12.198 784 HB3 TYR 473 HB1 TYR 473 17.185 -5.603 11.962 785 HD1 TYR 473 HD2 TYR 473 13.761 -4.216 12.568 786 HD2 TYR 473 HD1 TYR 473 17.935 -3.899 13.318 787 HE1 TYR 473 HE2 TYR 473 13.334 -2.366 14.131 788 HE2 TYR 473 HE1 TYR 473 17.521 -2.052 14.884 789 HH TYR 473 HH TYR 473 15.814 -0.360 15.336 790 H HIS 474 HN HIS 474 18.137 -5.479 9.438 791 HA HIS 474 HA HIS 474 19.201 -2.866 9.607 792 HB2 HIS 474 HB2 HIS 474 21.129 -3.691 8.437 793 HB3 HIS 474 HB1 HIS 474 20.600 -4.929 9.561 794 HD2 HIS 474 HD2 HIS 474 21.084 -4.354 5.774 795 HE1 HIS 474 HE1 HIS 474 19.822 -8.346 6.385 796 HE2 HIS 474 HE2 HIS 474 20.813 -6.710 4.719 797 H LEU 475 HN LEU 475 17.340 -4.470 7.146 798 HA LEU 475 HA LEU 475 18.000 -2.567 5.091 799 HB2 LEU 475 HB2 LEU 475 15.917 -4.733 5.299 800 HB3 LEU 475 HB1 LEU 475 15.998 -3.646 3.927 801 HG LEU 475 HG LEU 475 18.180 -5.548 4.792 802 HD11 LEU 475 HD11 LEU 475 16.499 -5.653 2.304 803 HD12 LEU 475 HD12 LEU 475 16.089 -6.533 3.775 804 HD13 LEU 475 HD13 LEU 475 17.599 -6.878 2.933 805 HD21 LEU 475 HD21 LEU 475 19.179 -3.618 3.785 806 HD22 LEU 475 HD22 LEU 475 17.994 -3.623 2.480 807 HD23 LEU 475 HD23 LEU 475 19.187 -4.918 2.593 808 H VAL 476 HN VAL 476 15.431 -3.063 7.423 809 HA VAL 476 HA VAL 476 13.643 -1.091 6.495 810 HB VAL 476 HB VAL 476 14.048 -1.978 9.363 811 HG11 VAL 476 HG11 VAL 476 11.682 -1.350 9.632 812 HG12 VAL 476 HG12 VAL 476 11.670 -0.741 7.977 813 HG13 VAL 476 HG13 VAL 476 12.695 0.024 9.190 814 HG21 VAL 476 HG21 VAL 476 12.254 -3.143 7.233 815 HG22 VAL 476 HG22 VAL 476 12.283 -3.619 8.932 816 HG23 VAL 476 HG23 VAL 476 13.694 -3.903 7.912 817 H LEU 477 HN LEU 477 16.335 -1.003 8.763 818 HA LEU 477 HA LEU 477 16.040 1.665 9.610 819 HB2 LEU 477 HB2 LEU 477 18.441 -0.147 9.469 820 HB3 LEU 477 HB1 LEU 477 18.511 1.468 10.151 821 HG LEU 477 HG LEU 477 16.713 -0.731 11.175 822 HD11 LEU 477 HD11 LEU 477 18.305 -0.796 13.074 823 HD12 LEU 477 HD12 LEU 477 19.391 0.237 12.146 824 HD13 LEU 477 HD13 LEU 477 18.985 -1.371 11.554 825 HD21 LEU 477 HD21 LEU 477 15.825 1.445 11.675 826 HD22 LEU 477 HD22 LEU 477 17.401 2.011 12.225 827 HD23 LEU 477 HD23 LEU 477 16.536 0.780 13.143 828 H GLN 478 HN GLN 478 17.345 0.302 6.692 829 HA GLN 478 HA GLN 478 18.887 2.599 5.962 830 HB2 GLN 478 HB2 GLN 478 19.110 0.168 5.093 831 HB3 GLN 478 HB1 GLN 478 17.816 0.606 3.985 832 HG2 GLN 478 HG2 GLN 478 19.229 2.523 3.226 833 HG3 GLN 478 HG1 GLN 478 20.535 1.867 4.207 834 HE21 GLN 478 HE21 GLN 478 18.214 -0.026 2.370 835 HE22 GLN 478 HE22 GLN 478 19.354 -0.654 1.232 836 H ASP 479 HN ASP 479 15.716 1.324 4.948 837 HA ASP 479 HA ASP 479 15.093 3.454 3.207 838 HB2 ASP 479 HB2 ASP 479 13.899 1.254 3.261 839 HB3 ASP 479 HB1 ASP 479 13.128 1.760 4.762 840 H LEU 480 HN LEU 480 14.677 3.005 6.655 841 HA LEU 480 HA LEU 480 12.965 5.153 7.193 842 HB2 LEU 480 HB2 LEU 480 14.640 3.340 8.689 843 HB3 LEU 480 HB1 LEU 480 14.698 4.951 9.377 844 HG LEU 480 HG LEU 480 12.984 3.593 10.458 845 HD11 LEU 480 HD11 LEU 480 11.780 5.767 8.747 846 HD12 LEU 480 HD12 LEU 480 12.630 6.009 10.272 847 HD13 LEU 480 HD13 LEU 480 11.107 5.122 10.242 848 HD21 LEU 480 HD21 LEU 480 12.452 2.093 8.629 849 HD22 LEU 480 HD22 LEU 480 11.740 3.424 7.718 850 HD23 LEU 480 HD23 LEU 480 10.991 2.883 9.219 851 H GLN 481 HN GLN 481 16.346 5.095 6.427 852 HA GLN 481 HA GLN 481 16.788 7.796 7.404 853 HB2 GLN 481 HB2 GLN 481 18.621 6.032 5.766 854 HB3 GLN 481 HB1 GLN 481 19.068 7.529 6.573 855 HG2 GLN 481 HG2 GLN 481 18.670 6.530 8.732 856 HG3 GLN 481 HG1 GLN 481 18.108 5.044 7.969 857 HE21 GLN 481 HE21 GLN 481 19.601 3.670 8.723 858 HE22 GLN 481 HE22 GLN 481 21.294 3.775 8.378 859 H LEU 482 HN LEU 482 15.821 6.202 4.531 860 HA LEU 482 HA LEU 482 16.495 8.439 2.805 861 HB2 LEU 482 HB2 LEU 482 15.558 5.657 2.413 862 HB3 LEU 482 HB1 LEU 482 15.014 6.823 1.225 863 HG LEU 482 HG LEU 482 16.991 5.735 0.398 864 HD11 LEU 482 HD11 LEU 482 18.389 7.622 -0.068 865 HD12 LEU 482 HD12 LEU 482 17.770 8.484 1.336 866 HD13 LEU 482 HD13 LEU 482 16.711 8.160 -0.034 867 HD21 LEU 482 HD21 LEU 482 17.954 4.955 2.471 868 HD22 LEU 482 HD22 LEU 482 18.302 6.613 2.967 869 HD23 LEU 482 HD23 LEU 482 19.149 5.910 1.587 870 H THR 483 HN THR 483 13.477 6.600 3.344 871 HA THR 483 HA THR 483 11.866 8.761 2.385 872 HB THR 483 HB THR 483 9.951 7.377 3.085 873 HG1 THR 483 HG1 THR 483 11.329 5.138 3.775 874 HG21 THR 483 HG21 THR 483 10.391 5.453 1.630 875 HG22 THR 483 HG22 THR 483 12.118 5.810 1.678 876 HG23 THR 483 HG23 THR 483 11.003 6.948 0.919 877 H ARG 484 HN ARG 484 12.605 7.394 5.548 878 HA ARG 484 HA ARG 484 12.474 8.205 7.660 879 HB2 ARG 484 HB2 ARG 484 12.042 10.885 6.325 880 HB3 ARG 484 HB1 ARG 484 12.443 10.635 8.019 881 HG2 ARG 484 HG2 ARG 484 14.617 10.134 7.581 882 HG3 ARG 484 HG1 ARG 484 14.257 9.463 5.990 883 HD2 ARG 484 HD2 ARG 484 13.709 11.857 5.296 884 HD3 ARG 484 HD1 ARG 484 14.504 12.346 6.791 885 HE ARG 484 HE ARG 484 16.107 10.581 5.192 886 HH11 ARG 484 HH11 ARG 484 15.158 13.913 5.685 887 HH12 ARG 484 HH12 ARG 484 16.568 14.563 4.918 888 HH21 ARG 484 HH21 ARG 484 17.960 11.435 4.156 889 HH22 ARG 484 HH22 ARG 484 18.158 13.156 4.043 890 H SER 485 HN SER 485 10.093 7.351 6.100 891 HA SER 485 HA SER 485 8.103 8.250 8.022 892 HB2 SER 485 HB2 SER 485 8.146 9.574 5.668 893 HB3 SER 485 HB1 SER 485 7.132 8.205 5.216 894 HG SER 485 HG SER 485 5.731 8.734 6.933 895 H VAL 486 HN VAL 486 7.192 6.489 8.793 896 HA VAL 486 HA VAL 486 7.640 3.908 7.872 897 HB VAL 486 HB VAL 486 5.820 3.211 9.418 898 HG11 VAL 486 HG11 VAL 486 7.746 5.232 10.561 899 HG12 VAL 486 HG12 VAL 486 8.121 3.546 10.203 900 HG13 VAL 486 HG13 VAL 486 6.939 3.939 11.450 901 HG21 VAL 486 HG21 VAL 486 4.316 5.111 9.117 902 HG22 VAL 486 HG22 VAL 486 5.502 6.179 9.869 903 HG23 VAL 486 HG23 VAL 486 4.739 4.903 10.817 904 H GLU 487 HN GLU 487 5.083 6.144 7.016 905 HA GLU 487 HA GLU 487 3.286 4.240 5.922 906 HB2 GLU 487 HB2 GLU 487 3.547 7.140 5.123 907 HB3 GLU 487 HB1 GLU 487 2.130 6.115 4.956 908 HG2 GLU 487 HG2 GLU 487 1.476 7.121 6.838 909 HG3 GLU 487 HG1 GLU 487 2.543 5.956 7.619 910 H ILE 488 HN ILE 488 6.206 5.636 4.720 911 HA ILE 488 HA ILE 488 5.526 4.827 1.984 912 HB ILE 488 HB ILE 488 8.062 6.217 2.834 913 HG12 ILE 488 HG12 ILE 488 5.498 7.513 1.877 914 HG13 ILE 488 HG11 ILE 488 6.059 7.522 3.545 915 HG21 ILE 488 HG21 ILE 488 6.612 6.032 0.195 916 HG22 ILE 488 HG22 ILE 488 8.089 5.175 0.632 917 HG23 ILE 488 HG23 ILE 488 8.101 6.932 0.485 918 HD11 ILE 488 HD11 ILE 488 7.460 8.766 1.194 919 HD12 ILE 488 HD12 ILE 488 8.058 8.755 2.855 920 HD13 ILE 488 HD13 ILE 488 6.571 9.617 2.455 921 H THR 489 HN THR 489 7.633 4.103 4.661 922 HA THR 489 HA THR 489 9.463 2.411 3.378 923 HB THR 489 HB THR 489 8.515 2.235 6.245 924 HG1 THR 489 HG1 THR 489 10.606 3.773 5.044 925 HG21 THR 489 HG21 THR 489 9.816 0.290 5.541 926 HG22 THR 489 HG22 THR 489 10.740 1.284 6.670 927 HG23 THR 489 HG23 THR 489 11.092 1.351 4.943 928 H THR 490 HN THR 490 6.399 1.683 5.047 929 HA THR 490 HA THR 490 6.569 -1.112 4.764 930 HB THR 490 HB THR 490 3.949 -0.858 4.906 931 HG1 THR 490 HG1 THR 490 4.738 1.629 6.027 932 HG21 THR 490 HG21 THR 490 5.603 -1.633 6.660 933 HG22 THR 490 HG22 THR 490 4.124 -0.896 7.265 934 HG23 THR 490 HG23 THR 490 5.624 0.030 7.247 935 H ASP 491 HN ASP 491 5.007 1.361 2.752 936 HA ASP 491 HA ASP 491 3.945 -0.432 0.848 937 HB2 ASP 491 HB2 ASP 491 3.175 1.903 1.057 938 HB3 ASP 491 HB1 ASP 491 4.734 2.467 0.464 939 H ASN 492 HN ASN 492 7.008 1.303 1.073 940 HA ASN 492 HA ASN 492 8.078 0.709 -1.424 941 HB2 ASN 492 HB2 ASN 492 9.159 1.455 1.219 942 HB3 ASN 492 HB1 ASN 492 10.295 0.617 0.166 943 HD21 ASN 492 HD21 ASN 492 11.080 3.011 0.751 944 HD22 ASN 492 HD22 ASN 492 10.766 4.152 -0.523 945 H ILE 493 HN ILE 493 8.116 -1.186 1.556 946 HA ILE 493 HA ILE 493 9.723 -3.303 0.589 947 HB ILE 493 HB ILE 493 7.628 -3.368 2.775 948 HG12 ILE 493 HG12 ILE 493 10.623 -3.021 3.024 949 HG13 ILE 493 HG11 ILE 493 9.479 -1.682 3.044 950 HG21 ILE 493 HG21 ILE 493 8.859 -5.318 3.620 951 HG22 ILE 493 HG22 ILE 493 9.908 -5.259 2.203 952 HG23 ILE 493 HG23 ILE 493 8.191 -5.607 2.013 953 HD11 ILE 493 HD11 ILE 493 8.439 -2.591 5.049 954 HD12 ILE 493 HD12 ILE 493 10.162 -2.308 5.289 955 HD13 ILE 493 HD13 ILE 493 9.569 -3.947 5.025 956 H LEU 494 HN LEU 494 6.228 -2.776 0.644 957 HA LEU 494 HA LEU 494 5.552 -5.336 -0.393 958 HB2 LEU 494 HB2 LEU 494 4.046 -2.745 -0.149 959 HB3 LEU 494 HB1 LEU 494 3.330 -4.166 -0.883 960 HG LEU 494 HG LEU 494 4.407 -4.112 1.939 961 HD11 LEU 494 HD11 LEU 494 2.081 -3.974 2.653 962 HD12 LEU 494 HD12 LEU 494 1.565 -3.830 0.976 963 HD13 LEU 494 HD13 LEU 494 2.533 -2.553 1.710 964 HD21 LEU 494 HD21 LEU 494 3.879 -6.238 0.325 965 HD22 LEU 494 HD22 LEU 494 2.331 -6.019 1.161 966 HD23 LEU 494 HD23 LEU 494 3.816 -6.265 2.089 967 H GLU 495 HN GLU 495 6.242 -2.211 -1.834 968 HA GLU 495 HA GLU 495 5.394 -2.875 -4.464 969 HB2 GLU 495 HB2 GLU 495 7.177 -0.722 -3.344 970 HB3 GLU 495 HB1 GLU 495 6.921 -0.896 -5.075 971 HG2 GLU 495 HG2 GLU 495 4.898 -0.245 -2.960 972 HG3 GLU 495 HG1 GLU 495 5.414 0.748 -4.322 973 H GLY 496 HN GLY 496 8.395 -3.265 -2.709 974 HA2 GLY 496 HA2 GLY 496 9.816 -5.119 -3.441 975 HA3 GLY 496 HA1 GLY 496 9.495 -4.617 -5.094 976 H ARG 497 HN ARG 497 9.938 -2.034 -2.936 977 HA ARG 497 HA ARG 497 12.281 -1.114 -4.247 978 HB2 ARG 497 HB2 ARG 497 10.558 0.318 -3.067 979 HB3 ARG 497 HB1 ARG 497 11.235 -0.240 -1.546 980 HG2 ARG 497 HG2 ARG 497 12.441 1.649 -1.707 981 HG3 ARG 497 HG1 ARG 497 13.471 0.655 -2.740 982 HD2 ARG 497 HD2 ARG 497 12.960 2.826 -3.765 983 HD3 ARG 497 HD1 ARG 497 12.330 1.483 -4.714 984 HE ARG 497 HE ARG 497 10.511 2.801 -2.840 985 HH11 ARG 497 HH11 ARG 497 11.557 2.307 -6.150 986 HH12 ARG 497 HH12 ARG 497 10.084 2.917 -6.837 987 HH21 ARG 497 HH21 ARG 497 8.576 3.608 -3.744 988 HH22 ARG 497 HH22 ARG 497 8.390 3.659 -5.469 989 H ILE 498 HN ILE 498 11.669 -2.480 -1.043 990 HA ILE 498 HA ILE 498 14.518 -2.816 -0.561 991 HB ILE 498 HB ILE 498 12.073 -3.330 1.139 992 HG12 ILE 498 HG12 ILE 498 13.542 -1.769 2.665 993 HG13 ILE 498 HG11 ILE 498 14.318 -1.346 1.142 994 HG21 ILE 498 HG21 ILE 498 13.626 -5.154 1.552 995 HG22 ILE 498 HG22 ILE 498 13.558 -4.068 2.940 996 HG23 ILE 498 HG23 ILE 498 14.931 -4.002 1.835 997 HD11 ILE 498 HD11 ILE 498 11.392 -1.057 1.789 998 HD12 ILE 498 HD12 ILE 498 12.145 -0.664 0.243 999 HD13 ILE 498 HD13 ILE 498 12.582 0.241 1.691 1000 H GLN 499 HN GLN 499 15.546 -4.625 -1.113 1001 HA GLN 499 HA GLN 499 14.145 -6.771 -2.354 1002 HB2 GLN 499 HB2 GLN 499 17.045 -6.552 -1.518 1003 HB3 GLN 499 HB1 GLN 499 16.381 -7.840 -2.509 1004 HG2 GLN 499 HG2 GLN 499 16.847 -4.976 -3.193 1005 HG3 GLN 499 HG1 GLN 499 17.329 -6.428 -4.064 1006 HE21 GLN 499 HE21 GLN 499 14.904 -4.042 -3.637 1007 HE22 GLN 499 HE22 GLN 499 13.808 -4.622 -4.842 1008 H VAL 500 HN VAL 500 12.935 -8.079 -1.208 1009 HA VAL 500 HA VAL 500 13.276 -8.680 1.526 1010 HB VAL 500 HB VAL 500 11.533 -10.401 1.153 1011 HG11 VAL 500 HG11 VAL 500 10.893 -8.087 1.559 1012 HG12 VAL 500 HG12 VAL 500 9.760 -8.867 0.456 1013 HG13 VAL 500 HG13 VAL 500 10.973 -7.748 -0.169 1014 HG21 VAL 500 HG21 VAL 500 11.795 -9.607 -1.749 1015 HG22 VAL 500 HG22 VAL 500 10.524 -10.630 -1.078 1016 HG23 VAL 500 HG23 VAL 500 12.200 -11.176 -1.052 1017 HA PRO 501 HA PRO 501 16.106 -12.061 1.630 1018 HB2 PRO 501 HB2 PRO 501 14.196 -13.685 3.197 1019 HB3 PRO 501 HB1 PRO 501 15.793 -13.068 3.656 1020 HG2 PRO 501 HG2 PRO 501 13.563 -12.066 4.702 1021 HG3 PRO 501 HG1 PRO 501 14.976 -11.051 4.353 1022 HD2 PRO 501 HD2 PRO 501 12.435 -11.338 2.812 1023 HD3 PRO 501 HD1 PRO 501 13.390 -9.879 3.151 1024 H PHE 502 HN PHE 502 16.495 -13.313 -0.065 1025 HA PHE 502 HA PHE 502 14.433 -15.239 -0.900 1026 HB2 PHE 502 HB2 PHE 502 14.600 -13.379 -2.529 1027 HB3 PHE 502 HB1 PHE 502 16.316 -13.711 -2.720 1028 HD1 PHE 502 HD1 PHE 502 12.949 -15.208 -3.173 1029 HD2 PHE 502 HD2 PHE 502 17.053 -15.277 -4.294 1030 HE1 PHE 502 HE1 PHE 502 12.429 -16.813 -4.966 1031 HE2 PHE 502 HE2 PHE 502 16.541 -16.881 -6.087 1032 HZ PHE 502 HZ PHE 502 14.227 -17.650 -6.424 1033 HA PRO 503 HA PRO 503 17.661 -18.166 -0.013 1034 HB2 PRO 503 HB2 PRO 503 16.621 -20.242 -1.517 1035 HB3 PRO 503 HB1 PRO 503 16.099 -19.835 0.128 1036 HG2 PRO 503 HG2 PRO 503 14.836 -19.148 -2.472 1037 HG3 PRO 503 HG1 PRO 503 14.083 -19.622 -0.937 1038 HD2 PRO 503 HD2 PRO 503 14.141 -17.066 -1.749 1039 HD3 PRO 503 HD1 PRO 503 14.271 -17.506 -0.034 1040 H THR 504 HN THR 504 19.393 -17.253 -1.075 1041 HA THR 504 HA THR 504 20.374 -18.602 -3.350 1042 HB THR 504 HB THR 504 18.746 -17.017 -4.460 1043 HG1 THR 504 HG1 THR 504 21.544 -16.841 -4.981 1044 HG21 THR 504 HG21 THR 504 19.049 -15.099 -2.949 1045 HG22 THR 504 HG22 THR 504 19.359 -14.657 -4.629 1046 HG23 THR 504 HG23 THR 504 20.706 -14.919 -3.521 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 -18.588 -10.287 14.633 2 H2 MET 1 HT2 MET 1 -18.721 -11.953 14.339 3 H3 MET 1 HT3 MET 1 -17.781 -10.987 13.317 4 HA MET 1 HA MET 1 -17.235 -11.512 16.177 5 HB2 MET 1 HB2 MET 1 -15.372 -12.858 15.439 6 HB3 MET 1 HB1 MET 1 -16.838 -13.464 14.683 7 HG2 MET 1 HG2 MET 1 -16.240 -12.282 12.615 8 HG3 MET 1 HG1 MET 1 -14.759 -11.716 13.383 9 HE1 MET 1 HE1 MET 1 -13.401 -14.332 10.825 10 HE2 MET 1 HE2 MET 1 -13.333 -12.664 11.394 11 HE3 MET 1 HE3 MET 1 -14.783 -13.261 10.588 12 H GLN 2 HN GLN 2 -15.240 -10.620 16.926 13 HA GLN 2 HA GLN 2 -14.595 -8.116 15.551 14 HB2 GLN 2 HB2 GLN 2 -14.329 -9.028 18.403 15 HB3 GLN 2 HB1 GLN 2 -13.499 -7.594 17.812 16 HG2 GLN 2 HG2 GLN 2 -16.461 -7.955 17.503 17 HG3 GLN 2 HG1 GLN 2 -15.742 -7.266 18.960 18 HE21 GLN 2 HE21 GLN 2 -17.479 -6.146 16.797 19 HE22 GLN 2 HE22 GLN 2 -16.645 -4.720 16.276 20 H ILE 3 HN ILE 3 -12.545 -7.535 15.014 21 HA ILE 3 HA ILE 3 -10.370 -9.450 15.508 22 HB ILE 3 HB ILE 3 -9.505 -9.051 13.209 23 HG12 ILE 3 HG12 ILE 3 -12.251 -7.992 12.545 24 HG13 ILE 3 HG11 ILE 3 -10.897 -6.930 12.917 25 HG21 ILE 3 HG21 ILE 3 -11.048 -10.573 12.073 26 HG22 ILE 3 HG22 ILE 3 -12.244 -10.307 13.341 27 HG23 ILE 3 HG23 ILE 3 -10.713 -11.096 13.724 28 HD11 ILE 3 HD11 ILE 3 -10.974 -8.939 10.678 29 HD12 ILE 3 HD12 ILE 3 -9.658 -7.820 11.031 30 HD13 ILE 3 HD13 ILE 3 -11.225 -7.201 10.512 31 H PHE 4 HN PHE 4 -8.205 -8.441 15.064 32 HA PHE 4 HA PHE 4 -8.293 -5.612 15.882 33 HB2 PHE 4 HB2 PHE 4 -6.222 -7.742 16.438 34 HB3 PHE 4 HB1 PHE 4 -6.006 -6.038 16.825 35 HD1 PHE 4 HD1 PHE 4 -7.525 -4.964 18.486 36 HD2 PHE 4 HD2 PHE 4 -7.456 -9.170 17.845 37 HE1 PHE 4 HE1 PHE 4 -8.636 -5.307 20.652 38 HE2 PHE 4 HE2 PHE 4 -8.574 -9.521 20.010 39 HZ PHE 4 HZ PHE 4 -9.161 -7.587 21.417 40 H VAL 5 HN VAL 5 -7.450 -4.146 14.567 41 HA VAL 5 HA VAL 5 -5.688 -5.059 12.382 42 HB VAL 5 HB VAL 5 -7.553 -2.674 12.320 43 HG11 VAL 5 HG11 VAL 5 -7.056 -2.650 9.921 44 HG12 VAL 5 HG12 VAL 5 -5.941 -4.000 10.138 45 HG13 VAL 5 HG13 VAL 5 -5.594 -2.441 10.884 46 HG21 VAL 5 HG21 VAL 5 -8.875 -4.698 12.368 47 HG22 VAL 5 HG22 VAL 5 -7.891 -5.409 11.090 48 HG23 VAL 5 HG23 VAL 5 -8.907 -4.009 10.744 49 H LYS 6 HN LYS 6 -3.661 -4.396 12.715 50 HA LYS 6 HA LYS 6 -3.177 -2.050 14.388 51 HB2 LYS 6 HB2 LYS 6 -1.958 -4.231 14.757 52 HB3 LYS 6 HB1 LYS 6 -1.138 -3.953 13.227 53 HG2 LYS 6 HG2 LYS 6 0.033 -2.111 14.057 54 HG3 LYS 6 HG1 LYS 6 -1.044 -1.934 15.443 55 HD2 LYS 6 HD2 LYS 6 0.615 -4.408 15.072 56 HD3 LYS 6 HD1 LYS 6 1.294 -2.960 15.815 57 HE2 LYS 6 HE2 LYS 6 -0.367 -3.005 17.554 58 HE3 LYS 6 HE1 LYS 6 -1.209 -4.340 16.767 59 HZ1 LYS 6 HZ1 LYS 6 1.544 -4.464 17.888 60 HZ2 LYS 6 HZ2 LYS 6 0.710 -5.742 17.154 61 HZ3 LYS 6 HZ3 LYS 6 0.151 -5.104 18.610 62 H THR 7 HN THR 7 -2.074 -0.237 13.690 63 HA THR 7 HA THR 7 -1.755 0.006 10.774 64 HB THR 7 HB THR 7 -2.082 2.510 11.241 65 HG1 THR 7 HG1 THR 7 -3.435 1.566 13.559 66 HG21 THR 7 HG21 THR 7 -4.393 0.608 11.646 67 HG22 THR 7 HG22 THR 7 -3.770 1.176 10.098 68 HG23 THR 7 HG23 THR 7 -4.540 2.308 11.210 69 H LEU 8 HN LEU 8 -0.200 1.748 10.139 70 HA LEU 8 HA LEU 8 2.336 1.262 11.324 71 HB2 LEU 8 HB2 LEU 8 1.545 3.360 9.306 72 HB3 LEU 8 HB1 LEU 8 3.183 2.850 9.672 73 HG LEU 8 HG LEU 8 1.067 1.047 8.505 74 HD11 LEU 8 HD11 LEU 8 3.348 2.465 7.139 75 HD12 LEU 8 HD12 LEU 8 1.636 2.851 6.961 76 HD13 LEU 8 HD13 LEU 8 2.254 1.300 6.393 77 HD21 LEU 8 HD21 LEU 8 2.928 -0.447 8.050 78 HD22 LEU 8 HD22 LEU 8 2.811 -0.108 9.776 79 HD23 LEU 8 HD23 LEU 8 4.046 0.692 8.803 80 H THR 9 HN THR 9 -0.152 3.496 11.953 81 HA THR 9 HA THR 9 1.504 5.580 13.029 82 HB THR 9 HB THR 9 -1.073 5.905 14.044 83 HG1 THR 9 HG1 THR 9 -2.335 5.510 12.100 84 HG21 THR 9 HG21 THR 9 0.323 7.658 13.056 85 HG22 THR 9 HG22 THR 9 -1.272 7.631 12.300 86 HG23 THR 9 HG23 THR 9 0.115 6.936 11.460 87 H GLY 10 HN GLY 10 0.364 2.581 14.152 88 HA2 GLY 10 HA2 GLY 10 1.047 1.605 16.190 89 HA3 GLY 10 HA1 GLY 10 1.304 3.214 16.847 90 H LYS 11 HN LYS 11 -1.642 2.457 15.168 91 HA LYS 11 HA LYS 11 -3.038 2.453 17.762 92 HB2 LYS 11 HB2 LYS 11 -3.329 4.495 16.246 93 HB3 LYS 11 HB1 LYS 11 -4.226 3.432 15.168 94 HG2 LYS 11 HG2 LYS 11 -5.749 2.912 17.078 95 HG3 LYS 11 HG1 LYS 11 -4.921 4.166 18.002 96 HD2 LYS 11 HD2 LYS 11 -6.795 5.255 17.124 97 HD3 LYS 11 HD1 LYS 11 -5.488 5.716 16.030 98 HE2 LYS 11 HE2 LYS 11 -6.238 4.280 14.346 99 HE3 LYS 11 HE1 LYS 11 -7.225 3.338 15.459 100 HZ1 LYS 11 HZ1 LYS 11 -8.737 5.175 15.664 101 HZ2 LYS 11 HZ2 LYS 11 -8.544 4.798 14.020 102 HZ3 LYS 11 HZ3 LYS 11 -7.765 6.145 14.679 103 H THR 12 HN THR 12 -4.066 0.631 18.201 104 HA THR 12 HA THR 12 -4.543 -1.310 16.089 105 HB THR 12 HB THR 12 -5.130 -1.651 19.031 106 HG1 THR 12 HG1 THR 12 -2.952 -1.145 18.919 107 HG21 THR 12 HG21 THR 12 -6.090 -3.333 17.519 108 HG22 THR 12 HG22 THR 12 -4.825 -4.027 18.534 109 HG23 THR 12 HG23 THR 12 -4.489 -3.639 16.848 110 H ILE 13 HN ILE 13 -6.400 -1.243 15.022 111 HA ILE 13 HA ILE 13 -8.749 -0.052 16.318 112 HB ILE 13 HB ILE 13 -8.837 -0.847 13.460 113 HG12 ILE 13 HG12 ILE 13 -7.412 1.676 14.316 114 HG13 ILE 13 HG11 ILE 13 -6.564 0.211 13.830 115 HG21 ILE 13 HG21 ILE 13 -9.788 1.576 14.981 116 HG22 ILE 13 HG22 ILE 13 -10.763 0.177 14.526 117 HG23 ILE 13 HG23 ILE 13 -10.111 1.242 13.279 118 HD11 ILE 13 HD11 ILE 13 -8.443 1.824 12.121 119 HD12 ILE 13 HD12 ILE 13 -7.628 0.339 11.630 120 HD13 ILE 13 HD13 ILE 13 -6.686 1.784 11.997 121 H THR 14 HN THR 14 -10.727 -1.119 16.396 122 HA THR 14 HA THR 14 -10.604 -4.012 15.865 123 HB THR 14 HB THR 14 -12.744 -3.149 17.658 124 HG1 THR 14 HG1 THR 14 -10.185 -2.222 18.080 125 HG21 THR 14 HG21 THR 14 -12.012 -5.493 17.299 126 HG22 THR 14 HG22 THR 14 -11.960 -5.008 18.993 127 HG23 THR 14 HG23 THR 14 -10.469 -5.095 18.054 128 H LEU 15 HN LEU 15 -12.218 -4.902 14.600 129 HA LEU 15 HA LEU 15 -14.397 -3.122 13.754 130 HB2 LEU 15 HB2 LEU 15 -12.538 -4.660 11.954 131 HB3 LEU 15 HB1 LEU 15 -14.082 -4.031 11.416 132 HG LEU 15 HG LEU 15 -11.951 -2.250 12.578 133 HD11 LEU 15 HD11 LEU 15 -11.238 -1.736 10.330 134 HD12 LEU 15 HD12 LEU 15 -12.400 -2.886 9.667 135 HD13 LEU 15 HD13 LEU 15 -11.043 -3.462 10.635 136 HD21 LEU 15 HD21 LEU 15 -14.159 -1.287 12.535 137 HD22 LEU 15 HD22 LEU 15 -14.373 -1.759 10.849 138 HD23 LEU 15 HD23 LEU 15 -13.176 -0.538 11.279 139 H GLU 16 HN GLU 16 -16.256 -4.135 13.000 140 HA GLU 16 HA GLU 16 -16.629 -6.854 13.984 141 HB2 GLU 16 HB2 GLU 16 -18.222 -5.052 14.618 142 HB3 GLU 16 HB1 GLU 16 -18.646 -4.860 12.925 143 HG2 GLU 16 HG2 GLU 16 -20.344 -6.144 13.985 144 HG3 GLU 16 HG1 GLU 16 -19.439 -7.207 12.908 145 H VAL 17 HN VAL 17 -16.184 -8.416 12.587 146 HA VAL 17 HA VAL 17 -17.173 -8.170 9.824 147 HB VAL 17 HB VAL 17 -15.156 -9.375 9.012 148 HG11 VAL 17 HG11 VAL 17 -13.609 -7.453 9.118 149 HG12 VAL 17 HG12 VAL 17 -14.622 -6.734 10.367 150 HG13 VAL 17 HG13 VAL 17 -15.265 -6.973 8.743 151 HG21 VAL 17 HG21 VAL 17 -13.150 -9.430 10.445 152 HG22 VAL 17 HG22 VAL 17 -14.458 -10.430 11.076 153 HG23 VAL 17 HG23 VAL 17 -14.124 -8.857 11.799 154 H GLU 18 HN GLU 18 -16.975 -10.456 8.760 155 HA GLU 18 HA GLU 18 -17.601 -12.550 10.711 156 HB2 GLU 18 HB2 GLU 18 -19.308 -11.704 8.371 157 HB3 GLU 18 HB1 GLU 18 -19.485 -13.262 9.163 158 HG2 GLU 18 HG2 GLU 18 -19.640 -10.705 10.709 159 HG3 GLU 18 HG1 GLU 18 -21.040 -11.354 9.859 160 HA PRO 19 HA PRO 19 -15.069 -15.242 8.327 161 HB2 PRO 19 HB2 PRO 19 -17.362 -17.121 8.045 162 HB3 PRO 19 HB1 PRO 19 -15.736 -17.410 8.693 163 HG2 PRO 19 HG2 PRO 19 -17.830 -17.222 10.305 164 HG3 PRO 19 HG1 PRO 19 -16.248 -16.560 10.760 165 HD2 PRO 19 HD2 PRO 19 -18.697 -15.135 9.852 166 HD3 PRO 19 HD1 PRO 19 -17.462 -14.633 11.024 167 H SER 20 HN SER 20 -18.322 -14.717 7.051 168 HA SER 20 HA SER 20 -17.423 -15.347 4.349 169 HB2 SER 20 HB2 SER 20 -20.187 -14.525 5.259 170 HB3 SER 20 HB1 SER 20 -19.745 -15.291 3.734 171 HG SER 20 HG SER 20 -18.830 -16.972 5.350 172 H ASP 21 HN ASP 21 -16.809 -12.781 6.042 173 HA ASP 21 HA ASP 21 -17.995 -10.701 4.440 174 HB2 ASP 21 HB2 ASP 21 -17.195 -10.550 6.917 175 HB3 ASP 21 HB1 ASP 21 -15.604 -10.284 6.214 176 H THR 22 HN THR 22 -16.859 -9.296 3.040 177 HA THR 22 HA THR 22 -14.685 -10.662 1.615 178 HB THR 22 HB THR 22 -16.018 -8.232 0.513 179 HG1 THR 22 HG1 THR 22 -17.359 -10.432 1.340 180 HG21 THR 22 HG21 THR 22 -15.180 -10.860 -0.727 181 HG22 THR 22 HG22 THR 22 -14.216 -9.385 -0.721 182 HG23 THR 22 HG23 THR 22 -15.747 -9.434 -1.595 183 H ILE 23 HN ILE 23 -12.754 -9.589 1.088 184 HA ILE 23 HA ILE 23 -11.678 -7.882 3.009 185 HB ILE 23 HB ILE 23 -10.762 -8.277 0.155 186 HG12 ILE 23 HG12 ILE 23 -10.892 -10.379 1.417 187 HG13 ILE 23 HG11 ILE 23 -9.217 -9.933 1.105 188 HG21 ILE 23 HG21 ILE 23 -8.567 -7.542 0.950 189 HG22 ILE 23 HG22 ILE 23 -9.258 -7.193 2.533 190 HG23 ILE 23 HG23 ILE 23 -9.782 -6.276 1.122 191 HD11 ILE 23 HD11 ILE 23 -10.701 -9.583 3.700 192 HD12 ILE 23 HD12 ILE 23 -9.040 -9.074 3.395 193 HD13 ILE 23 HD13 ILE 23 -9.462 -10.786 3.348 194 H GLU 24 HN GLU 24 -13.033 -7.120 -0.179 195 HA GLU 24 HA GLU 24 -12.472 -4.394 -0.248 196 HB2 GLU 24 HB2 GLU 24 -13.627 -6.087 -1.966 197 HB3 GLU 24 HB1 GLU 24 -15.080 -5.326 -1.335 198 HG2 GLU 24 HG2 GLU 24 -12.985 -3.432 -2.087 199 HG3 GLU 24 HG1 GLU 24 -13.592 -4.410 -3.422 200 H ASN 25 HN ASN 25 -15.158 -6.128 1.248 201 HA ASN 25 HA ASN 25 -16.659 -3.837 1.979 202 HB2 ASN 25 HB2 ASN 25 -17.562 -6.179 1.885 203 HB3 ASN 25 HB1 ASN 25 -16.646 -6.539 3.346 204 HD21 ASN 25 HD21 ASN 25 -18.342 -6.936 4.669 205 HD22 ASN 25 HD22 ASN 25 -19.495 -5.723 5.138 206 H VAL 26 HN VAL 26 -14.140 -5.726 3.560 207 HA VAL 26 HA VAL 26 -14.251 -4.487 6.091 208 HB VAL 26 HB VAL 26 -11.846 -5.699 4.706 209 HG11 VAL 26 HG11 VAL 26 -11.207 -4.302 6.604 210 HG12 VAL 26 HG12 VAL 26 -10.946 -6.009 6.962 211 HG13 VAL 26 HG13 VAL 26 -12.343 -5.172 7.635 212 HG21 VAL 26 HG21 VAL 26 -13.715 -7.270 4.863 213 HG22 VAL 26 HG22 VAL 26 -13.835 -6.959 6.594 214 HG23 VAL 26 HG23 VAL 26 -12.397 -7.740 5.937 215 H LYS 27 HN LYS 27 -12.491 -3.732 3.123 216 HA LYS 27 HA LYS 27 -10.950 -1.597 4.117 217 HB2 LYS 27 HB2 LYS 27 -12.000 -1.964 1.305 218 HB3 LYS 27 HB1 LYS 27 -10.653 -0.939 1.783 219 HG2 LYS 27 HG2 LYS 27 -10.061 -3.493 2.767 220 HG3 LYS 27 HG1 LYS 27 -10.676 -3.728 1.130 221 HD2 LYS 27 HD2 LYS 27 -8.433 -1.880 1.945 222 HD3 LYS 27 HD1 LYS 27 -8.255 -3.433 1.126 223 HE2 LYS 27 HE2 LYS 27 -10.046 -2.071 -0.465 224 HE3 LYS 27 HE1 LYS 27 -8.922 -0.813 0.044 225 HZ1 LYS 27 HZ1 LYS 27 -8.338 -3.317 -1.429 226 HZ2 LYS 27 HZ2 LYS 27 -7.117 -2.414 -0.664 227 HZ3 LYS 27 HZ3 LYS 27 -8.029 -1.715 -1.906 228 H ALA 28 HN ALA 28 -14.220 -1.779 2.846 229 HA ALA 28 HA ALA 28 -14.712 0.998 2.682 230 HB1 ALA 28 HB1 ALA 28 -16.138 -0.601 1.545 231 HB2 ALA 28 HB2 ALA 28 -17.094 0.369 2.662 232 HB3 ALA 28 HB3 ALA 28 -16.647 -1.281 3.089 233 H LYS 29 HN LYS 29 -15.017 -1.357 5.266 234 HA LYS 29 HA LYS 29 -16.354 0.311 7.121 235 HB2 LYS 29 HB2 LYS 29 -14.564 -2.089 7.565 236 HB3 LYS 29 HB1 LYS 29 -15.541 -1.332 8.819 237 HG2 LYS 29 HG2 LYS 29 -17.566 -1.896 7.656 238 HG3 LYS 29 HG1 LYS 29 -16.652 -2.520 6.283 239 HD2 LYS 29 HD2 LYS 29 -15.727 -4.289 7.701 240 HD3 LYS 29 HD1 LYS 29 -16.616 -3.653 9.086 241 HE2 LYS 29 HE2 LYS 29 -18.726 -4.102 7.962 242 HE3 LYS 29 HE1 LYS 29 -17.867 -4.680 6.537 243 HZ1 LYS 29 HZ1 LYS 29 -17.487 -5.940 9.185 244 HZ2 LYS 29 HZ2 LYS 29 -17.145 -6.585 7.646 245 HZ3 LYS 29 HZ3 LYS 29 -18.747 -6.399 8.156 246 H ILE 30 HN ILE 30 -12.953 -0.327 6.437 247 HA ILE 30 HA ILE 30 -11.921 1.274 8.552 248 HB ILE 30 HB ILE 30 -10.599 0.485 5.947 249 HG12 ILE 30 HG12 ILE 30 -10.353 -0.815 8.662 250 HG13 ILE 30 HG11 ILE 30 -11.417 -1.408 7.389 251 HG21 ILE 30 HG21 ILE 30 -9.474 2.359 7.031 252 HG22 ILE 30 HG22 ILE 30 -8.491 0.898 7.122 253 HG23 ILE 30 HG23 ILE 30 -9.388 1.448 8.538 254 HD11 ILE 30 HD11 ILE 30 -9.324 -2.653 7.486 255 HD12 ILE 30 HD12 ILE 30 -8.424 -1.162 7.199 256 HD13 ILE 30 HD13 ILE 30 -9.500 -1.797 5.955 257 H GLN 31 HN GLN 31 -12.709 1.848 5.169 258 HA GLN 31 HA GLN 31 -11.643 4.446 4.939 259 HB2 GLN 31 HB2 GLN 31 -12.208 3.209 2.956 260 HB3 GLN 31 HB1 GLN 31 -13.887 3.060 3.465 261 HG2 GLN 31 HG2 GLN 31 -14.056 5.556 3.295 262 HG3 GLN 31 HG1 GLN 31 -12.452 5.547 2.565 263 HE21 GLN 31 HE21 GLN 31 -13.328 6.453 0.670 264 HE22 GLN 31 HE22 GLN 31 -14.219 5.492 -0.456 265 H ASP 32 HN ASP 32 -14.625 3.253 6.280 266 HA ASP 32 HA ASP 32 -15.777 5.916 6.424 267 HB2 ASP 32 HB2 ASP 32 -16.983 3.585 6.053 268 HB3 ASP 32 HB1 ASP 32 -17.007 3.581 7.814 269 H LYS 33 HN LYS 33 -14.229 3.583 8.531 270 HA LYS 33 HA LYS 33 -14.871 5.018 10.940 271 HB2 LYS 33 HB2 LYS 33 -14.496 2.514 10.743 272 HB3 LYS 33 HB1 LYS 33 -12.779 2.873 10.634 273 HG2 LYS 33 HG2 LYS 33 -12.686 3.674 12.824 274 HG3 LYS 33 HG1 LYS 33 -14.438 3.860 12.925 275 HD2 LYS 33 HD2 LYS 33 -14.682 1.408 12.809 276 HD3 LYS 33 HD1 LYS 33 -12.923 1.253 12.777 277 HE2 LYS 33 HE2 LYS 33 -12.700 2.033 14.972 278 HE3 LYS 33 HE1 LYS 33 -14.325 2.719 14.988 279 HZ1 LYS 33 HZ1 LYS 33 -15.223 0.474 14.955 280 HZ2 LYS 33 HZ2 LYS 33 -14.214 0.693 16.289 281 HZ3 LYS 33 HZ3 LYS 33 -13.665 -0.184 14.954 282 H GLU 34 HN GLU 34 -11.899 4.520 9.037 283 HA GLU 34 HA GLU 34 -10.539 6.521 10.683 284 HB2 GLU 34 HB2 GLU 34 -9.501 4.688 8.517 285 HB3 GLU 34 HB1 GLU 34 -8.515 5.809 9.447 286 HG2 GLU 34 HG2 GLU 34 -10.082 3.507 10.590 287 HG3 GLU 34 HG1 GLU 34 -8.347 3.517 10.273 288 H GLY 35 HN GLY 35 -11.590 5.961 7.357 289 HA2 GLY 35 HA2 GLY 35 -12.299 7.789 5.982 290 HA3 GLY 35 HA1 GLY 35 -11.195 8.834 6.863 291 H ILE 36 HN ILE 36 -9.671 5.972 6.255 292 HA ILE 36 HA ILE 36 -7.906 7.136 4.327 293 HB ILE 36 HB ILE 36 -8.013 4.281 5.312 294 HG12 ILE 36 HG12 ILE 36 -6.248 6.499 6.352 295 HG13 ILE 36 HG11 ILE 36 -7.792 6.091 7.093 296 HG21 ILE 36 HG21 ILE 36 -5.785 5.855 4.026 297 HG22 ILE 36 HG22 ILE 36 -6.693 4.538 3.286 298 HG23 ILE 36 HG23 ILE 36 -5.642 4.219 4.666 299 HD11 ILE 36 HD11 ILE 36 -5.880 5.070 8.238 300 HD12 ILE 36 HD12 ILE 36 -5.478 4.198 6.759 301 HD13 ILE 36 HD13 ILE 36 -6.996 3.866 7.592 302 HA PRO 37 HA PRO 37 -10.179 5.819 0.700 303 HB2 PRO 37 HB2 PRO 37 -7.575 6.045 -0.679 304 HB3 PRO 37 HB1 PRO 37 -9.087 6.917 -0.983 305 HG2 PRO 37 HG2 PRO 37 -6.950 8.097 0.108 306 HG3 PRO 37 HG1 PRO 37 -8.612 8.559 0.513 307 HD2 PRO 37 HD2 PRO 37 -6.662 6.963 2.092 308 HD3 PRO 37 HD1 PRO 37 -7.910 8.100 2.641 309 HA PRO 38 HA PRO 38 -9.174 1.461 0.722 310 HB2 PRO 38 HB2 PRO 38 -10.651 1.379 -1.845 311 HB3 PRO 38 HB1 PRO 38 -10.971 0.508 -0.333 312 HG2 PRO 38 HG2 PRO 38 -12.536 2.497 -1.124 313 HG3 PRO 38 HG1 PRO 38 -12.147 2.240 0.590 314 HD2 PRO 38 HD2 PRO 38 -11.031 4.260 -1.311 315 HD3 PRO 38 HD1 PRO 38 -11.474 4.439 0.401 316 H ASP 39 HN ASP 39 -8.576 3.601 -1.940 317 HA ASP 39 HA ASP 39 -7.096 1.791 -3.562 318 HB2 ASP 39 HB2 ASP 39 -6.484 4.696 -3.704 319 HB3 ASP 39 HB1 ASP 39 -6.833 3.555 -4.999 320 H GLN 40 HN GLN 40 -6.379 3.631 -0.743 321 HA GLN 40 HA GLN 40 -3.492 3.189 -1.115 322 HB2 GLN 40 HB2 GLN 40 -5.024 5.132 0.608 323 HB3 GLN 40 HB1 GLN 40 -3.305 4.830 0.826 324 HG2 GLN 40 HG2 GLN 40 -2.919 5.537 -1.501 325 HG3 GLN 40 HG1 GLN 40 -4.636 5.916 -1.644 326 HE21 GLN 40 HE21 GLN 40 -1.611 6.808 -0.171 327 HE22 GLN 40 HE22 GLN 40 -2.097 8.391 0.336 328 H GLN 41 HN GLN 41 -5.960 1.587 0.110 329 HA GLN 41 HA GLN 41 -4.820 0.954 2.716 330 HB2 GLN 41 HB2 GLN 41 -7.377 0.169 1.342 331 HB3 GLN 41 HB1 GLN 41 -6.848 -0.592 2.834 332 HG2 GLN 41 HG2 GLN 41 -6.836 1.657 3.897 333 HG3 GLN 41 HG1 GLN 41 -7.537 2.306 2.412 334 HE21 GLN 41 HE21 GLN 41 -9.469 2.917 3.344 335 HE22 GLN 41 HE22 GLN 41 -10.637 1.764 3.899 336 H ARG 42 HN ARG 42 -3.074 -0.342 2.510 337 HA ARG 42 HA ARG 42 -3.321 -2.717 0.792 338 HB2 ARG 42 HB2 ARG 42 -0.845 -1.561 2.102 339 HB3 ARG 42 HB1 ARG 42 -0.884 -2.928 0.996 340 HG2 ARG 42 HG2 ARG 42 -1.888 -1.312 -0.697 341 HG3 ARG 42 HG1 ARG 42 -1.386 -0.029 0.406 342 HD2 ARG 42 HD2 ARG 42 0.342 -0.277 -1.197 343 HD3 ARG 42 HD1 ARG 42 0.935 -0.996 0.301 344 HE ARG 42 HE ARG 42 -0.188 -3.071 -1.102 345 HH11 ARG 42 HH11 ARG 42 2.403 -0.763 -1.638 346 HH12 ARG 42 HH12 ARG 42 3.243 -1.795 -2.769 347 HH21 ARG 42 HH21 ARG 42 0.927 -4.429 -2.548 348 HH22 ARG 42 HH22 ARG 42 2.412 -3.878 -3.263 349 H LEU 43 HN LEU 43 -4.459 -4.126 2.039 350 HA LEU 43 HA LEU 43 -3.883 -4.462 4.842 351 HB2 LEU 43 HB2 LEU 43 -5.839 -5.661 2.925 352 HB3 LEU 43 HB1 LEU 43 -5.550 -6.437 4.471 353 HG LEU 43 HG LEU 43 -6.398 -3.553 4.212 354 HD11 LEU 43 HD11 LEU 43 -8.112 -5.995 4.676 355 HD12 LEU 43 HD12 LEU 43 -8.128 -4.964 3.244 356 HD13 LEU 43 HD13 LEU 43 -8.654 -4.319 4.799 357 HD21 LEU 43 HD21 LEU 43 -7.025 -3.850 6.572 358 HD22 LEU 43 HD22 LEU 43 -5.302 -4.114 6.306 359 HD23 LEU 43 HD23 LEU 43 -6.382 -5.492 6.524 360 H ILE 44 HN ILE 44 -2.822 -6.070 5.818 361 HA ILE 44 HA ILE 44 -1.664 -8.198 4.150 362 HB ILE 44 HB ILE 44 -0.278 -6.276 5.965 363 HG12 ILE 44 HG12 ILE 44 1.550 -6.905 4.173 364 HG13 ILE 44 HG11 ILE 44 0.159 -7.497 3.276 365 HG21 ILE 44 HG21 ILE 44 0.155 -8.395 7.075 366 HG22 ILE 44 HG22 ILE 44 1.615 -7.804 6.282 367 HG23 ILE 44 HG23 ILE 44 0.679 -9.106 5.549 368 HD11 ILE 44 HD11 ILE 44 -0.864 -5.259 3.475 369 HD12 ILE 44 HD12 ILE 44 0.663 -5.257 2.594 370 HD13 ILE 44 HD13 ILE 44 0.609 -4.694 4.263 371 H PHE 45 HN PHE 45 -1.638 -10.189 5.041 372 HA PHE 45 HA PHE 45 -2.245 -10.501 7.886 373 HB2 PHE 45 HB2 PHE 45 -4.418 -10.685 6.752 374 HB3 PHE 45 HB1 PHE 45 -3.758 -11.901 5.666 375 HD1 PHE 45 HD1 PHE 45 -4.430 -11.236 9.261 376 HD2 PHE 45 HD2 PHE 45 -3.879 -14.150 6.212 377 HE1 PHE 45 HE1 PHE 45 -5.080 -13.001 10.840 378 HE2 PHE 45 HE2 PHE 45 -4.537 -15.925 7.787 379 HZ PHE 45 HZ PHE 45 -5.136 -15.350 10.108 380 H ALA 46 HN ALA 46 -0.793 -11.803 8.727 381 HA ALA 46 HA ALA 46 0.741 -13.435 9.034 382 HB1 ALA 46 HB1 ALA 46 0.591 -15.502 7.758 383 HB2 ALA 46 HB2 ALA 46 -0.476 -14.720 6.592 384 HB3 ALA 46 HB3 ALA 46 -1.010 -14.955 8.255 385 H GLY 47 HN GLY 47 1.225 -11.091 7.271 386 HA2 GLY 47 HA2 GLY 47 3.299 -10.342 6.467 387 HA3 GLY 47 HA1 GLY 47 3.799 -12.012 6.271 388 H LYS 48 HN LYS 48 0.793 -11.732 4.883 389 HA LYS 48 HA LYS 48 1.947 -10.988 2.279 390 HB2 LYS 48 HB2 LYS 48 0.207 -13.349 2.967 391 HB3 LYS 48 HB1 LYS 48 0.286 -12.719 1.326 392 HG2 LYS 48 HG2 LYS 48 2.724 -13.097 1.332 393 HG3 LYS 48 HG1 LYS 48 2.585 -13.803 2.944 394 HD2 LYS 48 HD2 LYS 48 0.989 -14.848 0.625 395 HD3 LYS 48 HD1 LYS 48 2.638 -15.396 0.929 396 HE2 LYS 48 HE2 LYS 48 1.978 -16.094 3.184 397 HE3 LYS 48 HE1 LYS 48 0.328 -15.566 2.863 398 HZ1 LYS 48 HZ1 LYS 48 1.773 -17.700 1.385 399 HZ2 LYS 48 HZ2 LYS 48 0.184 -17.198 1.093 400 HZ3 LYS 48 HZ3 LYS 48 0.581 -17.946 2.559 401 H GLN 49 HN GLN 49 0.536 -10.038 0.778 402 HA GLN 49 HA GLN 49 -1.454 -8.353 1.942 403 HB2 GLN 49 HB2 GLN 49 -0.201 -8.678 -0.725 404 HB3 GLN 49 HB1 GLN 49 -1.800 -7.948 -0.694 405 HG2 GLN 49 HG2 GLN 49 -0.311 -6.700 1.334 406 HG3 GLN 49 HG1 GLN 49 0.727 -6.775 -0.090 407 HE21 GLN 49 HE21 GLN 49 -2.428 -5.773 1.073 408 HE22 GLN 49 HE22 GLN 49 -2.679 -4.538 -0.115 409 H LEU 50 HN LEU 50 -3.641 -8.156 1.228 410 HA LEU 50 HA LEU 50 -4.848 -10.754 0.537 411 HB2 LEU 50 HB2 LEU 50 -6.221 -8.463 1.931 412 HB3 LEU 50 HB1 LEU 50 -6.769 -10.121 1.797 413 HG LEU 50 HG LEU 50 -4.360 -9.244 3.393 414 HD11 LEU 50 HD11 LEU 50 -7.086 -10.070 4.378 415 HD12 LEU 50 HD12 LEU 50 -6.528 -8.401 4.271 416 HD13 LEU 50 HD13 LEU 50 -5.714 -9.534 5.350 417 HD21 LEU 50 HD21 LEU 50 -5.254 -11.681 4.315 418 HD22 LEU 50 HD22 LEU 50 -3.844 -11.406 3.292 419 HD23 LEU 50 HD23 LEU 50 -5.393 -11.827 2.563 420 H GLU 51 HN GLU 51 -6.462 -10.825 -1.030 421 HA GLU 51 HA GLU 51 -6.503 -8.556 -2.860 422 HB2 GLU 51 HB2 GLU 51 -7.243 -11.443 -3.047 423 HB3 GLU 51 HB1 GLU 51 -7.969 -10.311 -4.178 424 HG2 GLU 51 HG2 GLU 51 -5.536 -9.558 -4.615 425 HG3 GLU 51 HG1 GLU 51 -5.103 -11.092 -3.861 426 H ASP 52 HN ASP 52 -8.277 -7.365 -3.356 427 HA ASP 52 HA ASP 52 -10.279 -7.029 -1.420 428 HB2 ASP 52 HB2 ASP 52 -10.062 -6.036 -4.260 429 HB3 ASP 52 HB1 ASP 52 -11.360 -5.556 -3.174 430 H GLY 53 HN GLY 53 -10.226 -8.889 -4.395 431 HA2 GLY 53 HA2 GLY 53 -13.085 -9.358 -4.333 432 HA3 GLY 53 HA1 GLY 53 -11.945 -10.003 -5.498 433 H ARG 54 HN ARG 54 -11.086 -10.459 -2.201 434 HA ARG 54 HA ARG 54 -12.079 -13.233 -2.354 435 HB2 ARG 54 HB2 ARG 54 -9.550 -12.244 -1.022 436 HB3 ARG 54 HB1 ARG 54 -10.121 -13.906 -1.023 437 HG2 ARG 54 HG2 ARG 54 -9.205 -12.307 -3.403 438 HG3 ARG 54 HG1 ARG 54 -8.366 -13.657 -2.640 439 HD2 ARG 54 HD2 ARG 54 -10.179 -15.158 -3.286 440 HD3 ARG 54 HD1 ARG 54 -11.043 -13.808 -4.017 441 HE ARG 54 HE ARG 54 -8.366 -14.494 -4.994 442 HH11 ARG 54 HH11 ARG 54 -11.822 -14.329 -5.542 443 HH12 ARG 54 HH12 ARG 54 -11.683 -14.512 -7.262 444 HH21 ARG 54 HH21 ARG 54 -8.177 -14.747 -7.241 445 HH22 ARG 54 HH22 ARG 54 -9.602 -14.749 -8.232 446 H THR 55 HN THR 55 -12.280 -14.262 -0.139 447 HA THR 55 HA THR 55 -13.481 -12.284 1.679 448 HB THR 55 HB THR 55 -14.741 -14.239 2.633 449 HG1 THR 55 HG1 THR 55 -13.318 -15.542 0.574 450 HG21 THR 55 HG21 THR 55 -15.149 -13.609 -0.286 451 HG22 THR 55 HG22 THR 55 -15.815 -12.725 1.088 452 HG23 THR 55 HG23 THR 55 -16.341 -14.377 0.763 453 H LEU 56 HN LEU 56 -13.472 -13.015 4.031 454 HA LEU 56 HA LEU 56 -10.823 -13.197 4.939 455 HB2 LEU 56 HB2 LEU 56 -13.379 -13.828 6.422 456 HB3 LEU 56 HB1 LEU 56 -11.821 -13.540 7.168 457 HG LEU 56 HG LEU 56 -13.506 -11.534 5.669 458 HD11 LEU 56 HD11 LEU 56 -12.628 -11.674 8.550 459 HD12 LEU 56 HD12 LEU 56 -14.251 -11.999 7.940 460 HD13 LEU 56 HD13 LEU 56 -13.569 -10.377 7.813 461 HD21 LEU 56 HD21 LEU 56 -11.765 -9.902 6.254 462 HD22 LEU 56 HD22 LEU 56 -11.179 -11.139 5.143 463 HD23 LEU 56 HD23 LEU 56 -10.752 -11.215 6.852 464 H SER 57 HN SER 57 -13.251 -15.633 4.330 465 HA SER 57 HA SER 57 -12.057 -17.800 5.662 466 HB2 SER 57 HB2 SER 57 -13.456 -18.868 3.504 467 HB3 SER 57 HB1 SER 57 -14.102 -18.537 5.111 468 HG SER 57 HG SER 57 -14.290 -16.991 2.760 469 H ASP 58 HN ASP 58 -11.388 -16.324 2.582 470 HA ASP 58 HA ASP 58 -10.083 -18.528 1.363 471 HB2 ASP 58 HB2 ASP 58 -9.984 -15.558 0.855 472 HB3 ASP 58 HB1 ASP 58 -9.021 -16.699 -0.078 473 H TYR 59 HN TYR 59 -9.123 -16.312 3.794 474 HA TYR 59 HA TYR 59 -6.334 -17.214 3.523 475 HB2 TYR 59 HB2 TYR 59 -7.362 -14.668 4.795 476 HB3 TYR 59 HB1 TYR 59 -5.672 -15.151 4.683 477 HD1 TYR 59 HD1 TYR 59 -4.587 -15.287 2.427 478 HD2 TYR 59 HD2 TYR 59 -8.457 -13.607 2.984 479 HE1 TYR 59 HE1 TYR 59 -4.411 -14.176 0.240 480 HE2 TYR 59 HE2 TYR 59 -8.293 -12.492 0.800 481 HH TYR 59 HH TYR 59 -5.854 -13.246 -1.477 482 H ASN 60 HN ASN 60 -8.907 -18.126 5.024 483 HA ASN 60 HA ASN 60 -9.443 -19.188 6.952 484 HB2 ASN 60 HB2 ASN 60 -6.440 -19.393 7.057 485 HB3 ASN 60 HB1 ASN 60 -7.469 -20.112 8.290 486 HD21 ASN 60 HD21 ASN 60 -5.675 -21.409 6.446 487 HD22 ASN 60 HD22 ASN 60 -6.637 -22.506 5.516 488 H ILE 61 HN ILE 61 -9.364 -16.340 7.045 489 HA ILE 61 HA ILE 61 -8.162 -15.558 9.542 490 HB ILE 61 HB ILE 61 -10.124 -14.072 7.792 491 HG12 ILE 61 HG12 ILE 61 -7.121 -13.782 8.030 492 HG13 ILE 61 HG11 ILE 61 -7.948 -14.612 6.718 493 HG21 ILE 61 HG21 ILE 61 -9.442 -12.078 9.027 494 HG22 ILE 61 HG22 ILE 61 -8.405 -13.064 10.055 495 HG23 ILE 61 HG23 ILE 61 -10.153 -13.279 10.108 496 HD11 ILE 61 HD11 ILE 61 -8.201 -11.691 7.395 497 HD12 ILE 61 HD12 ILE 61 -9.028 -12.521 6.076 498 HD13 ILE 61 HD13 ILE 61 -7.270 -12.378 6.064 499 H GLN 62 HN GLN 62 -8.981 -16.217 11.384 500 HA GLN 62 HA GLN 62 -11.871 -16.642 11.640 501 HB2 GLN 62 HB2 GLN 62 -9.578 -17.518 13.411 502 HB3 GLN 62 HB1 GLN 62 -11.271 -17.905 13.685 503 HG2 GLN 62 HG2 GLN 62 -11.314 -19.491 12.074 504 HG3 GLN 62 HG1 GLN 62 -10.143 -18.653 11.058 505 HE21 GLN 62 HE21 GLN 62 -7.996 -19.075 11.283 506 HE22 GLN 62 HE22 GLN 62 -7.367 -20.318 12.310 507 H LYS 63 HN LYS 63 -12.118 -16.416 14.385 508 HA LYS 63 HA LYS 63 -12.258 -13.571 14.678 509 HB2 LYS 63 HB2 LYS 63 -13.150 -14.146 16.969 510 HB3 LYS 63 HB1 LYS 63 -14.055 -14.810 15.617 511 HG2 LYS 63 HG2 LYS 63 -12.932 -16.970 15.948 512 HG3 LYS 63 HG1 LYS 63 -12.081 -16.293 17.337 513 HD2 LYS 63 HD2 LYS 63 -13.860 -16.520 18.673 514 HD3 LYS 63 HD1 LYS 63 -14.963 -15.882 17.454 515 HE2 LYS 63 HE2 LYS 63 -14.758 -18.136 16.303 516 HE3 LYS 63 HE1 LYS 63 -13.969 -18.697 17.773 517 HZ1 LYS 63 HZ1 LYS 63 -15.999 -17.940 18.986 518 HZ2 LYS 63 HZ2 LYS 63 -16.244 -19.245 17.942 519 HZ3 LYS 63 HZ3 LYS 63 -16.740 -17.698 17.487 520 H GLU 64 HN GLU 64 -11.252 -12.292 16.247 521 HA GLU 64 HA GLU 64 -9.605 -11.518 17.587 522 HB2 GLU 64 HB2 GLU 64 -9.118 -14.447 18.118 523 HB3 GLU 64 HB1 GLU 64 -8.265 -13.150 18.942 524 HG2 GLU 64 HG2 GLU 64 -10.462 -12.305 19.750 525 HG3 GLU 64 HG1 GLU 64 -11.216 -13.739 19.047 526 H SER 65 HN SER 65 -9.141 -12.659 14.703 527 HA SER 65 HA SER 65 -6.328 -13.153 14.626 528 HB2 SER 65 HB2 SER 65 -8.200 -12.389 12.369 529 HB3 SER 65 HB1 SER 65 -6.579 -13.064 12.195 530 HG SER 65 HG SER 65 -8.964 -14.301 12.840 531 H THR 66 HN THR 66 -4.683 -11.798 13.968 532 HA THR 66 HA THR 66 -5.257 -8.945 14.264 533 HB THR 66 HB THR 66 -2.465 -9.961 14.055 534 HG1 THR 66 HG1 THR 66 -4.221 -10.428 16.251 535 HG21 THR 66 HG21 THR 66 -2.891 -7.580 14.390 536 HG22 THR 66 HG22 THR 66 -2.098 -8.272 15.806 537 HG23 THR 66 HG23 THR 66 -3.830 -7.939 15.839 538 H LEU 67 HN LEU 67 -5.458 -7.768 12.502 539 HA LEU 67 HA LEU 67 -4.137 -8.652 10.024 540 HB2 LEU 67 HB2 LEU 67 -6.691 -7.232 10.597 541 HB3 LEU 67 HB1 LEU 67 -5.833 -6.781 9.137 542 HG LEU 67 HG LEU 67 -5.861 -9.256 8.522 543 HD11 LEU 67 HD11 LEU 67 -7.948 -9.320 10.696 544 HD12 LEU 67 HD12 LEU 67 -6.375 -10.117 10.756 545 HD13 LEU 67 HD13 LEU 67 -7.577 -10.621 9.567 546 HD21 LEU 67 HD21 LEU 67 -7.294 -7.635 7.428 547 HD22 LEU 67 HD22 LEU 67 -8.464 -7.748 8.743 548 HD23 LEU 67 HD23 LEU 67 -8.176 -9.138 7.698 549 H HIS 68 HN HIS 68 -2.997 -7.120 8.772 550 HA HIS 68 HA HIS 68 -2.175 -4.750 10.312 551 HB2 HIS 68 HB2 HIS 68 -0.634 -6.351 8.260 552 HB3 HIS 68 HB1 HIS 68 -0.044 -4.890 9.047 553 HD2 HIS 68 HD2 HIS 68 0.107 -5.227 11.971 554 HE1 HIS 68 HE1 HIS 68 0.893 -9.354 11.486 555 HE2 HIS 68 HE2 HIS 68 1.211 -7.342 12.991 556 H LEU 69 HN LEU 69 -2.686 -2.837 9.503 557 HA LEU 69 HA LEU 69 -3.542 -2.688 6.699 558 HB2 LEU 69 HB2 LEU 69 -5.177 -1.907 8.321 559 HB3 LEU 69 HB1 LEU 69 -4.004 -0.801 9.009 560 HG LEU 69 HG LEU 69 -3.958 0.420 6.825 561 HD11 LEU 69 HD11 LEU 69 -5.844 0.014 5.273 562 HD12 LEU 69 HD12 LEU 69 -6.227 -1.450 6.179 563 HD13 LEU 69 HD13 LEU 69 -4.685 -1.315 5.333 564 HD21 LEU 69 HD21 LEU 69 -6.620 0.177 8.217 565 HD22 LEU 69 HD22 LEU 69 -6.162 1.490 7.133 566 HD23 LEU 69 HD23 LEU 69 -5.296 1.259 8.652 567 H VAL 70 HN VAL 70 -1.840 -2.296 5.461 568 HA VAL 70 HA VAL 70 0.193 -0.390 6.335 569 HB VAL 70 HB VAL 70 0.105 -2.331 4.018 570 HG11 VAL 70 HG11 VAL 70 2.207 -0.305 4.744 571 HG12 VAL 70 HG12 VAL 70 1.322 -0.445 3.226 572 HG13 VAL 70 HG13 VAL 70 2.502 -1.677 3.677 573 HG21 VAL 70 HG21 VAL 70 0.474 -3.368 6.180 574 HG22 VAL 70 HG22 VAL 70 1.788 -2.240 6.518 575 HG23 VAL 70 HG23 VAL 70 1.951 -3.421 5.218 576 H LEU 71 HN LEU 71 0.504 1.551 5.385 577 HA LEU 71 HA LEU 71 -1.544 2.462 3.529 578 HB2 LEU 71 HB2 LEU 71 0.604 3.986 5.009 579 HB3 LEU 71 HB1 LEU 71 -0.631 4.710 3.998 580 HG LEU 71 HG LEU 71 -1.188 3.135 6.509 581 HD11 LEU 71 HD11 LEU 71 -1.188 6.111 6.036 582 HD12 LEU 71 HD12 LEU 71 -0.036 5.213 7.022 583 HD13 LEU 71 HD13 LEU 71 -1.728 5.302 7.508 584 HD21 LEU 71 HD21 LEU 71 -3.447 4.064 6.277 585 HD22 LEU 71 HD22 LEU 71 -3.015 3.036 4.911 586 HD23 LEU 71 HD23 LEU 71 -2.983 4.791 4.739 587 H ARG 72 HN ARG 72 -0.935 3.732 1.647 588 HA ARG 72 HA ARG 72 1.715 3.015 0.593 589 HB2 ARG 72 HB2 ARG 72 0.181 1.526 -0.480 590 HB3 ARG 72 HB1 ARG 72 -0.956 2.827 -0.803 591 HG2 ARG 72 HG2 ARG 72 0.589 3.822 -2.384 592 HG3 ARG 72 HG1 ARG 72 1.786 2.576 -2.025 593 HD2 ARG 72 HD2 ARG 72 -0.727 1.371 -2.709 594 HD3 ARG 72 HD1 ARG 72 -0.237 2.505 -3.965 595 HE ARG 72 HE ARG 72 1.915 0.802 -3.170 596 HH11 ARG 72 HH11 ARG 72 -1.001 0.937 -5.103 597 HH12 ARG 72 HH12 ARG 72 -0.469 -0.259 -6.241 598 HH21 ARG 72 HH21 ARG 72 2.625 -0.810 -4.678 599 HH22 ARG 72 HH22 ARG 72 1.577 -1.243 -5.995 600 H LEU 73 HN LEU 73 2.831 4.624 -0.233 601 HA LEU 73 HA LEU 73 1.426 7.076 -1.022 602 HB2 LEU 73 HB2 LEU 73 3.702 6.733 0.872 603 HB3 LEU 73 HB1 LEU 73 3.694 8.150 -0.160 604 HG LEU 73 HG LEU 73 1.302 8.540 0.763 605 HD11 LEU 73 HD11 LEU 73 2.361 6.435 2.596 606 HD12 LEU 73 HD12 LEU 73 0.743 6.630 1.917 607 HD13 LEU 73 HD13 LEU 73 1.288 7.693 3.214 608 HD21 LEU 73 HD21 LEU 73 3.232 9.959 1.245 609 HD22 LEU 73 HD22 LEU 73 3.707 8.871 2.550 610 HD23 LEU 73 HD23 LEU 73 2.195 9.773 2.659 611 H ARG 74 HN ARG 74 2.837 8.462 -2.423 612 HA ARG 74 HA ARG 74 4.661 6.803 -4.035 613 HB2 ARG 74 HB2 ARG 74 2.730 8.902 -5.043 614 HB3 ARG 74 HB1 ARG 74 3.879 8.015 -6.033 615 HG2 ARG 74 HG2 ARG 74 1.766 6.607 -4.433 616 HG3 ARG 74 HG1 ARG 74 1.447 7.246 -6.045 617 HD2 ARG 74 HD2 ARG 74 2.075 5.127 -6.603 618 HD3 ARG 74 HD1 ARG 74 3.652 5.910 -6.624 619 HE ARG 74 HE ARG 74 3.518 5.027 -4.091 620 HH11 ARG 74 HH11 ARG 74 2.829 3.416 -7.138 621 HH12 ARG 74 HH12 ARG 74 3.318 1.855 -6.564 622 HH21 ARG 74 HH21 ARG 74 4.155 2.948 -3.336 623 HH22 ARG 74 HH22 ARG 74 4.094 1.595 -4.435 624 H GLY 75 HN GLY 75 3.819 9.968 -2.803 625 HA2 GLY 75 HA2 GLY 75 6.262 11.168 -3.798 626 HA3 GLY 75 HA1 GLY 75 5.016 11.964 -2.847 627 H GLY 76 HN GLY 76 8.125 11.011 -2.783 628 HA2 GLY 76 HA2 GLY 76 8.333 11.344 0.066 629 HA3 GLY 76 HA1 GLY 76 8.710 9.710 -0.471 630 H1 SER 453 HT1 SER 453 21.254 9.863 16.292 631 H2 SER 453 HT2 SER 453 21.645 10.873 17.590 632 H3 SER 453 HT3 SER 453 20.161 11.046 16.808 633 HA SER 453 HA SER 453 21.060 8.846 18.542 634 HB2 SER 453 HB2 SER 453 18.613 9.570 19.421 635 HB3 SER 453 HB1 SER 453 20.101 10.337 19.981 636 HG SER 453 HG SER 453 19.019 12.057 19.328 637 H ASN 454 HN ASN 454 18.594 9.896 16.217 638 HA ASN 454 HA ASN 454 17.114 8.768 14.923 639 HB2 ASN 454 HB2 ASN 454 19.236 6.670 15.306 640 HB3 ASN 454 HB1 ASN 454 17.774 6.322 14.387 641 HD21 ASN 454 HD21 ASN 454 19.017 6.019 12.520 642 HD22 ASN 454 HD22 ASN 454 19.665 7.354 11.635 643 H SER 455 HN SER 455 16.730 8.831 17.814 644 HA SER 455 HA SER 455 15.804 6.398 18.837 645 HB2 SER 455 HB2 SER 455 14.542 8.986 19.645 646 HB3 SER 455 HB1 SER 455 15.083 7.640 20.653 647 HG SER 455 HG SER 455 16.424 9.617 20.659 648 H GLN 456 HN GLN 456 13.944 9.084 17.374 649 HA GLN 456 HA GLN 456 11.459 7.752 17.479 650 HB2 GLN 456 HB2 GLN 456 12.468 10.047 15.816 651 HB3 GLN 456 HB1 GLN 456 10.832 9.430 15.649 652 HG2 GLN 456 HG2 GLN 456 12.052 10.559 18.156 653 HG3 GLN 456 HG1 GLN 456 10.891 11.368 17.107 654 HE21 GLN 456 HE21 GLN 456 10.650 10.783 19.914 655 HE22 GLN 456 HE22 GLN 456 9.264 9.765 20.099 656 H LEU 457 HN LEU 457 13.976 7.898 15.023 657 HA LEU 457 HA LEU 457 12.562 6.617 12.956 658 HB2 LEU 457 HB2 LEU 457 15.530 6.668 13.508 659 HB3 LEU 457 HB1 LEU 457 14.802 6.114 12.015 660 HG LEU 457 HG LEU 457 14.634 8.930 13.094 661 HD11 LEU 457 HD11 LEU 457 16.096 9.490 11.215 662 HD12 LEU 457 HD12 LEU 457 16.222 7.779 10.807 663 HD13 LEU 457 HD13 LEU 457 16.873 8.372 12.336 664 HD21 LEU 457 HD21 LEU 457 12.655 8.333 11.807 665 HD22 LEU 457 HD22 LEU 457 13.672 7.753 10.489 666 HD23 LEU 457 HD23 LEU 457 13.667 9.464 10.907 667 H ASN 458 HN ASN 458 14.617 5.337 15.551 668 HA ASN 458 HA ASN 458 14.497 2.638 14.686 669 HB2 ASN 458 HB2 ASN 458 16.183 3.553 16.308 670 HB3 ASN 458 HB1 ASN 458 14.909 3.608 17.523 671 HD21 ASN 458 HD21 ASN 458 14.257 1.733 18.506 672 HD22 ASN 458 HD22 ASN 458 15.021 0.205 18.248 673 H ALA 459 HN ALA 459 12.521 4.580 16.869 674 HA ALA 459 HA ALA 459 10.868 2.479 17.799 675 HB1 ALA 459 HB1 ALA 459 11.054 4.689 18.900 676 HB2 ALA 459 HB2 ALA 459 9.382 4.227 18.578 677 HB3 ALA 459 HB3 ALA 459 10.186 5.410 17.545 678 H MET 460 HN MET 460 10.737 4.648 15.038 679 HA MET 460 HA MET 460 8.158 3.924 14.122 680 HB2 MET 460 HB2 MET 460 10.551 5.208 12.839 681 HB3 MET 460 HB1 MET 460 9.159 4.758 11.867 682 HG2 MET 460 HG2 MET 460 7.753 6.138 13.421 683 HG3 MET 460 HG1 MET 460 9.255 6.717 14.141 684 HE1 MET 460 HE1 MET 460 8.468 9.319 13.516 685 HE2 MET 460 HE2 MET 460 6.995 8.524 12.959 686 HE3 MET 460 HE3 MET 460 7.815 9.689 11.919 687 H ALA 461 HN ALA 461 11.417 2.788 13.329 688 HA ALA 461 HA ALA 461 10.713 0.921 11.359 689 HB1 ALA 461 HB1 ALA 461 13.022 0.837 13.298 690 HB2 ALA 461 HB2 ALA 461 13.015 1.640 11.728 691 HB3 ALA 461 HB3 ALA 461 12.886 -0.118 11.822 692 H HIS 462 HN HIS 462 10.951 0.652 14.865 693 HA HIS 462 HA HIS 462 10.515 -2.102 15.115 694 HB2 HIS 462 HB2 HIS 462 11.208 -0.372 16.908 695 HB3 HIS 462 HB1 HIS 462 9.482 -0.081 17.098 696 HD2 HIS 462 HD2 HIS 462 8.009 -2.287 18.117 697 HE1 HIS 462 HE1 HIS 462 11.475 -4.268 19.513 698 HE2 HIS 462 HE2 HIS 462 8.959 -4.075 19.736 699 H GLN 463 HN GLN 463 8.290 0.584 14.708 700 HA GLN 463 HA GLN 463 5.914 -0.850 15.279 701 HB2 GLN 463 HB2 GLN 463 6.140 1.648 15.226 702 HB3 GLN 463 HB1 GLN 463 6.210 1.555 13.473 703 HG2 GLN 463 HG2 GLN 463 3.982 2.160 14.352 704 HG3 GLN 463 HG1 GLN 463 3.975 0.695 13.370 705 HE21 GLN 463 HE21 GLN 463 3.602 -1.288 14.349 706 HE22 GLN 463 HE22 GLN 463 2.955 -1.416 15.948 707 H ILE 464 HN ILE 464 7.854 -0.423 12.394 708 HA ILE 464 HA ILE 464 5.946 -1.559 10.589 709 HB ILE 464 HB ILE 464 8.937 -1.244 10.261 710 HG12 ILE 464 HG12 ILE 464 6.686 0.517 9.268 711 HG13 ILE 464 HG11 ILE 464 7.706 0.883 10.655 712 HG21 ILE 464 HG21 ILE 464 8.508 -1.451 7.869 713 HG22 ILE 464 HG22 ILE 464 6.795 -1.717 8.192 714 HG23 ILE 464 HG23 ILE 464 7.987 -2.900 8.730 715 HD11 ILE 464 HD11 ILE 464 8.366 2.079 8.607 716 HD12 ILE 464 HD12 ILE 464 8.704 0.528 7.841 717 HD13 ILE 464 HD13 ILE 464 9.646 1.045 9.241 718 H GLN 465 HN GLN 465 8.649 -2.739 12.493 719 HA GLN 465 HA GLN 465 8.810 -5.341 11.434 720 HB2 GLN 465 HB2 GLN 465 10.365 -4.057 13.118 721 HB3 GLN 465 HB1 GLN 465 9.336 -4.796 14.335 722 HG2 GLN 465 HG2 GLN 465 11.198 -6.212 14.093 723 HG3 GLN 465 HG1 GLN 465 9.856 -7.014 13.281 724 HE21 GLN 465 HE21 GLN 465 11.249 -8.247 12.005 725 HE22 GLN 465 HE22 GLN 465 12.133 -7.560 10.684 726 H GLU 466 HN GLU 466 6.629 -3.831 13.640 727 HA GLU 466 HA GLU 466 5.513 -6.168 14.809 728 HB2 GLU 466 HB2 GLU 466 4.843 -3.279 14.674 729 HB3 GLU 466 HB1 GLU 466 3.513 -4.374 15.018 730 HG2 GLU 466 HG2 GLU 466 5.791 -5.025 16.642 731 HG3 GLU 466 HG1 GLU 466 5.355 -3.324 16.820 732 H MET 467 HN MET 467 5.123 -4.562 11.803 733 HA MET 467 HA MET 467 2.604 -5.918 11.197 734 HB2 MET 467 HB2 MET 467 4.109 -4.060 9.361 735 HB3 MET 467 HB1 MET 467 2.393 -4.445 9.358 736 HG2 MET 467 HG2 MET 467 3.565 -3.101 11.741 737 HG3 MET 467 HG1 MET 467 3.272 -2.160 10.280 738 HE1 MET 467 HE1 MET 467 0.894 -2.960 8.933 739 HE2 MET 467 HE2 MET 467 0.844 -1.305 9.542 740 HE3 MET 467 HE3 MET 467 -0.537 -2.375 9.784 741 H PHE 468 HN PHE 468 5.893 -5.548 9.887 742 HA PHE 468 HA PHE 468 5.503 -8.080 8.431 743 HB2 PHE 468 HB2 PHE 468 6.914 -5.557 7.719 744 HB3 PHE 468 HB1 PHE 468 7.622 -7.069 7.164 745 HD1 PHE 468 HD2 PHE 468 5.474 -8.722 6.350 746 HD2 PHE 468 HD1 PHE 468 5.817 -4.491 6.025 747 HE1 PHE 468 HE2 PHE 468 3.921 -8.751 4.445 748 HE2 PHE 468 HE1 PHE 468 4.266 -4.513 4.114 749 HZ PHE 468 HZ PHE 468 3.319 -6.643 3.324 750 HA PRO 469 HA PRO 469 8.697 -9.145 11.454 751 HB2 PRO 469 HB2 PRO 469 8.030 -11.747 11.698 752 HB3 PRO 469 HB1 PRO 469 7.100 -10.464 12.490 753 HG2 PRO 469 HG2 PRO 469 6.458 -12.016 10.053 754 HG3 PRO 469 HG1 PRO 469 5.387 -11.410 11.326 755 HD2 PRO 469 HD2 PRO 469 5.751 -10.214 8.852 756 HD3 PRO 469 HD1 PRO 469 5.090 -9.421 10.294 757 H GLN 470 HN GLN 470 8.183 -10.098 8.234 758 HA GLN 470 HA GLN 470 10.527 -11.842 8.210 759 HB2 GLN 470 HB2 GLN 470 9.821 -12.661 6.134 760 HB3 GLN 470 HB1 GLN 470 8.336 -12.449 7.044 761 HG2 GLN 470 HG2 GLN 470 9.063 -10.108 5.476 762 HG3 GLN 470 HG1 GLN 470 8.815 -11.553 4.500 763 HE21 GLN 470 HE21 GLN 470 6.936 -10.941 3.558 764 HE22 GLN 470 HE22 GLN 470 5.452 -10.736 4.424 765 H VAL 471 HN VAL 471 10.313 -8.693 8.257 766 HA VAL 471 HA VAL 471 12.100 -8.229 5.969 767 HB VAL 471 HB VAL 471 10.066 -6.798 6.108 768 HG11 VAL 471 HG11 VAL 471 9.959 -5.004 7.760 769 HG12 VAL 471 HG12 VAL 471 11.386 -5.660 8.566 770 HG13 VAL 471 HG13 VAL 471 9.889 -6.594 8.525 771 HG21 VAL 471 HG21 VAL 471 11.937 -5.992 4.856 772 HG22 VAL 471 HG22 VAL 471 12.732 -5.419 6.324 773 HG23 VAL 471 HG23 VAL 471 11.253 -4.641 5.761 774 HA PRO 472 HA PRO 472 15.537 -8.005 8.785 775 HB2 PRO 472 HB2 PRO 472 16.788 -6.306 6.706 776 HB3 PRO 472 HB1 PRO 472 17.342 -7.848 7.382 777 HG2 PRO 472 HG2 PRO 472 16.387 -7.709 4.917 778 HG3 PRO 472 HG1 PRO 472 16.043 -9.100 5.963 779 HD2 PRO 472 HD2 PRO 472 14.284 -6.781 5.279 780 HD3 PRO 472 HD1 PRO 472 13.878 -8.504 5.413 781 H TYR 473 HN TYR 473 15.549 -6.735 10.496 782 HA TYR 473 HA TYR 473 14.429 -4.212 10.736 783 HB2 TYR 473 HB2 TYR 473 15.135 -5.920 12.538 784 HB3 TYR 473 HB1 TYR 473 16.705 -5.131 12.472 785 HD1 TYR 473 HD2 TYR 473 13.115 -4.565 13.186 786 HD2 TYR 473 HD1 TYR 473 17.085 -3.092 13.608 787 HE1 TYR 473 HE2 TYR 473 12.316 -2.886 14.795 788 HE2 TYR 473 HE1 TYR 473 16.298 -1.413 15.222 789 HH TYR 473 HH TYR 473 14.231 -0.254 15.816 790 H HIS 474 HN HIS 474 17.825 -5.074 10.171 791 HA HIS 474 HA HIS 474 18.842 -2.447 10.395 792 HB2 HIS 474 HB2 HIS 474 20.829 -3.364 9.150 793 HB3 HIS 474 HB1 HIS 474 20.389 -4.243 10.606 794 HD2 HIS 474 HD2 HIS 474 20.738 -4.787 6.808 795 HE1 HIS 474 HE1 HIS 474 19.477 -8.413 8.589 796 HE2 HIS 474 HE2 HIS 474 20.160 -7.291 6.423 797 H LEU 475 HN LEU 475 17.159 -4.041 7.833 798 HA LEU 475 HA LEU 475 18.080 -2.143 5.838 799 HB2 LEU 475 HB2 LEU 475 16.143 -4.447 5.745 800 HB3 LEU 475 HB1 LEU 475 16.339 -3.339 4.399 801 HG LEU 475 HG LEU 475 18.380 -5.245 5.534 802 HD11 LEU 475 HD11 LEU 475 16.664 -6.054 3.891 803 HD12 LEU 475 HD12 LEU 475 18.343 -6.256 3.393 804 HD13 LEU 475 HD13 LEU 475 17.374 -4.948 2.714 805 HD21 LEU 475 HD21 LEU 475 19.618 -3.265 5.125 806 HD22 LEU 475 HD22 LEU 475 18.775 -2.968 3.604 807 HD23 LEU 475 HD23 LEU 475 19.885 -4.330 3.745 808 H VAL 476 HN VAL 476 15.349 -2.662 7.942 809 HA VAL 476 HA VAL 476 13.551 -0.848 6.712 810 HB VAL 476 HB VAL 476 13.712 -1.552 9.655 811 HG11 VAL 476 HG11 VAL 476 11.310 -1.021 9.650 812 HG12 VAL 476 HG12 VAL 476 11.441 -0.514 7.964 813 HG13 VAL 476 HG13 VAL 476 12.304 0.371 9.223 814 HG21 VAL 476 HG21 VAL 476 12.161 -2.914 7.455 815 HG22 VAL 476 HG22 VAL 476 12.075 -3.297 9.174 816 HG23 VAL 476 HG23 VAL 476 13.571 -3.572 8.281 817 H LEU 477 HN LEU 477 16.044 -0.539 9.177 818 HA LEU 477 HA LEU 477 15.603 2.171 9.828 819 HB2 LEU 477 HB2 LEU 477 18.044 0.416 10.046 820 HB3 LEU 477 HB1 LEU 477 18.004 2.067 10.633 821 HG LEU 477 HG LEU 477 16.103 -0.062 11.600 822 HD11 LEU 477 HD11 LEU 477 17.535 -0.226 13.574 823 HD12 LEU 477 HD12 LEU 477 18.708 0.850 12.814 824 HD13 LEU 477 HD13 LEU 477 18.383 -0.739 12.116 825 HD21 LEU 477 HD21 LEU 477 15.323 2.202 11.954 826 HD22 LEU 477 HD22 LEU 477 16.872 2.653 12.669 827 HD23 LEU 477 HD23 LEU 477 15.825 1.494 13.490 828 H GLN 478 HN GLN 478 16.950 0.676 7.082 829 HA GLN 478 HA GLN 478 18.655 2.849 6.286 830 HB2 GLN 478 HB2 GLN 478 19.196 0.609 5.543 831 HB3 GLN 478 HB1 GLN 478 17.618 0.440 4.785 832 HG2 GLN 478 HG2 GLN 478 18.285 2.404 3.313 833 HG3 GLN 478 HG1 GLN 478 19.920 2.167 3.931 834 HE21 GLN 478 HE21 GLN 478 17.641 -0.431 3.322 835 HE22 GLN 478 HE22 GLN 478 18.517 -1.137 2.009 836 H ASP 479 HN ASP 479 15.537 1.552 5.129 837 HA ASP 479 HA ASP 479 15.068 3.562 3.219 838 HB2 ASP 479 HB2 ASP 479 13.869 1.385 3.282 839 HB3 ASP 479 HB1 ASP 479 13.010 1.932 4.717 840 H LEU 480 HN LEU 480 14.354 3.351 6.645 841 HA LEU 480 HA LEU 480 12.617 5.527 6.880 842 HB2 LEU 480 HB2 LEU 480 14.154 3.837 8.650 843 HB3 LEU 480 HB1 LEU 480 14.176 5.496 9.210 844 HG LEU 480 HG LEU 480 12.379 4.329 10.298 845 HD11 LEU 480 HD11 LEU 480 11.147 6.064 8.169 846 HD12 LEU 480 HD12 LEU 480 12.011 6.689 9.572 847 HD13 LEU 480 HD13 LEU 480 10.535 5.749 9.790 848 HD21 LEU 480 HD21 LEU 480 12.055 2.520 8.723 849 HD22 LEU 480 HD22 LEU 480 11.407 3.644 7.528 850 HD23 LEU 480 HD23 LEU 480 10.524 3.340 9.023 851 H GLN 481 HN GLN 481 15.977 5.446 6.212 852 HA GLN 481 HA GLN 481 16.429 8.180 7.100 853 HB2 GLN 481 HB2 GLN 481 18.261 6.236 5.687 854 HB3 GLN 481 HB1 GLN 481 18.735 7.822 6.277 855 HG2 GLN 481 HG2 GLN 481 18.289 7.133 8.560 856 HG3 GLN 481 HG1 GLN 481 17.735 5.559 7.993 857 HE21 GLN 481 HE21 GLN 481 19.259 4.366 9.046 858 HE22 GLN 481 HE22 GLN 481 20.941 4.398 8.643 859 H LEU 482 HN LEU 482 15.417 6.538 4.299 860 HA LEU 482 HA LEU 482 16.223 8.748 2.551 861 HB2 LEU 482 HB2 LEU 482 15.349 5.928 2.036 862 HB3 LEU 482 HB1 LEU 482 15.208 7.133 0.773 863 HG LEU 482 HG LEU 482 17.234 5.986 0.375 864 HD11 LEU 482 HD11 LEU 482 17.317 8.473 0.218 865 HD12 LEU 482 HD12 LEU 482 18.881 7.701 0.469 866 HD13 LEU 482 HD13 LEU 482 18.064 8.494 1.815 867 HD21 LEU 482 HD21 LEU 482 17.483 4.926 2.555 868 HD22 LEU 482 HD22 LEU 482 17.966 6.469 3.257 869 HD23 LEU 482 HD23 LEU 482 18.986 5.695 2.044 870 H THR 483 HN THR 483 13.339 6.866 3.472 871 HA THR 483 HA THR 483 11.617 8.793 2.130 872 HB THR 483 HB THR 483 9.772 7.326 2.948 873 HG1 THR 483 HG1 THR 483 11.275 5.192 3.625 874 HG21 THR 483 HG21 THR 483 10.314 5.406 1.512 875 HG22 THR 483 HG22 THR 483 12.007 5.902 1.494 876 HG23 THR 483 HG23 THR 483 10.779 6.929 0.754 877 H ARG 484 HN ARG 484 12.388 7.695 5.386 878 HA ARG 484 HA ARG 484 12.130 8.619 7.439 879 HB2 ARG 484 HB2 ARG 484 11.561 11.175 5.925 880 HB3 ARG 484 HB1 ARG 484 11.955 11.051 7.632 881 HG2 ARG 484 HG2 ARG 484 14.166 10.588 7.230 882 HG3 ARG 484 HG1 ARG 484 13.851 9.951 5.615 883 HD2 ARG 484 HD2 ARG 484 13.252 12.269 4.906 884 HD3 ARG 484 HD1 ARG 484 13.792 12.834 6.486 885 HE ARG 484 HE ARG 484 15.977 11.633 5.748 886 HH11 ARG 484 HH11 ARG 484 13.834 13.548 3.753 887 HH12 ARG 484 HH12 ARG 484 15.080 14.010 2.639 888 HH21 ARG 484 HH21 ARG 484 17.619 12.259 4.296 889 HH22 ARG 484 HH22 ARG 484 17.227 13.278 2.949 890 H SER 485 HN SER 485 9.893 7.444 5.980 891 HA SER 485 HA SER 485 7.775 8.317 7.739 892 HB2 SER 485 HB2 SER 485 7.229 9.848 6.040 893 HB3 SER 485 HB1 SER 485 7.704 8.734 4.760 894 HG SER 485 HG SER 485 5.473 8.309 6.476 895 H VAL 486 HN VAL 486 7.025 6.484 8.551 896 HA VAL 486 HA VAL 486 7.572 3.931 7.550 897 HB VAL 486 HB VAL 486 5.863 3.101 9.147 898 HG11 VAL 486 HG11 VAL 486 7.607 5.234 10.363 899 HG12 VAL 486 HG12 VAL 486 8.187 3.654 9.838 900 HG13 VAL 486 HG13 VAL 486 7.003 3.769 11.140 901 HG21 VAL 486 HG21 VAL 486 4.737 4.711 10.633 902 HG22 VAL 486 HG22 VAL 486 4.215 4.871 8.955 903 HG23 VAL 486 HG23 VAL 486 5.351 6.032 9.639 904 H GLU 487 HN GLU 487 4.985 6.140 6.908 905 HA GLU 487 HA GLU 487 3.098 4.363 5.824 906 HB2 GLU 487 HB2 GLU 487 3.534 7.250 5.043 907 HB3 GLU 487 HB1 GLU 487 2.048 6.323 4.887 908 HG2 GLU 487 HG2 GLU 487 1.512 7.373 6.798 909 HG3 GLU 487 HG1 GLU 487 2.462 6.083 7.531 910 H ILE 488 HN ILE 488 6.009 5.745 4.521 911 HA ILE 488 HA ILE 488 5.338 4.802 1.824 912 HB ILE 488 HB ILE 488 7.884 6.230 2.550 913 HG12 ILE 488 HG12 ILE 488 5.288 7.561 1.746 914 HG13 ILE 488 HG11 ILE 488 5.942 7.565 3.379 915 HG21 ILE 488 HG21 ILE 488 6.267 6.060 0.011 916 HG22 ILE 488 HG22 ILE 488 7.752 5.174 0.357 917 HG23 ILE 488 HG23 ILE 488 7.786 6.931 0.205 918 HD11 ILE 488 HD11 ILE 488 7.194 8.802 0.939 919 HD12 ILE 488 HD12 ILE 488 7.931 8.753 2.540 920 HD13 ILE 488 HD13 ILE 488 6.434 9.650 2.286 921 H THR 489 HN THR 489 7.534 4.275 4.493 922 HA THR 489 HA THR 489 9.427 2.631 3.266 923 HB THR 489 HB THR 489 8.458 2.479 6.125 924 HG1 THR 489 HG1 THR 489 10.517 4.024 4.891 925 HG21 THR 489 HG21 THR 489 9.784 0.535 5.542 926 HG22 THR 489 HG22 THR 489 10.733 1.607 6.571 927 HG23 THR 489 HG23 THR 489 11.029 1.564 4.835 928 H THR 490 HN THR 490 6.578 1.626 5.168 929 HA THR 490 HA THR 490 6.880 -1.114 4.760 930 HB THR 490 HB THR 490 4.141 0.049 4.994 931 HG1 THR 490 HG1 THR 490 5.145 1.377 6.425 932 HG21 THR 490 HG21 THR 490 4.454 -2.376 5.077 933 HG22 THR 490 HG22 THR 490 3.913 -1.763 6.639 934 HG23 THR 490 HG23 THR 490 5.607 -2.190 6.398 935 H ASP 491 HN ASP 491 5.267 1.325 2.792 936 HA ASP 491 HA ASP 491 4.073 -0.487 0.955 937 HB2 ASP 491 HB2 ASP 491 3.205 1.743 1.043 938 HB3 ASP 491 HB1 ASP 491 4.796 2.445 0.772 939 H ASN 492 HN ASN 492 7.043 1.417 0.966 940 HA ASN 492 HA ASN 492 8.139 0.757 -1.480 941 HB2 ASN 492 HB2 ASN 492 9.121 1.748 1.087 942 HB3 ASN 492 HB1 ASN 492 10.324 0.786 0.240 943 HD21 ASN 492 HD21 ASN 492 11.248 3.090 0.463 944 HD22 ASN 492 HD22 ASN 492 10.986 4.127 -0.909 945 H ILE 493 HN ILE 493 8.208 -1.071 1.543 946 HA ILE 493 HA ILE 493 9.999 -3.094 0.747 947 HB ILE 493 HB ILE 493 7.704 -3.289 2.710 948 HG12 ILE 493 HG12 ILE 493 10.636 -2.775 3.239 949 HG13 ILE 493 HG11 ILE 493 9.414 -1.510 3.176 950 HG21 ILE 493 HG21 ILE 493 9.007 -5.159 3.685 951 HG22 ILE 493 HG22 ILE 493 10.110 -5.063 2.313 952 HG23 ILE 493 HG23 ILE 493 8.420 -5.496 2.055 953 HD11 ILE 493 HD11 ILE 493 9.486 -3.801 5.125 954 HD12 ILE 493 HD12 ILE 493 8.259 -2.538 5.065 955 HD13 ILE 493 HD13 ILE 493 9.928 -2.130 5.465 956 H LEU 494 HN LEU 494 6.454 -2.920 0.600 957 HA LEU 494 HA LEU 494 6.046 -5.480 -0.519 958 HB2 LEU 494 HB2 LEU 494 4.398 -2.968 -0.440 959 HB3 LEU 494 HB1 LEU 494 3.837 -4.397 -1.286 960 HG LEU 494 HG LEU 494 4.684 -4.723 1.549 961 HD11 LEU 494 HD11 LEU 494 2.534 -4.009 2.386 962 HD12 LEU 494 HD12 LEU 494 2.024 -3.548 0.762 963 HD13 LEU 494 HD13 LEU 494 3.325 -2.667 1.562 964 HD21 LEU 494 HD21 LEU 494 3.080 -6.104 -0.452 965 HD22 LEU 494 HD22 LEU 494 2.287 -5.995 1.122 966 HD23 LEU 494 HD23 LEU 494 3.888 -6.733 0.984 967 H GLU 495 HN GLU 495 6.836 -2.379 -1.920 968 HA GLU 495 HA GLU 495 6.261 -3.100 -4.629 969 HB2 GLU 495 HB2 GLU 495 8.145 -0.938 -3.667 970 HB3 GLU 495 HB1 GLU 495 7.363 -1.042 -5.238 971 HG2 GLU 495 HG2 GLU 495 5.900 -0.688 -2.634 972 HG3 GLU 495 HG1 GLU 495 6.353 0.630 -3.716 973 H GLY 496 HN GLY 496 9.004 -3.394 -2.504 974 HA2 GLY 496 HA2 GLY 496 10.622 -5.136 -2.961 975 HA3 GLY 496 HA1 GLY 496 10.449 -4.773 -4.671 976 H ARG 497 HN ARG 497 10.608 -2.120 -2.481 977 HA ARG 497 HA ARG 497 13.008 -1.133 -3.689 978 HB2 ARG 497 HB2 ARG 497 11.126 0.290 -2.803 979 HB3 ARG 497 HB1 ARG 497 11.641 -0.137 -1.179 980 HG2 ARG 497 HG2 ARG 497 12.736 1.832 -1.386 981 HG3 ARG 497 HG1 ARG 497 13.959 0.776 -2.094 982 HD2 ARG 497 HD2 ARG 497 13.673 2.687 -3.519 983 HD3 ARG 497 HD1 ARG 497 13.016 1.268 -4.330 984 HE ARG 497 HE ARG 497 11.158 2.954 -2.836 985 HH11 ARG 497 HH11 ARG 497 12.407 1.898 -5.932 986 HH12 ARG 497 HH12 ARG 497 11.101 2.591 -6.840 987 HH21 ARG 497 HH21 ARG 497 9.422 3.843 -4.018 988 HH22 ARG 497 HH22 ARG 497 9.398 3.699 -5.748 989 H ILE 498 HN ILE 498 12.169 -2.859 -0.812 990 HA ILE 498 HA ILE 498 14.987 -2.923 0.032 991 HB ILE 498 HB ILE 498 12.479 -3.286 1.694 992 HG12 ILE 498 HG12 ILE 498 13.902 -1.322 2.911 993 HG13 ILE 498 HG11 ILE 498 14.348 -1.039 1.232 994 HG21 ILE 498 HG21 ILE 498 14.169 -4.813 2.470 995 HG22 ILE 498 HG22 ILE 498 14.012 -3.483 3.617 996 HG23 ILE 498 HG23 ILE 498 15.373 -3.524 2.496 997 HD11 ILE 498 HD11 ILE 498 11.603 -0.993 2.440 998 HD12 ILE 498 HD12 ILE 498 11.897 -0.997 0.704 999 HD13 ILE 498 HD13 ILE 498 12.489 0.338 1.693 1000 H GLN 499 HN GLN 499 15.958 -4.850 -0.195 1001 HA GLN 499 HA GLN 499 14.522 -7.081 -1.222 1002 HB2 GLN 499 HB2 GLN 499 17.378 -6.745 -0.324 1003 HB3 GLN 499 HB1 GLN 499 16.752 -8.259 -0.963 1004 HG2 GLN 499 HG2 GLN 499 16.893 -5.617 -2.393 1005 HG3 GLN 499 HG1 GLN 499 17.878 -7.044 -2.704 1006 HE21 GLN 499 HE21 GLN 499 16.010 -5.486 -4.401 1007 HE22 GLN 499 HE22 GLN 499 14.902 -6.651 -5.039 1008 H VAL 500 HN VAL 500 13.943 -8.952 -0.312 1009 HA VAL 500 HA VAL 500 13.656 -9.015 2.562 1010 HB VAL 500 HB VAL 500 12.365 -11.099 2.132 1011 HG11 VAL 500 HG11 VAL 500 11.186 -9.001 2.173 1012 HG12 VAL 500 HG12 VAL 500 10.508 -10.017 0.901 1013 HG13 VAL 500 HG13 VAL 500 11.596 -8.693 0.485 1014 HG21 VAL 500 HG21 VAL 500 13.597 -11.868 0.160 1015 HG22 VAL 500 HG22 VAL 500 12.948 -10.517 -0.772 1016 HG23 VAL 500 HG23 VAL 500 11.865 -11.768 -0.158 1017 HA PRO 501 HA PRO 501 16.928 -11.831 3.563 1018 HB2 PRO 501 HB2 PRO 501 15.088 -13.801 4.767 1019 HB3 PRO 501 HB1 PRO 501 16.358 -12.834 5.536 1020 HG2 PRO 501 HG2 PRO 501 13.779 -12.337 5.970 1021 HG3 PRO 501 HG1 PRO 501 14.983 -11.035 5.880 1022 HD2 PRO 501 HD2 PRO 501 13.018 -11.932 3.817 1023 HD3 PRO 501 HD1 PRO 501 13.502 -10.284 4.271 1024 H PHE 502 HN PHE 502 17.401 -12.450 1.439 1025 HA PHE 502 HA PHE 502 16.186 -14.876 0.385 1026 HB2 PHE 502 HB2 PHE 502 16.482 -13.040 -1.177 1027 HB3 PHE 502 HB1 PHE 502 18.186 -12.913 -0.768 1028 HD1 PHE 502 HD1 PHE 502 15.704 -15.276 -2.225 1029 HD2 PHE 502 HD2 PHE 502 19.760 -13.998 -2.058 1030 HE1 PHE 502 HE1 PHE 502 16.263 -16.807 -4.067 1031 HE2 PHE 502 HE2 PHE 502 20.322 -15.527 -3.899 1032 HZ PHE 502 HZ PHE 502 18.571 -16.935 -4.904 1033 HA PRO 503 HA PRO 503 19.451 -17.390 2.073 1034 HB2 PRO 503 HB2 PRO 503 19.028 -19.590 0.478 1035 HB3 PRO 503 HB1 PRO 503 18.050 -19.204 1.905 1036 HG2 PRO 503 HG2 PRO 503 17.461 -18.729 -0.966 1037 HG3 PRO 503 HG1 PRO 503 16.384 -19.267 0.338 1038 HD2 PRO 503 HD2 PRO 503 16.390 -16.721 -0.555 1039 HD3 PRO 503 HD1 PRO 503 16.060 -17.131 1.140 1040 H THR 504 HN THR 504 21.263 -16.276 1.368 1041 HA THR 504 HA THR 504 22.724 -17.506 -0.779 1042 HB THR 504 HB THR 504 21.318 -15.683 -1.879 1043 HG1 THR 504 HG1 THR 504 24.161 -15.568 -2.000 1044 HG21 THR 504 HG21 THR 504 21.427 -13.978 -0.179 1045 HG22 THR 504 HG22 THR 504 22.191 -13.373 -1.649 1046 HG23 THR 504 HG23 THR 504 23.185 -13.918 -0.298 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 -18.251 -11.413 14.626 2 H2 MET 1 HT2 MET 1 -17.950 -12.885 13.845 3 H3 MET 1 HT3 MET 1 -17.395 -11.435 13.169 4 HA MET 1 HA MET 1 -16.529 -12.340 15.832 5 HB2 MET 1 HB2 MET 1 -14.534 -13.296 14.833 6 HB3 MET 1 HB1 MET 1 -15.956 -14.087 14.170 7 HG2 MET 1 HG2 MET 1 -15.765 -12.595 12.182 8 HG3 MET 1 HG1 MET 1 -14.238 -12.007 12.836 9 HE1 MET 1 HE1 MET 1 -12.970 -14.240 9.914 10 HE2 MET 1 HE2 MET 1 -12.794 -12.690 10.737 11 HE3 MET 1 HE3 MET 1 -14.320 -13.106 9.957 12 H GLN 2 HN GLN 2 -14.596 -11.228 16.504 13 HA GLN 2 HA GLN 2 -14.422 -8.557 15.297 14 HB2 GLN 2 HB2 GLN 2 -13.531 -9.509 18.025 15 HB3 GLN 2 HB1 GLN 2 -13.451 -7.854 17.438 16 HG2 GLN 2 HG2 GLN 2 -15.982 -9.436 17.810 17 HG3 GLN 2 HG1 GLN 2 -15.343 -8.252 18.949 18 HE21 GLN 2 HE21 GLN 2 -17.871 -8.283 17.513 19 HE22 GLN 2 HE22 GLN 2 -17.925 -6.807 16.618 20 H ILE 3 HN ILE 3 -12.536 -7.738 14.575 21 HA ILE 3 HA ILE 3 -10.123 -9.413 14.809 22 HB ILE 3 HB ILE 3 -9.446 -8.580 12.546 23 HG12 ILE 3 HG12 ILE 3 -12.357 -7.844 12.204 24 HG13 ILE 3 HG11 ILE 3 -11.107 -6.661 12.577 25 HG21 ILE 3 HG21 ILE 3 -10.747 -10.203 11.310 26 HG22 ILE 3 HG22 ILE 3 -11.984 -10.211 12.566 27 HG23 ILE 3 HG23 ILE 3 -10.371 -10.837 12.911 28 HD11 ILE 3 HD11 ILE 3 -11.147 -8.430 10.144 29 HD12 ILE 3 HD12 ILE 3 -9.969 -7.169 10.506 30 HD13 ILE 3 HD13 ILE 3 -11.651 -6.741 10.191 31 H PHE 4 HN PHE 4 -8.101 -8.200 14.655 32 HA PHE 4 HA PHE 4 -8.473 -5.432 15.589 33 HB2 PHE 4 HB2 PHE 4 -6.309 -7.414 16.316 34 HB3 PHE 4 HB1 PHE 4 -6.328 -5.727 16.816 35 HD1 PHE 4 HD1 PHE 4 -8.789 -5.071 17.843 36 HD2 PHE 4 HD2 PHE 4 -6.925 -8.893 17.934 37 HE1 PHE 4 HE1 PHE 4 -10.139 -5.676 19.808 38 HE2 PHE 4 HE2 PHE 4 -8.269 -9.506 19.902 39 HZ PHE 4 HZ PHE 4 -9.881 -7.897 20.840 40 H VAL 5 HN VAL 5 -8.036 -4.104 13.973 41 HA VAL 5 HA VAL 5 -5.918 -4.742 12.068 42 HB VAL 5 HB VAL 5 -7.776 -2.351 12.104 43 HG11 VAL 5 HG11 VAL 5 -7.114 -2.084 9.762 44 HG12 VAL 5 HG12 VAL 5 -5.997 -3.440 9.924 45 HG13 VAL 5 HG13 VAL 5 -5.726 -1.958 10.843 46 HG21 VAL 5 HG21 VAL 5 -9.036 -4.428 11.871 47 HG22 VAL 5 HG22 VAL 5 -7.989 -4.922 10.540 48 HG23 VAL 5 HG23 VAL 5 -9.040 -3.515 10.361 49 H LYS 6 HN LYS 6 -3.908 -4.033 12.388 50 HA LYS 6 HA LYS 6 -3.533 -1.823 14.285 51 HB2 LYS 6 HB2 LYS 6 -1.743 -4.117 13.504 52 HB3 LYS 6 HB1 LYS 6 -1.149 -2.724 14.400 53 HG2 LYS 6 HG2 LYS 6 -2.614 -3.179 16.227 54 HG3 LYS 6 HG1 LYS 6 -3.451 -4.432 15.313 55 HD2 LYS 6 HD2 LYS 6 -1.294 -5.704 15.247 56 HD3 LYS 6 HD1 LYS 6 -0.617 -4.498 16.345 57 HE2 LYS 6 HE2 LYS 6 -2.273 -5.038 18.019 58 HE3 LYS 6 HE1 LYS 6 -3.077 -6.148 16.914 59 HZ1 LYS 6 HZ1 LYS 6 -1.637 -7.254 18.561 60 HZ2 LYS 6 HZ2 LYS 6 -0.293 -6.490 17.880 61 HZ3 LYS 6 HZ3 LYS 6 -1.189 -7.592 16.966 62 H THR 7 HN THR 7 -2.478 -0.031 13.740 63 HA THR 7 HA THR 7 -1.714 0.258 10.918 64 HB THR 7 HB THR 7 -1.960 2.769 11.514 65 HG1 THR 7 HG1 THR 7 -3.630 1.677 13.550 66 HG21 THR 7 HG21 THR 7 -4.393 0.974 11.419 67 HG22 THR 7 HG22 THR 7 -3.506 1.596 10.028 68 HG23 THR 7 HG23 THR 7 -4.382 2.706 11.081 69 H LEU 8 HN LEU 8 0.073 1.748 10.473 70 HA LEU 8 HA LEU 8 2.413 1.126 11.870 71 HB2 LEU 8 HB2 LEU 8 1.783 3.366 9.959 72 HB3 LEU 8 HB1 LEU 8 3.399 3.024 10.547 73 HG LEU 8 HG LEU 8 1.796 0.912 9.137 74 HD11 LEU 8 HD11 LEU 8 3.569 2.987 7.868 75 HD12 LEU 8 HD12 LEU 8 1.825 2.840 7.656 76 HD13 LEU 8 HD13 LEU 8 2.897 1.576 7.055 77 HD21 LEU 8 HD21 LEU 8 4.020 0.042 8.618 78 HD22 LEU 8 HD22 LEU 8 3.792 0.215 10.357 79 HD23 LEU 8 HD23 LEU 8 4.753 1.399 9.472 80 H THR 9 HN THR 9 0.107 3.682 12.283 81 HA THR 9 HA THR 9 1.696 5.438 13.831 82 HB THR 9 HB THR 9 -1.072 5.657 14.526 83 HG1 THR 9 HG1 THR 9 -0.841 5.794 11.734 84 HG21 THR 9 HG21 THR 9 0.548 7.497 14.356 85 HG22 THR 9 HG22 THR 9 -0.877 7.788 13.359 86 HG23 THR 9 HG23 THR 9 0.631 7.257 12.612 87 H GLY 10 HN GLY 10 0.250 2.419 14.526 88 HA2 GLY 10 HA2 GLY 10 0.644 1.214 16.506 89 HA3 GLY 10 HA1 GLY 10 0.973 2.724 17.342 90 H LYS 11 HN LYS 11 -1.874 2.391 15.365 91 HA LYS 11 HA LYS 11 -3.482 2.395 17.828 92 HB2 LYS 11 HB2 LYS 11 -3.599 4.438 16.348 93 HB3 LYS 11 HB1 LYS 11 -4.335 3.418 15.117 94 HG2 LYS 11 HG2 LYS 11 -6.222 2.978 16.523 95 HG3 LYS 11 HG1 LYS 11 -5.463 3.809 17.883 96 HD2 LYS 11 HD2 LYS 11 -7.043 5.314 16.965 97 HD3 LYS 11 HD1 LYS 11 -5.455 5.887 16.457 98 HE2 LYS 11 HE2 LYS 11 -5.772 4.855 14.270 99 HE3 LYS 11 HE1 LYS 11 -7.334 4.219 14.782 100 HZ1 LYS 11 HZ1 LYS 11 -6.629 7.092 14.547 101 HZ2 LYS 11 HZ2 LYS 11 -8.118 6.487 15.063 102 HZ3 LYS 11 HZ3 LYS 11 -7.606 6.221 13.470 103 H THR 12 HN THR 12 -4.924 0.841 18.147 104 HA THR 12 HA THR 12 -5.177 -1.243 16.104 105 HB THR 12 HB THR 12 -6.271 -1.618 18.845 106 HG1 THR 12 HG1 THR 12 -3.633 -2.257 18.795 107 HG21 THR 12 HG21 THR 12 -6.379 -3.406 17.171 108 HG22 THR 12 HG22 THR 12 -5.363 -3.871 18.536 109 HG23 THR 12 HG23 THR 12 -4.623 -3.368 17.016 110 H ILE 13 HN ILE 13 -6.971 -1.289 14.934 111 HA ILE 13 HA ILE 13 -9.380 0.067 15.942 112 HB ILE 13 HB ILE 13 -8.890 -0.870 13.114 113 HG12 ILE 13 HG12 ILE 13 -8.474 1.941 14.137 114 HG13 ILE 13 HG11 ILE 13 -7.153 0.787 13.978 115 HG21 ILE 13 HG21 ILE 13 -10.747 1.248 14.188 116 HG22 ILE 13 HG22 ILE 13 -11.226 -0.407 13.812 117 HG23 ILE 13 HG23 ILE 13 -10.652 0.660 12.529 118 HD11 ILE 13 HD11 ILE 13 -7.593 0.620 11.581 119 HD12 ILE 13 HD12 ILE 13 -7.255 2.281 12.070 120 HD13 ILE 13 HD13 ILE 13 -8.914 1.778 11.747 121 H THR 14 HN THR 14 -11.158 -1.086 16.460 122 HA THR 14 HA THR 14 -11.078 -3.979 16.060 123 HB THR 14 HB THR 14 -13.204 -2.478 17.582 124 HG1 THR 14 HG1 THR 14 -10.725 -2.261 18.168 125 HG21 THR 14 HG21 THR 14 -13.622 -4.841 17.130 126 HG22 THR 14 HG22 THR 14 -13.328 -4.578 18.850 127 HG23 THR 14 HG23 THR 14 -12.059 -5.262 17.833 128 H LEU 15 HN LEU 15 -12.182 -4.913 14.453 129 HA LEU 15 HA LEU 15 -14.452 -3.425 13.305 130 HB2 LEU 15 HB2 LEU 15 -12.380 -5.078 11.875 131 HB3 LEU 15 HB1 LEU 15 -13.874 -4.544 11.133 132 HG LEU 15 HG LEU 15 -11.663 -2.760 12.154 133 HD11 LEU 15 HD11 LEU 15 -11.279 -2.248 9.833 134 HD12 LEU 15 HD12 LEU 15 -12.613 -3.291 9.348 135 HD13 LEU 15 HD13 LEU 15 -11.166 -3.991 10.073 136 HD21 LEU 15 HD21 LEU 15 -14.298 -2.099 10.848 137 HD22 LEU 15 HD22 LEU 15 -12.974 -0.956 11.068 138 HD23 LEU 15 HD23 LEU 15 -13.776 -1.657 12.473 139 H GLU 16 HN GLU 16 -16.292 -4.488 12.994 140 HA GLU 16 HA GLU 16 -16.439 -7.250 13.934 141 HB2 GLU 16 HB2 GLU 16 -17.986 -5.581 14.908 142 HB3 GLU 16 HB1 GLU 16 -18.636 -5.259 13.307 143 HG2 GLU 16 HG2 GLU 16 -19.396 -7.597 13.175 144 HG3 GLU 16 HG1 GLU 16 -18.810 -7.853 14.819 145 H VAL 17 HN VAL 17 -16.104 -8.699 12.376 146 HA VAL 17 HA VAL 17 -17.561 -8.385 9.846 147 HB VAL 17 HB VAL 17 -15.606 -9.299 8.604 148 HG11 VAL 17 HG11 VAL 17 -14.255 -7.202 8.639 149 HG12 VAL 17 HG12 VAL 17 -15.198 -6.676 10.035 150 HG13 VAL 17 HG13 VAL 17 -15.992 -6.935 8.481 151 HG21 VAL 17 HG21 VAL 17 -14.433 -10.360 10.451 152 HG22 VAL 17 HG22 VAL 17 -14.136 -8.788 11.191 153 HG23 VAL 17 HG23 VAL 17 -13.381 -9.193 9.651 154 H GLU 18 HN GLU 18 -17.247 -10.533 8.551 155 HA GLU 18 HA GLU 18 -17.236 -12.871 10.309 156 HB2 GLU 18 HB2 GLU 18 -19.523 -11.892 8.643 157 HB3 GLU 18 HB1 GLU 18 -19.254 -13.626 8.751 158 HG2 GLU 18 HG2 GLU 18 -19.630 -11.798 11.114 159 HG3 GLU 18 HG1 GLU 18 -20.897 -12.781 10.382 160 HA PRO 19 HA PRO 19 -14.862 -14.809 7.121 161 HB2 PRO 19 HB2 PRO 19 -16.848 -17.028 7.061 162 HB3 PRO 19 HB1 PRO 19 -15.095 -17.085 7.323 163 HG2 PRO 19 HG2 PRO 19 -16.781 -17.433 9.336 164 HG3 PRO 19 HG1 PRO 19 -15.257 -16.547 9.545 165 HD2 PRO 19 HD2 PRO 19 -18.038 -15.501 9.353 166 HD3 PRO 19 HD1 PRO 19 -16.663 -14.903 10.305 167 H SER 20 HN SER 20 -18.327 -14.592 6.645 168 HA SER 20 HA SER 20 -18.249 -15.142 3.837 169 HB2 SER 20 HB2 SER 20 -20.665 -13.985 4.221 170 HB3 SER 20 HB1 SER 20 -20.328 -15.678 4.575 171 HG SER 20 HG SER 20 -21.066 -13.742 6.260 172 H ASP 21 HN ASP 21 -17.320 -12.454 5.582 173 HA ASP 21 HA ASP 21 -18.294 -10.483 3.688 174 HB2 ASP 21 HB2 ASP 21 -18.005 -10.125 6.227 175 HB3 ASP 21 HB1 ASP 21 -16.290 -9.951 5.870 176 H THR 22 HN THR 22 -17.001 -9.273 2.306 177 HA THR 22 HA THR 22 -14.606 -10.657 1.404 178 HB THR 22 HB THR 22 -14.874 -8.657 -0.367 179 HG1 THR 22 HG1 THR 22 -17.168 -8.317 -0.645 180 HG21 THR 22 HG21 THR 22 -16.568 -11.157 -0.334 181 HG22 THR 22 HG22 THR 22 -14.903 -11.046 -0.902 182 HG23 THR 22 HG23 THR 22 -16.184 -10.189 -1.757 183 H ILE 23 HN ILE 23 -12.612 -9.594 1.064 184 HA ILE 23 HA ILE 23 -11.776 -7.856 3.096 185 HB ILE 23 HB ILE 23 -10.465 -8.259 0.400 186 HG12 ILE 23 HG12 ILE 23 -10.826 -10.407 1.496 187 HG13 ILE 23 HG11 ILE 23 -9.114 -9.992 1.539 188 HG21 ILE 23 HG21 ILE 23 -8.396 -7.629 1.518 189 HG22 ILE 23 HG22 ILE 23 -9.278 -7.357 3.020 190 HG23 ILE 23 HG23 ILE 23 -9.585 -6.333 1.619 191 HD11 ILE 23 HD11 ILE 23 -11.072 -9.738 3.811 192 HD12 ILE 23 HD12 ILE 23 -9.379 -9.252 3.865 193 HD13 ILE 23 HD13 ILE 23 -9.802 -10.948 3.642 194 H GLU 24 HN GLU 24 -13.017 -7.263 -0.107 195 HA GLU 24 HA GLU 24 -12.366 -4.576 -0.455 196 HB2 GLU 24 HB2 GLU 24 -13.301 -5.912 -2.251 197 HB3 GLU 24 HB1 GLU 24 -14.795 -6.133 -1.356 198 HG2 GLU 24 HG2 GLU 24 -14.771 -3.470 -1.449 199 HG3 GLU 24 HG1 GLU 24 -13.840 -3.808 -2.909 200 H ASN 25 HN ASN 25 -15.159 -6.069 1.134 201 HA ASN 25 HA ASN 25 -16.458 -3.619 1.760 202 HB2 ASN 25 HB2 ASN 25 -17.511 -5.942 1.646 203 HB3 ASN 25 HB1 ASN 25 -16.813 -6.225 3.237 204 HD21 ASN 25 HD21 ASN 25 -18.837 -6.482 4.143 205 HD22 ASN 25 HD22 ASN 25 -19.889 -5.128 4.441 206 H VAL 26 HN VAL 26 -14.141 -5.676 3.400 207 HA VAL 26 HA VAL 26 -14.244 -4.486 5.945 208 HB VAL 26 HB VAL 26 -11.849 -5.757 4.599 209 HG11 VAL 26 HG11 VAL 26 -11.203 -4.458 6.544 210 HG12 VAL 26 HG12 VAL 26 -11.061 -6.182 6.886 211 HG13 VAL 26 HG13 VAL 26 -12.431 -5.269 7.518 212 HG21 VAL 26 HG21 VAL 26 -13.772 -7.251 4.638 213 HG22 VAL 26 HG22 VAL 26 -13.958 -6.983 6.371 214 HG23 VAL 26 HG23 VAL 26 -12.522 -7.804 5.755 215 H LYS 27 HN LYS 27 -12.287 -3.762 3.088 216 HA LYS 27 HA LYS 27 -10.718 -1.713 4.203 217 HB2 LYS 27 HB2 LYS 27 -11.611 -2.069 1.332 218 HB3 LYS 27 HB1 LYS 27 -10.303 -1.024 1.867 219 HG2 LYS 27 HG2 LYS 27 -9.842 -3.645 2.882 220 HG3 LYS 27 HG1 LYS 27 -10.184 -3.752 1.154 221 HD2 LYS 27 HD2 LYS 27 -8.202 -1.815 2.326 222 HD3 LYS 27 HD1 LYS 27 -7.763 -3.432 1.776 223 HE2 LYS 27 HE2 LYS 27 -9.250 -1.582 -0.042 224 HE3 LYS 27 HE1 LYS 27 -7.509 -1.402 0.168 225 HZ1 LYS 27 HZ1 LYS 27 -8.927 -3.847 -0.767 226 HZ2 LYS 27 HZ2 LYS 27 -7.259 -3.730 -0.493 227 HZ3 LYS 27 HZ3 LYS 27 -7.979 -2.807 -1.708 228 H ALA 28 HN ALA 28 -13.907 -1.700 2.730 229 HA ALA 28 HA ALA 28 -14.213 1.105 2.567 230 HB1 ALA 28 HB1 ALA 28 -15.622 -0.453 1.308 231 HB2 ALA 28 HB2 ALA 28 -16.593 0.645 2.288 232 HB3 ALA 28 HB3 ALA 28 -16.342 -1.016 2.817 233 H LYS 29 HN LYS 29 -14.933 -1.268 5.067 234 HA LYS 29 HA LYS 29 -16.313 0.431 6.836 235 HB2 LYS 29 HB2 LYS 29 -14.672 -2.053 7.358 236 HB3 LYS 29 HB1 LYS 29 -15.672 -1.267 8.574 237 HG2 LYS 29 HG2 LYS 29 -17.666 -1.745 7.348 238 HG3 LYS 29 HG1 LYS 29 -16.735 -2.300 5.957 239 HD2 LYS 29 HD2 LYS 29 -15.861 -4.161 7.302 240 HD3 LYS 29 HD1 LYS 29 -16.843 -3.624 8.669 241 HE2 LYS 29 HE2 LYS 29 -18.870 -3.960 7.344 242 HE3 LYS 29 HE1 LYS 29 -17.892 -4.468 5.970 243 HZ1 LYS 29 HZ1 LYS 29 -17.438 -6.476 6.899 244 HZ2 LYS 29 HZ2 LYS 29 -18.958 -6.199 7.593 245 HZ3 LYS 29 HZ3 LYS 29 -17.560 -5.908 8.494 246 H ILE 30 HN ILE 30 -12.905 -0.177 6.302 247 HA ILE 30 HA ILE 30 -11.960 1.203 8.602 248 HB ILE 30 HB ILE 30 -10.566 0.611 5.982 249 HG12 ILE 30 HG12 ILE 30 -10.338 -0.765 8.664 250 HG13 ILE 30 HG11 ILE 30 -11.332 -1.354 7.336 251 HG21 ILE 30 HG21 ILE 30 -9.482 2.474 7.107 252 HG22 ILE 30 HG22 ILE 30 -8.476 1.029 7.207 253 HG23 ILE 30 HG23 ILE 30 -9.414 1.549 8.607 254 HD11 ILE 30 HD11 ILE 30 -9.165 -2.504 7.529 255 HD12 ILE 30 HD12 ILE 30 -8.350 -0.973 7.207 256 HD13 ILE 30 HD13 ILE 30 -9.381 -1.702 5.975 257 H GLN 31 HN GLN 31 -12.755 2.154 5.308 258 HA GLN 31 HA GLN 31 -11.709 4.795 5.486 259 HB2 GLN 31 HB2 GLN 31 -12.166 3.695 3.328 260 HB3 GLN 31 HB1 GLN 31 -13.888 3.716 3.683 261 HG2 GLN 31 HG2 GLN 31 -13.785 6.198 3.757 262 HG3 GLN 31 HG1 GLN 31 -12.101 6.100 3.249 263 HE21 GLN 31 HE21 GLN 31 -12.495 7.232 1.348 264 HE22 GLN 31 HE22 GLN 31 -13.351 6.534 0.018 265 H ASP 32 HN ASP 32 -14.762 3.308 6.285 266 HA ASP 32 HA ASP 32 -16.224 5.714 6.667 267 HB2 ASP 32 HB2 ASP 32 -17.404 3.653 6.276 268 HB3 ASP 32 HB1 ASP 32 -16.650 2.897 7.673 269 H LYS 33 HN LYS 33 -14.236 3.711 8.763 270 HA LYS 33 HA LYS 33 -14.962 5.251 11.109 271 HB2 LYS 33 HB2 LYS 33 -13.138 2.904 10.663 272 HB3 LYS 33 HB1 LYS 33 -13.215 3.745 12.204 273 HG2 LYS 33 HG2 LYS 33 -15.685 3.282 12.217 274 HG3 LYS 33 HG1 LYS 33 -15.416 2.233 10.823 275 HD2 LYS 33 HD2 LYS 33 -13.935 0.830 12.102 276 HD3 LYS 33 HD1 LYS 33 -14.007 1.938 13.472 277 HE2 LYS 33 HE2 LYS 33 -16.525 1.488 13.467 278 HE3 LYS 33 HE1 LYS 33 -16.157 0.130 12.408 279 HZ1 LYS 33 HZ1 LYS 33 -14.654 -0.720 14.144 280 HZ2 LYS 33 HZ2 LYS 33 -16.252 -0.608 14.681 281 HZ3 LYS 33 HZ3 LYS 33 -15.117 0.548 15.160 282 H GLU 34 HN GLU 34 -12.031 4.770 9.133 283 HA GLU 34 HA GLU 34 -10.661 6.806 10.720 284 HB2 GLU 34 HB2 GLU 34 -9.714 4.878 8.610 285 HB3 GLU 34 HB1 GLU 34 -8.691 6.169 9.232 286 HG2 GLU 34 HG2 GLU 34 -9.835 3.825 10.722 287 HG3 GLU 34 HG1 GLU 34 -8.139 4.236 10.456 288 H GLY 35 HN GLY 35 -11.517 6.225 7.323 289 HA2 GLY 35 HA2 GLY 35 -12.372 8.112 6.042 290 HA3 GLY 35 HA1 GLY 35 -11.227 9.131 6.901 291 H ILE 36 HN ILE 36 -9.577 6.390 6.328 292 HA ILE 36 HA ILE 36 -8.067 7.558 4.183 293 HB ILE 36 HB ILE 36 -7.799 4.805 5.406 294 HG12 ILE 36 HG12 ILE 36 -6.249 7.309 6.097 295 HG13 ILE 36 HG11 ILE 36 -7.615 6.720 7.039 296 HG21 ILE 36 HG21 ILE 36 -5.818 6.455 3.835 297 HG22 ILE 36 HG22 ILE 36 -6.701 5.053 3.233 298 HG23 ILE 36 HG23 ILE 36 -5.527 4.862 4.534 299 HD11 ILE 36 HD11 ILE 36 -5.532 6.064 8.063 300 HD12 ILE 36 HD12 ILE 36 -5.018 5.276 6.572 301 HD13 ILE 36 HD13 ILE 36 -6.392 4.643 7.475 302 HA PRO 37 HA PRO 37 -10.561 5.808 0.899 303 HB2 PRO 37 HB2 PRO 37 -8.062 6.202 -0.657 304 HB3 PRO 37 HB1 PRO 37 -9.699 6.798 -0.985 305 HG2 PRO 37 HG2 PRO 37 -7.784 8.426 -0.132 306 HG3 PRO 37 HG1 PRO 37 -9.469 8.614 0.389 307 HD2 PRO 37 HD2 PRO 37 -7.145 7.514 1.889 308 HD3 PRO 37 HD1 PRO 37 -8.529 8.461 2.474 309 HA PRO 38 HA PRO 38 -9.247 1.570 0.994 310 HB2 PRO 38 HB2 PRO 38 -10.607 0.702 -1.245 311 HB3 PRO 38 HB1 PRO 38 -11.352 0.933 0.348 312 HG2 PRO 38 HG2 PRO 38 -11.394 2.723 -2.023 313 HG3 PRO 38 HG1 PRO 38 -12.685 2.347 -0.864 314 HD2 PRO 38 HD2 PRO 38 -11.294 4.646 -0.753 315 HD3 PRO 38 HD1 PRO 38 -11.896 3.833 0.705 316 H ASP 39 HN ASP 39 -8.832 3.579 -1.816 317 HA ASP 39 HA ASP 39 -7.274 1.801 -3.382 318 HB2 ASP 39 HB2 ASP 39 -8.443 4.049 -4.024 319 HB3 ASP 39 HB1 ASP 39 -6.935 4.785 -3.498 320 H GLN 40 HN GLN 40 -6.566 3.801 -0.663 321 HA GLN 40 HA GLN 40 -3.671 3.510 -1.073 322 HB2 GLN 40 HB2 GLN 40 -5.172 5.672 -0.281 323 HB3 GLN 40 HB1 GLN 40 -4.607 5.033 1.256 324 HG2 GLN 40 HG2 GLN 40 -2.284 5.018 0.104 325 HG3 GLN 40 HG1 GLN 40 -3.034 6.150 -1.020 326 HE21 GLN 40 HE21 GLN 40 -0.863 6.650 0.798 327 HE22 GLN 40 HE22 GLN 40 -1.392 7.913 1.864 328 H GLN 41 HN GLN 41 -6.001 1.700 0.170 329 HA GLN 41 HA GLN 41 -4.700 1.099 2.721 330 HB2 GLN 41 HB2 GLN 41 -7.333 0.247 1.531 331 HB3 GLN 41 HB1 GLN 41 -6.702 -0.420 3.026 332 HG2 GLN 41 HG2 GLN 41 -6.696 1.867 3.979 333 HG3 GLN 41 HG1 GLN 41 -7.472 2.438 2.498 334 HE21 GLN 41 HE21 GLN 41 -9.370 3.059 3.510 335 HE22 GLN 41 HE22 GLN 41 -10.500 1.904 4.135 336 H ARG 42 HN ARG 42 -3.256 -0.460 2.811 337 HA ARG 42 HA ARG 42 -3.539 -2.749 0.978 338 HB2 ARG 42 HB2 ARG 42 -1.296 -1.008 1.454 339 HB3 ARG 42 HB1 ARG 42 -0.883 -2.645 1.947 340 HG2 ARG 42 HG2 ARG 42 -1.420 -3.499 -0.230 341 HG3 ARG 42 HG1 ARG 42 -2.024 -1.923 -0.742 342 HD2 ARG 42 HD2 ARG 42 0.078 -1.029 -0.944 343 HD3 ARG 42 HD1 ARG 42 0.774 -2.121 0.258 344 HE ARG 42 HE ARG 42 0.064 -3.767 -1.792 345 HH11 ARG 42 HH11 ARG 42 2.081 -0.895 -1.554 346 HH12 ARG 42 HH12 ARG 42 3.087 -1.360 -2.891 347 HH21 ARG 42 HH21 ARG 42 1.403 -4.356 -3.541 348 HH22 ARG 42 HH22 ARG 42 2.706 -3.308 -4.015 349 H LEU 43 HN LEU 43 -4.552 -4.209 2.218 350 HA LEU 43 HA LEU 43 -3.901 -4.491 5.027 351 HB2 LEU 43 HB2 LEU 43 -5.980 -5.682 3.231 352 HB3 LEU 43 HB1 LEU 43 -5.642 -6.408 4.791 353 HG LEU 43 HG LEU 43 -6.522 -3.547 4.382 354 HD11 LEU 43 HD11 LEU 43 -8.083 -5.936 5.352 355 HD12 LEU 43 HD12 LEU 43 -8.283 -5.139 3.792 356 HD13 LEU 43 HD13 LEU 43 -8.665 -4.275 5.281 357 HD21 LEU 43 HD21 LEU 43 -6.925 -3.668 6.844 358 HD22 LEU 43 HD22 LEU 43 -5.226 -3.736 6.383 359 HD23 LEU 43 HD23 LEU 43 -6.069 -5.211 6.853 360 H ILE 44 HN ILE 44 -2.552 -5.889 5.842 361 HA ILE 44 HA ILE 44 -1.646 -8.126 4.158 362 HB ILE 44 HB ILE 44 -0.094 -6.194 5.827 363 HG12 ILE 44 HG12 ILE 44 1.559 -6.717 3.902 364 HG13 ILE 44 HG11 ILE 44 0.185 -7.504 3.134 365 HG21 ILE 44 HG21 ILE 44 0.412 -8.327 6.896 366 HG22 ILE 44 HG22 ILE 44 1.803 -7.724 5.993 367 HG23 ILE 44 HG23 ILE 44 0.814 -9.023 5.327 368 HD11 ILE 44 HD11 ILE 44 0.376 -5.282 2.296 369 HD12 ILE 44 HD12 ILE 44 0.409 -4.614 3.926 370 HD13 ILE 44 HD13 ILE 44 -1.059 -5.372 3.313 371 H PHE 45 HN PHE 45 -1.662 -10.093 5.007 372 HA PHE 45 HA PHE 45 -2.138 -10.395 7.893 373 HB2 PHE 45 HB2 PHE 45 -4.238 -10.704 6.494 374 HB3 PHE 45 HB1 PHE 45 -3.457 -12.113 5.785 375 HD1 PHE 45 HD1 PHE 45 -4.585 -10.654 8.991 376 HD2 PHE 45 HD2 PHE 45 -3.542 -14.187 6.861 377 HE1 PHE 45 HE1 PHE 45 -5.412 -12.021 10.860 378 HE2 PHE 45 HE2 PHE 45 -4.367 -15.561 8.726 379 HZ PHE 45 HZ PHE 45 -5.304 -14.477 10.731 380 H ALA 46 HN ALA 46 -0.601 -11.579 8.767 381 HA ALA 46 HA ALA 46 1.053 -13.089 9.100 382 HB1 ALA 46 HB1 ALA 46 0.963 -15.224 7.966 383 HB2 ALA 46 HB2 ALA 46 -0.124 -14.559 6.746 384 HB3 ALA 46 HB3 ALA 46 -0.663 -14.713 8.418 385 H GLY 47 HN GLY 47 1.300 -10.835 7.080 386 HA2 GLY 47 HA2 GLY 47 3.357 -10.042 6.235 387 HA3 GLY 47 HA1 GLY 47 3.908 -11.701 6.082 388 H LYS 48 HN LYS 48 0.821 -11.508 4.822 389 HA LYS 48 HA LYS 48 1.847 -10.889 2.128 390 HB2 LYS 48 HB2 LYS 48 0.247 -13.263 3.047 391 HB3 LYS 48 HB1 LYS 48 0.119 -12.693 1.387 392 HG2 LYS 48 HG2 LYS 48 2.138 -13.492 0.823 393 HG3 LYS 48 HG1 LYS 48 2.864 -13.028 2.361 394 HD2 LYS 48 HD2 LYS 48 0.952 -15.333 2.182 395 HD3 LYS 48 HD1 LYS 48 2.663 -15.532 1.802 396 HE2 LYS 48 HE2 LYS 48 3.214 -14.602 4.039 397 HE3 LYS 48 HE1 LYS 48 1.489 -14.571 4.406 398 HZ1 LYS 48 HZ1 LYS 48 1.394 -16.935 4.227 399 HZ2 LYS 48 HZ2 LYS 48 2.670 -16.544 5.268 400 HZ3 LYS 48 HZ3 LYS 48 2.994 -17.022 3.678 401 H GLN 49 HN GLN 49 0.315 -10.044 0.644 402 HA GLN 49 HA GLN 49 -1.595 -8.314 1.901 403 HB2 GLN 49 HB2 GLN 49 -0.109 -7.999 -0.268 404 HB3 GLN 49 HB1 GLN 49 -1.524 -8.673 -1.055 405 HG2 GLN 49 HG2 GLN 49 -2.892 -6.899 0.022 406 HG3 GLN 49 HG1 GLN 49 -1.395 -6.185 0.621 407 HE21 GLN 49 HE21 GLN 49 -3.398 -6.731 -2.139 408 HE22 GLN 49 HE22 GLN 49 -2.537 -5.700 -3.229 409 H LEU 50 HN LEU 50 -3.809 -8.150 1.404 410 HA LEU 50 HA LEU 50 -5.072 -10.730 0.785 411 HB2 LEU 50 HB2 LEU 50 -6.310 -8.336 2.141 412 HB3 LEU 50 HB1 LEU 50 -6.989 -9.944 2.018 413 HG LEU 50 HG LEU 50 -4.544 -9.191 3.618 414 HD11 LEU 50 HD11 LEU 50 -7.276 -10.021 4.576 415 HD12 LEU 50 HD12 LEU 50 -6.695 -8.358 4.526 416 HD13 LEU 50 HD13 LEU 50 -5.898 -9.538 5.566 417 HD21 LEU 50 HD21 LEU 50 -4.216 -11.410 2.937 418 HD22 LEU 50 HD22 LEU 50 -5.923 -11.810 3.126 419 HD23 LEU 50 HD23 LEU 50 -4.921 -11.531 4.549 420 H GLU 51 HN GLU 51 -6.518 -10.896 -0.867 421 HA GLU 51 HA GLU 51 -6.631 -8.671 -2.736 422 HB2 GLU 51 HB2 GLU 51 -7.808 -11.439 -3.005 423 HB3 GLU 51 HB1 GLU 51 -7.579 -10.264 -4.290 424 HG2 GLU 51 HG2 GLU 51 -5.164 -10.444 -4.048 425 HG3 GLU 51 HG1 GLU 51 -5.373 -11.591 -2.726 426 H ASP 52 HN ASP 52 -8.443 -7.562 -3.293 427 HA ASP 52 HA ASP 52 -10.496 -7.296 -1.385 428 HB2 ASP 52 HB2 ASP 52 -10.103 -6.234 -4.161 429 HB3 ASP 52 HB1 ASP 52 -11.615 -5.957 -3.308 430 H GLY 53 HN GLY 53 -10.248 -9.209 -4.287 431 HA2 GLY 53 HA2 GLY 53 -13.088 -9.817 -4.328 432 HA3 GLY 53 HA1 GLY 53 -11.874 -10.429 -5.442 433 H ARG 54 HN ARG 54 -11.335 -10.641 -2.021 434 HA ARG 54 HA ARG 54 -12.057 -13.491 -2.071 435 HB2 ARG 54 HB2 ARG 54 -9.547 -12.263 -0.911 436 HB3 ARG 54 HB1 ARG 54 -10.060 -13.921 -0.623 437 HG2 ARG 54 HG2 ARG 54 -9.357 -12.728 -3.297 438 HG3 ARG 54 HG1 ARG 54 -8.341 -13.807 -2.340 439 HD2 ARG 54 HD2 ARG 54 -10.058 -15.557 -2.527 440 HD3 ARG 54 HD1 ARG 54 -11.042 -14.476 -3.512 441 HE ARG 54 HE ARG 54 -8.432 -15.593 -4.306 442 HH11 ARG 54 HH11 ARG 54 -11.522 -14.153 -5.140 443 HH12 ARG 54 HH12 ARG 54 -11.344 -14.471 -6.836 444 HH21 ARG 54 HH21 ARG 54 -8.188 -15.969 -6.531 445 HH22 ARG 54 HH22 ARG 54 -9.444 -15.493 -7.627 446 H THR 55 HN THR 55 -12.234 -14.403 0.166 447 HA THR 55 HA THR 55 -13.544 -12.409 1.888 448 HB THR 55 HB THR 55 -14.588 -14.478 2.966 449 HG1 THR 55 HG1 THR 55 -13.370 -15.625 0.658 450 HG21 THR 55 HG21 THR 55 -15.209 -13.812 0.085 451 HG22 THR 55 HG22 THR 55 -15.890 -13.043 1.519 452 HG23 THR 55 HG23 THR 55 -16.271 -14.726 1.157 453 H LEU 56 HN LEU 56 -13.448 -13.030 4.291 454 HA LEU 56 HA LEU 56 -10.737 -13.027 5.087 455 HB2 LEU 56 HB2 LEU 56 -13.310 -13.289 6.624 456 HB3 LEU 56 HB1 LEU 56 -11.748 -13.319 7.419 457 HG LEU 56 HG LEU 56 -11.772 -11.039 5.738 458 HD11 LEU 56 HD11 LEU 56 -14.233 -11.240 7.463 459 HD12 LEU 56 HD12 LEU 56 -14.203 -11.198 5.699 460 HD13 LEU 56 HD13 LEU 56 -13.670 -9.793 6.625 461 HD21 LEU 56 HD21 LEU 56 -11.525 -9.848 7.852 462 HD22 LEU 56 HD22 LEU 56 -10.515 -11.294 7.814 463 HD23 LEU 56 HD23 LEU 56 -12.022 -11.295 8.730 464 H SER 57 HN SER 57 -13.134 -15.585 4.845 465 HA SER 57 HA SER 57 -11.647 -17.508 6.331 466 HB2 SER 57 HB2 SER 57 -13.247 -19.048 4.810 467 HB3 SER 57 HB1 SER 57 -13.823 -18.191 6.238 468 HG SER 57 HG SER 57 -14.461 -17.830 3.623 469 H ASP 58 HN ASP 58 -11.385 -16.254 3.155 470 HA ASP 58 HA ASP 58 -10.279 -18.508 1.843 471 HB2 ASP 58 HB2 ASP 58 -10.255 -15.560 1.297 472 HB3 ASP 58 HB1 ASP 58 -9.245 -16.641 0.341 473 H TYR 59 HN TYR 59 -9.009 -16.250 4.087 474 HA TYR 59 HA TYR 59 -6.287 -17.243 3.573 475 HB2 TYR 59 HB2 TYR 59 -7.166 -14.704 4.966 476 HB3 TYR 59 HB1 TYR 59 -5.494 -15.215 4.748 477 HD1 TYR 59 HD1 TYR 59 -4.535 -15.319 2.448 478 HD2 TYR 59 HD2 TYR 59 -8.362 -13.628 3.226 479 HE1 TYR 59 HE1 TYR 59 -4.478 -14.203 0.260 480 HE2 TYR 59 HE2 TYR 59 -8.316 -12.505 1.038 481 HH TYR 59 HH TYR 59 -5.952 -13.240 -1.357 482 H ASN 60 HN ASN 60 -8.700 -18.212 5.216 483 HA ASN 60 HA ASN 60 -9.091 -19.342 7.143 484 HB2 ASN 60 HB2 ASN 60 -6.901 -20.403 6.336 485 HB3 ASN 60 HB1 ASN 60 -6.107 -19.428 7.565 486 HD21 ASN 60 HD21 ASN 60 -5.412 -21.281 8.638 487 HD22 ASN 60 HD22 ASN 60 -6.491 -22.241 9.588 488 H ILE 61 HN ILE 61 -9.132 -16.524 7.321 489 HA ILE 61 HA ILE 61 -7.775 -15.750 9.754 490 HB ILE 61 HB ILE 61 -9.868 -14.257 8.160 491 HG12 ILE 61 HG12 ILE 61 -6.862 -13.904 8.162 492 HG13 ILE 61 HG11 ILE 61 -7.756 -14.766 6.916 493 HG21 ILE 61 HG21 ILE 61 -9.070 -12.273 9.360 494 HG22 ILE 61 HG22 ILE 61 -7.986 -13.288 10.310 495 HG23 ILE 61 HG23 ILE 61 -9.731 -13.480 10.464 496 HD11 ILE 61 HD11 ILE 61 -8.033 -11.850 7.602 497 HD12 ILE 61 HD12 ILE 61 -8.954 -12.705 6.369 498 HD13 ILE 61 HD13 ILE 61 -7.210 -12.521 6.194 499 H GLN 62 HN GLN 62 -8.528 -16.066 11.731 500 HA GLN 62 HA GLN 62 -11.378 -16.707 12.076 501 HB2 GLN 62 HB2 GLN 62 -8.954 -17.429 13.726 502 HB3 GLN 62 HB1 GLN 62 -10.600 -17.690 14.278 503 HG2 GLN 62 HG2 GLN 62 -10.926 -19.043 12.145 504 HG3 GLN 62 HG1 GLN 62 -9.169 -18.998 11.992 505 HE21 GLN 62 HE21 GLN 62 -7.908 -20.165 13.433 506 HE22 GLN 62 HE22 GLN 62 -8.574 -21.357 14.496 507 H LYS 63 HN LYS 63 -11.512 -16.317 14.840 508 HA LYS 63 HA LYS 63 -11.889 -13.476 14.919 509 HB2 LYS 63 HB2 LYS 63 -12.919 -13.841 17.064 510 HB3 LYS 63 HB1 LYS 63 -13.461 -15.105 15.969 511 HG2 LYS 63 HG2 LYS 63 -11.807 -16.639 16.974 512 HG3 LYS 63 HG1 LYS 63 -11.363 -15.370 18.118 513 HD2 LYS 63 HD2 LYS 63 -13.812 -15.313 18.777 514 HD3 LYS 63 HD1 LYS 63 -13.994 -16.805 17.857 515 HE2 LYS 63 HE2 LYS 63 -13.566 -17.713 19.899 516 HE3 LYS 63 HE1 LYS 63 -11.904 -17.511 19.344 517 HZ1 LYS 63 HZ1 LYS 63 -11.843 -15.372 20.531 518 HZ2 LYS 63 HZ2 LYS 63 -12.122 -16.679 21.569 519 HZ3 LYS 63 HZ3 LYS 63 -13.400 -15.668 21.125 520 H GLU 64 HN GLU 64 -10.986 -12.026 16.431 521 HA GLU 64 HA GLU 64 -9.310 -10.988 17.532 522 HB2 GLU 64 HB2 GLU 64 -9.005 -13.780 18.595 523 HB3 GLU 64 HB1 GLU 64 -7.897 -12.504 19.081 524 HG2 GLU 64 HG2 GLU 64 -9.355 -12.053 20.694 525 HG3 GLU 64 HG1 GLU 64 -10.362 -11.342 19.433 526 H SER 65 HN SER 65 -8.784 -11.923 14.845 527 HA SER 65 HA SER 65 -5.962 -12.626 14.874 528 HB2 SER 65 HB2 SER 65 -7.785 -12.128 12.509 529 HB3 SER 65 HB1 SER 65 -6.181 -12.855 12.462 530 HG SER 65 HG SER 65 -8.609 -13.966 13.140 531 H THR 66 HN THR 66 -4.362 -11.343 13.849 532 HA THR 66 HA THR 66 -4.899 -8.487 14.082 533 HB THR 66 HB THR 66 -2.258 -9.930 13.781 534 HG1 THR 66 HG1 THR 66 -2.782 -10.413 15.804 535 HG21 THR 66 HG21 THR 66 -2.154 -7.620 12.995 536 HG22 THR 66 HG22 THR 66 -1.275 -7.805 14.512 537 HG23 THR 66 HG23 THR 66 -2.874 -7.064 14.507 538 H LEU 67 HN LEU 67 -5.106 -7.217 12.388 539 HA LEU 67 HA LEU 67 -4.161 -8.169 9.762 540 HB2 LEU 67 HB2 LEU 67 -6.647 -6.760 10.605 541 HB3 LEU 67 HB1 LEU 67 -5.955 -6.308 9.061 542 HG LEU 67 HG LEU 67 -6.000 -8.833 8.528 543 HD11 LEU 67 HD11 LEU 67 -7.743 -10.089 9.679 544 HD12 LEU 67 HD12 LEU 67 -7.997 -8.737 10.782 545 HD13 LEU 67 HD13 LEU 67 -6.464 -9.608 10.794 546 HD21 LEU 67 HD21 LEU 67 -8.539 -7.232 8.774 547 HD22 LEU 67 HD22 LEU 67 -8.334 -8.668 7.773 548 HD23 LEU 67 HD23 LEU 67 -7.412 -7.206 7.421 549 H HIS 68 HN HIS 68 -2.558 -7.015 8.915 550 HA HIS 68 HA HIS 68 -1.811 -4.502 10.184 551 HB2 HIS 68 HB2 HIS 68 -0.392 -6.113 8.046 552 HB3 HIS 68 HB1 HIS 68 0.272 -4.721 8.894 553 HD2 HIS 68 HD2 HIS 68 0.547 -5.215 11.769 554 HE1 HIS 68 HE1 HIS 68 1.050 -9.360 11.085 555 HE2 HIS 68 HE2 HIS 68 1.551 -7.437 12.654 556 H LEU 69 HN LEU 69 -2.164 -2.552 9.311 557 HA LEU 69 HA LEU 69 -3.194 -2.467 6.554 558 HB2 LEU 69 HB2 LEU 69 -4.779 -1.707 8.245 559 HB3 LEU 69 HB1 LEU 69 -3.616 -0.535 8.832 560 HG LEU 69 HG LEU 69 -3.731 0.634 6.650 561 HD11 LEU 69 HD11 LEU 69 -5.553 0.080 5.106 562 HD12 LEU 69 HD12 LEU 69 -5.915 -1.357 6.064 563 HD13 LEU 69 HD13 LEU 69 -4.366 -1.219 5.228 564 HD21 LEU 69 HD21 LEU 69 -6.373 0.238 8.052 565 HD22 LEU 69 HD22 LEU 69 -5.978 1.574 6.968 566 HD23 LEU 69 HD23 LEU 69 -5.114 1.392 8.495 567 H VAL 70 HN VAL 70 -1.629 -1.988 5.199 568 HA VAL 70 HA VAL 70 0.421 -0.026 5.926 569 HB VAL 70 HB VAL 70 0.204 -1.955 3.606 570 HG11 VAL 70 HG11 VAL 70 1.349 -0.036 2.773 571 HG12 VAL 70 HG12 VAL 70 2.556 -1.278 3.107 572 HG13 VAL 70 HG13 VAL 70 2.343 0.069 4.225 573 HG21 VAL 70 HG21 VAL 70 0.725 -2.987 5.758 574 HG22 VAL 70 HG22 VAL 70 2.087 -1.887 5.956 575 HG23 VAL 70 HG23 VAL 70 2.096 -3.073 4.653 576 H LEU 71 HN LEU 71 0.800 1.829 4.660 577 HA LEU 71 HA LEU 71 -1.421 2.589 2.877 578 HB2 LEU 71 HB2 LEU 71 0.360 4.411 4.495 579 HB3 LEU 71 HB1 LEU 71 -0.982 4.905 3.486 580 HG LEU 71 HG LEU 71 -1.246 3.205 5.966 581 HD11 LEU 71 HD11 LEU 71 -1.763 6.144 5.546 582 HD12 LEU 71 HD12 LEU 71 -0.490 5.436 6.541 583 HD13 LEU 71 HD13 LEU 71 -2.184 5.233 6.995 584 HD21 LEU 71 HD21 LEU 71 -3.629 3.676 5.749 585 HD22 LEU 71 HD22 LEU 71 -3.021 2.838 4.321 586 HD23 LEU 71 HD23 LEU 71 -3.325 4.576 4.262 587 H ARG 72 HN ARG 72 -0.933 3.151 0.833 588 HA ARG 72 HA ARG 72 1.850 2.948 0.007 589 HB2 ARG 72 HB2 ARG 72 0.290 1.747 -1.362 590 HB3 ARG 72 HB1 ARG 72 -0.757 3.149 -1.518 591 HG2 ARG 72 HG2 ARG 72 0.925 4.276 -2.869 592 HG3 ARG 72 HG1 ARG 72 2.007 2.893 -2.694 593 HD2 ARG 72 HD2 ARG 72 -0.726 2.401 -3.743 594 HD3 ARG 72 HD1 ARG 72 0.429 3.203 -4.804 595 HE ARG 72 HE ARG 72 1.821 1.069 -3.920 596 HH11 ARG 72 HH11 ARG 72 -1.380 1.374 -5.298 597 HH12 ARG 72 HH12 ARG 72 -1.322 -0.160 -6.100 598 HH21 ARG 72 HH21 ARG 72 1.902 -0.972 -4.988 599 HH22 ARG 72 HH22 ARG 72 0.524 -1.499 -5.913 600 H LEU 73 HN LEU 73 3.100 4.581 -0.692 601 HA LEU 73 HA LEU 73 1.925 7.221 -1.160 602 HB2 LEU 73 HB2 LEU 73 3.872 6.520 0.996 603 HB3 LEU 73 HB1 LEU 73 3.990 8.088 0.223 604 HG LEU 73 HG LEU 73 1.399 8.165 0.858 605 HD11 LEU 73 HD11 LEU 73 1.708 5.811 1.863 606 HD12 LEU 73 HD12 LEU 73 0.825 7.020 2.798 607 HD13 LEU 73 HD13 LEU 73 2.504 6.652 3.193 608 HD21 LEU 73 HD21 LEU 73 3.143 9.774 1.506 609 HD22 LEU 73 HD22 LEU 73 3.630 8.700 2.816 610 HD23 LEU 73 HD23 LEU 73 2.026 9.434 2.827 611 H ARG 74 HN ARG 74 3.298 8.625 -2.395 612 HA ARG 74 HA ARG 74 5.604 7.246 -3.614 613 HB2 ARG 74 HB2 ARG 74 3.559 9.013 -4.958 614 HB3 ARG 74 HB1 ARG 74 5.063 8.510 -5.716 615 HG2 ARG 74 HG2 ARG 74 2.906 6.645 -4.741 616 HG3 ARG 74 HG1 ARG 74 3.143 7.146 -6.415 617 HD2 ARG 74 HD2 ARG 74 4.485 5.381 -6.632 618 HD3 ARG 74 HD1 ARG 74 5.640 6.249 -5.625 619 HE ARG 74 HE ARG 74 4.481 5.099 -3.697 620 HH11 ARG 74 HH11 ARG 74 4.697 3.680 -6.907 621 HH12 ARG 74 HH12 ARG 74 4.493 2.053 -6.324 622 HH21 ARG 74 HH21 ARG 74 4.237 2.950 -2.956 623 HH22 ARG 74 HH22 ARG 74 4.252 1.655 -4.123 624 H GLY 75 HN GLY 75 4.523 9.920 -1.902 625 HA2 GLY 75 HA2 GLY 75 6.706 11.644 -2.829 626 HA3 GLY 75 HA1 GLY 75 5.373 12.135 -1.793 627 H GLY 76 HN GLY 76 8.603 11.140 -1.899 628 HA2 GLY 76 HA2 GLY 76 8.720 11.202 1.020 629 HA3 GLY 76 HA1 GLY 76 9.354 9.774 0.213 630 H1 SER 453 HT1 SER 453 23.304 9.524 16.724 631 H2 SER 453 HT2 SER 453 22.140 9.302 15.525 632 H3 SER 453 HT3 SER 453 23.117 8.008 16.008 633 HA SER 453 HA SER 453 22.149 8.080 18.214 634 HB2 SER 453 HB2 SER 453 19.807 9.562 17.782 635 HB3 SER 453 HB1 SER 453 21.157 9.999 18.828 636 HG SER 453 HG SER 453 20.382 11.397 16.873 637 H ASN 454 HN ASN 454 20.004 8.710 15.410 638 HA ASN 454 HA ASN 454 18.543 7.385 14.274 639 HB2 ASN 454 HB2 ASN 454 20.673 5.876 14.382 640 HB3 ASN 454 HB1 ASN 454 19.744 4.936 15.541 641 HD21 ASN 454 HD21 ASN 454 18.089 3.669 14.840 642 HD22 ASN 454 HD22 ASN 454 17.751 3.394 13.164 643 H SER 455 HN SER 455 18.353 7.973 17.361 644 HA SER 455 HA SER 455 16.889 6.080 18.692 645 HB2 SER 455 HB2 SER 455 15.895 8.738 19.263 646 HB3 SER 455 HB1 SER 455 16.889 7.675 20.263 647 HG SER 455 HG SER 455 17.805 9.792 19.502 648 H GLN 456 HN GLN 456 15.550 8.697 16.657 649 HA GLN 456 HA GLN 456 12.855 7.859 17.070 650 HB2 GLN 456 HB2 GLN 456 14.150 9.735 15.106 651 HB3 GLN 456 HB1 GLN 456 12.434 9.363 15.034 652 HG2 GLN 456 HG2 GLN 456 13.852 10.532 17.416 653 HG3 GLN 456 HG1 GLN 456 12.902 11.442 16.241 654 HE21 GLN 456 HE21 GLN 456 12.576 10.975 19.158 655 HE22 GLN 456 HE22 GLN 456 10.960 10.382 19.328 656 H LEU 457 HN LEU 457 15.252 7.276 14.565 657 HA LEU 457 HA LEU 457 13.529 6.011 12.732 658 HB2 LEU 457 HB2 LEU 457 16.497 5.614 13.110 659 HB3 LEU 457 HB1 LEU 457 15.572 5.140 11.697 660 HG LEU 457 HG LEU 457 15.989 7.984 12.639 661 HD11 LEU 457 HD11 LEU 457 17.365 8.200 10.620 662 HD12 LEU 457 HD12 LEU 457 17.175 6.472 10.314 663 HD13 LEU 457 HD13 LEU 457 18.033 7.027 11.753 664 HD21 LEU 457 HD21 LEU 457 13.849 7.710 11.524 665 HD22 LEU 457 HD22 LEU 457 14.639 6.899 10.171 666 HD23 LEU 457 HD23 LEU 457 14.971 8.601 10.495 667 H ASN 458 HN ASN 458 15.389 4.794 15.469 668 HA ASN 458 HA ASN 458 15.014 2.041 14.948 669 HB2 ASN 458 HB2 ASN 458 15.703 3.616 17.410 670 HB3 ASN 458 HB1 ASN 458 15.344 1.899 17.539 671 HD21 ASN 458 HD21 ASN 458 16.560 0.525 15.923 672 HD22 ASN 458 HD22 ASN 458 18.240 0.905 15.700 673 H ALA 459 HN ALA 459 13.227 4.289 17.042 674 HA ALA 459 HA ALA 459 11.340 2.453 17.999 675 HB1 ALA 459 HB1 ALA 459 11.702 4.655 18.997 676 HB2 ALA 459 HB2 ALA 459 10.002 4.397 18.605 677 HB3 ALA 459 HB3 ALA 459 11.003 5.418 17.573 678 H MET 460 HN MET 460 11.284 4.557 15.157 679 HA MET 460 HA MET 460 8.646 3.887 14.372 680 HB2 MET 460 HB2 MET 460 10.980 5.130 12.952 681 HB3 MET 460 HB1 MET 460 9.481 4.775 12.101 682 HG2 MET 460 HG2 MET 460 8.298 6.131 13.875 683 HG3 MET 460 HG1 MET 460 9.895 6.647 14.416 684 HE1 MET 460 HE1 MET 460 11.223 8.807 11.541 685 HE2 MET 460 HE2 MET 460 11.623 7.132 11.930 686 HE3 MET 460 HE3 MET 460 11.401 8.310 13.224 687 H ALA 461 HN ALA 461 11.813 2.551 13.572 688 HA ALA 461 HA ALA 461 10.912 0.806 11.531 689 HB1 ALA 461 HB1 ALA 461 13.323 0.558 13.326 690 HB2 ALA 461 HB2 ALA 461 13.268 1.396 11.777 691 HB3 ALA 461 HB3 ALA 461 13.046 -0.351 11.841 692 H HIS 462 HN HIS 462 11.171 0.554 15.020 693 HA HIS 462 HA HIS 462 10.743 -2.193 15.324 694 HB2 HIS 462 HB2 HIS 462 11.356 -0.377 17.080 695 HB3 HIS 462 HB1 HIS 462 9.618 -0.162 17.239 696 HD2 HIS 462 HD2 HIS 462 8.243 -2.542 18.127 697 HE1 HIS 462 HE1 HIS 462 11.762 -4.106 19.875 698 HE2 HIS 462 HE2 HIS 462 9.229 -4.180 19.877 699 H GLN 463 HN GLN 463 8.507 0.484 14.918 700 HA GLN 463 HA GLN 463 6.106 -0.891 15.400 701 HB2 GLN 463 HB2 GLN 463 6.734 1.517 13.692 702 HB3 GLN 463 HB1 GLN 463 5.097 0.929 13.944 703 HG2 GLN 463 HG2 GLN 463 6.956 1.789 16.144 704 HG3 GLN 463 HG1 GLN 463 5.719 2.813 15.417 705 HE21 GLN 463 HE21 GLN 463 3.529 2.277 15.736 706 HE22 GLN 463 HE22 GLN 463 3.031 1.285 17.063 707 H ILE 464 HN ILE 464 8.048 -0.464 12.497 708 HA ILE 464 HA ILE 464 6.204 -1.754 10.744 709 HB ILE 464 HB ILE 464 9.163 -1.246 10.393 710 HG12 ILE 464 HG12 ILE 464 6.789 0.332 9.381 711 HG13 ILE 464 HG11 ILE 464 7.765 0.782 10.775 712 HG21 ILE 464 HG21 ILE 464 8.631 -1.431 7.960 713 HG22 ILE 464 HG22 ILE 464 7.038 -2.045 8.410 714 HG23 ILE 464 HG23 ILE 464 8.489 -2.947 8.851 715 HD11 ILE 464 HD11 ILE 464 8.413 2.058 8.836 716 HD12 ILE 464 HD12 ILE 464 8.709 0.575 7.928 717 HD13 ILE 464 HD13 ILE 464 9.723 0.977 9.313 718 H GLN 465 HN GLN 465 8.865 -2.810 12.759 719 HA GLN 465 HA GLN 465 9.290 -5.346 11.624 720 HB2 GLN 465 HB2 GLN 465 10.751 -4.188 13.330 721 HB3 GLN 465 HB1 GLN 465 9.576 -4.655 14.552 722 HG2 GLN 465 HG2 GLN 465 11.217 -6.291 14.687 723 HG3 GLN 465 HG1 GLN 465 9.940 -7.044 13.734 724 HE21 GLN 465 HE21 GLN 465 10.241 -7.270 11.477 725 HE22 GLN 465 HE22 GLN 465 11.827 -7.253 10.781 726 H GLU 466 HN GLU 466 6.955 -4.186 13.981 727 HA GLU 466 HA GLU 466 5.957 -6.803 14.605 728 HB2 GLU 466 HB2 GLU 466 4.831 -4.053 15.163 729 HB3 GLU 466 HB1 GLU 466 4.139 -5.552 15.772 730 HG2 GLU 466 HG2 GLU 466 6.928 -4.576 16.362 731 HG3 GLU 466 HG1 GLU 466 5.538 -4.386 17.429 732 H MET 467 HN MET 467 5.399 -4.478 12.156 733 HA MET 467 HA MET 467 2.802 -5.517 11.407 734 HB2 MET 467 HB2 MET 467 4.615 -3.518 10.037 735 HB3 MET 467 HB1 MET 467 2.992 -3.931 9.506 736 HG2 MET 467 HG2 MET 467 3.398 -2.959 12.288 737 HG3 MET 467 HG1 MET 467 3.439 -1.803 10.958 738 HE1 MET 467 HE1 MET 467 1.367 -2.723 8.884 739 HE2 MET 467 HE2 MET 467 1.405 -1.089 9.543 740 HE3 MET 467 HE3 MET 467 -0.116 -1.973 9.474 741 H PHE 468 HN PHE 468 6.148 -5.837 10.516 742 HA PHE 468 HA PHE 468 5.409 -8.003 8.677 743 HB2 PHE 468 HB2 PHE 468 7.180 -5.657 8.150 744 HB3 PHE 468 HB1 PHE 468 7.629 -7.211 7.456 745 HD1 PHE 468 HD2 PHE 468 6.163 -8.311 5.821 746 HD2 PHE 468 HD1 PHE 468 5.320 -4.416 7.321 747 HE1 PHE 468 HE2 PHE 468 4.585 -7.946 3.971 748 HE2 PHE 468 HE1 PHE 468 3.740 -4.047 5.472 749 HZ PHE 468 HZ PHE 468 3.370 -5.809 3.798 750 HA PRO 469 HA PRO 469 8.431 -9.655 11.658 751 HB2 PRO 469 HB2 PRO 469 7.291 -12.089 11.909 752 HB3 PRO 469 HB1 PRO 469 6.664 -10.666 12.761 753 HG2 PRO 469 HG2 PRO 469 5.627 -12.019 10.337 754 HG3 PRO 469 HG1 PRO 469 4.751 -11.252 11.673 755 HD2 PRO 469 HD2 PRO 469 5.209 -10.087 9.200 756 HD3 PRO 469 HD1 PRO 469 4.795 -9.210 10.687 757 H GLN 470 HN GLN 470 8.419 -9.696 8.590 758 HA GLN 470 HA GLN 470 10.251 -11.968 8.337 759 HB2 GLN 470 HB2 GLN 470 9.312 -12.394 6.042 760 HB3 GLN 470 HB1 GLN 470 8.245 -12.820 7.373 761 HG2 GLN 470 HG2 GLN 470 7.037 -10.699 7.051 762 HG3 GLN 470 HG1 GLN 470 8.075 -10.345 5.667 763 HE21 GLN 470 HE21 GLN 470 7.737 -11.404 3.747 764 HE22 GLN 470 HE22 GLN 470 6.360 -12.404 3.450 765 H VAL 471 HN VAL 471 10.539 -9.008 8.606 766 HA VAL 471 HA VAL 471 12.132 -8.624 6.167 767 HB VAL 471 HB VAL 471 10.090 -7.221 6.058 768 HG11 VAL 471 HG11 VAL 471 9.831 -5.297 7.542 769 HG12 VAL 471 HG12 VAL 471 11.222 -5.835 8.486 770 HG13 VAL 471 HG13 VAL 471 9.756 -6.816 8.440 771 HG21 VAL 471 HG21 VAL 471 12.076 -6.494 4.887 772 HG22 VAL 471 HG22 VAL 471 12.680 -5.704 6.344 773 HG23 VAL 471 HG23 VAL 471 11.228 -5.096 5.549 774 HA PRO 472 HA PRO 472 15.478 -8.194 9.070 775 HB2 PRO 472 HB2 PRO 472 16.711 -6.708 6.803 776 HB3 PRO 472 HB1 PRO 472 17.336 -8.092 7.721 777 HG2 PRO 472 HG2 PRO 472 16.443 -8.438 5.269 778 HG3 PRO 472 HG1 PRO 472 16.087 -9.626 6.541 779 HD2 PRO 472 HD2 PRO 472 14.304 -7.520 5.383 780 HD3 PRO 472 HD1 PRO 472 13.931 -9.196 5.838 781 H TYR 473 HN TYR 473 15.777 -6.745 10.587 782 HA TYR 473 HA TYR 473 14.506 -4.268 10.701 783 HB2 TYR 473 HB2 TYR 473 15.273 -5.687 12.623 784 HB3 TYR 473 HB1 TYR 473 16.913 -5.144 12.302 785 HD1 TYR 473 HD2 TYR 473 13.526 -3.945 13.249 786 HD2 TYR 473 HD1 TYR 473 17.705 -3.135 13.219 787 HE1 TYR 473 HE2 TYR 473 13.159 -2.014 14.728 788 HE2 TYR 473 HE1 TYR 473 17.346 -1.206 14.698 789 HH TYR 473 HH TYR 473 14.356 -0.627 16.282 790 H HIS 474 HN HIS 474 17.837 -5.093 9.830 791 HA HIS 474 HA HIS 474 18.793 -2.429 9.798 792 HB2 HIS 474 HB2 HIS 474 20.769 -3.270 8.763 793 HB3 HIS 474 HB1 HIS 474 20.231 -4.494 9.900 794 HD2 HIS 474 HD2 HIS 474 20.789 -3.985 6.106 795 HE1 HIS 474 HE1 HIS 474 19.618 -7.996 6.774 796 HE2 HIS 474 HE2 HIS 474 20.623 -6.375 5.109 797 H LEU 475 HN LEU 475 17.150 -4.385 7.407 798 HA LEU 475 HA LEU 475 17.671 -2.610 5.229 799 HB2 LEU 475 HB2 LEU 475 15.846 -4.943 5.652 800 HB3 LEU 475 HB1 LEU 475 15.627 -3.913 4.254 801 HG LEU 475 HG LEU 475 18.137 -5.448 4.926 802 HD11 LEU 475 HD11 LEU 475 16.183 -6.799 4.166 803 HD12 LEU 475 HD12 LEU 475 17.579 -6.870 3.094 804 HD13 LEU 475 HD13 LEU 475 16.191 -5.870 2.669 805 HD21 LEU 475 HD21 LEU 475 18.752 -3.436 3.787 806 HD22 LEU 475 HD22 LEU 475 17.456 -3.643 2.611 807 HD23 LEU 475 HD23 LEU 475 18.821 -4.758 2.621 808 H VAL 476 HN VAL 476 15.233 -2.879 7.697 809 HA VAL 476 HA VAL 476 13.306 -1.162 6.515 810 HB VAL 476 HB VAL 476 13.774 -1.713 9.458 811 HG11 VAL 476 HG11 VAL 476 11.429 -1.073 9.733 812 HG12 VAL 476 HG12 VAL 476 11.335 -0.683 8.018 813 HG13 VAL 476 HG13 VAL 476 12.386 0.254 9.077 814 HG21 VAL 476 HG21 VAL 476 11.988 -3.104 7.465 815 HG22 VAL 476 HG22 VAL 476 11.976 -3.383 9.206 816 HG23 VAL 476 HG23 VAL 476 13.409 -3.784 8.259 817 H LEU 477 HN LEU 477 16.054 -0.675 8.661 818 HA LEU 477 HA LEU 477 15.643 2.057 9.210 819 HB2 LEU 477 HB2 LEU 477 18.195 0.443 9.140 820 HB3 LEU 477 HB1 LEU 477 18.069 2.067 9.787 821 HG LEU 477 HG LEU 477 16.549 -0.309 10.867 822 HD11 LEU 477 HD11 LEU 477 18.143 -0.290 12.699 823 HD12 LEU 477 HD12 LEU 477 19.043 1.015 11.929 824 HD13 LEU 477 HD13 LEU 477 18.968 -0.574 11.169 825 HD21 LEU 477 HD21 LEU 477 15.427 1.762 11.335 826 HD22 LEU 477 HD22 LEU 477 16.933 2.509 11.867 827 HD23 LEU 477 HD23 LEU 477 16.214 1.202 12.810 828 H GLN 478 HN GLN 478 16.899 0.407 6.443 829 HA GLN 478 HA GLN 478 18.409 2.497 5.308 830 HB2 GLN 478 HB2 GLN 478 18.633 0.201 4.522 831 HB3 GLN 478 HB1 GLN 478 16.960 0.202 3.977 832 HG2 GLN 478 HG2 GLN 478 17.622 2.121 2.451 833 HG3 GLN 478 HG1 GLN 478 19.290 1.711 2.838 834 HE21 GLN 478 HE21 GLN 478 16.728 -0.659 2.536 835 HE22 GLN 478 HE22 GLN 478 17.322 -1.387 1.085 836 H ASP 479 HN ASP 479 15.068 1.436 4.628 837 HA ASP 479 HA ASP 479 14.499 3.546 2.832 838 HB2 ASP 479 HB2 ASP 479 13.203 1.408 2.992 839 HB3 ASP 479 HB1 ASP 479 12.508 1.999 4.498 840 H LEU 480 HN LEU 480 14.241 3.221 6.301 841 HA LEU 480 HA LEU 480 12.622 5.431 6.853 842 HB2 LEU 480 HB2 LEU 480 14.371 3.653 8.327 843 HB3 LEU 480 HB1 LEU 480 14.451 5.287 8.950 844 HG LEU 480 HG LEU 480 12.806 3.995 10.179 845 HD11 LEU 480 HD11 LEU 480 11.415 5.979 8.388 846 HD12 LEU 480 HD12 LEU 480 12.419 6.406 9.773 847 HD13 LEU 480 HD13 LEU 480 10.932 5.490 10.012 848 HD21 LEU 480 HD21 LEU 480 12.265 2.384 8.402 849 HD22 LEU 480 HD22 LEU 480 11.384 3.645 7.542 850 HD23 LEU 480 HD23 LEU 480 10.819 3.095 9.120 851 H GLN 481 HN GLN 481 15.981 5.241 5.964 852 HA GLN 481 HA GLN 481 16.429 8.046 6.653 853 HB2 GLN 481 HB2 GLN 481 18.317 6.003 5.466 854 HB3 GLN 481 HB1 GLN 481 18.760 7.624 5.982 855 HG2 GLN 481 HG2 GLN 481 18.100 7.032 8.284 856 HG3 GLN 481 HG1 GLN 481 17.766 5.389 7.738 857 HE21 GLN 481 HE21 GLN 481 19.303 4.407 8.980 858 HE22 GLN 481 HE22 GLN 481 21.001 4.608 8.730 859 H LEU 482 HN LEU 482 14.971 6.509 4.219 860 HA LEU 482 HA LEU 482 16.039 8.304 2.142 861 HB2 LEU 482 HB2 LEU 482 15.069 5.518 2.094 862 HB3 LEU 482 HB1 LEU 482 14.530 6.516 0.759 863 HG LEU 482 HG LEU 482 16.540 5.267 0.167 864 HD11 LEU 482 HD11 LEU 482 17.851 7.077 -0.708 865 HD12 LEU 482 HD12 LEU 482 17.175 8.195 0.473 866 HD13 LEU 482 HD13 LEU 482 16.146 7.516 -0.786 867 HD21 LEU 482 HD21 LEU 482 17.582 4.979 2.303 868 HD22 LEU 482 HD22 LEU 482 17.778 6.722 2.501 869 HD23 LEU 482 HD23 LEU 482 18.700 5.866 1.263 870 H THR 483 HN THR 483 12.982 6.796 3.218 871 HA THR 483 HA THR 483 11.491 8.929 1.892 872 HB THR 483 HB THR 483 9.506 7.631 2.385 873 HG1 THR 483 HG1 THR 483 10.635 5.404 3.448 874 HG21 THR 483 HG21 THR 483 10.039 5.556 1.184 875 HG22 THR 483 HG22 THR 483 11.760 5.856 1.431 876 HG23 THR 483 HG23 THR 483 10.807 6.952 0.428 877 H ARG 484 HN ARG 484 12.392 7.823 5.052 878 HA ARG 484 HA ARG 484 12.277 8.725 7.125 879 HB2 ARG 484 HB2 ARG 484 11.242 11.230 5.786 880 HB3 ARG 484 HB1 ARG 484 11.867 11.111 7.421 881 HG2 ARG 484 HG2 ARG 484 13.779 11.826 6.515 882 HG3 ARG 484 HG1 ARG 484 13.963 10.157 5.970 883 HD2 ARG 484 HD2 ARG 484 13.098 10.663 3.827 884 HD3 ARG 484 HD1 ARG 484 12.528 12.246 4.352 885 HE ARG 484 HE ARG 484 15.272 12.220 4.716 886 HH11 ARG 484 HH11 ARG 484 13.031 11.883 2.039 887 HH12 ARG 484 HH12 ARG 484 14.095 12.625 0.893 888 HH21 ARG 484 HH21 ARG 484 16.674 13.203 3.193 889 HH22 ARG 484 HH22 ARG 484 16.160 13.377 1.546 890 H SER 485 HN SER 485 9.782 7.733 5.475 891 HA SER 485 HA SER 485 7.880 8.328 7.623 892 HB2 SER 485 HB2 SER 485 7.629 9.494 5.181 893 HB3 SER 485 HB1 SER 485 6.704 8.015 4.935 894 HG SER 485 HG SER 485 5.471 8.559 6.793 895 H VAL 486 HN VAL 486 7.316 6.501 8.557 896 HA VAL 486 HA VAL 486 8.020 3.954 7.745 897 HB VAL 486 HB VAL 486 6.313 3.123 9.374 898 HG11 VAL 486 HG11 VAL 486 7.877 5.373 10.589 899 HG12 VAL 486 HG12 VAL 486 8.675 3.947 9.923 900 HG13 VAL 486 HG13 VAL 486 7.529 3.778 11.254 901 HG21 VAL 486 HG21 VAL 486 4.620 4.847 9.066 902 HG22 VAL 486 HG22 VAL 486 5.716 6.061 9.728 903 HG23 VAL 486 HG23 VAL 486 5.119 4.756 10.754 904 H GLU 487 HN GLU 487 5.152 5.788 6.957 905 HA GLU 487 HA GLU 487 3.511 3.715 6.033 906 HB2 GLU 487 HB2 GLU 487 3.644 6.535 4.954 907 HB3 GLU 487 HB1 GLU 487 2.275 5.435 4.863 908 HG2 GLU 487 HG2 GLU 487 1.562 6.598 6.646 909 HG3 GLU 487 HG1 GLU 487 2.631 5.507 7.525 910 H ILE 488 HN ILE 488 5.747 5.808 4.241 911 HA ILE 488 HA ILE 488 5.368 4.553 1.729 912 HB ILE 488 HB ILE 488 7.920 5.951 2.482 913 HG12 ILE 488 HG12 ILE 488 5.402 7.395 1.650 914 HG13 ILE 488 HG11 ILE 488 5.894 7.238 3.330 915 HG21 ILE 488 HG21 ILE 488 6.288 5.887 -0.054 916 HG22 ILE 488 HG22 ILE 488 7.759 4.963 0.257 917 HG23 ILE 488 HG23 ILE 488 7.825 6.724 0.165 918 HD11 ILE 488 HD11 ILE 488 7.661 8.452 1.232 919 HD12 ILE 488 HD12 ILE 488 7.813 8.551 2.987 920 HD13 ILE 488 HD13 ILE 488 6.494 9.388 2.169 921 H THR 489 HN THR 489 7.367 3.887 4.467 922 HA THR 489 HA THR 489 9.337 2.282 3.256 923 HB THR 489 HB THR 489 8.284 2.101 6.085 924 HG1 THR 489 HG1 THR 489 10.195 3.771 4.813 925 HG21 THR 489 HG21 THR 489 9.602 0.178 5.673 926 HG22 THR 489 HG22 THR 489 10.672 1.316 6.497 927 HG23 THR 489 HG23 THR 489 10.789 1.097 4.751 928 H THR 490 HN THR 490 6.419 1.305 5.076 929 HA THR 490 HA THR 490 6.654 -1.440 4.570 930 HB THR 490 HB THR 490 3.984 -1.186 4.796 931 HG1 THR 490 HG1 THR 490 4.334 1.205 4.752 932 HG21 THR 490 HG21 THR 490 5.532 -2.349 6.337 933 HG22 THR 490 HG22 THR 490 4.260 -1.463 7.177 934 HG23 THR 490 HG23 THR 490 5.894 -0.801 7.100 935 H ASP 491 HN ASP 491 5.210 1.164 2.761 936 HA ASP 491 HA ASP 491 3.864 -0.383 0.817 937 HB2 ASP 491 HB2 ASP 491 3.299 1.943 1.213 938 HB3 ASP 491 HB1 ASP 491 4.924 2.450 0.774 939 H ASN 492 HN ASN 492 6.996 1.300 0.795 940 HA ASN 492 HA ASN 492 7.852 0.554 -1.746 941 HB2 ASN 492 HB2 ASN 492 9.240 1.389 0.764 942 HB3 ASN 492 HB1 ASN 492 10.215 0.720 -0.538 943 HD21 ASN 492 HD21 ASN 492 10.535 3.300 0.377 944 HD22 ASN 492 HD22 ASN 492 10.039 4.404 -0.875 945 H ILE 493 HN ILE 493 8.136 -1.169 1.325 946 HA ILE 493 HA ILE 493 9.810 -3.254 0.432 947 HB ILE 493 HB ILE 493 7.749 -3.235 2.647 948 HG12 ILE 493 HG12 ILE 493 10.761 -3.043 2.816 949 HG13 ILE 493 HG11 ILE 493 9.697 -1.640 2.801 950 HG21 ILE 493 HG21 ILE 493 8.901 -5.217 3.526 951 HG22 ILE 493 HG22 ILE 493 9.917 -5.261 2.086 952 HG23 ILE 493 HG23 ILE 493 8.178 -5.526 1.949 953 HD11 ILE 493 HD11 ILE 493 10.428 -2.277 5.058 954 HD12 ILE 493 HD12 ILE 493 9.621 -3.833 4.861 955 HD13 ILE 493 HD13 ILE 493 8.681 -2.342 4.863 956 H LEU 494 HN LEU 494 6.293 -2.875 0.450 957 HA LEU 494 HA LEU 494 5.753 -5.503 -0.536 958 HB2 LEU 494 HB2 LEU 494 4.103 -2.999 -0.306 959 HB3 LEU 494 HB1 LEU 494 3.474 -4.461 -1.044 960 HG LEU 494 HG LEU 494 4.632 -4.616 1.709 961 HD11 LEU 494 HD11 LEU 494 1.761 -3.893 1.227 962 HD12 LEU 494 HD12 LEU 494 2.995 -2.672 1.546 963 HD13 LEU 494 HD13 LEU 494 2.651 -3.913 2.748 964 HD21 LEU 494 HD21 LEU 494 3.726 -6.526 0.130 965 HD22 LEU 494 HD22 LEU 494 2.165 -5.996 0.784 966 HD23 LEU 494 HD23 LEU 494 3.441 -6.555 1.871 967 H GLU 495 HN GLU 495 6.311 -2.368 -1.975 968 HA GLU 495 HA GLU 495 5.471 -2.999 -4.608 969 HB2 GLU 495 HB2 GLU 495 7.445 -0.950 -3.589 970 HB3 GLU 495 HB1 GLU 495 6.895 -1.040 -5.257 971 HG2 GLU 495 HG2 GLU 495 5.080 -0.641 -2.899 972 HG3 GLU 495 HG1 GLU 495 5.745 0.667 -3.876 973 H GLY 496 HN GLY 496 8.660 -2.929 -3.070 974 HA2 GLY 496 HA2 GLY 496 10.021 -4.983 -3.687 975 HA3 GLY 496 HA1 GLY 496 9.709 -4.489 -5.345 976 H ARG 497 HN ARG 497 10.239 -2.094 -2.880 977 HA ARG 497 HA ARG 497 12.605 -1.183 -4.283 978 HB2 ARG 497 HB2 ARG 497 10.628 0.033 -2.673 979 HB3 ARG 497 HB1 ARG 497 12.145 0.204 -1.801 980 HG2 ARG 497 HG2 ARG 497 12.101 2.113 -3.087 981 HG3 ARG 497 HG1 ARG 497 13.074 1.022 -4.075 982 HD2 ARG 497 HD2 ARG 497 11.577 1.954 -5.599 983 HD3 ARG 497 HD1 ARG 497 10.858 0.392 -5.209 984 HE ARG 497 HE ARG 497 9.767 2.219 -3.438 985 HH11 ARG 497 HH11 ARG 497 9.794 1.703 -6.906 986 HH12 ARG 497 HH12 ARG 497 8.293 2.536 -7.161 987 HH21 ARG 497 HH21 ARG 497 7.782 3.269 -3.770 988 HH22 ARG 497 HH22 ARG 497 7.147 3.419 -5.382 989 H ILE 498 HN ILE 498 11.742 -2.886 -1.411 990 HA ILE 498 HA ILE 498 14.583 -3.171 -0.703 991 HB ILE 498 HB ILE 498 12.197 -3.196 1.168 992 HG12 ILE 498 HG12 ILE 498 13.957 -1.362 2.159 993 HG13 ILE 498 HG11 ILE 498 14.210 -1.173 0.425 994 HG21 ILE 498 HG21 ILE 498 13.793 -3.549 2.976 995 HG22 ILE 498 HG22 ILE 498 15.112 -3.640 1.810 996 HG23 ILE 498 HG23 ILE 498 13.857 -4.876 1.816 997 HD11 ILE 498 HD11 ILE 498 11.632 -0.863 1.941 998 HD12 ILE 498 HD12 ILE 498 11.751 -0.866 0.181 999 HD13 ILE 498 HD13 ILE 498 12.559 0.392 1.116 1000 H GLN 499 HN GLN 499 15.274 -5.171 -1.126 1001 HA GLN 499 HA GLN 499 13.490 -7.264 -1.818 1002 HB2 GLN 499 HB2 GLN 499 16.466 -7.186 -1.368 1003 HB3 GLN 499 HB1 GLN 499 15.617 -8.671 -1.786 1004 HG2 GLN 499 HG2 GLN 499 15.836 -6.161 -3.427 1005 HG3 GLN 499 HG1 GLN 499 16.525 -7.744 -3.783 1006 HE21 GLN 499 HE21 GLN 499 14.742 -6.095 -5.379 1007 HE22 GLN 499 HE22 GLN 499 13.328 -7.044 -5.673 1008 H VAL 500 HN VAL 500 12.833 -9.017 -0.744 1009 HA VAL 500 HA VAL 500 13.050 -8.951 2.151 1010 HB VAL 500 HB VAL 500 11.398 -10.861 2.024 1011 HG11 VAL 500 HG11 VAL 500 10.642 -8.586 2.398 1012 HG12 VAL 500 HG12 VAL 500 9.504 -9.435 1.354 1013 HG13 VAL 500 HG13 VAL 500 10.639 -8.279 0.661 1014 HG21 VAL 500 HG21 VAL 500 11.423 -10.187 -0.916 1015 HG22 VAL 500 HG22 VAL 500 10.256 -11.238 -0.115 1016 HG23 VAL 500 HG23 VAL 500 11.956 -11.703 -0.187 1017 HA PRO 501 HA PRO 501 15.969 -12.228 2.783 1018 HB2 PRO 501 HB2 PRO 501 13.847 -13.914 4.035 1019 HB3 PRO 501 HB1 PRO 501 15.418 -13.411 4.686 1020 HG2 PRO 501 HG2 PRO 501 13.192 -12.297 5.567 1021 HG3 PRO 501 HG1 PRO 501 14.662 -11.333 5.311 1022 HD2 PRO 501 HD2 PRO 501 12.200 -11.494 3.640 1023 HD3 PRO 501 HD1 PRO 501 13.228 -10.095 4.003 1024 H PHE 502 HN PHE 502 16.362 -12.931 0.724 1025 HA PHE 502 HA PHE 502 14.720 -15.151 -0.287 1026 HB2 PHE 502 HB2 PHE 502 14.796 -13.160 -1.748 1027 HB3 PHE 502 HB1 PHE 502 16.549 -13.257 -1.793 1028 HD1 PHE 502 HD1 PHE 502 13.433 -14.956 -2.819 1029 HD2 PHE 502 HD2 PHE 502 17.654 -14.702 -3.295 1030 HE1 PHE 502 HE1 PHE 502 13.294 -16.415 -4.791 1031 HE2 PHE 502 HE2 PHE 502 17.522 -16.164 -5.271 1032 HZ PHE 502 HZ PHE 502 15.339 -17.023 -6.021 1033 HA PRO 503 HA PRO 503 18.122 -17.824 0.722 1034 HB2 PRO 503 HB2 PRO 503 17.508 -19.808 -1.113 1035 HB3 PRO 503 HB1 PRO 503 16.772 -19.655 0.494 1036 HG2 PRO 503 HG2 PRO 503 15.714 -18.813 -2.153 1037 HG3 PRO 503 HG1 PRO 503 14.864 -19.524 -0.769 1038 HD2 PRO 503 HD2 PRO 503 14.710 -16.903 -1.311 1039 HD3 PRO 503 HD1 PRO 503 14.720 -17.514 0.356 1040 H THR 504 HN THR 504 20.117 -17.381 0.086 1041 HA THR 504 HA THR 504 20.898 -17.835 -2.666 1042 HB THR 504 HB THR 504 20.282 -15.413 -2.595 1043 HG1 THR 504 HG1 THR 504 22.930 -16.286 -3.056 1044 HG21 THR 504 HG21 THR 504 20.830 -14.924 -0.275 1045 HG22 THR 504 HG22 THR 504 21.749 -13.870 -1.348 1046 HG23 THR 504 HG23 THR 504 22.536 -15.251 -0.591 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 -18.661 -10.483 14.574 2 H2 MET 1 HT2 MET 1 -18.828 -12.114 14.142 3 H3 MET 1 HT3 MET 1 -17.903 -11.076 13.180 4 HA MET 1 HA MET 1 -17.281 -11.850 15.966 5 HB2 MET 1 HB2 MET 1 -15.542 -13.219 15.118 6 HB3 MET 1 HB1 MET 1 -16.966 -13.626 14.179 7 HG2 MET 1 HG2 MET 1 -16.133 -12.104 12.391 8 HG3 MET 1 HG1 MET 1 -14.648 -11.920 13.322 9 HE1 MET 1 HE1 MET 1 -13.480 -14.201 10.370 10 HE2 MET 1 HE2 MET 1 -13.219 -12.695 11.251 11 HE3 MET 1 HE3 MET 1 -14.675 -12.906 10.280 12 H GLN 2 HN GLN 2 -15.338 -10.935 16.788 13 HA GLN 2 HA GLN 2 -14.716 -8.374 15.507 14 HB2 GLN 2 HB2 GLN 2 -14.523 -9.356 18.337 15 HB3 GLN 2 HB1 GLN 2 -13.669 -7.909 17.815 16 HG2 GLN 2 HG2 GLN 2 -16.583 -8.170 17.252 17 HG3 GLN 2 HG1 GLN 2 -16.046 -7.748 18.876 18 HE21 GLN 2 HE21 GLN 2 -17.490 -6.241 16.722 19 HE22 GLN 2 HE22 GLN 2 -16.583 -4.770 16.549 20 H ILE 3 HN ILE 3 -12.777 -7.872 14.783 21 HA ILE 3 HA ILE 3 -10.552 -9.730 15.298 22 HB ILE 3 HB ILE 3 -9.654 -9.101 13.058 23 HG12 ILE 3 HG12 ILE 3 -12.417 -8.012 12.496 24 HG13 ILE 3 HG11 ILE 3 -11.052 -6.983 12.914 25 HG21 ILE 3 HG21 ILE 3 -11.221 -10.520 11.765 26 HG22 ILE 3 HG22 ILE 3 -12.349 -10.453 13.121 27 HG23 ILE 3 HG23 ILE 3 -10.769 -11.210 13.322 28 HD11 ILE 3 HD11 ILE 3 -11.104 -8.857 10.563 29 HD12 ILE 3 HD12 ILE 3 -9.869 -7.658 10.946 30 HD13 ILE 3 HD13 ILE 3 -11.489 -7.137 10.484 31 H PHE 4 HN PHE 4 -8.381 -8.623 14.908 32 HA PHE 4 HA PHE 4 -8.531 -5.884 15.991 33 HB2 PHE 4 HB2 PHE 4 -6.264 -7.855 16.343 34 HB3 PHE 4 HB1 PHE 4 -6.434 -6.287 17.125 35 HD1 PHE 4 HD1 PHE 4 -8.525 -5.975 18.626 36 HD2 PHE 4 HD2 PHE 4 -6.987 -9.760 17.424 37 HE1 PHE 4 HE1 PHE 4 -9.676 -7.041 20.521 38 HE2 PHE 4 HE2 PHE 4 -8.137 -10.833 19.317 39 HZ PHE 4 HZ PHE 4 -9.482 -9.474 20.869 40 H VAL 5 HN VAL 5 -8.071 -4.432 14.472 41 HA VAL 5 HA VAL 5 -6.052 -5.128 12.443 42 HB VAL 5 HB VAL 5 -8.106 -2.906 12.343 43 HG11 VAL 5 HG11 VAL 5 -7.478 -2.770 9.964 44 HG12 VAL 5 HG12 VAL 5 -6.215 -3.969 10.248 45 HG13 VAL 5 HG13 VAL 5 -6.129 -2.394 11.037 46 HG21 VAL 5 HG21 VAL 5 -9.249 -5.015 12.231 47 HG22 VAL 5 HG22 VAL 5 -8.094 -5.628 11.048 48 HG23 VAL 5 HG23 VAL 5 -9.192 -4.322 10.609 49 H LYS 6 HN LYS 6 -4.092 -4.299 12.788 50 HA LYS 6 HA LYS 6 -3.887 -1.912 14.494 51 HB2 LYS 6 HB2 LYS 6 -2.620 -4.280 14.789 52 HB3 LYS 6 HB1 LYS 6 -1.440 -3.426 13.802 53 HG2 LYS 6 HG2 LYS 6 -1.408 -1.601 15.443 54 HG3 LYS 6 HG1 LYS 6 -2.560 -2.492 16.437 55 HD2 LYS 6 HD2 LYS 6 -0.883 -4.376 16.484 56 HD3 LYS 6 HD1 LYS 6 0.270 -3.259 15.753 57 HE2 LYS 6 HE2 LYS 6 0.649 -3.215 18.095 58 HE3 LYS 6 HE1 LYS 6 -0.162 -1.707 17.675 59 HZ1 LYS 6 HZ1 LYS 6 -1.431 -4.102 18.888 60 HZ2 LYS 6 HZ2 LYS 6 -2.262 -2.702 18.428 61 HZ3 LYS 6 HZ3 LYS 6 -1.111 -2.637 19.666 62 H THR 7 HN THR 7 -3.015 -0.067 13.777 63 HA THR 7 HA THR 7 -2.323 0.064 10.938 64 HB THR 7 HB THR 7 -2.464 2.580 11.373 65 HG1 THR 7 HG1 THR 7 -3.649 3.153 13.247 66 HG21 THR 7 HG21 THR 7 -4.218 1.547 10.179 67 HG22 THR 7 HG22 THR 7 -4.998 2.496 11.446 68 HG23 THR 7 HG23 THR 7 -4.835 0.749 11.624 69 H LEU 8 HN LEU 8 -0.589 1.683 10.369 70 HA LEU 8 HA LEU 8 1.863 0.915 11.553 71 HB2 LEU 8 HB2 LEU 8 1.128 3.030 9.547 72 HB3 LEU 8 HB1 LEU 8 2.781 2.783 10.078 73 HG LEU 8 HG LEU 8 1.118 0.594 8.838 74 HD11 LEU 8 HD11 LEU 8 3.068 2.468 7.505 75 HD12 LEU 8 HD12 LEU 8 1.327 2.404 7.232 76 HD13 LEU 8 HD13 LEU 8 2.344 1.041 6.765 77 HD21 LEU 8 HD21 LEU 8 3.284 -0.464 8.486 78 HD22 LEU 8 HD22 LEU 8 3.027 -0.123 10.196 79 HD23 LEU 8 HD23 LEU 8 4.091 0.909 9.242 80 H THR 9 HN THR 9 -0.381 3.300 12.444 81 HA THR 9 HA THR 9 1.522 5.110 13.624 82 HB THR 9 HB THR 9 -0.876 5.757 14.760 83 HG1 THR 9 HG1 THR 9 -2.491 5.336 13.300 84 HG21 THR 9 HG21 THR 9 0.515 7.347 13.623 85 HG22 THR 9 HG22 THR 9 -1.081 7.395 12.872 86 HG23 THR 9 HG23 THR 9 0.247 6.551 12.072 87 H GLY 10 HN GLY 10 0.240 2.133 14.478 88 HA2 GLY 10 HA2 GLY 10 0.880 0.940 16.406 89 HA3 GLY 10 HA1 GLY 10 1.192 2.465 17.222 90 H LYS 11 HN LYS 11 -1.745 2.273 15.503 91 HA LYS 11 HA LYS 11 -3.207 2.094 18.042 92 HB2 LYS 11 HB2 LYS 11 -3.466 4.160 16.638 93 HB3 LYS 11 HB1 LYS 11 -4.175 3.156 15.382 94 HG2 LYS 11 HG2 LYS 11 -6.012 2.566 16.856 95 HG3 LYS 11 HG1 LYS 11 -5.288 3.509 18.159 96 HD2 LYS 11 HD2 LYS 11 -7.032 4.818 17.141 97 HD3 LYS 11 HD1 LYS 11 -5.475 5.533 16.720 98 HE2 LYS 11 HE2 LYS 11 -5.557 4.434 14.540 99 HE3 LYS 11 HE1 LYS 11 -7.100 3.695 14.964 100 HZ1 LYS 11 HZ1 LYS 11 -8.112 5.847 15.065 101 HZ2 LYS 11 HZ2 LYS 11 -7.328 5.702 13.572 102 HZ3 LYS 11 HZ3 LYS 11 -6.633 6.623 14.809 103 H THR 12 HN THR 12 -4.905 0.665 18.288 104 HA THR 12 HA THR 12 -5.152 -1.372 16.175 105 HB THR 12 HB THR 12 -5.851 -1.939 19.034 106 HG1 THR 12 HG1 THR 12 -3.818 -1.536 19.513 107 HG21 THR 12 HG21 THR 12 -6.434 -3.577 17.311 108 HG22 THR 12 HG22 THR 12 -5.190 -4.211 18.390 109 HG23 THR 12 HG23 THR 12 -4.751 -3.631 16.785 110 H ILE 13 HN ILE 13 -7.076 -1.547 15.255 111 HA ILE 13 HA ILE 13 -9.404 -0.330 16.599 112 HB ILE 13 HB ILE 13 -9.049 -0.805 13.634 113 HG12 ILE 13 HG12 ILE 13 -8.836 1.840 15.080 114 HG13 ILE 13 HG11 ILE 13 -7.433 0.862 14.664 115 HG21 ILE 13 HG21 ILE 13 -11.056 0.874 15.132 116 HG22 ILE 13 HG22 ILE 13 -11.376 -0.705 14.416 117 HG23 ILE 13 HG23 ILE 13 -10.965 0.665 13.383 118 HD11 ILE 13 HD11 ILE 13 -7.960 1.068 12.309 119 HD12 ILE 13 HD12 ILE 13 -7.833 2.659 13.059 120 HD13 ILE 13 HD13 ILE 13 -9.419 1.979 12.698 121 H THR 14 HN THR 14 -11.132 -1.561 17.023 122 HA THR 14 HA THR 14 -11.046 -4.381 16.282 123 HB THR 14 HB THR 14 -13.294 -4.060 17.833 124 HG1 THR 14 HG1 THR 14 -13.079 -2.081 18.607 125 HG21 THR 14 HG21 THR 14 -11.570 -5.758 18.163 126 HG22 THR 14 HG22 THR 14 -11.914 -4.926 19.679 127 HG23 THR 14 HG23 THR 14 -10.457 -4.531 18.768 128 H LEU 15 HN LEU 15 -12.239 -5.148 14.638 129 HA LEU 15 HA LEU 15 -14.484 -3.490 13.705 130 HB2 LEU 15 HB2 LEU 15 -12.581 -5.154 12.065 131 HB3 LEU 15 HB1 LEU 15 -14.018 -4.383 11.432 132 HG LEU 15 HG LEU 15 -11.632 -2.954 12.602 133 HD11 LEU 15 HD11 LEU 15 -11.152 -2.274 10.352 134 HD12 LEU 15 HD12 LEU 15 -12.602 -3.081 9.753 135 HD13 LEU 15 HD13 LEU 15 -11.264 -4.033 10.399 136 HD21 LEU 15 HD21 LEU 15 -13.633 -1.691 13.032 137 HD22 LEU 15 HD22 LEU 15 -14.175 -1.908 11.369 138 HD23 LEU 15 HD23 LEU 15 -12.749 -0.928 11.711 139 H GLU 16 HN GLU 16 -16.374 -4.427 13.255 140 HA GLU 16 HA GLU 16 -16.754 -7.194 14.057 141 HB2 GLU 16 HB2 GLU 16 -18.276 -5.290 14.797 142 HB3 GLU 16 HB1 GLU 16 -18.857 -5.226 13.140 143 HG2 GLU 16 HG2 GLU 16 -20.406 -6.498 14.421 144 HG3 GLU 16 HG1 GLU 16 -19.543 -7.603 13.354 145 H VAL 17 HN VAL 17 -16.339 -8.641 12.533 146 HA VAL 17 HA VAL 17 -17.471 -8.211 9.853 147 HB VAL 17 HB VAL 17 -15.431 -9.327 8.892 148 HG11 VAL 17 HG11 VAL 17 -14.031 -7.299 8.934 149 HG12 VAL 17 HG12 VAL 17 -15.027 -6.659 10.242 150 HG13 VAL 17 HG13 VAL 17 -15.734 -6.939 8.651 151 HG21 VAL 17 HG21 VAL 17 -14.562 -10.342 10.909 152 HG22 VAL 17 HG22 VAL 17 -14.311 -8.754 11.635 153 HG23 VAL 17 HG23 VAL 17 -13.361 -9.243 10.232 154 H GLU 18 HN GLU 18 -17.251 -10.360 8.584 155 HA GLU 18 HA GLU 18 -17.661 -12.663 10.348 156 HB2 GLU 18 HB2 GLU 18 -19.513 -11.674 8.179 157 HB3 GLU 18 HB1 GLU 18 -19.541 -13.340 8.740 158 HG2 GLU 18 HG2 GLU 18 -19.985 -10.920 10.478 159 HG3 GLU 18 HG1 GLU 18 -21.258 -11.939 9.807 160 HA PRO 19 HA PRO 19 -14.990 -14.871 7.627 161 HB2 PRO 19 HB2 PRO 19 -17.109 -16.942 7.295 162 HB3 PRO 19 HB1 PRO 19 -15.428 -17.116 7.837 163 HG2 PRO 19 HG2 PRO 19 -17.419 -17.271 9.567 164 HG3 PRO 19 HG1 PRO 19 -15.897 -16.458 9.989 165 HD2 PRO 19 HD2 PRO 19 -18.536 -15.267 9.280 166 HD3 PRO 19 HD1 PRO 19 -17.327 -14.722 10.459 167 H SER 20 HN SER 20 -18.337 -14.541 6.553 168 HA SER 20 HA SER 20 -17.696 -15.043 3.788 169 HB2 SER 20 HB2 SER 20 -20.269 -13.830 4.753 170 HB3 SER 20 HB1 SER 20 -19.994 -14.907 3.379 171 HG SER 20 HG SER 20 -19.557 -16.581 4.868 172 H ASP 21 HN ASP 21 -17.171 -12.416 5.729 173 HA ASP 21 HA ASP 21 -18.051 -10.311 4.003 174 HB2 ASP 21 HB2 ASP 21 -17.354 -10.282 6.566 175 HB3 ASP 21 HB1 ASP 21 -15.778 -9.884 5.890 176 H THR 22 HN THR 22 -16.778 -8.967 2.678 177 HA THR 22 HA THR 22 -14.519 -10.385 1.473 178 HB THR 22 HB THR 22 -14.869 -8.547 -0.335 179 HG1 THR 22 HG1 THR 22 -16.584 -7.326 -0.114 180 HG21 THR 22 HG21 THR 22 -16.875 -10.761 0.127 181 HG22 THR 22 HG22 THR 22 -15.336 -10.899 -0.722 182 HG23 THR 22 HG23 THR 22 -16.633 -9.921 -1.404 183 H ILE 23 HN ILE 23 -12.560 -9.333 1.007 184 HA ILE 23 HA ILE 23 -11.553 -7.655 3.012 185 HB ILE 23 HB ILE 23 -10.421 -7.924 0.224 186 HG12 ILE 23 HG12 ILE 23 -10.819 -10.152 1.115 187 HG13 ILE 23 HG11 ILE 23 -9.094 -9.811 1.131 188 HG21 ILE 23 HG21 ILE 23 -9.048 -7.365 2.849 189 HG22 ILE 23 HG22 ILE 23 -9.436 -6.155 1.625 190 HG23 ILE 23 HG23 ILE 23 -8.288 -7.444 1.258 191 HD11 ILE 23 HD11 ILE 23 -10.975 -9.795 3.478 192 HD12 ILE 23 HD12 ILE 23 -9.296 -9.258 3.549 193 HD13 ILE 23 HD13 ILE 23 -9.671 -10.935 3.150 194 H GLU 24 HN GLU 24 -12.885 -6.926 -0.162 195 HA GLU 24 HA GLU 24 -12.196 -4.211 -0.273 196 HB2 GLU 24 HB2 GLU 24 -12.971 -4.688 -2.323 197 HB3 GLU 24 HB1 GLU 24 -13.908 -6.051 -1.737 198 HG2 GLU 24 HG2 GLU 24 -15.044 -3.424 -1.108 199 HG3 GLU 24 HG1 GLU 24 -14.951 -3.804 -2.827 200 H ASN 25 HN ASN 25 -14.950 -5.863 1.189 201 HA ASN 25 HA ASN 25 -16.362 -3.487 1.888 202 HB2 ASN 25 HB2 ASN 25 -17.401 -5.771 1.696 203 HB3 ASN 25 HB1 ASN 25 -16.592 -6.203 3.198 204 HD21 ASN 25 HD21 ASN 25 -18.366 -6.498 4.430 205 HD22 ASN 25 HD22 ASN 25 -19.470 -5.220 4.852 206 H VAL 26 HN VAL 26 -14.017 -5.557 3.518 207 HA VAL 26 HA VAL 26 -14.174 -4.396 6.071 208 HB VAL 26 HB VAL 26 -11.769 -5.647 4.728 209 HG11 VAL 26 HG11 VAL 26 -11.101 -4.301 6.640 210 HG12 VAL 26 HG12 VAL 26 -10.939 -6.017 7.014 211 HG13 VAL 26 HG13 VAL 26 -12.308 -5.100 7.646 212 HG21 VAL 26 HG21 VAL 26 -13.643 -7.184 4.820 213 HG22 VAL 26 HG22 VAL 26 -13.868 -6.842 6.536 214 HG23 VAL 26 HG23 VAL 26 -12.410 -7.667 5.986 215 H LYS 27 HN LYS 27 -12.223 -3.591 3.231 216 HA LYS 27 HA LYS 27 -10.748 -1.499 4.423 217 HB2 LYS 27 HB2 LYS 27 -11.456 -2.055 1.543 218 HB3 LYS 27 HB1 LYS 27 -10.391 -0.746 2.036 219 HG2 LYS 27 HG2 LYS 27 -9.075 -2.622 3.259 220 HG3 LYS 27 HG1 LYS 27 -9.940 -3.692 2.157 221 HD2 LYS 27 HD2 LYS 27 -8.333 -1.310 1.259 222 HD3 LYS 27 HD1 LYS 27 -7.682 -2.946 1.359 223 HE2 LYS 27 HE2 LYS 27 -9.393 -3.707 -0.223 224 HE3 LYS 27 HE1 LYS 27 -10.025 -2.065 -0.320 225 HZ1 LYS 27 HZ1 LYS 27 -8.225 -1.345 -1.522 226 HZ2 LYS 27 HZ2 LYS 27 -8.360 -2.939 -2.097 227 HZ3 LYS 27 HZ3 LYS 27 -7.193 -2.548 -0.931 228 H ALA 28 HN ALA 28 -13.896 -1.632 2.889 229 HA ALA 28 HA ALA 28 -14.332 1.152 2.668 230 HB1 ALA 28 HB1 ALA 28 -15.679 -0.509 1.461 231 HB2 ALA 28 HB2 ALA 28 -16.690 0.580 2.411 232 HB3 ALA 28 HB3 ALA 28 -16.366 -1.055 2.990 233 H LYS 29 HN LYS 29 -14.881 -1.198 5.227 234 HA LYS 29 HA LYS 29 -16.312 0.489 6.982 235 HB2 LYS 29 HB2 LYS 29 -14.554 -1.902 7.579 236 HB3 LYS 29 HB1 LYS 29 -15.621 -1.133 8.746 237 HG2 LYS 29 HG2 LYS 29 -17.552 -1.719 7.421 238 HG3 LYS 29 HG1 LYS 29 -16.524 -2.404 6.167 239 HD2 LYS 29 HD2 LYS 29 -15.745 -4.115 7.721 240 HD3 LYS 29 HD1 LYS 29 -16.720 -3.400 9.008 241 HE2 LYS 29 HE2 LYS 29 -18.750 -3.856 7.727 242 HE3 LYS 29 HE1 LYS 29 -17.783 -4.573 6.440 243 HZ1 LYS 29 HZ1 LYS 29 -17.486 -6.470 7.598 244 HZ2 LYS 29 HZ2 LYS 29 -18.898 -5.979 8.394 245 HZ3 LYS 29 HZ3 LYS 29 -17.394 -5.683 9.100 246 H ILE 30 HN ILE 30 -12.883 -0.104 6.476 247 HA ILE 30 HA ILE 30 -11.974 1.458 8.673 248 HB ILE 30 HB ILE 30 -10.496 0.726 6.138 249 HG12 ILE 30 HG12 ILE 30 -10.474 -0.664 8.826 250 HG13 ILE 30 HG11 ILE 30 -11.398 -1.217 7.432 251 HG21 ILE 30 HG21 ILE 30 -9.411 2.546 7.312 252 HG22 ILE 30 HG22 ILE 30 -8.474 1.065 7.509 253 HG23 ILE 30 HG23 ILE 30 -9.490 1.646 8.828 254 HD11 ILE 30 HD11 ILE 30 -9.361 -2.483 7.640 255 HD12 ILE 30 HD12 ILE 30 -8.404 -1.001 7.623 256 HD13 ILE 30 HD13 ILE 30 -9.296 -1.490 6.184 257 H GLN 31 HN GLN 31 -12.679 2.112 5.292 258 HA GLN 31 HA GLN 31 -11.591 4.714 5.155 259 HB2 GLN 31 HB2 GLN 31 -12.134 3.561 3.121 260 HB3 GLN 31 HB1 GLN 31 -13.808 3.356 3.615 261 HG2 GLN 31 HG2 GLN 31 -13.934 5.911 3.590 262 HG3 GLN 31 HG1 GLN 31 -12.423 5.844 2.686 263 HE21 GLN 31 HE21 GLN 31 -13.400 6.752 0.878 264 HE22 GLN 31 HE22 GLN 31 -14.478 5.848 -0.133 265 H ASP 32 HN ASP 32 -14.690 3.466 6.211 266 HA ASP 32 HA ASP 32 -15.992 5.983 6.446 267 HB2 ASP 32 HB2 ASP 32 -17.284 3.946 6.253 268 HB3 ASP 32 HB1 ASP 32 -16.559 3.305 7.723 269 H LYS 33 HN LYS 33 -14.414 3.846 8.791 270 HA LYS 33 HA LYS 33 -14.890 5.592 10.996 271 HB2 LYS 33 HB2 LYS 33 -12.981 3.257 10.818 272 HB3 LYS 33 HB1 LYS 33 -13.560 4.023 12.291 273 HG2 LYS 33 HG2 LYS 33 -15.907 3.390 11.423 274 HG3 LYS 33 HG1 LYS 33 -15.038 2.276 10.369 275 HD2 LYS 33 HD2 LYS 33 -13.986 1.253 12.342 276 HD3 LYS 33 HD1 LYS 33 -14.892 2.354 13.382 277 HE2 LYS 33 HE2 LYS 33 -16.977 1.402 12.199 278 HE3 LYS 33 HE1 LYS 33 -15.903 0.098 11.688 279 HZ1 LYS 33 HZ1 LYS 33 -15.387 -0.295 14.045 280 HZ2 LYS 33 HZ2 LYS 33 -17.029 -0.506 13.712 281 HZ3 LYS 33 HZ3 LYS 33 -16.499 0.900 14.487 282 H GLU 34 HN GLU 34 -11.897 4.724 9.239 283 HA GLU 34 HA GLU 34 -10.426 6.741 10.701 284 HB2 GLU 34 HB2 GLU 34 -9.690 4.722 8.604 285 HB3 GLU 34 HB1 GLU 34 -8.568 5.993 9.072 286 HG2 GLU 34 HG2 GLU 34 -9.782 3.963 10.930 287 HG3 GLU 34 HG1 GLU 34 -8.150 3.902 10.263 288 H GLY 35 HN GLY 35 -11.133 6.156 7.256 289 HA2 GLY 35 HA2 GLY 35 -11.969 8.042 5.935 290 HA3 GLY 35 HA1 GLY 35 -10.877 9.073 6.849 291 H ILE 36 HN ILE 36 -9.408 6.163 6.216 292 HA ILE 36 HA ILE 36 -7.654 7.345 4.254 293 HB ILE 36 HB ILE 36 -7.596 4.498 5.248 294 HG12 ILE 36 HG12 ILE 36 -6.139 6.837 6.488 295 HG13 ILE 36 HG11 ILE 36 -7.649 6.198 7.124 296 HG21 ILE 36 HG21 ILE 36 -5.435 6.311 4.186 297 HG22 ILE 36 HG22 ILE 36 -6.189 4.976 3.317 298 HG23 ILE 36 HG23 ILE 36 -5.203 4.655 4.745 299 HD11 ILE 36 HD11 ILE 36 -5.791 5.319 8.366 300 HD12 ILE 36 HD12 ILE 36 -5.040 4.727 6.885 301 HD13 ILE 36 HD13 ILE 36 -6.556 4.021 7.450 302 HA PRO 37 HA PRO 37 -10.070 5.866 0.781 303 HB2 PRO 37 HB2 PRO 37 -7.462 6.175 -0.619 304 HB3 PRO 37 HB1 PRO 37 -9.046 6.867 -1.019 305 HG2 PRO 37 HG2 PRO 37 -7.121 8.376 -0.004 306 HG3 PRO 37 HG1 PRO 37 -8.819 8.608 0.456 307 HD2 PRO 37 HD2 PRO 37 -6.614 7.319 1.993 308 HD3 PRO 37 HD1 PRO 37 -7.957 8.329 2.567 309 HA PRO 38 HA PRO 38 -9.012 1.519 0.924 310 HB2 PRO 38 HB2 PRO 38 -10.523 1.454 -1.638 311 HB3 PRO 38 HB1 PRO 38 -10.775 0.510 -0.159 312 HG2 PRO 38 HG2 PRO 38 -12.426 2.472 -0.807 313 HG3 PRO 38 HG1 PRO 38 -11.958 2.182 0.881 314 HD2 PRO 38 HD2 PRO 38 -11.026 4.307 -0.995 315 HD3 PRO 38 HD1 PRO 38 -11.344 4.393 0.750 316 H ASP 39 HN ASP 39 -8.284 3.664 -1.662 317 HA ASP 39 HA ASP 39 -6.887 1.896 -3.387 318 HB2 ASP 39 HB2 ASP 39 -6.705 4.890 -3.000 319 HB3 ASP 39 HB1 ASP 39 -5.839 4.022 -4.259 320 H GLN 40 HN GLN 40 -5.990 3.832 -0.611 321 HA GLN 40 HA GLN 40 -3.184 3.021 -0.886 322 HB2 GLN 40 HB2 GLN 40 -4.407 5.059 0.982 323 HB3 GLN 40 HB1 GLN 40 -2.690 4.775 0.726 324 HG2 GLN 40 HG2 GLN 40 -2.843 5.578 -1.534 325 HG3 GLN 40 HG1 GLN 40 -4.594 5.724 -1.401 326 HE21 GLN 40 HE21 GLN 40 -2.571 7.746 -2.029 327 HE22 GLN 40 HE22 GLN 40 -2.766 8.993 -0.854 328 H GLN 41 HN GLN 41 -5.605 1.460 0.176 329 HA GLN 41 HA GLN 41 -4.632 0.896 2.888 330 HB2 GLN 41 HB2 GLN 41 -7.220 0.310 1.478 331 HB3 GLN 41 HB1 GLN 41 -6.777 -0.522 2.960 332 HG2 GLN 41 HG2 GLN 41 -6.527 1.787 3.991 333 HG3 GLN 41 HG1 GLN 41 -7.351 2.393 2.553 334 HE21 GLN 41 HE21 GLN 41 -9.218 3.037 3.564 335 HE22 GLN 41 HE22 GLN 41 -10.332 1.921 4.283 336 H ARG 42 HN ARG 42 -3.040 -0.576 2.844 337 HA ARG 42 HA ARG 42 -3.406 -2.956 1.144 338 HB2 ARG 42 HB2 ARG 42 -0.843 -1.964 2.420 339 HB3 ARG 42 HB1 ARG 42 -1.000 -3.293 1.280 340 HG2 ARG 42 HG2 ARG 42 -1.907 -1.543 -0.348 341 HG3 ARG 42 HG1 ARG 42 -1.255 -0.352 0.777 342 HD2 ARG 42 HD2 ARG 42 0.437 -0.693 -0.826 343 HD3 ARG 42 HD1 ARG 42 0.949 -1.602 0.595 344 HE ARG 42 HE ARG 42 -0.392 -3.445 -0.870 345 HH11 ARG 42 HH11 ARG 42 2.257 -1.253 -1.586 346 HH12 ARG 42 HH12 ARG 42 2.903 -2.274 -2.848 347 HH21 ARG 42 HH21 ARG 42 0.486 -4.783 -2.491 348 HH22 ARG 42 HH22 ARG 42 1.919 -4.282 -3.333 349 H LEU 43 HN LEU 43 -4.502 -4.380 2.390 350 HA LEU 43 HA LEU 43 -3.900 -4.637 5.218 351 HB2 LEU 43 HB2 LEU 43 -6.016 -5.689 3.399 352 HB3 LEU 43 HB1 LEU 43 -5.698 -6.541 4.897 353 HG LEU 43 HG LEU 43 -6.363 -3.603 4.794 354 HD11 LEU 43 HD11 LEU 43 -8.207 -5.935 5.278 355 HD12 LEU 43 HD12 LEU 43 -8.223 -4.873 3.871 356 HD13 LEU 43 HD13 LEU 43 -8.622 -4.231 5.464 357 HD21 LEU 43 HD21 LEU 43 -6.907 -3.981 7.176 358 HD22 LEU 43 HD22 LEU 43 -5.209 -4.282 6.806 359 HD23 LEU 43 HD23 LEU 43 -6.318 -5.636 7.021 360 H ILE 44 HN ILE 44 -2.580 -6.091 6.060 361 HA ILE 44 HA ILE 44 -1.761 -8.363 4.374 362 HB ILE 44 HB ILE 44 -0.129 -6.470 6.005 363 HG12 ILE 44 HG12 ILE 44 1.466 -7.114 4.032 364 HG13 ILE 44 HG11 ILE 44 0.002 -7.756 3.302 365 HG21 ILE 44 HG21 ILE 44 0.338 -8.618 7.071 366 HG22 ILE 44 HG22 ILE 44 1.730 -8.048 6.150 367 HG23 ILE 44 HG23 ILE 44 0.704 -9.323 5.496 368 HD11 ILE 44 HD11 ILE 44 -1.044 -5.553 3.499 369 HD12 ILE 44 HD12 ILE 44 0.427 -5.515 2.529 370 HD13 ILE 44 HD13 ILE 44 0.451 -4.919 4.188 371 H PHE 45 HN PHE 45 -1.738 -10.328 5.247 372 HA PHE 45 HA PHE 45 -2.193 -10.613 8.137 373 HB2 PHE 45 HB2 PHE 45 -4.328 -10.909 6.806 374 HB3 PHE 45 HB1 PHE 45 -3.573 -12.307 6.050 375 HD1 PHE 45 HD1 PHE 45 -4.088 -10.969 9.498 376 HD2 PHE 45 HD2 PHE 45 -4.151 -14.352 6.911 377 HE1 PHE 45 HE1 PHE 45 -4.850 -12.376 11.364 378 HE2 PHE 45 HE2 PHE 45 -4.912 -15.765 8.778 379 HZ PHE 45 HZ PHE 45 -5.263 -14.778 11.005 380 H ALA 46 HN ALA 46 -0.700 -11.827 9.014 381 HA ALA 46 HA ALA 46 0.846 -13.432 9.404 382 HB1 ALA 46 HB1 ALA 46 0.876 -15.484 8.134 383 HB2 ALA 46 HB2 ALA 46 -0.077 -14.738 6.850 384 HB3 ALA 46 HB3 ALA 46 -0.793 -15.000 8.441 385 H GLY 47 HN GLY 47 0.923 -11.422 6.731 386 HA2 GLY 47 HA2 GLY 47 3.303 -10.547 6.490 387 HA3 GLY 47 HA1 GLY 47 3.692 -12.213 6.096 388 H LYS 48 HN LYS 48 0.805 -12.038 4.764 389 HA LYS 48 HA LYS 48 1.830 -10.890 2.250 390 HB2 LYS 48 HB2 LYS 48 0.474 -13.448 2.824 391 HB3 LYS 48 HB1 LYS 48 -0.109 -12.592 1.400 392 HG2 LYS 48 HG2 LYS 48 2.196 -12.490 0.548 393 HG3 LYS 48 HG1 LYS 48 2.739 -13.409 1.952 394 HD2 LYS 48 HD2 LYS 48 0.587 -14.458 0.147 395 HD3 LYS 48 HD1 LYS 48 2.291 -14.670 -0.251 396 HE2 LYS 48 HE2 LYS 48 2.436 -15.567 2.204 397 HE3 LYS 48 HE1 LYS 48 0.705 -15.821 1.998 398 HZ1 LYS 48 HZ1 LYS 48 1.289 -17.067 -0.076 399 HZ2 LYS 48 HZ2 LYS 48 1.770 -17.809 1.362 400 HZ3 LYS 48 HZ3 LYS 48 2.906 -17.000 0.409 401 H GLN 49 HN GLN 49 0.264 -9.948 0.819 402 HA GLN 49 HA GLN 49 -1.690 -8.409 2.310 403 HB2 GLN 49 HB2 GLN 49 -0.158 -7.352 0.651 404 HB3 GLN 49 HB1 GLN 49 -0.971 -8.249 -0.620 405 HG2 GLN 49 HG2 GLN 49 -3.109 -7.105 0.279 406 HG3 GLN 49 HG1 GLN 49 -1.983 -5.983 1.038 407 HE21 GLN 49 HE21 GLN 49 -3.400 -7.062 -1.899 408 HE22 GLN 49 HE22 GLN 49 -2.733 -5.837 -2.925 409 H LEU 50 HN LEU 50 -3.857 -8.343 1.933 410 HA LEU 50 HA LEU 50 -4.999 -10.721 0.688 411 HB2 LEU 50 HB2 LEU 50 -6.583 -8.594 2.077 412 HB3 LEU 50 HB1 LEU 50 -6.916 -10.310 1.955 413 HG LEU 50 HG LEU 50 -4.675 -9.150 3.612 414 HD11 LEU 50 HD11 LEU 50 -7.352 -10.145 4.564 415 HD12 LEU 50 HD12 LEU 50 -6.930 -8.441 4.389 416 HD13 LEU 50 HD13 LEU 50 -6.058 -9.452 5.541 417 HD21 LEU 50 HD21 LEU 50 -5.914 -11.896 3.521 418 HD22 LEU 50 HD22 LEU 50 -4.668 -11.369 4.650 419 HD23 LEU 50 HD23 LEU 50 -4.315 -11.454 2.925 420 H GLU 51 HN GLU 51 -6.285 -10.657 -1.122 421 HA GLU 51 HA GLU 51 -6.164 -8.217 -2.677 422 HB2 GLU 51 HB2 GLU 51 -7.079 -11.020 -3.254 423 HB3 GLU 51 HB1 GLU 51 -7.412 -9.705 -4.374 424 HG2 GLU 51 HG2 GLU 51 -5.079 -9.281 -4.673 425 HG3 GLU 51 HG1 GLU 51 -4.661 -10.432 -3.407 426 H ASP 52 HN ASP 52 -7.944 -7.125 -3.550 427 HA ASP 52 HA ASP 52 -10.030 -6.556 -1.800 428 HB2 ASP 52 HB2 ASP 52 -9.509 -5.969 -4.682 429 HB3 ASP 52 HB1 ASP 52 -11.109 -5.629 -4.034 430 H GLY 53 HN GLY 53 -10.050 -8.612 -4.698 431 HA2 GLY 53 HA2 GLY 53 -12.826 -9.327 -4.272 432 HA3 GLY 53 HA1 GLY 53 -11.784 -9.903 -5.562 433 H ARG 54 HN ARG 54 -11.697 -10.075 -2.005 434 HA ARG 54 HA ARG 54 -11.779 -12.998 -2.160 435 HB2 ARG 54 HB2 ARG 54 -9.603 -11.419 -0.769 436 HB3 ARG 54 HB1 ARG 54 -9.897 -13.130 -0.501 437 HG2 ARG 54 HG2 ARG 54 -9.226 -11.957 -3.182 438 HG3 ARG 54 HG1 ARG 54 -8.023 -12.590 -2.059 439 HD2 ARG 54 HD2 ARG 54 -9.619 -14.702 -2.109 440 HD3 ARG 54 HD1 ARG 54 -10.064 -14.027 -3.676 441 HE ARG 54 HE ARG 54 -7.660 -15.391 -3.032 442 HH11 ARG 54 HH11 ARG 54 -8.956 -12.842 -5.058 443 HH12 ARG 54 HH12 ARG 54 -7.617 -12.866 -6.160 444 HH21 ARG 54 HH21 ARG 54 -5.915 -15.444 -4.487 445 HH22 ARG 54 HH22 ARG 54 -5.880 -14.349 -5.834 446 H THR 55 HN THR 55 -12.190 -13.965 -0.035 447 HA THR 55 HA THR 55 -13.683 -12.111 1.695 448 HB THR 55 HB THR 55 -14.839 -14.153 2.549 449 HG1 THR 55 HG1 THR 55 -13.373 -15.408 0.429 450 HG21 THR 55 HG21 THR 55 -15.009 -13.662 -0.426 451 HG22 THR 55 HG22 THR 55 -15.909 -12.819 0.835 452 HG23 THR 55 HG23 THR 55 -16.215 -14.527 0.525 453 H LEU 56 HN LEU 56 -13.712 -12.860 4.057 454 HA LEU 56 HA LEU 56 -11.047 -12.900 4.997 455 HB2 LEU 56 HB2 LEU 56 -13.686 -13.327 6.383 456 HB3 LEU 56 HB1 LEU 56 -12.155 -13.304 7.241 457 HG LEU 56 HG LEU 56 -13.288 -11.017 5.625 458 HD11 LEU 56 HD11 LEU 56 -13.078 -11.439 8.598 459 HD12 LEU 56 HD12 LEU 56 -14.558 -11.343 7.641 460 HD13 LEU 56 HD13 LEU 56 -13.526 -9.923 7.818 461 HD21 LEU 56 HD21 LEU 56 -11.448 -9.728 6.708 462 HD22 LEU 56 HD22 LEU 56 -10.898 -10.932 5.545 463 HD23 LEU 56 HD23 LEU 56 -10.775 -11.257 7.274 464 H SER 57 HN SER 57 -13.444 -15.402 4.476 465 HA SER 57 HA SER 57 -12.026 -17.447 5.851 466 HB2 SER 57 HB2 SER 57 -13.570 -18.931 4.383 467 HB3 SER 57 HB1 SER 57 -14.312 -17.876 5.587 468 HG SER 57 HG SER 57 -14.005 -17.294 2.816 469 H ASP 58 HN ASP 58 -11.655 -15.951 2.798 470 HA ASP 58 HA ASP 58 -10.560 -18.053 1.277 471 HB2 ASP 58 HB2 ASP 58 -10.582 -15.100 1.122 472 HB3 ASP 58 HB1 ASP 58 -9.253 -15.894 0.286 473 H TYR 59 HN TYR 59 -9.121 -15.784 3.540 474 HA TYR 59 HA TYR 59 -6.514 -17.084 3.171 475 HB2 TYR 59 HB2 TYR 59 -7.219 -14.460 4.499 476 HB3 TYR 59 HB1 TYR 59 -5.593 -15.118 4.377 477 HD1 TYR 59 HD1 TYR 59 -4.510 -15.316 2.141 478 HD2 TYR 59 HD2 TYR 59 -8.238 -13.330 2.679 479 HE1 TYR 59 HE1 TYR 59 -4.226 -14.210 -0.036 480 HE2 TYR 59 HE2 TYR 59 -7.970 -12.226 0.501 481 HH TYR 59 HH TYR 59 -5.477 -13.135 -1.730 482 H ASN 60 HN ASN 60 -8.951 -17.956 4.774 483 HA ASN 60 HA ASN 60 -9.410 -19.044 6.708 484 HB2 ASN 60 HB2 ASN 60 -6.397 -19.201 6.747 485 HB3 ASN 60 HB1 ASN 60 -7.405 -19.987 7.958 486 HD21 ASN 60 HD21 ASN 60 -5.591 -20.985 5.794 487 HD22 ASN 60 HD22 ASN 60 -6.544 -22.133 4.927 488 H ILE 61 HN ILE 61 -9.434 -16.224 6.844 489 HA ILE 61 HA ILE 61 -8.217 -15.493 9.372 490 HB ILE 61 HB ILE 61 -10.083 -13.903 7.599 491 HG12 ILE 61 HG12 ILE 61 -7.070 -13.826 7.868 492 HG13 ILE 61 HG11 ILE 61 -7.964 -14.445 6.486 493 HG21 ILE 61 HG21 ILE 61 -9.303 -11.963 8.885 494 HG22 ILE 61 HG22 ILE 61 -8.369 -13.037 9.926 495 HG23 ILE 61 HG23 ILE 61 -10.128 -13.138 9.909 496 HD11 ILE 61 HD11 ILE 61 -7.932 -11.595 7.443 497 HD12 ILE 61 HD12 ILE 61 -8.855 -12.208 6.071 498 HD13 ILE 61 HD13 ILE 61 -7.092 -12.237 6.032 499 H GLN 62 HN GLN 62 -9.194 -15.620 11.282 500 HA GLN 62 HA GLN 62 -12.102 -16.062 11.333 501 HB2 GLN 62 HB2 GLN 62 -10.040 -17.296 13.172 502 HB3 GLN 62 HB1 GLN 62 -11.775 -17.571 13.228 503 HG2 GLN 62 HG2 GLN 62 -11.764 -18.794 11.236 504 HG3 GLN 62 HG1 GLN 62 -10.167 -18.209 10.783 505 HE21 GLN 62 HE21 GLN 62 -8.347 -19.076 11.802 506 HE22 GLN 62 HE22 GLN 62 -8.412 -20.586 12.639 507 H LYS 63 HN LYS 63 -12.447 -15.995 14.084 508 HA LYS 63 HA LYS 63 -12.354 -13.186 14.562 509 HB2 LYS 63 HB2 LYS 63 -13.463 -13.678 16.652 510 HB3 LYS 63 HB1 LYS 63 -14.183 -14.648 15.377 511 HG2 LYS 63 HG2 LYS 63 -13.222 -16.618 16.163 512 HG3 LYS 63 HG1 LYS 63 -12.035 -15.757 17.143 513 HD2 LYS 63 HD2 LYS 63 -13.870 -14.934 18.578 514 HD3 LYS 63 HD1 LYS 63 -15.011 -15.887 17.628 515 HE2 LYS 63 HE2 LYS 63 -13.963 -17.927 18.295 516 HE3 LYS 63 HE1 LYS 63 -12.644 -17.056 19.071 517 HZ1 LYS 63 HZ1 LYS 63 -14.237 -17.857 20.690 518 HZ2 LYS 63 HZ2 LYS 63 -15.483 -17.011 19.928 519 HZ3 LYS 63 HZ3 LYS 63 -14.222 -16.167 20.672 520 H GLU 64 HN GLU 64 -11.325 -12.139 16.353 521 HA GLU 64 HA GLU 64 -9.598 -11.604 17.714 522 HB2 GLU 64 HB2 GLU 64 -9.055 -14.564 17.930 523 HB3 GLU 64 HB1 GLU 64 -8.514 -13.307 19.036 524 HG2 GLU 64 HG2 GLU 64 -10.799 -12.866 19.691 525 HG3 GLU 64 HG1 GLU 64 -11.386 -14.054 18.531 526 H SER 65 HN SER 65 -9.230 -12.645 14.717 527 HA SER 65 HA SER 65 -6.391 -13.084 14.650 528 HB2 SER 65 HB2 SER 65 -8.426 -12.624 12.456 529 HB3 SER 65 HB1 SER 65 -6.715 -12.938 12.156 530 HG SER 65 HG SER 65 -7.944 -14.722 13.869 531 H THR 66 HN THR 66 -4.804 -11.645 14.153 532 HA THR 66 HA THR 66 -5.573 -8.824 14.212 533 HB THR 66 HB THR 66 -2.822 -10.026 14.549 534 HG1 THR 66 HG1 THR 66 -4.032 -10.707 16.278 535 HG21 THR 66 HG21 THR 66 -2.867 -7.653 13.857 536 HG22 THR 66 HG22 THR 66 -2.234 -7.860 15.490 537 HG23 THR 66 HG23 THR 66 -3.885 -7.283 15.247 538 H LEU 67 HN LEU 67 -5.626 -7.711 12.421 539 HA LEU 67 HA LEU 67 -4.092 -8.637 10.089 540 HB2 LEU 67 HB2 LEU 67 -6.635 -7.071 10.385 541 HB3 LEU 67 HB1 LEU 67 -5.687 -6.934 8.919 542 HG LEU 67 HG LEU 67 -5.871 -9.493 8.767 543 HD11 LEU 67 HD11 LEU 67 -7.813 -10.479 9.862 544 HD12 LEU 67 HD12 LEU 67 -8.120 -8.957 10.701 545 HD13 LEU 67 HD13 LEU 67 -6.657 -9.878 11.052 546 HD21 LEU 67 HD21 LEU 67 -8.302 -7.743 8.445 547 HD22 LEU 67 HD22 LEU 67 -8.089 -9.333 7.712 548 HD23 LEU 67 HD23 LEU 67 -7.028 -8.001 7.255 549 H HIS 68 HN HIS 68 -2.697 -7.268 9.056 550 HA HIS 68 HA HIS 68 -1.968 -4.845 10.539 551 HB2 HIS 68 HB2 HIS 68 -0.484 -6.544 8.530 552 HB3 HIS 68 HB1 HIS 68 0.125 -4.998 9.106 553 HD2 HIS 68 HD2 HIS 68 0.683 -4.962 11.935 554 HE1 HIS 68 HE1 HIS 68 1.185 -9.159 12.033 555 HE2 HIS 68 HE2 HIS 68 1.830 -6.964 13.119 556 H LEU 69 HN LEU 69 -2.551 -2.907 9.752 557 HA LEU 69 HA LEU 69 -3.389 -2.772 6.944 558 HB2 LEU 69 HB2 LEU 69 -5.015 -2.006 8.622 559 HB3 LEU 69 HB1 LEU 69 -3.865 -0.810 9.189 560 HG LEU 69 HG LEU 69 -3.952 0.305 6.985 561 HD11 LEU 69 HD11 LEU 69 -5.709 -0.324 5.388 562 HD12 LEU 69 HD12 LEU 69 -6.081 -1.738 6.373 563 HD13 LEU 69 HD13 LEU 69 -4.507 -1.599 5.590 564 HD21 LEU 69 HD21 LEU 69 -6.565 -0.104 8.423 565 HD22 LEU 69 HD22 LEU 69 -6.315 1.115 7.174 566 HD23 LEU 69 HD23 LEU 69 -5.384 1.182 8.667 567 H VAL 70 HN VAL 70 -1.807 -2.261 5.625 568 HA VAL 70 HA VAL 70 0.219 -0.318 6.481 569 HB VAL 70 HB VAL 70 0.194 -2.247 4.153 570 HG11 VAL 70 HG11 VAL 70 2.667 -1.618 4.072 571 HG12 VAL 70 HG12 VAL 70 2.206 -0.204 5.021 572 HG13 VAL 70 HG13 VAL 70 1.508 -0.460 3.422 573 HG21 VAL 70 HG21 VAL 70 0.431 -3.339 6.324 574 HG22 VAL 70 HG22 VAL 70 1.794 -2.289 6.706 575 HG23 VAL 70 HG23 VAL 70 1.916 -3.445 5.380 576 H LEU 71 HN LEU 71 0.552 1.577 5.365 577 HA LEU 71 HA LEU 71 -1.580 2.372 3.548 578 HB2 LEU 71 HB2 LEU 71 0.537 3.890 5.046 579 HB3 LEU 71 HB1 LEU 71 -0.361 4.642 3.742 580 HG LEU 71 HG LEU 71 -2.442 3.798 5.147 581 HD11 LEU 71 HD11 LEU 71 -0.309 4.146 7.246 582 HD12 LEU 71 HD12 LEU 71 -1.101 2.628 6.819 583 HD13 LEU 71 HD13 LEU 71 -2.037 3.940 7.536 584 HD21 LEU 71 HD21 LEU 71 -2.476 5.989 6.264 585 HD22 LEU 71 HD22 LEU 71 -2.031 6.103 4.562 586 HD23 LEU 71 HD23 LEU 71 -0.790 6.230 5.810 587 H ARG 72 HN ARG 72 -0.705 3.963 1.744 588 HA ARG 72 HA ARG 72 1.774 2.994 0.566 589 HB2 ARG 72 HB2 ARG 72 0.249 1.389 -0.333 590 HB3 ARG 72 HB1 ARG 72 -0.960 2.618 -0.665 591 HG2 ARG 72 HG2 ARG 72 0.585 3.577 -2.371 592 HG3 ARG 72 HG1 ARG 72 1.648 2.191 -2.108 593 HD2 ARG 72 HD2 ARG 72 -1.033 1.278 -2.507 594 HD3 ARG 72 HD1 ARG 72 -0.594 2.377 -3.814 595 HE ARG 72 HE ARG 72 1.534 0.625 -3.483 596 HH11 ARG 72 HH11 ARG 72 -1.851 0.428 -4.345 597 HH12 ARG 72 HH12 ARG 72 -1.645 -0.943 -5.385 598 HH21 ARG 72 HH21 ARG 72 1.817 -1.185 -4.876 599 HH22 ARG 72 HH22 ARG 72 0.431 -1.860 -5.680 600 H LEU 73 HN LEU 73 2.732 4.464 -0.780 601 HA LEU 73 HA LEU 73 1.232 6.938 -1.328 602 HB2 LEU 73 HB2 LEU 73 3.905 6.559 -0.089 603 HB3 LEU 73 HB1 LEU 73 3.737 7.883 -1.226 604 HG LEU 73 HG LEU 73 1.612 8.424 0.267 605 HD11 LEU 73 HD11 LEU 73 2.243 6.307 1.644 606 HD12 LEU 73 HD12 LEU 73 1.703 7.767 2.470 607 HD13 LEU 73 HD13 LEU 73 3.419 7.383 2.398 608 HD21 LEU 73 HD21 LEU 73 3.410 9.969 -0.141 609 HD22 LEU 73 HD22 LEU 73 4.464 9.089 0.962 610 HD23 LEU 73 HD23 LEU 73 3.056 9.941 1.587 611 H ARG 74 HN ARG 74 2.089 8.164 -3.183 612 HA ARG 74 HA ARG 74 3.282 6.355 -5.182 613 HB2 ARG 74 HB2 ARG 74 1.393 8.643 -5.764 614 HB3 ARG 74 HB1 ARG 74 1.958 7.412 -6.888 615 HG2 ARG 74 HG2 ARG 74 0.191 6.912 -4.497 616 HG3 ARG 74 HG1 ARG 74 -0.355 7.034 -6.168 617 HD2 ARG 74 HD2 ARG 74 1.698 5.026 -5.269 618 HD3 ARG 74 HD1 ARG 74 -0.032 4.694 -5.239 619 HE ARG 74 HE ARG 74 0.220 5.403 -7.751 620 HH11 ARG 74 HH11 ARG 74 2.378 3.394 -5.842 621 HH12 ARG 74 HH12 ARG 74 2.910 2.466 -7.207 622 HH21 ARG 74 HH21 ARG 74 0.915 4.162 -9.536 623 HH22 ARG 74 HH22 ARG 74 2.086 2.901 -9.303 624 H GLY 75 HN GLY 75 4.290 8.478 -3.234 625 HA2 GLY 75 HA2 GLY 75 6.294 9.547 -4.995 626 HA3 GLY 75 HA1 GLY 75 5.203 10.772 -4.355 627 H GLY 76 HN GLY 76 8.015 10.616 -3.812 628 HA2 GLY 76 HA2 GLY 76 7.857 10.226 -0.896 629 HA3 GLY 76 HA1 GLY 76 9.216 9.575 -1.802 630 H1 SER 453 HT1 SER 453 20.994 10.982 14.459 631 H2 SER 453 HT2 SER 453 22.222 10.278 15.378 632 H3 SER 453 HT3 SER 453 21.807 11.897 15.622 633 HA SER 453 HA SER 453 20.971 10.293 17.320 634 HB2 SER 453 HB2 SER 453 18.665 11.686 16.021 635 HB3 SER 453 HB1 SER 453 19.147 11.660 17.717 636 HG SER 453 HG SER 453 19.817 13.612 17.141 637 H ASN 454 HN ASN 454 18.740 10.436 14.539 638 HA ASN 454 HA ASN 454 17.399 8.895 13.556 639 HB2 ASN 454 HB2 ASN 454 19.610 7.064 14.497 640 HB3 ASN 454 HB1 ASN 454 18.255 6.500 13.524 641 HD21 ASN 454 HD21 ASN 454 21.144 6.628 12.953 642 HD22 ASN 454 HD22 ASN 454 21.278 7.544 11.490 643 H SER 455 HN SER 455 17.073 9.580 16.439 644 HA SER 455 HA SER 455 16.239 7.291 17.863 645 HB2 SER 455 HB2 SER 455 14.994 9.934 18.435 646 HB3 SER 455 HB1 SER 455 15.709 8.761 19.543 647 HG SER 455 HG SER 455 17.649 9.593 19.218 648 H GLN 456 HN GLN 456 14.384 9.762 16.087 649 HA GLN 456 HA GLN 456 11.867 8.525 16.501 650 HB2 GLN 456 HB2 GLN 456 12.609 10.325 14.195 651 HB3 GLN 456 HB1 GLN 456 11.007 10.054 14.864 652 HG2 GLN 456 HG2 GLN 456 13.300 11.523 16.130 653 HG3 GLN 456 HG1 GLN 456 11.758 12.184 15.597 654 HE21 GLN 456 HE21 GLN 456 13.086 12.230 18.224 655 HE22 GLN 456 HE22 GLN 456 11.942 11.552 19.330 656 H LEU 457 HN LEU 457 14.312 8.254 14.006 657 HA LEU 457 HA LEU 457 12.772 6.747 12.177 658 HB2 LEU 457 HB2 LEU 457 15.772 6.720 12.513 659 HB3 LEU 457 HB1 LEU 457 14.876 6.227 11.090 660 HG LEU 457 HG LEU 457 15.186 9.027 12.162 661 HD11 LEU 457 HD11 LEU 457 16.237 9.433 9.992 662 HD12 LEU 457 HD12 LEU 457 16.041 7.729 9.584 663 HD13 LEU 457 HD13 LEU 457 17.093 8.200 10.919 664 HD21 LEU 457 HD21 LEU 457 12.905 8.714 11.364 665 HD22 LEU 457 HD22 LEU 457 13.518 8.072 9.839 666 HD23 LEU 457 HD23 LEU 457 13.825 9.752 10.277 667 H ASN 458 HN ASN 458 15.010 5.839 14.767 668 HA ASN 458 HA ASN 458 14.899 3.052 14.327 669 HB2 ASN 458 HB2 ASN 458 16.394 4.644 15.916 670 HB3 ASN 458 HB1 ASN 458 15.264 4.010 17.108 671 HD21 ASN 458 HD21 ASN 458 18.101 3.542 16.913 672 HD22 ASN 458 HD22 ASN 458 18.299 1.832 16.736 673 H ALA 459 HN ALA 459 13.013 5.232 16.373 674 HA ALA 459 HA ALA 459 11.465 3.254 17.654 675 HB1 ALA 459 HB1 ALA 459 11.651 5.571 18.459 676 HB2 ALA 459 HB2 ALA 459 9.972 5.061 18.279 677 HB3 ALA 459 HB3 ALA 459 10.708 6.115 17.072 678 H MET 460 HN MET 460 11.049 5.021 14.634 679 HA MET 460 HA MET 460 8.429 4.065 14.081 680 HB2 MET 460 HB2 MET 460 10.528 5.542 12.602 681 HB3 MET 460 HB1 MET 460 9.383 4.644 11.618 682 HG2 MET 460 HG2 MET 460 7.557 5.818 12.924 683 HG3 MET 460 HG1 MET 460 8.823 6.873 13.546 684 HE1 MET 460 HE1 MET 460 9.946 8.943 10.543 685 HE2 MET 460 HE2 MET 460 10.745 7.650 11.434 686 HE3 MET 460 HE3 MET 460 9.806 8.867 12.300 687 H ALA 461 HN ALA 461 11.679 2.966 13.223 688 HA ALA 461 HA ALA 461 10.935 0.922 11.444 689 HB1 ALA 461 HB1 ALA 461 13.361 1.097 13.229 690 HB2 ALA 461 HB2 ALA 461 13.216 1.763 11.602 691 HB3 ALA 461 HB3 ALA 461 13.179 0.017 11.847 692 H HIS 462 HN HIS 462 11.389 0.947 14.944 693 HA HIS 462 HA HIS 462 11.112 -1.786 15.436 694 HB2 HIS 462 HB2 HIS 462 11.837 -0.017 17.081 695 HB3 HIS 462 HB1 HIS 462 10.144 0.427 17.252 696 HD2 HIS 462 HD2 HIS 462 8.661 -1.148 18.910 697 HE1 HIS 462 HE1 HIS 462 11.740 -3.912 19.785 698 HE2 HIS 462 HE2 HIS 462 9.323 -3.289 20.216 699 H GLN 463 HN GLN 463 8.704 0.708 14.907 700 HA GLN 463 HA GLN 463 6.463 -0.868 15.672 701 HB2 GLN 463 HB2 GLN 463 6.430 1.609 15.608 702 HB3 GLN 463 HB1 GLN 463 6.563 1.549 13.856 703 HG2 GLN 463 HG2 GLN 463 4.269 1.963 14.591 704 HG3 GLN 463 HG1 GLN 463 4.413 0.453 13.696 705 HE21 GLN 463 HE21 GLN 463 4.120 -1.488 14.748 706 HE22 GLN 463 HE22 GLN 463 3.430 -1.596 16.329 707 H ILE 464 HN ILE 464 8.130 -0.248 12.617 708 HA ILE 464 HA ILE 464 6.262 -1.614 10.965 709 HB ILE 464 HB ILE 464 9.194 -1.013 10.516 710 HG12 ILE 464 HG12 ILE 464 6.683 0.337 9.504 711 HG13 ILE 464 HG11 ILE 464 7.763 0.970 10.742 712 HG21 ILE 464 HG21 ILE 464 8.705 -1.429 8.122 713 HG22 ILE 464 HG22 ILE 464 7.118 -2.042 8.585 714 HG23 ILE 464 HG23 ILE 464 8.576 -2.877 9.121 715 HD11 ILE 464 HD11 ILE 464 8.103 2.021 8.558 716 HD12 ILE 464 HD12 ILE 464 8.528 0.449 7.881 717 HD13 ILE 464 HD13 ILE 464 9.542 1.177 9.127 718 H GLN 465 HN GLN 465 9.077 -2.585 12.807 719 HA GLN 465 HA GLN 465 9.401 -5.171 11.742 720 HB2 GLN 465 HB2 GLN 465 10.909 -3.749 13.363 721 HB3 GLN 465 HB1 GLN 465 9.997 -4.582 14.617 722 HG2 GLN 465 HG2 GLN 465 12.062 -5.744 14.172 723 HG3 GLN 465 HG1 GLN 465 10.692 -6.739 13.676 724 HE21 GLN 465 HE21 GLN 465 11.812 -7.942 12.208 725 HE22 GLN 465 HE22 GLN 465 12.429 -7.304 10.722 726 H GLU 466 HN GLU 466 7.053 -3.839 13.848 727 HA GLU 466 HA GLU 466 6.225 -6.359 14.988 728 HB2 GLU 466 HB2 GLU 466 5.138 -3.551 15.093 729 HB3 GLU 466 HB1 GLU 466 4.249 -4.908 15.765 730 HG2 GLU 466 HG2 GLU 466 7.002 -4.023 16.584 731 HG3 GLU 466 HG1 GLU 466 5.508 -3.734 17.475 732 H MET 467 HN MET 467 5.688 -4.599 12.136 733 HA MET 467 HA MET 467 3.111 -5.844 11.565 734 HB2 MET 467 HB2 MET 467 4.735 -4.077 9.729 735 HB3 MET 467 HB1 MET 467 3.015 -4.425 9.641 736 HG2 MET 467 HG2 MET 467 4.201 -2.996 11.992 737 HG3 MET 467 HG1 MET 467 3.757 -2.141 10.518 738 HE1 MET 467 HE1 MET 467 1.252 -3.213 9.417 739 HE2 MET 467 HE2 MET 467 1.282 -1.508 9.862 740 HE3 MET 467 HE3 MET 467 -0.076 -2.520 10.350 741 H PHE 468 HN PHE 468 6.410 -5.719 10.268 742 HA PHE 468 HA PHE 468 5.920 -8.317 8.965 743 HB2 PHE 468 HB2 PHE 468 7.499 -5.965 7.910 744 HB3 PHE 468 HB1 PHE 468 7.610 -7.586 7.234 745 HD1 PHE 468 HD1 PHE 468 5.419 -4.691 7.733 746 HD2 PHE 468 HD2 PHE 468 5.911 -8.455 5.820 747 HE1 PHE 468 HE1 PHE 468 3.494 -4.201 6.290 748 HE2 PHE 468 HE2 PHE 468 3.984 -7.975 4.371 749 HZ PHE 468 HZ PHE 468 2.773 -5.843 4.606 750 HA PRO 469 HA PRO 469 9.460 -8.984 11.719 751 HB2 PRO 469 HB2 PRO 469 8.887 -11.532 12.359 752 HB3 PRO 469 HB1 PRO 469 8.002 -10.173 13.075 753 HG2 PRO 469 HG2 PRO 469 7.173 -12.017 10.898 754 HG3 PRO 469 HG1 PRO 469 6.215 -11.324 12.221 755 HD2 PRO 469 HD2 PRO 469 6.250 -10.370 9.622 756 HD3 PRO 469 HD1 PRO 469 5.747 -9.436 11.045 757 H GLN 470 HN GLN 470 8.644 -10.189 8.684 758 HA GLN 470 HA GLN 470 10.824 -12.102 8.534 759 HB2 GLN 470 HB2 GLN 470 10.001 -12.722 6.409 760 HB3 GLN 470 HB1 GLN 470 8.582 -12.447 7.407 761 HG2 GLN 470 HG2 GLN 470 9.398 -10.050 6.002 762 HG3 GLN 470 HG1 GLN 470 9.079 -11.388 4.903 763 HE21 GLN 470 HE21 GLN 470 7.225 -10.519 4.058 764 HE22 GLN 470 HE22 GLN 470 5.763 -10.347 4.967 765 H VAL 471 HN VAL 471 10.472 -8.772 8.088 766 HA VAL 471 HA VAL 471 12.593 -8.640 6.079 767 HB VAL 471 HB VAL 471 10.641 -7.199 5.709 768 HG11 VAL 471 HG11 VAL 471 10.201 -5.275 7.153 769 HG12 VAL 471 HG12 VAL 471 11.440 -5.839 8.275 770 HG13 VAL 471 HG13 VAL 471 9.985 -6.801 8.012 771 HG21 VAL 471 HG21 VAL 471 12.774 -6.477 4.828 772 HG22 VAL 471 HG22 VAL 471 13.158 -5.673 6.349 773 HG23 VAL 471 HG23 VAL 471 11.831 -5.080 5.349 774 HA PRO 472 HA PRO 472 15.736 -8.155 9.185 775 HB2 PRO 472 HB2 PRO 472 17.123 -6.648 7.022 776 HB3 PRO 472 HB1 PRO 472 17.687 -8.037 7.969 777 HG2 PRO 472 HG2 PRO 472 16.962 -8.348 5.451 778 HG3 PRO 472 HG1 PRO 472 16.552 -9.566 6.676 779 HD2 PRO 472 HD2 PRO 472 14.805 -7.489 5.428 780 HD3 PRO 472 HD1 PRO 472 14.434 -9.169 5.868 781 H TYR 473 HN TYR 473 15.951 -6.707 10.733 782 HA TYR 473 HA TYR 473 14.660 -4.237 10.779 783 HB2 TYR 473 HB2 TYR 473 15.430 -5.712 12.719 784 HB3 TYR 473 HB1 TYR 473 17.010 -4.968 12.518 785 HD1 TYR 473 HD2 TYR 473 13.445 -3.866 12.801 786 HD2 TYR 473 HD1 TYR 473 17.492 -3.244 13.952 787 HE1 TYR 473 HE2 TYR 473 12.738 -2.029 14.273 788 HE2 TYR 473 HE1 TYR 473 16.795 -1.412 15.436 789 HH TYR 473 HH TYR 473 14.898 0.187 15.619 790 H HIS 474 HN HIS 474 18.028 -5.042 10.061 791 HA HIS 474 HA HIS 474 18.959 -2.370 10.075 792 HB2 HIS 474 HB2 HIS 474 20.983 -3.193 9.112 793 HB3 HIS 474 HB1 HIS 474 20.418 -4.394 10.262 794 HD2 HIS 474 HD2 HIS 474 21.175 -3.996 6.500 795 HE1 HIS 474 HE1 HIS 474 19.983 -7.992 7.227 796 HE2 HIS 474 HE2 HIS 474 21.196 -6.442 5.635 797 H LEU 475 HN LEU 475 17.308 -4.275 7.686 798 HA LEU 475 HA LEU 475 17.950 -2.519 5.502 799 HB2 LEU 475 HB2 LEU 475 16.015 -4.792 5.839 800 HB3 LEU 475 HB1 LEU 475 16.002 -3.792 4.401 801 HG LEU 475 HG LEU 475 18.263 -5.538 5.366 802 HD11 LEU 475 HD11 LEU 475 16.407 -6.705 4.270 803 HD12 LEU 475 HD12 LEU 475 17.884 -6.758 3.309 804 HD13 LEU 475 HD13 LEU 475 16.585 -5.649 2.869 805 HD21 LEU 475 HD21 LEU 475 19.329 -3.644 4.461 806 HD22 LEU 475 HD22 LEU 475 18.153 -3.508 3.154 807 HD23 LEU 475 HD23 LEU 475 19.312 -4.838 3.163 808 H VAL 476 HN VAL 476 15.355 -2.900 7.823 809 HA VAL 476 HA VAL 476 13.533 -1.082 6.646 810 HB VAL 476 HB VAL 476 13.834 -1.739 9.587 811 HG11 VAL 476 HG11 VAL 476 11.423 -1.162 9.682 812 HG12 VAL 476 HG12 VAL 476 11.520 -0.622 8.005 813 HG13 VAL 476 HG13 VAL 476 12.451 0.207 9.254 814 HG21 VAL 476 HG21 VAL 476 12.179 -3.091 7.458 815 HG22 VAL 476 HG22 VAL 476 12.081 -3.424 9.187 816 HG23 VAL 476 HG23 VAL 476 13.565 -3.778 8.305 817 H LEU 477 HN LEU 477 16.142 -0.742 8.998 818 HA LEU 477 HA LEU 477 15.774 1.956 9.657 819 HB2 LEU 477 HB2 LEU 477 18.244 0.230 9.591 820 HB3 LEU 477 HB1 LEU 477 18.258 1.881 10.181 821 HG LEU 477 HG LEU 477 16.503 -0.274 11.348 822 HD11 LEU 477 HD11 LEU 477 18.161 -0.346 13.187 823 HD12 LEU 477 HD12 LEU 477 19.236 0.659 12.213 824 HD13 LEU 477 HD13 LEU 477 18.792 -0.954 11.657 825 HD21 LEU 477 HD21 LEU 477 15.730 1.983 11.778 826 HD22 LEU 477 HD22 LEU 477 17.335 2.453 12.333 827 HD23 LEU 477 HD23 LEU 477 16.390 1.284 13.256 828 H GLN 478 HN GLN 478 17.288 0.424 6.905 829 HA GLN 478 HA GLN 478 18.722 2.634 5.916 830 HB2 GLN 478 HB2 GLN 478 19.133 0.362 5.120 831 HB3 GLN 478 HB1 GLN 478 17.515 0.289 4.435 832 HG2 GLN 478 HG2 GLN 478 18.156 2.203 2.954 833 HG3 GLN 478 HG1 GLN 478 19.804 2.027 3.552 834 HE21 GLN 478 HE21 GLN 478 17.668 -0.687 3.014 835 HE22 GLN 478 HE22 GLN 478 18.526 -1.334 1.662 836 H ASP 479 HN ASP 479 15.509 1.381 4.973 837 HA ASP 479 HA ASP 479 14.927 3.520 3.208 838 HB2 ASP 479 HB2 ASP 479 13.774 1.289 3.197 839 HB3 ASP 479 HB1 ASP 479 12.931 1.772 4.665 840 H LEU 480 HN LEU 480 14.415 2.998 6.636 841 HA LEU 480 HA LEU 480 12.671 5.138 7.125 842 HB2 LEU 480 HB2 LEU 480 14.141 3.240 8.663 843 HB3 LEU 480 HB1 LEU 480 14.415 4.828 9.353 844 HG LEU 480 HG LEU 480 12.559 3.770 10.473 845 HD11 LEU 480 HD11 LEU 480 11.579 5.941 8.624 846 HD12 LEU 480 HD12 LEU 480 12.438 6.189 10.142 847 HD13 LEU 480 HD13 LEU 480 10.835 5.458 10.147 848 HD21 LEU 480 HD21 LEU 480 10.513 3.159 9.278 849 HD22 LEU 480 HD22 LEU 480 11.896 2.222 8.713 850 HD23 LEU 480 HD23 LEU 480 11.287 3.564 7.746 851 H GLN 481 HN GLN 481 16.105 5.025 6.593 852 HA GLN 481 HA GLN 481 16.487 7.766 7.489 853 HB2 GLN 481 HB2 GLN 481 18.359 5.721 6.298 854 HB3 GLN 481 HB1 GLN 481 18.849 7.363 6.678 855 HG2 GLN 481 HG2 GLN 481 18.376 7.008 9.016 856 HG3 GLN 481 HG1 GLN 481 17.768 5.389 8.671 857 HE21 GLN 481 HE21 GLN 481 19.281 4.439 10.030 858 HE22 GLN 481 HE22 GLN 481 20.951 4.310 9.604 859 H LEU 482 HN LEU 482 15.382 6.248 4.755 860 HA LEU 482 HA LEU 482 16.419 8.290 2.924 861 HB2 LEU 482 HB2 LEU 482 16.099 5.579 2.610 862 HB3 LEU 482 HB1 LEU 482 14.663 6.209 1.830 863 HG LEU 482 HG LEU 482 16.421 5.856 0.201 864 HD11 LEU 482 HD11 LEU 482 16.512 8.067 -0.812 865 HD12 LEU 482 HD12 LEU 482 15.989 8.794 0.708 866 HD13 LEU 482 HD13 LEU 482 14.902 7.724 -0.178 867 HD21 LEU 482 HD21 LEU 482 18.328 6.086 1.737 868 HD22 LEU 482 HD22 LEU 482 18.062 7.828 1.782 869 HD23 LEU 482 HD23 LEU 482 18.520 7.046 0.270 870 H THR 483 HN THR 483 13.305 6.660 3.584 871 HA THR 483 HA THR 483 11.869 8.908 2.429 872 HB THR 483 HB THR 483 9.852 7.554 2.824 873 HG1 THR 483 HG1 THR 483 11.150 5.243 3.534 874 HG21 THR 483 HG21 THR 483 10.394 5.699 1.306 875 HG22 THR 483 HG22 THR 483 12.114 6.003 1.554 876 HG23 THR 483 HG23 THR 483 11.112 7.214 0.757 877 H ARG 484 HN ARG 484 12.347 7.401 5.580 878 HA ARG 484 HA ARG 484 11.920 8.074 7.706 879 HB2 ARG 484 HB2 ARG 484 11.743 10.810 6.425 880 HB3 ARG 484 HB1 ARG 484 11.774 10.519 8.157 881 HG2 ARG 484 HG2 ARG 484 13.971 10.849 7.957 882 HG3 ARG 484 HG1 ARG 484 14.002 9.191 7.350 883 HD2 ARG 484 HD2 ARG 484 13.917 9.958 5.080 884 HD3 ARG 484 HD1 ARG 484 13.662 11.623 5.602 885 HE ARG 484 HE ARG 484 16.159 10.217 5.427 886 HH11 ARG 484 HH11 ARG 484 14.453 12.829 7.034 887 HH12 ARG 484 HH12 ARG 484 15.902 13.682 7.461 888 HH21 ARG 484 HH21 ARG 484 18.067 11.360 5.962 889 HH22 ARG 484 HH22 ARG 484 17.957 12.843 6.857 890 H SER 485 HN SER 485 9.804 7.049 6.222 891 HA SER 485 HA SER 485 7.573 8.117 7.714 892 HB2 SER 485 HB2 SER 485 7.651 9.534 5.664 893 HB3 SER 485 HB1 SER 485 7.487 8.082 4.685 894 HG SER 485 HG SER 485 5.549 8.319 6.625 895 H VAL 486 HN VAL 486 6.864 6.274 8.608 896 HA VAL 486 HA VAL 486 7.251 3.694 7.617 897 HB VAL 486 HB VAL 486 5.515 2.957 9.218 898 HG11 VAL 486 HG11 VAL 486 7.415 5.011 10.340 899 HG12 VAL 486 HG12 VAL 486 7.793 3.324 10.000 900 HG13 VAL 486 HG13 VAL 486 6.623 3.728 11.255 901 HG21 VAL 486 HG21 VAL 486 3.947 4.807 8.971 902 HG22 VAL 486 HG22 VAL 486 5.105 5.902 9.728 903 HG23 VAL 486 HG23 VAL 486 4.398 4.583 10.662 904 H GLU 487 HN GLU 487 4.824 6.055 6.950 905 HA GLU 487 HA GLU 487 2.820 4.413 5.864 906 HB2 GLU 487 HB2 GLU 487 3.498 7.258 5.098 907 HB3 GLU 487 HB1 GLU 487 1.946 6.460 4.889 908 HG2 GLU 487 HG2 GLU 487 1.454 7.564 6.788 909 HG3 GLU 487 HG1 GLU 487 2.229 6.172 7.538 910 H ILE 488 HN ILE 488 5.874 5.466 4.630 911 HA ILE 488 HA ILE 488 5.170 4.592 1.907 912 HB ILE 488 HB ILE 488 7.722 5.980 2.719 913 HG12 ILE 488 HG12 ILE 488 5.223 7.277 1.618 914 HG13 ILE 488 HG11 ILE 488 5.739 7.373 3.299 915 HG21 ILE 488 HG21 ILE 488 6.346 5.716 0.047 916 HG22 ILE 488 HG22 ILE 488 7.751 4.791 0.577 917 HG23 ILE 488 HG23 ILE 488 7.877 6.535 0.353 918 HD11 ILE 488 HD11 ILE 488 7.194 8.456 0.899 919 HD12 ILE 488 HD12 ILE 488 7.817 8.476 2.549 920 HD13 ILE 488 HD13 ILE 488 6.359 9.383 2.147 921 H THR 489 HN THR 489 7.610 4.206 4.430 922 HA THR 489 HA THR 489 9.356 2.438 3.252 923 HB THR 489 HB THR 489 8.487 2.392 6.148 924 HG1 THR 489 HG1 THR 489 10.506 3.907 4.806 925 HG21 THR 489 HG21 THR 489 10.978 1.417 4.748 926 HG22 THR 489 HG22 THR 489 9.823 0.461 5.678 927 HG23 THR 489 HG23 THR 489 10.857 1.632 6.494 928 H THR 490 HN THR 490 6.531 1.546 5.232 929 HA THR 490 HA THR 490 6.846 -1.217 4.966 930 HB THR 490 HB THR 490 4.114 -0.055 5.258 931 HG1 THR 490 HG1 THR 490 5.053 1.328 6.639 932 HG21 THR 490 HG21 THR 490 4.473 -2.472 5.456 933 HG22 THR 490 HG22 THR 490 3.965 -1.779 6.995 934 HG23 THR 490 HG23 THR 490 5.659 -2.191 6.728 935 H ASP 491 HN ASP 491 5.139 1.133 2.940 936 HA ASP 491 HA ASP 491 3.882 -0.795 1.264 937 HB2 ASP 491 HB2 ASP 491 3.014 1.472 1.295 938 HB3 ASP 491 HB1 ASP 491 4.569 2.115 0.777 939 H ASN 492 HN ASN 492 6.866 1.061 1.128 940 HA ASN 492 HA ASN 492 7.837 0.368 -1.363 941 HB2 ASN 492 HB2 ASN 492 9.235 0.925 1.246 942 HB3 ASN 492 HB1 ASN 492 10.151 0.534 -0.205 943 HD21 ASN 492 HD21 ASN 492 10.572 2.899 1.032 944 HD22 ASN 492 HD22 ASN 492 9.922 4.191 0.076 945 H ILE 493 HN ILE 493 8.057 -1.440 1.669 946 HA ILE 493 HA ILE 493 9.697 -3.540 0.740 947 HB ILE 493 HB ILE 493 7.580 -3.646 2.904 948 HG12 ILE 493 HG12 ILE 493 10.553 -3.142 3.169 949 HG13 ILE 493 HG11 ILE 493 9.334 -1.874 3.194 950 HG21 ILE 493 HG21 ILE 493 8.884 -5.525 3.792 951 HG22 ILE 493 HG22 ILE 493 9.959 -5.434 2.397 952 HG23 ILE 493 HG23 ILE 493 8.264 -5.866 2.178 953 HD11 ILE 493 HD11 ILE 493 9.542 -4.141 5.159 954 HD12 ILE 493 HD12 ILE 493 8.355 -2.837 5.197 955 HD13 ILE 493 HD13 ILE 493 10.064 -2.478 5.436 956 H LEU 494 HN LEU 494 6.185 -3.158 0.857 957 HA LEU 494 HA LEU 494 5.547 -5.730 -0.141 958 HB2 LEU 494 HB2 LEU 494 3.990 -3.152 -0.035 959 HB3 LEU 494 HB1 LEU 494 3.305 -4.663 -0.603 960 HG LEU 494 HG LEU 494 4.532 -4.452 2.132 961 HD11 LEU 494 HD11 LEU 494 1.660 -3.903 1.409 962 HD12 LEU 494 HD12 LEU 494 2.834 -2.693 1.935 963 HD13 LEU 494 HD13 LEU 494 2.338 -3.978 3.036 964 HD21 LEU 494 HD21 LEU 494 3.871 -6.628 0.854 965 HD22 LEU 494 HD22 LEU 494 2.227 -6.172 1.335 966 HD23 LEU 494 HD23 LEU 494 3.468 -6.439 2.562 967 H GLU 495 HN GLU 495 6.255 -2.670 -1.664 968 HA GLU 495 HA GLU 495 5.344 -3.436 -4.267 969 HB2 GLU 495 HB2 GLU 495 7.174 -1.197 -3.393 970 HB3 GLU 495 HB1 GLU 495 6.519 -1.385 -5.013 971 HG2 GLU 495 HG2 GLU 495 4.799 -1.112 -2.571 972 HG3 GLU 495 HG1 GLU 495 5.346 0.260 -3.533 973 H GLY 496 HN GLY 496 8.393 -3.545 -2.544 974 HA2 GLY 496 HA2 GLY 496 9.930 -5.337 -3.210 975 HA3 GLY 496 HA1 GLY 496 9.557 -4.934 -4.880 976 H ARG 497 HN ARG 497 9.867 -2.264 -2.779 977 HA ARG 497 HA ARG 497 12.161 -1.294 -4.187 978 HB2 ARG 497 HB2 ARG 497 10.256 -0.251 -2.239 979 HB3 ARG 497 HB1 ARG 497 11.896 0.299 -1.928 980 HG2 ARG 497 HG2 ARG 497 11.185 1.951 -3.324 981 HG3 ARG 497 HG1 ARG 497 11.853 0.827 -4.509 982 HD2 ARG 497 HD2 ARG 497 9.785 1.392 -5.416 983 HD3 ARG 497 HD1 ARG 497 9.462 -0.138 -4.605 984 HE ARG 497 HE ARG 497 8.894 1.817 -2.746 985 HH11 ARG 497 HH11 ARG 497 7.747 0.993 -5.956 986 HH12 ARG 497 HH12 ARG 497 6.151 1.606 -5.675 987 HH21 ARG 497 HH21 ARG 497 6.802 2.630 -2.380 988 HH22 ARG 497 HH22 ARG 497 5.610 2.537 -3.638 989 H ILE 498 HN ILE 498 11.575 -2.874 -1.142 990 HA ILE 498 HA ILE 498 14.390 -2.618 -0.383 991 HB ILE 498 HB ILE 498 11.921 -3.422 1.146 992 HG12 ILE 498 HG12 ILE 498 13.141 -1.776 2.784 993 HG13 ILE 498 HG11 ILE 498 14.019 -1.293 1.336 994 HG21 ILE 498 HG21 ILE 498 13.542 -5.138 1.691 995 HG22 ILE 498 HG22 ILE 498 13.342 -4.044 3.060 996 HG23 ILE 498 HG23 ILE 498 14.764 -3.911 2.026 997 HD11 ILE 498 HD11 ILE 498 11.900 -0.750 0.247 998 HD12 ILE 498 HD12 ILE 498 12.140 0.173 1.731 999 HD13 ILE 498 HD13 ILE 498 11.037 -1.203 1.716 1000 H GLN 499 HN GLN 499 15.756 -4.325 -0.420 1001 HA GLN 499 HA GLN 499 15.105 -6.582 -1.993 1002 HB2 GLN 499 HB2 GLN 499 17.481 -6.184 -0.170 1003 HB3 GLN 499 HB1 GLN 499 17.355 -7.366 -1.465 1004 HG2 GLN 499 HG2 GLN 499 17.440 -4.371 -1.743 1005 HG3 GLN 499 HG1 GLN 499 18.687 -5.524 -2.217 1006 HE21 GLN 499 HE21 GLN 499 17.194 -3.519 -3.782 1007 HE22 GLN 499 HE22 GLN 499 16.470 -4.399 -5.083 1008 H VAL 500 HN VAL 500 13.912 -8.233 -1.382 1009 HA VAL 500 HA VAL 500 13.533 -8.866 1.413 1010 HB VAL 500 HB VAL 500 11.957 -10.606 0.551 1011 HG11 VAL 500 HG11 VAL 500 11.189 -8.347 1.117 1012 HG12 VAL 500 HG12 VAL 500 10.261 -9.035 -0.216 1013 HG13 VAL 500 HG13 VAL 500 11.506 -7.828 -0.539 1014 HG21 VAL 500 HG21 VAL 500 12.640 -9.424 -2.142 1015 HG22 VAL 500 HG22 VAL 500 11.364 -10.599 -1.822 1016 HG23 VAL 500 HG23 VAL 500 13.054 -11.047 -1.590 1017 HA PRO 501 HA PRO 501 16.374 -12.199 1.853 1018 HB2 PRO 501 HB2 PRO 501 14.193 -13.920 2.892 1019 HB3 PRO 501 HB1 PRO 501 15.689 -13.393 3.684 1020 HG2 PRO 501 HG2 PRO 501 13.338 -12.397 4.404 1021 HG3 PRO 501 HG1 PRO 501 14.799 -11.390 4.359 1022 HD2 PRO 501 HD2 PRO 501 12.542 -11.517 2.407 1023 HD3 PRO 501 HD1 PRO 501 13.455 -10.110 2.992 1024 H PHE 502 HN PHE 502 16.876 -12.849 -0.188 1025 HA PHE 502 HA PHE 502 15.225 -14.976 -1.381 1026 HB2 PHE 502 HB2 PHE 502 15.251 -13.056 -2.835 1027 HB3 PHE 502 HB1 PHE 502 16.992 -12.878 -2.666 1028 HD1 PHE 502 HD1 PHE 502 14.350 -15.049 -4.083 1029 HD2 PHE 502 HD2 PHE 502 18.467 -13.977 -4.111 1030 HE1 PHE 502 HE1 PHE 502 14.685 -16.403 -6.109 1031 HE2 PHE 502 HE2 PHE 502 18.810 -15.332 -6.136 1032 HZ PHE 502 HZ PHE 502 16.917 -16.549 -7.135 1033 HA PRO 503 HA PRO 503 18.659 -17.680 -0.547 1034 HB2 PRO 503 HB2 PRO 503 18.106 -19.560 -2.491 1035 HB3 PRO 503 HB1 PRO 503 17.311 -19.500 -0.908 1036 HG2 PRO 503 HG2 PRO 503 16.340 -18.524 -3.541 1037 HG3 PRO 503 HG1 PRO 503 15.449 -19.323 -2.231 1038 HD2 PRO 503 HD2 PRO 503 15.300 -16.668 -2.641 1039 HD3 PRO 503 HD1 PRO 503 15.222 -17.380 -1.014 1040 H THR 504 HN THR 504 20.478 -16.629 -1.152 1041 HA THR 504 HA THR 504 21.409 -17.088 -3.881 1042 HB THR 504 HB THR 504 20.579 -14.783 -3.881 1043 HG1 THR 504 HG1 THR 504 23.084 -15.527 -4.446 1044 HG21 THR 504 HG21 THR 504 20.741 -14.305 -1.494 1045 HG22 THR 504 HG22 THR 504 21.591 -13.077 -2.432 1046 HG23 THR 504 HG23 THR 504 22.499 -14.335 -1.592 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 -18.319 -11.606 14.761 2 H2 MET 1 HT2 MET 1 -17.896 -12.936 13.802 3 H3 MET 1 HT3 MET 1 -17.435 -11.376 13.339 4 HA MET 1 HA MET 1 -16.567 -12.453 15.925 5 HB2 MET 1 HB2 MET 1 -14.601 -13.422 14.957 6 HB3 MET 1 HB1 MET 1 -15.986 -14.105 14.120 7 HG2 MET 1 HG2 MET 1 -15.611 -12.517 12.273 8 HG3 MET 1 HG1 MET 1 -14.179 -11.919 13.109 9 HE1 MET 1 HE1 MET 1 -12.500 -13.883 10.216 10 HE2 MET 1 HE2 MET 1 -12.630 -12.350 11.077 11 HE3 MET 1 HE3 MET 1 -13.983 -12.934 10.109 12 H GLN 2 HN GLN 2 -14.518 -11.396 16.557 13 HA GLN 2 HA GLN 2 -14.442 -8.652 15.499 14 HB2 GLN 2 HB2 GLN 2 -13.810 -9.838 18.183 15 HB3 GLN 2 HB1 GLN 2 -13.123 -8.289 17.715 16 HG2 GLN 2 HG2 GLN 2 -16.064 -8.925 17.785 17 HG3 GLN 2 HG1 GLN 2 -15.176 -8.070 19.047 18 HE21 GLN 2 HE21 GLN 2 -17.419 -7.158 17.452 19 HE22 GLN 2 HE22 GLN 2 -16.879 -5.743 16.621 20 H ILE 3 HN ILE 3 -12.575 -7.746 14.787 21 HA ILE 3 HA ILE 3 -10.144 -9.407 14.858 22 HB ILE 3 HB ILE 3 -9.545 -8.540 12.604 23 HG12 ILE 3 HG12 ILE 3 -12.443 -7.737 12.349 24 HG13 ILE 3 HG11 ILE 3 -11.178 -6.583 12.760 25 HG21 ILE 3 HG21 ILE 3 -11.021 -10.047 11.347 26 HG22 ILE 3 HG22 ILE 3 -12.085 -10.155 12.749 27 HG23 ILE 3 HG23 ILE 3 -10.438 -10.778 12.842 28 HD11 ILE 3 HD11 ILE 3 -11.224 -8.253 10.258 29 HD12 ILE 3 HD12 ILE 3 -10.074 -6.978 10.660 30 HD13 ILE 3 HD13 ILE 3 -11.768 -6.580 10.371 31 H PHE 4 HN PHE 4 -8.146 -8.120 14.494 32 HA PHE 4 HA PHE 4 -8.467 -5.412 15.609 33 HB2 PHE 4 HB2 PHE 4 -6.269 -7.433 16.102 34 HB3 PHE 4 HB1 PHE 4 -6.212 -5.760 16.648 35 HD1 PHE 4 HD1 PHE 4 -7.989 -4.963 18.258 36 HD2 PHE 4 HD2 PHE 4 -7.364 -9.078 17.357 37 HE1 PHE 4 HE1 PHE 4 -9.172 -5.592 20.320 38 HE2 PHE 4 HE2 PHE 4 -8.548 -9.711 19.418 39 HZ PHE 4 HZ PHE 4 -9.451 -7.970 20.902 40 H VAL 5 HN VAL 5 -8.294 -4.147 13.825 41 HA VAL 5 HA VAL 5 -6.173 -4.659 11.890 42 HB VAL 5 HB VAL 5 -8.220 -2.432 11.937 43 HG11 VAL 5 HG11 VAL 5 -7.634 -2.128 9.582 44 HG12 VAL 5 HG12 VAL 5 -6.394 -3.376 9.729 45 HG13 VAL 5 HG13 VAL 5 -6.242 -1.867 10.633 46 HG21 VAL 5 HG21 VAL 5 -9.307 -4.603 11.744 47 HG22 VAL 5 HG22 VAL 5 -8.234 -5.035 10.412 48 HG23 VAL 5 HG23 VAL 5 -9.397 -3.726 10.215 49 H LYS 6 HN LYS 6 -4.202 -3.968 12.413 50 HA LYS 6 HA LYS 6 -3.935 -1.620 14.140 51 HB2 LYS 6 HB2 LYS 6 -2.009 -3.809 13.384 52 HB3 LYS 6 HB1 LYS 6 -1.512 -2.363 14.255 53 HG2 LYS 6 HG2 LYS 6 -3.251 -2.949 15.981 54 HG3 LYS 6 HG1 LYS 6 -3.414 -4.504 15.161 55 HD2 LYS 6 HD2 LYS 6 -0.974 -4.863 15.483 56 HD3 LYS 6 HD1 LYS 6 -0.918 -3.371 16.423 57 HE2 LYS 6 HE2 LYS 6 -2.560 -4.333 17.989 58 HE3 LYS 6 HE1 LYS 6 -2.527 -5.837 17.069 59 HZ1 LYS 6 HZ1 LYS 6 -1.090 -6.016 18.956 60 HZ2 LYS 6 HZ2 LYS 6 -0.260 -4.607 18.534 61 HZ3 LYS 6 HZ3 LYS 6 -0.136 -5.985 17.561 62 H THR 7 HN THR 7 -3.195 0.244 13.466 63 HA THR 7 HA THR 7 -2.360 0.498 10.668 64 HB THR 7 HB THR 7 -2.669 2.954 12.264 65 HG1 THR 7 HG1 THR 7 -4.699 1.016 12.121 66 HG21 THR 7 HG21 THR 7 -3.843 1.976 9.661 67 HG22 THR 7 HG22 THR 7 -2.440 3.026 9.855 68 HG23 THR 7 HG23 THR 7 -4.043 3.603 10.311 69 H LEU 8 HN LEU 8 -0.558 2.016 10.204 70 HA LEU 8 HA LEU 8 1.760 1.345 11.681 71 HB2 LEU 8 HB2 LEU 8 1.305 3.421 9.548 72 HB3 LEU 8 HB1 LEU 8 2.884 3.004 10.188 73 HG LEU 8 HG LEU 8 1.068 1.001 8.852 74 HD11 LEU 8 HD11 LEU 8 3.369 2.517 7.640 75 HD12 LEU 8 HD12 LEU 8 1.664 2.813 7.298 76 HD13 LEU 8 HD13 LEU 8 2.397 1.271 6.858 77 HD21 LEU 8 HD21 LEU 8 3.143 -0.295 8.641 78 HD22 LEU 8 HD22 LEU 8 2.745 0.037 10.327 79 HD23 LEU 8 HD23 LEU 8 4.009 0.965 9.521 80 H THR 9 HN THR 9 -0.602 3.516 12.456 81 HA THR 9 HA THR 9 1.156 5.476 13.699 82 HB THR 9 HB THR 9 -1.347 6.186 14.482 83 HG1 THR 9 HG1 THR 9 -2.728 5.749 12.697 84 HG21 THR 9 HG21 THR 9 0.238 7.635 13.318 85 HG22 THR 9 HG22 THR 9 -1.352 7.726 12.561 86 HG23 THR 9 HG23 THR 9 -0.071 6.777 11.808 87 H GLY 10 HN GLY 10 0.124 2.478 14.455 88 HA2 GLY 10 HA2 GLY 10 0.371 1.351 16.478 89 HA3 GLY 10 HA1 GLY 10 0.555 2.899 17.291 90 H LYS 11 HN LYS 11 -2.128 2.527 15.185 91 HA LYS 11 HA LYS 11 -3.922 2.547 17.500 92 HB2 LYS 11 HB2 LYS 11 -4.112 4.372 15.834 93 HB3 LYS 11 HB1 LYS 11 -4.498 3.181 14.599 94 HG2 LYS 11 HG2 LYS 11 -6.530 2.577 15.788 95 HG3 LYS 11 HG1 LYS 11 -6.142 3.736 17.063 96 HD2 LYS 11 HD2 LYS 11 -6.263 5.564 15.445 97 HD3 LYS 11 HD1 LYS 11 -6.622 4.410 14.160 98 HE2 LYS 11 HE2 LYS 11 -8.699 3.804 15.224 99 HE3 LYS 11 HE1 LYS 11 -8.324 4.819 16.616 100 HZ1 LYS 11 HZ1 LYS 11 -8.401 6.753 15.157 101 HZ2 LYS 11 HZ2 LYS 11 -9.869 5.917 15.135 102 HZ3 LYS 11 HZ3 LYS 11 -8.790 5.769 13.833 103 H THR 12 HN THR 12 -5.398 0.964 17.861 104 HA THR 12 HA THR 12 -5.402 -1.304 15.983 105 HB THR 12 HB THR 12 -6.160 -1.464 18.900 106 HG1 THR 12 HG1 THR 12 -3.877 -0.765 18.383 107 HG21 THR 12 HG21 THR 12 -6.912 -3.285 17.410 108 HG22 THR 12 HG22 THR 12 -5.733 -3.845 18.596 109 HG23 THR 12 HG23 THR 12 -5.239 -3.561 16.927 110 H ILE 13 HN ILE 13 -7.146 -1.068 14.725 111 HA ILE 13 HA ILE 13 -9.631 -0.010 15.828 112 HB ILE 13 HB ILE 13 -9.114 -0.882 12.988 113 HG12 ILE 13 HG12 ILE 13 -8.881 1.936 14.049 114 HG13 ILE 13 HG11 ILE 13 -7.492 0.870 13.863 115 HG21 ILE 13 HG21 ILE 13 -11.138 1.038 14.141 116 HG22 ILE 13 HG22 ILE 13 -11.471 -0.619 13.636 117 HG23 ILE 13 HG23 ILE 13 -10.972 0.583 12.446 118 HD11 ILE 13 HD11 ILE 13 -7.934 0.713 11.469 119 HD12 ILE 13 HD12 ILE 13 -7.706 2.387 11.981 120 HD13 ILE 13 HD13 ILE 13 -9.329 1.773 11.659 121 H THR 14 HN THR 14 -11.000 -1.372 16.760 122 HA THR 14 HA THR 14 -11.024 -4.188 16.061 123 HB THR 14 HB THR 14 -13.143 -3.251 17.853 124 HG1 THR 14 HG1 THR 14 -10.409 -2.787 18.543 125 HG21 THR 14 HG21 THR 14 -12.487 -5.595 17.666 126 HG22 THR 14 HG22 THR 14 -12.222 -5.002 19.305 127 HG23 THR 14 HG23 THR 14 -10.855 -5.194 18.207 128 H LEU 15 HN LEU 15 -12.260 -4.924 14.441 129 HA LEU 15 HA LEU 15 -14.721 -3.444 13.801 130 HB2 LEU 15 HB2 LEU 15 -12.795 -4.806 11.931 131 HB3 LEU 15 HB1 LEU 15 -14.390 -4.272 11.446 132 HG LEU 15 HG LEU 15 -12.227 -2.441 12.493 133 HD11 LEU 15 HD11 LEU 15 -12.025 -1.693 10.169 134 HD12 LEU 15 HD12 LEU 15 -13.156 -2.950 9.670 135 HD13 LEU 15 HD13 LEU 15 -11.589 -3.391 10.347 136 HD21 LEU 15 HD21 LEU 15 -14.440 -1.568 12.917 137 HD22 LEU 15 HD22 LEU 15 -14.923 -1.900 11.254 138 HD23 LEU 15 HD23 LEU 15 -13.703 -0.672 11.589 139 H GLU 16 HN GLU 16 -16.533 -4.563 13.253 140 HA GLU 16 HA GLU 16 -16.588 -7.347 14.125 141 HB2 GLU 16 HB2 GLU 16 -18.221 -5.579 14.971 142 HB3 GLU 16 HB1 GLU 16 -18.935 -5.606 13.366 143 HG2 GLU 16 HG2 GLU 16 -18.659 -8.258 14.523 144 HG3 GLU 16 HG1 GLU 16 -19.665 -7.179 15.490 145 H VAL 17 HN VAL 17 -16.096 -8.734 12.556 146 HA VAL 17 HA VAL 17 -17.452 -8.438 9.962 147 HB VAL 17 HB VAL 17 -15.418 -9.319 8.833 148 HG11 VAL 17 HG11 VAL 17 -14.164 -7.233 8.840 149 HG12 VAL 17 HG12 VAL 17 -14.970 -6.735 10.328 150 HG13 VAL 17 HG13 VAL 17 -15.899 -6.913 8.839 151 HG21 VAL 17 HG21 VAL 17 -14.348 -10.402 10.717 152 HG22 VAL 17 HG22 VAL 17 -14.133 -8.848 11.523 153 HG23 VAL 17 HG23 VAL 17 -13.262 -9.195 10.029 154 H GLU 18 HN GLU 18 -17.073 -10.564 8.669 155 HA GLU 18 HA GLU 18 -17.171 -12.925 10.404 156 HB2 GLU 18 HB2 GLU 18 -19.276 -12.004 8.450 157 HB3 GLU 18 HB1 GLU 18 -19.121 -13.698 8.891 158 HG2 GLU 18 HG2 GLU 18 -19.490 -11.514 10.922 159 HG3 GLU 18 HG1 GLU 18 -20.837 -12.353 10.155 160 HA PRO 19 HA PRO 19 -14.691 -14.910 7.327 161 HB2 PRO 19 HB2 PRO 19 -16.774 -17.001 6.923 162 HB3 PRO 19 HB1 PRO 19 -15.067 -17.175 7.371 163 HG2 PRO 19 HG2 PRO 19 -16.973 -17.538 9.165 164 HG3 PRO 19 HG1 PRO 19 -15.445 -16.738 9.586 165 HD2 PRO 19 HD2 PRO 19 -18.137 -15.539 9.128 166 HD3 PRO 19 HD1 PRO 19 -16.877 -15.082 10.292 167 H SER 20 HN SER 20 -18.105 -14.595 6.511 168 HA SER 20 HA SER 20 -17.718 -14.863 3.685 169 HB2 SER 20 HB2 SER 20 -20.166 -13.514 4.437 170 HB3 SER 20 HB1 SER 20 -19.944 -15.108 3.711 171 HG SER 20 HG SER 20 -20.743 -14.608 6.137 172 H ASP 21 HN ASP 21 -16.898 -12.404 5.744 173 HA ASP 21 HA ASP 21 -17.747 -10.173 4.122 174 HB2 ASP 21 HB2 ASP 21 -16.892 -10.453 6.760 175 HB3 ASP 21 HB1 ASP 21 -15.567 -9.602 5.974 176 H THR 22 HN THR 22 -16.760 -9.491 2.357 177 HA THR 22 HA THR 22 -14.275 -10.637 1.503 178 HB THR 22 HB THR 22 -14.735 -8.614 -0.266 179 HG1 THR 22 HG1 THR 22 -16.831 -8.102 -0.328 180 HG21 THR 22 HG21 THR 22 -16.109 -11.304 -0.251 181 HG22 THR 22 HG22 THR 22 -14.474 -10.986 -0.829 182 HG23 THR 22 HG23 THR 22 -15.860 -10.284 -1.665 183 H ILE 23 HN ILE 23 -12.328 -9.535 1.115 184 HA ILE 23 HA ILE 23 -11.455 -7.743 3.065 185 HB ILE 23 HB ILE 23 -10.298 -8.134 0.297 186 HG12 ILE 23 HG12 ILE 23 -10.482 -10.262 1.459 187 HG13 ILE 23 HG11 ILE 23 -8.795 -9.769 1.394 188 HG21 ILE 23 HG21 ILE 23 -9.004 -7.085 2.810 189 HG22 ILE 23 HG22 ILE 23 -9.423 -6.140 1.383 190 HG23 ILE 23 HG23 ILE 23 -8.185 -7.390 1.278 191 HD11 ILE 23 HD11 ILE 23 -10.632 -9.573 3.767 192 HD12 ILE 23 HD12 ILE 23 -8.975 -8.973 3.719 193 HD13 ILE 23 HD13 ILE 23 -9.292 -10.700 3.551 194 H GLU 24 HN GLU 24 -12.776 -7.199 -0.122 195 HA GLU 24 HA GLU 24 -12.288 -4.455 -0.397 196 HB2 GLU 24 HB2 GLU 24 -13.041 -5.930 -2.219 197 HB3 GLU 24 HB1 GLU 24 -14.596 -6.113 -1.424 198 HG2 GLU 24 HG2 GLU 24 -14.873 -3.623 -1.649 199 HG3 GLU 24 HG1 GLU 24 -13.457 -3.650 -2.700 200 H ASN 25 HN ASN 25 -14.908 -6.229 1.178 201 HA ASN 25 HA ASN 25 -16.493 -3.913 1.711 202 HB2 ASN 25 HB2 ASN 25 -17.297 -6.353 1.628 203 HB3 ASN 25 HB1 ASN 25 -16.650 -6.494 3.261 204 HD21 ASN 25 HD21 ASN 25 -18.573 -6.778 4.297 205 HD22 ASN 25 HD22 ASN 25 -19.794 -5.545 4.385 206 H VAL 26 HN VAL 26 -14.024 -5.715 3.438 207 HA VAL 26 HA VAL 26 -14.322 -4.476 5.950 208 HB VAL 26 HB VAL 26 -11.772 -5.558 4.723 209 HG11 VAL 26 HG11 VAL 26 -11.339 -4.165 6.673 210 HG12 VAL 26 HG12 VAL 26 -11.035 -5.862 7.041 211 HG13 VAL 26 HG13 VAL 26 -12.513 -5.089 7.611 212 HG21 VAL 26 HG21 VAL 26 -13.474 -7.266 4.696 213 HG22 VAL 26 HG22 VAL 26 -13.886 -6.932 6.380 214 HG23 VAL 26 HG23 VAL 26 -12.315 -7.624 5.978 215 H LYS 27 HN LYS 27 -12.518 -3.610 3.051 216 HA LYS 27 HA LYS 27 -11.072 -1.432 4.078 217 HB2 LYS 27 HB2 LYS 27 -12.033 -2.179 1.335 218 HB3 LYS 27 HB1 LYS 27 -11.245 -0.632 1.603 219 HG2 LYS 27 HG2 LYS 27 -9.287 -1.855 2.515 220 HG3 LYS 27 HG1 LYS 27 -10.079 -3.367 2.058 221 HD2 LYS 27 HD2 LYS 27 -10.101 -2.697 -0.263 222 HD3 LYS 27 HD1 LYS 27 -9.436 -1.119 0.155 223 HE2 LYS 27 HE2 LYS 27 -7.385 -2.178 0.939 224 HE3 LYS 27 HE1 LYS 27 -8.051 -3.766 0.551 225 HZ1 LYS 27 HZ1 LYS 27 -6.638 -3.086 -1.224 226 HZ2 LYS 27 HZ2 LYS 27 -7.405 -1.588 -1.357 227 HZ3 LYS 27 HZ3 LYS 27 -8.235 -3.005 -1.787 228 H ALA 28 HN ALA 28 -14.316 -1.685 2.727 229 HA ALA 28 HA ALA 28 -14.917 1.072 2.661 230 HB1 ALA 28 HB1 ALA 28 -16.219 -0.599 1.432 231 HB2 ALA 28 HB2 ALA 28 -17.249 0.378 2.478 232 HB3 ALA 28 HB3 ALA 28 -16.809 -1.262 2.954 233 H LYS 29 HN LYS 29 -15.125 -1.367 5.169 234 HA LYS 29 HA LYS 29 -16.627 0.186 7.012 235 HB2 LYS 29 HB2 LYS 29 -14.800 -2.192 7.414 236 HB3 LYS 29 HB1 LYS 29 -15.754 -1.468 8.702 237 HG2 LYS 29 HG2 LYS 29 -17.805 -1.969 7.446 238 HG3 LYS 29 HG1 LYS 29 -16.832 -2.737 6.191 239 HD2 LYS 29 HD2 LYS 29 -16.092 -4.436 7.724 240 HD3 LYS 29 HD1 LYS 29 -16.851 -3.603 9.084 241 HE2 LYS 29 HE2 LYS 29 -19.048 -3.966 8.080 242 HE3 LYS 29 HE1 LYS 29 -18.297 -4.785 6.713 243 HZ1 LYS 29 HZ1 LYS 29 -19.269 -6.158 8.649 244 HZ2 LYS 29 HZ2 LYS 29 -17.831 -5.776 9.449 245 HZ3 LYS 29 HZ3 LYS 29 -17.783 -6.625 7.978 246 H ILE 30 HN ILE 30 -13.183 -0.284 6.422 247 HA ILE 30 HA ILE 30 -12.294 1.274 8.635 248 HB ILE 30 HB ILE 30 -10.840 0.661 6.051 249 HG12 ILE 30 HG12 ILE 30 -10.720 -0.766 8.720 250 HG13 ILE 30 HG11 ILE 30 -11.574 -1.356 7.300 251 HG21 ILE 30 HG21 ILE 30 -9.863 2.544 7.274 252 HG22 ILE 30 HG22 ILE 30 -8.801 1.136 7.303 253 HG23 ILE 30 HG23 ILE 30 -9.758 1.547 8.727 254 HD11 ILE 30 HD11 ILE 30 -9.459 -2.480 7.517 255 HD12 ILE 30 HD12 ILE 30 -8.611 -0.937 7.557 256 HD13 ILE 30 HD13 ILE 30 -9.435 -1.450 6.086 257 H GLN 31 HN GLN 31 -12.984 1.934 5.256 258 HA GLN 31 HA GLN 31 -12.088 4.603 5.166 259 HB2 GLN 31 HB2 GLN 31 -12.445 3.434 3.120 260 HB3 GLN 31 HB1 GLN 31 -14.106 3.047 3.550 261 HG2 GLN 31 HG2 GLN 31 -14.579 5.518 3.462 262 HG3 GLN 31 HG1 GLN 31 -12.975 5.715 2.755 263 HE21 GLN 31 HE21 GLN 31 -13.872 6.504 0.814 264 HE22 GLN 31 HE22 GLN 31 -14.661 5.454 -0.309 265 H ASP 32 HN ASP 32 -15.072 3.130 6.209 266 HA ASP 32 HA ASP 32 -16.585 5.555 6.348 267 HB2 ASP 32 HB2 ASP 32 -17.496 3.197 6.072 268 HB3 ASP 32 HB1 ASP 32 -17.166 2.960 7.783 269 H LYS 33 HN LYS 33 -14.151 4.256 8.296 270 HA LYS 33 HA LYS 33 -15.129 5.751 10.639 271 HB2 LYS 33 HB2 LYS 33 -13.444 3.284 10.407 272 HB3 LYS 33 HB1 LYS 33 -13.381 4.278 11.855 273 HG2 LYS 33 HG2 LYS 33 -15.841 4.009 12.076 274 HG3 LYS 33 HG1 LYS 33 -15.791 2.883 10.718 275 HD2 LYS 33 HD2 LYS 33 -14.435 1.351 11.934 276 HD3 LYS 33 HD1 LYS 33 -14.150 2.526 13.217 277 HE2 LYS 33 HE2 LYS 33 -16.868 2.385 13.205 278 HE3 LYS 33 HE1 LYS 33 -16.431 0.736 12.764 279 HZ1 LYS 33 HZ1 LYS 33 -15.164 0.508 14.740 280 HZ2 LYS 33 HZ2 LYS 33 -16.657 1.154 15.196 281 HZ3 LYS 33 HZ3 LYS 33 -15.299 2.152 15.108 282 H GLU 34 HN GLU 34 -12.128 4.945 8.883 283 HA GLU 34 HA GLU 34 -10.790 7.155 10.244 284 HB2 GLU 34 HB2 GLU 34 -9.683 5.069 8.362 285 HB3 GLU 34 HB1 GLU 34 -8.734 6.255 9.249 286 HG2 GLU 34 HG2 GLU 34 -10.408 4.061 10.450 287 HG3 GLU 34 HG1 GLU 34 -8.649 4.085 10.326 288 H GLY 35 HN GLY 35 -12.466 6.645 7.371 289 HA2 GLY 35 HA2 GLY 35 -12.801 7.974 5.531 290 HA3 GLY 35 HA1 GLY 35 -11.941 9.243 6.384 291 H ILE 36 HN ILE 36 -10.559 6.113 5.599 292 HA ILE 36 HA ILE 36 -8.595 7.487 3.904 293 HB ILE 36 HB ILE 36 -8.418 4.763 5.208 294 HG12 ILE 36 HG12 ILE 36 -6.952 7.314 5.911 295 HG13 ILE 36 HG11 ILE 36 -8.361 6.715 6.778 296 HG21 ILE 36 HG21 ILE 36 -6.356 6.345 3.678 297 HG22 ILE 36 HG22 ILE 36 -7.136 4.854 3.150 298 HG23 ILE 36 HG23 ILE 36 -6.053 4.838 4.542 299 HD11 ILE 36 HD11 ILE 36 -6.294 6.168 7.938 300 HD12 ILE 36 HD12 ILE 36 -5.722 5.291 6.519 301 HD13 ILE 36 HD13 ILE 36 -7.131 4.709 7.406 302 HA PRO 37 HA PRO 37 -10.638 5.738 0.329 303 HB2 PRO 37 HB2 PRO 37 -7.943 6.123 -0.877 304 HB3 PRO 37 HB1 PRO 37 -9.524 6.705 -1.433 305 HG2 PRO 37 HG2 PRO 37 -7.772 8.363 -0.337 306 HG3 PRO 37 HG1 PRO 37 -9.516 8.521 -0.037 307 HD2 PRO 37 HD2 PRO 37 -7.382 7.447 1.748 308 HD3 PRO 37 HD1 PRO 37 -8.836 8.378 2.155 309 HA PRO 38 HA PRO 38 -9.411 1.445 0.739 310 HB2 PRO 38 HB2 PRO 38 -10.846 1.211 -1.859 311 HB3 PRO 38 HB1 PRO 38 -11.107 0.329 -0.343 312 HG2 PRO 38 HG2 PRO 38 -12.807 2.194 -1.130 313 HG3 PRO 38 HG1 PRO 38 -12.381 1.998 0.583 314 HD2 PRO 38 HD2 PRO 38 -11.470 4.067 -1.363 315 HD3 PRO 38 HD1 PRO 38 -11.848 4.221 0.365 316 H ASP 39 HN ASP 39 -8.911 3.384 -2.115 317 HA ASP 39 HA ASP 39 -7.256 1.566 -3.539 318 HB2 ASP 39 HB2 ASP 39 -7.910 4.473 -3.743 319 HB3 ASP 39 HB1 ASP 39 -6.496 3.876 -4.602 320 H GLN 40 HN GLN 40 -6.719 3.530 -0.819 321 HA GLN 40 HA GLN 40 -3.806 3.446 -1.218 322 HB2 GLN 40 HB2 GLN 40 -5.304 5.607 -0.682 323 HB3 GLN 40 HB1 GLN 40 -4.994 5.071 0.962 324 HG2 GLN 40 HG2 GLN 40 -2.741 5.475 0.815 325 HG3 GLN 40 HG1 GLN 40 -2.716 5.311 -0.940 326 HE21 GLN 40 HE21 GLN 40 -1.616 7.413 0.704 327 HE22 GLN 40 HE22 GLN 40 -2.378 8.885 0.195 328 H GLN 41 HN GLN 41 -6.152 1.704 0.173 329 HA GLN 41 HA GLN 41 -4.838 1.227 2.730 330 HB2 GLN 41 HB2 GLN 41 -7.369 0.115 1.512 331 HB3 GLN 41 HB1 GLN 41 -6.743 -0.376 3.077 332 HG2 GLN 41 HG2 GLN 41 -6.956 1.961 3.849 333 HG3 GLN 41 HG1 GLN 41 -7.692 2.371 2.297 334 HE21 GLN 41 HE21 GLN 41 -9.669 2.940 3.181 335 HE22 GLN 41 HE22 GLN 41 -10.748 1.774 3.867 336 H ARG 42 HN ARG 42 -3.093 -0.078 2.646 337 HA ARG 42 HA ARG 42 -3.216 -2.441 0.897 338 HB2 ARG 42 HB2 ARG 42 -0.827 -1.155 2.250 339 HB3 ARG 42 HB1 ARG 42 -0.760 -2.598 1.247 340 HG2 ARG 42 HG2 ARG 42 -1.743 -1.165 -0.610 341 HG3 ARG 42 HG1 ARG 42 -1.385 0.221 0.421 342 HD2 ARG 42 HD2 ARG 42 0.520 0.121 -0.868 343 HD3 ARG 42 HD1 ARG 42 1.003 -0.842 0.531 344 HE ARG 42 HE ARG 42 0.048 -2.731 -1.097 345 HH11 ARG 42 HH11 ARG 42 2.334 -0.121 -1.680 346 HH12 ARG 42 HH12 ARG 42 3.109 -0.961 -3.005 347 HH21 ARG 42 HH21 ARG 42 1.077 -3.796 -2.820 348 HH22 ARG 42 HH22 ARG 42 2.394 -3.019 -3.649 349 H LEU 43 HN LEU 43 -4.326 -3.904 2.079 350 HA LEU 43 HA LEU 43 -3.815 -4.248 4.906 351 HB2 LEU 43 HB2 LEU 43 -5.753 -5.450 2.960 352 HB3 LEU 43 HB1 LEU 43 -5.509 -6.178 4.535 353 HG LEU 43 HG LEU 43 -6.280 -3.284 4.212 354 HD11 LEU 43 HD11 LEU 43 -8.122 -5.637 4.614 355 HD12 LEU 43 HD12 LEU 43 -7.977 -4.694 3.130 356 HD13 LEU 43 HD13 LEU 43 -8.582 -3.935 4.601 357 HD21 LEU 43 HD21 LEU 43 -7.053 -3.556 6.520 358 HD22 LEU 43 HD22 LEU 43 -5.333 -3.909 6.363 359 HD23 LEU 43 HD23 LEU 43 -6.493 -5.229 6.506 360 H ILE 44 HN ILE 44 -2.550 -5.707 5.804 361 HA ILE 44 HA ILE 44 -1.538 -7.924 4.149 362 HB ILE 44 HB ILE 44 -0.009 -5.965 5.831 363 HG12 ILE 44 HG12 ILE 44 1.609 -6.496 3.811 364 HG13 ILE 44 HG11 ILE 44 0.126 -7.072 3.060 365 HG21 ILE 44 HG21 ILE 44 0.582 -8.102 6.809 366 HG22 ILE 44 HG22 ILE 44 1.930 -7.474 5.860 367 HG23 ILE 44 HG23 ILE 44 0.919 -8.765 5.210 368 HD11 ILE 44 HD11 ILE 44 0.452 -4.826 2.397 369 HD12 ILE 44 HD12 ILE 44 0.726 -4.305 4.058 370 HD13 ILE 44 HD13 ILE 44 -0.878 -4.837 3.554 371 H PHE 45 HN PHE 45 -1.441 -9.881 5.097 372 HA PHE 45 HA PHE 45 -1.957 -10.075 7.987 373 HB2 PHE 45 HB2 PHE 45 -4.050 -10.551 6.726 374 HB3 PHE 45 HB1 PHE 45 -3.209 -11.829 5.855 375 HD1 PHE 45 HD1 PHE 45 -3.985 -10.766 9.340 376 HD2 PHE 45 HD2 PHE 45 -3.363 -13.987 6.633 377 HE1 PHE 45 HE1 PHE 45 -4.586 -12.365 11.109 378 HE2 PHE 45 HE2 PHE 45 -3.960 -15.594 8.396 379 HZ PHE 45 HZ PHE 45 -4.572 -14.783 10.640 380 H ALA 46 HN ALA 46 -0.315 -11.094 8.909 381 HA ALA 46 HA ALA 46 1.434 -12.481 9.311 382 HB1 ALA 46 HB1 ALA 46 1.420 -14.708 8.310 383 HB2 ALA 46 HB2 ALA 46 0.196 -14.187 7.153 384 HB3 ALA 46 HB3 ALA 46 -0.186 -14.249 8.872 385 H GLY 47 HN GLY 47 1.531 -10.401 7.120 386 HA2 GLY 47 HA2 GLY 47 3.509 -9.610 6.100 387 HA3 GLY 47 HA1 GLY 47 4.116 -11.256 6.061 388 H LYS 48 HN LYS 48 0.946 -11.247 4.985 389 HA LYS 48 HA LYS 48 1.839 -11.010 2.182 390 HB2 LYS 48 HB2 LYS 48 -0.138 -12.946 3.401 391 HB3 LYS 48 HB1 LYS 48 0.067 -12.724 1.670 392 HG2 LYS 48 HG2 LYS 48 2.304 -13.538 1.755 393 HG3 LYS 48 HG1 LYS 48 2.290 -13.549 3.519 394 HD2 LYS 48 HD2 LYS 48 0.375 -15.190 1.881 395 HD3 LYS 48 HD1 LYS 48 1.969 -15.785 2.348 396 HE2 LYS 48 HE2 LYS 48 1.333 -15.265 4.732 397 HE3 LYS 48 HE1 LYS 48 -0.308 -14.986 4.150 398 HZ1 LYS 48 HZ1 LYS 48 -0.275 -17.268 3.250 399 HZ2 LYS 48 HZ2 LYS 48 -0.131 -17.219 4.936 400 HZ3 LYS 48 HZ3 LYS 48 1.231 -17.515 3.980 401 H GLN 49 HN GLN 49 0.475 -10.006 0.726 402 HA GLN 49 HA GLN 49 -1.335 -8.098 1.865 403 HB2 GLN 49 HB2 GLN 49 0.038 -8.456 -0.636 404 HB3 GLN 49 HB1 GLN 49 -1.661 -8.120 -0.928 405 HG2 GLN 49 HG2 GLN 49 -1.421 -6.158 0.633 406 HG3 GLN 49 HG1 GLN 49 0.317 -6.432 0.573 407 HE21 GLN 49 HE21 GLN 49 -1.840 -6.924 -2.138 408 HE22 GLN 49 HE22 GLN 49 -1.249 -5.606 -3.089 409 H LEU 50 HN LEU 50 -3.518 -7.887 1.525 410 HA LEU 50 HA LEU 50 -4.902 -10.390 0.855 411 HB2 LEU 50 HB2 LEU 50 -6.067 -7.980 2.242 412 HB3 LEU 50 HB1 LEU 50 -6.743 -9.593 2.159 413 HG LEU 50 HG LEU 50 -4.307 -8.741 3.722 414 HD11 LEU 50 HD11 LEU 50 -6.985 -9.779 4.629 415 HD12 LEU 50 HD12 LEU 50 -6.464 -8.095 4.698 416 HD13 LEU 50 HD13 LEU 50 -5.635 -9.316 5.664 417 HD21 LEU 50 HD21 LEU 50 -4.560 -11.147 4.613 418 HD22 LEU 50 HD22 LEU 50 -3.755 -10.900 3.064 419 HD23 LEU 50 HD23 LEU 50 -5.431 -11.450 3.110 420 H GLU 51 HN GLU 51 -6.076 -10.510 -0.960 421 HA GLU 51 HA GLU 51 -6.280 -8.163 -2.645 422 HB2 GLU 51 HB2 GLU 51 -6.933 -11.072 -3.031 423 HB3 GLU 51 HB1 GLU 51 -7.443 -9.864 -4.202 424 HG2 GLU 51 HG2 GLU 51 -5.023 -9.165 -4.349 425 HG3 GLU 51 HG1 GLU 51 -4.643 -10.607 -3.410 426 H ASP 52 HN ASP 52 -8.106 -7.101 -3.212 427 HA ASP 52 HA ASP 52 -10.186 -6.873 -1.391 428 HB2 ASP 52 HB2 ASP 52 -10.307 -6.130 -4.316 429 HB3 ASP 52 HB1 ASP 52 -11.260 -5.437 -3.012 430 H GLY 53 HN GLY 53 -9.986 -8.796 -4.342 431 HA2 GLY 53 HA2 GLY 53 -12.756 -9.616 -4.174 432 HA3 GLY 53 HA1 GLY 53 -11.572 -10.163 -5.352 433 H ARG 54 HN ARG 54 -11.010 -10.295 -1.900 434 HA ARG 54 HA ARG 54 -11.404 -13.211 -1.976 435 HB2 ARG 54 HB2 ARG 54 -9.120 -11.705 -0.682 436 HB3 ARG 54 HB1 ARG 54 -9.436 -13.418 -0.455 437 HG2 ARG 54 HG2 ARG 54 -8.805 -12.108 -3.089 438 HG3 ARG 54 HG1 ARG 54 -7.654 -12.987 -2.079 439 HD2 ARG 54 HD2 ARG 54 -9.018 -15.009 -2.299 440 HD3 ARG 54 HD1 ARG 54 -10.155 -14.130 -3.319 441 HE ARG 54 HE ARG 54 -7.345 -14.650 -4.054 442 HH11 ARG 54 HH11 ARG 54 -10.724 -14.229 -4.912 443 HH12 ARG 54 HH12 ARG 54 -10.478 -14.643 -6.578 444 HH21 ARG 54 HH21 ARG 54 -7.030 -15.176 -6.263 445 HH22 ARG 54 HH22 ARG 54 -8.387 -15.171 -7.343 446 H THR 55 HN THR 55 -11.647 -14.161 0.203 447 HA THR 55 HA THR 55 -13.098 -12.298 1.960 448 HB THR 55 HB THR 55 -13.903 -14.726 2.857 449 HG1 THR 55 HG1 THR 55 -12.714 -15.330 0.597 450 HG21 THR 55 HG21 THR 55 -15.117 -13.162 0.582 451 HG22 THR 55 HG22 THR 55 -15.370 -12.871 2.304 452 HG23 THR 55 HG23 THR 55 -15.961 -14.359 1.564 453 H LEU 56 HN LEU 56 -13.035 -12.941 4.308 454 HA LEU 56 HA LEU 56 -10.379 -12.972 5.203 455 HB2 LEU 56 HB2 LEU 56 -12.917 -13.550 6.725 456 HB3 LEU 56 HB1 LEU 56 -11.359 -13.213 7.456 457 HG LEU 56 HG LEU 56 -12.777 -11.262 5.648 458 HD11 LEU 56 HD11 LEU 56 -12.825 -11.414 8.655 459 HD12 LEU 56 HD12 LEU 56 -14.188 -11.704 7.574 460 HD13 LEU 56 HD13 LEU 56 -13.471 -10.096 7.680 461 HD21 LEU 56 HD21 LEU 56 -11.274 -9.637 6.687 462 HD22 LEU 56 HD22 LEU 56 -10.373 -10.922 5.884 463 HD23 LEU 56 HD23 LEU 56 -10.536 -10.926 7.638 464 H SER 57 HN SER 57 -12.726 -15.551 4.813 465 HA SER 57 HA SER 57 -11.363 -17.548 6.250 466 HB2 SER 57 HB2 SER 57 -12.876 -18.558 3.984 467 HB3 SER 57 HB1 SER 57 -13.189 -18.741 5.711 468 HG SER 57 HG SER 57 -14.732 -17.465 4.282 469 H ASP 58 HN ASP 58 -10.875 -16.248 3.055 470 HA ASP 58 HA ASP 58 -9.551 -18.416 1.840 471 HB2 ASP 58 HB2 ASP 58 -9.394 -15.442 1.401 472 HB3 ASP 58 HB1 ASP 58 -8.425 -16.570 0.459 473 H TYR 59 HN TYR 59 -8.400 -15.829 3.916 474 HA TYR 59 HA TYR 59 -5.684 -16.921 3.782 475 HB2 TYR 59 HB2 TYR 59 -6.660 -14.385 5.108 476 HB3 TYR 59 HB1 TYR 59 -4.982 -14.865 4.883 477 HD1 TYR 59 HD1 TYR 59 -4.022 -14.919 2.589 478 HD2 TYR 59 HD2 TYR 59 -7.891 -13.347 3.368 479 HE1 TYR 59 HE1 TYR 59 -3.980 -13.769 0.418 480 HE2 TYR 59 HE2 TYR 59 -7.866 -12.191 1.200 481 HH TYR 59 HH TYR 59 -5.469 -12.826 -1.194 482 H ASN 60 HN ASN 60 -8.301 -17.688 5.324 483 HA ASN 60 HA ASN 60 -8.848 -18.776 7.221 484 HB2 ASN 60 HB2 ASN 60 -6.105 -19.424 6.746 485 HB3 ASN 60 HB1 ASN 60 -6.356 -19.275 8.483 486 HD21 ASN 60 HD21 ASN 60 -8.784 -20.293 6.150 487 HD22 ASN 60 HD22 ASN 60 -8.923 -21.913 6.735 488 H ILE 61 HN ILE 61 -8.705 -15.943 7.308 489 HA ILE 61 HA ILE 61 -7.502 -15.141 9.784 490 HB ILE 61 HB ILE 61 -9.543 -13.719 8.068 491 HG12 ILE 61 HG12 ILE 61 -6.562 -13.255 8.282 492 HG13 ILE 61 HG11 ILE 61 -7.316 -14.208 7.010 493 HG21 ILE 61 HG21 ILE 61 -8.898 -11.701 9.294 494 HG22 ILE 61 HG22 ILE 61 -7.840 -12.666 10.323 495 HG23 ILE 61 HG23 ILE 61 -9.585 -12.918 10.372 496 HD11 ILE 61 HD11 ILE 61 -7.853 -11.294 7.541 497 HD12 ILE 61 HD12 ILE 61 -8.515 -12.262 6.223 498 HD13 ILE 61 HD13 ILE 61 -6.786 -11.931 6.291 499 H GLN 62 HN GLN 62 -8.276 -15.697 11.685 500 HA GLN 62 HA GLN 62 -11.144 -16.255 11.967 501 HB2 GLN 62 HB2 GLN 62 -8.765 -17.112 13.615 502 HB3 GLN 62 HB1 GLN 62 -10.431 -17.444 14.061 503 HG2 GLN 62 HG2 GLN 62 -10.744 -18.877 12.220 504 HG3 GLN 62 HG1 GLN 62 -9.259 -18.328 11.447 505 HE21 GLN 62 HE21 GLN 62 -7.281 -19.071 12.191 506 HE22 GLN 62 HE22 GLN 62 -7.150 -20.461 13.211 507 H LYS 63 HN LYS 63 -11.395 -16.056 14.680 508 HA LYS 63 HA LYS 63 -11.755 -13.269 15.023 509 HB2 LYS 63 HB2 LYS 63 -12.486 -13.894 17.314 510 HB3 LYS 63 HB1 LYS 63 -13.294 -14.810 16.050 511 HG2 LYS 63 HG2 LYS 63 -11.959 -16.739 16.494 512 HG3 LYS 63 HG1 LYS 63 -10.924 -15.830 17.596 513 HD2 LYS 63 HD2 LYS 63 -12.671 -15.625 19.193 514 HD3 LYS 63 HD1 LYS 63 -13.874 -16.224 18.048 515 HE2 LYS 63 HE2 LYS 63 -12.936 -18.416 18.098 516 HE3 LYS 63 HE1 LYS 63 -11.537 -17.861 19.011 517 HZ1 LYS 63 HZ1 LYS 63 -14.250 -17.575 20.116 518 HZ2 LYS 63 HZ2 LYS 63 -12.771 -17.652 20.933 519 HZ3 LYS 63 HZ3 LYS 63 -13.430 -19.047 20.238 520 H GLU 64 HN GLU 64 -10.800 -11.864 16.465 521 HA GLU 64 HA GLU 64 -9.153 -10.847 17.626 522 HB2 GLU 64 HB2 GLU 64 -8.414 -13.638 18.515 523 HB3 GLU 64 HB1 GLU 64 -7.920 -12.136 19.288 524 HG2 GLU 64 HG2 GLU 64 -10.302 -11.622 19.713 525 HG3 GLU 64 HG1 GLU 64 -10.726 -13.198 19.055 526 H SER 65 HN SER 65 -8.634 -12.045 14.885 527 HA SER 65 HA SER 65 -5.778 -12.482 14.908 528 HB2 SER 65 HB2 SER 65 -7.671 -12.164 12.564 529 HB3 SER 65 HB1 SER 65 -6.000 -12.717 12.475 530 HG SER 65 HG SER 65 -8.280 -14.031 13.410 531 H THR 66 HN THR 66 -4.228 -11.099 14.039 532 HA THR 66 HA THR 66 -4.982 -8.288 14.110 533 HB THR 66 HB THR 66 -2.207 -9.459 13.890 534 HG1 THR 66 HG1 THR 66 -3.941 -9.396 15.987 535 HG21 THR 66 HG21 THR 66 -2.493 -7.067 13.247 536 HG22 THR 66 HG22 THR 66 -1.463 -7.296 14.659 537 HG23 THR 66 HG23 THR 66 -3.126 -6.749 14.863 538 H LEU 67 HN LEU 67 -5.204 -7.087 12.373 539 HA LEU 67 HA LEU 67 -4.135 -8.078 9.815 540 HB2 LEU 67 HB2 LEU 67 -6.635 -6.555 10.482 541 HB3 LEU 67 HB1 LEU 67 -5.929 -6.437 8.882 542 HG LEU 67 HG LEU 67 -6.049 -9.048 8.926 543 HD11 LEU 67 HD11 LEU 67 -7.938 -9.904 10.211 544 HD12 LEU 67 HD12 LEU 67 -8.157 -8.322 10.952 545 HD13 LEU 67 HD13 LEU 67 -6.693 -9.249 11.272 546 HD21 LEU 67 HD21 LEU 67 -8.486 -7.303 8.615 547 HD22 LEU 67 HD22 LEU 67 -8.316 -8.940 7.984 548 HD23 LEU 67 HD23 LEU 67 -7.281 -7.649 7.376 549 H HIS 68 HN HIS 68 -2.500 -6.943 9.045 550 HA HIS 68 HA HIS 68 -1.818 -4.394 10.246 551 HB2 HIS 68 HB2 HIS 68 -0.371 -5.959 8.097 552 HB3 HIS 68 HB1 HIS 68 0.280 -4.619 9.032 553 HD2 HIS 68 HD2 HIS 68 0.463 -5.271 11.895 554 HE1 HIS 68 HE1 HIS 68 0.985 -9.373 11.000 555 HE2 HIS 68 HE2 HIS 68 1.427 -7.543 12.694 556 H LEU 69 HN LEU 69 -2.439 -2.508 9.426 557 HA LEU 69 HA LEU 69 -3.257 -2.427 6.603 558 HB2 LEU 69 HB2 LEU 69 -5.009 -1.790 8.163 559 HB3 LEU 69 HB1 LEU 69 -3.961 -0.593 8.896 560 HG LEU 69 HG LEU 69 -3.939 0.658 6.750 561 HD11 LEU 69 HD11 LEU 69 -5.606 0.091 5.042 562 HD12 LEU 69 HD12 LEU 69 -5.988 -1.389 5.918 563 HD13 LEU 69 HD13 LEU 69 -4.384 -1.167 5.221 564 HD21 LEU 69 HD21 LEU 69 -6.658 0.111 7.931 565 HD22 LEU 69 HD22 LEU 69 -6.243 1.495 6.921 566 HD23 LEU 69 HD23 LEU 69 -5.485 1.297 8.501 567 H VAL 70 HN VAL 70 -1.608 -1.819 5.368 568 HA VAL 70 HA VAL 70 0.289 0.175 6.340 569 HB VAL 70 HB VAL 70 0.271 -1.498 3.827 570 HG11 VAL 70 HG11 VAL 70 1.436 0.538 3.340 571 HG12 VAL 70 HG12 VAL 70 2.637 -0.727 3.596 572 HG13 VAL 70 HG13 VAL 70 2.317 0.455 4.865 573 HG21 VAL 70 HG21 VAL 70 0.638 -2.810 5.837 574 HG22 VAL 70 HG22 VAL 70 1.907 -1.699 6.350 575 HG23 VAL 70 HG23 VAL 70 2.133 -2.686 4.907 576 H LEU 71 HN LEU 71 0.210 2.234 5.781 577 HA LEU 71 HA LEU 71 -1.787 3.112 3.858 578 HB2 LEU 71 HB2 LEU 71 0.026 4.773 5.615 579 HB3 LEU 71 HB1 LEU 71 -1.354 5.349 4.703 580 HG LEU 71 HG LEU 71 -1.490 3.427 7.025 581 HD11 LEU 71 HD11 LEU 71 -2.213 6.346 6.844 582 HD12 LEU 71 HD12 LEU 71 -0.842 5.668 7.720 583 HD13 LEU 71 HD13 LEU 71 -2.488 5.297 8.234 584 HD21 LEU 71 HD21 LEU 71 -3.908 3.811 6.886 585 HD22 LEU 71 HD22 LEU 71 -3.278 3.051 5.425 586 HD23 LEU 71 HD23 LEU 71 -3.665 4.772 5.426 587 H ARG 72 HN ARG 72 -1.197 3.209 1.804 588 HA ARG 72 HA ARG 72 1.587 3.440 1.068 589 HB2 ARG 72 HB2 ARG 72 0.935 2.355 -0.779 590 HB3 ARG 72 HB1 ARG 72 -0.665 2.251 -0.063 591 HG2 ARG 72 HG2 ARG 72 -1.539 3.736 -1.496 592 HG3 ARG 72 HG1 ARG 72 -0.109 4.769 -1.459 593 HD2 ARG 72 HD2 ARG 72 -0.518 2.248 -3.049 594 HD3 ARG 72 HD1 ARG 72 -0.312 3.886 -3.666 595 HE ARG 72 HE ARG 72 1.952 3.269 -2.166 596 HH11 ARG 72 HH11 ARG 72 0.393 2.133 -5.093 597 HH12 ARG 72 HH12 ARG 72 1.875 1.587 -5.809 598 HH21 ARG 72 HH21 ARG 72 3.870 2.568 -3.084 599 HH22 ARG 72 HH22 ARG 72 3.866 1.817 -4.660 600 H LEU 73 HN LEU 73 2.396 5.026 -0.444 601 HA LEU 73 HA LEU 73 0.903 7.561 -0.371 602 HB2 LEU 73 HB2 LEU 73 3.717 7.000 0.397 603 HB3 LEU 73 HB1 LEU 73 3.393 8.504 -0.445 604 HG LEU 73 HG LEU 73 1.513 8.741 1.402 605 HD11 LEU 73 HD11 LEU 73 2.046 6.483 2.332 606 HD12 LEU 73 HD12 LEU 73 2.081 7.802 3.504 607 HD13 LEU 73 HD13 LEU 73 3.590 7.142 2.871 608 HD21 LEU 73 HD21 LEU 73 3.198 10.384 1.127 609 HD22 LEU 73 HD22 LEU 73 4.448 9.299 1.733 610 HD23 LEU 73 HD23 LEU 73 3.212 9.917 2.827 611 H ARG 74 HN ARG 74 1.330 9.023 -2.107 612 HA ARG 74 HA ARG 74 2.039 7.602 -4.567 613 HB2 ARG 74 HB2 ARG 74 0.659 10.270 -4.273 614 HB3 ARG 74 HB1 ARG 74 0.821 9.327 -5.747 615 HG2 ARG 74 HG2 ARG 74 -0.670 8.354 -3.323 616 HG3 ARG 74 HG1 ARG 74 -1.428 9.254 -4.636 617 HD2 ARG 74 HD2 ARG 74 -0.795 7.526 -6.219 618 HD3 ARG 74 HD1 ARG 74 0.049 6.642 -4.949 619 HE ARG 74 HE ARG 74 -2.644 7.053 -4.202 620 HH11 ARG 74 HH11 ARG 74 -0.728 5.198 -6.462 621 HH12 ARG 74 HH12 ARG 74 -1.837 3.868 -6.515 622 HH21 ARG 74 HH21 ARG 74 -4.111 5.287 -4.260 623 HH22 ARG 74 HH22 ARG 74 -3.752 3.913 -5.259 624 H GLY 75 HN GLY 75 3.231 9.934 -2.397 625 HA2 GLY 75 HA2 GLY 75 5.403 10.532 -4.277 626 HA3 GLY 75 HA1 GLY 75 4.561 11.875 -3.518 627 H GLY 76 HN GLY 76 7.374 10.609 -3.371 628 HA2 GLY 76 HA2 GLY 76 7.501 10.511 -0.417 629 HA3 GLY 76 HA1 GLY 76 8.564 9.576 -1.462 630 H1 SER 453 HT1 SER 453 23.240 7.593 16.637 631 H2 SER 453 HT2 SER 453 23.407 9.248 16.942 632 H3 SER 453 HT3 SER 453 22.590 8.722 15.562 633 HA SER 453 HA SER 453 21.711 8.209 18.334 634 HB2 SER 453 HB2 SER 453 19.840 9.843 17.544 635 HB3 SER 453 HB1 SER 453 21.380 10.505 18.091 636 HG SER 453 HG SER 453 21.653 11.310 16.177 637 H ASN 454 HN ASN 454 19.824 8.927 15.467 638 HA ASN 454 HA ASN 454 18.246 7.774 14.316 639 HB2 ASN 454 HB2 ASN 454 20.289 5.659 14.865 640 HB3 ASN 454 HB1 ASN 454 18.750 5.190 14.157 641 HD21 ASN 454 HD21 ASN 454 19.903 4.530 12.295 642 HD22 ASN 454 HD22 ASN 454 20.446 5.687 11.128 643 H SER 455 HN SER 455 17.976 8.094 17.258 644 HA SER 455 HA SER 455 16.831 5.811 18.420 645 HB2 SER 455 HB2 SER 455 15.615 7.815 19.756 646 HB3 SER 455 HB1 SER 455 17.293 7.345 20.041 647 HG SER 455 HG SER 455 16.722 9.679 19.565 648 H GLN 456 HN GLN 456 15.291 8.629 16.893 649 HA GLN 456 HA GLN 456 12.640 7.757 17.131 650 HB2 GLN 456 HB2 GLN 456 13.815 9.502 14.960 651 HB3 GLN 456 HB1 GLN 456 12.118 9.410 15.409 652 HG2 GLN 456 HG2 GLN 456 14.316 10.344 17.236 653 HG3 GLN 456 HG1 GLN 456 13.283 11.407 16.283 654 HE21 GLN 456 HE21 GLN 456 13.672 11.058 19.203 655 HE22 GLN 456 HE22 GLN 456 12.084 10.806 19.838 656 H LEU 457 HN LEU 457 15.031 7.264 14.594 657 HA LEU 457 HA LEU 457 13.312 6.013 12.737 658 HB2 LEU 457 HB2 LEU 457 16.291 5.642 13.035 659 HB3 LEU 457 HB1 LEU 457 15.337 5.299 11.605 660 HG LEU 457 HG LEU 457 15.785 8.045 12.790 661 HD11 LEU 457 HD11 LEU 457 17.144 8.441 10.801 662 HD12 LEU 457 HD12 LEU 457 16.915 6.764 10.307 663 HD13 LEU 457 HD13 LEU 457 17.806 7.134 11.784 664 HD21 LEU 457 HD21 LEU 457 13.610 7.820 11.672 665 HD22 LEU 457 HD22 LEU 457 14.425 7.224 10.226 666 HD23 LEU 457 HD23 LEU 457 14.705 8.875 10.778 667 H ASN 458 HN ASN 458 15.427 4.744 15.274 668 HA ASN 458 HA ASN 458 15.093 2.010 14.703 669 HB2 ASN 458 HB2 ASN 458 16.522 3.484 16.564 670 HB3 ASN 458 HB1 ASN 458 15.359 2.604 17.552 671 HD21 ASN 458 HD21 ASN 458 18.197 2.286 17.477 672 HD22 ASN 458 HD22 ASN 458 18.518 0.659 16.987 673 H ALA 459 HN ALA 459 13.351 4.174 16.900 674 HA ALA 459 HA ALA 459 11.563 2.268 17.938 675 HB1 ALA 459 HB1 ALA 459 11.947 4.474 18.955 676 HB2 ALA 459 HB2 ALA 459 10.234 4.159 18.682 677 HB3 ALA 459 HB3 ALA 459 11.115 5.233 17.597 678 H MET 460 HN MET 460 11.317 4.433 15.145 679 HA MET 460 HA MET 460 8.664 3.793 14.448 680 HB2 MET 460 HB2 MET 460 10.959 5.118 13.141 681 HB3 MET 460 HB1 MET 460 9.761 4.430 12.055 682 HG2 MET 460 HG2 MET 460 8.008 5.720 13.172 683 HG3 MET 460 HG1 MET 460 9.218 6.423 14.244 684 HE1 MET 460 HE1 MET 460 11.059 8.980 12.167 685 HE2 MET 460 HE2 MET 460 11.520 7.502 13.011 686 HE3 MET 460 HE3 MET 460 10.379 8.622 13.755 687 H ALA 461 HN ALA 461 11.772 2.422 13.451 688 HA ALA 461 HA ALA 461 10.747 0.590 11.567 689 HB1 ALA 461 HB1 ALA 461 13.280 0.431 13.197 690 HB2 ALA 461 HB2 ALA 461 13.103 1.205 11.622 691 HB3 ALA 461 HB3 ALA 461 12.911 -0.543 11.774 692 H HIS 462 HN HIS 462 11.171 0.437 15.046 693 HA HIS 462 HA HIS 462 10.860 -2.320 15.423 694 HB2 HIS 462 HB2 HIS 462 11.620 -0.827 17.206 695 HB3 HIS 462 HB1 HIS 462 10.049 -0.037 17.238 696 HD2 HIS 462 HD2 HIS 462 9.103 -0.781 19.645 697 HE1 HIS 462 HE1 HIS 462 9.734 -4.938 19.182 698 HE2 HIS 462 HE2 HIS 462 8.871 -3.128 20.727 699 H GLN 463 HN GLN 463 8.473 0.264 15.116 700 HA GLN 463 HA GLN 463 6.211 -1.328 15.698 701 HB2 GLN 463 HB2 GLN 463 6.162 1.139 15.753 702 HB3 GLN 463 HB1 GLN 463 6.385 1.179 14.010 703 HG2 GLN 463 HG2 GLN 463 4.064 1.570 14.655 704 HG3 GLN 463 HG1 GLN 463 4.239 0.113 13.678 705 HE21 GLN 463 HE21 GLN 463 3.903 -1.901 14.634 706 HE22 GLN 463 HE22 GLN 463 3.113 -2.071 16.166 707 H ILE 464 HN ILE 464 7.990 -0.639 12.752 708 HA ILE 464 HA ILE 464 6.137 -1.862 10.971 709 HB ILE 464 HB ILE 464 9.095 -1.378 10.577 710 HG12 ILE 464 HG12 ILE 464 6.708 0.322 9.820 711 HG13 ILE 464 HG11 ILE 464 7.855 0.679 11.107 712 HG21 ILE 464 HG21 ILE 464 8.632 -1.535 8.201 713 HG22 ILE 464 HG22 ILE 464 6.924 -1.823 8.528 714 HG23 ILE 464 HG23 ILE 464 8.127 -3.018 9.011 715 HD11 ILE 464 HD11 ILE 464 8.252 1.981 9.067 716 HD12 ILE 464 HD12 ILE 464 8.554 0.482 8.189 717 HD13 ILE 464 HD13 ILE 464 9.625 0.965 9.503 718 H GLN 465 HN GLN 465 8.900 -2.985 12.815 719 HA GLN 465 HA GLN 465 9.225 -5.500 11.603 720 HB2 GLN 465 HB2 GLN 465 10.667 -4.206 13.380 721 HB3 GLN 465 HB1 GLN 465 9.697 -5.113 14.533 722 HG2 GLN 465 HG2 GLN 465 11.773 -6.261 14.099 723 HG3 GLN 465 HG1 GLN 465 10.416 -7.203 13.484 724 HE21 GLN 465 HE21 GLN 465 11.648 -8.329 12.023 725 HE22 GLN 465 HE22 GLN 465 12.306 -7.607 10.591 726 H GLU 466 HN GLU 466 6.932 -4.292 13.905 727 HA GLU 466 HA GLU 466 5.964 -6.868 14.732 728 HB2 GLU 466 HB2 GLU 466 5.058 -4.031 15.137 729 HB3 GLU 466 HB1 GLU 466 4.028 -5.374 15.609 730 HG2 GLU 466 HG2 GLU 466 6.822 -5.454 16.554 731 HG3 GLU 466 HG1 GLU 466 5.779 -4.220 17.257 732 H MET 467 HN MET 467 5.476 -4.777 12.079 733 HA MET 467 HA MET 467 2.866 -5.876 11.398 734 HB2 MET 467 HB2 MET 467 4.541 -4.016 9.709 735 HB3 MET 467 HB1 MET 467 2.806 -4.278 9.623 736 HG2 MET 467 HG2 MET 467 4.198 -3.040 11.979 737 HG3 MET 467 HG1 MET 467 3.503 -2.120 10.648 738 HE1 MET 467 HE1 MET 467 0.992 -1.293 10.692 739 HE2 MET 467 HE2 MET 467 -0.260 -2.485 11.042 740 HE3 MET 467 HE3 MET 467 0.973 -2.829 9.828 741 H PHE 468 HN PHE 468 6.196 -5.877 10.256 742 HA PHE 468 HA PHE 468 5.548 -8.187 8.552 743 HB2 PHE 468 HB2 PHE 468 7.106 -5.739 7.977 744 HB3 PHE 468 HB1 PHE 468 7.806 -7.245 7.398 745 HD1 PHE 468 HD1 PHE 468 4.929 -4.980 7.150 746 HD2 PHE 468 HD2 PHE 468 6.830 -8.458 5.607 747 HE1 PHE 468 HE1 PHE 468 3.432 -4.926 5.198 748 HE2 PHE 468 HE2 PHE 468 5.339 -8.413 3.652 749 HZ PHE 468 HZ PHE 468 3.637 -6.645 3.450 750 HA PRO 469 HA PRO 469 8.661 -9.749 11.477 751 HB2 PRO 469 HB2 PRO 469 7.591 -12.186 11.814 752 HB3 PRO 469 HB1 PRO 469 6.881 -10.758 12.592 753 HG2 PRO 469 HG2 PRO 469 5.975 -12.235 10.181 754 HG3 PRO 469 HG1 PRO 469 5.023 -11.496 11.481 755 HD2 PRO 469 HD2 PRO 469 5.492 -10.350 8.998 756 HD3 PRO 469 HD1 PRO 469 4.979 -9.474 10.452 757 H GLN 470 HN GLN 470 8.473 -9.935 8.355 758 HA GLN 470 HA GLN 470 10.368 -12.162 8.142 759 HB2 GLN 470 HB2 GLN 470 9.432 -12.786 5.967 760 HB3 GLN 470 HB1 GLN 470 8.244 -12.947 7.248 761 HG2 GLN 470 HG2 GLN 470 7.202 -10.856 6.567 762 HG3 GLN 470 HG1 GLN 470 8.416 -10.656 5.304 763 HE21 GLN 470 HE21 GLN 470 6.875 -10.665 3.666 764 HE22 GLN 470 HE22 GLN 470 6.045 -12.103 3.184 765 H VAL 471 HN VAL 471 10.807 -9.298 8.414 766 HA VAL 471 HA VAL 471 12.330 -8.927 5.938 767 HB VAL 471 HB VAL 471 10.331 -7.499 5.789 768 HG11 VAL 471 HG11 VAL 471 10.011 -5.613 7.294 769 HG12 VAL 471 HG12 VAL 471 11.377 -6.148 8.271 770 HG13 VAL 471 HG13 VAL 471 9.925 -7.144 8.166 771 HG21 VAL 471 HG21 VAL 471 12.338 -6.747 4.691 772 HG22 VAL 471 HG22 VAL 471 12.912 -5.992 6.178 773 HG23 VAL 471 HG23 VAL 471 11.480 -5.362 5.361 774 HA PRO 472 HA PRO 472 15.715 -8.526 8.804 775 HB2 PRO 472 HB2 PRO 472 16.903 -6.980 6.550 776 HB3 PRO 472 HB1 PRO 472 17.560 -8.372 7.432 777 HG2 PRO 472 HG2 PRO 472 16.629 -8.664 4.980 778 HG3 PRO 472 HG1 PRO 472 16.335 -9.898 6.220 779 HD2 PRO 472 HD2 PRO 472 14.467 -7.839 5.134 780 HD3 PRO 472 HD1 PRO 472 14.148 -9.521 5.609 781 H TYR 473 HN TYR 473 15.836 -7.122 10.391 782 HA TYR 473 HA TYR 473 14.604 -4.659 10.525 783 HB2 TYR 473 HB2 TYR 473 15.681 -6.227 12.346 784 HB3 TYR 473 HB1 TYR 473 17.052 -5.141 12.165 785 HD1 TYR 473 HD1 TYR 473 16.524 -2.590 12.417 786 HD2 TYR 473 HD2 TYR 473 13.977 -5.695 13.820 787 HE1 TYR 473 HE1 TYR 473 15.478 -1.014 13.987 788 HE2 TYR 473 HE2 TYR 473 12.918 -4.126 15.392 789 HH TYR 473 HH TYR 473 13.577 -0.698 15.309 790 H HIS 474 HN HIS 474 18.011 -5.330 9.747 791 HA HIS 474 HA HIS 474 18.828 -2.627 9.702 792 HB2 HIS 474 HB2 HIS 474 20.757 -3.496 8.313 793 HB3 HIS 474 HB1 HIS 474 20.537 -4.244 9.888 794 HD2 HIS 474 HD2 HIS 474 20.484 -5.151 6.132 795 HE1 HIS 474 HE1 HIS 474 19.817 -8.668 8.384 796 HE2 HIS 474 HE2 HIS 474 20.348 -7.745 6.087 797 H LEU 475 HN LEU 475 17.163 -4.572 7.354 798 HA LEU 475 HA LEU 475 17.753 -2.817 5.151 799 HB2 LEU 475 HB2 LEU 475 15.852 -5.115 5.522 800 HB3 LEU 475 HB1 LEU 475 15.808 -4.121 4.079 801 HG LEU 475 HG LEU 475 18.071 -5.876 5.024 802 HD11 LEU 475 HD11 LEU 475 16.150 -6.921 3.827 803 HD12 LEU 475 HD12 LEU 475 17.699 -7.088 3.002 804 HD13 LEU 475 HD13 LEU 475 16.526 -5.898 2.441 805 HD21 LEU 475 HD21 LEU 475 19.167 -3.956 4.195 806 HD22 LEU 475 HD22 LEU 475 18.018 -3.780 2.868 807 HD23 LEU 475 HD23 LEU 475 19.167 -5.118 2.866 808 H VAL 476 HN VAL 476 15.246 -3.183 7.552 809 HA VAL 476 HA VAL 476 13.376 -1.379 6.398 810 HB VAL 476 HB VAL 476 13.708 -2.022 9.339 811 HG11 VAL 476 HG11 VAL 476 11.304 -1.524 9.455 812 HG12 VAL 476 HG12 VAL 476 11.325 -1.084 7.747 813 HG13 VAL 476 HG13 VAL 476 12.246 -0.135 8.914 814 HG21 VAL 476 HG21 VAL 476 12.110 -3.501 7.249 815 HG22 VAL 476 HG22 VAL 476 12.055 -3.803 8.986 816 HG23 VAL 476 HG23 VAL 476 13.545 -4.096 8.088 817 H LEU 477 HN LEU 477 16.026 -1.088 8.700 818 HA LEU 477 HA LEU 477 15.669 1.613 9.390 819 HB2 LEU 477 HB2 LEU 477 18.095 -0.171 9.373 820 HB3 LEU 477 HB1 LEU 477 18.159 1.488 9.933 821 HG LEU 477 HG LEU 477 16.354 -0.617 11.124 822 HD11 LEU 477 HD11 LEU 477 17.954 -0.640 12.990 823 HD12 LEU 477 HD12 LEU 477 19.036 0.393 12.057 824 HD13 LEU 477 HD13 LEU 477 18.667 -1.235 11.489 825 HD21 LEU 477 HD21 LEU 477 15.518 1.612 11.481 826 HD22 LEU 477 HD22 LEU 477 17.114 2.173 11.980 827 HD23 LEU 477 HD23 LEU 477 16.229 1.025 12.983 828 H GLN 478 HN GLN 478 16.942 0.107 6.564 829 HA GLN 478 HA GLN 478 18.562 2.224 5.613 830 HB2 GLN 478 HB2 GLN 478 18.757 -0.028 4.698 831 HB3 GLN 478 HB1 GLN 478 17.107 0.047 4.098 832 HG2 GLN 478 HG2 GLN 478 17.828 1.998 2.684 833 HG3 GLN 478 HG1 GLN 478 19.484 1.623 3.151 834 HE21 GLN 478 HE21 GLN 478 16.973 -0.757 2.571 835 HE22 GLN 478 HE22 GLN 478 17.688 -1.435 1.151 836 H ASP 479 HN ASP 479 15.237 1.250 4.785 837 HA ASP 479 HA ASP 479 14.721 3.498 3.142 838 HB2 ASP 479 HB2 ASP 479 13.436 1.310 3.153 839 HB3 ASP 479 HB1 ASP 479 12.642 1.878 4.619 840 H LEU 480 HN LEU 480 14.377 2.891 6.576 841 HA LEU 480 HA LEU 480 12.769 5.071 7.262 842 HB2 LEU 480 HB2 LEU 480 14.398 3.138 8.623 843 HB3 LEU 480 HB1 LEU 480 14.667 4.720 9.324 844 HG LEU 480 HG LEU 480 12.948 3.609 10.572 845 HD11 LEU 480 HD11 LEU 480 12.695 6.042 10.128 846 HD12 LEU 480 HD12 LEU 480 11.176 5.211 10.455 847 HD13 LEU 480 HD13 LEU 480 11.606 5.641 8.801 848 HD21 LEU 480 HD21 LEU 480 10.795 2.986 9.446 849 HD22 LEU 480 HD22 LEU 480 12.176 1.970 9.034 850 HD23 LEU 480 HD23 LEU 480 11.617 3.202 7.902 851 H GLN 481 HN GLN 481 16.186 4.854 6.548 852 HA GLN 481 HA GLN 481 16.692 7.583 7.401 853 HB2 GLN 481 HB2 GLN 481 18.441 5.495 6.096 854 HB3 GLN 481 HB1 GLN 481 18.994 7.122 6.468 855 HG2 GLN 481 HG2 GLN 481 18.527 6.724 8.841 856 HG3 GLN 481 HG1 GLN 481 18.011 5.085 8.454 857 HE21 GLN 481 HE21 GLN 481 20.077 4.709 6.437 858 HE22 GLN 481 HE22 GLN 481 21.566 4.506 7.292 859 H LEU 482 HN LEU 482 15.342 6.168 4.735 860 HA LEU 482 HA LEU 482 16.410 8.152 2.854 861 HB2 LEU 482 HB2 LEU 482 15.372 5.423 2.610 862 HB3 LEU 482 HB1 LEU 482 14.729 6.523 1.409 863 HG LEU 482 HG LEU 482 16.656 5.361 0.524 864 HD11 LEU 482 HD11 LEU 482 17.939 7.234 -0.241 865 HD12 LEU 482 HD12 LEU 482 17.409 8.216 1.123 866 HD13 LEU 482 HD13 LEU 482 16.250 7.726 -0.113 867 HD21 LEU 482 HD21 LEU 482 17.769 4.876 2.655 868 HD22 LEU 482 HD22 LEU 482 18.213 6.576 2.803 869 HD23 LEU 482 HD23 LEU 482 18.869 5.605 1.486 870 H THR 483 HN THR 483 13.260 6.698 3.719 871 HA THR 483 HA THR 483 11.890 9.002 2.575 872 HB THR 483 HB THR 483 9.830 7.725 2.972 873 HG1 THR 483 HG1 THR 483 10.983 5.347 3.646 874 HG21 THR 483 HG21 THR 483 10.294 5.854 1.448 875 HG22 THR 483 HG22 THR 483 12.023 6.090 1.691 876 HG23 THR 483 HG23 THR 483 11.066 7.341 0.899 877 H ARG 484 HN ARG 484 12.488 7.511 5.701 878 HA ARG 484 HA ARG 484 12.182 8.219 7.838 879 HB2 ARG 484 HB2 ARG 484 12.637 10.605 6.332 880 HB3 ARG 484 HB1 ARG 484 11.390 10.941 7.522 881 HG2 ARG 484 HG2 ARG 484 13.255 11.459 8.720 882 HG3 ARG 484 HG1 ARG 484 13.065 9.758 9.154 883 HD2 ARG 484 HD2 ARG 484 14.809 9.084 7.774 884 HD3 ARG 484 HD1 ARG 484 14.742 10.556 6.805 885 HE ARG 484 HE ARG 484 15.484 10.913 9.583 886 HH11 ARG 484 HH11 ARG 484 16.585 10.487 6.288 887 HH12 ARG 484 HH12 ARG 484 18.156 11.145 6.598 888 HH21 ARG 484 HH21 ARG 484 17.556 11.758 9.999 889 HH22 ARG 484 HH22 ARG 484 18.716 11.861 8.712 890 H SER 485 HN SER 485 10.009 7.117 6.381 891 HA SER 485 HA SER 485 7.802 8.092 8.002 892 HB2 SER 485 HB2 SER 485 7.941 9.263 5.645 893 HB3 SER 485 HB1 SER 485 7.287 7.733 5.068 894 HG SER 485 HG SER 485 5.674 8.154 6.902 895 H VAL 486 HN VAL 486 7.053 6.289 8.937 896 HA VAL 486 HA VAL 486 7.658 3.688 8.156 897 HB VAL 486 HB VAL 486 5.821 2.948 9.666 898 HG11 VAL 486 HG11 VAL 486 7.595 5.104 10.797 899 HG12 VAL 486 HG12 VAL 486 8.063 3.428 10.517 900 HG13 VAL 486 HG13 VAL 486 6.820 3.808 11.708 901 HG21 VAL 486 HG21 VAL 486 4.239 4.757 9.245 902 HG22 VAL 486 HG22 VAL 486 5.338 5.904 10.010 903 HG23 VAL 486 HG23 VAL 486 4.598 4.619 10.966 904 H GLU 487 HN GLU 487 4.982 5.746 7.237 905 HA GLU 487 HA GLU 487 3.332 3.784 6.083 906 HB2 GLU 487 HB2 GLU 487 3.595 6.626 5.120 907 HB3 GLU 487 HB1 GLU 487 2.183 5.586 5.019 908 HG2 GLU 487 HG2 GLU 487 1.527 6.794 6.795 909 HG3 GLU 487 HG1 GLU 487 2.516 5.630 7.679 910 H ILE 488 HN ILE 488 5.670 5.981 4.542 911 HA ILE 488 HA ILE 488 5.456 4.839 1.971 912 HB ILE 488 HB ILE 488 7.910 6.253 3.010 913 HG12 ILE 488 HG12 ILE 488 5.432 7.518 1.823 914 HG13 ILE 488 HG11 ILE 488 5.844 7.558 3.533 915 HG21 ILE 488 HG21 ILE 488 6.690 6.060 0.259 916 HG22 ILE 488 HG22 ILE 488 8.111 5.186 0.824 917 HG23 ILE 488 HG23 ILE 488 8.158 6.943 0.677 918 HD11 ILE 488 HD11 ILE 488 6.438 9.640 2.460 919 HD12 ILE 488 HD12 ILE 488 7.442 8.780 1.291 920 HD13 ILE 488 HD13 ILE 488 7.889 8.796 2.998 921 H THR 489 HN THR 489 7.607 4.206 4.696 922 HA THR 489 HA THR 489 9.471 2.574 3.433 923 HB THR 489 HB THR 489 8.474 2.444 6.284 924 HG1 THR 489 HG1 THR 489 10.544 3.857 4.941 925 HG21 THR 489 HG21 THR 489 9.549 0.370 5.868 926 HG22 THR 489 HG22 THR 489 10.741 1.383 6.687 927 HG23 THR 489 HG23 THR 489 10.835 1.141 4.943 928 H THR 490 HN THR 490 6.626 1.480 5.314 929 HA THR 490 HA THR 490 6.933 -1.228 4.642 930 HB THR 490 HB THR 490 4.210 -0.133 5.193 931 HG1 THR 490 HG1 THR 490 5.389 1.060 6.659 932 HG21 THR 490 HG21 THR 490 4.554 -2.553 4.986 933 HG22 THR 490 HG22 THR 490 4.096 -2.120 6.631 934 HG23 THR 490 HG23 THR 490 5.779 -2.491 6.254 935 H ASP 491 HN ASP 491 5.229 1.402 3.060 936 HA ASP 491 HA ASP 491 3.802 -0.133 1.159 937 HB2 ASP 491 HB2 ASP 491 3.286 2.227 1.641 938 HB3 ASP 491 HB1 ASP 491 4.844 2.707 0.983 939 H ASN 492 HN ASN 492 6.887 1.553 1.056 940 HA ASN 492 HA ASN 492 7.676 0.924 -1.552 941 HB2 ASN 492 HB2 ASN 492 8.650 2.538 0.318 942 HB3 ASN 492 HB1 ASN 492 9.704 1.166 0.636 943 HD21 ASN 492 HD21 ASN 492 11.403 2.609 0.058 944 HD22 ASN 492 HD22 ASN 492 11.777 2.863 -1.619 945 H ILE 493 HN ILE 493 7.985 -0.875 1.462 946 HA ILE 493 HA ILE 493 9.803 -2.841 0.594 947 HB ILE 493 HB ILE 493 7.594 -3.033 2.656 948 HG12 ILE 493 HG12 ILE 493 10.589 -2.727 2.978 949 HG13 ILE 493 HG11 ILE 493 9.427 -1.413 3.114 950 HG21 ILE 493 HG21 ILE 493 8.770 -5.038 3.487 951 HG22 ILE 493 HG22 ILE 493 9.840 -4.968 2.087 952 HG23 ILE 493 HG23 ILE 493 8.116 -5.264 1.865 953 HD11 ILE 493 HD11 ILE 493 9.698 -3.802 4.913 954 HD12 ILE 493 HD12 ILE 493 8.365 -2.651 4.999 955 HD13 ILE 493 HD13 ILE 493 10.019 -2.114 5.306 956 H LEU 494 HN LEU 494 6.268 -2.720 0.524 957 HA LEU 494 HA LEU 494 5.878 -5.268 -0.652 958 HB2 LEU 494 HB2 LEU 494 4.144 -2.807 -0.506 959 HB3 LEU 494 HB1 LEU 494 3.599 -4.314 -1.218 960 HG LEU 494 HG LEU 494 4.649 -4.307 1.587 961 HD11 LEU 494 HD11 LEU 494 2.315 -3.950 2.360 962 HD12 LEU 494 HD12 LEU 494 1.893 -3.466 0.717 963 HD13 LEU 494 HD13 LEU 494 3.058 -2.518 1.643 964 HD21 LEU 494 HD21 LEU 494 3.481 -6.184 -0.181 965 HD22 LEU 494 HD22 LEU 494 2.342 -5.903 1.142 966 HD23 LEU 494 HD23 LEU 494 3.995 -6.421 1.487 967 H GLU 495 HN GLU 495 6.792 -2.211 -1.910 968 HA GLU 495 HA GLU 495 5.987 -2.704 -4.619 969 HB2 GLU 495 HB2 GLU 495 7.897 -0.671 -3.455 970 HB3 GLU 495 HB1 GLU 495 7.357 -0.698 -5.128 971 HG2 GLU 495 HG2 GLU 495 5.586 -0.354 -2.722 972 HG3 GLU 495 HG1 GLU 495 6.134 0.936 -3.790 973 H GLY 496 HN GLY 496 8.477 -3.879 -2.700 974 HA2 GLY 496 HA2 GLY 496 10.030 -5.494 -3.386 975 HA3 GLY 496 HA1 GLY 496 9.775 -5.002 -5.052 976 H ARG 497 HN ARG 497 10.297 -2.410 -2.905 977 HA ARG 497 HA ARG 497 12.772 -1.735 -4.173 978 HB2 ARG 497 HB2 ARG 497 10.996 -0.131 -3.244 979 HB3 ARG 497 HB1 ARG 497 11.685 -0.469 -1.664 980 HG2 ARG 497 HG2 ARG 497 12.866 1.392 -2.188 981 HG3 ARG 497 HG1 ARG 497 13.925 0.181 -2.909 982 HD2 ARG 497 HD2 ARG 497 13.661 1.886 -4.523 983 HD3 ARG 497 HD1 ARG 497 12.676 0.529 -5.064 984 HE ARG 497 HE ARG 497 10.896 2.012 -3.692 985 HH11 ARG 497 HH11 ARG 497 13.205 2.807 -6.200 986 HH12 ARG 497 HH12 ARG 497 12.280 4.141 -6.813 987 HH21 ARG 497 HH21 ARG 497 9.662 3.767 -4.501 988 HH22 ARG 497 HH22 ARG 497 10.262 4.684 -5.847 989 H ILE 498 HN ILE 498 11.784 -3.115 -1.130 990 HA ILE 498 HA ILE 498 14.547 -3.287 -0.204 991 HB ILE 498 HB ILE 498 11.889 -3.759 1.136 992 HG12 ILE 498 HG12 ILE 498 13.069 -2.260 2.873 993 HG13 ILE 498 HG11 ILE 498 14.257 -1.959 1.613 994 HG21 ILE 498 HG21 ILE 498 13.252 -5.671 1.760 995 HG22 ILE 498 HG22 ILE 498 13.056 -4.579 3.130 996 HG23 ILE 498 HG23 ILE 498 14.571 -4.596 2.228 997 HD11 ILE 498 HD11 ILE 498 11.314 -1.369 1.433 998 HD12 ILE 498 HD12 ILE 498 12.510 -1.056 0.176 999 HD13 ILE 498 HD13 ILE 498 12.597 -0.193 1.711 1000 H GLN 499 HN GLN 499 15.685 -5.123 -0.373 1001 HA GLN 499 HA GLN 499 14.795 -7.228 -1.998 1002 HB2 GLN 499 HB2 GLN 499 17.093 -7.377 -0.067 1003 HB3 GLN 499 HB1 GLN 499 16.891 -8.270 -1.567 1004 HG2 GLN 499 HG2 GLN 499 17.416 -5.323 -1.263 1005 HG3 GLN 499 HG1 GLN 499 18.517 -6.545 -1.889 1006 HE21 GLN 499 HE21 GLN 499 17.503 -4.093 -3.115 1007 HE22 GLN 499 HE22 GLN 499 16.751 -4.575 -4.595 1008 H VAL 500 HN VAL 500 13.172 -8.479 -1.426 1009 HA VAL 500 HA VAL 500 12.566 -9.244 1.239 1010 HB VAL 500 HB VAL 500 10.923 -10.786 0.199 1011 HG11 VAL 500 HG11 VAL 500 10.324 -8.458 0.602 1012 HG12 VAL 500 HG12 VAL 500 9.537 -9.072 -0.852 1013 HG13 VAL 500 HG13 VAL 500 10.943 -8.015 -0.990 1014 HG21 VAL 500 HG21 VAL 500 12.122 -9.826 -2.400 1015 HG22 VAL 500 HG22 VAL 500 10.635 -10.761 -2.249 1016 HG23 VAL 500 HG23 VAL 500 12.175 -11.469 -1.761 1017 HA PRO 501 HA PRO 501 15.031 -12.825 1.989 1018 HB2 PRO 501 HB2 PRO 501 12.521 -14.339 2.536 1019 HB3 PRO 501 HB1 PRO 501 13.947 -14.104 3.565 1020 HG2 PRO 501 HG2 PRO 501 11.700 -12.819 4.075 1021 HG3 PRO 501 HG1 PRO 501 13.275 -12.028 4.275 1022 HD2 PRO 501 HD2 PRO 501 11.268 -11.699 2.092 1023 HD3 PRO 501 HD1 PRO 501 12.317 -10.487 2.856 1024 H PHE 502 HN PHE 502 15.935 -13.790 0.292 1025 HA PHE 502 HA PHE 502 14.257 -15.517 -1.403 1026 HB2 PHE 502 HB2 PHE 502 15.007 -13.380 -2.538 1027 HB3 PHE 502 HB1 PHE 502 16.665 -13.936 -2.349 1028 HD1 PHE 502 HD1 PHE 502 13.468 -14.547 -4.048 1029 HD2 PHE 502 HD2 PHE 502 17.570 -15.628 -3.764 1030 HE1 PHE 502 HE1 PHE 502 13.284 -15.777 -6.168 1031 HE2 PHE 502 HE2 PHE 502 17.396 -16.860 -5.886 1032 HZ PHE 502 HZ PHE 502 15.252 -16.936 -7.091 1033 HA PRO 503 HA PRO 503 17.040 -18.682 0.011 1034 HB2 PRO 503 HB2 PRO 503 16.660 -20.432 -2.101 1035 HB3 PRO 503 HB1 PRO 503 15.576 -20.294 -0.705 1036 HG2 PRO 503 HG2 PRO 503 15.301 -19.124 -3.425 1037 HG3 PRO 503 HG1 PRO 503 14.064 -19.834 -2.367 1038 HD2 PRO 503 HD2 PRO 503 14.323 -17.179 -2.640 1039 HD3 PRO 503 HD1 PRO 503 13.859 -17.920 -1.095 1040 H THR 504 HN THR 504 19.028 -17.704 -0.199 1041 HA THR 504 HA THR 504 20.393 -18.131 -2.773 1042 HB THR 504 HB THR 504 21.187 -15.948 -0.862 1043 HG1 THR 504 HG1 THR 504 18.881 -15.843 -1.663 1044 HG21 THR 504 HG21 THR 504 22.748 -16.594 -2.646 1045 HG22 THR 504 HG22 THR 504 22.143 -14.953 -2.873 1046 HG23 THR 504 HG23 THR 504 21.499 -16.272 -3.850 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 -18.513 -10.646 14.462 2 H2 MET 1 HT2 MET 1 -18.586 -12.309 14.145 3 H3 MET 1 HT3 MET 1 -17.660 -11.300 13.153 4 HA MET 1 HA MET 1 -17.151 -11.891 16.006 5 HB2 MET 1 HB2 MET 1 -15.260 -13.154 15.298 6 HB3 MET 1 HB1 MET 1 -16.616 -13.709 14.327 7 HG2 MET 1 HG2 MET 1 -15.829 -12.183 12.509 8 HG3 MET 1 HG1 MET 1 -14.388 -11.879 13.476 9 HE1 MET 1 HE1 MET 1 -12.947 -14.171 10.675 10 HE2 MET 1 HE2 MET 1 -12.795 -12.641 11.538 11 HE3 MET 1 HE3 MET 1 -14.184 -12.928 10.490 12 H GLN 2 HN GLN 2 -15.217 -10.912 16.851 13 HA GLN 2 HA GLN 2 -14.792 -8.263 15.698 14 HB2 GLN 2 HB2 GLN 2 -13.653 -9.257 18.301 15 HB3 GLN 2 HB1 GLN 2 -13.930 -7.597 17.802 16 HG2 GLN 2 HG2 GLN 2 -15.991 -9.646 18.565 17 HG3 GLN 2 HG1 GLN 2 -15.550 -8.184 19.443 18 HE21 GLN 2 HE21 GLN 2 -18.116 -9.128 18.347 19 HE22 GLN 2 HE22 GLN 2 -18.682 -7.859 17.308 20 H ILE 3 HN ILE 3 -12.831 -7.469 15.084 21 HA ILE 3 HA ILE 3 -10.522 -9.282 15.175 22 HB ILE 3 HB ILE 3 -9.831 -8.476 12.915 23 HG12 ILE 3 HG12 ILE 3 -12.697 -7.584 12.578 24 HG13 ILE 3 HG11 ILE 3 -11.410 -6.465 13.012 25 HG21 ILE 3 HG21 ILE 3 -11.335 -9.964 11.663 26 HG22 ILE 3 HG22 ILE 3 -12.432 -10.000 13.044 27 HG23 ILE 3 HG23 ILE 3 -10.810 -10.675 13.189 28 HD11 ILE 3 HD11 ILE 3 -11.493 -8.147 10.520 29 HD12 ILE 3 HD12 ILE 3 -10.246 -6.974 10.948 30 HD13 ILE 3 HD13 ILE 3 -11.895 -6.432 10.622 31 H PHE 4 HN PHE 4 -8.448 -8.118 14.890 32 HA PHE 4 HA PHE 4 -8.691 -5.348 15.866 33 HB2 PHE 4 HB2 PHE 4 -6.607 -7.422 16.579 34 HB3 PHE 4 HB1 PHE 4 -6.553 -5.737 17.084 35 HD1 PHE 4 HD1 PHE 4 -8.375 -4.860 18.574 36 HD2 PHE 4 HD2 PHE 4 -7.870 -9.010 17.766 37 HE1 PHE 4 HE1 PHE 4 -9.722 -5.405 20.557 38 HE2 PHE 4 HE2 PHE 4 -9.218 -9.563 19.750 39 HZ PHE 4 HZ PHE 4 -10.149 -7.759 21.148 40 H VAL 5 HN VAL 5 -8.288 -4.121 14.118 41 HA VAL 5 HA VAL 5 -6.162 -4.885 12.273 42 HB VAL 5 HB VAL 5 -7.937 -2.447 12.147 43 HG11 VAL 5 HG11 VAL 5 -7.346 -2.456 9.769 44 HG12 VAL 5 HG12 VAL 5 -6.310 -3.859 10.034 45 HG13 VAL 5 HG13 VAL 5 -5.912 -2.314 10.787 46 HG21 VAL 5 HG21 VAL 5 -9.283 -4.512 12.174 47 HG22 VAL 5 HG22 VAL 5 -8.357 -5.111 10.797 48 HG23 VAL 5 HG23 VAL 5 -9.366 -3.676 10.623 49 H LYS 6 HN LYS 6 -4.157 -4.243 12.647 50 HA LYS 6 HA LYS 6 -3.682 -1.961 14.411 51 HB2 LYS 6 HB2 LYS 6 -2.474 -4.462 14.175 52 HB3 LYS 6 HB1 LYS 6 -1.308 -3.354 13.469 53 HG2 LYS 6 HG2 LYS 6 -1.175 -2.087 15.475 54 HG3 LYS 6 HG1 LYS 6 -2.555 -2.935 16.172 55 HD2 LYS 6 HD2 LYS 6 -1.280 -5.008 16.231 56 HD3 LYS 6 HD1 LYS 6 0.096 -4.202 15.474 57 HE2 LYS 6 HE2 LYS 6 0.362 -2.760 17.392 58 HE3 LYS 6 HE1 LYS 6 -1.101 -3.413 18.128 59 HZ1 LYS 6 HZ1 LYS 6 -0.064 -5.475 18.491 60 HZ2 LYS 6 HZ2 LYS 6 1.076 -4.321 18.974 61 HZ3 LYS 6 HZ3 LYS 6 1.243 -5.103 17.488 62 H THR 7 HN THR 7 -2.580 -0.168 13.786 63 HA THR 7 HA THR 7 -2.009 0.081 10.908 64 HB THR 7 HB THR 7 -2.394 2.574 11.336 65 HG1 THR 7 HG1 THR 7 -3.836 1.599 13.594 66 HG21 THR 7 HG21 THR 7 -4.708 0.649 11.589 67 HG22 THR 7 HG22 THR 7 -3.998 1.253 10.093 68 HG23 THR 7 HG23 THR 7 -4.857 2.355 11.169 69 H LEU 8 HN LEU 8 -0.290 1.599 10.355 70 HA LEU 8 HA LEU 8 2.064 1.196 11.847 71 HB2 LEU 8 HB2 LEU 8 1.407 3.192 9.675 72 HB3 LEU 8 HB1 LEU 8 3.015 2.988 10.346 73 HG LEU 8 HG LEU 8 1.524 0.709 9.065 74 HD11 LEU 8 HD11 LEU 8 3.505 2.536 7.722 75 HD12 LEU 8 HD12 LEU 8 1.760 2.613 7.483 76 HD13 LEU 8 HD13 LEU 8 2.652 1.169 7.004 77 HD21 LEU 8 HD21 LEU 8 3.790 -0.198 8.804 78 HD22 LEU 8 HD22 LEU 8 3.398 0.100 10.498 79 HD23 LEU 8 HD23 LEU 8 4.448 1.217 9.623 80 H THR 9 HN THR 9 -0.454 3.506 12.088 81 HA THR 9 HA THR 9 0.984 5.574 13.419 82 HB THR 9 HB THR 9 -1.797 5.591 14.107 83 HG1 THR 9 HG1 THR 9 -2.758 5.143 12.206 84 HG21 THR 9 HG21 THR 9 -0.404 7.578 13.792 85 HG22 THR 9 HG22 THR 9 -1.795 7.618 12.708 86 HG23 THR 9 HG23 THR 9 -0.204 7.179 12.085 87 H GLY 10 HN GLY 10 -0.064 2.506 14.376 88 HA2 GLY 10 HA2 GLY 10 0.331 1.494 16.440 89 HA3 GLY 10 HA1 GLY 10 0.604 3.081 17.143 90 H LYS 11 HN LYS 11 -2.229 2.588 15.240 91 HA LYS 11 HA LYS 11 -3.845 2.659 17.699 92 HB2 LYS 11 HB2 LYS 11 -4.084 4.618 16.216 93 HB3 LYS 11 HB1 LYS 11 -4.562 3.559 14.900 94 HG2 LYS 11 HG2 LYS 11 -6.519 2.852 16.248 95 HG3 LYS 11 HG1 LYS 11 -6.068 4.055 17.456 96 HD2 LYS 11 HD2 LYS 11 -6.285 5.821 15.759 97 HD3 LYS 11 HD1 LYS 11 -6.752 4.605 14.568 98 HE2 LYS 11 HE2 LYS 11 -8.690 4.016 15.970 99 HE3 LYS 11 HE1 LYS 11 -8.242 5.295 17.096 100 HZ1 LYS 11 HZ1 LYS 11 -8.449 6.852 15.155 101 HZ2 LYS 11 HZ2 LYS 11 -9.897 6.178 15.704 102 HZ3 LYS 11 HZ3 LYS 11 -9.169 5.580 14.291 103 H THR 12 HN THR 12 -5.393 1.115 18.043 104 HA THR 12 HA THR 12 -5.469 -1.079 16.089 105 HB THR 12 HB THR 12 -6.543 -1.235 18.895 106 HG1 THR 12 HG1 THR 12 -4.198 -0.564 18.673 107 HG21 THR 12 HG21 THR 12 -7.126 -3.026 17.314 108 HG22 THR 12 HG22 THR 12 -6.098 -3.614 18.621 109 HG23 THR 12 HG23 THR 12 -5.410 -3.317 17.024 110 H ILE 13 HN ILE 13 -7.217 -1.321 14.883 111 HA ILE 13 HA ILE 13 -9.682 0.069 15.682 112 HB ILE 13 HB ILE 13 -8.988 -0.979 12.940 113 HG12 ILE 13 HG12 ILE 13 -8.858 1.911 13.774 114 HG13 ILE 13 HG11 ILE 13 -7.450 0.861 13.889 115 HG21 ILE 13 HG21 ILE 13 -11.105 0.934 13.906 116 HG22 ILE 13 HG22 ILE 13 -11.356 -0.701 13.298 117 HG23 ILE 13 HG23 ILE 13 -10.773 0.563 12.215 118 HD11 ILE 13 HD11 ILE 13 -7.552 0.453 11.495 119 HD12 ILE 13 HD12 ILE 13 -7.434 2.178 11.845 120 HD13 ILE 13 HD13 ILE 13 -8.982 1.476 11.374 121 H THR 14 HN THR 14 -11.260 -1.163 16.465 122 HA THR 14 HA THR 14 -11.237 -4.037 15.917 123 HB THR 14 HB THR 14 -13.096 -2.579 17.798 124 HG1 THR 14 HG1 THR 14 -10.437 -2.791 17.968 125 HG21 THR 14 HG21 THR 14 -13.652 -4.912 17.227 126 HG22 THR 14 HG22 THR 14 -13.203 -4.740 18.924 127 HG23 THR 14 HG23 THR 14 -12.052 -5.417 17.771 128 H LEU 15 HN LEU 15 -12.539 -4.870 14.408 129 HA LEU 15 HA LEU 15 -14.921 -3.323 13.624 130 HB2 LEU 15 HB2 LEU 15 -13.026 -4.845 11.840 131 HB3 LEU 15 HB1 LEU 15 -14.559 -4.183 11.312 132 HG LEU 15 HG LEU 15 -12.389 -2.455 12.472 133 HD11 LEU 15 HD11 LEU 15 -11.648 -1.962 10.250 134 HD12 LEU 15 HD12 LEU 15 -12.880 -3.014 9.554 135 HD13 LEU 15 HD13 LEU 15 -11.557 -3.705 10.495 136 HD21 LEU 15 HD21 LEU 15 -14.640 -1.504 12.422 137 HD22 LEU 15 HD22 LEU 15 -14.753 -1.857 10.697 138 HD23 LEU 15 HD23 LEU 15 -13.572 -0.687 11.282 139 H GLU 16 HN GLU 16 -16.752 -4.425 13.153 140 HA GLU 16 HA GLU 16 -16.886 -7.194 14.030 141 HB2 GLU 16 HB2 GLU 16 -18.588 -5.666 14.886 142 HB3 GLU 16 HB1 GLU 16 -19.040 -5.206 13.251 143 HG2 GLU 16 HG2 GLU 16 -20.709 -6.677 13.861 144 HG3 GLU 16 HG1 GLU 16 -19.607 -7.699 12.940 145 H VAL 17 HN VAL 17 -16.379 -8.647 12.524 146 HA VAL 17 HA VAL 17 -17.559 -8.345 9.845 147 HB VAL 17 HB VAL 17 -15.463 -9.310 8.865 148 HG11 VAL 17 HG11 VAL 17 -14.172 -7.202 8.930 149 HG12 VAL 17 HG12 VAL 17 -15.203 -6.640 10.247 150 HG13 VAL 17 HG13 VAL 17 -15.895 -6.936 8.653 151 HG21 VAL 17 HG21 VAL 17 -14.546 -10.279 10.909 152 HG22 VAL 17 HG22 VAL 17 -14.317 -8.666 11.581 153 HG23 VAL 17 HG23 VAL 17 -13.391 -9.171 10.166 154 H GLU 18 HN GLU 18 -17.404 -10.438 8.606 155 HA GLU 18 HA GLU 18 -17.658 -12.750 10.406 156 HB2 GLU 18 HB2 GLU 18 -19.436 -11.875 8.135 157 HB3 GLU 18 HB1 GLU 18 -19.389 -13.550 8.667 158 HG2 GLU 18 HG2 GLU 18 -20.031 -11.223 10.468 159 HG3 GLU 18 HG1 GLU 18 -21.240 -12.214 9.651 160 HA PRO 19 HA PRO 19 -14.732 -14.908 7.913 161 HB2 PRO 19 HB2 PRO 19 -16.742 -17.088 7.574 162 HB3 PRO 19 HB1 PRO 19 -15.076 -17.170 8.179 163 HG2 PRO 19 HG2 PRO 19 -17.111 -17.352 9.850 164 HG3 PRO 19 HG1 PRO 19 -15.655 -16.438 10.286 165 HD2 PRO 19 HD2 PRO 19 -18.323 -15.427 9.424 166 HD3 PRO 19 HD1 PRO 19 -17.200 -14.769 10.630 167 H SER 20 HN SER 20 -18.052 -14.907 6.674 168 HA SER 20 HA SER 20 -17.235 -15.384 3.954 169 HB2 SER 20 HB2 SER 20 -19.950 -14.374 4.736 170 HB3 SER 20 HB1 SER 20 -19.509 -15.503 3.456 171 HG SER 20 HG SER 20 -20.516 -16.422 5.392 172 H ASP 21 HN ASP 21 -16.699 -12.761 5.716 173 HA ASP 21 HA ASP 21 -17.826 -10.734 4.000 174 HB2 ASP 21 HB2 ASP 21 -17.211 -10.593 6.550 175 HB3 ASP 21 HB1 ASP 21 -15.617 -10.167 5.937 176 H THR 22 HN THR 22 -16.792 -9.521 2.480 177 HA THR 22 HA THR 22 -14.396 -10.686 1.328 178 HB THR 22 HB THR 22 -15.466 -8.231 0.116 179 HG1 THR 22 HG1 THR 22 -17.092 -10.577 0.101 180 HG21 THR 22 HG21 THR 22 -15.047 -11.028 -0.949 181 HG22 THR 22 HG22 THR 22 -13.862 -9.721 -1.006 182 HG23 THR 22 HG23 THR 22 -15.372 -9.585 -1.910 183 H ILE 23 HN ILE 23 -12.434 -9.623 1.078 184 HA ILE 23 HA ILE 23 -11.601 -7.871 3.093 185 HB ILE 23 HB ILE 23 -10.316 -8.189 0.373 186 HG12 ILE 23 HG12 ILE 23 -10.674 -10.377 1.407 187 HG13 ILE 23 HG11 ILE 23 -8.962 -9.967 1.392 188 HG21 ILE 23 HG21 ILE 23 -8.248 -7.580 1.493 189 HG22 ILE 23 HG22 ILE 23 -9.109 -7.403 3.022 190 HG23 ILE 23 HG23 ILE 23 -9.453 -6.307 1.684 191 HD11 ILE 23 HD11 ILE 23 -10.817 -9.776 3.755 192 HD12 ILE 23 HD12 ILE 23 -9.110 -9.335 3.751 193 HD13 ILE 23 HD13 ILE 23 -9.588 -11.010 3.483 194 H GLU 24 HN GLU 24 -12.763 -7.272 -0.153 195 HA GLU 24 HA GLU 24 -12.186 -4.546 -0.366 196 HB2 GLU 24 HB2 GLU 24 -12.916 -5.979 -2.238 197 HB3 GLU 24 HB1 GLU 24 -14.522 -6.072 -1.532 198 HG2 GLU 24 HG2 GLU 24 -14.319 -3.430 -1.685 199 HG3 GLU 24 HG1 GLU 24 -13.207 -3.860 -2.987 200 H ASN 25 HN ASN 25 -14.891 -6.241 1.111 201 HA ASN 25 HA ASN 25 -16.440 -3.903 1.629 202 HB2 ASN 25 HB2 ASN 25 -17.414 -6.200 1.478 203 HB3 ASN 25 HB1 ASN 25 -16.603 -6.601 2.989 204 HD21 ASN 25 HD21 ASN 25 -18.317 -6.918 4.269 205 HD22 ASN 25 HD22 ASN 25 -19.494 -5.696 4.644 206 H VAL 26 HN VAL 26 -14.088 -5.810 3.418 207 HA VAL 26 HA VAL 26 -14.386 -4.607 5.935 208 HB VAL 26 HB VAL 26 -11.855 -5.720 4.699 209 HG11 VAL 26 HG11 VAL 26 -11.390 -4.342 6.661 210 HG12 VAL 26 HG12 VAL 26 -11.104 -6.048 7.009 211 HG13 VAL 26 HG13 VAL 26 -12.569 -5.262 7.596 212 HG21 VAL 26 HG21 VAL 26 -13.659 -7.358 4.694 213 HG22 VAL 26 HG22 VAL 26 -13.950 -7.062 6.409 214 HG23 VAL 26 HG23 VAL 26 -12.432 -7.791 5.886 215 H LYS 27 HN LYS 27 -12.501 -3.703 3.103 216 HA LYS 27 HA LYS 27 -11.033 -1.590 4.200 217 HB2 LYS 27 HB2 LYS 27 -12.023 -2.142 1.408 218 HB3 LYS 27 HB1 LYS 27 -11.075 -0.712 1.788 219 HG2 LYS 27 HG2 LYS 27 -9.263 -2.162 2.611 220 HG3 LYS 27 HG1 LYS 27 -10.210 -3.575 2.133 221 HD2 LYS 27 HD2 LYS 27 -10.167 -2.861 -0.175 222 HD3 LYS 27 HD1 LYS 27 -9.330 -1.372 0.268 223 HE2 LYS 27 HE2 LYS 27 -7.391 -2.619 0.967 224 HE3 LYS 27 HE1 LYS 27 -8.231 -4.146 0.696 225 HZ1 LYS 27 HZ1 LYS 27 -8.390 -3.583 -1.663 226 HZ2 LYS 27 HZ2 LYS 27 -6.777 -3.659 -1.143 227 HZ3 LYS 27 HZ3 LYS 27 -7.511 -2.158 -1.388 228 H ALA 28 HN ALA 28 -14.263 -1.683 2.788 229 HA ALA 28 HA ALA 28 -14.758 1.082 2.779 230 HB1 ALA 28 HB1 ALA 28 -16.120 -0.586 1.565 231 HB2 ALA 28 HB2 ALA 28 -17.090 0.510 2.547 232 HB3 ALA 28 HB3 ALA 28 -16.777 -1.132 3.108 233 H LYS 29 HN LYS 29 -15.120 -1.373 5.272 234 HA LYS 29 HA LYS 29 -16.549 0.240 7.116 235 HB2 LYS 29 HB2 LYS 29 -14.756 -2.134 7.667 236 HB3 LYS 29 HB1 LYS 29 -15.949 -1.463 8.769 237 HG2 LYS 29 HG2 LYS 29 -17.732 -2.057 7.217 238 HG3 LYS 29 HG1 LYS 29 -16.543 -2.710 6.096 239 HD2 LYS 29 HD2 LYS 29 -15.867 -4.346 7.827 240 HD3 LYS 29 HD1 LYS 29 -17.156 -3.731 8.864 241 HE2 LYS 29 HE2 LYS 29 -18.775 -4.287 7.047 242 HE3 LYS 29 HE1 LYS 29 -17.456 -5.066 6.180 243 HZ1 LYS 29 HZ1 LYS 29 -17.549 -6.855 7.490 244 HZ2 LYS 29 HZ2 LYS 29 -19.088 -6.290 7.920 245 HZ3 LYS 29 HZ3 LYS 29 -17.765 -5.949 8.912 246 H ILE 30 HN ILE 30 -13.125 -0.313 6.505 247 HA ILE 30 HA ILE 30 -12.154 1.118 8.760 248 HB ILE 30 HB ILE 30 -10.781 0.601 6.107 249 HG12 ILE 30 HG12 ILE 30 -10.629 -0.946 8.708 250 HG13 ILE 30 HG11 ILE 30 -11.541 -1.452 7.290 251 HG21 ILE 30 HG21 ILE 30 -9.727 2.402 7.387 252 HG22 ILE 30 HG22 ILE 30 -8.697 0.972 7.332 253 HG23 ILE 30 HG23 ILE 30 -9.613 1.343 8.794 254 HD11 ILE 30 HD11 ILE 30 -9.443 -2.637 7.436 255 HD12 ILE 30 HD12 ILE 30 -8.556 -1.112 7.454 256 HD13 ILE 30 HD13 ILE 30 -9.459 -1.593 6.016 257 H GLN 31 HN GLN 31 -13.028 1.983 5.466 258 HA GLN 31 HA GLN 31 -12.067 4.666 5.607 259 HB2 GLN 31 HB2 GLN 31 -12.452 3.486 3.466 260 HB3 GLN 31 HB1 GLN 31 -14.179 3.484 3.789 261 HG2 GLN 31 HG2 GLN 31 -14.219 5.905 3.719 262 HG3 GLN 31 HG1 GLN 31 -12.477 5.943 3.467 263 HE21 GLN 31 HE21 GLN 31 -12.676 7.032 1.526 264 HE22 GLN 31 HE22 GLN 31 -13.249 6.261 0.087 265 H ASP 32 HN ASP 32 -14.965 3.046 6.580 266 HA ASP 32 HA ASP 32 -16.626 5.336 6.794 267 HB2 ASP 32 HB2 ASP 32 -17.612 3.120 6.685 268 HB3 ASP 32 HB1 ASP 32 -16.793 2.641 8.165 269 H LYS 33 HN LYS 33 -14.683 3.550 9.176 270 HA LYS 33 HA LYS 33 -15.333 5.409 11.273 271 HB2 LYS 33 HB2 LYS 33 -13.372 3.121 11.130 272 HB3 LYS 33 HB1 LYS 33 -13.603 4.105 12.567 273 HG2 LYS 33 HG2 LYS 33 -16.032 3.449 12.501 274 HG3 LYS 33 HG1 LYS 33 -15.602 2.288 11.243 275 HD2 LYS 33 HD2 LYS 33 -13.916 1.326 12.836 276 HD3 LYS 33 HD1 LYS 33 -14.592 2.376 14.081 277 HE2 LYS 33 HE2 LYS 33 -16.179 0.335 12.529 278 HE3 LYS 33 HE1 LYS 33 -15.479 0.046 14.119 279 HZ1 LYS 33 HZ1 LYS 33 -16.962 2.424 14.203 280 HZ2 LYS 33 HZ2 LYS 33 -17.244 0.977 15.033 281 HZ3 LYS 33 HZ3 LYS 33 -17.927 1.222 13.508 282 H GLU 34 HN GLU 34 -12.270 4.576 9.615 283 HA GLU 34 HA GLU 34 -10.973 6.878 10.775 284 HB2 GLU 34 HB2 GLU 34 -9.969 4.971 8.657 285 HB3 GLU 34 HB1 GLU 34 -8.997 6.137 9.540 286 HG2 GLU 34 HG2 GLU 34 -10.475 3.846 10.814 287 HG3 GLU 34 HG1 GLU 34 -8.777 3.801 10.347 288 H GLY 35 HN GLY 35 -11.638 5.843 7.420 289 HA2 GLY 35 HA2 GLY 35 -12.755 7.530 5.982 290 HA3 GLY 35 HA1 GLY 35 -11.661 8.711 6.688 291 H ILE 36 HN ILE 36 -9.877 6.029 6.403 292 HA ILE 36 HA ILE 36 -8.275 7.006 4.309 293 HB ILE 36 HB ILE 36 -8.320 4.169 5.340 294 HG12 ILE 36 HG12 ILE 36 -6.592 6.376 6.437 295 HG13 ILE 36 HG11 ILE 36 -8.196 6.063 7.091 296 HG21 ILE 36 HG21 ILE 36 -6.072 5.820 4.190 297 HG22 ILE 36 HG22 ILE 36 -6.977 4.589 3.313 298 HG23 ILE 36 HG23 ILE 36 -5.984 4.135 4.698 299 HD11 ILE 36 HD11 ILE 36 -6.456 4.977 8.396 300 HD12 ILE 36 HD12 ILE 36 -5.937 4.085 6.966 301 HD13 ILE 36 HD13 ILE 36 -7.534 3.796 7.654 302 HA PRO 37 HA PRO 37 -10.764 5.497 0.878 303 HB2 PRO 37 HB2 PRO 37 -8.329 6.107 -0.688 304 HB3 PRO 37 HB1 PRO 37 -9.971 6.748 -0.869 305 HG2 PRO 37 HG2 PRO 37 -7.984 8.251 0.079 306 HG3 PRO 37 HG1 PRO 37 -9.655 8.415 0.657 307 HD2 PRO 37 HD2 PRO 37 -7.326 7.092 1.972 308 HD3 PRO 37 HD1 PRO 37 -8.641 8.046 2.687 309 HA PRO 38 HA PRO 38 -9.305 1.290 0.699 310 HB2 PRO 38 HB2 PRO 38 -10.672 1.249 -1.946 311 HB3 PRO 38 HB1 PRO 38 -10.908 0.201 -0.535 312 HG2 PRO 38 HG2 PRO 38 -12.696 2.045 -1.178 313 HG3 PRO 38 HG1 PRO 38 -12.308 1.678 0.515 314 HD2 PRO 38 HD2 PRO 38 -11.478 4.009 -1.146 315 HD3 PRO 38 HD1 PRO 38 -11.888 3.935 0.579 316 H ASP 39 HN ASP 39 -8.770 3.600 -1.832 317 HA ASP 39 HA ASP 39 -7.104 2.099 -3.535 318 HB2 ASP 39 HB2 ASP 39 -8.135 4.242 -4.178 319 HB3 ASP 39 HB1 ASP 39 -7.126 5.082 -3.007 320 H GLN 40 HN GLN 40 -6.479 3.895 -0.589 321 HA GLN 40 HA GLN 40 -3.602 3.371 -0.838 322 HB2 GLN 40 HB2 GLN 40 -5.160 5.208 0.980 323 HB3 GLN 40 HB1 GLN 40 -3.431 4.931 1.128 324 HG2 GLN 40 HG2 GLN 40 -2.987 5.946 -0.947 325 HG3 GLN 40 HG1 GLN 40 -4.691 5.936 -1.402 326 HE21 GLN 40 HE21 GLN 40 -2.742 8.138 -1.185 327 HE22 GLN 40 HE22 GLN 40 -3.462 9.288 -0.118 328 H GLN 41 HN GLN 41 -6.151 1.763 0.279 329 HA GLN 41 HA GLN 41 -5.095 1.044 2.889 330 HB2 GLN 41 HB2 GLN 41 -7.561 0.223 1.369 331 HB3 GLN 41 HB1 GLN 41 -7.083 -0.549 2.873 332 HG2 GLN 41 HG2 GLN 41 -7.084 1.817 3.856 333 HG3 GLN 41 HG1 GLN 41 -7.997 2.261 2.413 334 HE21 GLN 41 HE21 GLN 41 -9.889 2.711 3.496 335 HE22 GLN 41 HE22 GLN 41 -10.850 1.478 4.244 336 H ARG 42 HN ARG 42 -3.176 -0.038 2.448 337 HA ARG 42 HA ARG 42 -3.400 -2.467 0.821 338 HB2 ARG 42 HB2 ARG 42 -1.440 -0.646 0.763 339 HB3 ARG 42 HB1 ARG 42 -0.808 -1.660 2.052 340 HG2 ARG 42 HG2 ARG 42 -0.582 -3.512 0.658 341 HG3 ARG 42 HG1 ARG 42 -1.684 -2.849 -0.547 342 HD2 ARG 42 HD2 ARG 42 0.027 -1.031 -0.938 343 HD3 ARG 42 HD1 ARG 42 1.131 -1.977 0.060 344 HE ARG 42 HE ARG 42 0.133 -3.683 -1.896 345 HH11 ARG 42 HH11 ARG 42 2.154 -0.808 -1.713 346 HH12 ARG 42 HH12 ARG 42 3.015 -1.200 -3.177 347 HH21 ARG 42 HH21 ARG 42 1.300 -4.166 -3.813 348 HH22 ARG 42 HH22 ARG 42 2.544 -3.070 -4.352 349 H LEU 43 HN LEU 43 -4.570 -3.735 2.205 350 HA LEU 43 HA LEU 43 -3.798 -4.110 4.946 351 HB2 LEU 43 HB2 LEU 43 -5.913 -5.270 3.173 352 HB3 LEU 43 HB1 LEU 43 -5.569 -6.000 4.729 353 HG LEU 43 HG LEU 43 -6.289 -3.088 4.441 354 HD11 LEU 43 HD11 LEU 43 -8.131 -5.410 4.998 355 HD12 LEU 43 HD12 LEU 43 -8.107 -4.439 3.525 356 HD13 LEU 43 HD13 LEU 43 -8.563 -3.701 5.059 357 HD21 LEU 43 HD21 LEU 43 -6.826 -3.273 6.805 358 HD22 LEU 43 HD22 LEU 43 -5.160 -3.773 6.513 359 HD23 LEU 43 HD23 LEU 43 -6.409 -4.986 6.781 360 H ILE 44 HN ILE 44 -2.551 -5.584 5.791 361 HA ILE 44 HA ILE 44 -1.629 -7.835 4.136 362 HB ILE 44 HB ILE 44 -0.092 -5.887 5.802 363 HG12 ILE 44 HG12 ILE 44 1.604 -6.486 3.922 364 HG13 ILE 44 HG11 ILE 44 0.214 -7.221 3.133 365 HG21 ILE 44 HG21 ILE 44 0.421 -7.938 6.948 366 HG22 ILE 44 HG22 ILE 44 1.809 -7.457 5.971 367 HG23 ILE 44 HG23 ILE 44 0.750 -8.753 5.419 368 HD11 ILE 44 HD11 ILE 44 0.470 -5.026 2.284 369 HD12 ILE 44 HD12 ILE 44 0.567 -4.342 3.903 370 HD13 ILE 44 HD13 ILE 44 -0.951 -5.029 3.324 371 H PHE 45 HN PHE 45 -1.407 -9.817 5.180 372 HA PHE 45 HA PHE 45 -2.171 -9.910 8.022 373 HB2 PHE 45 HB2 PHE 45 -4.100 -10.507 6.511 374 HB3 PHE 45 HB1 PHE 45 -3.153 -11.882 5.953 375 HD1 PHE 45 HD1 PHE 45 -4.273 -10.348 9.170 376 HD2 PHE 45 HD2 PHE 45 -3.543 -13.901 6.949 377 HE1 PHE 45 HE1 PHE 45 -5.120 -11.693 11.049 378 HE2 PHE 45 HE2 PHE 45 -4.388 -15.251 8.820 379 HZ PHE 45 HZ PHE 45 -5.179 -14.147 10.877 380 H ALA 46 HN ALA 46 -0.405 -10.561 8.998 381 HA ALA 46 HA ALA 46 1.295 -11.874 9.717 382 HB1 ALA 46 HB1 ALA 46 1.418 -14.210 9.052 383 HB2 ALA 46 HB2 ALA 46 0.284 -13.911 7.736 384 HB3 ALA 46 HB3 ALA 46 -0.247 -13.748 9.410 385 H GLY 47 HN GLY 47 1.260 -10.384 6.881 386 HA2 GLY 47 HA2 GLY 47 3.527 -9.659 6.159 387 HA3 GLY 47 HA1 GLY 47 3.954 -11.363 6.154 388 H LYS 48 HN LYS 48 0.973 -11.548 5.066 389 HA LYS 48 HA LYS 48 1.821 -11.256 2.266 390 HB2 LYS 48 HB2 LYS 48 -0.389 -12.968 3.419 391 HB3 LYS 48 HB1 LYS 48 0.069 -12.891 1.724 392 HG2 LYS 48 HG2 LYS 48 2.350 -13.696 2.423 393 HG3 LYS 48 HG1 LYS 48 1.659 -14.001 4.018 394 HD2 LYS 48 HD2 LYS 48 0.652 -15.193 1.432 395 HD3 LYS 48 HD1 LYS 48 1.690 -16.019 2.593 396 HE2 LYS 48 HE2 LYS 48 -0.017 -15.914 4.277 397 HE3 LYS 48 HE1 LYS 48 -1.031 -14.909 3.246 398 HZ1 LYS 48 HZ1 LYS 48 -1.282 -16.730 1.720 399 HZ2 LYS 48 HZ2 LYS 48 -1.731 -17.235 3.269 400 HZ3 LYS 48 HZ3 LYS 48 -0.235 -17.697 2.632 401 H GLN 49 HN GLN 49 0.601 -10.090 0.827 402 HA GLN 49 HA GLN 49 -1.179 -8.142 1.972 403 HB2 GLN 49 HB2 GLN 49 0.520 -7.909 -0.032 404 HB3 GLN 49 HB1 GLN 49 -0.854 -8.458 -0.981 405 HG2 GLN 49 HG2 GLN 49 -2.060 -6.541 0.440 406 HG3 GLN 49 HG1 GLN 49 -0.425 -5.894 0.418 407 HE21 GLN 49 HE21 GLN 49 -3.180 -6.788 -1.498 408 HE22 GLN 49 HE22 GLN 49 -2.702 -5.953 -2.934 409 H LEU 50 HN LEU 50 -3.346 -8.005 1.798 410 HA LEU 50 HA LEU 50 -4.747 -10.403 0.953 411 HB2 LEU 50 HB2 LEU 50 -5.891 -7.871 2.129 412 HB3 LEU 50 HB1 LEU 50 -6.686 -9.428 2.014 413 HG LEU 50 HG LEU 50 -4.299 -8.793 3.751 414 HD11 LEU 50 HD11 LEU 50 -7.110 -9.459 4.590 415 HD12 LEU 50 HD12 LEU 50 -6.499 -7.812 4.451 416 HD13 LEU 50 HD13 LEU 50 -5.773 -8.927 5.609 417 HD21 LEU 50 HD21 LEU 50 -5.843 -11.329 3.288 418 HD22 LEU 50 HD22 LEU 50 -4.856 -11.060 4.723 419 HD23 LEU 50 HD23 LEU 50 -4.108 -11.061 3.126 420 H GLU 51 HN GLU 51 -6.212 -10.538 -0.684 421 HA GLU 51 HA GLU 51 -6.120 -8.393 -2.667 422 HB2 GLU 51 HB2 GLU 51 -7.230 -11.201 -2.858 423 HB3 GLU 51 HB1 GLU 51 -7.145 -10.054 -4.185 424 HG2 GLU 51 HG2 GLU 51 -4.946 -10.393 -4.519 425 HG3 GLU 51 HG1 GLU 51 -4.610 -10.607 -2.800 426 H ASP 52 HN ASP 52 -8.043 -7.520 -3.581 427 HA ASP 52 HA ASP 52 -10.068 -6.982 -1.680 428 HB2 ASP 52 HB2 ASP 52 -9.928 -6.464 -4.650 429 HB3 ASP 52 HB1 ASP 52 -11.256 -5.912 -3.637 430 H GLY 53 HN GLY 53 -9.920 -9.112 -4.491 431 HA2 GLY 53 HA2 GLY 53 -12.676 -9.965 -4.145 432 HA3 GLY 53 HA1 GLY 53 -11.561 -10.518 -5.383 433 H ARG 54 HN ARG 54 -11.336 -10.549 -1.835 434 HA ARG 54 HA ARG 54 -11.429 -13.475 -1.877 435 HB2 ARG 54 HB2 ARG 54 -9.219 -11.817 -0.654 436 HB3 ARG 54 HB1 ARG 54 -9.488 -13.509 -0.263 437 HG2 ARG 54 HG2 ARG 54 -8.890 -12.468 -3.024 438 HG3 ARG 54 HG1 ARG 54 -7.690 -13.134 -1.915 439 HD2 ARG 54 HD2 ARG 54 -9.033 -15.242 -1.859 440 HD3 ARG 54 HD1 ARG 54 -10.050 -14.559 -3.126 441 HE ARG 54 HE ARG 54 -7.226 -15.328 -3.393 442 HH11 ARG 54 HH11 ARG 54 -10.254 -14.327 -4.847 443 HH12 ARG 54 HH12 ARG 54 -9.752 -14.714 -6.461 444 HH21 ARG 54 HH21 ARG 54 -6.564 -15.834 -5.522 445 HH22 ARG 54 HH22 ARG 54 -7.649 -15.562 -6.845 446 H THR 55 HN THR 55 -11.871 -14.400 0.230 447 HA THR 55 HA THR 55 -13.384 -12.531 1.922 448 HB THR 55 HB THR 55 -14.473 -14.553 2.852 449 HG1 THR 55 HG1 THR 55 -12.918 -15.916 0.865 450 HG21 THR 55 HG21 THR 55 -14.568 -14.379 -0.163 451 HG22 THR 55 HG22 THR 55 -15.508 -13.400 0.963 452 HG23 THR 55 HG23 THR 55 -15.787 -15.140 0.860 453 H LEU 56 HN LEU 56 -13.402 -13.210 4.304 454 HA LEU 56 HA LEU 56 -10.754 -13.103 5.297 455 HB2 LEU 56 HB2 LEU 56 -13.355 -13.681 6.713 456 HB3 LEU 56 HB1 LEU 56 -11.829 -13.403 7.528 457 HG LEU 56 HG LEU 56 -13.327 -11.411 5.827 458 HD11 LEU 56 HD11 LEU 56 -12.800 -11.526 8.789 459 HD12 LEU 56 HD12 LEU 56 -14.353 -11.775 7.990 460 HD13 LEU 56 HD13 LEU 56 -13.575 -10.193 7.934 461 HD21 LEU 56 HD21 LEU 56 -11.610 -9.806 6.598 462 HD22 LEU 56 HD22 LEU 56 -10.957 -11.067 5.552 463 HD23 LEU 56 HD23 LEU 56 -10.706 -11.152 7.295 464 H SER 57 HN SER 57 -13.079 -15.684 4.849 465 HA SER 57 HA SER 57 -11.710 -17.676 6.309 466 HB2 SER 57 HB2 SER 57 -13.103 -19.075 4.421 467 HB3 SER 57 HB1 SER 57 -13.804 -18.458 5.919 468 HG SER 57 HG SER 57 -13.871 -17.275 3.337 469 H ASP 58 HN ASP 58 -11.354 -16.394 3.093 470 HA ASP 58 HA ASP 58 -9.997 -18.480 1.834 471 HB2 ASP 58 HB2 ASP 58 -10.071 -15.521 1.460 472 HB3 ASP 58 HB1 ASP 58 -8.823 -16.434 0.618 473 H TYR 59 HN TYR 59 -8.752 -15.881 3.886 474 HA TYR 59 HA TYR 59 -6.054 -16.986 3.681 475 HB2 TYR 59 HB2 TYR 59 -7.051 -14.470 5.037 476 HB3 TYR 59 HB1 TYR 59 -5.364 -14.965 4.935 477 HD1 TYR 59 HD1 TYR 59 -4.189 -14.918 2.772 478 HD2 TYR 59 HD2 TYR 59 -8.178 -13.496 3.162 479 HE1 TYR 59 HE1 TYR 59 -3.977 -13.747 0.618 480 HE2 TYR 59 HE2 TYR 59 -7.979 -12.327 1.013 481 HH TYR 59 HH TYR 59 -5.472 -12.897 -1.185 482 H ASN 60 HN ASN 60 -8.557 -17.945 5.301 483 HA ASN 60 HA ASN 60 -8.934 -19.135 7.192 484 HB2 ASN 60 HB2 ASN 60 -6.379 -19.790 6.486 485 HB3 ASN 60 HB1 ASN 60 -6.136 -19.186 8.120 486 HD21 ASN 60 HD21 ASN 60 -7.475 -21.674 6.153 487 HD22 ASN 60 HD22 ASN 60 -7.901 -22.754 7.436 488 H ILE 61 HN ILE 61 -8.979 -16.250 7.294 489 HA ILE 61 HA ILE 61 -7.777 -15.418 9.767 490 HB ILE 61 HB ILE 61 -9.889 -14.047 8.096 491 HG12 ILE 61 HG12 ILE 61 -6.908 -13.549 8.229 492 HG13 ILE 61 HG11 ILE 61 -7.707 -14.458 6.951 493 HG21 ILE 61 HG21 ILE 61 -9.327 -12.031 9.316 494 HG22 ILE 61 HG22 ILE 61 -8.128 -12.910 10.267 495 HG23 ILE 61 HG23 ILE 61 -9.843 -13.289 10.440 496 HD11 ILE 61 HD11 ILE 61 -8.201 -11.562 7.608 497 HD12 ILE 61 HD12 ILE 61 -8.945 -12.478 6.297 498 HD13 ILE 61 HD13 ILE 61 -7.209 -12.167 6.283 499 H GLN 62 HN GLN 62 -8.516 -15.919 11.694 500 HA GLN 62 HA GLN 62 -11.308 -16.738 12.017 501 HB2 GLN 62 HB2 GLN 62 -9.249 -16.936 14.180 502 HB3 GLN 62 HB1 GLN 62 -10.640 -17.965 13.880 503 HG2 GLN 62 HG2 GLN 62 -9.219 -19.417 12.995 504 HG3 GLN 62 HG1 GLN 62 -9.082 -18.310 11.630 505 HE21 GLN 62 HE21 GLN 62 -6.978 -18.741 11.160 506 HE22 GLN 62 HE22 GLN 62 -5.660 -18.330 12.206 507 H LYS 63 HN LYS 63 -11.687 -16.228 14.697 508 HA LYS 63 HA LYS 63 -12.135 -13.383 14.655 509 HB2 LYS 63 HB2 LYS 63 -13.408 -13.711 16.657 510 HB3 LYS 63 HB1 LYS 63 -13.794 -15.023 15.554 511 HG2 LYS 63 HG2 LYS 63 -12.345 -16.523 16.790 512 HG3 LYS 63 HG1 LYS 63 -11.877 -15.205 17.866 513 HD2 LYS 63 HD2 LYS 63 -14.298 -14.974 18.481 514 HD3 LYS 63 HD1 LYS 63 -14.604 -16.455 17.573 515 HE2 LYS 63 HE2 LYS 63 -13.129 -17.696 19.020 516 HE3 LYS 63 HE1 LYS 63 -12.660 -16.220 19.859 517 HZ1 LYS 63 HZ1 LYS 63 -14.877 -15.989 20.701 518 HZ2 LYS 63 HZ2 LYS 63 -14.305 -17.532 21.083 519 HZ3 LYS 63 HZ3 LYS 63 -15.408 -17.332 19.821 520 H GLU 64 HN GLU 64 -11.440 -11.926 16.315 521 HA GLU 64 HA GLU 64 -9.902 -10.910 17.624 522 HB2 GLU 64 HB2 GLU 64 -9.277 -13.730 18.521 523 HB3 GLU 64 HB1 GLU 64 -8.712 -12.266 19.315 524 HG2 GLU 64 HG2 GLU 64 -11.006 -11.633 19.814 525 HG3 GLU 64 HG1 GLU 64 -11.593 -13.075 18.986 526 H SER 65 HN SER 65 -9.205 -11.992 14.912 527 HA SER 65 HA SER 65 -6.365 -12.504 15.081 528 HB2 SER 65 HB2 SER 65 -8.129 -12.074 12.656 529 HB3 SER 65 HB1 SER 65 -6.460 -12.642 12.627 530 HG SER 65 HG SER 65 -8.791 -13.985 13.290 531 H THR 66 HN THR 66 -4.739 -11.147 14.431 532 HA THR 66 HA THR 66 -5.403 -8.314 14.432 533 HB THR 66 HB THR 66 -2.570 -8.997 14.292 534 HG1 THR 66 HG1 THR 66 -2.494 -10.063 16.283 535 HG21 THR 66 HG21 THR 66 -3.507 -6.807 14.993 536 HG22 THR 66 HG22 THR 66 -2.458 -7.519 16.218 537 HG23 THR 66 HG23 THR 66 -4.209 -7.589 16.408 538 H LEU 67 HN LEU 67 -5.518 -7.211 12.609 539 HA LEU 67 HA LEU 67 -4.232 -8.286 10.191 540 HB2 LEU 67 HB2 LEU 67 -6.644 -6.579 10.665 541 HB3 LEU 67 HB1 LEU 67 -5.782 -6.418 9.149 542 HG LEU 67 HG LEU 67 -6.085 -8.969 8.931 543 HD11 LEU 67 HD11 LEU 67 -7.994 -9.904 10.087 544 HD12 LEU 67 HD12 LEU 67 -8.248 -8.386 10.947 545 HD13 LEU 67 HD13 LEU 67 -6.797 -9.341 11.254 546 HD21 LEU 67 HD21 LEU 67 -8.472 -7.132 8.775 547 HD22 LEU 67 HD22 LEU 67 -8.294 -8.673 7.935 548 HD23 LEU 67 HD23 LEU 67 -7.229 -7.324 7.537 549 H HIS 68 HN HIS 68 -3.046 -6.840 8.822 550 HA HIS 68 HA HIS 68 -1.978 -4.520 10.291 551 HB2 HIS 68 HB2 HIS 68 -0.652 -6.067 8.050 552 HB3 HIS 68 HB1 HIS 68 0.080 -4.816 9.048 553 HD2 HIS 68 HD2 HIS 68 -0.123 -5.721 11.964 554 HE1 HIS 68 HE1 HIS 68 0.845 -9.633 10.683 555 HE2 HIS 68 HE2 HIS 68 0.906 -8.009 12.622 556 H LEU 69 HN LEU 69 -2.445 -2.564 9.494 557 HA LEU 69 HA LEU 69 -3.362 -2.420 6.704 558 HB2 LEU 69 HB2 LEU 69 -5.060 -1.739 8.276 559 HB3 LEU 69 HB1 LEU 69 -3.948 -0.628 9.051 560 HG LEU 69 HG LEU 69 -3.900 0.762 7.033 561 HD11 LEU 69 HD11 LEU 69 -5.517 0.319 5.219 562 HD12 LEU 69 HD12 LEU 69 -5.874 -1.245 5.952 563 HD13 LEU 69 HD13 LEU 69 -4.258 -0.909 5.332 564 HD21 LEU 69 HD21 LEU 69 -6.205 1.591 7.146 565 HD22 LEU 69 HD22 LEU 69 -5.542 1.263 8.746 566 HD23 LEU 69 HD23 LEU 69 -6.680 0.132 8.014 567 H VAL 70 HN VAL 70 -1.841 -1.772 5.375 568 HA VAL 70 HA VAL 70 0.176 0.145 6.296 569 HB VAL 70 HB VAL 70 0.085 -1.562 3.800 570 HG11 VAL 70 HG11 VAL 70 2.232 0.299 4.817 571 HG12 VAL 70 HG12 VAL 70 1.286 0.486 3.341 572 HG13 VAL 70 HG13 VAL 70 2.436 -0.843 3.490 573 HG21 VAL 70 HG21 VAL 70 0.456 -2.899 5.772 574 HG22 VAL 70 HG22 VAL 70 1.714 -1.795 6.326 575 HG23 VAL 70 HG23 VAL 70 1.965 -2.759 4.870 576 H LEU 71 HN LEU 71 0.122 2.188 5.661 577 HA LEU 71 HA LEU 71 -1.858 2.993 3.657 578 HB2 LEU 71 HB2 LEU 71 -0.279 4.756 5.532 579 HB3 LEU 71 HB1 LEU 71 -1.686 5.207 4.586 580 HG LEU 71 HG LEU 71 -1.679 3.261 6.897 581 HD11 LEU 71 HD11 LEU 71 -2.710 6.086 6.699 582 HD12 LEU 71 HD12 LEU 71 -1.320 5.542 7.639 583 HD13 LEU 71 HD13 LEU 71 -2.942 5.000 8.068 584 HD21 LEU 71 HD21 LEU 71 -3.976 4.369 5.289 585 HD22 LEU 71 HD22 LEU 71 -4.096 3.307 6.692 586 HD23 LEU 71 HD23 LEU 71 -3.360 2.717 5.205 587 H ARG 72 HN ARG 72 -1.249 3.701 1.696 588 HA ARG 72 HA ARG 72 1.625 4.231 1.296 589 HB2 ARG 72 HB2 ARG 72 1.435 3.386 -0.934 590 HB3 ARG 72 HB1 ARG 72 0.715 2.206 0.150 591 HG2 ARG 72 HG2 ARG 72 -1.521 3.116 -0.439 592 HG3 ARG 72 HG1 ARG 72 -0.736 4.151 -1.634 593 HD2 ARG 72 HD2 ARG 72 -1.122 1.198 -1.622 594 HD3 ARG 72 HD1 ARG 72 -1.328 2.357 -2.936 595 HE ARG 72 HE ARG 72 1.380 1.801 -1.951 596 HH11 ARG 72 HH11 ARG 72 -1.014 1.440 -4.484 597 HH12 ARG 72 HH12 ARG 72 0.144 0.974 -5.684 598 HH21 ARG 72 HH21 ARG 72 2.913 1.255 -3.522 599 HH22 ARG 72 HH22 ARG 72 2.389 0.872 -5.143 600 H LEU 73 HN LEU 73 1.984 5.603 -0.756 601 HA LEU 73 HA LEU 73 0.060 7.832 -0.770 602 HB2 LEU 73 HB2 LEU 73 3.075 8.009 -0.871 603 HB3 LEU 73 HB1 LEU 73 1.980 9.366 -1.039 604 HG LEU 73 HG LEU 73 1.154 8.488 1.346 605 HD11 LEU 73 HD11 LEU 73 2.724 6.601 1.377 606 HD12 LEU 73 HD12 LEU 73 3.040 7.743 2.684 607 HD13 LEU 73 HD13 LEU 73 4.070 7.733 1.254 608 HD21 LEU 73 HD21 LEU 73 1.901 10.740 0.874 609 HD22 LEU 73 HD22 LEU 73 3.580 10.203 0.834 610 HD23 LEU 73 HD23 LEU 73 2.673 10.148 2.345 611 H ARG 74 HN ARG 74 0.796 9.368 -2.702 612 HA ARG 74 HA ARG 74 0.843 7.657 -5.090 613 HB2 ARG 74 HB2 ARG 74 -0.218 10.425 -4.566 614 HB3 ARG 74 HB1 ARG 74 0.063 9.855 -6.203 615 HG2 ARG 74 HG2 ARG 74 -1.578 8.191 -4.359 616 HG3 ARG 74 HG1 ARG 74 -2.288 9.631 -5.089 617 HD2 ARG 74 HD2 ARG 74 -2.810 8.192 -6.747 618 HD3 ARG 74 HD1 ARG 74 -1.161 8.528 -7.259 619 HE ARG 74 HE ARG 74 -1.947 6.160 -5.684 620 HH11 ARG 74 HH11 ARG 74 0.070 7.717 -8.095 621 HH12 ARG 74 HH12 ARG 74 0.874 6.250 -8.545 622 HH21 ARG 74 HH21 ARG 74 -0.886 4.241 -6.266 623 HH22 ARG 74 HH22 ARG 74 0.331 4.265 -7.505 624 H GLY 75 HN GLY 75 2.407 10.353 -3.507 625 HA2 GLY 75 HA2 GLY 75 4.803 9.918 -5.062 626 HA3 GLY 75 HA1 GLY 75 4.023 11.468 -5.361 627 H GLY 76 HN GLY 76 6.631 11.047 -4.221 628 HA2 GLY 76 HA2 GLY 76 7.005 12.937 -2.429 629 HA3 GLY 76 HA1 GLY 76 6.286 11.707 -1.397 630 H1 SER 453 HT1 SER 453 21.796 9.574 16.968 631 H2 SER 453 HT2 SER 453 21.538 11.130 17.571 632 H3 SER 453 HT3 SER 453 20.715 10.614 16.191 633 HA SER 453 HA SER 453 20.380 9.610 18.948 634 HB2 SER 453 HB2 SER 453 18.005 10.402 18.529 635 HB3 SER 453 HB1 SER 453 19.213 11.678 18.677 636 HG SER 453 HG SER 453 18.657 12.298 16.756 637 H ASN 454 HN ASN 454 18.646 9.492 15.836 638 HA ASN 454 HA ASN 454 17.804 7.793 14.591 639 HB2 ASN 454 HB2 ASN 454 19.949 6.391 16.086 640 HB3 ASN 454 HB1 ASN 454 18.694 5.377 15.383 641 HD21 ASN 454 HD21 ASN 454 20.217 4.475 13.970 642 HD22 ASN 454 HD22 ASN 454 20.785 5.339 12.586 643 H SER 455 HN SER 455 17.102 8.405 17.634 644 HA SER 455 HA SER 455 15.704 6.199 18.622 645 HB2 SER 455 HB2 SER 455 14.769 8.991 19.163 646 HB3 SER 455 HB1 SER 455 14.971 7.639 20.280 647 HG SER 455 HG SER 455 17.154 7.951 20.278 648 H GLN 456 HN GLN 456 14.551 8.986 16.738 649 HA GLN 456 HA GLN 456 11.847 8.191 16.646 650 HB2 GLN 456 HB2 GLN 456 13.416 9.928 14.737 651 HB3 GLN 456 HB1 GLN 456 11.662 9.805 14.777 652 HG2 GLN 456 HG2 GLN 456 13.367 10.774 17.061 653 HG3 GLN 456 HG1 GLN 456 12.536 11.819 15.911 654 HE21 GLN 456 HE21 GLN 456 12.248 11.530 18.829 655 HE22 GLN 456 HE22 GLN 456 10.575 11.182 19.094 656 H LEU 457 HN LEU 457 14.562 7.621 14.469 657 HA LEU 457 HA LEU 457 13.071 6.344 12.430 658 HB2 LEU 457 HB2 LEU 457 15.989 5.940 13.088 659 HB3 LEU 457 HB1 LEU 457 15.205 5.627 11.551 660 HG LEU 457 HG LEU 457 15.564 8.352 12.800 661 HD11 LEU 457 HD11 LEU 457 17.149 8.713 10.950 662 HD12 LEU 457 HD12 LEU 457 16.985 7.013 10.510 663 HD13 LEU 457 HD13 LEU 457 17.677 7.457 12.068 664 HD21 LEU 457 HD21 LEU 457 13.554 8.239 11.443 665 HD22 LEU 457 HD22 LEU 457 14.470 7.534 10.110 666 HD23 LEU 457 HD23 LEU 457 14.795 9.189 10.627 667 H ASN 458 HN ASN 458 14.835 5.160 15.245 668 HA ASN 458 HA ASN 458 14.548 2.405 14.688 669 HB2 ASN 458 HB2 ASN 458 16.128 3.498 16.373 670 HB3 ASN 458 HB1 ASN 458 14.741 3.584 17.458 671 HD21 ASN 458 HD21 ASN 458 15.525 2.180 18.966 672 HD22 ASN 458 HD22 ASN 458 15.749 0.491 18.667 673 H ALA 459 HN ALA 459 12.629 4.651 16.639 674 HA ALA 459 HA ALA 459 10.772 2.778 17.618 675 HB1 ALA 459 HB1 ALA 459 11.067 5.026 18.568 676 HB2 ALA 459 HB2 ALA 459 9.382 4.701 18.164 677 HB3 ALA 459 HB3 ALA 459 10.360 5.727 17.113 678 H MET 460 HN MET 460 10.832 4.735 14.674 679 HA MET 460 HA MET 460 8.215 4.044 13.817 680 HB2 MET 460 HB2 MET 460 10.587 5.345 12.571 681 HB3 MET 460 HB1 MET 460 9.342 4.712 11.504 682 HG2 MET 460 HG2 MET 460 7.670 6.051 12.782 683 HG3 MET 460 HG1 MET 460 9.012 6.787 13.654 684 HE1 MET 460 HE1 MET 460 10.818 8.900 11.012 685 HE2 MET 460 HE2 MET 460 11.240 7.377 11.797 686 HE3 MET 460 HE3 MET 460 10.511 8.682 12.734 687 H ALA 461 HN ALA 461 11.440 2.761 13.080 688 HA ALA 461 HA ALA 461 10.626 0.864 11.166 689 HB1 ALA 461 HB1 ALA 461 12.999 0.766 13.027 690 HB2 ALA 461 HB2 ALA 461 12.957 1.541 11.443 691 HB3 ALA 461 HB3 ALA 461 12.782 -0.209 11.574 692 H HIS 462 HN HIS 462 10.873 0.750 14.664 693 HA HIS 462 HA HIS 462 10.507 -1.971 15.109 694 HB2 HIS 462 HB2 HIS 462 11.099 -0.186 16.802 695 HB3 HIS 462 HB1 HIS 462 9.396 0.247 16.834 696 HD2 HIS 462 HD2 HIS 462 7.689 -1.717 17.960 697 HE1 HIS 462 HE1 HIS 462 10.887 -3.789 19.790 698 HE2 HIS 462 HE2 HIS 462 8.373 -3.654 19.538 699 H GLN 463 HN GLN 463 8.124 0.600 14.641 700 HA GLN 463 HA GLN 463 5.811 -0.896 15.161 701 HB2 GLN 463 HB2 GLN 463 6.172 1.435 13.268 702 HB3 GLN 463 HB1 GLN 463 4.624 0.829 13.838 703 HG2 GLN 463 HG2 GLN 463 6.777 1.922 15.629 704 HG3 GLN 463 HG1 GLN 463 5.426 2.866 15.000 705 HE21 GLN 463 HE21 GLN 463 3.340 2.405 15.717 706 HE22 GLN 463 HE22 GLN 463 3.051 1.549 17.195 707 H ILE 464 HN ILE 464 7.674 -0.435 12.212 708 HA ILE 464 HA ILE 464 5.864 -1.816 10.508 709 HB ILE 464 HB ILE 464 8.823 -1.342 10.102 710 HG12 ILE 464 HG12 ILE 464 6.475 0.323 9.161 711 HG13 ILE 464 HG11 ILE 464 7.499 0.732 10.532 712 HG21 ILE 464 HG21 ILE 464 8.287 -1.567 7.714 713 HG22 ILE 464 HG22 ILE 464 6.620 -1.960 8.134 714 HG23 ILE 464 HG23 ILE 464 7.926 -3.042 8.612 715 HD11 ILE 464 HD11 ILE 464 8.105 1.971 8.519 716 HD12 ILE 464 HD12 ILE 464 8.434 0.452 7.688 717 HD13 ILE 464 HD13 ILE 464 9.419 0.934 9.070 718 H GLN 465 HN GLN 465 8.797 -2.763 12.256 719 HA GLN 465 HA GLN 465 9.072 -5.354 11.234 720 HB2 GLN 465 HB2 GLN 465 10.692 -4.035 12.717 721 HB3 GLN 465 HB1 GLN 465 9.723 -4.586 14.077 722 HG2 GLN 465 HG2 GLN 465 11.617 -6.025 13.837 723 HG3 GLN 465 HG1 GLN 465 10.165 -6.921 13.394 724 HE21 GLN 465 HE21 GLN 465 11.248 -8.388 12.132 725 HE22 GLN 465 HE22 GLN 465 11.942 -7.979 10.599 726 H GLU 466 HN GLU 466 7.011 -4.071 13.735 727 HA GLU 466 HA GLU 466 6.185 -6.541 14.853 728 HB2 GLU 466 HB2 GLU 466 5.007 -3.769 14.867 729 HB3 GLU 466 HB1 GLU 466 4.218 -5.119 15.670 730 HG2 GLU 466 HG2 GLU 466 7.022 -4.200 16.251 731 HG3 GLU 466 HG1 GLU 466 5.597 -3.715 17.170 732 H MET 467 HN MET 467 5.254 -4.794 12.015 733 HA MET 467 HA MET 467 2.839 -6.418 11.694 734 HB2 MET 467 HB2 MET 467 3.813 -4.117 9.988 735 HB3 MET 467 HB1 MET 467 2.251 -4.913 9.872 736 HG2 MET 467 HG2 MET 467 2.336 -4.135 12.501 737 HG3 MET 467 HG1 MET 467 3.151 -2.811 11.675 738 HE1 MET 467 HE1 MET 467 1.607 -3.075 8.795 739 HE2 MET 467 HE2 MET 467 2.007 -1.529 9.546 740 HE3 MET 467 HE3 MET 467 0.358 -1.846 9.011 741 H PHE 468 HN PHE 468 5.961 -5.785 10.194 742 HA PHE 468 HA PHE 468 5.436 -7.984 8.303 743 HB2 PHE 468 HB2 PHE 468 6.747 -5.373 8.010 744 HB3 PHE 468 HB1 PHE 468 7.659 -6.712 7.326 745 HD1 PHE 468 HD1 PHE 468 4.448 -4.907 7.202 746 HD2 PHE 468 HD2 PHE 468 6.968 -7.787 5.344 747 HE1 PHE 468 HE1 PHE 468 3.021 -4.858 5.198 748 HE2 PHE 468 HE2 PHE 468 5.548 -7.741 3.337 749 HZ PHE 468 HZ PHE 468 3.577 -6.280 3.259 750 HA PRO 469 HA PRO 469 8.730 -9.740 10.891 751 HB2 PRO 469 HB2 PRO 469 7.733 -12.228 11.035 752 HB3 PRO 469 HB1 PRO 469 7.039 -10.906 11.992 753 HG2 PRO 469 HG2 PRO 469 6.004 -12.197 9.537 754 HG3 PRO 469 HG1 PRO 469 5.126 -11.526 10.924 755 HD2 PRO 469 HD2 PRO 469 5.537 -10.253 8.460 756 HD3 PRO 469 HD1 PRO 469 4.971 -9.490 9.958 757 H GLN 470 HN GLN 470 7.938 -9.998 7.704 758 HA GLN 470 HA GLN 470 9.765 -12.212 7.133 759 HB2 GLN 470 HB2 GLN 470 8.850 -12.220 4.901 760 HB3 GLN 470 HB1 GLN 470 7.530 -12.217 6.062 761 HG2 GLN 470 HG2 GLN 470 7.021 -9.959 5.629 762 HG3 GLN 470 HG1 GLN 470 8.538 -9.701 4.768 763 HE21 GLN 470 HE21 GLN 470 7.655 -9.032 2.861 764 HE22 GLN 470 HE22 GLN 470 6.741 -10.069 1.822 765 H VAL 471 HN VAL 471 10.338 -9.221 7.837 766 HA VAL 471 HA VAL 471 12.372 -8.910 5.743 767 HB VAL 471 HB VAL 471 10.554 -7.342 5.249 768 HG11 VAL 471 HG11 VAL 471 9.971 -5.528 6.744 769 HG12 VAL 471 HG12 VAL 471 11.114 -6.124 7.947 770 HG13 VAL 471 HG13 VAL 471 9.692 -7.081 7.535 771 HG21 VAL 471 HG21 VAL 471 12.807 -6.679 4.664 772 HG22 VAL 471 HG22 VAL 471 13.050 -5.996 6.273 773 HG23 VAL 471 HG23 VAL 471 11.877 -5.271 5.174 774 HA PRO 472 HA PRO 472 15.071 -8.643 9.289 775 HB2 PRO 472 HB2 PRO 472 16.943 -7.278 7.453 776 HB3 PRO 472 HB1 PRO 472 17.144 -8.797 8.347 777 HG2 PRO 472 HG2 PRO 472 16.814 -8.783 5.709 778 HG3 PRO 472 HG1 PRO 472 16.119 -10.055 6.733 779 HD2 PRO 472 HD2 PRO 472 14.764 -7.696 5.492 780 HD3 PRO 472 HD1 PRO 472 14.196 -9.371 5.662 781 H TYR 473 HN TYR 473 15.341 -7.174 10.834 782 HA TYR 473 HA TYR 473 14.169 -4.665 10.785 783 HB2 TYR 473 HB2 TYR 473 14.859 -6.169 12.756 784 HB3 TYR 473 HB1 TYR 473 16.426 -5.382 12.635 785 HD1 TYR 473 HD2 TYR 473 12.920 -4.096 12.433 786 HD2 TYR 473 HD1 TYR 473 16.690 -3.925 14.390 787 HE1 TYR 473 HE2 TYR 473 12.088 -2.275 13.864 788 HE2 TYR 473 HE1 TYR 473 15.872 -2.112 15.829 789 HH TYR 473 HH TYR 473 14.122 -0.346 15.760 790 H HIS 474 HN HIS 474 17.554 -5.541 10.196 791 HA HIS 474 HA HIS 474 18.547 -2.892 10.258 792 HB2 HIS 474 HB2 HIS 474 20.600 -3.749 9.521 793 HB3 HIS 474 HB1 HIS 474 19.883 -5.071 10.427 794 HD2 HIS 474 HD2 HIS 474 21.568 -4.468 7.144 795 HE1 HIS 474 HE1 HIS 474 19.324 -8.024 6.683 796 HE2 HIS 474 HE2 HIS 474 21.277 -6.670 5.805 797 H LEU 475 HN LEU 475 16.924 -4.727 7.801 798 HA LEU 475 HA LEU 475 17.713 -2.971 5.659 799 HB2 LEU 475 HB2 LEU 475 15.758 -5.234 5.890 800 HB3 LEU 475 HB1 LEU 475 15.767 -4.203 4.473 801 HG LEU 475 HG LEU 475 18.026 -5.946 5.447 802 HD11 LEU 475 HD11 LEU 475 16.292 -7.189 4.332 803 HD12 LEU 475 HD12 LEU 475 17.699 -7.066 3.277 804 HD13 LEU 475 HD13 LEU 475 16.287 -6.046 2.991 805 HD21 LEU 475 HD21 LEU 475 19.069 -4.012 4.585 806 HD22 LEU 475 HD22 LEU 475 17.925 -3.898 3.248 807 HD23 LEU 475 HD23 LEU 475 19.109 -5.205 3.286 808 H VAL 476 HN VAL 476 15.022 -3.295 7.873 809 HA VAL 476 HA VAL 476 13.273 -1.456 6.615 810 HB VAL 476 HB VAL 476 13.454 -2.039 9.581 811 HG11 VAL 476 HG11 VAL 476 11.087 -1.453 9.606 812 HG12 VAL 476 HG12 VAL 476 11.145 -1.110 7.877 813 HG13 VAL 476 HG13 VAL 476 12.066 -0.115 9.006 814 HG21 VAL 476 HG21 VAL 476 11.905 -3.512 7.450 815 HG22 VAL 476 HG22 VAL 476 11.779 -3.787 9.188 816 HG23 VAL 476 HG23 VAL 476 13.291 -4.130 8.346 817 H LEU 477 HN LEU 477 15.723 -1.132 9.143 818 HA LEU 477 HA LEU 477 15.377 1.602 9.675 819 HB2 LEU 477 HB2 LEU 477 17.609 -0.345 10.054 820 HB3 LEU 477 HB1 LEU 477 17.920 1.361 10.305 821 HG LEU 477 HG LEU 477 15.721 -0.125 11.737 822 HD11 LEU 477 HD11 LEU 477 17.224 -0.232 13.656 823 HD12 LEU 477 HD12 LEU 477 18.527 0.450 12.682 824 HD13 LEU 477 HD13 LEU 477 17.874 -1.141 12.291 825 HD21 LEU 477 HD21 LEU 477 15.384 2.247 11.699 826 HD22 LEU 477 HD22 LEU 477 17.062 2.540 12.155 827 HD23 LEU 477 HD23 LEU 477 15.956 1.794 13.305 828 H GLN 478 HN GLN 478 17.057 -0.068 7.125 829 HA GLN 478 HA GLN 478 18.762 1.964 6.234 830 HB2 GLN 478 HB2 GLN 478 19.003 -0.291 5.408 831 HB3 GLN 478 HB1 GLN 478 17.386 -0.254 4.713 832 HG2 GLN 478 HG2 GLN 478 18.268 1.695 3.291 833 HG3 GLN 478 HG1 GLN 478 19.867 1.147 3.791 834 HE21 GLN 478 HE21 GLN 478 17.136 -0.974 3.221 835 HE22 GLN 478 HE22 GLN 478 17.787 -1.746 1.819 836 H ASP 479 HN ASP 479 15.489 1.102 5.086 837 HA ASP 479 HA ASP 479 15.295 3.345 3.342 838 HB2 ASP 479 HB2 ASP 479 13.969 1.229 3.092 839 HB3 ASP 479 HB1 ASP 479 13.026 1.709 4.499 840 H LEU 480 HN LEU 480 14.334 2.694 6.652 841 HA LEU 480 HA LEU 480 12.716 4.903 7.147 842 HB2 LEU 480 HB2 LEU 480 13.837 2.824 8.639 843 HB3 LEU 480 HB1 LEU 480 14.450 4.278 9.395 844 HG LEU 480 HG LEU 480 12.475 3.622 10.559 845 HD11 LEU 480 HD11 LEU 480 11.053 5.565 10.290 846 HD12 LEU 480 HD12 LEU 480 11.785 5.905 8.721 847 HD13 LEU 480 HD13 LEU 480 12.753 6.022 10.190 848 HD21 LEU 480 HD21 LEU 480 11.513 2.202 8.828 849 HD22 LEU 480 HD22 LEU 480 11.078 3.629 7.891 850 HD23 LEU 480 HD23 LEU 480 10.323 3.339 9.458 851 H GLN 481 HN GLN 481 16.212 4.625 7.036 852 HA GLN 481 HA GLN 481 16.699 7.241 8.114 853 HB2 GLN 481 HB2 GLN 481 18.453 5.239 6.700 854 HB3 GLN 481 HB1 GLN 481 19.044 6.800 7.249 855 HG2 GLN 481 HG2 GLN 481 18.644 6.242 9.523 856 HG3 GLN 481 HG1 GLN 481 17.766 4.783 9.068 857 HE21 GLN 481 HE21 GLN 481 19.136 3.478 10.286 858 HE22 GLN 481 HE22 GLN 481 20.756 3.128 9.799 859 H LEU 482 HN LEU 482 15.799 6.044 5.063 860 HA LEU 482 HA LEU 482 16.941 8.323 3.631 861 HB2 LEU 482 HB2 LEU 482 16.017 5.631 2.891 862 HB3 LEU 482 HB1 LEU 482 15.595 6.889 1.746 863 HG LEU 482 HG LEU 482 17.681 5.810 1.107 864 HD11 LEU 482 HD11 LEU 482 19.064 7.770 0.841 865 HD12 LEU 482 HD12 LEU 482 18.185 8.604 2.119 866 HD13 LEU 482 HD13 LEU 482 17.370 8.197 0.610 867 HD21 LEU 482 HD21 LEU 482 18.462 5.057 3.268 868 HD22 LEU 482 HD22 LEU 482 18.696 6.725 3.797 869 HD23 LEU 482 HD23 LEU 482 19.695 6.061 2.504 870 H THR 483 HN THR 483 13.780 6.659 3.707 871 HA THR 483 HA THR 483 12.445 8.964 2.634 872 HB THR 483 HB THR 483 10.371 7.641 3.014 873 HG1 THR 483 HG1 THR 483 11.553 5.270 3.570 874 HG21 THR 483 HG21 THR 483 10.922 5.833 1.422 875 HG22 THR 483 HG22 THR 483 12.636 6.181 1.647 876 HG23 THR 483 HG23 THR 483 11.579 7.392 0.922 877 H ARG 484 HN ARG 484 12.637 7.372 5.776 878 HA ARG 484 HA ARG 484 12.220 8.052 7.893 879 HB2 ARG 484 HB2 ARG 484 12.259 10.786 6.608 880 HB3 ARG 484 HB1 ARG 484 12.118 10.534 8.344 881 HG2 ARG 484 HG2 ARG 484 14.288 9.883 8.567 882 HG3 ARG 484 HG1 ARG 484 14.363 9.199 6.944 883 HD2 ARG 484 HD2 ARG 484 14.255 11.584 6.091 884 HD3 ARG 484 HD1 ARG 484 14.551 12.088 7.754 885 HE ARG 484 HE ARG 484 16.474 10.176 6.939 886 HH11 ARG 484 HH11 ARG 484 15.600 13.537 6.482 887 HH12 ARG 484 HH12 ARG 484 17.221 14.037 6.121 888 HH21 ARG 484 HH21 ARG 484 18.616 10.840 6.506 889 HH22 ARG 484 HH22 ARG 484 18.938 12.508 6.150 890 H SER 485 HN SER 485 10.144 7.175 6.227 891 HA SER 485 HA SER 485 7.863 8.215 7.694 892 HB2 SER 485 HB2 SER 485 7.546 9.616 5.858 893 HB3 SER 485 HB1 SER 485 8.234 8.457 4.724 894 HG SER 485 HG SER 485 5.752 8.074 6.071 895 H VAL 486 HN VAL 486 6.841 6.491 8.472 896 HA VAL 486 HA VAL 486 7.487 3.856 7.788 897 HB VAL 486 HB VAL 486 5.422 3.220 9.092 898 HG11 VAL 486 HG11 VAL 486 7.373 5.118 10.392 899 HG12 VAL 486 HG12 VAL 486 7.611 3.389 10.140 900 HG13 VAL 486 HG13 VAL 486 6.355 3.955 11.240 901 HG21 VAL 486 HG21 VAL 486 4.061 5.185 8.645 902 HG22 VAL 486 HG22 VAL 486 5.232 6.208 9.473 903 HG23 VAL 486 HG23 VAL 486 4.317 5.004 10.380 904 H GLU 487 HN GLU 487 4.936 5.969 6.632 905 HA GLU 487 HA GLU 487 3.343 4.018 5.374 906 HB2 GLU 487 HB2 GLU 487 3.714 6.821 4.343 907 HB3 GLU 487 HB1 GLU 487 2.281 5.809 4.240 908 HG2 GLU 487 HG2 GLU 487 1.580 7.093 5.945 909 HG3 GLU 487 HG1 GLU 487 2.545 5.978 6.912 910 H ILE 488 HN ILE 488 6.009 6.012 4.139 911 HA ILE 488 HA ILE 488 5.909 4.888 1.518 912 HB ILE 488 HB ILE 488 8.216 6.357 2.800 913 HG12 ILE 488 HG12 ILE 488 5.991 7.471 1.082 914 HG13 ILE 488 HG11 ILE 488 6.069 7.645 2.828 915 HG21 ILE 488 HG21 ILE 488 7.510 5.948 -0.102 916 HG22 ILE 488 HG22 ILE 488 8.789 5.102 0.769 917 HG23 ILE 488 HG23 ILE 488 8.897 6.844 0.519 918 HD11 ILE 488 HD11 ILE 488 8.179 8.664 0.949 919 HD12 ILE 488 HD12 ILE 488 8.033 8.987 2.677 920 HD13 ILE 488 HD13 ILE 488 6.835 9.631 1.553 921 H THR 489 HN THR 489 7.983 4.350 4.348 922 HA THR 489 HA THR 489 9.824 2.608 3.227 923 HB THR 489 HB THR 489 8.740 2.616 6.046 924 HG1 THR 489 HG1 THR 489 10.925 3.903 4.745 925 HG21 THR 489 HG21 THR 489 9.814 0.517 5.734 926 HG22 THR 489 HG22 THR 489 10.974 1.555 6.563 927 HG23 THR 489 HG23 THR 489 11.139 1.253 4.833 928 H THR 490 HN THR 490 6.796 1.718 4.914 929 HA THR 490 HA THR 490 7.112 -1.050 4.564 930 HB THR 490 HB THR 490 4.402 0.244 4.709 931 HG1 THR 490 HG1 THR 490 5.449 1.296 6.344 932 HG21 THR 490 HG21 THR 490 4.513 -2.194 4.509 933 HG22 THR 490 HG22 THR 490 3.916 -1.717 6.098 934 HG23 THR 490 HG23 THR 490 5.582 -2.264 5.909 935 H ASP 491 HN ASP 491 5.486 1.371 2.524 936 HA ASP 491 HA ASP 491 4.446 -0.559 0.701 937 HB2 ASP 491 HB2 ASP 491 3.696 1.900 1.044 938 HB3 ASP 491 HB1 ASP 491 5.011 2.291 -0.061 939 H ASN 492 HN ASN 492 7.387 1.341 0.893 940 HA ASN 492 HA ASN 492 8.454 0.893 -1.638 941 HB2 ASN 492 HB2 ASN 492 9.449 1.745 0.966 942 HB3 ASN 492 HB1 ASN 492 10.651 0.819 0.075 943 HD21 ASN 492 HD21 ASN 492 11.653 3.055 0.319 944 HD22 ASN 492 HD22 ASN 492 11.355 4.160 -0.987 945 H ILE 493 HN ILE 493 8.762 -1.054 1.313 946 HA ILE 493 HA ILE 493 10.385 -3.068 0.174 947 HB ILE 493 HB ILE 493 8.457 -3.384 2.485 948 HG12 ILE 493 HG12 ILE 493 11.383 -2.636 2.626 949 HG13 ILE 493 HG11 ILE 493 10.081 -1.451 2.697 950 HG21 ILE 493 HG21 ILE 493 9.960 -5.169 3.201 951 HG22 ILE 493 HG22 ILE 493 10.976 -4.896 1.787 952 HG23 ILE 493 HG23 ILE 493 9.326 -5.490 1.586 953 HD11 ILE 493 HD11 ILE 493 10.508 -3.711 4.639 954 HD12 ILE 493 HD12 ILE 493 9.232 -2.496 4.721 955 HD13 ILE 493 HD13 ILE 493 10.919 -2.018 4.912 956 H LEU 494 HN LEU 494 6.899 -2.679 0.496 957 HA LEU 494 HA LEU 494 6.103 -5.213 -0.422 958 HB2 LEU 494 HB2 LEU 494 4.893 -2.685 0.221 959 HB3 LEU 494 HB1 LEU 494 4.170 -3.341 -1.234 960 HG LEU 494 HG LEU 494 4.411 -5.332 0.884 961 HD11 LEU 494 HD11 LEU 494 2.418 -4.264 2.110 962 HD12 LEU 494 HD12 LEU 494 3.002 -2.748 1.423 963 HD13 LEU 494 HD13 LEU 494 4.042 -3.694 2.484 964 HD21 LEU 494 HD21 LEU 494 2.591 -4.504 -1.231 965 HD22 LEU 494 HD22 LEU 494 1.757 -4.975 0.257 966 HD23 LEU 494 HD23 LEU 494 2.866 -6.101 -0.527 967 H GLU 495 HN GLU 495 6.764 -2.194 -2.126 968 HA GLU 495 HA GLU 495 5.941 -3.138 -4.686 969 HB2 GLU 495 HB2 GLU 495 7.517 -0.755 -3.752 970 HB3 GLU 495 HB1 GLU 495 7.306 -1.093 -5.465 971 HG2 GLU 495 HG2 GLU 495 5.109 -0.633 -3.462 972 HG3 GLU 495 HG1 GLU 495 5.665 0.509 -4.687 973 H GLY 496 HN GLY 496 8.819 -3.488 -2.848 974 HA2 GLY 496 HA2 GLY 496 10.399 -5.182 -3.457 975 HA3 GLY 496 HA1 GLY 496 10.049 -4.849 -5.145 976 H ARG 497 HN ARG 497 10.462 -2.125 -3.089 977 HA ARG 497 HA ARG 497 12.718 -1.213 -4.580 978 HB2 ARG 497 HB2 ARG 497 11.168 0.408 -3.673 979 HB3 ARG 497 HB1 ARG 497 11.425 -0.190 -2.042 980 HG2 ARG 497 HG2 ARG 497 12.578 1.898 -2.327 981 HG3 ARG 497 HG1 ARG 497 13.757 0.598 -2.147 982 HD2 ARG 497 HD2 ARG 497 14.494 2.060 -3.894 983 HD3 ARG 497 HD1 ARG 497 13.980 0.539 -4.616 984 HE ARG 497 HE ARG 497 12.043 2.721 -4.535 985 HH11 ARG 497 HH11 ARG 497 14.325 0.826 -6.404 986 HH12 ARG 497 HH12 ARG 497 13.663 1.307 -7.932 987 HH21 ARG 497 HH21 ARG 497 11.166 3.344 -6.556 988 HH22 ARG 497 HH22 ARG 497 11.871 2.735 -8.020 989 H ILE 498 HN ILE 498 12.256 -2.717 -1.449 990 HA ILE 498 HA ILE 498 15.164 -2.723 -1.021 991 HB ILE 498 HB ILE 498 12.880 -3.167 0.912 992 HG12 ILE 498 HG12 ILE 498 14.369 -1.308 2.085 993 HG13 ILE 498 HG11 ILE 498 14.895 -1.014 0.432 994 HG21 ILE 498 HG21 ILE 498 14.658 -4.787 1.389 995 HG22 ILE 498 HG22 ILE 498 14.529 -3.569 2.657 996 HG23 ILE 498 HG23 ILE 498 15.831 -3.471 1.473 997 HD11 ILE 498 HD11 ILE 498 12.071 -0.898 1.460 998 HD12 ILE 498 HD12 ILE 498 12.553 -0.659 -0.219 999 HD13 ILE 498 HD13 ILE 498 13.091 0.472 1.023 1000 H GLN 499 HN GLN 499 16.266 -4.569 -1.158 1001 HA GLN 499 HA GLN 499 15.142 -6.853 -2.333 1002 HB2 GLN 499 HB2 GLN 499 17.792 -6.291 -1.035 1003 HB3 GLN 499 HB1 GLN 499 17.395 -7.899 -1.629 1004 HG2 GLN 499 HG2 GLN 499 17.328 -5.403 -3.306 1005 HG3 GLN 499 HG1 GLN 499 18.682 -6.529 -3.240 1006 HE21 GLN 499 HE21 GLN 499 16.765 -5.697 -5.396 1007 HE22 GLN 499 HE22 GLN 499 16.165 -7.190 -6.032 1008 H VAL 500 HN VAL 500 13.899 -8.322 -1.449 1009 HA VAL 500 HA VAL 500 13.692 -8.619 1.411 1010 HB VAL 500 HB VAL 500 11.925 -10.272 0.888 1011 HG11 VAL 500 HG11 VAL 500 11.349 -7.921 1.095 1012 HG12 VAL 500 HG12 VAL 500 10.345 -8.700 -0.129 1013 HG13 VAL 500 HG13 VAL 500 11.692 -7.671 -0.617 1014 HG21 VAL 500 HG21 VAL 500 12.862 -11.184 -1.172 1015 HG22 VAL 500 HG22 VAL 500 12.580 -9.647 -1.989 1016 HG23 VAL 500 HG23 VAL 500 11.212 -10.610 -1.428 1017 HA PRO 501 HA PRO 501 16.291 -12.120 2.167 1018 HB2 PRO 501 HB2 PRO 501 13.910 -13.632 3.146 1019 HB3 PRO 501 HB1 PRO 501 15.441 -13.273 3.969 1020 HG2 PRO 501 HG2 PRO 501 13.230 -11.999 4.641 1021 HG3 PRO 501 HG1 PRO 501 14.790 -11.154 4.568 1022 HD2 PRO 501 HD2 PRO 501 12.522 -11.091 2.633 1023 HD3 PRO 501 HD1 PRO 501 13.598 -9.780 3.157 1024 H PHE 502 HN PHE 502 17.003 -13.159 0.424 1025 HA PHE 502 HA PHE 502 15.215 -15.098 -0.873 1026 HB2 PHE 502 HB2 PHE 502 15.594 -12.999 -2.233 1027 HB3 PHE 502 HB1 PHE 502 17.296 -13.432 -2.306 1028 HD1 PHE 502 HD1 PHE 502 13.899 -14.534 -3.256 1029 HD2 PHE 502 HD2 PHE 502 18.085 -14.988 -3.871 1030 HE1 PHE 502 HE1 PHE 502 13.454 -15.927 -5.234 1031 HE2 PHE 502 HE2 PHE 502 17.645 -16.376 -5.848 1032 HZ PHE 502 HZ PHE 502 15.328 -16.851 -6.535 1033 HA PRO 503 HA PRO 503 18.417 -17.998 0.173 1034 HB2 PRO 503 HB2 PRO 503 17.835 -19.858 -1.789 1035 HB3 PRO 503 HB1 PRO 503 16.990 -19.737 -0.236 1036 HG2 PRO 503 HG2 PRO 503 16.170 -18.717 -2.907 1037 HG3 PRO 503 HG1 PRO 503 15.190 -19.459 -1.625 1038 HD2 PRO 503 HD2 PRO 503 15.195 -16.806 -2.033 1039 HD3 PRO 503 HD1 PRO 503 15.056 -17.506 -0.406 1040 H THR 504 HN THR 504 20.437 -17.417 -0.317 1041 HA THR 504 HA THR 504 21.532 -18.019 -2.886 1042 HB THR 504 HB THR 504 20.571 -15.789 -3.368 1043 HG1 THR 504 HG1 THR 504 23.379 -16.160 -3.300 1044 HG21 THR 504 HG21 THR 504 21.385 -13.802 -2.255 1045 HG22 THR 504 HG22 THR 504 22.457 -14.767 -1.241 1046 HG23 THR 504 HG23 THR 504 20.708 -14.902 -1.054 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 -18.367 -10.772 14.649 2 H2 MET 1 HT2 MET 1 -18.422 -12.400 14.176 3 H3 MET 1 HT3 MET 1 -17.627 -11.263 13.210 4 HA MET 1 HA MET 1 -16.827 -12.043 15.944 5 HB2 MET 1 HB2 MET 1 -15.009 -13.252 14.984 6 HB3 MET 1 HB1 MET 1 -16.473 -13.801 14.188 7 HG2 MET 1 HG2 MET 1 -15.956 -12.379 12.266 8 HG3 MET 1 HG1 MET 1 -14.481 -11.842 13.070 9 HE1 MET 1 HE1 MET 1 -12.987 -14.089 10.278 10 HE2 MET 1 HE2 MET 1 -13.005 -12.498 11.038 11 HE3 MET 1 HE3 MET 1 -14.407 -13.054 10.123 12 H GLN 2 HN GLN 2 -14.873 -11.097 16.666 13 HA GLN 2 HA GLN 2 -14.485 -8.425 15.564 14 HB2 GLN 2 HB2 GLN 2 -14.003 -9.694 18.218 15 HB3 GLN 2 HB1 GLN 2 -13.068 -8.272 17.779 16 HG2 GLN 2 HG2 GLN 2 -16.071 -8.437 17.830 17 HG3 GLN 2 HG1 GLN 2 -15.060 -7.708 19.076 18 HE21 GLN 2 HE21 GLN 2 -17.140 -6.539 17.368 19 HE22 GLN 2 HE22 GLN 2 -16.386 -5.220 16.546 20 H ILE 3 HN ILE 3 -12.598 -7.611 14.887 21 HA ILE 3 HA ILE 3 -10.236 -9.370 14.836 22 HB ILE 3 HB ILE 3 -9.654 -8.353 12.614 23 HG12 ILE 3 HG12 ILE 3 -12.575 -7.593 12.482 24 HG13 ILE 3 HG11 ILE 3 -11.307 -6.444 12.895 25 HG21 ILE 3 HG21 ILE 3 -11.221 -9.804 11.323 26 HG22 ILE 3 HG22 ILE 3 -12.121 -10.072 12.817 27 HG23 ILE 3 HG23 ILE 3 -10.445 -10.607 12.688 28 HD11 ILE 3 HD11 ILE 3 -11.494 -7.992 10.323 29 HD12 ILE 3 HD12 ILE 3 -10.263 -6.796 10.732 30 HD13 ILE 3 HD13 ILE 3 -11.946 -6.303 10.547 31 H PHE 4 HN PHE 4 -8.198 -8.170 14.661 32 HA PHE 4 HA PHE 4 -8.469 -5.470 15.810 33 HB2 PHE 4 HB2 PHE 4 -6.387 -7.599 16.319 34 HB3 PHE 4 HB1 PHE 4 -6.202 -5.927 16.836 35 HD1 PHE 4 HD2 PHE 4 -8.117 -9.026 17.317 36 HD2 PHE 4 HD1 PHE 4 -7.402 -5.066 18.709 37 HE1 PHE 4 HE2 PHE 4 -9.355 -9.528 19.383 38 HE2 PHE 4 HE1 PHE 4 -8.636 -5.562 20.776 39 HZ PHE 4 HZ PHE 4 -9.615 -7.798 21.114 40 H VAL 5 HN VAL 5 -8.176 -4.112 14.152 41 HA VAL 5 HA VAL 5 -6.142 -4.651 12.143 42 HB VAL 5 HB VAL 5 -7.950 -2.241 12.418 43 HG11 VAL 5 HG11 VAL 5 -7.449 -1.880 10.045 44 HG12 VAL 5 HG12 VAL 5 -6.343 -3.253 10.071 45 HG13 VAL 5 HG13 VAL 5 -5.990 -1.818 11.035 46 HG21 VAL 5 HG21 VAL 5 -9.256 -4.293 12.183 47 HG22 VAL 5 HG22 VAL 5 -8.332 -4.720 10.744 48 HG23 VAL 5 HG23 VAL 5 -9.367 -3.292 10.735 49 H LYS 6 HN LYS 6 -4.131 -3.879 12.253 50 HA LYS 6 HA LYS 6 -3.566 -1.810 14.267 51 HB2 LYS 6 HB2 LYS 6 -1.938 -4.079 13.178 52 HB3 LYS 6 HB1 LYS 6 -1.152 -2.697 13.925 53 HG2 LYS 6 HG2 LYS 6 -2.426 -3.098 15.982 54 HG3 LYS 6 HG1 LYS 6 -3.164 -4.515 15.235 55 HD2 LYS 6 HD2 LYS 6 -0.963 -5.540 14.981 56 HD3 LYS 6 HD1 LYS 6 -0.211 -4.115 15.696 57 HE2 LYS 6 HE2 LYS 6 -0.427 -5.937 17.318 58 HE3 LYS 6 HE1 LYS 6 -1.367 -4.525 17.790 59 HZ1 LYS 6 HZ1 LYS 6 -3.357 -5.611 16.962 60 HZ2 LYS 6 HZ2 LYS 6 -2.604 -6.570 18.129 61 HZ3 LYS 6 HZ3 LYS 6 -2.462 -6.969 16.492 62 H THR 7 HN THR 7 -2.708 0.073 13.679 63 HA THR 7 HA THR 7 -2.091 0.468 10.834 64 HB THR 7 HB THR 7 -2.390 2.932 11.433 65 HG1 THR 7 HG1 THR 7 -3.922 2.019 13.624 66 HG21 THR 7 HG21 THR 7 -4.744 1.050 11.654 67 HG22 THR 7 HG22 THR 7 -4.078 1.742 10.175 68 HG23 THR 7 HG23 THR 7 -4.866 2.784 11.359 69 H LEU 8 HN LEU 8 -0.315 1.912 10.318 70 HA LEU 8 HA LEU 8 2.047 1.324 11.754 71 HB2 LEU 8 HB2 LEU 8 1.561 3.432 9.649 72 HB3 LEU 8 HB1 LEU 8 3.137 2.863 10.178 73 HG LEU 8 HG LEU 8 1.086 1.033 8.941 74 HD11 LEU 8 HD11 LEU 8 3.310 2.534 7.570 75 HD12 LEU 8 HD12 LEU 8 1.582 2.812 7.355 76 HD13 LEU 8 HD13 LEU 8 2.300 1.287 6.838 77 HD21 LEU 8 HD21 LEU 8 2.946 -0.438 8.596 78 HD22 LEU 8 HD22 LEU 8 2.933 0.049 10.289 79 HD23 LEU 8 HD23 LEU 8 4.081 0.783 9.170 80 H THR 9 HN THR 9 -0.318 3.721 12.183 81 HA THR 9 HA THR 9 1.408 5.644 13.464 82 HB THR 9 HB THR 9 -1.377 6.048 14.055 83 HG1 THR 9 HG1 THR 9 -1.680 6.319 11.542 84 HG21 THR 9 HG21 THR 9 0.334 7.813 13.877 85 HG22 THR 9 HG22 THR 9 -1.023 8.110 12.789 86 HG23 THR 9 HG23 THR 9 0.494 7.475 12.153 87 H GLY 10 HN GLY 10 0.090 2.722 14.374 88 HA2 GLY 10 HA2 GLY 10 0.222 1.678 16.444 89 HA3 GLY 10 HA1 GLY 10 0.663 3.219 17.162 90 H LYS 11 HN LYS 11 -2.180 2.317 15.259 91 HA LYS 11 HA LYS 11 -3.863 2.867 17.605 92 HB2 LYS 11 HB2 LYS 11 -3.933 4.816 16.158 93 HB3 LYS 11 HB1 LYS 11 -4.274 3.804 14.761 94 HG2 LYS 11 HG2 LYS 11 -6.423 3.161 15.817 95 HG3 LYS 11 HG1 LYS 11 -6.078 4.305 17.117 96 HD2 LYS 11 HD2 LYS 11 -5.940 6.116 15.437 97 HD3 LYS 11 HD1 LYS 11 -6.396 4.962 14.186 98 HE2 LYS 11 HE2 LYS 11 -8.535 4.601 15.232 99 HE3 LYS 11 HE1 LYS 11 -8.073 5.603 16.604 100 HZ1 LYS 11 HZ1 LYS 11 -7.834 7.470 14.969 101 HZ2 LYS 11 HZ2 LYS 11 -9.414 6.924 15.217 102 HZ3 LYS 11 HZ3 LYS 11 -8.583 6.478 13.814 103 H THR 12 HN THR 12 -4.743 0.952 18.105 104 HA THR 12 HA THR 12 -5.299 -1.017 16.048 105 HB THR 12 HB THR 12 -6.009 -1.280 18.962 106 HG1 THR 12 HG1 THR 12 -3.951 -1.226 19.391 107 HG21 THR 12 HG21 THR 12 -6.846 -3.025 17.476 108 HG22 THR 12 HG22 THR 12 -5.582 -3.662 18.529 109 HG23 THR 12 HG23 THR 12 -5.221 -3.283 16.845 110 H ILE 13 HN ILE 13 -7.215 -1.379 15.137 111 HA ILE 13 HA ILE 13 -9.591 -0.093 16.322 112 HB ILE 13 HB ILE 13 -9.151 -0.610 13.380 113 HG12 ILE 13 HG12 ILE 13 -9.031 2.089 14.717 114 HG13 ILE 13 HG11 ILE 13 -7.587 1.108 14.486 115 HG21 ILE 13 HG21 ILE 13 -11.206 1.059 14.830 116 HG22 ILE 13 HG22 ILE 13 -11.490 -0.514 14.087 117 HG23 ILE 13 HG23 ILE 13 -11.067 0.871 13.081 118 HD11 ILE 13 HD11 ILE 13 -7.901 1.150 12.094 119 HD12 ILE 13 HD12 ILE 13 -7.887 2.795 12.731 120 HD13 ILE 13 HD13 ILE 13 -9.414 2.035 12.283 121 H THR 14 HN THR 14 -11.177 -1.420 16.881 122 HA THR 14 HA THR 14 -11.095 -4.208 16.002 123 HB THR 14 HB THR 14 -13.222 -3.858 17.806 124 HG1 THR 14 HG1 THR 14 -10.933 -2.660 18.958 125 HG21 THR 14 HG21 THR 14 -11.770 -5.798 17.756 126 HG22 THR 14 HG22 THR 14 -11.739 -5.088 19.370 127 HG23 THR 14 HG23 THR 14 -10.394 -4.817 18.263 128 H LEU 15 HN LEU 15 -12.376 -4.837 14.371 129 HA LEU 15 HA LEU 15 -14.832 -3.289 13.852 130 HB2 LEU 15 HB2 LEU 15 -13.034 -4.630 11.832 131 HB3 LEU 15 HB1 LEU 15 -14.540 -3.812 11.465 132 HG LEU 15 HG LEU 15 -12.137 -2.436 12.671 133 HD11 LEU 15 HD11 LEU 15 -11.712 -1.548 10.456 134 HD12 LEU 15 HD12 LEU 15 -13.055 -2.482 9.798 135 HD13 LEU 15 HD13 LEU 15 -11.632 -3.308 10.432 136 HD21 LEU 15 HD21 LEU 15 -14.235 -1.314 13.138 137 HD22 LEU 15 HD22 LEU 15 -14.679 -1.388 11.432 138 HD23 LEU 15 HD23 LEU 15 -13.312 -0.400 11.944 139 H GLU 16 HN GLU 16 -16.676 -4.403 13.296 140 HA GLU 16 HA GLU 16 -16.703 -7.224 13.990 141 HB2 GLU 16 HB2 GLU 16 -18.599 -5.069 14.065 142 HB3 GLU 16 HB1 GLU 16 -19.263 -6.385 13.106 143 HG2 GLU 16 HG2 GLU 16 -18.264 -6.557 15.940 144 HG3 GLU 16 HG1 GLU 16 -19.943 -6.598 15.409 145 H VAL 17 HN VAL 17 -16.394 -8.709 12.524 146 HA VAL 17 HA VAL 17 -17.486 -8.347 9.827 147 HB VAL 17 HB VAL 17 -15.418 -9.398 8.872 148 HG11 VAL 17 HG11 VAL 17 -14.086 -7.341 8.863 149 HG12 VAL 17 HG12 VAL 17 -15.044 -6.721 10.208 150 HG13 VAL 17 HG13 VAL 17 -15.805 -7.010 8.643 151 HG21 VAL 17 HG21 VAL 17 -14.530 -10.358 10.929 152 HG22 VAL 17 HG22 VAL 17 -14.247 -8.739 11.572 153 HG23 VAL 17 HG23 VAL 17 -13.346 -9.299 10.163 154 H GLU 18 HN GLU 18 -17.047 -10.571 8.620 155 HA GLU 18 HA GLU 18 -17.388 -12.831 10.445 156 HB2 GLU 18 HB2 GLU 18 -19.362 -11.909 8.366 157 HB3 GLU 18 HB1 GLU 18 -19.256 -13.609 8.805 158 HG2 GLU 18 HG2 GLU 18 -19.717 -11.415 10.806 159 HG3 GLU 18 HG1 GLU 18 -21.021 -12.277 9.991 160 HA PRO 19 HA PRO 19 -14.668 -14.942 7.668 161 HB2 PRO 19 HB2 PRO 19 -16.703 -17.120 7.457 162 HB3 PRO 19 HB1 PRO 19 -14.988 -17.214 7.904 163 HG2 PRO 19 HG2 PRO 19 -16.868 -17.440 9.750 164 HG3 PRO 19 HG1 PRO 19 -15.365 -16.553 10.074 165 HD2 PRO 19 HD2 PRO 19 -18.095 -15.493 9.535 166 HD3 PRO 19 HD1 PRO 19 -16.829 -14.868 10.610 167 H SER 20 HN SER 20 -18.081 -14.892 6.758 168 HA SER 20 HA SER 20 -17.624 -15.372 3.975 169 HB2 SER 20 HB2 SER 20 -20.137 -14.247 4.190 170 HB3 SER 20 HB1 SER 20 -19.768 -15.966 4.330 171 HG SER 20 HG SER 20 -20.909 -14.616 6.140 172 H ASP 21 HN ASP 21 -17.015 -12.685 5.839 173 HA ASP 21 HA ASP 21 -17.968 -10.620 4.094 174 HB2 ASP 21 HB2 ASP 21 -17.139 -10.602 6.664 175 HB3 ASP 21 HB1 ASP 21 -15.664 -10.050 5.879 176 H THR 22 HN THR 22 -16.752 -9.319 2.705 177 HA THR 22 HA THR 22 -14.472 -10.710 1.503 178 HB THR 22 HB THR 22 -15.485 -8.330 0.123 179 HG1 THR 22 HG1 THR 22 -17.220 -10.440 0.873 180 HG21 THR 22 HG21 THR 22 -15.146 -11.229 -0.659 181 HG22 THR 22 HG22 THR 22 -13.994 -9.925 -0.943 182 HG23 THR 22 HG23 THR 22 -15.552 -9.921 -1.769 183 H ILE 23 HN ILE 23 -12.521 -9.643 1.072 184 HA ILE 23 HA ILE 23 -11.560 -7.884 3.004 185 HB ILE 23 HB ILE 23 -10.497 -8.293 0.202 186 HG12 ILE 23 HG12 ILE 23 -10.648 -10.399 1.397 187 HG13 ILE 23 HG11 ILE 23 -8.961 -9.911 1.282 188 HG21 ILE 23 HG21 ILE 23 -8.364 -7.514 1.061 189 HG22 ILE 23 HG22 ILE 23 -9.084 -7.238 2.648 190 HG23 ILE 23 HG23 ILE 23 -9.601 -6.274 1.264 191 HD11 ILE 23 HD11 ILE 23 -10.745 -9.714 3.695 192 HD12 ILE 23 HD12 ILE 23 -9.115 -9.045 3.602 193 HD13 ILE 23 HD13 ILE 23 -9.364 -10.786 3.465 194 H GLU 24 HN GLU 24 -12.795 -7.228 -0.242 195 HA GLU 24 HA GLU 24 -12.282 -4.498 -0.389 196 HB2 GLU 24 HB2 GLU 24 -13.031 -5.793 -2.312 197 HB3 GLU 24 HB1 GLU 24 -14.584 -6.087 -1.542 198 HG2 GLU 24 HG2 GLU 24 -14.937 -3.591 -1.569 199 HG3 GLU 24 HG1 GLU 24 -13.513 -3.489 -2.604 200 H ASN 25 HN ASN 25 -15.045 -6.220 1.005 201 HA ASN 25 HA ASN 25 -16.571 -3.918 1.626 202 HB2 ASN 25 HB2 ASN 25 -17.415 -6.309 1.516 203 HB3 ASN 25 HB1 ASN 25 -16.673 -6.556 3.094 204 HD21 ASN 25 HD21 ASN 25 -18.430 -6.839 4.314 205 HD22 ASN 25 HD22 ASN 25 -19.677 -5.645 4.530 206 H VAL 26 HN VAL 26 -14.148 -5.771 3.391 207 HA VAL 26 HA VAL 26 -14.437 -4.523 5.893 208 HB VAL 26 HB VAL 26 -11.954 -5.714 4.633 209 HG11 VAL 26 HG11 VAL 26 -12.499 -4.950 7.501 210 HG12 VAL 26 HG12 VAL 26 -11.289 -4.249 6.426 211 HG13 VAL 26 HG13 VAL 26 -11.130 -5.922 6.961 212 HG21 VAL 26 HG21 VAL 26 -13.804 -7.295 4.862 213 HG22 VAL 26 HG22 VAL 26 -13.942 -6.895 6.573 214 HG23 VAL 26 HG23 VAL 26 -12.488 -7.689 5.966 215 H LYS 27 HN LYS 27 -12.564 -3.682 3.027 216 HA LYS 27 HA LYS 27 -11.121 -1.527 4.118 217 HB2 LYS 27 HB2 LYS 27 -12.042 -1.866 1.257 218 HB3 LYS 27 HB1 LYS 27 -10.720 -0.848 1.812 219 HG2 LYS 27 HG2 LYS 27 -10.215 -3.468 2.745 220 HG3 LYS 27 HG1 LYS 27 -10.675 -3.589 1.047 221 HD2 LYS 27 HD2 LYS 27 -8.586 -1.680 2.083 222 HD3 LYS 27 HD1 LYS 27 -8.221 -3.291 1.463 223 HE2 LYS 27 HE2 LYS 27 -9.911 -1.703 -0.317 224 HE3 LYS 27 HE1 LYS 27 -8.327 -0.989 -0.025 225 HZ1 LYS 27 HZ1 LYS 27 -8.100 -2.381 -1.879 226 HZ2 LYS 27 HZ2 LYS 27 -8.947 -3.656 -1.158 227 HZ3 LYS 27 HZ3 LYS 27 -7.402 -3.238 -0.602 228 H ALA 28 HN ALA 28 -14.320 -1.750 2.671 229 HA ALA 28 HA ALA 28 -14.844 1.022 2.519 230 HB1 ALA 28 HB1 ALA 28 -16.149 -0.660 1.291 231 HB2 ALA 28 HB2 ALA 28 -17.178 0.393 2.262 232 HB3 ALA 28 HB3 ALA 28 -16.818 -1.241 2.816 233 H LYS 29 HN LYS 29 -15.229 -1.366 5.055 234 HA LYS 29 HA LYS 29 -16.768 0.201 6.825 235 HB2 LYS 29 HB2 LYS 29 -14.856 -2.074 7.409 236 HB3 LYS 29 HB1 LYS 29 -15.989 -1.394 8.571 237 HG2 LYS 29 HG2 LYS 29 -17.855 -2.058 7.124 238 HG3 LYS 29 HG1 LYS 29 -16.709 -2.767 5.987 239 HD2 LYS 29 HD2 LYS 29 -16.006 -4.387 7.635 240 HD3 LYS 29 HD1 LYS 29 -17.002 -3.613 8.871 241 HE2 LYS 29 HE2 LYS 29 -19.010 -4.146 7.589 242 HE3 LYS 29 HE1 LYS 29 -18.024 -4.919 6.351 243 HZ1 LYS 29 HZ1 LYS 29 -17.672 -6.740 7.636 244 HZ2 LYS 29 HZ2 LYS 29 -19.168 -6.272 8.280 245 HZ3 LYS 29 HZ3 LYS 29 -17.743 -5.881 9.099 246 H ILE 30 HN ILE 30 -13.294 -0.168 6.346 247 HA ILE 30 HA ILE 30 -12.512 1.435 8.562 248 HB ILE 30 HB ILE 30 -10.973 0.850 6.020 249 HG12 ILE 30 HG12 ILE 30 -10.901 -0.584 8.684 250 HG13 ILE 30 HG11 ILE 30 -11.728 -1.181 7.251 251 HG21 ILE 30 HG21 ILE 30 -10.061 2.737 7.283 252 HG22 ILE 30 HG22 ILE 30 -8.980 1.346 7.336 253 HG23 ILE 30 HG23 ILE 30 -9.985 1.736 8.733 254 HD11 ILE 30 HD11 ILE 30 -9.585 -2.271 7.561 255 HD12 ILE 30 HD12 ILE 30 -8.767 -0.710 7.512 256 HD13 ILE 30 HD13 ILE 30 -9.596 -1.315 6.078 257 H GLN 31 HN GLN 31 -13.379 2.083 5.239 258 HA GLN 31 HA GLN 31 -12.450 4.774 5.144 259 HB2 GLN 31 HB2 GLN 31 -12.885 3.396 3.122 260 HB3 GLN 31 HB1 GLN 31 -14.604 3.450 3.480 261 HG2 GLN 31 HG2 GLN 31 -14.497 5.929 3.291 262 HG3 GLN 31 HG1 GLN 31 -12.827 5.764 2.756 263 HE21 GLN 31 HE21 GLN 31 -13.201 6.627 0.739 264 HE22 GLN 31 HE22 GLN 31 -14.128 5.817 -0.478 265 H ASP 32 HN ASP 32 -15.356 3.237 6.297 266 HA ASP 32 HA ASP 32 -16.894 5.661 6.408 267 HB2 ASP 32 HB2 ASP 32 -18.076 3.573 6.186 268 HB3 ASP 32 HB1 ASP 32 -17.326 2.936 7.645 269 H LYS 33 HN LYS 33 -14.766 3.947 8.582 270 HA LYS 33 HA LYS 33 -15.558 5.637 10.821 271 HB2 LYS 33 HB2 LYS 33 -13.489 3.442 10.718 272 HB3 LYS 33 HB1 LYS 33 -14.088 4.237 12.166 273 HG2 LYS 33 HG2 LYS 33 -16.414 3.376 11.151 274 HG3 LYS 33 HG1 LYS 33 -15.330 2.142 10.502 275 HD2 LYS 33 HD2 LYS 33 -14.466 1.744 12.777 276 HD3 LYS 33 HD1 LYS 33 -15.617 2.930 13.399 277 HE2 LYS 33 HE2 LYS 33 -17.413 1.485 12.285 278 HE3 LYS 33 HE1 LYS 33 -16.162 0.248 12.166 279 HZ1 LYS 33 HZ1 LYS 33 -15.865 0.593 14.645 280 HZ2 LYS 33 HZ2 LYS 33 -17.281 -0.190 14.154 281 HZ3 LYS 33 HZ3 LYS 33 -17.331 1.438 14.609 282 H GLU 34 HN GLU 34 -12.402 4.702 9.427 283 HA GLU 34 HA GLU 34 -11.171 7.041 10.553 284 HB2 GLU 34 HB2 GLU 34 -10.077 4.940 8.680 285 HB3 GLU 34 HB1 GLU 34 -9.125 6.227 9.412 286 HG2 GLU 34 HG2 GLU 34 -10.536 3.983 10.831 287 HG3 GLU 34 HG1 GLU 34 -8.797 4.219 10.662 288 H GLY 35 HN GLY 35 -12.323 6.045 7.388 289 HA2 GLY 35 HA2 GLY 35 -13.061 7.579 5.756 290 HA3 GLY 35 HA1 GLY 35 -12.093 8.827 6.526 291 H ILE 36 HN ILE 36 -10.223 6.126 6.281 292 HA ILE 36 HA ILE 36 -8.523 7.270 4.318 293 HB ILE 36 HB ILE 36 -8.471 4.443 5.397 294 HG12 ILE 36 HG12 ILE 36 -6.964 6.853 6.428 295 HG13 ILE 36 HG11 ILE 36 -8.458 6.261 7.148 296 HG21 ILE 36 HG21 ILE 36 -6.303 6.140 4.156 297 HG22 ILE 36 HG22 ILE 36 -7.096 4.757 3.407 298 HG23 ILE 36 HG23 ILE 36 -6.085 4.527 4.833 299 HD11 ILE 36 HD11 ILE 36 -7.358 4.113 7.601 300 HD12 ILE 36 HD12 ILE 36 -6.558 5.470 8.395 301 HD13 ILE 36 HD13 ILE 36 -5.860 4.764 6.937 302 HA PRO 37 HA PRO 37 -10.680 5.745 0.694 303 HB2 PRO 37 HB2 PRO 37 -8.051 6.219 -0.601 304 HB3 PRO 37 HB1 PRO 37 -9.645 6.872 -1.020 305 HG2 PRO 37 HG2 PRO 37 -7.793 8.400 0.105 306 HG3 PRO 37 HG1 PRO 37 -9.513 8.575 0.509 307 HD2 PRO 37 HD2 PRO 37 -7.328 7.282 2.076 308 HD3 PRO 37 HD1 PRO 37 -8.702 8.257 2.638 309 HA PRO 38 HA PRO 38 -9.433 1.460 0.791 310 HB2 PRO 38 HB2 PRO 38 -10.712 1.418 -1.900 311 HB3 PRO 38 HB1 PRO 38 -11.032 0.399 -0.482 312 HG2 PRO 38 HG2 PRO 38 -12.729 2.299 -1.182 313 HG3 PRO 38 HG1 PRO 38 -12.367 1.979 0.525 314 HD2 PRO 38 HD2 PRO 38 -11.408 4.203 -1.213 315 HD3 PRO 38 HD1 PRO 38 -11.861 4.222 0.503 316 H ASP 39 HN ASP 39 -8.752 3.536 -1.965 317 HA ASP 39 HA ASP 39 -7.048 1.745 -3.349 318 HB2 ASP 39 HB2 ASP 39 -8.108 4.255 -3.845 319 HB3 ASP 39 HB1 ASP 39 -6.380 4.561 -3.707 320 H GLN 40 HN GLN 40 -6.583 3.640 -0.529 321 HA GLN 40 HA GLN 40 -3.665 3.330 -0.752 322 HB2 GLN 40 HB2 GLN 40 -5.394 5.277 0.736 323 HB3 GLN 40 HB1 GLN 40 -3.752 4.962 1.281 324 HG2 GLN 40 HG2 GLN 40 -2.844 5.744 -0.782 325 HG3 GLN 40 HG1 GLN 40 -4.447 5.855 -1.508 326 HE21 GLN 40 HE21 GLN 40 -2.360 7.881 -1.102 327 HE22 GLN 40 HE22 GLN 40 -3.130 9.163 -0.241 328 H GLN 41 HN GLN 41 -6.151 1.673 0.357 329 HA GLN 41 HA GLN 41 -5.097 1.054 3.006 330 HB2 GLN 41 HB2 GLN 41 -7.600 0.225 1.546 331 HB3 GLN 41 HB1 GLN 41 -7.122 -0.481 3.079 332 HG2 GLN 41 HG2 GLN 41 -7.144 1.848 4.034 333 HG3 GLN 41 HG1 GLN 41 -7.903 2.364 2.524 334 HE21 GLN 41 HE21 GLN 41 -9.860 2.923 3.471 335 HE22 GLN 41 HE22 GLN 41 -10.952 1.734 4.098 336 H ARG 42 HN ARG 42 -3.232 -0.118 2.621 337 HA ARG 42 HA ARG 42 -3.495 -2.529 0.977 338 HB2 ARG 42 HB2 ARG 42 -1.049 -1.280 2.253 339 HB3 ARG 42 HB1 ARG 42 -1.033 -2.729 1.256 340 HG2 ARG 42 HG2 ARG 42 -2.134 -1.206 -0.530 341 HG3 ARG 42 HG1 ARG 42 -1.509 0.111 0.467 342 HD2 ARG 42 HD2 ARG 42 0.178 -0.269 -1.109 343 HD3 ARG 42 HD1 ARG 42 0.740 -1.099 0.341 344 HE ARG 42 HE ARG 42 -0.587 -3.033 -1.039 345 HH11 ARG 42 HH11 ARG 42 2.054 -0.851 -1.799 346 HH12 ARG 42 HH12 ARG 42 2.740 -1.918 -3.004 347 HH21 ARG 42 HH21 ARG 42 0.326 -4.431 -2.583 348 HH22 ARG 42 HH22 ARG 42 1.766 -3.948 -3.436 349 H LEU 43 HN LEU 43 -4.420 -4.115 2.086 350 HA LEU 43 HA LEU 43 -3.927 -4.400 4.940 351 HB2 LEU 43 HB2 LEU 43 -5.888 -5.644 3.035 352 HB3 LEU 43 HB1 LEU 43 -5.641 -6.298 4.642 353 HG LEU 43 HG LEU 43 -6.543 -3.474 4.049 354 HD11 LEU 43 HD11 LEU 43 -8.084 -5.885 4.991 355 HD12 LEU 43 HD12 LEU 43 -8.265 -5.056 3.446 356 HD13 LEU 43 HD13 LEU 43 -8.708 -4.235 4.943 357 HD21 LEU 43 HD21 LEU 43 -7.053 -3.441 6.475 358 HD22 LEU 43 HD22 LEU 43 -5.330 -3.568 6.126 359 HD23 LEU 43 HD23 LEU 43 -6.233 -4.994 6.637 360 H ILE 44 HN ILE 44 -2.463 -5.710 5.717 361 HA ILE 44 HA ILE 44 -1.541 -7.953 4.041 362 HB ILE 44 HB ILE 44 -0.019 -6.014 5.745 363 HG12 ILE 44 HG12 ILE 44 1.598 -6.431 3.738 364 HG13 ILE 44 HG11 ILE 44 0.181 -7.140 2.973 365 HG21 ILE 44 HG21 ILE 44 0.573 -8.188 6.681 366 HG22 ILE 44 HG22 ILE 44 1.925 -7.489 5.791 367 HG23 ILE 44 HG23 ILE 44 0.968 -8.781 5.068 368 HD11 ILE 44 HD11 ILE 44 0.416 -4.849 2.301 369 HD12 ILE 44 HD12 ILE 44 0.457 -4.321 3.984 370 HD13 ILE 44 HD13 ILE 44 -1.018 -5.017 3.314 371 H PHE 45 HN PHE 45 -1.311 -9.936 4.991 372 HA PHE 45 HA PHE 45 -1.887 -10.175 7.862 373 HB2 PHE 45 HB2 PHE 45 -3.928 -10.618 6.366 374 HB3 PHE 45 HB1 PHE 45 -3.073 -12.061 5.828 375 HD1 PHE 45 HD1 PHE 45 -4.204 -10.353 8.934 376 HD2 PHE 45 HD2 PHE 45 -3.355 -14.038 6.984 377 HE1 PHE 45 HE1 PHE 45 -5.074 -11.581 10.877 378 HE2 PHE 45 HE2 PHE 45 -4.225 -15.272 8.926 379 HZ PHE 45 HZ PHE 45 -5.089 -14.042 10.878 380 H ALA 46 HN ALA 46 -0.320 -11.267 8.803 381 HA ALA 46 HA ALA 46 1.390 -12.690 9.223 382 HB1 ALA 46 HB1 ALA 46 1.441 -14.854 8.118 383 HB2 ALA 46 HB2 ALA 46 0.310 -14.274 6.895 384 HB3 ALA 46 HB3 ALA 46 -0.207 -14.424 8.574 385 H GLY 47 HN GLY 47 1.424 -10.609 6.843 386 HA2 GLY 47 HA2 GLY 47 3.660 -9.796 6.226 387 HA3 GLY 47 HA1 GLY 47 4.086 -11.467 5.898 388 H LYS 48 HN LYS 48 1.323 -11.804 4.624 389 HA LYS 48 HA LYS 48 2.133 -10.674 2.033 390 HB2 LYS 48 HB2 LYS 48 0.434 -13.072 2.725 391 HB3 LYS 48 HB1 LYS 48 0.575 -12.438 1.092 392 HG2 LYS 48 HG2 LYS 48 2.986 -12.841 1.146 393 HG3 LYS 48 HG1 LYS 48 2.839 -13.482 2.781 394 HD2 LYS 48 HD2 LYS 48 1.311 -14.632 0.463 395 HD3 LYS 48 HD1 LYS 48 2.938 -15.171 0.874 396 HE2 LYS 48 HE2 LYS 48 2.177 -15.790 3.108 397 HE3 LYS 48 HE1 LYS 48 0.552 -15.226 2.721 398 HZ1 LYS 48 HZ1 LYS 48 0.382 -16.915 1.028 399 HZ2 LYS 48 HZ2 LYS 48 0.773 -17.636 2.506 400 HZ3 LYS 48 HZ3 LYS 48 1.964 -17.435 1.322 401 H GLN 49 HN GLN 49 0.592 -9.744 0.652 402 HA GLN 49 HA GLN 49 -1.388 -8.182 2.029 403 HB2 GLN 49 HB2 GLN 49 0.109 -7.527 0.011 404 HB3 GLN 49 HB1 GLN 49 -1.119 -8.325 -0.951 405 HG2 GLN 49 HG2 GLN 49 -2.744 -6.768 0.374 406 HG3 GLN 49 HG1 GLN 49 -1.284 -5.818 0.647 407 HE21 GLN 49 HE21 GLN 49 -3.497 -7.048 -1.757 408 HE22 GLN 49 HE22 GLN 49 -3.007 -5.993 -3.035 409 H LEU 50 HN LEU 50 -3.606 -8.106 1.558 410 HA LEU 50 HA LEU 50 -4.721 -10.692 0.737 411 HB2 LEU 50 HB2 LEU 50 -6.194 -8.405 2.031 412 HB3 LEU 50 HB1 LEU 50 -6.688 -10.082 1.936 413 HG LEU 50 HG LEU 50 -4.337 -9.091 3.551 414 HD11 LEU 50 HD11 LEU 50 -6.547 -8.269 4.361 415 HD12 LEU 50 HD12 LEU 50 -5.703 -9.322 5.495 416 HD13 LEU 50 HD13 LEU 50 -7.047 -9.950 4.542 417 HD21 LEU 50 HD21 LEU 50 -4.531 -11.339 4.593 418 HD22 LEU 50 HD22 LEU 50 -4.051 -11.380 2.897 419 HD23 LEU 50 HD23 LEU 50 -5.710 -11.765 3.355 420 H GLU 51 HN GLU 51 -6.087 -10.881 -0.985 421 HA GLU 51 HA GLU 51 -6.229 -8.627 -2.807 422 HB2 GLU 51 HB2 GLU 51 -6.976 -11.538 -3.013 423 HB3 GLU 51 HB1 GLU 51 -7.434 -10.383 -4.258 424 HG2 GLU 51 HG2 GLU 51 -4.586 -10.576 -3.392 425 HG3 GLU 51 HG1 GLU 51 -5.256 -11.774 -4.499 426 H ASP 52 HN ASP 52 -8.077 -7.570 -3.431 427 HA ASP 52 HA ASP 52 -10.143 -7.303 -1.550 428 HB2 ASP 52 HB2 ASP 52 -9.753 -6.335 -4.356 429 HB3 ASP 52 HB1 ASP 52 -11.298 -6.087 -3.549 430 H GLY 53 HN GLY 53 -9.860 -9.288 -4.409 431 HA2 GLY 53 HA2 GLY 53 -12.669 -10.041 -4.342 432 HA3 GLY 53 HA1 GLY 53 -11.468 -10.601 -5.493 433 H ARG 54 HN ARG 54 -11.268 -10.689 -1.975 434 HA ARG 54 HA ARG 54 -11.609 -13.600 -1.990 435 HB2 ARG 54 HB2 ARG 54 -9.249 -12.108 -0.828 436 HB3 ARG 54 HB1 ARG 54 -9.643 -13.769 -0.412 437 HG2 ARG 54 HG2 ARG 54 -9.012 -12.799 -3.192 438 HG3 ARG 54 HG1 ARG 54 -7.859 -13.574 -2.102 439 HD2 ARG 54 HD2 ARG 54 -9.345 -15.556 -2.023 440 HD3 ARG 54 HD1 ARG 54 -10.386 -14.780 -3.215 441 HE ARG 54 HE ARG 54 -7.704 -15.856 -3.670 442 HH11 ARG 54 HH11 ARG 54 -10.583 -14.294 -4.933 443 HH12 ARG 54 HH12 ARG 54 -10.168 -14.605 -6.592 444 HH21 ARG 54 HH21 ARG 54 -7.157 -16.235 -5.849 445 HH22 ARG 54 HH22 ARG 54 -8.219 -15.697 -7.109 446 H THR 55 HN THR 55 -12.091 -14.472 0.126 447 HA THR 55 HA THR 55 -13.422 -12.483 1.823 448 HB THR 55 HB THR 55 -14.568 -14.408 2.867 449 HG1 THR 55 HG1 THR 55 -13.105 -15.920 0.927 450 HG21 THR 55 HG21 THR 55 -14.736 -14.260 -0.139 451 HG22 THR 55 HG22 THR 55 -15.687 -13.345 1.031 452 HG23 THR 55 HG23 THR 55 -15.913 -15.088 0.880 453 H LEU 56 HN LEU 56 -13.421 -13.253 4.250 454 HA LEU 56 HA LEU 56 -10.726 -13.068 5.132 455 HB2 LEU 56 HB2 LEU 56 -13.285 -13.615 6.630 456 HB3 LEU 56 HB1 LEU 56 -11.735 -13.370 7.411 457 HG LEU 56 HG LEU 56 -13.109 -11.326 5.663 458 HD11 LEU 56 HD11 LEU 56 -12.908 -11.494 8.664 459 HD12 LEU 56 HD12 LEU 56 -14.371 -11.712 7.702 460 HD13 LEU 56 HD13 LEU 56 -13.570 -10.141 7.747 461 HD21 LEU 56 HD21 LEU 56 -11.442 -9.788 6.656 462 HD22 LEU 56 HD22 LEU 56 -10.714 -11.045 5.658 463 HD23 LEU 56 HD23 LEU 56 -10.660 -11.175 7.415 464 H SER 57 HN SER 57 -13.062 -15.708 4.926 465 HA SER 57 HA SER 57 -11.523 -17.639 6.297 466 HB2 SER 57 HB2 SER 57 -13.052 -19.050 4.456 467 HB3 SER 57 HB1 SER 57 -13.553 -18.596 6.084 468 HG SER 57 HG SER 57 -14.165 -17.388 3.618 469 H ASP 58 HN ASP 58 -11.351 -16.338 3.100 470 HA ASP 58 HA ASP 58 -10.049 -18.446 1.760 471 HB2 ASP 58 HB2 ASP 58 -10.331 -15.512 1.321 472 HB3 ASP 58 HB1 ASP 58 -9.058 -16.348 0.439 473 H TYR 59 HN TYR 59 -8.886 -15.997 3.951 474 HA TYR 59 HA TYR 59 -6.129 -16.929 3.508 475 HB2 TYR 59 HB2 TYR 59 -7.211 -14.342 4.616 476 HB3 TYR 59 HB1 TYR 59 -5.519 -14.807 4.774 477 HD1 TYR 59 HD1 TYR 59 -4.108 -15.014 2.755 478 HD2 TYR 59 HD2 TYR 59 -8.086 -13.526 2.553 479 HE1 TYR 59 HE1 TYR 59 -3.630 -14.068 0.539 480 HE2 TYR 59 HE2 TYR 59 -7.623 -12.577 0.335 481 HH TYR 59 HH TYR 59 -4.659 -13.261 -1.380 482 H ASN 60 HN ASN 60 -8.483 -17.923 5.246 483 HA ASN 60 HA ASN 60 -8.743 -19.028 7.210 484 HB2 ASN 60 HB2 ASN 60 -6.130 -19.489 6.502 485 HB3 ASN 60 HB1 ASN 60 -5.960 -18.841 8.131 486 HD21 ASN 60 HD21 ASN 60 -7.192 -21.432 6.186 487 HD22 ASN 60 HD22 ASN 60 -7.515 -22.524 7.488 488 H ILE 61 HN ILE 61 -8.750 -16.052 7.064 489 HA ILE 61 HA ILE 61 -7.767 -15.125 9.599 490 HB ILE 61 HB ILE 61 -9.652 -13.767 7.663 491 HG12 ILE 61 HG12 ILE 61 -6.670 -13.393 8.024 492 HG13 ILE 61 HG11 ILE 61 -7.406 -14.323 6.723 493 HG21 ILE 61 HG21 ILE 61 -9.000 -11.699 8.822 494 HG22 ILE 61 HG22 ILE 61 -8.070 -12.653 9.977 495 HG23 ILE 61 HG23 ILE 61 -9.822 -12.831 9.896 496 HD11 ILE 61 HD11 ILE 61 -7.799 -11.378 7.214 497 HD12 ILE 61 HD12 ILE 61 -8.497 -12.316 5.893 498 HD13 ILE 61 HD13 ILE 61 -6.751 -12.094 5.989 499 H GLN 62 HN GLN 62 -8.723 -15.486 11.454 500 HA GLN 62 HA GLN 62 -11.643 -15.866 11.512 501 HB2 GLN 62 HB2 GLN 62 -9.535 -17.108 13.297 502 HB3 GLN 62 HB1 GLN 62 -11.271 -17.330 13.472 503 HG2 GLN 62 HG2 GLN 62 -11.399 -18.794 11.770 504 HG3 GLN 62 HG1 GLN 62 -10.164 -17.969 10.821 505 HE21 GLN 62 HE21 GLN 62 -8.019 -18.533 11.068 506 HE22 GLN 62 HE22 GLN 62 -7.517 -19.931 11.956 507 H LYS 63 HN LYS 63 -11.737 -15.867 14.396 508 HA LYS 63 HA LYS 63 -11.811 -13.035 14.817 509 HB2 LYS 63 HB2 LYS 63 -12.694 -13.588 17.036 510 HB3 LYS 63 HB1 LYS 63 -13.537 -14.485 15.780 511 HG2 LYS 63 HG2 LYS 63 -12.309 -16.485 16.318 512 HG3 LYS 63 HG1 LYS 63 -11.321 -15.603 17.486 513 HD2 LYS 63 HD2 LYS 63 -13.332 -15.132 18.815 514 HD3 LYS 63 HD1 LYS 63 -14.307 -16.036 17.655 515 HE2 LYS 63 HE2 LYS 63 -13.190 -18.074 18.200 516 HE3 LYS 63 HE1 LYS 63 -11.987 -17.222 19.165 517 HZ1 LYS 63 HZ1 LYS 63 -13.581 -18.232 20.614 518 HZ2 LYS 63 HZ2 LYS 63 -14.869 -17.519 19.789 519 HZ3 LYS 63 HZ3 LYS 63 -13.802 -16.554 20.674 520 H GLU 64 HN GLU 64 -10.704 -11.873 16.436 521 HA GLU 64 HA GLU 64 -8.940 -11.193 17.686 522 HB2 GLU 64 HB2 GLU 64 -8.584 -14.160 18.012 523 HB3 GLU 64 HB1 GLU 64 -7.447 -13.014 18.710 524 HG2 GLU 64 HG2 GLU 64 -9.517 -11.939 19.788 525 HG3 GLU 64 HG1 GLU 64 -10.330 -13.449 19.377 526 H SER 65 HN SER 65 -8.745 -12.002 14.725 527 HA SER 65 HA SER 65 -5.916 -12.474 14.407 528 HB2 SER 65 HB2 SER 65 -7.976 -11.787 12.300 529 HB3 SER 65 HB1 SER 65 -6.377 -12.479 12.030 530 HG SER 65 HG SER 65 -8.719 -13.683 12.839 531 H THR 66 HN THR 66 -4.397 -11.027 13.703 532 HA THR 66 HA THR 66 -5.158 -8.209 13.940 533 HB THR 66 HB THR 66 -2.529 -9.639 14.264 534 HG1 THR 66 HG1 THR 66 -4.088 -9.314 16.040 535 HG21 THR 66 HG21 THR 66 -2.150 -7.604 12.892 536 HG22 THR 66 HG22 THR 66 -1.400 -7.510 14.487 537 HG23 THR 66 HG23 THR 66 -2.902 -6.644 14.168 538 H LEU 67 HN LEU 67 -5.411 -7.083 12.155 539 HA LEU 67 HA LEU 67 -4.132 -8.007 9.680 540 HB2 LEU 67 HB2 LEU 67 -6.598 -6.408 10.260 541 HB3 LEU 67 HB1 LEU 67 -5.797 -6.222 8.714 542 HG LEU 67 HG LEU 67 -6.018 -8.790 8.522 543 HD11 LEU 67 HD11 LEU 67 -7.880 -9.765 9.728 544 HD12 LEU 67 HD12 LEU 67 -8.139 -8.253 10.597 545 HD13 LEU 67 HD13 LEU 67 -6.662 -9.180 10.862 546 HD21 LEU 67 HD21 LEU 67 -8.401 -6.951 8.383 547 HD22 LEU 67 HD22 LEU 67 -8.318 -8.550 7.642 548 HD23 LEU 67 HD23 LEU 67 -7.229 -7.271 7.104 549 H HIS 68 HN HIS 68 -2.639 -6.791 8.679 550 HA HIS 68 HA HIS 68 -1.770 -4.361 10.044 551 HB2 HIS 68 HB2 HIS 68 -0.395 -5.813 7.775 552 HB3 HIS 68 HB1 HIS 68 0.309 -4.624 8.865 553 HD2 HIS 68 HD2 HIS 68 0.077 -5.692 11.705 554 HE1 HIS 68 HE1 HIS 68 0.996 -9.542 10.207 555 HE2 HIS 68 HE2 HIS 68 1.084 -8.025 12.232 556 H LEU 69 HN LEU 69 -2.252 -2.405 9.273 557 HA LEU 69 HA LEU 69 -3.223 -2.229 6.503 558 HB2 LEU 69 HB2 LEU 69 -4.829 -1.531 8.216 559 HB3 LEU 69 HB1 LEU 69 -3.684 -0.355 8.830 560 HG LEU 69 HG LEU 69 -3.804 0.859 6.675 561 HD11 LEU 69 HD11 LEU 69 -5.616 0.297 5.104 562 HD12 LEU 69 HD12 LEU 69 -5.930 -1.175 6.021 563 HD13 LEU 69 HD13 LEU 69 -4.385 -0.962 5.198 564 HD21 LEU 69 HD21 LEU 69 -6.417 0.383 8.098 565 HD22 LEU 69 HD22 LEU 69 -6.118 1.705 6.971 566 HD23 LEU 69 HD23 LEU 69 -5.205 1.608 8.475 567 H VAL 70 HN VAL 70 -1.620 -1.699 5.176 568 HA VAL 70 HA VAL 70 0.418 0.206 6.037 569 HB VAL 70 HB VAL 70 0.178 -1.599 3.634 570 HG11 VAL 70 HG11 VAL 70 1.175 0.467 2.856 571 HG12 VAL 70 HG12 VAL 70 2.403 -0.795 2.946 572 HG13 VAL 70 HG13 VAL 70 2.322 0.447 4.195 573 HG21 VAL 70 HG21 VAL 70 0.864 -2.704 5.665 574 HG22 VAL 70 HG22 VAL 70 2.116 -1.494 5.937 575 HG23 VAL 70 HG23 VAL 70 2.235 -2.590 4.560 576 H LEU 71 HN LEU 71 0.262 2.285 5.567 577 HA LEU 71 HA LEU 71 -1.720 3.206 3.632 578 HB2 LEU 71 HB2 LEU 71 0.055 4.791 5.499 579 HB3 LEU 71 HB1 LEU 71 -1.253 5.439 4.529 580 HG LEU 71 HG LEU 71 -1.567 3.469 6.793 581 HD11 LEU 71 HD11 LEU 71 -2.221 6.405 6.634 582 HD12 LEU 71 HD12 LEU 71 -0.926 5.677 7.584 583 HD13 LEU 71 HD13 LEU 71 -2.611 5.333 7.978 584 HD21 LEU 71 HD21 LEU 71 -3.975 3.949 6.532 585 HD22 LEU 71 HD22 LEU 71 -3.278 3.131 5.135 586 HD23 LEU 71 HD23 LEU 71 -3.605 4.863 5.066 587 H ARG 72 HN ARG 72 -1.049 3.311 1.580 588 HA ARG 72 HA ARG 72 1.777 3.732 1.028 589 HB2 ARG 72 HB2 ARG 72 1.383 2.925 -1.132 590 HB3 ARG 72 HB1 ARG 72 0.344 1.953 -0.105 591 HG2 ARG 72 HG2 ARG 72 -1.575 3.332 -0.752 592 HG3 ARG 72 HG1 ARG 72 -0.528 4.290 -1.799 593 HD2 ARG 72 HD2 ARG 72 -1.545 1.517 -2.142 594 HD3 ARG 72 HD1 ARG 72 -1.355 2.806 -3.330 595 HE ARG 72 HE ARG 72 1.135 1.748 -2.307 596 HH11 ARG 72 HH11 ARG 72 -1.335 1.436 -4.778 597 HH12 ARG 72 HH12 ARG 72 -0.290 0.601 -5.883 598 HH21 ARG 72 HH21 ARG 72 2.502 0.676 -3.748 599 HH22 ARG 72 HH22 ARG 72 1.901 0.169 -5.296 600 H LEU 73 HN LEU 73 2.541 5.271 -0.487 601 HA LEU 73 HA LEU 73 0.818 7.635 -0.815 602 HB2 LEU 73 HB2 LEU 73 3.693 7.504 0.078 603 HB3 LEU 73 HB1 LEU 73 2.997 8.962 -0.599 604 HG LEU 73 HG LEU 73 1.191 8.545 1.307 605 HD11 LEU 73 HD11 LEU 73 2.360 6.434 2.002 606 HD12 LEU 73 HD12 LEU 73 2.087 7.610 3.288 607 HD13 LEU 73 HD13 LEU 73 3.688 7.447 2.567 608 HD21 LEU 73 HD21 LEU 73 2.543 10.552 0.998 609 HD22 LEU 73 HD22 LEU 73 3.906 9.755 1.784 610 HD23 LEU 73 HD23 LEU 73 2.438 10.096 2.699 611 H ARG 74 HN ARG 74 2.084 9.198 -2.429 612 HA ARG 74 HA ARG 74 3.065 7.542 -4.652 613 HB2 ARG 74 HB2 ARG 74 1.109 9.836 -4.761 614 HB3 ARG 74 HB1 ARG 74 1.907 9.180 -6.180 615 HG2 ARG 74 HG2 ARG 74 0.014 7.731 -4.346 616 HG3 ARG 74 HG1 ARG 74 -0.293 8.246 -6.004 617 HD2 ARG 74 HD2 ARG 74 1.580 6.762 -6.728 618 HD3 ARG 74 HD1 ARG 74 1.673 6.161 -5.073 619 HE ARG 74 HE ARG 74 -0.959 5.859 -5.850 620 HH11 ARG 74 HH11 ARG 74 2.163 4.664 -6.874 621 HH12 ARG 74 HH12 ARG 74 1.525 3.200 -7.544 622 HH21 ARG 74 HH21 ARG 74 -1.802 3.910 -6.707 623 HH22 ARG 74 HH22 ARG 74 -0.723 2.769 -7.442 624 H GLY 75 HN GLY 75 3.413 10.410 -2.758 625 HA2 GLY 75 HA2 GLY 75 5.726 11.169 -4.431 626 HA3 GLY 75 HA1 GLY 75 4.676 12.365 -3.687 627 H GLY 76 HN GLY 76 7.484 10.547 -3.349 628 HA2 GLY 76 HA2 GLY 76 7.921 11.648 -0.693 629 HA3 GLY 76 HA1 GLY 76 7.929 9.893 -0.802 630 H1 SER 453 HT1 SER 453 21.084 10.375 15.263 631 H2 SER 453 HT2 SER 453 22.444 9.392 15.441 632 H3 SER 453 HT3 SER 453 22.322 10.835 16.312 633 HA SER 453 HA SER 453 21.888 8.886 17.682 634 HB2 SER 453 HB2 SER 453 19.237 10.102 17.681 635 HB3 SER 453 HB1 SER 453 20.503 10.172 18.909 636 HG SER 453 HG SER 453 20.407 12.224 18.220 637 H ASN 454 HN ASN 454 19.324 9.432 15.252 638 HA ASN 454 HA ASN 454 17.930 8.018 14.153 639 HB2 ASN 454 HB2 ASN 454 20.261 6.330 14.739 640 HB3 ASN 454 HB1 ASN 454 18.768 5.433 14.494 641 HD21 ASN 454 HD21 ASN 454 19.310 4.543 12.568 642 HD22 ASN 454 HD22 ASN 454 19.535 5.459 11.113 643 H SER 455 HN SER 455 17.731 8.503 17.141 644 HA SER 455 HA SER 455 16.687 6.237 18.408 645 HB2 SER 455 HB2 SER 455 15.748 9.020 19.038 646 HB3 SER 455 HB1 SER 455 16.095 7.686 20.142 647 HG SER 455 HG SER 455 18.229 8.038 19.949 648 H GLN 456 HN GLN 456 15.043 8.857 16.650 649 HA GLN 456 HA GLN 456 12.424 7.837 17.081 650 HB2 GLN 456 HB2 GLN 456 13.271 9.606 14.788 651 HB3 GLN 456 HB1 GLN 456 11.679 9.486 15.523 652 HG2 GLN 456 HG2 GLN 456 14.131 10.543 16.906 653 HG3 GLN 456 HG1 GLN 456 12.902 11.541 16.132 654 HE21 GLN 456 HE21 GLN 456 13.806 11.357 18.926 655 HE22 GLN 456 HE22 GLN 456 12.381 11.048 19.853 656 H LEU 457 HN LEU 457 14.748 7.561 14.439 657 HA LEU 457 HA LEU 457 13.082 6.169 12.651 658 HB2 LEU 457 HB2 LEU 457 16.088 6.072 12.902 659 HB3 LEU 457 HB1 LEU 457 15.167 5.481 11.534 660 HG LEU 457 HG LEU 457 15.404 8.357 12.424 661 HD11 LEU 457 HD11 LEU 457 16.389 6.925 9.961 662 HD12 LEU 457 HD12 LEU 457 17.386 7.500 11.296 663 HD13 LEU 457 HD13 LEU 457 16.529 8.655 10.274 664 HD21 LEU 457 HD21 LEU 457 13.178 8.011 11.582 665 HD22 LEU 457 HD22 LEU 457 13.798 7.122 10.192 666 HD23 LEU 457 HD23 LEU 457 14.123 8.848 10.350 667 H ASN 458 HN ASN 458 15.370 5.018 15.101 668 HA ASN 458 HA ASN 458 15.103 2.272 14.535 669 HB2 ASN 458 HB2 ASN 458 16.574 3.825 16.325 670 HB3 ASN 458 HB1 ASN 458 15.568 2.811 17.355 671 HD21 ASN 458 HD21 ASN 458 18.457 2.776 16.926 672 HD22 ASN 458 HD22 ASN 458 18.834 1.172 16.393 673 H ALA 459 HN ALA 459 13.430 4.366 16.856 674 HA ALA 459 HA ALA 459 11.824 2.399 18.034 675 HB1 ALA 459 HB1 ALA 459 12.112 4.591 19.024 676 HB2 ALA 459 HB2 ALA 459 10.400 4.258 18.765 677 HB3 ALA 459 HB3 ALA 459 11.263 5.337 17.670 678 H MET 460 HN MET 460 11.272 4.445 15.201 679 HA MET 460 HA MET 460 8.616 3.535 14.743 680 HB2 MET 460 HB2 MET 460 10.620 4.984 13.028 681 HB3 MET 460 HB1 MET 460 9.045 4.505 12.411 682 HG2 MET 460 HG2 MET 460 8.081 5.770 14.408 683 HG3 MET 460 HG1 MET 460 9.690 6.473 14.573 684 HE1 MET 460 HE1 MET 460 10.125 8.431 11.234 685 HE2 MET 460 HE2 MET 460 10.674 6.791 11.573 686 HE3 MET 460 HE3 MET 460 10.822 8.043 12.807 687 H ALA 461 HN ALA 461 11.790 2.524 13.594 688 HA ALA 461 HA ALA 461 10.924 0.727 11.605 689 HB1 ALA 461 HB1 ALA 461 13.433 0.594 13.275 690 HB2 ALA 461 HB2 ALA 461 13.240 1.517 11.784 691 HB3 ALA 461 HB3 ALA 461 13.152 -0.245 11.748 692 H HIS 462 HN HIS 462 11.477 0.355 15.068 693 HA HIS 462 HA HIS 462 11.177 -2.426 15.225 694 HB2 HIS 462 HB2 HIS 462 11.891 -0.686 17.043 695 HB3 HIS 462 HB1 HIS 462 10.169 -0.616 17.399 696 HD2 HIS 462 HD2 HIS 462 10.692 -4.162 16.563 697 HE1 HIS 462 HE1 HIS 462 11.681 -3.860 20.668 698 HE2 HIS 462 HE2 HIS 462 10.950 -5.425 18.815 699 H GLN 463 HN GLN 463 8.820 0.187 15.176 700 HA GLN 463 HA GLN 463 6.533 -1.317 15.821 701 HB2 GLN 463 HB2 GLN 463 6.444 1.091 15.861 702 HB3 GLN 463 HB1 GLN 463 6.864 1.184 14.157 703 HG2 GLN 463 HG2 GLN 463 4.526 1.641 14.434 704 HG3 GLN 463 HG1 GLN 463 4.721 0.099 13.604 705 HE21 GLN 463 HE21 GLN 463 4.190 -1.811 14.679 706 HE22 GLN 463 HE22 GLN 463 3.222 -1.814 16.113 707 H ILE 464 HN ILE 464 8.199 -0.732 12.767 708 HA ILE 464 HA ILE 464 6.235 -2.000 11.133 709 HB ILE 464 HB ILE 464 9.163 -1.491 10.566 710 HG12 ILE 464 HG12 ILE 464 6.685 0.096 9.852 711 HG13 ILE 464 HG11 ILE 464 7.919 0.566 11.017 712 HG21 ILE 464 HG21 ILE 464 8.539 -1.746 8.203 713 HG22 ILE 464 HG22 ILE 464 6.906 -2.194 8.693 714 HG23 ILE 464 HG23 ILE 464 8.268 -3.231 9.118 715 HD11 ILE 464 HD11 ILE 464 8.186 1.759 8.927 716 HD12 ILE 464 HD12 ILE 464 8.317 0.234 8.054 717 HD13 ILE 464 HD13 ILE 464 9.562 0.694 9.214 718 H GLN 465 HN GLN 465 9.201 -3.046 12.731 719 HA GLN 465 HA GLN 465 9.350 -5.632 11.627 720 HB2 GLN 465 HB2 GLN 465 11.091 -4.304 13.020 721 HB3 GLN 465 HB1 GLN 465 10.256 -4.967 14.419 722 HG2 GLN 465 HG2 GLN 465 12.113 -6.364 13.961 723 HG3 GLN 465 HG1 GLN 465 10.661 -7.242 13.480 724 HE21 GLN 465 HE21 GLN 465 11.701 -8.560 12.037 725 HE22 GLN 465 HE22 GLN 465 12.361 -7.986 10.541 726 H GLU 466 HN GLU 466 7.405 -4.264 14.144 727 HA GLU 466 HA GLU 466 6.606 -6.772 15.304 728 HB2 GLU 466 HB2 GLU 466 5.566 -3.951 15.577 729 HB3 GLU 466 HB1 GLU 466 4.861 -5.317 16.430 730 HG2 GLU 466 HG2 GLU 466 7.770 -4.641 16.646 731 HG3 GLU 466 HG1 GLU 466 6.551 -3.884 17.670 732 H MET 467 HN MET 467 5.759 -5.023 12.542 733 HA MET 467 HA MET 467 3.110 -6.267 12.369 734 HB2 MET 467 HB2 MET 467 4.357 -4.112 10.644 735 HB3 MET 467 HB1 MET 467 2.718 -4.724 10.485 736 HG2 MET 467 HG2 MET 467 3.397 -3.739 13.157 737 HG3 MET 467 HG1 MET 467 3.423 -2.517 11.889 738 HE1 MET 467 HE1 MET 467 1.356 -3.095 9.888 739 HE2 MET 467 HE2 MET 467 1.225 -1.544 10.716 740 HE3 MET 467 HE3 MET 467 -0.201 -2.564 10.522 741 H PHE 468 HN PHE 468 6.099 -5.819 10.495 742 HA PHE 468 HA PHE 468 5.291 -8.066 8.784 743 HB2 PHE 468 HB2 PHE 468 7.153 -5.746 8.379 744 HB3 PHE 468 HB1 PHE 468 7.318 -7.199 7.400 745 HD1 PHE 468 HD1 PHE 468 5.050 -4.438 8.294 746 HD2 PHE 468 HD2 PHE 468 5.832 -7.662 5.628 747 HE1 PHE 468 HE1 PHE 468 3.292 -3.614 6.783 748 HE2 PHE 468 HE2 PHE 468 4.075 -6.844 4.116 749 HZ PHE 468 HZ PHE 468 2.801 -4.818 4.691 750 HA PRO 469 HA PRO 469 8.585 -10.165 11.061 751 HB2 PRO 469 HB2 PRO 469 7.410 -12.570 11.169 752 HB3 PRO 469 HB1 PRO 469 6.836 -11.231 12.181 753 HG2 PRO 469 HG2 PRO 469 5.635 -12.389 9.738 754 HG3 PRO 469 HG1 PRO 469 4.853 -11.661 11.152 755 HD2 PRO 469 HD2 PRO 469 5.357 -10.406 8.673 756 HD3 PRO 469 HD1 PRO 469 4.797 -9.632 10.168 757 H GLN 470 HN GLN 470 8.444 -9.711 8.099 758 HA GLN 470 HA GLN 470 10.004 -12.061 7.310 759 HB2 GLN 470 HB2 GLN 470 8.879 -12.234 5.170 760 HB3 GLN 470 HB1 GLN 470 7.706 -12.395 6.466 761 HG2 GLN 470 HG2 GLN 470 6.957 -10.126 6.129 762 HG3 GLN 470 HG1 GLN 470 8.203 -9.868 4.907 763 HE21 GLN 470 HE21 GLN 470 6.826 -9.432 3.231 764 HE22 GLN 470 HE22 GLN 470 5.750 -10.596 2.548 765 H VAL 471 HN VAL 471 10.835 -9.436 8.095 766 HA VAL 471 HA VAL 471 12.293 -8.724 5.686 767 HB VAL 471 HB VAL 471 10.345 -7.247 5.602 768 HG11 VAL 471 HG11 VAL 471 9.948 -5.552 7.316 769 HG12 VAL 471 HG12 VAL 471 11.230 -6.250 8.305 770 HG13 VAL 471 HG13 VAL 471 9.775 -7.184 7.962 771 HG21 VAL 471 HG21 VAL 471 12.406 -6.365 4.726 772 HG22 VAL 471 HG22 VAL 471 12.906 -5.833 6.330 773 HG23 VAL 471 HG23 VAL 471 11.527 -5.072 5.540 774 HA PRO 472 HA PRO 472 15.560 -8.627 8.724 775 HB2 PRO 472 HB2 PRO 472 16.941 -6.989 6.664 776 HB3 PRO 472 HB1 PRO 472 17.458 -8.501 7.437 777 HG2 PRO 472 HG2 PRO 472 16.638 -8.495 4.926 778 HG3 PRO 472 HG1 PRO 472 16.204 -9.820 6.026 779 HD2 PRO 472 HD2 PRO 472 14.538 -7.518 5.100 780 HD3 PRO 472 HD1 PRO 472 14.090 -9.222 5.322 781 H TYR 473 HN TYR 473 15.793 -7.321 10.397 782 HA TYR 473 HA TYR 473 14.603 -4.854 10.708 783 HB2 TYR 473 HB2 TYR 473 15.444 -6.437 12.498 784 HB3 TYR 473 HB1 TYR 473 17.043 -5.755 12.236 785 HD1 TYR 473 HD2 TYR 473 13.556 -4.745 13.083 786 HD2 TYR 473 HD1 TYR 473 17.706 -3.896 13.454 787 HE1 TYR 473 HE2 TYR 473 13.040 -2.951 14.679 788 HE2 TYR 473 HE1 TYR 473 17.202 -2.099 15.056 789 HH TYR 473 HH TYR 473 15.362 -0.644 15.673 790 H HIS 474 HN HIS 474 18.018 -5.515 9.932 791 HA HIS 474 HA HIS 474 18.860 -2.831 10.010 792 HB2 HIS 474 HB2 HIS 474 20.794 -3.656 8.604 793 HB3 HIS 474 HB1 HIS 474 20.544 -4.500 10.124 794 HD2 HIS 474 HD2 HIS 474 20.629 -5.172 6.341 795 HE1 HIS 474 HE1 HIS 474 19.636 -8.781 8.312 796 HE2 HIS 474 HE2 HIS 474 20.477 -7.756 6.152 797 H LEU 475 HN LEU 475 17.295 -4.693 7.498 798 HA LEU 475 HA LEU 475 17.905 -2.836 5.407 799 HB2 LEU 475 HB2 LEU 475 16.002 -5.142 5.643 800 HB3 LEU 475 HB1 LEU 475 15.980 -4.092 4.241 801 HG LEU 475 HG LEU 475 18.243 -5.863 5.156 802 HD11 LEU 475 HD11 LEU 475 16.287 -6.817 3.868 803 HD12 LEU 475 HD12 LEU 475 17.883 -7.060 3.160 804 HD13 LEU 475 HD13 LEU 475 16.813 -5.816 2.515 805 HD21 LEU 475 HD21 LEU 475 19.285 -3.856 4.406 806 HD22 LEU 475 HD22 LEU 475 18.195 -3.732 3.027 807 HD23 LEU 475 HD23 LEU 475 19.396 -5.023 3.087 808 H VAL 476 HN VAL 476 15.302 -3.273 7.707 809 HA VAL 476 HA VAL 476 13.448 -1.480 6.545 810 HB VAL 476 HB VAL 476 13.781 -2.100 9.492 811 HG11 VAL 476 HG11 VAL 476 11.349 -1.605 9.576 812 HG12 VAL 476 HG12 VAL 476 11.441 -1.070 7.898 813 HG13 VAL 476 HG13 VAL 476 12.341 -0.211 9.148 814 HG21 VAL 476 HG21 VAL 476 12.149 -3.541 7.406 815 HG22 VAL 476 HG22 VAL 476 12.096 -3.849 9.143 816 HG23 VAL 476 HG23 VAL 476 13.575 -4.167 8.237 817 H LEU 477 HN LEU 477 16.038 -1.098 8.910 818 HA LEU 477 HA LEU 477 15.637 1.607 9.532 819 HB2 LEU 477 HB2 LEU 477 18.079 -0.153 9.576 820 HB3 LEU 477 HB1 LEU 477 18.138 1.524 10.086 821 HG LEU 477 HG LEU 477 16.257 -0.482 11.319 822 HD11 LEU 477 HD11 LEU 477 17.877 -0.634 13.166 823 HD12 LEU 477 HD12 LEU 477 19.031 0.296 12.208 824 HD13 LEU 477 HD13 LEU 477 18.511 -1.297 11.660 825 HD21 LEU 477 HD21 LEU 477 15.626 1.822 11.667 826 HD22 LEU 477 HD22 LEU 477 17.265 2.227 12.181 827 HD23 LEU 477 HD23 LEU 477 16.270 1.158 13.169 828 H GLN 478 HN GLN 478 17.224 0.046 6.850 829 HA GLN 478 HA GLN 478 18.722 2.181 5.839 830 HB2 GLN 478 HB2 GLN 478 19.134 0.015 4.972 831 HB3 GLN 478 HB1 GLN 478 17.449 -0.213 4.534 832 HG2 GLN 478 HG2 GLN 478 18.035 1.945 3.034 833 HG3 GLN 478 HG1 GLN 478 19.615 1.168 3.097 834 HE21 GLN 478 HE21 GLN 478 16.575 -0.573 3.202 835 HE22 GLN 478 HE22 GLN 478 16.733 -1.307 1.648 836 H ASP 479 HN ASP 479 15.403 1.148 5.041 837 HA ASP 479 HA ASP 479 14.950 3.286 3.213 838 HB2 ASP 479 HB2 ASP 479 13.688 1.102 3.244 839 HB3 ASP 479 HB1 ASP 479 12.855 1.676 4.683 840 H LEU 480 HN LEU 480 14.326 2.796 6.639 841 HA LEU 480 HA LEU 480 12.707 5.015 7.132 842 HB2 LEU 480 HB2 LEU 480 14.326 3.168 8.693 843 HB3 LEU 480 HB1 LEU 480 14.290 4.771 9.394 844 HG LEU 480 HG LEU 480 12.569 3.374 10.379 845 HD11 LEU 480 HD11 LEU 480 12.113 5.763 10.127 846 HD12 LEU 480 HD12 LEU 480 10.636 4.804 10.022 847 HD13 LEU 480 HD13 LEU 480 11.371 5.455 8.558 848 HD21 LEU 480 HD21 LEU 480 12.240 1.830 8.520 849 HD22 LEU 480 HD22 LEU 480 11.475 3.112 7.582 850 HD23 LEU 480 HD23 LEU 480 10.707 2.519 9.054 851 H GLN 481 HN GLN 481 16.170 4.760 6.726 852 HA GLN 481 HA GLN 481 16.701 7.444 7.642 853 HB2 GLN 481 HB2 GLN 481 18.431 5.399 6.250 854 HB3 GLN 481 HB1 GLN 481 19.010 6.973 6.777 855 HG2 GLN 481 HG2 GLN 481 18.609 6.428 9.067 856 HG3 GLN 481 HG1 GLN 481 17.804 4.925 8.617 857 HE21 GLN 481 HE21 GLN 481 19.756 4.343 6.514 858 HE22 GLN 481 HE22 GLN 481 21.185 3.809 7.324 859 H LEU 482 HN LEU 482 15.463 6.145 4.824 860 HA LEU 482 HA LEU 482 16.543 8.310 3.158 861 HB2 LEU 482 HB2 LEU 482 16.254 5.596 2.661 862 HB3 LEU 482 HB1 LEU 482 14.911 6.316 1.800 863 HG LEU 482 HG LEU 482 16.843 6.023 0.341 864 HD11 LEU 482 HD11 LEU 482 16.988 8.291 -0.544 865 HD12 LEU 482 HD12 LEU 482 16.299 8.926 0.950 866 HD13 LEU 482 HD13 LEU 482 15.330 7.887 -0.094 867 HD21 LEU 482 HD21 LEU 482 18.572 6.213 2.098 868 HD22 LEU 482 HD22 LEU 482 18.278 7.951 2.162 869 HD23 LEU 482 HD23 LEU 482 18.908 7.216 0.689 870 H THR 483 HN THR 483 13.465 6.618 3.823 871 HA THR 483 HA THR 483 11.975 8.805 2.624 872 HB THR 483 HB THR 483 9.986 7.421 3.090 873 HG1 THR 483 HG1 THR 483 11.256 5.128 3.775 874 HG21 THR 483 HG21 THR 483 10.546 5.560 1.589 875 HG22 THR 483 HG22 THR 483 12.263 5.908 1.801 876 HG23 THR 483 HG23 THR 483 11.214 7.082 1.006 877 H ARG 484 HN ARG 484 12.618 7.452 5.798 878 HA ARG 484 HA ARG 484 12.302 8.227 7.908 879 HB2 ARG 484 HB2 ARG 484 11.626 10.873 6.608 880 HB3 ARG 484 HB1 ARG 484 12.076 10.619 8.286 881 HG2 ARG 484 HG2 ARG 484 14.270 10.549 7.820 882 HG3 ARG 484 HG1 ARG 484 14.029 9.643 6.323 883 HD2 ARG 484 HD2 ARG 484 13.265 11.708 5.228 884 HD3 ARG 484 HD1 ARG 484 13.566 12.595 6.720 885 HE ARG 484 HE ARG 484 15.953 11.894 6.424 886 HH11 ARG 484 HH11 ARG 484 13.797 12.191 3.679 887 HH12 ARG 484 HH12 ARG 484 15.076 12.483 2.548 888 HH21 ARG 484 HH21 ARG 484 17.640 12.301 4.928 889 HH22 ARG 484 HH22 ARG 484 17.250 12.554 3.255 890 H SER 485 HN SER 485 10.062 7.270 6.113 891 HA SER 485 HA SER 485 7.877 8.024 7.909 892 HB2 SER 485 HB2 SER 485 7.368 9.445 6.107 893 HB3 SER 485 HB1 SER 485 7.923 8.279 4.910 894 HG SER 485 HG SER 485 5.649 7.833 6.559 895 H VAL 486 HN VAL 486 7.093 6.225 8.755 896 HA VAL 486 HA VAL 486 7.798 3.641 7.949 897 HB VAL 486 HB VAL 486 5.971 2.869 9.479 898 HG11 VAL 486 HG11 VAL 486 7.791 4.988 10.618 899 HG12 VAL 486 HG12 VAL 486 8.246 3.317 10.288 900 HG13 VAL 486 HG13 VAL 486 7.029 3.674 11.514 901 HG21 VAL 486 HG21 VAL 486 4.409 4.726 9.111 902 HG22 VAL 486 HG22 VAL 486 5.529 5.822 9.918 903 HG23 VAL 486 HG23 VAL 486 4.774 4.510 10.823 904 H GLU 487 HN GLU 487 5.144 5.693 7.027 905 HA GLU 487 HA GLU 487 3.462 3.717 5.913 906 HB2 GLU 487 HB2 GLU 487 3.705 6.605 5.056 907 HB3 GLU 487 HB1 GLU 487 2.319 5.548 4.824 908 HG2 GLU 487 HG2 GLU 487 1.548 6.603 6.642 909 HG3 GLU 487 HG1 GLU 487 2.550 5.434 7.501 910 H ILE 488 HN ILE 488 5.921 5.831 4.457 911 HA ILE 488 HA ILE 488 5.603 4.770 1.838 912 HB ILE 488 HB ILE 488 8.066 6.136 2.931 913 HG12 ILE 488 HG12 ILE 488 5.632 7.366 1.615 914 HG13 ILE 488 HG11 ILE 488 6.033 7.490 3.325 915 HG21 ILE 488 HG21 ILE 488 6.993 5.850 0.123 916 HG22 ILE 488 HG22 ILE 488 8.406 5.027 0.787 917 HG23 ILE 488 HG23 ILE 488 8.420 6.779 0.583 918 HD11 ILE 488 HD11 ILE 488 7.631 8.597 1.028 919 HD12 ILE 488 HD12 ILE 488 8.098 8.682 2.728 920 HD13 ILE 488 HD13 ILE 488 6.645 9.509 2.169 921 H THR 489 HN THR 489 7.791 4.060 4.526 922 HA THR 489 HA THR 489 9.540 2.315 3.269 923 HB THR 489 HB THR 489 8.525 2.174 6.112 924 HG1 THR 489 HG1 THR 489 10.648 3.601 4.851 925 HG21 THR 489 HG21 THR 489 9.641 0.120 5.581 926 HG22 THR 489 HG22 THR 489 10.747 1.105 6.539 927 HG23 THR 489 HG23 THR 489 10.962 0.983 4.793 928 H THR 490 HN THR 490 6.469 1.522 4.914 929 HA THR 490 HA THR 490 6.660 -1.257 4.517 930 HB THR 490 HB THR 490 4.039 -1.049 4.728 931 HG1 THR 490 HG1 THR 490 4.851 1.413 5.903 932 HG21 THR 490 HG21 THR 490 5.598 -1.956 6.414 933 HG22 THR 490 HG22 THR 490 4.287 -1.027 7.139 934 HG23 THR 490 HG23 THR 490 5.894 -0.316 6.992 935 H ASP 491 HN ASP 491 5.007 1.256 2.600 936 HA ASP 491 HA ASP 491 3.960 -0.530 0.666 937 HB2 ASP 491 HB2 ASP 491 3.172 1.816 0.948 938 HB3 ASP 491 HB1 ASP 491 4.699 2.383 0.282 939 H ASN 492 HN ASN 492 6.970 1.244 0.953 940 HA ASN 492 HA ASN 492 8.088 0.731 -1.546 941 HB2 ASN 492 HB2 ASN 492 9.105 1.471 1.130 942 HB3 ASN 492 HB1 ASN 492 10.275 0.705 0.066 943 HD21 ASN 492 HD21 ASN 492 10.675 3.251 0.895 944 HD22 ASN 492 HD22 ASN 492 10.439 4.352 -0.426 945 H ILE 493 HN ILE 493 8.176 -1.182 1.434 946 HA ILE 493 HA ILE 493 9.839 -3.246 0.470 947 HB ILE 493 HB ILE 493 7.666 -3.471 2.569 948 HG12 ILE 493 HG12 ILE 493 10.614 -2.947 2.969 949 HG13 ILE 493 HG11 ILE 493 9.388 -1.685 2.990 950 HG21 ILE 493 HG21 ILE 493 8.969 -5.369 3.403 951 HG22 ILE 493 HG22 ILE 493 10.100 -5.183 2.063 952 HG23 ILE 493 HG23 ILE 493 8.425 -5.637 1.748 953 HD11 ILE 493 HD11 ILE 493 9.638 -3.997 4.898 954 HD12 ILE 493 HD12 ILE 493 8.300 -2.848 4.884 955 HD13 ILE 493 HD13 ILE 493 9.937 -2.293 5.240 956 H LEU 494 HN LEU 494 6.348 -2.773 0.434 957 HA LEU 494 HA LEU 494 5.680 -5.317 -0.622 958 HB2 LEU 494 HB2 LEU 494 4.190 -2.694 -0.568 959 HB3 LEU 494 HB1 LEU 494 3.496 -4.178 -1.191 960 HG LEU 494 HG LEU 494 4.515 -3.904 1.638 961 HD11 LEU 494 HD11 LEU 494 2.232 -3.616 2.331 962 HD12 LEU 494 HD12 LEU 494 1.678 -3.695 0.661 963 HD13 LEU 494 HD13 LEU 494 2.659 -2.332 1.198 964 HD21 LEU 494 HD21 LEU 494 3.926 -6.131 0.167 965 HD22 LEU 494 HD22 LEU 494 2.395 -5.807 1.009 966 HD23 LEU 494 HD23 LEU 494 3.891 -6.028 1.929 967 H GLU 495 HN GLU 495 6.714 -2.323 -2.073 968 HA GLU 495 HA GLU 495 5.908 -3.131 -4.731 969 HB2 GLU 495 HB2 GLU 495 7.432 -0.748 -3.698 970 HB3 GLU 495 HB1 GLU 495 7.172 -1.039 -5.413 971 HG2 GLU 495 HG2 GLU 495 5.133 -0.460 -3.292 972 HG3 GLU 495 HG1 GLU 495 5.482 0.448 -4.763 973 H GLY 496 HN GLY 496 8.919 -2.967 -2.875 974 HA2 GLY 496 HA2 GLY 496 10.389 -4.931 -3.574 975 HA3 GLY 496 HA1 GLY 496 10.283 -4.225 -5.176 976 H ARG 497 HN ARG 497 10.412 -1.903 -2.696 977 HA ARG 497 HA ARG 497 12.879 -0.839 -3.559 978 HB2 ARG 497 HB2 ARG 497 11.283 0.607 -2.515 979 HB3 ARG 497 HB1 ARG 497 11.226 -0.402 -1.080 980 HG2 ARG 497 HG2 ARG 497 12.555 1.235 -0.275 981 HG3 ARG 497 HG1 ARG 497 13.810 0.240 -1.015 982 HD2 ARG 497 HD2 ARG 497 14.056 2.618 -1.584 983 HD3 ARG 497 HD1 ARG 497 13.772 1.607 -3.003 984 HE ARG 497 HE ARG 497 11.489 2.955 -1.772 985 HH11 ARG 497 HH11 ARG 497 13.812 2.800 -4.387 986 HH12 ARG 497 HH12 ARG 497 12.839 3.740 -5.474 987 HH21 ARG 497 HH21 ARG 497 10.213 4.201 -3.190 988 HH22 ARG 497 HH22 ARG 497 10.788 4.533 -4.798 989 H ILE 498 HN ILE 498 11.966 -2.787 -0.772 990 HA ILE 498 HA ILE 498 14.798 -3.154 -0.101 991 HB ILE 498 HB ILE 498 12.316 -3.702 1.544 992 HG12 ILE 498 HG12 ILE 498 14.477 -1.597 1.780 993 HG13 ILE 498 HG11 ILE 498 12.795 -1.323 1.340 994 HG21 ILE 498 HG21 ILE 498 14.014 -5.329 2.082 995 HG22 ILE 498 HG22 ILE 498 13.888 -4.156 3.393 996 HG23 ILE 498 HG23 ILE 498 15.224 -4.058 2.248 997 HD11 ILE 498 HD11 ILE 498 14.005 -1.854 3.994 998 HD12 ILE 498 HD12 ILE 498 12.367 -2.432 3.696 999 HD13 ILE 498 HD13 ILE 498 12.739 -0.717 3.530 1000 H GLN 499 HN GLN 499 15.732 -5.033 -0.574 1001 HA GLN 499 HA GLN 499 14.404 -7.074 -1.968 1002 HB2 GLN 499 HB2 GLN 499 17.098 -6.869 -0.671 1003 HB3 GLN 499 HB1 GLN 499 16.551 -8.401 -1.338 1004 HG2 GLN 499 HG2 GLN 499 16.829 -5.815 -2.850 1005 HG3 GLN 499 HG1 GLN 499 17.937 -7.183 -2.918 1006 HE21 GLN 499 HE21 GLN 499 16.536 -5.980 -5.096 1007 HE22 GLN 499 HE22 GLN 499 15.518 -7.202 -5.784 1008 H VAL 500 HN VAL 500 13.318 -8.796 -1.332 1009 HA VAL 500 HA VAL 500 12.645 -9.179 1.404 1010 HB VAL 500 HB VAL 500 11.332 -11.107 0.599 1011 HG11 VAL 500 HG11 VAL 500 10.383 -8.864 0.455 1012 HG12 VAL 500 HG12 VAL 500 9.822 -9.876 -0.877 1013 HG13 VAL 500 HG13 VAL 500 11.073 -8.667 -1.156 1014 HG21 VAL 500 HG21 VAL 500 12.571 -10.499 -2.088 1015 HG22 VAL 500 HG22 VAL 500 11.287 -11.669 -1.782 1016 HG23 VAL 500 HG23 VAL 500 12.894 -11.924 -1.101 1017 HA PRO 501 HA PRO 501 15.609 -12.205 2.704 1018 HB2 PRO 501 HB2 PRO 501 13.507 -14.087 3.568 1019 HB3 PRO 501 HB1 PRO 501 14.709 -13.222 4.542 1020 HG2 PRO 501 HG2 PRO 501 12.123 -12.585 4.630 1021 HG3 PRO 501 HG1 PRO 501 13.403 -11.363 4.774 1022 HD2 PRO 501 HD2 PRO 501 11.699 -12.037 2.412 1023 HD3 PRO 501 HD1 PRO 501 12.223 -10.448 3.009 1024 H PHE 502 HN PHE 502 16.113 -12.640 0.443 1025 HA PHE 502 HA PHE 502 14.937 -14.955 -0.808 1026 HB2 PHE 502 HB2 PHE 502 15.943 -12.789 -1.906 1027 HB3 PHE 502 HB1 PHE 502 17.465 -13.662 -1.766 1028 HD1 PHE 502 HD1 PHE 502 13.973 -14.444 -2.844 1029 HD2 PHE 502 HD2 PHE 502 18.133 -14.729 -3.671 1030 HE1 PHE 502 HE1 PHE 502 13.467 -15.632 -4.939 1031 HE2 PHE 502 HE2 PHE 502 17.639 -15.919 -5.769 1032 HZ PHE 502 HZ PHE 502 15.302 -16.367 -6.405 1033 HA PRO 503 HA PRO 503 17.791 -17.593 1.428 1034 HB2 PRO 503 HB2 PRO 503 16.803 -19.945 0.446 1035 HB3 PRO 503 HB1 PRO 503 16.064 -19.058 1.792 1036 HG2 PRO 503 HG2 PRO 503 15.251 -19.186 -1.056 1037 HG3 PRO 503 HG1 PRO 503 14.254 -19.099 0.408 1038 HD2 PRO 503 HD2 PRO 503 14.745 -16.961 -1.215 1039 HD3 PRO 503 HD1 PRO 503 14.373 -16.825 0.514 1040 H THR 504 HN THR 504 19.712 -17.177 0.477 1041 HA THR 504 HA THR 504 20.363 -18.779 -1.900 1042 HB THR 504 HB THR 504 20.204 -16.351 -2.476 1043 HG1 THR 504 HG1 THR 504 22.311 -18.017 -2.891 1044 HG21 THR 504 HG21 THR 504 20.906 -15.390 -0.355 1045 HG22 THR 504 HG22 THR 504 21.967 -14.833 -1.649 1046 HG23 THR 504 HG23 THR 504 22.511 -16.095 -0.542 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 -18.455 -11.256 14.957 2 H2 MET 1 HT2 MET 1 -18.180 -12.663 14.058 3 H3 MET 1 HT3 MET 1 -17.624 -11.172 13.488 4 HA MET 1 HA MET 1 -16.709 -12.205 16.080 5 HB2 MET 1 HB2 MET 1 -14.813 -13.273 15.020 6 HB3 MET 1 HB1 MET 1 -16.292 -13.964 14.374 7 HG2 MET 1 HG2 MET 1 -16.057 -12.509 12.393 8 HG3 MET 1 HG1 MET 1 -14.520 -11.934 13.038 9 HE1 MET 1 HE1 MET 1 -13.208 -14.151 10.151 10 HE2 MET 1 HE2 MET 1 -13.159 -12.574 10.939 11 HE3 MET 1 HE3 MET 1 -14.629 -13.105 10.122 12 H GLN 2 HN GLN 2 -14.533 -11.300 16.550 13 HA GLN 2 HA GLN 2 -14.344 -8.579 15.442 14 HB2 GLN 2 HB2 GLN 2 -13.110 -9.597 18.002 15 HB3 GLN 2 HB1 GLN 2 -13.269 -7.925 17.486 16 HG2 GLN 2 HG2 GLN 2 -15.549 -9.759 18.164 17 HG3 GLN 2 HG1 GLN 2 -14.866 -8.540 19.235 18 HE21 GLN 2 HE21 GLN 2 -17.566 -8.869 18.090 19 HE22 GLN 2 HE22 GLN 2 -17.917 -7.362 17.306 20 H ILE 3 HN ILE 3 -12.447 -7.791 14.659 21 HA ILE 3 HA ILE 3 -10.147 -9.635 14.567 22 HB ILE 3 HB ILE 3 -9.581 -8.670 12.329 23 HG12 ILE 3 HG12 ILE 3 -12.452 -7.760 12.201 24 HG13 ILE 3 HG11 ILE 3 -11.153 -6.670 12.673 25 HG21 ILE 3 HG21 ILE 3 -11.218 -10.038 11.076 26 HG22 ILE 3 HG22 ILE 3 -12.162 -10.211 12.556 27 HG23 ILE 3 HG23 ILE 3 -10.528 -10.875 12.467 28 HD11 ILE 3 HD11 ILE 3 -11.267 -8.160 10.060 29 HD12 ILE 3 HD12 ILE 3 -10.087 -6.941 10.538 30 HD13 ILE 3 HD13 ILE 3 -11.773 -6.487 10.299 31 H PHE 4 HN PHE 4 -8.067 -8.582 14.415 32 HA PHE 4 HA PHE 4 -8.148 -5.877 15.581 33 HB2 PHE 4 HB2 PHE 4 -6.073 -8.063 15.852 34 HB3 PHE 4 HB1 PHE 4 -5.875 -6.429 16.480 35 HD1 PHE 4 HD1 PHE 4 -7.719 -5.604 18.108 36 HD2 PHE 4 HD2 PHE 4 -7.016 -9.700 17.183 37 HE1 PHE 4 HE1 PHE 4 -8.855 -6.268 20.188 38 HE2 PHE 4 HE2 PHE 4 -8.152 -10.367 19.259 39 HZ PHE 4 HZ PHE 4 -9.071 -8.653 20.765 40 H VAL 5 HN VAL 5 -7.779 -4.399 14.063 41 HA VAL 5 HA VAL 5 -5.917 -4.999 11.884 42 HB VAL 5 HB VAL 5 -7.702 -2.583 12.249 43 HG11 VAL 5 HG11 VAL 5 -7.272 -2.209 9.856 44 HG12 VAL 5 HG12 VAL 5 -6.146 -3.568 9.860 45 HG13 VAL 5 HG13 VAL 5 -5.797 -2.128 10.820 46 HG21 VAL 5 HG21 VAL 5 -8.131 -5.103 10.649 47 HG22 VAL 5 HG22 VAL 5 -9.106 -3.642 10.492 48 HG23 VAL 5 HG23 VAL 5 -9.090 -4.532 12.015 49 H LYS 6 HN LYS 6 -3.875 -4.416 12.099 50 HA LYS 6 HA LYS 6 -3.167 -2.400 14.094 51 HB2 LYS 6 HB2 LYS 6 -2.086 -4.726 13.948 52 HB3 LYS 6 HB1 LYS 6 -1.246 -4.109 12.532 53 HG2 LYS 6 HG2 LYS 6 -0.556 -2.172 14.129 54 HG3 LYS 6 HG1 LYS 6 -0.951 -3.337 15.394 55 HD2 LYS 6 HD2 LYS 6 0.570 -4.961 14.190 56 HD3 LYS 6 HD1 LYS 6 1.103 -3.594 13.209 57 HE2 LYS 6 HE2 LYS 6 2.685 -3.711 14.919 58 HE3 LYS 6 HE1 LYS 6 1.590 -2.429 15.437 59 HZ1 LYS 6 HZ1 LYS 6 0.734 -3.712 17.103 60 HZ2 LYS 6 HZ2 LYS 6 2.319 -4.317 17.072 61 HZ3 LYS 6 HZ3 LYS 6 1.065 -5.176 16.321 62 H THR 7 HN THR 7 -2.111 -0.544 13.609 63 HA THR 7 HA THR 7 -1.730 0.060 10.755 64 HB THR 7 HB THR 7 -2.108 2.475 11.461 65 HG1 THR 7 HG1 THR 7 -3.501 1.394 13.673 66 HG21 THR 7 HG21 THR 7 -4.447 0.590 11.782 67 HG22 THR 7 HG22 THR 7 -3.800 1.160 10.243 68 HG23 THR 7 HG23 THR 7 -4.530 2.303 11.368 69 H LEU 8 HN LEU 8 -0.119 1.857 10.419 70 HA LEU 8 HA LEU 8 2.350 1.154 11.620 71 HB2 LEU 8 HB2 LEU 8 1.575 3.458 9.836 72 HB3 LEU 8 HB1 LEU 8 3.225 3.110 10.321 73 HG LEU 8 HG LEU 8 1.521 1.104 8.861 74 HD11 LEU 8 HD11 LEU 8 1.715 3.118 7.488 75 HD12 LEU 8 HD12 LEU 8 2.653 1.783 6.815 76 HD13 LEU 8 HD13 LEU 8 3.467 3.084 7.686 77 HD21 LEU 8 HD21 LEU 8 3.647 0.063 8.374 78 HD22 LEU 8 HD22 LEU 8 3.470 0.275 10.116 79 HD23 LEU 8 HD23 LEU 8 4.503 1.366 9.195 80 H THR 9 HN THR 9 -0.094 3.413 12.457 81 HA THR 9 HA THR 9 1.644 5.078 14.057 82 HB THR 9 HB THR 9 -0.932 5.695 14.803 83 HG1 THR 9 HG1 THR 9 -2.142 5.617 12.862 84 HG21 THR 9 HG21 THR 9 0.676 7.355 14.164 85 HG22 THR 9 HG22 THR 9 -0.728 7.534 13.112 86 HG23 THR 9 HG23 THR 9 0.731 6.743 12.511 87 H GLY 10 HN GLY 10 0.437 2.050 14.429 88 HA2 GLY 10 HA2 GLY 10 0.588 0.684 16.304 89 HA3 GLY 10 HA1 GLY 10 0.857 2.112 17.293 90 H LYS 11 HN LYS 11 -1.775 2.712 15.404 91 HA LYS 11 HA LYS 11 -3.574 2.474 17.626 92 HB2 LYS 11 HB2 LYS 11 -3.666 4.362 16.025 93 HB3 LYS 11 HB1 LYS 11 -4.132 3.245 14.754 94 HG2 LYS 11 HG2 LYS 11 -6.168 2.694 16.053 95 HG3 LYS 11 HG1 LYS 11 -5.714 3.939 17.218 96 HD2 LYS 11 HD2 LYS 11 -5.802 5.629 15.460 97 HD3 LYS 11 HD1 LYS 11 -6.205 4.385 14.275 98 HE2 LYS 11 HE2 LYS 11 -8.288 3.924 15.418 99 HE3 LYS 11 HE1 LYS 11 -7.876 5.071 16.690 100 HZ1 LYS 11 HZ1 LYS 11 -8.388 5.701 13.831 101 HZ2 LYS 11 HZ2 LYS 11 -7.880 6.832 14.988 102 HZ3 LYS 11 HZ3 LYS 11 -9.388 6.079 15.148 103 H THR 12 HN THR 12 -4.107 0.437 18.147 104 HA THR 12 HA THR 12 -4.661 -1.564 16.147 105 HB THR 12 HB THR 12 -5.253 -1.796 19.094 106 HG1 THR 12 HG1 THR 12 -3.155 -1.322 19.236 107 HG21 THR 12 HG21 THR 12 -6.058 -3.609 17.647 108 HG22 THR 12 HG22 THR 12 -4.756 -4.164 18.700 109 HG23 THR 12 HG23 THR 12 -4.430 -3.817 17.002 110 H ILE 13 HN ILE 13 -6.494 -1.429 15.038 111 HA ILE 13 HA ILE 13 -8.913 -0.407 16.352 112 HB ILE 13 HB ILE 13 -8.596 -0.946 13.406 113 HG12 ILE 13 HG12 ILE 13 -8.224 1.769 14.644 114 HG13 ILE 13 HG11 ILE 13 -6.858 0.676 14.450 115 HG21 ILE 13 HG21 ILE 13 -10.426 0.873 14.971 116 HG22 ILE 13 HG22 ILE 13 -10.875 -0.663 14.232 117 HG23 ILE 13 HG23 ILE 13 -10.404 0.699 13.215 118 HD11 ILE 13 HD11 ILE 13 -7.231 0.614 12.050 119 HD12 ILE 13 HD12 ILE 13 -7.023 2.271 12.614 120 HD13 ILE 13 HD13 ILE 13 -8.634 1.664 12.231 121 H THR 14 HN THR 14 -10.368 -1.793 17.024 122 HA THR 14 HA THR 14 -10.342 -4.535 16.010 123 HB THR 14 HB THR 14 -12.080 -3.503 18.245 124 HG1 THR 14 HG1 THR 14 -9.344 -3.730 18.150 125 HG21 THR 14 HG21 THR 14 -12.507 -5.777 17.372 126 HG22 THR 14 HG22 THR 14 -11.929 -5.808 19.038 127 HG23 THR 14 HG23 THR 14 -10.834 -6.208 17.715 128 H LEU 15 HN LEU 15 -11.702 -5.054 14.411 129 HA LEU 15 HA LEU 15 -14.133 -3.419 14.062 130 HB2 LEU 15 HB2 LEU 15 -12.550 -4.948 11.997 131 HB3 LEU 15 HB1 LEU 15 -14.047 -4.092 11.682 132 HG LEU 15 HG LEU 15 -11.477 -2.800 12.597 133 HD11 LEU 15 HD11 LEU 15 -11.327 -1.942 10.328 134 HD12 LEU 15 HD12 LEU 15 -12.781 -2.833 9.881 135 HD13 LEU 15 HD13 LEU 15 -11.317 -3.705 10.330 136 HD21 LEU 15 HD21 LEU 15 -13.412 -1.553 13.333 137 HD22 LEU 15 HD22 LEU 15 -14.115 -1.630 11.716 138 HD23 LEU 15 HD23 LEU 15 -12.637 -0.710 11.995 139 H GLU 16 HN GLU 16 -16.057 -4.420 13.510 140 HA GLU 16 HA GLU 16 -16.243 -7.226 14.309 141 HB2 GLU 16 HB2 GLU 16 -17.708 -5.516 15.412 142 HB3 GLU 16 HB1 GLU 16 -18.473 -5.225 13.855 143 HG2 GLU 16 HG2 GLU 16 -19.490 -7.314 13.824 144 HG3 GLU 16 HG1 GLU 16 -18.391 -7.972 15.035 145 H VAL 17 HN VAL 17 -16.129 -8.639 12.713 146 HA VAL 17 HA VAL 17 -17.620 -8.129 10.243 147 HB VAL 17 HB VAL 17 -15.735 -9.156 8.933 148 HG11 VAL 17 HG11 VAL 17 -14.333 -7.092 8.920 149 HG12 VAL 17 HG12 VAL 17 -15.246 -6.525 10.319 150 HG13 VAL 17 HG13 VAL 17 -16.064 -6.793 8.779 151 HG21 VAL 17 HG21 VAL 17 -14.506 -10.249 10.667 152 HG22 VAL 17 HG22 VAL 17 -14.259 -8.728 11.526 153 HG23 VAL 17 HG23 VAL 17 -13.469 -9.001 9.973 154 H GLU 18 HN GLU 18 -17.380 -10.283 8.862 155 HA GLU 18 HA GLU 18 -17.587 -12.626 10.605 156 HB2 GLU 18 HB2 GLU 18 -19.673 -11.616 8.671 157 HB3 GLU 18 HB1 GLU 18 -19.591 -13.312 9.134 158 HG2 GLU 18 HG2 GLU 18 -19.823 -11.078 11.129 159 HG3 GLU 18 HG1 GLU 18 -21.219 -11.888 10.418 160 HA PRO 19 HA PRO 19 -15.139 -14.715 7.583 161 HB2 PRO 19 HB2 PRO 19 -17.258 -16.811 7.437 162 HB3 PRO 19 HB1 PRO 19 -15.523 -16.981 7.769 163 HG2 PRO 19 HG2 PRO 19 -17.290 -17.208 9.721 164 HG3 PRO 19 HG1 PRO 19 -15.741 -16.382 9.984 165 HD2 PRO 19 HD2 PRO 19 -18.461 -15.225 9.631 166 HD3 PRO 19 HD1 PRO 19 -17.123 -14.675 10.659 167 H SER 20 HN SER 20 -18.588 -14.483 6.900 168 HA SER 20 HA SER 20 -18.367 -14.955 4.097 169 HB2 SER 20 HB2 SER 20 -20.740 -13.484 4.905 170 HB3 SER 20 HB1 SER 20 -20.601 -15.120 4.256 171 HG SER 20 HG SER 20 -21.323 -14.581 6.635 172 H ASP 21 HN ASP 21 -17.431 -12.317 5.910 173 HA ASP 21 HA ASP 21 -18.352 -10.223 4.163 174 HB2 ASP 21 HB2 ASP 21 -17.618 -10.124 6.707 175 HB3 ASP 21 HB1 ASP 21 -16.030 -9.833 6.009 176 H THR 22 HN THR 22 -16.992 -8.895 2.836 177 HA THR 22 HA THR 22 -14.829 -10.445 1.606 178 HB THR 22 HB THR 22 -15.090 -8.676 -0.242 179 HG1 THR 22 HG1 THR 22 -17.637 -8.168 0.088 180 HG21 THR 22 HG21 THR 22 -17.363 -10.586 0.315 181 HG22 THR 22 HG22 THR 22 -15.840 -10.996 -0.475 182 HG23 THR 22 HG23 THR 22 -16.966 -9.884 -1.252 183 H ILE 23 HN ILE 23 -12.852 -9.469 1.061 184 HA ILE 23 HA ILE 23 -11.711 -7.826 3.021 185 HB ILE 23 HB ILE 23 -10.731 -8.305 0.199 186 HG12 ILE 23 HG12 ILE 23 -11.082 -10.412 1.365 187 HG13 ILE 23 HG11 ILE 23 -9.358 -10.095 1.225 188 HG21 ILE 23 HG21 ILE 23 -8.506 -7.806 1.105 189 HG22 ILE 23 HG22 ILE 23 -9.239 -7.392 2.655 190 HG23 ILE 23 HG23 ILE 23 -9.597 -6.427 1.224 191 HD11 ILE 23 HD11 ILE 23 -11.071 -9.778 3.675 192 HD12 ILE 23 HD12 ILE 23 -9.389 -9.258 3.565 193 HD13 ILE 23 HD13 ILE 23 -9.798 -10.965 3.396 194 H GLU 24 HN GLU 24 -13.136 -7.058 -0.099 195 HA GLU 24 HA GLU 24 -12.302 -4.363 -0.241 196 HB2 GLU 24 HB2 GLU 24 -13.308 -5.897 -2.072 197 HB3 GLU 24 HB1 GLU 24 -14.863 -5.372 -1.442 198 HG2 GLU 24 HG2 GLU 24 -13.440 -3.019 -1.776 199 HG3 GLU 24 HG1 GLU 24 -13.008 -3.996 -3.179 200 H ASN 25 HN ASN 25 -14.977 -5.958 1.363 201 HA ASN 25 HA ASN 25 -16.433 -3.545 1.900 202 HB2 ASN 25 HB2 ASN 25 -17.424 -5.889 1.837 203 HB3 ASN 25 HB1 ASN 25 -16.675 -6.148 3.410 204 HD21 ASN 25 HD21 ASN 25 -18.511 -6.334 4.586 205 HD22 ASN 25 HD22 ASN 25 -19.640 -5.032 4.818 206 H VAL 26 HN VAL 26 -14.054 -5.510 3.568 207 HA VAL 26 HA VAL 26 -14.181 -4.308 6.097 208 HB VAL 26 HB VAL 26 -11.745 -5.462 4.719 209 HG11 VAL 26 HG11 VAL 26 -11.174 -4.090 6.666 210 HG12 VAL 26 HG12 VAL 26 -10.854 -5.799 6.960 211 HG13 VAL 26 HG13 VAL 26 -12.284 -5.036 7.657 212 HG21 VAL 26 HG21 VAL 26 -13.597 -7.049 4.812 213 HG22 VAL 26 HG22 VAL 26 -13.752 -6.781 6.548 214 HG23 VAL 26 HG23 VAL 26 -12.295 -7.532 5.897 215 H LYS 27 HN LYS 27 -12.454 -3.433 3.163 216 HA LYS 27 HA LYS 27 -10.895 -1.341 4.197 217 HB2 LYS 27 HB2 LYS 27 -12.025 -1.794 1.436 218 HB3 LYS 27 HB1 LYS 27 -10.900 -0.501 1.819 219 HG2 LYS 27 HG2 LYS 27 -9.264 -2.200 2.560 220 HG3 LYS 27 HG1 LYS 27 -10.385 -3.455 2.030 221 HD2 LYS 27 HD2 LYS 27 -10.306 -2.584 -0.246 222 HD3 LYS 27 HD1 LYS 27 -9.214 -1.300 0.274 223 HE2 LYS 27 HE2 LYS 27 -7.548 -2.981 0.910 224 HE3 LYS 27 HE1 LYS 27 -8.641 -4.259 0.380 225 HZ1 LYS 27 HZ1 LYS 27 -8.595 -3.156 -1.862 226 HZ2 LYS 27 HZ2 LYS 27 -7.152 -3.897 -1.379 227 HZ3 LYS 27 HZ3 LYS 27 -7.301 -2.216 -1.291 228 H ALA 28 HN ALA 28 -14.203 -1.450 3.030 229 HA ALA 28 HA ALA 28 -14.663 1.342 2.969 230 HB1 ALA 28 HB1 ALA 28 -16.107 -0.226 1.781 231 HB2 ALA 28 HB2 ALA 28 -17.044 0.745 2.918 232 HB3 ALA 28 HB3 ALA 28 -16.629 -0.922 3.315 233 H LYS 29 HN LYS 29 -15.001 -1.133 5.454 234 HA LYS 29 HA LYS 29 -16.285 0.524 7.373 235 HB2 LYS 29 HB2 LYS 29 -14.651 -1.995 7.740 236 HB3 LYS 29 HB1 LYS 29 -15.633 -1.247 8.993 237 HG2 LYS 29 HG2 LYS 29 -17.638 -1.626 7.705 238 HG3 LYS 29 HG1 LYS 29 -16.688 -2.273 6.369 239 HD2 LYS 29 HD2 LYS 29 -15.952 -4.122 7.786 240 HD3 LYS 29 HD1 LYS 29 -16.885 -3.465 9.134 241 HE2 LYS 29 HE2 LYS 29 -18.939 -3.712 7.820 242 HE3 LYS 29 HE1 LYS 29 -18.007 -4.392 6.491 243 HZ1 LYS 29 HZ1 LYS 29 -17.636 -6.343 7.622 244 HZ2 LYS 29 HZ2 LYS 29 -19.199 -5.944 8.146 245 HZ3 LYS 29 HZ3 LYS 29 -17.877 -5.638 9.150 246 H ILE 30 HN ILE 30 -12.936 -0.166 6.583 247 HA ILE 30 HA ILE 30 -11.816 1.158 8.839 248 HB ILE 30 HB ILE 30 -10.602 0.538 6.138 249 HG12 ILE 30 HG12 ILE 30 -10.243 -0.851 8.800 250 HG13 ILE 30 HG11 ILE 30 -11.322 -1.412 7.527 251 HG21 ILE 30 HG21 ILE 30 -9.417 2.382 7.219 252 HG22 ILE 30 HG22 ILE 30 -8.430 0.920 7.192 253 HG23 ILE 30 HG23 ILE 30 -9.234 1.413 8.683 254 HD11 ILE 30 HD11 ILE 30 -9.258 -2.660 7.506 255 HD12 ILE 30 HD12 ILE 30 -8.328 -1.170 7.353 256 HD13 ILE 30 HD13 ILE 30 -9.389 -1.686 6.042 257 H GLN 31 HN GLN 31 -12.718 2.129 5.576 258 HA GLN 31 HA GLN 31 -11.614 4.749 5.733 259 HB2 GLN 31 HB2 GLN 31 -12.248 3.473 3.612 260 HB3 GLN 31 HB1 GLN 31 -13.912 3.932 3.962 261 HG2 GLN 31 HG2 GLN 31 -12.809 6.335 4.130 262 HG3 GLN 31 HG1 GLN 31 -11.636 5.590 3.048 263 HE21 GLN 31 HE21 GLN 31 -13.591 7.728 2.626 264 HE22 GLN 31 HE22 GLN 31 -14.550 7.223 1.278 265 H ASP 32 HN ASP 32 -14.605 3.304 6.748 266 HA ASP 32 HA ASP 32 -16.129 5.677 7.017 267 HB2 ASP 32 HB2 ASP 32 -17.219 3.510 7.004 268 HB3 ASP 32 HB1 ASP 32 -16.325 3.012 8.434 269 H LYS 33 HN LYS 33 -13.879 3.987 9.113 270 HA LYS 33 HA LYS 33 -14.375 5.836 11.301 271 HB2 LYS 33 HB2 LYS 33 -12.519 3.461 11.090 272 HB3 LYS 33 HB1 LYS 33 -12.733 4.438 12.536 273 HG2 LYS 33 HG2 LYS 33 -15.199 3.838 12.379 274 HG3 LYS 33 HG1 LYS 33 -14.708 2.610 11.212 275 HD2 LYS 33 HD2 LYS 33 -13.082 1.776 12.961 276 HD3 LYS 33 HD1 LYS 33 -13.889 2.854 14.098 277 HE2 LYS 33 HE2 LYS 33 -15.241 0.659 12.537 278 HE3 LYS 33 HE1 LYS 33 -14.730 0.538 14.217 279 HZ1 LYS 33 HZ1 LYS 33 -16.209 2.490 14.653 280 HZ2 LYS 33 HZ2 LYS 33 -17.011 1.061 14.229 281 HZ3 LYS 33 HZ3 LYS 33 -16.825 2.294 13.089 282 H GLU 34 HN GLU 34 -11.418 4.683 9.659 283 HA GLU 34 HA GLU 34 -9.893 6.898 10.626 284 HB2 GLU 34 HB2 GLU 34 -9.168 4.898 8.485 285 HB3 GLU 34 HB1 GLU 34 -8.058 5.944 9.356 286 HG2 GLU 34 HG2 GLU 34 -9.633 3.628 10.436 287 HG3 GLU 34 HG1 GLU 34 -7.882 3.783 10.305 288 H GLY 35 HN GLY 35 -11.367 6.080 7.522 289 HA2 GLY 35 HA2 GLY 35 -12.155 7.737 6.017 290 HA3 GLY 35 HA1 GLY 35 -11.023 8.880 6.718 291 H ILE 36 HN ILE 36 -9.120 6.360 6.431 292 HA ILE 36 HA ILE 36 -7.702 7.325 4.210 293 HB ILE 36 HB ILE 36 -7.514 4.565 5.432 294 HG12 ILE 36 HG12 ILE 36 -5.918 7.038 6.126 295 HG13 ILE 36 HG11 ILE 36 -7.305 6.481 7.055 296 HG21 ILE 36 HG21 ILE 36 -5.508 6.172 3.848 297 HG22 ILE 36 HG22 ILE 36 -6.392 4.760 3.271 298 HG23 ILE 36 HG23 ILE 36 -5.219 4.591 4.577 299 HD11 ILE 36 HD11 ILE 36 -5.239 5.793 8.099 300 HD12 ILE 36 HD12 ILE 36 -4.736 4.977 6.618 301 HD13 ILE 36 HD13 ILE 36 -6.130 4.386 7.522 302 HA PRO 37 HA PRO 37 -10.200 5.747 0.847 303 HB2 PRO 37 HB2 PRO 37 -7.588 5.958 -0.577 304 HB3 PRO 37 HB1 PRO 37 -9.175 6.617 -1.022 305 HG2 PRO 37 HG2 PRO 37 -7.273 8.195 -0.084 306 HG3 PRO 37 HG1 PRO 37 -8.973 8.432 0.367 307 HD2 PRO 37 HD2 PRO 37 -6.746 7.270 1.968 308 HD3 PRO 37 HD1 PRO 37 -8.122 8.262 2.492 309 HA PRO 38 HA PRO 38 -9.330 1.392 1.034 310 HB2 PRO 38 HB2 PRO 38 -10.745 1.323 -1.583 311 HB3 PRO 38 HB1 PRO 38 -11.102 0.450 -0.080 312 HG2 PRO 38 HG2 PRO 38 -12.623 2.468 -0.867 313 HG3 PRO 38 HG1 PRO 38 -12.238 2.215 0.848 314 HD2 PRO 38 HD2 PRO 38 -11.103 4.206 -1.063 315 HD3 PRO 38 HD1 PRO 38 -11.512 4.389 0.655 316 H ASP 39 HN ASP 39 -8.600 3.333 -1.799 317 HA ASP 39 HA ASP 39 -7.126 1.347 -3.211 318 HB2 ASP 39 HB2 ASP 39 -6.517 4.264 -3.513 319 HB3 ASP 39 HB1 ASP 39 -6.610 3.011 -4.747 320 H GLN 40 HN GLN 40 -6.392 3.426 -0.560 321 HA GLN 40 HA GLN 40 -3.510 2.979 -0.863 322 HB2 GLN 40 HB2 GLN 40 -5.136 4.849 0.851 323 HB3 GLN 40 HB1 GLN 40 -3.427 4.562 1.154 324 HG2 GLN 40 HG2 GLN 40 -2.909 5.328 -1.114 325 HG3 GLN 40 HG1 GLN 40 -4.622 5.652 -1.381 326 HE21 GLN 40 HE21 GLN 40 -2.254 7.422 -1.367 327 HE22 GLN 40 HE22 GLN 40 -2.631 8.676 -0.239 328 H GLN 41 HN GLN 41 -5.964 1.298 0.309 329 HA GLN 41 HA GLN 41 -4.738 0.586 2.863 330 HB2 GLN 41 HB2 GLN 41 -7.385 -0.189 1.638 331 HB3 GLN 41 HB1 GLN 41 -6.804 -0.775 3.189 332 HG2 GLN 41 HG2 GLN 41 -6.722 1.581 3.980 333 HG3 GLN 41 HG1 GLN 41 -7.476 2.064 2.460 334 HE21 GLN 41 HE21 GLN 41 -9.331 2.841 3.458 335 HE22 GLN 41 HE22 GLN 41 -10.506 1.780 4.160 336 H ARG 42 HN ARG 42 -3.004 -0.685 2.379 337 HA ARG 42 HA ARG 42 -3.458 -3.039 0.683 338 HB2 ARG 42 HB2 ARG 42 -0.875 -1.992 1.877 339 HB3 ARG 42 HB1 ARG 42 -1.019 -3.338 0.756 340 HG2 ARG 42 HG2 ARG 42 -2.010 -1.699 -0.890 341 HG3 ARG 42 HG1 ARG 42 -1.516 -0.422 0.222 342 HD2 ARG 42 HD2 ARG 42 0.261 -0.533 -1.267 343 HD3 ARG 42 HD1 ARG 42 0.819 -1.520 0.084 344 HE ARG 42 HE ARG 42 -0.419 -3.274 -1.645 345 HH11 ARG 42 HH11 ARG 42 2.321 -1.067 -1.767 346 HH12 ARG 42 HH12 ARG 42 3.115 -1.942 -3.056 347 HH21 ARG 42 HH21 ARG 42 0.640 -4.415 -3.321 348 HH22 ARG 42 HH22 ARG 42 2.167 -3.845 -3.914 349 H LEU 43 HN LEU 43 -4.485 -4.509 1.887 350 HA LEU 43 HA LEU 43 -3.868 -4.847 4.693 351 HB2 LEU 43 HB2 LEU 43 -5.918 -6.062 2.860 352 HB3 LEU 43 HB1 LEU 43 -5.655 -6.674 4.482 353 HG LEU 43 HG LEU 43 -6.398 -3.809 3.885 354 HD11 LEU 43 HD11 LEU 43 -8.185 -6.085 4.744 355 HD12 LEU 43 HD12 LEU 43 -8.174 -5.336 3.147 356 HD13 LEU 43 HD13 LEU 43 -8.657 -4.396 4.559 357 HD21 LEU 43 HD21 LEU 43 -7.006 -3.804 6.280 358 HD22 LEU 43 HD22 LEU 43 -5.288 -4.093 6.008 359 HD23 LEU 43 HD23 LEU 43 -6.353 -5.437 6.422 360 H ILE 44 HN ILE 44 -2.429 -6.182 5.440 361 HA ILE 44 HA ILE 44 -1.606 -8.456 3.765 362 HB ILE 44 HB ILE 44 -0.009 -6.505 5.356 363 HG12 ILE 44 HG12 ILE 44 1.621 -7.103 3.452 364 HG13 ILE 44 HG11 ILE 44 0.266 -7.974 2.741 365 HG21 ILE 44 HG21 ILE 44 0.490 -8.576 6.525 366 HG22 ILE 44 HG22 ILE 44 1.878 -8.064 5.564 367 HG23 ILE 44 HG23 ILE 44 0.844 -9.375 4.994 368 HD11 ILE 44 HD11 ILE 44 0.322 -5.037 3.398 369 HD12 ILE 44 HD12 ILE 44 -1.023 -5.910 2.667 370 HD13 ILE 44 HD13 ILE 44 0.500 -5.749 1.795 371 H PHE 45 HN PHE 45 -1.593 -10.423 4.631 372 HA PHE 45 HA PHE 45 -2.049 -10.732 7.519 373 HB2 PHE 45 HB2 PHE 45 -4.195 -11.004 6.270 374 HB3 PHE 45 HB1 PHE 45 -3.457 -12.304 5.343 375 HD1 PHE 45 HD1 PHE 45 -3.984 -11.334 8.914 376 HD2 PHE 45 HD2 PHE 45 -3.898 -14.448 6.008 377 HE1 PHE 45 HE1 PHE 45 -4.700 -12.952 10.625 378 HE2 PHE 45 HE2 PHE 45 -4.613 -16.065 7.716 379 HZ PHE 45 HZ PHE 45 -5.014 -15.321 10.027 380 H ALA 46 HN ALA 46 -0.515 -11.967 8.362 381 HA ALA 46 HA ALA 46 1.145 -13.488 8.633 382 HB1 ALA 46 HB1 ALA 46 1.017 -15.603 7.440 383 HB2 ALA 46 HB2 ALA 46 -0.137 -14.909 6.301 384 HB3 ALA 46 HB3 ALA 46 -0.581 -15.106 7.997 385 H GLY 47 HN GLY 47 1.376 -11.202 6.686 386 HA2 GLY 47 HA2 GLY 47 3.333 -10.379 5.699 387 HA3 GLY 47 HA1 GLY 47 3.955 -12.017 5.609 388 H LYS 48 HN LYS 48 0.766 -11.556 4.406 389 HA LYS 48 HA LYS 48 1.755 -11.221 1.668 390 HB2 LYS 48 HB2 LYS 48 0.170 -13.522 2.749 391 HB3 LYS 48 HB1 LYS 48 -0.071 -13.015 1.083 392 HG2 LYS 48 HG2 LYS 48 1.997 -13.708 0.420 393 HG3 LYS 48 HG1 LYS 48 2.713 -13.458 2.013 394 HD2 LYS 48 HD2 LYS 48 0.711 -15.630 1.443 395 HD3 LYS 48 HD1 LYS 48 2.450 -15.864 1.261 396 HE2 LYS 48 HE2 LYS 48 2.539 -14.935 3.701 397 HE3 LYS 48 HE1 LYS 48 0.842 -15.409 3.741 398 HZ1 LYS 48 HZ1 LYS 48 3.117 -17.203 3.096 399 HZ2 LYS 48 HZ2 LYS 48 1.490 -17.656 3.162 400 HZ3 LYS 48 HZ3 LYS 48 2.287 -17.162 4.568 401 H GLN 49 HN GLN 49 0.296 -10.273 0.242 402 HA GLN 49 HA GLN 49 -1.637 -8.554 1.489 403 HB2 GLN 49 HB2 GLN 49 -0.063 -8.269 -0.675 404 HB3 GLN 49 HB1 GLN 49 -1.556 -8.758 -1.458 405 HG2 GLN 49 HG2 GLN 49 -2.725 -6.925 -0.279 406 HG3 GLN 49 HG1 GLN 49 -1.177 -6.403 0.377 407 HE21 GLN 49 HE21 GLN 49 -1.642 -7.668 -2.856 408 HE22 GLN 49 HE22 GLN 49 -1.312 -6.190 -3.686 409 H LEU 50 HN LEU 50 -3.832 -8.447 1.097 410 HA LEU 50 HA LEU 50 -5.062 -10.973 0.234 411 HB2 LEU 50 HB2 LEU 50 -6.430 -8.725 1.703 412 HB3 LEU 50 HB1 LEU 50 -6.956 -10.388 1.547 413 HG LEU 50 HG LEU 50 -4.595 -9.432 3.160 414 HD11 LEU 50 HD11 LEU 50 -7.257 -10.526 4.055 415 HD12 LEU 50 HD12 LEU 50 -6.777 -8.829 4.115 416 HD13 LEU 50 HD13 LEU 50 -5.923 -10.023 5.094 417 HD21 LEU 50 HD21 LEU 50 -5.665 -12.158 2.542 418 HD22 LEU 50 HD22 LEU 50 -4.807 -11.841 4.047 419 HD23 LEU 50 HD23 LEU 50 -3.999 -11.576 2.503 420 H GLU 51 HN GLU 51 -6.751 -10.965 -1.286 421 HA GLU 51 HA GLU 51 -6.703 -8.657 -3.068 422 HB2 GLU 51 HB2 GLU 51 -7.874 -11.425 -3.366 423 HB3 GLU 51 HB1 GLU 51 -8.055 -10.161 -4.575 424 HG2 GLU 51 HG2 GLU 51 -5.522 -10.036 -4.610 425 HG3 GLU 51 HG1 GLU 51 -5.544 -11.537 -3.685 426 H ASP 52 HN ASP 52 -8.469 -7.456 -3.649 427 HA ASP 52 HA ASP 52 -10.418 -6.963 -1.678 428 HB2 ASP 52 HB2 ASP 52 -10.240 -6.104 -4.569 429 HB3 ASP 52 HB1 ASP 52 -11.487 -5.532 -3.470 430 H GLY 53 HN GLY 53 -10.403 -9.011 -4.489 431 HA2 GLY 53 HA2 GLY 53 -13.283 -9.438 -4.354 432 HA3 GLY 53 HA1 GLY 53 -12.186 -10.105 -5.551 433 H ARG 54 HN ARG 54 -11.655 -10.317 -2.086 434 HA ARG 54 HA ARG 54 -12.337 -13.177 -2.195 435 HB2 ARG 54 HB2 ARG 54 -9.890 -11.919 -0.946 436 HB3 ARG 54 HB1 ARG 54 -10.394 -13.578 -0.654 437 HG2 ARG 54 HG2 ARG 54 -9.700 -12.445 -3.353 438 HG3 ARG 54 HG1 ARG 54 -8.603 -13.382 -2.334 439 HD2 ARG 54 HD2 ARG 54 -10.147 -15.278 -2.426 440 HD3 ARG 54 HD1 ARG 54 -11.246 -14.338 -3.437 441 HE ARG 54 HE ARG 54 -8.616 -15.380 -4.227 442 HH11 ARG 54 HH11 ARG 54 -11.648 -13.829 -5.073 443 HH12 ARG 54 HH12 ARG 54 -11.407 -14.024 -6.779 444 HH21 ARG 54 HH21 ARG 54 -8.300 -15.623 -6.456 445 HH22 ARG 54 HH22 ARG 54 -9.497 -15.040 -7.569 446 H THR 55 HN THR 55 -12.495 -14.125 0.038 447 HA THR 55 HA THR 55 -13.882 -12.218 1.805 448 HB THR 55 HB THR 55 -14.965 -14.314 2.752 449 HG1 THR 55 HG1 THR 55 -13.590 -15.394 0.510 450 HG21 THR 55 HG21 THR 55 -15.462 -13.491 -0.107 451 HG22 THR 55 HG22 THR 55 -16.258 -12.879 1.345 452 HG23 THR 55 HG23 THR 55 -16.544 -14.535 0.813 453 H LEU 56 HN LEU 56 -13.861 -13.056 4.169 454 HA LEU 56 HA LEU 56 -11.149 -13.120 5.011 455 HB2 LEU 56 HB2 LEU 56 -13.718 -13.532 6.532 456 HB3 LEU 56 HB1 LEU 56 -12.140 -13.419 7.290 457 HG LEU 56 HG LEU 56 -13.372 -11.229 5.613 458 HD11 LEU 56 HD11 LEU 56 -13.240 -11.512 8.608 459 HD12 LEU 56 HD12 LEU 56 -14.696 -11.585 7.614 460 HD13 LEU 56 HD13 LEU 56 -13.780 -10.081 7.729 461 HD21 LEU 56 HD21 LEU 56 -11.622 -9.838 6.662 462 HD22 LEU 56 HD22 LEU 56 -10.953 -11.127 5.662 463 HD23 LEU 56 HD23 LEU 56 -10.956 -11.285 7.417 464 H SER 57 HN SER 57 -13.646 -15.554 4.629 465 HA SER 57 HA SER 57 -12.260 -17.637 5.966 466 HB2 SER 57 HB2 SER 57 -13.939 -18.930 4.237 467 HB3 SER 57 HB1 SER 57 -14.420 -18.295 5.814 468 HG SER 57 HG SER 57 -15.142 -17.480 3.320 469 H ASP 58 HN ASP 58 -11.807 -16.138 2.962 470 HA ASP 58 HA ASP 58 -10.813 -18.321 1.437 471 HB2 ASP 58 HB2 ASP 58 -10.739 -15.356 1.216 472 HB3 ASP 58 HB1 ASP 58 -9.528 -16.257 0.311 473 H TYR 59 HN TYR 59 -9.446 -16.179 3.792 474 HA TYR 59 HA TYR 59 -6.804 -17.411 3.395 475 HB2 TYR 59 HB2 TYR 59 -7.488 -14.792 4.754 476 HB3 TYR 59 HB1 TYR 59 -5.867 -15.434 4.507 477 HD1 TYR 59 HD1 TYR 59 -4.913 -15.535 2.230 478 HD2 TYR 59 HD2 TYR 59 -8.672 -13.696 2.985 479 HE1 TYR 59 HE1 TYR 59 -4.802 -14.421 0.040 480 HE2 TYR 59 HE2 TYR 59 -8.577 -12.580 0.795 481 HH TYR 59 HH TYR 59 -6.305 -13.440 -1.610 482 H ASN 60 HN ASN 60 -9.346 -18.105 5.010 483 HA ASN 60 HA ASN 60 -9.885 -19.148 6.946 484 HB2 ASN 60 HB2 ASN 60 -7.775 -20.429 6.227 485 HB3 ASN 60 HB1 ASN 60 -6.943 -19.515 7.483 486 HD21 ASN 60 HD21 ASN 60 -6.506 -21.324 8.727 487 HD22 ASN 60 HD22 ASN 60 -7.735 -22.197 9.572 488 H ILE 61 HN ILE 61 -9.598 -16.323 7.024 489 HA ILE 61 HA ILE 61 -8.268 -15.606 9.471 490 HB ILE 61 HB ILE 61 -10.170 -14.037 7.718 491 HG12 ILE 61 HG12 ILE 61 -7.179 -13.766 8.085 492 HG13 ILE 61 HG11 ILE 61 -7.935 -14.633 6.755 493 HG21 ILE 61 HG21 ILE 61 -9.422 -12.054 8.980 494 HG22 ILE 61 HG22 ILE 61 -8.561 -13.115 10.094 495 HG23 ILE 61 HG23 ILE 61 -10.319 -13.198 9.980 496 HD11 ILE 61 HD11 ILE 61 -8.338 -11.711 7.335 497 HD12 ILE 61 HD12 ILE 61 -8.934 -12.606 5.938 498 HD13 ILE 61 HD13 ILE 61 -7.200 -12.360 6.154 499 H GLN 62 HN GLN 62 -9.052 -16.184 11.357 500 HA GLN 62 HA GLN 62 -11.952 -16.461 11.704 501 HB2 GLN 62 HB2 GLN 62 -9.641 -17.522 13.343 502 HB3 GLN 62 HB1 GLN 62 -11.335 -17.724 13.769 503 HG2 GLN 62 HG2 GLN 62 -11.620 -19.400 12.331 504 HG3 GLN 62 HG1 GLN 62 -10.720 -18.580 11.057 505 HE21 GLN 62 HE21 GLN 62 -8.549 -18.969 10.811 506 HE22 GLN 62 HE22 GLN 62 -7.724 -20.236 11.656 507 H LYS 63 HN LYS 63 -12.024 -16.242 14.496 508 HA LYS 63 HA LYS 63 -12.124 -13.405 14.770 509 HB2 LYS 63 HB2 LYS 63 -12.934 -13.865 17.048 510 HB3 LYS 63 HB1 LYS 63 -13.807 -14.792 15.837 511 HG2 LYS 63 HG2 LYS 63 -12.647 -16.794 16.422 512 HG3 LYS 63 HG1 LYS 63 -11.543 -15.905 17.478 513 HD2 LYS 63 HD2 LYS 63 -13.326 -15.367 18.984 514 HD3 LYS 63 HD1 LYS 63 -14.526 -16.047 17.885 515 HE2 LYS 63 HE2 LYS 63 -13.561 -18.265 18.201 516 HE3 LYS 63 HE1 LYS 63 -12.334 -17.587 19.266 517 HZ1 LYS 63 HZ1 LYS 63 -13.936 -17.078 20.886 518 HZ2 LYS 63 HZ2 LYS 63 -14.312 -18.647 20.375 519 HZ3 LYS 63 HZ3 LYS 63 -15.228 -17.340 19.826 520 H GLU 64 HN GLU 64 -11.023 -12.093 16.204 521 HA GLU 64 HA GLU 64 -9.287 -11.237 17.356 522 HB2 GLU 64 HB2 GLU 64 -8.937 -14.118 18.145 523 HB3 GLU 64 HB1 GLU 64 -7.875 -12.845 18.737 524 HG2 GLU 64 HG2 GLU 64 -9.919 -11.664 19.576 525 HG3 GLU 64 HG1 GLU 64 -10.835 -13.113 19.168 526 H SER 65 HN SER 65 -8.975 -12.439 14.549 527 HA SER 65 HA SER 65 -6.158 -13.000 14.400 528 HB2 SER 65 HB2 SER 65 -8.099 -12.407 12.152 529 HB3 SER 65 HB1 SER 65 -6.509 -13.157 11.999 530 HG SER 65 HG SER 65 -8.915 -14.248 12.753 531 H THR 66 HN THR 66 -4.550 -11.656 13.633 532 HA THR 66 HA THR 66 -5.186 -8.806 13.750 533 HB THR 66 HB THR 66 -2.406 -9.934 13.598 534 HG1 THR 66 HG1 THR 66 -4.276 -10.281 15.593 535 HG21 THR 66 HG21 THR 66 -2.764 -7.483 13.457 536 HG22 THR 66 HG22 THR 66 -1.853 -7.954 14.893 537 HG23 THR 66 HG23 THR 66 -3.559 -7.533 15.029 538 H LEU 67 HN LEU 67 -5.213 -7.573 12.015 539 HA LEU 67 HA LEU 67 -4.049 -8.603 9.511 540 HB2 LEU 67 HB2 LEU 67 -6.472 -6.887 10.019 541 HB3 LEU 67 HB1 LEU 67 -5.701 -6.944 8.448 542 HG LEU 67 HG LEU 67 -6.062 -9.530 8.677 543 HD11 LEU 67 HD11 LEU 67 -8.064 -10.119 9.912 544 HD12 LEU 67 HD12 LEU 67 -8.214 -8.462 10.495 545 HD13 LEU 67 HD13 LEU 67 -6.844 -9.455 10.997 546 HD21 LEU 67 HD21 LEU 67 -8.303 -7.600 8.097 547 HD22 LEU 67 HD22 LEU 67 -8.250 -9.291 7.595 548 HD23 LEU 67 HD23 LEU 67 -7.069 -8.144 6.961 549 H HIS 68 HN HIS 68 -2.589 -7.349 8.471 550 HA HIS 68 HA HIS 68 -1.730 -4.930 9.859 551 HB2 HIS 68 HB2 HIS 68 -0.388 -6.445 7.610 552 HB3 HIS 68 HB1 HIS 68 0.319 -5.124 8.534 553 HD2 HIS 68 HD2 HIS 68 0.403 -5.864 11.442 554 HE1 HIS 68 HE1 HIS 68 1.202 -9.871 10.350 555 HE2 HIS 68 HE2 HIS 68 1.470 -8.115 12.153 556 H LEU 69 HN LEU 69 -2.468 -3.040 9.203 557 HA LEU 69 HA LEU 69 -3.451 -2.743 6.473 558 HB2 LEU 69 HB2 LEU 69 -4.859 -1.963 8.331 559 HB3 LEU 69 HB1 LEU 69 -3.594 -0.856 8.827 560 HG LEU 69 HG LEU 69 -3.843 0.376 6.709 561 HD11 LEU 69 HD11 LEU 69 -5.881 -0.106 5.337 562 HD12 LEU 69 HD12 LEU 69 -6.018 -1.640 6.198 563 HD13 LEU 69 HD13 LEU 69 -4.595 -1.305 5.210 564 HD21 LEU 69 HD21 LEU 69 -6.381 0.001 8.290 565 HD22 LEU 69 HD22 LEU 69 -6.063 1.343 7.190 566 HD23 LEU 69 HD23 LEU 69 -5.078 1.135 8.637 567 H VAL 70 HN VAL 70 -1.630 -2.602 5.231 568 HA VAL 70 HA VAL 70 0.454 -0.696 5.915 569 HB VAL 70 HB VAL 70 0.157 -2.505 3.505 570 HG11 VAL 70 HG11 VAL 70 2.512 -0.859 4.417 571 HG12 VAL 70 HG12 VAL 70 1.533 -0.575 2.979 572 HG13 VAL 70 HG13 VAL 70 2.529 -2.026 3.097 573 HG21 VAL 70 HG21 VAL 70 0.427 -3.743 5.589 574 HG22 VAL 70 HG22 VAL 70 1.869 -2.801 5.969 575 HG23 VAL 70 HG23 VAL 70 1.863 -3.882 4.575 576 H LEU 71 HN LEU 71 0.692 1.273 5.035 577 HA LEU 71 HA LEU 71 -1.409 2.231 3.260 578 HB2 LEU 71 HB2 LEU 71 0.779 3.760 4.684 579 HB3 LEU 71 HB1 LEU 71 -0.553 4.467 3.786 580 HG LEU 71 HG LEU 71 -0.849 2.807 6.291 581 HD11 LEU 71 HD11 LEU 71 0.229 4.968 6.708 582 HD12 LEU 71 HD12 LEU 71 -1.392 4.889 7.401 583 HD13 LEU 71 HD13 LEU 71 -1.115 5.783 5.906 584 HD21 LEU 71 HD21 LEU 71 -3.170 3.595 6.248 585 HD22 LEU 71 HD22 LEU 71 -2.780 2.634 4.822 586 HD23 LEU 71 HD23 LEU 71 -2.867 4.392 4.704 587 H ARG 72 HN ARG 72 -0.833 3.566 1.401 588 HA ARG 72 HA ARG 72 1.818 2.945 0.294 589 HB2 ARG 72 HB2 ARG 72 0.273 1.331 -0.666 590 HB3 ARG 72 HB1 ARG 72 -0.856 2.606 -1.094 591 HG2 ARG 72 HG2 ARG 72 0.786 3.513 -2.676 592 HG3 ARG 72 HG1 ARG 72 1.890 2.196 -2.266 593 HD2 ARG 72 HD2 ARG 72 -0.634 1.062 -2.897 594 HD3 ARG 72 HD1 ARG 72 -0.234 2.224 -4.159 595 HE ARG 72 HE ARG 72 1.959 0.502 -3.533 596 HH11 ARG 72 HH11 ARG 72 -1.058 0.703 -5.303 597 HH12 ARG 72 HH12 ARG 72 -0.590 -0.471 -6.493 598 HH21 ARG 72 HH21 ARG 72 2.593 -1.051 -5.116 599 HH22 ARG 72 HH22 ARG 72 1.479 -1.460 -6.393 600 H LEU 73 HN LEU 73 2.801 4.643 -0.543 601 HA LEU 73 HA LEU 73 1.194 6.985 -1.316 602 HB2 LEU 73 HB2 LEU 73 3.669 6.827 0.364 603 HB3 LEU 73 HB1 LEU 73 3.387 8.247 -0.621 604 HG LEU 73 HG LEU 73 1.097 8.358 0.568 605 HD11 LEU 73 HD11 LEU 73 2.481 6.212 2.046 606 HD12 LEU 73 HD12 LEU 73 0.755 6.515 1.824 607 HD13 LEU 73 HD13 LEU 73 1.666 7.437 3.022 608 HD21 LEU 73 HD21 LEU 73 2.918 9.963 0.873 609 HD22 LEU 73 HD22 LEU 73 3.642 8.907 2.087 610 HD23 LEU 73 HD23 LEU 73 2.070 9.647 2.386 611 H ARG 74 HN ARG 74 1.603 7.745 -3.305 612 HA ARG 74 HA ARG 74 3.728 6.427 -4.818 613 HB2 ARG 74 HB2 ARG 74 1.486 8.182 -5.830 614 HB3 ARG 74 HB1 ARG 74 2.571 7.204 -6.806 615 HG2 ARG 74 HG2 ARG 74 0.531 6.184 -4.842 616 HG3 ARG 74 HG1 ARG 74 0.417 6.124 -6.602 617 HD2 ARG 74 HD2 ARG 74 2.606 4.791 -5.013 618 HD3 ARG 74 HD1 ARG 74 1.121 3.978 -5.505 619 HE ARG 74 HE ARG 74 2.205 5.073 -7.801 620 HH11 ARG 74 HH11 ARG 74 3.243 2.755 -5.387 621 HH12 ARG 74 HH12 ARG 74 4.138 1.791 -6.515 622 HH21 ARG 74 HH21 ARG 74 3.387 3.802 -9.285 623 HH22 ARG 74 HH22 ARG 74 4.209 2.381 -8.730 624 H GLY 75 HN GLY 75 3.823 8.853 -2.889 625 HA2 GLY 75 HA2 GLY 75 5.506 10.500 -4.658 626 HA3 GLY 75 HA1 GLY 75 4.424 11.228 -3.478 627 H GLY 76 HN GLY 76 7.510 10.878 -3.930 628 HA2 GLY 76 HA2 GLY 76 8.052 10.631 -1.071 629 HA3 GLY 76 HA1 GLY 76 8.919 9.553 -2.158 630 H1 SER 453 HT1 SER 453 21.172 10.985 16.294 631 H2 SER 453 HT2 SER 453 22.128 9.619 16.559 632 H3 SER 453 HT3 SER 453 22.300 10.975 17.550 633 HA SER 453 HA SER 453 21.096 9.373 18.766 634 HB2 SER 453 HB2 SER 453 18.792 10.615 18.831 635 HB3 SER 453 HB1 SER 453 20.255 11.479 19.303 636 HG SER 453 HG SER 453 18.777 12.562 17.762 637 H ASN 454 HN ASN 454 18.810 10.273 16.189 638 HA ASN 454 HA ASN 454 17.410 9.067 14.867 639 HB2 ASN 454 HB2 ASN 454 19.526 6.987 15.366 640 HB3 ASN 454 HB1 ASN 454 18.093 6.628 14.410 641 HD21 ASN 454 HD21 ASN 454 19.431 6.249 12.621 642 HD22 ASN 454 HD22 ASN 454 20.090 7.562 11.705 643 H SER 455 HN SER 455 17.133 9.107 17.853 644 HA SER 455 HA SER 455 16.124 6.683 18.816 645 HB2 SER 455 HB2 SER 455 14.895 9.197 19.798 646 HB3 SER 455 HB1 SER 455 15.639 7.877 20.702 647 HG SER 455 HG SER 455 17.148 9.372 20.900 648 H GLN 456 HN GLN 456 14.524 9.370 17.152 649 HA GLN 456 HA GLN 456 11.885 8.373 17.434 650 HB2 GLN 456 HB2 GLN 456 13.008 10.238 15.337 651 HB3 GLN 456 HB1 GLN 456 11.298 9.990 15.679 652 HG2 GLN 456 HG2 GLN 456 13.347 11.151 17.556 653 HG3 GLN 456 HG1 GLN 456 12.083 12.035 16.703 654 HE21 GLN 456 HE21 GLN 456 12.675 11.641 19.602 655 HE22 GLN 456 HE22 GLN 456 11.193 11.053 20.282 656 H LEU 457 HN LEU 457 14.379 7.969 14.994 657 HA LEU 457 HA LEU 457 12.768 6.614 13.096 658 HB2 LEU 457 HB2 LEU 457 15.755 6.417 13.490 659 HB3 LEU 457 HB1 LEU 457 14.870 5.956 12.049 660 HG LEU 457 HG LEU 457 15.141 8.765 13.117 661 HD11 LEU 457 HD11 LEU 457 16.532 9.152 11.169 662 HD12 LEU 457 HD12 LEU 457 16.361 7.463 10.693 663 HD13 LEU 457 HD13 LEU 457 17.216 7.877 12.177 664 HD21 LEU 457 HD21 LEU 457 13.017 8.464 12.000 665 HD22 LEU 457 HD22 LEU 457 13.822 7.723 10.618 666 HD23 LEU 457 HD23 LEU 457 14.100 9.424 10.990 667 H ASN 458 HN ASN 458 14.844 5.550 15.745 668 HA ASN 458 HA ASN 458 14.744 2.788 15.284 669 HB2 ASN 458 HB2 ASN 458 15.031 4.355 17.853 670 HB3 ASN 458 HB1 ASN 458 15.180 2.604 17.775 671 HD21 ASN 458 HD21 ASN 458 17.148 4.503 18.609 672 HD22 ASN 458 HD22 ASN 458 18.501 4.331 17.546 673 H ALA 459 HN ALA 459 12.629 4.895 17.177 674 HA ALA 459 HA ALA 459 10.930 2.855 18.152 675 HB1 ALA 459 HB1 ALA 459 11.069 5.073 19.183 676 HB2 ALA 459 HB2 ALA 459 9.408 4.660 18.753 677 HB3 ALA 459 HB3 ALA 459 10.326 5.782 17.749 678 H MET 460 HN MET 460 10.659 5.047 15.365 679 HA MET 460 HA MET 460 8.133 4.123 14.510 680 HB2 MET 460 HB2 MET 460 10.364 5.595 13.139 681 HB3 MET 460 HB1 MET 460 8.934 5.093 12.250 682 HG2 MET 460 HG2 MET 460 7.553 6.348 13.903 683 HG3 MET 460 HG1 MET 460 9.047 6.956 14.607 684 HE1 MET 460 HE1 MET 460 10.540 9.116 11.737 685 HE2 MET 460 HE2 MET 460 10.890 7.415 12.047 686 HE3 MET 460 HE3 MET 460 10.725 8.542 13.393 687 H ALA 461 HN ALA 461 11.403 3.001 13.870 688 HA ALA 461 HA ALA 461 10.778 1.292 11.711 689 HB1 ALA 461 HB1 ALA 461 13.005 1.031 13.725 690 HB2 ALA 461 HB2 ALA 461 13.063 1.984 12.244 691 HB3 ALA 461 HB3 ALA 461 12.919 0.229 12.156 692 H HIS 462 HN HIS 462 10.712 0.842 15.208 693 HA HIS 462 HA HIS 462 10.325 -1.952 15.205 694 HB2 HIS 462 HB2 HIS 462 10.967 -0.752 17.240 695 HB3 HIS 462 HB1 HIS 462 9.432 0.111 17.237 696 HD2 HIS 462 HD2 HIS 462 7.292 -1.233 18.291 697 HE1 HIS 462 HE1 HIS 462 9.405 -4.781 19.206 698 HE2 HIS 462 HE2 HIS 462 7.130 -3.660 19.193 699 H GLN 463 HN GLN 463 8.131 0.758 14.877 700 HA GLN 463 HA GLN 463 5.682 -0.549 15.205 701 HB2 GLN 463 HB2 GLN 463 6.392 1.765 13.389 702 HB3 GLN 463 HB1 GLN 463 4.752 1.276 13.788 703 HG2 GLN 463 HG2 GLN 463 6.730 2.026 15.910 704 HG3 GLN 463 HG1 GLN 463 5.761 3.235 15.067 705 HE21 GLN 463 HE21 GLN 463 3.586 3.362 15.454 706 HE22 GLN 463 HE22 GLN 463 2.812 2.522 16.752 707 H ILE 464 HN ILE 464 7.739 -0.159 12.362 708 HA ILE 464 HA ILE 464 5.952 -1.537 10.597 709 HB ILE 464 HB ILE 464 8.901 -1.045 10.180 710 HG12 ILE 464 HG12 ILE 464 6.551 0.751 9.549 711 HG13 ILE 464 HG11 ILE 464 7.797 1.063 10.754 712 HG21 ILE 464 HG21 ILE 464 8.352 -1.143 7.816 713 HG22 ILE 464 HG22 ILE 464 6.649 -1.389 8.202 714 HG23 ILE 464 HG23 ILE 464 7.837 -2.623 8.624 715 HD11 ILE 464 HD11 ILE 464 8.240 0.866 7.786 716 HD12 ILE 464 HD12 ILE 464 9.465 1.228 9.002 717 HD13 ILE 464 HD13 ILE 464 8.140 2.357 8.722 718 H GLN 465 HN GLN 465 8.683 -2.402 12.617 719 HA GLN 465 HA GLN 465 9.217 -4.946 11.544 720 HB2 GLN 465 HB2 GLN 465 10.561 -3.549 13.268 721 HB3 GLN 465 HB1 GLN 465 9.530 -4.320 14.466 722 HG2 GLN 465 HG2 GLN 465 11.579 -5.543 14.293 723 HG3 GLN 465 HG1 GLN 465 10.269 -6.523 13.629 724 HE21 GLN 465 HE21 GLN 465 11.485 -7.759 12.282 725 HE22 GLN 465 HE22 GLN 465 12.319 -7.137 10.898 726 H GLU 466 HN GLU 466 6.808 -3.810 13.809 727 HA GLU 466 HA GLU 466 5.964 -6.473 14.535 728 HB2 GLU 466 HB2 GLU 466 4.935 -3.716 15.144 729 HB3 GLU 466 HB1 GLU 466 3.985 -5.140 15.543 730 HG2 GLU 466 HG2 GLU 466 6.132 -5.931 16.752 731 HG3 GLU 466 HG1 GLU 466 6.593 -4.230 16.675 732 H MET 467 HN MET 467 5.414 -4.336 11.971 733 HA MET 467 HA MET 467 2.779 -5.371 11.293 734 HB2 MET 467 HB2 MET 467 4.598 -3.363 9.958 735 HB3 MET 467 HB1 MET 467 3.070 -3.881 9.264 736 HG2 MET 467 HG2 MET 467 3.143 -2.795 12.040 737 HG3 MET 467 HG1 MET 467 3.198 -1.700 10.662 738 HE1 MET 467 HE1 MET 467 1.395 -2.939 8.490 739 HE2 MET 467 HE2 MET 467 1.248 -1.264 9.021 740 HE3 MET 467 HE3 MET 467 -0.189 -2.278 8.901 741 H PHE 468 HN PHE 468 6.081 -5.419 10.007 742 HA PHE 468 HA PHE 468 5.286 -7.735 8.372 743 HB2 PHE 468 HB2 PHE 468 6.781 -5.325 7.683 744 HB3 PHE 468 HB1 PHE 468 7.642 -6.803 7.257 745 HD1 PHE 468 HD2 PHE 468 6.304 -8.574 5.940 746 HD2 PHE 468 HD1 PHE 468 5.147 -4.494 6.266 747 HE1 PHE 468 HE2 PHE 468 4.910 -8.814 3.926 748 HE2 PHE 468 HE1 PHE 468 3.750 -4.726 4.254 749 HZ PHE 468 HZ PHE 468 3.632 -6.891 3.085 750 HA PRO 469 HA PRO 469 8.304 -9.436 11.313 751 HB2 PRO 469 HB2 PRO 469 7.200 -11.890 11.478 752 HB3 PRO 469 HB1 PRO 469 6.512 -10.499 12.337 753 HG2 PRO 469 HG2 PRO 469 5.615 -11.783 9.810 754 HG3 PRO 469 HG1 PRO 469 4.656 -11.143 11.158 755 HD2 PRO 469 HD2 PRO 469 5.100 -9.801 8.804 756 HD3 PRO 469 HD1 PRO 469 4.696 -9.020 10.344 757 H GLN 470 HN GLN 470 8.610 -9.285 8.349 758 HA GLN 470 HA GLN 470 10.394 -11.569 8.071 759 HB2 GLN 470 HB2 GLN 470 9.538 -12.009 5.750 760 HB3 GLN 470 HB1 GLN 470 8.421 -12.445 7.037 761 HG2 GLN 470 HG2 GLN 470 7.381 -10.135 6.630 762 HG3 GLN 470 HG1 GLN 470 8.283 -10.154 5.116 763 HE21 GLN 470 HE21 GLN 470 6.512 -10.247 3.808 764 HE22 GLN 470 HE22 GLN 470 5.455 -11.614 3.715 765 H VAL 471 HN VAL 471 10.734 -8.711 8.471 766 HA VAL 471 HA VAL 471 12.344 -8.170 6.079 767 HB VAL 471 HB VAL 471 10.334 -6.767 5.928 768 HG11 VAL 471 HG11 VAL 471 9.906 -4.995 7.560 769 HG12 VAL 471 HG12 VAL 471 11.214 -5.611 8.570 770 HG13 VAL 471 HG13 VAL 471 9.779 -6.596 8.289 771 HG21 VAL 471 HG21 VAL 471 12.415 -5.900 5.026 772 HG22 VAL 471 HG22 VAL 471 12.823 -5.201 6.594 773 HG23 VAL 471 HG23 VAL 471 11.438 -4.590 5.690 774 HA PRO 472 HA PRO 472 15.591 -7.842 9.110 775 HB2 PRO 472 HB2 PRO 472 16.895 -6.167 7.032 776 HB3 PRO 472 HB1 PRO 472 17.486 -7.635 7.832 777 HG2 PRO 472 HG2 PRO 472 16.682 -7.701 5.315 778 HG3 PRO 472 HG1 PRO 472 16.336 -9.038 6.429 779 HD2 PRO 472 HD2 PRO 472 14.512 -6.883 5.455 780 HD3 PRO 472 HD1 PRO 472 14.183 -8.605 5.738 781 H TYR 473 HN TYR 473 15.553 -6.522 10.776 782 HA TYR 473 HA TYR 473 14.299 -4.052 10.876 783 HB2 TYR 473 HB2 TYR 473 14.758 -5.481 12.839 784 HB3 TYR 473 HB1 TYR 473 16.466 -5.072 12.724 785 HD1 TYR 473 HD2 TYR 473 13.151 -3.350 12.964 786 HD2 TYR 473 HD1 TYR 473 17.248 -3.393 14.083 787 HE1 TYR 473 HE2 TYR 473 12.774 -1.389 14.398 788 HE2 TYR 473 HE1 TYR 473 16.882 -1.433 15.521 789 HH TYR 473 HH TYR 473 13.652 -0.077 15.996 790 H HIS 474 HN HIS 474 17.718 -4.767 10.305 791 HA HIS 474 HA HIS 474 18.592 -2.084 10.557 792 HB2 HIS 474 HB2 HIS 474 20.650 -2.846 9.419 793 HB3 HIS 474 HB1 HIS 474 20.190 -3.887 10.755 794 HD2 HIS 474 HD2 HIS 474 20.696 -4.003 6.932 795 HE1 HIS 474 HE1 HIS 474 19.698 -7.884 8.281 796 HE2 HIS 474 HE2 HIS 474 20.721 -6.538 6.398 797 H LEU 475 HN LEU 475 17.142 -3.869 7.937 798 HA LEU 475 HA LEU 475 17.882 -1.943 5.934 799 HB2 LEU 475 HB2 LEU 475 15.957 -4.259 5.942 800 HB3 LEU 475 HB1 LEU 475 16.116 -3.183 4.567 801 HG LEU 475 HG LEU 475 18.199 -5.048 5.688 802 HD11 LEU 475 HD11 LEU 475 16.501 -5.996 4.173 803 HD12 LEU 475 HD12 LEU 475 18.129 -6.046 3.497 804 HD13 LEU 475 HD13 LEU 475 16.979 -4.828 2.944 805 HD21 LEU 475 HD21 LEU 475 19.404 -3.078 5.182 806 HD22 LEU 475 HD22 LEU 475 18.493 -2.823 3.693 807 HD23 LEU 475 HD23 LEU 475 19.626 -4.169 3.817 808 H VAL 476 HN VAL 476 15.273 -2.426 8.165 809 HA VAL 476 HA VAL 476 13.395 -0.669 6.970 810 HB VAL 476 HB VAL 476 13.684 -1.329 9.912 811 HG11 VAL 476 HG11 VAL 476 11.294 -0.804 10.030 812 HG12 VAL 476 HG12 VAL 476 11.315 -0.352 8.325 813 HG13 VAL 476 HG13 VAL 476 12.243 0.584 9.495 814 HG21 VAL 476 HG21 VAL 476 12.083 -2.739 7.779 815 HG22 VAL 476 HG22 VAL 476 12.028 -3.090 9.507 816 HG23 VAL 476 HG23 VAL 476 13.513 -3.371 8.598 817 H LEU 477 HN LEU 477 15.963 -0.294 9.364 818 HA LEU 477 HA LEU 477 15.530 2.430 9.970 819 HB2 LEU 477 HB2 LEU 477 18.032 0.744 10.083 820 HB3 LEU 477 HB1 LEU 477 17.939 2.381 10.701 821 HG LEU 477 HG LEU 477 16.214 0.112 11.697 822 HD11 LEU 477 HD11 LEU 477 17.692 0.095 13.660 823 HD12 LEU 477 HD12 LEU 477 18.758 1.247 12.855 824 HD13 LEU 477 HD13 LEU 477 18.544 -0.371 12.186 825 HD21 LEU 477 HD21 LEU 477 15.233 2.291 12.065 826 HD22 LEU 477 HD22 LEU 477 16.747 2.893 12.738 827 HD23 LEU 477 HD23 LEU 477 15.834 1.649 13.593 828 H GLN 478 HN GLN 478 17.100 0.810 7.339 829 HA GLN 478 HA GLN 478 18.662 2.939 6.352 830 HB2 GLN 478 HB2 GLN 478 18.968 0.602 5.654 831 HB3 GLN 478 HB1 GLN 478 17.388 0.623 4.885 832 HG2 GLN 478 HG2 GLN 478 18.250 2.465 3.408 833 HG3 GLN 478 HG1 GLN 478 19.850 2.144 4.072 834 HE21 GLN 478 HE21 GLN 478 17.400 -0.282 3.403 835 HE22 GLN 478 HE22 GLN 478 18.270 -1.075 2.137 836 H ASP 479 HN ASP 479 15.460 1.739 5.336 837 HA ASP 479 HA ASP 479 14.989 3.835 3.492 838 HB2 ASP 479 HB2 ASP 479 13.825 1.597 3.526 839 HB3 ASP 479 HB1 ASP 479 12.885 2.185 4.891 840 H LEU 480 HN LEU 480 14.331 3.446 6.908 841 HA LEU 480 HA LEU 480 12.537 5.570 7.272 842 HB2 LEU 480 HB2 LEU 480 14.074 3.793 8.933 843 HB3 LEU 480 HB1 LEU 480 14.137 5.418 9.585 844 HG LEU 480 HG LEU 480 12.330 4.169 10.610 845 HD11 LEU 480 HD11 LEU 480 11.241 6.227 8.696 846 HD12 LEU 480 HD12 LEU 480 12.026 6.580 10.235 847 HD13 LEU 480 HD13 LEU 480 10.499 5.699 10.205 848 HD21 LEU 480 HD21 LEU 480 11.944 2.592 8.765 849 HD22 LEU 480 HD22 LEU 480 11.190 3.887 7.836 850 HD23 LEU 480 HD23 LEU 480 10.450 3.333 9.337 851 H GLN 481 HN GLN 481 15.989 5.551 6.848 852 HA GLN 481 HA GLN 481 16.272 8.296 7.741 853 HB2 GLN 481 HB2 GLN 481 18.211 6.312 6.548 854 HB3 GLN 481 HB1 GLN 481 18.651 7.978 6.903 855 HG2 GLN 481 HG2 GLN 481 18.175 7.636 9.253 856 HG3 GLN 481 HG1 GLN 481 17.639 5.989 8.925 857 HE21 GLN 481 HE21 GLN 481 19.180 5.120 10.308 858 HE22 GLN 481 HE22 GLN 481 20.861 5.069 9.906 859 H LEU 482 HN LEU 482 15.562 6.596 4.872 860 HA LEU 482 HA LEU 482 16.416 8.748 3.118 861 HB2 LEU 482 HB2 LEU 482 15.466 5.964 2.761 862 HB3 LEU 482 HB1 LEU 482 15.098 7.085 1.468 863 HG LEU 482 HG LEU 482 17.127 5.882 0.949 864 HD11 LEU 482 HD11 LEU 482 18.612 7.712 0.508 865 HD12 LEU 482 HD12 LEU 482 17.838 8.696 1.746 866 HD13 LEU 482 HD13 LEU 482 16.949 8.256 0.287 867 HD21 LEU 482 HD21 LEU 482 17.851 5.258 3.164 868 HD22 LEU 482 HD22 LEU 482 18.177 6.945 3.565 869 HD23 LEU 482 HD23 LEU 482 19.146 6.126 2.340 870 H THR 483 HN THR 483 13.348 6.941 3.403 871 HA THR 483 HA THR 483 11.851 9.095 2.256 872 HB THR 483 HB THR 483 9.868 7.725 2.784 873 HG1 THR 483 HG1 THR 483 11.166 5.480 3.603 874 HG21 THR 483 HG21 THR 483 10.442 5.772 1.397 875 HG22 THR 483 HG22 THR 483 12.151 6.172 1.562 876 HG23 THR 483 HG23 THR 483 11.068 7.275 0.718 877 H ARG 484 HN ARG 484 12.322 7.790 5.486 878 HA ARG 484 HA ARG 484 12.017 8.635 7.561 879 HB2 ARG 484 HB2 ARG 484 11.663 11.227 6.054 880 HB3 ARG 484 HB1 ARG 484 11.697 11.117 7.810 881 HG2 ARG 484 HG2 ARG 484 13.936 10.667 7.878 882 HG3 ARG 484 HG1 ARG 484 13.947 9.932 6.274 883 HD2 ARG 484 HD2 ARG 484 13.572 12.868 6.804 884 HD3 ARG 484 HD1 ARG 484 15.112 12.123 6.382 885 HE ARG 484 HE ARG 484 13.886 11.382 4.281 886 HH11 ARG 484 HH11 ARG 484 13.103 14.319 6.027 887 HH12 ARG 484 HH12 ARG 484 12.504 15.146 4.625 888 HH21 ARG 484 HH21 ARG 484 13.093 12.487 2.418 889 HH22 ARG 484 HH22 ARG 484 12.501 14.111 2.584 890 H SER 485 HN SER 485 9.809 7.755 5.706 891 HA SER 485 HA SER 485 7.598 8.556 7.455 892 HB2 SER 485 HB2 SER 485 7.596 8.599 4.430 893 HB3 SER 485 HB1 SER 485 6.114 8.573 5.387 894 HG SER 485 HG SER 485 6.372 10.612 5.809 895 H VAL 486 HN VAL 486 7.018 6.734 8.406 896 HA VAL 486 HA VAL 486 7.661 4.151 7.636 897 HB VAL 486 HB VAL 486 5.879 3.405 9.217 898 HG11 VAL 486 HG11 VAL 486 7.587 5.632 10.306 899 HG12 VAL 486 HG12 VAL 486 8.182 4.016 9.928 900 HG13 VAL 486 HG13 VAL 486 6.963 4.237 11.185 901 HG21 VAL 486 HG21 VAL 486 4.278 5.234 8.770 902 HG22 VAL 486 HG22 VAL 486 5.373 6.359 9.576 903 HG23 VAL 486 HG23 VAL 486 4.630 5.045 10.488 904 H GLU 487 HN GLU 487 4.953 6.134 6.688 905 HA GLU 487 HA GLU 487 3.256 4.103 5.724 906 HB2 GLU 487 HB2 GLU 487 3.423 6.851 4.515 907 HB3 GLU 487 HB1 GLU 487 2.014 5.813 4.679 908 HG2 GLU 487 HG2 GLU 487 1.538 7.179 6.387 909 HG3 GLU 487 HG1 GLU 487 2.651 6.132 7.265 910 H ILE 488 HN ILE 488 5.985 5.766 4.266 911 HA ILE 488 HA ILE 488 5.456 4.551 1.670 912 HB ILE 488 HB ILE 488 7.926 6.124 2.359 913 HG12 ILE 488 HG12 ILE 488 5.265 7.273 1.477 914 HG13 ILE 488 HG11 ILE 488 5.933 7.418 3.097 915 HG21 ILE 488 HG21 ILE 488 6.367 5.755 -0.196 916 HG22 ILE 488 HG22 ILE 488 7.887 4.964 0.218 917 HG23 ILE 488 HG23 ILE 488 7.839 6.712 -0.017 918 HD11 ILE 488 HD11 ILE 488 7.124 8.550 0.574 919 HD12 ILE 488 HD12 ILE 488 7.827 8.678 2.186 920 HD13 ILE 488 HD13 ILE 488 6.282 9.450 1.835 921 H THR 489 HN THR 489 7.530 4.184 4.416 922 HA THR 489 HA THR 489 9.534 2.552 3.318 923 HB THR 489 HB THR 489 8.485 2.535 6.154 924 HG1 THR 489 HG1 THR 489 10.477 4.123 4.864 925 HG21 THR 489 HG21 THR 489 9.880 0.644 5.880 926 HG22 THR 489 HG22 THR 489 10.897 1.878 6.627 927 HG23 THR 489 HG23 THR 489 11.038 1.547 4.901 928 H THR 490 HN THR 490 6.562 1.672 5.075 929 HA THR 490 HA THR 490 6.920 -1.107 4.878 930 HB THR 490 HB THR 490 4.185 0.114 4.956 931 HG1 THR 490 HG1 THR 490 5.226 1.404 6.418 932 HG21 THR 490 HG21 THR 490 5.493 -2.175 6.432 933 HG22 THR 490 HG22 THR 490 4.390 -2.321 5.063 934 HG23 THR 490 HG23 THR 490 3.812 -1.676 6.600 935 H ASP 491 HN ASP 491 5.387 1.226 2.730 936 HA ASP 491 HA ASP 491 4.242 -0.698 0.970 937 HB2 ASP 491 HB2 ASP 491 3.471 1.662 1.097 938 HB3 ASP 491 HB1 ASP 491 5.001 2.174 0.390 939 H ASN 492 HN ASN 492 7.261 1.112 1.063 940 HA ASN 492 HA ASN 492 8.332 0.412 -1.404 941 HB2 ASN 492 HB2 ASN 492 9.427 1.310 1.188 942 HB3 ASN 492 HB1 ASN 492 10.568 0.469 0.148 943 HD21 ASN 492 HD21 ASN 492 11.013 3.065 0.799 944 HD22 ASN 492 HD22 ASN 492 10.748 4.079 -0.585 945 H ILE 493 HN ILE 493 8.162 -1.445 1.578 946 HA ILE 493 HA ILE 493 9.949 -3.510 0.810 947 HB ILE 493 HB ILE 493 7.581 -3.775 2.673 948 HG12 ILE 493 HG12 ILE 493 10.427 -3.052 3.401 949 HG13 ILE 493 HG11 ILE 493 9.126 -1.876 3.246 950 HG21 ILE 493 HG21 ILE 493 8.905 -5.571 3.698 951 HG22 ILE 493 HG22 ILE 493 10.148 -5.350 2.467 952 HG23 ILE 493 HG23 ILE 493 8.539 -5.905 2.006 953 HD11 ILE 493 HD11 ILE 493 9.272 -4.141 5.216 954 HD12 ILE 493 HD12 ILE 493 7.897 -3.053 5.026 955 HD13 ILE 493 HD13 ILE 493 9.457 -2.423 5.560 956 H LEU 494 HN LEU 494 6.449 -3.101 0.525 957 HA LEU 494 HA LEU 494 5.936 -5.624 -0.679 958 HB2 LEU 494 HB2 LEU 494 4.395 -3.044 -0.516 959 HB3 LEU 494 HB1 LEU 494 3.792 -4.408 -1.437 960 HG LEU 494 HG LEU 494 4.495 -4.665 1.480 961 HD11 LEU 494 HD11 LEU 494 2.232 -4.212 2.059 962 HD12 LEU 494 HD12 LEU 494 1.768 -4.054 0.367 963 HD13 LEU 494 HD13 LEU 494 2.814 -2.844 1.110 964 HD21 LEU 494 HD21 LEU 494 3.614 -6.434 -0.558 965 HD22 LEU 494 HD22 LEU 494 2.303 -6.249 0.622 966 HD23 LEU 494 HD23 LEU 494 3.909 -6.779 1.146 967 H GLU 495 HN GLU 495 6.878 -2.492 -1.858 968 HA GLU 495 HA GLU 495 6.316 -2.995 -4.608 969 HB2 GLU 495 HB2 GLU 495 7.903 -0.890 -3.159 970 HB3 GLU 495 HB1 GLU 495 7.873 -0.968 -4.916 971 HG2 GLU 495 HG2 GLU 495 5.599 -0.439 -3.035 972 HG3 GLU 495 HG1 GLU 495 6.227 0.592 -4.322 973 H GLY 496 HN GLY 496 9.036 -3.625 -2.522 974 HA2 GLY 496 HA2 GLY 496 10.522 -5.423 -3.218 975 HA3 GLY 496 HA1 GLY 496 10.410 -4.802 -4.856 976 H ARG 497 HN ARG 497 10.676 -2.287 -2.629 977 HA ARG 497 HA ARG 497 13.239 -1.519 -3.578 978 HB2 ARG 497 HB2 ARG 497 11.533 0.093 -2.793 979 HB3 ARG 497 HB1 ARG 497 11.721 -0.522 -1.159 980 HG2 ARG 497 HG2 ARG 497 13.157 1.175 -0.917 981 HG3 ARG 497 HG1 ARG 497 14.286 0.133 -1.782 982 HD2 ARG 497 HD2 ARG 497 14.226 2.382 -2.740 983 HD3 ARG 497 HD1 ARG 497 13.656 1.170 -3.889 984 HE ARG 497 HE ARG 497 11.742 2.745 -2.297 985 HH11 ARG 497 HH11 ARG 497 13.058 1.820 -5.405 986 HH12 ARG 497 HH12 ARG 497 11.730 2.473 -6.305 987 HH21 ARG 497 HH21 ARG 497 9.978 3.585 -3.479 988 HH22 ARG 497 HH22 ARG 497 9.969 3.466 -5.210 989 H ILE 498 HN ILE 498 12.118 -2.699 -0.425 990 HA ILE 498 HA ILE 498 14.830 -3.035 0.520 991 HB ILE 498 HB ILE 498 12.137 -3.576 1.770 992 HG12 ILE 498 HG12 ILE 498 13.277 -1.940 3.486 993 HG13 ILE 498 HG11 ILE 498 14.304 -1.536 2.116 994 HG21 ILE 498 HG21 ILE 498 13.628 -5.349 2.497 995 HG22 ILE 498 HG22 ILE 498 13.297 -4.231 3.821 996 HG23 ILE 498 HG23 ILE 498 14.838 -4.156 2.969 997 HD11 ILE 498 HD11 ILE 498 11.315 -1.261 2.281 998 HD12 ILE 498 HD12 ILE 498 12.269 -0.980 0.825 999 HD13 ILE 498 HD13 ILE 498 12.512 0.036 2.246 1000 H GLN 499 HN GLN 499 15.989 -4.836 0.297 1001 HA GLN 499 HA GLN 499 14.879 -7.086 -1.095 1002 HB2 GLN 499 HB2 GLN 499 17.600 -6.717 0.167 1003 HB3 GLN 499 HB1 GLN 499 17.143 -8.039 -0.896 1004 HG2 GLN 499 HG2 GLN 499 17.312 -5.124 -1.619 1005 HG3 GLN 499 HG1 GLN 499 18.409 -6.407 -2.122 1006 HE21 GLN 499 HE21 GLN 499 15.396 -4.845 -2.660 1007 HE22 GLN 499 HE22 GLN 499 14.951 -5.722 -4.080 1008 H VAL 500 HN VAL 500 13.674 -8.535 -0.122 1009 HA VAL 500 HA VAL 500 13.671 -8.937 2.704 1010 HB VAL 500 HB VAL 500 12.069 -10.799 2.186 1011 HG11 VAL 500 HG11 VAL 500 11.266 -8.544 2.616 1012 HG12 VAL 500 HG12 VAL 500 10.278 -9.322 1.380 1013 HG13 VAL 500 HG13 VAL 500 11.486 -8.126 0.916 1014 HG21 VAL 500 HG21 VAL 500 12.475 -9.882 -0.658 1015 HG22 VAL 500 HG22 VAL 500 11.257 -11.033 -0.108 1016 HG23 VAL 500 HG23 VAL 500 12.970 -11.438 0.008 1017 HA PRO 501 HA PRO 501 16.591 -12.164 3.346 1018 HB2 PRO 501 HB2 PRO 501 14.494 -13.834 4.624 1019 HB3 PRO 501 HB1 PRO 501 16.014 -13.217 5.297 1020 HG2 PRO 501 HG2 PRO 501 13.686 -12.193 6.037 1021 HG3 PRO 501 HG1 PRO 501 15.120 -11.168 5.822 1022 HD2 PRO 501 HD2 PRO 501 12.775 -11.527 4.010 1023 HD3 PRO 501 HD1 PRO 501 13.674 -10.050 4.409 1024 H PHE 502 HN PHE 502 17.313 -13.379 1.754 1025 HA PHE 502 HA PHE 502 15.572 -15.471 0.645 1026 HB2 PHE 502 HB2 PHE 502 15.783 -13.584 -0.956 1027 HB3 PHE 502 HB1 PHE 502 17.531 -13.754 -0.908 1028 HD1 PHE 502 HD1 PHE 502 14.396 -15.371 -1.969 1029 HD2 PHE 502 HD2 PHE 502 18.644 -15.381 -2.214 1030 HE1 PHE 502 HE1 PHE 502 14.281 -16.975 -3.826 1031 HE2 PHE 502 HE2 PHE 502 18.534 -16.986 -4.073 1032 HZ PHE 502 HZ PHE 502 16.353 -17.782 -4.884 1033 HA PRO 503 HA PRO 503 18.950 -18.055 1.937 1034 HB2 PRO 503 HB2 PRO 503 18.321 -20.258 0.415 1035 HB3 PRO 503 HB1 PRO 503 17.509 -19.845 1.936 1036 HG2 PRO 503 HG2 PRO 503 16.621 -19.362 -0.861 1037 HG3 PRO 503 HG1 PRO 503 15.680 -19.888 0.548 1038 HD2 PRO 503 HD2 PRO 503 15.622 -17.345 -0.335 1039 HD3 PRO 503 HD1 PRO 503 15.488 -17.751 1.390 1040 H THR 504 HN THR 504 20.764 -17.109 1.082 1041 HA THR 504 HA THR 504 21.470 -17.901 -1.659 1042 HB THR 504 HB THR 504 21.054 -15.435 -1.377 1043 HG1 THR 504 HG1 THR 504 23.567 -16.466 -2.179 1044 HG21 THR 504 HG21 THR 504 21.987 -15.280 0.928 1045 HG22 THR 504 HG22 THR 504 22.641 -14.077 -0.183 1046 HG23 THR 504 HG23 THR 504 23.598 -15.496 0.245 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 -18.430 -11.200 14.679 2 H2 MET 1 HT2 MET 1 -18.178 -12.750 14.053 3 H3 MET 1 HT3 MET 1 -17.487 -11.408 13.293 4 HA MET 1 HA MET 1 -16.848 -12.143 16.077 5 HB2 MET 1 HB2 MET 1 -14.858 -13.281 15.282 6 HB3 MET 1 HB1 MET 1 -16.277 -14.028 14.564 7 HG2 MET 1 HG2 MET 1 -15.863 -12.720 12.502 8 HG3 MET 1 HG1 MET 1 -14.375 -12.117 13.229 9 HE1 MET 1 HE1 MET 1 -13.068 -14.643 10.520 10 HE2 MET 1 HE2 MET 1 -12.942 -13.002 11.152 11 HE3 MET 1 HE3 MET 1 -14.445 -13.544 10.404 12 H GLN 2 HN GLN 2 -14.747 -11.183 16.695 13 HA GLN 2 HA GLN 2 -14.433 -8.563 15.401 14 HB2 GLN 2 HB2 GLN 2 -13.959 -9.521 18.216 15 HB3 GLN 2 HB1 GLN 2 -13.276 -8.009 17.630 16 HG2 GLN 2 HG2 GLN 2 -16.193 -8.500 17.293 17 HG3 GLN 2 HG1 GLN 2 -15.571 -8.063 18.885 18 HE21 GLN 2 HE21 GLN 2 -17.270 -6.656 16.818 19 HE22 GLN 2 HE22 GLN 2 -16.499 -5.113 16.636 20 H ILE 3 HN ILE 3 -12.495 -7.838 14.723 21 HA ILE 3 HA ILE 3 -10.179 -9.638 15.018 22 HB ILE 3 HB ILE 3 -9.421 -8.863 12.759 23 HG12 ILE 3 HG12 ILE 3 -12.272 -7.969 12.342 24 HG13 ILE 3 HG11 ILE 3 -10.995 -6.850 12.807 25 HG21 ILE 3 HG21 ILE 3 -10.877 -10.368 11.498 26 HG22 ILE 3 HG22 ILE 3 -12.044 -10.354 12.820 27 HG23 ILE 3 HG23 ILE 3 -10.444 -11.056 13.063 28 HD11 ILE 3 HD11 ILE 3 -10.929 -8.566 10.339 29 HD12 ILE 3 HD12 ILE 3 -9.805 -7.278 10.776 30 HD13 ILE 3 HD13 ILE 3 -11.479 -6.892 10.383 31 H PHE 4 HN PHE 4 -8.082 -8.442 14.562 32 HA PHE 4 HA PHE 4 -8.271 -5.717 15.680 33 HB2 PHE 4 HB2 PHE 4 -6.036 -7.728 16.009 34 HB3 PHE 4 HB1 PHE 4 -6.046 -6.097 16.668 35 HD1 PHE 4 HD1 PHE 4 -8.045 -5.532 18.243 36 HD2 PHE 4 HD2 PHE 4 -6.769 -9.479 17.296 37 HE1 PHE 4 HE1 PHE 4 -9.138 -6.372 20.279 38 HE2 PHE 4 HE2 PHE 4 -7.857 -10.322 19.332 39 HZ PHE 4 HZ PHE 4 -9.046 -8.771 20.826 40 H VAL 5 HN VAL 5 -7.780 -4.212 14.226 41 HA VAL 5 HA VAL 5 -5.914 -4.906 12.058 42 HB VAL 5 HB VAL 5 -7.796 -2.543 12.244 43 HG11 VAL 5 HG11 VAL 5 -7.282 -2.222 9.869 44 HG12 VAL 5 HG12 VAL 5 -6.130 -3.555 9.938 45 HG13 VAL 5 HG13 VAL 5 -5.833 -2.085 10.865 46 HG21 VAL 5 HG21 VAL 5 -9.112 -4.523 12.031 47 HG22 VAL 5 HG22 VAL 5 -8.043 -5.166 10.785 48 HG23 VAL 5 HG23 VAL 5 -9.045 -3.757 10.444 49 H LYS 6 HN LYS 6 -3.900 -4.218 12.237 50 HA LYS 6 HA LYS 6 -3.328 -2.057 14.137 51 HB2 LYS 6 HB2 LYS 6 -2.174 -4.511 13.907 52 HB3 LYS 6 HB1 LYS 6 -1.079 -3.536 12.933 53 HG2 LYS 6 HG2 LYS 6 -0.644 -2.075 14.778 54 HG3 LYS 6 HG1 LYS 6 -1.875 -2.876 15.759 55 HD2 LYS 6 HD2 LYS 6 -0.479 -5.010 15.360 56 HD3 LYS 6 HD1 LYS 6 0.808 -3.899 14.890 57 HE2 LYS 6 HE2 LYS 6 1.035 -4.474 17.226 58 HE3 LYS 6 HE1 LYS 6 0.596 -2.773 17.069 59 HZ1 LYS 6 HZ1 LYS 6 -0.626 -4.071 18.820 60 HZ2 LYS 6 HZ2 LYS 6 -1.402 -4.905 17.574 61 HZ3 LYS 6 HZ3 LYS 6 -1.609 -3.233 17.729 62 H THR 7 HN THR 7 -2.091 -0.286 13.577 63 HA THR 7 HA THR 7 -1.624 0.103 10.695 64 HB THR 7 HB THR 7 -1.944 2.651 11.769 65 HG1 THR 7 HG1 THR 7 -3.690 0.782 12.971 66 HG21 THR 7 HG21 THR 7 -3.948 0.933 10.298 67 HG22 THR 7 HG22 THR 7 -2.691 1.928 9.560 68 HG23 THR 7 HG23 THR 7 -4.019 2.689 10.439 69 H LEU 8 HN LEU 8 0.011 1.832 10.263 70 HA LEU 8 HA LEU 8 2.416 1.286 11.640 71 HB2 LEU 8 HB2 LEU 8 1.679 3.417 9.641 72 HB3 LEU 8 HB1 LEU 8 3.311 3.180 10.239 73 HG LEU 8 HG LEU 8 1.779 0.971 8.882 74 HD11 LEU 8 HD11 LEU 8 3.616 2.988 7.600 75 HD12 LEU 8 HD12 LEU 8 1.877 2.856 7.339 76 HD13 LEU 8 HD13 LEU 8 2.948 1.555 6.818 77 HD21 LEU 8 HD21 LEU 8 4.004 0.062 8.502 78 HD22 LEU 8 HD22 LEU 8 3.730 0.338 10.222 79 HD23 LEU 8 HD23 LEU 8 4.726 1.460 9.296 80 H THR 9 HN THR 9 -0.126 3.364 12.397 81 HA THR 9 HA THR 9 1.427 5.371 13.762 82 HB THR 9 HB THR 9 -1.106 5.674 14.715 83 HG1 THR 9 HG1 THR 9 -2.507 5.158 12.957 84 HG21 THR 9 HG21 THR 9 0.231 7.391 13.581 85 HG22 THR 9 HG22 THR 9 -1.411 7.337 12.940 86 HG23 THR 9 HG23 THR 9 -0.086 6.615 12.029 87 H GLY 10 HN GLY 10 0.821 2.220 14.404 88 HA2 GLY 10 HA2 GLY 10 1.189 0.972 16.306 89 HA3 GLY 10 HA1 GLY 10 1.543 2.467 17.162 90 H LYS 11 HN LYS 11 -1.406 1.848 15.408 91 HA LYS 11 HA LYS 11 -2.861 1.799 17.963 92 HB2 LYS 11 HB2 LYS 11 -3.031 3.890 16.458 93 HB3 LYS 11 HB1 LYS 11 -3.999 2.877 15.399 94 HG2 LYS 11 HG2 LYS 11 -5.604 2.510 17.182 95 HG3 LYS 11 HG1 LYS 11 -4.613 3.464 18.285 96 HD2 LYS 11 HD2 LYS 11 -6.326 4.909 17.535 97 HD3 LYS 11 HD1 LYS 11 -4.871 5.379 16.653 98 HE2 LYS 11 HE2 LYS 11 -5.611 4.307 14.677 99 HE3 LYS 11 HE1 LYS 11 -6.896 3.457 15.533 100 HZ1 LYS 11 HZ1 LYS 11 -6.772 6.397 15.149 101 HZ2 LYS 11 HZ2 LYS 11 -8.028 5.538 15.882 102 HZ3 LYS 11 HZ3 LYS 11 -7.722 5.340 14.226 103 H THR 12 HN THR 12 -4.413 0.293 18.221 104 HA THR 12 HA THR 12 -4.793 -1.619 16.019 105 HB THR 12 HB THR 12 -5.332 -2.201 18.927 106 HG1 THR 12 HG1 THR 12 -3.172 -1.691 18.889 107 HG21 THR 12 HG21 THR 12 -6.284 -3.746 17.275 108 HG22 THR 12 HG22 THR 12 -5.004 -4.524 18.208 109 HG23 THR 12 HG23 THR 12 -4.687 -3.972 16.563 110 H ILE 13 HN ILE 13 -6.687 -1.441 15.036 111 HA ILE 13 HA ILE 13 -8.942 -0.254 16.496 112 HB ILE 13 HB ILE 13 -8.713 -0.756 13.523 113 HG12 ILE 13 HG12 ILE 13 -8.605 2.006 14.059 114 HG13 ILE 13 HG11 ILE 13 -7.461 1.256 15.169 115 HG21 ILE 13 HG21 ILE 13 -10.592 0.999 15.101 116 HG22 ILE 13 HG22 ILE 13 -11.005 -0.542 14.351 117 HG23 ILE 13 HG23 ILE 13 -10.554 0.835 13.347 118 HD11 ILE 13 HD11 ILE 13 -6.339 0.182 13.301 119 HD12 ILE 13 HD12 ILE 13 -6.401 1.932 13.087 120 HD13 ILE 13 HD13 ILE 13 -7.503 0.894 12.182 121 H THR 14 HN THR 14 -10.728 -1.398 16.975 122 HA THR 14 HA THR 14 -10.758 -4.231 16.304 123 HB THR 14 HB THR 14 -12.927 -4.017 17.819 124 HG1 THR 14 HG1 THR 14 -12.103 -2.282 19.462 125 HG21 THR 14 HG21 THR 14 -10.971 -5.325 18.418 126 HG22 THR 14 HG22 THR 14 -11.510 -4.381 19.807 127 HG23 THR 14 HG23 THR 14 -10.105 -3.860 18.879 128 H LEU 15 HN LEU 15 -12.113 -5.103 14.833 129 HA LEU 15 HA LEU 15 -14.354 -3.469 13.872 130 HB2 LEU 15 HB2 LEU 15 -12.288 -4.870 12.188 131 HB3 LEU 15 HB1 LEU 15 -13.840 -4.358 11.556 132 HG LEU 15 HG LEU 15 -11.777 -2.502 12.749 133 HD11 LEU 15 HD11 LEU 15 -11.284 -1.820 10.512 134 HD12 LEU 15 HD12 LEU 15 -12.524 -2.889 9.860 135 HD13 LEU 15 HD13 LEU 15 -11.085 -3.569 10.616 136 HD21 LEU 15 HD21 LEU 15 -14.001 -1.618 13.008 137 HD22 LEU 15 HD22 LEU 15 -14.382 -1.981 11.324 138 HD23 LEU 15 HD23 LEU 15 -13.180 -0.751 11.712 139 H GLU 16 HN GLU 16 -16.139 -4.571 13.203 140 HA GLU 16 HA GLU 16 -16.263 -7.365 14.034 141 HB2 GLU 16 HB2 GLU 16 -17.929 -5.750 14.936 142 HB3 GLU 16 HB1 GLU 16 -18.514 -5.485 13.299 143 HG2 GLU 16 HG2 GLU 16 -19.860 -7.227 13.478 144 HG3 GLU 16 HG1 GLU 16 -18.484 -8.280 13.798 145 H VAL 17 HN VAL 17 -16.087 -8.872 12.561 146 HA VAL 17 HA VAL 17 -17.234 -8.458 9.897 147 HB VAL 17 HB VAL 17 -15.207 -9.644 8.927 148 HG11 VAL 17 HG11 VAL 17 -13.847 -7.574 8.804 149 HG12 VAL 17 HG12 VAL 17 -14.869 -6.868 10.056 150 HG13 VAL 17 HG13 VAL 17 -15.561 -7.304 8.494 151 HG21 VAL 17 HG21 VAL 17 -14.211 -10.493 10.945 152 HG22 VAL 17 HG22 VAL 17 -14.036 -8.863 11.596 153 HG23 VAL 17 HG23 VAL 17 -13.087 -9.361 10.195 154 H GLU 18 HN GLU 18 -17.125 -10.616 8.680 155 HA GLU 18 HA GLU 18 -17.417 -12.906 10.492 156 HB2 GLU 18 HB2 GLU 18 -19.392 -11.944 8.418 157 HB3 GLU 18 HB1 GLU 18 -19.403 -13.590 9.037 158 HG2 GLU 18 HG2 GLU 18 -19.580 -11.201 10.844 159 HG3 GLU 18 HG1 GLU 18 -21.001 -11.932 10.101 160 HA PRO 19 HA PRO 19 -14.973 -15.167 7.597 161 HB2 PRO 19 HB2 PRO 19 -17.126 -17.226 7.462 162 HB3 PRO 19 HB1 PRO 19 -15.413 -17.404 7.886 163 HG2 PRO 19 HG2 PRO 19 -17.275 -17.515 9.756 164 HG3 PRO 19 HG1 PRO 19 -15.721 -16.712 10.054 165 HD2 PRO 19 HD2 PRO 19 -18.393 -15.504 9.519 166 HD3 PRO 19 HD1 PRO 19 -17.100 -14.956 10.602 167 H SER 20 HN SER 20 -18.353 -14.701 6.845 168 HA SER 20 HA SER 20 -17.999 -15.249 4.027 169 HB2 SER 20 HB2 SER 20 -20.521 -14.209 4.324 170 HB3 SER 20 HB1 SER 20 -20.108 -15.919 4.458 171 HG SER 20 HG SER 20 -20.919 -15.682 6.393 172 H ASP 21 HN ASP 21 -17.248 -12.637 5.895 173 HA ASP 21 HA ASP 21 -18.335 -10.556 4.217 174 HB2 ASP 21 HB2 ASP 21 -17.618 -10.460 6.763 175 HB3 ASP 21 HB1 ASP 21 -16.050 -10.047 6.080 176 H THR 22 HN THR 22 -17.089 -9.124 2.921 177 HA THR 22 HA THR 22 -14.855 -10.487 1.589 178 HB THR 22 HB THR 22 -16.333 -8.062 0.571 179 HG1 THR 22 HG1 THR 22 -17.806 -9.835 1.018 180 HG21 THR 22 HG21 THR 22 -14.943 -10.282 -0.929 181 HG22 THR 22 HG22 THR 22 -14.179 -8.752 -0.497 182 HG23 THR 22 HG23 THR 22 -15.565 -8.766 -1.586 183 H ILE 23 HN ILE 23 -12.887 -9.451 1.206 184 HA ILE 23 HA ILE 23 -11.842 -7.783 3.156 185 HB ILE 23 HB ILE 23 -10.904 -8.145 0.306 186 HG12 ILE 23 HG12 ILE 23 -11.002 -10.223 1.636 187 HG13 ILE 23 HG11 ILE 23 -9.349 -9.773 1.236 188 HG21 ILE 23 HG21 ILE 23 -8.718 -7.360 1.085 189 HG22 ILE 23 HG22 ILE 23 -9.417 -7.003 2.664 190 HG23 ILE 23 HG23 ILE 23 -9.958 -6.113 1.240 191 HD11 ILE 23 HD11 ILE 23 -10.718 -9.395 3.887 192 HD12 ILE 23 HD12 ILE 23 -9.092 -8.834 3.498 193 HD13 ILE 23 HD13 ILE 23 -9.453 -10.560 3.501 194 H GLU 24 HN GLU 24 -13.163 -6.921 -0.013 195 HA GLU 24 HA GLU 24 -12.540 -4.208 -0.014 196 HB2 GLU 24 HB2 GLU 24 -13.539 -5.668 -1.879 197 HB3 GLU 24 HB1 GLU 24 -15.098 -5.300 -1.154 198 HG2 GLU 24 HG2 GLU 24 -14.295 -2.832 -1.364 199 HG3 GLU 24 HG1 GLU 24 -13.194 -3.496 -2.571 200 H ASN 25 HN ASN 25 -15.186 -5.932 1.525 201 HA ASN 25 HA ASN 25 -16.673 -3.586 2.221 202 HB2 ASN 25 HB2 ASN 25 -17.598 -5.961 2.036 203 HB3 ASN 25 HB1 ASN 25 -16.843 -6.271 3.596 204 HD21 ASN 25 HD21 ASN 25 -18.739 -6.631 4.655 205 HD22 ASN 25 HD22 ASN 25 -19.894 -5.372 4.979 206 H VAL 26 HN VAL 26 -14.205 -5.568 3.717 207 HA VAL 26 HA VAL 26 -14.334 -4.467 6.313 208 HB VAL 26 HB VAL 26 -11.910 -5.624 4.916 209 HG11 VAL 26 HG11 VAL 26 -12.516 -5.430 7.866 210 HG12 VAL 26 HG12 VAL 26 -11.442 -4.340 6.988 211 HG13 VAL 26 HG13 VAL 26 -11.041 -6.052 7.124 212 HG21 VAL 26 HG21 VAL 26 -13.799 -7.179 4.868 213 HG22 VAL 26 HG22 VAL 26 -13.983 -7.012 6.614 214 HG23 VAL 26 HG23 VAL 26 -12.526 -7.747 5.947 215 H LYS 27 HN LYS 27 -12.440 -3.638 3.431 216 HA LYS 27 HA LYS 27 -10.916 -1.568 4.570 217 HB2 LYS 27 HB2 LYS 27 -11.843 -1.889 1.708 218 HB3 LYS 27 HB1 LYS 27 -10.580 -0.788 2.246 219 HG2 LYS 27 HG2 LYS 27 -9.642 -3.098 3.243 220 HG3 LYS 27 HG1 LYS 27 -10.515 -3.703 1.836 221 HD2 LYS 27 HD2 LYS 27 -8.317 -1.635 1.871 222 HD3 LYS 27 HD1 LYS 27 -8.232 -3.268 1.211 223 HE2 LYS 27 HE2 LYS 27 -10.265 -2.409 -0.241 224 HE3 LYS 27 HE1 LYS 27 -9.555 -0.835 0.117 225 HZ1 LYS 27 HZ1 LYS 27 -7.980 -1.194 -1.386 226 HZ2 LYS 27 HZ2 LYS 27 -8.776 -2.625 -1.842 227 HZ3 LYS 27 HZ3 LYS 27 -7.551 -2.667 -0.677 228 H ALA 28 HN ALA 28 -14.128 -1.623 3.138 229 HA ALA 28 HA ALA 28 -14.551 1.165 3.059 230 HB1 ALA 28 HB1 ALA 28 -15.955 -0.437 1.839 231 HB2 ALA 28 HB2 ALA 28 -16.916 0.626 2.866 232 HB3 ALA 28 HB3 ALA 28 -16.595 -1.033 3.371 233 H LYS 29 HN LYS 29 -15.073 -1.279 5.539 234 HA LYS 29 HA LYS 29 -16.402 0.353 7.417 235 HB2 LYS 29 HB2 LYS 29 -14.689 -2.115 7.780 236 HB3 LYS 29 HB1 LYS 29 -15.594 -1.360 9.088 237 HG2 LYS 29 HG2 LYS 29 -17.678 -1.821 7.983 238 HG3 LYS 29 HG1 LYS 29 -16.833 -2.418 6.553 239 HD2 LYS 29 HD2 LYS 29 -15.905 -4.259 7.866 240 HD3 LYS 29 HD1 LYS 29 -16.724 -3.655 9.306 241 HE2 LYS 29 HE2 LYS 29 -18.894 -3.958 8.155 242 HE3 LYS 29 HE1 LYS 29 -18.039 -4.642 6.777 243 HZ1 LYS 29 HZ1 LYS 29 -17.532 -5.863 9.381 244 HZ2 LYS 29 HZ2 LYS 29 -17.662 -6.586 7.844 245 HZ3 LYS 29 HZ3 LYS 29 -19.054 -6.124 8.692 246 H ILE 30 HN ILE 30 -13.008 -0.248 6.731 247 HA ILE 30 HA ILE 30 -11.954 1.170 8.955 248 HB ILE 30 HB ILE 30 -10.643 0.635 6.279 249 HG12 ILE 30 HG12 ILE 30 -10.456 -0.938 8.858 250 HG13 ILE 30 HG11 ILE 30 -11.429 -1.414 7.471 251 HG21 ILE 30 HG21 ILE 30 -9.523 2.396 7.546 252 HG22 ILE 30 HG22 ILE 30 -8.531 0.940 7.486 253 HG23 ILE 30 HG23 ILE 30 -9.429 1.336 8.952 254 HD11 ILE 30 HD11 ILE 30 -9.359 -2.645 7.508 255 HD12 ILE 30 HD12 ILE 30 -8.434 -1.145 7.543 256 HD13 ILE 30 HD13 ILE 30 -9.384 -1.559 6.118 257 H GLN 31 HN GLN 31 -12.903 2.073 5.692 258 HA GLN 31 HA GLN 31 -11.808 4.696 5.773 259 HB2 GLN 31 HB2 GLN 31 -12.331 3.629 3.645 260 HB3 GLN 31 HB1 GLN 31 -14.038 3.567 4.069 261 HG2 GLN 31 HG2 GLN 31 -14.090 6.021 4.126 262 HG3 GLN 31 HG1 GLN 31 -12.397 6.054 3.636 263 HE21 GLN 31 HE21 GLN 31 -12.874 7.192 1.768 264 HE22 GLN 31 HE22 GLN 31 -13.655 6.452 0.413 265 H ASP 32 HN ASP 32 -14.977 3.339 6.514 266 HA ASP 32 HA ASP 32 -16.275 5.808 6.999 267 HB2 ASP 32 HB2 ASP 32 -17.498 3.711 6.580 268 HB3 ASP 32 HB1 ASP 32 -16.898 3.058 8.098 269 H LYS 33 HN LYS 33 -14.344 3.675 8.977 270 HA LYS 33 HA LYS 33 -14.975 5.072 11.426 271 HB2 LYS 33 HB2 LYS 33 -14.532 2.566 11.155 272 HB3 LYS 33 HB1 LYS 33 -12.833 2.995 11.069 273 HG2 LYS 33 HG2 LYS 33 -12.803 3.776 13.279 274 HG3 LYS 33 HG1 LYS 33 -14.566 3.824 13.369 275 HD2 LYS 33 HD2 LYS 33 -14.642 1.386 13.200 276 HD3 LYS 33 HD1 LYS 33 -12.882 1.337 13.104 277 HE2 LYS 33 HE2 LYS 33 -12.639 2.056 15.328 278 HE3 LYS 33 HE1 LYS 33 -14.318 2.581 15.430 279 HZ1 LYS 33 HZ1 LYS 33 -13.910 0.481 16.602 280 HZ2 LYS 33 HZ2 LYS 33 -13.437 -0.243 15.150 281 HZ3 LYS 33 HZ3 LYS 33 -15.028 0.295 15.347 282 H GLU 34 HN GLU 34 -11.841 4.290 9.909 283 HA GLU 34 HA GLU 34 -10.519 6.379 11.369 284 HB2 GLU 34 HB2 GLU 34 -9.565 4.511 9.204 285 HB3 GLU 34 HB1 GLU 34 -8.523 5.637 10.062 286 HG2 GLU 34 HG2 GLU 34 -10.109 3.432 11.356 287 HG3 GLU 34 HG1 GLU 34 -8.398 3.341 10.932 288 H GLY 35 HN GLY 35 -11.806 6.043 8.135 289 HA2 GLY 35 HA2 GLY 35 -12.249 7.790 6.644 290 HA3 GLY 35 HA1 GLY 35 -11.320 8.870 7.676 291 H ILE 36 HN ILE 36 -10.393 5.807 6.182 292 HA ILE 36 HA ILE 36 -8.214 7.224 4.799 293 HB ILE 36 HB ILE 36 -8.280 4.372 5.803 294 HG12 ILE 36 HG12 ILE 36 -6.538 6.681 6.694 295 HG13 ILE 36 HG11 ILE 36 -7.998 6.172 7.533 296 HG21 ILE 36 HG21 ILE 36 -6.050 5.856 4.417 297 HG22 ILE 36 HG22 ILE 36 -7.037 4.583 3.701 298 HG23 ILE 36 HG23 ILE 36 -5.969 4.215 5.057 299 HD11 ILE 36 HD11 ILE 36 -5.996 5.300 8.603 300 HD12 ILE 36 HD12 ILE 36 -5.543 4.486 7.105 301 HD13 ILE 36 HD13 ILE 36 -7.000 3.995 7.970 302 HA PRO 37 HA PRO 37 -10.314 6.038 1.017 303 HB2 PRO 37 HB2 PRO 37 -7.567 6.314 -0.097 304 HB3 PRO 37 HB1 PRO 37 -9.078 7.090 -0.612 305 HG2 PRO 37 HG2 PRO 37 -7.210 8.456 0.683 306 HG3 PRO 37 HG1 PRO 37 -8.936 8.743 0.964 307 HD2 PRO 37 HD2 PRO 37 -6.965 7.315 2.673 308 HD3 PRO 37 HD1 PRO 37 -8.352 8.322 3.136 309 HA PRO 38 HA PRO 38 -9.395 1.659 1.083 310 HB2 PRO 38 HB2 PRO 38 -10.816 1.672 -1.523 311 HB3 PRO 38 HB1 PRO 38 -11.168 0.753 -0.049 312 HG2 PRO 38 HG2 PRO 38 -12.698 2.793 -0.797 313 HG3 PRO 38 HG1 PRO 38 -12.354 2.457 0.911 314 HD2 PRO 38 HD2 PRO 38 -11.217 4.564 -0.859 315 HD3 PRO 38 HD1 PRO 38 -11.636 4.633 0.864 316 H ASP 39 HN ASP 39 -8.697 3.798 -1.562 317 HA ASP 39 HA ASP 39 -7.286 2.057 -3.255 318 HB2 ASP 39 HB2 ASP 39 -6.672 4.988 -2.879 319 HB3 ASP 39 HB1 ASP 39 -6.445 4.015 -4.328 320 H GLN 40 HN GLN 40 -6.171 4.167 -0.638 321 HA GLN 40 HA GLN 40 -3.435 3.248 -0.949 322 HB2 GLN 40 HB2 GLN 40 -4.627 5.144 1.079 323 HB3 GLN 40 HB1 GLN 40 -2.912 4.856 0.821 324 HG2 GLN 40 HG2 GLN 40 -3.234 5.684 -1.531 325 HG3 GLN 40 HG1 GLN 40 -4.862 6.168 -1.052 326 HE21 GLN 40 HE21 GLN 40 -2.676 7.837 -1.959 327 HE22 GLN 40 HE22 GLN 40 -2.355 8.960 -0.684 328 H GLN 41 HN GLN 41 -6.029 1.867 0.384 329 HA GLN 41 HA GLN 41 -4.889 1.086 2.925 330 HB2 GLN 41 HB2 GLN 41 -7.444 0.384 1.495 331 HB3 GLN 41 HB1 GLN 41 -6.943 -0.456 2.954 332 HG2 GLN 41 HG2 GLN 41 -6.815 1.848 4.032 333 HG3 GLN 41 HG1 GLN 41 -7.709 2.419 2.622 334 HE21 GLN 41 HE21 GLN 41 -9.568 2.945 3.756 335 HE22 GLN 41 HE22 GLN 41 -10.604 1.739 4.445 336 H ARG 42 HN ARG 42 -2.998 -0.010 2.341 337 HA ARG 42 HA ARG 42 -3.276 -2.399 0.684 338 HB2 ARG 42 HB2 ARG 42 -1.290 -0.674 0.643 339 HB3 ARG 42 HB1 ARG 42 -0.719 -1.580 2.034 340 HG2 ARG 42 HG2 ARG 42 -0.409 -3.531 0.786 341 HG3 ARG 42 HG1 ARG 42 -1.420 -2.949 -0.536 342 HD2 ARG 42 HD2 ARG 42 0.282 -1.210 -1.016 343 HD3 ARG 42 HD1 ARG 42 1.306 -1.904 0.242 344 HE ARG 42 HE ARG 42 0.611 -3.940 -1.555 345 HH11 ARG 42 HH11 ARG 42 2.518 -0.985 -1.523 346 HH12 ARG 42 HH12 ARG 42 3.639 -1.573 -2.714 347 HH21 ARG 42 HH21 ARG 42 2.119 -4.688 -3.120 348 HH22 ARG 42 HH22 ARG 42 3.408 -3.635 -3.636 349 H LEU 43 HN LEU 43 -4.332 -3.902 1.846 350 HA LEU 43 HA LEU 43 -3.760 -4.324 4.650 351 HB2 LEU 43 HB2 LEU 43 -5.787 -5.333 2.718 352 HB3 LEU 43 HB1 LEU 43 -5.451 -6.292 4.145 353 HG LEU 43 HG LEU 43 -6.330 -3.405 4.210 354 HD11 LEU 43 HD11 LEU 43 -7.936 -5.913 4.679 355 HD12 LEU 43 HD12 LEU 43 -8.080 -4.835 3.291 356 HD13 LEU 43 HD13 LEU 43 -8.502 -4.258 4.903 357 HD21 LEU 43 HD21 LEU 43 -6.790 -3.924 6.596 358 HD22 LEU 43 HD22 LEU 43 -5.080 -3.995 6.178 359 HD23 LEU 43 HD23 LEU 43 -6.002 -5.486 6.369 360 H ILE 44 HN ILE 44 -2.590 -5.894 5.513 361 HA ILE 44 HA ILE 44 -1.616 -8.055 3.769 362 HB ILE 44 HB ILE 44 -0.031 -6.202 5.514 363 HG12 ILE 44 HG12 ILE 44 1.588 -6.779 3.488 364 HG13 ILE 44 HG11 ILE 44 0.074 -7.231 2.719 365 HG21 ILE 44 HG21 ILE 44 0.481 -8.369 6.454 366 HG22 ILE 44 HG22 ILE 44 1.858 -7.778 5.524 367 HG23 ILE 44 HG23 ILE 44 0.803 -9.020 4.848 368 HD11 ILE 44 HD11 ILE 44 0.595 -4.975 2.144 369 HD12 ILE 44 HD12 ILE 44 0.801 -4.543 3.841 370 HD13 ILE 44 HD13 ILE 44 -0.796 -4.970 3.228 371 H PHE 45 HN PHE 45 -1.578 -10.044 4.673 372 HA PHE 45 HA PHE 45 -2.216 -10.283 7.535 373 HB2 PHE 45 HB2 PHE 45 -4.207 -10.781 6.068 374 HB3 PHE 45 HB1 PHE 45 -3.283 -12.105 5.365 375 HD1 PHE 45 HD1 PHE 45 -4.346 -10.833 8.708 376 HD2 PHE 45 HD2 PHE 45 -3.563 -14.212 6.238 377 HE1 PHE 45 HE1 PHE 45 -5.115 -12.321 10.507 378 HE2 PHE 45 HE2 PHE 45 -4.330 -15.707 8.036 379 HZ PHE 45 HZ PHE 45 -5.108 -14.760 10.173 380 H ALA 46 HN ALA 46 -0.684 -11.337 8.567 381 HA ALA 46 HA ALA 46 0.953 -12.810 9.123 382 HB1 ALA 46 HB1 ALA 46 1.299 -14.851 7.852 383 HB2 ALA 46 HB2 ALA 46 0.341 -14.205 6.520 384 HB3 ALA 46 HB3 ALA 46 -0.427 -14.550 8.069 385 H GLY 47 HN GLY 47 1.092 -12.083 5.644 386 HA2 GLY 47 HA2 GLY 47 3.344 -10.452 5.763 387 HA3 GLY 47 HA1 GLY 47 3.919 -12.089 5.483 388 H LYS 48 HN LYS 48 0.816 -11.228 4.225 389 HA LYS 48 HA LYS 48 1.926 -10.635 1.587 390 HB2 LYS 48 HB2 LYS 48 0.028 -12.908 2.191 391 HB3 LYS 48 HB1 LYS 48 0.287 -12.275 0.574 392 HG2 LYS 48 HG2 LYS 48 2.589 -12.959 0.612 393 HG3 LYS 48 HG1 LYS 48 2.457 -13.439 2.305 394 HD2 LYS 48 HD2 LYS 48 0.792 -14.662 0.110 395 HD3 LYS 48 HD1 LYS 48 2.346 -15.320 0.627 396 HE2 LYS 48 HE2 LYS 48 1.446 -15.511 2.925 397 HE3 LYS 48 HE1 LYS 48 -0.118 -14.956 2.329 398 HZ1 LYS 48 HZ1 LYS 48 0.034 -17.387 2.521 399 HZ2 LYS 48 HZ2 LYS 48 1.281 -17.394 1.378 400 HZ3 LYS 48 HZ3 LYS 48 -0.269 -16.889 0.933 401 H GLN 49 HN GLN 49 0.357 -9.718 0.127 402 HA GLN 49 HA GLN 49 -1.504 -8.003 1.493 403 HB2 GLN 49 HB2 GLN 49 -0.015 -7.623 -0.692 404 HB3 GLN 49 HB1 GLN 49 -1.481 -8.183 -1.477 405 HG2 GLN 49 HG2 GLN 49 -2.671 -6.409 -0.055 406 HG3 GLN 49 HG1 GLN 49 -1.060 -5.737 0.191 407 HE21 GLN 49 HE21 GLN 49 -3.599 -6.350 -2.089 408 HE22 GLN 49 HE22 GLN 49 -2.979 -5.352 -3.361 409 H LEU 50 HN LEU 50 -3.734 -7.812 0.997 410 HA LEU 50 HA LEU 50 -4.972 -10.366 0.226 411 HB2 LEU 50 HB2 LEU 50 -6.270 -8.127 1.775 412 HB3 LEU 50 HB1 LEU 50 -6.838 -9.774 1.594 413 HG LEU 50 HG LEU 50 -4.372 -8.951 3.129 414 HD11 LEU 50 HD11 LEU 50 -7.057 -9.893 4.123 415 HD12 LEU 50 HD12 LEU 50 -6.460 -8.236 4.203 416 HD13 LEU 50 HD13 LEU 50 -5.651 -9.510 5.113 417 HD21 LEU 50 HD21 LEU 50 -4.412 -11.276 3.926 418 HD22 LEU 50 HD22 LEU 50 -4.130 -11.162 2.190 419 HD23 LEU 50 HD23 LEU 50 -5.720 -11.625 2.799 420 H GLU 51 HN GLU 51 -6.638 -10.391 -1.274 421 HA GLU 51 HA GLU 51 -6.752 -8.064 -3.028 422 HB2 GLU 51 HB2 GLU 51 -7.837 -10.861 -3.324 423 HB3 GLU 51 HB1 GLU 51 -8.046 -9.598 -4.525 424 HG2 GLU 51 HG2 GLU 51 -5.540 -9.447 -4.632 425 HG3 GLU 51 HG1 GLU 51 -5.495 -10.912 -3.650 426 H ASP 52 HN ASP 52 -8.672 -7.048 -3.638 427 HA ASP 52 HA ASP 52 -10.569 -6.747 -1.537 428 HB2 ASP 52 HB2 ASP 52 -10.197 -5.555 -4.248 429 HB3 ASP 52 HB1 ASP 52 -11.747 -5.350 -3.440 430 H GLY 53 HN GLY 53 -10.435 -8.834 -4.255 431 HA2 GLY 53 HA2 GLY 53 -13.336 -9.228 -4.247 432 HA3 GLY 53 HA1 GLY 53 -12.210 -9.874 -5.431 433 H ARG 54 HN ARG 54 -11.347 -10.212 -2.103 434 HA ARG 54 HA ARG 54 -12.168 -13.044 -2.222 435 HB2 ARG 54 HB2 ARG 54 -9.783 -11.989 -0.709 436 HB3 ARG 54 HB1 ARG 54 -10.199 -13.666 -1.020 437 HG2 ARG 54 HG2 ARG 54 -9.502 -11.707 -3.181 438 HG3 ARG 54 HG1 ARG 54 -8.318 -12.742 -2.380 439 HD2 ARG 54 HD2 ARG 54 -9.488 -14.720 -3.146 440 HD3 ARG 54 HD1 ARG 54 -10.758 -13.723 -3.860 441 HE ARG 54 HE ARG 54 -8.094 -13.164 -4.839 442 HH11 ARG 54 HH11 ARG 54 -10.995 -15.091 -5.289 443 HH12 ARG 54 HH12 ARG 54 -10.675 -15.381 -6.970 444 HH21 ARG 54 HH21 ARG 54 -7.702 -13.526 -7.029 445 HH22 ARG 54 HH22 ARG 54 -8.805 -14.493 -7.958 446 H THR 55 HN THR 55 -12.605 -14.065 -0.186 447 HA THR 55 HA THR 55 -13.822 -12.198 1.717 448 HB THR 55 HB THR 55 -15.028 -14.137 2.591 449 HG1 THR 55 HG1 THR 55 -13.567 -15.598 0.609 450 HG21 THR 55 HG21 THR 55 -16.410 -14.654 0.650 451 HG22 THR 55 HG22 THR 55 -15.155 -14.038 -0.425 452 HG23 THR 55 HG23 THR 55 -15.993 -12.942 0.674 453 H LEU 56 HN LEU 56 -13.738 -13.125 4.074 454 HA LEU 56 HA LEU 56 -11.011 -13.139 4.852 455 HB2 LEU 56 HB2 LEU 56 -13.445 -13.880 6.477 456 HB3 LEU 56 HB1 LEU 56 -11.854 -13.528 7.122 457 HG LEU 56 HG LEU 56 -13.752 -11.604 5.788 458 HD11 LEU 56 HD11 LEU 56 -12.556 -11.738 8.548 459 HD12 LEU 56 HD12 LEU 56 -14.233 -12.067 8.112 460 HD13 LEU 56 HD13 LEU 56 -13.579 -10.439 7.939 461 HD21 LEU 56 HD21 LEU 56 -12.031 -9.894 6.153 462 HD22 LEU 56 HD22 LEU 56 -11.502 -11.123 5.006 463 HD23 LEU 56 HD23 LEU 56 -10.901 -11.149 6.663 464 H SER 57 HN SER 57 -13.334 -15.616 4.163 465 HA SER 57 HA SER 57 -11.951 -17.773 5.405 466 HB2 SER 57 HB2 SER 57 -13.988 -17.848 3.170 467 HB3 SER 57 HB1 SER 57 -13.508 -19.203 4.190 468 HG SER 57 HG SER 57 -15.142 -17.020 4.760 469 H ASP 58 HN ASP 58 -11.650 -16.138 2.359 470 HA ASP 58 HA ASP 58 -10.388 -18.175 0.868 471 HB2 ASP 58 HB2 ASP 58 -10.454 -15.180 0.666 472 HB3 ASP 58 HB1 ASP 58 -9.379 -16.110 -0.373 473 H TYR 59 HN TYR 59 -9.246 -16.036 3.338 474 HA TYR 59 HA TYR 59 -6.493 -16.985 2.893 475 HB2 TYR 59 HB2 TYR 59 -7.468 -14.532 4.377 476 HB3 TYR 59 HB1 TYR 59 -5.783 -15.036 4.262 477 HD1 TYR 59 HD1 TYR 59 -4.700 -15.106 1.981 478 HD2 TYR 59 HD2 TYR 59 -8.471 -13.269 2.680 479 HE1 TYR 59 HE1 TYR 59 -4.477 -13.871 -0.132 480 HE2 TYR 59 HE2 TYR 59 -8.262 -12.023 0.572 481 HH TYR 59 HH TYR 59 -5.847 -12.755 -1.763 482 H ASN 60 HN ASN 60 -9.038 -17.913 4.430 483 HA ASN 60 HA ASN 60 -9.582 -19.061 6.298 484 HB2 ASN 60 HB2 ASN 60 -7.439 -20.267 5.363 485 HB3 ASN 60 HB1 ASN 60 -6.699 -19.649 6.837 486 HD21 ASN 60 HD21 ASN 60 -6.424 -21.629 7.771 487 HD22 ASN 60 HD22 ASN 60 -7.736 -22.610 8.319 488 H ILE 61 HN ILE 61 -9.324 -16.321 6.716 489 HA ILE 61 HA ILE 61 -7.749 -15.773 9.033 490 HB ILE 61 HB ILE 61 -10.058 -14.232 7.828 491 HG12 ILE 61 HG12 ILE 61 -7.073 -13.753 7.678 492 HG13 ILE 61 HG11 ILE 61 -8.032 -14.489 6.399 493 HG21 ILE 61 HG21 ILE 61 -9.268 -12.344 9.184 494 HG22 ILE 61 HG22 ILE 61 -8.075 -13.396 9.944 495 HG23 ILE 61 HG23 ILE 61 -9.795 -13.693 10.191 496 HD11 ILE 61 HD11 ILE 61 -8.435 -11.708 7.469 497 HD12 ILE 61 HD12 ILE 61 -9.274 -12.450 6.105 498 HD13 ILE 61 HD13 ILE 61 -7.545 -12.117 6.002 499 H GLN 62 HN GLN 62 -8.160 -16.529 10.974 500 HA GLN 62 HA GLN 62 -10.803 -17.507 11.669 501 HB2 GLN 62 HB2 GLN 62 -8.249 -17.521 13.285 502 HB3 GLN 62 HB1 GLN 62 -9.716 -18.413 13.656 503 HG2 GLN 62 HG2 GLN 62 -8.961 -20.127 12.484 504 HG3 GLN 62 HG1 GLN 62 -8.925 -19.126 11.033 505 HE21 GLN 62 HE21 GLN 62 -7.002 -18.484 10.224 506 HE22 GLN 62 HE22 GLN 62 -5.468 -18.860 10.939 507 H LYS 63 HN LYS 63 -11.243 -17.102 14.181 508 HA LYS 63 HA LYS 63 -11.817 -14.308 14.388 509 HB2 LYS 63 HB2 LYS 63 -12.760 -14.950 16.621 510 HB3 LYS 63 HB1 LYS 63 -13.440 -15.841 15.268 511 HG2 LYS 63 HG2 LYS 63 -11.928 -17.722 15.803 512 HG3 LYS 63 HG1 LYS 63 -11.368 -16.827 17.215 513 HD2 LYS 63 HD2 LYS 63 -14.286 -17.386 16.792 514 HD3 LYS 63 HD1 LYS 63 -13.224 -18.586 17.528 515 HE2 LYS 63 HE2 LYS 63 -12.611 -17.007 19.269 516 HE3 LYS 63 HE1 LYS 63 -13.618 -15.768 18.522 517 HZ1 LYS 63 HZ1 LYS 63 -15.562 -17.015 19.010 518 HZ2 LYS 63 HZ2 LYS 63 -14.657 -16.926 20.432 519 HZ3 LYS 63 HZ3 LYS 63 -14.665 -18.353 19.523 520 H GLU 64 HN GLU 64 -11.067 -12.863 15.996 521 HA GLU 64 HA GLU 64 -9.576 -11.863 17.389 522 HB2 GLU 64 HB2 GLU 64 -9.714 -14.496 18.328 523 HB3 GLU 64 HB1 GLU 64 -7.995 -14.144 18.213 524 HG2 GLU 64 HG2 GLU 64 -8.820 -13.632 20.419 525 HG3 GLU 64 HG1 GLU 64 -8.315 -12.160 19.599 526 H SER 65 HN SER 65 -8.882 -12.876 14.530 527 HA SER 65 HA SER 65 -6.013 -13.078 14.589 528 HB2 SER 65 HB2 SER 65 -7.890 -12.672 12.242 529 HB3 SER 65 HB1 SER 65 -6.174 -13.060 12.126 530 HG SER 65 HG SER 65 -8.333 -14.674 12.790 531 H THR 66 HN THR 66 -4.564 -11.589 13.566 532 HA THR 66 HA THR 66 -5.451 -8.797 13.827 533 HB THR 66 HB THR 66 -2.597 -9.781 13.885 534 HG1 THR 66 HG1 THR 66 -4.521 -10.140 15.737 535 HG21 THR 66 HG21 THR 66 -2.859 -7.401 13.450 536 HG22 THR 66 HG22 THR 66 -2.210 -7.650 15.071 537 HG23 THR 66 HG23 THR 66 -3.911 -7.236 14.856 538 H LEU 67 HN LEU 67 -5.283 -7.446 12.134 539 HA LEU 67 HA LEU 67 -4.031 -8.475 9.671 540 HB2 LEU 67 HB2 LEU 67 -6.509 -6.826 10.097 541 HB3 LEU 67 HB1 LEU 67 -5.640 -6.750 8.578 542 HG LEU 67 HG LEU 67 -5.917 -9.335 8.557 543 HD11 LEU 67 HD11 LEU 67 -7.943 -10.122 9.671 544 HD12 LEU 67 HD12 LEU 67 -8.123 -8.552 10.455 545 HD13 LEU 67 HD13 LEU 67 -6.736 -9.572 10.832 546 HD21 LEU 67 HD21 LEU 67 -8.211 -7.435 8.099 547 HD22 LEU 67 HD22 LEU 67 -8.135 -9.089 7.492 548 HD23 LEU 67 HD23 LEU 67 -6.961 -7.895 6.941 549 H HIS 68 HN HIS 68 -2.749 -7.057 8.490 550 HA HIS 68 HA HIS 68 -1.878 -4.689 9.998 551 HB2 HIS 68 HB2 HIS 68 -0.375 -6.059 7.763 552 HB3 HIS 68 HB1 HIS 68 0.249 -4.902 8.933 553 HD2 HIS 68 HD2 HIS 68 0.007 -6.047 11.707 554 HE1 HIS 68 HE1 HIS 68 0.844 -9.893 10.156 555 HE2 HIS 68 HE2 HIS 68 0.908 -8.424 12.217 556 H LEU 69 HN LEU 69 -2.214 -2.710 9.193 557 HA LEU 69 HA LEU 69 -3.127 -2.526 6.398 558 HB2 LEU 69 HB2 LEU 69 -4.835 -1.910 8.039 559 HB3 LEU 69 HB1 LEU 69 -3.748 -0.723 8.736 560 HG LEU 69 HG LEU 69 -3.782 0.517 6.580 561 HD11 LEU 69 HD11 LEU 69 -5.564 -0.033 4.964 562 HD12 LEU 69 HD12 LEU 69 -5.881 -1.522 5.853 563 HD13 LEU 69 HD13 LEU 69 -4.320 -1.279 5.065 564 HD21 LEU 69 HD21 LEU 69 -6.481 0.034 7.841 565 HD22 LEU 69 HD22 LEU 69 -6.035 1.425 6.852 566 HD23 LEU 69 HD23 LEU 69 -5.255 1.166 8.412 567 H VAL 70 HN VAL 70 -1.533 -1.857 5.139 568 HA VAL 70 HA VAL 70 0.434 0.051 6.181 569 HB VAL 70 HB VAL 70 0.454 -1.569 3.625 570 HG11 VAL 70 HG11 VAL 70 2.701 0.007 4.854 571 HG12 VAL 70 HG12 VAL 70 1.701 0.588 3.524 572 HG13 VAL 70 HG13 VAL 70 2.709 -0.845 3.311 573 HG21 VAL 70 HG21 VAL 70 0.669 -2.983 5.580 574 HG22 VAL 70 HG22 VAL 70 1.950 -1.948 6.213 575 HG23 VAL 70 HG23 VAL 70 2.212 -2.873 4.735 576 H LEU 71 HN LEU 71 0.299 2.134 5.667 577 HA LEU 71 HA LEU 71 -1.602 3.055 3.698 578 HB2 LEU 71 HB2 LEU 71 0.194 4.356 5.707 579 HB3 LEU 71 HB1 LEU 71 -0.456 5.321 4.395 580 HG LEU 71 HG LEU 71 -2.145 3.754 6.344 581 HD11 LEU 71 HD11 LEU 71 -1.488 6.695 6.280 582 HD12 LEU 71 HD12 LEU 71 -0.954 5.535 7.495 583 HD13 LEU 71 HD13 LEU 71 -2.666 5.929 7.346 584 HD21 LEU 71 HD21 LEU 71 -3.945 5.208 5.435 585 HD22 LEU 71 HD22 LEU 71 -3.276 4.082 4.255 586 HD23 LEU 71 HD23 LEU 71 -2.807 5.782 4.215 587 H ARG 72 HN ARG 72 -1.089 3.111 1.611 588 HA ARG 72 HA ARG 72 1.732 3.205 0.868 589 HB2 ARG 72 HB2 ARG 72 1.188 1.857 -0.832 590 HB3 ARG 72 HB1 ARG 72 -0.356 1.660 -0.025 591 HG2 ARG 72 HG2 ARG 72 -1.463 3.004 -1.513 592 HG3 ARG 72 HG1 ARG 72 -0.014 3.919 -1.937 593 HD2 ARG 72 HD2 ARG 72 -0.714 1.106 -2.765 594 HD3 ARG 72 HD1 ARG 72 -0.602 2.531 -3.801 595 HE ARG 72 HE ARG 72 1.857 2.144 -2.486 596 HH11 ARG 72 HH11 ARG 72 -0.091 0.593 -4.956 597 HH12 ARG 72 HH12 ARG 72 1.286 -0.033 -5.807 598 HH21 ARG 72 HH21 ARG 72 3.628 1.329 -3.549 599 HH22 ARG 72 HH22 ARG 72 3.427 0.375 -5.004 600 H LEU 73 HN LEU 73 2.598 4.650 -0.573 601 HA LEU 73 HA LEU 73 0.987 6.899 -1.508 602 HB2 LEU 73 HB2 LEU 73 3.532 7.225 0.091 603 HB3 LEU 73 HB1 LEU 73 2.705 8.518 -0.750 604 HG LEU 73 HG LEU 73 0.710 7.629 0.857 605 HD11 LEU 73 HD11 LEU 73 2.282 5.998 1.895 606 HD12 LEU 73 HD12 LEU 73 1.563 7.141 3.035 607 HD13 LEU 73 HD13 LEU 73 3.226 7.364 2.489 608 HD21 LEU 73 HD21 LEU 73 1.354 9.938 0.609 609 HD22 LEU 73 HD22 LEU 73 2.855 9.652 1.487 610 HD23 LEU 73 HD23 LEU 73 1.308 9.534 2.325 611 H ARG 74 HN ARG 74 2.095 8.103 -3.215 612 HA ARG 74 HA ARG 74 3.928 6.342 -4.665 613 HB2 ARG 74 HB2 ARG 74 2.359 8.756 -5.589 614 HB3 ARG 74 HB1 ARG 74 3.442 7.818 -6.609 615 HG2 ARG 74 HG2 ARG 74 0.887 6.883 -5.325 616 HG3 ARG 74 HG1 ARG 74 1.210 7.112 -7.044 617 HD2 ARG 74 HD2 ARG 74 2.977 5.353 -6.867 618 HD3 ARG 74 HD1 ARG 74 2.433 5.052 -5.218 619 HE ARG 74 HE ARG 74 0.168 4.832 -6.710 620 HH11 ARG 74 HH11 ARG 74 3.311 3.269 -6.756 621 HH12 ARG 74 HH12 ARG 74 2.711 1.817 -7.493 622 HH21 ARG 74 HH21 ARG 74 -0.618 2.921 -7.654 623 HH22 ARG 74 HH22 ARG 74 0.476 1.617 -7.997 624 H GLY 75 HN GLY 75 3.650 9.679 -3.536 625 HA2 GLY 75 HA2 GLY 75 6.531 10.013 -4.069 626 HA3 GLY 75 HA1 GLY 75 5.371 11.333 -4.027 627 H GLY 76 HN GLY 76 7.378 11.886 -2.531 628 HA2 GLY 76 HA2 GLY 76 6.336 11.689 0.162 629 HA3 GLY 76 HA1 GLY 76 7.900 10.921 -0.083 630 H1 SER 453 HT1 SER 453 19.624 12.044 15.561 631 H2 SER 453 HT2 SER 453 21.093 11.324 15.983 632 H3 SER 453 HT3 SER 453 20.639 12.794 16.683 633 HA SER 453 HA SER 453 20.357 10.944 18.204 634 HB2 SER 453 HB2 SER 453 17.628 11.937 17.421 635 HB3 SER 453 HB1 SER 453 18.291 11.679 19.034 636 HG SER 453 HG SER 453 19.055 13.633 19.012 637 H ASN 454 HN ASN 454 18.055 10.752 15.466 638 HA ASN 454 HA ASN 454 17.093 8.998 14.392 639 HB2 ASN 454 HB2 ASN 454 19.284 7.390 15.734 640 HB3 ASN 454 HB1 ASN 454 18.197 6.762 14.503 641 HD21 ASN 454 HD21 ASN 454 21.151 7.216 14.656 642 HD22 ASN 454 HD22 ASN 454 21.530 8.079 13.208 643 H SER 455 HN SER 455 16.435 9.791 17.200 644 HA SER 455 HA SER 455 15.616 7.509 18.657 645 HB2 SER 455 HB2 SER 455 14.019 9.585 19.522 646 HB3 SER 455 HB1 SER 455 15.642 9.228 20.121 647 HG SER 455 HG SER 455 15.387 11.417 19.407 648 H GLN 456 HN GLN 456 13.733 9.907 16.802 649 HA GLN 456 HA GLN 456 11.298 8.474 16.982 650 HB2 GLN 456 HB2 GLN 456 12.270 10.787 15.357 651 HB3 GLN 456 HB1 GLN 456 10.770 9.996 14.891 652 HG2 GLN 456 HG2 GLN 456 11.309 11.083 17.643 653 HG3 GLN 456 HG1 GLN 456 10.488 11.981 16.368 654 HE21 GLN 456 HE21 GLN 456 9.535 11.125 18.987 655 HE22 GLN 456 HE22 GLN 456 8.125 10.165 18.691 656 H LEU 457 HN LEU 457 13.953 8.473 14.706 657 HA LEU 457 HA LEU 457 12.688 7.042 12.635 658 HB2 LEU 457 HB2 LEU 457 15.596 7.225 13.411 659 HB3 LEU 457 HB1 LEU 457 15.024 6.454 11.945 660 HG LEU 457 HG LEU 457 14.685 9.372 12.640 661 HD11 LEU 457 HD11 LEU 457 16.261 9.747 10.803 662 HD12 LEU 457 HD12 LEU 457 16.463 8.002 10.636 663 HD13 LEU 457 HD13 LEU 457 16.986 8.811 12.112 664 HD21 LEU 457 HD21 LEU 457 12.822 8.646 11.310 665 HD22 LEU 457 HD22 LEU 457 13.894 7.801 10.193 666 HD23 LEU 457 HD23 LEU 457 13.924 9.562 10.282 667 H ASN 458 HN ASN 458 14.557 5.980 15.453 668 HA ASN 458 HA ASN 458 14.504 3.224 14.788 669 HB2 ASN 458 HB2 ASN 458 15.325 4.839 17.106 670 HB3 ASN 458 HB1 ASN 458 14.738 3.229 17.515 671 HD21 ASN 458 HD21 ASN 458 17.228 5.071 16.023 672 HD22 ASN 458 HD22 ASN 458 18.314 3.759 15.720 673 H ALA 459 HN ALA 459 12.477 5.250 16.872 674 HA ALA 459 HA ALA 459 10.801 3.209 17.833 675 HB1 ALA 459 HB1 ALA 459 10.923 5.478 18.797 676 HB2 ALA 459 HB2 ALA 459 9.267 4.978 18.450 677 HB3 ALA 459 HB3 ALA 459 10.093 6.105 17.373 678 H MET 460 HN MET 460 10.575 5.290 14.986 679 HA MET 460 HA MET 460 8.051 4.394 14.104 680 HB2 MET 460 HB2 MET 460 10.275 5.977 12.997 681 HB3 MET 460 HB1 MET 460 9.290 5.149 11.800 682 HG2 MET 460 HG2 MET 460 7.279 6.191 12.919 683 HG3 MET 460 HG1 MET 460 8.417 7.191 13.821 684 HE1 MET 460 HE1 MET 460 10.211 9.149 10.934 685 HE2 MET 460 HE2 MET 460 10.708 7.621 11.659 686 HE3 MET 460 HE3 MET 460 10.090 8.921 12.680 687 H ALA 461 HN ALA 461 11.339 3.271 13.446 688 HA ALA 461 HA ALA 461 10.746 1.473 11.382 689 HB1 ALA 461 HB1 ALA 461 12.928 1.286 13.455 690 HB2 ALA 461 HB2 ALA 461 13.022 2.159 11.925 691 HB3 ALA 461 HB3 ALA 461 12.872 0.403 11.930 692 H HIS 462 HN HIS 462 10.627 1.123 14.882 693 HA HIS 462 HA HIS 462 10.223 -1.668 14.953 694 HB2 HIS 462 HB2 HIS 462 10.848 -0.135 16.895 695 HB3 HIS 462 HB1 HIS 462 9.139 0.282 16.983 696 HD2 HIS 462 HD2 HIS 462 7.562 -1.487 18.295 697 HE1 HIS 462 HE1 HIS 462 10.502 -4.489 18.784 698 HE2 HIS 462 HE2 HIS 462 8.215 -3.680 19.517 699 H GLN 463 HN GLN 463 8.063 1.022 14.448 700 HA GLN 463 HA GLN 463 5.606 -0.253 14.911 701 HB2 GLN 463 HB2 GLN 463 6.148 1.881 12.838 702 HB3 GLN 463 HB1 GLN 463 4.607 1.518 13.601 703 HG2 GLN 463 HG2 GLN 463 6.961 2.394 15.226 704 HG3 GLN 463 HG1 GLN 463 5.935 3.563 14.398 705 HE21 GLN 463 HE21 GLN 463 3.777 3.769 15.025 706 HE22 GLN 463 HE22 GLN 463 3.235 3.232 16.575 707 H ILE 464 HN ILE 464 7.724 -0.157 12.111 708 HA ILE 464 HA ILE 464 5.911 -1.481 10.343 709 HB ILE 464 HB ILE 464 8.917 -1.214 10.135 710 HG12 ILE 464 HG12 ILE 464 6.714 0.472 8.929 711 HG13 ILE 464 HG11 ILE 464 7.759 0.959 10.257 712 HG21 ILE 464 HG21 ILE 464 8.621 -1.672 7.768 713 HG22 ILE 464 HG22 ILE 464 6.882 -1.846 8.001 714 HG23 ILE 464 HG23 ILE 464 7.991 -3.008 8.733 715 HD11 ILE 464 HD11 ILE 464 8.437 1.938 8.122 716 HD12 ILE 464 HD12 ILE 464 8.684 0.320 7.466 717 HD13 ILE 464 HD13 ILE 464 9.689 0.896 8.798 718 H GLN 465 HN GLN 465 8.609 -2.479 12.384 719 HA GLN 465 HA GLN 465 8.778 -5.152 11.561 720 HB2 GLN 465 HB2 GLN 465 10.324 -3.715 13.101 721 HB3 GLN 465 HB1 GLN 465 9.314 -4.344 14.395 722 HG2 GLN 465 HG2 GLN 465 11.208 -5.750 14.243 723 HG3 GLN 465 HG1 GLN 465 9.844 -6.646 13.571 724 HE21 GLN 465 HE21 GLN 465 11.124 -7.990 12.327 725 HE22 GLN 465 HE22 GLN 465 11.971 -7.435 10.922 726 H GLU 466 HN GLU 466 6.623 -3.538 13.784 727 HA GLU 466 HA GLU 466 5.618 -5.860 15.070 728 HB2 GLU 466 HB2 GLU 466 4.528 -3.070 14.748 729 HB3 GLU 466 HB1 GLU 466 3.701 -4.315 15.675 730 HG2 GLU 466 HG2 GLU 466 6.533 -3.483 16.231 731 HG3 GLU 466 HG1 GLU 466 5.139 -2.694 16.974 732 H MET 467 HN MET 467 5.019 -4.413 12.021 733 HA MET 467 HA MET 467 2.552 -5.968 11.690 734 HB2 MET 467 HB2 MET 467 3.692 -3.761 9.968 735 HB3 MET 467 HB1 MET 467 2.178 -4.600 9.673 736 HG2 MET 467 HG2 MET 467 1.798 -3.758 12.214 737 HG3 MET 467 HG1 MET 467 2.817 -2.467 11.583 738 HE1 MET 467 HE1 MET 467 1.780 -2.790 8.406 739 HE2 MET 467 HE2 MET 467 2.243 -1.282 9.192 740 HE3 MET 467 HE3 MET 467 0.674 -1.418 8.398 741 H PHE 468 HN PHE 468 5.740 -5.426 10.261 742 HA PHE 468 HA PHE 468 5.305 -7.792 8.565 743 HB2 PHE 468 HB2 PHE 468 6.847 -5.281 8.194 744 HB3 PHE 468 HB1 PHE 468 7.526 -6.751 7.502 745 HD1 PHE 468 HD1 PHE 468 4.243 -4.983 7.701 746 HD2 PHE 468 HD2 PHE 468 6.970 -7.244 5.340 747 HE1 PHE 468 HE1 PHE 468 2.752 -4.751 5.761 748 HE2 PHE 468 HE2 PHE 468 5.484 -7.012 3.396 749 HZ PHE 468 HZ PHE 468 3.370 -5.760 3.607 750 HA PRO 469 HA PRO 469 8.422 -9.341 11.487 751 HB2 PRO 469 HB2 PRO 469 7.330 -11.772 11.851 752 HB3 PRO 469 HB1 PRO 469 6.665 -10.334 12.644 753 HG2 PRO 469 HG2 PRO 469 5.615 -11.868 10.355 754 HG3 PRO 469 HG1 PRO 469 4.753 -10.933 11.589 755 HD2 PRO 469 HD2 PRO 469 5.383 -10.106 8.958 756 HD3 PRO 469 HD1 PRO 469 4.703 -9.113 10.261 757 H GLN 470 HN GLN 470 8.400 -9.386 8.462 758 HA GLN 470 HA GLN 470 10.094 -11.763 8.144 759 HB2 GLN 470 HB2 GLN 470 9.179 -12.085 5.869 760 HB3 GLN 470 HB1 GLN 470 7.968 -12.310 7.125 761 HG2 GLN 470 HG2 GLN 470 7.244 -9.932 6.691 762 HG3 GLN 470 HG1 GLN 470 8.292 -9.965 5.271 763 HE21 GLN 470 HE21 GLN 470 6.594 -9.722 3.835 764 HE22 GLN 470 HE22 GLN 470 5.445 -10.980 3.523 765 H VAL 471 HN VAL 471 10.527 -8.793 8.512 766 HA VAL 471 HA VAL 471 12.287 -8.463 6.188 767 HB VAL 471 HB VAL 471 10.363 -6.979 5.877 768 HG11 VAL 471 HG11 VAL 471 9.935 -5.114 7.395 769 HG12 VAL 471 HG12 VAL 471 11.155 -5.737 8.506 770 HG13 VAL 471 HG13 VAL 471 9.693 -6.670 8.189 771 HG21 VAL 471 HG21 VAL 471 12.480 -6.231 5.015 772 HG22 VAL 471 HG22 VAL 471 12.913 -5.536 6.576 773 HG23 VAL 471 HG23 VAL 471 11.585 -4.848 5.642 774 HA PRO 472 HA PRO 472 15.418 -8.159 9.326 775 HB2 PRO 472 HB2 PRO 472 16.861 -6.631 7.218 776 HB3 PRO 472 HB1 PRO 472 17.375 -8.071 8.114 777 HG2 PRO 472 HG2 PRO 472 16.657 -8.258 5.579 778 HG3 PRO 472 HG1 PRO 472 16.209 -9.513 6.753 779 HD2 PRO 472 HD2 PRO 472 14.524 -7.340 5.585 780 HD3 PRO 472 HD1 PRO 472 14.105 -9.026 5.952 781 H TYR 473 HN TYR 473 15.177 -6.776 10.932 782 HA TYR 473 HA TYR 473 14.126 -4.232 10.855 783 HB2 TYR 473 HB2 TYR 473 14.452 -5.688 12.883 784 HB3 TYR 473 HB1 TYR 473 16.139 -5.188 12.895 785 HD1 TYR 473 HD2 TYR 473 12.674 -4.065 13.383 786 HD2 TYR 473 HD1 TYR 473 16.781 -3.015 13.675 787 HE1 TYR 473 HE2 TYR 473 12.066 -2.087 14.707 788 HE2 TYR 473 HE1 TYR 473 16.186 -1.033 15.001 789 HH TYR 473 HH TYR 473 13.788 0.455 15.139 790 H HIS 474 HN HIS 474 17.552 -5.157 10.723 791 HA HIS 474 HA HIS 474 18.586 -2.550 10.883 792 HB2 HIS 474 HB2 HIS 474 20.666 -3.521 9.911 793 HB3 HIS 474 HB1 HIS 474 20.045 -4.410 11.294 794 HD2 HIS 474 HD2 HIS 474 20.714 -4.874 7.508 795 HE1 HIS 474 HE1 HIS 474 19.463 -8.571 9.147 796 HE2 HIS 474 HE2 HIS 474 20.359 -7.412 7.081 797 H LEU 475 HN LEU 475 17.205 -4.302 8.216 798 HA LEU 475 HA LEU 475 18.252 -2.442 6.256 799 HB2 LEU 475 HB2 LEU 475 16.395 -4.803 6.061 800 HB3 LEU 475 HB1 LEU 475 16.708 -3.745 4.698 801 HG LEU 475 HG LEU 475 18.764 -5.405 6.159 802 HD11 LEU 475 HD11 LEU 475 17.080 -6.532 4.597 803 HD12 LEU 475 HD12 LEU 475 18.795 -6.830 4.317 804 HD13 LEU 475 HD13 LEU 475 17.921 -5.686 3.299 805 HD21 LEU 475 HD21 LEU 475 19.863 -3.446 5.431 806 HD22 LEU 475 HD22 LEU 475 19.001 -3.445 3.893 807 HD23 LEU 475 HD23 LEU 475 20.216 -4.680 4.224 808 H VAL 476 HN VAL 476 15.466 -2.823 8.234 809 HA VAL 476 HA VAL 476 13.663 -1.217 6.726 810 HB VAL 476 HB VAL 476 13.690 -1.722 9.712 811 HG11 VAL 476 HG11 VAL 476 11.266 -1.211 9.558 812 HG12 VAL 476 HG12 VAL 476 11.516 -0.710 7.886 813 HG13 VAL 476 HG13 VAL 476 12.303 0.170 9.196 814 HG21 VAL 476 HG21 VAL 476 12.248 -3.193 7.510 815 HG22 VAL 476 HG22 VAL 476 12.036 -3.472 9.238 816 HG23 VAL 476 HG23 VAL 476 13.590 -3.809 8.475 817 H LEU 477 HN LEU 477 15.940 -0.600 9.345 818 HA LEU 477 HA LEU 477 15.347 2.141 9.675 819 HB2 LEU 477 HB2 LEU 477 17.480 0.284 10.531 820 HB3 LEU 477 HB1 LEU 477 17.924 1.980 10.484 821 HG LEU 477 HG LEU 477 15.537 0.926 11.995 822 HD11 LEU 477 HD11 LEU 477 16.905 1.219 14.007 823 HD12 LEU 477 HD12 LEU 477 18.305 1.566 12.993 824 HD13 LEU 477 HD13 LEU 477 17.549 -0.027 12.939 825 HD21 LEU 477 HD21 LEU 477 15.291 3.246 11.457 826 HD22 LEU 477 HD22 LEU 477 16.951 3.587 11.947 827 HD23 LEU 477 HD23 LEU 477 15.752 3.129 13.156 828 H GLN 478 HN GLN 478 17.179 0.415 7.336 829 HA GLN 478 HA GLN 478 18.961 2.401 6.481 830 HB2 GLN 478 HB2 GLN 478 19.207 0.093 5.777 831 HB3 GLN 478 HB1 GLN 478 17.658 0.143 4.947 832 HG2 GLN 478 HG2 GLN 478 18.720 2.029 3.553 833 HG3 GLN 478 HG1 GLN 478 20.249 1.429 4.188 834 HE21 GLN 478 HE21 GLN 478 17.476 -0.601 3.445 835 HE22 GLN 478 HE22 GLN 478 18.211 -1.428 2.117 836 H ASP 479 HN ASP 479 15.824 1.464 5.049 837 HA ASP 479 HA ASP 479 15.773 3.720 3.309 838 HB2 ASP 479 HB2 ASP 479 14.581 1.589 2.819 839 HB3 ASP 479 HB1 ASP 479 13.457 1.954 4.125 840 H LEU 480 HN LEU 480 14.596 3.087 6.530 841 HA LEU 480 HA LEU 480 12.729 5.130 6.839 842 HB2 LEU 480 HB2 LEU 480 14.024 3.266 8.494 843 HB3 LEU 480 HB1 LEU 480 14.342 4.830 9.216 844 HG LEU 480 HG LEU 480 12.379 3.818 10.216 845 HD11 LEU 480 HD11 LEU 480 11.694 6.157 8.441 846 HD12 LEU 480 HD12 LEU 480 12.374 6.226 10.067 847 HD13 LEU 480 HD13 LEU 480 10.739 5.613 9.821 848 HD21 LEU 480 HD21 LEU 480 11.723 2.403 8.334 849 HD22 LEU 480 HD22 LEU 480 11.194 3.831 7.445 850 HD23 LEU 480 HD23 LEU 480 10.371 3.363 8.931 851 H GLN 481 HN GLN 481 16.219 5.239 6.840 852 HA GLN 481 HA GLN 481 16.316 7.962 7.823 853 HB2 GLN 481 HB2 GLN 481 18.476 6.145 6.735 854 HB3 GLN 481 HB1 GLN 481 18.762 7.745 7.407 855 HG2 GLN 481 HG2 GLN 481 18.121 7.059 9.567 856 HG3 GLN 481 HG1 GLN 481 17.431 5.553 8.967 857 HE21 GLN 481 HE21 GLN 481 18.641 4.221 10.199 858 HE22 GLN 481 HE22 GLN 481 20.348 4.018 10.023 859 H LEU 482 HN LEU 482 15.619 6.567 4.883 860 HA LEU 482 HA LEU 482 16.747 8.814 3.358 861 HB2 LEU 482 HB2 LEU 482 16.162 5.990 2.711 862 HB3 LEU 482 HB1 LEU 482 15.824 7.148 1.443 863 HG LEU 482 HG LEU 482 18.021 6.225 1.118 864 HD11 LEU 482 HD11 LEU 482 18.394 9.004 2.202 865 HD12 LEU 482 HD12 LEU 482 17.589 8.658 0.672 866 HD13 LEU 482 HD13 LEU 482 19.281 8.213 0.897 867 HD21 LEU 482 HD21 LEU 482 18.558 5.495 3.333 868 HD22 LEU 482 HD22 LEU 482 18.573 7.154 3.927 869 HD23 LEU 482 HD23 LEU 482 19.811 6.611 2.793 870 H THR 483 HN THR 483 13.742 7.059 4.013 871 HA THR 483 HA THR 483 12.253 8.995 2.396 872 HB THR 483 HB THR 483 10.287 7.476 3.080 873 HG1 THR 483 HG1 THR 483 11.911 5.317 3.389 874 HG21 THR 483 HG21 THR 483 10.875 5.809 1.361 875 HG22 THR 483 HG22 THR 483 12.541 6.391 1.388 876 HG23 THR 483 HG23 THR 483 11.242 7.454 0.846 877 H ARG 484 HN ARG 484 12.701 7.964 5.712 878 HA ARG 484 HA ARG 484 12.082 8.819 7.716 879 HB2 ARG 484 HB2 ARG 484 11.577 11.340 6.121 880 HB3 ARG 484 HB1 ARG 484 11.649 11.247 7.875 881 HG2 ARG 484 HG2 ARG 484 13.806 11.730 7.689 882 HG3 ARG 484 HG1 ARG 484 14.025 10.097 7.059 883 HD2 ARG 484 HD2 ARG 484 13.415 11.117 4.780 884 HD3 ARG 484 HD1 ARG 484 13.728 12.671 5.551 885 HE ARG 484 HE ARG 484 15.908 10.994 6.047 886 HH11 ARG 484 HH11 ARG 484 14.387 12.639 3.357 887 HH12 ARG 484 HH12 ARG 484 15.856 12.756 2.441 888 HH21 ARG 484 HH21 ARG 484 17.825 11.127 4.840 889 HH22 ARG 484 HH22 ARG 484 17.811 11.891 3.283 890 H SER 485 HN SER 485 10.143 7.563 5.900 891 HA SER 485 HA SER 485 7.736 8.305 7.353 892 HB2 SER 485 HB2 SER 485 7.349 9.634 5.441 893 HB3 SER 485 HB1 SER 485 8.038 8.429 4.356 894 HG SER 485 HG SER 485 5.639 8.042 5.846 895 H VAL 486 HN VAL 486 7.217 6.452 8.286 896 HA VAL 486 HA VAL 486 8.073 3.912 7.540 897 HB VAL 486 HB VAL 486 6.164 3.087 9.010 898 HG11 VAL 486 HG11 VAL 486 8.098 5.108 10.120 899 HG12 VAL 486 HG12 VAL 486 8.422 3.399 9.832 900 HG13 VAL 486 HG13 VAL 486 7.247 3.881 11.058 901 HG21 VAL 486 HG21 VAL 486 4.666 5.003 8.676 902 HG22 VAL 486 HG22 VAL 486 5.824 6.046 9.499 903 HG23 VAL 486 HG23 VAL 486 5.026 4.745 10.383 904 H GLU 487 HN GLU 487 5.243 5.716 6.575 905 HA GLU 487 HA GLU 487 3.761 3.575 5.503 906 HB2 GLU 487 HB2 GLU 487 3.699 6.385 4.432 907 HB3 GLU 487 HB1 GLU 487 2.390 5.213 4.496 908 HG2 GLU 487 HG2 GLU 487 1.734 6.422 6.263 909 HG3 GLU 487 HG1 GLU 487 2.942 5.466 7.122 910 H ILE 488 HN ILE 488 5.939 5.916 3.928 911 HA ILE 488 HA ILE 488 5.757 4.739 1.360 912 HB ILE 488 HB ILE 488 8.011 6.435 2.443 913 HG12 ILE 488 HG12 ILE 488 5.548 7.311 0.919 914 HG13 ILE 488 HG11 ILE 488 5.737 7.467 2.662 915 HG21 ILE 488 HG21 ILE 488 7.125 5.844 -0.380 916 HG22 ILE 488 HG22 ILE 488 8.623 5.316 0.387 917 HG23 ILE 488 HG23 ILE 488 8.350 7.030 0.067 918 HD11 ILE 488 HD11 ILE 488 7.457 8.782 0.574 919 HD12 ILE 488 HD12 ILE 488 7.651 8.944 2.318 920 HD13 ILE 488 HD13 ILE 488 6.198 9.562 1.531 921 H THR 489 HN THR 489 7.922 4.241 4.089 922 HA THR 489 HA THR 489 9.856 2.674 2.788 923 HB THR 489 HB THR 489 8.989 2.500 5.681 924 HG1 THR 489 HG1 THR 489 10.936 4.133 4.376 925 HG21 THR 489 HG21 THR 489 11.489 1.616 4.250 926 HG22 THR 489 HG22 THR 489 10.350 0.616 5.150 927 HG23 THR 489 HG23 THR 489 11.371 1.773 6.004 928 H THR 490 HN THR 490 7.131 1.597 4.840 929 HA THR 490 HA THR 490 7.442 -1.135 4.387 930 HB THR 490 HB THR 490 4.739 0.120 4.806 931 HG1 THR 490 HG1 THR 490 6.012 1.144 6.320 932 HG21 THR 490 HG21 THR 490 4.819 -2.308 4.543 933 HG22 THR 490 HG22 THR 490 4.390 -1.879 6.199 934 HG23 THR 490 HG23 THR 490 6.028 -2.418 5.823 935 H ASP 491 HN ASP 491 5.566 1.269 2.578 936 HA ASP 491 HA ASP 491 4.290 -0.533 0.837 937 HB2 ASP 491 HB2 ASP 491 3.696 1.888 1.121 938 HB3 ASP 491 HB1 ASP 491 5.134 2.296 0.186 939 H ASN 492 HN ASN 492 7.322 1.267 0.547 940 HA ASN 492 HA ASN 492 8.011 0.354 -2.022 941 HB2 ASN 492 HB2 ASN 492 9.346 1.799 0.142 942 HB3 ASN 492 HB1 ASN 492 10.442 0.782 -0.791 943 HD21 ASN 492 HD21 ASN 492 8.324 3.521 -0.845 944 HD22 ASN 492 HD22 ASN 492 8.821 4.132 -2.385 945 H ILE 493 HN ILE 493 8.549 -1.024 1.177 946 HA ILE 493 HA ILE 493 10.370 -3.038 0.424 947 HB ILE 493 HB ILE 493 8.308 -3.051 2.644 948 HG12 ILE 493 HG12 ILE 493 11.291 -2.548 2.747 949 HG13 ILE 493 HG11 ILE 493 10.074 -1.275 2.729 950 HG21 ILE 493 HG21 ILE 493 9.615 -4.868 3.637 951 HG22 ILE 493 HG22 ILE 493 10.670 -4.885 2.223 952 HG23 ILE 493 HG23 ILE 493 8.971 -5.330 2.062 953 HD11 ILE 493 HD11 ILE 493 10.282 -3.399 4.850 954 HD12 ILE 493 HD12 ILE 493 9.218 -1.994 4.851 955 HD13 ILE 493 HD13 ILE 493 10.962 -1.777 4.977 956 H LEU 494 HN LEU 494 6.845 -2.923 0.490 957 HA LEU 494 HA LEU 494 6.371 -5.600 -0.273 958 HB2 LEU 494 HB2 LEU 494 4.758 -3.072 -0.407 959 HB3 LEU 494 HB1 LEU 494 4.150 -4.553 -1.122 960 HG LEU 494 HG LEU 494 5.059 -4.715 1.702 961 HD11 LEU 494 HD11 LEU 494 2.345 -3.617 1.080 962 HD12 LEU 494 HD12 LEU 494 3.718 -2.547 1.365 963 HD13 LEU 494 HD13 LEU 494 3.196 -3.664 2.625 964 HD21 LEU 494 HD21 LEU 494 3.875 -6.441 0.008 965 HD22 LEU 494 HD22 LEU 494 2.445 -5.719 0.771 966 HD23 LEU 494 HD23 LEU 494 3.677 -6.503 1.762 967 H GLU 495 HN GLU 495 6.957 -2.652 -2.101 968 HA GLU 495 HA GLU 495 6.336 -3.776 -4.653 969 HB2 GLU 495 HB2 GLU 495 8.012 -1.348 -3.973 970 HB3 GLU 495 HB1 GLU 495 7.413 -1.758 -5.575 971 HG2 GLU 495 HG2 GLU 495 5.677 -1.166 -3.186 972 HG3 GLU 495 HG1 GLU 495 6.088 -0.011 -4.452 973 H GLY 496 HN GLY 496 9.354 -3.203 -2.857 974 HA2 GLY 496 HA2 GLY 496 10.826 -5.307 -3.260 975 HA3 GLY 496 HA1 GLY 496 10.793 -4.731 -4.917 976 H ARG 497 HN ARG 497 11.131 -2.930 -1.864 977 HA ARG 497 HA ARG 497 13.458 -1.569 -2.957 978 HB2 ARG 497 HB2 ARG 497 12.093 -0.056 -1.821 979 HB3 ARG 497 HB1 ARG 497 11.727 -1.196 -0.534 980 HG2 ARG 497 HG2 ARG 497 13.108 0.360 0.491 981 HG3 ARG 497 HG1 ARG 497 14.211 -0.961 0.100 982 HD2 ARG 497 HD2 ARG 497 15.418 0.851 -0.631 983 HD3 ARG 497 HD1 ARG 497 14.570 0.394 -2.109 984 HE ARG 497 HE ARG 497 13.730 2.594 -0.308 985 HH11 ARG 497 HH11 ARG 497 14.052 1.198 -3.524 986 HH12 ARG 497 HH12 ARG 497 13.306 2.548 -4.314 987 HH21 ARG 497 HH21 ARG 497 12.750 4.356 -1.376 988 HH22 ARG 497 HH22 ARG 497 12.568 4.339 -3.102 989 H ILE 498 HN ILE 498 12.638 -3.820 -0.403 990 HA ILE 498 HA ILE 498 15.491 -4.127 0.231 991 HB ILE 498 HB ILE 498 13.062 -4.757 1.923 992 HG12 ILE 498 HG12 ILE 498 15.237 -2.673 2.249 993 HG13 ILE 498 HG11 ILE 498 13.579 -2.356 1.753 994 HG21 ILE 498 HG21 ILE 498 14.842 -6.383 2.297 995 HG22 ILE 498 HG22 ILE 498 14.631 -5.335 3.699 996 HG23 ILE 498 HG23 ILE 498 15.983 -5.074 2.597 997 HD11 ILE 498 HD11 ILE 498 14.614 -3.172 4.434 998 HD12 ILE 498 HD12 ILE 498 12.923 -3.407 3.995 999 HD13 ILE 498 HD13 ILE 498 13.616 -1.785 3.999 1000 H GLN 499 HN GLN 499 16.381 -6.172 0.214 1001 HA GLN 499 HA GLN 499 15.184 -8.072 -1.517 1002 HB2 GLN 499 HB2 GLN 499 17.552 -8.471 0.322 1003 HB3 GLN 499 HB1 GLN 499 17.145 -9.433 -1.091 1004 HG2 GLN 499 HG2 GLN 499 17.966 -6.540 -1.094 1005 HG3 GLN 499 HG1 GLN 499 18.968 -7.910 -1.567 1006 HE21 GLN 499 HE21 GLN 499 18.025 -5.524 -3.046 1007 HE22 GLN 499 HE22 GLN 499 17.268 -6.145 -4.470 1008 H VAL 500 HN VAL 500 13.615 -9.402 -0.990 1009 HA VAL 500 HA VAL 500 12.762 -9.887 1.657 1010 HB VAL 500 HB VAL 500 11.248 -11.584 0.629 1011 HG11 VAL 500 HG11 VAL 500 10.555 -9.266 0.784 1012 HG12 VAL 500 HG12 VAL 500 9.958 -9.978 -0.716 1013 HG13 VAL 500 HG13 VAL 500 11.355 -8.902 -0.746 1014 HG21 VAL 500 HG21 VAL 500 12.671 -10.809 -1.917 1015 HG22 VAL 500 HG22 VAL 500 11.191 -11.763 -1.833 1016 HG23 VAL 500 HG23 VAL 500 12.687 -12.394 -1.147 1017 HA PRO 501 HA PRO 501 15.112 -13.396 2.964 1018 HB2 PRO 501 HB2 PRO 501 12.647 -14.807 3.760 1019 HB3 PRO 501 HB1 PRO 501 13.982 -14.220 4.767 1020 HG2 PRO 501 HG2 PRO 501 11.590 -13.059 4.817 1021 HG3 PRO 501 HG1 PRO 501 13.092 -12.130 4.992 1022 HD2 PRO 501 HD2 PRO 501 11.327 -12.428 2.602 1023 HD3 PRO 501 HD1 PRO 501 12.161 -10.985 3.218 1024 H PHE 502 HN PHE 502 15.508 -13.889 0.665 1025 HA PHE 502 HA PHE 502 13.967 -16.017 -0.545 1026 HB2 PHE 502 HB2 PHE 502 15.010 -14.048 -1.782 1027 HB3 PHE 502 HB1 PHE 502 16.565 -14.829 -1.525 1028 HD1 PHE 502 HD1 PHE 502 13.307 -15.113 -3.209 1029 HD2 PHE 502 HD2 PHE 502 17.238 -16.703 -2.835 1030 HE1 PHE 502 HE1 PHE 502 12.958 -16.446 -5.247 1031 HE2 PHE 502 HE2 PHE 502 16.892 -18.040 -4.872 1032 HZ PHE 502 HZ PHE 502 14.751 -17.909 -6.080 1033 HA PRO 503 HA PRO 503 16.430 -19.265 1.240 1034 HB2 PRO 503 HB2 PRO 503 15.832 -21.208 -0.619 1035 HB3 PRO 503 HB1 PRO 503 14.772 -20.769 0.733 1036 HG2 PRO 503 HG2 PRO 503 14.625 -19.953 -2.121 1037 HG3 PRO 503 HG1 PRO 503 13.318 -20.362 -0.991 1038 HD2 PRO 503 HD2 PRO 503 13.912 -17.814 -1.631 1039 HD3 PRO 503 HD1 PRO 503 13.313 -18.276 -0.024 1040 H THR 504 HN THR 504 18.573 -19.195 1.046 1041 HA THR 504 HA THR 504 19.769 -19.762 -1.560 1042 HB THR 504 HB THR 504 19.728 -17.268 -1.126 1043 HG1 THR 504 HG1 THR 504 21.968 -18.819 -1.712 1044 HG21 THR 504 HG21 THR 504 21.755 -17.974 0.997 1045 HG22 THR 504 HG22 THR 504 20.149 -17.303 1.284 1046 HG23 THR 504 HG23 THR 504 21.366 -16.347 0.439 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 -18.747 -10.926 14.259 2 H2 MET 1 HT2 MET 1 -18.611 -12.568 13.905 3 H3 MET 1 HT3 MET 1 -17.776 -11.429 12.972 4 HA MET 1 HA MET 1 -17.312 -11.951 15.850 5 HB2 MET 1 HB2 MET 1 -15.278 -13.064 15.222 6 HB3 MET 1 HB1 MET 1 -16.594 -13.809 14.331 7 HG2 MET 1 HG2 MET 1 -15.970 -12.393 12.377 8 HG3 MET 1 HG1 MET 1 -14.554 -11.869 13.285 9 HE1 MET 1 HE1 MET 1 -12.987 -14.283 10.645 10 HE2 MET 1 HE2 MET 1 -12.913 -12.681 11.378 11 HE3 MET 1 HE3 MET 1 -14.318 -13.148 10.417 12 H GLN 2 HN GLN 2 -15.169 -10.984 16.516 13 HA GLN 2 HA GLN 2 -14.934 -8.315 15.290 14 HB2 GLN 2 HB2 GLN 2 -13.924 -9.113 18.015 15 HB3 GLN 2 HB1 GLN 2 -14.198 -7.492 17.396 16 HG2 GLN 2 HG2 GLN 2 -16.327 -9.525 18.009 17 HG3 GLN 2 HG1 GLN 2 -15.889 -8.153 19.020 18 HE21 GLN 2 HE21 GLN 2 -18.438 -8.811 17.845 19 HE22 GLN 2 HE22 GLN 2 -18.880 -7.475 16.841 20 H ILE 3 HN ILE 3 -12.960 -7.497 14.718 21 HA ILE 3 HA ILE 3 -10.604 -9.227 15.045 22 HB ILE 3 HB ILE 3 -9.817 -8.491 12.787 23 HG12 ILE 3 HG12 ILE 3 -12.682 -7.795 12.188 24 HG13 ILE 3 HG11 ILE 3 -11.544 -6.572 12.745 25 HG21 ILE 3 HG21 ILE 3 -11.183 -10.100 11.531 26 HG22 ILE 3 HG22 ILE 3 -12.342 -10.130 12.861 27 HG23 ILE 3 HG23 ILE 3 -10.697 -10.716 13.110 28 HD11 ILE 3 HD11 ILE 3 -11.185 -8.277 10.288 29 HD12 ILE 3 HD12 ILE 3 -10.128 -6.970 10.829 30 HD13 ILE 3 HD13 ILE 3 -11.775 -6.615 10.304 31 H PHE 4 HN PHE 4 -8.550 -8.004 14.724 32 HA PHE 4 HA PHE 4 -8.883 -5.195 15.558 33 HB2 PHE 4 HB2 PHE 4 -6.762 -7.151 16.472 34 HB3 PHE 4 HB1 PHE 4 -6.855 -5.456 16.934 35 HD1 PHE 4 HD1 PHE 4 -8.952 -4.683 18.175 36 HD2 PHE 4 HD2 PHE 4 -7.874 -8.778 17.714 37 HE1 PHE 4 HE1 PHE 4 -10.404 -5.274 20.069 38 HE2 PHE 4 HE2 PHE 4 -9.330 -9.374 19.608 39 HZ PHE 4 HZ PHE 4 -10.595 -7.622 20.786 40 H VAL 5 HN VAL 5 -8.224 -3.891 14.004 41 HA VAL 5 HA VAL 5 -6.086 -4.759 12.188 42 HB VAL 5 HB VAL 5 -7.882 -2.340 11.923 43 HG11 VAL 5 HG11 VAL 5 -7.172 -2.364 9.586 44 HG12 VAL 5 HG12 VAL 5 -6.134 -3.753 9.912 45 HG13 VAL 5 HG13 VAL 5 -5.794 -2.199 10.675 46 HG21 VAL 5 HG21 VAL 5 -9.274 -4.313 11.887 47 HG22 VAL 5 HG22 VAL 5 -8.204 -5.090 10.721 48 HG23 VAL 5 HG23 VAL 5 -9.133 -3.667 10.252 49 H LYS 6 HN LYS 6 -4.101 -4.003 12.494 50 HA LYS 6 HA LYS 6 -3.735 -1.695 14.270 51 HB2 LYS 6 HB2 LYS 6 -2.598 -3.985 14.636 52 HB3 LYS 6 HB1 LYS 6 -1.548 -3.519 13.305 53 HG2 LYS 6 HG2 LYS 6 -0.943 -1.472 14.573 54 HG3 LYS 6 HG1 LYS 6 -1.889 -2.088 15.930 55 HD2 LYS 6 HD2 LYS 6 -0.455 -4.158 15.839 56 HD3 LYS 6 HD1 LYS 6 0.578 -3.297 14.697 57 HE2 LYS 6 HE2 LYS 6 1.545 -3.055 16.857 58 HE3 LYS 6 HE1 LYS 6 0.839 -1.500 16.418 59 HZ1 LYS 6 HZ1 LYS 6 0.368 -2.135 18.719 60 HZ2 LYS 6 HZ2 LYS 6 -0.444 -3.516 18.183 61 HZ3 LYS 6 HZ3 LYS 6 -1.052 -1.981 17.814 62 H THR 7 HN THR 7 -2.845 0.163 13.598 63 HA THR 7 HA THR 7 -2.052 0.318 10.769 64 HB THR 7 HB THR 7 -2.406 2.908 11.955 65 HG1 THR 7 HG1 THR 7 -4.326 0.965 12.580 66 HG21 THR 7 HG21 THR 7 -4.021 1.419 9.887 67 HG22 THR 7 HG22 THR 7 -2.588 2.395 9.566 68 HG23 THR 7 HG23 THR 7 -4.059 3.160 10.170 69 H LEU 8 HN LEU 8 -0.311 1.870 10.270 70 HA LEU 8 HA LEU 8 2.008 1.400 11.807 71 HB2 LEU 8 HB2 LEU 8 1.404 3.345 9.593 72 HB3 LEU 8 HB1 LEU 8 2.995 3.205 10.318 73 HG LEU 8 HG LEU 8 1.592 0.857 9.063 74 HD11 LEU 8 HD11 LEU 8 3.512 2.780 7.765 75 HD12 LEU 8 HD12 LEU 8 1.800 2.606 7.383 76 HD13 LEU 8 HD13 LEU 8 2.915 1.279 7.060 77 HD21 LEU 8 HD21 LEU 8 3.883 -0.023 8.917 78 HD22 LEU 8 HD22 LEU 8 3.414 0.318 10.583 79 HD23 LEU 8 HD23 LEU 8 4.483 1.427 9.722 80 H THR 9 HN THR 9 -0.474 3.670 12.156 81 HA THR 9 HA THR 9 1.034 5.759 13.406 82 HB THR 9 HB THR 9 -1.620 6.062 14.160 83 HG1 THR 9 HG1 THR 9 -2.825 5.420 12.379 84 HG21 THR 9 HG21 THR 9 -0.165 7.794 13.204 85 HG22 THR 9 HG22 THR 9 -1.710 7.718 12.355 86 HG23 THR 9 HG23 THR 9 -0.268 7.009 11.628 87 H GLY 10 HN GLY 10 0.350 2.718 14.427 88 HA2 GLY 10 HA2 GLY 10 0.589 1.748 16.514 89 HA3 GLY 10 HA1 GLY 10 0.841 3.357 17.188 90 H LYS 11 HN LYS 11 -1.890 2.335 15.270 91 HA LYS 11 HA LYS 11 -3.633 2.646 17.619 92 HB2 LYS 11 HB2 LYS 11 -3.822 4.542 16.046 93 HB3 LYS 11 HB1 LYS 11 -4.219 3.423 14.753 94 HG2 LYS 11 HG2 LYS 11 -6.270 2.796 15.911 95 HG3 LYS 11 HG1 LYS 11 -5.864 3.898 17.232 96 HD2 LYS 11 HD2 LYS 11 -5.997 5.794 15.765 97 HD3 LYS 11 HD1 LYS 11 -6.204 4.750 14.360 98 HE2 LYS 11 HE2 LYS 11 -8.325 3.940 15.327 99 HE3 LYS 11 HE1 LYS 11 -8.123 5.080 16.657 100 HZ1 LYS 11 HZ1 LYS 11 -8.291 6.897 15.164 101 HZ2 LYS 11 HZ2 LYS 11 -9.591 5.869 14.834 102 HZ3 LYS 11 HZ3 LYS 11 -8.245 5.887 13.802 103 H THR 12 HN THR 12 -5.173 1.125 17.931 104 HA THR 12 HA THR 12 -5.261 -1.102 16.006 105 HB THR 12 HB THR 12 -6.060 -1.288 18.910 106 HG1 THR 12 HG1 THR 12 -3.936 -2.065 19.281 107 HG21 THR 12 HG21 THR 12 -6.829 -3.075 17.406 108 HG22 THR 12 HG22 THR 12 -5.640 -3.674 18.563 109 HG23 THR 12 HG23 THR 12 -5.165 -3.354 16.895 110 H ILE 13 HN ILE 13 -7.002 -0.930 14.778 111 HA ILE 13 HA ILE 13 -9.445 0.268 15.860 112 HB ILE 13 HB ILE 13 -8.973 -0.558 13.001 113 HG12 ILE 13 HG12 ILE 13 -8.488 2.216 14.082 114 HG13 ILE 13 HG11 ILE 13 -7.193 1.031 13.954 115 HG21 ILE 13 HG21 ILE 13 -10.795 1.492 14.257 116 HG22 ILE 13 HG22 ILE 13 -11.280 -0.088 13.643 117 HG23 ILE 13 HG23 ILE 13 -10.672 1.141 12.533 118 HD11 ILE 13 HD11 ILE 13 -7.564 0.882 11.551 119 HD12 ILE 13 HD12 ILE 13 -7.214 2.537 12.053 120 HD13 ILE 13 HD13 ILE 13 -8.869 2.060 11.681 121 H THR 14 HN THR 14 -11.100 -0.960 16.464 122 HA THR 14 HA THR 14 -11.067 -3.805 15.860 123 HB THR 14 HB THR 14 -13.122 -2.378 17.538 124 HG1 THR 14 HG1 THR 14 -10.431 -2.699 18.017 125 HG21 THR 14 HG21 THR 14 -13.527 -4.743 16.987 126 HG22 THR 14 HG22 THR 14 -13.232 -4.519 18.713 127 HG23 THR 14 HG23 THR 14 -11.958 -5.164 17.676 128 H LEU 15 HN LEU 15 -12.590 -4.821 14.605 129 HA LEU 15 HA LEU 15 -14.772 -3.201 13.510 130 HB2 LEU 15 HB2 LEU 15 -12.628 -4.596 11.947 131 HB3 LEU 15 HB1 LEU 15 -14.225 -4.379 11.262 132 HG LEU 15 HG LEU 15 -12.441 -2.133 12.198 133 HD11 LEU 15 HD11 LEU 15 -12.264 -1.666 9.758 134 HD12 LEU 15 HD12 LEU 15 -13.017 -3.231 9.460 135 HD13 LEU 15 HD13 LEU 15 -11.457 -3.146 10.278 136 HD21 LEU 15 HD21 LEU 15 -14.741 -1.483 12.367 137 HD22 LEU 15 HD22 LEU 15 -15.102 -2.169 10.785 138 HD23 LEU 15 HD23 LEU 15 -14.072 -0.745 10.913 139 H GLU 16 HN GLU 16 -16.538 -4.341 12.762 140 HA GLU 16 HA GLU 16 -16.751 -7.064 13.807 141 HB2 GLU 16 HB2 GLU 16 -18.475 -5.503 14.547 142 HB3 GLU 16 HB1 GLU 16 -18.858 -5.095 12.881 143 HG2 GLU 16 HG2 GLU 16 -19.383 -7.611 12.635 144 HG3 GLU 16 HG1 GLU 16 -19.458 -7.594 14.396 145 H VAL 17 HN VAL 17 -16.384 -8.641 12.415 146 HA VAL 17 HA VAL 17 -17.339 -8.349 9.654 147 HB VAL 17 HB VAL 17 -15.285 -9.495 8.832 148 HG11 VAL 17 HG11 VAL 17 -13.825 -7.526 8.923 149 HG12 VAL 17 HG12 VAL 17 -14.823 -6.857 10.214 150 HG13 VAL 17 HG13 VAL 17 -15.503 -7.087 8.603 151 HG21 VAL 17 HG21 VAL 17 -14.493 -10.569 10.809 152 HG22 VAL 17 HG22 VAL 17 -14.355 -9.031 11.659 153 HG23 VAL 17 HG23 VAL 17 -13.269 -9.396 10.319 154 H GLU 18 HN GLU 18 -17.677 -10.347 8.567 155 HA GLU 18 HA GLU 18 -18.148 -12.598 10.409 156 HB2 GLU 18 HB2 GLU 18 -19.552 -11.730 7.879 157 HB3 GLU 18 HB1 GLU 18 -19.802 -13.316 8.598 158 HG2 GLU 18 HG2 GLU 18 -20.338 -10.675 9.941 159 HG3 GLU 18 HG1 GLU 18 -21.554 -11.743 9.238 160 HA PRO 19 HA PRO 19 -15.307 -15.239 8.292 161 HB2 PRO 19 HB2 PRO 19 -17.555 -17.078 7.606 162 HB3 PRO 19 HB1 PRO 19 -16.029 -17.422 8.444 163 HG2 PRO 19 HG2 PRO 19 -18.297 -17.295 9.789 164 HG3 PRO 19 HG1 PRO 19 -16.793 -16.635 10.464 165 HD2 PRO 19 HD2 PRO 19 -19.117 -15.194 9.277 166 HD3 PRO 19 HD1 PRO 19 -18.075 -14.734 10.639 167 H SER 20 HN SER 20 -18.367 -14.714 6.592 168 HA SER 20 HA SER 20 -17.098 -15.156 4.009 169 HB2 SER 20 HB2 SER 20 -19.961 -14.329 4.473 170 HB3 SER 20 HB1 SER 20 -19.282 -15.197 3.099 171 HG SER 20 HG SER 20 -20.429 -16.564 4.570 172 H ASP 21 HN ASP 21 -16.613 -12.738 5.843 173 HA ASP 21 HA ASP 21 -17.674 -10.497 4.392 174 HB2 ASP 21 HB2 ASP 21 -16.428 -10.872 6.882 175 HB3 ASP 21 HB1 ASP 21 -15.326 -9.855 5.960 176 H THR 22 HN THR 22 -16.893 -9.637 2.597 177 HA THR 22 HA THR 22 -14.554 -10.681 1.339 178 HB THR 22 HB THR 22 -15.813 -8.132 0.412 179 HG1 THR 22 HG1 THR 22 -17.518 -9.440 -0.529 180 HG21 THR 22 HG21 THR 22 -14.929 -10.656 -0.999 181 HG22 THR 22 HG22 THR 22 -14.024 -9.145 -0.902 182 HG23 THR 22 HG23 THR 22 -15.548 -9.204 -1.786 183 H ILE 23 HN ILE 23 -12.551 -9.716 1.062 184 HA ILE 23 HA ILE 23 -11.524 -8.105 3.075 185 HB ILE 23 HB ILE 23 -10.481 -8.482 0.265 186 HG12 ILE 23 HG12 ILE 23 -10.656 -10.561 1.532 187 HG13 ILE 23 HG11 ILE 23 -8.966 -10.114 1.320 188 HG21 ILE 23 HG21 ILE 23 -8.307 -7.755 1.153 189 HG22 ILE 23 HG22 ILE 23 -9.078 -7.353 2.687 190 HG23 ILE 23 HG23 ILE 23 -9.515 -6.471 1.223 191 HD11 ILE 23 HD11 ILE 23 -10.620 -9.795 3.816 192 HD12 ILE 23 HD12 ILE 23 -8.968 -9.213 3.623 193 HD13 ILE 23 HD13 ILE 23 -9.309 -10.942 3.546 194 H GLU 24 HN GLU 24 -12.682 -7.170 -0.149 195 HA GLU 24 HA GLU 24 -12.038 -4.447 -0.004 196 HB2 GLU 24 HB2 GLU 24 -12.788 -5.714 -2.048 197 HB3 GLU 24 HB1 GLU 24 -14.430 -5.621 -1.428 198 HG2 GLU 24 HG2 GLU 24 -13.435 -3.005 -1.357 199 HG3 GLU 24 HG1 GLU 24 -12.934 -3.680 -2.906 200 H ASN 25 HN ASN 25 -14.865 -6.231 1.133 201 HA ASN 25 HA ASN 25 -16.425 -3.985 1.856 202 HB2 ASN 25 HB2 ASN 25 -17.262 -6.367 1.624 203 HB3 ASN 25 HB1 ASN 25 -16.507 -6.704 3.178 204 HD21 ASN 25 HD21 ASN 25 -18.120 -6.953 4.561 205 HD22 ASN 25 HD22 ASN 25 -19.438 -5.842 4.776 206 H VAL 26 HN VAL 26 -14.030 -5.928 3.574 207 HA VAL 26 HA VAL 26 -14.345 -4.742 6.115 208 HB VAL 26 HB VAL 26 -11.834 -5.945 4.928 209 HG11 VAL 26 HG11 VAL 26 -11.386 -4.610 6.912 210 HG12 VAL 26 HG12 VAL 26 -11.177 -6.326 7.255 211 HG13 VAL 26 HG13 VAL 26 -12.629 -5.488 7.800 212 HG21 VAL 26 HG21 VAL 26 -13.675 -7.529 4.844 213 HG22 VAL 26 HG22 VAL 26 -14.035 -7.232 6.544 214 HG23 VAL 26 HG23 VAL 26 -12.519 -8.007 6.087 215 H LYS 27 HN LYS 27 -12.317 -3.970 3.335 216 HA LYS 27 HA LYS 27 -10.866 -1.861 4.516 217 HB2 LYS 27 HB2 LYS 27 -11.569 -2.367 1.621 218 HB3 LYS 27 HB1 LYS 27 -10.411 -1.163 2.169 219 HG2 LYS 27 HG2 LYS 27 -8.964 -2.847 3.048 220 HG3 LYS 27 HG1 LYS 27 -10.166 -4.102 2.748 221 HD2 LYS 27 HD2 LYS 27 -8.560 -4.269 1.012 222 HD3 LYS 27 HD1 LYS 27 -9.996 -3.527 0.304 223 HE2 LYS 27 HE2 LYS 27 -8.987 -1.338 0.457 224 HE3 LYS 27 HE1 LYS 27 -7.586 -2.008 1.290 225 HZ1 LYS 27 HZ1 LYS 27 -6.890 -3.107 -0.637 226 HZ2 LYS 27 HZ2 LYS 27 -7.336 -1.559 -1.163 227 HZ3 LYS 27 HZ3 LYS 27 -8.371 -2.880 -1.431 228 H ALA 28 HN ALA 28 -13.991 -2.033 2.959 229 HA ALA 28 HA ALA 28 -14.434 0.756 2.714 230 HB1 ALA 28 HB1 ALA 28 -15.724 -0.940 1.470 231 HB2 ALA 28 HB2 ALA 28 -16.763 0.176 2.353 232 HB3 ALA 28 HB3 ALA 28 -16.482 -1.450 2.978 233 H LYS 29 HN LYS 29 -14.970 -1.602 5.255 234 HA LYS 29 HA LYS 29 -16.508 0.049 6.969 235 HB2 LYS 29 HB2 LYS 29 -14.746 -2.341 7.572 236 HB3 LYS 29 HB1 LYS 29 -15.818 -1.586 8.746 237 HG2 LYS 29 HG2 LYS 29 -17.747 -2.157 7.422 238 HG3 LYS 29 HG1 LYS 29 -16.722 -2.788 6.136 239 HD2 LYS 29 HD2 LYS 29 -15.950 -4.576 7.567 240 HD3 LYS 29 HD1 LYS 29 -16.830 -3.902 8.942 241 HE2 LYS 29 HE2 LYS 29 -18.946 -4.286 7.791 242 HE3 LYS 29 HE1 LYS 29 -18.082 -4.910 6.386 243 HZ1 LYS 29 HZ1 LYS 29 -17.492 -6.837 7.503 244 HZ2 LYS 29 HZ2 LYS 29 -19.058 -6.560 8.067 245 HZ3 LYS 29 HZ3 LYS 29 -17.735 -6.161 9.041 246 H ILE 30 HN ILE 30 -13.061 -0.448 6.507 247 HA ILE 30 HA ILE 30 -12.225 1.154 8.728 248 HB ILE 30 HB ILE 30 -10.634 0.522 6.227 249 HG12 ILE 30 HG12 ILE 30 -10.629 -1.016 8.826 250 HG13 ILE 30 HG11 ILE 30 -11.580 -1.501 7.427 251 HG21 ILE 30 HG21 ILE 30 -9.798 1.309 9.018 252 HG22 ILE 30 HG22 ILE 30 -9.670 2.297 7.562 253 HG23 ILE 30 HG23 ILE 30 -8.697 0.836 7.724 254 HD11 ILE 30 HD11 ILE 30 -9.532 -2.763 7.533 255 HD12 ILE 30 HD12 ILE 30 -8.584 -1.277 7.560 256 HD13 ILE 30 HD13 ILE 30 -9.512 -1.704 6.123 257 H GLN 31 HN GLN 31 -12.892 1.672 5.334 258 HA GLN 31 HA GLN 31 -11.913 4.294 5.059 259 HB2 GLN 31 HB2 GLN 31 -12.468 2.947 3.118 260 HB3 GLN 31 HB1 GLN 31 -14.149 2.847 3.620 261 HG2 GLN 31 HG2 GLN 31 -14.414 5.236 3.257 262 HG3 GLN 31 HG1 GLN 31 -12.720 5.363 2.786 263 HE21 GLN 31 HE21 GLN 31 -13.264 6.161 0.769 264 HE22 GLN 31 HE22 GLN 31 -13.933 5.158 -0.472 265 H ASP 32 HN ASP 32 -14.904 2.999 6.312 266 HA ASP 32 HA ASP 32 -16.266 5.514 6.438 267 HB2 ASP 32 HB2 ASP 32 -17.539 3.442 6.304 268 HB3 ASP 32 HB1 ASP 32 -16.829 2.874 7.809 269 H LYS 33 HN LYS 33 -14.393 3.557 8.704 270 HA LYS 33 HA LYS 33 -14.968 5.248 10.941 271 HB2 LYS 33 HB2 LYS 33 -13.266 2.854 10.472 272 HB3 LYS 33 HB1 LYS 33 -12.888 3.868 11.857 273 HG2 LYS 33 HG2 LYS 33 -15.336 3.635 12.505 274 HG3 LYS 33 HG1 LYS 33 -15.415 2.352 11.298 275 HD2 LYS 33 HD2 LYS 33 -13.745 1.077 12.455 276 HD3 LYS 33 HD1 LYS 33 -13.442 2.401 13.579 277 HE2 LYS 33 HE2 LYS 33 -15.834 2.185 14.320 278 HE3 LYS 33 HE1 LYS 33 -15.932 0.721 13.343 279 HZ1 LYS 33 HZ1 LYS 33 -14.071 1.168 15.613 280 HZ2 LYS 33 HZ2 LYS 33 -14.142 -0.235 14.671 281 HZ3 LYS 33 HZ3 LYS 33 -15.456 0.196 15.642 282 H GLU 34 HN GLU 34 -11.948 4.639 9.113 283 HA GLU 34 HA GLU 34 -10.733 6.938 10.410 284 HB2 GLU 34 HB2 GLU 34 -9.646 4.865 8.513 285 HB3 GLU 34 HB1 GLU 34 -8.704 6.237 9.083 286 HG2 GLU 34 HG2 GLU 34 -9.992 4.226 10.907 287 HG3 GLU 34 HG1 GLU 34 -8.333 4.104 10.322 288 H GLY 35 HN GLY 35 -11.700 5.973 7.140 289 HA2 GLY 35 HA2 GLY 35 -12.464 7.540 5.527 290 HA3 GLY 35 HA1 GLY 35 -11.612 8.809 6.397 291 H ILE 36 HN ILE 36 -10.524 5.670 5.161 292 HA ILE 36 HA ILE 36 -8.484 7.095 3.586 293 HB ILE 36 HB ILE 36 -8.195 4.297 4.700 294 HG12 ILE 36 HG12 ILE 36 -6.997 6.841 5.824 295 HG13 ILE 36 HG11 ILE 36 -8.397 6.023 6.511 296 HG21 ILE 36 HG21 ILE 36 -6.165 6.230 3.580 297 HG22 ILE 36 HG22 ILE 36 -6.818 4.822 2.742 298 HG23 ILE 36 HG23 ILE 36 -5.830 4.609 4.189 299 HD11 ILE 36 HD11 ILE 36 -6.383 5.481 7.739 300 HD12 ILE 36 HD12 ILE 36 -5.621 4.885 6.264 301 HD13 ILE 36 HD13 ILE 36 -7.018 4.045 6.935 302 HA PRO 37 HA PRO 37 -10.628 5.357 0.058 303 HB2 PRO 37 HB2 PRO 37 -7.947 5.713 -1.189 304 HB3 PRO 37 HB1 PRO 37 -9.532 6.293 -1.731 305 HG2 PRO 37 HG2 PRO 37 -7.773 7.961 -0.675 306 HG3 PRO 37 HG1 PRO 37 -9.509 8.116 -0.344 307 HD2 PRO 37 HD2 PRO 37 -7.345 7.070 1.411 308 HD3 PRO 37 HD1 PRO 37 -8.803 7.992 1.831 309 HA PRO 38 HA PRO 38 -9.473 1.063 0.362 310 HB2 PRO 38 HB2 PRO 38 -10.721 0.849 -2.326 311 HB3 PRO 38 HB1 PRO 38 -11.107 -0.016 -0.826 312 HG2 PRO 38 HG2 PRO 38 -12.705 1.881 -1.755 313 HG3 PRO 38 HG1 PRO 38 -12.424 1.678 -0.014 314 HD2 PRO 38 HD2 PRO 38 -11.306 3.718 -1.881 315 HD3 PRO 38 HD1 PRO 38 -11.832 3.892 -0.194 316 H ASP 39 HN ASP 39 -8.729 2.968 -2.506 317 HA ASP 39 HA ASP 39 -6.909 0.998 -3.563 318 HB2 ASP 39 HB2 ASP 39 -6.512 2.509 -5.353 319 HB3 ASP 39 HB1 ASP 39 -8.223 2.654 -4.973 320 H GLN 40 HN GLN 40 -6.772 3.325 -1.144 321 HA GLN 40 HA GLN 40 -3.848 3.554 -1.331 322 HB2 GLN 40 HB2 GLN 40 -5.705 5.493 -0.866 323 HB3 GLN 40 HB1 GLN 40 -5.284 5.039 0.779 324 HG2 GLN 40 HG2 GLN 40 -2.901 5.412 0.211 325 HG3 GLN 40 HG1 GLN 40 -3.416 6.010 -1.364 326 HE21 GLN 40 HE21 GLN 40 -1.986 7.337 0.795 327 HE22 GLN 40 HE22 GLN 40 -2.920 8.742 1.191 328 H GLN 41 HN GLN 41 -6.201 1.727 0.041 329 HA GLN 41 HA GLN 41 -4.845 1.277 2.585 330 HB2 GLN 41 HB2 GLN 41 -7.536 0.615 1.475 331 HB3 GLN 41 HB1 GLN 41 -6.885 -0.395 2.755 332 HG2 GLN 41 HG2 GLN 41 -6.592 1.672 4.124 333 HG3 GLN 41 HG1 GLN 41 -7.474 2.547 2.868 334 HE21 GLN 41 HE21 GLN 41 -9.666 2.314 2.715 335 HE22 GLN 41 HE22 GLN 41 -10.611 1.405 3.845 336 H ARG 42 HN ARG 42 -3.328 -0.251 2.699 337 HA ARG 42 HA ARG 42 -3.545 -2.562 0.881 338 HB2 ARG 42 HB2 ARG 42 -1.021 -1.617 2.242 339 HB3 ARG 42 HB1 ARG 42 -1.162 -2.763 0.915 340 HG2 ARG 42 HG2 ARG 42 -2.152 -0.780 -0.400 341 HG3 ARG 42 HG1 ARG 42 -1.445 0.218 0.870 342 HD2 ARG 42 HD2 ARG 42 0.085 0.042 -1.006 343 HD3 ARG 42 HD1 ARG 42 0.754 -0.780 0.407 344 HE ARG 42 HE ARG 42 -0.578 -2.730 -0.985 345 HH11 ARG 42 HH11 ARG 42 1.997 -0.470 -1.736 346 HH12 ARG 42 HH12 ARG 42 2.733 -1.529 -2.915 347 HH21 ARG 42 HH21 ARG 42 0.416 -4.122 -2.493 348 HH22 ARG 42 HH22 ARG 42 1.846 -3.595 -3.328 349 H LEU 43 HN LEU 43 -4.529 -4.137 2.016 350 HA LEU 43 HA LEU 43 -4.079 -4.388 4.868 351 HB2 LEU 43 HB2 LEU 43 -6.005 -5.476 2.916 352 HB3 LEU 43 HB1 LEU 43 -5.602 -6.534 4.254 353 HG LEU 43 HG LEU 43 -6.683 -3.725 4.535 354 HD11 LEU 43 HD11 LEU 43 -8.034 -6.395 4.913 355 HD12 LEU 43 HD12 LEU 43 -8.344 -5.246 3.610 356 HD13 LEU 43 HD13 LEU 43 -8.740 -4.819 5.276 357 HD21 LEU 43 HD21 LEU 43 -7.010 -4.420 6.904 358 HD22 LEU 43 HD22 LEU 43 -5.318 -4.284 6.429 359 HD23 LEU 43 HD23 LEU 43 -6.070 -5.874 6.562 360 H ILE 44 HN ILE 44 -2.689 -5.672 5.798 361 HA ILE 44 HA ILE 44 -1.531 -7.897 4.260 362 HB ILE 44 HB ILE 44 -0.197 -5.748 5.844 363 HG12 ILE 44 HG12 ILE 44 1.596 -6.284 4.058 364 HG13 ILE 44 HG11 ILE 44 0.336 -7.245 3.295 365 HG21 ILE 44 HG21 ILE 44 0.403 -7.732 7.118 366 HG22 ILE 44 HG22 ILE 44 1.795 -7.101 6.238 367 HG23 ILE 44 HG23 ILE 44 0.948 -8.527 5.641 368 HD11 ILE 44 HD11 ILE 44 0.469 -5.036 2.316 369 HD12 ILE 44 HD12 ILE 44 0.191 -4.304 3.896 370 HD13 ILE 44 HD13 ILE 44 -1.075 -5.267 3.132 371 H PHE 45 HN PHE 45 -1.187 -9.796 5.358 372 HA PHE 45 HA PHE 45 -1.889 -9.911 8.201 373 HB2 PHE 45 HB2 PHE 45 -3.907 -10.502 6.828 374 HB3 PHE 45 HB1 PHE 45 -2.990 -11.844 6.152 375 HD1 PHE 45 HD1 PHE 45 -4.374 -10.462 9.286 376 HD2 PHE 45 HD2 PHE 45 -2.804 -13.887 7.306 377 HE1 PHE 45 HE1 PHE 45 -5.082 -11.876 11.172 378 HE2 PHE 45 HE2 PHE 45 -3.512 -15.305 9.185 379 HZ PHE 45 HZ PHE 45 -4.652 -14.304 11.120 380 H ALA 46 HN ALA 46 -0.296 -10.858 9.234 381 HA ALA 46 HA ALA 46 1.443 -12.201 9.789 382 HB1 ALA 46 HB1 ALA 46 1.538 -14.432 8.925 383 HB2 ALA 46 HB2 ALA 46 0.559 -13.988 7.528 384 HB3 ALA 46 HB3 ALA 46 -0.156 -13.992 9.142 385 H GLY 47 HN GLY 47 1.434 -10.326 7.223 386 HA2 GLY 47 HA2 GLY 47 3.616 -9.451 6.551 387 HA3 GLY 47 HA1 GLY 47 4.166 -11.114 6.434 388 H LYS 48 HN LYS 48 1.300 -11.552 5.201 389 HA LYS 48 HA LYS 48 2.196 -10.894 2.474 390 HB2 LYS 48 HB2 LYS 48 0.291 -13.014 3.476 391 HB3 LYS 48 HB1 LYS 48 0.531 -12.651 1.773 392 HG2 LYS 48 HG2 LYS 48 2.956 -13.166 2.095 393 HG3 LYS 48 HG1 LYS 48 2.553 -13.728 3.718 394 HD2 LYS 48 HD2 LYS 48 1.270 -14.805 1.212 395 HD3 LYS 48 HD1 LYS 48 2.690 -15.527 1.967 396 HE2 LYS 48 HE2 LYS 48 1.433 -15.915 4.010 397 HE3 LYS 48 HE1 LYS 48 0.019 -15.130 3.308 398 HZ1 LYS 48 HZ1 LYS 48 -0.110 -16.870 1.658 399 HZ2 LYS 48 HZ2 LYS 48 -0.118 -17.555 3.206 400 HZ3 LYS 48 HZ3 LYS 48 1.287 -17.603 2.267 401 H GLN 49 HN GLN 49 0.491 -10.330 0.904 402 HA GLN 49 HA GLN 49 -1.249 -8.336 2.090 403 HB2 GLN 49 HB2 GLN 49 0.227 -8.409 -0.215 404 HB3 GLN 49 HB1 GLN 49 -1.396 -8.718 -0.810 405 HG2 GLN 49 HG2 GLN 49 -2.083 -6.668 0.558 406 HG3 GLN 49 HG1 GLN 49 -0.357 -6.316 0.648 407 HE21 GLN 49 HE21 GLN 49 -3.154 -6.436 -1.387 408 HE22 GLN 49 HE22 GLN 49 -2.443 -5.663 -2.760 409 H LEU 50 HN LEU 50 -3.447 -8.206 1.840 410 HA LEU 50 HA LEU 50 -4.799 -10.737 1.217 411 HB2 LEU 50 HB2 LEU 50 -5.918 -8.266 2.554 412 HB3 LEU 50 HB1 LEU 50 -6.702 -9.827 2.426 413 HG LEU 50 HG LEU 50 -4.220 -9.227 4.046 414 HD11 LEU 50 HD11 LEU 50 -7.027 -9.889 4.931 415 HD12 LEU 50 HD12 LEU 50 -6.291 -8.288 4.984 416 HD13 LEU 50 HD13 LEU 50 -5.639 -9.591 5.976 417 HD21 LEU 50 HD21 LEU 50 -4.582 -11.520 4.927 418 HD22 LEU 50 HD22 LEU 50 -4.100 -11.476 3.233 419 HD23 LEU 50 HD23 LEU 50 -5.784 -11.774 3.664 420 H GLU 51 HN GLU 51 -5.912 -10.930 -0.636 421 HA GLU 51 HA GLU 51 -6.003 -8.720 -2.461 422 HB2 GLU 51 HB2 GLU 51 -7.234 -11.466 -2.715 423 HB3 GLU 51 HB1 GLU 51 -7.019 -10.306 -4.019 424 HG2 GLU 51 HG2 GLU 51 -4.486 -10.541 -3.012 425 HG3 GLU 51 HG1 GLU 51 -5.127 -12.175 -2.834 426 H ASP 52 HN ASP 52 -7.622 -7.389 -2.916 427 HA ASP 52 HA ASP 52 -9.748 -6.923 -1.217 428 HB2 ASP 52 HB2 ASP 52 -9.337 -6.177 -4.111 429 HB3 ASP 52 HB1 ASP 52 -10.749 -5.650 -3.204 430 H GLY 53 HN GLY 53 -9.741 -8.782 -4.239 431 HA2 GLY 53 HA2 GLY 53 -12.572 -9.363 -3.999 432 HA3 GLY 53 HA1 GLY 53 -11.504 -9.887 -5.288 433 H ARG 54 HN ARG 54 -11.213 -10.341 -1.789 434 HA ARG 54 HA ARG 54 -11.687 -13.211 -2.135 435 HB2 ARG 54 HB2 ARG 54 -9.255 -11.968 -0.839 436 HB3 ARG 54 HB1 ARG 54 -9.744 -13.633 -0.556 437 HG2 ARG 54 HG2 ARG 54 -8.978 -12.439 -3.211 438 HG3 ARG 54 HG1 ARG 54 -7.984 -13.509 -2.221 439 HD2 ARG 54 HD2 ARG 54 -9.793 -15.230 -2.430 440 HD3 ARG 54 HD1 ARG 54 -10.591 -14.166 -3.586 441 HE ARG 54 HE ARG 54 -8.064 -15.594 -3.983 442 HH11 ARG 54 HH11 ARG 54 -10.573 -13.508 -5.265 443 HH12 ARG 54 HH12 ARG 54 -10.133 -13.796 -6.919 444 HH21 ARG 54 HH21 ARG 54 -7.478 -15.955 -6.151 445 HH22 ARG 54 HH22 ARG 54 -8.373 -15.188 -7.424 446 H THR 55 HN THR 55 -11.782 -14.271 0.116 447 HA THR 55 HA THR 55 -13.256 -12.440 1.898 448 HB THR 55 HB THR 55 -14.209 -14.734 2.766 449 HG1 THR 55 HG1 THR 55 -12.763 -15.512 0.632 450 HG21 THR 55 HG21 THR 55 -15.070 -13.440 0.176 451 HG22 THR 55 HG22 THR 55 -15.596 -13.002 1.805 452 HG23 THR 55 HG23 THR 55 -16.054 -14.563 1.119 453 H LEU 56 HN LEU 56 -13.282 -13.296 4.239 454 HA LEU 56 HA LEU 56 -10.620 -13.330 5.185 455 HB2 LEU 56 HB2 LEU 56 -13.183 -13.995 6.634 456 HB3 LEU 56 HB1 LEU 56 -11.638 -13.688 7.404 457 HG LEU 56 HG LEU 56 -13.249 -11.695 5.807 458 HD11 LEU 56 HD11 LEU 56 -12.663 -11.876 8.756 459 HD12 LEU 56 HD12 LEU 56 -14.218 -12.178 7.980 460 HD13 LEU 56 HD13 LEU 56 -13.519 -10.560 7.951 461 HD21 LEU 56 HD21 LEU 56 -11.580 -10.063 6.565 462 HD22 LEU 56 HD22 LEU 56 -10.875 -11.291 5.517 463 HD23 LEU 56 HD23 LEU 56 -10.626 -11.372 7.262 464 H SER 57 HN SER 57 -12.925 -15.851 4.479 465 HA SER 57 HA SER 57 -11.631 -17.959 5.859 466 HB2 SER 57 HB2 SER 57 -13.041 -19.036 3.677 467 HB3 SER 57 HB1 SER 57 -13.625 -18.838 5.332 468 HG SER 57 HG SER 57 -14.842 -17.785 3.519 469 H ASP 58 HN ASP 58 -10.998 -16.353 2.882 470 HA ASP 58 HA ASP 58 -9.705 -18.362 1.416 471 HB2 ASP 58 HB2 ASP 58 -9.617 -15.384 1.449 472 HB3 ASP 58 HB1 ASP 58 -8.324 -16.226 0.603 473 H TYR 59 HN TYR 59 -8.566 -16.199 3.930 474 HA TYR 59 HA TYR 59 -5.926 -17.484 3.838 475 HB2 TYR 59 HB2 TYR 59 -6.717 -14.911 5.218 476 HB3 TYR 59 HB1 TYR 59 -5.081 -15.525 4.996 477 HD1 TYR 59 HD1 TYR 59 -4.062 -15.534 2.742 478 HD2 TYR 59 HD2 TYR 59 -7.859 -13.751 3.453 479 HE1 TYR 59 HE1 TYR 59 -3.902 -14.350 0.594 480 HE2 TYR 59 HE2 TYR 59 -7.707 -12.561 1.305 481 HH TYR 59 HH TYR 59 -5.377 -13.334 -1.056 482 H ASN 60 HN ASN 60 -8.660 -18.138 5.165 483 HA ASN 60 HA ASN 60 -9.438 -19.145 7.031 484 HB2 ASN 60 HB2 ASN 60 -6.640 -19.992 6.779 485 HB3 ASN 60 HB1 ASN 60 -7.306 -20.176 8.401 486 HD21 ASN 60 HD21 ASN 60 -6.546 -22.171 6.360 487 HD22 ASN 60 HD22 ASN 60 -7.954 -23.148 6.144 488 H ILE 61 HN ILE 61 -9.099 -16.410 7.302 489 HA ILE 61 HA ILE 61 -7.773 -15.799 9.769 490 HB ILE 61 HB ILE 61 -9.845 -14.165 8.286 491 HG12 ILE 61 HG12 ILE 61 -6.822 -14.089 8.133 492 HG13 ILE 61 HG11 ILE 61 -7.899 -14.680 6.874 493 HG21 ILE 61 HG21 ILE 61 -8.962 -12.265 9.510 494 HG22 ILE 61 HG22 ILE 61 -7.791 -13.304 10.323 495 HG23 ILE 61 HG23 ILE 61 -9.516 -13.503 10.636 496 HD11 ILE 61 HD11 ILE 61 -7.713 -11.850 7.872 497 HD12 ILE 61 HD12 ILE 61 -8.847 -12.429 6.653 498 HD13 ILE 61 HD13 ILE 61 -7.113 -12.468 6.333 499 H GLN 62 HN GLN 62 -8.578 -15.825 11.772 500 HA GLN 62 HA GLN 62 -11.357 -16.722 12.105 501 HB2 GLN 62 HB2 GLN 62 -8.912 -17.060 13.845 502 HB3 GLN 62 HB1 GLN 62 -10.537 -17.466 14.377 503 HG2 GLN 62 HG2 GLN 62 -10.699 -19.275 12.976 504 HG3 GLN 62 HG1 GLN 62 -9.509 -18.640 11.843 505 HE21 GLN 62 HE21 GLN 62 -7.346 -18.977 12.216 506 HE22 GLN 62 HE22 GLN 62 -6.760 -20.078 13.415 507 H LYS 63 HN LYS 63 -11.796 -16.120 14.726 508 HA LYS 63 HA LYS 63 -12.142 -13.262 14.575 509 HB2 LYS 63 HB2 LYS 63 -13.465 -13.500 16.617 510 HB3 LYS 63 HB1 LYS 63 -13.977 -14.648 15.391 511 HG2 LYS 63 HG2 LYS 63 -12.855 -16.444 16.529 512 HG3 LYS 63 HG1 LYS 63 -12.162 -15.312 17.694 513 HD2 LYS 63 HD2 LYS 63 -14.426 -14.725 18.448 514 HD3 LYS 63 HD1 LYS 63 -15.098 -15.899 17.316 515 HE2 LYS 63 HE2 LYS 63 -14.232 -17.712 18.506 516 HE3 LYS 63 HE1 LYS 63 -13.077 -16.705 19.377 517 HZ1 LYS 63 HZ1 LYS 63 -16.019 -16.561 19.725 518 HZ2 LYS 63 HZ2 LYS 63 -14.851 -15.734 20.628 519 HZ3 LYS 63 HZ3 LYS 63 -14.975 -17.416 20.746 520 H GLU 64 HN GLU 64 -11.476 -11.774 16.158 521 HA GLU 64 HA GLU 64 -10.008 -10.741 17.520 522 HB2 GLU 64 HB2 GLU 64 -9.638 -13.537 18.585 523 HB3 GLU 64 HB1 GLU 64 -8.862 -12.125 19.291 524 HG2 GLU 64 HG2 GLU 64 -11.163 -11.140 19.556 525 HG3 GLU 64 HG1 GLU 64 -11.801 -12.725 19.125 526 H SER 65 HN SER 65 -9.169 -12.019 14.910 527 HA SER 65 HA SER 65 -6.363 -12.547 15.249 528 HB2 SER 65 HB2 SER 65 -7.917 -12.041 12.699 529 HB3 SER 65 HB1 SER 65 -6.306 -12.748 12.821 530 HG SER 65 HG SER 65 -8.797 -13.872 13.317 531 H THR 66 HN THR 66 -4.683 -11.268 14.212 532 HA THR 66 HA THR 66 -5.271 -8.401 14.451 533 HB THR 66 HB THR 66 -2.499 -9.541 14.332 534 HG1 THR 66 HG1 THR 66 -4.389 -9.928 16.305 535 HG21 THR 66 HG21 THR 66 -2.747 -7.118 14.220 536 HG22 THR 66 HG22 THR 66 -2.008 -7.585 15.752 537 HG23 THR 66 HG23 THR 66 -3.710 -7.131 15.696 538 H LEU 67 HN LEU 67 -5.548 -7.339 12.624 539 HA LEU 67 HA LEU 67 -4.230 -8.319 10.185 540 HB2 LEU 67 HB2 LEU 67 -6.728 -6.746 10.689 541 HB3 LEU 67 HB1 LEU 67 -5.907 -6.587 9.149 542 HG LEU 67 HG LEU 67 -6.088 -9.143 8.987 543 HD11 LEU 67 HD11 LEU 67 -7.964 -10.130 10.224 544 HD12 LEU 67 HD12 LEU 67 -8.133 -8.635 11.144 545 HD13 LEU 67 HD13 LEU 67 -6.668 -9.605 11.296 546 HD21 LEU 67 HD21 LEU 67 -8.561 -7.421 8.888 547 HD22 LEU 67 HD22 LEU 67 -8.381 -8.996 8.113 548 HD23 LEU 67 HD23 LEU 67 -7.380 -7.639 7.597 549 H HIS 68 HN HIS 68 -2.891 -6.991 9.021 550 HA HIS 68 HA HIS 68 -2.055 -4.541 10.403 551 HB2 HIS 68 HB2 HIS 68 -0.613 -6.184 8.310 552 HB3 HIS 68 HB1 HIS 68 0.034 -4.759 9.113 553 HD2 HIS 68 HD2 HIS 68 0.292 -5.164 12.012 554 HE1 HIS 68 HE1 HIS 68 0.916 -9.308 11.428 555 HE2 HIS 68 HE2 HIS 68 1.363 -7.331 12.945 556 H LEU 69 HN LEU 69 -2.602 -2.639 9.558 557 HA LEU 69 HA LEU 69 -3.478 -2.577 6.756 558 HB2 LEU 69 HB2 LEU 69 -5.075 -1.757 8.456 559 HB3 LEU 69 HB1 LEU 69 -3.916 -0.531 8.931 560 HG LEU 69 HG LEU 69 -4.064 0.475 6.684 561 HD11 LEU 69 HD11 LEU 69 -5.874 -0.242 5.174 562 HD12 LEU 69 HD12 LEU 69 -6.177 -1.626 6.222 563 HD13 LEU 69 HD13 LEU 69 -4.635 -1.477 5.379 564 HD21 LEU 69 HD21 LEU 69 -6.675 0.110 8.138 565 HD22 LEU 69 HD22 LEU 69 -6.376 1.331 6.900 566 HD23 LEU 69 HD23 LEU 69 -5.471 1.367 8.414 567 H VAL 70 HN VAL 70 -1.765 -2.232 5.503 568 HA VAL 70 HA VAL 70 0.348 -0.431 6.317 569 HB VAL 70 HB VAL 70 -0.086 -2.267 3.991 570 HG11 VAL 70 HG11 VAL 70 1.899 -0.017 4.123 571 HG12 VAL 70 HG12 VAL 70 0.757 -0.397 2.836 572 HG13 VAL 70 HG13 VAL 70 2.145 -1.444 3.121 573 HG21 VAL 70 HG21 VAL 70 0.870 -3.160 6.040 574 HG22 VAL 70 HG22 VAL 70 2.144 -1.941 5.992 575 HG23 VAL 70 HG23 VAL 70 2.060 -3.177 4.737 576 H LEU 71 HN LEU 71 0.574 1.616 5.716 577 HA LEU 71 HA LEU 71 -1.518 2.839 4.127 578 HB2 LEU 71 HB2 LEU 71 0.853 4.119 5.488 579 HB3 LEU 71 HB1 LEU 71 -0.537 4.952 4.819 580 HG LEU 71 HG LEU 71 -0.625 3.053 7.167 581 HD11 LEU 71 HD11 LEU 71 -0.789 6.062 7.097 582 HD12 LEU 71 HD12 LEU 71 0.573 5.117 7.693 583 HD13 LEU 71 HD13 LEU 71 -0.980 5.043 8.523 584 HD21 LEU 71 HD21 LEU 71 -2.903 3.962 7.468 585 HD22 LEU 71 HD22 LEU 71 -2.717 3.057 5.967 586 HD23 LEU 71 HD23 LEU 71 -2.737 4.820 5.936 587 H ARG 72 HN ARG 72 -1.109 4.107 2.278 588 HA ARG 72 HA ARG 72 1.485 3.686 0.973 589 HB2 ARG 72 HB2 ARG 72 0.320 2.088 -0.208 590 HB3 ARG 72 HB1 ARG 72 -1.229 2.876 0.041 591 HG2 ARG 72 HG2 ARG 72 -0.651 4.549 -1.647 592 HG3 ARG 72 HG1 ARG 72 0.904 3.751 -1.895 593 HD2 ARG 72 HD2 ARG 72 -1.571 2.121 -2.145 594 HD3 ARG 72 HD1 ARG 72 -1.180 3.244 -3.445 595 HE ARG 72 HE ARG 72 1.007 1.531 -2.636 596 HH11 ARG 72 HH11 ARG 72 -1.776 1.875 -4.740 597 HH12 ARG 72 HH12 ARG 72 -1.184 0.759 -5.925 598 HH21 ARG 72 HH21 ARG 72 1.786 0.054 -4.191 599 HH22 ARG 72 HH22 ARG 72 0.854 -0.276 -5.614 600 H LEU 73 HN LEU 73 2.185 5.408 -0.260 601 HA LEU 73 HA LEU 73 0.414 7.762 -0.319 602 HB2 LEU 73 HB2 LEU 73 3.296 7.498 0.405 603 HB3 LEU 73 HB1 LEU 73 2.781 8.957 -0.415 604 HG LEU 73 HG LEU 73 1.020 9.166 1.447 605 HD11 LEU 73 HD11 LEU 73 2.864 7.115 2.649 606 HD12 LEU 73 HD12 LEU 73 1.118 7.000 2.415 607 HD13 LEU 73 HD13 LEU 73 1.776 8.134 3.596 608 HD21 LEU 73 HD21 LEU 73 2.952 10.637 1.232 609 HD22 LEU 73 HD22 LEU 73 3.946 9.470 2.103 610 HD23 LEU 73 HD23 LEU 73 2.612 10.277 2.925 611 H ARG 74 HN ARG 74 0.617 9.146 -2.127 612 HA ARG 74 HA ARG 74 1.461 7.740 -4.541 613 HB2 ARG 74 HB2 ARG 74 -0.760 9.209 -4.020 614 HB3 ARG 74 HB1 ARG 74 0.265 10.446 -4.732 615 HG2 ARG 74 HG2 ARG 74 -0.121 7.819 -6.106 616 HG3 ARG 74 HG1 ARG 74 -1.325 9.101 -6.243 617 HD2 ARG 74 HD2 ARG 74 0.179 10.560 -7.290 618 HD3 ARG 74 HD1 ARG 74 1.577 9.611 -6.788 619 HE ARG 74 HE ARG 74 -0.377 8.662 -8.784 620 HH11 ARG 74 HH11 ARG 74 2.922 9.089 -7.672 621 HH12 ARG 74 HH12 ARG 74 3.621 8.300 -9.049 622 HH21 ARG 74 HH21 ARG 74 0.539 7.616 -10.593 623 HH22 ARG 74 HH22 ARG 74 2.262 7.462 -10.716 624 H GLY 75 HN GLY 75 2.522 10.096 -2.385 625 HA2 GLY 75 HA2 GLY 75 4.966 10.506 -3.795 626 HA3 GLY 75 HA1 GLY 75 3.944 11.940 -3.821 627 H GLY 76 HN GLY 76 6.556 11.188 -2.425 628 HA2 GLY 76 HA2 GLY 76 6.066 12.672 -0.061 629 HA3 GLY 76 HA1 GLY 76 6.222 10.959 0.309 630 H1 SER 453 HT1 SER 453 20.626 10.778 16.723 631 H2 SER 453 HT2 SER 453 21.968 10.002 17.393 632 H3 SER 453 HT3 SER 453 21.405 11.447 18.062 633 HA SER 453 HA SER 453 20.800 9.495 19.375 634 HB2 SER 453 HB2 SER 453 18.402 10.855 18.131 635 HB3 SER 453 HB1 SER 453 18.541 10.210 19.765 636 HG SER 453 HG SER 453 19.044 12.656 18.988 637 H ASN 454 HN ASN 454 18.698 9.701 16.499 638 HA ASN 454 HA ASN 454 17.743 8.149 15.166 639 HB2 ASN 454 HB2 ASN 454 20.060 6.503 16.176 640 HB3 ASN 454 HB1 ASN 454 18.879 5.852 15.044 641 HD21 ASN 454 HD21 ASN 454 21.306 5.799 14.133 642 HD22 ASN 454 HD22 ASN 454 21.625 7.064 12.998 643 H SER 455 HN SER 455 17.282 8.343 18.201 644 HA SER 455 HA SER 455 16.319 5.840 19.081 645 HB2 SER 455 HB2 SER 455 15.234 8.463 20.067 646 HB3 SER 455 HB1 SER 455 15.577 6.992 20.979 647 HG SER 455 HG SER 455 17.770 7.404 20.784 648 H GLN 456 HN GLN 456 14.768 8.637 17.562 649 HA GLN 456 HA GLN 456 12.140 7.555 17.665 650 HB2 GLN 456 HB2 GLN 456 13.382 9.807 16.096 651 HB3 GLN 456 HB1 GLN 456 11.696 9.346 15.889 652 HG2 GLN 456 HG2 GLN 456 13.018 10.339 18.403 653 HG3 GLN 456 HG1 GLN 456 11.812 11.175 17.425 654 HE21 GLN 456 HE21 GLN 456 11.818 10.347 20.268 655 HE22 GLN 456 HE22 GLN 456 10.381 9.406 20.471 656 H LEU 457 HN LEU 457 14.757 7.466 15.341 657 HA LEU 457 HA LEU 457 13.307 6.378 13.177 658 HB2 LEU 457 HB2 LEU 457 16.234 6.088 13.878 659 HB3 LEU 457 HB1 LEU 457 15.525 5.648 12.337 660 HG LEU 457 HG LEU 457 15.624 8.445 13.479 661 HD11 LEU 457 HD11 LEU 457 17.243 8.881 11.707 662 HD12 LEU 457 HD12 LEU 457 17.188 7.183 11.234 663 HD13 LEU 457 HD13 LEU 457 17.824 7.636 12.815 664 HD21 LEU 457 HD21 LEU 457 13.670 8.153 12.088 665 HD22 LEU 457 HD22 LEU 457 14.645 7.410 10.819 666 HD23 LEU 457 HD23 LEU 457 14.870 9.112 11.225 667 H ASN 458 HN ASN 458 15.115 4.917 15.837 668 HA ASN 458 HA ASN 458 14.817 2.226 15.057 669 HB2 ASN 458 HB2 ASN 458 15.681 3.675 17.454 670 HB3 ASN 458 HB1 ASN 458 14.914 2.132 17.810 671 HD21 ASN 458 HD21 ASN 458 17.713 3.068 18.026 672 HD22 ASN 458 HD22 ASN 458 18.644 1.907 17.150 673 H ALA 459 HN ALA 459 12.860 4.318 17.134 674 HA ALA 459 HA ALA 459 11.006 2.378 17.970 675 HB1 ALA 459 HB1 ALA 459 11.245 4.573 19.040 676 HB2 ALA 459 HB2 ALA 459 9.575 4.253 18.575 677 HB3 ALA 459 HB3 ALA 459 10.567 5.341 17.605 678 H MET 460 HN MET 460 10.990 4.603 15.211 679 HA MET 460 HA MET 460 8.443 3.912 14.229 680 HB2 MET 460 HB2 MET 460 10.866 5.217 13.068 681 HB3 MET 460 HB1 MET 460 9.576 4.711 11.985 682 HG2 MET 460 HG2 MET 460 8.002 6.037 13.442 683 HG3 MET 460 HG1 MET 460 9.434 6.697 14.232 684 HE1 MET 460 HE1 MET 460 11.153 8.769 11.478 685 HE2 MET 460 HE2 MET 460 11.551 7.135 12.011 686 HE3 MET 460 HE3 MET 460 11.084 8.360 13.192 687 H ALA 461 HN ALA 461 11.678 2.670 13.485 688 HA ALA 461 HA ALA 461 10.895 0.884 11.451 689 HB1 ALA 461 HB1 ALA 461 13.245 0.671 13.334 690 HB2 ALA 461 HB2 ALA 461 13.225 1.563 11.813 691 HB3 ALA 461 HB3 ALA 461 13.053 -0.194 11.809 692 H HIS 462 HN HIS 462 11.148 0.536 14.955 693 HA HIS 462 HA HIS 462 10.685 -2.236 15.080 694 HB2 HIS 462 HB2 HIS 462 11.388 -0.441 16.911 695 HB3 HIS 462 HB1 HIS 462 9.664 -0.481 17.262 696 HD2 HIS 462 HD2 HIS 462 9.909 -3.921 16.464 697 HE1 HIS 462 HE1 HIS 462 11.704 -3.777 20.290 698 HE2 HIS 462 HE2 HIS 462 10.479 -5.243 18.621 699 H GLN 463 HN GLN 463 8.494 0.511 14.912 700 HA GLN 463 HA GLN 463 6.111 -0.870 15.499 701 HB2 GLN 463 HB2 GLN 463 6.524 1.679 15.302 702 HB3 GLN 463 HB1 GLN 463 6.235 1.446 13.583 703 HG2 GLN 463 HG2 GLN 463 4.218 2.176 14.723 704 HG3 GLN 463 HG1 GLN 463 4.021 0.556 14.056 705 HE21 GLN 463 HE21 GLN 463 3.867 -1.197 15.451 706 HE22 GLN 463 HE22 GLN 463 3.558 -1.007 17.143 707 H ILE 464 HN ILE 464 7.942 -0.429 12.537 708 HA ILE 464 HA ILE 464 5.979 -1.609 10.818 709 HB ILE 464 HB ILE 464 8.947 -1.271 10.336 710 HG12 ILE 464 HG12 ILE 464 6.653 0.531 9.528 711 HG13 ILE 464 HG11 ILE 464 7.776 0.860 10.847 712 HG21 ILE 464 HG21 ILE 464 8.385 -1.440 7.970 713 HG22 ILE 464 HG22 ILE 464 6.687 -1.684 8.379 714 HG23 ILE 464 HG23 ILE 464 7.885 -2.893 8.837 715 HD11 ILE 464 HD11 ILE 464 8.323 2.093 8.807 716 HD12 ILE 464 HD12 ILE 464 8.540 0.566 7.952 717 HD13 ILE 464 HD13 ILE 464 9.612 0.991 9.286 718 H GLN 465 HN GLN 465 8.712 -2.737 12.680 719 HA GLN 465 HA GLN 465 8.977 -5.314 11.580 720 HB2 GLN 465 HB2 GLN 465 10.528 -4.040 13.198 721 HB3 GLN 465 HB1 GLN 465 9.483 -4.646 14.474 722 HG2 GLN 465 HG2 GLN 465 11.373 -6.086 14.295 723 HG3 GLN 465 HG1 GLN 465 9.958 -6.950 13.698 724 HE21 GLN 465 HE21 GLN 465 11.121 -8.363 12.456 725 HE22 GLN 465 HE22 GLN 465 11.931 -7.885 11.002 726 H GLU 466 HN GLU 466 6.682 -3.933 13.743 727 HA GLU 466 HA GLU 466 5.668 -6.417 14.786 728 HB2 GLU 466 HB2 GLU 466 4.556 -3.604 14.809 729 HB3 GLU 466 HB1 GLU 466 3.814 -4.964 15.641 730 HG2 GLU 466 HG2 GLU 466 6.661 -4.253 16.182 731 HG3 GLU 466 HG1 GLU 466 5.357 -3.333 16.934 732 H MET 467 HN MET 467 5.286 -4.592 11.943 733 HA MET 467 HA MET 467 2.674 -5.720 11.288 734 HB2 MET 467 HB2 MET 467 4.417 -3.906 9.604 735 HB3 MET 467 HB1 MET 467 2.715 -4.267 9.354 736 HG2 MET 467 HG2 MET 467 3.530 -3.029 11.928 737 HG3 MET 467 HG1 MET 467 3.512 -2.025 10.480 738 HE1 MET 467 HE1 MET 467 1.113 -2.980 8.760 739 HE2 MET 467 HE2 MET 467 1.425 -1.299 9.191 740 HE3 MET 467 HE3 MET 467 -0.185 -1.983 9.416 741 H PHE 468 HN PHE 468 6.006 -5.694 10.099 742 HA PHE 468 HA PHE 468 5.393 -8.106 8.524 743 HB2 PHE 468 HB2 PHE 468 7.375 -5.887 8.033 744 HB3 PHE 468 HB1 PHE 468 7.496 -7.444 7.225 745 HD1 PHE 468 HD2 PHE 468 5.470 -8.229 5.875 746 HD2 PHE 468 HD1 PHE 468 6.026 -4.210 7.158 747 HE1 PHE 468 HE2 PHE 468 3.891 -7.465 4.148 748 HE2 PHE 468 HE1 PHE 468 4.450 -3.439 5.434 749 HZ PHE 468 HZ PHE 468 3.383 -5.066 3.927 750 HA PRO 469 HA PRO 469 8.354 -9.617 11.607 751 HB2 PRO 469 HB2 PRO 469 7.097 -12.052 11.921 752 HB3 PRO 469 HB1 PRO 469 6.699 -10.596 12.846 753 HG2 PRO 469 HG2 PRO 469 5.124 -11.950 10.851 754 HG3 PRO 469 HG1 PRO 469 4.669 -10.611 11.915 755 HD2 PRO 469 HD2 PRO 469 5.421 -10.540 9.110 756 HD3 PRO 469 HD1 PRO 469 4.702 -9.266 10.112 757 H GLN 470 HN GLN 470 8.519 -9.808 8.619 758 HA GLN 470 HA GLN 470 10.196 -12.206 8.542 759 HB2 GLN 470 HB2 GLN 470 9.370 -12.850 6.355 760 HB3 GLN 470 HB1 GLN 470 8.043 -12.802 7.503 761 HG2 GLN 470 HG2 GLN 470 7.312 -10.673 6.609 762 HG3 GLN 470 HG1 GLN 470 8.686 -10.649 5.503 763 HE21 GLN 470 HE21 GLN 470 5.865 -10.566 4.854 764 HE22 GLN 470 HE22 GLN 470 5.548 -11.938 3.857 765 H VAL 471 HN VAL 471 10.424 -9.150 8.610 766 HA VAL 471 HA VAL 471 12.218 -8.919 6.291 767 HB VAL 471 HB VAL 471 10.273 -7.403 6.135 768 HG11 VAL 471 HG11 VAL 471 10.054 -5.503 7.663 769 HG12 VAL 471 HG12 VAL 471 11.355 -6.157 8.658 770 HG13 VAL 471 HG13 VAL 471 9.839 -7.044 8.495 771 HG21 VAL 471 HG21 VAL 471 12.342 -6.737 5.069 772 HG22 VAL 471 HG22 VAL 471 12.909 -6.003 6.570 773 HG23 VAL 471 HG23 VAL 471 11.521 -5.320 5.723 774 HA PRO 472 HA PRO 472 15.507 -8.611 9.285 775 HB2 PRO 472 HB2 PRO 472 16.873 -7.053 7.163 776 HB3 PRO 472 HB1 PRO 472 17.396 -8.532 7.989 777 HG2 PRO 472 HG2 PRO 472 16.577 -8.605 5.477 778 HG3 PRO 472 HG1 PRO 472 16.178 -9.906 6.617 779 HD2 PRO 472 HD2 PRO 472 14.449 -7.685 5.614 780 HD3 PRO 472 HD1 PRO 472 14.042 -9.387 5.921 781 H TYR 473 HN TYR 473 15.565 -7.208 10.901 782 HA TYR 473 HA TYR 473 14.396 -4.706 10.941 783 HB2 TYR 473 HB2 TYR 473 14.960 -6.109 12.923 784 HB3 TYR 473 HB1 TYR 473 16.644 -5.640 12.730 785 HD1 TYR 473 HD2 TYR 473 13.274 -4.059 13.053 786 HD2 TYR 473 HD1 TYR 473 17.421 -3.870 13.992 787 HE1 TYR 473 HE2 TYR 473 12.866 -2.064 14.432 788 HE2 TYR 473 HE1 TYR 473 17.023 -1.880 15.378 789 HH TYR 473 HH TYR 473 15.411 -0.100 15.624 790 H HIS 474 HN HIS 474 17.786 -5.528 10.322 791 HA HIS 474 HA HIS 474 18.720 -2.853 10.356 792 HB2 HIS 474 HB2 HIS 474 20.739 -3.775 9.196 793 HB3 HIS 474 HB1 HIS 474 20.321 -4.601 10.691 794 HD2 HIS 474 HD2 HIS 474 20.778 -5.297 6.944 795 HE1 HIS 474 HE1 HIS 474 19.544 -8.881 8.820 796 HE2 HIS 474 HE2 HIS 474 20.633 -7.881 6.763 797 H LEU 475 HN LEU 475 17.079 -4.724 7.952 798 HA LEU 475 HA LEU 475 17.893 -3.025 5.759 799 HB2 LEU 475 HB2 LEU 475 15.898 -5.260 6.014 800 HB3 LEU 475 HB1 LEU 475 15.988 -4.275 4.568 801 HG LEU 475 HG LEU 475 18.064 -6.163 5.655 802 HD11 LEU 475 HD11 LEU 475 16.239 -7.027 4.210 803 HD12 LEU 475 HD12 LEU 475 17.850 -7.231 3.522 804 HD13 LEU 475 HD13 LEU 475 16.796 -5.945 2.935 805 HD21 LEU 475 HD21 LEU 475 19.365 -4.280 5.057 806 HD22 LEU 475 HD22 LEU 475 18.391 -3.973 3.618 807 HD23 LEU 475 HD23 LEU 475 19.447 -5.384 3.682 808 H VAL 476 HN VAL 476 15.287 -3.234 8.056 809 HA VAL 476 HA VAL 476 13.491 -1.467 6.742 810 HB VAL 476 HB VAL 476 13.726 -1.955 9.721 811 HG11 VAL 476 HG11 VAL 476 11.336 -1.372 9.750 812 HG12 VAL 476 HG12 VAL 476 11.421 -0.996 8.030 813 HG13 VAL 476 HG13 VAL 476 12.344 -0.039 9.189 814 HG21 VAL 476 HG21 VAL 476 12.095 -3.451 7.673 815 HG22 VAL 476 HG22 VAL 476 12.034 -3.695 9.419 816 HG23 VAL 476 HG23 VAL 476 13.509 -4.069 8.526 817 H LEU 477 HN LEU 477 16.101 -1.067 9.071 818 HA LEU 477 HA LEU 477 15.759 1.671 9.600 819 HB2 LEU 477 HB2 LEU 477 18.208 -0.085 9.674 820 HB3 LEU 477 HB1 LEU 477 18.210 1.584 10.212 821 HG LEU 477 HG LEU 477 16.438 -0.555 11.397 822 HD11 LEU 477 HD11 LEU 477 18.007 -0.565 13.277 823 HD12 LEU 477 HD12 LEU 477 19.077 0.517 12.386 824 HD13 LEU 477 HD13 LEU 477 18.772 -1.113 11.788 825 HD21 LEU 477 HD21 LEU 477 15.566 1.674 11.715 826 HD22 LEU 477 HD22 LEU 477 17.139 2.248 12.268 827 HD23 LEU 477 HD23 LEU 477 16.233 1.089 13.240 828 H GLN 478 HN GLN 478 17.158 -0.030 6.922 829 HA GLN 478 HA GLN 478 18.743 2.021 5.834 830 HB2 GLN 478 HB2 GLN 478 18.925 -0.299 5.087 831 HB3 GLN 478 HB1 GLN 478 17.290 -0.236 4.442 832 HG2 GLN 478 HG2 GLN 478 18.055 1.562 2.888 833 HG3 GLN 478 HG1 GLN 478 19.697 1.278 3.459 834 HE21 GLN 478 HE21 GLN 478 17.330 -1.272 3.035 835 HE22 GLN 478 HE22 GLN 478 18.109 -2.026 1.687 836 H ASP 479 HN ASP 479 15.375 1.077 5.134 837 HA ASP 479 HA ASP 479 14.932 3.189 3.282 838 HB2 ASP 479 HB2 ASP 479 13.574 1.084 3.393 839 HB3 ASP 479 HB1 ASP 479 12.843 1.690 4.877 840 H LEU 480 HN LEU 480 14.512 2.816 6.734 841 HA LEU 480 HA LEU 480 12.983 5.099 7.253 842 HB2 LEU 480 HB2 LEU 480 14.553 3.202 8.783 843 HB3 LEU 480 HB1 LEU 480 14.676 4.818 9.446 844 HG LEU 480 HG LEU 480 12.895 3.532 10.522 845 HD11 LEU 480 HD11 LEU 480 12.684 5.968 10.326 846 HD12 LEU 480 HD12 LEU 480 11.114 5.165 10.318 847 HD13 LEU 480 HD13 LEU 480 11.807 5.764 8.810 848 HD21 LEU 480 HD21 LEU 480 12.322 2.090 8.623 849 HD22 LEU 480 HD22 LEU 480 11.602 3.471 7.799 850 HD23 LEU 480 HD23 LEU 480 10.898 2.877 9.303 851 H GLN 481 HN GLN 481 16.380 4.725 6.586 852 HA GLN 481 HA GLN 481 17.019 7.427 7.421 853 HB2 GLN 481 HB2 GLN 481 18.644 5.289 6.039 854 HB3 GLN 481 HB1 GLN 481 19.273 6.877 6.452 855 HG2 GLN 481 HG2 GLN 481 18.171 5.924 8.820 856 HG3 GLN 481 HG1 GLN 481 18.974 4.530 8.096 857 HE21 GLN 481 HE21 GLN 481 20.683 4.419 9.486 858 HE22 GLN 481 HE22 GLN 481 21.902 5.640 9.603 859 H LEU 482 HN LEU 482 15.703 5.968 4.703 860 HA LEU 482 HA LEU 482 16.720 8.018 2.871 861 HB2 LEU 482 HB2 LEU 482 15.691 5.284 2.563 862 HB3 LEU 482 HB1 LEU 482 15.120 6.413 1.352 863 HG LEU 482 HG LEU 482 17.110 5.191 0.601 864 HD11 LEU 482 HD11 LEU 482 18.393 7.094 -0.168 865 HD12 LEU 482 HD12 LEU 482 17.671 8.115 1.074 866 HD13 LEU 482 HD13 LEU 482 16.670 7.465 -0.222 867 HD21 LEU 482 HD21 LEU 482 18.218 4.789 2.696 868 HD22 LEU 482 HD22 LEU 482 18.439 6.518 2.957 869 HD23 LEU 482 HD23 LEU 482 19.298 5.708 1.649 870 H THR 483 HN THR 483 13.586 6.505 3.713 871 HA THR 483 HA THR 483 12.178 8.769 2.553 872 HB THR 483 HB THR 483 10.130 7.527 3.103 873 HG1 THR 483 HG1 THR 483 11.255 5.165 3.820 874 HG21 THR 483 HG21 THR 483 10.499 5.590 1.642 875 HG22 THR 483 HG22 THR 483 12.242 5.816 1.783 876 HG23 THR 483 HG23 THR 483 11.256 7.042 0.987 877 H ARG 484 HN ARG 484 12.723 7.308 5.717 878 HA ARG 484 HA ARG 484 12.525 8.074 7.842 879 HB2 ARG 484 HB2 ARG 484 12.389 10.730 6.415 880 HB3 ARG 484 HB1 ARG 484 12.287 10.601 8.166 881 HG2 ARG 484 HG2 ARG 484 14.513 10.881 8.059 882 HG3 ARG 484 HG1 ARG 484 14.519 9.155 7.701 883 HD2 ARG 484 HD2 ARG 484 15.853 10.042 6.019 884 HD3 ARG 484 HD1 ARG 484 14.277 9.889 5.241 885 HE ARG 484 HE ARG 484 15.352 12.419 6.313 886 HH11 ARG 484 HH11 ARG 484 13.552 10.641 3.891 887 HH12 ARG 484 HH12 ARG 484 13.119 12.054 2.992 888 HH21 ARG 484 HH21 ARG 484 14.811 14.272 5.108 889 HH22 ARG 484 HH22 ARG 484 13.848 14.120 3.675 890 H SER 485 HN SER 485 10.206 7.357 6.093 891 HA SER 485 HA SER 485 8.134 8.239 7.945 892 HB2 SER 485 HB2 SER 485 8.376 9.322 5.341 893 HB3 SER 485 HB1 SER 485 7.020 8.197 5.290 894 HG SER 485 HG SER 485 6.003 9.330 6.887 895 H VAL 486 HN VAL 486 7.365 6.421 8.735 896 HA VAL 486 HA VAL 486 7.740 3.876 7.657 897 HB VAL 486 HB VAL 486 6.174 3.061 9.334 898 HG11 VAL 486 HG11 VAL 486 7.698 5.291 10.635 899 HG12 VAL 486 HG12 VAL 486 8.528 3.930 9.881 900 HG13 VAL 486 HG13 VAL 486 7.411 3.651 11.220 901 HG21 VAL 486 HG21 VAL 486 4.431 4.739 9.145 902 HG22 VAL 486 HG22 VAL 486 5.513 5.967 9.802 903 HG23 VAL 486 HG23 VAL 486 4.986 4.624 10.816 904 H GLU 487 HN GLU 487 5.204 6.196 7.089 905 HA GLU 487 HA GLU 487 3.275 4.376 6.059 906 HB2 GLU 487 HB2 GLU 487 3.388 7.208 5.113 907 HB3 GLU 487 HB1 GLU 487 1.992 6.228 5.532 908 HG2 GLU 487 HG2 GLU 487 1.978 7.578 7.336 909 HG3 GLU 487 HG1 GLU 487 3.131 6.385 7.936 910 H ILE 488 HN ILE 488 6.169 5.665 4.777 911 HA ILE 488 HA ILE 488 5.348 5.059 2.024 912 HB ILE 488 HB ILE 488 7.909 6.371 2.960 913 HG12 ILE 488 HG12 ILE 488 5.429 7.675 1.807 914 HG13 ILE 488 HG11 ILE 488 5.883 7.715 3.505 915 HG21 ILE 488 HG21 ILE 488 6.659 6.168 0.222 916 HG22 ILE 488 HG22 ILE 488 8.093 5.305 0.779 917 HG23 ILE 488 HG23 ILE 488 8.127 7.060 0.618 918 HD11 ILE 488 HD11 ILE 488 6.481 9.782 2.388 919 HD12 ILE 488 HD12 ILE 488 7.465 8.884 1.233 920 HD13 ILE 488 HD13 ILE 488 7.923 8.926 2.935 921 H THR 489 HN THR 489 7.552 4.159 4.564 922 HA THR 489 HA THR 489 9.313 2.485 3.224 923 HB THR 489 HB THR 489 8.248 2.137 6.031 924 HG1 THR 489 HG1 THR 489 10.451 3.653 5.021 925 HG21 THR 489 HG21 THR 489 9.481 0.182 5.319 926 HG22 THR 489 HG22 THR 489 10.478 1.110 6.442 927 HG23 THR 489 HG23 THR 489 10.793 1.188 4.708 928 H THR 490 HN THR 490 6.206 1.671 4.759 929 HA THR 490 HA THR 490 6.301 -1.084 4.301 930 HB THR 490 HB THR 490 3.713 -0.811 4.378 931 HG1 THR 490 HG1 THR 490 3.280 1.288 4.113 932 HG21 THR 490 HG21 THR 490 5.194 -1.566 6.233 933 HG22 THR 490 HG22 THR 490 3.792 -0.651 6.787 934 HG23 THR 490 HG23 THR 490 5.380 0.118 6.721 935 H ASP 491 HN ASP 491 4.913 1.520 2.315 936 HA ASP 491 HA ASP 491 3.911 -0.220 0.301 937 HB2 ASP 491 HB2 ASP 491 3.102 2.119 0.688 938 HB3 ASP 491 HB1 ASP 491 4.617 2.708 0.008 939 H ASN 492 HN ASN 492 6.859 1.666 0.688 940 HA ASN 492 HA ASN 492 8.037 1.274 -1.796 941 HB2 ASN 492 HB2 ASN 492 8.772 2.547 0.481 942 HB3 ASN 492 HB1 ASN 492 9.842 1.153 0.552 943 HD21 ASN 492 HD21 ASN 492 11.577 2.649 0.342 944 HD22 ASN 492 HD22 ASN 492 11.994 3.271 -1.226 945 H ILE 493 HN ILE 493 8.167 -0.774 1.101 946 HA ILE 493 HA ILE 493 9.880 -2.735 -0.040 947 HB ILE 493 HB ILE 493 7.956 -2.962 2.285 948 HG12 ILE 493 HG12 ILE 493 10.961 -2.595 2.274 949 HG13 ILE 493 HG11 ILE 493 9.804 -1.289 2.517 950 HG21 ILE 493 HG21 ILE 493 9.268 -4.943 2.931 951 HG22 ILE 493 HG22 ILE 493 10.169 -4.823 1.423 952 HG23 ILE 493 HG23 ILE 493 8.441 -5.162 1.387 953 HD11 ILE 493 HD11 ILE 493 10.163 -3.695 4.292 954 HD12 ILE 493 HD12 ILE 493 8.995 -2.398 4.538 955 HD13 ILE 493 HD13 ILE 493 10.721 -2.055 4.626 956 H LEU 494 HN LEU 494 6.355 -2.489 0.296 957 HA LEU 494 HA LEU 494 5.744 -5.037 -0.740 958 HB2 LEU 494 HB2 LEU 494 4.197 -2.495 -0.415 959 HB3 LEU 494 HB1 LEU 494 3.490 -3.851 -1.273 960 HG LEU 494 HG LEU 494 4.585 -4.182 1.512 961 HD11 LEU 494 HD11 LEU 494 2.312 -3.840 2.348 962 HD12 LEU 494 HD12 LEU 494 1.800 -3.336 0.737 963 HD13 LEU 494 HD13 LEU 494 2.976 -2.371 1.631 964 HD21 LEU 494 HD21 LEU 494 3.560 -5.946 -0.366 965 HD22 LEU 494 HD22 LEU 494 2.221 -5.664 0.762 966 HD23 LEU 494 HD23 LEU 494 3.777 -6.245 1.361 967 H GLU 495 HN GLU 495 6.485 -2.009 -2.315 968 HA GLU 495 HA GLU 495 5.518 -2.847 -4.889 969 HB2 GLU 495 HB2 GLU 495 7.306 -0.553 -4.074 970 HB3 GLU 495 HB1 GLU 495 6.748 -0.828 -5.717 971 HG2 GLU 495 HG2 GLU 495 5.075 -0.175 -3.308 972 HG3 GLU 495 HG1 GLU 495 5.368 0.834 -4.723 973 H GLY 496 HN GLY 496 8.254 -3.531 -3.045 974 HA2 GLY 496 HA2 GLY 496 9.910 -5.074 -3.630 975 HA3 GLY 496 HA1 GLY 496 9.484 -4.859 -5.321 976 H ARG 497 HN ARG 497 10.001 -2.031 -3.393 977 HA ARG 497 HA ARG 497 12.169 -1.215 -5.074 978 HB2 ARG 497 HB2 ARG 497 10.379 0.173 -3.633 979 HB3 ARG 497 HB1 ARG 497 11.710 0.168 -2.483 980 HG2 ARG 497 HG2 ARG 497 12.246 2.060 -3.588 981 HG3 ARG 497 HG1 ARG 497 13.058 0.912 -4.658 982 HD2 ARG 497 HD2 ARG 497 11.756 2.489 -5.959 983 HD3 ARG 497 HD1 ARG 497 11.063 0.874 -6.095 984 HE ARG 497 HE ARG 497 9.831 2.353 -3.996 985 HH11 ARG 497 HH11 ARG 497 9.883 1.996 -7.487 986 HH12 ARG 497 HH12 ARG 497 8.255 2.562 -7.695 987 HH21 ARG 497 HH21 ARG 497 7.690 3.091 -4.268 988 HH22 ARG 497 HH22 ARG 497 7.017 3.202 -5.866 989 H ILE 498 HN ILE 498 11.875 -2.317 -1.733 990 HA ILE 498 HA ILE 498 14.766 -2.311 -1.398 991 HB ILE 498 HB ILE 498 12.514 -2.987 0.503 992 HG12 ILE 498 HG12 ILE 498 13.838 -1.048 1.744 993 HG13 ILE 498 HG11 ILE 498 14.338 -0.660 0.102 994 HG21 ILE 498 HG21 ILE 498 14.423 -4.464 0.938 995 HG22 ILE 498 HG22 ILE 498 14.181 -3.305 2.244 996 HG23 ILE 498 HG23 ILE 498 15.474 -3.056 1.070 997 HD11 ILE 498 HD11 ILE 498 11.489 -0.882 1.038 998 HD12 ILE 498 HD12 ILE 498 12.030 -0.411 -0.573 999 HD13 ILE 498 HD13 ILE 498 12.383 0.622 0.814 1000 H GLN 499 HN GLN 499 15.989 -4.065 -1.715 1001 HA GLN 499 HA GLN 499 14.882 -6.428 -2.802 1002 HB2 GLN 499 HB2 GLN 499 17.658 -5.876 -1.746 1003 HB3 GLN 499 HB1 GLN 499 17.199 -7.309 -2.657 1004 HG2 GLN 499 HG2 GLN 499 17.040 -4.478 -3.659 1005 HG3 GLN 499 HG1 GLN 499 18.302 -5.640 -4.058 1006 HE21 GLN 499 HE21 GLN 499 16.360 -4.221 -5.758 1007 HE22 GLN 499 HE22 GLN 499 15.514 -5.458 -6.624 1008 H VAL 500 HN VAL 500 14.050 -8.123 -1.844 1009 HA VAL 500 HA VAL 500 14.001 -8.388 1.008 1010 HB VAL 500 HB VAL 500 12.661 -10.426 0.568 1011 HG11 VAL 500 HG11 VAL 500 11.532 -8.293 0.705 1012 HG12 VAL 500 HG12 VAL 500 10.756 -9.298 -0.520 1013 HG13 VAL 500 HG13 VAL 500 11.836 -7.990 -1.006 1014 HG21 VAL 500 HG21 VAL 500 13.111 -9.778 -2.344 1015 HG22 VAL 500 HG22 VAL 500 12.048 -11.034 -1.710 1016 HG23 VAL 500 HG23 VAL 500 13.792 -11.156 -1.479 1017 HA PRO 501 HA PRO 501 17.318 -11.247 1.677 1018 HB2 PRO 501 HB2 PRO 501 15.558 -13.179 3.042 1019 HB3 PRO 501 HB1 PRO 501 16.896 -12.224 3.702 1020 HG2 PRO 501 HG2 PRO 501 14.355 -11.709 4.336 1021 HG3 PRO 501 HG1 PRO 501 15.570 -10.424 4.177 1022 HD2 PRO 501 HD2 PRO 501 13.433 -11.244 2.257 1023 HD3 PRO 501 HD1 PRO 501 14.002 -9.618 2.689 1024 H PHE 502 HN PHE 502 17.421 -11.807 -0.583 1025 HA PHE 502 HA PHE 502 16.054 -14.185 -1.501 1026 HB2 PHE 502 HB2 PHE 502 16.560 -12.123 -2.916 1027 HB3 PHE 502 HB1 PHE 502 18.235 -12.663 -2.928 1028 HD1 PHE 502 HD1 PHE 502 14.836 -13.375 -4.080 1029 HD2 PHE 502 HD2 PHE 502 18.917 -14.557 -4.223 1030 HE1 PHE 502 HE1 PHE 502 14.344 -14.825 -6.004 1031 HE2 PHE 502 HE2 PHE 502 18.434 -16.011 -6.147 1032 HZ PHE 502 HZ PHE 502 16.143 -16.145 -7.038 1033 HA PRO 503 HA PRO 503 19.346 -16.878 -0.161 1034 HB2 PRO 503 HB2 PRO 503 18.414 -19.148 -1.316 1035 HB3 PRO 503 HB1 PRO 503 17.677 -18.452 0.140 1036 HG2 PRO 503 HG2 PRO 503 16.781 -18.269 -2.693 1037 HG3 PRO 503 HG1 PRO 503 15.826 -18.517 -1.218 1038 HD2 PRO 503 HD2 PRO 503 16.039 -16.107 -2.456 1039 HD3 PRO 503 HD1 PRO 503 15.780 -16.288 -0.709 1040 H THR 504 HN THR 504 21.025 -15.959 -1.383 1041 HA THR 504 HA THR 504 21.817 -17.539 -3.672 1042 HB THR 504 HB THR 504 20.506 -15.769 -4.736 1043 HG1 THR 504 HG1 THR 504 23.322 -15.583 -5.046 1044 HG21 THR 504 HG21 THR 504 20.692 -14.063 -2.990 1045 HG22 THR 504 HG22 THR 504 21.152 -13.415 -4.565 1046 HG23 THR 504 HG23 THR 504 22.396 -13.841 -3.389 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 -18.425 -10.923 14.605 2 H2 MET 1 HT2 MET 1 -18.310 -12.479 13.957 3 H3 MET 1 HT3 MET 1 -17.613 -11.170 13.141 4 HA MET 1 HA MET 1 -16.801 -12.092 15.829 5 HB2 MET 1 HB2 MET 1 -14.910 -13.166 14.838 6 HB3 MET 1 HB1 MET 1 -16.344 -13.764 14.022 7 HG2 MET 1 HG2 MET 1 -15.898 -12.253 12.150 8 HG3 MET 1 HG1 MET 1 -14.445 -11.680 12.968 9 HE1 MET 1 HE1 MET 1 -12.859 -12.164 11.097 10 HE2 MET 1 HE2 MET 1 -14.097 -12.776 9.999 11 HE3 MET 1 HE3 MET 1 -12.635 -13.717 10.289 12 H GLN 2 HN GLN 2 -14.877 -11.111 16.595 13 HA GLN 2 HA GLN 2 -14.587 -8.364 15.636 14 HB2 GLN 2 HB2 GLN 2 -13.460 -9.644 18.136 15 HB3 GLN 2 HB1 GLN 2 -13.500 -7.926 17.760 16 HG2 GLN 2 HG2 GLN 2 -15.965 -9.617 18.083 17 HG3 GLN 2 HG1 GLN 2 -15.225 -8.704 19.397 18 HE21 GLN 2 HE21 GLN 2 -17.865 -8.492 18.064 19 HE22 GLN 2 HE22 GLN 2 -17.986 -6.840 17.549 20 H ILE 3 HN ILE 3 -12.709 -7.533 14.854 21 HA ILE 3 HA ILE 3 -10.362 -9.307 14.747 22 HB ILE 3 HB ILE 3 -9.841 -8.390 12.490 23 HG12 ILE 3 HG12 ILE 3 -12.724 -7.494 12.403 24 HG13 ILE 3 HG11 ILE 3 -11.406 -6.394 12.793 25 HG21 ILE 3 HG21 ILE 3 -11.430 -9.818 11.275 26 HG22 ILE 3 HG22 ILE 3 -12.428 -9.922 12.727 27 HG23 ILE 3 HG23 ILE 3 -10.802 -10.603 12.724 28 HD11 ILE 3 HD11 ILE 3 -11.698 -7.949 10.235 29 HD12 ILE 3 HD12 ILE 3 -10.391 -6.831 10.622 30 HD13 ILE 3 HD13 ILE 3 -12.042 -6.233 10.453 31 H PHE 4 HN PHE 4 -8.334 -8.195 14.528 32 HA PHE 4 HA PHE 4 -8.455 -5.429 15.542 33 HB2 PHE 4 HB2 PHE 4 -6.356 -7.549 16.089 34 HB3 PHE 4 HB1 PHE 4 -6.304 -5.891 16.676 35 HD1 PHE 4 HD1 PHE 4 -8.167 -5.114 18.217 36 HD2 PHE 4 HD2 PHE 4 -7.463 -9.209 17.296 37 HE1 PHE 4 HE1 PHE 4 -9.436 -5.782 20.216 38 HE2 PHE 4 HE2 PHE 4 -8.734 -9.880 19.291 39 HZ PHE 4 HZ PHE 4 -9.723 -8.166 20.756 40 H VAL 5 HN VAL 5 -7.738 -3.984 14.143 41 HA VAL 5 HA VAL 5 -5.867 -4.848 12.041 42 HB VAL 5 HB VAL 5 -7.589 -2.363 12.075 43 HG11 VAL 5 HG11 VAL 5 -7.059 -2.272 9.671 44 HG12 VAL 5 HG12 VAL 5 -5.979 -3.653 9.873 45 HG13 VAL 5 HG13 VAL 5 -5.620 -2.127 10.682 46 HG21 VAL 5 HG21 VAL 5 -9.017 -4.312 11.995 47 HG22 VAL 5 HG22 VAL 5 -8.051 -5.002 10.692 48 HG23 VAL 5 HG23 VAL 5 -8.987 -3.533 10.414 49 H LYS 6 HN LYS 6 -3.823 -4.343 12.411 50 HA LYS 6 HA LYS 6 -3.181 -2.173 14.249 51 HB2 LYS 6 HB2 LYS 6 -2.107 -4.589 14.134 52 HB3 LYS 6 HB1 LYS 6 -1.089 -3.838 12.913 53 HG2 LYS 6 HG2 LYS 6 -0.534 -2.066 14.611 54 HG3 LYS 6 HG1 LYS 6 -1.356 -3.067 15.809 55 HD2 LYS 6 HD2 LYS 6 0.199 -4.943 15.052 56 HD3 LYS 6 HD1 LYS 6 1.128 -3.684 14.239 57 HE2 LYS 6 HE2 LYS 6 2.207 -3.805 16.273 58 HE3 LYS 6 HE1 LYS 6 1.045 -2.514 16.576 59 HZ1 LYS 6 HZ1 LYS 6 1.049 -4.058 18.398 60 HZ2 LYS 6 HZ2 LYS 6 0.765 -5.363 17.364 61 HZ3 LYS 6 HZ3 LYS 6 -0.427 -4.183 17.585 62 H THR 7 HN THR 7 -2.066 -0.357 13.689 63 HA THR 7 HA THR 7 -1.637 0.073 10.810 64 HB THR 7 HB THR 7 -1.978 2.505 11.295 65 HG1 THR 7 HG1 THR 7 -3.030 1.599 13.790 66 HG21 THR 7 HG21 THR 7 -4.423 2.386 11.473 67 HG22 THR 7 HG22 THR 7 -4.303 0.707 11.998 68 HG23 THR 7 HG23 THR 7 -3.800 1.159 10.369 69 H LEU 8 HN LEU 8 0.042 1.812 10.391 70 HA LEU 8 HA LEU 8 2.492 1.059 11.570 71 HB2 LEU 8 HB2 LEU 8 1.762 3.411 9.828 72 HB3 LEU 8 HB1 LEU 8 3.410 2.989 10.271 73 HG LEU 8 HG LEU 8 1.545 1.143 8.782 74 HD11 LEU 8 HD11 LEU 8 3.699 2.973 7.732 75 HD12 LEU 8 HD12 LEU 8 1.968 3.074 7.402 76 HD13 LEU 8 HD13 LEU 8 2.902 1.705 6.799 77 HD21 LEU 8 HD21 LEU 8 3.507 -0.167 8.351 78 HD22 LEU 8 HD22 LEU 8 3.390 0.103 10.090 79 HD23 LEU 8 HD23 LEU 8 4.538 1.033 9.127 80 H THR 9 HN THR 9 0.187 3.531 12.333 81 HA THR 9 HA THR 9 1.908 5.148 13.921 82 HB THR 9 HB THR 9 -1.023 5.035 14.474 83 HG1 THR 9 HG1 THR 9 -0.622 6.596 12.342 84 HG21 THR 9 HG21 THR 9 0.332 6.724 15.581 85 HG22 THR 9 HG22 THR 9 -0.737 7.498 14.413 86 HG23 THR 9 HG23 THR 9 0.967 7.267 14.028 87 H GLY 10 HN GLY 10 0.293 2.160 14.402 88 HA2 GLY 10 HA2 GLY 10 0.988 0.762 16.253 89 HA3 GLY 10 HA1 GLY 10 1.036 2.207 17.256 90 H LYS 11 HN LYS 11 -1.458 3.178 16.031 91 HA LYS 11 HA LYS 11 -3.274 2.308 17.951 92 HB2 LYS 11 HB2 LYS 11 -3.425 4.446 16.724 93 HB3 LYS 11 HB1 LYS 11 -3.855 3.563 15.267 94 HG2 LYS 11 HG2 LYS 11 -5.884 2.738 16.383 95 HG3 LYS 11 HG1 LYS 11 -5.458 3.685 17.810 96 HD2 LYS 11 HD2 LYS 11 -7.077 4.912 16.516 97 HD3 LYS 11 HD1 LYS 11 -5.520 5.733 16.409 98 HE2 LYS 11 HE2 LYS 11 -5.128 4.741 14.222 99 HE3 LYS 11 HE1 LYS 11 -6.646 3.856 14.333 100 HZ1 LYS 11 HZ1 LYS 11 -6.315 6.800 14.179 101 HZ2 LYS 11 HZ2 LYS 11 -7.790 6.025 14.455 102 HZ3 LYS 11 HZ3 LYS 11 -6.973 5.785 12.990 103 H THR 12 HN THR 12 -4.383 0.499 18.140 104 HA THR 12 HA THR 12 -4.706 -1.227 15.790 105 HB THR 12 HB THR 12 -5.240 -2.056 18.633 106 HG1 THR 12 HG1 THR 12 -2.944 -1.115 17.845 107 HG21 THR 12 HG21 THR 12 -5.925 -3.571 16.818 108 HG22 THR 12 HG22 THR 12 -4.622 -4.263 17.784 109 HG23 THR 12 HG23 THR 12 -4.273 -3.570 16.202 110 H ILE 13 HN ILE 13 -6.552 -0.862 14.783 111 HA ILE 13 HA ILE 13 -8.900 0.100 16.187 112 HB ILE 13 HB ILE 13 -8.821 -0.657 13.279 113 HG12 ILE 13 HG12 ILE 13 -8.026 2.070 14.299 114 HG13 ILE 13 HG11 ILE 13 -6.833 0.815 13.983 115 HG21 ILE 13 HG21 ILE 13 -10.316 1.467 14.812 116 HG22 ILE 13 HG22 ILE 13 -10.978 -0.063 14.238 117 HG23 ILE 13 HG23 ILE 13 -10.449 1.159 13.082 118 HD11 ILE 13 HD11 ILE 13 -7.511 0.727 11.656 119 HD12 ILE 13 HD12 ILE 13 -7.049 2.367 12.119 120 HD13 ILE 13 HD13 ILE 13 -8.753 1.941 11.964 121 H THR 14 HN THR 14 -10.844 -0.982 16.370 122 HA THR 14 HA THR 14 -10.714 -3.887 15.912 123 HB THR 14 HB THR 14 -12.792 -2.697 17.692 124 HG1 THR 14 HG1 THR 14 -10.225 -2.127 18.015 125 HG21 THR 14 HG21 THR 14 -12.703 -5.118 17.282 126 HG22 THR 14 HG22 THR 14 -12.378 -4.743 18.974 127 HG23 THR 14 HG23 THR 14 -11.047 -5.159 17.895 128 H LEU 15 HN LEU 15 -12.322 -4.848 14.689 129 HA LEU 15 HA LEU 15 -14.531 -3.143 13.797 130 HB2 LEU 15 HB2 LEU 15 -12.498 -4.503 12.082 131 HB3 LEU 15 HB1 LEU 15 -14.122 -4.247 11.477 132 HG LEU 15 HG LEU 15 -12.555 -1.943 12.580 133 HD11 LEU 15 HD11 LEU 15 -11.700 -1.491 10.348 134 HD12 LEU 15 HD12 LEU 15 -12.385 -3.008 9.766 135 HD13 LEU 15 HD13 LEU 15 -11.086 -3.026 10.961 136 HD21 LEU 15 HD21 LEU 15 -14.926 -1.622 12.118 137 HD22 LEU 15 HD22 LEU 15 -14.690 -2.193 10.467 138 HD23 LEU 15 HD23 LEU 15 -13.936 -0.688 10.994 139 H GLU 16 HN GLU 16 -16.342 -4.223 13.012 140 HA GLU 16 HA GLU 16 -16.593 -6.976 13.979 141 HB2 GLU 16 HB2 GLU 16 -18.146 -4.767 14.456 142 HB3 GLU 16 HB1 GLU 16 -19.014 -5.535 13.136 143 HG2 GLU 16 HG2 GLU 16 -19.592 -7.341 14.378 144 HG3 GLU 16 HG1 GLU 16 -18.156 -7.241 15.397 145 H VAL 17 HN VAL 17 -16.320 -8.445 12.426 146 HA VAL 17 HA VAL 17 -17.624 -7.998 9.830 147 HB VAL 17 HB VAL 17 -15.682 -9.101 8.693 148 HG11 VAL 17 HG11 VAL 17 -14.249 -7.101 8.674 149 HG12 VAL 17 HG12 VAL 17 -15.116 -6.481 10.080 150 HG13 VAL 17 HG13 VAL 17 -15.962 -6.699 8.546 151 HG21 VAL 17 HG21 VAL 17 -14.725 -10.142 10.715 152 HG22 VAL 17 HG22 VAL 17 -14.248 -8.545 11.287 153 HG23 VAL 17 HG23 VAL 17 -13.539 -9.200 9.811 154 H GLU 18 HN GLU 18 -17.656 -10.069 8.544 155 HA GLU 18 HA GLU 18 -18.136 -12.360 10.334 156 HB2 GLU 18 HB2 GLU 18 -19.597 -11.460 7.844 157 HB3 GLU 18 HB1 GLU 18 -19.781 -13.075 8.515 158 HG2 GLU 18 HG2 GLU 18 -20.405 -10.502 9.953 159 HG3 GLU 18 HG1 GLU 18 -21.586 -11.575 9.201 160 HA PRO 19 HA PRO 19 -15.068 -14.694 8.167 161 HB2 PRO 19 HB2 PRO 19 -17.157 -16.781 7.731 162 HB3 PRO 19 HB1 PRO 19 -15.544 -16.931 8.453 163 HG2 PRO 19 HG2 PRO 19 -17.707 -16.959 9.977 164 HG3 PRO 19 HG1 PRO 19 -16.220 -16.141 10.499 165 HD2 PRO 19 HD2 PRO 19 -18.764 -14.966 9.501 166 HD3 PRO 19 HD1 PRO 19 -17.629 -14.345 10.715 167 H SER 20 HN SER 20 -18.275 -14.599 6.659 168 HA SER 20 HA SER 20 -17.171 -15.133 4.034 169 HB2 SER 20 HB2 SER 20 -20.015 -14.373 4.657 170 HB3 SER 20 HB1 SER 20 -19.406 -15.328 3.302 171 HG SER 20 HG SER 20 -20.360 -16.603 4.985 172 H ASP 21 HN ASP 21 -16.934 -12.454 5.747 173 HA ASP 21 HA ASP 21 -18.087 -10.503 3.983 174 HB2 ASP 21 HB2 ASP 21 -17.384 -10.311 6.528 175 HB3 ASP 21 HB1 ASP 21 -15.841 -9.820 5.838 176 H THR 22 HN THR 22 -17.076 -9.283 2.415 177 HA THR 22 HA THR 22 -14.785 -10.507 1.171 178 HB THR 22 HB THR 22 -15.267 -8.172 -0.219 179 HG1 THR 22 HG1 THR 22 -17.304 -7.606 0.042 180 HG21 THR 22 HG21 THR 22 -16.601 -10.860 -0.572 181 HG22 THR 22 HG22 THR 22 -14.999 -10.417 -1.165 182 HG23 THR 22 HG23 THR 22 -16.434 -9.622 -1.814 183 H ILE 23 HN ILE 23 -12.768 -9.606 0.857 184 HA ILE 23 HA ILE 23 -11.661 -8.094 2.915 185 HB ILE 23 HB ILE 23 -10.604 -8.429 0.101 186 HG12 ILE 23 HG12 ILE 23 -10.969 -10.582 1.155 187 HG13 ILE 23 HG11 ILE 23 -9.242 -10.248 1.114 188 HG21 ILE 23 HG21 ILE 23 -8.420 -7.920 1.034 189 HG22 ILE 23 HG22 ILE 23 -9.138 -7.676 2.627 190 HG23 ILE 23 HG23 ILE 23 -9.532 -6.578 1.304 191 HD11 ILE 23 HD11 ILE 23 -11.082 -10.051 3.483 192 HD12 ILE 23 HD12 ILE 23 -9.404 -9.507 3.484 193 HD13 ILE 23 HD13 ILE 23 -9.781 -11.212 3.225 194 H GLU 24 HN GLU 24 -12.864 -7.054 -0.251 195 HA GLU 24 HA GLU 24 -11.996 -4.402 -0.148 196 HB2 GLU 24 HB2 GLU 24 -12.909 -5.466 -2.177 197 HB3 GLU 24 HB1 GLU 24 -14.509 -5.465 -1.444 198 HG2 GLU 24 HG2 GLU 24 -14.439 -3.013 -1.339 199 HG3 GLU 24 HG1 GLU 24 -12.865 -3.040 -2.129 200 H ASN 25 HN ASN 25 -14.917 -5.922 1.120 201 HA ASN 25 HA ASN 25 -16.232 -3.560 1.922 202 HB2 ASN 25 HB2 ASN 25 -17.186 -5.945 1.759 203 HB3 ASN 25 HB1 ASN 25 -16.489 -6.198 3.355 204 HD21 ASN 25 HD21 ASN 25 -18.549 -6.522 4.230 205 HD22 ASN 25 HD22 ASN 25 -19.637 -5.193 4.501 206 H VAL 26 HN VAL 26 -13.902 -5.673 3.499 207 HA VAL 26 HA VAL 26 -13.964 -4.527 6.058 208 HB VAL 26 HB VAL 26 -11.566 -5.727 4.655 209 HG11 VAL 26 HG11 VAL 26 -11.007 -4.462 6.687 210 HG12 VAL 26 HG12 VAL 26 -10.727 -6.191 6.890 211 HG13 VAL 26 HG13 VAL 26 -12.154 -5.439 7.601 212 HG21 VAL 26 HG21 VAL 26 -13.447 -7.268 4.623 213 HG22 VAL 26 HG22 VAL 26 -13.672 -7.054 6.359 214 HG23 VAL 26 HG23 VAL 26 -12.210 -7.829 5.748 215 H LYS 27 HN LYS 27 -12.015 -3.743 3.190 216 HA LYS 27 HA LYS 27 -10.491 -1.680 4.352 217 HB2 LYS 27 HB2 LYS 27 -11.341 -1.797 1.458 218 HB3 LYS 27 HB1 LYS 27 -9.915 -1.016 2.125 219 HG2 LYS 27 HG2 LYS 27 -9.474 -3.539 2.931 220 HG3 LYS 27 HG1 LYS 27 -10.390 -3.845 1.456 221 HD2 LYS 27 HD2 LYS 27 -7.830 -2.279 1.742 222 HD3 LYS 27 HD1 LYS 27 -8.062 -3.810 0.897 223 HE2 LYS 27 HE2 LYS 27 -9.193 -1.123 0.126 224 HE3 LYS 27 HE1 LYS 27 -7.911 -2.003 -0.702 225 HZ1 LYS 27 HZ1 LYS 27 -9.633 -3.817 -1.030 226 HZ2 LYS 27 HZ2 LYS 27 -9.839 -2.400 -1.932 227 HZ3 LYS 27 HZ3 LYS 27 -10.788 -2.669 -0.562 228 H ALA 28 HN ALA 28 -13.654 -1.707 2.813 229 HA ALA 28 HA ALA 28 -14.002 1.111 2.755 230 HB1 ALA 28 HB1 ALA 28 -15.314 -0.419 1.352 231 HB2 ALA 28 HB2 ALA 28 -16.345 0.635 2.318 232 HB3 ALA 28 HB3 ALA 28 -16.109 -1.047 2.794 233 H LYS 29 HN LYS 29 -14.752 -1.409 5.092 234 HA LYS 29 HA LYS 29 -16.235 0.191 6.881 235 HB2 LYS 29 HB2 LYS 29 -14.668 -2.358 7.250 236 HB3 LYS 29 HB1 LYS 29 -15.526 -1.587 8.575 237 HG2 LYS 29 HG2 LYS 29 -17.626 -1.828 7.425 238 HG3 LYS 29 HG1 LYS 29 -16.810 -2.485 6.008 239 HD2 LYS 29 HD2 LYS 29 -16.113 -4.430 7.251 240 HD3 LYS 29 HD1 LYS 29 -16.757 -3.746 8.742 241 HE2 LYS 29 HE2 LYS 29 -19.016 -3.839 7.841 242 HE3 LYS 29 HE1 LYS 29 -18.398 -4.471 6.317 243 HZ1 LYS 29 HZ1 LYS 29 -17.935 -5.874 8.875 244 HZ2 LYS 29 HZ2 LYS 29 -17.827 -6.497 7.299 245 HZ3 LYS 29 HZ3 LYS 29 -19.338 -6.123 7.967 246 H ILE 30 HN ILE 30 -12.779 -0.505 6.585 247 HA ILE 30 HA ILE 30 -11.975 0.889 8.931 248 HB ILE 30 HB ILE 30 -10.334 0.449 6.420 249 HG12 ILE 30 HG12 ILE 30 -10.385 -1.303 8.882 250 HG13 ILE 30 HG11 ILE 30 -11.331 -1.652 7.438 251 HG21 ILE 30 HG21 ILE 30 -9.376 2.091 7.926 252 HG22 ILE 30 HG22 ILE 30 -8.421 0.610 7.960 253 HG23 ILE 30 HG23 ILE 30 -9.531 0.973 9.281 254 HD11 ILE 30 HD11 ILE 30 -9.212 -2.910 7.577 255 HD12 ILE 30 HD12 ILE 30 -8.336 -1.382 7.495 256 HD13 ILE 30 HD13 ILE 30 -9.330 -1.902 6.135 257 H GLN 31 HN GLN 31 -12.370 1.738 5.547 258 HA GLN 31 HA GLN 31 -11.372 4.346 5.593 259 HB2 GLN 31 HB2 GLN 31 -11.725 3.754 3.433 260 HB3 GLN 31 HB1 GLN 31 -13.076 2.710 3.842 261 HG2 GLN 31 HG2 GLN 31 -14.481 4.767 4.089 262 HG3 GLN 31 HG1 GLN 31 -13.125 5.687 3.434 263 HE21 GLN 31 HE21 GLN 31 -14.457 6.316 1.692 264 HE22 GLN 31 HE22 GLN 31 -14.784 5.230 0.385 265 H ASP 32 HN ASP 32 -14.509 3.044 6.465 266 HA ASP 32 HA ASP 32 -15.843 5.546 6.704 267 HB2 ASP 32 HB2 ASP 32 -16.929 3.287 6.402 268 HB3 ASP 32 HB1 ASP 32 -16.566 2.964 8.093 269 H LYS 33 HN LYS 33 -13.584 3.928 8.672 270 HA LYS 33 HA LYS 33 -14.383 5.448 11.051 271 HB2 LYS 33 HB2 LYS 33 -12.595 3.064 10.656 272 HB3 LYS 33 HB1 LYS 33 -12.527 4.014 12.131 273 HG2 LYS 33 HG2 LYS 33 -15.047 3.592 12.298 274 HG3 LYS 33 HG1 LYS 33 -14.776 2.341 11.084 275 HD2 LYS 33 HD2 LYS 33 -13.181 1.225 12.534 276 HD3 LYS 33 HD1 LYS 33 -13.326 2.515 13.729 277 HE2 LYS 33 HE2 LYS 33 -15.770 1.947 13.884 278 HE3 LYS 33 HE1 LYS 33 -15.425 0.528 12.898 279 HZ1 LYS 33 HZ1 LYS 33 -13.985 -0.327 14.582 280 HZ2 LYS 33 HZ2 LYS 33 -15.438 0.109 15.330 281 HZ3 LYS 33 HZ3 LYS 33 -14.082 1.106 15.481 282 H GLU 34 HN GLU 34 -11.483 4.717 9.120 283 HA GLU 34 HA GLU 34 -9.958 6.794 10.428 284 HB2 GLU 34 HB2 GLU 34 -9.346 4.945 8.126 285 HB3 GLU 34 HB1 GLU 34 -8.204 6.133 8.740 286 HG2 GLU 34 HG2 GLU 34 -9.384 3.834 10.279 287 HG3 GLU 34 HG1 GLU 34 -7.741 3.944 9.652 288 H GLY 35 HN GLY 35 -11.464 6.334 7.257 289 HA2 GLY 35 HA2 GLY 35 -12.301 8.143 5.968 290 HA3 GLY 35 HA1 GLY 35 -11.180 9.217 6.796 291 H ILE 36 HN ILE 36 -9.589 6.428 6.022 292 HA ILE 36 HA ILE 36 -8.126 7.721 3.883 293 HB ILE 36 HB ILE 36 -7.683 4.992 5.109 294 HG12 ILE 36 HG12 ILE 36 -6.219 7.551 5.760 295 HG13 ILE 36 HG11 ILE 36 -7.582 6.965 6.706 296 HG21 ILE 36 HG21 ILE 36 -5.852 6.746 3.477 297 HG22 ILE 36 HG22 ILE 36 -6.632 5.265 2.926 298 HG23 ILE 36 HG23 ILE 36 -5.419 5.198 4.204 299 HD11 ILE 36 HD11 ILE 36 -5.477 6.364 7.739 300 HD12 ILE 36 HD12 ILE 36 -4.983 5.518 6.271 301 HD13 ILE 36 HD13 ILE 36 -6.349 4.925 7.215 302 HA PRO 37 HA PRO 37 -10.578 5.833 0.656 303 HB2 PRO 37 HB2 PRO 37 -8.116 6.259 -0.949 304 HB3 PRO 37 HB1 PRO 37 -9.769 6.822 -1.248 305 HG2 PRO 37 HG2 PRO 37 -7.873 8.496 -0.453 306 HG3 PRO 37 HG1 PRO 37 -9.552 8.653 0.100 307 HD2 PRO 37 HD2 PRO 37 -7.176 7.602 1.563 308 HD3 PRO 37 HD1 PRO 37 -8.554 8.547 2.163 309 HA PRO 38 HA PRO 38 -9.301 1.583 0.684 310 HB2 PRO 38 HB2 PRO 38 -10.454 1.458 -2.052 311 HB3 PRO 38 HB1 PRO 38 -10.856 0.506 -0.611 312 HG2 PRO 38 HG2 PRO 38 -12.486 2.400 -1.504 313 HG3 PRO 38 HG1 PRO 38 -12.268 2.095 0.230 314 HD2 PRO 38 HD2 PRO 38 -11.192 4.312 -1.443 315 HD3 PRO 38 HD1 PRO 38 -11.737 4.324 0.246 316 H ASP 39 HN ASP 39 -8.513 3.678 -1.992 317 HA ASP 39 HA ASP 39 -6.753 1.928 -3.357 318 HB2 ASP 39 HB2 ASP 39 -7.221 4.887 -3.405 319 HB3 ASP 39 HB1 ASP 39 -5.836 4.204 -4.252 320 H GLN 40 HN GLN 40 -6.379 3.902 -0.541 321 HA GLN 40 HA GLN 40 -3.461 3.583 -0.678 322 HB2 GLN 40 HB2 GLN 40 -5.013 5.366 1.202 323 HB3 GLN 40 HB1 GLN 40 -3.278 5.370 0.915 324 HG2 GLN 40 HG2 GLN 40 -3.769 6.015 -1.459 325 HG3 GLN 40 HG1 GLN 40 -5.449 6.233 -0.975 326 HE21 GLN 40 HE21 GLN 40 -2.614 6.995 0.960 327 HE22 GLN 40 HE22 GLN 40 -2.875 8.705 0.992 328 H GLN 41 HN GLN 41 -5.618 1.626 0.141 329 HA GLN 41 HA GLN 41 -4.578 1.015 2.832 330 HB2 GLN 41 HB2 GLN 41 -7.320 0.698 1.653 331 HB3 GLN 41 HB1 GLN 41 -6.803 -0.314 2.993 332 HG2 GLN 41 HG2 GLN 41 -6.336 1.765 4.285 333 HG3 GLN 41 HG1 GLN 41 -7.064 2.682 2.963 334 HE21 GLN 41 HE21 GLN 41 -9.273 2.600 2.659 335 HE22 GLN 41 HE22 GLN 41 -10.354 1.890 3.805 336 H ARG 42 HN ARG 42 -3.194 -0.639 2.707 337 HA ARG 42 HA ARG 42 -3.875 -2.870 0.895 338 HB2 ARG 42 HB2 ARG 42 -1.122 -2.166 1.932 339 HB3 ARG 42 HB1 ARG 42 -1.515 -3.397 0.745 340 HG2 ARG 42 HG2 ARG 42 -2.238 -1.660 -0.817 341 HG3 ARG 42 HG1 ARG 42 -1.836 -0.425 0.379 342 HD2 ARG 42 HD2 ARG 42 0.017 -0.497 -1.060 343 HD3 ARG 42 HD1 ARG 42 0.514 -1.409 0.363 344 HE ARG 42 HE ARG 42 -0.450 -3.330 -1.268 345 HH11 ARG 42 HH11 ARG 42 1.931 -0.783 -1.697 346 HH12 ARG 42 HH12 ARG 42 2.782 -1.650 -2.955 347 HH21 ARG 42 HH21 ARG 42 0.709 -4.457 -2.898 348 HH22 ARG 42 HH22 ARG 42 2.108 -3.708 -3.612 349 H LEU 43 HN LEU 43 -4.642 -4.567 1.994 350 HA LEU 43 HA LEU 43 -3.975 -4.854 4.823 351 HB2 LEU 43 HB2 LEU 43 -6.132 -5.987 3.074 352 HB3 LEU 43 HB1 LEU 43 -5.766 -6.720 4.624 353 HG LEU 43 HG LEU 43 -6.596 -3.840 4.240 354 HD11 LEU 43 HD11 LEU 43 -8.175 -6.199 5.257 355 HD12 LEU 43 HD12 LEU 43 -8.400 -5.408 3.697 356 HD13 LEU 43 HD13 LEU 43 -8.729 -4.524 5.188 357 HD21 LEU 43 HD21 LEU 43 -6.940 -3.977 6.718 358 HD22 LEU 43 HD22 LEU 43 -5.257 -4.040 6.202 359 HD23 LEU 43 HD23 LEU 43 -6.085 -5.518 6.691 360 H ILE 44 HN ILE 44 -2.580 -6.291 5.545 361 HA ILE 44 HA ILE 44 -1.832 -8.535 3.787 362 HB ILE 44 HB ILE 44 -0.111 -6.749 5.480 363 HG12 ILE 44 HG12 ILE 44 1.339 -7.119 3.330 364 HG13 ILE 44 HG11 ILE 44 -0.177 -7.670 2.631 365 HG21 ILE 44 HG21 ILE 44 0.460 -8.975 6.240 366 HG22 ILE 44 HG22 ILE 44 1.755 -8.339 5.225 367 HG23 ILE 44 HG23 ILE 44 0.627 -9.528 4.573 368 HD11 ILE 44 HD11 ILE 44 0.175 -5.349 2.110 369 HD12 ILE 44 HD12 ILE 44 0.364 -4.962 3.820 370 HD13 ILE 44 HD13 ILE 44 -1.196 -5.509 3.207 371 H PHE 45 HN PHE 45 -1.724 -10.518 4.642 372 HA PHE 45 HA PHE 45 -1.915 -10.904 7.530 373 HB2 PHE 45 HB2 PHE 45 -4.255 -10.868 6.648 374 HB3 PHE 45 HB1 PHE 45 -3.834 -12.202 5.581 375 HD1 PHE 45 HD1 PHE 45 -3.901 -11.271 9.183 376 HD2 PHE 45 HD2 PHE 45 -4.138 -14.388 6.293 377 HE1 PHE 45 HE1 PHE 45 -4.485 -12.871 10.957 378 HE2 PHE 45 HE2 PHE 45 -4.725 -15.991 8.065 379 HZ PHE 45 HZ PHE 45 -4.902 -15.233 10.399 380 H ALA 46 HN ALA 46 -0.735 -12.614 8.179 381 HA ALA 46 HA ALA 46 0.715 -14.355 8.129 382 HB1 ALA 46 HB1 ALA 46 0.223 -16.236 6.707 383 HB2 ALA 46 HB2 ALA 46 -0.774 -15.231 5.656 384 HB3 ALA 46 HB3 ALA 46 -1.289 -15.556 7.311 385 H GLY 47 HN GLY 47 1.298 -11.869 6.643 386 HA2 GLY 47 HA2 GLY 47 3.242 -11.126 5.628 387 HA3 GLY 47 HA1 GLY 47 3.708 -12.797 5.371 388 H LYS 48 HN LYS 48 0.574 -12.109 4.239 389 HA LYS 48 HA LYS 48 1.567 -11.532 1.529 390 HB2 LYS 48 HB2 LYS 48 -0.413 -13.670 2.334 391 HB3 LYS 48 HB1 LYS 48 -0.224 -13.110 0.679 392 HG2 LYS 48 HG2 LYS 48 1.910 -14.021 0.488 393 HG3 LYS 48 HG1 LYS 48 2.106 -14.163 2.237 394 HD2 LYS 48 HD2 LYS 48 -0.034 -15.690 0.791 395 HD3 LYS 48 HD1 LYS 48 1.620 -16.297 0.867 396 HE2 LYS 48 HE2 LYS 48 1.521 -16.173 3.330 397 HE3 LYS 48 HE1 LYS 48 -0.154 -15.637 3.217 398 HZ1 LYS 48 HZ1 LYS 48 -0.786 -17.705 2.292 399 HZ2 LYS 48 HZ2 LYS 48 0.148 -18.050 3.659 400 HZ3 LYS 48 HZ3 LYS 48 0.816 -18.209 2.115 401 H GLN 49 HN GLN 49 -0.035 -10.550 0.126 402 HA GLN 49 HA GLN 49 -1.770 -8.788 1.626 403 HB2 GLN 49 HB2 GLN 49 -0.302 -8.437 -0.665 404 HB3 GLN 49 HB1 GLN 49 -1.925 -8.661 -1.302 405 HG2 GLN 49 HG2 GLN 49 -2.647 -6.893 0.393 406 HG3 GLN 49 HG1 GLN 49 -0.932 -6.544 0.575 407 HE21 GLN 49 HE21 GLN 49 -3.655 -6.487 -1.594 408 HE22 GLN 49 HE22 GLN 49 -2.974 -5.382 -2.740 409 H LEU 50 HN LEU 50 -3.999 -8.627 1.369 410 HA LEU 50 HA LEU 50 -5.282 -11.130 0.593 411 HB2 LEU 50 HB2 LEU 50 -6.512 -8.699 1.889 412 HB3 LEU 50 HB1 LEU 50 -7.219 -10.299 1.765 413 HG LEU 50 HG LEU 50 -4.730 -9.665 3.352 414 HD11 LEU 50 HD11 LEU 50 -7.508 -10.157 4.404 415 HD12 LEU 50 HD12 LEU 50 -6.805 -8.554 4.205 416 HD13 LEU 50 HD13 LEU 50 -6.070 -9.704 5.321 417 HD21 LEU 50 HD21 LEU 50 -5.352 -11.889 4.406 418 HD22 LEU 50 HD22 LEU 50 -4.693 -11.943 2.772 419 HD23 LEU 50 HD23 LEU 50 -6.428 -12.122 3.030 420 H GLU 51 HN GLU 51 -6.713 -11.347 -1.053 421 HA GLU 51 HA GLU 51 -6.776 -9.210 -3.006 422 HB2 GLU 51 HB2 GLU 51 -7.903 -12.014 -3.085 423 HB3 GLU 51 HB1 GLU 51 -7.930 -10.884 -4.432 424 HG2 GLU 51 HG2 GLU 51 -5.409 -10.803 -4.234 425 HG3 GLU 51 HG1 GLU 51 -5.552 -12.190 -3.155 426 H ASP 52 HN ASP 52 -8.472 -7.981 -3.517 427 HA ASP 52 HA ASP 52 -10.493 -7.497 -1.665 428 HB2 ASP 52 HB2 ASP 52 -9.889 -6.602 -4.411 429 HB3 ASP 52 HB1 ASP 52 -11.558 -6.408 -3.889 430 H GLY 53 HN GLY 53 -10.513 -9.569 -4.503 431 HA2 GLY 53 HA2 GLY 53 -13.379 -10.041 -4.250 432 HA3 GLY 53 HA1 GLY 53 -12.325 -10.696 -5.491 433 H ARG 54 HN ARG 54 -11.826 -10.884 -2.003 434 HA ARG 54 HA ARG 54 -12.500 -13.732 -2.063 435 HB2 ARG 54 HB2 ARG 54 -9.887 -12.541 -1.142 436 HB3 ARG 54 HB1 ARG 54 -10.439 -14.113 -0.587 437 HG2 ARG 54 HG2 ARG 54 -9.844 -13.322 -3.430 438 HG3 ARG 54 HG1 ARG 54 -8.876 -14.377 -2.402 439 HD2 ARG 54 HD2 ARG 54 -10.791 -15.947 -2.285 440 HD3 ARG 54 HD1 ARG 54 -11.669 -14.913 -3.410 441 HE ARG 54 HE ARG 54 -9.260 -16.480 -4.030 442 HH11 ARG 54 HH11 ARG 54 -12.048 -14.617 -5.086 443 HH12 ARG 54 HH12 ARG 54 -11.869 -15.076 -6.753 444 HH21 ARG 54 HH21 ARG 54 -9.041 -17.071 -6.220 445 HH22 ARG 54 HH22 ARG 54 -10.166 -16.464 -7.393 446 H THR 55 HN THR 55 -12.668 -14.637 0.161 447 HA THR 55 HA THR 55 -13.795 -12.583 1.938 448 HB THR 55 HB THR 55 -15.078 -14.409 2.982 449 HG1 THR 55 HG1 THR 55 -13.652 -15.971 1.075 450 HG21 THR 55 HG21 THR 55 -15.367 -14.187 -0.016 451 HG22 THR 55 HG22 THR 55 -16.139 -13.170 1.199 452 HG23 THR 55 HG23 THR 55 -16.583 -14.870 1.061 453 H LEU 56 HN LEU 56 -13.613 -13.118 4.305 454 HA LEU 56 HA LEU 56 -10.910 -13.335 5.032 455 HB2 LEU 56 HB2 LEU 56 -13.359 -13.665 6.761 456 HB3 LEU 56 HB1 LEU 56 -11.735 -13.352 7.343 457 HG LEU 56 HG LEU 56 -13.229 -11.452 5.535 458 HD11 LEU 56 HD11 LEU 56 -13.004 -11.394 8.539 459 HD12 LEU 56 HD12 LEU 56 -14.468 -11.747 7.620 460 HD13 LEU 56 HD13 LEU 56 -13.731 -10.147 7.526 461 HD21 LEU 56 HD21 LEU 56 -11.585 -9.834 6.359 462 HD22 LEU 56 HD22 LEU 56 -10.807 -11.187 5.542 463 HD23 LEU 56 HD23 LEU 56 -10.807 -11.104 7.303 464 H SER 57 HN SER 57 -13.490 -15.711 4.874 465 HA SER 57 HA SER 57 -12.227 -17.768 6.329 466 HB2 SER 57 HB2 SER 57 -13.832 -19.084 4.535 467 HB3 SER 57 HB1 SER 57 -14.380 -18.400 6.066 468 HG SER 57 HG SER 57 -14.520 -17.251 3.475 469 H ASP 58 HN ASP 58 -11.771 -16.607 3.101 470 HA ASP 58 HA ASP 58 -10.731 -18.916 1.878 471 HB2 ASP 58 HB2 ASP 58 -10.446 -15.978 1.353 472 HB3 ASP 58 HB1 ASP 58 -9.456 -17.123 0.458 473 H TYR 59 HN TYR 59 -9.173 -16.359 3.738 474 HA TYR 59 HA TYR 59 -6.579 -17.685 3.479 475 HB2 TYR 59 HB2 TYR 59 -7.283 -15.034 4.757 476 HB3 TYR 59 HB1 TYR 59 -5.659 -15.650 4.486 477 HD1 TYR 59 HD1 TYR 59 -4.697 -15.677 2.250 478 HD2 TYR 59 HD2 TYR 59 -8.607 -14.140 2.935 479 HE1 TYR 59 HE1 TYR 59 -4.660 -14.616 0.033 480 HE2 TYR 59 HE2 TYR 59 -8.583 -13.078 0.718 481 HH TYR 59 HH TYR 59 -6.197 -13.791 -1.635 482 H ASN 60 HN ASN 60 -9.067 -18.345 5.249 483 HA ASN 60 HA ASN 60 -9.450 -19.359 7.240 484 HB2 ASN 60 HB2 ASN 60 -6.562 -19.767 6.808 485 HB3 ASN 60 HB1 ASN 60 -7.102 -19.941 8.476 486 HD21 ASN 60 HD21 ASN 60 -7.428 -21.147 5.219 487 HD22 ASN 60 HD22 ASN 60 -8.147 -22.661 5.646 488 H ILE 61 HN ILE 61 -9.220 -16.464 7.119 489 HA ILE 61 HA ILE 61 -7.927 -15.587 9.520 490 HB ILE 61 HB ILE 61 -10.003 -14.159 7.849 491 HG12 ILE 61 HG12 ILE 61 -6.996 -13.850 7.812 492 HG13 ILE 61 HG11 ILE 61 -7.898 -14.816 6.649 493 HG21 ILE 61 HG21 ILE 61 -9.175 -12.121 8.911 494 HG22 ILE 61 HG22 ILE 61 -8.077 -13.079 9.902 495 HG23 ILE 61 HG23 ILE 61 -9.820 -13.245 10.109 496 HD11 ILE 61 HD11 ILE 61 -8.285 -11.865 7.081 497 HD12 ILE 61 HD12 ILE 61 -9.024 -12.863 5.829 498 HD13 ILE 61 HD13 ILE 61 -7.284 -12.579 5.817 499 H GLN 62 HN GLN 62 -8.635 -16.221 11.409 500 HA GLN 62 HA GLN 62 -11.475 -16.727 11.842 501 HB2 GLN 62 HB2 GLN 62 -9.109 -17.281 13.642 502 HB3 GLN 62 HB1 GLN 62 -10.756 -17.838 13.894 503 HG2 GLN 62 HG2 GLN 62 -10.647 -19.359 12.137 504 HG3 GLN 62 HG1 GLN 62 -9.253 -18.564 11.413 505 HE21 GLN 62 HE21 GLN 62 -7.208 -19.014 12.183 506 HE22 GLN 62 HE22 GLN 62 -6.887 -20.310 13.286 507 H LYS 63 HN LYS 63 -11.957 -16.246 14.371 508 HA LYS 63 HA LYS 63 -12.130 -13.417 14.518 509 HB2 LYS 63 HB2 LYS 63 -13.215 -13.811 16.698 510 HB3 LYS 63 HB1 LYS 63 -13.907 -14.798 15.419 511 HG2 LYS 63 HG2 LYS 63 -12.647 -16.726 16.207 512 HG3 LYS 63 HG1 LYS 63 -11.922 -15.739 17.478 513 HD2 LYS 63 HD2 LYS 63 -14.074 -15.383 18.500 514 HD3 LYS 63 HD1 LYS 63 -14.888 -16.197 17.161 515 HE2 LYS 63 HE2 LYS 63 -13.793 -18.286 17.752 516 HE3 LYS 63 HE1 LYS 63 -12.926 -17.478 19.059 517 HZ1 LYS 63 HZ1 LYS 63 -15.085 -16.980 20.079 518 HZ2 LYS 63 HZ2 LYS 63 -14.825 -18.643 19.929 519 HZ3 LYS 63 HZ3 LYS 63 -15.867 -17.851 18.858 520 H GLU 64 HN GLU 64 -11.258 -12.018 16.053 521 HA GLU 64 HA GLU 64 -9.688 -11.098 17.392 522 HB2 GLU 64 HB2 GLU 64 -9.265 -13.966 18.222 523 HB3 GLU 64 HB1 GLU 64 -8.417 -12.613 18.960 524 HG2 GLU 64 HG2 GLU 64 -10.439 -11.696 19.800 525 HG3 GLU 64 HG1 GLU 64 -11.411 -12.818 18.850 526 H SER 65 HN SER 65 -9.053 -12.159 14.629 527 HA SER 65 HA SER 65 -6.206 -12.688 14.803 528 HB2 SER 65 HB2 SER 65 -7.980 -12.319 12.381 529 HB3 SER 65 HB1 SER 65 -6.299 -12.846 12.349 530 HG SER 65 HG SER 65 -8.596 -14.228 13.063 531 H THR 66 HN THR 66 -4.605 -11.346 13.804 532 HA THR 66 HA THR 66 -5.337 -8.508 13.897 533 HB THR 66 HB THR 66 -2.518 -9.546 13.886 534 HG1 THR 66 HG1 THR 66 -4.110 -10.409 15.619 535 HG21 THR 66 HG21 THR 66 -2.910 -7.125 13.594 536 HG22 THR 66 HG22 THR 66 -2.072 -7.484 15.103 537 HG23 THR 66 HG23 THR 66 -3.792 -7.099 15.123 538 H LEU 67 HN LEU 67 -5.361 -7.346 12.112 539 HA LEU 67 HA LEU 67 -4.167 -8.461 9.664 540 HB2 LEU 67 HB2 LEU 67 -6.342 -6.392 10.006 541 HB3 LEU 67 HB1 LEU 67 -5.692 -6.917 8.466 542 HG LEU 67 HG LEU 67 -7.181 -8.688 10.411 543 HD11 LEU 67 HD11 LEU 67 -9.000 -8.600 8.811 544 HD12 LEU 67 HD12 LEU 67 -8.073 -7.507 7.783 545 HD13 LEU 67 HD13 LEU 67 -8.607 -6.977 9.377 546 HD21 LEU 67 HD21 LEU 67 -7.220 -10.268 8.513 547 HD22 LEU 67 HD22 LEU 67 -5.593 -9.958 9.114 548 HD23 LEU 67 HD23 LEU 67 -6.143 -9.190 7.626 549 H HIS 68 HN HIS 68 -2.750 -7.262 8.473 550 HA HIS 68 HA HIS 68 -1.657 -4.907 9.824 551 HB2 HIS 68 HB2 HIS 68 -0.481 -6.627 7.624 552 HB3 HIS 68 HB1 HIS 68 0.337 -5.283 8.421 553 HD2 HIS 68 HD2 HIS 68 0.035 -5.900 11.479 554 HE1 HIS 68 HE1 HIS 68 1.234 -9.849 10.554 555 HE2 HIS 68 HE2 HIS 68 1.105 -8.086 12.368 556 H LEU 69 HN LEU 69 -2.379 -3.017 9.148 557 HA LEU 69 HA LEU 69 -3.283 -2.737 6.376 558 HB2 LEU 69 HB2 LEU 69 -4.831 -2.043 8.152 559 HB3 LEU 69 HB1 LEU 69 -3.642 -0.900 8.749 560 HG LEU 69 HG LEU 69 -3.798 0.343 6.613 561 HD11 LEU 69 HD11 LEU 69 -5.662 -0.151 5.092 562 HD12 LEU 69 HD12 LEU 69 -6.010 -1.617 6.008 563 HD13 LEU 69 HD13 LEU 69 -4.481 -1.459 5.142 564 HD21 LEU 69 HD21 LEU 69 -6.386 -0.093 8.094 565 HD22 LEU 69 HD22 LEU 69 -6.051 1.267 7.021 566 HD23 LEU 69 HD23 LEU 69 -5.117 1.060 8.503 567 H VAL 70 HN VAL 70 -1.729 -2.154 5.022 568 HA VAL 70 HA VAL 70 0.420 -0.396 5.929 569 HB VAL 70 HB VAL 70 0.035 -1.908 3.347 570 HG11 VAL 70 HG11 VAL 70 2.349 -0.220 4.262 571 HG12 VAL 70 HG12 VAL 70 1.294 0.092 2.886 572 HG13 VAL 70 HG13 VAL 70 2.381 -1.297 2.869 573 HG21 VAL 70 HG21 VAL 70 0.496 -3.349 5.246 574 HG22 VAL 70 HG22 VAL 70 1.901 -2.370 5.665 575 HG23 VAL 70 HG23 VAL 70 1.886 -3.291 4.162 576 H LEU 71 HN LEU 71 0.376 1.710 5.577 577 HA LEU 71 HA LEU 71 -1.677 2.907 3.941 578 HB2 LEU 71 HB2 LEU 71 0.605 4.252 5.390 579 HB3 LEU 71 HB1 LEU 71 -0.855 5.014 4.792 580 HG LEU 71 HG LEU 71 -0.787 2.959 7.003 581 HD11 LEU 71 HD11 LEU 71 -1.040 5.957 7.146 582 HD12 LEU 71 HD12 LEU 71 0.331 4.998 7.699 583 HD13 LEU 71 HD13 LEU 71 -1.233 4.843 8.500 584 HD21 LEU 71 HD21 LEU 71 -3.095 3.752 7.403 585 HD22 LEU 71 HD22 LEU 71 -2.895 2.963 5.839 586 HD23 LEU 71 HD23 LEU 71 -2.984 4.721 5.935 587 H ARG 72 HN ARG 72 -1.398 3.021 1.811 588 HA ARG 72 HA ARG 72 1.330 3.158 0.749 589 HB2 ARG 72 HB2 ARG 72 0.582 1.716 -0.780 590 HB3 ARG 72 HB1 ARG 72 -0.989 1.722 0.005 591 HG2 ARG 72 HG2 ARG 72 -1.923 3.028 -1.591 592 HG3 ARG 72 HG1 ARG 72 -0.440 3.938 -1.878 593 HD2 ARG 72 HD2 ARG 72 -0.971 1.109 -2.785 594 HD3 ARG 72 HD1 ARG 72 -1.082 2.547 -3.801 595 HE ARG 72 HE ARG 72 1.472 2.369 -2.553 596 HH11 ARG 72 HH11 ARG 72 -0.431 0.978 -5.158 597 HH12 ARG 72 HH12 ARG 72 0.955 0.570 -6.118 598 HH21 ARG 72 HH21 ARG 72 3.274 1.849 -3.801 599 HH22 ARG 72 HH22 ARG 72 3.078 1.057 -5.337 600 H LEU 73 HN LEU 73 1.880 4.569 -0.949 601 HA LEU 73 HA LEU 73 0.219 7.001 -1.147 602 HB2 LEU 73 HB2 LEU 73 3.184 6.747 -0.707 603 HB3 LEU 73 HB1 LEU 73 2.493 8.188 -1.425 604 HG LEU 73 HG LEU 73 0.980 8.140 0.746 605 HD11 LEU 73 HD11 LEU 73 1.798 6.054 1.634 606 HD12 LEU 73 HD12 LEU 73 2.287 7.378 2.691 607 HD13 LEU 73 HD13 LEU 73 3.458 6.650 1.592 608 HD21 LEU 73 HD21 LEU 73 2.487 9.944 0.071 609 HD22 LEU 73 HD22 LEU 73 3.850 9.062 0.757 610 HD23 LEU 73 HD23 LEU 73 2.563 9.651 1.808 611 H ARG 74 HN ARG 74 0.834 8.330 -3.134 612 HA ARG 74 HA ARG 74 1.293 6.464 -5.352 613 HB2 ARG 74 HB2 ARG 74 -0.255 8.977 -5.041 614 HB3 ARG 74 HB1 ARG 74 0.475 8.681 -6.613 615 HG2 ARG 74 HG2 ARG 74 -1.402 6.809 -5.177 616 HG3 ARG 74 HG1 ARG 74 -1.835 7.890 -6.503 617 HD2 ARG 74 HD2 ARG 74 -0.181 6.726 -7.932 618 HD3 ARG 74 HD1 ARG 74 0.115 5.593 -6.616 619 HE ARG 74 HE ARG 74 -2.566 5.449 -6.981 620 HH11 ARG 74 HH11 ARG 74 0.196 5.120 -9.113 621 HH12 ARG 74 HH12 ARG 74 -0.608 4.020 -10.189 622 HH21 ARG 74 HH21 ARG 74 -3.618 3.975 -8.357 623 HH22 ARG 74 HH22 ARG 74 -2.795 3.370 -9.762 624 H GLY 75 HN GLY 75 2.707 9.041 -3.650 625 HA2 GLY 75 HA2 GLY 75 5.078 8.912 -5.282 626 HA3 GLY 75 HA1 GLY 75 4.236 10.453 -5.376 627 H GLY 76 HN GLY 76 6.890 9.843 -4.284 628 HA2 GLY 76 HA2 GLY 76 6.428 10.569 -1.458 629 HA3 GLY 76 HA1 GLY 76 7.860 9.731 -2.044 630 H1 SER 453 HT1 SER 453 21.525 10.400 16.505 631 H2 SER 453 HT2 SER 453 22.513 9.114 16.033 632 H3 SER 453 HT3 SER 453 22.981 10.114 17.306 633 HA SER 453 HA SER 453 22.208 8.163 18.305 634 HB2 SER 453 HB2 SER 453 19.735 9.266 18.960 635 HB3 SER 453 HB1 SER 453 21.267 9.577 19.778 636 HG SER 453 HG SER 453 19.875 11.381 18.708 637 H ASN 454 HN ASN 454 19.681 9.412 16.105 638 HA ASN 454 HA ASN 454 18.147 8.375 14.789 639 HB2 ASN 454 HB2 ASN 454 20.188 6.214 15.135 640 HB3 ASN 454 HB1 ASN 454 18.649 5.816 14.378 641 HD21 ASN 454 HD21 ASN 454 19.977 5.313 12.545 642 HD22 ASN 454 HD22 ASN 454 20.451 6.575 11.460 643 H SER 455 HN SER 455 17.925 8.385 17.768 644 HA SER 455 HA SER 455 16.715 6.013 18.667 645 HB2 SER 455 HB2 SER 455 16.009 8.746 19.710 646 HB3 SER 455 HB1 SER 455 16.149 7.227 20.597 647 HG SER 455 HG SER 455 18.408 7.293 20.190 648 H GLN 456 HN GLN 456 15.342 8.956 17.237 649 HA GLN 456 HA GLN 456 12.630 8.176 17.525 650 HB2 GLN 456 HB2 GLN 456 13.894 10.117 15.582 651 HB3 GLN 456 HB1 GLN 456 12.166 9.957 15.864 652 HG2 GLN 456 HG2 GLN 456 14.220 10.808 17.894 653 HG3 GLN 456 HG1 GLN 456 13.079 11.860 17.060 654 HE21 GLN 456 HE21 GLN 456 13.457 11.324 19.917 655 HE22 GLN 456 HE22 GLN 456 11.922 10.786 20.501 656 H LEU 457 HN LEU 457 15.034 7.731 15.008 657 HA LEU 457 HA LEU 457 13.263 6.665 13.066 658 HB2 LEU 457 HB2 LEU 457 16.239 6.248 13.374 659 HB3 LEU 457 HB1 LEU 457 15.300 5.854 11.946 660 HG LEU 457 HG LEU 457 15.747 8.630 13.052 661 HD11 LEU 457 HD11 LEU 457 17.088 8.979 11.060 662 HD12 LEU 457 HD12 LEU 457 16.818 7.308 10.568 663 HD13 LEU 457 HD13 LEU 457 17.743 7.659 12.028 664 HD21 LEU 457 HD21 LEU 457 13.573 8.461 11.998 665 HD22 LEU 457 HD22 LEU 457 14.293 7.706 10.578 666 HD23 LEU 457 HD23 LEU 457 14.671 9.382 10.974 667 H ASN 458 HN ASN 458 15.204 5.287 15.648 668 HA ASN 458 HA ASN 458 14.880 2.567 15.021 669 HB2 ASN 458 HB2 ASN 458 15.613 4.123 17.446 670 HB3 ASN 458 HB1 ASN 458 15.091 2.462 17.698 671 HD21 ASN 458 HD21 ASN 458 17.721 3.956 17.859 672 HD22 ASN 458 HD22 ASN 458 18.820 2.972 16.961 673 H ALA 459 HN ALA 459 12.975 4.744 17.064 674 HA ALA 459 HA ALA 459 11.097 2.856 17.959 675 HB1 ALA 459 HB1 ALA 459 11.393 5.074 18.978 676 HB2 ALA 459 HB2 ALA 459 9.711 4.761 18.556 677 HB3 ALA 459 HB3 ALA 459 10.693 5.819 17.542 678 H MET 460 HN MET 460 11.151 4.948 15.110 679 HA MET 460 HA MET 460 8.556 4.242 14.196 680 HB2 MET 460 HB2 MET 460 10.900 5.672 13.050 681 HB3 MET 460 HB1 MET 460 9.702 5.044 11.925 682 HG2 MET 460 HG2 MET 460 7.954 6.272 13.181 683 HG3 MET 460 HG1 MET 460 9.222 6.980 14.180 684 HE1 MET 460 HE1 MET 460 11.120 9.302 11.769 685 HE2 MET 460 HE2 MET 460 11.568 7.649 12.187 686 HE3 MET 460 HE3 MET 460 10.915 8.725 13.423 687 H ALA 461 HN ALA 461 11.803 3.015 13.516 688 HA ALA 461 HA ALA 461 11.077 1.210 11.475 689 HB1 ALA 461 HB1 ALA 461 13.364 1.048 13.441 690 HB2 ALA 461 HB2 ALA 461 13.396 1.852 11.872 691 HB3 ALA 461 HB3 ALA 461 13.214 0.100 11.961 692 H HIS 462 HN HIS 462 11.130 0.974 14.980 693 HA HIS 462 HA HIS 462 10.669 -1.795 15.211 694 HB2 HIS 462 HB2 HIS 462 11.132 0.275 16.962 695 HB3 HIS 462 HB1 HIS 462 9.456 -0.138 17.304 696 HD2 HIS 462 HD2 HIS 462 10.268 -3.470 16.674 697 HE1 HIS 462 HE1 HIS 462 12.258 -2.836 20.352 698 HE2 HIS 462 HE2 HIS 462 11.564 -4.568 18.638 699 H GLN 463 HN GLN 463 8.568 0.907 14.566 700 HA GLN 463 HA GLN 463 6.091 -0.280 15.198 701 HB2 GLN 463 HB2 GLN 463 6.798 1.824 13.141 702 HB3 GLN 463 HB1 GLN 463 5.150 1.376 13.559 703 HG2 GLN 463 HG2 GLN 463 7.191 2.582 15.410 704 HG3 GLN 463 HG1 GLN 463 5.816 3.411 14.685 705 HE21 GLN 463 HE21 GLN 463 3.690 2.713 15.297 706 HE22 GLN 463 HE22 GLN 463 3.430 2.021 16.861 707 H ILE 464 HN ILE 464 7.923 -0.069 12.179 708 HA ILE 464 HA ILE 464 6.118 -1.616 10.631 709 HB ILE 464 HB ILE 464 9.063 -1.157 10.127 710 HG12 ILE 464 HG12 ILE 464 6.701 0.464 9.151 711 HG13 ILE 464 HG11 ILE 464 7.761 0.947 10.473 712 HG21 ILE 464 HG21 ILE 464 8.506 -1.555 7.788 713 HG22 ILE 464 HG22 ILE 464 6.819 -1.828 8.223 714 HG23 ILE 464 HG23 ILE 464 8.063 -2.947 8.777 715 HD11 ILE 464 HD11 ILE 464 8.297 2.043 8.340 716 HD12 ILE 464 HD12 ILE 464 8.654 0.463 7.643 717 HD13 ILE 464 HD13 ILE 464 9.633 1.081 8.974 718 H GLN 465 HN GLN 465 8.964 -2.365 12.557 719 HA GLN 465 HA GLN 465 9.358 -5.016 11.727 720 HB2 GLN 465 HB2 GLN 465 10.854 -3.526 13.199 721 HB3 GLN 465 HB1 GLN 465 9.856 -4.070 14.541 722 HG2 GLN 465 HG2 GLN 465 11.798 -5.440 14.463 723 HG3 GLN 465 HG1 GLN 465 10.428 -6.412 13.932 724 HE21 GLN 465 HE21 GLN 465 11.624 -7.853 12.755 725 HE22 GLN 465 HE22 GLN 465 12.428 -7.428 11.281 726 H GLU 466 HN GLU 466 7.147 -3.610 14.054 727 HA GLU 466 HA GLU 466 6.300 -6.129 15.139 728 HB2 GLU 466 HB2 GLU 466 5.390 -3.286 15.403 729 HB3 GLU 466 HB1 GLU 466 4.355 -4.585 15.980 730 HG2 GLU 466 HG2 GLU 466 7.208 -4.191 16.837 731 HG3 GLU 466 HG1 GLU 466 5.810 -3.580 17.721 732 H MET 467 HN MET 467 5.466 -4.172 12.441 733 HA MET 467 HA MET 467 2.900 -5.437 11.996 734 HB2 MET 467 HB2 MET 467 4.523 -3.430 10.427 735 HB3 MET 467 HB1 MET 467 3.013 -4.106 9.831 736 HG2 MET 467 HG2 MET 467 3.039 -2.878 12.532 737 HG3 MET 467 HG1 MET 467 3.091 -1.815 11.127 738 HE1 MET 467 HE1 MET 467 -0.235 -2.531 9.308 739 HE2 MET 467 HE2 MET 467 1.370 -3.164 8.941 740 HE3 MET 467 HE3 MET 467 1.177 -1.481 9.434 741 H PHE 468 HN PHE 468 6.040 -5.307 10.354 742 HA PHE 468 HA PHE 468 5.342 -7.800 8.951 743 HB2 PHE 468 HB2 PHE 468 6.939 -5.403 8.151 744 HB3 PHE 468 HB1 PHE 468 7.407 -6.973 7.507 745 HD1 PHE 468 HD1 PHE 468 4.454 -4.740 7.873 746 HD2 PHE 468 HD2 PHE 468 6.383 -7.784 5.611 747 HE1 PHE 468 HE1 PHE 468 2.730 -4.529 6.133 748 HE2 PHE 468 HE2 PHE 468 4.661 -7.580 3.864 749 HZ PHE 468 HZ PHE 468 2.835 -5.948 4.124 750 HA PRO 469 HA PRO 469 8.704 -9.108 11.733 751 HB2 PRO 469 HB2 PRO 469 7.702 -11.512 12.342 752 HB3 PRO 469 HB1 PRO 469 7.021 -10.035 13.052 753 HG2 PRO 469 HG2 PRO 469 5.967 -11.722 10.844 754 HG3 PRO 469 HG1 PRO 469 5.102 -10.884 12.144 755 HD2 PRO 469 HD2 PRO 469 5.383 -9.949 9.542 756 HD3 PRO 469 HD1 PRO 469 4.936 -8.966 10.950 757 H GLN 470 HN GLN 470 8.430 -9.390 8.714 758 HA GLN 470 HA GLN 470 10.097 -11.798 8.441 759 HB2 GLN 470 HB2 GLN 470 9.131 -12.171 6.213 760 HB3 GLN 470 HB1 GLN 470 7.901 -12.241 7.467 761 HG2 GLN 470 HG2 GLN 470 7.389 -9.829 6.903 762 HG3 GLN 470 HG1 GLN 470 8.400 -10.051 5.476 763 HE21 GLN 470 HE21 GLN 470 6.749 -9.812 4.009 764 HE22 GLN 470 HE22 GLN 470 5.483 -10.970 3.817 765 H VAL 471 HN VAL 471 10.587 -8.811 8.736 766 HA VAL 471 HA VAL 471 12.393 -8.599 6.432 767 HB VAL 471 HB VAL 471 10.523 -7.082 6.031 768 HG11 VAL 471 HG11 VAL 471 10.078 -5.177 7.506 769 HG12 VAL 471 HG12 VAL 471 11.252 -5.806 8.662 770 HG13 VAL 471 HG13 VAL 471 9.784 -6.719 8.313 771 HG21 VAL 471 HG21 VAL 471 12.675 -6.376 5.215 772 HG22 VAL 471 HG22 VAL 471 13.072 -5.656 6.775 773 HG23 VAL 471 HG23 VAL 471 11.782 -4.967 5.788 774 HA PRO 472 HA PRO 472 15.509 -8.217 9.597 775 HB2 PRO 472 HB2 PRO 472 16.976 -6.753 7.465 776 HB3 PRO 472 HB1 PRO 472 17.472 -8.174 8.404 777 HG2 PRO 472 HG2 PRO 472 16.774 -8.411 5.865 778 HG3 PRO 472 HG1 PRO 472 16.323 -9.640 7.062 779 HD2 PRO 472 HD2 PRO 472 14.638 -7.511 5.826 780 HD3 PRO 472 HD1 PRO 472 14.220 -9.183 6.251 781 H TYR 473 HN TYR 473 15.818 -6.747 11.134 782 HA TYR 473 HA TYR 473 14.573 -4.262 11.188 783 HB2 TYR 473 HB2 TYR 473 15.479 -5.738 13.113 784 HB3 TYR 473 HB1 TYR 473 16.996 -4.886 12.860 785 HD1 TYR 473 HD1 TYR 473 17.157 -2.467 13.362 786 HD2 TYR 473 HD2 TYR 473 13.599 -4.666 14.144 787 HE1 TYR 473 HE1 TYR 473 16.363 -0.653 14.822 788 HE2 TYR 473 HE2 TYR 473 12.793 -2.861 15.603 789 HH TYR 473 HH TYR 473 13.932 0.156 15.608 790 H HIS 474 HN HIS 474 17.927 -5.085 10.378 791 HA HIS 474 HA HIS 474 18.842 -2.407 10.294 792 HB2 HIS 474 HB2 HIS 474 20.866 -3.241 9.427 793 HB3 HIS 474 HB1 HIS 474 20.269 -4.506 10.485 794 HD2 HIS 474 HD2 HIS 474 21.500 -4.020 6.951 795 HE1 HIS 474 HE1 HIS 474 19.639 -7.815 7.100 796 HE2 HIS 474 HE2 HIS 474 21.313 -6.366 5.870 797 H LEU 475 HN LEU 475 17.095 -4.358 8.026 798 HA LEU 475 HA LEU 475 17.716 -2.694 5.761 799 HB2 LEU 475 HB2 LEU 475 15.753 -4.929 6.212 800 HB3 LEU 475 HB1 LEU 475 15.710 -3.962 4.752 801 HG LEU 475 HG LEU 475 17.904 -5.805 5.681 802 HD11 LEU 475 HD11 LEU 475 16.058 -6.835 4.474 803 HD12 LEU 475 HD12 LEU 475 17.534 -6.857 3.509 804 HD13 LEU 475 HD13 LEU 475 16.266 -5.684 3.155 805 HD21 LEU 475 HD21 LEU 475 19.091 -3.910 4.913 806 HD22 LEU 475 HD22 LEU 475 17.986 -3.676 3.559 807 HD23 LEU 475 HD23 LEU 475 19.080 -5.059 3.572 808 H VAL 476 HN VAL 476 15.215 -2.930 8.192 809 HA VAL 476 HA VAL 476 13.380 -1.127 7.001 810 HB VAL 476 HB VAL 476 13.749 -1.641 9.958 811 HG11 VAL 476 HG11 VAL 476 11.356 -1.095 10.081 812 HG12 VAL 476 HG12 VAL 476 11.364 -0.729 8.355 813 HG13 VAL 476 HG13 VAL 476 12.317 0.252 9.468 814 HG21 VAL 476 HG21 VAL 476 12.100 -3.169 7.953 815 HG22 VAL 476 HG22 VAL 476 12.046 -3.388 9.702 816 HG23 VAL 476 HG23 VAL 476 13.523 -3.759 8.814 817 H LEU 477 HN LEU 477 15.991 -0.755 9.360 818 HA LEU 477 HA LEU 477 15.697 2.006 9.815 819 HB2 LEU 477 HB2 LEU 477 17.938 0.057 10.140 820 HB3 LEU 477 HB1 LEU 477 18.275 1.770 10.291 821 HG LEU 477 HG LEU 477 16.277 0.251 11.966 822 HD11 LEU 477 HD11 LEU 477 17.933 0.592 13.770 823 HD12 LEU 477 HD12 LEU 477 19.070 1.212 12.574 824 HD13 LEU 477 HD13 LEU 477 18.523 -0.461 12.486 825 HD21 LEU 477 HD21 LEU 477 15.617 2.541 11.775 826 HD22 LEU 477 HD22 LEU 477 17.266 3.095 12.055 827 HD23 LEU 477 HD23 LEU 477 16.361 2.325 13.359 828 H GLN 478 HN GLN 478 17.266 0.198 7.287 829 HA GLN 478 HA GLN 478 18.876 2.208 6.192 830 HB2 GLN 478 HB2 GLN 478 19.134 -0.108 5.544 831 HB3 GLN 478 HB1 GLN 478 17.507 -0.141 4.875 832 HG2 GLN 478 HG2 GLN 478 18.258 1.610 3.239 833 HG3 GLN 478 HG1 GLN 478 19.899 1.351 3.829 834 HE21 GLN 478 HE21 GLN 478 17.484 -1.163 3.490 835 HE22 GLN 478 HE22 GLN 478 18.273 -2.008 2.206 836 H ASP 479 HN ASP 479 15.536 1.263 5.388 837 HA ASP 479 HA ASP 479 15.258 3.341 3.431 838 HB2 ASP 479 HB2 ASP 479 13.966 1.168 3.431 839 HB3 ASP 479 HB1 ASP 479 13.024 1.814 4.772 840 H LEU 480 HN LEU 480 14.471 2.953 6.825 841 HA LEU 480 HA LEU 480 12.782 5.139 7.187 842 HB2 LEU 480 HB2 LEU 480 14.208 3.306 8.839 843 HB3 LEU 480 HB1 LEU 480 14.503 4.920 9.453 844 HG LEU 480 HG LEU 480 12.615 3.899 10.599 845 HD11 LEU 480 HD11 LEU 480 11.774 6.115 8.734 846 HD12 LEU 480 HD12 LEU 480 12.561 6.306 10.299 847 HD13 LEU 480 HD13 LEU 480 10.930 5.644 10.208 848 HD21 LEU 480 HD21 LEU 480 11.924 2.375 8.802 849 HD22 LEU 480 HD22 LEU 480 11.305 3.750 7.886 850 HD23 LEU 480 HD23 LEU 480 10.570 3.315 9.428 851 H GLN 481 HN GLN 481 16.260 4.966 6.892 852 HA GLN 481 HA GLN 481 16.615 7.752 7.615 853 HB2 GLN 481 HB2 GLN 481 18.557 5.633 6.683 854 HB3 GLN 481 HB1 GLN 481 19.022 7.278 7.101 855 HG2 GLN 481 HG2 GLN 481 18.394 6.975 9.365 856 HG3 GLN 481 HG1 GLN 481 17.596 5.444 9.008 857 HE21 GLN 481 HE21 GLN 481 18.857 3.611 8.643 858 HE22 GLN 481 HE22 GLN 481 20.516 3.531 9.137 859 H LEU 482 HN LEU 482 15.392 6.380 4.975 860 HA LEU 482 HA LEU 482 16.696 8.278 3.133 861 HB2 LEU 482 HB2 LEU 482 16.532 5.548 2.867 862 HB3 LEU 482 HB1 LEU 482 15.160 6.090 1.923 863 HG LEU 482 HG LEU 482 17.185 5.757 0.554 864 HD11 LEU 482 HD11 LEU 482 17.132 7.916 -0.605 865 HD12 LEU 482 HD12 LEU 482 16.249 8.609 0.754 866 HD13 LEU 482 HD13 LEU 482 15.519 7.324 -0.209 867 HD21 LEU 482 HD21 LEU 482 18.799 6.415 2.335 868 HD22 LEU 482 HD22 LEU 482 18.344 8.097 2.059 869 HD23 LEU 482 HD23 LEU 482 19.103 7.165 0.770 870 H THR 483 HN THR 483 13.587 6.629 3.760 871 HA THR 483 HA THR 483 12.167 8.675 2.265 872 HB THR 483 HB THR 483 10.142 7.326 2.917 873 HG1 THR 483 HG1 THR 483 11.484 5.083 3.595 874 HG21 THR 483 HG21 THR 483 10.672 5.450 1.428 875 HG22 THR 483 HG22 THR 483 12.389 5.831 1.555 876 HG23 THR 483 HG23 THR 483 11.286 6.970 0.781 877 H ARG 484 HN ARG 484 12.710 7.718 5.586 878 HA ARG 484 HA ARG 484 12.210 8.653 7.595 879 HB2 ARG 484 HB2 ARG 484 11.744 11.187 6.005 880 HB3 ARG 484 HB1 ARG 484 11.987 11.088 7.741 881 HG2 ARG 484 HG2 ARG 484 14.107 11.596 7.223 882 HG3 ARG 484 HG1 ARG 484 14.236 9.874 6.853 883 HD2 ARG 484 HD2 ARG 484 13.982 10.238 4.547 884 HD3 ARG 484 HD1 ARG 484 13.370 11.870 4.786 885 HE ARG 484 HE ARG 484 16.085 11.452 5.678 886 HH11 ARG 484 HH11 ARG 484 13.984 12.400 3.046 887 HH12 ARG 484 HH12 ARG 484 15.210 13.304 2.222 888 HH21 ARG 484 HH21 ARG 484 17.713 12.629 4.583 889 HH22 ARG 484 HH22 ARG 484 17.335 13.429 3.091 890 H SER 485 HN SER 485 10.123 7.417 5.992 891 HA SER 485 HA SER 485 7.833 8.393 7.478 892 HB2 SER 485 HB2 SER 485 7.645 9.777 5.519 893 HB3 SER 485 HB1 SER 485 7.954 8.410 4.454 894 HG SER 485 HG SER 485 5.755 8.279 6.197 895 H VAL 486 HN VAL 486 7.269 6.539 8.438 896 HA VAL 486 HA VAL 486 7.864 3.964 7.592 897 HB VAL 486 HB VAL 486 6.054 3.201 9.160 898 HG11 VAL 486 HG11 VAL 486 7.972 5.259 10.247 899 HG12 VAL 486 HG12 VAL 486 8.355 3.574 9.902 900 HG13 VAL 486 HG13 VAL 486 7.198 3.971 11.170 901 HG21 VAL 486 HG21 VAL 486 4.554 5.146 8.827 902 HG22 VAL 486 HG22 VAL 486 5.708 6.149 9.704 903 HG23 VAL 486 HG23 VAL 486 4.892 4.821 10.527 904 H GLU 487 HN GLU 487 5.152 6.004 6.774 905 HA GLU 487 HA GLU 487 3.427 4.048 5.720 906 HB2 GLU 487 HB2 GLU 487 3.694 6.892 4.734 907 HB3 GLU 487 HB1 GLU 487 2.271 5.864 4.651 908 HG2 GLU 487 HG2 GLU 487 1.650 7.053 6.449 909 HG3 GLU 487 HG1 GLU 487 2.656 5.885 7.303 910 H ILE 488 HN ILE 488 5.737 6.194 4.067 911 HA ILE 488 HA ILE 488 5.436 5.033 1.516 912 HB ILE 488 HB ILE 488 7.849 6.494 2.599 913 HG12 ILE 488 HG12 ILE 488 5.425 7.576 1.144 914 HG13 ILE 488 HG11 ILE 488 5.776 7.808 2.854 915 HG21 ILE 488 HG21 ILE 488 6.926 6.078 -0.241 916 HG22 ILE 488 HG22 ILE 488 8.305 5.294 0.529 917 HG23 ILE 488 HG23 ILE 488 8.317 7.037 0.266 918 HD11 ILE 488 HD11 ILE 488 7.458 8.809 0.568 919 HD12 ILE 488 HD12 ILE 488 7.779 9.063 2.284 920 HD13 ILE 488 HD13 ILE 488 6.346 9.774 1.540 921 H THR 489 HN THR 489 7.491 4.287 4.233 922 HA THR 489 HA THR 489 9.350 2.611 2.945 923 HB THR 489 HB THR 489 8.413 2.492 5.817 924 HG1 THR 489 HG1 THR 489 10.615 3.869 4.626 925 HG21 THR 489 HG21 THR 489 9.606 0.473 5.206 926 HG22 THR 489 HG22 THR 489 10.631 1.474 6.235 927 HG23 THR 489 HG23 THR 489 10.908 1.424 4.493 928 H THR 490 HN THR 490 6.615 1.678 5.021 929 HA THR 490 HA THR 490 6.737 -1.054 4.539 930 HB THR 490 HB THR 490 4.125 0.336 5.047 931 HG1 THR 490 HG1 THR 490 5.475 1.377 6.472 932 HG21 THR 490 HG21 THR 490 4.150 -2.115 4.875 933 HG22 THR 490 HG22 THR 490 3.754 -1.586 6.510 934 HG23 THR 490 HG23 THR 490 5.371 -2.190 6.144 935 H ASP 491 HN ASP 491 5.010 1.466 2.749 936 HA ASP 491 HA ASP 491 3.580 -0.297 1.050 937 HB2 ASP 491 HB2 ASP 491 3.001 2.099 1.357 938 HB3 ASP 491 HB1 ASP 491 4.463 2.541 0.482 939 H ASN 492 HN ASN 492 6.668 1.386 0.748 940 HA ASN 492 HA ASN 492 7.227 0.523 -1.882 941 HB2 ASN 492 HB2 ASN 492 8.647 1.935 0.253 942 HB3 ASN 492 HB1 ASN 492 9.697 0.978 -0.786 943 HD21 ASN 492 HD21 ASN 492 7.665 3.732 -0.546 944 HD22 ASN 492 HD22 ASN 492 8.018 4.394 -2.108 945 H ILE 493 HN ILE 493 7.666 -0.978 1.236 946 HA ILE 493 HA ILE 493 9.567 -2.933 0.507 947 HB ILE 493 HB ILE 493 7.373 -3.067 2.592 948 HG12 ILE 493 HG12 ILE 493 10.342 -2.544 2.857 949 HG13 ILE 493 HG11 ILE 493 9.081 -1.320 2.959 950 HG21 ILE 493 HG21 ILE 493 8.637 -4.940 3.573 951 HG22 ILE 493 HG22 ILE 493 9.719 -4.919 2.181 952 HG23 ILE 493 HG23 ILE 493 8.017 -5.323 1.966 953 HD11 ILE 493 HD11 ILE 493 9.540 -3.607 4.855 954 HD12 ILE 493 HD12 ILE 493 8.169 -2.502 4.934 955 HD13 ILE 493 HD13 ILE 493 9.808 -1.892 5.165 956 H LEU 494 HN LEU 494 6.053 -2.811 0.300 957 HA LEU 494 HA LEU 494 5.774 -5.489 -0.687 958 HB2 LEU 494 HB2 LEU 494 3.928 -3.140 -0.400 959 HB3 LEU 494 HB1 LEU 494 3.421 -4.588 -1.249 960 HG LEU 494 HG LEU 494 4.524 -4.909 1.499 961 HD11 LEU 494 HD11 LEU 494 2.206 -4.545 2.388 962 HD12 LEU 494 HD12 LEU 494 1.816 -3.768 0.853 963 HD13 LEU 494 HD13 LEU 494 3.058 -3.081 1.896 964 HD21 LEU 494 HD21 LEU 494 3.424 -6.591 -0.359 965 HD22 LEU 494 HD22 LEU 494 2.054 -6.248 0.705 966 HD23 LEU 494 HD23 LEU 494 3.547 -6.917 1.370 967 H GLU 495 HN GLU 495 6.586 -2.488 -2.070 968 HA GLU 495 HA GLU 495 5.632 -3.158 -4.719 969 HB2 GLU 495 HB2 GLU 495 7.197 -0.827 -3.627 970 HB3 GLU 495 HB1 GLU 495 6.885 -1.029 -5.346 971 HG2 GLU 495 HG2 GLU 495 4.862 -0.670 -3.155 972 HG3 GLU 495 HG1 GLU 495 5.257 0.458 -4.452 973 H GLY 496 HN GLY 496 8.757 -2.885 -3.061 974 HA2 GLY 496 HA2 GLY 496 10.201 -4.859 -3.890 975 HA3 GLY 496 HA1 GLY 496 10.030 -4.054 -5.440 976 H ARG 497 HN ARG 497 10.112 -1.631 -3.210 977 HA ARG 497 HA ARG 497 12.621 -0.659 -3.970 978 HB2 ARG 497 HB2 ARG 497 10.779 0.683 -2.926 979 HB3 ARG 497 HB1 ARG 497 11.177 -0.059 -1.385 980 HG2 ARG 497 HG2 ARG 497 12.258 1.982 -1.292 981 HG3 ARG 497 HG1 ARG 497 13.539 0.871 -1.779 982 HD2 ARG 497 HD2 ARG 497 13.671 2.868 -3.120 983 HD3 ARG 497 HD1 ARG 497 13.155 1.520 -4.131 984 HE ARG 497 HE ARG 497 10.873 2.836 -3.171 985 HH11 ARG 497 HH11 ARG 497 13.538 3.378 -5.368 986 HH12 ARG 497 HH12 ARG 497 12.663 4.499 -6.360 987 HH21 ARG 497 HH21 ARG 497 9.706 4.301 -4.472 988 HH22 ARG 497 HH22 ARG 497 10.479 5.029 -5.847 989 H ILE 498 HN ILE 498 11.638 -2.240 -0.953 990 HA ILE 498 HA ILE 498 14.439 -2.678 -0.259 991 HB ILE 498 HB ILE 498 11.883 -3.188 1.284 992 HG12 ILE 498 HG12 ILE 498 13.219 -1.578 2.887 993 HG13 ILE 498 HG11 ILE 498 14.060 -1.130 1.408 994 HG21 ILE 498 HG21 ILE 498 13.502 -4.959 1.771 995 HG22 ILE 498 HG22 ILE 498 13.272 -3.899 3.161 996 HG23 ILE 498 HG23 ILE 498 14.717 -3.741 2.162 997 HD11 ILE 498 HD11 ILE 498 11.076 -1.000 1.765 998 HD12 ILE 498 HD12 ILE 498 12.019 -0.390 0.406 999 HD13 ILE 498 HD13 ILE 498 12.176 0.358 1.994 1000 H GLN 499 HN GLN 499 15.362 -4.435 -1.088 1001 HA GLN 499 HA GLN 499 13.967 -6.522 -2.340 1002 HB2 GLN 499 HB2 GLN 499 16.802 -6.418 -1.304 1003 HB3 GLN 499 HB1 GLN 499 16.167 -7.717 -2.303 1004 HG2 GLN 499 HG2 GLN 499 16.368 -4.818 -3.099 1005 HG3 GLN 499 HG1 GLN 499 17.441 -6.114 -3.623 1006 HE21 GLN 499 HE21 GLN 499 14.302 -4.670 -3.961 1007 HE22 GLN 499 HE22 GLN 499 13.818 -5.563 -5.357 1008 H VAL 500 HN VAL 500 12.653 -7.847 -1.363 1009 HA VAL 500 HA VAL 500 12.601 -8.455 1.367 1010 HB VAL 500 HB VAL 500 11.007 -10.237 0.780 1011 HG11 VAL 500 HG11 VAL 500 10.255 -7.905 0.910 1012 HG12 VAL 500 HG12 VAL 500 9.321 -8.832 -0.265 1013 HG13 VAL 500 HG13 VAL 500 10.570 -7.715 -0.815 1014 HG21 VAL 500 HG21 VAL 500 11.749 -9.595 -2.076 1015 HG22 VAL 500 HG22 VAL 500 10.420 -10.640 -1.576 1016 HG23 VAL 500 HG23 VAL 500 12.086 -11.101 -1.223 1017 HA PRO 501 HA PRO 501 15.572 -11.621 2.116 1018 HB2 PRO 501 HB2 PRO 501 13.385 -13.269 3.283 1019 HB3 PRO 501 HB1 PRO 501 14.907 -12.728 4.017 1020 HG2 PRO 501 HG2 PRO 501 12.609 -11.624 4.712 1021 HG3 PRO 501 HG1 PRO 501 14.082 -10.647 4.542 1022 HD2 PRO 501 HD2 PRO 501 11.753 -10.887 2.691 1023 HD3 PRO 501 HD1 PRO 501 12.726 -9.460 3.107 1024 H PHE 502 HN PHE 502 16.137 -12.443 0.179 1025 HA PHE 502 HA PHE 502 14.461 -14.518 -1.033 1026 HB2 PHE 502 HB2 PHE 502 15.155 -12.665 -2.504 1027 HB3 PHE 502 HB1 PHE 502 16.841 -13.010 -2.150 1028 HD1 PHE 502 HD1 PHE 502 13.793 -14.409 -3.721 1029 HD2 PHE 502 HD2 PHE 502 18.028 -14.591 -3.387 1030 HE1 PHE 502 HE1 PHE 502 13.871 -15.966 -5.619 1031 HE2 PHE 502 HE2 PHE 502 18.115 -16.154 -5.289 1032 HZ PHE 502 HZ PHE 502 16.033 -16.845 -6.405 1033 HA PRO 503 HA PRO 503 17.257 -17.523 0.700 1034 HB2 PRO 503 HB2 PRO 503 16.416 -19.656 -0.812 1035 HB3 PRO 503 HB1 PRO 503 15.552 -19.060 0.619 1036 HG2 PRO 503 HG2 PRO 503 14.981 -18.585 -2.259 1037 HG3 PRO 503 HG1 PRO 503 13.861 -18.861 -0.913 1038 HD2 PRO 503 HD2 PRO 503 14.331 -16.398 -1.929 1039 HD3 PRO 503 HD1 PRO 503 13.933 -16.675 -0.220 1040 H THR 504 HN THR 504 19.193 -16.690 -0.111 1041 HA THR 504 HA THR 504 20.141 -18.024 -2.549 1042 HB THR 504 HB THR 504 19.776 -15.675 -3.121 1043 HG1 THR 504 HG1 THR 504 22.389 -16.695 -2.938 1044 HG21 THR 504 HG21 THR 504 19.935 -14.694 -0.894 1045 HG22 THR 504 HG22 THR 504 21.036 -13.887 -2.011 1046 HG23 THR 504 HG23 THR 504 21.660 -15.055 -0.845 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 -18.490 -11.565 14.721 2 H2 MET 1 HT2 MET 1 -18.123 -12.931 13.789 3 H3 MET 1 HT3 MET 1 -17.584 -11.399 13.304 4 HA MET 1 HA MET 1 -16.785 -12.564 15.882 5 HB2 MET 1 HB2 MET 1 -14.783 -13.446 14.894 6 HB3 MET 1 HB1 MET 1 -16.158 -14.101 14.019 7 HG2 MET 1 HG2 MET 1 -15.784 -12.418 12.251 8 HG3 MET 1 HG1 MET 1 -14.349 -11.874 13.118 9 HE1 MET 1 HE1 MET 1 -12.857 -12.201 11.032 10 HE2 MET 1 HE2 MET 1 -14.197 -12.794 10.051 11 HE3 MET 1 HE3 MET 1 -12.693 -13.709 10.133 12 H GLN 2 HN GLN 2 -14.877 -11.518 16.714 13 HA GLN 2 HA GLN 2 -14.716 -8.727 15.820 14 HB2 GLN 2 HB2 GLN 2 -13.942 -9.993 18.455 15 HB3 GLN 2 HB1 GLN 2 -13.765 -8.286 18.070 16 HG2 GLN 2 HG2 GLN 2 -16.403 -9.715 17.996 17 HG3 GLN 2 HG1 GLN 2 -15.781 -8.912 19.435 18 HE21 GLN 2 HE21 GLN 2 -18.157 -8.375 17.807 19 HE22 GLN 2 HE22 GLN 2 -18.025 -6.721 17.321 20 H ILE 3 HN ILE 3 -12.902 -7.905 14.996 21 HA ILE 3 HA ILE 3 -10.392 -9.423 15.308 22 HB ILE 3 HB ILE 3 -9.719 -8.816 13.039 23 HG12 ILE 3 HG12 ILE 3 -12.524 -7.888 12.481 24 HG13 ILE 3 HG11 ILE 3 -11.294 -6.761 13.043 25 HG21 ILE 3 HG21 ILE 3 -11.228 -10.295 11.791 26 HG22 ILE 3 HG22 ILE 3 -12.376 -10.233 13.128 27 HG23 ILE 3 HG23 ILE 3 -10.789 -10.965 13.363 28 HD11 ILE 3 HD11 ILE 3 -11.071 -8.457 10.567 29 HD12 ILE 3 HD12 ILE 3 -9.936 -7.219 11.106 30 HD13 ILE 3 HD13 ILE 3 -11.562 -6.763 10.601 31 H PHE 4 HN PHE 4 -8.450 -8.011 14.784 32 HA PHE 4 HA PHE 4 -8.960 -5.251 15.677 33 HB2 PHE 4 HB2 PHE 4 -6.748 -7.127 16.526 34 HB3 PHE 4 HB1 PHE 4 -6.710 -5.392 16.827 35 HD1 PHE 4 HD2 PHE 4 -8.304 -8.569 17.708 36 HD2 PHE 4 HD1 PHE 4 -8.157 -4.382 18.467 37 HE1 PHE 4 HE2 PHE 4 -9.601 -8.900 19.772 38 HE2 PHE 4 HE1 PHE 4 -9.449 -4.711 20.531 39 HZ PHE 4 HZ PHE 4 -10.174 -6.969 21.187 40 H VAL 5 HN VAL 5 -8.278 -3.756 14.339 41 HA VAL 5 HA VAL 5 -6.413 -4.490 12.200 42 HB VAL 5 HB VAL 5 -8.052 -1.957 12.414 43 HG11 VAL 5 HG11 VAL 5 -7.657 -1.796 10.013 44 HG12 VAL 5 HG12 VAL 5 -6.702 -3.278 10.064 45 HG13 VAL 5 HG13 VAL 5 -6.137 -1.835 10.906 46 HG21 VAL 5 HG21 VAL 5 -9.582 -3.827 12.403 47 HG22 VAL 5 HG22 VAL 5 -8.739 -4.549 11.032 48 HG23 VAL 5 HG23 VAL 5 -9.614 -3.030 10.830 49 H LYS 6 HN LYS 6 -4.388 -3.812 12.242 50 HA LYS 6 HA LYS 6 -3.637 -1.759 14.208 51 HB2 LYS 6 HB2 LYS 6 -2.457 -4.276 13.397 52 HB3 LYS 6 HB1 LYS 6 -1.310 -2.956 13.210 53 HG2 LYS 6 HG2 LYS 6 -2.856 -3.314 15.752 54 HG3 LYS 6 HG1 LYS 6 -1.372 -4.218 15.442 55 HD2 LYS 6 HD2 LYS 6 -0.154 -2.123 15.130 56 HD3 LYS 6 HD1 LYS 6 -1.637 -1.210 15.417 57 HE2 LYS 6 HE2 LYS 6 -0.180 -1.314 17.408 58 HE3 LYS 6 HE1 LYS 6 -1.763 -2.045 17.680 59 HZ1 LYS 6 HZ1 LYS 6 0.166 -3.332 18.558 60 HZ2 LYS 6 HZ2 LYS 6 0.655 -3.614 16.965 61 HZ3 LYS 6 HZ3 LYS 6 -0.832 -4.204 17.513 62 H THR 7 HN THR 7 -3.052 0.167 13.493 63 HA THR 7 HA THR 7 -2.460 0.469 10.634 64 HB THR 7 HB THR 7 -2.859 2.896 11.011 65 HG1 THR 7 HG1 THR 7 -3.742 2.100 13.609 66 HG21 THR 7 HG21 THR 7 -5.115 1.137 11.979 67 HG22 THR 7 HG22 THR 7 -4.693 1.413 10.289 68 HG23 THR 7 HG23 THR 7 -5.274 2.749 11.284 69 H LEU 8 HN LEU 8 -0.709 1.935 10.022 70 HA LEU 8 HA LEU 8 1.688 1.381 11.422 71 HB2 LEU 8 HB2 LEU 8 1.013 3.219 9.144 72 HB3 LEU 8 HB1 LEU 8 2.633 3.136 9.811 73 HG LEU 8 HG LEU 8 1.192 0.711 8.756 74 HD11 LEU 8 HD11 LEU 8 2.323 0.981 6.677 75 HD12 LEU 8 HD12 LEU 8 3.186 2.399 7.268 76 HD13 LEU 8 HD13 LEU 8 1.442 2.472 7.007 77 HD21 LEU 8 HD21 LEU 8 3.490 -0.176 8.588 78 HD22 LEU 8 HD22 LEU 8 3.039 0.232 10.243 79 HD23 LEU 8 HD23 LEU 8 4.092 1.307 9.328 80 H THR 9 HN THR 9 -0.696 3.542 12.125 81 HA THR 9 HA THR 9 1.028 5.608 13.217 82 HB THR 9 HB THR 9 -1.618 6.072 14.029 83 HG1 THR 9 HG1 THR 9 -2.692 4.859 12.634 84 HG21 THR 9 HG21 THR 9 -0.012 7.759 13.271 85 HG22 THR 9 HG22 THR 9 -1.528 7.886 12.381 86 HG23 THR 9 HG23 THR 9 -0.122 7.134 11.626 87 H GLY 10 HN GLY 10 0.108 2.616 14.163 88 HA2 GLY 10 HA2 GLY 10 0.471 1.593 16.223 89 HA3 GLY 10 HA1 GLY 10 0.647 3.180 16.957 90 H LYS 11 HN LYS 11 -2.089 3.251 15.148 91 HA LYS 11 HA LYS 11 -3.772 3.063 17.505 92 HB2 LYS 11 HB2 LYS 11 -4.029 4.977 16.025 93 HB3 LYS 11 HB1 LYS 11 -4.353 3.919 14.662 94 HG2 LYS 11 HG2 LYS 11 -6.385 3.114 15.913 95 HG3 LYS 11 HG1 LYS 11 -6.089 4.427 17.057 96 HD2 LYS 11 HD2 LYS 11 -6.133 6.006 15.118 97 HD3 LYS 11 HD1 LYS 11 -6.660 4.661 14.107 98 HE2 LYS 11 HE2 LYS 11 -8.669 4.412 15.383 99 HE3 LYS 11 HE1 LYS 11 -8.107 5.573 16.583 100 HZ1 LYS 11 HZ1 LYS 11 -8.876 6.128 13.768 101 HZ2 LYS 11 HZ2 LYS 11 -8.098 7.253 14.770 102 HZ3 LYS 11 HZ3 LYS 11 -9.635 6.686 15.181 103 H THR 12 HN THR 12 -5.059 1.404 17.968 104 HA THR 12 HA THR 12 -5.373 -0.732 15.974 105 HB THR 12 HB THR 12 -5.938 -1.017 18.922 106 HG1 THR 12 HG1 THR 12 -3.784 -1.711 19.160 107 HG21 THR 12 HG21 THR 12 -6.747 -2.772 17.400 108 HG22 THR 12 HG22 THR 12 -5.489 -3.374 18.478 109 HG23 THR 12 HG23 THR 12 -5.106 -2.995 16.797 110 H ILE 13 HN ILE 13 -7.357 -1.205 15.210 111 HA ILE 13 HA ILE 13 -9.677 0.050 16.539 112 HB ILE 13 HB ILE 13 -9.452 -0.455 13.569 113 HG12 ILE 13 HG12 ILE 13 -9.159 2.205 14.973 114 HG13 ILE 13 HG11 ILE 13 -7.787 1.242 14.431 115 HG21 ILE 13 HG21 ILE 13 -11.383 1.217 15.175 116 HG22 ILE 13 HG22 ILE 13 -11.726 -0.365 14.475 117 HG23 ILE 13 HG23 ILE 13 -11.392 1.012 13.423 118 HD11 ILE 13 HD11 ILE 13 -8.610 1.412 12.129 119 HD12 ILE 13 HD12 ILE 13 -8.291 2.989 12.847 120 HD13 ILE 13 HD13 ILE 13 -9.950 2.411 12.693 121 H THR 14 HN THR 14 -11.220 -1.349 17.171 122 HA THR 14 HA THR 14 -11.034 -4.133 16.379 123 HB THR 14 HB THR 14 -13.144 -2.925 18.168 124 HG1 THR 14 HG1 THR 14 -11.591 -3.623 19.874 125 HG21 THR 14 HG21 THR 14 -13.353 -5.287 17.320 126 HG22 THR 14 HG22 THR 14 -13.311 -5.129 19.073 127 HG23 THR 14 HG23 THR 14 -11.874 -5.660 18.204 128 H LEU 15 HN LEU 15 -12.073 -4.864 14.618 129 HA LEU 15 HA LEU 15 -14.457 -3.384 13.740 130 HB2 LEU 15 HB2 LEU 15 -12.128 -4.332 12.335 131 HB3 LEU 15 HB1 LEU 15 -13.586 -5.001 11.631 132 HG LEU 15 HG LEU 15 -13.059 -2.059 12.052 133 HD11 LEU 15 HD11 LEU 15 -12.828 -1.959 9.628 134 HD12 LEU 15 HD12 LEU 15 -13.019 -3.709 9.530 135 HD13 LEU 15 HD13 LEU 15 -11.611 -3.018 10.336 136 HD21 LEU 15 HD21 LEU 15 -15.435 -2.639 12.154 137 HD22 LEU 15 HD22 LEU 15 -15.297 -3.472 10.606 138 HD23 LEU 15 HD23 LEU 15 -15.053 -1.728 10.693 139 H GLU 16 HN GLU 16 -16.301 -4.408 13.248 140 HA GLU 16 HA GLU 16 -16.550 -7.174 14.136 141 HB2 GLU 16 HB2 GLU 16 -18.102 -5.399 14.993 142 HB3 GLU 16 HB1 GLU 16 -18.711 -5.202 13.356 143 HG2 GLU 16 HG2 GLU 16 -18.773 -7.929 14.508 144 HG3 GLU 16 HG1 GLU 16 -19.901 -6.742 15.160 145 H VAL 17 HN VAL 17 -16.214 -8.651 12.613 146 HA VAL 17 HA VAL 17 -17.484 -8.288 9.996 147 HB VAL 17 HB VAL 17 -15.446 -9.348 8.933 148 HG11 VAL 17 HG11 VAL 17 -14.186 -7.220 8.799 149 HG12 VAL 17 HG12 VAL 17 -15.174 -6.586 10.114 150 HG13 VAL 17 HG13 VAL 17 -15.923 -7.010 8.574 151 HG21 VAL 17 HG21 VAL 17 -14.354 -10.189 10.913 152 HG22 VAL 17 HG22 VAL 17 -14.198 -8.556 11.559 153 HG23 VAL 17 HG23 VAL 17 -13.300 -9.023 10.115 154 H GLU 18 HN GLU 18 -17.036 -10.480 8.733 155 HA GLU 18 HA GLU 18 -17.223 -12.773 10.518 156 HB2 GLU 18 HB2 GLU 18 -19.423 -11.722 8.786 157 HB3 GLU 18 HB1 GLU 18 -19.235 -13.466 8.920 158 HG2 GLU 18 HG2 GLU 18 -19.424 -11.696 11.338 159 HG3 GLU 18 HG1 GLU 18 -20.847 -12.350 10.527 160 HA PRO 19 HA PRO 19 -14.832 -14.938 7.508 161 HB2 PRO 19 HB2 PRO 19 -16.968 -17.020 7.419 162 HB3 PRO 19 HB1 PRO 19 -15.232 -17.196 7.734 163 HG2 PRO 19 HG2 PRO 19 -16.981 -17.375 9.705 164 HG3 PRO 19 HG1 PRO 19 -15.417 -16.563 9.933 165 HD2 PRO 19 HD2 PRO 19 -18.129 -15.375 9.615 166 HD3 PRO 19 HD1 PRO 19 -16.760 -14.821 10.597 167 H SER 20 HN SER 20 -18.200 -14.362 6.827 168 HA SER 20 HA SER 20 -18.000 -15.016 4.024 169 HB2 SER 20 HB2 SER 20 -20.366 -13.597 4.484 170 HB3 SER 20 HB1 SER 20 -20.180 -15.350 4.433 171 HG SER 20 HG SER 20 -21.090 -14.233 6.428 172 H ASP 21 HN ASP 21 -17.017 -12.399 5.822 173 HA ASP 21 HA ASP 21 -17.843 -10.333 3.970 174 HB2 ASP 21 HB2 ASP 21 -16.995 -10.364 6.646 175 HB3 ASP 21 HB1 ASP 21 -15.722 -9.525 5.767 176 H THR 22 HN THR 22 -16.535 -9.243 2.535 177 HA THR 22 HA THR 22 -14.186 -10.710 1.650 178 HB THR 22 HB THR 22 -14.336 -8.857 -0.206 179 HG1 THR 22 HG1 THR 22 -16.875 -8.576 -0.270 180 HG21 THR 22 HG21 THR 22 -16.348 -11.092 0.079 181 HG22 THR 22 HG22 THR 22 -14.742 -11.206 -0.641 182 HG23 THR 22 HG23 THR 22 -15.994 -10.241 -1.424 183 H ILE 23 HN ILE 23 -12.214 -9.542 1.071 184 HA ILE 23 HA ILE 23 -11.241 -7.932 3.162 185 HB ILE 23 HB ILE 23 -10.150 -8.223 0.356 186 HG12 ILE 23 HG12 ILE 23 -10.341 -10.388 1.416 187 HG13 ILE 23 HG11 ILE 23 -8.647 -9.918 1.385 188 HG21 ILE 23 HG21 ILE 23 -8.019 -7.522 1.267 189 HG22 ILE 23 HG22 ILE 23 -8.736 -7.340 2.868 190 HG23 ILE 23 HG23 ILE 23 -9.238 -6.280 1.551 191 HD11 ILE 23 HD11 ILE 23 -8.852 -9.216 3.747 192 HD12 ILE 23 HD12 ILE 23 -9.157 -10.933 3.494 193 HD13 ILE 23 HD13 ILE 23 -10.507 -9.827 3.749 194 H GLU 24 HN GLU 24 -12.601 -7.171 0.024 195 HA GLU 24 HA GLU 24 -12.032 -4.417 -0.040 196 HB2 GLU 24 HB2 GLU 24 -12.784 -5.736 -1.988 197 HB3 GLU 24 HB1 GLU 24 -14.363 -5.923 -1.243 198 HG2 GLU 24 HG2 GLU 24 -14.491 -3.377 -1.269 199 HG3 GLU 24 HG1 GLU 24 -13.107 -3.445 -2.363 200 H ASN 25 HN ASN 25 -14.741 -6.272 1.248 201 HA ASN 25 HA ASN 25 -16.404 -4.133 1.977 202 HB2 ASN 25 HB2 ASN 25 -16.213 -7.008 2.590 203 HB3 ASN 25 HB1 ASN 25 -16.999 -6.040 3.831 204 HD21 ASN 25 HD21 ASN 25 -18.786 -7.475 3.175 205 HD22 ASN 25 HD22 ASN 25 -19.803 -6.948 1.870 206 H VAL 26 HN VAL 26 -13.759 -5.753 3.639 207 HA VAL 26 HA VAL 26 -14.088 -4.551 6.160 208 HB VAL 26 HB VAL 26 -11.502 -5.452 4.873 209 HG11 VAL 26 HG11 VAL 26 -11.172 -4.017 6.838 210 HG12 VAL 26 HG12 VAL 26 -10.651 -5.676 7.137 211 HG13 VAL 26 HG13 VAL 26 -12.186 -5.102 7.789 212 HG21 VAL 26 HG21 VAL 26 -13.160 -7.246 4.905 213 HG22 VAL 26 HG22 VAL 26 -13.416 -6.984 6.630 214 HG23 VAL 26 HG23 VAL 26 -11.858 -7.567 6.050 215 H LYS 27 HN LYS 27 -12.265 -3.589 3.285 216 HA LYS 27 HA LYS 27 -10.998 -1.321 4.321 217 HB2 LYS 27 HB2 LYS 27 -11.923 -2.007 1.539 218 HB3 LYS 27 HB1 LYS 27 -11.035 -0.536 1.898 219 HG2 LYS 27 HG2 LYS 27 -9.156 -1.865 2.711 220 HG3 LYS 27 HG1 LYS 27 -10.056 -3.343 2.355 221 HD2 LYS 27 HD2 LYS 27 -10.057 -2.884 0.028 222 HD3 LYS 27 HD1 LYS 27 -9.439 -1.253 0.286 223 HE2 LYS 27 HE2 LYS 27 -7.349 -2.230 1.174 224 HE3 LYS 27 HE1 LYS 27 -7.978 -3.835 0.803 225 HZ1 LYS 27 HZ1 LYS 27 -7.616 -1.703 -1.229 226 HZ2 LYS 27 HZ2 LYS 27 -8.007 -3.329 -1.508 227 HZ3 LYS 27 HZ3 LYS 27 -6.476 -2.913 -0.914 228 H ALA 28 HN ALA 28 -14.194 -1.745 2.883 229 HA ALA 28 HA ALA 28 -14.926 0.974 2.782 230 HB1 ALA 28 HB1 ALA 28 -16.112 -0.838 1.585 231 HB2 ALA 28 HB2 ALA 28 -17.196 0.199 2.511 232 HB3 ALA 28 HB3 ALA 28 -16.763 -1.396 3.127 233 H LYS 29 HN LYS 29 -15.223 -1.475 5.302 234 HA LYS 29 HA LYS 29 -16.742 0.117 7.093 235 HB2 LYS 29 HB2 LYS 29 -14.974 -2.291 7.544 236 HB3 LYS 29 HB1 LYS 29 -15.925 -1.543 8.816 237 HG2 LYS 29 HG2 LYS 29 -17.975 -2.036 7.625 238 HG3 LYS 29 HG1 LYS 29 -17.053 -2.723 6.286 239 HD2 LYS 29 HD2 LYS 29 -16.244 -4.503 7.684 240 HD3 LYS 29 HD1 LYS 29 -16.962 -3.761 9.117 241 HE2 LYS 29 HE2 LYS 29 -19.194 -4.082 8.157 242 HE3 LYS 29 HE1 LYS 29 -18.472 -4.819 6.728 243 HZ1 LYS 29 HZ1 LYS 29 -17.914 -6.718 7.862 244 HZ2 LYS 29 HZ2 LYS 29 -19.364 -6.300 8.635 245 HZ3 LYS 29 HZ3 LYS 29 -17.887 -5.947 9.377 246 H ILE 30 HN ILE 30 -13.320 -0.294 6.471 247 HA ILE 30 HA ILE 30 -12.386 1.141 8.743 248 HB ILE 30 HB ILE 30 -11.059 0.584 6.081 249 HG12 ILE 30 HG12 ILE 30 -10.644 -0.674 8.801 250 HG13 ILE 30 HG11 ILE 30 -11.579 -1.390 7.492 251 HG21 ILE 30 HG21 ILE 30 -9.839 1.699 8.608 252 HG22 ILE 30 HG22 ILE 30 -10.077 2.572 7.094 253 HG23 ILE 30 HG23 ILE 30 -8.952 1.216 7.161 254 HD11 ILE 30 HD11 ILE 30 -9.586 -1.526 6.117 255 HD12 ILE 30 HD12 ILE 30 -9.339 -2.348 7.658 256 HD13 ILE 30 HD13 ILE 30 -8.641 -0.751 7.388 257 H GLN 31 HN GLN 31 -13.093 2.013 5.383 258 HA GLN 31 HA GLN 31 -12.230 4.690 5.512 259 HB2 GLN 31 HB2 GLN 31 -12.646 3.567 3.386 260 HB3 GLN 31 HB1 GLN 31 -14.357 3.427 3.771 261 HG2 GLN 31 HG2 GLN 31 -14.525 5.887 3.778 262 HG3 GLN 31 HG1 GLN 31 -12.831 5.983 3.304 263 HE21 GLN 31 HE21 GLN 31 -13.377 7.069 1.416 264 HE22 GLN 31 HE22 GLN 31 -14.088 6.255 0.065 265 H ASP 32 HN ASP 32 -15.250 3.142 6.360 266 HA ASP 32 HA ASP 32 -16.901 5.382 6.615 267 HB2 ASP 32 HB2 ASP 32 -18.022 3.344 6.720 268 HB3 ASP 32 HB1 ASP 32 -16.868 2.650 7.853 269 H LYS 33 HN LYS 33 -14.419 4.144 8.720 270 HA LYS 33 HA LYS 33 -15.197 6.030 10.822 271 HB2 LYS 33 HB2 LYS 33 -13.070 3.905 11.011 272 HB3 LYS 33 HB1 LYS 33 -13.885 4.745 12.324 273 HG2 LYS 33 HG2 LYS 33 -15.980 3.638 11.732 274 HG3 LYS 33 HG1 LYS 33 -15.159 2.797 10.416 275 HD2 LYS 33 HD2 LYS 33 -13.584 1.892 12.208 276 HD3 LYS 33 HD1 LYS 33 -14.773 2.469 13.381 277 HE2 LYS 33 HE2 LYS 33 -15.301 0.527 11.132 278 HE3 LYS 33 HE1 LYS 33 -15.107 0.099 12.829 279 HZ1 LYS 33 HZ1 LYS 33 -17.259 1.821 11.713 280 HZ2 LYS 33 HZ2 LYS 33 -17.076 1.405 13.339 281 HZ3 LYS 33 HZ3 LYS 33 -17.433 0.212 12.198 282 H GLU 34 HN GLU 34 -12.259 4.984 9.084 283 HA GLU 34 HA GLU 34 -10.714 7.172 10.112 284 HB2 GLU 34 HB2 GLU 34 -10.201 5.022 8.079 285 HB3 GLU 34 HB1 GLU 34 -9.054 6.330 8.329 286 HG2 GLU 34 HG2 GLU 34 -9.979 4.329 10.372 287 HG3 GLU 34 HG1 GLU 34 -8.386 4.423 9.621 288 H GLY 35 HN GLY 35 -12.300 6.481 7.031 289 HA2 GLY 35 HA2 GLY 35 -13.120 8.119 5.558 290 HA3 GLY 35 HA1 GLY 35 -12.138 9.321 6.383 291 H ILE 36 HN ILE 36 -10.415 6.515 5.683 292 HA ILE 36 HA ILE 36 -8.952 7.901 3.570 293 HB ILE 36 HB ILE 36 -8.255 5.346 5.030 294 HG12 ILE 36 HG12 ILE 36 -7.086 8.103 5.422 295 HG13 ILE 36 HG11 ILE 36 -8.355 7.435 6.442 296 HG21 ILE 36 HG21 ILE 36 -6.570 7.096 3.242 297 HG22 ILE 36 HG22 ILE 36 -7.208 5.505 2.828 298 HG23 ILE 36 HG23 ILE 36 -6.015 5.669 4.118 299 HD11 ILE 36 HD11 ILE 36 -6.143 7.229 7.452 300 HD12 ILE 36 HD12 ILE 36 -5.613 6.254 6.082 301 HD13 ILE 36 HD13 ILE 36 -6.880 5.653 7.152 302 HA PRO 37 HA PRO 37 -11.045 5.557 0.382 303 HB2 PRO 37 HB2 PRO 37 -8.567 6.163 -1.139 304 HB3 PRO 37 HB1 PRO 37 -10.257 6.503 -1.552 305 HG2 PRO 37 HG2 PRO 37 -8.627 8.443 -0.786 306 HG3 PRO 37 HG1 PRO 37 -10.333 8.419 -0.297 307 HD2 PRO 37 HD2 PRO 37 -7.906 7.746 1.295 308 HD3 PRO 37 HD1 PRO 37 -9.402 8.559 1.797 309 HA PRO 38 HA PRO 38 -9.309 1.479 0.929 310 HB2 PRO 38 HB2 PRO 38 -10.806 0.991 -1.603 311 HB3 PRO 38 HB1 PRO 38 -10.880 0.119 -0.060 312 HG2 PRO 38 HG2 PRO 38 -12.834 1.744 -0.786 313 HG3 PRO 38 HG1 PRO 38 -12.301 1.647 0.904 314 HD2 PRO 38 HD2 PRO 38 -11.779 3.766 -1.120 315 HD3 PRO 38 HD1 PRO 38 -12.038 3.905 0.630 316 H ASP 39 HN ASP 39 -9.038 3.313 -2.050 317 HA ASP 39 HA ASP 39 -7.364 1.567 -3.495 318 HB2 ASP 39 HB2 ASP 39 -7.985 4.482 -3.632 319 HB3 ASP 39 HB1 ASP 39 -6.611 3.872 -4.550 320 H GLN 40 HN GLN 40 -6.695 3.745 -0.884 321 HA GLN 40 HA GLN 40 -3.808 3.433 -1.331 322 HB2 GLN 40 HB2 GLN 40 -5.482 5.518 -0.091 323 HB3 GLN 40 HB1 GLN 40 -3.994 5.151 0.773 324 HG2 GLN 40 HG2 GLN 40 -2.703 5.587 -1.243 325 HG3 GLN 40 HG1 GLN 40 -4.190 5.921 -2.128 326 HE21 GLN 40 HE21 GLN 40 -1.819 7.586 -1.508 327 HE22 GLN 40 HE22 GLN 40 -2.459 9.013 -0.770 328 H GLN 41 HN GLN 41 -6.154 1.819 0.138 329 HA GLN 41 HA GLN 41 -4.823 1.349 2.688 330 HB2 GLN 41 HB2 GLN 41 -7.405 0.291 1.536 331 HB3 GLN 41 HB1 GLN 41 -6.775 -0.166 3.109 332 HG2 GLN 41 HG2 GLN 41 -6.885 2.251 3.753 333 HG3 GLN 41 HG1 GLN 41 -7.732 2.547 2.233 334 HE21 GLN 41 HE21 GLN 41 -9.649 3.168 3.215 335 HE22 GLN 41 HE22 GLN 41 -10.667 2.045 4.050 336 H ARG 42 HN ARG 42 -3.108 0.012 2.546 337 HA ARG 42 HA ARG 42 -3.356 -2.387 0.869 338 HB2 ARG 42 HB2 ARG 42 -0.922 -1.175 2.200 339 HB3 ARG 42 HB1 ARG 42 -0.909 -2.639 1.229 340 HG2 ARG 42 HG2 ARG 42 -1.854 -1.169 -0.647 341 HG3 ARG 42 HG1 ARG 42 -1.346 0.193 0.354 342 HD2 ARG 42 HD2 ARG 42 0.483 -0.157 -1.044 343 HD3 ARG 42 HD1 ARG 42 0.937 -0.996 0.439 344 HE ARG 42 HE ARG 42 -0.186 -2.968 -0.977 345 HH11 ARG 42 HH11 ARG 42 2.254 -0.587 -1.825 346 HH12 ARG 42 HH12 ARG 42 2.954 -1.593 -3.077 347 HH21 ARG 42 HH21 ARG 42 0.760 -4.274 -2.575 348 HH22 ARG 42 HH22 ARG 42 2.110 -3.672 -3.491 349 H LEU 43 HN LEU 43 -4.386 -3.912 2.012 350 HA LEU 43 HA LEU 43 -3.916 -4.167 4.867 351 HB2 LEU 43 HB2 LEU 43 -5.898 -5.299 2.947 352 HB3 LEU 43 HB1 LEU 43 -5.616 -6.133 4.462 353 HG LEU 43 HG LEU 43 -6.472 -3.245 4.239 354 HD11 LEU 43 HD11 LEU 43 -8.099 -5.681 4.952 355 HD12 LEU 43 HD12 LEU 43 -8.210 -4.781 3.439 356 HD13 LEU 43 HD13 LEU 43 -8.660 -4.011 4.960 357 HD21 LEU 43 HD21 LEU 43 -6.997 -3.571 6.663 358 HD22 LEU 43 HD22 LEU 43 -5.276 -3.600 6.275 359 HD23 LEU 43 HD23 LEU 43 -6.136 -5.109 6.582 360 H ILE 44 HN ILE 44 -2.569 -5.542 5.748 361 HA ILE 44 HA ILE 44 -1.603 -7.809 4.134 362 HB ILE 44 HB ILE 44 -0.068 -5.874 5.840 363 HG12 ILE 44 HG12 ILE 44 1.539 -6.339 3.804 364 HG13 ILE 44 HG11 ILE 44 0.062 -6.913 3.041 365 HG21 ILE 44 HG21 ILE 44 0.501 -8.060 6.740 366 HG22 ILE 44 HG22 ILE 44 1.858 -7.374 5.846 367 HG23 ILE 44 HG23 ILE 44 0.873 -8.643 5.117 368 HD11 ILE 44 HD11 ILE 44 0.445 -4.611 2.463 369 HD12 ILE 44 HD12 ILE 44 0.544 -4.168 4.168 370 HD13 ILE 44 HD13 ILE 44 -0.983 -4.733 3.489 371 H PHE 45 HN PHE 45 -1.389 -9.748 5.125 372 HA PHE 45 HA PHE 45 -1.866 -9.950 8.002 373 HB2 PHE 45 HB2 PHE 45 -4.064 -10.288 6.936 374 HB3 PHE 45 HB1 PHE 45 -3.376 -11.550 5.919 375 HD1 PHE 45 HD1 PHE 45 -3.810 -10.658 9.508 376 HD2 PHE 45 HD2 PHE 45 -3.553 -13.742 6.586 377 HE1 PHE 45 HE1 PHE 45 -4.363 -12.330 11.225 378 HE2 PHE 45 HE2 PHE 45 -4.107 -15.418 8.297 379 HZ PHE 45 HZ PHE 45 -4.516 -14.713 10.623 380 H ALA 46 HN ALA 46 -0.404 -11.236 8.883 381 HA ALA 46 HA ALA 46 1.218 -12.782 9.193 382 HB1 ALA 46 HB1 ALA 46 1.167 -14.852 7.957 383 HB2 ALA 46 HB2 ALA 46 0.136 -14.125 6.724 384 HB3 ALA 46 HB3 ALA 46 -0.478 -14.359 8.360 385 H GLY 47 HN GLY 47 1.356 -10.523 6.979 386 HA2 GLY 47 HA2 GLY 47 3.570 -9.699 6.408 387 HA3 GLY 47 HA1 GLY 47 4.041 -11.358 6.090 388 H LYS 48 HN LYS 48 1.176 -11.453 4.728 389 HA LYS 48 HA LYS 48 2.172 -10.357 2.177 390 HB2 LYS 48 HB2 LYS 48 0.529 -12.824 2.727 391 HB3 LYS 48 HB1 LYS 48 0.652 -12.115 1.123 392 HG2 LYS 48 HG2 LYS 48 3.125 -12.365 1.278 393 HG3 LYS 48 HG1 LYS 48 2.889 -13.237 2.793 394 HD2 LYS 48 HD2 LYS 48 1.640 -14.056 0.173 395 HD3 LYS 48 HD1 LYS 48 3.172 -14.694 0.773 396 HE2 LYS 48 HE2 LYS 48 2.065 -15.580 2.740 397 HE3 LYS 48 HE1 LYS 48 0.536 -14.866 2.228 398 HZ1 LYS 48 HZ1 LYS 48 0.584 -16.286 0.265 399 HZ2 LYS 48 HZ2 LYS 48 0.618 -17.206 1.683 400 HZ3 LYS 48 HZ3 LYS 48 2.034 -16.986 0.787 401 H GLN 49 HN GLN 49 0.613 -9.526 0.686 402 HA GLN 49 HA GLN 49 -1.401 -7.964 2.008 403 HB2 GLN 49 HB2 GLN 49 0.137 -7.438 -0.118 404 HB3 GLN 49 HB1 GLN 49 -1.279 -8.049 -0.958 405 HG2 GLN 49 HG2 GLN 49 -2.603 -6.400 0.491 406 HG3 GLN 49 HG1 GLN 49 -1.044 -5.646 0.808 407 HE21 GLN 49 HE21 GLN 49 -3.547 -6.182 -1.489 408 HE22 GLN 49 HE22 GLN 49 -2.934 -5.138 -2.724 409 H LEU 50 HN LEU 50 -3.586 -8.008 1.702 410 HA LEU 50 HA LEU 50 -4.656 -10.589 0.836 411 HB2 LEU 50 HB2 LEU 50 -6.195 -8.371 2.168 412 HB3 LEU 50 HB1 LEU 50 -6.575 -10.083 2.121 413 HG LEU 50 HG LEU 50 -4.255 -8.881 3.643 414 HD11 LEU 50 HD11 LEU 50 -6.898 -9.913 4.655 415 HD12 LEU 50 HD12 LEU 50 -6.437 -8.215 4.556 416 HD13 LEU 50 HD13 LEU 50 -5.567 -9.303 5.636 417 HD21 LEU 50 HD21 LEU 50 -4.986 -11.412 4.612 418 HD22 LEU 50 HD22 LEU 50 -3.507 -10.968 3.759 419 HD23 LEU 50 HD23 LEU 50 -4.903 -11.562 2.857 420 H GLU 51 HN GLU 51 -6.062 -10.805 -0.846 421 HA GLU 51 HA GLU 51 -6.219 -8.606 -2.712 422 HB2 GLU 51 HB2 GLU 51 -7.284 -11.421 -2.819 423 HB3 GLU 51 HB1 GLU 51 -7.450 -10.262 -4.126 424 HG2 GLU 51 HG2 GLU 51 -4.871 -10.118 -3.999 425 HG3 GLU 51 HG1 GLU 51 -5.007 -11.644 -3.123 426 H ASP 52 HN ASP 52 -7.948 -7.394 -3.207 427 HA ASP 52 HA ASP 52 -10.028 -7.055 -1.360 428 HB2 ASP 52 HB2 ASP 52 -9.651 -6.083 -4.188 429 HB3 ASP 52 HB1 ASP 52 -11.037 -5.618 -3.208 430 H GLY 53 HN GLY 53 -9.807 -9.071 -4.197 431 HA2 GLY 53 HA2 GLY 53 -12.678 -9.470 -4.336 432 HA3 GLY 53 HA1 GLY 53 -11.474 -10.195 -5.384 433 H ARG 54 HN ARG 54 -10.531 -10.625 -2.201 434 HA ARG 54 HA ARG 54 -11.691 -13.334 -2.207 435 HB2 ARG 54 HB2 ARG 54 -9.206 -12.433 -0.741 436 HB3 ARG 54 HB1 ARG 54 -9.783 -14.080 -0.941 437 HG2 ARG 54 HG2 ARG 54 -8.962 -12.349 -3.255 438 HG3 ARG 54 HG1 ARG 54 -7.838 -13.390 -2.380 439 HD2 ARG 54 HD2 ARG 54 -9.126 -15.343 -2.967 440 HD3 ARG 54 HD1 ARG 54 -10.357 -14.337 -3.732 441 HE ARG 54 HE ARG 54 -7.780 -13.882 -4.868 442 HH11 ARG 54 HH11 ARG 54 -10.452 -16.161 -4.875 443 HH12 ARG 54 HH12 ARG 54 -10.152 -16.700 -6.496 444 HH21 ARG 54 HH21 ARG 54 -7.397 -14.591 -7.005 445 HH22 ARG 54 HH22 ARG 54 -8.418 -15.799 -7.711 446 H THR 55 HN THR 55 -11.924 -14.272 0.044 447 HA THR 55 HA THR 55 -13.228 -12.248 1.726 448 HB THR 55 HB THR 55 -14.431 -14.112 2.772 449 HG1 THR 55 HG1 THR 55 -12.958 -15.718 0.914 450 HG21 THR 55 HG21 THR 55 -14.559 -14.185 -0.247 451 HG22 THR 55 HG22 THR 55 -15.432 -13.069 0.804 452 HG23 THR 55 HG23 THR 55 -15.800 -14.792 0.849 453 H LEU 56 HN LEU 56 -13.215 -12.906 4.145 454 HA LEU 56 HA LEU 56 -10.535 -12.831 5.052 455 HB2 LEU 56 HB2 LEU 56 -13.115 -13.364 6.525 456 HB3 LEU 56 HB1 LEU 56 -11.569 -13.127 7.315 457 HG LEU 56 HG LEU 56 -12.793 -11.048 5.512 458 HD11 LEU 56 HD11 LEU 56 -13.049 -11.307 8.504 459 HD12 LEU 56 HD12 LEU 56 -14.350 -11.499 7.330 460 HD13 LEU 56 HD13 LEU 56 -13.577 -9.929 7.538 461 HD21 LEU 56 HD21 LEU 56 -11.288 -9.546 6.712 462 HD22 LEU 56 HD22 LEU 56 -10.396 -10.845 5.921 463 HD23 LEU 56 HD23 LEU 56 -10.683 -10.902 7.661 464 H SER 57 HN SER 57 -12.837 -15.403 4.572 465 HA SER 57 HA SER 57 -11.460 -17.397 6.059 466 HB2 SER 57 HB2 SER 57 -13.386 -17.784 3.762 467 HB3 SER 57 HB1 SER 57 -12.986 -18.956 5.018 468 HG SER 57 HG SER 57 -14.823 -16.987 5.048 469 H ASP 58 HN ASP 58 -11.060 -16.045 2.908 470 HA ASP 58 HA ASP 58 -9.771 -18.196 1.614 471 HB2 ASP 58 HB2 ASP 58 -9.878 -15.240 1.175 472 HB3 ASP 58 HB1 ASP 58 -8.688 -16.187 0.290 473 H TYR 59 HN TYR 59 -8.688 -15.947 3.999 474 HA TYR 59 HA TYR 59 -5.924 -16.901 3.625 475 HB2 TYR 59 HB2 TYR 59 -6.927 -14.330 4.864 476 HB3 TYR 59 HB1 TYR 59 -5.244 -14.850 4.877 477 HD1 TYR 59 HD1 TYR 59 -3.957 -14.939 2.780 478 HD2 TYR 59 HD2 TYR 59 -7.928 -13.426 2.885 479 HE1 TYR 59 HE1 TYR 59 -3.607 -13.887 0.586 480 HE2 TYR 59 HE2 TYR 59 -7.587 -12.373 0.694 481 HH TYR 59 HH TYR 59 -4.748 -12.988 -1.223 482 H ASN 60 HN ASN 60 -8.403 -17.851 5.236 483 HA ASN 60 HA ASN 60 -8.793 -18.967 7.178 484 HB2 ASN 60 HB2 ASN 60 -6.242 -19.633 6.466 485 HB3 ASN 60 HB1 ASN 60 -5.989 -18.995 8.086 486 HD21 ASN 60 HD21 ASN 60 -7.254 -21.565 6.198 487 HD22 ASN 60 HD22 ASN 60 -7.696 -22.597 7.512 488 H ILE 61 HN ILE 61 -8.801 -16.071 7.200 489 HA ILE 61 HA ILE 61 -7.628 -15.213 9.686 490 HB ILE 61 HB ILE 61 -9.610 -13.789 7.904 491 HG12 ILE 61 HG12 ILE 61 -6.629 -13.346 8.138 492 HG13 ILE 61 HG11 ILE 61 -7.360 -14.357 6.896 493 HG21 ILE 61 HG21 ILE 61 -8.911 -11.758 9.091 494 HG22 ILE 61 HG22 ILE 61 -7.905 -12.736 10.159 495 HG23 ILE 61 HG23 ILE 61 -9.658 -12.926 10.180 496 HD11 ILE 61 HD11 ILE 61 -7.921 -11.425 7.292 497 HD12 ILE 61 HD12 ILE 61 -8.550 -12.450 6.002 498 HD13 ILE 61 HD13 ILE 61 -6.823 -12.105 6.093 499 H GLN 62 HN GLN 62 -8.455 -15.647 11.588 500 HA GLN 62 HA GLN 62 -11.354 -16.095 11.829 501 HB2 GLN 62 HB2 GLN 62 -9.090 -17.048 13.596 502 HB3 GLN 62 HB1 GLN 62 -10.799 -17.357 13.884 503 HG2 GLN 62 HG2 GLN 62 -10.862 -19.038 12.420 504 HG3 GLN 62 HG1 GLN 62 -9.901 -18.163 11.228 505 HE21 GLN 62 HE21 GLN 62 -7.692 -18.436 11.181 506 HE22 GLN 62 HE22 GLN 62 -6.880 -19.654 12.104 507 H LYS 63 HN LYS 63 -11.429 -15.859 14.660 508 HA LYS 63 HA LYS 63 -11.582 -13.000 14.891 509 HB2 LYS 63 HB2 LYS 63 -12.447 -13.461 17.158 510 HB3 LYS 63 HB1 LYS 63 -13.298 -14.375 15.922 511 HG2 LYS 63 HG2 LYS 63 -12.207 -16.389 16.525 512 HG3 LYS 63 HG1 LYS 63 -11.048 -15.532 17.542 513 HD2 LYS 63 HD2 LYS 63 -12.818 -14.911 19.077 514 HD3 LYS 63 HD1 LYS 63 -14.016 -15.691 18.041 515 HE2 LYS 63 HE2 LYS 63 -12.933 -17.843 18.400 516 HE3 LYS 63 HE1 LYS 63 -11.713 -17.074 19.412 517 HZ1 LYS 63 HZ1 LYS 63 -13.428 -16.466 20.975 518 HZ2 LYS 63 HZ2 LYS 63 -13.450 -18.136 20.714 519 HZ3 LYS 63 HZ3 LYS 63 -14.623 -17.153 19.991 520 H GLU 64 HN GLU 64 -10.633 -11.813 16.689 521 HA GLU 64 HA GLU 64 -8.904 -11.050 17.942 522 HB2 GLU 64 HB2 GLU 64 -8.195 -13.976 18.198 523 HB3 GLU 64 HB1 GLU 64 -7.485 -12.680 19.150 524 HG2 GLU 64 HG2 GLU 64 -10.423 -12.826 19.192 525 HG3 GLU 64 HG1 GLU 64 -9.576 -14.178 19.940 526 H SER 65 HN SER 65 -8.567 -12.074 14.962 527 HA SER 65 HA SER 65 -5.709 -12.295 14.750 528 HB2 SER 65 HB2 SER 65 -7.692 -11.824 12.514 529 HB3 SER 65 HB1 SER 65 -6.065 -12.494 12.382 530 HG SER 65 HG SER 65 -8.427 -13.714 13.069 531 H THR 66 HN THR 66 -4.306 -10.780 13.801 532 HA THR 66 HA THR 66 -5.258 -8.012 14.051 533 HB THR 66 HB THR 66 -2.366 -8.845 13.960 534 HG1 THR 66 HG1 THR 66 -4.160 -9.537 15.823 535 HG21 THR 66 HG21 THR 66 -2.980 -6.441 13.737 536 HG22 THR 66 HG22 THR 66 -2.012 -6.784 15.169 537 HG23 THR 66 HG23 THR 66 -3.750 -6.529 15.322 538 H LEU 67 HN LEU 67 -5.660 -6.990 12.222 539 HA LEU 67 HA LEU 67 -4.338 -7.861 9.753 540 HB2 LEU 67 HB2 LEU 67 -6.867 -6.411 10.377 541 HB3 LEU 67 HB1 LEU 67 -6.078 -6.055 8.853 542 HG LEU 67 HG LEU 67 -6.126 -8.568 8.415 543 HD11 LEU 67 HD11 LEU 67 -7.873 -9.818 9.598 544 HD12 LEU 67 HD12 LEU 67 -8.112 -8.447 10.681 545 HD13 LEU 67 HD13 LEU 67 -6.577 -9.314 10.682 546 HD21 LEU 67 HD21 LEU 67 -8.706 -7.019 8.598 547 HD22 LEU 67 HD22 LEU 67 -8.463 -8.484 7.646 548 HD23 LEU 67 HD23 LEU 67 -7.571 -7.015 7.248 549 H HIS 68 HN HIS 68 -2.784 -6.669 8.827 550 HA HIS 68 HA HIS 68 -2.033 -4.174 10.135 551 HB2 HIS 68 HB2 HIS 68 -0.538 -5.568 7.912 552 HB3 HIS 68 HB1 HIS 68 0.092 -4.422 9.090 553 HD2 HIS 68 HD2 HIS 68 -0.620 -5.756 11.868 554 HE1 HIS 68 HE1 HIS 68 1.025 -9.304 10.255 555 HE2 HIS 68 HE2 HIS 68 0.194 -8.167 12.358 556 H LEU 69 HN LEU 69 -2.419 -2.226 9.292 557 HA LEU 69 HA LEU 69 -3.345 -2.088 6.500 558 HB2 LEU 69 HB2 LEU 69 -4.980 -1.376 8.209 559 HB3 LEU 69 HB1 LEU 69 -3.851 -0.154 8.764 560 HG LEU 69 HG LEU 69 -3.956 0.822 6.419 561 HD11 LEU 69 HD11 LEU 69 -5.970 0.283 5.123 562 HD12 LEU 69 HD12 LEU 69 -6.339 -1.018 6.256 563 HD13 LEU 69 HD13 LEU 69 -4.881 -1.096 5.268 564 HD21 LEU 69 HD21 LEU 69 -6.399 0.796 8.183 565 HD22 LEU 69 HD22 LEU 69 -6.144 1.930 6.856 566 HD23 LEU 69 HD23 LEU 69 -5.049 1.929 8.238 567 H VAL 70 HN VAL 70 -1.832 -1.420 5.157 568 HA VAL 70 HA VAL 70 0.174 0.517 6.090 569 HB VAL 70 HB VAL 70 0.219 -1.385 3.741 570 HG11 VAL 70 HG11 VAL 70 2.268 0.624 4.654 571 HG12 VAL 70 HG12 VAL 70 1.422 0.588 3.108 572 HG13 VAL 70 HG13 VAL 70 2.593 -0.671 3.505 573 HG21 VAL 70 HG21 VAL 70 0.500 -2.489 5.887 574 HG22 VAL 70 HG22 VAL 70 1.789 -1.363 6.314 575 HG23 VAL 70 HG23 VAL 70 2.014 -2.496 4.981 576 H LEU 71 HN LEU 71 0.346 2.489 5.150 577 HA LEU 71 HA LEU 71 -1.685 3.202 3.174 578 HB2 LEU 71 HB2 LEU 71 0.081 4.865 4.967 579 HB3 LEU 71 HB1 LEU 71 -0.920 5.561 3.708 580 HG LEU 71 HG LEU 71 -2.833 4.232 4.979 581 HD11 LEU 71 HD11 LEU 71 -0.819 4.783 7.153 582 HD12 LEU 71 HD12 LEU 71 -1.325 3.189 6.592 583 HD13 LEU 71 HD13 LEU 71 -2.485 4.253 7.387 584 HD21 LEU 71 HD21 LEU 71 -3.276 6.286 6.265 585 HD22 LEU 71 HD22 LEU 71 -2.842 6.614 4.588 586 HD23 LEU 71 HD23 LEU 71 -1.656 6.859 5.868 587 H ARG 72 HN ARG 72 -1.175 3.407 1.126 588 HA ARG 72 HA ARG 72 1.646 3.413 0.341 589 HB2 ARG 72 HB2 ARG 72 0.745 1.817 -0.989 590 HB3 ARG 72 HB1 ARG 72 -0.886 2.433 -0.789 591 HG2 ARG 72 HG2 ARG 72 0.152 4.321 -2.414 592 HG3 ARG 72 HG1 ARG 72 1.071 2.905 -2.931 593 HD2 ARG 72 HD2 ARG 72 -1.310 1.772 -2.876 594 HD3 ARG 72 HD1 ARG 72 -1.858 3.435 -3.070 595 HE ARG 72 HE ARG 72 0.166 2.771 -4.960 596 HH11 ARG 72 HH11 ARG 72 -3.263 2.408 -4.282 597 HH12 ARG 72 HH12 ARG 72 -3.687 2.141 -5.942 598 HH21 ARG 72 HH21 ARG 72 -0.396 2.413 -7.134 599 HH22 ARG 72 HH22 ARG 72 -2.055 2.143 -7.568 600 H LEU 73 HN LEU 73 2.600 5.064 -0.759 601 HA LEU 73 HA LEU 73 0.927 7.388 -1.453 602 HB2 LEU 73 HB2 LEU 73 3.543 7.377 0.046 603 HB3 LEU 73 HB1 LEU 73 2.895 8.813 -0.717 604 HG LEU 73 HG LEU 73 0.778 8.206 0.772 605 HD11 LEU 73 HD11 LEU 73 1.932 6.142 1.627 606 HD12 LEU 73 HD12 LEU 73 1.318 7.240 2.864 607 HD13 LEU 73 HD13 LEU 73 3.040 7.213 2.487 608 HD21 LEU 73 HD21 LEU 73 1.955 10.315 0.835 609 HD22 LEU 73 HD22 LEU 73 3.273 9.584 1.750 610 HD23 LEU 73 HD23 LEU 73 1.675 9.740 2.479 611 H ARG 74 HN ARG 74 1.110 7.824 -3.543 612 HA ARG 74 HA ARG 74 3.429 6.874 -5.026 613 HB2 ARG 74 HB2 ARG 74 0.808 8.080 -5.917 614 HB3 ARG 74 HB1 ARG 74 2.102 7.639 -7.024 615 HG2 ARG 74 HG2 ARG 74 1.895 5.309 -5.825 616 HG3 ARG 74 HG1 ARG 74 0.275 5.902 -5.449 617 HD2 ARG 74 HD2 ARG 74 0.111 4.687 -7.486 618 HD3 ARG 74 HD1 ARG 74 0.004 6.398 -7.894 619 HE ARG 74 HE ARG 74 2.493 4.839 -8.187 620 HH11 ARG 74 HH11 ARG 74 0.148 7.138 -9.434 621 HH12 ARG 74 HH12 ARG 74 1.081 7.495 -10.855 622 HH21 ARG 74 HH21 ARG 74 3.708 5.319 -10.056 623 HH22 ARG 74 HH22 ARG 74 3.098 6.468 -11.206 624 H GLY 75 HN GLY 75 3.924 8.979 -3.228 625 HA2 GLY 75 HA2 GLY 75 5.018 10.931 -5.075 626 HA3 GLY 75 HA1 GLY 75 3.856 11.562 -3.916 627 H GLY 76 HN GLY 76 7.072 10.732 -4.473 628 HA2 GLY 76 HA2 GLY 76 7.794 11.572 -1.784 629 HA3 GLY 76 HA1 GLY 76 8.281 9.940 -2.231 630 H1 SER 453 HT1 SER 453 21.110 9.790 16.460 631 H2 SER 453 HT2 SER 453 22.375 9.032 17.283 632 H3 SER 453 HT3 SER 453 21.833 10.552 17.782 633 HA SER 453 HA SER 453 21.085 8.680 19.194 634 HB2 SER 453 HB2 SER 453 18.780 10.106 17.873 635 HB3 SER 453 HB1 SER 453 18.951 9.647 19.566 636 HG SER 453 HG SER 453 19.409 11.960 18.737 637 H ASN 454 HN ASN 454 19.115 8.906 16.222 638 HA ASN 454 HA ASN 454 18.092 7.351 14.930 639 HB2 ASN 454 HB2 ASN 454 20.569 6.302 15.369 640 HB3 ASN 454 HB1 ASN 454 19.538 5.012 15.977 641 HD21 ASN 454 HD21 ASN 454 19.895 3.560 14.372 642 HD22 ASN 454 HD22 ASN 454 19.411 3.811 12.731 643 H SER 455 HN SER 455 17.442 7.778 17.886 644 HA SER 455 HA SER 455 16.316 5.356 18.844 645 HB2 SER 455 HB2 SER 455 15.371 8.053 19.738 646 HB3 SER 455 HB1 SER 455 15.671 6.603 20.694 647 HG SER 455 HG SER 455 17.407 7.811 21.136 648 H GLN 456 HN GLN 456 14.893 8.279 17.391 649 HA GLN 456 HA GLN 456 12.225 7.382 17.429 650 HB2 GLN 456 HB2 GLN 456 13.720 9.588 16.214 651 HB3 GLN 456 HB1 GLN 456 12.339 9.066 15.256 652 HG2 GLN 456 HG2 GLN 456 12.201 9.795 18.173 653 HG3 GLN 456 HG1 GLN 456 11.848 10.905 16.852 654 HE21 GLN 456 HE21 GLN 456 10.144 9.891 19.013 655 HE22 GLN 456 HE22 GLN 456 8.779 9.163 18.239 656 H LEU 457 HN LEU 457 14.785 7.053 15.031 657 HA LEU 457 HA LEU 457 13.177 5.947 12.996 658 HB2 LEU 457 HB2 LEU 457 16.127 5.866 13.550 659 HB3 LEU 457 HB1 LEU 457 15.432 4.971 12.213 660 HG LEU 457 HG LEU 457 15.542 7.954 12.589 661 HD11 LEU 457 HD11 LEU 457 16.614 7.891 10.411 662 HD12 LEU 457 HD12 LEU 457 16.396 6.144 10.335 663 HD13 LEU 457 HD13 LEU 457 17.467 6.845 11.549 664 HD21 LEU 457 HD21 LEU 457 14.236 7.959 10.376 665 HD22 LEU 457 HD22 LEU 457 13.332 7.702 11.866 666 HD23 LEU 457 HD23 LEU 457 13.731 6.333 10.830 667 H ASN 458 HN ASN 458 15.034 4.505 15.630 668 HA ASN 458 HA ASN 458 14.614 1.814 14.866 669 HB2 ASN 458 HB2 ASN 458 15.630 3.227 17.252 670 HB3 ASN 458 HB1 ASN 458 14.916 1.651 17.570 671 HD21 ASN 458 HD21 ASN 458 17.540 3.366 16.154 672 HD22 ASN 458 HD22 ASN 458 18.509 1.987 15.756 673 H ALA 459 HN ALA 459 12.894 4.016 17.033 674 HA ALA 459 HA ALA 459 10.973 2.189 17.973 675 HB1 ALA 459 HB1 ALA 459 11.381 4.381 19.004 676 HB2 ALA 459 HB2 ALA 459 9.676 4.138 18.625 677 HB3 ALA 459 HB3 ALA 459 10.672 5.168 17.595 678 H MET 460 HN MET 460 11.108 4.192 15.088 679 HA MET 460 HA MET 460 8.433 3.644 14.253 680 HB2 MET 460 HB2 MET 460 10.776 5.061 13.168 681 HB3 MET 460 HB1 MET 460 9.714 4.357 11.957 682 HG2 MET 460 HG2 MET 460 7.811 5.539 12.970 683 HG3 MET 460 HG1 MET 460 8.917 6.289 14.118 684 HE1 MET 460 HE1 MET 460 10.976 8.741 12.013 685 HE2 MET 460 HE2 MET 460 11.371 7.211 12.798 686 HE3 MET 460 HE3 MET 460 10.351 8.388 13.623 687 H ALA 461 HN ALA 461 11.617 2.327 13.434 688 HA ALA 461 HA ALA 461 10.741 0.540 11.438 689 HB1 ALA 461 HB1 ALA 461 13.127 0.269 13.268 690 HB2 ALA 461 HB2 ALA 461 13.099 1.165 11.748 691 HB3 ALA 461 HB3 ALA 461 12.879 -0.584 11.745 692 H HIS 462 HN HIS 462 11.045 0.250 14.933 693 HA HIS 462 HA HIS 462 10.563 -2.485 15.221 694 HB2 HIS 462 HB2 HIS 462 11.162 -0.567 16.958 695 HB3 HIS 462 HB1 HIS 462 9.421 -0.566 17.210 696 HD2 HIS 462 HD2 HIS 462 8.546 -3.463 17.643 697 HE1 HIS 462 HE1 HIS 462 12.035 -4.028 19.972 698 HE2 HIS 462 HE2 HIS 462 9.661 -4.813 19.555 699 H GLN 463 HN GLN 463 8.370 0.201 14.709 700 HA GLN 463 HA GLN 463 5.947 -1.075 15.338 701 HB2 GLN 463 HB2 GLN 463 6.055 1.329 15.056 702 HB3 GLN 463 HB1 GLN 463 6.545 1.152 13.379 703 HG2 GLN 463 HG2 GLN 463 4.230 1.795 13.501 704 HG3 GLN 463 HG1 GLN 463 4.361 0.156 12.861 705 HE21 GLN 463 HE21 GLN 463 3.687 -1.579 14.123 706 HE22 GLN 463 HE22 GLN 463 2.666 -1.367 15.505 707 H ILE 464 HN ILE 464 7.822 -0.927 12.360 708 HA ILE 464 HA ILE 464 5.889 -2.374 10.809 709 HB ILE 464 HB ILE 464 8.811 -1.895 10.193 710 HG12 ILE 464 HG12 ILE 464 6.421 -0.265 9.311 711 HG13 ILE 464 HG11 ILE 464 7.484 0.194 10.638 712 HG21 ILE 464 HG21 ILE 464 8.119 -2.207 7.856 713 HG22 ILE 464 HG22 ILE 464 6.482 -2.580 8.400 714 HG23 ILE 464 HG23 ILE 464 7.820 -3.646 8.831 715 HD11 ILE 464 HD11 ILE 464 8.017 1.368 8.564 716 HD12 ILE 464 HD12 ILE 464 8.334 -0.180 7.777 717 HD13 ILE 464 HD13 ILE 464 9.353 0.355 9.113 718 H GLN 465 HN GLN 465 8.914 -3.128 12.472 719 HA GLN 465 HA GLN 465 9.205 -5.776 11.589 720 HB2 GLN 465 HB2 GLN 465 10.806 -4.188 12.928 721 HB3 GLN 465 HB1 GLN 465 10.080 -4.965 14.329 722 HG2 GLN 465 HG2 GLN 465 12.106 -6.110 13.763 723 HG3 GLN 465 HG1 GLN 465 10.737 -7.162 13.405 724 HE21 GLN 465 HE21 GLN 465 11.799 -8.383 11.888 725 HE22 GLN 465 HE22 GLN 465 12.280 -7.763 10.343 726 H GLU 466 HN GLU 466 7.148 -4.410 14.025 727 HA GLU 466 HA GLU 466 6.600 -6.925 15.317 728 HB2 GLU 466 HB2 GLU 466 5.665 -4.117 15.625 729 HB3 GLU 466 HB1 GLU 466 4.631 -5.398 16.241 730 HG2 GLU 466 HG2 GLU 466 7.532 -5.220 16.969 731 HG3 GLU 466 HG1 GLU 466 6.287 -4.342 17.856 732 H MET 467 HN MET 467 5.678 -5.618 12.418 733 HA MET 467 HA MET 467 3.147 -7.124 12.429 734 HB2 MET 467 HB2 MET 467 3.900 -4.744 10.718 735 HB3 MET 467 HB1 MET 467 2.386 -5.635 10.622 736 HG2 MET 467 HG2 MET 467 2.170 -5.029 13.134 737 HG3 MET 467 HG1 MET 467 3.357 -3.785 12.753 738 HE1 MET 467 HE1 MET 467 2.380 -3.265 9.616 739 HE2 MET 467 HE2 MET 467 2.980 -2.036 10.730 740 HE3 MET 467 HE3 MET 467 1.433 -1.807 9.914 741 H PHE 468 HN PHE 468 6.102 -6.372 10.694 742 HA PHE 468 HA PHE 468 5.560 -8.615 8.861 743 HB2 PHE 468 HB2 PHE 468 7.237 -6.125 8.521 744 HB3 PHE 468 HB1 PHE 468 7.384 -7.513 7.449 745 HD1 PHE 468 HD1 PHE 468 4.950 -5.018 8.727 746 HD2 PHE 468 HD2 PHE 468 5.956 -7.766 5.639 747 HE1 PHE 468 HE1 PHE 468 3.087 -4.164 7.363 748 HE2 PHE 468 HE2 PHE 468 4.101 -6.920 4.270 749 HZ PHE 468 HZ PHE 468 2.661 -5.111 5.134 750 HA PRO 469 HA PRO 469 9.018 -10.166 11.374 751 HB2 PRO 469 HB2 PRO 469 8.132 -12.681 11.646 752 HB3 PRO 469 HB1 PRO 469 7.416 -11.351 12.574 753 HG2 PRO 469 HG2 PRO 469 6.352 -12.782 10.214 754 HG3 PRO 469 HG1 PRO 469 5.497 -12.086 11.602 755 HD2 PRO 469 HD2 PRO 469 5.783 -10.902 9.067 756 HD3 PRO 469 HD1 PRO 469 5.217 -10.103 10.546 757 H GLN 470 HN GLN 470 8.581 -10.169 8.278 758 HA GLN 470 HA GLN 470 10.538 -12.302 7.773 759 HB2 GLN 470 HB2 GLN 470 9.461 -12.692 5.568 760 HB3 GLN 470 HB1 GLN 470 8.453 -13.129 6.937 761 HG2 GLN 470 HG2 GLN 470 7.413 -10.792 6.642 762 HG3 GLN 470 HG1 GLN 470 8.164 -10.831 5.044 763 HE21 GLN 470 HE21 GLN 470 6.294 -10.959 3.866 764 HE22 GLN 470 HE22 GLN 470 5.245 -12.332 3.900 765 H VAL 471 HN VAL 471 10.715 -9.341 8.175 766 HA VAL 471 HA VAL 471 12.159 -8.773 5.681 767 HB VAL 471 HB VAL 471 10.106 -7.419 5.729 768 HG11 VAL 471 HG11 VAL 471 9.826 -5.640 7.399 769 HG12 VAL 471 HG12 VAL 471 11.206 -6.277 8.293 770 HG13 VAL 471 HG13 VAL 471 9.746 -7.251 8.113 771 HG21 VAL 471 HG21 VAL 471 12.023 -6.495 4.611 772 HG22 VAL 471 HG22 VAL 471 12.652 -5.854 6.129 773 HG23 VAL 471 HG23 VAL 471 11.164 -5.201 5.443 774 HA PRO 472 HA PRO 472 15.648 -8.465 8.435 775 HB2 PRO 472 HB2 PRO 472 16.708 -6.718 6.267 776 HB3 PRO 472 HB1 PRO 472 17.428 -8.161 7.008 777 HG2 PRO 472 HG2 PRO 472 16.410 -8.282 4.576 778 HG3 PRO 472 HG1 PRO 472 16.186 -9.616 5.726 779 HD2 PRO 472 HD2 PRO 472 14.246 -7.508 4.887 780 HD3 PRO 472 HD1 PRO 472 13.976 -9.234 5.212 781 H TYR 473 HN TYR 473 15.465 -7.213 10.154 782 HA TYR 473 HA TYR 473 14.340 -4.700 10.359 783 HB2 TYR 473 HB2 TYR 473 14.782 -6.277 12.237 784 HB3 TYR 473 HB1 TYR 473 16.487 -5.857 12.148 785 HD1 TYR 473 HD2 TYR 473 13.143 -4.257 12.591 786 HD2 TYR 473 HD1 TYR 473 17.296 -4.169 13.512 787 HE1 TYR 473 HE2 TYR 473 12.754 -2.398 14.149 788 HE2 TYR 473 HE1 TYR 473 16.915 -2.310 15.077 789 HH TYR 473 HH TYR 473 15.387 -0.657 15.643 790 H HIS 474 HN HIS 474 17.737 -5.549 9.832 791 HA HIS 474 HA HIS 474 18.769 -2.952 10.177 792 HB2 HIS 474 HB2 HIS 474 20.770 -3.793 8.970 793 HB3 HIS 474 HB1 HIS 474 20.255 -4.835 10.287 794 HD2 HIS 474 HD2 HIS 474 20.818 -4.918 6.486 795 HE1 HIS 474 HE1 HIS 474 19.444 -8.721 7.725 796 HE2 HIS 474 HE2 HIS 474 20.655 -7.441 5.906 797 H LEU 475 HN LEU 475 17.213 -4.482 7.464 798 HA LEU 475 HA LEU 475 18.072 -2.452 5.598 799 HB2 LEU 475 HB2 LEU 475 16.090 -4.708 5.373 800 HB3 LEU 475 HB1 LEU 475 16.372 -3.555 4.083 801 HG LEU 475 HG LEU 475 18.354 -5.521 5.222 802 HD11 LEU 475 HD11 LEU 475 16.671 -6.409 3.648 803 HD12 LEU 475 HD12 LEU 475 18.319 -6.499 3.028 804 HD13 LEU 475 HD13 LEU 475 17.227 -5.245 2.444 805 HD21 LEU 475 HD21 LEU 475 19.606 -3.553 4.769 806 HD22 LEU 475 HD22 LEU 475 18.749 -3.278 3.253 807 HD23 LEU 475 HD23 LEU 475 19.857 -4.643 3.405 808 H VAL 476 HN VAL 476 15.289 -3.156 7.598 809 HA VAL 476 HA VAL 476 13.504 -1.268 6.501 810 HB VAL 476 HB VAL 476 13.671 -2.194 9.379 811 HG11 VAL 476 HG11 VAL 476 11.267 -1.651 9.446 812 HG12 VAL 476 HG12 VAL 476 11.395 -0.976 7.822 813 HG13 VAL 476 HG13 VAL 476 12.274 -0.233 9.157 814 HG21 VAL 476 HG21 VAL 476 12.102 -3.345 7.075 815 HG22 VAL 476 HG22 VAL 476 12.005 -3.875 8.755 816 HG23 VAL 476 HG23 VAL 476 13.504 -4.085 7.848 817 H LEU 477 HN LEU 477 15.930 -1.077 9.054 818 HA LEU 477 HA LEU 477 15.453 1.596 9.816 819 HB2 LEU 477 HB2 LEU 477 17.629 -0.381 10.192 820 HB3 LEU 477 HB1 LEU 477 18.072 1.304 10.391 821 HG LEU 477 HG LEU 477 15.813 -0.012 11.894 822 HD11 LEU 477 HD11 LEU 477 17.343 -0.076 13.800 823 HD12 LEU 477 HD12 LEU 477 18.653 0.504 12.769 824 HD13 LEU 477 HD13 LEU 477 17.927 -1.076 12.470 825 HD21 LEU 477 HD21 LEU 477 15.626 2.410 11.697 826 HD22 LEU 477 HD22 LEU 477 17.276 2.600 12.290 827 HD23 LEU 477 HD23 LEU 477 16.026 1.948 13.350 828 H GLN 478 HN GLN 478 17.273 0.162 7.218 829 HA GLN 478 HA GLN 478 18.832 2.421 6.520 830 HB2 GLN 478 HB2 GLN 478 19.267 0.070 5.775 831 HB3 GLN 478 HB1 GLN 478 17.876 0.198 4.708 832 HG2 GLN 478 HG2 GLN 478 19.035 2.163 3.634 833 HG3 GLN 478 HG1 GLN 478 20.465 1.708 4.559 834 HE21 GLN 478 HE21 GLN 478 18.141 -0.531 3.170 835 HE22 GLN 478 HE22 GLN 478 19.224 -1.239 2.024 836 H ASP 479 HN ASP 479 15.721 1.190 5.344 837 HA ASP 479 HA ASP 479 15.328 3.230 3.408 838 HB2 ASP 479 HB2 ASP 479 14.136 1.018 3.423 839 HB3 ASP 479 HB1 ASP 479 13.181 1.602 4.784 840 H LEU 480 HN LEU 480 14.363 2.867 6.778 841 HA LEU 480 HA LEU 480 12.591 4.978 7.054 842 HB2 LEU 480 HB2 LEU 480 14.108 3.268 8.780 843 HB3 LEU 480 HB1 LEU 480 14.179 4.906 9.394 844 HG LEU 480 HG LEU 480 12.365 3.838 10.483 845 HD11 LEU 480 HD11 LEU 480 11.094 5.438 8.274 846 HD12 LEU 480 HD12 LEU 480 11.977 6.158 9.618 847 HD13 LEU 480 HD13 LEU 480 10.515 5.222 9.926 848 HD21 LEU 480 HD21 LEU 480 12.078 1.956 8.985 849 HD22 LEU 480 HD22 LEU 480 11.394 3.016 7.754 850 HD23 LEU 480 HD23 LEU 480 10.531 2.757 9.268 851 H GLN 481 HN GLN 481 16.069 5.058 6.805 852 HA GLN 481 HA GLN 481 16.422 7.707 7.806 853 HB2 GLN 481 HB2 GLN 481 18.240 6.191 5.931 854 HB3 GLN 481 HB1 GLN 481 18.673 7.558 6.945 855 HG2 GLN 481 HG2 GLN 481 18.406 6.248 8.927 856 HG3 GLN 481 HG1 GLN 481 17.773 4.890 7.996 857 HE21 GLN 481 HE21 GLN 481 19.324 3.430 8.517 858 HE22 GLN 481 HE22 GLN 481 20.983 3.576 8.049 859 H LEU 482 HN LEU 482 15.325 6.439 4.819 860 HA LEU 482 HA LEU 482 15.920 8.957 3.429 861 HB2 LEU 482 HB2 LEU 482 15.843 6.194 2.623 862 HB3 LEU 482 HB1 LEU 482 14.768 7.151 1.624 863 HG LEU 482 HG LEU 482 16.953 6.965 0.589 864 HD11 LEU 482 HD11 LEU 482 16.533 9.756 1.648 865 HD12 LEU 482 HD12 LEU 482 15.650 9.040 0.301 866 HD13 LEU 482 HD13 LEU 482 17.389 9.300 0.174 867 HD21 LEU 482 HD21 LEU 482 17.987 8.246 3.115 868 HD22 LEU 482 HD22 LEU 482 18.928 8.013 1.643 869 HD23 LEU 482 HD23 LEU 482 18.331 6.615 2.538 870 H THR 483 HN THR 483 13.236 6.665 3.930 871 HA THR 483 HA THR 483 11.317 8.376 2.686 872 HB THR 483 HB THR 483 9.706 6.745 3.949 873 HG1 THR 483 HG1 THR 483 11.562 4.781 3.911 874 HG21 THR 483 HG21 THR 483 10.033 5.076 2.174 875 HG22 THR 483 HG22 THR 483 11.588 5.810 1.779 876 HG23 THR 483 HG23 THR 483 10.095 6.719 1.539 877 H ARG 484 HN ARG 484 12.156 7.637 6.045 878 HA ARG 484 HA ARG 484 11.757 8.704 8.007 879 HB2 ARG 484 HB2 ARG 484 11.023 11.006 6.190 880 HB3 ARG 484 HB1 ARG 484 11.157 11.136 7.937 881 HG2 ARG 484 HG2 ARG 484 13.504 10.558 7.829 882 HG3 ARG 484 HG1 ARG 484 13.384 10.330 6.085 883 HD2 ARG 484 HD2 ARG 484 12.890 12.646 5.749 884 HD3 ARG 484 HD1 ARG 484 12.771 12.922 7.485 885 HE ARG 484 HE ARG 484 15.151 12.593 7.646 886 HH11 ARG 484 HH11 ARG 484 13.888 12.985 4.398 887 HH12 ARG 484 HH12 ARG 484 15.420 13.430 3.717 888 HH21 ARG 484 HH21 ARG 484 17.178 13.159 6.748 889 HH22 ARG 484 HH22 ARG 484 17.303 13.516 5.056 890 H SER 485 HN SER 485 9.567 7.367 6.338 891 HA SER 485 HA SER 485 7.426 7.977 8.190 892 HB2 SER 485 HB2 SER 485 6.596 9.475 6.630 893 HB3 SER 485 HB1 SER 485 7.312 8.615 5.269 894 HG SER 485 HG SER 485 4.840 8.295 6.474 895 H VAL 486 HN VAL 486 6.852 6.062 8.935 896 HA VAL 486 HA VAL 486 7.570 3.598 7.891 897 HB VAL 486 HB VAL 486 5.719 2.659 9.345 898 HG11 VAL 486 HG11 VAL 486 7.702 4.572 10.568 899 HG12 VAL 486 HG12 VAL 486 7.977 2.875 10.175 900 HG13 VAL 486 HG13 VAL 486 6.836 3.313 11.447 901 HG21 VAL 486 HG21 VAL 486 4.205 4.585 9.218 902 HG22 VAL 486 HG22 VAL 486 5.377 5.560 10.104 903 HG23 VAL 486 HG23 VAL 486 4.607 4.177 10.886 904 H GLU 487 HN GLU 487 4.889 5.628 7.074 905 HA GLU 487 HA GLU 487 3.175 3.719 5.916 906 HB2 GLU 487 HB2 GLU 487 3.506 6.610 5.104 907 HB3 GLU 487 HB1 GLU 487 2.087 5.599 4.859 908 HG2 GLU 487 HG2 GLU 487 1.368 5.850 6.982 909 HG3 GLU 487 HG1 GLU 487 3.000 5.899 7.646 910 H ILE 488 HN ILE 488 5.498 5.945 4.398 911 HA ILE 488 HA ILE 488 5.276 4.734 1.829 912 HB ILE 488 HB ILE 488 7.654 6.358 2.697 913 HG12 ILE 488 HG12 ILE 488 4.995 7.496 1.801 914 HG13 ILE 488 HG11 ILE 488 5.536 7.468 3.476 915 HG21 ILE 488 HG21 ILE 488 6.152 6.164 0.085 916 HG22 ILE 488 HG22 ILE 488 7.673 5.356 0.462 917 HG23 ILE 488 HG23 ILE 488 7.609 7.116 0.378 918 HD11 ILE 488 HD11 ILE 488 6.869 8.913 1.198 919 HD12 ILE 488 HD12 ILE 488 7.454 8.864 2.862 920 HD13 ILE 488 HD13 ILE 488 5.914 9.640 2.490 921 H THR 489 HN THR 489 7.302 4.218 4.618 922 HA THR 489 HA THR 489 9.395 2.775 3.411 923 HB THR 489 HB THR 489 8.310 2.406 6.212 924 HG1 THR 489 HG1 THR 489 10.349 4.138 5.211 925 HG21 THR 489 HG21 THR 489 9.854 0.625 5.339 926 HG22 THR 489 HG22 THR 489 10.440 1.476 6.767 927 HG23 THR 489 HG23 THR 489 11.092 1.869 5.175 928 H THR 490 HN THR 490 6.470 1.577 5.081 929 HA THR 490 HA THR 490 6.976 -1.139 4.521 930 HB THR 490 HB THR 490 4.196 -0.070 4.918 931 HG1 THR 490 HG1 THR 490 5.348 0.959 6.535 932 HG21 THR 490 HG21 THR 490 4.467 -2.467 4.533 933 HG22 THR 490 HG22 THR 490 3.953 -2.160 6.193 934 HG23 THR 490 HG23 THR 490 5.636 -2.556 5.851 935 H ASP 491 HN ASP 491 5.221 1.366 2.763 936 HA ASP 491 HA ASP 491 4.060 -0.326 0.813 937 HB2 ASP 491 HB2 ASP 491 3.398 2.057 1.223 938 HB3 ASP 491 HB1 ASP 491 4.907 2.564 0.472 939 H ASN 492 HN ASN 492 7.100 1.427 1.017 940 HA ASN 492 HA ASN 492 8.144 0.839 -1.518 941 HB2 ASN 492 HB2 ASN 492 8.980 2.337 0.563 942 HB3 ASN 492 HB1 ASN 492 10.019 0.934 0.791 943 HD21 ASN 492 HD21 ASN 492 11.836 2.224 0.339 944 HD22 ASN 492 HD22 ASN 492 12.218 2.679 -1.291 945 H ILE 493 HN ILE 493 8.269 -0.926 1.542 946 HA ILE 493 HA ILE 493 9.978 -3.013 0.666 947 HB ILE 493 HB ILE 493 7.896 -3.071 2.865 948 HG12 ILE 493 HG12 ILE 493 10.872 -2.585 3.070 949 HG13 ILE 493 HG11 ILE 493 9.662 -1.307 3.091 950 HG21 ILE 493 HG21 ILE 493 9.202 -4.940 3.774 951 HG22 ILE 493 HG22 ILE 493 10.253 -4.889 2.359 952 HG23 ILE 493 HG23 ILE 493 8.550 -5.314 2.178 953 HD11 ILE 493 HD11 ILE 493 9.820 -3.550 5.090 954 HD12 ILE 493 HD12 ILE 493 8.738 -2.160 5.139 955 HD13 ILE 493 HD13 ILE 493 10.475 -1.930 5.330 956 H LEU 494 HN LEU 494 6.457 -2.657 0.818 957 HA LEU 494 HA LEU 494 5.780 -5.245 -0.042 958 HB2 LEU 494 HB2 LEU 494 4.326 -2.613 -0.173 959 HB3 LEU 494 HB1 LEU 494 3.606 -4.101 -0.756 960 HG LEU 494 HG LEU 494 4.599 -3.773 2.072 961 HD11 LEU 494 HD11 LEU 494 2.330 -3.337 2.735 962 HD12 LEU 494 HD12 LEU 494 1.777 -3.471 1.067 963 HD13 LEU 494 HD13 LEU 494 2.818 -2.129 1.545 964 HD21 LEU 494 HD21 LEU 494 3.962 -6.025 0.675 965 HD22 LEU 494 HD22 LEU 494 2.422 -5.622 1.444 966 HD23 LEU 494 HD23 LEU 494 3.869 -5.859 2.429 967 H GLU 495 HN GLU 495 6.400 -2.266 -1.846 968 HA GLU 495 HA GLU 495 5.677 -3.252 -4.383 969 HB2 GLU 495 HB2 GLU 495 7.512 -1.029 -3.510 970 HB3 GLU 495 HB1 GLU 495 7.263 -1.410 -5.209 971 HG2 GLU 495 HG2 GLU 495 5.202 -0.503 -3.221 972 HG3 GLU 495 HG1 GLU 495 5.803 0.374 -4.628 973 H GLY 496 HN GLY 496 8.691 -3.383 -2.562 974 HA2 GLY 496 HA2 GLY 496 10.002 -5.437 -2.937 975 HA3 GLY 496 HA1 GLY 496 9.728 -5.192 -4.653 976 H ARG 497 HN ARG 497 10.456 -2.459 -2.619 977 HA ARG 497 HA ARG 497 12.867 -1.999 -4.146 978 HB2 ARG 497 HB2 ARG 497 11.264 -0.183 -3.463 979 HB3 ARG 497 HB1 ARG 497 11.824 -0.397 -1.810 980 HG2 ARG 497 HG2 ARG 497 13.384 1.117 -2.251 981 HG3 ARG 497 HG1 ARG 497 14.153 -0.088 -3.288 982 HD2 ARG 497 HD2 ARG 497 13.877 1.882 -4.588 983 HD3 ARG 497 HD1 ARG 497 12.676 0.722 -5.149 984 HE ARG 497 HE ARG 497 11.227 2.081 -3.400 985 HH11 ARG 497 HH11 ARG 497 13.470 3.251 -5.821 986 HH12 ARG 497 HH12 ARG 497 12.674 4.782 -5.995 987 HH21 ARG 497 HH21 ARG 497 10.195 4.095 -3.619 988 HH22 ARG 497 HH22 ARG 497 10.796 5.257 -4.758 989 H ILE 498 HN ILE 498 11.990 -3.236 -1.043 990 HA ILE 498 HA ILE 498 14.735 -3.112 -0.066 991 HB ILE 498 HB ILE 498 12.095 -3.718 1.212 992 HG12 ILE 498 HG12 ILE 498 13.123 -2.184 2.971 993 HG13 ILE 498 HG11 ILE 498 14.432 -1.910 1.829 994 HG21 ILE 498 HG21 ILE 498 13.353 -5.602 1.948 995 HG22 ILE 498 HG22 ILE 498 13.306 -4.442 3.277 996 HG23 ILE 498 HG23 ILE 498 14.763 -4.600 2.295 997 HD11 ILE 498 HD11 ILE 498 11.524 -1.292 1.363 998 HD12 ILE 498 HD12 ILE 498 12.836 -1.012 0.217 999 HD13 ILE 498 HD13 ILE 498 12.793 -0.126 1.742 1000 H GLN 499 HN GLN 499 16.052 -4.838 0.025 1001 HA GLN 499 HA GLN 499 15.453 -7.109 -1.557 1002 HB2 GLN 499 HB2 GLN 499 17.753 -6.543 0.318 1003 HB3 GLN 499 HB1 GLN 499 17.663 -7.950 -0.738 1004 HG2 GLN 499 HG2 GLN 499 17.638 -5.086 -1.668 1005 HG3 GLN 499 HG1 GLN 499 19.051 -6.141 -1.656 1006 HE21 GLN 499 HE21 GLN 499 17.647 -4.804 -3.877 1007 HE22 GLN 499 HE22 GLN 499 17.232 -6.063 -4.986 1008 H VAL 500 HN VAL 500 13.973 -8.506 -0.909 1009 HA VAL 500 HA VAL 500 13.613 -9.216 1.856 1010 HB VAL 500 HB VAL 500 11.890 -10.794 0.979 1011 HG11 VAL 500 HG11 VAL 500 11.263 -8.533 1.593 1012 HG12 VAL 500 HG12 VAL 500 10.334 -9.067 0.192 1013 HG13 VAL 500 HG13 VAL 500 11.688 -7.958 -0.020 1014 HG21 VAL 500 HG21 VAL 500 12.630 -9.640 -1.712 1015 HG22 VAL 500 HG22 VAL 500 11.281 -10.728 -1.382 1016 HG23 VAL 500 HG23 VAL 500 12.940 -11.293 -1.181 1017 HA PRO 501 HA PRO 501 16.164 -12.796 2.174 1018 HB2 PRO 501 HB2 PRO 501 13.814 -14.424 2.974 1019 HB3 PRO 501 HB1 PRO 501 15.316 -14.104 3.859 1020 HG2 PRO 501 HG2 PRO 501 13.039 -12.973 4.598 1021 HG3 PRO 501 HG1 PRO 501 14.576 -12.088 4.677 1022 HD2 PRO 501 HD2 PRO 501 12.378 -11.871 2.670 1023 HD3 PRO 501 HD1 PRO 501 13.384 -10.594 3.384 1024 H PHE 502 HN PHE 502 16.816 -13.505 0.240 1025 HA PHE 502 HA PHE 502 15.040 -15.316 -1.255 1026 HB2 PHE 502 HB2 PHE 502 15.551 -13.129 -2.402 1027 HB3 PHE 502 HB1 PHE 502 17.249 -13.591 -2.408 1028 HD1 PHE 502 HD1 PHE 502 13.922 -14.358 -3.774 1029 HD2 PHE 502 HD2 PHE 502 18.093 -15.190 -3.967 1030 HE1 PHE 502 HE1 PHE 502 13.581 -15.545 -5.900 1031 HE2 PHE 502 HE2 PHE 502 17.757 -16.379 -6.097 1032 HZ PHE 502 HZ PHE 502 15.499 -16.553 -7.063 1033 HA PRO 503 HA PRO 503 18.141 -18.359 -0.310 1034 HB2 PRO 503 HB2 PRO 503 17.360 -20.218 -2.175 1035 HB3 PRO 503 HB1 PRO 503 16.548 -19.985 -0.617 1036 HG2 PRO 503 HG2 PRO 503 15.769 -19.005 -3.310 1037 HG3 PRO 503 HG1 PRO 503 14.758 -19.629 -1.993 1038 HD2 PRO 503 HD2 PRO 503 14.983 -16.991 -2.519 1039 HD3 PRO 503 HD1 PRO 503 14.726 -17.626 -0.881 1040 H THR 504 HN THR 504 20.053 -17.443 -0.975 1041 HA THR 504 HA THR 504 20.948 -18.209 -3.642 1042 HB THR 504 HB THR 504 20.172 -15.871 -3.856 1043 HG1 THR 504 HG1 THR 504 22.986 -16.313 -4.005 1044 HG21 THR 504 HG21 THR 504 20.585 -15.158 -1.539 1045 HG22 THR 504 HG22 THR 504 21.333 -14.064 -2.706 1046 HG23 THR 504 HG23 THR 504 22.322 -15.237 -1.833 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 -18.670 -10.700 14.926 2 H2 MET 1 HT2 MET 1 -18.505 -12.230 14.218 3 H3 MET 1 HT3 MET 1 -17.834 -10.870 13.466 4 HA MET 1 HA MET 1 -17.017 -11.716 16.162 5 HB2 MET 1 HB2 MET 1 -15.209 -12.974 15.256 6 HB3 MET 1 HB1 MET 1 -16.663 -13.540 14.450 7 HG2 MET 1 HG2 MET 1 -16.097 -12.059 12.533 8 HG3 MET 1 HG1 MET 1 -14.574 -11.683 13.337 9 HE1 MET 1 HE1 MET 1 -13.286 -14.000 10.506 10 HE2 MET 1 HE2 MET 1 -13.083 -12.464 11.353 11 HE3 MET 1 HE3 MET 1 -14.541 -12.763 10.403 12 H GLN 2 HN GLN 2 -14.937 -10.778 16.719 13 HA GLN 2 HA GLN 2 -14.620 -8.168 15.415 14 HB2 GLN 2 HB2 GLN 2 -13.578 -8.920 18.139 15 HB3 GLN 2 HB1 GLN 2 -13.817 -7.309 17.477 16 HG2 GLN 2 HG2 GLN 2 -15.987 -9.262 18.217 17 HG3 GLN 2 HG1 GLN 2 -15.502 -7.843 19.142 18 HE21 GLN 2 HE21 GLN 2 -18.066 -8.605 17.905 19 HE22 GLN 2 HE22 GLN 2 -18.504 -7.272 16.886 20 H ILE 3 HN ILE 3 -12.707 -7.513 14.623 21 HA ILE 3 HA ILE 3 -10.400 -9.325 14.919 22 HB ILE 3 HB ILE 3 -9.688 -8.645 12.626 23 HG12 ILE 3 HG12 ILE 3 -12.522 -7.674 12.250 24 HG13 ILE 3 HG11 ILE 3 -11.191 -6.581 12.615 25 HG21 ILE 3 HG21 ILE 3 -11.268 -10.119 11.435 26 HG22 ILE 3 HG22 ILE 3 -12.333 -10.078 12.840 27 HG23 ILE 3 HG23 ILE 3 -10.729 -10.797 12.971 28 HD11 ILE 3 HD11 ILE 3 -11.357 -8.391 10.212 29 HD12 ILE 3 HD12 ILE 3 -10.069 -7.240 10.569 30 HD13 ILE 3 HD13 ILE 3 -11.698 -6.660 10.230 31 H PHE 4 HN PHE 4 -8.350 -8.330 14.999 32 HA PHE 4 HA PHE 4 -8.491 -5.503 15.793 33 HB2 PHE 4 HB2 PHE 4 -6.258 -7.461 16.351 34 HB3 PHE 4 HB1 PHE 4 -6.499 -5.880 17.086 35 HD1 PHE 4 HD1 PHE 4 -8.888 -5.627 18.266 36 HD2 PHE 4 HD2 PHE 4 -6.841 -9.296 17.586 37 HE1 PHE 4 HE1 PHE 4 -10.174 -6.678 20.082 38 HE2 PHE 4 HE2 PHE 4 -8.126 -10.351 19.398 39 HZ PHE 4 HZ PHE 4 -9.792 -9.048 20.650 40 H VAL 5 HN VAL 5 -7.945 -4.146 14.228 41 HA VAL 5 HA VAL 5 -5.888 -4.958 12.286 42 HB VAL 5 HB VAL 5 -7.778 -2.604 12.111 43 HG11 VAL 5 HG11 VAL 5 -7.143 -2.555 9.765 44 HG12 VAL 5 HG12 VAL 5 -6.074 -3.936 10.011 45 HG13 VAL 5 HG13 VAL 5 -5.720 -2.396 10.793 46 HG21 VAL 5 HG21 VAL 5 -8.996 -4.003 10.437 47 HG22 VAL 5 HG22 VAL 5 -9.117 -4.591 12.096 48 HG23 VAL 5 HG23 VAL 5 -8.024 -5.377 10.959 49 H LYS 6 HN LYS 6 -3.905 -4.183 12.569 50 HA LYS 6 HA LYS 6 -3.571 -1.810 14.268 51 HB2 LYS 6 HB2 LYS 6 -2.426 -4.121 14.730 52 HB3 LYS 6 HB1 LYS 6 -1.300 -3.599 13.483 53 HG2 LYS 6 HG2 LYS 6 -0.884 -1.533 14.803 54 HG3 LYS 6 HG1 LYS 6 -1.898 -2.203 16.084 55 HD2 LYS 6 HD2 LYS 6 -0.387 -4.139 16.244 56 HD3 LYS 6 HD1 LYS 6 0.641 -3.425 15.001 57 HE2 LYS 6 HE2 LYS 6 1.673 -2.857 17.027 58 HE3 LYS 6 HE1 LYS 6 0.810 -1.399 16.536 59 HZ1 LYS 6 HZ1 LYS 6 0.376 -1.702 18.814 60 HZ2 LYS 6 HZ2 LYS 6 0.044 -3.348 18.628 61 HZ3 LYS 6 HZ3 LYS 6 -1.038 -2.197 18.023 62 H THR 7 HN THR 7 -2.342 -0.081 13.612 63 HA THR 7 HA THR 7 -1.700 -0.007 10.738 64 HB THR 7 HB THR 7 -1.972 2.504 11.001 65 HG1 THR 7 HG1 THR 7 -3.261 1.691 13.417 66 HG21 THR 7 HG21 THR 7 -4.408 0.783 11.494 67 HG22 THR 7 HG22 THR 7 -3.688 1.135 9.923 68 HG23 THR 7 HG23 THR 7 -4.420 2.431 10.866 69 H LEU 8 HN LEU 8 0.049 1.532 10.176 70 HA LEU 8 HA LEU 8 2.418 0.971 11.588 71 HB2 LEU 8 HB2 LEU 8 1.844 3.094 9.520 72 HB3 LEU 8 HB1 LEU 8 3.447 2.632 10.059 73 HG LEU 8 HG LEU 8 1.579 0.622 8.832 74 HD11 LEU 8 HD11 LEU 8 2.710 1.037 6.689 75 HD12 LEU 8 HD12 LEU 8 3.520 2.433 7.402 76 HD13 LEU 8 HD13 LEU 8 1.765 2.428 7.224 77 HD21 LEU 8 HD21 LEU 8 3.539 -0.640 8.467 78 HD22 LEU 8 HD22 LEU 8 3.658 -0.035 10.119 79 HD23 LEU 8 HD23 LEU 8 4.581 0.734 8.830 80 H THR 9 HN THR 9 0.089 3.512 11.862 81 HA THR 9 HA THR 9 1.732 5.405 13.213 82 HB THR 9 HB THR 9 -1.014 5.748 13.902 83 HG1 THR 9 HG1 THR 9 -1.971 5.599 11.859 84 HG21 THR 9 HG21 THR 9 0.595 7.551 13.524 85 HG22 THR 9 HG22 THR 9 -0.806 7.729 12.468 86 HG23 THR 9 HG23 THR 9 0.709 7.100 11.823 87 H GLY 10 HN GLY 10 0.326 2.472 14.163 88 HA2 GLY 10 HA2 GLY 10 0.819 1.502 16.278 89 HA3 GLY 10 HA1 GLY 10 0.899 3.117 16.968 90 H LYS 11 HN LYS 11 -1.739 3.141 15.041 91 HA LYS 11 HA LYS 11 -3.525 2.920 17.301 92 HB2 LYS 11 HB2 LYS 11 -3.670 3.990 14.548 93 HB3 LYS 11 HB1 LYS 11 -5.173 3.339 15.188 94 HG2 LYS 11 HG2 LYS 11 -4.865 4.829 17.178 95 HG3 LYS 11 HG1 LYS 11 -3.508 5.574 16.329 96 HD2 LYS 11 HD2 LYS 11 -5.385 6.954 15.905 97 HD3 LYS 11 HD1 LYS 11 -5.125 6.025 14.426 98 HE2 LYS 11 HE2 LYS 11 -6.855 4.412 15.249 99 HE3 LYS 11 HE1 LYS 11 -7.189 5.531 16.567 100 HZ1 LYS 11 HZ1 LYS 11 -7.679 5.880 13.673 101 HZ2 LYS 11 HZ2 LYS 11 -7.557 7.225 14.697 102 HZ3 LYS 11 HZ3 LYS 11 -8.758 6.065 14.968 103 H THR 12 HN THR 12 -4.933 1.331 17.706 104 HA THR 12 HA THR 12 -5.022 -0.925 15.820 105 HB THR 12 HB THR 12 -5.601 -1.162 18.768 106 HG1 THR 12 HG1 THR 12 -3.508 -0.426 18.745 107 HG21 THR 12 HG21 THR 12 -6.294 -3.001 17.274 108 HG22 THR 12 HG22 THR 12 -5.027 -3.503 18.392 109 HG23 THR 12 HG23 THR 12 -4.628 -3.152 16.710 110 H ILE 13 HN ILE 13 -6.890 -1.054 14.805 111 HA ILE 13 HA ILE 13 -9.294 0.033 16.111 112 HB ILE 13 HB ILE 13 -8.778 -0.396 13.164 113 HG12 ILE 13 HG12 ILE 13 -9.150 2.281 13.465 114 HG13 ILE 13 HG11 ILE 13 -8.338 1.894 14.978 115 HG21 ILE 13 HG21 ILE 13 -11.111 0.893 14.566 116 HG22 ILE 13 HG22 ILE 13 -11.129 -0.639 13.693 117 HG23 ILE 13 HG23 ILE 13 -10.851 0.871 12.822 118 HD11 ILE 13 HD11 ILE 13 -6.506 0.864 13.697 119 HD12 ILE 13 HD12 ILE 13 -6.730 2.573 13.320 120 HD13 ILE 13 HD13 ILE 13 -7.313 1.339 12.203 121 H THR 14 HN THR 14 -10.869 -1.317 16.665 122 HA THR 14 HA THR 14 -10.717 -4.102 15.815 123 HB THR 14 HB THR 14 -12.655 -2.909 17.802 124 HG1 THR 14 HG1 THR 14 -10.361 -2.530 18.317 125 HG21 THR 14 HG21 THR 14 -13.189 -5.163 17.010 126 HG22 THR 14 HG22 THR 14 -12.699 -5.192 18.704 127 HG23 THR 14 HG23 THR 14 -11.571 -5.711 17.451 128 H LEU 15 HN LEU 15 -11.953 -4.814 14.184 129 HA LEU 15 HA LEU 15 -14.276 -3.178 13.409 130 HB2 LEU 15 HB2 LEU 15 -12.499 -4.947 11.739 131 HB3 LEU 15 HB1 LEU 15 -13.991 -4.240 11.154 132 HG LEU 15 HG LEU 15 -11.589 -2.673 12.102 133 HD11 LEU 15 HD11 LEU 15 -11.284 -2.124 9.746 134 HD12 LEU 15 HD12 LEU 15 -12.622 -3.189 9.318 135 HD13 LEU 15 HD13 LEU 15 -11.151 -3.861 10.019 136 HD21 LEU 15 HD21 LEU 15 -13.602 -1.424 12.484 137 HD22 LEU 15 HD22 LEU 15 -14.206 -1.818 10.875 138 HD23 LEU 15 HD23 LEU 15 -12.801 -0.768 11.056 139 H GLU 16 HN GLU 16 -16.176 -4.150 12.802 140 HA GLU 16 HA GLU 16 -16.586 -6.819 13.924 141 HB2 GLU 16 HB2 GLU 16 -18.016 -4.867 14.646 142 HB3 GLU 16 HB1 GLU 16 -18.660 -4.822 13.011 143 HG2 GLU 16 HG2 GLU 16 -19.895 -6.713 13.290 144 HG3 GLU 16 HG1 GLU 16 -18.784 -7.391 14.482 145 H VAL 17 HN VAL 17 -16.341 -8.397 12.505 146 HA VAL 17 HA VAL 17 -17.642 -8.151 9.883 147 HB VAL 17 HB VAL 17 -15.697 -9.331 8.835 148 HG11 VAL 17 HG11 VAL 17 -14.256 -7.338 8.668 149 HG12 VAL 17 HG12 VAL 17 -15.133 -6.614 10.016 150 HG13 VAL 17 HG13 VAL 17 -15.968 -6.950 8.499 151 HG21 VAL 17 HG21 VAL 17 -14.677 -10.269 10.818 152 HG22 VAL 17 HG22 VAL 17 -14.352 -8.655 11.449 153 HG23 VAL 17 HG23 VAL 17 -13.518 -9.219 10.001 154 H GLU 18 HN GLU 18 -17.356 -10.419 8.761 155 HA GLU 18 HA GLU 18 -17.678 -12.597 10.685 156 HB2 GLU 18 HB2 GLU 18 -19.709 -11.665 8.674 157 HB3 GLU 18 HB1 GLU 18 -19.623 -13.367 9.110 158 HG2 GLU 18 HG2 GLU 18 -20.025 -11.111 11.069 159 HG3 GLU 18 HG1 GLU 18 -21.315 -12.101 10.387 160 HA PRO 19 HA PRO 19 -15.168 -15.018 7.993 161 HB2 PRO 19 HB2 PRO 19 -17.442 -16.941 7.709 162 HB3 PRO 19 HB1 PRO 19 -15.753 -17.247 8.161 163 HG2 PRO 19 HG2 PRO 19 -17.643 -17.263 9.999 164 HG3 PRO 19 HG1 PRO 19 -16.054 -16.545 10.331 165 HD2 PRO 19 HD2 PRO 19 -18.653 -15.202 9.794 166 HD3 PRO 19 HD1 PRO 19 -17.323 -14.710 10.859 167 H SER 20 HN SER 20 -18.510 -14.651 6.871 168 HA SER 20 HA SER 20 -17.808 -15.143 4.122 169 HB2 SER 20 HB2 SER 20 -20.419 -13.923 4.891 170 HB3 SER 20 HB1 SER 20 -20.072 -15.190 3.715 171 HG SER 20 HG SER 20 -20.876 -15.454 6.236 172 H ASP 21 HN ASP 21 -16.935 -12.602 5.826 173 HA ASP 21 HA ASP 21 -17.970 -10.498 4.118 174 HB2 ASP 21 HB2 ASP 21 -17.179 -10.490 6.724 175 HB3 ASP 21 HB1 ASP 21 -15.742 -9.846 5.934 176 H THR 22 HN THR 22 -16.774 -9.254 2.714 177 HA THR 22 HA THR 22 -14.495 -10.621 1.524 178 HB THR 22 HB THR 22 -15.375 -8.097 0.310 179 HG1 THR 22 HG1 THR 22 -17.427 -8.664 -0.092 180 HG21 THR 22 HG21 THR 22 -15.170 -10.927 -0.725 181 HG22 THR 22 HG22 THR 22 -13.912 -9.697 -0.833 182 HG23 THR 22 HG23 THR 22 -15.429 -9.490 -1.709 183 H ILE 23 HN ILE 23 -12.478 -9.642 1.151 184 HA ILE 23 HA ILE 23 -11.491 -7.947 3.167 185 HB ILE 23 HB ILE 23 -10.292 -8.409 0.427 186 HG12 ILE 23 HG12 ILE 23 -10.729 -10.525 1.604 187 HG13 ILE 23 HG11 ILE 23 -9.003 -10.210 1.461 188 HG21 ILE 23 HG21 ILE 23 -8.159 -7.846 1.475 189 HG22 ILE 23 HG22 ILE 23 -8.987 -7.529 2.999 190 HG23 ILE 23 HG23 ILE 23 -9.305 -6.510 1.596 191 HD11 ILE 23 HD11 ILE 23 -10.700 -9.834 3.915 192 HD12 ILE 23 HD12 ILE 23 -8.993 -9.410 3.789 193 HD13 ILE 23 HD13 ILE 23 -9.497 -11.094 3.636 194 H GLU 24 HN GLU 24 -12.654 -7.341 -0.084 195 HA GLU 24 HA GLU 24 -11.979 -4.641 -0.347 196 HB2 GLU 24 HB2 GLU 24 -12.825 -6.170 -2.159 197 HB3 GLU 24 HB1 GLU 24 -14.429 -6.027 -1.460 198 HG2 GLU 24 HG2 GLU 24 -14.100 -3.493 -1.786 199 HG3 GLU 24 HG1 GLU 24 -12.806 -3.964 -2.885 200 H ASN 25 HN ASN 25 -14.702 -6.246 1.175 201 HA ASN 25 HA ASN 25 -16.232 -3.893 1.658 202 HB2 ASN 25 HB2 ASN 25 -17.015 -6.368 1.637 203 HB3 ASN 25 HB1 ASN 25 -16.447 -6.402 3.304 204 HD21 ASN 25 HD21 ASN 25 -18.428 -6.675 4.207 205 HD22 ASN 25 HD22 ASN 25 -19.652 -5.441 4.199 206 H VAL 26 HN VAL 26 -13.758 -5.650 3.403 207 HA VAL 26 HA VAL 26 -14.048 -4.422 5.919 208 HB VAL 26 HB VAL 26 -11.534 -5.493 4.617 209 HG11 VAL 26 HG11 VAL 26 -11.002 -4.019 6.482 210 HG12 VAL 26 HG12 VAL 26 -10.661 -5.699 6.898 211 HG13 VAL 26 HG13 VAL 26 -12.111 -4.915 7.522 212 HG21 VAL 26 HG21 VAL 26 -13.289 -7.176 4.778 213 HG22 VAL 26 HG22 VAL 26 -13.492 -6.818 6.493 214 HG23 VAL 26 HG23 VAL 26 -11.984 -7.525 5.913 215 H LYS 27 HN LYS 27 -12.232 -3.547 3.036 216 HA LYS 27 HA LYS 27 -10.805 -1.365 4.026 217 HB2 LYS 27 HB2 LYS 27 -11.879 -1.984 1.280 218 HB3 LYS 27 HB1 LYS 27 -10.892 -0.569 1.607 219 HG2 LYS 27 HG2 LYS 27 -9.062 -2.001 2.350 220 HG3 LYS 27 HG1 LYS 27 -10.052 -3.428 2.031 221 HD2 LYS 27 HD2 LYS 27 -10.061 -3.032 -0.288 222 HD3 LYS 27 HD1 LYS 27 -9.472 -1.382 -0.086 223 HE2 LYS 27 HE2 LYS 27 -7.348 -2.376 0.832 224 HE3 LYS 27 HE1 LYS 27 -7.946 -3.948 0.300 225 HZ1 LYS 27 HZ1 LYS 27 -7.484 -1.588 -1.440 226 HZ2 LYS 27 HZ2 LYS 27 -8.079 -3.089 -1.961 227 HZ3 LYS 27 HZ3 LYS 27 -6.500 -2.962 -1.357 228 H ALA 28 HN ALA 28 -14.058 -1.582 2.702 229 HA ALA 28 HA ALA 28 -14.641 1.164 2.618 230 HB1 ALA 28 HB1 ALA 28 -15.994 -0.512 1.462 231 HB2 ALA 28 HB2 ALA 28 -16.987 0.476 2.532 232 HB3 ALA 28 HB3 ALA 28 -16.528 -1.157 3.013 233 H LYS 29 HN LYS 29 -14.990 -1.252 5.178 234 HA LYS 29 HA LYS 29 -16.367 0.431 6.997 235 HB2 LYS 29 HB2 LYS 29 -14.591 -1.921 7.669 236 HB3 LYS 29 HB1 LYS 29 -15.869 -1.244 8.668 237 HG2 LYS 29 HG2 LYS 29 -17.472 -1.869 6.817 238 HG3 LYS 29 HG1 LYS 29 -16.141 -2.782 6.104 239 HD2 LYS 29 HD2 LYS 29 -15.990 -3.794 8.536 240 HD3 LYS 29 HD1 LYS 29 -17.683 -3.300 8.598 241 HE2 LYS 29 HE2 LYS 29 -17.714 -4.502 6.227 242 HE3 LYS 29 HE1 LYS 29 -16.357 -5.373 6.937 243 HZ1 LYS 29 HZ1 LYS 29 -18.205 -6.641 7.483 244 HZ2 LYS 29 HZ2 LYS 29 -19.161 -5.285 7.850 245 HZ3 LYS 29 HZ3 LYS 29 -17.916 -5.747 8.899 246 H ILE 30 HN ILE 30 -12.961 -0.243 6.405 247 HA ILE 30 HA ILE 30 -11.925 1.146 8.632 248 HB ILE 30 HB ILE 30 -10.683 0.540 5.943 249 HG12 ILE 30 HG12 ILE 30 -10.266 -0.697 8.673 250 HG13 ILE 30 HG11 ILE 30 -11.258 -1.392 7.397 251 HG21 ILE 30 HG21 ILE 30 -9.584 2.491 6.890 252 HG22 ILE 30 HG22 ILE 30 -8.522 1.085 6.976 253 HG23 ILE 30 HG23 ILE 30 -9.367 1.644 8.421 254 HD11 ILE 30 HD11 ILE 30 -9.058 -2.446 7.560 255 HD12 ILE 30 HD12 ILE 30 -8.295 -0.893 7.220 256 HD13 ILE 30 HD13 ILE 30 -9.302 -1.668 5.996 257 H GLN 31 HN GLN 31 -12.694 2.162 5.328 258 HA GLN 31 HA GLN 31 -11.701 4.805 5.608 259 HB2 GLN 31 HB2 GLN 31 -12.086 3.734 3.419 260 HB3 GLN 31 HB1 GLN 31 -13.820 3.760 3.717 261 HG2 GLN 31 HG2 GLN 31 -13.853 6.153 3.681 262 HG3 GLN 31 HG1 GLN 31 -12.094 6.222 3.595 263 HE21 GLN 31 HE21 GLN 31 -12.138 7.403 1.693 264 HE22 GLN 31 HE22 GLN 31 -12.574 6.695 0.175 265 H ASP 32 HN ASP 32 -14.752 3.285 6.333 266 HA ASP 32 HA ASP 32 -16.298 5.625 6.660 267 HB2 ASP 32 HB2 ASP 32 -17.298 3.401 6.379 268 HB3 ASP 32 HB1 ASP 32 -16.629 2.897 7.927 269 H LYS 33 HN LYS 33 -14.050 3.967 8.747 270 HA LYS 33 HA LYS 33 -14.837 5.651 11.008 271 HB2 LYS 33 HB2 LYS 33 -13.002 3.259 10.882 272 HB3 LYS 33 HB1 LYS 33 -13.372 4.163 12.343 273 HG2 LYS 33 HG2 LYS 33 -15.750 3.572 12.080 274 HG3 LYS 33 HG1 LYS 33 -15.326 2.608 10.665 275 HD2 LYS 33 HD2 LYS 33 -13.843 1.234 12.086 276 HD3 LYS 33 HD1 LYS 33 -14.360 2.170 13.490 277 HE2 LYS 33 HE2 LYS 33 -16.649 1.236 12.047 278 HE3 LYS 33 HE1 LYS 33 -15.570 -0.117 12.381 279 HZ1 LYS 33 HZ1 LYS 33 -15.610 0.449 14.711 280 HZ2 LYS 33 HZ2 LYS 33 -17.195 0.251 14.157 281 HZ3 LYS 33 HZ3 LYS 33 -16.576 1.802 14.414 282 H GLU 34 HN GLU 34 -11.769 4.542 9.544 283 HA GLU 34 HA GLU 34 -10.295 6.675 10.760 284 HB2 GLU 34 HB2 GLU 34 -9.519 4.705 8.602 285 HB3 GLU 34 HB1 GLU 34 -8.405 5.812 9.394 286 HG2 GLU 34 HG2 GLU 34 -9.953 3.598 10.720 287 HG3 GLU 34 HG1 GLU 34 -8.233 3.592 10.340 288 H GLY 35 HN GLY 35 -11.341 5.955 7.451 289 HA2 GLY 35 HA2 GLY 35 -12.065 7.622 5.927 290 HA3 GLY 35 HA1 GLY 35 -11.169 8.817 6.854 291 H ILE 36 HN ILE 36 -10.065 5.706 5.604 292 HA ILE 36 HA ILE 36 -8.051 7.151 4.017 293 HB ILE 36 HB ILE 36 -7.841 4.376 5.199 294 HG12 ILE 36 HG12 ILE 36 -6.249 6.791 6.030 295 HG13 ILE 36 HG11 ILE 36 -7.790 6.402 6.785 296 HG21 ILE 36 HG21 ILE 36 -5.795 6.064 3.766 297 HG22 ILE 36 HG22 ILE 36 -6.573 4.611 3.136 298 HG23 ILE 36 HG23 ILE 36 -5.486 4.501 4.523 299 HD11 ILE 36 HD11 ILE 36 -5.903 5.580 8.085 300 HD12 ILE 36 HD12 ILE 36 -5.378 4.610 6.708 301 HD13 ILE 36 HD13 ILE 36 -6.913 4.257 7.503 302 HA PRO 37 HA PRO 37 -10.183 5.534 0.440 303 HB2 PRO 37 HB2 PRO 37 -7.463 5.741 -0.767 304 HB3 PRO 37 HB1 PRO 37 -9.006 6.408 -1.335 305 HG2 PRO 37 HG2 PRO 37 -7.173 7.975 -0.238 306 HG3 PRO 37 HG1 PRO 37 -8.905 8.226 0.061 307 HD2 PRO 37 HD2 PRO 37 -6.833 7.057 1.852 308 HD3 PRO 37 HD1 PRO 37 -8.245 8.056 2.249 309 HA PRO 38 HA PRO 38 -9.278 1.179 0.826 310 HB2 PRO 38 HB2 PRO 38 -10.579 1.030 -1.845 311 HB3 PRO 38 HB1 PRO 38 -10.979 0.175 -0.344 312 HG2 PRO 38 HG2 PRO 38 -12.506 2.143 -1.225 313 HG3 PRO 38 HG1 PRO 38 -12.183 1.930 0.508 314 HD2 PRO 38 HD2 PRO 38 -11.023 3.918 -1.392 315 HD3 PRO 38 HD1 PRO 38 -11.493 4.116 0.308 316 H ASP 39 HN ASP 39 -8.515 3.016 -2.062 317 HA ASP 39 HA ASP 39 -6.867 1.058 -3.300 318 HB2 ASP 39 HB2 ASP 39 -7.675 3.800 -3.801 319 HB3 ASP 39 HB1 ASP 39 -5.971 3.559 -4.164 320 H GLN 40 HN GLN 40 -6.405 3.293 -0.739 321 HA GLN 40 HA GLN 40 -3.490 3.147 -0.905 322 HB2 GLN 40 HB2 GLN 40 -5.357 5.093 0.022 323 HB3 GLN 40 HB1 GLN 40 -4.375 4.590 1.390 324 HG2 GLN 40 HG2 GLN 40 -2.351 5.052 0.024 325 HG3 GLN 40 HG1 GLN 40 -3.407 5.718 -1.220 326 HE21 GLN 40 HE21 GLN 40 -1.284 6.863 0.535 327 HE22 GLN 40 HE22 GLN 40 -2.021 8.257 1.257 328 H GLN 41 HN GLN 41 -5.967 1.411 0.399 329 HA GLN 41 HA GLN 41 -4.673 0.770 2.921 330 HB2 GLN 41 HB2 GLN 41 -7.230 -0.234 1.672 331 HB3 GLN 41 HB1 GLN 41 -6.642 -0.701 3.261 332 HG2 GLN 41 HG2 GLN 41 -6.791 1.658 3.964 333 HG3 GLN 41 HG1 GLN 41 -7.479 2.053 2.387 334 HE21 GLN 41 HE21 GLN 41 -9.469 2.713 3.201 335 HE22 GLN 41 HE22 GLN 41 -10.597 1.591 3.887 336 H ARG 42 HN ARG 42 -3.025 -0.619 2.836 337 HA ARG 42 HA ARG 42 -3.309 -2.963 1.074 338 HB2 ARG 42 HB2 ARG 42 -1.124 -1.153 1.458 339 HB3 ARG 42 HB1 ARG 42 -0.637 -2.745 2.029 340 HG2 ARG 42 HG2 ARG 42 -0.971 -3.726 -0.065 341 HG3 ARG 42 HG1 ARG 42 -1.931 -2.368 -0.649 342 HD2 ARG 42 HD2 ARG 42 -0.026 -0.984 -0.859 343 HD3 ARG 42 HD1 ARG 42 0.976 -2.096 0.081 344 HE ARG 42 HE ARG 42 0.035 -3.464 -2.169 345 HH11 ARG 42 HH11 ARG 42 2.213 -0.792 -1.431 346 HH12 ARG 42 HH12 ARG 42 3.188 -1.069 -2.841 347 HH21 ARG 42 HH21 ARG 42 1.328 -3.775 -4.029 348 HH22 ARG 42 HH22 ARG 42 2.686 -2.720 -4.319 349 H LEU 43 HN LEU 43 -4.386 -4.331 2.396 350 HA LEU 43 HA LEU 43 -3.637 -4.663 5.160 351 HB2 LEU 43 HB2 LEU 43 -5.720 -5.902 3.395 352 HB3 LEU 43 HB1 LEU 43 -5.384 -6.555 4.986 353 HG LEU 43 HG LEU 43 -6.167 -3.678 4.538 354 HD11 LEU 43 HD11 LEU 43 -7.939 -6.017 5.232 355 HD12 LEU 43 HD12 LEU 43 -7.955 -5.116 3.716 356 HD13 LEU 43 HD13 LEU 43 -8.422 -4.319 5.218 357 HD21 LEU 43 HD21 LEU 43 -6.776 -3.823 6.930 358 HD22 LEU 43 HD22 LEU 43 -5.056 -4.074 6.643 359 HD23 LEU 43 HD23 LEU 43 -6.105 -5.451 6.978 360 H ILE 44 HN ILE 44 -2.394 -6.143 6.020 361 HA ILE 44 HA ILE 44 -1.467 -8.377 4.339 362 HB ILE 44 HB ILE 44 0.076 -6.505 6.090 363 HG12 ILE 44 HG12 ILE 44 1.780 -7.046 4.193 364 HG13 ILE 44 HG11 ILE 44 0.381 -7.716 3.364 365 HG21 ILE 44 HG21 ILE 44 0.507 -8.674 7.109 366 HG22 ILE 44 HG22 ILE 44 1.940 -8.066 6.280 367 HG23 ILE 44 HG23 ILE 44 0.963 -9.333 5.537 368 HD11 ILE 44 HD11 ILE 44 0.766 -5.450 2.667 369 HD12 ILE 44 HD12 ILE 44 0.702 -4.892 4.335 370 HD13 ILE 44 HD13 ILE 44 -0.745 -5.545 3.564 371 H PHE 45 HN PHE 45 -1.435 -10.369 5.248 372 HA PHE 45 HA PHE 45 -1.987 -10.648 8.111 373 HB2 PHE 45 HB2 PHE 45 -4.157 -10.800 6.867 374 HB3 PHE 45 HB1 PHE 45 -3.500 -12.160 5.967 375 HD1 PHE 45 HD1 PHE 45 -4.085 -11.051 9.477 376 HD2 PHE 45 HD2 PHE 45 -3.912 -14.285 6.717 377 HE1 PHE 45 HE1 PHE 45 -4.861 -12.585 11.235 378 HE2 PHE 45 HE2 PHE 45 -4.685 -15.827 8.470 379 HZ PHE 45 HZ PHE 45 -5.161 -14.979 10.733 380 H ALA 46 HN ALA 46 -0.634 -12.056 8.975 381 HA ALA 46 HA ALA 46 0.899 -13.695 9.262 382 HB1 ALA 46 HB1 ALA 46 0.719 -15.733 7.954 383 HB2 ALA 46 HB2 ALA 46 -0.318 -14.914 6.787 384 HB3 ALA 46 HB3 ALA 46 -0.875 -15.163 8.442 385 H GLY 47 HN GLY 47 1.263 -11.382 7.232 386 HA2 GLY 47 HA2 GLY 47 3.427 -10.663 6.534 387 HA3 GLY 47 HA1 GLY 47 3.876 -12.345 6.309 388 H LYS 48 HN LYS 48 0.918 -12.248 5.014 389 HA LYS 48 HA LYS 48 1.985 -11.567 2.354 390 HB2 LYS 48 HB2 LYS 48 -0.134 -13.573 3.142 391 HB3 LYS 48 HB1 LYS 48 0.271 -13.162 1.480 392 HG2 LYS 48 HG2 LYS 48 2.535 -13.981 1.804 393 HG3 LYS 48 HG1 LYS 48 2.176 -14.348 3.491 394 HD2 LYS 48 HD2 LYS 48 0.605 -15.538 1.226 395 HD3 LYS 48 HD1 LYS 48 2.086 -16.278 1.832 396 HE2 LYS 48 HE2 LYS 48 1.122 -16.514 4.030 397 HE3 LYS 48 HE1 LYS 48 -0.327 -15.643 3.522 398 HZ1 LYS 48 HZ1 LYS 48 -0.971 -17.405 2.147 399 HZ2 LYS 48 HZ2 LYS 48 -0.469 -18.144 3.578 400 HZ3 LYS 48 HZ3 LYS 48 0.540 -18.156 2.222 401 H GLN 49 HN GLN 49 0.655 -10.438 0.900 402 HA GLN 49 HA GLN 49 -1.176 -8.617 2.191 403 HB2 GLN 49 HB2 GLN 49 0.538 -8.194 0.217 404 HB3 GLN 49 HB1 GLN 49 -0.833 -8.673 -0.775 405 HG2 GLN 49 HG2 GLN 49 -1.984 -6.879 0.919 406 HG3 GLN 49 HG1 GLN 49 -0.363 -6.214 0.734 407 HE21 GLN 49 HE21 GLN 49 -3.347 -6.995 -0.874 408 HE22 GLN 49 HE22 GLN 49 -3.025 -6.108 -2.322 409 H LEU 50 HN LEU 50 -3.348 -8.453 1.886 410 HA LEU 50 HA LEU 50 -4.668 -10.857 0.895 411 HB2 LEU 50 HB2 LEU 50 -5.919 -8.446 2.207 412 HB3 LEU 50 HB1 LEU 50 -6.634 -10.033 2.006 413 HG LEU 50 HG LEU 50 -4.287 -9.373 3.786 414 HD11 LEU 50 HD11 LEU 50 -7.092 -10.160 4.539 415 HD12 LEU 50 HD12 LEU 50 -6.487 -8.505 4.544 416 HD13 LEU 50 HD13 LEU 50 -5.778 -9.705 5.624 417 HD21 LEU 50 HD21 LEU 50 -3.948 -11.585 3.133 418 HD22 LEU 50 HD22 LEU 50 -5.675 -11.941 3.103 419 HD23 LEU 50 HD23 LEU 50 -4.844 -11.727 4.643 420 H GLU 51 HN GLU 51 -6.165 -10.888 -0.744 421 HA GLU 51 HA GLU 51 -5.972 -8.706 -2.657 422 HB2 GLU 51 HB2 GLU 51 -7.097 -11.492 -2.773 423 HB3 GLU 51 HB1 GLU 51 -7.407 -10.326 -4.050 424 HG2 GLU 51 HG2 GLU 51 -5.002 -10.119 -4.433 425 HG3 GLU 51 HG1 GLU 51 -4.706 -11.310 -3.165 426 H ASP 52 HN ASP 52 -7.748 -7.598 -3.498 427 HA ASP 52 HA ASP 52 -9.786 -6.939 -1.654 428 HB2 ASP 52 HB2 ASP 52 -9.477 -6.360 -4.605 429 HB3 ASP 52 HB1 ASP 52 -10.808 -5.731 -3.642 430 H GLY 53 HN GLY 53 -9.691 -9.008 -4.491 431 HA2 GLY 53 HA2 GLY 53 -12.511 -9.663 -4.254 432 HA3 GLY 53 HA1 GLY 53 -11.406 -10.234 -5.495 433 H ARG 54 HN ARG 54 -11.380 -10.417 -1.947 434 HA ARG 54 HA ARG 54 -11.619 -13.318 -2.068 435 HB2 ARG 54 HB2 ARG 54 -9.248 -11.850 -0.924 436 HB3 ARG 54 HB1 ARG 54 -9.692 -13.457 -0.375 437 HG2 ARG 54 HG2 ARG 54 -8.936 -12.690 -3.187 438 HG3 ARG 54 HG1 ARG 54 -7.923 -13.553 -2.029 439 HD2 ARG 54 HD2 ARG 54 -9.695 -15.335 -1.964 440 HD3 ARG 54 HD1 ARG 54 -10.480 -14.505 -3.309 441 HE ARG 54 HE ARG 54 -8.070 -16.094 -3.399 442 HH11 ARG 54 HH11 ARG 54 -10.058 -13.711 -5.029 443 HH12 ARG 54 HH12 ARG 54 -9.319 -13.974 -6.578 444 HH21 ARG 54 HH21 ARG 54 -7.099 -16.445 -5.443 445 HH22 ARG 54 HH22 ARG 54 -7.647 -15.533 -6.813 446 H THR 55 HN THR 55 -12.095 -14.243 0.037 447 HA THR 55 HA THR 55 -13.441 -12.277 1.765 448 HB THR 55 HB THR 55 -14.769 -14.212 2.593 449 HG1 THR 55 HG1 THR 55 -13.283 -15.581 0.572 450 HG21 THR 55 HG21 THR 55 -14.859 -13.798 -0.397 451 HG22 THR 55 HG22 THR 55 -15.673 -12.808 0.814 452 HG23 THR 55 HG23 THR 55 -16.151 -14.489 0.583 453 H LEU 56 HN LEU 56 -13.541 -12.926 4.109 454 HA LEU 56 HA LEU 56 -10.931 -13.248 5.133 455 HB2 LEU 56 HB2 LEU 56 -13.592 -13.555 6.531 456 HB3 LEU 56 HB1 LEU 56 -12.042 -13.422 7.340 457 HG LEU 56 HG LEU 56 -13.202 -11.272 5.565 458 HD11 LEU 56 HD11 LEU 56 -13.216 -11.501 8.569 459 HD12 LEU 56 HD12 LEU 56 -14.621 -11.586 7.505 460 HD13 LEU 56 HD13 LEU 56 -13.708 -10.082 7.642 461 HD21 LEU 56 HD21 LEU 56 -11.510 -9.864 6.703 462 HD22 LEU 56 HD22 LEU 56 -10.806 -11.135 5.707 463 HD23 LEU 56 HD23 LEU 56 -10.857 -11.317 7.459 464 H SER 57 HN SER 57 -13.529 -15.471 4.474 465 HA SER 57 HA SER 57 -12.552 -17.686 5.921 466 HB2 SER 57 HB2 SER 57 -14.017 -18.864 4.013 467 HB3 SER 57 HB1 SER 57 -14.748 -18.010 5.372 468 HG SER 57 HG SER 57 -14.177 -16.818 2.845 469 H ASP 58 HN ASP 58 -11.684 -16.327 2.851 470 HA ASP 58 HA ASP 58 -10.590 -18.624 1.622 471 HB2 ASP 58 HB2 ASP 58 -10.165 -15.675 1.245 472 HB3 ASP 58 HB1 ASP 58 -9.173 -16.840 0.374 473 H TYR 59 HN TYR 59 -9.171 -16.146 3.700 474 HA TYR 59 HA TYR 59 -6.631 -17.590 3.698 475 HB2 TYR 59 HB2 TYR 59 -7.350 -14.977 5.051 476 HB3 TYR 59 HB1 TYR 59 -5.734 -15.654 4.888 477 HD1 TYR 59 HD1 TYR 59 -4.704 -15.808 2.602 478 HD2 TYR 59 HD2 TYR 59 -8.326 -13.694 3.317 479 HE1 TYR 59 HE1 TYR 59 -4.418 -14.613 0.473 480 HE2 TYR 59 HE2 TYR 59 -8.051 -12.490 1.191 481 HH TYR 59 HH TYR 59 -5.688 -13.404 -1.150 482 H ASN 60 HN ASN 60 -9.417 -17.987 5.106 483 HA ASN 60 HA ASN 60 -10.251 -18.945 6.964 484 HB2 ASN 60 HB2 ASN 60 -7.923 -20.307 6.365 485 HB3 ASN 60 HB1 ASN 60 -7.754 -19.952 8.081 486 HD21 ASN 60 HD21 ASN 60 -10.519 -20.793 5.995 487 HD22 ASN 60 HD22 ASN 60 -11.061 -22.116 6.973 488 H ILE 61 HN ILE 61 -9.664 -16.266 7.216 489 HA ILE 61 HA ILE 61 -8.270 -15.744 9.673 490 HB ILE 61 HB ILE 61 -10.141 -13.953 8.110 491 HG12 ILE 61 HG12 ILE 61 -7.115 -14.027 8.097 492 HG13 ILE 61 HG11 ILE 61 -8.121 -14.764 6.855 493 HG21 ILE 61 HG21 ILE 61 -9.075 -12.120 9.320 494 HG22 ILE 61 HG22 ILE 61 -8.114 -13.280 10.238 495 HG23 ILE 61 HG23 ILE 61 -9.868 -13.241 10.426 496 HD11 ILE 61 HD11 ILE 61 -8.074 -11.834 7.538 497 HD12 ILE 61 HD12 ILE 61 -9.002 -12.594 6.246 498 HD13 ILE 61 HD13 ILE 61 -7.239 -12.585 6.179 499 H GLN 62 HN GLN 62 -9.075 -16.330 11.550 500 HA GLN 62 HA GLN 62 -11.964 -16.522 11.915 501 HB2 GLN 62 HB2 GLN 62 -9.612 -17.546 13.500 502 HB3 GLN 62 HB1 GLN 62 -11.257 -17.605 14.118 503 HG2 GLN 62 HG2 GLN 62 -11.775 -19.373 12.874 504 HG3 GLN 62 HG1 GLN 62 -11.015 -18.695 11.434 505 HE21 GLN 62 HE21 GLN 62 -8.910 -19.222 10.946 506 HE22 GLN 62 HE22 GLN 62 -8.038 -20.464 11.779 507 H LYS 63 HN LYS 63 -12.215 -16.153 14.603 508 HA LYS 63 HA LYS 63 -12.167 -13.295 14.781 509 HB2 LYS 63 HB2 LYS 63 -13.376 -13.578 16.850 510 HB3 LYS 63 HB1 LYS 63 -14.049 -14.661 15.642 511 HG2 LYS 63 HG2 LYS 63 -12.887 -16.540 16.633 512 HG3 LYS 63 HG1 LYS 63 -12.110 -15.466 17.797 513 HD2 LYS 63 HD2 LYS 63 -14.391 -14.833 18.610 514 HD3 LYS 63 HD1 LYS 63 -15.048 -16.094 17.568 515 HE2 LYS 63 HE2 LYS 63 -13.683 -17.757 18.756 516 HE3 LYS 63 HE1 LYS 63 -13.078 -16.484 19.815 517 HZ1 LYS 63 HZ1 LYS 63 -14.950 -17.838 20.730 518 HZ2 LYS 63 HZ2 LYS 63 -15.956 -17.143 19.559 519 HZ3 LYS 63 HZ3 LYS 63 -15.219 -16.166 20.724 520 H GLU 64 HN GLU 64 -11.273 -12.126 16.603 521 HA GLU 64 HA GLU 64 -9.612 -11.458 17.978 522 HB2 GLU 64 HB2 GLU 64 -9.682 -14.377 18.486 523 HB3 GLU 64 HB1 GLU 64 -8.236 -13.525 19.011 524 HG2 GLU 64 HG2 GLU 64 -9.690 -13.576 20.856 525 HG3 GLU 64 HG1 GLU 64 -9.746 -11.932 20.228 526 H SER 65 HN SER 65 -9.124 -12.409 15.063 527 HA SER 65 HA SER 65 -6.280 -12.918 15.084 528 HB2 SER 65 HB2 SER 65 -8.094 -12.322 12.731 529 HB3 SER 65 HB1 SER 65 -6.465 -12.993 12.659 530 HG SER 65 HG SER 65 -8.873 -14.207 13.314 531 H THR 66 HN THR 66 -4.742 -11.526 13.970 532 HA THR 66 HA THR 66 -5.458 -8.684 14.254 533 HB THR 66 HB THR 66 -2.653 -9.791 14.332 534 HG1 THR 66 HG1 THR 66 -4.543 -10.273 16.106 535 HG21 THR 66 HG21 THR 66 -3.833 -7.255 15.475 536 HG22 THR 66 HG22 THR 66 -2.965 -7.355 13.944 537 HG23 THR 66 HG23 THR 66 -2.129 -7.712 15.454 538 H LEU 67 HN LEU 67 -5.397 -7.447 12.505 539 HA LEU 67 HA LEU 67 -4.089 -8.504 10.083 540 HB2 LEU 67 HB2 LEU 67 -6.617 -6.946 10.480 541 HB3 LEU 67 HB1 LEU 67 -5.734 -6.784 8.975 542 HG LEU 67 HG LEU 67 -5.876 -9.359 8.848 543 HD11 LEU 67 HD11 LEU 67 -7.803 -10.337 9.967 544 HD12 LEU 67 HD12 LEU 67 -8.102 -8.812 10.802 545 HD13 LEU 67 HD13 LEU 67 -6.632 -9.729 11.136 546 HD21 LEU 67 HD21 LEU 67 -7.065 -7.820 7.366 547 HD22 LEU 67 HD22 LEU 67 -8.366 -7.689 8.549 548 HD23 LEU 67 HD23 LEU 67 -8.045 -9.233 7.760 549 H HIS 68 HN HIS 68 -2.709 -7.190 8.967 550 HA HIS 68 HA HIS 68 -1.907 -4.733 10.344 551 HB2 HIS 68 HB2 HIS 68 -0.498 -6.378 8.231 552 HB3 HIS 68 HB1 HIS 68 0.165 -4.933 8.987 553 HD2 HIS 68 HD2 HIS 68 0.445 -5.283 11.904 554 HE1 HIS 68 HE1 HIS 68 1.136 -9.423 11.387 555 HE2 HIS 68 HE2 HIS 68 1.592 -7.404 12.851 556 H LEU 69 HN LEU 69 -2.416 -2.803 9.530 557 HA LEU 69 HA LEU 69 -3.312 -2.673 6.732 558 HB2 LEU 69 HB2 LEU 69 -4.978 -1.973 8.366 559 HB3 LEU 69 HB1 LEU 69 -3.854 -0.814 9.046 560 HG LEU 69 HG LEU 69 -3.873 0.421 6.886 561 HD11 LEU 69 HD11 LEU 69 -5.628 -0.072 5.261 562 HD12 LEU 69 HD12 LEU 69 -6.074 -1.513 6.176 563 HD13 LEU 69 HD13 LEU 69 -4.489 -1.409 5.406 564 HD21 LEU 69 HD21 LEU 69 -6.523 0.004 8.259 565 HD22 LEU 69 HD22 LEU 69 -6.167 1.325 7.146 566 HD23 LEU 69 HD23 LEU 69 -5.287 1.193 8.668 567 H VAL 70 HN VAL 70 -1.712 -2.110 5.437 568 HA VAL 70 HA VAL 70 0.316 -0.208 6.353 569 HB VAL 70 HB VAL 70 0.196 -1.909 3.855 570 HG11 VAL 70 HG11 VAL 70 2.424 -0.147 4.871 571 HG12 VAL 70 HG12 VAL 70 1.441 0.146 3.437 572 HG13 VAL 70 HG13 VAL 70 2.526 -1.242 3.495 573 HG21 VAL 70 HG21 VAL 70 0.535 -3.235 5.856 574 HG22 VAL 70 HG22 VAL 70 1.843 -2.170 6.368 575 HG23 VAL 70 HG23 VAL 70 2.030 -3.163 4.925 576 H LEU 71 HN LEU 71 0.552 1.801 5.519 577 HA LEU 71 HA LEU 71 -1.571 2.773 3.769 578 HB2 LEU 71 HB2 LEU 71 0.528 4.301 5.315 579 HB3 LEU 71 HB1 LEU 71 -0.811 5.010 4.432 580 HG LEU 71 HG LEU 71 -1.087 3.211 6.842 581 HD11 LEU 71 HD11 LEU 71 -1.384 6.196 6.565 582 HD12 LEU 71 HD12 LEU 71 -0.126 5.344 7.461 583 HD13 LEU 71 HD13 LEU 71 -1.804 5.256 7.995 584 HD21 LEU 71 HD21 LEU 71 -3.430 3.870 6.794 585 HD22 LEU 71 HD22 LEU 71 -2.979 3.057 5.298 586 HD23 LEU 71 HD23 LEU 71 -3.148 4.811 5.331 587 H ARG 72 HN ARG 72 -1.170 2.670 1.688 588 HA ARG 72 HA ARG 72 1.548 2.702 0.649 589 HB2 ARG 72 HB2 ARG 72 0.038 1.072 -0.276 590 HB3 ARG 72 HB1 ARG 72 -1.193 2.286 -0.580 591 HG2 ARG 72 HG2 ARG 72 0.300 3.302 -2.280 592 HG3 ARG 72 HG1 ARG 72 1.432 1.972 -2.021 593 HD2 ARG 72 HD2 ARG 72 -0.880 0.617 -2.438 594 HD3 ARG 72 HD1 ARG 72 -1.131 2.030 -3.463 595 HE ARG 72 HE ARG 72 1.425 1.100 -3.996 596 HH11 ARG 72 HH11 ARG 72 -1.861 -0.035 -4.306 597 HH12 ARG 72 HH12 ARG 72 -1.510 -1.113 -5.618 598 HH21 ARG 72 HH21 ARG 72 1.914 -0.294 -5.737 599 HH22 ARG 72 HH22 ARG 72 0.645 -1.271 -6.427 600 H LEU 73 HN LEU 73 2.191 4.134 -1.101 601 HA LEU 73 HA LEU 73 0.641 6.627 -1.258 602 HB2 LEU 73 HB2 LEU 73 3.504 6.326 -0.432 603 HB3 LEU 73 HB1 LEU 73 2.997 7.766 -1.293 604 HG LEU 73 HG LEU 73 1.120 7.732 0.629 605 HD11 LEU 73 HD11 LEU 73 1.954 5.744 1.723 606 HD12 LEU 73 HD12 LEU 73 2.185 7.148 2.767 607 HD13 LEU 73 HD13 LEU 73 3.554 6.471 1.883 608 HD21 LEU 73 HD21 LEU 73 2.444 9.659 0.156 609 HD22 LEU 73 HD22 LEU 73 3.900 8.883 0.776 610 HD23 LEU 73 HD23 LEU 73 2.595 9.318 1.879 611 H ARG 74 HN ARG 74 1.681 8.090 -3.018 612 HA ARG 74 HA ARG 74 2.116 6.387 -5.370 613 HB2 ARG 74 HB2 ARG 74 1.185 9.244 -5.084 614 HB3 ARG 74 HB1 ARG 74 1.590 8.525 -6.635 615 HG2 ARG 74 HG2 ARG 74 -0.617 7.721 -4.759 616 HG3 ARG 74 HG1 ARG 74 -0.771 8.429 -6.369 617 HD2 ARG 74 HD2 ARG 74 0.714 6.240 -6.925 618 HD3 ARG 74 HD1 ARG 74 -0.233 5.649 -5.561 619 HE ARG 74 HE ARG 74 -1.986 6.911 -7.318 620 HH11 ARG 74 HH11 ARG 74 0.103 4.106 -7.239 621 HH12 ARG 74 HH12 ARG 74 -0.814 3.229 -8.426 622 HH21 ARG 74 HH21 ARG 74 -3.214 5.750 -8.871 623 HH22 ARG 74 HH22 ARG 74 -2.699 4.167 -9.352 624 H GLY 75 HN GLY 75 3.757 8.277 -3.189 625 HA2 GLY 75 HA2 GLY 75 6.276 7.945 -4.075 626 HA3 GLY 75 HA1 GLY 75 5.737 9.350 -4.988 627 H GLY 76 HN GLY 76 7.857 9.591 -3.260 628 HA2 GLY 76 HA2 GLY 76 7.242 11.817 -1.772 629 HA3 GLY 76 HA1 GLY 76 7.041 10.464 -0.665 630 H1 SER 453 HT1 SER 453 20.520 10.819 16.886 631 H2 SER 453 HT2 SER 453 21.759 9.834 17.467 632 H3 SER 453 HT3 SER 453 21.453 11.326 18.199 633 HA SER 453 HA SER 453 20.626 9.502 19.527 634 HB2 SER 453 HB2 SER 453 18.202 10.877 18.449 635 HB3 SER 453 HB1 SER 453 18.686 10.603 20.122 636 HG SER 453 HG SER 453 19.808 12.392 20.108 637 H ASN 454 HN ASN 454 18.650 9.827 16.563 638 HA ASN 454 HA ASN 454 17.575 8.315 15.265 639 HB2 ASN 454 HB2 ASN 454 19.769 6.678 16.417 640 HB3 ASN 454 HB1 ASN 454 18.435 5.810 15.666 641 HD21 ASN 454 HD21 ASN 454 20.058 5.108 14.146 642 HD22 ASN 454 HD22 ASN 454 20.474 6.128 12.817 643 H SER 455 HN SER 455 16.797 8.848 18.148 644 HA SER 455 HA SER 455 15.567 6.531 19.193 645 HB2 SER 455 HB2 SER 455 14.303 9.111 19.840 646 HB3 SER 455 HB1 SER 455 15.007 7.899 20.911 647 HG SER 455 HG SER 455 16.973 8.783 20.669 648 H GLN 456 HN GLN 456 14.435 9.126 17.084 649 HA GLN 456 HA GLN 456 11.720 8.247 17.059 650 HB2 GLN 456 HB2 GLN 456 13.066 9.991 14.994 651 HB3 GLN 456 HB1 GLN 456 11.355 9.927 15.398 652 HG2 GLN 456 HG2 GLN 456 13.579 10.971 17.136 653 HG3 GLN 456 HG1 GLN 456 12.340 11.920 16.318 654 HE21 GLN 456 HE21 GLN 456 13.045 11.677 19.173 655 HE22 GLN 456 HE22 GLN 456 11.578 11.228 19.972 656 H LEU 457 HN LEU 457 14.560 7.651 15.100 657 HA LEU 457 HA LEU 457 13.192 6.342 12.977 658 HB2 LEU 457 HB2 LEU 457 16.078 6.199 13.848 659 HB3 LEU 457 HB1 LEU 457 15.453 5.472 12.379 660 HG LEU 457 HG LEU 457 15.559 8.422 13.021 661 HD11 LEU 457 HD11 LEU 457 17.095 8.500 11.116 662 HD12 LEU 457 HD12 LEU 457 16.997 6.745 10.973 663 HD13 LEU 457 HD13 LEU 457 17.707 7.473 12.413 664 HD21 LEU 457 HD21 LEU 457 13.538 7.958 11.771 665 HD22 LEU 457 HD22 LEU 457 14.447 7.000 10.603 666 HD23 LEU 457 HD23 LEU 457 14.721 8.737 10.721 667 H ASN 458 HN ASN 458 14.834 5.236 15.906 668 HA ASN 458 HA ASN 458 14.609 2.473 15.459 669 HB2 ASN 458 HB2 ASN 458 15.230 4.226 17.722 670 HB3 ASN 458 HB1 ASN 458 14.438 2.728 18.204 671 HD21 ASN 458 HD21 ASN 458 17.140 3.605 18.710 672 HD22 ASN 458 HD22 ASN 458 18.182 2.410 18.023 673 H ALA 459 HN ALA 459 12.477 4.736 17.149 674 HA ALA 459 HA ALA 459 10.560 2.871 17.987 675 HB1 ALA 459 HB1 ALA 459 10.734 5.186 18.836 676 HB2 ALA 459 HB2 ALA 459 9.097 4.760 18.340 677 HB3 ALA 459 HB3 ALA 459 10.100 5.771 17.301 678 H MET 460 HN MET 460 10.712 4.883 15.071 679 HA MET 460 HA MET 460 8.257 4.003 13.987 680 HB2 MET 460 HB2 MET 460 10.634 5.461 12.920 681 HB3 MET 460 HB1 MET 460 9.441 4.838 11.788 682 HG2 MET 460 HG2 MET 460 7.702 6.058 13.167 683 HG3 MET 460 HG1 MET 460 9.048 6.858 13.974 684 HE1 MET 460 HE1 MET 460 10.587 9.107 11.292 685 HE2 MET 460 HE2 MET 460 11.158 7.626 12.057 686 HE3 MET 460 HE3 MET 460 10.347 8.857 13.022 687 H ALA 461 HN ALA 461 11.563 2.818 13.645 688 HA ALA 461 HA ALA 461 11.065 1.031 11.523 689 HB1 ALA 461 HB1 ALA 461 13.153 0.826 13.689 690 HB2 ALA 461 HB2 ALA 461 13.320 1.719 12.176 691 HB3 ALA 461 HB3 ALA 461 13.159 -0.038 12.152 692 H HIS 462 HN HIS 462 11.012 0.593 15.050 693 HA HIS 462 HA HIS 462 10.446 -2.163 15.018 694 HB2 HIS 462 HB2 HIS 462 11.185 -0.706 17.009 695 HB3 HIS 462 HB1 HIS 462 9.479 -0.298 17.179 696 HD2 HIS 462 HD2 HIS 462 7.800 -2.634 17.626 697 HE1 HIS 462 HE1 HIS 462 11.027 -4.819 19.264 698 HE2 HIS 462 HE2 HIS 462 8.553 -4.854 18.726 699 H GLN 463 HN GLN 463 8.414 0.657 14.682 700 HA GLN 463 HA GLN 463 5.905 -0.499 15.146 701 HB2 GLN 463 HB2 GLN 463 6.748 1.753 13.320 702 HB3 GLN 463 HB1 GLN 463 5.068 1.296 13.553 703 HG2 GLN 463 HG2 GLN 463 6.908 2.128 15.780 704 HG3 GLN 463 HG1 GLN 463 5.823 3.225 14.924 705 HE21 GLN 463 HE21 GLN 463 3.586 2.953 15.147 706 HE22 GLN 463 HE22 GLN 463 2.919 2.126 16.509 707 H ILE 464 HN ILE 464 7.898 -0.340 12.248 708 HA ILE 464 HA ILE 464 5.979 -1.674 10.577 709 HB ILE 464 HB ILE 464 8.931 -1.229 10.100 710 HG12 ILE 464 HG12 ILE 464 6.592 0.437 9.153 711 HG13 ILE 464 HG11 ILE 464 7.608 0.853 10.531 712 HG21 ILE 464 HG21 ILE 464 8.361 -1.501 7.734 713 HG22 ILE 464 HG22 ILE 464 6.691 -1.848 8.176 714 HG23 ILE 464 HG23 ILE 464 7.978 -2.951 8.662 715 HD11 ILE 464 HD11 ILE 464 8.274 2.086 8.568 716 HD12 ILE 464 HD12 ILE 464 8.504 0.585 7.675 717 HD13 ILE 464 HD13 ILE 464 9.547 0.968 9.043 718 H GLN 465 HN GLN 465 8.731 -2.588 12.532 719 HA GLN 465 HA GLN 465 9.203 -5.151 11.524 720 HB2 GLN 465 HB2 GLN 465 10.547 -3.780 13.245 721 HB3 GLN 465 HB1 GLN 465 9.457 -4.469 14.440 722 HG2 GLN 465 HG2 GLN 465 11.486 -5.754 14.338 723 HG3 GLN 465 HG1 GLN 465 10.137 -6.718 13.736 724 HE21 GLN 465 HE21 GLN 465 11.322 -8.076 12.465 725 HE22 GLN 465 HE22 GLN 465 12.163 -7.555 11.041 726 H GLU 466 HN GLU 466 6.849 -3.990 13.876 727 HA GLU 466 HA GLU 466 5.927 -6.605 14.617 728 HB2 GLU 466 HB2 GLU 466 4.717 -3.865 15.027 729 HB3 GLU 466 HB1 GLU 466 4.069 -5.344 15.716 730 HG2 GLU 466 HG2 GLU 466 6.832 -4.284 16.260 731 HG3 GLU 466 HG1 GLU 466 5.432 -4.017 17.297 732 H MET 467 HN MET 467 5.387 -4.531 11.983 733 HA MET 467 HA MET 467 2.763 -5.622 11.340 734 HB2 MET 467 HB2 MET 467 4.493 -3.639 9.839 735 HB3 MET 467 HB1 MET 467 2.845 -4.077 9.413 736 HG2 MET 467 HG2 MET 467 3.471 -2.948 12.107 737 HG3 MET 467 HG1 MET 467 3.288 -1.895 10.707 738 HE1 MET 467 HE1 MET 467 1.120 -2.977 8.959 739 HE2 MET 467 HE2 MET 467 1.015 -1.320 9.556 740 HE3 MET 467 HE3 MET 467 -0.389 -2.386 9.656 741 H PHE 468 HN PHE 468 6.063 -5.572 10.073 742 HA PHE 468 HA PHE 468 5.365 -7.856 8.351 743 HB2 PHE 468 HB2 PHE 468 6.923 -5.432 7.852 744 HB3 PHE 468 HB1 PHE 468 7.767 -6.905 7.389 745 HD1 PHE 468 HD1 PHE 468 4.539 -5.121 6.973 746 HD2 PHE 468 HD2 PHE 468 7.302 -7.930 5.365 747 HE1 PHE 468 HE1 PHE 468 3.240 -5.199 4.885 748 HE2 PHE 468 HE2 PHE 468 6.009 -8.011 3.275 749 HZ PHE 468 HZ PHE 468 3.975 -6.646 3.031 750 HA PRO 469 HA PRO 469 8.251 -9.676 11.350 751 HB2 PRO 469 HB2 PRO 469 7.102 -12.103 11.447 752 HB3 PRO 469 HB1 PRO 469 6.389 -10.708 12.281 753 HG2 PRO 469 HG2 PRO 469 5.583 -11.992 9.725 754 HG3 PRO 469 HG1 PRO 469 4.580 -11.304 11.015 755 HD2 PRO 469 HD2 PRO 469 5.223 -10.016 8.648 756 HD3 PRO 469 HD1 PRO 469 4.665 -9.216 10.130 757 H GLN 470 HN GLN 470 8.378 -9.611 8.258 758 HA GLN 470 HA GLN 470 10.195 -11.902 8.027 759 HB2 GLN 470 HB2 GLN 470 9.416 -12.317 5.734 760 HB3 GLN 470 HB1 GLN 470 8.118 -12.521 6.901 761 HG2 GLN 470 HG2 GLN 470 7.475 -10.110 6.322 762 HG3 GLN 470 HG1 GLN 470 8.536 -10.306 4.927 763 HE21 GLN 470 HE21 GLN 470 6.928 -10.192 3.415 764 HE22 GLN 470 HE22 GLN 470 5.703 -11.394 3.225 765 H VAL 471 HN VAL 471 10.428 -8.904 8.420 766 HA VAL 471 HA VAL 471 12.240 -8.434 6.154 767 HB VAL 471 HB VAL 471 10.244 -6.967 6.005 768 HG11 VAL 471 HG11 VAL 471 9.906 -5.163 7.598 769 HG12 VAL 471 HG12 VAL 471 11.237 -5.770 8.586 770 HG13 VAL 471 HG13 VAL 471 9.771 -6.733 8.395 771 HG21 VAL 471 HG21 VAL 471 12.307 -6.206 5.021 772 HG22 VAL 471 HG22 VAL 471 12.852 -5.567 6.570 773 HG23 VAL 471 HG23 VAL 471 11.473 -4.837 5.752 774 HA PRO 472 HA PRO 472 15.344 -8.202 9.343 775 HB2 PRO 472 HB2 PRO 472 16.872 -6.679 7.310 776 HB3 PRO 472 HB1 PRO 472 17.298 -8.186 8.141 777 HG2 PRO 472 HG2 PRO 472 16.620 -8.181 5.576 778 HG3 PRO 472 HG1 PRO 472 16.143 -9.501 6.666 779 HD2 PRO 472 HD2 PRO 472 14.501 -7.230 5.626 780 HD3 PRO 472 HD1 PRO 472 14.054 -8.931 5.878 781 H TYR 473 HN TYR 473 15.492 -6.792 10.937 782 HA TYR 473 HA TYR 473 14.334 -4.271 10.968 783 HB2 TYR 473 HB2 TYR 473 14.903 -5.715 12.945 784 HB3 TYR 473 HB1 TYR 473 16.573 -5.201 12.770 785 HD1 TYR 473 HD2 TYR 473 13.137 -3.900 13.374 786 HD2 TYR 473 HD1 TYR 473 17.321 -3.237 13.796 787 HE1 TYR 473 HE2 TYR 473 12.679 -1.961 14.817 788 HE2 TYR 473 HE1 TYR 473 16.872 -1.302 15.241 789 HH TYR 473 HH TYR 473 15.203 0.220 15.815 790 H HIS 474 HN HIS 474 17.713 -5.164 10.360 791 HA HIS 474 HA HIS 474 18.735 -2.538 10.397 792 HB2 HIS 474 HB2 HIS 474 20.702 -3.461 9.232 793 HB3 HIS 474 HB1 HIS 474 20.226 -4.437 10.613 794 HD2 HIS 474 HD2 HIS 474 20.041 -4.622 6.690 795 HE1 HIS 474 HE1 HIS 474 19.886 -8.519 8.334 796 HE2 HIS 474 HE2 HIS 474 20.209 -7.166 6.213 797 H LEU 475 HN LEU 475 16.960 -4.266 7.974 798 HA LEU 475 HA LEU 475 17.767 -2.521 5.823 799 HB2 LEU 475 HB2 LEU 475 15.806 -4.761 6.102 800 HB3 LEU 475 HB1 LEU 475 15.653 -3.659 4.746 801 HG LEU 475 HG LEU 475 18.029 -5.413 5.382 802 HD11 LEU 475 HD11 LEU 475 16.063 -6.550 4.417 803 HD12 LEU 475 HD12 LEU 475 17.459 -6.560 3.341 804 HD13 LEU 475 HD13 LEU 475 16.125 -5.444 3.046 805 HD21 LEU 475 HD21 LEU 475 18.939 -3.438 4.467 806 HD22 LEU 475 HD22 LEU 475 17.630 -3.286 3.296 807 HD23 LEU 475 HD23 LEU 475 18.821 -4.575 3.124 808 H VAL 476 HN VAL 476 15.080 -2.842 8.048 809 HA VAL 476 HA VAL 476 13.387 -0.891 6.908 810 HB VAL 476 HB VAL 476 13.592 -1.561 9.851 811 HG11 VAL 476 HG11 VAL 476 11.229 -0.952 9.908 812 HG12 VAL 476 HG12 VAL 476 11.280 -0.571 8.186 813 HG13 VAL 476 HG13 VAL 476 12.219 0.390 9.331 814 HG21 VAL 476 HG21 VAL 476 12.053 -2.983 7.682 815 HG22 VAL 476 HG22 VAL 476 11.851 -3.259 9.412 816 HG23 VAL 476 HG23 VAL 476 13.388 -3.635 8.634 817 H LEU 477 HN LEU 477 15.939 -0.752 9.336 818 HA LEU 477 HA LEU 477 15.711 1.935 10.067 819 HB2 LEU 477 HB2 LEU 477 18.025 0.025 10.013 820 HB3 LEU 477 HB1 LEU 477 18.242 1.688 10.522 821 HG LEU 477 HG LEU 477 16.327 -0.250 11.827 822 HD11 LEU 477 HD11 LEU 477 17.996 -0.300 13.653 823 HD12 LEU 477 HD12 LEU 477 19.114 0.588 12.618 824 HD13 LEU 477 HD13 LEU 477 18.583 -1.028 12.159 825 HD21 LEU 477 HD21 LEU 477 15.660 2.048 12.138 826 HD22 LEU 477 HD22 LEU 477 17.299 2.500 12.605 827 HD23 LEU 477 HD23 LEU 477 16.347 1.437 13.643 828 H GLN 478 HN GLN 478 17.292 0.433 7.319 829 HA GLN 478 HA GLN 478 18.789 2.674 6.487 830 HB2 GLN 478 HB2 GLN 478 19.219 0.369 5.701 831 HB3 GLN 478 HB1 GLN 478 17.712 0.416 4.794 832 HG2 GLN 478 HG2 GLN 478 18.576 2.275 3.462 833 HG3 GLN 478 HG1 GLN 478 20.091 2.206 4.360 834 HE21 GLN 478 HE21 GLN 478 18.242 -0.602 3.392 835 HE22 GLN 478 HE22 GLN 478 19.389 -1.191 2.239 836 H ASP 479 HN ASP 479 15.649 1.427 5.312 837 HA ASP 479 HA ASP 479 15.221 3.549 3.500 838 HB2 ASP 479 HB2 ASP 479 14.015 1.344 3.477 839 HB3 ASP 479 HB1 ASP 479 13.073 1.909 4.854 840 H LEU 480 HN LEU 480 14.366 3.091 6.883 841 HA LEU 480 HA LEU 480 12.683 5.303 7.208 842 HB2 LEU 480 HB2 LEU 480 13.888 3.348 8.874 843 HB3 LEU 480 HB1 LEU 480 14.271 4.910 9.567 844 HG LEU 480 HG LEU 480 12.276 4.076 10.606 845 HD11 LEU 480 HD11 LEU 480 11.526 6.224 8.636 846 HD12 LEU 480 HD12 LEU 480 12.377 6.483 10.157 847 HD13 LEU 480 HD13 LEU 480 10.725 5.872 10.165 848 HD21 LEU 480 HD21 LEU 480 11.578 2.512 8.889 849 HD22 LEU 480 HD22 LEU 480 11.137 3.850 7.827 850 HD23 LEU 480 HD23 LEU 480 10.250 3.586 9.329 851 H GLN 481 HN GLN 481 16.142 5.095 6.952 852 HA GLN 481 HA GLN 481 16.629 7.732 8.016 853 HB2 GLN 481 HB2 GLN 481 18.332 5.663 6.652 854 HB3 GLN 481 HB1 GLN 481 18.941 7.286 6.933 855 HG2 GLN 481 HG2 GLN 481 18.797 7.044 9.277 856 HG3 GLN 481 HG1 GLN 481 17.843 5.569 9.133 857 HE21 GLN 481 HE21 GLN 481 18.854 3.652 8.596 858 HE22 GLN 481 HE22 GLN 481 20.571 3.449 8.705 859 H LEU 482 HN LEU 482 15.744 6.387 4.991 860 HA LEU 482 HA LEU 482 16.666 8.743 3.527 861 HB2 LEU 482 HB2 LEU 482 15.950 5.979 2.784 862 HB3 LEU 482 HB1 LEU 482 15.483 7.211 1.630 863 HG LEU 482 HG LEU 482 17.606 6.331 0.973 864 HD11 LEU 482 HD11 LEU 482 18.919 8.307 0.835 865 HD12 LEU 482 HD12 LEU 482 18.161 8.987 2.274 866 HD13 LEU 482 HD13 LEU 482 17.226 8.795 0.791 867 HD21 LEU 482 HD21 LEU 482 18.337 5.378 3.065 868 HD22 LEU 482 HD22 LEU 482 18.538 6.985 3.761 869 HD23 LEU 482 HD23 LEU 482 19.583 6.461 2.440 870 H THR 483 HN THR 483 13.652 6.828 3.743 871 HA THR 483 HA THR 483 12.121 8.974 2.584 872 HB THR 483 HB THR 483 10.163 7.513 3.057 873 HG1 THR 483 HG1 THR 483 11.501 5.259 3.663 874 HG21 THR 483 HG21 THR 483 10.836 5.682 1.526 875 HG22 THR 483 HG22 THR 483 12.514 6.205 1.681 876 HG23 THR 483 HG23 THR 483 11.319 7.273 0.943 877 H ARG 484 HN ARG 484 12.582 7.590 5.788 878 HA ARG 484 HA ARG 484 12.095 8.331 7.877 879 HB2 ARG 484 HB2 ARG 484 11.802 11.033 6.545 880 HB3 ARG 484 HB1 ARG 484 12.013 10.746 8.268 881 HG2 ARG 484 HG2 ARG 484 14.225 10.512 8.080 882 HG3 ARG 484 HG1 ARG 484 14.093 9.534 6.617 883 HD2 ARG 484 HD2 ARG 484 13.500 11.739 5.440 884 HD3 ARG 484 HD1 ARG 484 14.143 12.521 6.883 885 HE ARG 484 HE ARG 484 16.043 10.680 6.008 886 HH11 ARG 484 HH11 ARG 484 14.539 13.631 4.867 887 HH12 ARG 484 HH12 ARG 484 15.919 14.121 3.936 888 HH21 ARG 484 HH21 ARG 484 17.848 11.311 4.755 889 HH22 ARG 484 HH22 ARG 484 17.796 12.802 3.871 890 H SER 485 HN SER 485 10.027 7.254 6.294 891 HA SER 485 HA SER 485 7.726 8.264 7.738 892 HB2 SER 485 HB2 SER 485 7.406 9.630 5.849 893 HB3 SER 485 HB1 SER 485 8.012 8.402 4.742 894 HG SER 485 HG SER 485 5.613 8.069 6.231 895 H VAL 486 HN VAL 486 7.029 6.457 8.674 896 HA VAL 486 HA VAL 486 7.658 3.857 7.966 897 HB VAL 486 HB VAL 486 5.656 3.175 9.361 898 HG11 VAL 486 HG11 VAL 486 6.651 4.006 11.459 899 HG12 VAL 486 HG12 VAL 486 7.652 5.111 10.517 900 HG13 VAL 486 HG13 VAL 486 7.849 3.368 10.334 901 HG21 VAL 486 HG21 VAL 486 4.235 5.103 8.947 902 HG22 VAL 486 HG22 VAL 486 5.412 6.159 9.728 903 HG23 VAL 486 HG23 VAL 486 4.561 4.938 10.671 904 H GLU 487 HN GLU 487 5.011 5.855 6.851 905 HA GLU 487 HA GLU 487 3.435 3.822 5.705 906 HB2 GLU 487 HB2 GLU 487 3.651 6.632 4.636 907 HB3 GLU 487 HB1 GLU 487 2.264 5.557 4.584 908 HG2 GLU 487 HG2 GLU 487 1.560 6.821 6.302 909 HG3 GLU 487 HG1 GLU 487 2.593 5.747 7.240 910 H ILE 488 HN ILE 488 5.717 6.071 4.141 911 HA ILE 488 HA ILE 488 5.634 4.788 1.616 912 HB ILE 488 HB ILE 488 7.926 6.479 2.609 913 HG12 ILE 488 HG12 ILE 488 5.341 7.462 1.380 914 HG13 ILE 488 HG11 ILE 488 5.735 7.584 3.090 915 HG21 ILE 488 HG21 ILE 488 6.736 6.067 -0.134 916 HG22 ILE 488 HG22 ILE 488 8.253 5.385 0.455 917 HG23 ILE 488 HG23 ILE 488 8.089 7.130 0.252 918 HD11 ILE 488 HD11 ILE 488 7.262 8.877 0.844 919 HD12 ILE 488 HD12 ILE 488 7.619 9.026 2.564 920 HD13 ILE 488 HD13 ILE 488 6.117 9.683 1.914 921 H THR 489 HN THR 489 7.475 4.206 4.488 922 HA THR 489 HA THR 489 9.634 2.792 3.283 923 HB THR 489 HB THR 489 8.601 2.675 6.124 924 HG1 THR 489 HG1 THR 489 10.759 4.087 4.892 925 HG21 THR 489 HG21 THR 489 9.838 0.664 5.717 926 HG22 THR 489 HG22 THR 489 10.885 1.757 6.622 927 HG23 THR 489 HG23 THR 489 11.112 1.550 4.885 928 H THR 490 HN THR 490 6.766 1.639 5.067 929 HA THR 490 HA THR 490 7.220 -1.091 4.559 930 HB THR 490 HB THR 490 4.456 0.036 4.897 931 HG1 THR 490 HG1 THR 490 5.576 1.126 6.477 932 HG21 THR 490 HG21 THR 490 4.696 -2.385 4.632 933 HG22 THR 490 HG22 THR 490 4.163 -1.983 6.266 934 HG23 THR 490 HG23 THR 490 5.846 -2.424 5.971 935 H ASP 491 HN ASP 491 5.585 1.432 2.771 936 HA ASP 491 HA ASP 491 4.356 -0.243 0.842 937 HB2 ASP 491 HB2 ASP 491 3.923 2.267 1.410 938 HB3 ASP 491 HB1 ASP 491 5.217 2.570 0.254 939 H ASN 492 HN ASN 492 7.432 1.470 1.008 940 HA ASN 492 HA ASN 492 8.404 1.019 -1.551 941 HB2 ASN 492 HB2 ASN 492 9.594 1.572 1.097 942 HB3 ASN 492 HB1 ASN 492 10.674 0.804 -0.059 943 HD21 ASN 492 HD21 ASN 492 11.360 3.211 0.819 944 HD22 ASN 492 HD22 ASN 492 11.082 4.421 -0.394 945 H ILE 493 HN ILE 493 8.643 -1.020 1.336 946 HA ILE 493 HA ILE 493 10.174 -3.086 0.184 947 HB ILE 493 HB ILE 493 8.140 -3.377 2.402 948 HG12 ILE 493 HG12 ILE 493 11.084 -2.772 2.698 949 HG13 ILE 493 HG11 ILE 493 9.845 -1.523 2.727 950 HG21 ILE 493 HG21 ILE 493 9.512 -5.251 3.125 951 HG22 ILE 493 HG22 ILE 493 10.628 -4.970 1.789 952 HG23 ILE 493 HG23 ILE 493 8.975 -5.488 1.461 953 HD11 ILE 493 HD11 ILE 493 10.040 -3.839 4.635 954 HD12 ILE 493 HD12 ILE 493 8.837 -2.551 4.681 955 HD13 ILE 493 HD13 ILE 493 10.537 -2.182 4.967 956 H LEU 494 HN LEU 494 6.684 -2.602 0.457 957 HA LEU 494 HA LEU 494 5.928 -5.089 -0.657 958 HB2 LEU 494 HB2 LEU 494 4.637 -2.653 0.232 959 HB3 LEU 494 HB1 LEU 494 3.868 -3.308 -1.200 960 HG LEU 494 HG LEU 494 4.392 -5.359 0.800 961 HD11 LEU 494 HD11 LEU 494 2.583 -4.593 2.328 962 HD12 LEU 494 HD12 LEU 494 2.659 -3.016 1.547 963 HD13 LEU 494 HD13 LEU 494 4.057 -3.634 2.417 964 HD21 LEU 494 HD21 LEU 494 2.274 -4.486 -1.055 965 HD22 LEU 494 HD22 LEU 494 1.732 -5.333 0.397 966 HD23 LEU 494 HD23 LEU 494 2.881 -6.104 -0.698 967 H GLU 495 HN GLU 495 6.488 -1.899 -2.092 968 HA GLU 495 HA GLU 495 5.593 -2.675 -4.689 969 HB2 GLU 495 HB2 GLU 495 7.315 -0.359 -3.798 970 HB3 GLU 495 HB1 GLU 495 6.737 -0.580 -5.444 971 HG2 GLU 495 HG2 GLU 495 4.969 -0.285 -3.026 972 HG3 GLU 495 HG1 GLU 495 5.389 1.019 -4.135 973 H GLY 496 HN GLY 496 8.606 -2.942 -2.984 974 HA2 GLY 496 HA2 GLY 496 10.148 -4.660 -3.729 975 HA3 GLY 496 HA1 GLY 496 9.743 -4.234 -5.382 976 H ARG 497 HN ARG 497 10.314 -1.753 -3.014 977 HA ARG 497 HA ARG 497 12.458 -0.662 -4.570 978 HB2 ARG 497 HB2 ARG 497 10.833 0.712 -3.246 979 HB3 ARG 497 HB1 ARG 497 11.588 0.109 -1.779 980 HG2 ARG 497 HG2 ARG 497 12.757 2.028 -1.954 981 HG3 ARG 497 HG1 ARG 497 13.761 1.047 -3.025 982 HD2 ARG 497 HD2 ARG 497 13.295 3.134 -4.117 983 HD3 ARG 497 HD1 ARG 497 12.408 1.853 -4.941 984 HE ARG 497 HE ARG 497 10.895 3.213 -2.897 985 HH11 ARG 497 HH11 ARG 497 11.785 3.147 -6.281 986 HH12 ARG 497 HH12 ARG 497 10.436 4.112 -6.788 987 HH21 ARG 497 HH21 ARG 497 9.106 4.463 -3.552 988 HH22 ARG 497 HH22 ARG 497 8.907 4.866 -5.232 989 H ILE 498 HN ILE 498 12.208 -2.176 -1.378 990 HA ILE 498 HA ILE 498 15.107 -2.319 -1.167 991 HB ILE 498 HB ILE 498 12.931 -3.144 0.767 992 HG12 ILE 498 HG12 ILE 498 14.380 -1.288 2.068 993 HG13 ILE 498 HG11 ILE 498 14.636 -0.737 0.417 994 HG21 ILE 498 HG21 ILE 498 14.853 -4.630 0.996 995 HG22 ILE 498 HG22 ILE 498 14.721 -3.555 2.388 996 HG23 ILE 498 HG23 ILE 498 15.926 -3.238 1.139 997 HD11 ILE 498 HD11 ILE 498 12.023 -1.039 1.861 998 HD12 ILE 498 HD12 ILE 498 12.158 -0.725 0.132 999 HD13 ILE 498 HD13 ILE 498 12.783 0.445 1.294 1000 H GLN 499 HN GLN 499 16.145 -3.966 -2.006 1001 HA GLN 499 HA GLN 499 14.880 -6.223 -3.114 1002 HB2 GLN 499 HB2 GLN 499 17.797 -5.863 -2.401 1003 HB3 GLN 499 HB1 GLN 499 17.146 -7.087 -3.480 1004 HG2 GLN 499 HG2 GLN 499 17.105 -4.112 -3.922 1005 HG3 GLN 499 HG1 GLN 499 18.135 -5.283 -4.742 1006 HE21 GLN 499 HE21 GLN 499 16.260 -3.410 -5.877 1007 HE22 GLN 499 HE22 GLN 499 15.103 -4.338 -6.760 1008 H VAL 500 HN VAL 500 13.984 -7.821 -2.049 1009 HA VAL 500 HA VAL 500 14.484 -8.396 0.686 1010 HB VAL 500 HB VAL 500 13.027 -10.385 0.302 1011 HG11 VAL 500 HG11 VAL 500 12.045 -8.259 0.918 1012 HG12 VAL 500 HG12 VAL 500 10.992 -9.101 -0.219 1013 HG13 VAL 500 HG13 VAL 500 11.997 -7.762 -0.772 1014 HG21 VAL 500 HG21 VAL 500 12.937 -9.384 -2.545 1015 HG22 VAL 500 HG22 VAL 500 11.934 -10.667 -1.873 1016 HG23 VAL 500 HG23 VAL 500 13.678 -10.887 -2.000 1017 HA PRO 501 HA PRO 501 17.844 -11.257 0.725 1018 HB2 PRO 501 HB2 PRO 501 16.037 -13.268 1.985 1019 HB3 PRO 501 HB1 PRO 501 17.602 -12.646 2.545 1020 HG2 PRO 501 HG2 PRO 501 15.364 -11.858 3.705 1021 HG3 PRO 501 HG1 PRO 501 16.692 -10.718 3.409 1022 HD2 PRO 501 HD2 PRO 501 14.114 -11.023 1.948 1023 HD3 PRO 501 HD1 PRO 501 15.025 -9.550 2.339 1024 H PHE 502 HN PHE 502 18.224 -11.813 -1.364 1025 HA PHE 502 HA PHE 502 16.560 -13.815 -2.669 1026 HB2 PHE 502 HB2 PHE 502 17.324 -11.721 -3.846 1027 HB3 PHE 502 HB1 PHE 502 18.967 -12.346 -3.774 1028 HD1 PHE 502 HD1 PHE 502 15.581 -13.043 -5.094 1029 HD2 PHE 502 HD2 PHE 502 19.746 -13.843 -5.393 1030 HE1 PHE 502 HE1 PHE 502 15.192 -14.260 -7.199 1031 HE2 PHE 502 HE2 PHE 502 19.370 -15.055 -7.497 1032 HZ PHE 502 HZ PHE 502 17.088 -15.265 -8.404 1033 HA PRO 503 HA PRO 503 19.341 -17.115 -1.627 1034 HB2 PRO 503 HB2 PRO 503 18.582 -18.890 -3.562 1035 HB3 PRO 503 HB1 PRO 503 17.627 -18.569 -2.103 1036 HG2 PRO 503 HG2 PRO 503 17.265 -17.521 -4.862 1037 HG3 PRO 503 HG1 PRO 503 16.048 -18.063 -3.689 1038 HD2 PRO 503 HD2 PRO 503 16.571 -15.453 -4.136 1039 HD3 PRO 503 HD1 PRO 503 16.052 -16.073 -2.556 1040 H THR 504 HN THR 504 21.071 -15.586 -2.465 1041 HA THR 504 HA THR 504 22.390 -16.824 -4.782 1042 HB THR 504 HB THR 504 21.609 -14.681 -5.561 1043 HG1 THR 504 HG1 THR 504 24.355 -14.327 -4.890 1044 HG21 THR 504 HG21 THR 504 21.215 -13.576 -3.435 1045 HG22 THR 504 HG22 THR 504 22.236 -12.571 -4.461 1046 HG23 THR 504 HG23 THR 504 22.951 -13.490 -3.137 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 -18.231 -11.066 14.357 2 H2 MET 1 HT2 MET 1 -18.225 -12.693 13.884 3 H3 MET 1 HT3 MET 1 -17.393 -11.541 12.964 4 HA MET 1 HA MET 1 -16.756 -12.283 15.754 5 HB2 MET 1 HB2 MET 1 -14.810 -13.425 14.892 6 HB3 MET 1 HB1 MET 1 -16.247 -14.084 14.120 7 HG2 MET 1 HG2 MET 1 -15.769 -12.649 12.152 8 HG3 MET 1 HG1 MET 1 -14.263 -12.160 12.929 9 HE1 MET 1 HE1 MET 1 -12.891 -14.500 10.158 10 HE2 MET 1 HE2 MET 1 -12.766 -12.925 10.945 11 HE3 MET 1 HE3 MET 1 -14.218 -13.346 10.036 12 H GLN 2 HN GLN 2 -14.801 -11.306 16.538 13 HA GLN 2 HA GLN 2 -14.472 -8.620 15.447 14 HB2 GLN 2 HB2 GLN 2 -13.934 -9.895 18.101 15 HB3 GLN 2 HB1 GLN 2 -13.128 -8.390 17.676 16 HG2 GLN 2 HG2 GLN 2 -16.099 -8.688 17.458 17 HG3 GLN 2 HG1 GLN 2 -15.320 -8.260 18.981 18 HE21 GLN 2 HE21 GLN 2 -17.097 -6.825 16.979 19 HE22 GLN 2 HE22 GLN 2 -16.282 -5.316 16.721 20 H ILE 3 HN ILE 3 -12.622 -7.805 14.697 21 HA ILE 3 HA ILE 3 -10.240 -9.540 14.677 22 HB ILE 3 HB ILE 3 -9.665 -8.544 12.455 23 HG12 ILE 3 HG12 ILE 3 -12.564 -7.706 12.326 24 HG13 ILE 3 HG11 ILE 3 -11.270 -6.590 12.751 25 HG21 ILE 3 HG21 ILE 3 -11.209 -9.972 11.166 26 HG22 ILE 3 HG22 ILE 3 -12.211 -10.154 12.607 27 HG23 ILE 3 HG23 ILE 3 -10.563 -10.782 12.594 28 HD11 ILE 3 HD11 ILE 3 -11.454 -8.132 10.174 29 HD12 ILE 3 HD12 ILE 3 -10.234 -6.930 10.595 30 HD13 ILE 3 HD13 ILE 3 -11.916 -6.442 10.393 31 H PHE 4 HN PHE 4 -8.201 -8.360 14.530 32 HA PHE 4 HA PHE 4 -8.448 -5.673 15.713 33 HB2 PHE 4 HB2 PHE 4 -6.264 -7.733 16.084 34 HB3 PHE 4 HB1 PHE 4 -6.230 -6.102 16.749 35 HD1 PHE 4 HD1 PHE 4 -8.182 -5.444 18.295 36 HD2 PHE 4 HD2 PHE 4 -7.197 -9.462 17.301 37 HE1 PHE 4 HE1 PHE 4 -9.392 -6.234 20.288 38 HE2 PHE 4 HE2 PHE 4 -8.404 -10.255 19.286 39 HZ PHE 4 HZ PHE 4 -9.505 -8.642 20.785 40 H VAL 5 HN VAL 5 -8.246 -4.324 14.009 41 HA VAL 5 HA VAL 5 -6.205 -4.805 11.993 42 HB VAL 5 HB VAL 5 -8.061 -2.430 12.259 43 HG11 VAL 5 HG11 VAL 5 -7.598 -2.070 9.895 44 HG12 VAL 5 HG12 VAL 5 -6.516 -3.465 9.882 45 HG13 VAL 5 HG13 VAL 5 -6.107 -2.038 10.837 46 HG21 VAL 5 HG21 VAL 5 -9.374 -4.466 12.074 47 HG22 VAL 5 HG22 VAL 5 -8.439 -4.962 10.663 48 HG23 VAL 5 HG23 VAL 5 -9.470 -3.533 10.580 49 H LYS 6 HN LYS 6 -4.201 -4.038 12.173 50 HA LYS 6 HA LYS 6 -3.734 -1.854 14.095 51 HB2 LYS 6 HB2 LYS 6 -1.965 -4.151 13.260 52 HB3 LYS 6 HB1 LYS 6 -1.369 -2.765 14.160 53 HG2 LYS 6 HG2 LYS 6 -2.917 -3.271 15.983 54 HG3 LYS 6 HG1 LYS 6 -3.526 -4.657 15.078 55 HD2 LYS 6 HD2 LYS 6 -1.353 -5.716 15.171 56 HD3 LYS 6 HD1 LYS 6 -0.665 -4.298 15.960 57 HE2 LYS 6 HE2 LYS 6 -1.084 -6.003 17.614 58 HE3 LYS 6 HE1 LYS 6 -2.199 -4.662 17.868 59 HZ1 LYS 6 HZ1 LYS 6 -3.343 -6.758 18.072 60 HZ2 LYS 6 HZ2 LYS 6 -2.836 -7.246 16.532 61 HZ3 LYS 6 HZ3 LYS 6 -3.908 -5.947 16.701 62 H THR 7 HN THR 7 -2.575 -0.104 13.485 63 HA THR 7 HA THR 7 -1.964 0.114 10.616 64 HB THR 7 HB THR 7 -2.007 2.649 11.225 65 HG1 THR 7 HG1 THR 7 -3.639 1.575 13.309 66 HG21 THR 7 HG21 THR 7 -4.534 1.000 11.143 67 HG22 THR 7 HG22 THR 7 -3.633 1.596 9.750 68 HG23 THR 7 HG23 THR 7 -4.435 2.733 10.834 69 H LEU 8 HN LEU 8 -0.201 1.762 10.145 70 HA LEU 8 HA LEU 8 2.195 0.935 11.451 71 HB2 LEU 8 HB2 LEU 8 1.688 3.090 9.399 72 HB3 LEU 8 HB1 LEU 8 3.281 2.576 9.924 73 HG LEU 8 HG LEU 8 1.294 0.698 8.650 74 HD11 LEU 8 HD11 LEU 8 3.548 2.185 7.320 75 HD12 LEU 8 HD12 LEU 8 1.835 2.548 7.119 76 HD13 LEU 8 HD13 LEU 8 2.479 1.001 6.569 77 HD21 LEU 8 HD21 LEU 8 3.192 -0.728 8.326 78 HD22 LEU 8 HD22 LEU 8 3.131 -0.263 10.025 79 HD23 LEU 8 HD23 LEU 8 4.288 0.508 8.942 80 H THR 9 HN THR 9 -0.085 3.302 12.164 81 HA THR 9 HA THR 9 1.773 5.133 13.429 82 HB THR 9 HB THR 9 -0.651 5.985 14.252 83 HG1 THR 9 HG1 THR 9 -2.204 5.464 12.770 84 HG21 THR 9 HG21 THR 9 0.964 7.317 12.993 85 HG22 THR 9 HG22 THR 9 -0.647 7.485 12.297 86 HG23 THR 9 HG23 THR 9 0.550 6.449 11.518 87 H GLY 10 HN GLY 10 0.484 2.200 14.202 88 HA2 GLY 10 HA2 GLY 10 0.685 1.031 16.199 89 HA3 GLY 10 HA1 GLY 10 1.084 2.539 17.014 90 H LYS 11 HN LYS 11 -1.724 2.451 15.028 91 HA LYS 11 HA LYS 11 -3.405 2.673 17.421 92 HB2 LYS 11 HB2 LYS 11 -3.401 4.513 15.739 93 HB3 LYS 11 HB1 LYS 11 -4.031 3.385 14.549 94 HG2 LYS 11 HG2 LYS 11 -6.003 3.047 16.068 95 HG3 LYS 11 HG1 LYS 11 -5.391 4.395 17.031 96 HD2 LYS 11 HD2 LYS 11 -5.404 5.760 14.903 97 HD3 LYS 11 HD1 LYS 11 -6.292 4.429 14.157 98 HE2 LYS 11 HE2 LYS 11 -7.903 6.011 14.864 99 HE3 LYS 11 HE1 LYS 11 -7.984 4.668 16.003 100 HZ1 LYS 11 HZ1 LYS 11 -6.858 5.905 17.627 101 HZ2 LYS 11 HZ2 LYS 11 -8.013 6.962 16.991 102 HZ3 LYS 11 HZ3 LYS 11 -6.392 7.104 16.532 103 H THR 12 HN THR 12 -4.871 1.137 17.904 104 HA THR 12 HA THR 12 -5.206 -1.059 15.982 105 HB THR 12 HB THR 12 -5.935 -1.119 18.909 106 HG1 THR 12 HG1 THR 12 -3.666 -0.692 18.595 107 HG21 THR 12 HG21 THR 12 -6.964 -2.857 17.527 108 HG22 THR 12 HG22 THR 12 -5.756 -3.554 18.606 109 HG23 THR 12 HG23 THR 12 -5.378 -3.310 16.902 110 H ILE 13 HN ILE 13 -7.083 -1.369 15.012 111 HA ILE 13 HA ILE 13 -9.457 0.029 16.054 112 HB ILE 13 HB ILE 13 -8.841 -0.690 13.181 113 HG12 ILE 13 HG12 ILE 13 -9.104 2.002 13.195 114 HG13 ILE 13 HG11 ILE 13 -8.410 1.757 14.793 115 HG21 ILE 13 HG21 ILE 13 -11.163 0.844 14.342 116 HG22 ILE 13 HG22 ILE 13 -11.226 -0.789 13.682 117 HG23 ILE 13 HG23 ILE 13 -10.856 0.575 12.626 118 HD11 ILE 13 HD11 ILE 13 -6.487 0.655 13.827 119 HD12 ILE 13 HD12 ILE 13 -6.719 2.232 13.071 120 HD13 ILE 13 HD13 ILE 13 -7.201 0.766 12.218 121 H THR 14 HN THR 14 -11.165 -1.203 16.583 122 HA THR 14 HA THR 14 -11.044 -4.061 15.925 123 HB THR 14 HB THR 14 -13.099 -3.767 17.740 124 HG1 THR 14 HG1 THR 14 -12.611 -1.634 18.223 125 HG21 THR 14 HG21 THR 14 -11.386 -5.488 17.810 126 HG22 THR 14 HG22 THR 14 -11.483 -4.677 19.373 127 HG23 THR 14 HG23 THR 14 -10.172 -4.291 18.259 128 H LEU 15 HN LEU 15 -12.508 -4.969 14.611 129 HA LEU 15 HA LEU 15 -14.952 -3.470 13.985 130 HB2 LEU 15 HB2 LEU 15 -12.827 -4.383 12.114 131 HB3 LEU 15 HB1 LEU 15 -14.490 -4.488 11.574 132 HG LEU 15 HG LEU 15 -13.382 -1.914 12.655 133 HD11 LEU 15 HD11 LEU 15 -12.878 -1.249 10.357 134 HD12 LEU 15 HD12 LEU 15 -13.263 -2.878 9.799 135 HD13 LEU 15 HD13 LEU 15 -11.883 -2.613 10.866 136 HD21 LEU 15 HD21 LEU 15 -15.789 -2.062 12.446 137 HD22 LEU 15 HD22 LEU 15 -15.638 -2.613 10.778 138 HD23 LEU 15 HD23 LEU 15 -15.150 -0.975 11.212 139 H GLU 16 HN GLU 16 -16.744 -4.648 13.563 140 HA GLU 16 HA GLU 16 -16.601 -7.498 14.189 141 HB2 GLU 16 HB2 GLU 16 -18.207 -6.018 15.406 142 HB3 GLU 16 HB1 GLU 16 -19.025 -5.704 13.881 143 HG2 GLU 16 HG2 GLU 16 -20.295 -7.338 14.990 144 HG3 GLU 16 HG1 GLU 16 -19.418 -8.187 13.716 145 H VAL 17 HN VAL 17 -16.268 -8.754 12.462 146 HA VAL 17 HA VAL 17 -17.940 -8.315 10.089 147 HB VAL 17 HB VAL 17 -15.987 -8.985 8.640 148 HG11 VAL 17 HG11 VAL 17 -14.948 -6.737 8.649 149 HG12 VAL 17 HG12 VAL 17 -15.789 -6.387 10.159 150 HG13 VAL 17 HG13 VAL 17 -16.712 -6.687 8.686 151 HG21 VAL 17 HG21 VAL 17 -13.730 -8.613 9.547 152 HG22 VAL 17 HG22 VAL 17 -14.559 -9.950 10.346 153 HG23 VAL 17 HG23 VAL 17 -14.426 -8.384 11.150 154 H GLU 18 HN GLU 18 -18.034 -10.238 8.691 155 HA GLU 18 HA GLU 18 -17.776 -12.709 10.274 156 HB2 GLU 18 HB2 GLU 18 -19.754 -11.937 8.117 157 HB3 GLU 18 HB1 GLU 18 -19.554 -13.591 8.684 158 HG2 GLU 18 HG2 GLU 18 -20.478 -11.214 10.278 159 HG3 GLU 18 HG1 GLU 18 -21.424 -12.623 9.804 160 HA PRO 19 HA PRO 19 -14.833 -14.351 7.443 161 HB2 PRO 19 HB2 PRO 19 -16.536 -16.767 7.141 162 HB3 PRO 19 HB1 PRO 19 -14.848 -16.637 7.669 163 HG2 PRO 19 HG2 PRO 19 -16.782 -17.162 9.405 164 HG3 PRO 19 HG1 PRO 19 -15.408 -16.122 9.830 165 HD2 PRO 19 HD2 PRO 19 -18.218 -15.363 9.192 166 HD3 PRO 19 HD1 PRO 19 -17.081 -14.644 10.351 167 H SER 20 HN SER 20 -18.203 -14.494 6.556 168 HA SER 20 HA SER 20 -17.753 -15.014 3.780 169 HB2 SER 20 HB2 SER 20 -20.341 -13.989 4.110 170 HB3 SER 20 HB1 SER 20 -19.870 -15.688 4.059 171 HG SER 20 HG SER 20 -20.440 -15.784 6.072 172 H ASP 21 HN ASP 21 -17.175 -12.275 5.530 173 HA ASP 21 HA ASP 21 -18.263 -10.358 3.651 174 HB2 ASP 21 HB2 ASP 21 -17.926 -9.997 6.193 175 HB3 ASP 21 HB1 ASP 21 -16.236 -9.707 5.781 176 H THR 22 HN THR 22 -17.169 -9.279 2.091 177 HA THR 22 HA THR 22 -14.697 -10.446 1.177 178 HB THR 22 HB THR 22 -15.448 -8.126 -0.333 179 HG1 THR 22 HG1 THR 22 -17.585 -8.684 -0.822 180 HG21 THR 22 HG21 THR 22 -15.730 -11.071 -0.956 181 HG22 THR 22 HG22 THR 22 -14.266 -10.117 -1.191 182 HG23 THR 22 HG23 THR 22 -15.714 -9.751 -2.128 183 H ILE 23 HN ILE 23 -12.733 -9.393 0.912 184 HA ILE 23 HA ILE 23 -11.886 -7.657 2.911 185 HB ILE 23 HB ILE 23 -10.633 -8.038 0.187 186 HG12 ILE 23 HG12 ILE 23 -10.984 -10.174 1.337 187 HG13 ILE 23 HG11 ILE 23 -9.272 -9.775 1.261 188 HG21 ILE 23 HG21 ILE 23 -8.544 -7.391 1.258 189 HG22 ILE 23 HG22 ILE 23 -9.398 -7.116 2.776 190 HG23 ILE 23 HG23 ILE 23 -9.741 -6.100 1.377 191 HD11 ILE 23 HD11 ILE 23 -11.089 -9.553 3.649 192 HD12 ILE 23 HD12 ILE 23 -9.435 -8.945 3.602 193 HD13 ILE 23 HD13 ILE 23 -9.744 -10.671 3.416 194 H GLU 24 HN GLU 24 -13.063 -6.972 -0.324 195 HA GLU 24 HA GLU 24 -12.407 -4.275 -0.526 196 HB2 GLU 24 HB2 GLU 24 -13.447 -5.917 -2.257 197 HB3 GLU 24 HB1 GLU 24 -14.986 -5.383 -1.602 198 HG2 GLU 24 HG2 GLU 24 -13.124 -3.240 -2.366 199 HG3 GLU 24 HG1 GLU 24 -13.739 -4.226 -3.687 200 H ASN 25 HN ASN 25 -15.194 -5.844 0.966 201 HA ASN 25 HA ASN 25 -16.579 -3.423 1.566 202 HB2 ASN 25 HB2 ASN 25 -17.667 -5.679 1.361 203 HB3 ASN 25 HB1 ASN 25 -16.916 -6.119 2.893 204 HD21 ASN 25 HD21 ASN 25 -18.793 -6.398 3.999 205 HD22 ASN 25 HD22 ASN 25 -19.872 -5.093 4.390 206 H VAL 26 HN VAL 26 -14.339 -5.512 3.299 207 HA VAL 26 HA VAL 26 -14.581 -4.386 5.851 208 HB VAL 26 HB VAL 26 -12.113 -5.606 4.590 209 HG11 VAL 26 HG11 VAL 26 -11.553 -4.341 6.588 210 HG12 VAL 26 HG12 VAL 26 -11.419 -6.071 6.899 211 HG13 VAL 26 HG13 VAL 26 -12.816 -5.175 7.493 212 HG21 VAL 26 HG21 VAL 26 -14.000 -7.130 4.513 213 HG22 VAL 26 HG22 VAL 26 -14.318 -6.861 6.227 214 HG23 VAL 26 HG23 VAL 26 -12.836 -7.673 5.720 215 H LYS 27 HN LYS 27 -12.517 -3.500 3.115 216 HA LYS 27 HA LYS 27 -11.019 -1.523 4.447 217 HB2 LYS 27 HB2 LYS 27 -11.670 -1.933 1.535 218 HB3 LYS 27 HB1 LYS 27 -10.622 -0.637 2.096 219 HG2 LYS 27 HG2 LYS 27 -9.250 -2.451 3.234 220 HG3 LYS 27 HG1 LYS 27 -10.171 -3.597 2.261 221 HD2 LYS 27 HD2 LYS 27 -8.501 -1.318 1.197 222 HD3 LYS 27 HD1 LYS 27 -8.041 -3.020 1.191 223 HE2 LYS 27 HE2 LYS 27 -10.232 -3.375 -0.117 224 HE3 LYS 27 HE1 LYS 27 -10.176 -1.631 -0.384 225 HZ1 LYS 27 HZ1 LYS 27 -7.732 -3.101 -0.959 226 HZ2 LYS 27 HZ2 LYS 27 -8.446 -1.819 -1.796 227 HZ3 LYS 27 HZ3 LYS 27 -9.034 -3.397 -2.000 228 H ALA 28 HN ALA 28 -14.153 -1.397 2.844 229 HA ALA 28 HA ALA 28 -14.391 1.425 2.775 230 HB1 ALA 28 HB1 ALA 28 -15.864 0.150 1.412 231 HB2 ALA 28 HB2 ALA 28 -16.861 0.949 2.628 232 HB3 ALA 28 HB3 ALA 28 -16.463 -0.761 2.797 233 H LYS 29 HN LYS 29 -15.092 -1.017 5.187 234 HA LYS 29 HA LYS 29 -16.473 0.673 7.002 235 HB2 LYS 29 HB2 LYS 29 -14.965 -1.912 7.465 236 HB3 LYS 29 HB1 LYS 29 -16.016 -1.142 8.648 237 HG2 LYS 29 HG2 LYS 29 -17.936 -1.507 7.309 238 HG3 LYS 29 HG1 LYS 29 -16.956 -1.992 5.925 239 HD2 LYS 29 HD2 LYS 29 -16.189 -3.966 7.203 240 HD3 LYS 29 HD1 LYS 29 -17.251 -3.490 8.533 241 HE2 LYS 29 HE2 LYS 29 -19.171 -3.625 6.974 242 HE3 LYS 29 HE1 LYS 29 -18.078 -4.209 5.723 243 HZ1 LYS 29 HZ1 LYS 29 -17.780 -6.217 6.790 244 HZ2 LYS 29 HZ2 LYS 29 -19.414 -5.895 7.095 245 HZ3 LYS 29 HZ3 LYS 29 -18.266 -5.620 8.301 246 H ILE 30 HN ILE 30 -13.099 -0.100 6.450 247 HA ILE 30 HA ILE 30 -12.116 1.158 8.813 248 HB ILE 30 HB ILE 30 -10.635 0.656 6.222 249 HG12 ILE 30 HG12 ILE 30 -10.819 -1.076 8.701 250 HG13 ILE 30 HG11 ILE 30 -11.644 -1.399 7.178 251 HG21 ILE 30 HG21 ILE 30 -9.518 2.255 7.687 252 HG22 ILE 30 HG22 ILE 30 -8.628 0.735 7.625 253 HG23 ILE 30 HG23 ILE 30 -9.625 1.116 9.029 254 HD11 ILE 30 HD11 ILE 30 -9.678 -2.770 7.356 255 HD12 ILE 30 HD12 ILE 30 -8.672 -1.349 7.637 256 HD13 ILE 30 HD13 ILE 30 -9.450 -1.582 6.071 257 H GLN 31 HN GLN 31 -12.811 2.174 5.534 258 HA GLN 31 HA GLN 31 -11.629 4.755 5.720 259 HB2 GLN 31 HB2 GLN 31 -12.077 3.751 3.544 260 HB3 GLN 31 HB1 GLN 31 -13.803 3.706 3.893 261 HG2 GLN 31 HG2 GLN 31 -13.875 6.137 3.925 262 HG3 GLN 31 HG1 GLN 31 -12.139 6.206 3.630 263 HE21 GLN 31 HE21 GLN 31 -12.458 7.399 1.742 264 HE22 GLN 31 HE22 GLN 31 -13.053 6.672 0.290 265 H ASP 32 HN ASP 32 -14.735 3.404 6.522 266 HA ASP 32 HA ASP 32 -16.056 5.907 6.941 267 HB2 ASP 32 HB2 ASP 32 -17.155 3.674 6.413 268 HB3 ASP 32 HB1 ASP 32 -16.849 3.226 8.086 269 H LYS 33 HN LYS 33 -13.795 4.119 8.717 270 HA LYS 33 HA LYS 33 -14.614 5.355 11.249 271 HB2 LYS 33 HB2 LYS 33 -13.127 2.889 10.548 272 HB3 LYS 33 HB1 LYS 33 -12.608 3.735 11.999 273 HG2 LYS 33 HG2 LYS 33 -14.854 3.584 12.915 274 HG3 LYS 33 HG1 LYS 33 -15.409 2.780 11.443 275 HD2 LYS 33 HD2 LYS 33 -14.082 0.869 11.880 276 HD3 LYS 33 HD1 LYS 33 -13.174 1.701 13.144 277 HE2 LYS 33 HE2 LYS 33 -16.131 1.181 13.323 278 HE3 LYS 33 HE1 LYS 33 -14.924 0.043 13.915 279 HZ1 LYS 33 HZ1 LYS 33 -15.345 2.829 14.853 280 HZ2 LYS 33 HZ2 LYS 33 -14.061 1.846 15.345 281 HZ3 LYS 33 HZ3 LYS 33 -15.653 1.406 15.713 282 H GLU 34 HN GLU 34 -11.641 4.753 9.362 283 HA GLU 34 HA GLU 34 -10.293 6.847 10.882 284 HB2 GLU 34 HB2 GLU 34 -9.283 4.818 8.894 285 HB3 GLU 34 HB1 GLU 34 -8.269 6.064 9.610 286 HG2 GLU 34 HG2 GLU 34 -9.690 3.827 11.036 287 HG3 GLU 34 HG1 GLU 34 -7.950 4.030 10.821 288 H GLY 35 HN GLY 35 -11.772 6.403 7.803 289 HA2 GLY 35 HA2 GLY 35 -12.262 8.081 6.263 290 HA3 GLY 35 HA1 GLY 35 -11.176 9.155 7.126 291 H ILE 36 HN ILE 36 -9.735 6.178 6.458 292 HA ILE 36 HA ILE 36 -8.009 7.415 4.485 293 HB ILE 36 HB ILE 36 -7.867 4.624 5.633 294 HG12 ILE 36 HG12 ILE 36 -6.303 7.069 6.469 295 HG13 ILE 36 HG11 ILE 36 -7.725 6.485 7.325 296 HG21 ILE 36 HG21 ILE 36 -5.760 6.274 4.245 297 HG22 ILE 36 HG22 ILE 36 -6.663 4.954 3.506 298 HG23 ILE 36 HG23 ILE 36 -5.574 4.630 4.855 299 HD11 ILE 36 HD11 ILE 36 -5.738 5.741 8.446 300 HD12 ILE 36 HD12 ILE 36 -5.124 5.025 6.956 301 HD13 ILE 36 HD13 ILE 36 -6.557 4.354 7.732 302 HA PRO 37 HA PRO 37 -10.404 5.840 1.024 303 HB2 PRO 37 HB2 PRO 37 -7.801 6.236 -0.370 304 HB3 PRO 37 HB1 PRO 37 -9.409 6.855 -0.788 305 HG2 PRO 37 HG2 PRO 37 -7.567 8.456 0.231 306 HG3 PRO 37 HG1 PRO 37 -9.277 8.611 0.680 307 HD2 PRO 37 HD2 PRO 37 -7.020 7.447 2.239 308 HD3 PRO 37 HD1 PRO 37 -8.419 8.386 2.797 309 HA PRO 38 HA PRO 38 -9.210 1.551 0.986 310 HB2 PRO 38 HB2 PRO 38 -10.578 1.396 -1.630 311 HB3 PRO 38 HB1 PRO 38 -10.939 0.548 -0.116 312 HG2 PRO 38 HG2 PRO 38 -12.513 2.486 -1.032 313 HG3 PRO 38 HG1 PRO 38 -12.225 2.254 0.703 314 HD2 PRO 38 HD2 PRO 38 -11.058 4.290 -1.143 315 HD3 PRO 38 HD1 PRO 38 -11.593 4.462 0.542 316 H ASP 39 HN ASP 39 -8.446 3.723 -1.611 317 HA ASP 39 HA ASP 39 -6.894 1.883 -3.160 318 HB2 ASP 39 HB2 ASP 39 -6.694 4.900 -3.124 319 HB3 ASP 39 HB1 ASP 39 -6.124 3.822 -4.392 320 H GLN 40 HN GLN 40 -6.319 3.896 -0.409 321 HA GLN 40 HA GLN 40 -3.420 3.546 -0.603 322 HB2 GLN 40 HB2 GLN 40 -5.024 5.088 1.440 323 HB3 GLN 40 HB1 GLN 40 -3.281 5.137 1.229 324 HG2 GLN 40 HG2 GLN 40 -3.535 6.180 -0.934 325 HG3 GLN 40 HG1 GLN 40 -5.291 6.053 -0.814 326 HE21 GLN 40 HE21 GLN 40 -3.627 8.418 -1.143 327 HE22 GLN 40 HE22 GLN 40 -3.988 9.445 0.200 328 H GLN 41 HN GLN 41 -6.038 1.958 0.633 329 HA GLN 41 HA GLN 41 -4.841 1.071 3.114 330 HB2 GLN 41 HB2 GLN 41 -7.421 0.426 1.710 331 HB3 GLN 41 HB1 GLN 41 -6.902 -0.426 3.155 332 HG2 GLN 41 HG2 GLN 41 -6.799 1.809 4.301 333 HG3 GLN 41 HG1 GLN 41 -7.592 2.485 2.875 334 HE21 GLN 41 HE21 GLN 41 -9.497 3.028 3.858 335 HE22 GLN 41 HE22 GLN 41 -10.611 1.851 4.472 336 H ARG 42 HN ARG 42 -3.103 -0.223 2.775 337 HA ARG 42 HA ARG 42 -3.438 -2.507 0.958 338 HB2 ARG 42 HB2 ARG 42 -0.936 -1.430 2.281 339 HB3 ARG 42 HB1 ARG 42 -0.989 -2.794 1.177 340 HG2 ARG 42 HG2 ARG 42 -1.943 -1.183 -0.534 341 HG3 ARG 42 HG1 ARG 42 -1.489 0.105 0.584 342 HD2 ARG 42 HD2 ARG 42 0.330 -0.050 -0.876 343 HD3 ARG 42 HD1 ARG 42 0.846 -0.946 0.553 344 HE ARG 42 HE ARG 42 -0.179 -2.903 -0.960 345 HH11 ARG 42 HH11 ARG 42 2.116 -0.348 -1.706 346 HH12 ARG 42 HH12 ARG 42 2.876 -1.259 -2.994 347 HH21 ARG 42 HH21 ARG 42 0.822 -4.068 -2.632 348 HH22 ARG 42 HH22 ARG 42 2.148 -3.357 -3.504 349 H LEU 43 HN LEU 43 -4.538 -4.016 2.100 350 HA LEU 43 HA LEU 43 -3.951 -4.489 4.896 351 HB2 LEU 43 HB2 LEU 43 -5.999 -5.499 2.969 352 HB3 LEU 43 HB1 LEU 43 -5.693 -6.393 4.445 353 HG LEU 43 HG LEU 43 -6.524 -3.492 4.344 354 HD11 LEU 43 HD11 LEU 43 -8.150 -5.942 5.001 355 HD12 LEU 43 HD12 LEU 43 -8.293 -4.975 3.534 356 HD13 LEU 43 HD13 LEU 43 -8.698 -4.269 5.098 357 HD21 LEU 43 HD21 LEU 43 -6.979 -3.860 6.759 358 HD22 LEU 43 HD22 LEU 43 -5.270 -3.960 6.338 359 HD23 LEU 43 HD23 LEU 43 -6.195 -5.435 6.626 360 H ILE 44 HN ILE 44 -2.532 -5.862 5.615 361 HA ILE 44 HA ILE 44 -1.693 -8.097 3.887 362 HB ILE 44 HB ILE 44 -0.066 -6.238 5.593 363 HG12 ILE 44 HG12 ILE 44 1.478 -6.702 3.509 364 HG13 ILE 44 HG11 ILE 44 -0.032 -7.231 2.776 365 HG21 ILE 44 HG21 ILE 44 0.480 -8.468 6.434 366 HG22 ILE 44 HG22 ILE 44 1.833 -7.758 5.551 367 HG23 ILE 44 HG23 ILE 44 0.838 -9.002 4.790 368 HD11 ILE 44 HD11 ILE 44 0.365 -4.943 2.213 369 HD12 ILE 44 HD12 ILE 44 0.583 -4.515 3.911 370 HD13 ILE 44 HD13 ILE 44 -1.003 -5.020 3.325 371 H PHE 45 HN PHE 45 -1.557 -10.080 4.789 372 HA PHE 45 HA PHE 45 -2.069 -10.351 7.670 373 HB2 PHE 45 HB2 PHE 45 -4.169 -10.755 6.399 374 HB3 PHE 45 HB1 PHE 45 -3.352 -12.019 5.489 375 HD1 PHE 45 HD1 PHE 45 -4.196 -11.042 8.979 376 HD2 PHE 45 HD2 PHE 45 -3.467 -14.203 6.227 377 HE1 PHE 45 HE1 PHE 45 -4.840 -12.682 10.696 378 HE2 PHE 45 HE2 PHE 45 -4.111 -15.848 7.938 379 HZ PHE 45 HZ PHE 45 -4.800 -15.089 10.176 380 H ALA 46 HN ALA 46 -0.338 -11.269 8.489 381 HA ALA 46 HA ALA 46 1.390 -12.675 8.882 382 HB1 ALA 46 HB1 ALA 46 1.315 -14.926 8.033 383 HB2 ALA 46 HB2 ALA 46 0.151 -14.458 6.793 384 HB3 ALA 46 HB3 ALA 46 -0.309 -14.421 8.496 385 H GLY 47 HN GLY 47 1.374 -10.703 6.528 386 HA2 GLY 47 HA2 GLY 47 3.459 -9.998 5.566 387 HA3 GLY 47 HA1 GLY 47 3.917 -11.685 5.416 388 H LYS 48 HN LYS 48 0.831 -11.729 4.440 389 HA LYS 48 HA LYS 48 1.563 -11.149 1.645 390 HB2 LYS 48 HB2 LYS 48 0.026 -13.400 2.873 391 HB3 LYS 48 HB1 LYS 48 -0.396 -12.878 1.248 392 HG2 LYS 48 HG2 LYS 48 1.628 -13.535 0.364 393 HG3 LYS 48 HG1 LYS 48 2.450 -13.458 1.922 394 HD2 LYS 48 HD2 LYS 48 0.289 -15.464 1.345 395 HD3 LYS 48 HD1 LYS 48 1.986 -15.775 0.973 396 HE2 LYS 48 HE2 LYS 48 2.328 -15.027 3.470 397 HE3 LYS 48 HE1 LYS 48 0.635 -15.497 3.615 398 HZ1 LYS 48 HZ1 LYS 48 1.181 -17.689 2.841 399 HZ2 LYS 48 HZ2 LYS 48 2.182 -17.305 4.144 400 HZ3 LYS 48 HZ3 LYS 48 2.790 -17.248 2.569 401 H GLN 49 HN GLN 49 0.010 -10.183 0.302 402 HA GLN 49 HA GLN 49 -1.774 -8.409 1.701 403 HB2 GLN 49 HB2 GLN 49 -0.934 -8.752 -1.150 404 HB3 GLN 49 HB1 GLN 49 -2.349 -7.781 -0.774 405 HG2 GLN 49 HG2 GLN 49 -0.895 -6.455 0.783 406 HG3 GLN 49 HG1 GLN 49 0.482 -7.324 0.111 407 HE21 GLN 49 HE21 GLN 49 -0.609 -7.448 -2.561 408 HE22 GLN 49 HE22 GLN 49 -0.496 -5.855 -3.221 409 H LEU 50 HN LEU 50 -3.973 -8.319 1.610 410 HA LEU 50 HA LEU 50 -5.310 -10.822 0.929 411 HB2 LEU 50 HB2 LEU 50 -6.398 -8.340 2.275 412 HB3 LEU 50 HB1 LEU 50 -7.225 -9.877 2.129 413 HG LEU 50 HG LEU 50 -4.684 -9.434 3.696 414 HD11 LEU 50 HD11 LEU 50 -7.529 -9.761 4.634 415 HD12 LEU 50 HD12 LEU 50 -6.569 -8.285 4.719 416 HD13 LEU 50 HD13 LEU 50 -6.103 -9.694 5.671 417 HD21 LEU 50 HD21 LEU 50 -5.245 -11.678 4.617 418 HD22 LEU 50 HD22 LEU 50 -4.796 -11.693 2.913 419 HD23 LEU 50 HD23 LEU 50 -6.493 -11.824 3.382 420 H GLU 51 HN GLU 51 -6.282 -11.068 -0.979 421 HA GLU 51 HA GLU 51 -6.540 -8.869 -2.788 422 HB2 GLU 51 HB2 GLU 51 -7.334 -11.767 -2.932 423 HB3 GLU 51 HB1 GLU 51 -7.689 -10.637 -4.229 424 HG2 GLU 51 HG2 GLU 51 -5.062 -10.155 -3.872 425 HG3 GLU 51 HG1 GLU 51 -5.143 -11.857 -3.424 426 H ASP 52 HN ASP 52 -8.296 -7.784 -3.452 427 HA ASP 52 HA ASP 52 -10.401 -7.344 -1.678 428 HB2 ASP 52 HB2 ASP 52 -9.842 -6.549 -4.500 429 HB3 ASP 52 HB1 ASP 52 -11.446 -6.252 -3.839 430 H GLY 53 HN GLY 53 -10.224 -9.415 -4.517 431 HA2 GLY 53 HA2 GLY 53 -13.056 -9.969 -4.491 432 HA3 GLY 53 HA1 GLY 53 -11.857 -10.711 -5.534 433 H ARG 54 HN ARG 54 -11.011 -10.857 -2.230 434 HA ARG 54 HA ARG 54 -12.016 -13.631 -2.129 435 HB2 ARG 54 HB2 ARG 54 -9.591 -12.633 -0.645 436 HB3 ARG 54 HB1 ARG 54 -10.085 -14.296 -0.915 437 HG2 ARG 54 HG2 ARG 54 -9.255 -12.456 -3.136 438 HG3 ARG 54 HG1 ARG 54 -8.125 -13.483 -2.254 439 HD2 ARG 54 HD2 ARG 54 -10.001 -15.298 -2.918 440 HD3 ARG 54 HD1 ARG 54 -10.161 -14.179 -4.273 441 HE ARG 54 HE ARG 54 -7.871 -15.857 -3.632 442 HH11 ARG 54 HH11 ARG 54 -9.188 -13.311 -5.647 443 HH12 ARG 54 HH12 ARG 54 -7.919 -13.415 -6.822 444 HH21 ARG 54 HH21 ARG 54 -6.209 -15.996 -5.168 445 HH22 ARG 54 HH22 ARG 54 -6.218 -14.949 -6.549 446 H THR 55 HN THR 55 -12.230 -14.467 0.137 447 HA THR 55 HA THR 55 -13.406 -12.375 1.844 448 HB THR 55 HB THR 55 -14.648 -14.337 2.909 449 HG1 THR 55 HG1 THR 55 -13.413 -15.609 0.701 450 HG21 THR 55 HG21 THR 55 -15.207 -13.589 0.040 451 HG22 THR 55 HG22 THR 55 -15.806 -12.776 1.484 452 HG23 THR 55 HG23 THR 55 -16.355 -14.408 1.103 453 H LEU 56 HN LEU 56 -13.418 -13.154 4.254 454 HA LEU 56 HA LEU 56 -10.719 -13.295 5.080 455 HB2 LEU 56 HB2 LEU 56 -13.231 -13.782 6.673 456 HB3 LEU 56 HB1 LEU 56 -11.640 -13.503 7.352 457 HG LEU 56 HG LEU 56 -13.101 -11.486 5.644 458 HD11 LEU 56 HD11 LEU 56 -12.970 -11.750 8.641 459 HD12 LEU 56 HD12 LEU 56 -14.409 -11.846 7.626 460 HD13 LEU 56 HD13 LEU 56 -13.540 -10.319 7.784 461 HD21 LEU 56 HD21 LEU 56 -11.473 -9.922 6.619 462 HD22 LEU 56 HD22 LEU 56 -10.685 -11.198 5.692 463 HD23 LEU 56 HD23 LEU 56 -10.695 -11.267 7.454 464 H SER 57 HN SER 57 -13.226 -15.716 4.697 465 HA SER 57 HA SER 57 -11.904 -17.811 6.071 466 HB2 SER 57 HB2 SER 57 -13.584 -18.964 4.145 467 HB3 SER 57 HB1 SER 57 -13.984 -18.606 5.826 468 HG SER 57 HG SER 57 -14.742 -17.313 3.515 469 H ASP 58 HN ASP 58 -11.357 -16.407 3.004 470 HA ASP 58 HA ASP 58 -10.344 -18.720 1.665 471 HB2 ASP 58 HB2 ASP 58 -10.189 -15.765 1.143 472 HB3 ASP 58 HB1 ASP 58 -9.230 -16.890 0.186 473 H TYR 59 HN TYR 59 -9.058 -16.453 3.921 474 HA TYR 59 HA TYR 59 -6.368 -17.577 3.505 475 HB2 TYR 59 HB2 TYR 59 -7.178 -14.954 4.775 476 HB3 TYR 59 HB1 TYR 59 -5.526 -15.553 4.662 477 HD1 TYR 59 HD1 TYR 59 -4.409 -15.695 2.463 478 HD2 TYR 59 HD2 TYR 59 -8.278 -13.975 2.886 479 HE1 TYR 59 HE1 TYR 59 -4.182 -14.652 0.250 480 HE2 TYR 59 HE2 TYR 59 -8.060 -12.929 0.674 481 HH TYR 59 HH TYR 59 -5.942 -13.847 -1.582 482 H ASN 60 HN ASN 60 -8.890 -18.276 5.170 483 HA ASN 60 HA ASN 60 -9.396 -19.283 7.127 484 HB2 ASN 60 HB2 ASN 60 -7.262 -20.553 6.391 485 HB3 ASN 60 HB1 ASN 60 -6.464 -19.658 7.678 486 HD21 ASN 60 HD21 ASN 60 -6.045 -21.397 8.958 487 HD22 ASN 60 HD22 ASN 60 -7.275 -22.321 9.749 488 H ILE 61 HN ILE 61 -9.045 -16.436 7.141 489 HA ILE 61 HA ILE 61 -7.690 -15.668 9.540 490 HB ILE 61 HB ILE 61 -9.784 -14.148 7.974 491 HG12 ILE 61 HG12 ILE 61 -6.770 -13.914 7.857 492 HG13 ILE 61 HG11 ILE 61 -7.740 -14.794 6.679 493 HG21 ILE 61 HG21 ILE 61 -8.911 -12.169 9.084 494 HG22 ILE 61 HG22 ILE 61 -7.761 -13.159 9.985 495 HG23 ILE 61 HG23 ILE 61 -9.494 -13.335 10.270 496 HD11 ILE 61 HD11 ILE 61 -7.925 -11.848 7.261 497 HD12 ILE 61 HD12 ILE 61 -8.879 -12.731 6.069 498 HD13 ILE 61 HD13 ILE 61 -7.132 -12.585 5.869 499 H GLN 62 HN GLN 62 -8.373 -16.316 11.444 500 HA GLN 62 HA GLN 62 -11.207 -16.804 11.913 501 HB2 GLN 62 HB2 GLN 62 -8.724 -17.442 13.514 502 HB3 GLN 62 HB1 GLN 62 -10.356 -17.776 14.082 503 HG2 GLN 62 HG2 GLN 62 -10.623 -19.537 12.695 504 HG3 GLN 62 HG1 GLN 62 -9.684 -18.797 11.398 505 HE21 GLN 62 HE21 GLN 62 -7.468 -19.081 11.340 506 HE22 GLN 62 HE22 GLN 62 -6.663 -20.269 12.306 507 H LYS 63 HN LYS 63 -11.618 -16.296 14.482 508 HA LYS 63 HA LYS 63 -11.821 -13.458 14.566 509 HB2 LYS 63 HB2 LYS 63 -12.915 -13.793 16.709 510 HB3 LYS 63 HB1 LYS 63 -13.528 -14.950 15.538 511 HG2 LYS 63 HG2 LYS 63 -11.989 -16.646 16.491 512 HG3 LYS 63 HG1 LYS 63 -11.547 -15.479 17.739 513 HD2 LYS 63 HD2 LYS 63 -13.838 -15.396 18.515 514 HD3 LYS 63 HD1 LYS 63 -14.344 -16.476 17.212 515 HE2 LYS 63 HE2 LYS 63 -12.745 -18.174 18.150 516 HE3 LYS 63 HE1 LYS 63 -12.542 -17.107 19.536 517 HZ1 LYS 63 HZ1 LYS 63 -14.967 -17.250 19.879 518 HZ2 LYS 63 HZ2 LYS 63 -14.183 -18.738 20.047 519 HZ3 LYS 63 HZ3 LYS 63 -15.054 -18.397 18.640 520 H GLU 64 HN GLU 64 -10.972 -12.047 16.148 521 HA GLU 64 HA GLU 64 -9.368 -11.094 17.411 522 HB2 GLU 64 HB2 GLU 64 -9.171 -13.937 18.317 523 HB3 GLU 64 HB1 GLU 64 -7.985 -12.766 18.875 524 HG2 GLU 64 HG2 GLU 64 -9.402 -12.218 20.480 525 HG3 GLU 64 HG1 GLU 64 -10.438 -11.514 19.243 526 H SER 65 HN SER 65 -8.765 -12.108 14.664 527 HA SER 65 HA SER 65 -5.898 -12.592 14.812 528 HB2 SER 65 HB2 SER 65 -7.697 -12.375 12.382 529 HB3 SER 65 HB1 SER 65 -6.014 -12.899 12.383 530 HG SER 65 HG SER 65 -8.310 -14.242 13.193 531 H THR 66 HN THR 66 -4.351 -11.201 13.931 532 HA THR 66 HA THR 66 -5.151 -8.404 13.949 533 HB THR 66 HB THR 66 -2.460 -9.766 14.062 534 HG1 THR 66 HG1 THR 66 -3.621 -9.645 16.023 535 HG21 THR 66 HG21 THR 66 -2.301 -7.711 12.677 536 HG22 THR 66 HG22 THR 66 -1.405 -7.597 14.193 537 HG23 THR 66 HG23 THR 66 -2.966 -6.789 14.026 538 H LEU 67 HN LEU 67 -5.334 -7.200 12.209 539 HA LEU 67 HA LEU 67 -4.323 -8.245 9.652 540 HB2 LEU 67 HB2 LEU 67 -6.685 -6.526 10.353 541 HB3 LEU 67 HB1 LEU 67 -5.990 -6.454 8.746 542 HG LEU 67 HG LEU 67 -6.333 -9.031 8.738 543 HD11 LEU 67 HD11 LEU 67 -8.201 -9.801 10.082 544 HD12 LEU 67 HD12 LEU 67 -8.317 -8.220 10.855 545 HD13 LEU 67 HD13 LEU 67 -6.891 -9.226 11.112 546 HD21 LEU 67 HD21 LEU 67 -8.655 -7.112 8.579 547 HD22 LEU 67 HD22 LEU 67 -8.620 -8.738 7.896 548 HD23 LEU 67 HD23 LEU 67 -7.525 -7.499 7.282 549 H HIS 68 HN HIS 68 -2.684 -7.173 8.748 550 HA HIS 68 HA HIS 68 -1.740 -4.742 10.021 551 HB2 HIS 68 HB2 HIS 68 -0.530 -6.311 7.733 552 HB3 HIS 68 HB1 HIS 68 0.261 -5.039 8.652 553 HD2 HIS 68 HD2 HIS 68 0.328 -5.834 11.565 554 HE1 HIS 68 HE1 HIS 68 1.020 -9.838 10.373 555 HE2 HIS 68 HE2 HIS 68 1.339 -8.134 12.220 556 H LEU 69 HN LEU 69 -2.408 -2.810 9.347 557 HA LEU 69 HA LEU 69 -3.293 -2.556 6.559 558 HB2 LEU 69 HB2 LEU 69 -4.932 -1.928 8.279 559 HB3 LEU 69 HB1 LEU 69 -3.809 -0.742 8.918 560 HG LEU 69 HG LEU 69 -3.950 0.536 6.828 561 HD11 LEU 69 HD11 LEU 69 -5.711 -0.083 5.181 562 HD12 LEU 69 HD12 LEU 69 -5.868 -1.633 6.008 563 HD13 LEU 69 HD13 LEU 69 -4.345 -1.199 5.232 564 HD21 LEU 69 HD21 LEU 69 -6.619 -0.137 8.053 565 HD22 LEU 69 HD22 LEU 69 -6.285 1.280 7.058 566 HD23 LEU 69 HD23 LEU 69 -5.484 1.087 8.619 567 H VAL 70 HN VAL 70 -1.625 -2.019 5.319 568 HA VAL 70 HA VAL 70 0.368 -0.109 6.273 569 HB VAL 70 HB VAL 70 0.240 -1.788 3.763 570 HG11 VAL 70 HG11 VAL 70 2.575 -1.062 3.382 571 HG12 VAL 70 HG12 VAL 70 2.396 0.102 4.694 572 HG13 VAL 70 HG13 VAL 70 1.413 0.255 3.238 573 HG21 VAL 70 HG21 VAL 70 0.665 -3.091 5.747 574 HG22 VAL 70 HG22 VAL 70 1.947 -1.980 6.233 575 HG23 VAL 70 HG23 VAL 70 2.142 -2.973 4.789 576 H LEU 71 HN LEU 71 0.346 1.968 5.719 577 HA LEU 71 HA LEU 71 -1.703 2.903 3.882 578 HB2 LEU 71 HB2 LEU 71 0.238 4.516 5.544 579 HB3 LEU 71 HB1 LEU 71 -1.182 5.122 4.713 580 HG LEU 71 HG LEU 71 -1.167 3.246 7.076 581 HD11 LEU 71 HD11 LEU 71 -2.048 6.115 6.812 582 HD12 LEU 71 HD12 LEU 71 -0.605 5.543 7.649 583 HD13 LEU 71 HD13 LEU 71 -2.205 5.113 8.255 584 HD21 LEU 71 HD21 LEU 71 -3.613 3.527 7.031 585 HD22 LEU 71 HD22 LEU 71 -3.001 2.694 5.603 586 HD23 LEU 71 HD23 LEU 71 -3.468 4.391 5.500 587 H ARG 72 HN ARG 72 -1.276 3.240 1.821 588 HA ARG 72 HA ARG 72 1.512 3.477 0.957 589 HB2 ARG 72 HB2 ARG 72 0.805 2.044 -0.609 590 HB3 ARG 72 HB1 ARG 72 -0.868 2.244 -0.113 591 HG2 ARG 72 HG2 ARG 72 -1.319 3.753 -1.758 592 HG3 ARG 72 HG1 ARG 72 0.332 4.372 -1.798 593 HD2 ARG 72 HD2 ARG 72 -0.507 1.663 -2.827 594 HD3 ARG 72 HD1 ARG 72 -0.303 3.095 -3.834 595 HE ARG 72 HE ARG 72 1.955 2.148 -2.209 596 HH11 ARG 72 HH11 ARG 72 0.487 2.508 -5.372 597 HH12 ARG 72 HH12 ARG 72 1.993 2.370 -6.224 598 HH21 ARG 72 HH21 ARG 72 3.925 1.992 -3.296 599 HH22 ARG 72 HH22 ARG 72 3.962 2.060 -5.038 600 H LEU 73 HN LEU 73 2.216 5.159 -0.397 601 HA LEU 73 HA LEU 73 0.447 7.507 -0.454 602 HB2 LEU 73 HB2 LEU 73 3.370 7.297 0.189 603 HB3 LEU 73 HB1 LEU 73 2.704 8.790 -0.446 604 HG LEU 73 HG LEU 73 0.996 8.510 1.539 605 HD11 LEU 73 HD11 LEU 73 2.089 6.246 2.074 606 HD12 LEU 73 HD12 LEU 73 1.738 7.347 3.407 607 HD13 LEU 73 HD13 LEU 73 3.384 7.208 2.787 608 HD21 LEU 73 HD21 LEU 73 2.559 10.370 1.227 609 HD22 LEU 73 HD22 LEU 73 3.840 9.410 1.965 610 HD23 LEU 73 HD23 LEU 73 2.437 9.891 2.919 611 H ARG 74 HN ARG 74 0.922 9.043 -2.181 612 HA ARG 74 HA ARG 74 1.978 7.688 -4.572 613 HB2 ARG 74 HB2 ARG 74 -0.292 9.657 -4.296 614 HB3 ARG 74 HB1 ARG 74 0.410 9.203 -5.844 615 HG2 ARG 74 HG2 ARG 74 -0.912 7.319 -3.897 616 HG3 ARG 74 HG1 ARG 74 -1.633 7.953 -5.380 617 HD2 ARG 74 HD2 ARG 74 0.245 6.900 -6.644 618 HD3 ARG 74 HD1 ARG 74 0.775 6.155 -5.140 619 HE ARG 74 HE ARG 74 -1.291 4.906 -5.114 620 HH11 ARG 74 HH11 ARG 74 -0.571 6.561 -8.116 621 HH12 ARG 74 HH12 ARG 74 -1.514 5.476 -9.084 622 HH21 ARG 74 HH21 ARG 74 -2.515 3.475 -6.372 623 HH22 ARG 74 HH22 ARG 74 -2.619 3.704 -8.089 624 H GLY 75 HN GLY 75 3.021 9.682 -2.432 625 HA2 GLY 75 HA2 GLY 75 4.794 11.062 -4.195 626 HA3 GLY 75 HA1 GLY 75 3.614 12.148 -3.470 627 H GLY 76 HN GLY 76 6.575 11.911 -3.105 628 HA2 GLY 76 HA2 GLY 76 6.616 12.357 -0.300 629 HA3 GLY 76 HA1 GLY 76 7.291 10.778 -0.684 630 H1 SER 453 HT1 SER 453 22.588 8.995 15.170 631 H2 SER 453 HT2 SER 453 22.977 10.484 15.862 632 H3 SER 453 HT3 SER 453 21.840 10.407 14.618 633 HA SER 453 HA SER 453 21.583 9.467 17.398 634 HB2 SER 453 HB2 SER 453 19.400 10.854 17.043 635 HB3 SER 453 HB1 SER 453 20.926 11.706 17.277 636 HG SER 453 HG SER 453 19.796 12.559 15.505 637 H ASN 454 HN ASN 454 19.280 9.866 14.725 638 HA ASN 454 HA ASN 454 17.684 8.511 13.845 639 HB2 ASN 454 HB2 ASN 454 19.752 6.411 14.513 640 HB3 ASN 454 HB1 ASN 454 18.261 6.048 13.646 641 HD21 ASN 454 HD21 ASN 454 21.013 5.795 12.765 642 HD22 ASN 454 HD22 ASN 454 21.159 6.772 11.347 643 H SER 455 HN SER 455 17.615 9.215 16.645 644 HA SER 455 HA SER 455 16.801 7.116 18.306 645 HB2 SER 455 HB2 SER 455 15.523 9.703 18.816 646 HB3 SER 455 HB1 SER 455 16.634 8.779 19.828 647 HG SER 455 HG SER 455 17.460 10.838 19.037 648 H GLN 456 HN GLN 456 14.803 9.497 16.544 649 HA GLN 456 HA GLN 456 12.360 8.198 17.209 650 HB2 GLN 456 HB2 GLN 456 13.052 10.308 15.171 651 HB3 GLN 456 HB1 GLN 456 11.414 9.709 15.405 652 HG2 GLN 456 HG2 GLN 456 13.129 11.138 17.422 653 HG3 GLN 456 HG1 GLN 456 11.688 11.758 16.619 654 HE21 GLN 456 HE21 GLN 456 12.294 11.409 19.470 655 HE22 GLN 456 HE22 GLN 456 11.024 10.418 20.097 656 H LEU 457 HN LEU 457 14.574 8.022 14.503 657 HA LEU 457 HA LEU 457 12.882 6.612 12.739 658 HB2 LEU 457 HB2 LEU 457 15.895 6.523 12.888 659 HB3 LEU 457 HB1 LEU 457 14.914 6.037 11.520 660 HG LEU 457 HG LEU 457 15.283 8.834 12.581 661 HD11 LEU 457 HD11 LEU 457 16.236 9.234 10.351 662 HD12 LEU 457 HD12 LEU 457 16.069 7.515 9.993 663 HD13 LEU 457 HD13 LEU 457 17.151 8.047 11.281 664 HD21 LEU 457 HD21 LEU 457 13.859 9.566 10.737 665 HD22 LEU 457 HD22 LEU 457 12.973 8.535 11.860 666 HD23 LEU 457 HD23 LEU 457 13.531 7.888 10.317 667 H ASN 458 HN ASN 458 15.033 5.601 15.322 668 HA ASN 458 HA ASN 458 15.016 2.835 14.771 669 HB2 ASN 458 HB2 ASN 458 15.953 4.568 16.881 670 HB3 ASN 458 HB1 ASN 458 15.197 3.133 17.562 671 HD21 ASN 458 HD21 ASN 458 18.003 3.995 17.487 672 HD22 ASN 458 HD22 ASN 458 18.874 2.693 16.753 673 H ALA 459 HN ALA 459 12.939 4.869 16.783 674 HA ALA 459 HA ALA 459 11.327 2.775 17.788 675 HB1 ALA 459 HB1 ALA 459 11.451 5.026 18.798 676 HB2 ALA 459 HB2 ALA 459 9.794 4.514 18.486 677 HB3 ALA 459 HB3 ALA 459 10.573 5.674 17.411 678 H MET 460 HN MET 460 11.073 4.883 14.977 679 HA MET 460 HA MET 460 8.532 4.037 14.107 680 HB2 MET 460 HB2 MET 460 10.856 5.402 12.811 681 HB3 MET 460 HB1 MET 460 9.548 4.804 11.802 682 HG2 MET 460 HG2 MET 460 7.961 6.134 13.175 683 HG3 MET 460 HG1 MET 460 9.346 6.820 14.023 684 HE1 MET 460 HE1 MET 460 8.007 9.722 11.685 685 HE2 MET 460 HE2 MET 460 8.315 9.238 13.352 686 HE3 MET 460 HE3 MET 460 7.028 8.459 12.431 687 H ALA 461 HN ALA 461 11.797 2.945 13.271 688 HA ALA 461 HA ALA 461 11.064 1.046 11.340 689 HB1 ALA 461 HB1 ALA 461 13.459 1.009 13.176 690 HB2 ALA 461 HB2 ALA 461 13.361 1.842 11.625 691 HB3 ALA 461 HB3 ALA 461 13.277 0.082 11.687 692 H HIS 462 HN HIS 462 11.370 0.832 14.848 693 HA HIS 462 HA HIS 462 11.086 -1.954 15.099 694 HB2 HIS 462 HB2 HIS 462 11.803 -0.303 16.900 695 HB3 HIS 462 HB1 HIS 462 10.097 0.077 17.104 696 HD2 HIS 462 HD2 HIS 462 8.709 -1.613 18.696 697 HE1 HIS 462 HE1 HIS 462 11.726 -4.552 19.053 698 HE2 HIS 462 HE2 HIS 462 9.528 -3.707 19.981 699 H GLN 463 HN GLN 463 8.734 0.643 14.824 700 HA GLN 463 HA GLN 463 6.441 -0.862 15.462 701 HB2 GLN 463 HB2 GLN 463 6.490 1.616 15.343 702 HB3 GLN 463 HB1 GLN 463 6.651 1.513 13.596 703 HG2 GLN 463 HG2 GLN 463 4.363 2.014 14.297 704 HG3 GLN 463 HG1 GLN 463 4.471 0.491 13.415 705 HE21 GLN 463 HE21 GLN 463 4.127 -1.449 14.516 706 HE22 GLN 463 HE22 GLN 463 3.389 -1.493 16.080 707 H ILE 464 HN ILE 464 8.229 -0.388 12.474 708 HA ILE 464 HA ILE 464 6.356 -1.720 10.785 709 HB ILE 464 HB ILE 464 9.311 -1.229 10.361 710 HG12 ILE 464 HG12 ILE 464 6.925 0.326 9.341 711 HG13 ILE 464 HG11 ILE 464 7.937 0.823 10.694 712 HG21 ILE 464 HG21 ILE 464 8.819 -1.561 7.980 713 HG22 ILE 464 HG22 ILE 464 7.155 -1.979 8.387 714 HG23 ILE 464 HG23 ILE 464 8.480 -3.012 8.924 715 HD11 ILE 464 HD11 ILE 464 8.506 1.984 8.623 716 HD12 ILE 464 HD12 ILE 464 8.880 0.438 7.865 717 HD13 ILE 464 HD13 ILE 464 9.848 1.012 9.223 718 H GLN 465 HN GLN 465 9.216 -2.681 12.600 719 HA GLN 465 HA GLN 465 9.531 -5.276 11.597 720 HB2 GLN 465 HB2 GLN 465 11.040 -3.878 13.181 721 HB3 GLN 465 HB1 GLN 465 10.069 -4.577 14.471 722 HG2 GLN 465 HG2 GLN 465 12.056 -5.879 14.193 723 HG3 GLN 465 HG1 GLN 465 10.669 -6.824 13.657 724 HE21 GLN 465 HE21 GLN 465 11.718 -8.146 12.255 725 HE22 GLN 465 HE22 GLN 465 12.477 -7.595 10.798 726 H GLU 466 HN GLU 466 7.287 -3.956 13.888 727 HA GLU 466 HA GLU 466 6.391 -6.509 14.892 728 HB2 GLU 466 HB2 GLU 466 5.448 -3.669 15.228 729 HB3 GLU 466 HB1 GLU 466 4.532 -5.022 15.871 730 HG2 GLU 466 HG2 GLU 466 7.421 -4.762 16.551 731 HG3 GLU 466 HG1 GLU 466 6.239 -3.737 17.362 732 H MET 467 HN MET 467 5.631 -4.412 12.269 733 HA MET 467 HA MET 467 3.000 -5.575 11.816 734 HB2 MET 467 HB2 MET 467 4.557 -3.512 10.247 735 HB3 MET 467 HB1 MET 467 2.906 -4.008 9.904 736 HG2 MET 467 HG2 MET 467 3.729 -2.827 12.538 737 HG3 MET 467 HG1 MET 467 3.205 -1.844 11.176 738 HE1 MET 467 HE1 MET 467 0.955 -3.328 9.804 739 HE2 MET 467 HE2 MET 467 0.740 -1.658 10.329 740 HE3 MET 467 HE3 MET 467 -0.493 -2.865 10.699 741 H PHE 468 HN PHE 468 6.193 -5.497 10.301 742 HA PHE 468 HA PHE 468 5.328 -7.719 8.567 743 HB2 PHE 468 HB2 PHE 468 6.834 -5.274 8.009 744 HB3 PHE 468 HB1 PHE 468 7.653 -6.727 7.445 745 HD1 PHE 468 HD1 PHE 468 4.340 -5.040 7.344 746 HD2 PHE 468 HD2 PHE 468 7.092 -7.635 5.400 747 HE1 PHE 468 HE1 PHE 468 2.889 -5.088 5.357 748 HE2 PHE 468 HE2 PHE 468 5.649 -7.684 3.410 749 HZ PHE 468 HZ PHE 468 3.544 -6.410 3.386 750 HA PRO 469 HA PRO 469 8.490 -9.546 11.301 751 HB2 PRO 469 HB2 PRO 469 7.272 -11.922 11.650 752 HB3 PRO 469 HB1 PRO 469 6.747 -10.472 12.526 753 HG2 PRO 469 HG2 PRO 469 5.524 -11.787 10.160 754 HG3 PRO 469 HG1 PRO 469 4.748 -11.020 11.559 755 HD2 PRO 469 HD2 PRO 469 5.083 -9.826 9.083 756 HD3 PRO 469 HD1 PRO 469 4.800 -8.961 10.606 757 H GLN 470 HN GLN 470 8.622 -9.398 8.384 758 HA GLN 470 HA GLN 470 10.085 -11.887 7.931 759 HB2 GLN 470 HB2 GLN 470 9.105 -12.207 5.723 760 HB3 GLN 470 HB1 GLN 470 7.858 -12.247 6.961 761 HG2 GLN 470 HG2 GLN 470 7.361 -9.859 6.424 762 HG3 GLN 470 HG1 GLN 470 8.474 -9.993 5.063 763 HE21 GLN 470 HE21 GLN 470 6.864 -9.627 3.538 764 HE22 GLN 470 HE22 GLN 470 5.632 -10.788 3.189 765 H VAL 471 HN VAL 471 10.466 -8.819 8.250 766 HA VAL 471 HA VAL 471 12.230 -8.532 5.913 767 HB VAL 471 HB VAL 471 10.348 -6.968 5.758 768 HG11 VAL 471 HG11 VAL 471 10.079 -5.145 7.364 769 HG12 VAL 471 HG12 VAL 471 11.335 -5.855 8.378 770 HG13 VAL 471 HG13 VAL 471 9.820 -6.718 8.117 771 HG21 VAL 471 HG21 VAL 471 12.462 -6.275 4.813 772 HG22 VAL 471 HG22 VAL 471 12.981 -5.631 6.372 773 HG23 VAL 471 HG23 VAL 471 11.636 -4.881 5.513 774 HA PRO 472 HA PRO 472 15.509 -8.405 8.923 775 HB2 PRO 472 HB2 PRO 472 16.937 -6.907 6.786 776 HB3 PRO 472 HB1 PRO 472 17.410 -8.394 7.629 777 HG2 PRO 472 HG2 PRO 472 16.589 -8.487 5.122 778 HG3 PRO 472 HG1 PRO 472 16.112 -9.742 6.285 779 HD2 PRO 472 HD2 PRO 472 14.517 -7.432 5.250 780 HD3 PRO 472 HD1 PRO 472 14.016 -9.109 5.555 781 H TYR 473 HN TYR 473 15.687 -7.033 10.537 782 HA TYR 473 HA TYR 473 14.601 -4.507 10.676 783 HB2 TYR 473 HB2 TYR 473 15.187 -5.944 12.606 784 HB3 TYR 473 HB1 TYR 473 16.885 -5.573 12.339 785 HD1 TYR 473 HD2 TYR 473 13.665 -3.700 12.748 786 HD2 TYR 473 HD1 TYR 473 17.800 -3.978 13.720 787 HE1 TYR 473 HE2 TYR 473 13.455 -1.718 14.189 788 HE2 TYR 473 HE1 TYR 473 17.597 -2.004 15.167 789 HH TYR 473 HH TYR 473 16.076 0.013 15.330 790 H HIS 474 HN HIS 474 17.951 -5.369 9.855 791 HA HIS 474 HA HIS 474 18.937 -2.721 9.987 792 HB2 HIS 474 HB2 HIS 474 20.922 -3.537 8.899 793 HB3 HIS 474 HB1 HIS 474 20.383 -4.747 10.054 794 HD2 HIS 474 HD2 HIS 474 21.108 -4.348 6.310 795 HE1 HIS 474 HE1 HIS 474 19.623 -8.253 6.969 796 HE2 HIS 474 HE2 HIS 474 20.860 -6.746 5.349 797 H LEU 475 HN LEU 475 17.282 -4.503 7.481 798 HA LEU 475 HA LEU 475 17.928 -2.628 5.403 799 HB2 LEU 475 HB2 LEU 475 16.084 -4.975 5.622 800 HB3 LEU 475 HB1 LEU 475 15.922 -3.863 4.274 801 HG LEU 475 HG LEU 475 18.426 -5.409 4.968 802 HD11 LEU 475 HD11 LEU 475 16.496 -6.759 4.111 803 HD12 LEU 475 HD12 LEU 475 17.947 -6.806 3.111 804 HD13 LEU 475 HD13 LEU 475 16.574 -5.808 2.628 805 HD21 LEU 475 HD21 LEU 475 19.060 -3.384 3.899 806 HD22 LEU 475 HD22 LEU 475 17.763 -3.525 2.712 807 HD23 LEU 475 HD23 LEU 475 19.119 -4.651 2.674 808 H VAL 476 HN VAL 476 15.391 -3.049 7.754 809 HA VAL 476 HA VAL 476 13.518 -1.244 6.633 810 HB VAL 476 HB VAL 476 13.899 -1.860 9.570 811 HG11 VAL 476 HG11 VAL 476 11.517 -1.348 9.746 812 HG12 VAL 476 HG12 VAL 476 11.467 -0.974 8.024 813 HG13 VAL 476 HG13 VAL 476 12.420 0.031 9.117 814 HG21 VAL 476 HG21 VAL 476 12.288 -3.350 7.504 815 HG22 VAL 476 HG22 VAL 476 12.219 -3.634 9.242 816 HG23 VAL 476 HG23 VAL 476 13.712 -3.948 8.358 817 H LEU 477 HN LEU 477 16.134 -0.899 8.984 818 HA LEU 477 HA LEU 477 15.753 1.823 9.573 819 HB2 LEU 477 HB2 LEU 477 18.050 -0.074 9.803 820 HB3 LEU 477 HB1 LEU 477 18.330 1.637 10.059 821 HG LEU 477 HG LEU 477 16.265 0.067 11.593 822 HD11 LEU 477 HD11 LEU 477 17.910 0.054 13.434 823 HD12 LEU 477 HD12 LEU 477 19.127 0.672 12.316 824 HD13 LEU 477 HD13 LEU 477 18.413 -0.921 12.054 825 HD21 LEU 477 HD21 LEU 477 15.895 2.462 11.566 826 HD22 LEU 477 HD22 LEU 477 17.568 2.749 12.043 827 HD23 LEU 477 HD23 LEU 477 16.457 1.958 13.161 828 H GLN 478 HN GLN 478 17.270 0.202 6.916 829 HA GLN 478 HA GLN 478 18.845 2.311 5.924 830 HB2 GLN 478 HB2 GLN 478 19.225 0.095 5.114 831 HB3 GLN 478 HB1 GLN 478 17.560 -0.061 4.576 832 HG2 GLN 478 HG2 GLN 478 18.224 2.015 3.085 833 HG3 GLN 478 HG1 GLN 478 19.840 1.356 3.318 834 HE21 GLN 478 HE21 GLN 478 16.909 -0.570 3.151 835 HE22 GLN 478 HE22 GLN 478 17.291 -1.350 1.659 836 H ASP 479 HN ASP 479 15.569 1.237 4.995 837 HA ASP 479 HA ASP 479 15.142 3.378 3.178 838 HB2 ASP 479 HB2 ASP 479 13.906 1.141 3.253 839 HB3 ASP 479 HB1 ASP 479 12.957 1.834 4.565 840 H LEU 480 HN LEU 480 14.578 2.943 6.599 841 HA LEU 480 HA LEU 480 12.860 5.103 7.061 842 HB2 LEU 480 HB2 LEU 480 14.371 3.247 8.624 843 HB3 LEU 480 HB1 LEU 480 14.627 4.852 9.275 844 HG LEU 480 HG LEU 480 12.795 3.697 10.406 845 HD11 LEU 480 HD11 LEU 480 11.942 6.046 8.725 846 HD12 LEU 480 HD12 LEU 480 12.685 6.093 10.324 847 HD13 LEU 480 HD13 LEU 480 11.061 5.437 10.126 848 HD21 LEU 480 HD21 LEU 480 12.062 2.288 8.553 849 HD22 LEU 480 HD22 LEU 480 11.437 3.709 7.718 850 HD23 LEU 480 HD23 LEU 480 10.722 3.198 9.246 851 H GLN 481 HN GLN 481 16.231 5.002 6.355 852 HA GLN 481 HA GLN 481 16.644 7.768 7.205 853 HB2 GLN 481 HB2 GLN 481 18.523 5.671 6.112 854 HB3 GLN 481 HB1 GLN 481 19.012 7.323 6.458 855 HG2 GLN 481 HG2 GLN 481 18.636 7.048 8.777 856 HG3 GLN 481 HG1 GLN 481 17.799 5.515 8.529 857 HE21 GLN 481 HE21 GLN 481 18.980 3.668 8.102 858 HE22 GLN 481 HE22 GLN 481 20.691 3.576 8.361 859 H LEU 482 HN LEU 482 15.556 6.129 4.524 860 HA LEU 482 HA LEU 482 16.623 8.087 2.620 861 HB2 LEU 482 HB2 LEU 482 15.748 5.306 2.445 862 HB3 LEU 482 HB1 LEU 482 15.087 6.309 1.172 863 HG LEU 482 HG LEU 482 17.127 5.215 0.437 864 HD11 LEU 482 HD11 LEU 482 18.348 7.147 -0.361 865 HD12 LEU 482 HD12 LEU 482 17.574 8.167 0.851 866 HD13 LEU 482 HD13 LEU 482 16.612 7.444 -0.438 867 HD21 LEU 482 HD21 LEU 482 18.266 4.880 2.517 868 HD22 LEU 482 HD22 LEU 482 18.407 6.619 2.774 869 HD23 LEU 482 HD23 LEU 482 19.300 5.846 1.463 870 H THR 483 HN THR 483 13.501 6.523 3.402 871 HA THR 483 HA THR 483 12.092 8.738 2.130 872 HB THR 483 HB THR 483 10.048 7.409 2.637 873 HG1 THR 483 HG1 THR 483 11.365 5.088 3.228 874 HG21 THR 483 HG21 THR 483 10.521 5.582 1.064 875 HG22 THR 483 HG22 THR 483 12.250 5.886 1.236 876 HG23 THR 483 HG23 THR 483 11.208 7.107 0.505 877 H ARG 484 HN ARG 484 12.647 7.359 5.303 878 HA ARG 484 HA ARG 484 12.316 8.111 7.420 879 HB2 ARG 484 HB2 ARG 484 11.918 10.827 6.142 880 HB3 ARG 484 HB1 ARG 484 12.314 10.511 7.827 881 HG2 ARG 484 HG2 ARG 484 14.497 9.907 7.332 882 HG3 ARG 484 HG1 ARG 484 14.121 9.566 5.642 883 HD2 ARG 484 HD2 ARG 484 13.559 12.101 5.530 884 HD3 ARG 484 HD1 ARG 484 14.535 12.202 6.994 885 HE ARG 484 HE ARG 484 16.384 11.244 5.686 886 HH11 ARG 484 HH11 ARG 484 13.707 12.706 3.952 887 HH12 ARG 484 HH12 ARG 484 14.645 13.047 2.537 888 HH21 ARG 484 HH21 ARG 484 17.612 11.677 3.801 889 HH22 ARG 484 HH22 ARG 484 16.857 12.449 2.444 890 H SER 485 HN SER 485 10.128 7.013 6.062 891 HA SER 485 HA SER 485 7.956 8.091 7.645 892 HB2 SER 485 HB2 SER 485 7.608 9.433 5.706 893 HB3 SER 485 HB1 SER 485 7.946 8.085 4.625 894 HG SER 485 HG SER 485 5.783 7.902 6.426 895 H VAL 486 HN VAL 486 7.186 6.346 8.631 896 HA VAL 486 HA VAL 486 7.770 3.714 7.997 897 HB VAL 486 HB VAL 486 5.761 3.118 9.446 898 HG11 VAL 486 HG11 VAL 486 7.847 4.992 10.542 899 HG12 VAL 486 HG12 VAL 486 8.020 3.251 10.319 900 HG13 VAL 486 HG13 VAL 486 6.865 3.881 11.493 901 HG21 VAL 486 HG21 VAL 486 4.445 5.140 9.021 902 HG22 VAL 486 HG22 VAL 486 5.681 6.110 9.827 903 HG23 VAL 486 HG23 VAL 486 4.758 4.918 10.743 904 H GLU 487 HN GLU 487 5.004 5.663 7.012 905 HA GLU 487 HA GLU 487 3.487 3.565 5.888 906 HB2 GLU 487 HB2 GLU 487 3.458 6.374 4.827 907 HB3 GLU 487 HB1 GLU 487 2.128 5.234 4.946 908 HG2 GLU 487 HG2 GLU 487 1.553 6.518 6.693 909 HG3 GLU 487 HG1 GLU 487 2.721 5.512 7.550 910 H ILE 488 HN ILE 488 5.642 5.942 4.353 911 HA ILE 488 HA ILE 488 5.472 4.867 1.756 912 HB ILE 488 HB ILE 488 7.780 6.443 2.910 913 HG12 ILE 488 HG12 ILE 488 5.244 7.424 1.572 914 HG13 ILE 488 HG11 ILE 488 5.633 7.593 3.282 915 HG21 ILE 488 HG21 ILE 488 6.817 6.124 0.071 916 HG22 ILE 488 HG22 ILE 488 8.266 5.396 0.762 917 HG23 ILE 488 HG23 ILE 488 8.151 7.149 0.601 918 HD11 ILE 488 HD11 ILE 488 7.107 8.857 0.983 919 HD12 ILE 488 HD12 ILE 488 7.553 9.000 2.683 920 HD13 ILE 488 HD13 ILE 488 6.023 9.669 2.115 921 H THR 489 HN THR 489 7.632 4.204 4.448 922 HA THR 489 HA THR 489 9.524 2.642 3.074 923 HB THR 489 HB THR 489 8.697 2.560 5.984 924 HG1 THR 489 HG1 THR 489 10.800 3.877 4.570 925 HG21 THR 489 HG21 THR 489 9.785 0.483 5.525 926 HG22 THR 489 HG22 THR 489 10.973 1.526 6.305 927 HG23 THR 489 HG23 THR 489 11.029 1.279 4.561 928 H THR 490 HN THR 490 6.812 1.556 5.145 929 HA THR 490 HA THR 490 7.129 -1.172 4.621 930 HB THR 490 HB THR 490 4.440 0.048 5.196 931 HG1 THR 490 HG1 THR 490 5.715 1.060 6.689 932 HG21 THR 490 HG21 THR 490 4.573 -2.385 4.878 933 HG22 THR 490 HG22 THR 490 4.166 -1.977 6.544 934 HG23 THR 490 HG23 THR 490 5.806 -2.480 6.135 935 H ASP 491 HN ASP 491 5.296 1.305 2.918 936 HA ASP 491 HA ASP 491 3.911 -0.424 1.166 937 HB2 ASP 491 HB2 ASP 491 3.161 1.848 1.410 938 HB3 ASP 491 HB1 ASP 491 4.723 2.476 0.885 939 H ASN 492 HN ASN 492 6.962 1.329 0.887 940 HA ASN 492 HA ASN 492 7.581 0.585 -1.745 941 HB2 ASN 492 HB2 ASN 492 9.057 1.733 0.535 942 HB3 ASN 492 HB1 ASN 492 10.047 0.858 -0.629 943 HD21 ASN 492 HD21 ASN 492 8.133 3.641 -0.034 944 HD22 ASN 492 HD22 ASN 492 8.477 4.458 -1.522 945 H ILE 493 HN ILE 493 8.034 -1.080 1.306 946 HA ILE 493 HA ILE 493 9.845 -3.053 0.454 947 HB ILE 493 HB ILE 493 7.659 -3.308 2.537 948 HG12 ILE 493 HG12 ILE 493 10.596 -2.633 2.826 949 HG13 ILE 493 HG11 ILE 493 9.267 -1.493 2.999 950 HG21 ILE 493 HG21 ILE 493 8.953 -5.173 3.431 951 HG22 ILE 493 HG22 ILE 493 10.119 -5.006 2.117 952 HG23 ILE 493 HG23 ILE 493 8.459 -5.490 1.768 953 HD11 ILE 493 HD11 ILE 493 9.811 -3.869 4.762 954 HD12 ILE 493 HD12 ILE 493 8.455 -2.756 4.932 955 HD13 ILE 493 HD13 ILE 493 10.106 -2.178 5.160 956 H LEU 494 HN LEU 494 6.318 -2.913 0.365 957 HA LEU 494 HA LEU 494 5.943 -5.518 -0.719 958 HB2 LEU 494 HB2 LEU 494 4.199 -3.072 -0.531 959 HB3 LEU 494 HB1 LEU 494 3.654 -4.534 -1.334 960 HG LEU 494 HG LEU 494 4.705 -4.884 1.407 961 HD11 LEU 494 HD11 LEU 494 2.482 -4.214 2.343 962 HD12 LEU 494 HD12 LEU 494 2.145 -3.423 0.802 963 HD13 LEU 494 HD13 LEU 494 3.492 -2.873 1.800 964 HD21 LEU 494 HD21 LEU 494 3.251 -6.361 -0.458 965 HD22 LEU 494 HD22 LEU 494 2.084 -5.931 0.798 966 HD23 LEU 494 HD23 LEU 494 3.569 -6.789 1.222 967 H GLU 495 HN GLU 495 6.830 -2.492 -2.071 968 HA GLU 495 HA GLU 495 6.004 -3.146 -4.758 969 HB2 GLU 495 HB2 GLU 495 7.703 -0.890 -3.687 970 HB3 GLU 495 HB1 GLU 495 7.188 -1.045 -5.361 971 HG2 GLU 495 HG2 GLU 495 5.395 -0.704 -2.968 972 HG3 GLU 495 HG1 GLU 495 5.783 0.521 -4.175 973 H GLY 496 HN GLY 496 8.757 -3.670 -2.778 974 HA2 GLY 496 HA2 GLY 496 10.327 -5.370 -3.502 975 HA3 GLY 496 HA1 GLY 496 10.198 -4.720 -5.129 976 H ARG 497 HN ARG 497 10.320 -2.263 -2.823 977 HA ARG 497 HA ARG 497 12.815 -1.302 -3.738 978 HB2 ARG 497 HB2 ARG 497 10.980 0.100 -2.754 979 HB3 ARG 497 HB1 ARG 497 11.391 -0.551 -1.177 980 HG2 ARG 497 HG2 ARG 497 12.440 1.540 -1.278 981 HG3 ARG 497 HG1 ARG 497 13.727 0.366 -1.565 982 HD2 ARG 497 HD2 ARG 497 13.959 2.178 -3.133 983 HD3 ARG 497 HD1 ARG 497 13.453 0.730 -3.995 984 HE ARG 497 HE ARG 497 11.254 2.404 -3.212 985 HH11 ARG 497 HH11 ARG 497 13.674 1.826 -5.681 986 HH12 ARG 497 HH12 ARG 497 12.800 2.670 -6.915 987 HH21 ARG 497 HH21 ARG 497 10.097 3.517 -4.836 988 HH22 ARG 497 HH22 ARG 497 10.766 3.638 -6.434 989 H ILE 498 HN ILE 498 11.840 -2.775 -0.667 990 HA ILE 498 HA ILE 498 14.641 -3.184 0.057 991 HB ILE 498 HB ILE 498 12.069 -3.465 1.617 992 HG12 ILE 498 HG12 ILE 498 13.525 -1.891 3.141 993 HG13 ILE 498 HG11 ILE 498 14.429 -1.617 1.655 994 HG21 ILE 498 HG21 ILE 498 13.433 -5.342 2.267 995 HG22 ILE 498 HG22 ILE 498 13.455 -4.134 3.553 996 HG23 ILE 498 HG23 ILE 498 14.837 -4.292 2.469 997 HD11 ILE 498 HD11 ILE 498 11.584 -0.931 2.275 998 HD12 ILE 498 HD12 ILE 498 12.162 -1.054 0.615 999 HD13 ILE 498 HD13 ILE 498 12.889 0.115 1.714 1000 H GLN 499 HN GLN 499 15.594 -5.054 -0.337 1001 HA GLN 499 HA GLN 499 14.226 -7.198 -1.579 1002 HB2 GLN 499 HB2 GLN 499 16.991 -6.544 -0.862 1003 HB3 GLN 499 HB1 GLN 499 16.628 -8.266 -0.803 1004 HG2 GLN 499 HG2 GLN 499 16.033 -6.501 -3.162 1005 HG3 GLN 499 HG1 GLN 499 17.500 -7.464 -2.988 1006 HE21 GLN 499 HE21 GLN 499 15.177 -7.540 -4.892 1007 HE22 GLN 499 HE22 GLN 499 14.645 -9.187 -4.864 1008 H VAL 500 HN VAL 500 13.476 -9.069 -0.813 1009 HA VAL 500 HA VAL 500 13.166 -9.322 2.058 1010 HB VAL 500 HB VAL 500 11.743 -11.327 1.425 1011 HG11 VAL 500 HG11 VAL 500 10.733 -9.194 1.947 1012 HG12 VAL 500 HG12 VAL 500 9.877 -9.930 0.591 1013 HG13 VAL 500 HG13 VAL 500 11.022 -8.619 0.306 1014 HG21 VAL 500 HG21 VAL 500 12.181 -10.240 -1.357 1015 HG22 VAL 500 HG22 VAL 500 11.014 -11.485 -0.913 1016 HG23 VAL 500 HG23 VAL 500 12.743 -11.797 -0.748 1017 HA PRO 501 HA PRO 501 16.307 -12.323 2.803 1018 HB2 PRO 501 HB2 PRO 501 14.325 -14.001 4.231 1019 HB3 PRO 501 HB1 PRO 501 15.815 -13.256 4.838 1020 HG2 PRO 501 HG2 PRO 501 13.427 -12.329 5.541 1021 HG3 PRO 501 HG1 PRO 501 14.808 -11.247 5.274 1022 HD2 PRO 501 HD2 PRO 501 12.472 -11.793 3.497 1023 HD3 PRO 501 HD1 PRO 501 13.326 -10.267 3.809 1024 H PHE 502 HN PHE 502 16.792 -13.314 0.903 1025 HA PHE 502 HA PHE 502 15.084 -15.556 0.043 1026 HB2 PHE 502 HB2 PHE 502 15.672 -13.481 -1.470 1027 HB3 PHE 502 HB1 PHE 502 17.198 -14.328 -1.694 1028 HD1 PHE 502 HD1 PHE 502 13.534 -14.653 -2.090 1029 HD2 PHE 502 HD2 PHE 502 17.374 -16.107 -3.204 1030 HE1 PHE 502 HE1 PHE 502 12.502 -16.012 -3.865 1031 HE2 PHE 502 HE2 PHE 502 16.352 -17.470 -4.977 1032 HZ PHE 502 HZ PHE 502 13.908 -17.420 -5.312 1033 HA PRO 503 HA PRO 503 18.375 -18.247 1.312 1034 HB2 PRO 503 HB2 PRO 503 17.678 -20.428 -0.199 1035 HB3 PRO 503 HB1 PRO 503 16.865 -19.979 1.310 1036 HG2 PRO 503 HG2 PRO 503 16.010 -19.509 -1.496 1037 HG3 PRO 503 HG1 PRO 503 15.045 -19.958 -0.076 1038 HD2 PRO 503 HD2 PRO 503 15.127 -17.434 -1.038 1039 HD3 PRO 503 HD1 PRO 503 14.903 -17.804 0.684 1040 H THR 504 HN THR 504 20.237 -17.391 0.468 1041 HA THR 504 HA THR 504 21.271 -18.617 -1.909 1042 HB THR 504 HB THR 504 20.021 -16.707 -2.878 1043 HG1 THR 504 HG1 THR 504 22.858 -16.734 -2.994 1044 HG21 THR 504 HG21 THR 504 20.154 -15.148 -1.012 1045 HG22 THR 504 HG22 THR 504 20.817 -14.413 -2.473 1046 HG23 THR 504 HG23 THR 504 21.901 -15.022 -1.223
Contact the webmaster for help, if required. Saturday, May 25, 2024 1:39:35 PM GMT (wattos1)