NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
611042 | 2n9x | 25919 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 -9.676 2.368 8.614 2 H2 MET 1 H2 MET 1 -8.725 3.434 7.841 3 H3 MET 1 H3 MET 1 -10.253 3.866 8.160 4 HA MET 1 HA MET 1 -10.077 3.404 5.893 5 HB2 MET 1 HB2 MET 1 -9.504 0.469 6.440 6 HB3 MET 1 HB3 MET 1 -9.469 1.356 4.911 7 HG2 MET 1 HG2 MET 1 -7.536 2.732 6.034 8 HG3 MET 1 HG3 MET 1 -7.454 1.371 7.156 9 HE1 MET 1 HE1 MET 1 -4.354 0.548 5.119 10 HE2 MET 1 HE2 MET 1 -4.920 2.047 5.877 11 HE3 MET 1 HE3 MET 1 -5.123 0.492 6.723 12 HA PRO 2 HA PRO 2 -13.801 0.494 6.809 13 HB2 PRO 2 HB2 PRO 2 -14.078 1.107 9.767 14 HB3 PRO 2 HB3 PRO 2 -14.607 -0.346 8.865 15 HG2 PRO 2 HG2 PRO 2 -12.323 -0.429 10.278 16 HG3 PRO 2 HG3 PRO 2 -12.332 -1.090 8.608 17 HD2 PRO 2 HD2 PRO 2 -11.386 1.628 9.564 18 HD3 PRO 2 HD3 PRO 2 -10.583 0.472 8.458 19 H SER 3 H SER 3 -13.384 3.707 8.301 20 HA SER 3 HA SER 3 -16.200 4.438 7.793 21 HB2 SER 3 HB2 SER 3 -15.547 6.586 8.784 22 HB3 SER 3 HB3 SER 3 -15.170 5.201 9.828 23 HG SER 3 HG SER 3 -13.433 6.710 9.726 24 H GLU 4 H GLU 4 -13.033 4.958 6.301 25 HA GLU 4 HA GLU 4 -13.873 6.986 4.427 26 HB2 GLU 4 HB2 GLU 4 -11.440 5.137 4.400 27 HB3 GLU 4 HB3 GLU 4 -11.686 6.555 3.405 28 HG2 GLU 4 HG2 GLU 4 -10.378 7.469 5.004 29 HG3 GLU 4 HG3 GLU 4 -11.965 7.891 5.618 30 H LYS 5 H LYS 5 -13.288 6.579 2.009 31 HA LYS 5 HA LYS 5 -15.148 4.687 0.802 32 HB2 LYS 5 HB2 LYS 5 -12.920 6.356 -0.459 33 HB3 LYS 5 HB3 LYS 5 -14.233 5.564 -1.321 34 HG2 LYS 5 HG2 LYS 5 -14.505 7.903 0.604 35 HG3 LYS 5 HG3 LYS 5 -14.627 7.936 -1.154 36 HD2 LYS 5 HD2 LYS 5 -16.651 6.458 -1.032 37 HD3 LYS 5 HD3 LYS 5 -16.530 6.475 0.735 38 HE2 LYS 5 HE2 LYS 5 -18.210 8.044 0.143 39 HE3 LYS 5 HE3 LYS 5 -16.818 8.946 0.738 40 HZ1 LYS 5 HZ1 LYS 5 -16.240 9.470 -1.586 41 HZ2 LYS 5 HZ2 LYS 5 -17.490 8.575 -2.147 42 HZ3 LYS 5 HZ3 LYS 5 -17.773 9.928 -1.297 43 H THR 6 H THR 6 -14.277 3.344 -1.138 44 HA THR 6 HA THR 6 -13.199 1.073 -0.298 45 HB THR 6 HB THR 6 -12.520 1.748 -3.113 46 HG1 THR 6 HG1 THR 6 -14.687 1.724 -3.669 47 HG21 THR 6 HG21 THR 6 -12.375 -0.603 -2.336 48 HG22 THR 6 HG22 THR 6 -14.075 -0.530 -1.810 49 HG23 THR 6 HG23 THR 6 -13.661 -0.410 -3.534 50 H PHE 7 H PHE 7 -11.387 -0.064 -0.034 51 HA PHE 7 HA PHE 7 -9.333 0.990 1.206 52 HB2 PHE 7 HB2 PHE 7 -9.786 -1.304 1.275 53 HB3 PHE 7 HB3 PHE 7 -9.426 -1.516 -0.422 54 HD1 PHE 7 HD1 PHE 7 -7.745 -3.148 -0.503 55 HD2 PHE 7 HD2 PHE 7 -7.349 0.153 2.241 56 HE1 PHE 7 HE1 PHE 7 -5.521 -3.980 0.197 57 HE2 PHE 7 HE2 PHE 7 -5.123 -0.668 2.920 58 HZ PHE 7 HZ PHE 7 -4.208 -2.763 1.909 59 H LYS 8 H LYS 8 -8.978 0.757 -2.359 60 HA LYS 8 HA LYS 8 -6.210 1.493 -2.461 61 HB2 LYS 8 HB2 LYS 8 -7.515 0.554 -4.344 62 HB3 LYS 8 HB3 LYS 8 -8.460 2.046 -4.458 63 HG2 LYS 8 HG2 LYS 8 -6.458 3.320 -5.096 64 HG3 LYS 8 HG3 LYS 8 -5.430 1.901 -4.810 65 HD2 LYS 8 HD2 LYS 8 -6.561 0.709 -6.658 66 HD3 LYS 8 HD3 LYS 8 -7.622 2.114 -6.922 67 HE2 LYS 8 HE2 LYS 8 -5.633 3.527 -7.391 68 HE3 LYS 8 HE3 LYS 8 -4.574 2.142 -7.133 69 HZ1 LYS 8 HZ1 LYS 8 -6.638 2.340 -9.282 70 HZ2 LYS 8 HZ2 LYS 8 -5.033 2.484 -9.506 71 HZ3 LYS 8 HZ3 LYS 8 -5.657 1.047 -9.050 72 H GLN 9 H GLN 9 -9.015 3.540 -1.892 73 HA GLN 9 HA GLN 9 -7.763 6.101 -2.250 74 HB2 GLN 9 HB2 GLN 9 -10.161 5.721 -2.158 75 HB3 GLN 9 HB3 GLN 9 -10.079 5.182 -0.487 76 HG2 GLN 9 HG2 GLN 9 -9.054 7.954 -1.107 77 HG3 GLN 9 HG3 GLN 9 -10.785 7.664 -1.230 78 HE21 GLN 9 HE21 GLN 9 -10.868 8.491 2.240 79 HE22 GLN 9 HE22 GLN 9 -11.286 9.053 0.622 80 H ARG 10 H ARG 10 -7.583 3.736 0.358 81 HA ARG 10 HA ARG 10 -6.093 5.564 2.163 82 HB2 ARG 10 HB2 ARG 10 -6.990 2.670 2.464 83 HB3 ARG 10 HB3 ARG 10 -6.070 3.545 3.681 84 HG2 ARG 10 HG2 ARG 10 -8.812 4.479 2.696 85 HG3 ARG 10 HG3 ARG 10 -8.581 3.387 4.035 86 HD2 ARG 10 HD2 ARG 10 -8.800 5.466 5.082 87 HD3 ARG 10 HD3 ARG 10 -7.061 5.151 5.104 88 HE ARG 10 HE ARG 10 -8.239 6.738 2.866 89 HH11 ARG 10 HH11 ARG 10 -6.474 7.021 5.905 90 HH12 ARG 10 HH12 ARG 10 -5.811 8.564 5.461 91 HH21 ARG 10 HH21 ARG 10 -7.301 8.655 2.358 92 HH22 ARG 10 HH22 ARG 10 -6.318 9.495 3.522 93 H ARG 11 H ARG 11 -5.373 2.448 0.457 94 HA ARG 11 HA ARG 11 -2.504 3.239 0.539 95 HB2 ARG 11 HB2 ARG 11 -3.299 2.038 2.678 96 HB3 ARG 11 HB3 ARG 11 -3.404 0.572 1.712 97 HG2 ARG 11 HG2 ARG 11 -1.045 0.552 1.297 98 HG3 ARG 11 HG3 ARG 11 -0.881 2.257 1.758 99 HD2 ARG 11 HD2 ARG 11 -1.590 0.041 3.684 100 HD3 ARG 11 HD3 ARG 11 0.047 0.678 3.453 101 HE ARG 11 HE ARG 11 -1.172 2.977 4.014 102 HH11 ARG 11 HH11 ARG 11 -2.132 0.780 7.181 103 HH12 ARG 11 HH12 ARG 11 -1.229 0.010 5.862 104 HH21 ARG 11 HH21 ARG 11 -2.160 3.887 5.831 105 HH22 ARG 11 HH22 ARG 11 -2.599 2.828 7.158 106 H THR 12 H THR 12 -1.329 2.677 -1.095 107 HA THR 12 HA THR 12 -2.409 0.948 -3.232 108 HB THR 12 HB THR 12 -1.005 1.944 -4.745 109 HG1 THR 12 HG1 THR 12 0.817 3.143 -4.171 110 HG21 THR 12 HG21 THR 12 -1.465 4.241 -2.795 111 HG22 THR 12 HG22 THR 12 -1.274 4.327 -4.556 112 HG23 THR 12 HG23 THR 12 -2.716 3.563 -3.866 113 H PHE 13 H PHE 13 -0.879 -0.462 -4.525 114 HA PHE 13 HA PHE 13 -0.133 -2.626 -3.026 115 HB2 PHE 13 HB2 PHE 13 -0.571 -3.048 -5.210 116 HB3 PHE 13 HB3 PHE 13 0.500 -1.793 -5.801 117 HD1 PHE 13 HD1 PHE 13 0.297 -5.337 -4.867 118 HD2 PHE 13 HD2 PHE 13 2.946 -2.107 -5.957 119 HE1 PHE 13 HE1 PHE 13 2.082 -6.980 -5.451 120 HE2 PHE 13 HE2 PHE 13 4.719 -3.742 -6.502 121 HZ PHE 13 HZ PHE 13 4.286 -6.177 -6.256 122 H GLU 14 H GLU 14 2.385 -0.297 -4.117 123 HA GLU 14 HA GLU 14 4.518 -1.703 -2.792 124 HB2 GLU 14 HB2 GLU 14 4.830 -0.106 -4.606 125 HB3 GLU 14 HB3 GLU 14 4.251 1.221 -3.581 126 HG2 GLU 14 HG2 GLU 14 6.164 0.935 -2.066 127 HG3 GLU 14 HG3 GLU 14 6.701 -0.484 -2.976 128 H GLN 15 H GLN 15 2.232 0.753 -1.606 129 HA GLN 15 HA GLN 15 3.566 1.149 0.954 130 HB2 GLN 15 HB2 GLN 15 0.706 1.637 0.085 131 HB3 GLN 15 HB3 GLN 15 1.439 2.221 1.587 132 HG2 GLN 15 HG2 GLN 15 2.916 3.696 0.394 133 HG3 GLN 15 HG3 GLN 15 2.480 3.013 -1.169 134 HE21 GLN 15 HE21 GLN 15 0.588 6.203 -0.768 135 HE22 GLN 15 HE22 GLN 15 2.294 5.783 -0.726 136 H ARG 16 H ARG 16 1.183 -1.205 -0.286 137 HA ARG 16 HA ARG 16 0.711 -2.472 2.312 138 HB2 ARG 16 HB2 ARG 16 0.363 -3.623 -0.485 139 HB3 ARG 16 HB3 ARG 16 -0.214 -4.356 1.011 140 HG2 ARG 16 HG2 ARG 16 -1.742 -2.469 1.408 141 HG3 ARG 16 HG3 ARG 16 -1.103 -1.620 0.007 142 HD2 ARG 16 HD2 ARG 16 -1.793 -3.786 -1.313 143 HD3 ARG 16 HD3 ARG 16 -2.845 -4.065 0.092 144 HE ARG 16 HE ARG 16 -3.405 -1.451 -0.555 145 HH11 ARG 16 HH11 ARG 16 -3.591 -4.384 -2.523 146 HH12 ARG 16 HH12 ARG 16 -4.726 -3.641 -3.604 147 HH21 ARG 16 HH21 ARG 16 -4.769 -0.608 -1.965 148 HH22 ARG 16 HH22 ARG 16 -5.464 -1.583 -3.248 149 H VAL 17 H VAL 17 3.187 -2.893 -0.232 150 HA VAL 17 HA VAL 17 4.480 -5.156 1.016 151 HB VAL 17 HB VAL 17 5.850 -3.042 -0.681 152 HG11 VAL 17 HG11 VAL 17 7.448 -4.441 0.506 153 HG12 VAL 17 HG12 VAL 17 6.573 -5.910 0.035 154 HG13 VAL 17 HG13 VAL 17 7.403 -4.926 -1.190 155 HG21 VAL 17 HG21 VAL 17 5.516 -4.730 -2.532 156 HG22 VAL 17 HG22 VAL 17 4.348 -5.553 -1.471 157 HG23 VAL 17 HG23 VAL 17 4.059 -3.901 -2.020 158 H GLU 18 H GLU 18 4.944 -1.614 1.474 159 HA GLU 18 HA GLU 18 6.870 -1.856 3.588 160 HB2 GLU 18 HB2 GLU 18 4.802 0.293 3.028 161 HB3 GLU 18 HB3 GLU 18 6.002 0.380 4.325 162 HG2 GLU 18 HG2 GLU 18 7.825 0.148 2.677 163 HG3 GLU 18 HG3 GLU 18 6.643 0.084 1.365 164 H ASP 19 H ASP 19 3.241 -1.801 3.834 165 HA ASP 19 HA ASP 19 3.119 -2.266 6.609 166 HB2 ASP 19 HB2 ASP 19 1.263 -3.187 4.411 167 HB3 ASP 19 HB3 ASP 19 0.983 -3.559 6.095 168 H VAL 20 H VAL 20 3.530 -4.787 4.097 169 HA VAL 20 HA VAL 20 3.608 -7.018 5.906 170 HB VAL 20 HB VAL 20 4.883 -6.644 3.172 171 HG11 VAL 20 HG11 VAL 20 5.083 -9.120 3.117 172 HG12 VAL 20 HG12 VAL 20 6.156 -8.415 4.324 173 HG13 VAL 20 HG13 VAL 20 4.641 -9.195 4.835 174 HG21 VAL 20 HG21 VAL 20 2.464 -8.276 4.070 175 HG22 VAL 20 HG22 VAL 20 2.365 -6.679 3.307 176 HG23 VAL 20 HG23 VAL 20 3.045 -8.047 2.409 177 H ARG 21 H ARG 21 6.260 -4.882 4.708 178 HA ARG 21 HA ARG 21 8.364 -6.242 6.081 179 HB2 ARG 21 HB2 ARG 21 8.760 -4.661 4.242 180 HB3 ARG 21 HB3 ARG 21 8.117 -3.334 5.194 181 HG2 ARG 21 HG2 ARG 21 10.533 -3.211 5.130 182 HG3 ARG 21 HG3 ARG 21 9.979 -3.471 6.781 183 HD2 ARG 21 HD2 ARG 21 11.954 -4.826 6.366 184 HD3 ARG 21 HD3 ARG 21 10.578 -5.874 6.611 185 HE ARG 21 HE ARG 21 10.668 -6.582 4.380 186 HH11 ARG 21 HH11 ARG 21 11.706 -6.970 2.463 187 HH12 ARG 21 HH12 ARG 21 13.092 -6.029 2.010 188 HH21 ARG 21 HH21 ARG 21 13.037 -4.013 4.782 189 HH22 ARG 21 HH22 ARG 21 13.815 -4.383 3.269 190 H LEU 22 H LEU 22 6.510 -3.339 7.178 191 HA LEU 22 HA LEU 22 7.701 -3.183 9.751 192 HB2 LEU 22 HB2 LEU 22 5.078 -2.210 8.540 193 HB3 LEU 22 HB3 LEU 22 5.360 -2.104 10.272 194 HG LEU 22 HG LEU 22 7.602 -0.966 9.686 195 HD11 LEU 22 HD11 LEU 22 7.619 -1.312 7.246 196 HD12 LEU 22 HD12 LEU 22 6.124 -0.352 7.108 197 HD13 LEU 22 HD13 LEU 22 7.637 0.399 7.663 198 HD21 LEU 22 HD21 LEU 22 6.497 1.245 9.613 199 HD22 LEU 22 HD22 LEU 22 4.961 0.463 9.173 200 HD23 LEU 22 HD23 LEU 22 5.698 0.166 10.768 201 H ILE 23 H ILE 23 4.712 -5.004 8.767 202 HA ILE 23 HA ILE 23 4.265 -5.793 11.493 203 HB ILE 23 HB ILE 23 2.619 -5.554 9.564 204 HG12 ILE 23 HG12 ILE 23 2.105 -6.117 11.917 205 HG13 ILE 23 HG13 ILE 23 0.980 -6.662 10.707 206 HG21 ILE 23 HG21 ILE 23 3.152 -8.527 9.161 207 HG22 ILE 23 HG22 ILE 23 1.854 -7.530 8.453 208 HG23 ILE 23 HG23 ILE 23 3.541 -7.223 8.028 209 HD11 ILE 23 HD11 ILE 23 1.743 -8.992 10.944 210 HD12 ILE 23 HD12 ILE 23 2.983 -8.474 12.107 211 HD13 ILE 23 HD13 ILE 23 1.282 -8.318 12.513 212 H ARG 24 H ARG 24 5.884 -7.529 8.775 213 HA ARG 24 HA ARG 24 6.472 -9.928 10.256 214 HB2 ARG 24 HB2 ARG 24 7.875 -8.521 7.941 215 HB3 ARG 24 HB3 ARG 24 8.476 -10.020 8.615 216 HG2 ARG 24 HG2 ARG 24 5.719 -9.688 7.347 217 HG3 ARG 24 HG3 ARG 24 7.157 -10.379 6.586 218 HD2 ARG 24 HD2 ARG 24 7.123 -11.998 8.710 219 HD3 ARG 24 HD3 ARG 24 5.436 -11.523 8.786 220 HE ARG 24 HE ARG 24 5.013 -12.550 6.672 221 HH11 ARG 24 HH11 ARG 24 5.324 -14.279 5.303 222 HH12 ARG 24 HH12 ARG 24 6.831 -15.155 5.346 223 HH21 ARG 24 HH21 ARG 24 8.333 -13.146 7.673 224 HH22 ARG 24 HH22 ARG 24 8.491 -14.517 6.614 225 H GLU 25 H GLU 25 8.156 -6.796 10.239 226 HA GLU 25 HA GLU 25 10.348 -7.712 11.860 227 HB2 GLU 25 HB2 GLU 25 10.543 -5.719 10.496 228 HB3 GLU 25 HB3 GLU 25 9.200 -4.956 11.335 229 HG2 GLU 25 HG2 GLU 25 11.218 -3.953 12.093 230 HG3 GLU 25 HG3 GLU 25 10.509 -4.842 13.423 231 H GLN 26 H GLN 26 7.296 -6.000 12.786 232 HA GLN 26 HA GLN 26 8.117 -6.080 15.588 233 HB2 GLN 26 HB2 GLN 26 6.298 -4.647 16.034 234 HB3 GLN 26 HB3 GLN 26 7.047 -4.141 14.520 235 HG2 GLN 26 HG2 GLN 26 5.192 -5.477 13.337 236 HG3 GLN 26 HG3 GLN 26 4.410 -5.616 14.899 237 HE21 GLN 26 HE21 GLN 26 2.734 -2.743 13.389 238 HE22 GLN 26 HE22 GLN 26 2.703 -4.501 13.347 239 H HIS 27 H HIS 27 5.682 -7.931 13.728 240 HA HIS 27 HA HIS 27 5.174 -9.656 16.109 241 HB2 HIS 27 HB2 HIS 27 2.933 -8.284 14.576 242 HB3 HIS 27 HB3 HIS 27 2.725 -9.496 15.829 243 HD1 HIS 27 HD1 HIS 27 4.551 -8.277 18.135 244 HD2 HIS 27 HD2 HIS 27 1.730 -6.276 15.711 245 HE1 HIS 27 HE1 HIS 27 3.709 -6.265 19.506 246 HE2 HIS 27 HE2 HIS 27 2.013 -5.037 18.005 247 HA PRO 28 HA PRO 28 5.578 -11.906 11.992 248 HB2 PRO 28 HB2 PRO 28 7.457 -13.782 12.773 249 HB3 PRO 28 HB3 PRO 28 7.848 -12.161 12.130 250 HG2 PRO 28 HG2 PRO 28 7.649 -13.021 15.034 251 HG3 PRO 28 HG3 PRO 28 8.973 -12.109 14.240 252 HD2 PRO 28 HD2 PRO 28 7.065 -10.823 15.634 253 HD3 PRO 28 HD3 PRO 28 7.642 -10.148 14.082 254 H THR 29 H THR 29 4.749 -12.960 15.239 255 HA THR 29 HA THR 29 3.702 -15.551 14.543 256 HB THR 29 HB THR 29 2.713 -15.646 16.650 257 HG1 THR 29 HG1 THR 29 2.354 -13.800 17.901 258 HG21 THR 29 HG21 THR 29 4.427 -15.038 18.224 259 HG22 THR 29 HG22 THR 29 5.246 -15.524 16.735 260 HG23 THR 29 HG23 THR 29 5.096 -13.798 17.146 261 H LYS 30 H LYS 30 2.468 -12.431 13.779 262 HA LYS 30 HA LYS 30 -0.154 -13.675 13.075 263 HB2 LYS 30 HB2 LYS 30 0.487 -10.714 13.388 264 HB3 LYS 30 HB3 LYS 30 -1.065 -11.414 12.889 265 HG2 LYS 30 HG2 LYS 30 -1.050 -12.714 15.084 266 HG3 LYS 30 HG3 LYS 30 0.312 -11.705 15.594 267 HD2 LYS 30 HD2 LYS 30 -1.108 -9.679 15.418 268 HD3 LYS 30 HD3 LYS 30 -2.456 -10.665 14.797 269 HE2 LYS 30 HE2 LYS 30 -2.266 -12.070 16.913 270 HE3 LYS 30 HE3 LYS 30 -1.146 -10.868 17.550 271 HZ1 LYS 30 HZ1 LYS 30 -2.966 -9.214 17.437 272 HZ2 LYS 30 HZ2 LYS 30 -3.982 -10.298 16.771 273 HZ3 LYS 30 HZ3 LYS 30 -3.421 -10.523 18.305 274 H ILE 31 H ILE 31 -0.981 -13.533 11.133 275 HA ILE 31 HA ILE 31 0.928 -13.466 8.898 276 HB ILE 31 HB ILE 31 -1.868 -14.625 9.210 277 HG12 ILE 31 HG12 ILE 31 -0.355 -15.781 10.717 278 HG13 ILE 31 HG13 ILE 31 -0.794 -16.817 9.374 279 HG21 ILE 31 HG21 ILE 31 0.175 -15.010 6.998 280 HG22 ILE 31 HG22 ILE 31 -1.315 -15.959 7.210 281 HG23 ILE 31 HG23 ILE 31 -1.419 -14.233 6.851 282 HD11 ILE 31 HD11 ILE 31 1.869 -15.348 9.651 283 HD12 ILE 31 HD12 ILE 31 1.577 -17.057 9.980 284 HD13 ILE 31 HD13 ILE 31 1.422 -16.451 8.325 285 HA PRO 32 HA PRO 32 -1.148 -9.706 7.462 286 HB2 PRO 32 HB2 PRO 32 0.340 -9.146 5.253 287 HB3 PRO 32 HB3 PRO 32 0.981 -8.995 6.912 288 HG2 PRO 32 HG2 PRO 32 1.364 -11.298 4.989 289 HG3 PRO 32 HG3 PRO 32 2.601 -10.450 5.966 290 HD2 PRO 32 HD2 PRO 32 1.422 -12.803 6.754 291 HD3 PRO 32 HD3 PRO 32 1.952 -11.554 7.922 292 H VAL 33 H VAL 33 -3.186 -9.932 6.700 293 HA VAL 33 HA VAL 33 -3.546 -11.094 3.982 294 HB VAL 33 HB VAL 33 -5.599 -11.395 6.138 295 HG11 VAL 33 HG11 VAL 33 -6.406 -13.239 4.657 296 HG12 VAL 33 HG12 VAL 33 -6.482 -11.666 3.879 297 HG13 VAL 33 HG13 VAL 33 -5.170 -12.787 3.466 298 HG21 VAL 33 HG21 VAL 33 -3.428 -13.393 5.440 299 HG22 VAL 33 HG22 VAL 33 -3.733 -12.626 7.011 300 HG23 VAL 33 HG23 VAL 33 -4.896 -13.777 6.368 301 H ILE 34 H ILE 34 -4.893 -10.113 2.576 302 HA ILE 34 HA ILE 34 -6.150 -7.508 3.362 303 HB ILE 34 HB ILE 34 -4.989 -8.522 0.768 304 HG12 ILE 34 HG12 ILE 34 -4.329 -5.903 2.171 305 HG13 ILE 34 HG13 ILE 34 -3.601 -7.397 2.740 306 HG21 ILE 34 HG21 ILE 34 -7.030 -7.333 0.134 307 HG22 ILE 34 HG22 ILE 34 -6.622 -5.981 1.216 308 HG23 ILE 34 HG23 ILE 34 -5.640 -6.310 -0.218 309 HD11 ILE 34 HD11 ILE 34 -3.315 -6.297 -0.066 310 HD12 ILE 34 HD12 ILE 34 -2.078 -6.350 1.206 311 HD13 ILE 34 HD13 ILE 34 -2.680 -7.857 0.491 312 H ILE 35 H ILE 35 -8.310 -7.147 2.837 313 HA ILE 35 HA ILE 35 -9.821 -9.341 1.604 314 HB ILE 35 HB ILE 35 -10.091 -9.858 3.919 315 HG12 ILE 35 HG12 ILE 35 -12.618 -8.525 2.829 316 HG13 ILE 35 HG13 ILE 35 -12.045 -10.155 2.387 317 HG21 ILE 35 HG21 ILE 35 -11.113 -8.260 5.533 318 HG22 ILE 35 HG22 ILE 35 -9.603 -7.638 4.897 319 HG23 ILE 35 HG23 ILE 35 -11.151 -7.010 4.287 320 HD11 ILE 35 HD11 ILE 35 -13.033 -9.325 5.132 321 HD12 ILE 35 HD12 ILE 35 -13.873 -10.309 3.935 322 HD13 ILE 35 HD13 ILE 35 -12.383 -10.926 4.673 323 H GLU 36 H GLU 36 -11.348 -8.742 0.162 324 HA GLU 36 HA GLU 36 -12.412 -5.955 0.210 325 HB2 GLU 36 HB2 GLU 36 -10.229 -5.960 -1.063 326 HB3 GLU 36 HB3 GLU 36 -10.949 -7.104 -2.208 327 HG2 GLU 36 HG2 GLU 36 -12.702 -5.409 -2.751 328 HG3 GLU 36 HG3 GLU 36 -11.965 -4.294 -1.595 329 H ARG 37 H ARG 37 -14.406 -5.746 -0.610 330 HA ARG 37 HA ARG 37 -16.063 -8.042 -1.083 331 HB2 ARG 37 HB2 ARG 37 -16.840 -5.981 -0.090 332 HB3 ARG 37 HB3 ARG 37 -16.436 -5.067 -1.546 333 HG2 ARG 37 HG2 ARG 37 -18.238 -6.057 -2.788 334 HG3 ARG 37 HG3 ARG 37 -18.539 -7.266 -1.523 335 HD2 ARG 37 HD2 ARG 37 -20.187 -5.374 -1.546 336 HD3 ARG 37 HD3 ARG 37 -19.380 -5.611 0.001 337 HE ARG 37 HE ARG 37 -19.004 -3.347 -1.909 338 HH11 ARG 37 HH11 ARG 37 -18.278 -4.602 1.344 339 HH12 ARG 37 HH12 ARG 37 -17.301 -3.173 1.677 340 HH21 ARG 37 HH21 ARG 37 -17.712 -1.565 -1.205 341 HH22 ARG 37 HH22 ARG 37 -17.067 -1.646 0.438 342 H TYR 38 H TYR 38 -16.813 -8.986 -2.892 343 HA TYR 38 HA TYR 38 -15.397 -8.873 -5.287 344 HB2 TYR 38 HB2 TYR 38 -16.406 -10.869 -4.770 345 HB3 TYR 38 HB3 TYR 38 -17.971 -10.122 -4.512 346 HD1 TYR 38 HD1 TYR 38 -15.541 -10.362 -7.404 347 HD2 TYR 38 HD2 TYR 38 -19.599 -10.844 -5.992 348 HE1 TYR 38 HE1 TYR 38 -16.239 -11.129 -9.657 349 HE2 TYR 38 HE2 TYR 38 -20.266 -11.653 -8.242 350 HH TYR 38 HH TYR 38 -17.985 -11.795 -10.995 351 H LYS 39 H LYS 39 -15.203 -7.582 -6.928 352 HA LYS 39 HA LYS 39 -16.727 -5.188 -7.143 353 HB2 LYS 39 HB2 LYS 39 -14.806 -6.508 -9.107 354 HB3 LYS 39 HB3 LYS 39 -15.454 -4.871 -9.288 355 HG2 LYS 39 HG2 LYS 39 -14.459 -4.206 -7.122 356 HG3 LYS 39 HG3 LYS 39 -13.778 -5.827 -6.924 357 HD2 LYS 39 HD2 LYS 39 -12.465 -5.535 -9.014 358 HD3 LYS 39 HD3 LYS 39 -13.139 -3.900 -9.198 359 HE2 LYS 39 HE2 LYS 39 -12.151 -3.255 -7.005 360 HE3 LYS 39 HE3 LYS 39 -11.492 -4.879 -6.818 361 HZ1 LYS 39 HZ1 LYS 39 -10.147 -4.489 -8.834 362 HZ2 LYS 39 HZ2 LYS 39 -10.746 -2.972 -8.982 363 HZ3 LYS 39 HZ3 LYS 39 -9.816 -3.361 -7.699 364 H GLY 40 H GLY 40 -17.195 -8.268 -8.787 365 HA2 GLY 40 HA2 GLY 40 -18.903 -7.315 -10.908 366 HA3 GLY 40 HA3 GLY 40 -18.704 -8.983 -10.380 367 H GLU 41 H GLU 41 -19.609 -8.124 -7.539 368 HA GLU 41 HA GLU 41 -22.348 -7.223 -7.920 369 HB2 GLU 41 HB2 GLU 41 -22.703 -9.522 -8.476 370 HB3 GLU 41 HB3 GLU 41 -21.765 -10.075 -7.103 371 HG2 GLU 41 HG2 GLU 41 -24.100 -10.495 -6.758 372 HG3 GLU 41 HG3 GLU 41 -23.493 -9.383 -5.550 373 H LYS 42 H LYS 42 -21.885 -5.541 -6.624 374 HA LYS 42 HA LYS 42 -20.728 -5.805 -3.960 375 HB2 LYS 42 HB2 LYS 42 -21.914 -3.437 -5.454 376 HB3 LYS 42 HB3 LYS 42 -21.101 -3.332 -3.888 377 HG2 LYS 42 HG2 LYS 42 -18.996 -4.150 -4.851 378 HG3 LYS 42 HG3 LYS 42 -19.762 -4.344 -6.438 379 HD2 LYS 42 HD2 LYS 42 -20.248 -1.930 -6.528 380 HD3 LYS 42 HD3 LYS 42 -19.489 -1.697 -4.940 381 HE2 LYS 42 HE2 LYS 42 -17.315 -2.444 -5.819 382 HE3 LYS 42 HE3 LYS 42 -18.047 -2.816 -7.389 383 HZ1 LYS 42 HZ1 LYS 42 -18.556 -0.437 -7.640 384 HZ2 LYS 42 HZ2 LYS 42 -17.874 -0.087 -6.197 385 HZ3 LYS 42 HZ3 LYS 42 -16.954 -0.641 -7.425 386 H GLN 43 H GLN 43 -22.858 -7.436 -3.924 387 HA GLN 43 HA GLN 43 -25.332 -6.210 -3.050 388 HB2 GLN 43 HB2 GLN 43 -24.966 -8.449 -4.174 389 HB3 GLN 43 HB3 GLN 43 -24.396 -9.083 -2.630 390 HG2 GLN 43 HG2 GLN 43 -26.618 -8.499 -1.630 391 HG3 GLN 43 HG3 GLN 43 -27.140 -7.897 -3.211 392 HE21 GLN 43 HE21 GLN 43 -27.113 -11.352 -4.589 393 HE22 GLN 43 HE22 GLN 43 -26.603 -9.739 -5.081 394 H LEU 44 H LEU 44 -22.573 -7.610 -1.305 395 HA LEU 44 HA LEU 44 -23.786 -7.401 1.333 396 HB2 LEU 44 HB2 LEU 44 -20.942 -7.893 0.345 397 HB3 LEU 44 HB3 LEU 44 -21.385 -7.904 2.054 398 HG LEU 44 HG LEU 44 -22.415 -9.819 -0.091 399 HD11 LEU 44 HD11 LEU 44 -21.162 -11.492 1.234 400 HD12 LEU 44 HD12 LEU 44 -20.100 -10.213 0.598 401 HD13 LEU 44 HD13 LEU 44 -20.587 -10.205 2.314 402 HD21 LEU 44 HD21 LEU 44 -23.032 -9.692 2.892 403 HD22 LEU 44 HD22 LEU 44 -24.203 -9.541 1.558 404 HD23 LEU 44 HD23 LEU 44 -23.395 -11.082 1.846 405 HA PRO 45 HA PRO 45 -23.263 -3.213 2.184 406 HB2 PRO 45 HB2 PRO 45 -22.765 -3.071 4.888 407 HB3 PRO 45 HB3 PRO 45 -24.331 -3.579 4.181 408 HG2 PRO 45 HG2 PRO 45 -22.048 -5.363 5.111 409 HG3 PRO 45 HG3 PRO 45 -23.788 -5.483 5.548 410 HD2 PRO 45 HD2 PRO 45 -22.762 -7.004 3.577 411 HD3 PRO 45 HD3 PRO 45 -24.366 -6.238 3.360 412 H VAL 46 H VAL 46 -21.903 -1.434 2.753 413 HA VAL 46 HA VAL 46 -19.117 -1.793 2.124 414 HB VAL 46 HB VAL 46 -19.017 0.575 1.962 415 HG11 VAL 46 HG11 VAL 46 -20.171 -0.685 0.140 416 HG12 VAL 46 HG12 VAL 46 -21.733 -0.255 0.870 417 HG13 VAL 46 HG13 VAL 46 -20.653 1.009 0.262 418 HG21 VAL 46 HG21 VAL 46 -20.907 2.080 2.463 419 HG22 VAL 46 HG22 VAL 46 -21.816 0.735 3.173 420 HG23 VAL 46 HG23 VAL 46 -20.325 1.312 3.938 421 H LEU 47 H LEU 47 -19.645 -3.063 4.546 422 HA LEU 47 HA LEU 47 -18.346 -1.533 6.714 423 HB2 LEU 47 HB2 LEU 47 -19.251 -4.429 6.468 424 HB3 LEU 47 HB3 LEU 47 -18.533 -3.738 7.923 425 HG LEU 47 HG LEU 47 -21.142 -2.769 6.666 426 HD11 LEU 47 HD11 LEU 47 -20.660 -4.538 9.093 427 HD12 LEU 47 HD12 LEU 47 -22.234 -3.917 8.542 428 HD13 LEU 47 HD13 LEU 47 -21.335 -5.053 7.528 429 HD21 LEU 47 HD21 LEU 47 -21.472 -1.650 8.862 430 HD22 LEU 47 HD22 LEU 47 -19.833 -2.131 9.348 431 HD23 LEU 47 HD23 LEU 47 -20.080 -1.000 7.997 432 H ASP 48 H ASP 48 -16.706 -1.144 4.900 433 HA ASP 48 HA ASP 48 -14.979 -3.102 3.948 434 HB2 ASP 48 HB2 ASP 48 -14.688 -0.106 4.148 435 HB3 ASP 48 HB3 ASP 48 -13.498 -1.135 3.354 436 H LYS 49 H LYS 49 -14.226 -4.505 5.584 437 HA LYS 49 HA LYS 49 -12.447 -3.618 7.704 438 HB2 LYS 49 HB2 LYS 49 -12.615 -6.348 6.348 439 HB3 LYS 49 HB3 LYS 49 -11.839 -6.011 7.893 440 HG2 LYS 49 HG2 LYS 49 -14.824 -5.884 7.290 441 HG3 LYS 49 HG3 LYS 49 -13.963 -7.102 8.207 442 HD2 LYS 49 HD2 LYS 49 -14.938 -5.871 9.859 443 HD3 LYS 49 HD3 LYS 49 -13.305 -5.201 9.854 444 HE2 LYS 49 HE2 LYS 49 -14.089 -3.222 8.619 445 HE3 LYS 49 HE3 LYS 49 -15.679 -3.970 8.367 446 HZ1 LYS 49 HZ1 LYS 49 -15.795 -2.393 10.209 447 HZ2 LYS 49 HZ2 LYS 49 -15.969 -3.888 10.850 448 HZ3 LYS 49 HZ3 LYS 49 -14.533 -3.086 10.983 449 H THR 50 H THR 50 -11.785 -4.321 4.372 450 HA THR 50 HA THR 50 -10.024 -4.159 3.054 451 HB THR 50 HB THR 50 -8.727 -2.366 2.995 452 HG1 THR 50 HG1 THR 50 -7.821 -1.387 4.660 453 HG21 THR 50 HG21 THR 50 -11.189 -1.720 3.342 454 HG22 THR 50 HG22 THR 50 -10.721 -1.316 5.020 455 HG23 THR 50 HG23 THR 50 -9.976 -0.465 3.648 456 H LYS 51 H LYS 51 -8.614 -4.669 6.271 457 HA LYS 51 HA LYS 51 -7.096 -6.945 5.167 458 HB2 LYS 51 HB2 LYS 51 -4.888 -6.109 5.878 459 HB3 LYS 51 HB3 LYS 51 -5.609 -5.074 4.668 460 HG2 LYS 51 HG2 LYS 51 -6.408 -3.991 7.196 461 HG3 LYS 51 HG3 LYS 51 -4.719 -4.433 7.376 462 HD2 LYS 51 HD2 LYS 51 -5.939 -2.601 5.270 463 HD3 LYS 51 HD3 LYS 51 -5.030 -2.082 6.677 464 HE2 LYS 51 HE2 LYS 51 -3.952 -3.605 4.242 465 HE3 LYS 51 HE3 LYS 51 -3.728 -1.902 4.609 466 HZ1 LYS 51 HZ1 LYS 51 -2.456 -4.207 5.993 467 HZ2 LYS 51 HZ2 LYS 51 -1.753 -2.846 5.375 468 HZ3 LYS 51 HZ3 LYS 51 -2.567 -2.755 6.758 469 H PHE 52 H PHE 52 -5.889 -8.111 6.857 470 HA PHE 52 HA PHE 52 -6.406 -7.493 9.582 471 HB2 PHE 52 HB2 PHE 52 -7.426 -9.775 10.193 472 HB3 PHE 52 HB3 PHE 52 -8.411 -8.427 9.676 473 HD1 PHE 52 HD1 PHE 52 -6.635 -11.376 8.174 474 HD2 PHE 52 HD2 PHE 52 -10.099 -8.832 8.117 475 HE1 PHE 52 HE1 PHE 52 -7.703 -12.881 6.515 476 HE2 PHE 52 HE2 PHE 52 -11.188 -10.370 6.503 477 HZ PHE 52 HZ PHE 52 -9.985 -12.376 5.660 478 H LEU 53 H LEU 53 -5.342 -8.672 11.213 479 HA LEU 53 HA LEU 53 -2.849 -10.001 10.186 480 HB2 LEU 53 HB2 LEU 53 -3.261 -8.357 12.719 481 HB3 LEU 53 HB3 LEU 53 -1.758 -9.122 12.197 482 HG LEU 53 HG LEU 53 -3.185 -6.833 10.777 483 HD11 LEU 53 HD11 LEU 53 -2.141 -6.188 12.905 484 HD12 LEU 53 HD12 LEU 53 -0.628 -6.957 12.427 485 HD13 LEU 53 HD13 LEU 53 -1.228 -5.531 11.535 486 HD21 LEU 53 HD21 LEU 53 -2.066 -8.124 9.092 487 HD22 LEU 53 HD22 LEU 53 -1.077 -6.707 9.427 488 HD23 LEU 53 HD23 LEU 53 -0.608 -8.296 10.096 489 H VAL 54 H VAL 54 -3.448 -12.120 10.265 490 HA VAL 54 HA VAL 54 -5.099 -13.010 12.540 491 HB VAL 54 HB VAL 54 -4.358 -14.858 10.303 492 HG11 VAL 54 HG11 VAL 54 -6.536 -15.828 10.812 493 HG12 VAL 54 HG12 VAL 54 -5.607 -15.663 12.316 494 HG13 VAL 54 HG13 VAL 54 -6.906 -14.508 11.947 495 HG21 VAL 54 HG21 VAL 54 -5.125 -12.909 9.091 496 HG22 VAL 54 HG22 VAL 54 -6.395 -14.130 9.087 497 HG23 VAL 54 HG23 VAL 54 -6.529 -12.736 10.185 498 HA PRO 55 HA PRO 55 -1.543 -14.859 14.628 499 HB2 PRO 55 HB2 PRO 55 -3.554 -16.518 16.080 500 HB3 PRO 55 HB3 PRO 55 -2.251 -15.493 16.729 501 HG2 PRO 55 HG2 PRO 55 -4.923 -14.769 16.781 502 HG3 PRO 55 HG3 PRO 55 -3.591 -13.588 16.679 503 HD2 PRO 55 HD2 PRO 55 -5.448 -14.508 14.525 504 HD3 PRO 55 HD3 PRO 55 -4.632 -12.937 14.743 505 H ASP 56 H ASP 56 -0.357 -16.573 14.033 506 HA ASP 56 HA ASP 56 -0.760 -18.182 11.917 507 HB2 ASP 56 HB2 ASP 56 0.971 -19.718 12.947 508 HB3 ASP 56 HB3 ASP 56 1.362 -18.007 12.813 509 H HIS 57 H HIS 57 -1.702 -19.185 15.128 510 HA HIS 57 HA HIS 57 -2.632 -21.823 14.272 511 HB2 HIS 57 HB2 HIS 57 -2.902 -22.241 16.662 512 HB3 HIS 57 HB3 HIS 57 -1.328 -21.566 16.274 513 HD1 HIS 57 HD1 HIS 57 -0.852 -18.990 17.084 514 HD2 HIS 57 HD2 HIS 57 -4.254 -21.035 18.552 515 HE1 HIS 57 HE1 HIS 57 -1.592 -17.755 19.232 516 HE2 HIS 57 HE2 HIS 57 -3.646 -19.027 20.139 517 H VAL 58 H VAL 58 -4.282 -18.965 13.980 518 HA VAL 58 HA VAL 58 -6.966 -19.802 14.865 519 HB VAL 58 HB VAL 58 -5.957 -17.682 12.968 520 HG11 VAL 58 HG11 VAL 58 -8.848 -18.233 13.744 521 HG12 VAL 58 HG12 VAL 58 -8.274 -16.736 12.987 522 HG13 VAL 58 HG13 VAL 58 -8.159 -18.253 12.099 523 HG21 VAL 58 HG21 VAL 58 -6.853 -16.174 14.756 524 HG22 VAL 58 HG22 VAL 58 -7.314 -17.596 15.708 525 HG23 VAL 58 HG23 VAL 58 -5.602 -17.264 15.383 526 H ASN 59 H ASN 59 -8.399 -21.101 13.718 527 HA ASN 59 HA ASN 59 -7.548 -22.386 11.211 528 HB2 ASN 59 HB2 ASN 59 -10.060 -22.593 12.926 529 HB3 ASN 59 HB3 ASN 59 -9.833 -23.487 11.430 530 HD21 ASN 59 HD21 ASN 59 -10.288 -24.841 13.802 531 HD22 ASN 59 HD22 ASN 59 -8.814 -25.697 14.231 532 H MET 60 H MET 60 -8.511 -22.181 9.159 533 HA MET 60 HA MET 60 -9.402 -19.640 8.324 534 HB2 MET 60 HB2 MET 60 -8.411 -21.373 6.873 535 HB3 MET 60 HB3 MET 60 -9.858 -22.367 7.053 536 HG2 MET 60 HG2 MET 60 -9.951 -21.251 4.929 537 HG3 MET 60 HG3 MET 60 -11.203 -20.569 5.960 538 HE1 MET 60 HE1 MET 60 -10.663 -19.111 3.394 539 HE2 MET 60 HE2 MET 60 -11.653 -18.398 4.690 540 HE3 MET 60 HE3 MET 60 -10.393 -17.429 3.903 541 H SER 61 H SER 61 -11.384 -22.457 9.302 542 HA SER 61 HA SER 61 -13.975 -21.366 8.863 543 HB2 SER 61 HB2 SER 61 -14.627 -23.057 10.598 544 HB3 SER 61 HB3 SER 61 -13.647 -23.712 9.269 545 HG SER 61 HG SER 61 -12.967 -24.349 11.459 546 H GLU 62 H GLU 62 -11.769 -21.047 11.673 547 HA GLU 62 HA GLU 62 -13.663 -19.524 13.258 548 HB2 GLU 62 HB2 GLU 62 -11.823 -20.847 14.257 549 HB3 GLU 62 HB3 GLU 62 -10.646 -19.792 13.492 550 HG2 GLU 62 HG2 GLU 62 -10.818 -19.160 15.775 551 HG3 GLU 62 HG3 GLU 62 -11.498 -17.860 14.810 552 H LEU 63 H LEU 63 -10.961 -18.575 11.073 553 HA LEU 63 HA LEU 63 -11.232 -15.738 11.356 554 HB2 LEU 63 HB2 LEU 63 -9.327 -16.739 10.195 555 HB3 LEU 63 HB3 LEU 63 -10.384 -17.469 8.994 556 HG LEU 63 HG LEU 63 -11.038 -15.165 8.199 557 HD11 LEU 63 HD11 LEU 63 -8.765 -14.282 10.037 558 HD12 LEU 63 HD12 LEU 63 -9.593 -13.266 8.836 559 HD13 LEU 63 HD13 LEU 63 -10.479 -13.867 10.232 560 HD21 LEU 63 HD21 LEU 63 -9.302 -16.507 7.075 561 HD22 LEU 63 HD22 LEU 63 -9.008 -14.776 6.942 562 HD23 LEU 63 HD23 LEU 63 -8.056 -15.748 8.096 563 H ILE 64 H ILE 64 -12.878 -17.972 9.076 564 HA ILE 64 HA ILE 64 -14.626 -16.127 7.813 565 HB ILE 64 HB ILE 64 -14.749 -19.065 8.465 566 HG12 ILE 64 HG12 ILE 64 -14.799 -17.692 5.757 567 HG13 ILE 64 HG13 ILE 64 -13.297 -17.979 6.638 568 HG21 ILE 64 HG21 ILE 64 -17.111 -18.479 8.595 569 HG22 ILE 64 HG22 ILE 64 -17.005 -17.586 7.055 570 HG23 ILE 64 HG23 ILE 64 -16.805 -19.342 7.102 571 HD11 ILE 64 HD11 ILE 64 -15.212 -20.161 5.774 572 HD12 ILE 64 HD12 ILE 64 -13.660 -19.757 5.016 573 HD13 ILE 64 HD13 ILE 64 -13.700 -20.400 6.670 574 H LYS 65 H LYS 65 -15.107 -17.870 10.921 575 HA LYS 65 HA LYS 65 -17.724 -16.888 11.436 576 HB2 LYS 65 HB2 LYS 65 -16.474 -18.832 12.502 577 HB3 LYS 65 HB3 LYS 65 -15.608 -17.651 13.489 578 HG2 LYS 65 HG2 LYS 65 -17.918 -16.832 14.273 579 HG3 LYS 65 HG3 LYS 65 -18.587 -18.264 13.472 580 HD2 LYS 65 HD2 LYS 65 -16.446 -18.262 15.655 581 HD3 LYS 65 HD3 LYS 65 -18.160 -18.567 15.944 582 HE2 LYS 65 HE2 LYS 65 -18.134 -20.643 14.783 583 HE3 LYS 65 HE3 LYS 65 -16.597 -20.292 13.987 584 HZ1 LYS 65 HZ1 LYS 65 -15.449 -20.470 16.072 585 HZ2 LYS 65 HZ2 LYS 65 -16.852 -20.698 16.922 586 HZ3 LYS 65 HZ3 LYS 65 -16.329 -21.840 15.870 587 H ILE 66 H ILE 66 -14.597 -15.548 12.693 588 HA ILE 66 HA ILE 66 -15.904 -13.316 13.989 589 HB ILE 66 HB ILE 66 -13.790 -13.975 14.764 590 HG12 ILE 66 HG12 ILE 66 -14.469 -11.477 14.769 591 HG13 ILE 66 HG13 ILE 66 -12.871 -11.969 15.278 592 HG21 ILE 66 HG21 ILE 66 -12.653 -14.846 12.838 593 HG22 ILE 66 HG22 ILE 66 -12.528 -13.246 12.094 594 HG23 ILE 66 HG23 ILE 66 -11.649 -13.624 13.593 595 HD11 ILE 66 HD11 ILE 66 -13.476 -10.733 12.565 596 HD12 ILE 66 HD12 ILE 66 -12.767 -9.913 13.967 597 HD13 ILE 66 HD13 ILE 66 -11.869 -11.199 13.171 598 H ILE 67 H ILE 67 -14.478 -13.599 10.703 599 HA ILE 67 HA ILE 67 -14.998 -10.816 10.070 600 HB ILE 67 HB ILE 67 -14.428 -13.229 8.319 601 HG12 ILE 67 HG12 ILE 67 -12.551 -12.653 9.785 602 HG13 ILE 67 HG13 ILE 67 -12.175 -12.264 8.124 603 HG21 ILE 67 HG21 ILE 67 -13.841 -11.569 6.559 604 HG22 ILE 67 HG22 ILE 67 -15.564 -11.607 6.923 605 HG23 ILE 67 HG23 ILE 67 -14.571 -10.280 7.550 606 HD11 ILE 67 HD11 ILE 67 -11.324 -10.577 9.681 607 HD12 ILE 67 HD12 ILE 67 -12.546 -9.842 8.626 608 HD13 ILE 67 HD13 ILE 67 -12.934 -10.263 10.311 609 H ARG 68 H ARG 68 -16.976 -13.773 9.439 610 HA ARG 68 HA ARG 68 -19.130 -12.444 8.128 611 HB2 ARG 68 HB2 ARG 68 -18.829 -14.917 8.312 612 HB3 ARG 68 HB3 ARG 68 -19.249 -14.835 10.028 613 HG2 ARG 68 HG2 ARG 68 -21.477 -13.860 9.361 614 HG3 ARG 68 HG3 ARG 68 -21.006 -14.050 7.668 615 HD2 ARG 68 HD2 ARG 68 -22.518 -15.836 8.346 616 HD3 ARG 68 HD3 ARG 68 -20.938 -16.471 7.912 617 HE ARG 68 HE ARG 68 -20.661 -17.282 10.034 618 HH11 ARG 68 HH11 ARG 68 -23.236 -14.858 10.348 619 HH12 ARG 68 HH12 ARG 68 -23.633 -15.431 11.947 620 HH21 ARG 68 HH21 ARG 68 -21.286 -17.920 12.049 621 HH22 ARG 68 HH22 ARG 68 -22.561 -17.090 12.881 622 H ARG 69 H ARG 69 -18.610 -12.941 11.637 623 HA ARG 69 HA ARG 69 -20.935 -11.470 12.489 624 HB2 ARG 69 HB2 ARG 69 -19.851 -13.063 13.963 625 HB3 ARG 69 HB3 ARG 69 -18.329 -12.183 13.900 626 HG2 ARG 69 HG2 ARG 69 -19.474 -11.826 16.035 627 HG3 ARG 69 HG3 ARG 69 -19.267 -10.318 15.160 628 HD2 ARG 69 HD2 ARG 69 -21.718 -10.606 14.349 629 HD3 ARG 69 HD3 ARG 69 -21.823 -11.941 15.480 630 HE ARG 69 HE ARG 69 -21.769 -10.462 17.285 631 HH11 ARG 69 HH11 ARG 69 -21.215 -8.531 14.356 632 HH12 ARG 69 HH12 ARG 69 -21.621 -7.061 15.198 633 HH21 ARG 69 HH21 ARG 69 -22.212 -8.532 18.237 634 HH22 ARG 69 HH22 ARG 69 -22.151 -7.058 17.323 635 H ARG 70 H ARG 70 -17.568 -10.323 12.004 636 HA ARG 70 HA ARG 70 -18.152 -7.574 12.742 637 HB2 ARG 70 HB2 ARG 70 -15.916 -8.888 11.138 638 HB3 ARG 70 HB3 ARG 70 -15.967 -7.153 11.405 639 HG2 ARG 70 HG2 ARG 70 -15.957 -9.169 13.687 640 HG3 ARG 70 HG3 ARG 70 -14.510 -8.408 13.011 641 HD2 ARG 70 HD2 ARG 70 -15.380 -6.173 13.570 642 HD3 ARG 70 HD3 ARG 70 -16.838 -6.891 14.263 643 HE ARG 70 HE ARG 70 -15.406 -8.032 15.940 644 HH11 ARG 70 HH11 ARG 70 -13.899 -5.134 14.457 645 HH12 ARG 70 HH12 ARG 70 -13.295 -4.689 16.059 646 HH21 ARG 70 HH21 ARG 70 -14.260 -7.343 17.776 647 HH22 ARG 70 HH22 ARG 70 -13.358 -5.834 17.653 648 H LEU 71 H LEU 71 -18.492 -9.228 9.667 649 HA LEU 71 HA LEU 71 -19.401 -6.798 8.275 650 HB2 LEU 71 HB2 LEU 71 -19.423 -9.752 7.545 651 HB3 LEU 71 HB3 LEU 71 -19.957 -8.466 6.467 652 HG LEU 71 HG LEU 71 -17.117 -8.655 7.567 653 HD11 LEU 71 HD11 LEU 71 -18.264 -9.481 4.866 654 HD12 LEU 71 HD12 LEU 71 -16.541 -9.473 5.307 655 HD13 LEU 71 HD13 LEU 71 -17.666 -10.578 6.127 656 HD21 LEU 71 HD21 LEU 71 -17.692 -6.375 6.887 657 HD22 LEU 71 HD22 LEU 71 -16.616 -7.099 5.693 658 HD23 LEU 71 HD23 LEU 71 -18.353 -6.976 5.346 659 H GLN 72 H GLN 72 -20.889 -8.397 10.724 660 HA GLN 72 HA GLN 72 -22.962 -8.510 11.541 661 HB2 GLN 72 HB2 GLN 72 -22.718 -6.046 10.693 662 HB3 GLN 72 HB3 GLN 72 -23.921 -6.515 9.488 663 HG2 GLN 72 HG2 GLN 72 -25.508 -7.100 11.324 664 HG3 GLN 72 HG3 GLN 72 -24.256 -6.746 12.517 665 HE21 GLN 72 HE21 GLN 72 -26.322 -3.727 12.537 666 HE22 GLN 72 HE22 GLN 72 -26.375 -5.382 13.128 667 H LEU 73 H LEU 73 -22.344 -10.414 9.318 668 HA LEU 73 HA LEU 73 -24.929 -10.689 7.891 669 HB2 LEU 73 HB2 LEU 73 -22.421 -12.330 7.562 670 HB3 LEU 73 HB3 LEU 73 -23.790 -12.246 6.459 671 HG LEU 73 HG LEU 73 -21.790 -10.033 7.087 672 HD11 LEU 73 HD11 LEU 73 -22.247 -11.552 4.516 673 HD12 LEU 73 HD12 LEU 73 -21.017 -10.301 4.825 674 HD13 LEU 73 HD13 LEU 73 -20.921 -11.851 5.678 675 HD21 LEU 73 HD21 LEU 73 -24.072 -9.987 5.059 676 HD22 LEU 73 HD22 LEU 73 -24.011 -9.034 6.565 677 HD23 LEU 73 HD23 LEU 73 -22.838 -8.730 5.291 678 H ASN 74 H ASN 74 -26.482 -11.530 9.113 679 HA ASN 74 HA ASN 74 -26.188 -13.528 11.141 680 HB2 ASN 74 HB2 ASN 74 -28.055 -11.804 10.796 681 HB3 ASN 74 HB3 ASN 74 -28.678 -12.840 9.505 682 HD21 ASN 74 HD21 ASN 74 -30.715 -13.845 12.309 683 HD22 ASN 74 HD22 ASN 74 -30.612 -12.621 11.050 684 H ALA 75 H ALA 75 -27.287 -15.736 11.044 685 HA ALA 75 HA ALA 75 -25.893 -17.425 9.310 686 HB1 ALA 75 HB1 ALA 75 -26.887 -18.058 11.485 687 HB2 ALA 75 HB2 ALA 75 -28.520 -17.930 10.779 688 HB3 ALA 75 HB3 ALA 75 -27.392 -19.177 10.207 689 H ASN 76 H ASN 76 -29.151 -16.092 8.802 690 HA ASN 76 HA ASN 76 -29.821 -17.706 6.497 691 HB2 ASN 76 HB2 ASN 76 -31.456 -16.656 8.043 692 HB3 ASN 76 HB3 ASN 76 -30.904 -15.050 7.550 693 HD21 ASN 76 HD21 ASN 76 -33.248 -14.991 4.937 694 HD22 ASN 76 HD22 ASN 76 -32.280 -14.114 6.117 695 H GLN 77 H GLN 77 -27.809 -14.860 6.821 696 HA GLN 77 HA GLN 77 -28.172 -13.961 4.041 697 HB2 GLN 77 HB2 GLN 77 -27.974 -12.329 5.868 698 HB3 GLN 77 HB3 GLN 77 -26.395 -12.971 6.306 699 HG2 GLN 77 HG2 GLN 77 -26.188 -10.885 5.070 700 HG3 GLN 77 HG3 GLN 77 -25.432 -12.208 4.181 701 HE21 GLN 77 HE21 GLN 77 -28.854 -10.459 2.651 702 HE22 GLN 77 HE22 GLN 77 -28.406 -10.145 4.320 703 H ALA 78 H ALA 78 -26.930 -14.628 2.362 704 HA ALA 78 HA ALA 78 -25.046 -16.781 2.730 705 HB1 ALA 78 HB1 ALA 78 -24.876 -16.712 0.287 706 HB2 ALA 78 HB2 ALA 78 -26.568 -16.611 0.796 707 HB3 ALA 78 HB3 ALA 78 -25.711 -15.144 0.245 708 H PHE 79 H PHE 79 -22.839 -16.825 2.697 709 HA PHE 79 HA PHE 79 -21.258 -14.523 1.909 710 HB2 PHE 79 HB2 PHE 79 -21.755 -13.658 3.990 711 HB3 PHE 79 HB3 PHE 79 -21.605 -15.200 4.799 712 HD1 PHE 79 HD1 PHE 79 -19.528 -15.962 5.728 713 HD2 PHE 79 HD2 PHE 79 -19.639 -12.478 3.182 714 HE1 PHE 79 HE1 PHE 79 -17.219 -15.368 6.422 715 HE2 PHE 79 HE2 PHE 79 -17.321 -11.908 3.873 716 HZ PHE 79 HZ PHE 79 -16.119 -13.352 5.497 717 H PHE 80 H PHE 80 -19.226 -14.858 1.297 718 HA PHE 80 HA PHE 80 -17.913 -17.475 1.878 719 HB2 PHE 80 HB2 PHE 80 -18.341 -16.241 -0.879 720 HB3 PHE 80 HB3 PHE 80 -17.358 -17.654 -0.532 721 HD1 PHE 80 HD1 PHE 80 -18.334 -19.841 -0.152 722 HD2 PHE 80 HD2 PHE 80 -20.823 -16.381 -0.788 723 HE1 PHE 80 HE1 PHE 80 -20.294 -21.323 -0.526 724 HE2 PHE 80 HE2 PHE 80 -22.781 -17.868 -1.161 725 HZ PHE 80 HZ PHE 80 -22.520 -20.335 -1.026 726 H LEU 81 H LEU 81 -15.696 -17.359 2.139 727 HA LEU 81 HA LEU 81 -14.291 -14.836 1.320 728 HB2 LEU 81 HB2 LEU 81 -13.503 -16.953 3.371 729 HB3 LEU 81 HB3 LEU 81 -12.382 -15.765 2.720 730 HG LEU 81 HG LEU 81 -14.821 -15.184 4.423 731 HD11 LEU 81 HD11 LEU 81 -12.735 -16.021 5.572 732 HD12 LEU 81 HD12 LEU 81 -11.868 -14.620 4.913 733 HD13 LEU 81 HD13 LEU 81 -13.207 -14.381 6.053 734 HD21 LEU 81 HD21 LEU 81 -14.652 -13.348 2.874 735 HD22 LEU 81 HD22 LEU 81 -13.990 -12.805 4.409 736 HD23 LEU 81 HD23 LEU 81 -12.881 -13.212 3.089 737 H LEU 82 H LEU 82 -13.188 -14.895 -0.418 738 HA LEU 82 HA LEU 82 -12.652 -17.469 -1.781 739 HB2 LEU 82 HB2 LEU 82 -12.823 -14.738 -3.068 740 HB3 LEU 82 HB3 LEU 82 -12.958 -16.310 -3.829 741 HG LEU 82 HG LEU 82 -15.045 -15.030 -1.986 742 HD11 LEU 82 HD11 LEU 82 -14.812 -13.926 -4.182 743 HD12 LEU 82 HD12 LEU 82 -15.037 -15.486 -4.997 744 HD13 LEU 82 HD13 LEU 82 -16.350 -14.776 -4.029 745 HD21 LEU 82 HD21 LEU 82 -15.181 -17.463 -1.814 746 HD22 LEU 82 HD22 LEU 82 -16.504 -16.889 -2.835 747 HD23 LEU 82 HD23 LEU 82 -15.068 -17.634 -3.578 748 H VAL 83 H VAL 83 -10.640 -17.985 -1.007 749 HA VAL 83 HA VAL 83 -8.530 -16.007 -0.649 750 HB VAL 83 HB VAL 83 -8.155 -19.006 -0.658 751 HG11 VAL 83 HG11 VAL 83 -6.308 -18.468 0.861 752 HG12 VAL 83 HG12 VAL 83 -6.101 -17.606 -0.664 753 HG13 VAL 83 HG13 VAL 83 -6.701 -16.735 0.769 754 HG21 VAL 83 HG21 VAL 83 -9.950 -18.629 0.924 755 HG22 VAL 83 HG22 VAL 83 -8.459 -18.837 1.843 756 HG23 VAL 83 HG23 VAL 83 -9.128 -17.204 1.602 757 H ASN 84 H ASN 84 -7.143 -15.259 -2.120 758 HA ASN 84 HA ASN 84 -6.498 -14.706 -4.242 759 HB2 ASN 84 HB2 ASN 84 -4.898 -16.486 -3.509 760 HB3 ASN 84 HB3 ASN 84 -5.849 -17.670 -4.408 761 HD21 ASN 84 HD21 ASN 84 -3.270 -16.976 -6.790 762 HD22 ASN 84 HD22 ASN 84 -3.714 -18.007 -5.416 763 H GLY 85 H GLY 85 -9.240 -14.925 -4.084 764 HA2 GLY 85 HA2 GLY 85 -10.949 -14.606 -5.606 765 HA3 GLY 85 HA3 GLY 85 -9.939 -15.244 -6.899 766 H HIS 86 H HIS 86 -9.979 -17.642 -4.486 767 HA HIS 86 HA HIS 86 -12.417 -18.959 -5.647 768 HB2 HIS 86 HB2 HIS 86 -9.681 -20.199 -5.177 769 HB3 HIS 86 HB3 HIS 86 -11.130 -21.081 -5.658 770 HD1 HIS 86 HD1 HIS 86 -8.330 -19.112 -7.193 771 HD2 HIS 86 HD2 HIS 86 -12.333 -20.146 -8.076 772 HE1 HIS 86 HE1 HIS 86 -8.656 -18.662 -9.709 773 HE2 HIS 86 HE2 HIS 86 -11.092 -19.313 -10.246 774 H SER 87 H SER 87 -13.740 -20.106 -4.352 775 HA SER 87 HA SER 87 -13.815 -19.353 -1.620 776 HB2 SER 87 HB2 SER 87 -15.820 -19.908 -2.906 777 HB3 SER 87 HB3 SER 87 -15.310 -21.609 -2.987 778 HG SER 87 HG SER 87 -16.729 -21.355 -1.260 779 H MET 88 H MET 88 -13.277 -20.186 0.257 780 HA MET 88 HA MET 88 -12.484 -23.061 0.483 781 HB2 MET 88 HB2 MET 88 -11.000 -20.752 1.800 782 HB3 MET 88 HB3 MET 88 -10.722 -22.465 2.108 783 HG2 MET 88 HG2 MET 88 -10.174 -22.773 -0.317 784 HG3 MET 88 HG3 MET 88 -10.251 -21.019 -0.514 785 HE1 MET 88 HE1 MET 88 -7.823 -21.164 -1.587 786 HE2 MET 88 HE2 MET 88 -6.412 -21.855 -0.757 787 HE3 MET 88 HE3 MET 88 -7.738 -22.915 -1.278 788 H VAL 89 H VAL 89 -15.033 -21.582 1.012 789 HA VAL 89 HA VAL 89 -15.281 -20.849 3.671 790 HB VAL 89 HB VAL 89 -16.823 -20.376 1.717 791 HG11 VAL 89 HG11 VAL 89 -18.877 -21.687 1.559 792 HG12 VAL 89 HG12 VAL 89 -17.488 -22.729 1.209 793 HG13 VAL 89 HG13 VAL 89 -18.304 -22.825 2.786 794 HG21 VAL 89 HG21 VAL 89 -17.160 -19.457 3.972 795 HG22 VAL 89 HG22 VAL 89 -18.694 -19.833 3.172 796 HG23 VAL 89 HG23 VAL 89 -18.079 -20.912 4.431 797 H SER 90 H SER 90 -15.554 -24.147 2.523 798 HA SER 90 HA SER 90 -16.652 -25.124 5.071 799 HB2 SER 90 HB2 SER 90 -15.716 -26.597 2.581 800 HB3 SER 90 HB3 SER 90 -16.559 -27.326 3.961 801 HG SER 90 HG SER 90 -18.022 -26.783 2.282 802 H VAL 91 H VAL 91 -13.455 -24.338 4.206 803 HA VAL 91 HA VAL 91 -12.301 -26.796 5.243 804 HB VAL 91 HB VAL 91 -11.526 -25.393 3.184 805 HG11 VAL 91 HG11 VAL 91 -9.522 -24.098 3.556 806 HG12 VAL 91 HG12 VAL 91 -10.837 -23.383 4.503 807 HG13 VAL 91 HG13 VAL 91 -9.586 -24.367 5.303 808 HG21 VAL 91 HG21 VAL 91 -9.666 -26.936 5.027 809 HG22 VAL 91 HG22 VAL 91 -10.704 -27.592 3.748 810 HG23 VAL 91 HG23 VAL 91 -9.348 -26.546 3.325 811 H SER 92 H SER 92 -11.179 -27.283 7.009 812 HA SER 92 HA SER 92 -11.389 -25.423 9.281 813 HB2 SER 92 HB2 SER 92 -10.546 -28.338 9.115 814 HB3 SER 92 HB3 SER 92 -10.758 -27.407 10.612 815 HG SER 92 HG SER 92 -12.650 -28.612 10.064 816 H THR 93 H THR 93 -8.896 -25.978 7.054 817 HA THR 93 HA THR 93 -6.662 -26.443 8.483 818 HB THR 93 HB THR 93 -6.473 -24.555 6.176 819 HG1 THR 93 HG1 THR 93 -6.818 -26.366 4.824 820 HG21 THR 93 HG21 THR 93 -4.372 -25.430 7.114 821 HG22 THR 93 HG22 THR 93 -4.953 -27.098 6.897 822 HG23 THR 93 HG23 THR 93 -4.646 -26.058 5.489 823 HA PRO 94 HA PRO 94 -5.405 -22.825 10.860 824 HB2 PRO 94 HB2 PRO 94 -2.646 -23.889 10.226 825 HB3 PRO 94 HB3 PRO 94 -3.279 -23.243 11.774 826 HG2 PRO 94 HG2 PRO 94 -3.121 -25.914 11.424 827 HG3 PRO 94 HG3 PRO 94 -4.608 -25.211 12.138 828 HD2 PRO 94 HD2 PRO 94 -4.119 -26.082 9.278 829 HD3 PRO 94 HD3 PRO 94 -5.528 -26.402 10.331 830 H ILE 95 H ILE 95 -4.832 -20.728 10.364 831 HA ILE 95 HA ILE 95 -4.937 -20.016 7.664 832 HB ILE 95 HB ILE 95 -5.755 -18.608 9.486 833 HG12 ILE 95 HG12 ILE 95 -5.019 -16.393 8.731 834 HG13 ILE 95 HG13 ILE 95 -3.658 -17.088 7.860 835 HG21 ILE 95 HG21 ILE 95 -3.895 -18.916 11.116 836 HG22 ILE 95 HG22 ILE 95 -2.827 -17.941 10.088 837 HG23 ILE 95 HG23 ILE 95 -4.252 -17.223 10.849 838 HD11 ILE 95 HD11 ILE 95 -6.598 -17.665 7.258 839 HD12 ILE 95 HD12 ILE 95 -5.600 -16.466 6.416 840 HD13 ILE 95 HD13 ILE 95 -5.200 -18.186 6.286 841 H SER 96 H SER 96 -1.946 -20.400 9.601 842 HA SER 96 HA SER 96 -0.151 -19.194 7.772 843 HB2 SER 96 HB2 SER 96 0.238 -21.560 9.634 844 HB3 SER 96 HB3 SER 96 1.547 -20.752 8.733 845 HG SER 96 HG SER 96 1.407 -19.790 10.730 846 H GLU 97 H GLU 97 -1.558 -22.493 7.660 847 HA GLU 97 HA GLU 97 0.159 -23.393 5.469 848 HB2 GLU 97 HB2 GLU 97 -2.505 -24.446 6.475 849 HB3 GLU 97 HB3 GLU 97 -1.441 -25.292 5.362 850 HG2 GLU 97 HG2 GLU 97 -0.810 -24.581 8.267 851 HG3 GLU 97 HG3 GLU 97 -1.333 -26.149 7.681 852 H VAL 98 H VAL 98 -3.159 -22.097 5.722 853 HA VAL 98 HA VAL 98 -3.798 -22.103 2.906 854 HB VAL 98 HB VAL 98 -4.732 -20.237 5.125 855 HG11 VAL 98 HG11 VAL 98 -5.233 -19.226 2.950 856 HG12 VAL 98 HG12 VAL 98 -5.934 -20.760 2.379 857 HG13 VAL 98 HG13 VAL 98 -6.715 -19.841 3.685 858 HG21 VAL 98 HG21 VAL 98 -6.750 -21.684 5.171 859 HG22 VAL 98 HG22 VAL 98 -5.977 -22.784 4.015 860 HG23 VAL 98 HG23 VAL 98 -5.297 -22.570 5.642 861 H TYR 99 H TYR 99 -2.178 -19.721 5.013 862 HA TYR 99 HA TYR 99 -1.671 -17.787 3.033 863 HB2 TYR 99 HB2 TYR 99 -1.603 -17.072 5.217 864 HB3 TYR 99 HB3 TYR 99 -0.483 -18.321 5.708 865 HD1 TYR 99 HD1 TYR 99 1.939 -18.157 5.349 866 HD2 TYR 99 HD2 TYR 99 -0.778 -15.021 4.197 867 HE1 TYR 99 HE1 TYR 99 3.847 -16.573 5.141 868 HE2 TYR 99 HE2 TYR 99 1.118 -13.450 3.946 869 HH TYR 99 HH TYR 99 3.395 -13.244 3.917 870 H GLU 100 H GLU 100 0.771 -20.234 4.122 871 HA GLU 100 HA GLU 100 2.598 -19.459 2.068 872 HB2 GLU 100 HB2 GLU 100 2.254 -22.110 3.523 873 HB3 GLU 100 HB3 GLU 100 3.606 -21.757 2.462 874 HG2 GLU 100 HG2 GLU 100 2.936 -20.234 5.009 875 HG3 GLU 100 HG3 GLU 100 4.141 -21.500 4.858 876 H SER 101 H SER 101 -0.250 -21.495 1.804 877 HA SER 101 HA SER 101 0.404 -22.653 -0.767 878 HB2 SER 101 HB2 SER 101 -1.215 -23.632 0.797 879 HB3 SER 101 HB3 SER 101 -2.275 -22.226 0.596 880 HG SER 101 HG SER 101 -2.825 -24.065 -0.753 881 H GLU 102 H GLU 102 -1.264 -19.625 0.190 882 HA GLU 102 HA GLU 102 -1.622 -18.922 -2.702 883 HB2 GLU 102 HB2 GLU 102 -3.507 -18.557 -0.373 884 HB3 GLU 102 HB3 GLU 102 -3.761 -17.814 -1.942 885 HG2 GLU 102 HG2 GLU 102 -3.656 -20.799 -1.372 886 HG3 GLU 102 HG3 GLU 102 -5.099 -19.836 -1.621 887 H LYS 103 H LYS 103 0.200 -17.909 -0.224 888 HA LYS 103 HA LYS 103 0.175 -15.120 -0.137 889 HB2 LYS 103 HB2 LYS 103 1.595 -16.507 1.233 890 HB3 LYS 103 HB3 LYS 103 2.423 -17.154 -0.186 891 HG2 LYS 103 HG2 LYS 103 3.389 -14.822 -0.556 892 HG3 LYS 103 HG3 LYS 103 2.595 -14.338 0.951 893 HD2 LYS 103 HD2 LYS 103 4.846 -14.898 1.566 894 HD3 LYS 103 HD3 LYS 103 3.857 -16.266 2.098 895 HE2 LYS 103 HE2 LYS 103 4.462 -17.407 -0.137 896 HE3 LYS 103 HE3 LYS 103 5.589 -16.077 -0.415 897 HZ1 LYS 103 HZ1 LYS 103 6.732 -17.945 0.587 898 HZ2 LYS 103 HZ2 LYS 103 6.704 -16.755 1.708 899 HZ3 LYS 103 HZ3 LYS 103 5.676 -18.048 1.825 900 H ASP 104 H ASP 104 0.598 -13.496 -1.466 901 HA ASP 104 HA ASP 104 1.077 -14.053 -4.325 902 HB2 ASP 104 HB2 ASP 104 -0.831 -12.703 -3.387 903 HB3 ASP 104 HB3 ASP 104 0.344 -11.482 -2.884 904 H GLU 105 H GLU 105 2.287 -12.035 -5.376 905 HA GLU 105 HA GLU 105 4.918 -12.553 -5.399 906 HB2 GLU 105 HB2 GLU 105 3.558 -9.878 -5.936 907 HB3 GLU 105 HB3 GLU 105 5.215 -10.218 -6.413 908 HG2 GLU 105 HG2 GLU 105 2.787 -11.789 -7.377 909 HG3 GLU 105 HG3 GLU 105 3.574 -10.478 -8.246 910 H ASP 106 H ASP 106 3.637 -10.094 -3.160 911 HA ASP 106 HA ASP 106 6.366 -9.765 -2.084 912 HB2 ASP 106 HB2 ASP 106 4.445 -7.605 -2.764 913 HB3 ASP 106 HB3 ASP 106 5.695 -7.380 -1.539 914 H GLY 107 H GLY 107 4.359 -11.600 -1.100 915 HA2 GLY 107 HA2 GLY 107 4.633 -12.643 0.971 916 HA3 GLY 107 HA3 GLY 107 5.168 -11.137 1.702 917 H PHE 108 H PHE 108 2.351 -10.253 0.254 918 HA PHE 108 HA PHE 108 0.687 -10.850 2.612 919 HB2 PHE 108 HB2 PHE 108 -0.989 -9.314 1.371 920 HB3 PHE 108 HB3 PHE 108 0.367 -8.693 2.285 921 HD1 PHE 108 HD1 PHE 108 0.090 -10.018 -1.239 922 HD2 PHE 108 HD2 PHE 108 1.116 -6.697 1.303 923 HE1 PHE 108 HE1 PHE 108 0.982 -8.794 -3.205 924 HE2 PHE 108 HE2 PHE 108 1.993 -5.475 -0.666 925 HZ PHE 108 HZ PHE 108 1.960 -6.517 -2.903 926 H LEU 109 H LEU 109 -1.443 -11.691 2.581 927 HA LEU 109 HA LEU 109 -2.014 -13.521 0.265 928 HB2 LEU 109 HB2 LEU 109 -1.706 -14.687 2.326 929 HB3 LEU 109 HB3 LEU 109 -2.777 -13.582 3.198 930 HG LEU 109 HG LEU 109 -4.685 -14.492 1.717 931 HD11 LEU 109 HD11 LEU 109 -4.256 -16.747 0.771 932 HD12 LEU 109 HD12 LEU 109 -3.306 -15.510 -0.059 933 HD13 LEU 109 HD13 LEU 109 -2.530 -16.578 1.135 934 HD21 LEU 109 HD21 LEU 109 -4.442 -15.171 4.049 935 HD22 LEU 109 HD22 LEU 109 -4.903 -16.568 3.054 936 HD23 LEU 109 HD23 LEU 109 -3.226 -16.381 3.609 937 H TYR 110 H TYR 110 -3.910 -13.289 -0.881 938 HA TYR 110 HA TYR 110 -5.732 -11.096 -0.062 939 HB2 TYR 110 HB2 TYR 110 -5.030 -12.129 -2.775 940 HB3 TYR 110 HB3 TYR 110 -6.549 -11.308 -2.490 941 HD1 TYR 110 HD1 TYR 110 -6.701 -8.936 -2.325 942 HD2 TYR 110 HD2 TYR 110 -2.842 -10.876 -2.266 943 HE1 TYR 110 HE1 TYR 110 -5.578 -6.739 -2.649 944 HE2 TYR 110 HE2 TYR 110 -1.739 -8.676 -2.571 945 HH TYR 110 HH TYR 110 -2.020 -6.440 -2.941 946 H MET 111 H MET 111 -7.808 -11.267 0.395 947 HA MET 111 HA MET 111 -9.271 -13.755 -0.401 948 HB2 MET 111 HB2 MET 111 -9.619 -12.249 2.222 949 HB3 MET 111 HB3 MET 111 -10.566 -13.628 1.663 950 HG2 MET 111 HG2 MET 111 -8.372 -14.947 1.611 951 HG3 MET 111 HG3 MET 111 -7.643 -13.595 2.482 952 HE1 MET 111 HE1 MET 111 -6.839 -15.427 4.260 953 HE2 MET 111 HE2 MET 111 -7.954 -16.488 5.134 954 HE3 MET 111 HE3 MET 111 -7.703 -16.710 3.393 955 H VAL 112 H VAL 112 -10.751 -13.171 -1.930 956 HA VAL 112 HA VAL 112 -12.012 -10.456 -1.785 957 HB VAL 112 HB VAL 112 -12.335 -12.675 -3.833 958 HG11 VAL 112 HG11 VAL 112 -13.484 -9.853 -3.803 959 HG12 VAL 112 HG12 VAL 112 -13.537 -10.978 -5.180 960 HG13 VAL 112 HG13 VAL 112 -14.408 -11.372 -3.694 961 HG21 VAL 112 HG21 VAL 112 -11.148 -11.108 -5.335 962 HG22 VAL 112 HG22 VAL 112 -10.929 -9.972 -3.989 963 HG23 VAL 112 HG23 VAL 112 -10.132 -11.560 -3.964 964 H TYR 113 H TYR 113 -14.325 -10.264 -1.155 965 HA TYR 113 HA TYR 113 -15.502 -12.885 -0.218 966 HB2 TYR 113 HB2 TYR 113 -16.168 -12.021 1.793 967 HB3 TYR 113 HB3 TYR 113 -14.535 -11.407 1.624 968 HD1 TYR 113 HD1 TYR 113 -18.097 -10.569 1.841 969 HD2 TYR 113 HD2 TYR 113 -14.134 -9.005 1.280 970 HE1 TYR 113 HE1 TYR 113 -18.899 -8.289 2.504 971 HE2 TYR 113 HE2 TYR 113 -14.915 -6.746 2.022 972 HH TYR 113 HH TYR 113 -16.698 -5.621 3.118 973 H ALA 114 H ALA 114 -17.713 -13.103 -0.323 974 HA ALA 114 HA ALA 114 -19.306 -11.099 -1.801 975 HB1 ALA 114 HB1 ALA 114 -17.775 -12.289 -3.469 976 HB2 ALA 114 HB2 ALA 114 -18.587 -13.798 -3.046 977 HB3 ALA 114 HB3 ALA 114 -19.503 -12.469 -3.800 978 H SER 115 H SER 115 -21.521 -11.738 -2.182 979 HA SER 115 HA SER 115 -22.741 -13.559 -0.263 980 HB2 SER 115 HB2 SER 115 -24.817 -12.868 -1.585 981 HB3 SER 115 HB3 SER 115 -23.910 -11.560 -0.798 982 HG SER 115 HG SER 115 -24.291 -12.046 -3.494 983 H GLN 116 H GLN 116 -21.546 -13.820 -3.510 984 HA GLN 116 HA GLN 116 -21.940 -16.703 -3.560 985 HB2 GLN 116 HB2 GLN 116 -23.064 -16.831 -5.655 986 HB3 GLN 116 HB3 GLN 116 -24.050 -15.840 -4.597 987 HG2 GLN 116 HG2 GLN 116 -22.269 -14.835 -6.857 988 HG3 GLN 116 HG3 GLN 116 -24.011 -15.017 -6.928 989 HE21 GLN 116 HE21 GLN 116 -22.427 -11.679 -5.214 990 HE22 GLN 116 HE22 GLN 116 -21.379 -12.975 -5.821 991 H GLU 117 H GLU 117 -20.369 -17.703 -4.980 992 HA GLU 117 HA GLU 117 -17.927 -16.319 -4.971 993 HB2 GLU 117 HB2 GLU 117 -18.170 -18.732 -4.799 994 HB3 GLU 117 HB3 GLU 117 -18.698 -18.840 -6.487 995 HG2 GLU 117 HG2 GLU 117 -16.520 -18.202 -7.291 996 HG3 GLU 117 HG3 GLU 117 -16.002 -17.697 -5.685 997 H THR 118 H THR 118 -20.121 -16.735 -7.745 998 HA THR 118 HA THR 118 -18.837 -14.472 -9.026 999 HB THR 118 HB THR 118 -18.338 -15.223 -11.094 1000 HG1 THR 118 HG1 THR 118 -19.040 -17.171 -11.967 1001 HG21 THR 118 HG21 THR 118 -16.927 -17.213 -11.025 1002 HG22 THR 118 HG22 THR 118 -16.653 -16.224 -9.590 1003 HG23 THR 118 HG23 THR 118 -17.640 -17.704 -9.470 1004 H PHE 119 H PHE 119 -20.060 -13.321 -10.550 1005 HA PHE 119 HA PHE 119 -22.890 -14.112 -10.946 1006 HB2 PHE 119 HB2 PHE 119 -22.845 -12.930 -8.773 1007 HB3 PHE 119 HB3 PHE 119 -22.072 -11.553 -9.541 1008 HD1 PHE 119 HD1 PHE 119 -23.334 -9.960 -10.903 1009 HD2 PHE 119 HD2 PHE 119 -25.203 -13.467 -9.231 1010 HE1 PHE 119 HE1 PHE 119 -25.578 -9.004 -11.408 1011 HE2 PHE 119 HE2 PHE 119 -27.450 -12.507 -9.742 1012 HZ PHE 119 HZ PHE 119 -27.634 -10.277 -10.825 1013 H GLY 120 H GLY 120 -20.307 -11.740 -11.640 1014 HA2 GLY 120 HA2 GLY 120 -20.603 -11.881 -14.452 1015 HA3 GLY 120 HA3 GLY 120 -21.470 -10.447 -13.902 1016 H1 ASP 10 H1 ASP 10 -10.058 0.396 21.243 1017 H2 ASP 10 H2 ASP 10 -10.357 -1.171 21.636 1018 H3 ASP 10 H3 ASP 10 -8.822 -0.688 21.294 1019 HA ASP 10 HA ASP 10 -9.791 -1.909 19.464 1020 HB2 ASP 10 HB2 ASP 10 -11.565 -0.773 18.071 1021 HB3 ASP 10 HB3 ASP 10 -12.064 -1.531 19.573 1022 H TYR 11 H TYR 11 -9.387 -1.454 17.177 1023 HA TYR 11 HA TYR 11 -8.197 1.148 16.458 1024 HB2 TYR 11 HB2 TYR 11 -6.387 -0.484 17.616 1025 HB3 TYR 11 HB3 TYR 11 -6.365 -1.250 16.048 1026 HD1 TYR 11 HD1 TYR 11 -4.918 1.228 18.060 1027 HD2 TYR 11 HD2 TYR 11 -6.086 0.516 13.959 1028 HE1 TYR 11 HE1 TYR 11 -3.341 2.995 17.298 1029 HE2 TYR 11 HE2 TYR 11 -4.539 2.325 13.222 1030 HH TYR 11 HH TYR 11 -2.935 3.855 13.840 1031 H GLU 12 H GLU 12 -8.232 -2.368 15.502 1032 HA GLU 12 HA GLU 12 -8.706 -3.437 13.603 1033 HB2 GLU 12 HB2 GLU 12 -10.982 -2.366 14.320 1034 HB3 GLU 12 HB3 GLU 12 -10.831 -1.465 12.794 1035 HG2 GLU 12 HG2 GLU 12 -10.528 -3.719 11.647 1036 HG3 GLU 12 HG3 GLU 12 -10.764 -4.496 13.219 1037 H SER 13 H SER 13 -9.638 -1.711 10.996 1038 HA SER 13 HA SER 13 -6.860 -1.785 10.048 1039 HB2 SER 13 HB2 SER 13 -8.500 -2.926 8.748 1040 HB3 SER 13 HB3 SER 13 -9.426 -1.429 8.508 1041 HG SER 13 HG SER 13 -8.000 -1.860 6.750 1042 H ASP 14 H ASP 14 -5.588 -0.200 10.241 1043 HA ASP 14 HA ASP 14 -5.803 2.056 8.621 1044 HB2 ASP 14 HB2 ASP 14 -6.252 2.681 11.497 1045 HB3 ASP 14 HB3 ASP 14 -5.229 3.773 10.565 1046 H ASP 15 H ASP 15 -3.634 2.037 11.503 1047 HA ASP 15 HA ASP 15 -1.402 1.563 9.645 1048 HB2 ASP 15 HB2 ASP 15 -0.346 3.752 10.379 1049 HB3 ASP 15 HB3 ASP 15 -1.670 3.795 9.234 1050 H ASP 16 H ASP 16 0.651 1.412 10.303 1051 HA ASP 16 HA ASP 16 2.318 0.532 11.463 1052 HB2 ASP 16 HB2 ASP 16 2.742 2.755 11.682 1053 HB3 ASP 16 HB3 ASP 16 1.538 2.980 12.945 1054 H SER 17 H SER 17 0.914 1.265 14.609 1055 HA SER 17 HA SER 17 1.888 -1.341 15.537 1056 HB2 SER 17 HB2 SER 17 2.268 0.906 16.663 1057 HB3 SER 17 HB3 SER 17 0.567 0.858 17.155 1058 HG SER 17 HG SER 17 2.024 0.021 18.759 1059 H TYR 18 H TYR 18 -0.841 -0.679 14.011 1060 HA TYR 18 HA TYR 18 -2.979 -1.103 15.606 1061 HB2 TYR 18 HB2 TYR 18 -4.231 -1.781 13.551 1062 HB3 TYR 18 HB3 TYR 18 -3.363 -0.268 13.542 1063 HD1 TYR 18 HD1 TYR 18 -0.938 -2.906 12.862 1064 HD2 TYR 18 HD2 TYR 18 -4.141 -0.580 11.193 1065 HE1 TYR 18 HE1 TYR 18 -0.123 -3.434 10.597 1066 HE2 TYR 18 HE2 TYR 18 -3.348 -1.147 8.879 1067 HH TYR 18 HH TYR 18 -0.461 -3.209 8.316 1068 H GLU 19 H GLU 19 -4.415 -2.549 16.313 1069 HA GLU 19 HA GLU 19 -3.761 -5.441 15.990 1070 HB2 GLU 19 HB2 GLU 19 -4.014 -4.665 18.288 1071 HB3 GLU 19 HB3 GLU 19 -5.633 -4.054 17.946 1072 HG2 GLU 19 HG2 GLU 19 -5.494 -6.324 19.116 1073 HG3 GLU 19 HG3 GLU 19 -6.522 -6.250 17.698 1074 H VAL 20 H VAL 20 -4.384 -5.319 13.729 1075 HA VAL 20 HA VAL 20 -6.856 -4.254 12.940 1076 HB VAL 20 HB VAL 20 -5.376 -6.252 11.260 1077 HG11 VAL 20 HG11 VAL 20 -7.181 -3.876 10.640 1078 HG12 VAL 20 HG12 VAL 20 -6.273 -4.788 9.425 1079 HG13 VAL 20 HG13 VAL 20 -7.564 -5.561 10.351 1080 HG21 VAL 20 HG21 VAL 20 -4.160 -4.297 10.329 1081 HG22 VAL 20 HG22 VAL 20 -4.894 -3.267 11.574 1082 HG23 VAL 20 HG23 VAL 20 -3.742 -4.546 12.022 1083 H LEU 21 H LEU 21 -6.308 -7.582 13.992 1084 HA LEU 21 HA LEU 21 -8.966 -8.468 13.042 1085 HB2 LEU 21 HB2 LEU 21 -6.818 -9.906 13.368 1086 HB3 LEU 21 HB3 LEU 21 -7.166 -9.806 15.089 1087 HG LEU 21 HG LEU 21 -9.423 -10.904 14.594 1088 HD11 LEU 21 HD11 LEU 21 -9.636 -12.122 12.442 1089 HD12 LEU 21 HD12 LEU 21 -9.616 -10.376 12.168 1090 HD13 LEU 21 HD13 LEU 21 -8.158 -11.342 11.846 1091 HD21 LEU 21 HD21 LEU 21 -7.473 -12.189 15.404 1092 HD22 LEU 21 HD22 LEU 21 -8.460 -13.147 14.283 1093 HD23 LEU 21 HD23 LEU 21 -6.934 -12.415 13.727 1094 H ASP 22 H ASP 22 -7.929 -6.392 15.427 1095 HA ASP 22 HA ASP 22 -8.608 -5.630 17.383 1096 HB2 ASP 22 HB2 ASP 22 -9.939 -4.491 15.756 1097 HB3 ASP 22 HB3 ASP 22 -11.180 -5.735 15.846 1098 H LEU 23 H LEU 23 -8.098 -8.214 17.837 1099 HA LEU 23 HA LEU 23 -9.721 -8.716 20.220 1100 HB2 LEU 23 HB2 LEU 23 -10.253 -10.992 19.765 1101 HB3 LEU 23 HB3 LEU 23 -10.856 -9.996 18.461 1102 HG LEU 23 HG LEU 23 -8.676 -10.758 17.173 1103 HD11 LEU 23 HD11 LEU 23 -7.505 -12.003 18.951 1104 HD12 LEU 23 HD12 LEU 23 -8.951 -12.985 19.256 1105 HD13 LEU 23 HD13 LEU 23 -8.058 -13.136 17.733 1106 HD21 LEU 23 HD21 LEU 23 -10.968 -11.354 16.552 1107 HD22 LEU 23 HD22 LEU 23 -9.912 -12.765 16.376 1108 HD23 LEU 23 HD23 LEU 23 -10.996 -12.645 17.776 1109 H THR 24 H THR 24 -8.671 -9.917 21.829 1110 HA THR 24 HA THR 24 -5.695 -10.093 21.660 1111 HB THR 24 HB THR 24 -6.142 -10.913 24.121 1112 HG1 THR 24 HG1 THR 24 -8.367 -11.150 24.069 1113 HG21 THR 24 HG21 THR 24 -6.782 -8.047 23.308 1114 HG22 THR 24 HG22 THR 24 -6.278 -8.592 24.926 1115 HG23 THR 24 HG23 THR 24 -5.158 -8.728 23.562 1116 H GLU 25 H GLU 25 -4.968 -11.932 20.765 1117 HA GLU 25 HA GLU 25 -6.448 -14.400 20.631 1118 HB2 GLU 25 HB2 GLU 25 -4.548 -15.277 19.517 1119 HB3 GLU 25 HB3 GLU 25 -4.825 -13.656 18.917 1120 HG2 GLU 25 HG2 GLU 25 -2.696 -14.423 20.975 1121 HG3 GLU 25 HG3 GLU 25 -2.430 -14.305 19.246 1122 H TYR 26 H TYR 26 -5.689 -16.470 21.397 1123 HA TYR 26 HA TYR 26 -4.224 -16.489 23.944 1124 HB2 TYR 26 HB2 TYR 26 -6.977 -17.593 23.548 1125 HB3 TYR 26 HB3 TYR 26 -5.885 -18.241 24.756 1126 HD1 TYR 26 HD1 TYR 26 -8.059 -15.425 23.917 1127 HD2 TYR 26 HD2 TYR 26 -5.004 -16.836 26.621 1128 HE1 TYR 26 HE1 TYR 26 -8.672 -13.642 25.545 1129 HE2 TYR 26 HE2 TYR 26 -5.609 -15.042 28.245 1130 HH TYR 26 HH TYR 26 -6.985 -13.258 28.688 Start of MODEL 2 1 H1 MET 1 H1 MET 1 -9.813 5.879 6.054 2 H2 MET 1 H2 MET 1 -8.779 5.267 7.167 3 H3 MET 1 H3 MET 1 -8.229 6.238 5.982 4 HA MET 1 HA MET 1 -8.741 4.687 4.264 5 HB2 MET 1 HB2 MET 1 -6.879 3.641 6.401 6 HB3 MET 1 HB3 MET 1 -7.253 2.686 4.969 7 HG2 MET 1 HG2 MET 1 -6.624 4.734 3.585 8 HG3 MET 1 HG3 MET 1 -5.907 5.389 5.065 9 HE1 MET 1 HE1 MET 1 -2.930 2.931 5.741 10 HE2 MET 1 HE2 MET 1 -3.778 4.415 6.242 11 HE3 MET 1 HE3 MET 1 -4.542 2.818 6.485 12 HA PRO 2 HA PRO 2 -10.428 0.588 5.793 13 HB2 PRO 2 HB2 PRO 2 -11.539 1.030 8.547 14 HB3 PRO 2 HB3 PRO 2 -10.676 -0.386 7.876 15 HG2 PRO 2 HG2 PRO 2 -9.389 1.311 9.518 16 HG3 PRO 2 HG3 PRO 2 -8.576 0.706 8.043 17 HD2 PRO 2 HD2 PRO 2 -10.036 3.332 8.425 18 HD3 PRO 2 HD3 PRO 2 -8.383 3.032 7.798 19 H SER 3 H SER 3 -12.413 3.330 6.964 20 HA SER 3 HA SER 3 -14.893 1.973 6.928 21 HB2 SER 3 HB2 SER 3 -14.509 3.983 8.216 22 HB3 SER 3 HB3 SER 3 -14.319 4.939 6.735 23 HG SER 3 HG SER 3 -16.454 5.065 7.675 24 H GLU 4 H GLU 4 -16.196 1.342 5.440 25 HA GLU 4 HA GLU 4 -17.464 1.066 3.615 26 HB2 GLU 4 HB2 GLU 4 -17.190 4.077 3.502 27 HB3 GLU 4 HB3 GLU 4 -18.306 3.148 2.499 28 HG2 GLU 4 HG2 GLU 4 -19.361 2.172 4.517 29 HG3 GLU 4 HG3 GLU 4 -18.302 3.145 5.543 30 H LYS 5 H LYS 5 -14.363 2.234 2.829 31 HA LYS 5 HA LYS 5 -14.581 1.269 0.004 32 HB2 LYS 5 HB2 LYS 5 -13.350 3.875 0.994 33 HB3 LYS 5 HB3 LYS 5 -13.105 3.225 -0.634 34 HG2 LYS 5 HG2 LYS 5 -15.555 3.335 -1.042 35 HG3 LYS 5 HG3 LYS 5 -15.777 4.062 0.562 36 HD2 LYS 5 HD2 LYS 5 -14.318 5.959 -0.086 37 HD3 LYS 5 HD3 LYS 5 -14.106 5.242 -1.700 38 HE2 LYS 5 HE2 LYS 5 -16.564 5.361 -2.077 39 HE3 LYS 5 HE3 LYS 5 -16.781 6.074 -0.475 40 HZ1 LYS 5 HZ1 LYS 5 -15.433 7.982 -1.212 41 HZ2 LYS 5 HZ2 LYS 5 -15.247 7.330 -2.696 42 HZ3 LYS 5 HZ3 LYS 5 -16.723 7.794 -2.194 43 H THR 6 H THR 6 -12.298 1.093 -0.995 44 HA THR 6 HA THR 6 -10.798 -0.673 0.804 45 HB THR 6 HB THR 6 -9.820 -1.717 -0.907 46 HG1 THR 6 HG1 THR 6 -9.571 -0.677 -2.996 47 HG21 THR 6 HG21 THR 6 -12.307 -1.896 -1.270 48 HG22 THR 6 HG22 THR 6 -12.178 -0.589 -2.477 49 HG23 THR 6 HG23 THR 6 -11.339 -2.126 -2.734 50 H PHE 7 H PHE 7 -8.281 -0.636 0.717 51 HA PHE 7 HA PHE 7 -7.406 2.046 1.475 52 HB2 PHE 7 HB2 PHE 7 -5.158 0.987 1.736 53 HB3 PHE 7 HB3 PHE 7 -6.456 0.315 2.712 54 HD1 PHE 7 HD1 PHE 7 -4.596 -0.234 -0.496 55 HD2 PHE 7 HD2 PHE 7 -6.942 -2.003 2.663 56 HE1 PHE 7 HE1 PHE 7 -4.296 -2.490 -1.517 57 HE2 PHE 7 HE2 PHE 7 -6.624 -4.237 1.660 58 HZ PHE 7 HZ PHE 7 -5.295 -4.488 -0.442 59 H LYS 8 H LYS 8 -7.738 0.662 -1.650 60 HA LYS 8 HA LYS 8 -5.313 1.637 -2.838 61 HB2 LYS 8 HB2 LYS 8 -6.777 -0.121 -3.803 62 HB3 LYS 8 HB3 LYS 8 -8.036 1.077 -4.088 63 HG2 LYS 8 HG2 LYS 8 -6.875 0.525 -6.140 64 HG3 LYS 8 HG3 LYS 8 -6.650 2.221 -5.753 65 HD2 LYS 8 HD2 LYS 8 -4.372 1.678 -4.825 66 HD3 LYS 8 HD3 LYS 8 -4.602 -0.009 -5.292 67 HE2 LYS 8 HE2 LYS 8 -4.584 2.412 -7.170 68 HE3 LYS 8 HE3 LYS 8 -3.195 1.370 -6.860 69 HZ1 LYS 8 HZ1 LYS 8 -4.298 0.697 -8.890 70 HZ2 LYS 8 HZ2 LYS 8 -4.474 -0.508 -7.805 71 HZ3 LYS 8 HZ3 LYS 8 -5.736 0.481 -8.148 72 H GLN 9 H GLN 9 -8.179 3.333 -1.932 73 HA GLN 9 HA GLN 9 -7.860 5.761 -3.374 74 HB2 GLN 9 HB2 GLN 9 -9.354 6.668 -1.762 75 HB3 GLN 9 HB3 GLN 9 -9.812 4.969 -1.926 76 HG2 GLN 9 HG2 GLN 9 -8.475 4.478 0.169 77 HG3 GLN 9 HG3 GLN 9 -8.186 6.205 0.349 78 HE21 GLN 9 HE21 GLN 9 -11.567 4.744 1.853 79 HE22 GLN 9 HE22 GLN 9 -10.299 3.695 1.218 80 H ARG 10 H ARG 10 -5.753 4.393 -1.016 81 HA ARG 10 HA ARG 10 -4.322 6.973 -0.533 82 HB2 ARG 10 HB2 ARG 10 -5.948 6.253 1.330 83 HB3 ARG 10 HB3 ARG 10 -4.920 4.851 1.566 84 HG2 ARG 10 HG2 ARG 10 -4.211 6.372 3.213 85 HG3 ARG 10 HG3 ARG 10 -2.982 6.552 1.958 86 HD2 ARG 10 HD2 ARG 10 -4.226 8.553 1.095 87 HD3 ARG 10 HD3 ARG 10 -5.421 8.337 2.400 88 HE ARG 10 HE ARG 10 -2.871 8.480 3.619 89 HH11 ARG 10 HH11 ARG 10 -4.932 10.674 1.813 90 HH12 ARG 10 HH12 ARG 10 -4.254 12.087 2.573 91 HH21 ARG 10 HH21 ARG 10 -2.061 10.327 4.566 92 HH22 ARG 10 HH22 ARG 10 -2.673 11.884 4.093 93 H ARG 11 H ARG 11 -3.985 3.368 -0.212 94 HA ARG 11 HA ARG 11 -1.036 3.672 -0.117 95 HB2 ARG 11 HB2 ARG 11 -2.994 1.445 0.549 96 HB3 ARG 11 HB3 ARG 11 -1.278 1.115 0.419 97 HG2 ARG 11 HG2 ARG 11 -2.261 3.332 2.243 98 HG3 ARG 11 HG3 ARG 11 -2.277 1.643 2.766 99 HD2 ARG 11 HD2 ARG 11 0.112 1.420 2.445 100 HD3 ARG 11 HD3 ARG 11 0.221 3.011 1.711 101 HE ARG 11 HE ARG 11 -0.234 2.402 4.595 102 HH11 ARG 11 HH11 ARG 11 0.332 3.820 6.065 103 HH12 ARG 11 HH12 ARG 11 0.868 5.433 5.628 104 HH21 ARG 11 HH21 ARG 11 0.651 4.888 2.224 105 HH22 ARG 11 HH22 ARG 11 1.018 6.017 3.496 106 H THR 12 H THR 12 0.364 2.293 -1.230 107 HA THR 12 HA THR 12 -0.459 1.275 -3.922 108 HB THR 12 HB THR 12 1.644 2.291 -4.808 109 HG1 THR 12 HG1 THR 12 2.891 3.455 -3.598 110 HG21 THR 12 HG21 THR 12 -0.533 3.486 -5.091 111 HG22 THR 12 HG22 THR 12 -0.191 4.410 -3.609 112 HG23 THR 12 HG23 THR 12 0.866 4.574 -5.028 113 H PHE 13 H PHE 13 1.277 -0.166 -4.837 114 HA PHE 13 HA PHE 13 1.778 -2.264 -3.126 115 HB2 PHE 13 HB2 PHE 13 1.666 -2.729 -5.378 116 HB3 PHE 13 HB3 PHE 13 2.904 -1.559 -5.794 117 HD1 PHE 13 HD1 PHE 13 5.337 -2.019 -5.379 118 HD2 PHE 13 HD2 PHE 13 2.283 -5.019 -4.852 119 HE1 PHE 13 HE1 PHE 13 7.068 -3.800 -5.445 120 HE2 PHE 13 HE2 PHE 13 4.017 -6.796 -4.963 121 HZ PHE 13 HZ PHE 13 6.414 -6.187 -5.231 122 H GLU 14 H GLU 14 4.352 0.074 -3.989 123 HA GLU 14 HA GLU 14 6.328 -1.173 -2.361 124 HB2 GLU 14 HB2 GLU 14 7.611 0.818 -2.657 125 HB3 GLU 14 HB3 GLU 14 6.883 0.348 -4.178 126 HG2 GLU 14 HG2 GLU 14 5.844 2.575 -2.369 127 HG3 GLU 14 HG3 GLU 14 6.978 2.808 -3.680 128 H GLN 15 H GLN 15 3.800 1.162 -1.465 129 HA GLN 15 HA GLN 15 4.888 1.670 1.206 130 HB2 GLN 15 HB2 GLN 15 2.096 2.099 0.069 131 HB3 GLN 15 HB3 GLN 15 2.668 2.646 1.647 132 HG2 GLN 15 HG2 GLN 15 4.338 4.106 0.590 133 HG3 GLN 15 HG3 GLN 15 3.870 3.536 -1.008 134 HE21 GLN 15 HE21 GLN 15 2.014 6.652 -0.811 135 HE22 GLN 15 HE22 GLN 15 3.603 6.029 -1.227 136 H ARG 16 H ARG 16 2.400 -0.520 -0.194 137 HA ARG 16 HA ARG 16 1.676 -1.752 2.316 138 HB2 ARG 16 HB2 ARG 16 1.387 -2.802 -0.520 139 HB3 ARG 16 HB3 ARG 16 0.731 -3.566 0.940 140 HG2 ARG 16 HG2 ARG 16 -0.439 -1.325 1.436 141 HG3 ARG 16 HG3 ARG 16 -0.041 -0.867 -0.224 142 HD2 ARG 16 HD2 ARG 16 -1.791 -3.185 0.686 143 HD3 ARG 16 HD3 ARG 16 -2.286 -1.712 -0.134 144 HE ARG 16 HE ARG 16 -1.359 -2.465 -2.186 145 HH11 ARG 16 HH11 ARG 16 -1.124 -5.037 0.256 146 HH12 ARG 16 HH12 ARG 16 -0.759 -6.212 -1.011 147 HH21 ARG 16 HH21 ARG 16 -0.645 -5.759 -2.963 148 HH22 ARG 16 HH22 ARG 16 -0.921 -4.156 -3.641 149 H VAL 17 H VAL 17 4.255 -2.516 -0.009 150 HA VAL 17 HA VAL 17 5.140 -4.937 1.295 151 HB VAL 17 HB VAL 17 6.479 -2.940 -0.562 152 HG11 VAL 17 HG11 VAL 17 8.322 -4.592 -0.841 153 HG12 VAL 17 HG12 VAL 17 8.326 -3.849 0.759 154 HG13 VAL 17 HG13 VAL 17 7.697 -5.504 0.551 155 HG21 VAL 17 HG21 VAL 17 6.316 -4.785 -2.170 156 HG22 VAL 17 HG22 VAL 17 5.680 -5.871 -0.917 157 HG23 VAL 17 HG23 VAL 17 4.719 -4.497 -1.476 158 H GLU 18 H GLU 18 6.102 -1.429 1.834 159 HA GLU 18 HA GLU 18 7.935 -2.171 3.930 160 HB2 GLU 18 HB2 GLU 18 7.634 0.172 2.765 161 HB3 GLU 18 HB3 GLU 18 6.391 0.423 4.012 162 HG2 GLU 18 HG2 GLU 18 8.545 1.353 4.709 163 HG3 GLU 18 HG3 GLU 18 7.997 0.073 5.786 164 H ASP 19 H ASP 19 4.460 -1.347 3.993 165 HA ASP 19 HA ASP 19 3.971 -1.703 6.737 166 HB2 ASP 19 HB2 ASP 19 2.313 -0.689 5.590 167 HB3 ASP 19 HB3 ASP 19 2.331 -1.861 4.296 168 H VAL 20 H VAL 20 3.774 -4.344 4.262 169 HA VAL 20 HA VAL 20 3.437 -6.329 6.232 170 HB VAL 20 HB VAL 20 3.220 -6.451 3.607 171 HG11 VAL 20 HG11 VAL 20 5.643 -6.472 3.069 172 HG12 VAL 20 HG12 VAL 20 5.842 -7.950 4.032 173 HG13 VAL 20 HG13 VAL 20 4.835 -7.953 2.581 174 HG21 VAL 20 HG21 VAL 20 2.321 -8.027 5.240 175 HG22 VAL 20 HG22 VAL 20 2.997 -8.882 3.849 176 HG23 VAL 20 HG23 VAL 20 3.916 -8.816 5.377 177 H ARG 21 H ARG 21 6.486 -4.996 5.059 178 HA ARG 21 HA ARG 21 8.230 -6.788 6.487 179 HB2 ARG 21 HB2 ARG 21 9.013 -5.432 4.640 180 HB3 ARG 21 HB3 ARG 21 8.601 -3.939 5.481 181 HG2 ARG 21 HG2 ARG 21 10.320 -4.382 7.203 182 HG3 ARG 21 HG3 ARG 21 10.717 -5.918 6.403 183 HD2 ARG 21 HD2 ARG 21 11.375 -4.688 4.363 184 HD3 ARG 21 HD3 ARG 21 10.951 -3.158 5.128 185 HE ARG 21 HE ARG 21 13.193 -4.980 5.908 186 HH11 ARG 21 HH11 ARG 21 15.070 -2.386 7.127 187 HH12 ARG 21 HH12 ARG 21 14.995 -4.090 6.801 188 HH21 ARG 21 HH21 ARG 21 11.889 -1.671 6.021 189 HH22 ARG 21 HH22 ARG 21 13.367 -1.075 6.719 190 H LEU 22 H LEU 22 7.102 -3.494 7.434 191 HA LEU 22 HA LEU 22 8.323 -3.682 10.033 192 HB2 LEU 22 HB2 LEU 22 7.385 -1.572 10.494 193 HB3 LEU 22 HB3 LEU 22 7.890 -1.593 8.820 194 HG LEU 22 HG LEU 22 5.320 -2.188 8.400 195 HD11 LEU 22 HD11 LEU 22 5.177 -0.541 10.949 196 HD12 LEU 22 HD12 LEU 22 3.822 -1.005 9.896 197 HD13 LEU 22 HD13 LEU 22 4.681 -2.236 10.815 198 HD21 LEU 22 HD21 LEU 22 4.848 0.221 8.108 199 HD22 LEU 22 HD22 LEU 22 6.328 0.611 9.012 200 HD23 LEU 22 HD23 LEU 22 6.412 -0.230 7.442 201 H ILE 23 H ILE 23 5.092 -4.652 8.899 202 HA ILE 23 HA ILE 23 4.058 -5.316 11.503 203 HB ILE 23 HB ILE 23 3.400 -6.127 8.665 204 HG12 ILE 23 HG12 ILE 23 2.613 -3.923 9.288 205 HG13 ILE 23 HG13 ILE 23 1.246 -5.015 9.162 206 HG21 ILE 23 HG21 ILE 23 2.125 -7.307 11.145 207 HG22 ILE 23 HG22 ILE 23 1.400 -7.316 9.511 208 HG23 ILE 23 HG23 ILE 23 2.906 -8.159 9.793 209 HD11 ILE 23 HD11 ILE 23 2.506 -3.813 11.637 210 HD12 ILE 23 HD12 ILE 23 0.872 -3.588 11.031 211 HD13 ILE 23 HD13 ILE 23 1.325 -5.152 11.735 212 H ARG 24 H ARG 24 5.763 -7.417 9.083 213 HA ARG 24 HA ARG 24 5.822 -9.694 10.856 214 HB2 ARG 24 HB2 ARG 24 7.540 -8.867 8.481 215 HB3 ARG 24 HB3 ARG 24 7.829 -10.361 9.365 216 HG2 ARG 24 HG2 ARG 24 5.208 -9.686 7.949 217 HG3 ARG 24 HG3 ARG 24 6.519 -10.682 7.310 218 HD2 ARG 24 HD2 ARG 24 6.209 -12.116 9.460 219 HD3 ARG 24 HD3 ARG 24 4.632 -11.301 9.607 220 HE ARG 24 HE ARG 24 4.754 -12.171 6.959 221 HH11 ARG 24 HH11 ARG 24 4.356 -14.166 6.075 222 HH12 ARG 24 HH12 ARG 24 4.198 -15.556 7.105 223 HH21 ARG 24 HH21 ARG 24 4.818 -13.886 10.049 224 HH22 ARG 24 HH22 ARG 24 4.572 -15.418 9.281 225 H GLU 25 H GLU 25 8.047 -6.953 10.554 226 HA GLU 25 HA GLU 25 10.044 -7.899 12.337 227 HB2 GLU 25 HB2 GLU 25 10.327 -5.993 10.846 228 HB3 GLU 25 HB3 GLU 25 9.134 -5.061 11.764 229 HG2 GLU 25 HG2 GLU 25 10.592 -5.127 13.758 230 HG3 GLU 25 HG3 GLU 25 11.756 -6.131 12.889 231 H GLN 26 H GLN 26 7.108 -5.902 13.158 232 HA GLN 26 HA GLN 26 7.765 -6.044 15.988 233 HB2 GLN 26 HB2 GLN 26 5.845 -4.754 16.393 234 HB3 GLN 26 HB3 GLN 26 6.590 -4.139 14.922 235 HG2 GLN 26 HG2 GLN 26 4.856 -5.401 13.596 236 HG3 GLN 26 HG3 GLN 26 4.102 -5.897 15.114 237 HE21 GLN 26 HE21 GLN 26 2.086 -3.048 14.127 238 HE22 GLN 26 HE22 GLN 26 2.165 -4.796 14.031 239 H HIS 27 H HIS 27 5.575 -7.949 13.907 240 HA HIS 27 HA HIS 27 5.184 -9.908 16.147 241 HB2 HIS 27 HB2 HIS 27 2.953 -8.717 14.446 242 HB3 HIS 27 HB3 HIS 27 2.770 -10.087 15.543 243 HD1 HIS 27 HD1 HIS 27 4.159 -8.907 18.169 244 HD2 HIS 27 HD2 HIS 27 1.321 -7.070 15.635 245 HE1 HIS 27 HE1 HIS 27 2.818 -7.260 19.631 246 HE2 HIS 27 HE2 HIS 27 1.079 -6.164 18.086 247 HA PRO 28 HA PRO 28 6.541 -12.109 12.324 248 HB2 PRO 28 HB2 PRO 28 7.425 -14.009 14.500 249 HB3 PRO 28 HB3 PRO 28 8.260 -13.570 12.977 250 HG2 PRO 28 HG2 PRO 28 9.044 -12.474 15.320 251 HG3 PRO 28 HG3 PRO 28 8.906 -11.448 13.855 252 HD2 PRO 28 HD2 PRO 28 6.945 -11.746 16.143 253 HD3 PRO 28 HD3 PRO 28 7.500 -10.259 15.319 254 H THR 29 H THR 29 4.808 -13.386 15.157 255 HA THR 29 HA THR 29 3.743 -15.731 13.888 256 HB THR 29 HB THR 29 2.637 -16.211 15.863 257 HG1 THR 29 HG1 THR 29 2.227 -14.646 17.446 258 HG21 THR 29 HG21 THR 29 4.256 -15.973 17.627 259 HG22 THR 29 HG22 THR 29 5.152 -16.173 16.114 260 HG23 THR 29 HG23 THR 29 5.008 -14.561 16.865 261 H LYS 30 H LYS 30 2.640 -12.526 13.486 262 HA LYS 30 HA LYS 30 -0.090 -13.490 12.802 263 HB2 LYS 30 HB2 LYS 30 0.990 -10.656 12.925 264 HB3 LYS 30 HB3 LYS 30 -0.618 -11.127 12.341 265 HG2 LYS 30 HG2 LYS 30 -1.119 -12.195 14.522 266 HG3 LYS 30 HG3 LYS 30 0.438 -11.647 15.150 267 HD2 LYS 30 HD2 LYS 30 -0.257 -9.286 14.886 268 HD3 LYS 30 HD3 LYS 30 -1.784 -9.804 14.142 269 HE2 LYS 30 HE2 LYS 30 -2.371 -11.042 16.230 270 HE3 LYS 30 HE3 LYS 30 -0.878 -10.473 16.988 271 HZ1 LYS 30 HZ1 LYS 30 -1.732 -8.189 16.908 272 HZ2 LYS 30 HZ2 LYS 30 -3.069 -8.638 16.047 273 HZ3 LYS 30 HZ3 LYS 30 -2.854 -9.134 17.588 274 H ILE 31 H ILE 31 -0.924 -13.578 10.904 275 HA ILE 31 HA ILE 31 0.918 -13.837 8.601 276 HB ILE 31 HB ILE 31 -1.796 -15.048 9.247 277 HG12 ILE 31 HG12 ILE 31 -0.062 -15.871 10.775 278 HG13 ILE 31 HG13 ILE 31 -0.632 -17.124 9.684 279 HG21 ILE 31 HG21 ILE 31 0.084 -15.563 6.929 280 HG22 ILE 31 HG22 ILE 31 -1.278 -16.616 7.386 281 HG23 ILE 31 HG23 ILE 31 -1.588 -14.956 6.863 282 HD11 ILE 31 HD11 ILE 31 1.424 -16.891 8.294 283 HD12 ILE 31 HD12 ILE 31 2.013 -15.634 9.412 284 HD13 ILE 31 HD13 ILE 31 1.783 -17.294 9.974 285 HA PRO 32 HA PRO 32 -1.355 -10.204 7.278 286 HB2 PRO 32 HB2 PRO 32 0.173 -9.385 5.177 287 HB3 PRO 32 HB3 PRO 32 0.722 -9.303 6.878 288 HG2 PRO 32 HG2 PRO 32 1.335 -11.423 4.816 289 HG3 PRO 32 HG3 PRO 32 2.475 -10.601 5.920 290 HD2 PRO 32 HD2 PRO 32 1.440 -13.063 6.471 291 HD3 PRO 32 HD3 PRO 32 1.817 -11.867 7.749 292 H VAL 33 H VAL 33 -3.275 -10.191 6.341 293 HA VAL 33 HA VAL 33 -3.680 -11.428 3.671 294 HB VAL 33 HB VAL 33 -5.738 -11.518 5.846 295 HG11 VAL 33 HG11 VAL 33 -6.615 -11.928 3.628 296 HG12 VAL 33 HG12 VAL 33 -5.352 -13.142 3.329 297 HG13 VAL 33 HG13 VAL 33 -6.608 -13.428 4.540 298 HG21 VAL 33 HG21 VAL 33 -3.627 -13.644 5.348 299 HG22 VAL 33 HG22 VAL 33 -3.954 -12.756 6.848 300 HG23 VAL 33 HG23 VAL 33 -5.138 -13.911 6.256 301 H ILE 34 H ILE 34 -5.018 -10.446 2.232 302 HA ILE 34 HA ILE 34 -6.234 -7.798 2.966 303 HB ILE 34 HB ILE 34 -5.741 -9.047 0.234 304 HG12 ILE 34 HG12 ILE 34 -3.603 -8.467 1.106 305 HG13 ILE 34 HG13 ILE 34 -4.042 -7.270 -0.088 306 HG21 ILE 34 HG21 ILE 34 -6.271 -6.712 -0.586 307 HG22 ILE 34 HG22 ILE 34 -7.646 -7.603 0.061 308 HG23 ILE 34 HG23 ILE 34 -6.874 -6.350 1.050 309 HD11 ILE 34 HD11 ILE 34 -4.666 -5.690 1.772 310 HD12 ILE 34 HD12 ILE 34 -4.086 -6.903 2.937 311 HD13 ILE 34 HD13 ILE 34 -2.968 -6.174 1.778 312 H ILE 35 H ILE 35 -8.447 -7.488 2.793 313 HA ILE 35 HA ILE 35 -10.095 -9.686 1.699 314 HB ILE 35 HB ILE 35 -10.409 -10.012 4.017 315 HG12 ILE 35 HG12 ILE 35 -12.813 -8.496 2.876 316 HG13 ILE 35 HG13 ILE 35 -12.361 -10.158 2.461 317 HG21 ILE 35 HG21 ILE 35 -11.212 -7.075 4.242 318 HG22 ILE 35 HG22 ILE 35 -11.257 -8.265 5.552 319 HG23 ILE 35 HG23 ILE 35 -9.707 -7.793 4.879 320 HD11 ILE 35 HD11 ILE 35 -13.288 -9.190 5.190 321 HD12 ILE 35 HD12 ILE 35 -14.188 -10.169 4.034 322 HD13 ILE 35 HD13 ILE 35 -12.748 -10.844 4.807 323 H GLU 36 H GLU 36 -11.456 -9.025 0.123 324 HA GLU 36 HA GLU 36 -12.327 -6.154 0.132 325 HB2 GLU 36 HB2 GLU 36 -10.344 -6.621 -1.411 326 HB3 GLU 36 HB3 GLU 36 -11.444 -7.642 -2.354 327 HG2 GLU 36 HG2 GLU 36 -12.951 -5.594 -2.585 328 HG3 GLU 36 HG3 GLU 36 -11.671 -4.655 -1.825 329 H ARG 37 H ARG 37 -14.406 -5.739 -0.538 330 HA ARG 37 HA ARG 37 -16.345 -7.900 -0.799 331 HB2 ARG 37 HB2 ARG 37 -16.866 -5.662 0.134 332 HB3 ARG 37 HB3 ARG 37 -16.478 -4.908 -1.407 333 HG2 ARG 37 HG2 ARG 37 -18.394 -5.909 -2.486 334 HG3 ARG 37 HG3 ARG 37 -18.674 -6.999 -1.122 335 HD2 ARG 37 HD2 ARG 37 -20.296 -5.179 -1.133 336 HD3 ARG 37 HD3 ARG 37 -19.288 -5.145 0.323 337 HE ARG 37 HE ARG 37 -18.072 -3.411 -1.571 338 HH11 ARG 37 HH11 ARG 37 -21.056 -3.467 0.273 339 HH12 ARG 37 HH12 ARG 37 -21.163 -1.722 0.309 340 HH21 ARG 37 HH21 ARG 37 -18.221 -1.178 -1.384 341 HH22 ARG 37 HH22 ARG 37 -19.572 -0.479 -0.563 342 H TYR 38 H TYR 38 -17.134 -8.874 -2.669 343 HA TYR 38 HA TYR 38 -15.546 -8.859 -4.923 344 HB2 TYR 38 HB2 TYR 38 -16.674 -10.779 -4.655 345 HB3 TYR 38 HB3 TYR 38 -18.219 -9.985 -4.411 346 HD1 TYR 38 HD1 TYR 38 -15.636 -10.357 -7.154 347 HD2 TYR 38 HD2 TYR 38 -19.818 -10.178 -6.074 348 HE1 TYR 38 HE1 TYR 38 -16.278 -10.712 -9.532 349 HE2 TYR 38 HE2 TYR 38 -20.444 -10.563 -8.448 350 HH TYR 38 HH TYR 38 -19.689 -10.943 -10.598 351 H LYS 39 H LYS 39 -15.163 -7.806 -6.668 352 HA LYS 39 HA LYS 39 -15.981 -5.147 -6.929 353 HB2 LYS 39 HB2 LYS 39 -14.723 -6.974 -9.029 354 HB3 LYS 39 HB3 LYS 39 -14.806 -5.217 -9.139 355 HG2 LYS 39 HG2 LYS 39 -13.440 -5.000 -7.079 356 HG3 LYS 39 HG3 LYS 39 -13.325 -6.769 -6.970 357 HD2 LYS 39 HD2 LYS 39 -12.292 -6.809 -9.258 358 HD3 LYS 39 HD3 LYS 39 -12.281 -5.046 -9.266 359 HE2 LYS 39 HE2 LYS 39 -10.814 -6.847 -7.276 360 HE3 LYS 39 HE3 LYS 39 -10.090 -6.087 -8.692 361 HZ1 LYS 39 HZ1 LYS 39 -11.172 -4.677 -6.297 362 HZ2 LYS 39 HZ2 LYS 39 -9.624 -4.751 -6.773 363 HZ3 LYS 39 HZ3 LYS 39 -10.687 -3.893 -7.675 364 H GLY 40 H GLY 40 -17.317 -7.949 -8.635 365 HA2 GLY 40 HA2 GLY 40 -18.797 -6.391 -10.588 366 HA3 GLY 40 HA3 GLY 40 -18.894 -8.124 -10.316 367 H GLU 41 H GLU 41 -19.601 -7.396 -7.322 368 HA GLU 41 HA GLU 41 -22.343 -6.362 -7.633 369 HB2 GLU 41 HB2 GLU 41 -22.443 -8.786 -8.319 370 HB3 GLU 41 HB3 GLU 41 -21.840 -9.221 -6.738 371 HG2 GLU 41 HG2 GLU 41 -24.143 -9.608 -6.694 372 HG3 GLU 41 HG3 GLU 41 -23.883 -8.189 -5.704 373 H LYS 42 H LYS 42 -21.349 -4.736 -6.331 374 HA LYS 42 HA LYS 42 -20.422 -5.269 -3.642 375 HB2 LYS 42 HB2 LYS 42 -21.017 -2.704 -5.164 376 HB3 LYS 42 HB3 LYS 42 -20.346 -2.727 -3.533 377 HG2 LYS 42 HG2 LYS 42 -18.361 -3.929 -4.271 378 HG3 LYS 42 HG3 LYS 42 -18.986 -4.026 -5.929 379 HD2 LYS 42 HD2 LYS 42 -18.983 -1.594 -6.139 380 HD3 LYS 42 HD3 LYS 42 -18.483 -1.396 -4.448 381 HE2 LYS 42 HE2 LYS 42 -16.303 -2.436 -4.911 382 HE3 LYS 42 HE3 LYS 42 -16.815 -2.839 -6.562 383 HZ1 LYS 42 HZ1 LYS 42 -16.956 -0.443 -7.040 384 HZ2 LYS 42 HZ2 LYS 42 -16.493 -0.064 -5.517 385 HZ3 LYS 42 HZ3 LYS 42 -15.454 -0.821 -6.528 386 H GLN 43 H GLN 43 -22.952 -6.368 -3.803 387 HA GLN 43 HA GLN 43 -25.069 -4.654 -2.799 388 HB2 GLN 43 HB2 GLN 43 -24.715 -7.669 -2.921 389 HB3 GLN 43 HB3 GLN 43 -26.199 -6.908 -2.353 390 HG2 GLN 43 HG2 GLN 43 -25.051 -6.289 -5.100 391 HG3 GLN 43 HG3 GLN 43 -26.014 -7.730 -4.766 392 HE21 GLN 43 HE21 GLN 43 -28.595 -5.658 -6.036 393 HE22 GLN 43 HE22 GLN 43 -27.309 -6.802 -6.492 394 H LEU 44 H LEU 44 -23.009 -7.095 -1.186 395 HA LEU 44 HA LEU 44 -24.346 -6.850 1.357 396 HB2 LEU 44 HB2 LEU 44 -21.658 -8.077 0.603 397 HB3 LEU 44 HB3 LEU 44 -22.471 -8.320 2.149 398 HG LEU 44 HG LEU 44 -23.457 -9.266 -0.581 399 HD11 LEU 44 HD11 LEU 44 -23.055 -11.491 0.351 400 HD12 LEU 44 HD12 LEU 44 -21.561 -10.528 0.400 401 HD13 LEU 44 HD13 LEU 44 -22.529 -10.771 1.884 402 HD21 LEU 44 HD21 LEU 44 -25.428 -8.731 0.763 403 HD22 LEU 44 HD22 LEU 44 -25.214 -10.481 0.705 404 HD23 LEU 44 HD23 LEU 44 -24.739 -9.589 2.168 405 HA PRO 45 HA PRO 45 -22.221 -3.437 3.230 406 HB2 PRO 45 HB2 PRO 45 -22.146 -4.107 5.900 407 HB3 PRO 45 HB3 PRO 45 -23.645 -3.655 5.037 408 HG2 PRO 45 HG2 PRO 45 -22.589 -6.460 5.569 409 HG3 PRO 45 HG3 PRO 45 -24.229 -5.812 5.903 410 HD2 PRO 45 HD2 PRO 45 -23.722 -7.213 3.658 411 HD3 PRO 45 HD3 PRO 45 -24.782 -5.772 3.596 412 H VAL 46 H VAL 46 -20.224 -2.779 4.196 413 HA VAL 46 HA VAL 46 -18.083 -4.872 4.418 414 HB VAL 46 HB VAL 46 -18.036 -3.594 2.264 415 HG11 VAL 46 HG11 VAL 46 -17.106 -1.351 2.212 416 HG12 VAL 46 HG12 VAL 46 -18.623 -1.337 3.124 417 HG13 VAL 46 HG13 VAL 46 -17.057 -1.274 3.983 418 HG21 VAL 46 HG21 VAL 46 -15.635 -3.327 2.204 419 HG22 VAL 46 HG22 VAL 46 -15.539 -3.213 3.968 420 HG23 VAL 46 HG23 VAL 46 -16.010 -4.739 3.205 421 H LEU 47 H LEU 47 -19.347 -1.937 5.835 422 HA LEU 47 HA LEU 47 -18.718 -0.675 7.603 423 HB2 LEU 47 HB2 LEU 47 -17.861 -3.343 8.777 424 HB3 LEU 47 HB3 LEU 47 -18.198 -1.865 9.680 425 HG LEU 47 HG LEU 47 -20.229 -3.467 8.060 426 HD11 LEU 47 HD11 LEU 47 -19.452 -4.611 10.099 427 HD12 LEU 47 HD12 LEU 47 -19.826 -3.167 11.063 428 HD13 LEU 47 HD13 LEU 47 -21.131 -4.074 10.267 429 HD21 LEU 47 HD21 LEU 47 -21.919 -2.048 9.208 430 HD22 LEU 47 HD22 LEU 47 -20.611 -1.060 9.896 431 HD23 LEU 47 HD23 LEU 47 -20.889 -1.088 8.141 432 H ASP 48 H ASP 48 -16.085 -2.396 8.874 433 HA ASP 48 HA ASP 48 -14.139 -0.529 7.634 434 HB2 ASP 48 HB2 ASP 48 -14.141 -1.977 10.284 435 HB3 ASP 48 HB3 ASP 48 -12.720 -1.181 9.642 436 H LYS 49 H LYS 49 -14.972 -3.670 6.911 437 HA LYS 49 HA LYS 49 -12.420 -5.002 7.289 438 HB2 LYS 49 HB2 LYS 49 -14.674 -5.746 5.382 439 HB3 LYS 49 HB3 LYS 49 -13.346 -6.784 5.886 440 HG2 LYS 49 HG2 LYS 49 -15.658 -5.796 7.582 441 HG3 LYS 49 HG3 LYS 49 -15.370 -7.413 6.953 442 HD2 LYS 49 HD2 LYS 49 -14.614 -7.917 8.950 443 HD3 LYS 49 HD3 LYS 49 -13.112 -7.103 8.483 444 HE2 LYS 49 HE2 LYS 49 -13.856 -5.030 9.573 445 HE3 LYS 49 HE3 LYS 49 -15.494 -5.671 9.790 446 HZ1 LYS 49 HZ1 LYS 49 -13.033 -6.713 11.144 447 HZ2 LYS 49 HZ2 LYS 49 -14.237 -5.867 11.867 448 HZ3 LYS 49 HZ3 LYS 49 -14.506 -7.394 11.308 449 H THR 50 H THR 50 -10.617 -4.361 6.333 450 HA THR 50 HA THR 50 -10.492 -4.689 3.396 451 HB THR 50 HB THR 50 -9.218 -2.866 2.878 452 HG1 THR 50 HG1 THR 50 -8.418 -1.459 4.602 453 HG21 THR 50 HG21 THR 50 -11.106 -1.707 4.965 454 HG22 THR 50 HG22 THR 50 -10.364 -0.848 3.599 455 HG23 THR 50 HG23 THR 50 -11.547 -2.124 3.290 456 H LYS 51 H LYS 51 -8.696 -4.908 6.433 457 HA LYS 51 HA LYS 51 -6.736 -6.767 5.150 458 HB2 LYS 51 HB2 LYS 51 -6.074 -4.321 6.851 459 HB3 LYS 51 HB3 LYS 51 -4.904 -5.548 6.349 460 HG2 LYS 51 HG2 LYS 51 -4.991 -4.864 4.065 461 HG3 LYS 51 HG3 LYS 51 -6.452 -3.918 4.306 462 HD2 LYS 51 HD2 LYS 51 -4.667 -2.375 4.106 463 HD3 LYS 51 HD3 LYS 51 -5.261 -2.339 5.769 464 HE2 LYS 51 HE2 LYS 51 -3.334 -3.853 6.418 465 HE3 LYS 51 HE3 LYS 51 -2.743 -3.743 4.752 466 HZ1 LYS 51 HZ1 LYS 51 -2.685 -1.265 5.114 467 HZ2 LYS 51 HZ2 LYS 51 -2.996 -1.514 6.715 468 HZ3 LYS 51 HZ3 LYS 51 -1.600 -2.094 5.990 469 H PHE 52 H PHE 52 -6.160 -8.455 6.439 470 HA PHE 52 HA PHE 52 -6.298 -8.065 9.298 471 HB2 PHE 52 HB2 PHE 52 -7.296 -10.345 9.758 472 HB3 PHE 52 HB3 PHE 52 -8.278 -8.919 9.491 473 HD1 PHE 52 HD1 PHE 52 -10.130 -9.075 8.135 474 HD2 PHE 52 HD2 PHE 52 -6.900 -11.871 7.649 475 HE1 PHE 52 HE1 PHE 52 -11.525 -10.427 6.606 476 HE2 PHE 52 HE2 PHE 52 -8.269 -13.170 6.028 477 HZ PHE 52 HZ PHE 52 -10.587 -12.461 5.510 478 H LEU 53 H LEU 53 -4.754 -8.597 10.481 479 HA LEU 53 HA LEU 53 -2.617 -10.359 9.413 480 HB2 LEU 53 HB2 LEU 53 -2.372 -8.723 11.941 481 HB3 LEU 53 HB3 LEU 53 -1.121 -9.346 10.897 482 HG LEU 53 HG LEU 53 -3.014 -7.050 10.176 483 HD11 LEU 53 HD11 LEU 53 -0.929 -5.684 10.527 484 HD12 LEU 53 HD12 LEU 53 -1.627 -6.367 12.001 485 HD13 LEU 53 HD13 LEU 53 -0.190 -7.108 11.287 486 HD21 LEU 53 HD21 LEU 53 -0.557 -8.220 8.796 487 HD22 LEU 53 HD22 LEU 53 -2.218 -8.139 8.161 488 HD23 LEU 53 HD23 LEU 53 -1.289 -6.655 8.377 489 H VAL 54 H VAL 54 -3.499 -12.419 9.769 490 HA VAL 54 HA VAL 54 -4.982 -12.925 12.251 491 HB VAL 54 HB VAL 54 -4.411 -15.066 10.236 492 HG11 VAL 54 HG11 VAL 54 -6.587 -15.916 10.951 493 HG12 VAL 54 HG12 VAL 54 -5.585 -15.601 12.379 494 HG13 VAL 54 HG13 VAL 54 -6.876 -14.471 11.940 495 HG21 VAL 54 HG21 VAL 54 -5.187 -13.236 8.830 496 HG22 VAL 54 HG22 VAL 54 -6.468 -14.429 9.008 497 HG23 VAL 54 HG23 VAL 54 -6.546 -12.918 9.931 498 HA PRO 55 HA PRO 55 -1.396 -14.730 14.343 499 HB2 PRO 55 HB2 PRO 55 -3.441 -16.100 16.058 500 HB3 PRO 55 HB3 PRO 55 -1.984 -15.183 16.540 501 HG2 PRO 55 HG2 PRO 55 -4.460 -14.076 16.755 502 HG3 PRO 55 HG3 PRO 55 -3.065 -13.107 16.185 503 HD2 PRO 55 HD2 PRO 55 -5.250 -14.391 14.524 504 HD3 PRO 55 HD3 PRO 55 -4.522 -12.763 14.390 505 H ASP 56 H ASP 56 -0.261 -16.555 13.845 506 HA ASP 56 HA ASP 56 -1.111 -18.178 11.823 507 HB2 ASP 56 HB2 ASP 56 0.902 -19.575 12.257 508 HB3 ASP 56 HB3 ASP 56 1.167 -17.840 12.143 509 H HIS 57 H HIS 57 -1.647 -18.972 15.165 510 HA HIS 57 HA HIS 57 -2.340 -21.774 14.706 511 HB2 HIS 57 HB2 HIS 57 -2.614 -19.889 17.082 512 HB3 HIS 57 HB3 HIS 57 -3.267 -21.518 17.088 513 HD1 HIS 57 HD1 HIS 57 0.303 -20.092 16.224 514 HD2 HIS 57 HD2 HIS 57 -1.751 -23.145 18.324 515 HE1 HIS 57 HE1 HIS 57 2.094 -21.508 17.400 516 HE2 HIS 57 HE2 HIS 57 0.842 -23.375 18.666 517 H VAL 58 H VAL 58 -4.141 -18.887 14.133 518 HA VAL 58 HA VAL 58 -6.800 -19.944 14.718 519 HB VAL 58 HB VAL 58 -5.963 -17.641 12.964 520 HG11 VAL 58 HG11 VAL 58 -8.240 -16.774 13.239 521 HG12 VAL 58 HG12 VAL 58 -8.287 -18.344 12.446 522 HG13 VAL 58 HG13 VAL 58 -8.711 -18.195 14.177 523 HG21 VAL 58 HG21 VAL 58 -5.287 -17.277 15.317 524 HG22 VAL 58 HG22 VAL 58 -6.649 -16.225 14.919 525 HG23 VAL 58 HG23 VAL 58 -6.918 -17.696 15.864 526 H ASN 59 H ASN 59 -8.049 -21.200 13.482 527 HA ASN 59 HA ASN 59 -7.067 -22.155 10.882 528 HB2 ASN 59 HB2 ASN 59 -9.407 -23.048 12.612 529 HB3 ASN 59 HB3 ASN 59 -8.850 -23.835 11.146 530 HD21 ASN 59 HD21 ASN 59 -6.805 -24.382 14.631 531 HD22 ASN 59 HD22 ASN 59 -8.083 -23.171 14.531 532 H MET 60 H MET 60 -8.377 -22.353 9.004 533 HA MET 60 HA MET 60 -9.418 -19.936 8.051 534 HB2 MET 60 HB2 MET 60 -8.462 -21.859 6.767 535 HB3 MET 60 HB3 MET 60 -9.932 -22.777 7.080 536 HG2 MET 60 HG2 MET 60 -10.020 -21.940 4.883 537 HG3 MET 60 HG3 MET 60 -11.226 -21.043 5.803 538 HE1 MET 60 HE1 MET 60 -10.466 -17.523 4.896 539 HE2 MET 60 HE2 MET 60 -11.598 -18.859 4.619 540 HE3 MET 60 HE3 MET 60 -11.077 -18.461 6.279 541 H SER 61 H SER 61 -11.200 -22.658 9.507 542 HA SER 61 HA SER 61 -13.871 -21.799 8.981 543 HB2 SER 61 HB2 SER 61 -14.373 -23.359 10.906 544 HB3 SER 61 HB3 SER 61 -13.429 -24.063 9.578 545 HG SER 61 HG SER 61 -12.596 -24.493 11.767 546 H GLU 62 H GLU 62 -11.888 -21.373 11.966 547 HA GLU 62 HA GLU 62 -13.800 -19.641 13.227 548 HB2 GLU 62 HB2 GLU 62 -11.700 -18.847 14.589 549 HB3 GLU 62 HB3 GLU 62 -12.451 -20.437 14.819 550 HG2 GLU 62 HG2 GLU 62 -10.676 -21.394 13.314 551 HG3 GLU 62 HG3 GLU 62 -9.925 -19.797 13.300 552 H LEU 63 H LEU 63 -11.069 -18.808 11.074 553 HA LEU 63 HA LEU 63 -11.403 -15.961 11.215 554 HB2 LEU 63 HB2 LEU 63 -9.451 -17.021 10.206 555 HB3 LEU 63 HB3 LEU 63 -10.448 -17.803 8.988 556 HG LEU 63 HG LEU 63 -11.019 -15.577 8.009 557 HD11 LEU 63 HD11 LEU 63 -8.971 -14.532 10.029 558 HD12 LEU 63 HD12 LEU 63 -9.643 -13.609 8.663 559 HD13 LEU 63 HD13 LEU 63 -10.704 -14.115 9.976 560 HD21 LEU 63 HD21 LEU 63 -8.846 -15.205 6.968 561 HD22 LEU 63 HD22 LEU 63 -8.036 -16.102 8.284 562 HD23 LEU 63 HD23 LEU 63 -9.137 -16.940 7.171 563 H ILE 64 H ILE 64 -13.075 -18.364 9.089 564 HA ILE 64 HA ILE 64 -14.765 -16.414 7.788 565 HB ILE 64 HB ILE 64 -15.123 -19.379 8.311 566 HG12 ILE 64 HG12 ILE 64 -14.655 -18.010 5.641 567 HG13 ILE 64 HG13 ILE 64 -13.303 -18.384 6.693 568 HG21 ILE 64 HG21 ILE 64 -16.887 -17.547 6.613 569 HG22 ILE 64 HG22 ILE 64 -16.940 -19.324 6.591 570 HG23 ILE 64 HG23 ILE 64 -17.383 -18.466 8.054 571 HD11 ILE 64 HD11 ILE 64 -15.241 -20.411 5.533 572 HD12 ILE 64 HD12 ILE 64 -13.561 -20.152 5.063 573 HD13 ILE 64 HD13 ILE 64 -13.931 -20.794 6.673 574 H LYS 65 H LYS 65 -15.273 -18.299 10.814 575 HA LYS 65 HA LYS 65 -17.900 -17.306 11.338 576 HB2 LYS 65 HB2 LYS 65 -15.774 -18.439 13.185 577 HB3 LYS 65 HB3 LYS 65 -17.393 -17.995 13.736 578 HG2 LYS 65 HG2 LYS 65 -18.454 -19.570 12.233 579 HG3 LYS 65 HG3 LYS 65 -16.942 -19.910 11.415 580 HD2 LYS 65 HD2 LYS 65 -17.431 -21.757 12.886 581 HD3 LYS 65 HD3 LYS 65 -15.991 -20.924 13.438 582 HE2 LYS 65 HE2 LYS 65 -17.267 -21.511 15.369 583 HE3 LYS 65 HE3 LYS 65 -17.358 -19.761 15.200 584 HZ1 LYS 65 HZ1 LYS 65 -19.608 -20.035 14.253 585 HZ2 LYS 65 HZ2 LYS 65 -19.492 -21.672 14.344 586 HZ3 LYS 65 HZ3 LYS 65 -19.535 -20.770 15.703 587 H ILE 66 H ILE 66 -14.792 -15.914 12.560 588 HA ILE 66 HA ILE 66 -16.129 -13.792 13.973 589 HB ILE 66 HB ILE 66 -13.907 -14.259 14.558 590 HG12 ILE 66 HG12 ILE 66 -14.772 -11.821 14.638 591 HG13 ILE 66 HG13 ILE 66 -13.085 -12.166 14.959 592 HG21 ILE 66 HG21 ILE 66 -11.914 -13.741 13.219 593 HG22 ILE 66 HG22 ILE 66 -12.877 -15.022 12.518 594 HG23 ILE 66 HG23 ILE 66 -12.932 -13.416 11.795 595 HD11 ILE 66 HD11 ILE 66 -14.066 -11.068 12.289 596 HD12 ILE 66 HD12 ILE 66 -13.374 -10.124 13.613 597 HD13 ILE 66 HD13 ILE 66 -12.389 -11.336 12.787 598 H ILE 67 H ILE 67 -14.940 -13.877 10.595 599 HA ILE 67 HA ILE 67 -15.763 -11.162 10.025 600 HB ILE 67 HB ILE 67 -15.182 -13.538 8.218 601 HG12 ILE 67 HG12 ILE 67 -13.226 -12.824 9.502 602 HG13 ILE 67 HG13 ILE 67 -13.030 -12.491 7.801 603 HG21 ILE 67 HG21 ILE 67 -14.902 -11.861 6.389 604 HG22 ILE 67 HG22 ILE 67 -16.570 -11.984 6.957 605 HG23 ILE 67 HG23 ILE 67 -15.583 -10.606 7.459 606 HD11 ILE 67 HD11 ILE 67 -12.117 -10.702 9.215 607 HD12 ILE 67 HD12 ILE 67 -13.426 -10.080 8.207 608 HD13 ILE 67 HD13 ILE 67 -13.699 -10.410 9.937 609 H ARG 68 H ARG 68 -17.478 -14.285 9.528 610 HA ARG 68 HA ARG 68 -19.858 -13.159 8.420 611 HB2 ARG 68 HB2 ARG 68 -19.248 -15.573 8.373 612 HB3 ARG 68 HB3 ARG 68 -19.548 -15.683 10.110 613 HG2 ARG 68 HG2 ARG 68 -21.929 -15.065 9.740 614 HG3 ARG 68 HG3 ARG 68 -21.628 -14.919 8.007 615 HD2 ARG 68 HD2 ARG 68 -21.288 -17.478 9.633 616 HD3 ARG 68 HD3 ARG 68 -22.756 -17.050 8.773 617 HE ARG 68 HE ARG 68 -20.167 -17.926 7.622 618 HH11 ARG 68 HH11 ARG 68 -23.448 -16.914 6.895 619 HH12 ARG 68 HH12 ARG 68 -23.347 -17.464 5.247 620 HH21 ARG 68 HH21 ARG 68 -20.113 -18.570 5.466 621 HH22 ARG 68 HH22 ARG 68 -21.442 -18.148 4.416 622 H ARG 69 H ARG 69 -18.918 -13.514 11.843 623 HA ARG 69 HA ARG 69 -21.453 -12.507 12.862 624 HB2 ARG 69 HB2 ARG 69 -19.944 -13.934 14.203 625 HB3 ARG 69 HB3 ARG 69 -18.707 -12.676 14.170 626 HG2 ARG 69 HG2 ARG 69 -19.796 -12.585 16.307 627 HG3 ARG 69 HG3 ARG 69 -20.268 -11.137 15.417 628 HD2 ARG 69 HD2 ARG 69 -22.442 -12.170 14.855 629 HD3 ARG 69 HD3 ARG 69 -21.972 -13.659 15.670 630 HE ARG 69 HE ARG 69 -22.702 -11.050 16.884 631 HH11 ARG 69 HH11 ARG 69 -21.675 -14.334 17.579 632 HH12 ARG 69 HH12 ARG 69 -22.194 -14.237 19.238 633 HH21 ARG 69 HH21 ARG 69 -23.306 -10.991 19.008 634 HH22 ARG 69 HH22 ARG 69 -23.084 -12.384 20.024 635 H ARG 70 H ARG 70 -18.285 -10.925 12.301 636 HA ARG 70 HA ARG 70 -19.153 -8.352 13.331 637 HB2 ARG 70 HB2 ARG 70 -16.690 -9.451 12.068 638 HB3 ARG 70 HB3 ARG 70 -17.023 -7.781 11.651 639 HG2 ARG 70 HG2 ARG 70 -15.607 -7.824 13.593 640 HG3 ARG 70 HG3 ARG 70 -17.179 -7.142 14.018 641 HD2 ARG 70 HD2 ARG 70 -17.815 -9.254 15.119 642 HD3 ARG 70 HD3 ARG 70 -16.286 -9.990 14.599 643 HE ARG 70 HE ARG 70 -15.927 -7.501 16.107 644 HH11 ARG 70 HH11 ARG 70 -16.461 -10.925 16.695 645 HH12 ARG 70 HH12 ARG 70 -15.605 -10.868 18.207 646 HH21 ARG 70 HH21 ARG 70 -14.842 -7.504 17.982 647 HH22 ARG 70 HH22 ARG 70 -14.697 -8.975 18.915 648 H LEU 71 H LEU 71 -19.075 -9.592 9.977 649 HA LEU 71 HA LEU 71 -20.204 -7.106 8.883 650 HB2 LEU 71 HB2 LEU 71 -20.059 -9.960 7.819 651 HB3 LEU 71 HB3 LEU 71 -20.781 -8.627 6.927 652 HG LEU 71 HG LEU 71 -17.855 -8.735 7.793 653 HD11 LEU 71 HD11 LEU 71 -19.146 -9.143 5.061 654 HD12 LEU 71 HD12 LEU 71 -17.405 -9.146 5.414 655 HD13 LEU 71 HD13 LEU 71 -18.445 -10.420 6.081 656 HD21 LEU 71 HD21 LEU 71 -17.643 -6.862 6.105 657 HD22 LEU 71 HD22 LEU 71 -19.408 -6.780 6.041 658 HD23 LEU 71 HD23 LEU 71 -18.544 -6.404 7.553 659 H GLN 72 H GLN 72 -22.380 -6.560 8.696 660 HA GLN 72 HA GLN 72 -24.205 -7.892 10.467 661 HB2 GLN 72 HB2 GLN 72 -24.553 -5.606 8.524 662 HB3 GLN 72 HB3 GLN 72 -25.856 -6.231 9.549 663 HG2 GLN 72 HG2 GLN 72 -24.535 -5.796 11.585 664 HG3 GLN 72 HG3 GLN 72 -23.179 -5.221 10.625 665 HE21 GLN 72 HE21 GLN 72 -24.842 -2.141 11.742 666 HE22 GLN 72 HE22 GLN 72 -23.855 -3.427 12.420 667 H LEU 73 H LEU 73 -24.814 -9.854 10.002 668 HA LEU 73 HA LEU 73 -26.185 -10.563 7.462 669 HB2 LEU 73 HB2 LEU 73 -23.822 -11.985 8.766 670 HB3 LEU 73 HB3 LEU 73 -24.775 -12.680 7.464 671 HG LEU 73 HG LEU 73 -23.153 -10.104 7.165 672 HD11 LEU 73 HD11 LEU 73 -21.543 -11.511 5.950 673 HD12 LEU 73 HD12 LEU 73 -21.692 -11.971 7.649 674 HD13 LEU 73 HD13 LEU 73 -22.477 -12.961 6.401 675 HD21 LEU 73 HD21 LEU 73 -24.975 -10.305 5.513 676 HD22 LEU 73 HD22 LEU 73 -23.410 -10.579 4.743 677 HD23 LEU 73 HD23 LEU 73 -24.463 -11.964 5.122 678 H ASN 74 H ASN 74 -27.177 -12.750 7.618 679 HA ASN 74 HA ASN 74 -27.917 -13.815 10.226 680 HB2 ASN 74 HB2 ASN 74 -29.390 -11.730 9.843 681 HB3 ASN 74 HB3 ASN 74 -30.091 -12.567 8.463 682 HD21 ASN 74 HD21 ASN 74 -32.468 -13.233 11.129 683 HD22 ASN 74 HD22 ASN 74 -32.033 -11.991 9.960 684 H ALA 75 H ALA 75 -29.414 -15.762 9.860 685 HA ALA 75 HA ALA 75 -28.245 -17.552 8.068 686 HB1 ALA 75 HB1 ALA 75 -31.024 -17.636 9.338 687 HB2 ALA 75 HB2 ALA 75 -30.117 -19.036 8.719 688 HB3 ALA 75 HB3 ALA 75 -29.501 -18.138 10.118 689 H ASN 76 H ASN 76 -31.116 -15.550 7.485 690 HA ASN 76 HA ASN 76 -31.918 -16.840 5.022 691 HB2 ASN 76 HB2 ASN 76 -33.438 -15.632 6.555 692 HB3 ASN 76 HB3 ASN 76 -32.584 -14.120 6.234 693 HD21 ASN 76 HD21 ASN 76 -34.713 -13.441 3.525 694 HD22 ASN 76 HD22 ASN 76 -33.709 -12.841 4.841 695 H GLN 77 H GLN 77 -29.436 -14.463 5.693 696 HA GLN 77 HA GLN 77 -29.465 -13.336 2.961 697 HB2 GLN 77 HB2 GLN 77 -29.136 -11.847 4.901 698 HB3 GLN 77 HB3 GLN 77 -27.692 -12.746 5.361 699 HG2 GLN 77 HG2 GLN 77 -27.086 -10.670 4.233 700 HG3 GLN 77 HG3 GLN 77 -26.547 -12.051 3.288 701 HE21 GLN 77 HE21 GLN 77 -29.556 -9.642 1.794 702 HE22 GLN 77 HE22 GLN 77 -29.073 -9.479 3.473 703 H ALA 78 H ALA 78 -28.011 -13.821 1.366 704 HA ALA 78 HA ALA 78 -26.359 -16.236 1.680 705 HB1 ALA 78 HB1 ALA 78 -27.748 -15.886 -0.325 706 HB2 ALA 78 HB2 ALA 78 -26.824 -14.416 -0.717 707 HB3 ALA 78 HB3 ALA 78 -26.027 -16.004 -0.729 708 H PHE 79 H PHE 79 -24.279 -16.206 2.289 709 HA PHE 79 HA PHE 79 -22.456 -14.192 1.306 710 HB2 PHE 79 HB2 PHE 79 -22.982 -12.868 3.096 711 HB3 PHE 79 HB3 PHE 79 -23.167 -14.222 4.193 712 HD1 PHE 79 HD1 PHE 79 -21.211 -15.359 5.193 713 HD2 PHE 79 HD2 PHE 79 -20.760 -11.835 2.773 714 HE1 PHE 79 HE1 PHE 79 -18.902 -15.072 6.057 715 HE2 PHE 79 HE2 PHE 79 -18.476 -11.510 3.697 716 HZ PHE 79 HZ PHE 79 -17.537 -13.138 5.298 717 H PHE 80 H PHE 80 -20.468 -14.775 0.919 718 HA PHE 80 HA PHE 80 -19.313 -17.150 2.278 719 HB2 PHE 80 HB2 PHE 80 -19.386 -16.690 -0.720 720 HB3 PHE 80 HB3 PHE 80 -18.366 -17.868 0.094 721 HD1 PHE 80 HD1 PHE 80 -19.191 -19.997 0.837 722 HD2 PHE 80 HD2 PHE 80 -21.875 -17.022 -0.754 723 HE1 PHE 80 HE1 PHE 80 -20.964 -21.719 0.606 724 HE2 PHE 80 HE2 PHE 80 -23.652 -18.745 -0.983 725 HZ PHE 80 HZ PHE 80 -23.197 -21.095 -0.308 726 H LEU 81 H LEU 81 -17.323 -16.805 3.039 727 HA LEU 81 HA LEU 81 -15.670 -14.559 1.991 728 HB2 LEU 81 HB2 LEU 81 -16.059 -14.669 4.386 729 HB3 LEU 81 HB3 LEU 81 -15.455 -16.301 4.466 730 HG LEU 81 HG LEU 81 -13.954 -14.625 5.410 731 HD11 LEU 81 HD11 LEU 81 -12.496 -15.728 3.004 732 HD12 LEU 81 HD12 LEU 81 -11.917 -15.409 4.653 733 HD13 LEU 81 HD13 LEU 81 -13.034 -16.754 4.352 734 HD21 LEU 81 HD21 LEU 81 -13.535 -13.551 2.594 735 HD22 LEU 81 HD22 LEU 81 -14.406 -12.727 3.915 736 HD23 LEU 81 HD23 LEU 81 -12.672 -13.069 4.071 737 H LEU 82 H LEU 82 -14.147 -14.961 0.556 738 HA LEU 82 HA LEU 82 -13.527 -17.773 -0.231 739 HB2 LEU 82 HB2 LEU 82 -13.562 -15.312 -2.004 740 HB3 LEU 82 HB3 LEU 82 -13.553 -16.997 -2.499 741 HG LEU 82 HG LEU 82 -15.899 -15.523 -1.200 742 HD11 LEU 82 HD11 LEU 82 -15.502 -16.509 -4.053 743 HD12 LEU 82 HD12 LEU 82 -16.959 -15.748 -3.398 744 HD13 LEU 82 HD13 LEU 82 -15.466 -14.810 -3.515 745 HD21 LEU 82 HD21 LEU 82 -15.987 -17.916 -0.634 746 HD22 LEU 82 HD22 LEU 82 -17.197 -17.545 -1.875 747 HD23 LEU 82 HD23 LEU 82 -15.688 -18.332 -2.343 748 H VAL 83 H VAL 83 -11.462 -18.334 -0.800 749 HA VAL 83 HA VAL 83 -9.337 -16.280 -0.462 750 HB VAL 83 HB VAL 83 -7.793 -17.663 0.380 751 HG11 VAL 83 HG11 VAL 83 -9.671 -17.255 1.992 752 HG12 VAL 83 HG12 VAL 83 -10.358 -18.822 1.563 753 HG13 VAL 83 HG13 VAL 83 -8.756 -18.745 2.325 754 HG21 VAL 83 HG21 VAL 83 -7.981 -20.157 0.518 755 HG22 VAL 83 HG22 VAL 83 -9.419 -20.063 -0.528 756 HG23 VAL 83 HG23 VAL 83 -7.831 -19.541 -1.131 757 H ASN 84 H ASN 84 -8.151 -15.725 -2.134 758 HA ASN 84 HA ASN 84 -7.961 -15.255 -4.364 759 HB2 ASN 84 HB2 ASN 84 -6.243 -17.051 -3.775 760 HB3 ASN 84 HB3 ASN 84 -7.275 -18.211 -4.602 761 HD21 ASN 84 HD21 ASN 84 -4.790 -17.160 -7.086 762 HD22 ASN 84 HD22 ASN 84 -4.857 -18.115 -5.599 763 H GLY 85 H GLY 85 -10.605 -15.492 -3.776 764 HA2 GLY 85 HA2 GLY 85 -12.620 -15.432 -4.837 765 HA3 GLY 85 HA3 GLY 85 -11.837 -15.943 -6.334 766 H HIS 86 H HIS 86 -11.273 -18.356 -3.959 767 HA HIS 86 HA HIS 86 -13.757 -19.871 -4.727 768 HB2 HIS 86 HB2 HIS 86 -11.711 -20.809 -5.710 769 HB3 HIS 86 HB3 HIS 86 -10.957 -20.901 -4.125 770 HD1 HIS 86 HD1 HIS 86 -11.230 -23.227 -2.966 771 HD2 HIS 86 HD2 HIS 86 -14.236 -22.320 -5.802 772 HE1 HIS 86 HE1 HIS 86 -12.763 -25.286 -3.086 773 HE2 HIS 86 HE2 HIS 86 -14.588 -24.732 -4.822 774 H SER 87 H SER 87 -14.871 -21.075 -3.149 775 HA SER 87 HA SER 87 -14.816 -19.962 -0.485 776 HB2 SER 87 HB2 SER 87 -16.900 -20.669 -1.495 777 HB3 SER 87 HB3 SER 87 -16.320 -22.345 -1.594 778 HG SER 87 HG SER 87 -17.592 -22.079 0.264 779 H MET 88 H MET 88 -14.261 -20.809 1.457 780 HA MET 88 HA MET 88 -12.871 -23.461 1.570 781 HB2 MET 88 HB2 MET 88 -12.073 -20.915 3.024 782 HB3 MET 88 HB3 MET 88 -11.389 -22.516 3.324 783 HG2 MET 88 HG2 MET 88 -11.268 -21.138 0.627 784 HG3 MET 88 HG3 MET 88 -10.022 -21.009 1.860 785 HE1 MET 88 HE1 MET 88 -9.158 -23.460 3.085 786 HE2 MET 88 HE2 MET 88 -8.114 -24.253 1.883 787 HE3 MET 88 HE3 MET 88 -8.033 -22.494 2.102 788 H VAL 89 H VAL 89 -15.740 -22.348 2.293 789 HA VAL 89 HA VAL 89 -15.995 -22.511 5.149 790 HB VAL 89 HB VAL 89 -18.104 -23.058 3.023 791 HG11 VAL 89 HG11 VAL 89 -18.397 -22.287 5.962 792 HG12 VAL 89 HG12 VAL 89 -19.718 -22.294 4.775 793 HG13 VAL 89 HG13 VAL 89 -18.926 -23.807 5.207 794 HG21 VAL 89 HG21 VAL 89 -17.423 -20.456 4.467 795 HG22 VAL 89 HG22 VAL 89 -17.093 -20.794 2.761 796 HG23 VAL 89 HG23 VAL 89 -18.760 -20.706 3.322 797 H SER 90 H SER 90 -15.800 -25.042 2.740 798 HA SER 90 HA SER 90 -16.762 -27.204 4.408 799 HB2 SER 90 HB2 SER 90 -15.964 -28.595 2.516 800 HB3 SER 90 HB3 SER 90 -17.001 -27.258 1.998 801 HG SER 90 HG SER 90 -15.083 -27.479 0.708 802 H VAL 91 H VAL 91 -13.815 -25.527 4.713 803 HA VAL 91 HA VAL 91 -12.472 -27.950 5.747 804 HB VAL 91 HB VAL 91 -11.917 -27.484 3.319 805 HG11 VAL 91 HG11 VAL 91 -11.483 -25.052 3.514 806 HG12 VAL 91 HG12 VAL 91 -10.076 -25.386 4.545 807 HG13 VAL 91 HG13 VAL 91 -10.100 -25.946 2.862 808 HG21 VAL 91 HG21 VAL 91 -9.655 -28.276 3.573 809 HG22 VAL 91 HG22 VAL 91 -9.602 -27.780 5.267 810 HG23 VAL 91 HG23 VAL 91 -10.698 -29.082 4.743 811 H SER 92 H SER 92 -10.920 -27.867 7.245 812 HA SER 92 HA SER 92 -11.071 -25.514 9.019 813 HB2 SER 92 HB2 SER 92 -10.524 -27.170 10.778 814 HB3 SER 92 HB3 SER 92 -11.973 -27.579 9.854 815 HG SER 92 HG SER 92 -10.565 -29.399 10.137 816 H THR 93 H THR 93 -8.950 -25.922 6.753 817 HA THR 93 HA THR 93 -6.480 -26.459 7.714 818 HB THR 93 HB THR 93 -6.804 -24.243 5.737 819 HG1 THR 93 HG1 THR 93 -7.183 -25.935 4.194 820 HG21 THR 93 HG21 THR 93 -4.501 -24.966 6.145 821 HG22 THR 93 HG22 THR 93 -4.955 -26.668 5.850 822 HG23 THR 93 HG23 THR 93 -5.009 -25.472 4.535 823 HA PRO 94 HA PRO 94 -5.091 -23.119 10.417 824 HB2 PRO 94 HB2 PRO 94 -2.359 -23.952 9.446 825 HB3 PRO 94 HB3 PRO 94 -2.915 -23.615 11.117 826 HG2 PRO 94 HG2 PRO 94 -2.629 -26.168 10.288 827 HG3 PRO 94 HG3 PRO 94 -4.086 -25.704 11.225 828 HD2 PRO 94 HD2 PRO 94 -3.812 -26.008 8.220 829 HD3 PRO 94 HD3 PRO 94 -5.086 -26.639 9.315 830 H ILE 95 H ILE 95 -4.684 -20.903 10.075 831 HA ILE 95 HA ILE 95 -4.864 -20.001 7.414 832 HB ILE 95 HB ILE 95 -5.693 -18.788 9.408 833 HG12 ILE 95 HG12 ILE 95 -5.258 -16.526 8.697 834 HG13 ILE 95 HG13 ILE 95 -3.822 -16.996 7.791 835 HG21 ILE 95 HG21 ILE 95 -2.835 -17.786 9.832 836 HG22 ILE 95 HG22 ILE 95 -4.270 -17.424 10.802 837 HG23 ILE 95 HG23 ILE 95 -3.587 -19.044 10.834 838 HD11 ILE 95 HD11 ILE 95 -5.175 -18.136 6.134 839 HD12 ILE 95 HD12 ILE 95 -6.639 -17.967 7.141 840 HD13 ILE 95 HD13 ILE 95 -5.875 -16.538 6.416 841 H SER 96 H SER 96 -1.906 -20.525 9.281 842 HA SER 96 HA SER 96 -0.109 -19.089 7.555 843 HB2 SER 96 HB2 SER 96 0.479 -19.893 9.811 844 HB3 SER 96 HB3 SER 96 0.383 -21.573 9.244 845 HG SER 96 HG SER 96 2.551 -20.796 9.199 846 H GLU 97 H GLU 97 -1.390 -22.446 7.360 847 HA GLU 97 HA GLU 97 0.207 -23.188 5.049 848 HB2 GLU 97 HB2 GLU 97 -0.636 -24.887 6.565 849 HB3 GLU 97 HB3 GLU 97 -2.284 -24.335 6.333 850 HG2 GLU 97 HG2 GLU 97 -2.015 -26.365 5.134 851 HG3 GLU 97 HG3 GLU 97 -2.242 -25.080 3.970 852 H VAL 98 H VAL 98 -3.149 -21.975 5.445 853 HA VAL 98 HA VAL 98 -3.747 -21.857 2.618 854 HB VAL 98 HB VAL 98 -4.830 -20.012 4.776 855 HG11 VAL 98 HG11 VAL 98 -5.978 -20.862 2.080 856 HG12 VAL 98 HG12 VAL 98 -6.808 -19.865 3.300 857 HG13 VAL 98 HG13 VAL 98 -5.366 -19.245 2.493 858 HG21 VAL 98 HG21 VAL 98 -5.255 -22.333 5.467 859 HG22 VAL 98 HG22 VAL 98 -6.749 -21.590 4.906 860 HG23 VAL 98 HG23 VAL 98 -5.879 -22.720 3.848 861 H TYR 99 H TYR 99 -2.089 -19.574 4.796 862 HA TYR 99 HA TYR 99 -1.706 -17.569 2.832 863 HB2 TYR 99 HB2 TYR 99 -1.565 -16.843 4.986 864 HB3 TYR 99 HB3 TYR 99 -0.412 -18.080 5.453 865 HD1 TYR 99 HD1 TYR 99 -0.806 -14.754 4.052 866 HD2 TYR 99 HD2 TYR 99 1.998 -17.932 4.845 867 HE1 TYR 99 HE1 TYR 99 1.052 -13.213 3.599 868 HE2 TYR 99 HE2 TYR 99 3.886 -16.349 4.462 869 HH TYR 99 HH TYR 99 3.335 -12.949 3.471 870 H GLU 100 H GLU 100 0.817 -19.962 3.785 871 HA GLU 100 HA GLU 100 2.602 -19.083 1.744 872 HB2 GLU 100 HB2 GLU 100 2.317 -21.808 3.082 873 HB3 GLU 100 HB3 GLU 100 3.646 -21.348 1.999 874 HG2 GLU 100 HG2 GLU 100 4.137 -19.399 3.530 875 HG3 GLU 100 HG3 GLU 100 2.968 -20.064 4.675 876 H SER 101 H SER 101 -0.183 -21.233 1.438 877 HA SER 101 HA SER 101 0.559 -22.160 -1.243 878 HB2 SER 101 HB2 SER 101 -1.657 -23.234 -1.245 879 HB3 SER 101 HB3 SER 101 -0.647 -23.683 0.137 880 HG SER 101 HG SER 101 -1.872 -22.538 1.474 881 H GLU 102 H GLU 102 -1.428 -19.453 -0.050 882 HA GLU 102 HA GLU 102 -2.008 -18.726 -2.899 883 HB2 GLU 102 HB2 GLU 102 -3.888 -18.626 -0.538 884 HB3 GLU 102 HB3 GLU 102 -4.231 -17.839 -2.071 885 HG2 GLU 102 HG2 GLU 102 -3.810 -20.830 -1.652 886 HG3 GLU 102 HG3 GLU 102 -5.355 -20.014 -1.785 887 H LYS 103 H LYS 103 -0.058 -17.738 -0.672 888 HA LYS 103 HA LYS 103 -0.236 -14.919 -0.510 889 HB2 LYS 103 HB2 LYS 103 1.222 -16.110 0.887 890 HB3 LYS 103 HB3 LYS 103 1.941 -17.000 -0.462 891 HG2 LYS 103 HG2 LYS 103 3.103 -14.875 -1.161 892 HG3 LYS 103 HG3 LYS 103 2.477 -14.120 0.333 893 HD2 LYS 103 HD2 LYS 103 3.504 -16.033 1.632 894 HD3 LYS 103 HD3 LYS 103 4.191 -16.658 0.141 895 HE2 LYS 103 HE2 LYS 103 4.832 -13.957 1.397 896 HE3 LYS 103 HE3 LYS 103 5.788 -15.430 1.563 897 HZ1 LYS 103 HZ1 LYS 103 6.167 -15.415 -0.854 898 HZ2 LYS 103 HZ2 LYS 103 5.308 -14.027 -1.031 899 HZ3 LYS 103 HZ3 LYS 103 6.709 -14.033 -0.189 900 H ASP 104 H ASP 104 0.291 -13.264 -1.764 901 HA ASP 104 HA ASP 104 1.171 -13.721 -4.578 902 HB2 ASP 104 HB2 ASP 104 -1.029 -12.636 -4.100 903 HB3 ASP 104 HB3 ASP 104 -0.173 -11.325 -3.284 904 H GLU 105 H GLU 105 2.406 -11.747 -5.470 905 HA GLU 105 HA GLU 105 5.028 -11.809 -4.395 906 HB2 GLU 105 HB2 GLU 105 3.766 -9.887 -6.392 907 HB3 GLU 105 HB3 GLU 105 5.494 -10.074 -6.154 908 HG2 GLU 105 HG2 GLU 105 3.606 -12.255 -7.152 909 HG3 GLU 105 HG3 GLU 105 4.656 -11.259 -8.150 910 H ASP 106 H ASP 106 2.483 -9.566 -3.573 911 HA ASP 106 HA ASP 106 4.258 -7.488 -2.499 912 HB2 ASP 106 HB2 ASP 106 2.207 -6.496 -1.611 913 HB3 ASP 106 HB3 ASP 106 2.079 -6.844 -3.328 914 H GLY 107 H GLY 107 3.440 -10.576 -1.467 915 HA2 GLY 107 HA2 GLY 107 4.280 -11.636 0.464 916 HA3 GLY 107 HA3 GLY 107 4.407 -10.094 1.297 917 H PHE 108 H PHE 108 1.327 -10.193 -0.137 918 HA PHE 108 HA PHE 108 0.093 -11.046 2.425 919 HB2 PHE 108 HB2 PHE 108 -0.931 -9.289 0.186 920 HB3 PHE 108 HB3 PHE 108 -1.927 -9.893 1.486 921 HD1 PHE 108 HD1 PHE 108 1.031 -7.740 0.783 922 HD2 PHE 108 HD2 PHE 108 -2.078 -8.798 3.576 923 HE1 PHE 108 HE1 PHE 108 1.539 -5.715 2.121 924 HE2 PHE 108 HE2 PHE 108 -1.544 -6.787 4.933 925 HZ PHE 108 HZ PHE 108 0.260 -5.234 4.198 926 H LEU 109 H LEU 109 -1.685 -12.387 2.598 927 HA LEU 109 HA LEU 109 -2.244 -14.243 0.328 928 HB2 LEU 109 HB2 LEU 109 -2.106 -15.341 2.405 929 HB3 LEU 109 HB3 LEU 109 -3.045 -14.097 3.233 930 HG LEU 109 HG LEU 109 -5.094 -14.889 1.978 931 HD11 LEU 109 HD11 LEU 109 -4.011 -15.984 0.061 932 HD12 LEU 109 HD12 LEU 109 -3.234 -17.146 1.152 933 HD13 LEU 109 HD13 LEU 109 -5.005 -17.127 0.965 934 HD21 LEU 109 HD21 LEU 109 -4.636 -15.626 4.276 935 HD22 LEU 109 HD22 LEU 109 -5.359 -16.944 3.327 936 HD23 LEU 109 HD23 LEU 109 -3.632 -16.951 3.674 937 H TYR 110 H TYR 110 -4.085 -14.079 -0.950 938 HA TYR 110 HA TYR 110 -5.805 -11.746 -0.430 939 HB2 TYR 110 HB2 TYR 110 -5.081 -13.070 -2.973 940 HB3 TYR 110 HB3 TYR 110 -6.581 -12.165 -2.834 941 HD1 TYR 110 HD1 TYR 110 -6.617 -9.786 -2.855 942 HD2 TYR 110 HD2 TYR 110 -2.878 -11.876 -2.249 943 HE1 TYR 110 HE1 TYR 110 -5.370 -7.630 -2.998 944 HE2 TYR 110 HE2 TYR 110 -1.657 -9.718 -2.360 945 HH TYR 110 HH TYR 110 -1.810 -7.512 -2.581 946 H MET 111 H MET 111 -7.695 -11.698 0.357 947 HA MET 111 HA MET 111 -9.523 -13.958 -0.249 948 HB2 MET 111 HB2 MET 111 -9.493 -12.359 2.347 949 HB3 MET 111 HB3 MET 111 -10.658 -13.607 1.886 950 HG2 MET 111 HG2 MET 111 -8.670 -15.206 1.669 951 HG3 MET 111 HG3 MET 111 -7.706 -13.967 2.479 952 HE1 MET 111 HE1 MET 111 -7.770 -16.820 3.374 953 HE2 MET 111 HE2 MET 111 -6.994 -15.664 4.481 954 HE3 MET 111 HE3 MET 111 -8.170 -16.838 5.100 955 H VAL 112 H VAL 112 -11.651 -13.465 -0.683 956 HA VAL 112 HA VAL 112 -12.488 -10.649 -0.710 957 HB VAL 112 HB VAL 112 -13.463 -10.709 -2.928 958 HG11 VAL 112 HG11 VAL 112 -11.102 -9.916 -2.726 959 HG12 VAL 112 HG12 VAL 112 -10.545 -11.538 -3.182 960 HG13 VAL 112 HG13 VAL 112 -11.499 -10.569 -4.320 961 HG21 VAL 112 HG21 VAL 112 -12.942 -12.512 -4.540 962 HG22 VAL 112 HG22 VAL 112 -12.193 -13.459 -3.240 963 HG23 VAL 112 HG23 VAL 112 -13.935 -13.088 -3.192 964 H TYR 113 H TYR 113 -14.987 -10.510 -0.929 965 HA TYR 113 HA TYR 113 -16.237 -13.147 -0.263 966 HB2 TYR 113 HB2 TYR 113 -17.369 -12.340 1.654 967 HB3 TYR 113 HB3 TYR 113 -15.672 -11.976 1.876 968 HD1 TYR 113 HD1 TYR 113 -14.850 -9.603 1.703 969 HD2 TYR 113 HD2 TYR 113 -19.038 -10.621 1.435 970 HE1 TYR 113 HE1 TYR 113 -15.469 -7.241 2.220 971 HE2 TYR 113 HE2 TYR 113 -19.643 -8.267 1.985 972 HH TYR 113 HH TYR 113 -18.811 -6.276 2.807 973 H ALA 114 H ALA 114 -18.450 -13.282 -0.615 974 HA ALA 114 HA ALA 114 -19.774 -11.253 -2.331 975 HB1 ALA 114 HB1 ALA 114 -18.152 -12.496 -3.788 976 HB2 ALA 114 HB2 ALA 114 -18.950 -14.012 -3.355 977 HB3 ALA 114 HB3 ALA 114 -19.831 -12.747 -4.260 978 H SER 115 H SER 115 -21.907 -11.984 -3.049 979 HA SER 115 HA SER 115 -23.494 -13.390 -1.070 980 HB2 SER 115 HB2 SER 115 -25.313 -12.819 -2.686 981 HB3 SER 115 HB3 SER 115 -24.308 -11.415 -2.257 982 HG SER 115 HG SER 115 -24.668 -11.640 -4.558 983 H GLN 116 H GLN 116 -21.378 -14.866 -2.927 984 HA GLN 116 HA GLN 116 -22.985 -17.225 -3.641 985 HB2 GLN 116 HB2 GLN 116 -22.359 -17.118 -6.019 986 HB3 GLN 116 HB3 GLN 116 -23.308 -15.722 -5.538 987 HG2 GLN 116 HG2 GLN 116 -20.767 -14.713 -5.189 988 HG3 GLN 116 HG3 GLN 116 -20.476 -15.868 -6.471 989 HE21 GLN 116 HE21 GLN 116 -22.920 -12.620 -7.238 990 HE22 GLN 116 HE22 GLN 116 -22.694 -13.081 -5.568 991 H GLU 117 H GLU 117 -21.724 -19.096 -4.090 992 HA GLU 117 HA GLU 117 -19.371 -19.325 -2.495 993 HB2 GLU 117 HB2 GLU 117 -21.114 -21.076 -3.025 994 HB3 GLU 117 HB3 GLU 117 -20.382 -21.237 -4.633 995 HG2 GLU 117 HG2 GLU 117 -18.237 -21.911 -3.573 996 HG3 GLU 117 HG3 GLU 117 -18.991 -21.745 -1.979 997 H THR 118 H THR 118 -19.749 -18.865 -5.967 998 HA THR 118 HA THR 118 -16.918 -18.071 -6.331 999 HB THR 118 HB THR 118 -17.069 -19.483 -8.585 1000 HG1 THR 118 HG1 THR 118 -19.078 -20.461 -8.252 1001 HG21 THR 118 HG21 THR 118 -15.318 -19.775 -6.876 1002 HG22 THR 118 HG22 THR 118 -16.375 -20.915 -6.003 1003 HG23 THR 118 HG23 THR 118 -15.799 -21.296 -7.647 1004 H PHE 119 H PHE 119 -17.044 -16.284 -7.646 1005 HA PHE 119 HA PHE 119 -19.531 -15.629 -8.994 1006 HB2 PHE 119 HB2 PHE 119 -18.177 -13.602 -9.811 1007 HB3 PHE 119 HB3 PHE 119 -18.804 -13.721 -8.179 1008 HD1 PHE 119 HD1 PHE 119 -15.683 -14.178 -10.208 1009 HD2 PHE 119 HD2 PHE 119 -17.377 -13.604 -6.285 1010 HE1 PHE 119 HE1 PHE 119 -13.408 -13.825 -9.273 1011 HE2 PHE 119 HE2 PHE 119 -15.113 -13.244 -5.358 1012 HZ PHE 119 HZ PHE 119 -13.117 -13.352 -6.849 1013 H GLY 120 H GLY 120 -19.985 -15.245 -11.112 1014 HA2 GLY 120 HA2 GLY 120 -18.563 -17.033 -13.028 1015 HA3 GLY 120 HA3 GLY 120 -20.194 -16.397 -13.197 1016 H1 ASP 10 H1 ASP 10 -11.938 -3.062 19.104 1017 H2 ASP 10 H2 ASP 10 -10.555 -2.919 19.976 1018 H3 ASP 10 H3 ASP 10 -11.949 -2.269 20.535 1019 HA ASP 10 HA ASP 10 -12.062 -0.692 18.808 1020 HB2 ASP 10 HB2 ASP 10 -9.495 -0.591 20.363 1021 HB3 ASP 10 HB3 ASP 10 -9.996 0.685 19.254 1022 H TYR 11 H TYR 11 -8.625 -1.605 18.316 1023 HA TYR 11 HA TYR 11 -8.700 -0.594 15.730 1024 HB2 TYR 11 HB2 TYR 11 -6.692 -2.212 17.219 1025 HB3 TYR 11 HB3 TYR 11 -6.493 -2.029 15.493 1026 HD1 TYR 11 HD1 TYR 11 -6.113 -0.367 18.700 1027 HD2 TYR 11 HD2 TYR 11 -6.394 0.244 14.427 1028 HE1 TYR 11 HE1 TYR 11 -5.084 1.885 18.950 1029 HE2 TYR 11 HE2 TYR 11 -5.361 2.501 14.688 1030 HH TYR 11 HH TYR 11 -4.375 3.798 17.890 1031 H GLU 12 H GLU 12 -8.981 -1.106 13.702 1032 HA GLU 12 HA GLU 12 -8.773 -3.877 12.874 1033 HB2 GLU 12 HB2 GLU 12 -11.117 -3.756 13.612 1034 HB3 GLU 12 HB3 GLU 12 -11.386 -2.343 12.598 1035 HG2 GLU 12 HG2 GLU 12 -12.392 -4.317 11.639 1036 HG3 GLU 12 HG3 GLU 12 -11.154 -3.686 10.574 1037 H SER 13 H SER 13 -8.352 -4.206 10.735 1038 HA SER 13 HA SER 13 -7.419 -3.801 8.708 1039 HB2 SER 13 HB2 SER 13 -10.091 -2.477 8.773 1040 HB3 SER 13 HB3 SER 13 -9.173 -2.517 7.263 1041 HG SER 13 HG SER 13 -9.643 -4.866 8.829 1042 H ASP 14 H ASP 14 -6.660 -1.362 10.603 1043 HA ASP 14 HA ASP 14 -6.122 0.681 8.603 1044 HB2 ASP 14 HB2 ASP 14 -6.997 1.285 10.758 1045 HB3 ASP 14 HB3 ASP 14 -5.582 0.595 11.561 1046 H ASP 15 H ASP 15 -3.478 0.717 10.780 1047 HA ASP 15 HA ASP 15 -1.558 -0.600 9.011 1048 HB2 ASP 15 HB2 ASP 15 -2.348 1.627 7.902 1049 HB3 ASP 15 HB3 ASP 15 -1.546 2.447 9.240 1050 H ASP 16 H ASP 16 0.631 -0.139 9.760 1051 HA ASP 16 HA ASP 16 2.180 -0.416 11.357 1052 HB2 ASP 16 HB2 ASP 16 2.544 1.745 10.736 1053 HB3 ASP 16 HB3 ASP 16 1.199 2.361 11.691 1054 H SER 17 H SER 17 0.465 1.371 13.879 1055 HA SER 17 HA SER 17 1.343 -0.642 15.775 1056 HB2 SER 17 HB2 SER 17 0.445 0.921 17.450 1057 HB3 SER 17 HB3 SER 17 1.513 1.724 16.283 1058 HG SER 17 HG SER 17 -0.415 2.932 16.649 1059 H TYR 18 H TYR 18 -1.466 -0.511 13.912 1060 HA TYR 18 HA TYR 18 -3.494 -1.133 15.814 1061 HB2 TYR 18 HB2 TYR 18 -4.860 -1.390 13.974 1062 HB3 TYR 18 HB3 TYR 18 -3.678 -0.249 13.398 1063 HD1 TYR 18 HD1 TYR 18 -5.724 -2.606 12.289 1064 HD2 TYR 18 HD2 TYR 18 -1.477 -1.890 12.322 1065 HE1 TYR 18 HE1 TYR 18 -5.451 -3.915 10.150 1066 HE2 TYR 18 HE2 TYR 18 -1.231 -3.148 10.207 1067 HH TYR 18 HH TYR 18 -2.286 -4.399 8.585 1068 H GLU 19 H GLU 19 -4.362 -3.098 16.508 1069 HA GLU 19 HA GLU 19 -2.690 -5.502 16.082 1070 HB2 GLU 19 HB2 GLU 19 -4.676 -4.749 18.236 1071 HB3 GLU 19 HB3 GLU 19 -3.954 -6.349 18.131 1072 HG2 GLU 19 HG2 GLU 19 -2.405 -3.745 18.445 1073 HG3 GLU 19 HG3 GLU 19 -2.763 -4.896 19.724 1074 H VAL 20 H VAL 20 -5.744 -4.486 15.014 1075 HA VAL 20 HA VAL 20 -7.183 -5.324 13.585 1076 HB VAL 20 HB VAL 20 -4.825 -6.037 12.668 1077 HG11 VAL 20 HG11 VAL 20 -6.199 -8.671 12.205 1078 HG12 VAL 20 HG12 VAL 20 -4.474 -8.218 12.190 1079 HG13 VAL 20 HG13 VAL 20 -5.304 -8.462 13.702 1080 HG21 VAL 20 HG21 VAL 20 -6.844 -5.260 11.380 1081 HG22 VAL 20 HG22 VAL 20 -5.757 -6.358 10.538 1082 HG23 VAL 20 HG23 VAL 20 -7.311 -6.942 11.173 1083 H LEU 21 H LEU 21 -8.696 -6.829 12.768 1084 HA LEU 21 HA LEU 21 -10.310 -8.357 12.804 1085 HB2 LEU 21 HB2 LEU 21 -8.406 -9.925 14.563 1086 HB3 LEU 21 HB3 LEU 21 -9.988 -10.543 14.144 1087 HG LEU 21 HG LEU 21 -8.155 -9.661 11.923 1088 HD11 LEU 21 HD11 LEU 21 -7.226 -11.938 11.828 1089 HD12 LEU 21 HD12 LEU 21 -6.773 -11.131 13.339 1090 HD13 LEU 21 HD13 LEU 21 -8.069 -12.358 13.335 1091 HD21 LEU 21 HD21 LEU 21 -10.205 -11.902 12.142 1092 HD22 LEU 21 HD22 LEU 21 -10.501 -10.307 11.401 1093 HD23 LEU 21 HD23 LEU 21 -9.334 -11.426 10.679 1094 H ASP 22 H ASP 22 -9.722 -6.287 15.061 1095 HA ASP 22 HA ASP 22 -10.413 -5.617 16.995 1096 HB2 ASP 22 HB2 ASP 22 -12.285 -4.943 15.738 1097 HB3 ASP 22 HB3 ASP 22 -13.025 -6.535 15.815 1098 H LEU 23 H LEU 23 -9.126 -8.012 17.163 1099 HA LEU 23 HA LEU 23 -10.329 -9.460 19.483 1100 HB2 LEU 23 HB2 LEU 23 -10.958 -10.640 17.456 1101 HB3 LEU 23 HB3 LEU 23 -9.323 -10.521 16.826 1102 HG LEU 23 HG LEU 23 -8.524 -12.069 18.629 1103 HD11 LEU 23 HD11 LEU 23 -10.195 -13.428 19.824 1104 HD12 LEU 23 HD12 LEU 23 -10.345 -11.732 20.288 1105 HD13 LEU 23 HD13 LEU 23 -11.511 -12.439 19.148 1106 HD21 LEU 23 HD21 LEU 23 -10.748 -13.143 16.848 1107 HD22 LEU 23 HD22 LEU 23 -9.059 -12.872 16.362 1108 HD23 LEU 23 HD23 LEU 23 -9.438 -14.090 17.589 1109 H THR 24 H THR 24 -8.948 -9.885 21.087 1110 HA THR 24 HA THR 24 -6.057 -9.472 20.754 1111 HB THR 24 HB THR 24 -5.764 -9.347 22.998 1112 HG1 THR 24 HG1 THR 24 -7.242 -10.100 24.521 1113 HG21 THR 24 HG21 THR 24 -7.351 -7.771 23.896 1114 HG22 THR 24 HG22 THR 24 -7.183 -7.445 22.162 1115 HG23 THR 24 HG23 THR 24 -8.622 -8.295 22.770 1116 H GLU 25 H GLU 25 -4.437 -10.958 21.616 1117 HA GLU 25 HA GLU 25 -5.194 -13.766 21.832 1118 HB2 GLU 25 HB2 GLU 25 -4.904 -13.717 19.472 1119 HB3 GLU 25 HB3 GLU 25 -3.470 -12.715 19.585 1120 HG2 GLU 25 HG2 GLU 25 -2.890 -14.931 18.886 1121 HG3 GLU 25 HG3 GLU 25 -2.142 -14.553 20.425 1122 H TYR 26 H TYR 26 -3.678 -15.065 22.831 1123 HA TYR 26 HA TYR 26 -2.320 -13.813 24.960 1124 HB2 TYR 26 HB2 TYR 26 -2.547 -16.673 24.116 1125 HB3 TYR 26 HB3 TYR 26 -1.540 -16.190 25.468 1126 HD1 TYR 26 HD1 TYR 26 -4.972 -16.734 24.367 1127 HD2 TYR 26 HD2 TYR 26 -2.502 -15.025 27.464 1128 HE1 TYR 26 HE1 TYR 26 -6.931 -16.710 25.906 1129 HE2 TYR 26 HE2 TYR 26 -4.469 -14.989 29.007 1130 HH TYR 26 HH TYR 26 -7.708 -16.175 28.003 Start of MODEL 3 1 H1 MET 1 H1 MET 1 -8.707 1.758 7.817 2 H2 MET 1 H2 MET 1 -8.332 1.289 6.306 3 H3 MET 1 H3 MET 1 -8.108 2.852 6.758 4 HA MET 1 HA MET 1 -10.485 3.245 6.950 5 HB2 MET 1 HB2 MET 1 -9.325 3.553 4.722 6 HB3 MET 1 HB3 MET 1 -9.853 1.942 4.252 7 HG2 MET 1 HG2 MET 1 -11.419 3.441 3.314 8 HG3 MET 1 HG3 MET 1 -12.258 2.744 4.697 9 HE1 MET 1 HE1 MET 1 -13.356 5.232 3.226 10 HE2 MET 1 HE2 MET 1 -14.127 4.773 4.769 11 HE3 MET 1 HE3 MET 1 -13.649 6.456 4.482 12 HA PRO 2 HA PRO 2 -12.314 -0.779 8.000 13 HB2 PRO 2 HB2 PRO 2 -14.534 0.925 9.109 14 HB3 PRO 2 HB3 PRO 2 -13.674 -0.452 9.864 15 HG2 PRO 2 HG2 PRO 2 -13.108 2.083 10.611 16 HG3 PRO 2 HG3 PRO 2 -11.777 0.911 10.362 17 HD2 PRO 2 HD2 PRO 2 -12.851 2.994 8.417 18 HD3 PRO 2 HD3 PRO 2 -11.162 2.704 8.911 19 H SER 3 H SER 3 -13.978 1.698 6.095 20 HA SER 3 HA SER 3 -15.707 -0.300 4.759 21 HB2 SER 3 HB2 SER 3 -16.820 0.368 6.952 22 HB3 SER 3 HB3 SER 3 -16.923 2.015 6.314 23 HG SER 3 HG SER 3 -18.843 0.862 5.856 24 H GLU 4 H GLU 4 -17.360 1.067 3.422 25 HA GLU 4 HA GLU 4 -17.852 2.286 1.596 26 HB2 GLU 4 HB2 GLU 4 -16.389 4.436 3.155 27 HB3 GLU 4 HB3 GLU 4 -17.462 4.704 1.773 28 HG2 GLU 4 HG2 GLU 4 -19.300 3.523 3.015 29 HG3 GLU 4 HG3 GLU 4 -18.257 3.468 4.439 30 H LYS 5 H LYS 5 -14.370 2.350 2.050 31 HA LYS 5 HA LYS 5 -14.003 2.479 -0.916 32 HB2 LYS 5 HB2 LYS 5 -12.386 4.061 1.131 33 HB3 LYS 5 HB3 LYS 5 -12.000 3.918 -0.588 34 HG2 LYS 5 HG2 LYS 5 -14.188 4.982 -1.150 35 HG3 LYS 5 HG3 LYS 5 -14.493 5.227 0.582 36 HD2 LYS 5 HD2 LYS 5 -12.381 6.553 0.742 37 HD3 LYS 5 HD3 LYS 5 -12.162 6.401 -1.004 38 HE2 LYS 5 HE2 LYS 5 -14.553 7.703 0.392 39 HE3 LYS 5 HE3 LYS 5 -13.163 8.578 -0.249 40 HZ1 LYS 5 HZ1 LYS 5 -15.085 6.993 -1.891 41 HZ2 LYS 5 HZ2 LYS 5 -14.964 8.611 -1.845 42 HZ3 LYS 5 HZ3 LYS 5 -13.751 7.735 -2.489 43 H THR 6 H THR 6 -12.028 1.542 -1.690 44 HA THR 6 HA THR 6 -11.302 -0.831 -0.182 45 HB THR 6 HB THR 6 -10.382 -1.788 -1.964 46 HG1 THR 6 HG1 THR 6 -9.481 -0.570 -3.713 47 HG21 THR 6 HG21 THR 6 -11.658 -1.398 -3.957 48 HG22 THR 6 HG22 THR 6 -12.738 -1.116 -2.584 49 HG23 THR 6 HG23 THR 6 -12.049 0.266 -3.475 50 H PHE 7 H PHE 7 -9.057 -1.611 0.149 51 HA PHE 7 HA PHE 7 -7.689 0.351 1.742 52 HB2 PHE 7 HB2 PHE 7 -7.814 -1.706 2.702 53 HB3 PHE 7 HB3 PHE 7 -7.298 -2.549 1.254 54 HD1 PHE 7 HD1 PHE 7 -5.726 0.156 3.345 55 HD2 PHE 7 HD2 PHE 7 -5.421 -3.815 1.728 56 HE1 PHE 7 HE1 PHE 7 -3.450 -0.060 4.321 57 HE2 PHE 7 HE2 PHE 7 -3.184 -4.064 2.767 58 HZ PHE 7 HZ PHE 7 -2.163 -2.168 4.018 59 H LYS 8 H LYS 8 -7.384 -0.211 -1.579 60 HA LYS 8 HA LYS 8 -4.643 0.487 -2.065 61 HB2 LYS 8 HB2 LYS 8 -7.223 1.001 -3.603 62 HB3 LYS 8 HB3 LYS 8 -5.657 1.434 -4.252 63 HG2 LYS 8 HG2 LYS 8 -6.288 -1.405 -3.361 64 HG3 LYS 8 HG3 LYS 8 -6.696 -0.814 -4.965 65 HD2 LYS 8 HD2 LYS 8 -3.858 -0.906 -3.844 66 HD3 LYS 8 HD3 LYS 8 -4.595 -2.091 -4.934 67 HE2 LYS 8 HE2 LYS 8 -5.050 -0.124 -6.546 68 HE3 LYS 8 HE3 LYS 8 -3.969 0.838 -5.531 69 HZ1 LYS 8 HZ1 LYS 8 -2.760 -0.172 -7.383 70 HZ2 LYS 8 HZ2 LYS 8 -2.206 -0.847 -6.000 71 HZ3 LYS 8 HZ3 LYS 8 -3.235 -1.674 -6.973 72 H GLN 9 H GLN 9 -7.383 2.591 -1.252 73 HA GLN 9 HA GLN 9 -6.045 5.034 -1.958 74 HB2 GLN 9 HB2 GLN 9 -7.924 6.141 -1.181 75 HB3 GLN 9 HB3 GLN 9 -8.529 4.601 -1.728 76 HG2 GLN 9 HG2 GLN 9 -9.715 4.765 0.182 77 HG3 GLN 9 HG3 GLN 9 -8.334 3.909 0.842 78 HE21 GLN 9 HE21 GLN 9 -9.173 6.754 3.125 79 HE22 GLN 9 HE22 GLN 9 -9.992 5.300 2.578 80 H ARG 10 H ARG 10 -6.051 3.133 1.041 81 HA ARG 10 HA ARG 10 -4.609 5.179 2.596 82 HB2 ARG 10 HB2 ARG 10 -6.211 3.585 3.645 83 HB3 ARG 10 HB3 ARG 10 -5.171 2.252 3.159 84 HG2 ARG 10 HG2 ARG 10 -4.752 2.575 5.456 85 HG3 ARG 10 HG3 ARG 10 -3.341 3.229 4.633 86 HD2 ARG 10 HD2 ARG 10 -4.240 5.527 4.930 87 HD3 ARG 10 HD3 ARG 10 -5.647 4.833 5.772 88 HE ARG 10 HE ARG 10 -3.104 3.969 6.945 89 HH11 ARG 10 HH11 ARG 10 -3.320 6.028 9.685 90 HH12 ARG 10 HH12 ARG 10 -2.431 4.741 8.919 91 HH21 ARG 10 HH21 ARG 10 -5.385 6.656 7.012 92 HH22 ARG 10 HH22 ARG 10 -4.890 7.145 8.604 93 H ARG 11 H ARG 11 -3.718 2.050 1.045 94 HA ARG 11 HA ARG 11 -0.869 2.984 0.999 95 HB2 ARG 11 HB2 ARG 11 -1.786 0.204 1.856 96 HB3 ARG 11 HB3 ARG 11 -0.108 0.687 1.626 97 HG2 ARG 11 HG2 ARG 11 -2.003 1.819 3.707 98 HG3 ARG 11 HG3 ARG 11 -0.790 0.600 4.015 99 HD2 ARG 11 HD2 ARG 11 1.007 2.083 3.812 100 HD3 ARG 11 HD3 ARG 11 0.102 3.211 2.807 101 HE ARG 11 HE ARG 11 -0.700 2.891 5.667 102 HH11 ARG 11 HH11 ARG 11 0.508 6.434 4.288 103 HH12 ARG 11 HH12 ARG 11 0.525 5.103 3.168 104 HH21 ARG 11 HH21 ARG 11 -0.716 4.597 6.922 105 HH22 ARG 11 HH22 ARG 11 -0.192 6.180 6.365 106 H THR 12 H THR 12 -0.061 3.061 -0.881 107 HA THR 12 HA THR 12 -0.894 1.363 -3.174 108 HB THR 12 HB THR 12 0.961 2.746 -4.276 109 HG1 THR 12 HG1 THR 12 1.627 4.597 -3.128 110 HG21 THR 12 HG21 THR 12 -1.450 3.355 -4.465 111 HG22 THR 12 HG22 THR 12 -1.303 4.336 -2.989 112 HG23 THR 12 HG23 THR 12 -0.396 4.780 -4.454 113 H PHE 13 H PHE 13 1.045 0.354 -4.407 114 HA PHE 13 HA PHE 13 1.885 -1.751 -2.947 115 HB2 PHE 13 HB2 PHE 13 1.767 -2.035 -5.207 116 HB3 PHE 13 HB3 PHE 13 2.887 -0.723 -5.542 117 HD1 PHE 13 HD1 PHE 13 2.636 -4.226 -4.347 118 HD2 PHE 13 HD2 PHE 13 5.296 -1.058 -5.569 119 HE1 PHE 13 HE1 PHE 13 4.508 -5.853 -4.493 120 HE2 PHE 13 HE2 PHE 13 7.165 -2.686 -5.707 121 HZ PHE 13 HZ PHE 13 6.776 -5.085 -5.176 122 H GLU 14 H GLU 14 4.228 0.940 -3.454 123 HA GLU 14 HA GLU 14 6.290 -0.471 -2.027 124 HB2 GLU 14 HB2 GLU 14 7.515 1.596 -2.025 125 HB3 GLU 14 HB3 GLU 14 6.758 1.319 -3.592 126 HG2 GLU 14 HG2 GLU 14 4.930 2.940 -2.935 127 HG3 GLU 14 HG3 GLU 14 5.830 3.275 -1.450 128 H GLN 15 H GLN 15 3.779 1.768 -0.860 129 HA GLN 15 HA GLN 15 4.794 1.917 1.877 130 HB2 GLN 15 HB2 GLN 15 1.978 2.435 0.820 131 HB3 GLN 15 HB3 GLN 15 2.647 2.944 2.376 132 HG2 GLN 15 HG2 GLN 15 4.275 4.412 1.178 133 HG3 GLN 15 HG3 GLN 15 3.554 3.941 -0.364 134 HE21 GLN 15 HE21 GLN 15 1.875 7.094 0.363 135 HE22 GLN 15 HE22 GLN 15 3.431 6.518 -0.212 136 H ARG 16 H ARG 16 2.347 0.036 0.168 137 HA ARG 16 HA ARG 16 1.239 -1.565 2.249 138 HB2 ARG 16 HB2 ARG 16 0.237 -1.329 0.036 139 HB3 ARG 16 HB3 ARG 16 1.696 -1.887 -0.737 140 HG2 ARG 16 HG2 ARG 16 0.271 -3.626 -1.009 141 HG3 ARG 16 HG3 ARG 16 1.334 -4.174 0.274 142 HD2 ARG 16 HD2 ARG 16 -0.892 -4.792 0.922 143 HD3 ARG 16 HD3 ARG 16 -0.443 -3.440 1.944 144 HE ARG 16 HE ARG 16 -2.110 -2.147 0.962 145 HH11 ARG 16 HH11 ARG 16 -1.616 -4.891 -1.200 146 HH12 ARG 16 HH12 ARG 16 -3.091 -4.574 -2.065 147 HH21 ARG 16 HH21 ARG 16 -3.818 -1.666 -0.339 148 HH22 ARG 16 HH22 ARG 16 -4.290 -2.755 -1.615 149 H VAL 17 H VAL 17 3.992 -2.298 0.054 150 HA VAL 17 HA VAL 17 4.677 -4.839 1.166 151 HB VAL 17 HB VAL 17 6.244 -2.728 -0.358 152 HG11 VAL 17 HG11 VAL 17 7.974 -3.830 0.966 153 HG12 VAL 17 HG12 VAL 17 7.289 -5.434 0.597 154 HG13 VAL 17 HG13 VAL 17 8.041 -4.452 -0.680 155 HG21 VAL 17 HG21 VAL 17 4.485 -4.140 -1.517 156 HG22 VAL 17 HG22 VAL 17 6.117 -4.362 -2.151 157 HG23 VAL 17 HG23 VAL 17 5.409 -5.579 -1.069 158 H GLU 18 H GLU 18 5.970 -1.532 2.022 159 HA GLU 18 HA GLU 18 7.643 -2.479 4.126 160 HB2 GLU 18 HB2 GLU 18 6.313 0.210 3.653 161 HB3 GLU 18 HB3 GLU 18 7.422 -0.109 4.997 162 HG2 GLU 18 HG2 GLU 18 9.196 -0.775 3.436 163 HG3 GLU 18 HG3 GLU 18 8.135 -0.488 2.060 164 H ASP 19 H ASP 19 4.235 -1.330 4.347 165 HA ASP 19 HA ASP 19 3.917 -1.721 7.159 166 HB2 ASP 19 HB2 ASP 19 2.422 -0.349 5.898 167 HB3 ASP 19 HB3 ASP 19 1.941 -1.711 4.884 168 H VAL 20 H VAL 20 2.962 -4.048 4.560 169 HA VAL 20 HA VAL 20 2.297 -6.054 6.506 170 HB VAL 20 HB VAL 20 2.068 -7.648 4.801 171 HG11 VAL 20 HG11 VAL 20 0.436 -6.589 3.367 172 HG12 VAL 20 HG12 VAL 20 0.323 -5.899 4.995 173 HG13 VAL 20 HG13 VAL 20 1.110 -4.983 3.696 174 HG21 VAL 20 HG21 VAL 20 3.487 -5.748 2.911 175 HG22 VAL 20 HG22 VAL 20 4.052 -7.337 3.437 176 HG23 VAL 20 HG23 VAL 20 2.614 -7.204 2.415 177 H ARG 21 H ARG 21 5.412 -5.413 4.857 178 HA ARG 21 HA ARG 21 6.724 -7.770 5.887 179 HB2 ARG 21 HB2 ARG 21 7.592 -6.575 3.984 180 HB3 ARG 21 HB3 ARG 21 7.831 -5.095 4.914 181 HG2 ARG 21 HG2 ARG 21 9.233 -7.575 5.887 182 HG3 ARG 21 HG3 ARG 21 9.808 -6.860 4.381 183 HD2 ARG 21 HD2 ARG 21 10.330 -4.761 5.418 184 HD3 ARG 21 HD3 ARG 21 9.475 -5.187 6.891 185 HE ARG 21 HE ARG 21 11.176 -6.648 7.578 186 HH11 ARG 21 HH11 ARG 21 12.232 -5.131 4.560 187 HH12 ARG 21 HH12 ARG 21 13.895 -5.486 4.929 188 HH21 ARG 21 HH21 ARG 21 13.104 -7.048 7.924 189 HH22 ARG 21 HH22 ARG 21 14.423 -6.610 6.824 190 H LEU 22 H LEU 22 6.691 -4.392 7.154 191 HA LEU 22 HA LEU 22 8.294 -5.012 9.462 192 HB2 LEU 22 HB2 LEU 22 6.326 -2.778 8.828 193 HB3 LEU 22 HB3 LEU 22 7.149 -2.863 10.382 194 HG LEU 22 HG LEU 22 8.682 -2.867 7.770 195 HD11 LEU 22 HD11 LEU 22 7.320 -0.806 7.878 196 HD12 LEU 22 HD12 LEU 22 7.935 -0.474 9.513 197 HD13 LEU 22 HD13 LEU 22 9.035 -0.439 8.116 198 HD21 LEU 22 HD21 LEU 22 10.522 -2.027 9.208 199 HD22 LEU 22 HD22 LEU 22 9.468 -2.162 10.631 200 HD23 LEU 22 HD23 LEU 22 9.966 -3.615 9.735 201 H ILE 23 H ILE 23 4.715 -4.707 9.136 202 HA ILE 23 HA ILE 23 4.291 -5.209 11.893 203 HB ILE 23 HB ILE 23 2.726 -4.118 10.146 204 HG12 ILE 23 HG12 ILE 23 0.665 -4.855 11.395 205 HG13 ILE 23 HG13 ILE 23 1.672 -6.002 12.284 206 HG21 ILE 23 HG21 ILE 23 2.626 -6.185 8.663 207 HG22 ILE 23 HG22 ILE 23 1.629 -6.963 9.902 208 HG23 ILE 23 HG23 ILE 23 1.065 -5.484 9.089 209 HD11 ILE 23 HD11 ILE 23 1.309 -4.016 13.617 210 HD12 ILE 23 HD12 ILE 23 3.007 -4.006 13.138 211 HD13 ILE 23 HD13 ILE 23 1.860 -2.954 12.296 212 H ARG 24 H ARG 24 4.623 -7.538 9.209 213 HA ARG 24 HA ARG 24 3.892 -9.826 10.884 214 HB2 ARG 24 HB2 ARG 24 3.869 -9.603 8.303 215 HB3 ARG 24 HB3 ARG 24 5.594 -9.943 8.342 216 HG2 ARG 24 HG2 ARG 24 3.436 -11.698 9.600 217 HG3 ARG 24 HG3 ARG 24 3.953 -11.889 7.934 218 HD2 ARG 24 HD2 ARG 24 6.153 -12.593 8.577 219 HD3 ARG 24 HD3 ARG 24 5.881 -12.175 10.262 220 HE ARG 24 HE ARG 24 4.124 -13.905 10.400 221 HH11 ARG 24 HH11 ARG 24 6.270 -14.349 7.642 222 HH12 ARG 24 HH12 ARG 24 6.138 -16.076 7.730 223 HH21 ARG 24 HH21 ARG 24 4.287 -16.048 10.632 224 HH22 ARG 24 HH22 ARG 24 4.936 -17.034 9.343 225 H GLU 25 H GLU 25 7.058 -8.425 9.852 226 HA GLU 25 HA GLU 25 8.671 -10.355 11.146 227 HB2 GLU 25 HB2 GLU 25 9.462 -8.812 9.444 228 HB3 GLU 25 HB3 GLU 25 9.250 -7.429 10.537 229 HG2 GLU 25 HG2 GLU 25 10.979 -8.281 12.034 230 HG3 GLU 25 HG3 GLU 25 11.101 -9.783 11.106 231 H GLN 26 H GLN 26 7.354 -7.324 12.536 232 HA GLN 26 HA GLN 26 8.643 -7.723 15.096 233 HB2 GLN 26 HB2 GLN 26 7.276 -5.842 15.880 234 HB3 GLN 26 HB3 GLN 26 8.146 -5.540 14.388 235 HG2 GLN 26 HG2 GLN 26 6.232 -4.696 13.594 236 HG3 GLN 26 HG3 GLN 26 5.762 -6.363 13.344 237 HE21 GLN 26 HE21 GLN 26 2.886 -5.831 15.267 238 HE22 GLN 26 HE22 GLN 26 3.633 -6.640 13.892 239 H HIS 27 H HIS 27 5.942 -9.393 13.827 240 HA HIS 27 HA HIS 27 5.800 -10.879 16.324 241 HB2 HIS 27 HB2 HIS 27 3.352 -10.852 16.621 242 HB3 HIS 27 HB3 HIS 27 4.168 -9.355 17.009 243 HD1 HIS 27 HD1 HIS 27 2.907 -10.254 13.490 244 HD2 HIS 27 HD2 HIS 27 2.031 -7.825 16.812 245 HE1 HIS 27 HE1 HIS 27 0.922 -8.741 12.780 246 HE2 HIS 27 HE2 HIS 27 0.372 -7.280 14.875 247 HA PRO 28 HA PRO 28 5.893 -13.150 12.360 248 HB2 PRO 28 HB2 PRO 28 7.322 -15.137 14.147 249 HB3 PRO 28 HB3 PRO 28 7.677 -14.696 12.445 250 HG2 PRO 28 HG2 PRO 28 9.149 -13.599 14.398 251 HG3 PRO 28 HG3 PRO 28 8.494 -12.531 13.112 252 HD2 PRO 28 HD2 PRO 28 7.370 -13.027 15.887 253 HD3 PRO 28 HD3 PRO 28 7.668 -11.472 15.061 254 H THR 29 H THR 29 4.600 -14.380 15.409 255 HA THR 29 HA THR 29 3.319 -16.701 14.348 256 HB THR 29 HB THR 29 2.210 -16.978 16.342 257 HG1 THR 29 HG1 THR 29 1.838 -15.282 17.793 258 HG21 THR 29 HG21 THR 29 4.628 -15.340 17.239 259 HG22 THR 29 HG22 THR 29 3.813 -16.656 18.104 260 HG23 THR 29 HG23 THR 29 4.722 -17.011 16.627 261 H LYS 30 H LYS 30 2.499 -13.492 13.639 262 HA LYS 30 HA LYS 30 -0.248 -14.350 12.812 263 HB2 LYS 30 HB2 LYS 30 0.924 -11.608 13.295 264 HB3 LYS 30 HB3 LYS 30 -0.613 -11.856 12.445 265 HG2 LYS 30 HG2 LYS 30 -1.590 -12.969 14.341 266 HG3 LYS 30 HG3 LYS 30 -0.073 -12.897 15.259 267 HD2 LYS 30 HD2 LYS 30 -0.198 -10.510 15.446 268 HD3 LYS 30 HD3 LYS 30 -1.512 -10.404 14.246 269 HE2 LYS 30 HE2 LYS 30 -3.020 -11.646 15.751 270 HE3 LYS 30 HE3 LYS 30 -1.714 -11.792 16.955 271 HZ1 LYS 30 HZ1 LYS 30 -1.670 -9.357 17.068 272 HZ2 LYS 30 HZ2 LYS 30 -2.980 -9.270 16.031 273 HZ3 LYS 30 HZ3 LYS 30 -3.099 -9.947 17.534 274 H ILE 31 H ILE 31 -1.107 -13.778 10.893 275 HA ILE 31 HA ILE 31 0.713 -13.601 8.515 276 HB ILE 31 HB ILE 31 -2.045 -14.856 8.827 277 HG12 ILE 31 HG12 ILE 31 -0.507 -16.218 10.080 278 HG13 ILE 31 HG13 ILE 31 -1.019 -17.045 8.625 279 HG21 ILE 31 HG21 ILE 31 -1.637 -15.835 6.615 280 HG22 ILE 31 HG22 ILE 31 -1.701 -14.079 6.546 281 HG23 ILE 31 HG23 ILE 31 -0.122 -14.901 6.459 282 HD11 ILE 31 HD11 ILE 31 1.355 -17.435 9.044 283 HD12 ILE 31 HD12 ILE 31 1.166 -16.524 7.540 284 HD13 ILE 31 HD13 ILE 31 1.693 -15.698 9.023 285 HA PRO 32 HA PRO 32 -1.832 -9.821 7.977 286 HB2 PRO 32 HB2 PRO 32 -0.175 -9.409 5.527 287 HB3 PRO 32 HB3 PRO 32 -0.506 -8.292 6.870 288 HG2 PRO 32 HG2 PRO 32 1.925 -9.514 6.601 289 HG3 PRO 32 HG3 PRO 32 1.188 -9.229 8.213 290 HD2 PRO 32 HD2 PRO 32 1.160 -11.784 6.576 291 HD3 PRO 32 HD3 PRO 32 1.528 -11.552 8.314 292 H VAL 33 H VAL 33 -3.717 -9.674 6.905 293 HA VAL 33 HA VAL 33 -4.176 -11.205 4.390 294 HB VAL 33 HB VAL 33 -6.134 -11.193 6.701 295 HG11 VAL 33 HG11 VAL 33 -7.235 -13.000 5.443 296 HG12 VAL 33 HG12 VAL 33 -7.182 -11.520 4.489 297 HG13 VAL 33 HG13 VAL 33 -6.042 -12.837 4.138 298 HG21 VAL 33 HG21 VAL 33 -5.585 -13.614 6.982 299 HG22 VAL 33 HG22 VAL 33 -4.182 -13.387 5.918 300 HG23 VAL 33 HG23 VAL 33 -4.280 -12.525 7.466 301 H ILE 34 H ILE 34 -5.349 -10.162 2.887 302 HA ILE 34 HA ILE 34 -6.680 -7.561 3.609 303 HB ILE 34 HB ILE 34 -5.579 -8.576 0.970 304 HG12 ILE 34 HG12 ILE 34 -4.911 -6.137 2.700 305 HG13 ILE 34 HG13 ILE 34 -3.964 -7.621 2.619 306 HG21 ILE 34 HG21 ILE 34 -6.406 -6.449 -0.021 307 HG22 ILE 34 HG22 ILE 34 -7.735 -7.447 0.520 308 HG23 ILE 34 HG23 ILE 34 -7.221 -6.050 1.505 309 HD11 ILE 34 HD11 ILE 34 -3.623 -7.231 0.161 310 HD12 ILE 34 HD12 ILE 34 -4.353 -5.622 0.378 311 HD13 ILE 34 HD13 ILE 34 -2.865 -6.043 1.237 312 H ILE 35 H ILE 35 -8.864 -7.338 3.179 313 HA ILE 35 HA ILE 35 -10.283 -9.629 1.943 314 HB ILE 35 HB ILE 35 -10.632 -10.016 4.272 315 HG12 ILE 35 HG12 ILE 35 -13.149 -8.717 3.120 316 HG13 ILE 35 HG13 ILE 35 -12.518 -10.297 2.621 317 HG21 ILE 35 HG21 ILE 35 -11.713 -8.374 5.771 318 HG22 ILE 35 HG22 ILE 35 -10.171 -7.766 5.197 319 HG23 ILE 35 HG23 ILE 35 -11.701 -7.165 4.496 320 HD11 ILE 35 HD11 ILE 35 -12.753 -11.122 4.982 321 HD12 ILE 35 HD12 ILE 35 -13.570 -9.590 5.386 322 HD13 ILE 35 HD13 ILE 35 -14.286 -10.681 4.195 323 H GLU 36 H GLU 36 -11.690 -8.948 0.345 324 HA GLU 36 HA GLU 36 -12.947 -6.295 0.695 325 HB2 GLU 36 HB2 GLU 36 -12.424 -5.503 -1.533 326 HB3 GLU 36 HB3 GLU 36 -10.967 -5.707 -0.565 327 HG2 GLU 36 HG2 GLU 36 -10.467 -7.831 -1.720 328 HG3 GLU 36 HG3 GLU 36 -11.948 -7.671 -2.682 329 H ARG 37 H ARG 37 -14.831 -5.926 -0.409 330 HA ARG 37 HA ARG 37 -16.522 -8.104 -1.142 331 HB2 ARG 37 HB2 ARG 37 -17.323 -5.879 -0.474 332 HB3 ARG 37 HB3 ARG 37 -16.593 -5.142 -1.898 333 HG2 ARG 37 HG2 ARG 37 -18.160 -6.261 -3.375 334 HG3 ARG 37 HG3 ARG 37 -18.742 -7.297 -2.064 335 HD2 ARG 37 HD2 ARG 37 -20.372 -5.599 -2.480 336 HD3 ARG 37 HD3 ARG 37 -19.657 -5.326 -0.885 337 HE ARG 37 HE ARG 37 -18.178 -3.710 -2.636 338 HH11 ARG 37 HH11 ARG 37 -21.560 -3.862 -1.692 339 HH12 ARG 37 HH12 ARG 37 -21.827 -2.178 -2.062 340 HH21 ARG 37 HH21 ARG 37 -18.596 -1.542 -3.063 341 HH22 ARG 37 HH22 ARG 37 -20.184 -0.906 -2.786 342 H TYR 38 H TYR 38 -16.798 -9.260 -2.994 343 HA TYR 38 HA TYR 38 -14.775 -9.359 -4.844 344 HB2 TYR 38 HB2 TYR 38 -15.866 -11.315 -4.547 345 HB3 TYR 38 HB3 TYR 38 -17.455 -10.600 -4.767 346 HD1 TYR 38 HD1 TYR 38 -14.312 -11.259 -6.750 347 HD2 TYR 38 HD2 TYR 38 -18.629 -11.062 -6.728 348 HE1 TYR 38 HE1 TYR 38 -14.357 -11.942 -9.140 349 HE2 TYR 38 HE2 TYR 38 -18.659 -11.725 -9.125 350 HH TYR 38 HH TYR 38 -15.660 -12.402 -10.972 351 H LYS 39 H LYS 39 -14.147 -8.698 -6.767 352 HA LYS 39 HA LYS 39 -14.900 -6.100 -7.501 353 HB2 LYS 39 HB2 LYS 39 -13.330 -8.193 -9.071 354 HB3 LYS 39 HB3 LYS 39 -13.443 -6.489 -9.524 355 HG2 LYS 39 HG2 LYS 39 -12.428 -5.830 -7.360 356 HG3 LYS 39 HG3 LYS 39 -12.276 -7.535 -6.907 357 HD2 LYS 39 HD2 LYS 39 -10.828 -7.934 -8.897 358 HD3 LYS 39 HD3 LYS 39 -10.970 -6.213 -9.332 359 HE2 LYS 39 HE2 LYS 39 -9.947 -5.594 -7.142 360 HE3 LYS 39 HE3 LYS 39 -9.791 -7.304 -6.734 361 HZ1 LYS 39 HZ1 LYS 39 -8.306 -7.564 -8.663 362 HZ2 LYS 39 HZ2 LYS 39 -8.443 -5.974 -9.034 363 HZ3 LYS 39 HZ3 LYS 39 -7.717 -6.431 -7.643 364 H GLY 40 H GLY 40 -15.838 -9.113 -9.148 365 HA2 GLY 40 HA2 GLY 40 -17.040 -7.802 -11.418 366 HA3 GLY 40 HA3 GLY 40 -17.149 -9.506 -11.000 367 H GLU 41 H GLU 41 -18.382 -8.838 -8.315 368 HA GLU 41 HA GLU 41 -21.038 -7.785 -9.075 369 HB2 GLU 41 HB2 GLU 41 -21.166 -10.147 -9.638 370 HB3 GLU 41 HB3 GLU 41 -20.550 -10.595 -8.061 371 HG2 GLU 41 HG2 GLU 41 -22.861 -11.060 -8.096 372 HG3 GLU 41 HG3 GLU 41 -22.615 -9.727 -6.987 373 H LYS 42 H LYS 42 -20.525 -6.047 -7.799 374 HA LYS 42 HA LYS 42 -19.805 -6.310 -4.993 375 HB2 LYS 42 HB2 LYS 42 -20.538 -3.901 -6.704 376 HB3 LYS 42 HB3 LYS 42 -19.956 -3.804 -5.044 377 HG2 LYS 42 HG2 LYS 42 -17.862 -5.041 -5.751 378 HG3 LYS 42 HG3 LYS 42 -18.410 -4.880 -7.429 379 HD2 LYS 42 HD2 LYS 42 -18.425 -2.380 -7.136 380 HD3 LYS 42 HD3 LYS 42 -17.855 -2.591 -5.486 381 HE2 LYS 42 HE2 LYS 42 -15.919 -2.024 -6.723 382 HE3 LYS 42 HE3 LYS 42 -15.773 -3.740 -6.398 383 HZ1 LYS 42 HZ1 LYS 42 -15.272 -3.158 -8.749 384 HZ2 LYS 42 HZ2 LYS 42 -16.559 -4.170 -8.721 385 HZ3 LYS 42 HZ3 LYS 42 -16.764 -2.558 -8.972 386 H GLN 43 H GLN 43 -22.114 -7.714 -5.292 387 HA GLN 43 HA GLN 43 -24.498 -6.126 -4.821 388 HB2 GLN 43 HB2 GLN 43 -24.428 -8.153 -6.157 389 HB3 GLN 43 HB3 GLN 43 -24.004 -9.133 -4.754 390 HG2 GLN 43 HG2 GLN 43 -26.523 -7.423 -4.769 391 HG3 GLN 43 HG3 GLN 43 -26.496 -8.947 -5.642 392 HE21 GLN 43 HE21 GLN 43 -27.892 -9.694 -2.280 393 HE22 GLN 43 HE22 GLN 43 -28.358 -8.651 -3.617 394 H LEU 44 H LEU 44 -22.464 -8.058 -2.605 395 HA LEU 44 HA LEU 44 -24.238 -7.738 -0.349 396 HB2 LEU 44 HB2 LEU 44 -21.306 -8.496 -0.649 397 HB3 LEU 44 HB3 LEU 44 -22.076 -8.406 0.930 398 HG LEU 44 HG LEU 44 -23.008 -10.241 -1.320 399 HD11 LEU 44 HD11 LEU 44 -21.423 -10.811 1.227 400 HD12 LEU 44 HD12 LEU 44 -22.026 -12.030 0.082 401 HD13 LEU 44 HD13 LEU 44 -20.789 -10.867 -0.436 402 HD21 LEU 44 HD21 LEU 44 -23.821 -10.031 1.621 403 HD22 LEU 44 HD22 LEU 44 -24.864 -9.758 0.208 404 HD23 LEU 44 HD23 LEU 44 -24.261 -11.377 0.548 405 HA PRO 45 HA PRO 45 -23.368 -3.731 1.333 406 HB2 PRO 45 HB2 PRO 45 -22.489 -5.158 3.854 407 HB3 PRO 45 HB3 PRO 45 -23.546 -3.716 3.691 408 HG2 PRO 45 HG2 PRO 45 -24.666 -6.140 4.075 409 HG3 PRO 45 HG3 PRO 45 -25.344 -5.051 2.819 410 HD2 PRO 45 HD2 PRO 45 -23.482 -7.404 2.455 411 HD3 PRO 45 HD3 PRO 45 -24.919 -6.936 1.499 412 H VAL 46 H VAL 46 -21.741 -2.217 1.859 413 HA VAL 46 HA VAL 46 -19.122 -2.980 0.897 414 HB VAL 46 HB VAL 46 -20.415 -0.905 0.285 415 HG11 VAL 46 HG11 VAL 46 -20.969 -0.113 2.578 416 HG12 VAL 46 HG12 VAL 46 -19.250 0.209 2.877 417 HG13 VAL 46 HG13 VAL 46 -20.126 1.111 1.625 418 HG21 VAL 46 HG21 VAL 46 -17.546 -0.384 1.138 419 HG22 VAL 46 HG22 VAL 46 -18.027 -1.261 -0.327 420 HG23 VAL 46 HG23 VAL 46 -18.471 0.443 -0.128 421 H LEU 47 H LEU 47 -20.308 -2.642 4.109 422 HA LEU 47 HA LEU 47 -17.843 -1.936 5.423 423 HB2 LEU 47 HB2 LEU 47 -19.956 -1.595 6.524 424 HB3 LEU 47 HB3 LEU 47 -20.411 -3.283 6.316 425 HG LEU 47 HG LEU 47 -18.645 -3.981 7.919 426 HD11 LEU 47 HD11 LEU 47 -17.043 -2.111 7.647 427 HD12 LEU 47 HD12 LEU 47 -18.241 -0.987 8.327 428 HD13 LEU 47 HD13 LEU 47 -17.548 -2.279 9.332 429 HD21 LEU 47 HD21 LEU 47 -20.949 -3.531 8.689 430 HD22 LEU 47 HD22 LEU 47 -19.749 -3.127 9.932 431 HD23 LEU 47 HD23 LEU 47 -20.514 -1.833 8.987 432 H ASP 48 H ASP 48 -16.016 -3.131 5.232 433 HA ASP 48 HA ASP 48 -16.210 -6.069 5.646 434 HB2 ASP 48 HB2 ASP 48 -14.611 -6.480 3.869 435 HB3 ASP 48 HB3 ASP 48 -16.115 -5.745 3.331 436 H LYS 49 H LYS 49 -14.673 -3.338 6.817 437 HA LYS 49 HA LYS 49 -12.887 -2.887 8.075 438 HB2 LYS 49 HB2 LYS 49 -12.910 -5.837 8.777 439 HB3 LYS 49 HB3 LYS 49 -11.888 -4.621 9.544 440 HG2 LYS 49 HG2 LYS 49 -13.960 -3.299 10.115 441 HG3 LYS 49 HG3 LYS 49 -14.936 -4.647 9.516 442 HD2 LYS 49 HD2 LYS 49 -13.768 -6.140 11.208 443 HD3 LYS 49 HD3 LYS 49 -12.978 -4.704 11.865 444 HE2 LYS 49 HE2 LYS 49 -15.983 -5.271 11.780 445 HE3 LYS 49 HE3 LYS 49 -14.933 -5.348 13.196 446 HZ1 LYS 49 HZ1 LYS 49 -15.649 -2.853 11.720 447 HZ2 LYS 49 HZ2 LYS 49 -16.107 -3.259 13.227 448 HZ3 LYS 49 HZ3 LYS 49 -14.543 -2.898 12.925 449 H THR 50 H THR 50 -12.525 -4.726 5.408 450 HA THR 50 HA THR 50 -11.094 -5.052 3.875 451 HB THR 50 HB THR 50 -9.608 -2.541 4.228 452 HG1 THR 50 HG1 THR 50 -12.423 -2.753 3.937 453 HG21 THR 50 HG21 THR 50 -11.263 -3.752 1.971 454 HG22 THR 50 HG22 THR 50 -10.385 -2.216 1.895 455 HG23 THR 50 HG23 THR 50 -9.490 -3.734 2.083 456 H LYS 51 H LYS 51 -9.419 -5.046 6.776 457 HA LYS 51 HA LYS 51 -7.044 -6.439 5.613 458 HB2 LYS 51 HB2 LYS 51 -6.770 -3.947 5.504 459 HB3 LYS 51 HB3 LYS 51 -7.114 -3.841 7.228 460 HG2 LYS 51 HG2 LYS 51 -4.978 -5.150 7.649 461 HG3 LYS 51 HG3 LYS 51 -4.661 -5.046 5.895 462 HD2 LYS 51 HD2 LYS 51 -4.980 -2.510 6.106 463 HD3 LYS 51 HD3 LYS 51 -5.037 -2.735 7.872 464 HE2 LYS 51 HE2 LYS 51 -2.747 -3.847 7.678 465 HE3 LYS 51 HE3 LYS 51 -2.727 -3.371 5.981 466 HZ1 LYS 51 HZ1 LYS 51 -2.821 -1.512 8.335 467 HZ2 LYS 51 HZ2 LYS 51 -1.597 -1.699 7.225 468 HZ3 LYS 51 HZ3 LYS 51 -3.015 -1.009 6.784 469 H PHE 52 H PHE 52 -6.004 -7.761 7.193 470 HA PHE 52 HA PHE 52 -6.739 -7.612 10.034 471 HB2 PHE 52 HB2 PHE 52 -7.391 -10.042 8.339 472 HB3 PHE 52 HB3 PHE 52 -7.306 -10.082 10.084 473 HD1 PHE 52 HD1 PHE 52 -9.582 -9.931 7.475 474 HD2 PHE 52 HD2 PHE 52 -8.750 -8.071 11.266 475 HE1 PHE 52 HE1 PHE 52 -11.975 -9.330 7.724 476 HE2 PHE 52 HE2 PHE 52 -11.145 -7.442 11.489 477 HZ PHE 52 HZ PHE 52 -12.762 -8.100 9.720 478 H LEU 53 H LEU 53 -5.323 -8.774 11.515 479 HA LEU 53 HA LEU 53 -2.904 -9.995 10.213 480 HB2 LEU 53 HB2 LEU 53 -2.941 -8.573 12.873 481 HB3 LEU 53 HB3 LEU 53 -1.540 -9.189 12.016 482 HG LEU 53 HG LEU 53 -3.255 -6.822 11.120 483 HD11 LEU 53 HD11 LEU 53 -2.050 -6.429 13.265 484 HD12 LEU 53 HD12 LEU 53 -0.512 -6.825 12.456 485 HD13 LEU 53 HD13 LEU 53 -1.465 -5.419 11.942 486 HD21 LEU 53 HD21 LEU 53 -1.260 -6.292 9.688 487 HD22 LEU 53 HD22 LEU 53 -0.548 -7.860 10.139 488 HD23 LEU 53 HD23 LEU 53 -2.066 -7.793 9.211 489 H VAL 54 H VAL 54 -3.712 -12.081 10.213 490 HA VAL 54 HA VAL 54 -5.269 -13.037 12.512 491 HB VAL 54 HB VAL 54 -4.639 -14.548 9.982 492 HG11 VAL 54 HG11 VAL 54 -6.941 -14.783 11.988 493 HG12 VAL 54 HG12 VAL 54 -6.690 -15.782 10.542 494 HG13 VAL 54 HG13 VAL 54 -5.554 -15.886 11.889 495 HG21 VAL 54 HG21 VAL 54 -5.765 -12.414 9.373 496 HG22 VAL 54 HG22 VAL 54 -6.838 -13.792 9.162 497 HG23 VAL 54 HG23 VAL 54 -7.026 -12.738 10.583 498 HA PRO 55 HA PRO 55 -1.764 -15.237 14.379 499 HB2 PRO 55 HB2 PRO 55 -3.957 -16.691 15.836 500 HB3 PRO 55 HB3 PRO 55 -2.466 -15.950 16.483 501 HG2 PRO 55 HG2 PRO 55 -4.859 -14.712 16.777 502 HG3 PRO 55 HG3 PRO 55 -3.387 -13.778 16.372 503 HD2 PRO 55 HD2 PRO 55 -5.592 -14.717 14.520 504 HD3 PRO 55 HD3 PRO 55 -4.789 -13.119 14.609 505 H ASP 56 H ASP 56 -0.716 -17.119 13.839 506 HA ASP 56 HA ASP 56 -1.538 -18.559 11.626 507 HB2 ASP 56 HB2 ASP 56 0.363 -20.099 12.123 508 HB3 ASP 56 HB3 ASP 56 0.736 -18.383 12.084 509 H HIS 57 H HIS 57 -2.194 -19.456 14.928 510 HA HIS 57 HA HIS 57 -3.063 -22.175 14.377 511 HB2 HIS 57 HB2 HIS 57 -3.326 -20.322 16.772 512 HB3 HIS 57 HB3 HIS 57 -4.087 -21.902 16.735 513 HD1 HIS 57 HD1 HIS 57 -0.402 -20.696 16.061 514 HD2 HIS 57 HD2 HIS 57 -2.744 -23.652 17.994 515 HE1 HIS 57 HE1 HIS 57 1.240 -22.247 17.290 516 HE2 HIS 57 HE2 HIS 57 -0.185 -24.057 18.447 517 H VAL 58 H VAL 58 -4.669 -19.220 13.688 518 HA VAL 58 HA VAL 58 -7.406 -20.011 14.250 519 HB VAL 58 HB VAL 58 -6.210 -17.962 12.371 520 HG11 VAL 58 HG11 VAL 58 -8.502 -16.962 12.268 521 HG12 VAL 58 HG12 VAL 58 -8.368 -18.499 11.424 522 HG13 VAL 58 HG13 VAL 58 -9.139 -18.434 13.023 523 HG21 VAL 58 HG21 VAL 58 -7.680 -17.723 15.044 524 HG22 VAL 58 HG22 VAL 58 -5.938 -17.481 14.793 525 HG23 VAL 58 HG23 VAL 58 -7.102 -16.364 14.065 526 H ASN 59 H ASN 59 -8.640 -21.442 13.168 527 HA ASN 59 HA ASN 59 -7.796 -22.657 10.626 528 HB2 ASN 59 HB2 ASN 59 -10.247 -22.990 12.407 529 HB3 ASN 59 HB3 ASN 59 -10.021 -23.868 10.896 530 HD21 ASN 59 HD21 ASN 59 -8.829 -26.010 13.709 531 HD22 ASN 59 HD22 ASN 59 -10.338 -25.187 13.364 532 H MET 60 H MET 60 -8.970 -22.541 8.597 533 HA MET 60 HA MET 60 -9.967 -19.966 7.949 534 HB2 MET 60 HB2 MET 60 -10.136 -22.669 6.602 535 HB3 MET 60 HB3 MET 60 -11.064 -21.330 5.942 536 HG2 MET 60 HG2 MET 60 -8.064 -21.501 6.263 537 HG3 MET 60 HG3 MET 60 -9.000 -21.431 4.773 538 HE1 MET 60 HE1 MET 60 -10.825 -19.312 4.541 539 HE2 MET 60 HE2 MET 60 -11.054 -18.735 6.200 540 HE3 MET 60 HE3 MET 60 -10.364 -17.650 4.977 541 H SER 61 H SER 61 -11.877 -22.806 8.938 542 HA SER 61 HA SER 61 -14.473 -21.674 8.668 543 HB2 SER 61 HB2 SER 61 -15.035 -23.336 10.470 544 HB3 SER 61 HB3 SER 61 -14.154 -24.024 9.093 545 HG SER 61 HG SER 61 -13.345 -24.657 11.225 546 H GLU 62 H GLU 62 -12.114 -21.449 11.344 547 HA GLU 62 HA GLU 62 -13.742 -19.818 13.069 548 HB2 GLU 62 HB2 GLU 62 -11.899 -21.162 13.881 549 HB3 GLU 62 HB3 GLU 62 -10.741 -20.233 12.928 550 HG2 GLU 62 HG2 GLU 62 -11.251 -18.203 14.234 551 HG3 GLU 62 HG3 GLU 62 -12.421 -19.117 15.194 552 H LEU 63 H LEU 63 -11.177 -18.885 10.681 553 HA LEU 63 HA LEU 63 -11.435 -16.075 11.074 554 HB2 LEU 63 HB2 LEU 63 -9.565 -17.079 9.814 555 HB3 LEU 63 HB3 LEU 63 -10.677 -17.614 8.555 556 HG LEU 63 HG LEU 63 -11.198 -15.222 8.009 557 HD11 LEU 63 HD11 LEU 63 -10.674 -14.139 10.167 558 HD12 LEU 63 HD12 LEU 63 -8.978 -14.642 10.032 559 HD13 LEU 63 HD13 LEU 63 -9.659 -13.460 8.888 560 HD21 LEU 63 HD21 LEU 63 -9.413 -16.437 6.785 561 HD22 LEU 63 HD22 LEU 63 -9.089 -14.709 6.886 562 HD23 LEU 63 HD23 LEU 63 -8.214 -15.838 7.956 563 H ILE 64 H ILE 64 -13.195 -18.219 8.811 564 HA ILE 64 HA ILE 64 -14.980 -16.286 7.701 565 HB ILE 64 HB ILE 64 -14.982 -19.258 8.094 566 HG12 ILE 64 HG12 ILE 64 -15.327 -17.618 5.595 567 HG13 ILE 64 HG13 ILE 64 -13.751 -18.051 6.283 568 HG21 ILE 64 HG21 ILE 64 -17.423 -17.739 7.059 569 HG22 ILE 64 HG22 ILE 64 -17.183 -19.493 6.939 570 HG23 ILE 64 HG23 ILE 64 -17.363 -18.763 8.519 571 HD11 ILE 64 HD11 ILE 64 -14.276 -19.598 4.508 572 HD12 ILE 64 HD12 ILE 64 -14.268 -20.455 6.060 573 HD13 ILE 64 HD13 ILE 64 -15.808 -20.036 5.276 574 H LYS 65 H LYS 65 -15.285 -18.163 10.754 575 HA LYS 65 HA LYS 65 -17.879 -17.162 11.407 576 HB2 LYS 65 HB2 LYS 65 -16.759 -19.217 12.308 577 HB3 LYS 65 HB3 LYS 65 -15.760 -18.184 13.342 578 HG2 LYS 65 HG2 LYS 65 -17.794 -17.302 14.441 579 HG3 LYS 65 HG3 LYS 65 -18.807 -18.256 13.329 580 HD2 LYS 65 HD2 LYS 65 -17.818 -20.352 14.231 581 HD3 LYS 65 HD3 LYS 65 -16.824 -19.400 15.352 582 HE2 LYS 65 HE2 LYS 65 -18.889 -18.459 16.380 583 HE3 LYS 65 HE3 LYS 65 -19.878 -19.402 15.253 584 HZ1 LYS 65 HZ1 LYS 65 -19.662 -20.523 17.403 585 HZ2 LYS 65 HZ2 LYS 65 -18.953 -21.439 16.252 586 HZ3 LYS 65 HZ3 LYS 65 -18.036 -20.565 17.290 587 H ILE 66 H ILE 66 -14.655 -15.898 12.521 588 HA ILE 66 HA ILE 66 -15.941 -13.726 13.959 589 HB ILE 66 HB ILE 66 -13.885 -14.181 14.774 590 HG12 ILE 66 HG12 ILE 66 -14.382 -11.743 14.668 591 HG13 ILE 66 HG13 ILE 66 -12.716 -12.194 14.917 592 HG21 ILE 66 HG21 ILE 66 -12.664 -15.334 13.122 593 HG22 ILE 66 HG22 ILE 66 -12.599 -13.924 12.040 594 HG23 ILE 66 HG23 ILE 66 -11.699 -13.949 13.579 595 HD11 ILE 66 HD11 ILE 66 -12.662 -10.301 13.497 596 HD12 ILE 66 HD12 ILE 66 -12.268 -11.667 12.451 597 HD13 ILE 66 HD13 ILE 66 -13.880 -10.935 12.406 598 H ILE 67 H ILE 67 -14.740 -13.897 10.593 599 HA ILE 67 HA ILE 67 -15.415 -11.185 9.931 600 HB ILE 67 HB ILE 67 -14.877 -13.703 8.408 601 HG12 ILE 67 HG12 ILE 67 -13.128 -12.466 7.383 602 HG13 ILE 67 HG13 ILE 67 -13.797 -10.918 7.891 603 HG21 ILE 67 HG21 ILE 67 -15.252 -12.528 6.230 604 HG22 ILE 67 HG22 ILE 67 -16.750 -12.899 7.089 605 HG23 ILE 67 HG23 ILE 67 -16.093 -11.245 7.111 606 HD11 ILE 67 HD11 ILE 67 -12.643 -12.915 9.864 607 HD12 ILE 67 HD12 ILE 67 -11.699 -11.643 9.090 608 HD13 ILE 67 HD13 ILE 67 -13.051 -11.212 10.146 609 H ARG 68 H ARG 68 -17.492 -14.139 9.586 610 HA ARG 68 HA ARG 68 -19.829 -12.751 8.699 611 HB2 ARG 68 HB2 ARG 68 -19.370 -15.394 10.122 612 HB3 ARG 68 HB3 ARG 68 -20.992 -14.759 9.950 613 HG2 ARG 68 HG2 ARG 68 -20.504 -14.571 7.403 614 HG3 ARG 68 HG3 ARG 68 -19.127 -15.640 7.723 615 HD2 ARG 68 HD2 ARG 68 -20.612 -17.307 8.734 616 HD3 ARG 68 HD3 ARG 68 -21.991 -16.228 8.654 617 HE ARG 68 HE ARG 68 -20.893 -17.883 6.508 618 HH11 ARG 68 HH11 ARG 68 -22.906 -15.001 6.962 619 HH12 ARG 68 HH12 ARG 68 -24.055 -15.568 5.772 620 HH21 ARG 68 HH21 ARG 68 -22.437 -18.414 4.919 621 HH22 ARG 68 HH22 ARG 68 -23.767 -17.302 4.650 622 H ARG 69 H ARG 69 -18.592 -12.992 11.974 623 HA ARG 69 HA ARG 69 -21.116 -11.929 13.106 624 HB2 ARG 69 HB2 ARG 69 -19.867 -13.828 14.104 625 HB3 ARG 69 HB3 ARG 69 -18.536 -12.728 14.515 626 HG2 ARG 69 HG2 ARG 69 -20.007 -11.440 15.994 627 HG3 ARG 69 HG3 ARG 69 -21.427 -12.340 15.425 628 HD2 ARG 69 HD2 ARG 69 -20.484 -14.429 16.365 629 HD3 ARG 69 HD3 ARG 69 -19.060 -13.532 16.920 630 HE ARG 69 HE ARG 69 -21.634 -12.479 17.875 631 HH11 ARG 69 HH11 ARG 69 -22.067 -12.462 20.048 632 HH12 ARG 69 HH12 ARG 69 -21.121 -13.432 21.134 633 HH21 ARG 69 HH21 ARG 69 -19.085 -14.752 18.700 634 HH22 ARG 69 HH22 ARG 69 -19.465 -14.691 20.401 635 H ARG 70 H ARG 70 -17.777 -10.730 12.652 636 HA ARG 70 HA ARG 70 -18.343 -8.127 13.921 637 HB2 ARG 70 HB2 ARG 70 -16.069 -9.104 12.136 638 HB3 ARG 70 HB3 ARG 70 -16.130 -7.500 12.856 639 HG2 ARG 70 HG2 ARG 70 -16.055 -10.101 14.445 640 HG3 ARG 70 HG3 ARG 70 -14.674 -9.080 14.048 641 HD2 ARG 70 HD2 ARG 70 -15.180 -8.525 16.260 642 HD3 ARG 70 HD3 ARG 70 -15.797 -7.189 15.284 643 HE ARG 70 HE ARG 70 -17.654 -9.389 16.089 644 HH11 ARG 70 HH11 ARG 70 -16.583 -6.148 16.875 645 HH12 ARG 70 HH12 ARG 70 -18.049 -5.769 17.733 646 HH21 ARG 70 HH21 ARG 70 -19.539 -8.808 17.142 647 HH22 ARG 70 HH22 ARG 70 -19.660 -7.253 17.903 648 H LEU 71 H LEU 71 -18.389 -9.318 10.599 649 HA LEU 71 HA LEU 71 -19.378 -6.694 9.594 650 HB2 LEU 71 HB2 LEU 71 -19.116 -9.299 8.062 651 HB3 LEU 71 HB3 LEU 71 -19.338 -7.678 7.411 652 HG LEU 71 HG LEU 71 -16.825 -8.820 8.713 653 HD11 LEU 71 HD11 LEU 71 -17.242 -9.488 6.388 654 HD12 LEU 71 HD12 LEU 71 -17.456 -7.807 5.909 655 HD13 LEU 71 HD13 LEU 71 -15.863 -8.383 6.476 656 HD21 LEU 71 HD21 LEU 71 -17.298 -5.985 7.728 657 HD22 LEU 71 HD22 LEU 71 -17.004 -6.473 9.411 658 HD23 LEU 71 HD23 LEU 71 -15.730 -6.686 8.213 659 H GLN 72 H GLN 72 -21.533 -6.530 8.642 660 HA GLN 72 HA GLN 72 -23.541 -8.043 10.090 661 HB2 GLN 72 HB2 GLN 72 -23.764 -5.819 8.041 662 HB3 GLN 72 HB3 GLN 72 -25.139 -6.551 8.892 663 HG2 GLN 72 HG2 GLN 72 -24.138 -5.928 11.081 664 HG3 GLN 72 HG3 GLN 72 -22.811 -5.115 10.245 665 HE21 GLN 72 HE21 GLN 72 -25.207 -2.448 11.111 666 HE22 GLN 72 HE22 GLN 72 -24.123 -3.534 11.964 667 H LEU 73 H LEU 73 -22.442 -10.011 9.007 668 HA LEU 73 HA LEU 73 -23.945 -10.900 6.572 669 HB2 LEU 73 HB2 LEU 73 -20.993 -11.285 7.184 670 HB3 LEU 73 HB3 LEU 73 -21.847 -12.001 5.819 671 HG LEU 73 HG LEU 73 -21.478 -8.997 6.242 672 HD11 LEU 73 HD11 LEU 73 -19.788 -9.110 4.512 673 HD12 LEU 73 HD12 LEU 73 -19.355 -10.257 5.793 674 HD13 LEU 73 HD13 LEU 73 -20.068 -10.846 4.284 675 HD21 LEU 73 HD21 LEU 73 -23.452 -9.481 4.839 676 HD22 LEU 73 HD22 LEU 73 -22.134 -8.863 3.841 677 HD23 LEU 73 HD23 LEU 73 -22.496 -10.604 3.846 678 H ASN 74 H ASN 74 -25.038 -11.414 8.869 679 HA ASN 74 HA ASN 74 -24.384 -13.599 10.464 680 HB2 ASN 74 HB2 ASN 74 -26.222 -12.041 10.909 681 HB3 ASN 74 HB3 ASN 74 -27.077 -12.561 9.459 682 HD21 ASN 74 HD21 ASN 74 -27.644 -14.625 12.872 683 HD22 ASN 74 HD22 ASN 74 -26.583 -13.226 12.840 684 H ALA 75 H ALA 75 -25.037 -15.833 10.501 685 HA ALA 75 HA ALA 75 -24.347 -17.416 8.382 686 HB1 ALA 75 HB1 ALA 75 -24.640 -18.130 10.732 687 HB2 ALA 75 HB2 ALA 75 -26.409 -17.996 10.553 688 HB3 ALA 75 HB3 ALA 75 -25.506 -19.218 9.629 689 H ASN 76 H ASN 76 -27.639 -16.165 8.925 690 HA ASN 76 HA ASN 76 -29.016 -17.765 6.991 691 HB2 ASN 76 HB2 ASN 76 -30.066 -16.547 8.852 692 HB3 ASN 76 HB3 ASN 76 -29.549 -15.006 8.168 693 HD21 ASN 76 HD21 ASN 76 -32.526 -14.752 6.330 694 HD22 ASN 76 HD22 ASN 76 -31.207 -13.960 7.186 695 H GLN 77 H GLN 77 -27.003 -14.871 6.559 696 HA GLN 77 HA GLN 77 -28.005 -14.250 3.892 697 HB2 GLN 77 HB2 GLN 77 -27.133 -12.504 5.404 698 HB3 GLN 77 HB3 GLN 77 -25.546 -13.277 5.408 699 HG2 GLN 77 HG2 GLN 77 -25.550 -11.351 3.923 700 HG3 GLN 77 HG3 GLN 77 -25.268 -12.816 2.998 701 HE21 GLN 77 HE21 GLN 77 -28.801 -10.733 2.466 702 HE22 GLN 77 HE22 GLN 77 -27.763 -10.347 3.827 703 H ALA 78 H ALA 78 -27.201 -14.838 1.956 704 HA ALA 78 HA ALA 78 -25.506 -17.164 1.676 705 HB1 ALA 78 HB1 ALA 78 -27.361 -16.683 0.139 706 HB2 ALA 78 HB2 ALA 78 -26.584 -15.168 -0.370 707 HB3 ALA 78 HB3 ALA 78 -25.827 -16.732 -0.741 708 H PHE 79 H PHE 79 -23.355 -17.176 1.815 709 HA PHE 79 HA PHE 79 -21.691 -15.043 0.779 710 HB2 PHE 79 HB2 PHE 79 -22.148 -13.862 2.678 711 HB3 PHE 79 HB3 PHE 79 -22.234 -15.276 3.690 712 HD1 PHE 79 HD1 PHE 79 -20.056 -16.528 4.317 713 HD2 PHE 79 HD2 PHE 79 -20.156 -12.564 2.622 714 HE1 PHE 79 HE1 PHE 79 -17.787 -16.088 5.214 715 HE2 PHE 79 HE2 PHE 79 -17.911 -12.104 3.599 716 HZ PHE 79 HZ PHE 79 -16.718 -13.872 4.853 717 H PHE 80 H PHE 80 -19.667 -15.477 0.304 718 HA PHE 80 HA PHE 80 -18.406 -18.031 1.222 719 HB2 PHE 80 HB2 PHE 80 -18.446 -16.946 -1.634 720 HB3 PHE 80 HB3 PHE 80 -17.636 -18.405 -1.079 721 HD1 PHE 80 HD1 PHE 80 -20.924 -16.870 -1.841 722 HD2 PHE 80 HD2 PHE 80 -18.849 -20.480 -0.747 723 HE1 PHE 80 HE1 PHE 80 -22.965 -18.205 -2.367 724 HE2 PHE 80 HE2 PHE 80 -20.874 -21.811 -1.290 725 HZ PHE 80 HZ PHE 80 -22.935 -20.674 -2.096 726 H LEU 81 H LEU 81 -16.403 -17.610 2.023 727 HA LEU 81 HA LEU 81 -15.005 -15.077 1.296 728 HB2 LEU 81 HB2 LEU 81 -15.397 -15.469 3.654 729 HB3 LEU 81 HB3 LEU 81 -14.607 -17.039 3.566 730 HG LEU 81 HG LEU 81 -12.456 -16.114 3.427 731 HD11 LEU 81 HD11 LEU 81 -12.060 -13.602 3.266 732 HD12 LEU 81 HD12 LEU 81 -12.773 -14.249 1.790 733 HD13 LEU 81 HD13 LEU 81 -13.788 -13.379 2.968 734 HD21 LEU 81 HD21 LEU 81 -12.290 -14.618 5.357 735 HD22 LEU 81 HD22 LEU 81 -14.043 -14.314 5.292 736 HD23 LEU 81 HD23 LEU 81 -13.420 -15.936 5.661 737 H LEU 82 H LEU 82 -13.516 -15.137 -0.216 738 HA LEU 82 HA LEU 82 -12.474 -17.738 -1.194 739 HB2 LEU 82 HB2 LEU 82 -12.643 -15.206 -2.810 740 HB3 LEU 82 HB3 LEU 82 -12.615 -16.861 -3.381 741 HG LEU 82 HG LEU 82 -14.995 -15.422 -2.101 742 HD11 LEU 82 HD11 LEU 82 -15.956 -15.512 -4.346 743 HD12 LEU 82 HD12 LEU 82 -14.413 -14.651 -4.390 744 HD13 LEU 82 HD13 LEU 82 -14.510 -16.330 -4.973 745 HD21 LEU 82 HD21 LEU 82 -14.830 -18.188 -3.378 746 HD22 LEU 82 HD22 LEU 82 -15.155 -17.841 -1.649 747 HD23 LEU 82 HD23 LEU 82 -16.318 -17.358 -2.893 748 H VAL 83 H VAL 83 -10.272 -17.976 -1.654 749 HA VAL 83 HA VAL 83 -8.491 -15.640 -1.048 750 HB VAL 83 HB VAL 83 -8.078 -17.462 0.487 751 HG11 VAL 83 HG11 VAL 83 -7.103 -19.581 -0.181 752 HG12 VAL 83 HG12 VAL 83 -8.661 -19.414 -0.996 753 HG13 VAL 83 HG13 VAL 83 -7.157 -19.129 -1.895 754 HG21 VAL 83 HG21 VAL 83 -5.822 -17.022 -1.484 755 HG22 VAL 83 HG22 VAL 83 -6.267 -15.958 -0.128 756 HG23 VAL 83 HG23 VAL 83 -5.665 -17.594 0.190 757 H ASN 84 H ASN 84 -7.369 -14.809 -2.683 758 HA ASN 84 HA ASN 84 -7.084 -14.252 -4.886 759 HB2 ASN 84 HB2 ASN 84 -5.985 -17.087 -4.886 760 HB3 ASN 84 HB3 ASN 84 -5.655 -15.889 -6.137 761 HD21 ASN 84 HD21 ASN 84 -3.032 -15.916 -3.311 762 HD22 ASN 84 HD22 ASN 84 -3.898 -17.280 -4.013 763 H GLY 85 H GLY 85 -9.727 -14.962 -4.364 764 HA2 GLY 85 HA2 GLY 85 -11.678 -15.049 -5.537 765 HA3 GLY 85 HA3 GLY 85 -10.789 -15.378 -7.023 766 H HIS 86 H HIS 86 -9.982 -17.806 -4.726 767 HA HIS 86 HA HIS 86 -12.213 -19.596 -5.664 768 HB2 HIS 86 HB2 HIS 86 -9.342 -20.279 -4.932 769 HB3 HIS 86 HB3 HIS 86 -10.598 -21.474 -5.254 770 HD1 HIS 86 HD1 HIS 86 -7.941 -19.814 -7.088 771 HD2 HIS 86 HD2 HIS 86 -11.991 -20.795 -7.821 772 HE1 HIS 86 HE1 HIS 86 -8.258 -19.745 -9.650 773 HE2 HIS 86 HE2 HIS 86 -10.724 -20.353 -10.081 774 H SER 87 H SER 87 -13.328 -20.912 -4.246 775 HA SER 87 HA SER 87 -13.792 -19.616 -1.730 776 HB2 SER 87 HB2 SER 87 -15.582 -20.591 -3.096 777 HB3 SER 87 HB3 SER 87 -14.942 -22.218 -2.768 778 HG SER 87 HG SER 87 -16.633 -21.650 -1.332 779 H MET 88 H MET 88 -13.620 -20.172 0.336 780 HA MET 88 HA MET 88 -12.184 -22.696 1.114 781 HB2 MET 88 HB2 MET 88 -12.137 -19.959 2.426 782 HB3 MET 88 HB3 MET 88 -11.356 -21.386 3.090 783 HG2 MET 88 HG2 MET 88 -9.803 -21.540 1.270 784 HG3 MET 88 HG3 MET 88 -10.630 -20.275 0.360 785 HE1 MET 88 HE1 MET 88 -10.884 -17.943 0.976 786 HE2 MET 88 HE2 MET 88 -11.177 -17.932 2.716 787 HE3 MET 88 HE3 MET 88 -9.826 -16.999 2.047 788 H VAL 89 H VAL 89 -15.238 -21.706 0.907 789 HA VAL 89 HA VAL 89 -16.195 -21.310 3.478 790 HB VAL 89 HB VAL 89 -17.322 -20.959 1.224 791 HG11 VAL 89 HG11 VAL 89 -18.976 -22.592 0.526 792 HG12 VAL 89 HG12 VAL 89 -17.382 -23.364 0.517 793 HG13 VAL 89 HG13 VAL 89 -18.533 -23.692 1.839 794 HG21 VAL 89 HG21 VAL 89 -19.030 -21.922 3.542 795 HG22 VAL 89 HG22 VAL 89 -18.319 -20.298 3.374 796 HG23 VAL 89 HG23 VAL 89 -19.534 -20.857 2.218 797 H SER 90 H SER 90 -15.542 -24.472 2.134 798 HA SER 90 HA SER 90 -16.763 -25.836 4.474 799 HB2 SER 90 HB2 SER 90 -16.442 -27.861 3.120 800 HB3 SER 90 HB3 SER 90 -17.375 -26.626 2.259 801 HG SER 90 HG SER 90 -15.727 -27.568 0.933 802 H VAL 91 H VAL 91 -13.691 -24.582 3.837 803 HA VAL 91 HA VAL 91 -12.256 -26.999 4.615 804 HB VAL 91 HB VAL 91 -11.627 -25.418 2.691 805 HG11 VAL 91 HG11 VAL 91 -11.264 -23.399 4.194 806 HG12 VAL 91 HG12 VAL 91 -9.839 -24.226 4.847 807 HG13 VAL 91 HG13 VAL 91 -9.910 -23.812 3.123 808 HG21 VAL 91 HG21 VAL 91 -10.460 -27.494 3.241 809 HG22 VAL 91 HG22 VAL 91 -9.316 -26.222 2.799 810 HG23 VAL 91 HG23 VAL 91 -9.522 -26.667 4.506 811 H SER 92 H SER 92 -11.203 -27.540 6.385 812 HA SER 92 HA SER 92 -11.507 -25.878 8.792 813 HB2 SER 92 HB2 SER 92 -10.828 -27.953 9.940 814 HB3 SER 92 HB3 SER 92 -12.177 -28.214 8.826 815 HG SER 92 HG SER 92 -10.540 -29.834 8.605 816 H THR 93 H THR 93 -9.016 -26.237 6.510 817 HA THR 93 HA THR 93 -6.803 -26.656 8.089 818 HB THR 93 HB THR 93 -7.038 -26.788 5.570 819 HG1 THR 93 HG1 THR 93 -4.840 -26.820 5.439 820 HG21 THR 93 HG21 THR 93 -5.716 -24.042 5.704 821 HG22 THR 93 HG22 THR 93 -6.073 -25.011 4.260 822 HG23 THR 93 HG23 THR 93 -7.401 -24.297 5.193 823 HA PRO 94 HA PRO 94 -5.684 -22.928 10.249 824 HB2 PRO 94 HB2 PRO 94 -2.838 -23.726 9.673 825 HB3 PRO 94 HB3 PRO 94 -3.576 -23.205 11.219 826 HG2 PRO 94 HG2 PRO 94 -3.096 -25.825 10.757 827 HG3 PRO 94 HG3 PRO 94 -4.663 -25.323 11.492 828 HD2 PRO 94 HD2 PRO 94 -4.061 -25.979 8.592 829 HD3 PRO 94 HD3 PRO 94 -5.410 -26.547 9.620 830 H ILE 95 H ILE 95 -5.098 -20.796 9.830 831 HA ILE 95 HA ILE 95 -5.021 -19.903 7.161 832 HB ILE 95 HB ILE 95 -5.836 -18.614 9.126 833 HG12 ILE 95 HG12 ILE 95 -4.980 -16.378 8.509 834 HG13 ILE 95 HG13 ILE 95 -3.710 -17.104 7.524 835 HG21 ILE 95 HG21 ILE 95 -4.275 -17.360 10.545 836 HG22 ILE 95 HG22 ILE 95 -4.007 -19.085 10.725 837 HG23 ILE 95 HG23 ILE 95 -2.887 -18.105 9.741 838 HD11 ILE 95 HD11 ILE 95 -6.703 -17.529 7.085 839 HD12 ILE 95 HD12 ILE 95 -5.731 -16.299 6.256 840 HD13 ILE 95 HD13 ILE 95 -5.389 -18.018 5.987 841 H SER 96 H SER 96 -2.287 -20.818 9.191 842 HA SER 96 HA SER 96 -0.176 -19.628 7.652 843 HB2 SER 96 HB2 SER 96 1.216 -21.361 8.786 844 HB3 SER 96 HB3 SER 96 0.222 -20.384 9.886 845 HG SER 96 HG SER 96 0.137 -22.693 10.312 846 H GLU 97 H GLU 97 -1.918 -22.751 7.324 847 HA GLU 97 HA GLU 97 -0.210 -23.784 5.205 848 HB2 GLU 97 HB2 GLU 97 -3.088 -24.463 5.926 849 HB3 GLU 97 HB3 GLU 97 -2.071 -25.385 4.835 850 HG2 GLU 97 HG2 GLU 97 -1.554 -24.968 7.818 851 HG3 GLU 97 HG3 GLU 97 -2.262 -26.398 7.085 852 H VAL 98 H VAL 98 -3.303 -21.976 5.254 853 HA VAL 98 HA VAL 98 -3.560 -21.707 2.410 854 HB VAL 98 HB VAL 98 -4.435 -19.609 4.411 855 HG11 VAL 98 HG11 VAL 98 -4.590 -18.948 2.022 856 HG12 VAL 98 HG12 VAL 98 -5.532 -20.413 1.680 857 HG13 VAL 98 HG13 VAL 98 -6.188 -19.151 2.743 858 HG21 VAL 98 HG21 VAL 98 -6.638 -20.782 4.368 859 HG22 VAL 98 HG22 VAL 98 -5.869 -22.158 3.563 860 HG23 VAL 98 HG23 VAL 98 -5.386 -21.688 5.212 861 H TYR 99 H TYR 99 -1.860 -19.622 4.794 862 HA TYR 99 HA TYR 99 -0.792 -17.781 2.993 863 HB2 TYR 99 HB2 TYR 99 -0.589 -17.082 5.080 864 HB3 TYR 99 HB3 TYR 99 -0.041 -18.622 5.704 865 HD1 TYR 99 HD1 TYR 99 2.255 -19.186 5.900 866 HD2 TYR 99 HD2 TYR 99 1.066 -15.614 3.790 867 HE1 TYR 99 HE1 TYR 99 4.624 -18.459 5.812 868 HE2 TYR 99 HE2 TYR 99 3.462 -14.900 3.682 869 HH TYR 99 HH TYR 99 6.120 -16.919 4.942 870 H GLU 100 H GLU 100 1.007 -20.777 3.896 871 HA GLU 100 HA GLU 100 3.050 -20.142 2.000 872 HB2 GLU 100 HB2 GLU 100 2.207 -22.781 3.233 873 HB3 GLU 100 HB3 GLU 100 3.595 -22.644 2.158 874 HG2 GLU 100 HG2 GLU 100 3.289 -21.129 4.780 875 HG3 GLU 100 HG3 GLU 100 4.183 -22.624 4.569 876 H SER 101 H SER 101 -0.058 -21.692 1.474 877 HA SER 101 HA SER 101 0.605 -22.648 -1.209 878 HB2 SER 101 HB2 SER 101 -0.986 -23.777 0.300 879 HB3 SER 101 HB3 SER 101 -2.054 -22.360 0.227 880 HG SER 101 HG SER 101 -2.596 -24.100 -1.268 881 H GLU 102 H GLU 102 -1.034 -19.750 0.077 882 HA GLU 102 HA GLU 102 -1.559 -18.750 -2.710 883 HB2 GLU 102 HB2 GLU 102 -3.206 -18.520 -0.172 884 HB3 GLU 102 HB3 GLU 102 -3.616 -17.755 -1.679 885 HG2 GLU 102 HG2 GLU 102 -3.407 -20.768 -1.292 886 HG3 GLU 102 HG3 GLU 102 -4.881 -19.829 -1.200 887 H LYS 103 H LYS 103 0.516 -17.888 -0.265 888 HA LYS 103 HA LYS 103 -0.002 -15.128 -0.055 889 HB2 LYS 103 HB2 LYS 103 2.299 -14.824 0.647 890 HB3 LYS 103 HB3 LYS 103 1.567 -16.209 1.434 891 HG2 LYS 103 HG2 LYS 103 2.779 -17.724 -0.196 892 HG3 LYS 103 HG3 LYS 103 3.521 -16.282 -0.918 893 HD2 LYS 103 HD2 LYS 103 4.424 -15.689 1.367 894 HD3 LYS 103 HD3 LYS 103 3.866 -17.272 1.942 895 HE2 LYS 103 HE2 LYS 103 5.827 -16.827 -0.360 896 HE3 LYS 103 HE3 LYS 103 6.315 -17.144 1.308 897 HZ1 LYS 103 HZ1 LYS 103 5.335 -19.333 1.199 898 HZ2 LYS 103 HZ2 LYS 103 4.695 -19.060 -0.306 899 HZ3 LYS 103 HZ3 LYS 103 6.309 -19.160 -0.085 900 H ASP 104 H ASP 104 0.556 -13.338 -1.052 901 HA ASP 104 HA ASP 104 2.362 -13.313 -3.364 902 HB2 ASP 104 HB2 ASP 104 -0.525 -12.503 -3.426 903 HB3 ASP 104 HB3 ASP 104 0.649 -11.646 -4.428 904 H GLU 105 H GLU 105 3.528 -11.484 -3.794 905 HA GLU 105 HA GLU 105 4.423 -10.186 -1.475 906 HB2 GLU 105 HB2 GLU 105 4.880 -9.452 -4.404 907 HB3 GLU 105 HB3 GLU 105 5.752 -8.781 -3.040 908 HG2 GLU 105 HG2 GLU 105 7.208 -10.389 -3.741 909 HG3 GLU 105 HG3 GLU 105 6.406 -11.169 -2.384 910 H ASP 106 H ASP 106 1.881 -9.060 -3.607 911 HA ASP 106 HA ASP 106 2.016 -6.313 -2.648 912 HB2 ASP 106 HB2 ASP 106 -0.076 -5.962 -3.974 913 HB3 ASP 106 HB3 ASP 106 1.407 -6.356 -4.821 914 H GLY 107 H GLY 107 0.900 -8.996 -1.036 915 HA2 GLY 107 HA2 GLY 107 -0.127 -7.338 1.050 916 HA3 GLY 107 HA3 GLY 107 -1.498 -7.951 0.118 917 H PHE 108 H PHE 108 1.178 -10.181 0.489 918 HA PHE 108 HA PHE 108 1.241 -12.165 1.451 919 HB2 PHE 108 HB2 PHE 108 0.144 -10.753 3.808 920 HB3 PHE 108 HB3 PHE 108 0.276 -12.495 3.809 921 HD1 PHE 108 HD1 PHE 108 2.085 -13.320 4.950 922 HD2 PHE 108 HD2 PHE 108 2.540 -9.631 2.760 923 HE1 PHE 108 HE1 PHE 108 4.457 -13.188 5.652 924 HE2 PHE 108 HE2 PHE 108 4.921 -9.512 3.470 925 HZ PHE 108 HZ PHE 108 5.872 -11.280 4.927 926 H LEU 109 H LEU 109 -1.835 -12.216 3.107 927 HA LEU 109 HA LEU 109 -2.810 -13.999 0.912 928 HB2 LEU 109 HB2 LEU 109 -3.556 -13.643 3.820 929 HB3 LEU 109 HB3 LEU 109 -4.661 -14.423 2.690 930 HG LEU 109 HG LEU 109 -1.847 -15.394 3.342 931 HD11 LEU 109 HD11 LEU 109 -4.603 -16.567 3.929 932 HD12 LEU 109 HD12 LEU 109 -3.035 -17.237 4.435 933 HD13 LEU 109 HD13 LEU 109 -3.588 -15.703 5.115 934 HD21 LEU 109 HD21 LEU 109 -2.282 -16.055 1.064 935 HD22 LEU 109 HD22 LEU 109 -2.716 -17.450 2.042 936 HD23 LEU 109 HD23 LEU 109 -3.992 -16.397 1.418 937 H TYR 110 H TYR 110 -3.701 -12.889 -0.680 938 HA TYR 110 HA TYR 110 -5.644 -10.753 -0.154 939 HB2 TYR 110 HB2 TYR 110 -4.226 -11.752 -2.514 940 HB3 TYR 110 HB3 TYR 110 -5.926 -11.491 -2.822 941 HD1 TYR 110 HD1 TYR 110 -6.988 -9.300 -2.510 942 HD2 TYR 110 HD2 TYR 110 -2.712 -9.820 -2.132 943 HE1 TYR 110 HE1 TYR 110 -6.668 -6.875 -2.911 944 HE2 TYR 110 HE2 TYR 110 -2.400 -7.378 -2.544 945 HH TYR 110 HH TYR 110 -5.114 -5.252 -3.472 946 H MET 111 H MET 111 -7.568 -11.214 0.670 947 HA MET 111 HA MET 111 -9.057 -13.509 -0.492 948 HB2 MET 111 HB2 MET 111 -9.540 -12.211 2.220 949 HB3 MET 111 HB3 MET 111 -10.430 -13.552 1.504 950 HG2 MET 111 HG2 MET 111 -8.282 -14.881 1.475 951 HG3 MET 111 HG3 MET 111 -7.549 -13.587 2.436 952 HE1 MET 111 HE1 MET 111 -7.633 -16.685 3.186 953 HE2 MET 111 HE2 MET 111 -6.810 -15.424 4.135 954 HE3 MET 111 HE3 MET 111 -7.928 -16.555 4.932 955 H VAL 112 H VAL 112 -11.138 -13.243 -1.208 956 HA VAL 112 HA VAL 112 -12.341 -10.573 -0.965 957 HB VAL 112 HB VAL 112 -13.049 -10.277 -3.134 958 HG11 VAL 112 HG11 VAL 112 -11.089 -10.269 -4.544 959 HG12 VAL 112 HG12 VAL 112 -10.569 -9.899 -2.894 960 HG13 VAL 112 HG13 VAL 112 -10.296 -11.520 -3.565 961 HG21 VAL 112 HG21 VAL 112 -12.785 -11.932 -4.962 962 HG22 VAL 112 HG22 VAL 112 -12.211 -13.124 -3.783 963 HG23 VAL 112 HG23 VAL 112 -13.877 -12.496 -3.691 964 H TYR 113 H TYR 113 -14.721 -10.561 -0.893 965 HA TYR 113 HA TYR 113 -15.807 -13.333 -0.453 966 HB2 TYR 113 HB2 TYR 113 -17.123 -12.637 1.365 967 HB3 TYR 113 HB3 TYR 113 -15.474 -12.157 1.712 968 HD1 TYR 113 HD1 TYR 113 -18.899 -11.024 1.160 969 HD2 TYR 113 HD2 TYR 113 -14.803 -9.734 1.516 970 HE1 TYR 113 HE1 TYR 113 -19.672 -8.688 1.540 971 HE2 TYR 113 HE2 TYR 113 -15.581 -7.401 1.878 972 HH TYR 113 HH TYR 113 -19.034 -6.459 1.871 973 H ALA 114 H ALA 114 -17.935 -13.684 -0.935 974 HA ALA 114 HA ALA 114 -19.343 -11.801 -2.791 975 HB1 ALA 114 HB1 ALA 114 -19.128 -13.532 -4.559 976 HB2 ALA 114 HB2 ALA 114 -17.539 -12.965 -4.043 977 HB3 ALA 114 HB3 ALA 114 -18.141 -14.526 -3.468 978 H SER 115 H SER 115 -21.496 -12.434 -3.276 979 HA SER 115 HA SER 115 -22.761 -14.345 -1.429 980 HB2 SER 115 HB2 SER 115 -24.871 -13.506 -2.610 981 HB3 SER 115 HB3 SER 115 -23.960 -12.379 -1.599 982 HG SER 115 HG SER 115 -24.425 -11.329 -3.474 983 H GLN 116 H GLN 116 -21.038 -14.845 -4.082 984 HA GLN 116 HA GLN 116 -22.274 -17.420 -4.723 985 HB2 GLN 116 HB2 GLN 116 -22.170 -17.018 -7.138 986 HB3 GLN 116 HB3 GLN 116 -23.366 -16.013 -6.355 987 HG2 GLN 116 HG2 GLN 116 -20.633 -15.076 -7.342 988 HG3 GLN 116 HG3 GLN 116 -22.170 -14.854 -8.167 989 HE21 GLN 116 HE21 GLN 116 -23.229 -12.526 -5.413 990 HE22 GLN 116 HE22 GLN 116 -23.942 -13.786 -6.413 991 H GLU 117 H GLU 117 -20.686 -18.970 -5.368 992 HA GLU 117 HA GLU 117 -17.967 -18.296 -4.655 993 HB2 GLU 117 HB2 GLU 117 -17.488 -20.560 -4.899 994 HB3 GLU 117 HB3 GLU 117 -19.095 -20.497 -4.207 995 HG2 GLU 117 HG2 GLU 117 -18.409 -21.066 -7.135 996 HG3 GLU 117 HG3 GLU 117 -18.729 -22.275 -5.915 997 H THR 118 H THR 118 -19.656 -18.157 -7.648 998 HA THR 118 HA THR 118 -17.384 -17.115 -9.037 999 HB THR 118 HB THR 118 -17.047 -19.579 -9.368 1000 HG1 THR 118 HG1 THR 118 -16.543 -19.253 -11.524 1001 HG21 THR 118 HG21 THR 118 -19.451 -19.345 -11.245 1002 HG22 THR 118 HG22 THR 118 -18.397 -20.756 -11.011 1003 HG23 THR 118 HG23 THR 118 -19.460 -20.229 -9.700 1004 H PHE 119 H PHE 119 -17.985 -16.233 -11.209 1005 HA PHE 119 HA PHE 119 -20.839 -15.671 -11.552 1006 HB2 PHE 119 HB2 PHE 119 -20.392 -14.185 -9.771 1007 HB3 PHE 119 HB3 PHE 119 -18.913 -13.624 -10.522 1008 HD1 PHE 119 HD1 PHE 119 -22.599 -13.483 -10.646 1009 HD2 PHE 119 HD2 PHE 119 -18.917 -11.860 -12.194 1010 HE1 PHE 119 HE1 PHE 119 -23.857 -11.582 -11.652 1011 HE2 PHE 119 HE2 PHE 119 -20.174 -9.960 -13.197 1012 HZ PHE 119 HZ PHE 119 -22.644 -9.823 -12.927 1013 H GLY 120 H GLY 120 -21.503 -14.621 -13.430 1014 HA2 GLY 120 HA2 GLY 120 -19.815 -15.295 -15.743 1015 HA3 GLY 120 HA3 GLY 120 -21.518 -14.876 -15.756 1016 H1 ASP 10 H1 ASP 10 -11.020 -1.174 21.236 1017 H2 ASP 10 H2 ASP 10 -11.556 -1.067 19.697 1018 H3 ASP 10 H3 ASP 10 -10.098 -1.766 20.015 1019 HA ASP 10 HA ASP 10 -10.858 1.041 20.459 1020 HB2 ASP 10 HB2 ASP 10 -8.238 -0.264 21.135 1021 HB3 ASP 10 HB3 ASP 10 -8.412 1.478 20.896 1022 H TYR 11 H TYR 11 -7.846 0.140 18.863 1023 HA TYR 11 HA TYR 11 -8.346 2.112 16.894 1024 HB2 TYR 11 HB2 TYR 11 -6.116 1.133 15.922 1025 HB3 TYR 11 HB3 TYR 11 -6.183 2.082 17.395 1026 HD1 TYR 11 HD1 TYR 11 -6.331 -1.539 16.279 1027 HD2 TYR 11 HD2 TYR 11 -5.171 1.296 19.338 1028 HE1 TYR 11 HE1 TYR 11 -5.651 -3.403 17.808 1029 HE2 TYR 11 HE2 TYR 11 -4.321 -0.564 20.751 1030 HH TYR 11 HH TYR 11 -4.131 -2.851 20.990 1031 H GLU 12 H GLU 12 -8.767 -1.348 16.575 1032 HA GLU 12 HA GLU 12 -8.971 -2.710 14.776 1033 HB2 GLU 12 HB2 GLU 12 -10.894 -2.318 13.334 1034 HB3 GLU 12 HB3 GLU 12 -11.182 -2.330 15.070 1035 HG2 GLU 12 HG2 GLU 12 -11.398 0.110 15.120 1036 HG3 GLU 12 HG3 GLU 12 -11.029 0.204 13.387 1037 H SER 13 H SER 13 -9.816 -0.569 12.208 1038 HA SER 13 HA SER 13 -7.505 -1.508 10.683 1039 HB2 SER 13 HB2 SER 13 -9.770 -1.181 9.689 1040 HB3 SER 13 HB3 SER 13 -9.586 0.563 9.986 1041 HG SER 13 HG SER 13 -8.113 -1.078 8.194 1042 H ASP 14 H ASP 14 -5.536 -0.635 10.730 1043 HA ASP 14 HA ASP 14 -5.084 2.244 10.566 1044 HB2 ASP 14 HB2 ASP 14 -5.542 1.528 13.085 1045 HB3 ASP 14 HB3 ASP 14 -3.983 0.741 12.983 1046 H ASP 15 H ASP 15 -2.543 2.323 11.158 1047 HA ASP 15 HA ASP 15 -1.032 -0.007 10.311 1048 HB2 ASP 15 HB2 ASP 15 0.505 1.424 8.839 1049 HB3 ASP 15 HB3 ASP 15 -0.980 0.722 8.214 1050 H ASP 16 H ASP 16 1.159 -0.134 10.898 1051 HA ASP 16 HA ASP 16 2.646 -0.261 12.522 1052 HB2 ASP 16 HB2 ASP 16 3.675 1.568 11.704 1053 HB3 ASP 16 HB3 ASP 16 2.464 2.686 12.314 1054 H SER 17 H SER 17 2.340 -1.450 14.198 1055 HA SER 17 HA SER 17 1.659 -2.295 16.170 1056 HB2 SER 17 HB2 SER 17 3.323 -0.614 16.831 1057 HB3 SER 17 HB3 SER 17 2.018 0.539 17.151 1058 HG SER 17 HG SER 17 2.678 -0.619 19.047 1059 H TYR 18 H TYR 18 -0.441 -2.887 15.416 1060 HA TYR 18 HA TYR 18 -2.725 -1.836 16.925 1061 HB2 TYR 18 HB2 TYR 18 -3.955 -1.047 14.996 1062 HB3 TYR 18 HB3 TYR 18 -2.415 -0.225 14.953 1063 HD1 TYR 18 HD1 TYR 18 -0.578 -1.128 13.404 1064 HD2 TYR 18 HD2 TYR 18 -4.686 -2.382 13.179 1065 HE1 TYR 18 HE1 TYR 18 -0.105 -2.206 11.208 1066 HE2 TYR 18 HE2 TYR 18 -4.200 -3.415 10.920 1067 HH TYR 18 HH TYR 18 -0.955 -3.415 9.482 1068 H GLU 19 H GLU 19 -4.769 -3.007 15.911 1069 HA GLU 19 HA GLU 19 -4.300 -5.499 14.464 1070 HB2 GLU 19 HB2 GLU 19 -3.941 -6.297 16.739 1071 HB3 GLU 19 HB3 GLU 19 -5.417 -5.525 17.302 1072 HG2 GLU 19 HG2 GLU 19 -5.701 -7.958 16.991 1073 HG3 GLU 19 HG3 GLU 19 -6.809 -7.019 15.999 1074 H VAL 20 H VAL 20 -5.934 -5.743 13.003 1075 HA VAL 20 HA VAL 20 -8.262 -3.985 13.165 1076 HB VAL 20 HB VAL 20 -7.928 -5.976 10.989 1077 HG11 VAL 20 HG11 VAL 20 -9.292 -3.273 11.257 1078 HG12 VAL 20 HG12 VAL 20 -9.013 -4.044 9.685 1079 HG13 VAL 20 HG13 VAL 20 -10.014 -4.847 10.882 1080 HG21 VAL 20 HG21 VAL 20 -6.448 -3.368 11.259 1081 HG22 VAL 20 HG22 VAL 20 -5.790 -4.997 10.936 1082 HG23 VAL 20 HG23 VAL 20 -6.725 -4.164 9.696 1083 H LEU 21 H LEU 21 -7.680 -7.326 13.850 1084 HA LEU 21 HA LEU 21 -10.468 -8.219 13.813 1085 HB2 LEU 21 HB2 LEU 21 -7.988 -9.156 15.307 1086 HB3 LEU 21 HB3 LEU 21 -9.520 -10.033 15.282 1087 HG LEU 21 HG LEU 21 -7.926 -9.504 12.751 1088 HD11 LEU 21 HD11 LEU 21 -6.530 -10.805 14.269 1089 HD12 LEU 21 HD12 LEU 21 -7.877 -11.935 14.578 1090 HD13 LEU 21 HD13 LEU 21 -7.148 -11.826 12.959 1091 HD21 LEU 21 HD21 LEU 21 -10.338 -10.115 12.452 1092 HD22 LEU 21 HD22 LEU 21 -9.244 -11.362 11.849 1093 HD23 LEU 21 HD23 LEU 21 -10.055 -11.582 13.415 1094 H ASP 22 H ASP 22 -8.711 -6.073 15.798 1095 HA ASP 22 HA ASP 22 -8.704 -5.321 17.872 1096 HB2 ASP 22 HB2 ASP 22 -10.777 -4.347 16.843 1097 HB3 ASP 22 HB3 ASP 22 -11.729 -5.606 17.632 1098 H LEU 23 H LEU 23 -8.241 -8.062 17.706 1099 HA LEU 23 HA LEU 23 -9.722 -9.507 19.799 1100 HB2 LEU 23 HB2 LEU 23 -9.522 -10.372 17.501 1101 HB3 LEU 23 HB3 LEU 23 -7.764 -10.376 17.635 1102 HG LEU 23 HG LEU 23 -7.940 -12.178 19.370 1103 HD11 LEU 23 HD11 LEU 23 -10.273 -11.751 20.172 1104 HD12 LEU 23 HD12 LEU 23 -10.889 -12.199 18.568 1105 HD13 LEU 23 HD13 LEU 23 -10.073 -13.407 19.580 1106 HD21 LEU 23 HD21 LEU 23 -8.542 -13.957 17.768 1107 HD22 LEU 23 HD22 LEU 23 -9.329 -12.771 16.710 1108 HD23 LEU 23 HD23 LEU 23 -7.570 -12.708 16.977 1109 H THR 24 H THR 24 -8.616 -10.781 21.443 1110 HA THR 24 HA THR 24 -6.697 -9.198 22.788 1111 HB THR 24 HB THR 24 -6.927 -10.501 24.647 1112 HG1 THR 24 HG1 THR 24 -7.534 -12.650 24.611 1113 HG21 THR 24 HG21 THR 24 -9.264 -10.960 24.958 1114 HG22 THR 24 HG22 THR 24 -9.148 -9.551 23.898 1115 HG23 THR 24 HG23 THR 24 -9.544 -11.151 23.217 1116 H GLU 25 H GLU 25 -5.979 -11.772 20.602 1117 HA GLU 25 HA GLU 25 -3.354 -12.394 21.672 1118 HB2 GLU 25 HB2 GLU 25 -4.499 -12.761 18.875 1119 HB3 GLU 25 HB3 GLU 25 -2.955 -13.400 19.410 1120 HG2 GLU 25 HG2 GLU 25 -5.681 -14.147 20.552 1121 HG3 GLU 25 HG3 GLU 25 -4.745 -15.095 19.411 1122 H TYR 26 H TYR 26 -1.484 -11.305 21.517 1123 HA TYR 26 HA TYR 26 -1.367 -8.713 20.386 1124 HB2 TYR 26 HB2 TYR 26 -0.132 -8.941 22.288 1125 HB3 TYR 26 HB3 TYR 26 0.643 -10.418 21.751 1126 HD1 TYR 26 HD1 TYR 26 2.667 -10.410 20.448 1127 HD2 TYR 26 HD2 TYR 26 0.601 -6.725 21.312 1128 HE1 TYR 26 HE1 TYR 26 4.657 -9.109 19.672 1129 HE2 TYR 26 HE2 TYR 26 2.573 -5.431 20.526 1130 HH TYR 26 HH TYR 26 4.714 -5.526 19.667 Start of MODEL 4 1 H1 MET 1 H1 MET 1 -7.936 1.936 7.391 2 H2 MET 1 H2 MET 1 -7.263 3.353 7.885 3 H3 MET 1 H3 MET 1 -8.198 2.512 8.914 4 HA MET 1 HA MET 1 -9.487 4.358 8.144 5 HB2 MET 1 HB2 MET 1 -8.112 4.841 6.201 6 HB3 MET 1 HB3 MET 1 -8.810 3.479 5.310 7 HG2 MET 1 HG2 MET 1 -10.983 4.544 5.276 8 HG3 MET 1 HG3 MET 1 -10.479 5.744 6.480 9 HE1 MET 1 HE1 MET 1 -11.043 8.029 3.395 10 HE2 MET 1 HE2 MET 1 -12.006 6.634 3.939 11 HE3 MET 1 HE3 MET 1 -11.353 7.788 5.132 12 HA PRO 2 HA PRO 2 -12.350 0.809 8.183 13 HB2 PRO 2 HB2 PRO 2 -13.878 2.390 10.187 14 HB3 PRO 2 HB3 PRO 2 -13.191 0.751 10.332 15 HG2 PRO 2 HG2 PRO 2 -12.100 2.843 11.671 16 HG3 PRO 2 HG3 PRO 2 -11.063 1.576 10.927 17 HD2 PRO 2 HD2 PRO 2 -11.843 4.260 9.746 18 HD3 PRO 2 HD3 PRO 2 -10.212 3.573 9.965 19 H SER 3 H SER 3 -13.041 4.184 7.608 20 HA SER 3 HA SER 3 -15.857 4.050 7.099 21 HB2 SER 3 HB2 SER 3 -15.487 6.416 6.403 22 HB3 SER 3 HB3 SER 3 -14.823 6.010 7.990 23 HG SER 3 HG SER 3 -13.341 7.223 6.735 24 H GLU 4 H GLU 4 -16.487 5.409 4.969 25 HA GLU 4 HA GLU 4 -16.769 3.524 2.963 26 HB2 GLU 4 HB2 GLU 4 -18.349 5.268 3.292 27 HB3 GLU 4 HB3 GLU 4 -17.138 6.516 3.084 28 HG2 GLU 4 HG2 GLU 4 -18.647 6.549 1.251 29 HG3 GLU 4 HG3 GLU 4 -17.040 6.127 0.686 30 H LYS 5 H LYS 5 -16.270 3.424 0.824 31 HA LYS 5 HA LYS 5 -14.921 2.984 -0.914 32 HB2 LYS 5 HB2 LYS 5 -14.829 5.372 -1.217 33 HB3 LYS 5 HB3 LYS 5 -13.437 5.520 -0.157 34 HG2 LYS 5 HG2 LYS 5 -12.023 4.313 -1.733 35 HG3 LYS 5 HG3 LYS 5 -13.428 3.964 -2.771 36 HD2 LYS 5 HD2 LYS 5 -13.759 6.403 -3.126 37 HD3 LYS 5 HD3 LYS 5 -12.335 6.738 -2.115 38 HE2 LYS 5 HE2 LYS 5 -10.902 5.473 -3.700 39 HE3 LYS 5 HE3 LYS 5 -12.316 5.074 -4.681 40 HZ1 LYS 5 HZ1 LYS 5 -11.288 7.838 -4.217 41 HZ2 LYS 5 HZ2 LYS 5 -11.119 6.985 -5.598 42 HZ3 LYS 5 HZ3 LYS 5 -12.598 7.471 -5.122 43 H THR 6 H THR 6 -12.793 2.088 -1.583 44 HA THR 6 HA THR 6 -12.055 0.256 0.477 45 HB THR 6 HB THR 6 -11.082 -1.095 -0.994 46 HG1 THR 6 HG1 THR 6 -10.000 -0.287 -2.896 47 HG21 THR 6 HG21 THR 6 -13.334 -0.498 -1.976 48 HG22 THR 6 HG22 THR 6 -12.492 0.642 -3.058 49 HG23 THR 6 HG23 THR 6 -12.143 -1.091 -3.145 50 H PHE 7 H PHE 7 -9.856 -0.447 1.092 51 HA PHE 7 HA PHE 7 -8.316 1.696 2.197 52 HB2 PHE 7 HB2 PHE 7 -8.364 -0.193 3.430 53 HB3 PHE 7 HB3 PHE 7 -8.034 -1.255 2.075 54 HD1 PHE 7 HD1 PHE 7 -6.017 -2.377 2.120 55 HD2 PHE 7 HD2 PHE 7 -6.294 1.528 3.931 56 HE1 PHE 7 HE1 PHE 7 -3.688 -2.586 2.943 57 HE2 PHE 7 HE2 PHE 7 -3.965 1.306 4.765 58 HZ PHE 7 HZ PHE 7 -2.651 -0.757 4.253 59 H LYS 8 H LYS 8 -8.250 0.652 -1.039 60 HA LYS 8 HA LYS 8 -5.507 1.274 -1.732 61 HB2 LYS 8 HB2 LYS 8 -7.165 0.039 -3.142 62 HB3 LYS 8 HB3 LYS 8 -8.071 1.542 -3.369 63 HG2 LYS 8 HG2 LYS 8 -6.161 2.547 -4.559 64 HG3 LYS 8 HG3 LYS 8 -5.183 1.101 -4.240 65 HD2 LYS 8 HD2 LYS 8 -6.749 -0.263 -5.584 66 HD3 LYS 8 HD3 LYS 8 -7.773 1.167 -5.852 67 HE2 LYS 8 HE2 LYS 8 -5.861 2.310 -6.972 68 HE3 LYS 8 HE3 LYS 8 -4.859 0.869 -6.738 69 HZ1 LYS 8 HZ1 LYS 8 -6.431 -0.368 -8.154 70 HZ2 LYS 8 HZ2 LYS 8 -7.359 0.968 -8.362 71 HZ3 LYS 8 HZ3 LYS 8 -5.848 0.918 -8.969 72 H GLN 9 H GLN 9 -8.236 3.386 -1.012 73 HA GLN 9 HA GLN 9 -7.071 5.814 -2.019 74 HB2 GLN 9 HB2 GLN 9 -8.827 6.918 -0.968 75 HB3 GLN 9 HB3 GLN 9 -9.503 5.332 -1.347 76 HG2 GLN 9 HG2 GLN 9 -8.893 4.687 1.098 77 HG3 GLN 9 HG3 GLN 9 -8.613 6.402 1.363 78 HE21 GLN 9 HE21 GLN 9 -12.348 5.154 1.750 79 HE22 GLN 9 HE22 GLN 9 -10.951 4.083 1.745 80 H ARG 10 H ARG 10 -6.086 3.907 0.685 81 HA ARG 10 HA ARG 10 -4.343 6.148 1.689 82 HB2 ARG 10 HB2 ARG 10 -5.244 3.635 3.143 83 HB3 ARG 10 HB3 ARG 10 -4.107 4.823 3.774 84 HG2 ARG 10 HG2 ARG 10 -7.035 5.383 3.118 85 HG3 ARG 10 HG3 ARG 10 -6.386 4.987 4.699 86 HD2 ARG 10 HD2 ARG 10 -6.690 7.321 4.715 87 HD3 ARG 10 HD3 ARG 10 -4.944 7.027 4.612 88 HE ARG 10 HE ARG 10 -6.251 7.408 2.009 89 HH11 ARG 10 HH11 ARG 10 -4.411 10.573 3.583 90 HH12 ARG 10 HH12 ARG 10 -4.886 9.276 4.640 91 HH21 ARG 10 HH21 ARG 10 -5.533 8.972 0.722 92 HH22 ARG 10 HH22 ARG 10 -4.818 10.426 1.389 93 H ARG 11 H ARG 11 -4.207 2.566 1.172 94 HA ARG 11 HA ARG 11 -1.323 2.968 0.366 95 HB2 ARG 11 HB2 ARG 11 -2.409 0.606 1.923 96 HB3 ARG 11 HB3 ARG 11 -0.730 0.904 1.503 97 HG2 ARG 11 HG2 ARG 11 -2.394 2.617 3.404 98 HG3 ARG 11 HG3 ARG 11 -1.315 1.335 3.903 99 HD2 ARG 11 HD2 ARG 11 -0.330 3.750 2.337 100 HD3 ARG 11 HD3 ARG 11 -0.462 3.731 4.101 101 HE ARG 11 HE ARG 11 1.001 1.431 3.473 102 HH11 ARG 11 HH11 ARG 11 1.562 4.899 3.172 103 HH12 ARG 11 HH12 ARG 11 3.290 4.683 3.190 104 HH21 ARG 11 HH21 ARG 11 3.154 1.266 3.251 105 HH22 ARG 11 HH22 ARG 11 4.187 2.654 3.107 106 H THR 12 H THR 12 -1.044 2.517 -1.640 107 HA THR 12 HA THR 12 -2.604 0.633 -3.290 108 HB THR 12 HB THR 12 -0.789 1.263 -4.968 109 HG1 THR 12 HG1 THR 12 0.785 2.599 -4.378 110 HG21 THR 12 HG21 THR 12 -1.457 3.596 -5.263 111 HG22 THR 12 HG22 THR 12 -2.868 2.614 -4.834 112 HG23 THR 12 HG23 THR 12 -2.112 3.655 -3.614 113 H PHE 13 H PHE 13 -1.211 -1.071 -4.565 114 HA PHE 13 HA PHE 13 -0.358 -3.019 -2.849 115 HB2 PHE 13 HB2 PHE 13 -1.000 -3.728 -4.905 116 HB3 PHE 13 HB3 PHE 13 0.059 -2.623 -5.758 117 HD1 PHE 13 HD1 PHE 13 2.423 -3.104 -6.151 118 HD2 PHE 13 HD2 PHE 13 -0.134 -5.934 -4.140 119 HE1 PHE 13 HE1 PHE 13 4.085 -4.896 -6.570 120 HE2 PHE 13 HE2 PHE 13 1.521 -7.741 -4.598 121 HZ PHE 13 HZ PHE 13 3.623 -7.218 -5.810 122 H GLU 14 H GLU 14 2.087 -0.926 -4.453 123 HA GLU 14 HA GLU 14 4.325 -2.139 -3.137 124 HB2 GLU 14 HB2 GLU 14 4.025 0.740 -4.112 125 HB3 GLU 14 HB3 GLU 14 5.515 -0.098 -3.728 126 HG2 GLU 14 HG2 GLU 14 5.516 -0.259 -6.004 127 HG3 GLU 14 HG3 GLU 14 4.846 -1.818 -5.549 128 H GLN 15 H GLN 15 2.163 0.486 -2.115 129 HA GLN 15 HA GLN 15 3.639 1.155 0.312 130 HB2 GLN 15 HB2 GLN 15 0.860 1.801 -0.742 131 HB3 GLN 15 HB3 GLN 15 1.450 2.370 0.802 132 HG2 GLN 15 HG2 GLN 15 3.398 3.457 -0.348 133 HG3 GLN 15 HG3 GLN 15 2.701 2.985 -1.903 134 HE21 GLN 15 HE21 GLN 15 0.044 5.437 -1.691 135 HE22 GLN 15 HE22 GLN 15 0.538 3.936 -2.474 136 H ARG 16 H ARG 16 1.076 -1.181 -0.467 137 HA ARG 16 HA ARG 16 0.684 -2.006 2.325 138 HB2 ARG 16 HB2 ARG 16 0.040 -3.442 -0.278 139 HB3 ARG 16 HB3 ARG 16 -0.411 -3.997 1.338 140 HG2 ARG 16 HG2 ARG 16 -1.698 -1.871 1.688 141 HG3 ARG 16 HG3 ARG 16 -1.327 -1.407 0.025 142 HD2 ARG 16 HD2 ARG 16 -2.285 -3.676 -0.665 143 HD3 ARG 16 HD3 ARG 16 -2.951 -3.775 0.984 144 HE ARG 16 HE ARG 16 -3.737 -1.258 -0.012 145 HH11 ARG 16 HH11 ARG 16 -4.143 -4.501 -1.408 146 HH12 ARG 16 HH12 ARG 16 -5.801 -4.084 -1.886 147 HH21 ARG 16 HH21 ARG 16 -5.843 -0.941 -0.849 148 HH22 ARG 16 HH22 ARG 16 -6.641 -2.330 -1.617 149 H VAL 17 H VAL 17 2.850 -3.108 -0.296 150 HA VAL 17 HA VAL 17 3.985 -5.322 1.140 151 HB VAL 17 HB VAL 17 5.154 -3.508 -1.000 152 HG11 VAL 17 HG11 VAL 17 6.329 -6.082 0.137 153 HG12 VAL 17 HG12 VAL 17 6.865 -5.282 -1.352 154 HG13 VAL 17 HG13 VAL 17 7.069 -4.463 0.195 155 HG21 VAL 17 HG21 VAL 17 4.708 -5.383 -2.478 156 HG22 VAL 17 HG22 VAL 17 4.186 -6.397 -1.110 157 HG23 VAL 17 HG23 VAL 17 3.213 -5.018 -1.619 158 H GLU 18 H GLU 18 4.877 -1.802 1.240 159 HA GLU 18 HA GLU 18 6.941 -2.038 3.214 160 HB2 GLU 18 HB2 GLU 18 4.886 0.137 2.745 161 HB3 GLU 18 HB3 GLU 18 6.206 0.277 3.911 162 HG2 GLU 18 HG2 GLU 18 7.853 0.087 2.121 163 HG3 GLU 18 HG3 GLU 18 6.569 -0.122 0.922 164 H ASP 19 H ASP 19 3.410 -1.507 3.723 165 HA ASP 19 HA ASP 19 3.406 -1.595 6.555 166 HB2 ASP 19 HB2 ASP 19 1.615 -0.629 5.450 167 HB3 ASP 19 HB3 ASP 19 1.352 -2.037 4.436 168 H VAL 20 H VAL 20 2.734 -4.307 4.368 169 HA VAL 20 HA VAL 20 2.598 -6.404 6.275 170 HB VAL 20 HB VAL 20 3.494 -6.302 3.364 171 HG11 VAL 20 HG11 VAL 20 2.955 -8.803 5.017 172 HG12 VAL 20 HG12 VAL 20 3.135 -8.731 3.248 173 HG13 VAL 20 HG13 VAL 20 4.503 -8.335 4.280 174 HG21 VAL 20 HG21 VAL 20 0.920 -7.339 4.641 175 HG22 VAL 20 HG22 VAL 20 1.085 -5.763 3.859 176 HG23 VAL 20 HG23 VAL 20 1.275 -7.233 2.902 177 H ARG 21 H ARG 21 5.534 -5.076 4.590 178 HA ARG 21 HA ARG 21 7.333 -7.011 5.711 179 HB2 ARG 21 HB2 ARG 21 7.861 -5.700 3.712 180 HB3 ARG 21 HB3 ARG 21 7.880 -4.201 4.650 181 HG2 ARG 21 HG2 ARG 21 9.827 -5.017 5.950 182 HG3 ARG 21 HG3 ARG 21 9.740 -6.578 5.115 183 HD2 ARG 21 HD2 ARG 21 11.512 -5.272 4.132 184 HD3 ARG 21 HD3 ARG 21 10.212 -5.443 2.960 185 HE ARG 21 HE ARG 21 10.737 -2.991 4.639 186 HH11 ARG 21 HH11 ARG 21 10.573 -1.009 3.678 187 HH12 ARG 21 HH12 ARG 21 10.170 -0.882 1.997 188 HH21 ARG 21 HH21 ARG 21 9.854 -4.261 1.496 189 HH22 ARG 21 HH22 ARG 21 9.759 -2.679 0.783 190 H LEU 22 H LEU 22 6.765 -3.599 6.799 191 HA LEU 22 HA LEU 22 8.382 -3.794 9.132 192 HB2 LEU 22 HB2 LEU 22 6.040 -2.027 8.284 193 HB3 LEU 22 HB3 LEU 22 6.659 -1.971 9.929 194 HG LEU 22 HG LEU 22 8.988 -1.675 8.908 195 HD11 LEU 22 HD11 LEU 22 8.466 -2.098 6.530 196 HD12 LEU 22 HD12 LEU 22 7.372 -0.695 6.531 197 HD13 LEU 22 HD13 LEU 22 9.113 -0.473 6.781 198 HD21 LEU 22 HD21 LEU 22 7.793 0.085 10.151 199 HD22 LEU 22 HD22 LEU 22 8.679 0.783 8.786 200 HD23 LEU 22 HD23 LEU 22 6.919 0.551 8.674 201 H ILE 23 H ILE 23 4.901 -4.556 8.719 202 HA ILE 23 HA ILE 23 4.424 -5.300 11.442 203 HB ILE 23 HB ILE 23 3.137 -5.978 8.782 204 HG12 ILE 23 HG12 ILE 23 2.673 -3.739 9.534 205 HG13 ILE 23 HG13 ILE 23 1.224 -4.702 9.710 206 HG21 ILE 23 HG21 ILE 23 1.289 -7.065 9.906 207 HG22 ILE 23 HG22 ILE 23 2.764 -7.988 10.064 208 HG23 ILE 23 HG23 ILE 23 2.193 -7.047 11.454 209 HD11 ILE 23 HD11 ILE 23 3.067 -3.670 11.894 210 HD12 ILE 23 HD12 ILE 23 1.408 -3.208 11.569 211 HD13 ILE 23 HD13 ILE 23 1.741 -4.828 12.205 212 H ARG 24 H ARG 24 5.427 -7.412 8.686 213 HA ARG 24 HA ARG 24 5.444 -9.785 10.300 214 HB2 ARG 24 HB2 ARG 24 5.278 -9.782 7.835 215 HB3 ARG 24 HB3 ARG 24 6.904 -9.125 7.706 216 HG2 ARG 24 HG2 ARG 24 6.972 -11.481 7.225 217 HG3 ARG 24 HG3 ARG 24 7.828 -11.199 8.733 218 HD2 ARG 24 HD2 ARG 24 5.784 -11.969 9.991 219 HD3 ARG 24 HD3 ARG 24 4.992 -12.286 8.434 220 HE ARG 24 HE ARG 24 7.592 -13.583 8.673 221 HH11 ARG 24 HH11 ARG 24 4.229 -14.089 9.667 222 HH12 ARG 24 HH12 ARG 24 4.460 -15.813 9.714 223 HH21 ARG 24 HH21 ARG 24 7.747 -15.779 8.741 224 HH22 ARG 24 HH22 ARG 24 6.376 -16.739 9.197 225 H GLU 25 H GLU 25 8.015 -7.417 9.640 226 HA GLU 25 HA GLU 25 10.129 -8.805 10.975 227 HB2 GLU 25 HB2 GLU 25 9.599 -5.860 10.473 228 HB3 GLU 25 HB3 GLU 25 11.043 -6.411 11.299 229 HG2 GLU 25 HG2 GLU 25 10.224 -7.324 8.505 230 HG3 GLU 25 HG3 GLU 25 11.318 -5.987 8.840 231 H GLN 26 H GLN 26 7.675 -6.531 12.398 232 HA GLN 26 HA GLN 26 8.803 -6.998 15.070 233 HB2 GLN 26 HB2 GLN 26 7.028 -5.661 15.936 234 HB3 GLN 26 HB3 GLN 26 7.831 -4.842 14.606 235 HG2 GLN 26 HG2 GLN 26 5.961 -5.160 13.146 236 HG3 GLN 26 HG3 GLN 26 5.222 -6.355 14.210 237 HE21 GLN 26 HE21 GLN 26 3.133 -3.495 14.873 238 HE22 GLN 26 HE22 GLN 26 3.287 -4.925 13.882 239 H HIS 27 H HIS 27 6.283 -8.560 13.175 240 HA HIS 27 HA HIS 27 5.722 -10.420 15.469 241 HB2 HIS 27 HB2 HIS 27 3.683 -9.266 13.535 242 HB3 HIS 27 HB3 HIS 27 3.355 -10.444 14.807 243 HD1 HIS 27 HD1 HIS 27 4.938 -8.875 17.217 244 HD2 HIS 27 HD2 HIS 27 2.064 -7.426 14.476 245 HE1 HIS 27 HE1 HIS 27 3.738 -6.925 18.384 246 HE2 HIS 27 HE2 HIS 27 2.002 -6.029 16.706 247 HA PRO 28 HA PRO 28 6.886 -13.058 11.822 248 HB2 PRO 28 HB2 PRO 28 8.579 -14.769 13.150 249 HB3 PRO 28 HB3 PRO 28 9.080 -13.198 12.457 250 HG2 PRO 28 HG2 PRO 28 8.270 -13.784 15.327 251 HG3 PRO 28 HG3 PRO 28 9.745 -12.942 14.745 252 HD2 PRO 28 HD2 PRO 28 7.586 -11.554 15.557 253 HD3 PRO 28 HD3 PRO 28 8.502 -11.018 14.119 254 H THR 29 H THR 29 5.437 -13.616 14.964 255 HA THR 29 HA THR 29 4.473 -16.293 14.378 256 HB THR 29 HB THR 29 3.394 -16.279 16.430 257 HG1 THR 29 HG1 THR 29 3.041 -14.362 17.599 258 HG21 THR 29 HG21 THR 29 5.737 -14.398 16.961 259 HG22 THR 29 HG22 THR 29 5.035 -15.616 18.042 260 HG23 THR 29 HG23 THR 29 5.928 -16.133 16.605 261 H LYS 30 H LYS 30 3.466 -13.407 13.014 262 HA LYS 30 HA LYS 30 0.648 -14.384 12.710 263 HB2 LYS 30 HB2 LYS 30 1.633 -11.505 12.864 264 HB3 LYS 30 HB3 LYS 30 -0.036 -12.017 12.558 265 HG2 LYS 30 HG2 LYS 30 -0.079 -13.172 14.763 266 HG3 LYS 30 HG3 LYS 30 1.561 -12.592 15.091 267 HD2 LYS 30 HD2 LYS 30 0.789 -10.267 15.095 268 HD3 LYS 30 HD3 LYS 30 -0.815 -10.764 14.548 269 HE2 LYS 30 HE2 LYS 30 -0.911 -10.276 16.915 270 HE3 LYS 30 HE3 LYS 30 -1.216 -11.990 16.644 271 HZ1 LYS 30 HZ1 LYS 30 1.356 -10.824 17.631 272 HZ2 LYS 30 HZ2 LYS 30 0.264 -11.655 18.518 273 HZ3 LYS 30 HZ3 LYS 30 1.113 -12.431 17.357 274 H ILE 31 H ILE 31 -0.491 -13.893 10.892 275 HA ILE 31 HA ILE 31 1.041 -13.655 8.320 276 HB ILE 31 HB ILE 31 -1.674 -14.889 8.929 277 HG12 ILE 31 HG12 ILE 31 0.032 -16.265 9.947 278 HG13 ILE 31 HG13 ILE 31 -0.674 -17.063 8.552 279 HG21 ILE 31 HG21 ILE 31 -0.060 -14.887 6.338 280 HG22 ILE 31 HG22 ILE 31 -1.543 -15.814 6.644 281 HG23 ILE 31 HG23 ILE 31 -1.601 -14.057 6.634 282 HD11 ILE 31 HD11 ILE 31 1.742 -17.447 8.660 283 HD12 ILE 31 HD12 ILE 31 1.334 -16.547 7.192 284 HD13 ILE 31 HD13 ILE 31 2.057 -15.706 8.585 285 HA PRO 32 HA PRO 32 -1.391 -9.786 8.079 286 HB2 PRO 32 HB2 PRO 32 0.507 -9.391 5.773 287 HB3 PRO 32 HB3 PRO 32 -0.027 -8.211 7.010 288 HG2 PRO 32 HG2 PRO 32 2.428 -9.328 7.224 289 HG3 PRO 32 HG3 PRO 32 1.371 -9.240 8.674 290 HD2 PRO 32 HD2 PRO 32 1.745 -11.601 6.810 291 HD3 PRO 32 HD3 PRO 32 1.889 -11.542 8.588 292 H VAL 33 H VAL 33 -3.313 -9.703 7.059 293 HA VAL 33 HA VAL 33 -3.584 -10.827 4.327 294 HB VAL 33 HB VAL 33 -5.789 -11.057 6.340 295 HG11 VAL 33 HG11 VAL 33 -5.171 -12.577 3.777 296 HG12 VAL 33 HG12 VAL 33 -6.561 -12.863 4.838 297 HG13 VAL 33 HG13 VAL 33 -6.423 -11.335 3.983 298 HG21 VAL 33 HG21 VAL 33 -3.649 -13.146 5.855 299 HG22 VAL 33 HG22 VAL 33 -4.006 -12.312 7.377 300 HG23 VAL 33 HG23 VAL 33 -5.190 -13.434 6.707 301 H ILE 34 H ILE 34 -4.640 -9.627 2.835 302 HA ILE 34 HA ILE 34 -6.068 -7.146 3.762 303 HB ILE 34 HB ILE 34 -5.264 -7.862 0.942 304 HG12 ILE 34 HG12 ILE 34 -3.172 -7.706 2.115 305 HG13 ILE 34 HG13 ILE 34 -3.398 -6.267 1.150 306 HG21 ILE 34 HG21 ILE 34 -6.177 -5.260 2.258 307 HG22 ILE 34 HG22 ILE 34 -5.568 -5.404 0.601 308 HG23 ILE 34 HG23 ILE 34 -7.057 -6.225 1.055 309 HD11 ILE 34 HD11 ILE 34 -2.429 -5.674 3.292 310 HD12 ILE 34 HD12 ILE 34 -4.057 -4.986 3.193 311 HD13 ILE 34 HD13 ILE 34 -3.755 -6.439 4.172 312 H ILE 35 H ILE 35 -8.269 -6.860 3.296 313 HA ILE 35 HA ILE 35 -9.673 -9.056 1.884 314 HB ILE 35 HB ILE 35 -10.068 -9.578 4.160 315 HG12 ILE 35 HG12 ILE 35 -12.547 -8.238 2.949 316 HG13 ILE 35 HG13 ILE 35 -11.934 -9.846 2.552 317 HG21 ILE 35 HG21 ILE 35 -9.643 -7.350 5.191 318 HG22 ILE 35 HG22 ILE 35 -11.233 -6.788 4.589 319 HG23 ILE 35 HG23 ILE 35 -11.109 -8.082 5.787 320 HD11 ILE 35 HD11 ILE 35 -13.063 -8.972 5.248 321 HD12 ILE 35 HD12 ILE 35 -13.814 -10.032 4.076 322 HD13 ILE 35 HD13 ILE 35 -12.344 -10.569 4.905 323 H GLU 36 H GLU 36 -10.598 -8.316 0.118 324 HA GLU 36 HA GLU 36 -11.667 -5.495 0.098 325 HB2 GLU 36 HB2 GLU 36 -10.226 -6.963 -2.141 326 HB3 GLU 36 HB3 GLU 36 -11.127 -5.449 -2.323 327 HG2 GLU 36 HG2 GLU 36 -9.638 -4.402 -0.594 328 HG3 GLU 36 HG3 GLU 36 -8.662 -5.873 -0.596 329 H ARG 37 H ARG 37 -13.755 -5.251 -0.476 330 HA ARG 37 HA ARG 37 -15.449 -7.536 -1.009 331 HB2 ARG 37 HB2 ARG 37 -16.246 -5.554 0.145 332 HB3 ARG 37 HB3 ARG 37 -15.926 -4.538 -1.264 333 HG2 ARG 37 HG2 ARG 37 -17.700 -5.622 -2.537 334 HG3 ARG 37 HG3 ARG 37 -17.873 -6.878 -1.301 335 HD2 ARG 37 HD2 ARG 37 -19.690 -5.325 -1.086 336 HD3 ARG 37 HD3 ARG 37 -18.641 -5.195 0.329 337 HE ARG 37 HE ARG 37 -17.762 -3.220 -1.511 338 HH11 ARG 37 HH11 ARG 37 -18.361 -1.060 -1.397 339 HH12 ARG 37 HH12 ARG 37 -19.784 -0.611 -0.522 340 HH21 ARG 37 HH21 ARG 37 -20.696 -3.813 0.333 341 HH22 ARG 37 HH22 ARG 37 -21.113 -2.120 0.365 342 H TYR 38 H TYR 38 -16.292 -8.327 -2.886 343 HA TYR 38 HA TYR 38 -14.649 -8.256 -5.118 344 HB2 TYR 38 HB2 TYR 38 -15.741 -10.223 -4.801 345 HB3 TYR 38 HB3 TYR 38 -17.303 -9.465 -4.592 346 HD1 TYR 38 HD1 TYR 38 -18.858 -9.447 -6.329 347 HD2 TYR 38 HD2 TYR 38 -14.695 -10.157 -7.218 348 HE1 TYR 38 HE1 TYR 38 -19.453 -9.965 -8.694 349 HE2 TYR 38 HE2 TYR 38 -15.285 -10.636 -9.590 350 HH TYR 38 HH TYR 38 -18.673 -10.641 -10.769 351 H LYS 39 H LYS 39 -14.606 -7.611 -7.211 352 HA LYS 39 HA LYS 39 -15.242 -4.865 -7.548 353 HB2 LYS 39 HB2 LYS 39 -14.380 -6.955 -9.595 354 HB3 LYS 39 HB3 LYS 39 -14.457 -5.217 -9.906 355 HG2 LYS 39 HG2 LYS 39 -12.816 -4.790 -8.108 356 HG3 LYS 39 HG3 LYS 39 -12.693 -6.534 -7.798 357 HD2 LYS 39 HD2 LYS 39 -11.925 -6.896 -10.135 358 HD3 LYS 39 HD3 LYS 39 -12.022 -5.145 -10.430 359 HE2 LYS 39 HE2 LYS 39 -10.352 -4.745 -8.632 360 HE3 LYS 39 HE3 LYS 39 -10.254 -6.486 -8.330 361 HZ1 LYS 39 HZ1 LYS 39 -8.453 -5.740 -9.786 362 HZ2 LYS 39 HZ2 LYS 39 -9.416 -6.763 -10.618 363 HZ3 LYS 39 HZ3 LYS 39 -9.504 -5.151 -10.888 364 H GLY 40 H GLY 40 -16.813 -7.671 -9.074 365 HA2 GLY 40 HA2 GLY 40 -18.499 -6.054 -10.775 366 HA3 GLY 40 HA3 GLY 40 -18.560 -7.800 -10.576 367 H GLU 41 H GLU 41 -19.008 -7.160 -7.502 368 HA GLU 41 HA GLU 41 -21.782 -6.152 -7.561 369 HB2 GLU 41 HB2 GLU 41 -22.024 -8.515 -8.201 370 HB3 GLU 41 HB3 GLU 41 -21.107 -9.020 -6.784 371 HG2 GLU 41 HG2 GLU 41 -23.498 -9.351 -6.442 372 HG3 GLU 41 HG3 GLU 41 -22.860 -8.179 -5.294 373 H LYS 42 H LYS 42 -21.867 -4.742 -5.969 374 HA LYS 42 HA LYS 42 -20.101 -4.923 -3.603 375 HB2 LYS 42 HB2 LYS 42 -21.966 -2.684 -4.475 376 HB3 LYS 42 HB3 LYS 42 -20.713 -2.582 -3.253 377 HG2 LYS 42 HG2 LYS 42 -20.339 -2.821 -6.257 378 HG3 LYS 42 HG3 LYS 42 -19.961 -1.455 -5.206 379 HD2 LYS 42 HD2 LYS 42 -18.292 -3.064 -4.024 380 HD3 LYS 42 HD3 LYS 42 -18.497 -4.108 -5.434 381 HE2 LYS 42 HE2 LYS 42 -17.461 -1.227 -5.394 382 HE3 LYS 42 HE3 LYS 42 -16.488 -2.669 -5.618 383 HZ1 LYS 42 HZ1 LYS 42 -16.977 -1.605 -7.744 384 HZ2 LYS 42 HZ2 LYS 42 -17.690 -3.075 -7.742 385 HZ3 LYS 42 HZ3 LYS 42 -18.583 -1.707 -7.519 386 H GLN 43 H GLN 43 -22.561 -6.654 -3.883 387 HA GLN 43 HA GLN 43 -24.754 -5.768 -2.462 388 HB2 GLN 43 HB2 GLN 43 -24.683 -7.751 -3.866 389 HB3 GLN 43 HB3 GLN 43 -23.646 -8.588 -2.704 390 HG2 GLN 43 HG2 GLN 43 -25.499 -8.575 -1.043 391 HG3 GLN 43 HG3 GLN 43 -26.496 -7.650 -2.168 392 HE21 GLN 43 HE21 GLN 43 -27.800 -10.915 -2.902 393 HE22 GLN 43 HE22 GLN 43 -28.091 -9.439 -1.995 394 H LEU 44 H LEU 44 -22.009 -7.569 -0.965 395 HA LEU 44 HA LEU 44 -23.349 -7.591 1.629 396 HB2 LEU 44 HB2 LEU 44 -20.543 -8.499 0.884 397 HB3 LEU 44 HB3 LEU 44 -21.396 -8.858 2.379 398 HG LEU 44 HG LEU 44 -22.127 -9.891 -0.382 399 HD11 LEU 44 HD11 LEU 44 -20.164 -10.941 0.767 400 HD12 LEU 44 HD12 LEU 44 -21.229 -11.348 2.134 401 HD13 LEU 44 HD13 LEU 44 -21.528 -12.050 0.540 402 HD21 LEU 44 HD21 LEU 44 -23.507 -10.354 2.303 403 HD22 LEU 44 HD22 LEU 44 -24.213 -9.556 0.874 404 HD23 LEU 44 HD23 LEU 44 -23.822 -11.279 0.819 405 HA PRO 45 HA PRO 45 -21.800 -3.849 3.244 406 HB2 PRO 45 HB2 PRO 45 -21.775 -4.240 5.957 407 HB3 PRO 45 HB3 PRO 45 -23.275 -4.168 4.988 408 HG2 PRO 45 HG2 PRO 45 -21.776 -6.648 5.898 409 HG3 PRO 45 HG3 PRO 45 -23.528 -6.297 6.038 410 HD2 PRO 45 HD2 PRO 45 -22.550 -7.799 4.007 411 HD3 PRO 45 HD3 PRO 45 -23.881 -6.633 3.736 412 H VAL 46 H VAL 46 -19.767 -3.046 3.026 413 HA VAL 46 HA VAL 46 -17.450 -4.535 4.038 414 HB VAL 46 HB VAL 46 -17.552 -3.570 1.756 415 HG11 VAL 46 HG11 VAL 46 -16.882 -1.324 1.308 416 HG12 VAL 46 HG12 VAL 46 -18.314 -1.255 2.348 417 HG13 VAL 46 HG13 VAL 46 -16.696 -0.942 3.019 418 HG21 VAL 46 HG21 VAL 46 -15.171 -3.113 1.654 419 HG22 VAL 46 HG22 VAL 46 -15.105 -2.883 3.410 420 HG23 VAL 46 HG23 VAL 46 -15.500 -4.478 2.735 421 H LEU 47 H LEU 47 -18.944 -3.944 6.116 422 HA LEU 47 HA LEU 47 -18.522 -1.411 7.347 423 HB2 LEU 47 HB2 LEU 47 -20.437 -2.841 7.842 424 HB3 LEU 47 HB3 LEU 47 -19.377 -4.109 8.449 425 HG LEU 47 HG LEU 47 -18.674 -2.610 10.338 426 HD11 LEU 47 HD11 LEU 47 -20.082 -0.629 10.830 427 HD12 LEU 47 HD12 LEU 47 -19.158 -0.399 9.345 428 HD13 LEU 47 HD13 LEU 47 -20.885 -0.804 9.257 429 HD21 LEU 47 HD21 LEU 47 -20.451 -4.276 10.622 430 HD22 LEU 47 HD22 LEU 47 -20.808 -2.818 11.565 431 HD23 LEU 47 HD23 LEU 47 -21.660 -3.102 10.030 432 H ASP 48 H ASP 48 -16.671 -0.614 8.067 433 HA ASP 48 HA ASP 48 -14.810 -0.254 9.161 434 HB2 ASP 48 HB2 ASP 48 -16.039 -2.290 10.991 435 HB3 ASP 48 HB3 ASP 48 -14.544 -1.466 11.391 436 H LYS 49 H LYS 49 -14.789 -3.470 7.972 437 HA LYS 49 HA LYS 49 -11.859 -3.702 8.549 438 HB2 LYS 49 HB2 LYS 49 -14.008 -5.824 8.217 439 HB3 LYS 49 HB3 LYS 49 -12.275 -6.164 8.212 440 HG2 LYS 49 HG2 LYS 49 -12.722 -6.599 10.395 441 HG3 LYS 49 HG3 LYS 49 -12.222 -4.918 10.509 442 HD2 LYS 49 HD2 LYS 49 -14.710 -4.298 10.506 443 HD3 LYS 49 HD3 LYS 49 -15.081 -6.036 10.589 444 HE2 LYS 49 HE2 LYS 49 -13.984 -6.265 12.710 445 HE3 LYS 49 HE3 LYS 49 -13.225 -4.677 12.592 446 HZ1 LYS 49 HZ1 LYS 49 -15.190 -4.714 14.105 447 HZ2 LYS 49 HZ2 LYS 49 -15.371 -3.616 12.912 448 HZ3 LYS 49 HZ3 LYS 49 -16.188 -5.040 12.833 449 H THR 50 H THR 50 -10.489 -3.575 7.055 450 HA THR 50 HA THR 50 -10.984 -4.413 4.212 451 HB THR 50 HB THR 50 -9.634 -2.488 3.496 452 HG1 THR 50 HG1 THR 50 -9.222 -0.895 5.205 453 HG21 THR 50 HG21 THR 50 -11.170 -0.681 3.917 454 HG22 THR 50 HG22 THR 50 -12.135 -2.164 3.780 455 HG23 THR 50 HG23 THR 50 -11.801 -1.461 5.383 456 H LYS 51 H LYS 51 -8.939 -4.656 6.973 457 HA LYS 51 HA LYS 51 -7.383 -6.739 5.686 458 HB2 LYS 51 HB2 LYS 51 -5.146 -5.742 6.329 459 HB3 LYS 51 HB3 LYS 51 -5.933 -5.011 4.931 460 HG2 LYS 51 HG2 LYS 51 -6.532 -3.057 6.124 461 HG3 LYS 51 HG3 LYS 51 -6.133 -3.787 7.698 462 HD2 LYS 51 HD2 LYS 51 -3.766 -3.825 7.149 463 HD3 LYS 51 HD3 LYS 51 -4.077 -3.251 5.494 464 HE2 LYS 51 HE2 LYS 51 -4.733 -1.112 6.193 465 HE3 LYS 51 HE3 LYS 51 -5.089 -1.637 7.836 466 HZ1 LYS 51 HZ1 LYS 51 -3.040 -0.408 7.851 467 HZ2 LYS 51 HZ2 LYS 51 -2.713 -1.952 8.220 468 HZ3 LYS 51 HZ3 LYS 51 -2.309 -1.427 6.737 469 H PHE 52 H PHE 52 -6.240 -8.053 7.148 470 HA PHE 52 HA PHE 52 -6.348 -7.420 9.965 471 HB2 PHE 52 HB2 PHE 52 -7.331 -9.710 10.560 472 HB3 PHE 52 HB3 PHE 52 -8.355 -8.336 10.186 473 HD1 PHE 52 HD1 PHE 52 -10.165 -8.657 8.727 474 HD2 PHE 52 HD2 PHE 52 -6.752 -11.271 8.468 475 HE1 PHE 52 HE1 PHE 52 -11.340 -10.045 7.042 476 HE2 PHE 52 HE2 PHE 52 -7.916 -12.627 6.752 477 HZ PHE 52 HZ PHE 52 -10.215 -12.017 6.029 478 H LEU 53 H LEU 53 -4.880 -8.291 11.317 479 HA LEU 53 HA LEU 53 -2.742 -10.007 10.104 480 HB2 LEU 53 HB2 LEU 53 -2.911 -8.152 12.515 481 HB3 LEU 53 HB3 LEU 53 -1.706 -9.412 12.447 482 HG LEU 53 HG LEU 53 -0.568 -8.475 10.608 483 HD11 LEU 53 HD11 LEU 53 -1.169 -6.363 9.486 484 HD12 LEU 53 HD12 LEU 53 -2.354 -7.630 9.162 485 HD13 LEU 53 HD13 LEU 53 -2.731 -6.347 10.328 486 HD21 LEU 53 HD21 LEU 53 -0.057 -6.161 11.550 487 HD22 LEU 53 HD22 LEU 53 -1.408 -6.370 12.658 488 HD23 LEU 53 HD23 LEU 53 -0.029 -7.476 12.741 489 H VAL 54 H VAL 54 -2.736 -12.129 10.652 490 HA VAL 54 HA VAL 54 -4.584 -13.006 12.820 491 HB VAL 54 HB VAL 54 -4.047 -14.621 10.356 492 HG11 VAL 54 HG11 VAL 54 -5.059 -15.719 12.371 493 HG12 VAL 54 HG12 VAL 54 -6.411 -14.570 12.290 494 HG13 VAL 54 HG13 VAL 54 -6.136 -15.714 10.963 495 HG21 VAL 54 HG21 VAL 54 -6.222 -13.821 9.457 496 HG22 VAL 54 HG22 VAL 54 -6.263 -12.578 10.730 497 HG23 VAL 54 HG23 VAL 54 -4.987 -12.563 9.487 498 HA PRO 55 HA PRO 55 -0.928 -15.171 14.337 499 HB2 PRO 55 HB2 PRO 55 -1.929 -16.311 16.604 500 HB3 PRO 55 HB3 PRO 55 -1.607 -14.559 16.475 501 HG2 PRO 55 HG2 PRO 55 -4.246 -15.989 16.110 502 HG3 PRO 55 HG3 PRO 55 -3.909 -14.529 17.090 503 HD2 PRO 55 HD2 PRO 55 -4.941 -14.411 14.555 504 HD3 PRO 55 HD3 PRO 55 -3.827 -13.156 15.188 505 H ASP 56 H ASP 56 -0.121 -17.245 14.247 506 HA ASP 56 HA ASP 56 -1.135 -18.963 12.362 507 HB2 ASP 56 HB2 ASP 56 1.114 -19.052 12.726 508 HB3 ASP 56 HB3 ASP 56 0.953 -19.188 14.469 509 H HIS 57 H HIS 57 -1.970 -19.178 15.745 510 HA HIS 57 HA HIS 57 -3.045 -21.810 15.783 511 HB2 HIS 57 HB2 HIS 57 -2.449 -20.444 17.761 512 HB3 HIS 57 HB3 HIS 57 -3.772 -19.336 17.420 513 HD1 HIS 57 HD1 HIS 57 -3.527 -23.200 18.041 514 HD2 HIS 57 HD2 HIS 57 -5.749 -19.746 19.029 515 HE1 HIS 57 HE1 HIS 57 -5.348 -23.956 19.702 516 HE2 HIS 57 HE2 HIS 57 -6.702 -21.844 20.289 517 H VAL 58 H VAL 58 -4.484 -18.911 14.407 518 HA VAL 58 HA VAL 58 -7.288 -19.825 14.515 519 HB VAL 58 HB VAL 58 -5.896 -17.637 12.960 520 HG11 VAL 58 HG11 VAL 58 -7.876 -18.207 11.672 521 HG12 VAL 58 HG12 VAL 58 -8.878 -18.232 13.148 522 HG13 VAL 58 HG13 VAL 58 -8.187 -16.710 12.547 523 HG21 VAL 58 HG21 VAL 58 -7.017 -16.128 14.553 524 HG22 VAL 58 HG22 VAL 58 -7.785 -17.514 15.359 525 HG23 VAL 58 HG23 VAL 58 -6.029 -17.298 15.436 526 H ASN 59 H ASN 59 -8.321 -21.110 12.972 527 HA ASN 59 HA ASN 59 -6.855 -21.769 10.455 528 HB2 ASN 59 HB2 ASN 59 -8.285 -23.719 10.269 529 HB3 ASN 59 HB3 ASN 59 -7.326 -23.742 11.749 530 HD21 ASN 59 HD21 ASN 59 -10.511 -24.976 12.860 531 HD22 ASN 59 HD22 ASN 59 -9.011 -25.495 12.083 532 H MET 60 H MET 60 -8.316 -22.154 8.518 533 HA MET 60 HA MET 60 -9.370 -19.621 7.848 534 HB2 MET 60 HB2 MET 60 -8.489 -21.403 6.282 535 HB3 MET 60 HB3 MET 60 -10.017 -22.244 6.459 536 HG2 MET 60 HG2 MET 60 -10.145 -21.003 4.455 537 HG3 MET 60 HG3 MET 60 -11.203 -20.197 5.611 538 HE1 MET 60 HE1 MET 60 -10.005 -17.158 3.491 539 HE2 MET 60 HE2 MET 60 -10.621 -18.756 3.032 540 HE3 MET 60 HE3 MET 60 -11.368 -17.853 4.375 541 H SER 61 H SER 61 -11.262 -22.581 8.748 542 HA SER 61 HA SER 61 -13.802 -21.329 8.479 543 HB2 SER 61 HB2 SER 61 -14.629 -23.194 9.882 544 HB3 SER 61 HB3 SER 61 -13.594 -23.726 8.538 545 HG SER 61 HG SER 61 -13.120 -24.729 10.621 546 H GLU 62 H GLU 62 -11.624 -21.421 11.389 547 HA GLU 62 HA GLU 62 -13.464 -19.956 13.045 548 HB2 GLU 62 HB2 GLU 62 -11.578 -21.149 14.027 549 HB3 GLU 62 HB3 GLU 62 -10.438 -20.127 13.144 550 HG2 GLU 62 HG2 GLU 62 -10.509 -19.440 15.432 551 HG3 GLU 62 HG3 GLU 62 -11.142 -18.157 14.420 552 H LEU 63 H LEU 63 -10.914 -18.812 10.756 553 HA LEU 63 HA LEU 63 -11.260 -16.035 11.286 554 HB2 LEU 63 HB2 LEU 63 -9.372 -16.885 9.991 555 HB3 LEU 63 HB3 LEU 63 -10.450 -17.481 8.738 556 HG LEU 63 HG LEU 63 -11.149 -15.125 8.218 557 HD11 LEU 63 HD11 LEU 63 -9.730 -13.281 9.039 558 HD12 LEU 63 HD12 LEU 63 -10.595 -14.037 10.373 559 HD13 LEU 63 HD13 LEU 63 -8.868 -14.401 10.118 560 HD21 LEU 63 HD21 LEU 63 -9.399 -16.316 6.954 561 HD22 LEU 63 HD22 LEU 63 -9.125 -14.576 7.014 562 HD23 LEU 63 HD23 LEU 63 -8.156 -15.653 8.050 563 H ILE 64 H ILE 64 -13.052 -18.165 9.011 564 HA ILE 64 HA ILE 64 -14.931 -16.202 8.093 565 HB ILE 64 HB ILE 64 -14.854 -19.195 8.250 566 HG12 ILE 64 HG12 ILE 64 -15.768 -18.797 5.851 567 HG13 ILE 64 HG13 ILE 64 -15.400 -17.100 6.111 568 HG21 ILE 64 HG21 ILE 64 -17.094 -18.941 9.149 569 HG22 ILE 64 HG22 ILE 64 -17.515 -17.777 7.861 570 HG23 ILE 64 HG23 ILE 64 -17.183 -19.476 7.484 571 HD11 ILE 64 HD11 ILE 64 -13.570 -18.295 4.947 572 HD12 ILE 64 HD12 ILE 64 -13.002 -17.739 6.532 573 HD13 ILE 64 HD13 ILE 64 -13.443 -19.446 6.296 574 H LYS 65 H LYS 65 -15.053 -18.268 11.009 575 HA LYS 65 HA LYS 65 -17.631 -17.446 11.865 576 HB2 LYS 65 HB2 LYS 65 -16.543 -19.489 12.541 577 HB3 LYS 65 HB3 LYS 65 -15.286 -18.604 13.405 578 HG2 LYS 65 HG2 LYS 65 -16.853 -17.806 15.049 579 HG3 LYS 65 HG3 LYS 65 -18.228 -18.442 14.127 580 HD2 LYS 65 HD2 LYS 65 -17.899 -20.598 14.790 581 HD3 LYS 65 HD3 LYS 65 -16.149 -20.491 14.747 582 HE2 LYS 65 HE2 LYS 65 -17.880 -19.361 16.992 583 HE3 LYS 65 HE3 LYS 65 -17.091 -20.940 17.003 584 HZ1 LYS 65 HZ1 LYS 65 -15.619 -19.477 18.120 585 HZ2 LYS 65 HZ2 LYS 65 -14.926 -19.710 16.643 586 HZ3 LYS 65 HZ3 LYS 65 -15.701 -18.315 16.977 587 H ILE 66 H ILE 66 -14.449 -16.075 12.935 588 HA ILE 66 HA ILE 66 -15.758 -14.026 14.514 589 HB ILE 66 HB ILE 66 -13.742 -14.098 15.294 590 HG12 ILE 66 HG12 ILE 66 -14.044 -11.712 14.666 591 HG13 ILE 66 HG13 ILE 66 -12.408 -12.244 14.983 592 HG21 ILE 66 HG21 ILE 66 -11.566 -14.312 14.031 593 HG22 ILE 66 HG22 ILE 66 -12.639 -15.701 14.056 594 HG23 ILE 66 HG23 ILE 66 -12.550 -14.673 12.595 595 HD11 ILE 66 HD11 ILE 66 -13.551 -11.445 12.308 596 HD12 ILE 66 HD12 ILE 66 -12.179 -10.778 13.179 597 HD13 ILE 66 HD13 ILE 66 -12.044 -12.369 12.430 598 H ILE 67 H ILE 67 -14.656 -13.946 11.105 599 HA ILE 67 HA ILE 67 -15.397 -11.184 10.776 600 HB ILE 67 HB ILE 67 -14.868 -13.447 8.838 601 HG12 ILE 67 HG12 ILE 67 -12.934 -12.616 10.149 602 HG13 ILE 67 HG13 ILE 67 -12.760 -12.380 8.424 603 HG21 ILE 67 HG21 ILE 67 -16.325 -11.958 7.587 604 HG22 ILE 67 HG22 ILE 67 -15.433 -10.528 8.157 605 HG23 ILE 67 HG23 ILE 67 -14.666 -11.678 7.047 606 HD11 ILE 67 HD11 ILE 67 -11.914 -10.482 9.783 607 HD12 ILE 67 HD12 ILE 67 -13.169 -9.982 8.635 608 HD13 ILE 67 HD13 ILE 67 -13.545 -10.151 10.363 609 H ARG 68 H ARG 68 -17.315 -14.139 9.985 610 HA ARG 68 HA ARG 68 -19.569 -12.569 9.093 611 HB2 ARG 68 HB2 ARG 68 -20.763 -14.586 8.855 612 HB3 ARG 68 HB3 ARG 68 -19.101 -14.912 8.435 613 HG2 ARG 68 HG2 ARG 68 -19.473 -16.772 9.660 614 HG3 ARG 68 HG3 ARG 68 -18.946 -15.735 10.977 615 HD2 ARG 68 HD2 ARG 68 -21.304 -15.280 11.573 616 HD3 ARG 68 HD3 ARG 68 -21.844 -16.262 10.203 617 HE ARG 68 HE ARG 68 -20.638 -18.200 11.286 618 HH11 ARG 68 HH11 ARG 68 -22.162 -15.736 13.271 619 HH12 ARG 68 HH12 ARG 68 -22.319 -16.818 14.625 620 HH21 ARG 68 HH21 ARG 68 -20.901 -19.511 13.045 621 HH22 ARG 68 HH22 ARG 68 -21.652 -18.900 14.486 622 H ARG 69 H ARG 69 -18.607 -13.499 12.344 623 HA ARG 69 HA ARG 69 -21.151 -12.613 13.531 624 HB2 ARG 69 HB2 ARG 69 -19.724 -14.268 14.648 625 HB3 ARG 69 HB3 ARG 69 -18.417 -13.081 14.800 626 HG2 ARG 69 HG2 ARG 69 -19.813 -11.659 16.248 627 HG3 ARG 69 HG3 ARG 69 -21.205 -12.727 15.995 628 HD2 ARG 69 HD2 ARG 69 -19.978 -14.579 17.099 629 HD3 ARG 69 HD3 ARG 69 -18.587 -13.502 17.358 630 HE ARG 69 HE ARG 69 -20.917 -12.267 18.450 631 HH11 ARG 69 HH11 ARG 69 -18.864 -15.006 19.211 632 HH12 ARG 69 HH12 ARG 69 -19.253 -14.945 20.907 633 HH21 ARG 69 HH21 ARG 69 -21.370 -12.242 20.624 634 HH22 ARG 69 HH22 ARG 69 -20.636 -13.413 21.681 635 H ARG 70 H ARG 70 -17.927 -11.074 13.060 636 HA ARG 70 HA ARG 70 -18.767 -8.705 14.512 637 HB2 ARG 70 HB2 ARG 70 -16.355 -9.865 14.111 638 HB3 ARG 70 HB3 ARG 70 -16.294 -8.725 12.768 639 HG2 ARG 70 HG2 ARG 70 -15.235 -7.727 14.667 640 HG3 ARG 70 HG3 ARG 70 -16.784 -6.886 14.467 641 HD2 ARG 70 HD2 ARG 70 -17.752 -8.207 16.331 642 HD3 ARG 70 HD3 ARG 70 -16.243 -9.139 16.460 643 HE ARG 70 HE ARG 70 -15.626 -6.362 16.669 644 HH11 ARG 70 HH11 ARG 70 -17.363 -8.672 18.665 645 HH12 ARG 70 HH12 ARG 70 -16.840 -7.907 20.142 646 HH21 ARG 70 HH21 ARG 70 -14.835 -5.597 18.528 647 HH22 ARG 70 HH22 ARG 70 -15.487 -6.134 20.062 648 H LEU 71 H LEU 71 -18.619 -9.502 11.082 649 HA LEU 71 HA LEU 71 -19.546 -6.825 10.221 650 HB2 LEU 71 HB2 LEU 71 -19.406 -9.512 8.774 651 HB3 LEU 71 HB3 LEU 71 -19.897 -8.003 8.027 652 HG LEU 71 HG LEU 71 -17.116 -8.540 9.165 653 HD11 LEU 71 HD11 LEU 71 -18.107 -8.377 6.293 654 HD12 LEU 71 HD12 LEU 71 -16.430 -8.639 6.807 655 HD13 LEU 71 HD13 LEU 71 -17.662 -9.873 7.134 656 HD21 LEU 71 HD21 LEU 71 -16.506 -6.476 7.917 657 HD22 LEU 71 HD22 LEU 71 -18.210 -6.216 7.507 658 HD23 LEU 71 HD23 LEU 71 -17.664 -6.131 9.201 659 H GLN 72 H GLN 72 -21.730 -6.416 9.501 660 HA GLN 72 HA GLN 72 -23.757 -7.845 10.988 661 HB2 GLN 72 HB2 GLN 72 -23.893 -5.451 9.147 662 HB3 GLN 72 HB3 GLN 72 -25.302 -6.138 9.980 663 HG2 GLN 72 HG2 GLN 72 -24.237 -5.816 12.176 664 HG3 GLN 72 HG3 GLN 72 -22.799 -5.142 11.416 665 HE21 GLN 72 HE21 GLN 72 -24.735 -2.212 12.533 666 HE22 GLN 72 HE22 GLN 72 -23.802 -3.516 13.255 667 H LEU 73 H LEU 73 -22.665 -9.651 9.355 668 HA LEU 73 HA LEU 73 -24.501 -10.303 7.122 669 HB2 LEU 73 HB2 LEU 73 -22.117 -11.718 8.381 670 HB3 LEU 73 HB3 LEU 73 -23.053 -12.393 7.054 671 HG LEU 73 HG LEU 73 -21.626 -9.697 6.845 672 HD11 LEU 73 HD11 LEU 73 -20.646 -12.458 6.034 673 HD12 LEU 73 HD12 LEU 73 -19.877 -10.917 5.589 674 HD13 LEU 73 HD13 LEU 73 -19.948 -11.407 7.279 675 HD21 LEU 73 HD21 LEU 73 -21.803 -10.137 4.421 676 HD22 LEU 73 HD22 LEU 73 -22.690 -11.640 4.739 677 HD23 LEU 73 HD23 LEU 73 -23.407 -10.064 5.163 678 H ASN 74 H ASN 74 -25.557 -12.446 7.168 679 HA ASN 74 HA ASN 74 -26.427 -13.501 9.777 680 HB2 ASN 74 HB2 ASN 74 -27.886 -11.527 9.403 681 HB3 ASN 74 HB3 ASN 74 -28.297 -12.098 7.793 682 HD21 ASN 74 HD21 ASN 74 -30.346 -13.539 10.969 683 HD22 ASN 74 HD22 ASN 74 -29.035 -12.391 11.201 684 H ALA 75 H ALA 75 -27.599 -15.568 9.511 685 HA ALA 75 HA ALA 75 -26.492 -17.273 7.569 686 HB1 ALA 75 HB1 ALA 75 -29.040 -17.607 9.210 687 HB2 ALA 75 HB2 ALA 75 -28.105 -18.913 8.455 688 HB3 ALA 75 HB3 ALA 75 -27.387 -17.960 9.765 689 H ASN 76 H ASN 76 -29.374 -15.270 7.225 690 HA ASN 76 HA ASN 76 -30.449 -16.625 4.887 691 HB2 ASN 76 HB2 ASN 76 -30.846 -13.837 6.066 692 HB3 ASN 76 HB3 ASN 76 -31.692 -14.422 4.636 693 HD21 ASN 76 HD21 ASN 76 -32.985 -15.647 8.271 694 HD22 ASN 76 HD22 ASN 76 -31.540 -14.643 8.125 695 H GLN 77 H GLN 77 -27.706 -14.517 5.276 696 HA GLN 77 HA GLN 77 -27.705 -13.651 2.435 697 HB2 GLN 77 HB2 GLN 77 -25.661 -13.017 4.600 698 HB3 GLN 77 HB3 GLN 77 -25.846 -12.244 3.038 699 HG2 GLN 77 HG2 GLN 77 -27.664 -12.008 5.467 700 HG3 GLN 77 HG3 GLN 77 -26.695 -10.746 4.723 701 HE21 GLN 77 HE21 GLN 77 -29.079 -10.372 1.935 702 HE22 GLN 77 HE22 GLN 77 -27.349 -10.323 2.243 703 H ALA 78 H ALA 78 -26.356 -14.539 0.910 704 HA ALA 78 HA ALA 78 -24.693 -16.871 1.568 705 HB1 ALA 78 HB1 ALA 78 -24.213 -16.881 -0.833 706 HB2 ALA 78 HB2 ALA 78 -25.961 -16.742 -0.549 707 HB3 ALA 78 HB3 ALA 78 -25.020 -15.307 -1.028 708 H PHE 79 H PHE 79 -22.485 -16.861 1.911 709 HA PHE 79 HA PHE 79 -20.918 -14.431 1.454 710 HB2 PHE 79 HB2 PHE 79 -21.687 -13.716 3.473 711 HB3 PHE 79 HB3 PHE 79 -21.743 -15.331 4.159 712 HD1 PHE 79 HD1 PHE 79 -19.290 -12.753 2.986 713 HD2 PHE 79 HD2 PHE 79 -20.006 -16.130 5.559 714 HE1 PHE 79 HE1 PHE 79 -17.118 -12.337 4.146 715 HE2 PHE 79 HE2 PHE 79 -17.813 -15.753 6.663 716 HZ PHE 79 HZ PHE 79 -16.393 -13.836 5.986 717 H PHE 80 H PHE 80 -18.901 -14.591 0.953 718 HA PHE 80 HA PHE 80 -17.356 -17.009 1.677 719 HB2 PHE 80 HB2 PHE 80 -17.780 -15.943 -1.131 720 HB3 PHE 80 HB3 PHE 80 -16.580 -17.139 -0.687 721 HD1 PHE 80 HD1 PHE 80 -20.139 -16.541 -1.284 722 HD2 PHE 80 HD2 PHE 80 -17.222 -19.435 -0.006 723 HE1 PHE 80 HE1 PHE 80 -21.796 -18.364 -1.646 724 HE2 PHE 80 HE2 PHE 80 -18.880 -21.262 -0.361 725 HZ PHE 80 HZ PHE 80 -21.162 -20.724 -1.184 726 H LEU 81 H LEU 81 -15.248 -16.741 2.086 727 HA LEU 81 HA LEU 81 -13.910 -14.137 1.412 728 HB2 LEU 81 HB2 LEU 81 -13.170 -16.288 3.450 729 HB3 LEU 81 HB3 LEU 81 -12.167 -14.902 3.034 730 HG LEU 81 HG LEU 81 -14.866 -14.845 4.427 731 HD11 LEU 81 HD11 LEU 81 -13.561 -13.940 6.297 732 HD12 LEU 81 HD12 LEU 81 -12.877 -15.494 5.798 733 HD13 LEU 81 HD13 LEU 81 -12.076 -13.983 5.322 734 HD21 LEU 81 HD21 LEU 81 -14.781 -12.855 3.016 735 HD22 LEU 81 HD22 LEU 81 -14.417 -12.372 4.670 736 HD23 LEU 81 HD23 LEU 81 -13.090 -12.537 3.495 737 H LEU 82 H LEU 82 -13.462 -14.493 -0.715 738 HA LEU 82 HA LEU 82 -12.443 -17.064 -1.650 739 HB2 LEU 82 HB2 LEU 82 -12.642 -14.406 -3.106 740 HB3 LEU 82 HB3 LEU 82 -12.429 -15.987 -3.836 741 HG LEU 82 HG LEU 82 -14.926 -15.034 -2.346 742 HD11 LEU 82 HD11 LEU 82 -14.367 -15.558 -5.298 743 HD12 LEU 82 HD12 LEU 82 -15.954 -15.181 -4.599 744 HD13 LEU 82 HD13 LEU 82 -14.654 -13.975 -4.531 745 HD21 LEU 82 HD21 LEU 82 -15.922 -17.133 -3.200 746 HD22 LEU 82 HD22 LEU 82 -14.336 -17.637 -3.815 747 HD23 LEU 82 HD23 LEU 82 -14.620 -17.466 -2.062 748 H VAL 83 H VAL 83 -10.524 -17.455 -0.567 749 HA VAL 83 HA VAL 83 -8.391 -15.497 -0.476 750 HB VAL 83 HB VAL 83 -8.684 -17.150 1.271 751 HG11 VAL 83 HG11 VAL 83 -7.553 -19.215 -0.659 752 HG12 VAL 83 HG12 VAL 83 -7.911 -19.423 1.067 753 HG13 VAL 83 HG13 VAL 83 -9.231 -19.166 -0.082 754 HG21 VAL 83 HG21 VAL 83 -6.529 -15.998 0.948 755 HG22 VAL 83 HG22 VAL 83 -6.321 -17.627 1.590 756 HG23 VAL 83 HG23 VAL 83 -5.982 -17.306 -0.122 757 H ASN 84 H ASN 84 -6.977 -14.969 -1.949 758 HA ASN 84 HA ASN 84 -6.308 -14.640 -4.107 759 HB2 ASN 84 HB2 ASN 84 -4.666 -16.230 -3.119 760 HB3 ASN 84 HB3 ASN 84 -5.559 -17.570 -3.849 761 HD21 ASN 84 HD21 ASN 84 -3.140 -17.264 -6.413 762 HD22 ASN 84 HD22 ASN 84 -3.714 -18.204 -5.020 763 H GLY 85 H GLY 85 -9.094 -15.068 -4.002 764 HA2 GLY 85 HA2 GLY 85 -10.694 -14.960 -5.672 765 HA3 GLY 85 HA3 GLY 85 -9.583 -15.691 -6.823 766 H HIS 86 H HIS 86 -9.760 -17.821 -4.144 767 HA HIS 86 HA HIS 86 -12.267 -19.131 -5.149 768 HB2 HIS 86 HB2 HIS 86 -10.286 -20.193 -6.207 769 HB3 HIS 86 HB3 HIS 86 -9.643 -20.585 -4.619 770 HD1 HIS 86 HD1 HIS 86 -10.440 -22.921 -3.685 771 HD2 HIS 86 HD2 HIS 86 -12.926 -21.277 -6.689 772 HE1 HIS 86 HE1 HIS 86 -12.281 -24.664 -4.151 773 HE2 HIS 86 HE2 HIS 86 -13.774 -23.668 -5.992 774 H SER 87 H SER 87 -13.431 -20.437 -3.690 775 HA SER 87 HA SER 87 -13.419 -19.446 -0.982 776 HB2 SER 87 HB2 SER 87 -15.495 -20.055 -2.090 777 HB3 SER 87 HB3 SER 87 -14.938 -21.736 -2.262 778 HG SER 87 HG SER 87 -16.157 -21.703 -0.424 779 H MET 88 H MET 88 -12.873 -20.322 0.905 780 HA MET 88 HA MET 88 -12.092 -23.163 1.161 781 HB2 MET 88 HB2 MET 88 -10.316 -20.871 2.097 782 HB3 MET 88 HB3 MET 88 -10.160 -22.535 2.654 783 HG2 MET 88 HG2 MET 88 -9.853 -23.244 0.245 784 HG3 MET 88 HG3 MET 88 -9.714 -21.521 -0.150 785 HE1 MET 88 HE1 MET 88 -5.986 -22.562 -0.457 786 HE2 MET 88 HE2 MET 88 -7.419 -23.461 -1.005 787 HE3 MET 88 HE3 MET 88 -7.350 -21.691 -1.190 788 H VAL 89 H VAL 89 -14.516 -21.593 1.890 789 HA VAL 89 HA VAL 89 -14.373 -20.751 4.615 790 HB VAL 89 HB VAL 89 -16.755 -20.540 4.614 791 HG11 VAL 89 HG11 VAL 89 -15.718 -19.778 1.848 792 HG12 VAL 89 HG12 VAL 89 -17.077 -19.066 2.732 793 HG13 VAL 89 HG13 VAL 89 -15.427 -18.871 3.345 794 HG21 VAL 89 HG21 VAL 89 -18.167 -21.235 2.712 795 HG22 VAL 89 HG22 VAL 89 -16.810 -22.136 2.020 796 HG23 VAL 89 HG23 VAL 89 -17.506 -22.620 3.584 797 H SER 90 H SER 90 -15.010 -23.977 3.386 798 HA SER 90 HA SER 90 -15.856 -25.024 6.003 799 HB2 SER 90 HB2 SER 90 -16.030 -27.150 4.752 800 HB3 SER 90 HB3 SER 90 -16.914 -25.835 3.969 801 HG SER 90 HG SER 90 -15.624 -27.064 2.479 802 H VAL 91 H VAL 91 -12.811 -24.271 4.762 803 HA VAL 91 HA VAL 91 -11.465 -26.782 5.322 804 HB VAL 91 HB VAL 91 -10.322 -24.077 4.569 805 HG11 VAL 91 HG11 VAL 91 -9.041 -26.841 4.576 806 HG12 VAL 91 HG12 VAL 91 -8.355 -25.392 3.804 807 HG13 VAL 91 HG13 VAL 91 -8.568 -25.419 5.551 808 HG21 VAL 91 HG21 VAL 91 -10.140 -25.064 2.308 809 HG22 VAL 91 HG22 VAL 91 -10.926 -26.549 2.880 810 HG23 VAL 91 HG23 VAL 91 -11.834 -25.030 2.817 811 H SER 92 H SER 92 -10.615 -27.495 7.131 812 HA SER 92 HA SER 92 -10.567 -25.904 9.569 813 HB2 SER 92 HB2 SER 92 -9.958 -28.076 10.596 814 HB3 SER 92 HB3 SER 92 -11.387 -28.194 9.554 815 HG SER 92 HG SER 92 -9.868 -29.909 9.179 816 H THR 93 H THR 93 -8.261 -26.166 7.158 817 HA THR 93 HA THR 93 -5.928 -26.587 8.661 818 HB THR 93 HB THR 93 -6.306 -26.828 6.133 819 HG1 THR 93 HG1 THR 93 -4.113 -26.986 5.976 820 HG21 THR 93 HG21 THR 93 -5.313 -25.155 4.738 821 HG22 THR 93 HG22 THR 93 -6.537 -24.308 5.703 822 HG23 THR 93 HG23 THR 93 -4.824 -24.164 6.126 823 HA PRO 94 HA PRO 94 -4.885 -22.814 10.736 824 HB2 PRO 94 HB2 PRO 94 -2.063 -23.489 9.892 825 HB3 PRO 94 HB3 PRO 94 -2.656 -22.937 11.489 826 HG2 PRO 94 HG2 PRO 94 -2.149 -25.550 11.095 827 HG3 PRO 94 HG3 PRO 94 -3.671 -25.069 11.924 828 HD2 PRO 94 HD2 PRO 94 -3.268 -25.849 9.028 829 HD3 PRO 94 HD3 PRO 94 -4.532 -26.370 10.177 830 H ILE 95 H ILE 95 -4.437 -20.616 10.303 831 HA ILE 95 HA ILE 95 -4.651 -19.735 7.627 832 HB ILE 95 HB ILE 95 -5.362 -18.467 9.632 833 HG12 ILE 95 HG12 ILE 95 -4.703 -16.215 8.952 834 HG13 ILE 95 HG13 ILE 95 -3.411 -16.840 7.938 835 HG21 ILE 95 HG21 ILE 95 -3.366 -18.872 11.090 836 HG22 ILE 95 HG22 ILE 95 -2.403 -17.797 10.057 837 HG23 ILE 95 HG23 ILE 95 -3.777 -17.171 10.973 838 HD11 ILE 95 HD11 ILE 95 -6.387 -17.430 7.543 839 HD12 ILE 95 HD12 ILE 95 -5.488 -16.142 6.721 840 HD13 ILE 95 HD13 ILE 95 -5.069 -17.834 6.419 841 H SER 96 H SER 96 -1.734 -20.466 9.447 842 HA SER 96 HA SER 96 0.182 -19.261 7.651 843 HB2 SER 96 HB2 SER 96 1.756 -20.838 8.817 844 HB3 SER 96 HB3 SER 96 0.808 -19.816 9.910 845 HG SER 96 HG SER 96 0.562 -21.763 10.773 846 H GLU 97 H GLU 97 -1.424 -22.472 7.713 847 HA GLU 97 HA GLU 97 0.069 -23.504 5.421 848 HB2 GLU 97 HB2 GLU 97 -2.545 -24.403 6.696 849 HB3 GLU 97 HB3 GLU 97 -1.704 -25.271 5.426 850 HG2 GLU 97 HG2 GLU 97 -0.624 -24.701 8.224 851 HG3 GLU 97 HG3 GLU 97 -1.323 -26.217 7.681 852 H VAL 98 H VAL 98 -3.080 -21.848 5.860 853 HA VAL 98 HA VAL 98 -3.837 -21.831 3.085 854 HB VAL 98 HB VAL 98 -4.361 -19.655 5.137 855 HG11 VAL 98 HG11 VAL 98 -4.811 -18.920 2.818 856 HG12 VAL 98 HG12 VAL 98 -5.818 -20.350 2.552 857 HG13 VAL 98 HG13 VAL 98 -6.315 -19.112 3.727 858 HG21 VAL 98 HG21 VAL 98 -6.544 -20.698 5.468 859 HG22 VAL 98 HG22 VAL 98 -6.097 -22.046 4.398 860 HG23 VAL 98 HG23 VAL 98 -5.262 -21.806 5.953 861 H TYR 99 H TYR 99 -1.842 -19.497 4.993 862 HA TYR 99 HA TYR 99 -1.061 -17.951 2.766 863 HB2 TYR 99 HB2 TYR 99 -0.684 -16.867 4.703 864 HB3 TYR 99 HB3 TYR 99 0.053 -18.258 5.494 865 HD1 TYR 99 HD1 TYR 99 2.411 -18.593 5.482 866 HD2 TYR 99 HD2 TYR 99 0.633 -15.722 2.789 867 HE1 TYR 99 HE1 TYR 99 4.675 -17.841 4.783 868 HE2 TYR 99 HE2 TYR 99 2.911 -14.988 2.086 869 HH TYR 99 HH TYR 99 5.895 -16.416 3.447 870 H GLU 100 H GLU 100 0.776 -20.790 4.039 871 HA GLU 100 HA GLU 100 2.754 -20.685 2.035 872 HB2 GLU 100 HB2 GLU 100 3.001 -22.066 3.985 873 HB3 GLU 100 HB3 GLU 100 1.539 -22.969 3.612 874 HG2 GLU 100 HG2 GLU 100 3.491 -24.306 3.198 875 HG3 GLU 100 HG3 GLU 100 2.580 -24.053 1.722 876 H SER 101 H SER 101 -0.545 -21.915 1.775 877 HA SER 101 HA SER 101 -0.199 -23.112 -0.862 878 HB2 SER 101 HB2 SER 101 -2.710 -22.308 0.663 879 HB3 SER 101 HB3 SER 101 -2.663 -23.245 -0.836 880 HG SER 101 HG SER 101 -1.635 -23.970 1.717 881 H GLU 102 H GLU 102 -1.360 -19.930 0.284 882 HA GLU 102 HA GLU 102 -1.745 -19.000 -2.548 883 HB2 GLU 102 HB2 GLU 102 -3.465 -18.420 -0.124 884 HB3 GLU 102 HB3 GLU 102 -3.729 -17.785 -1.742 885 HG2 GLU 102 HG2 GLU 102 -3.957 -20.686 -0.857 886 HG3 GLU 102 HG3 GLU 102 -5.263 -19.590 -1.252 887 H LYS 103 H LYS 103 0.540 -18.570 -0.613 888 HA LYS 103 HA LYS 103 0.837 -15.913 0.024 889 HB2 LYS 103 HB2 LYS 103 3.293 -16.257 -0.297 890 HB3 LYS 103 HB3 LYS 103 2.473 -17.426 0.721 891 HG2 LYS 103 HG2 LYS 103 2.423 -19.025 -1.263 892 HG3 LYS 103 HG3 LYS 103 3.483 -17.875 -2.109 893 HD2 LYS 103 HD2 LYS 103 5.163 -18.111 -0.302 894 HD3 LYS 103 HD3 LYS 103 4.063 -19.177 0.595 895 HE2 LYS 103 HE2 LYS 103 4.076 -20.760 -1.359 896 HE3 LYS 103 HE3 LYS 103 5.286 -19.738 -2.146 897 HZ1 LYS 103 HZ1 LYS 103 6.336 -21.573 -0.936 898 HZ2 LYS 103 HZ2 LYS 103 6.760 -20.169 -0.212 899 HZ3 LYS 103 HZ3 LYS 103 5.614 -21.143 0.468 900 H ASP 104 H ASP 104 1.029 -14.066 -0.890 901 HA ASP 104 HA ASP 104 0.626 -13.821 -3.731 902 HB2 ASP 104 HB2 ASP 104 -0.756 -12.542 -2.504 903 HB3 ASP 104 HB3 ASP 104 0.505 -11.970 -1.415 904 H GLU 105 H GLU 105 1.674 -11.983 -5.011 905 HA GLU 105 HA GLU 105 4.274 -12.821 -5.759 906 HB2 GLU 105 HB2 GLU 105 2.785 -10.216 -6.298 907 HB3 GLU 105 HB3 GLU 105 4.264 -10.743 -7.120 908 HG2 GLU 105 HG2 GLU 105 3.062 -12.831 -7.847 909 HG3 GLU 105 HG3 GLU 105 1.567 -12.160 -7.182 910 H ASP 106 H ASP 106 3.318 -10.106 -3.627 911 HA ASP 106 HA ASP 106 6.077 -10.039 -2.621 912 HB2 ASP 106 HB2 ASP 106 4.790 -7.599 -3.801 913 HB3 ASP 106 HB3 ASP 106 6.005 -7.484 -2.546 914 H GLY 107 H GLY 107 2.718 -9.440 -1.912 915 HA2 GLY 107 HA2 GLY 107 3.276 -8.735 0.907 916 HA3 GLY 107 HA3 GLY 107 1.702 -8.894 0.125 917 H PHE 108 H PHE 108 1.464 -10.052 2.320 918 HA PHE 108 HA PHE 108 2.230 -12.872 2.178 919 HB2 PHE 108 HB2 PHE 108 1.163 -11.278 4.395 920 HB3 PHE 108 HB3 PHE 108 0.764 -12.987 4.337 921 HD1 PHE 108 HD1 PHE 108 3.903 -10.944 3.669 922 HD2 PHE 108 HD2 PHE 108 2.114 -14.338 5.630 923 HE1 PHE 108 HE1 PHE 108 6.105 -11.561 4.616 924 HE2 PHE 108 HE2 PHE 108 4.313 -14.960 6.565 925 HZ PHE 108 HZ PHE 108 6.325 -13.586 6.040 926 H LEU 109 H LEU 109 -1.079 -11.713 2.911 927 HA LEU 109 HA LEU 109 -2.002 -13.704 0.878 928 HB2 LEU 109 HB2 LEU 109 -1.686 -14.620 3.195 929 HB3 LEU 109 HB3 LEU 109 -2.878 -13.473 3.775 930 HG LEU 109 HG LEU 109 -4.617 -14.596 2.367 931 HD11 LEU 109 HD11 LEU 109 -3.347 -15.565 0.551 932 HD12 LEU 109 HD12 LEU 109 -2.282 -16.433 1.677 933 HD13 LEU 109 HD13 LEU 109 -3.977 -16.912 1.503 934 HD21 LEU 109 HD21 LEU 109 -3.048 -16.498 4.166 935 HD22 LEU 109 HD22 LEU 109 -4.207 -15.273 4.733 936 HD23 LEU 109 HD23 LEU 109 -4.768 -16.626 3.733 937 H TYR 110 H TYR 110 -3.905 -13.378 -0.159 938 HA TYR 110 HA TYR 110 -5.504 -10.973 0.526 939 HB2 TYR 110 HB2 TYR 110 -4.496 -11.867 -2.122 940 HB3 TYR 110 HB3 TYR 110 -6.080 -11.142 -2.054 941 HD1 TYR 110 HD1 TYR 110 -2.502 -10.502 -1.089 942 HD2 TYR 110 HD2 TYR 110 -6.378 -8.827 -1.983 943 HE1 TYR 110 HE1 TYR 110 -1.512 -8.217 -1.137 944 HE2 TYR 110 HE2 TYR 110 -5.386 -6.560 -2.045 945 HH TYR 110 HH TYR 110 -1.877 -5.999 -1.662 946 H MET 111 H MET 111 -7.658 -10.976 0.670 947 HA MET 111 HA MET 111 -9.116 -13.433 -0.225 948 HB2 MET 111 HB2 MET 111 -9.528 -11.953 2.407 949 HB3 MET 111 HB3 MET 111 -10.541 -13.266 1.784 950 HG2 MET 111 HG2 MET 111 -8.521 -14.748 1.762 951 HG3 MET 111 HG3 MET 111 -7.597 -13.452 2.526 952 HE1 MET 111 HE1 MET 111 -6.762 -15.104 4.315 953 HE2 MET 111 HE2 MET 111 -7.819 -16.146 5.284 954 HE3 MET 111 HE3 MET 111 -7.693 -16.402 3.538 955 H VAL 112 H VAL 112 -10.599 -12.972 -1.709 956 HA VAL 112 HA VAL 112 -11.726 -10.245 -1.812 957 HB VAL 112 HB VAL 112 -12.459 -12.323 -3.823 958 HG11 VAL 112 HG11 VAL 112 -12.186 -9.291 -3.935 959 HG12 VAL 112 HG12 VAL 112 -12.808 -10.349 -5.221 960 HG13 VAL 112 HG13 VAL 112 -13.713 -10.168 -3.703 961 HG21 VAL 112 HG21 VAL 112 -9.971 -10.577 -3.854 962 HG22 VAL 112 HG22 VAL 112 -10.026 -12.358 -3.888 963 HG23 VAL 112 HG23 VAL 112 -10.633 -11.439 -5.265 964 H TYR 113 H TYR 113 -13.484 -9.711 -0.816 965 HA TYR 113 HA TYR 113 -15.195 -11.765 0.374 966 HB2 TYR 113 HB2 TYR 113 -14.478 -10.398 1.964 967 HB3 TYR 113 HB3 TYR 113 -14.542 -8.966 0.969 968 HD1 TYR 113 HD1 TYR 113 -17.359 -11.346 1.855 969 HD2 TYR 113 HD2 TYR 113 -15.596 -7.426 2.285 970 HE1 TYR 113 HE1 TYR 113 -19.331 -10.565 3.194 971 HE2 TYR 113 HE2 TYR 113 -17.574 -6.686 3.587 972 HH TYR 113 HH TYR 113 -19.588 -7.277 4.495 973 H ALA 114 H ALA 114 -16.931 -12.586 -0.493 974 HA ALA 114 HA ALA 114 -18.647 -10.926 -2.289 975 HB1 ALA 114 HB1 ALA 114 -18.332 -12.508 -4.118 976 HB2 ALA 114 HB2 ALA 114 -16.736 -11.952 -3.592 977 HB3 ALA 114 HB3 ALA 114 -17.308 -13.553 -3.096 978 H SER 115 H SER 115 -20.631 -11.974 -2.976 979 HA SER 115 HA SER 115 -21.755 -13.879 -1.032 980 HB2 SER 115 HB2 SER 115 -23.876 -13.379 -2.332 981 HB3 SER 115 HB3 SER 115 -23.133 -12.034 -1.457 982 HG SER 115 HG SER 115 -23.753 -11.430 -3.562 983 H GLN 116 H GLN 116 -20.079 -14.247 -3.922 984 HA GLN 116 HA GLN 116 -21.445 -16.812 -4.638 985 HB2 GLN 116 HB2 GLN 116 -19.731 -14.894 -6.256 986 HB3 GLN 116 HB3 GLN 116 -20.042 -16.542 -6.764 987 HG2 GLN 116 HG2 GLN 116 -21.541 -14.993 -7.896 988 HG3 GLN 116 HG3 GLN 116 -22.420 -16.176 -6.931 989 HE21 GLN 116 HE21 GLN 116 -22.359 -12.359 -5.363 990 HE22 GLN 116 HE22 GLN 116 -21.029 -12.819 -6.432 991 H GLU 117 H GLU 117 -20.258 -18.713 -4.917 992 HA GLU 117 HA GLU 117 -17.976 -19.122 -3.232 993 HB2 GLU 117 HB2 GLU 117 -19.742 -20.773 -3.763 994 HB3 GLU 117 HB3 GLU 117 -19.153 -20.860 -5.435 995 HG2 GLU 117 HG2 GLU 117 -17.017 -21.784 -4.663 996 HG3 GLU 117 HG3 GLU 117 -17.516 -21.589 -2.973 997 H THR 118 H THR 118 -18.209 -18.280 -6.615 998 HA THR 118 HA THR 118 -15.400 -17.601 -6.719 999 HB THR 118 HB THR 118 -15.094 -19.906 -7.376 1000 HG1 THR 118 HG1 THR 118 -14.151 -19.506 -9.354 1001 HG21 THR 118 HG21 THR 118 -17.144 -19.460 -9.599 1002 HG22 THR 118 HG22 THR 118 -16.121 -20.899 -9.363 1003 HG23 THR 118 HG23 THR 118 -17.363 -20.508 -8.173 1004 H PHE 119 H PHE 119 -14.980 -16.105 -8.413 1005 HA PHE 119 HA PHE 119 -17.359 -15.005 -9.753 1006 HB2 PHE 119 HB2 PHE 119 -15.822 -13.120 -10.440 1007 HB3 PHE 119 HB3 PHE 119 -16.423 -13.258 -8.804 1008 HD1 PHE 119 HD1 PHE 119 -14.953 -13.150 -6.969 1009 HD2 PHE 119 HD2 PHE 119 -13.413 -14.097 -10.885 1010 HE1 PHE 119 HE1 PHE 119 -12.625 -12.978 -6.104 1011 HE2 PHE 119 HE2 PHE 119 -11.087 -13.925 -10.015 1012 HZ PHE 119 HZ PHE 119 -10.691 -13.344 -7.630 1013 H GLY 120 H GLY 120 -15.310 -17.373 -10.557 1014 HA2 GLY 120 HA2 GLY 120 -15.434 -18.618 -12.562 1015 HA3 GLY 120 HA3 GLY 120 -16.018 -17.209 -13.442 1016 H1 ASP 10 H1 ASP 10 -13.107 -2.981 17.704 1017 H2 ASP 10 H2 ASP 10 -13.935 -1.624 18.125 1018 H3 ASP 10 H3 ASP 10 -13.089 -1.674 16.705 1019 HA ASP 10 HA ASP 10 -11.925 -0.363 18.409 1020 HB2 ASP 10 HB2 ASP 10 -12.710 -1.853 20.307 1021 HB3 ASP 10 HB3 ASP 10 -11.605 -3.103 19.739 1022 H TYR 11 H TYR 11 -9.782 -0.037 17.810 1023 HA TYR 11 HA TYR 11 -8.128 -0.077 16.385 1024 HB2 TYR 11 HB2 TYR 11 -7.963 -2.925 17.233 1025 HB3 TYR 11 HB3 TYR 11 -6.977 -2.366 15.899 1026 HD1 TYR 11 HD1 TYR 11 -7.120 -2.601 19.455 1027 HD2 TYR 11 HD2 TYR 11 -5.601 -0.212 16.187 1028 HE1 TYR 11 HE1 TYR 11 -5.375 -1.669 20.956 1029 HE2 TYR 11 HE2 TYR 11 -3.855 0.735 17.711 1030 HH TYR 11 HH TYR 11 -3.596 -0.206 21.161 1031 H GLU 12 H GLU 12 -9.778 -2.983 15.238 1032 HA GLU 12 HA GLU 12 -9.770 -3.874 13.112 1033 HB2 GLU 12 HB2 GLU 12 -11.376 -2.752 11.659 1034 HB3 GLU 12 HB3 GLU 12 -11.928 -2.979 13.288 1035 HG2 GLU 12 HG2 GLU 12 -10.745 -0.339 12.377 1036 HG3 GLU 12 HG3 GLU 12 -12.400 -0.763 12.025 1037 H SER 13 H SER 13 -9.945 -2.124 10.589 1038 HA SER 13 HA SER 13 -7.246 -2.745 9.868 1039 HB2 SER 13 HB2 SER 13 -9.490 -1.478 8.261 1040 HB3 SER 13 HB3 SER 13 -8.033 -2.258 7.622 1041 HG SER 13 HG SER 13 -8.823 -4.140 9.052 1042 H ASP 14 H ASP 14 -6.735 -0.802 11.647 1043 HA ASP 14 HA ASP 14 -5.918 1.551 10.054 1044 HB2 ASP 14 HB2 ASP 14 -6.184 1.257 12.998 1045 HB3 ASP 14 HB3 ASP 14 -5.228 2.550 12.268 1046 H ASP 15 H ASP 15 -3.609 1.020 12.577 1047 HA ASP 15 HA ASP 15 -1.651 -0.078 10.693 1048 HB2 ASP 15 HB2 ASP 15 -1.885 2.255 9.919 1049 HB3 ASP 15 HB3 ASP 15 -1.542 2.836 11.547 1050 H ASP 16 H ASP 16 0.488 -0.195 11.494 1051 HA ASP 16 HA ASP 16 2.020 -0.996 12.859 1052 HB2 ASP 16 HB2 ASP 16 2.576 1.205 12.825 1053 HB3 ASP 16 HB3 ASP 16 1.331 1.652 13.987 1054 H SER 17 H SER 17 0.425 0.148 15.804 1055 HA SER 17 HA SER 17 1.335 -2.290 17.130 1056 HB2 SER 17 HB2 SER 17 0.624 -1.101 19.182 1057 HB3 SER 17 HB3 SER 17 1.712 -0.141 18.169 1058 HG SER 17 HG SER 17 -0.109 1.074 18.923 1059 H TYR 18 H TYR 18 -1.359 -1.781 15.405 1060 HA TYR 18 HA TYR 18 -3.472 -2.291 17.086 1061 HB2 TYR 18 HB2 TYR 18 -4.809 -2.596 15.045 1062 HB3 TYR 18 HB3 TYR 18 -3.826 -1.153 15.143 1063 HD1 TYR 18 HD1 TYR 18 -5.086 -1.592 12.849 1064 HD2 TYR 18 HD2 TYR 18 -1.368 -3.433 14.005 1065 HE1 TYR 18 HE1 TYR 18 -4.558 -2.097 10.444 1066 HE2 TYR 18 HE2 TYR 18 -0.813 -3.827 11.642 1067 HH TYR 18 HH TYR 18 -1.537 -3.689 9.391 1068 H GLU 19 H GLU 19 -5.027 -3.791 17.491 1069 HA GLU 19 HA GLU 19 -4.327 -6.633 17.454 1070 HB2 GLU 19 HB2 GLU 19 -6.896 -5.143 18.104 1071 HB3 GLU 19 HB3 GLU 19 -6.701 -6.873 18.320 1072 HG2 GLU 19 HG2 GLU 19 -5.011 -4.758 19.726 1073 HG3 GLU 19 HG3 GLU 19 -6.444 -5.514 20.404 1074 H VAL 20 H VAL 20 -6.173 -4.551 15.362 1075 HA VAL 20 HA VAL 20 -7.085 -4.677 13.395 1076 HB VAL 20 HB VAL 20 -5.691 -7.062 12.381 1077 HG11 VAL 20 HG11 VAL 20 -5.780 -4.138 11.545 1078 HG12 VAL 20 HG12 VAL 20 -5.158 -5.477 10.569 1079 HG13 VAL 20 HG13 VAL 20 -6.890 -5.373 10.968 1080 HG21 VAL 20 HG21 VAL 20 -3.909 -6.473 13.820 1081 HG22 VAL 20 HG22 VAL 20 -3.538 -5.696 12.270 1082 HG23 VAL 20 HG23 VAL 20 -4.201 -4.749 13.595 1083 H LEU 21 H LEU 21 -7.437 -7.938 14.701 1084 HA LEU 21 HA LEU 21 -9.618 -8.613 12.823 1085 HB2 LEU 21 HB2 LEU 21 -8.418 -9.877 15.326 1086 HB3 LEU 21 HB3 LEU 21 -9.878 -10.533 14.607 1087 HG LEU 21 HG LEU 21 -7.382 -10.171 12.939 1088 HD11 LEU 21 HD11 LEU 21 -6.861 -12.535 13.403 1089 HD12 LEU 21 HD12 LEU 21 -6.776 -11.561 14.876 1090 HD13 LEU 21 HD13 LEU 21 -8.186 -12.607 14.590 1091 HD21 LEU 21 HD21 LEU 21 -9.721 -12.115 12.724 1092 HD22 LEU 21 HD22 LEU 21 -9.572 -10.622 11.768 1093 HD23 LEU 21 HD23 LEU 21 -8.398 -11.928 11.562 1094 H ASP 22 H ASP 22 -9.436 -6.494 15.417 1095 HA ASP 22 HA ASP 22 -10.777 -5.709 16.979 1096 HB2 ASP 22 HB2 ASP 22 -11.892 -4.693 15.244 1097 HB3 ASP 22 HB3 ASP 22 -12.715 -6.158 14.765 1098 H LEU 23 H LEU 23 -9.868 -8.124 17.298 1099 HA LEU 23 HA LEU 23 -11.269 -9.356 19.515 1100 HB2 LEU 23 HB2 LEU 23 -12.433 -10.606 17.910 1101 HB3 LEU 23 HB3 LEU 23 -11.125 -10.603 16.749 1102 HG LEU 23 HG LEU 23 -10.537 -12.108 19.266 1103 HD11 LEU 23 HD11 LEU 23 -12.884 -12.730 18.953 1104 HD12 LEU 23 HD12 LEU 23 -12.563 -13.142 17.250 1105 HD13 LEU 23 HD13 LEU 23 -11.809 -14.081 18.554 1106 HD21 LEU 23 HD21 LEU 23 -8.993 -12.111 17.274 1107 HD22 LEU 23 HD22 LEU 23 -9.579 -13.724 17.685 1108 HD23 LEU 23 HD23 LEU 23 -10.280 -12.858 16.309 1109 H THR 24 H THR 24 -9.631 -10.179 20.876 1110 HA THR 24 HA THR 24 -6.923 -9.512 20.083 1111 HB THR 24 HB THR 24 -6.207 -9.492 22.168 1112 HG1 THR 24 HG1 THR 24 -7.160 -10.730 23.859 1113 HG21 THR 24 HG21 THR 24 -8.174 -7.931 22.006 1114 HG22 THR 24 HG22 THR 24 -9.182 -9.188 22.777 1115 HG23 THR 24 HG23 THR 24 -7.814 -8.481 23.650 1116 H GLU 25 H GLU 25 -5.008 -10.866 20.615 1117 HA GLU 25 HA GLU 25 -5.124 -13.397 19.216 1118 HB2 GLU 25 HB2 GLU 25 -2.768 -13.550 19.711 1119 HB3 GLU 25 HB3 GLU 25 -3.164 -11.902 19.208 1120 HG2 GLU 25 HG2 GLU 25 -3.185 -11.211 21.624 1121 HG3 GLU 25 HG3 GLU 25 -2.709 -12.851 22.072 1122 H TYR 26 H TYR 26 -6.147 -12.719 22.334 1123 HA TYR 26 HA TYR 26 -6.416 -13.770 24.233 1124 HB2 TYR 26 HB2 TYR 26 -7.237 -15.895 22.320 1125 HB3 TYR 26 HB3 TYR 26 -7.392 -16.103 24.057 1126 HD1 TYR 26 HD1 TYR 26 -8.646 -14.355 25.445 1127 HD2 TYR 26 HD2 TYR 26 -8.932 -14.641 21.149 1128 HE1 TYR 26 HE1 TYR 26 -10.786 -13.079 25.503 1129 HE2 TYR 26 HE2 TYR 26 -11.087 -13.385 21.212 1130 HH TYR 26 HH TYR 26 -12.538 -12.213 24.273 Start of MODEL 5 1 H1 MET 1 H1 MET 1 -7.250 1.951 7.134 2 H2 MET 1 H2 MET 1 -7.130 1.787 5.515 3 H3 MET 1 H3 MET 1 -6.478 3.106 6.264 4 HA MET 1 HA MET 1 -8.599 4.001 6.833 5 HB2 MET 1 HB2 MET 1 -8.401 3.163 3.916 6 HB3 MET 1 HB3 MET 1 -9.750 4.115 4.527 7 HG2 MET 1 HG2 MET 1 -8.303 5.904 5.231 8 HG3 MET 1 HG3 MET 1 -6.856 5.003 4.757 9 HE1 MET 1 HE1 MET 1 -8.405 8.015 3.841 10 HE2 MET 1 HE2 MET 1 -6.674 7.679 3.626 11 HE3 MET 1 HE3 MET 1 -7.668 8.142 2.231 12 HA PRO 2 HA PRO 2 -11.670 0.675 7.342 13 HB2 PRO 2 HB2 PRO 2 -12.678 1.471 9.741 14 HB3 PRO 2 HB3 PRO 2 -11.181 0.527 9.581 15 HG2 PRO 2 HG2 PRO 2 -11.522 3.482 10.092 16 HG3 PRO 2 HG3 PRO 2 -10.327 2.345 10.796 17 HD2 PRO 2 HD2 PRO 2 -9.876 4.092 8.629 18 HD3 PRO 2 HD3 PRO 2 -8.892 2.654 9.021 19 H SER 3 H SER 3 -11.734 4.156 7.220 20 HA SER 3 HA SER 3 -14.502 4.731 6.932 21 HB2 SER 3 HB2 SER 3 -13.569 6.820 5.870 22 HB3 SER 3 HB3 SER 3 -12.899 6.434 7.462 23 HG SER 3 HG SER 3 -11.284 7.013 5.880 24 H GLU 4 H GLU 4 -15.196 5.884 4.769 25 HA GLU 4 HA GLU 4 -15.910 3.842 3.014 26 HB2 GLU 4 HB2 GLU 4 -15.957 6.859 2.707 27 HB3 GLU 4 HB3 GLU 4 -16.621 5.803 1.475 28 HG2 GLU 4 HG2 GLU 4 -17.525 5.822 4.384 29 HG3 GLU 4 HG3 GLU 4 -18.305 6.704 3.074 30 H LYS 5 H LYS 5 -15.632 3.377 0.927 31 HA LYS 5 HA LYS 5 -14.541 2.605 -0.872 32 HB2 LYS 5 HB2 LYS 5 -12.566 4.895 -0.721 33 HB3 LYS 5 HB3 LYS 5 -12.937 3.900 -2.112 34 HG2 LYS 5 HG2 LYS 5 -14.792 5.939 -0.813 35 HG3 LYS 5 HG3 LYS 5 -13.890 6.125 -2.315 36 HD2 LYS 5 HD2 LYS 5 -15.207 4.268 -3.344 37 HD3 LYS 5 HD3 LYS 5 -16.099 4.077 -1.835 38 HE2 LYS 5 HE2 LYS 5 -17.485 5.327 -3.324 39 HE3 LYS 5 HE3 LYS 5 -16.968 6.393 -2.023 40 HZ1 LYS 5 HZ1 LYS 5 -15.750 6.333 -4.747 41 HZ2 LYS 5 HZ2 LYS 5 -16.812 7.451 -4.227 42 HZ3 LYS 5 HZ3 LYS 5 -15.335 7.380 -3.552 43 H THR 6 H THR 6 -12.759 1.382 -1.605 44 HA THR 6 HA THR 6 -11.472 0.063 0.621 45 HB THR 6 HB THR 6 -12.497 -1.136 -1.274 46 HG1 THR 6 HG1 THR 6 -10.968 -2.768 -0.962 47 HG21 THR 6 HG21 THR 6 -9.785 -0.786 -2.627 48 HG22 THR 6 HG22 THR 6 -11.183 -1.738 -3.183 49 HG23 THR 6 HG23 THR 6 -11.278 0.024 -3.173 50 H PHE 7 H PHE 7 -9.165 -0.770 0.440 51 HA PHE 7 HA PHE 7 -7.668 1.425 1.364 52 HB2 PHE 7 HB2 PHE 7 -5.804 -0.119 1.641 53 HB3 PHE 7 HB3 PHE 7 -7.321 -0.817 2.178 54 HD1 PHE 7 HD1 PHE 7 -4.762 -0.855 -0.505 55 HD2 PHE 7 HD2 PHE 7 -8.251 -2.829 1.108 56 HE1 PHE 7 HE1 PHE 7 -4.370 -2.801 -2.012 57 HE2 PHE 7 HE2 PHE 7 -7.861 -4.747 -0.417 58 HZ PHE 7 HZ PHE 7 -5.917 -4.738 -1.967 59 H LYS 8 H LYS 8 -7.763 0.378 -1.966 60 HA LYS 8 HA LYS 8 -5.227 1.414 -2.813 61 HB2 LYS 8 HB2 LYS 8 -6.633 -0.145 -4.107 62 HB3 LYS 8 HB3 LYS 8 -7.852 1.104 -4.335 63 HG2 LYS 8 HG2 LYS 8 -6.459 0.745 -6.335 64 HG3 LYS 8 HG3 LYS 8 -6.353 2.402 -5.743 65 HD2 LYS 8 HD2 LYS 8 -4.139 1.917 -4.733 66 HD3 LYS 8 HD3 LYS 8 -4.302 0.211 -5.154 67 HE2 LYS 8 HE2 LYS 8 -2.781 1.305 -6.678 68 HE3 LYS 8 HE3 LYS 8 -4.221 0.751 -7.544 69 HZ1 LYS 8 HZ1 LYS 8 -3.532 3.031 -8.175 70 HZ2 LYS 8 HZ2 LYS 8 -5.037 3.047 -7.556 71 HZ3 LYS 8 HZ3 LYS 8 -3.771 3.571 -6.654 72 H GLN 9 H GLN 9 -8.023 3.115 -1.790 73 HA GLN 9 HA GLN 9 -7.572 5.703 -2.886 74 HB2 GLN 9 HB2 GLN 9 -9.585 4.963 -1.698 75 HB3 GLN 9 HB3 GLN 9 -8.672 4.782 -0.197 76 HG2 GLN 9 HG2 GLN 9 -8.373 7.181 0.003 77 HG3 GLN 9 HG3 GLN 9 -8.991 7.451 -1.633 78 HE21 GLN 9 HE21 GLN 9 -11.742 6.214 1.215 79 HE22 GLN 9 HE22 GLN 9 -10.035 5.929 1.494 80 H ARG 10 H ARG 10 -5.774 3.959 -0.403 81 HA ARG 10 HA ARG 10 -3.949 6.319 -0.063 82 HB2 ARG 10 HB2 ARG 10 -5.321 6.148 1.878 83 HB3 ARG 10 HB3 ARG 10 -4.982 4.425 2.073 84 HG2 ARG 10 HG2 ARG 10 -2.693 4.860 2.718 85 HG3 ARG 10 HG3 ARG 10 -2.822 6.570 2.249 86 HD2 ARG 10 HD2 ARG 10 -4.469 6.964 4.051 87 HD3 ARG 10 HD3 ARG 10 -4.472 5.251 4.445 88 HE ARG 10 HE ARG 10 -2.542 5.501 5.677 89 HH11 ARG 10 HH11 ARG 10 -2.798 8.452 3.764 90 HH12 ARG 10 HH12 ARG 10 -1.594 9.257 4.729 91 HH21 ARG 10 HH21 ARG 10 -0.622 8.211 6.415 92 HH22 ARG 10 HH22 ARG 10 -1.104 6.583 6.861 93 H ARG 11 H ARG 11 -4.006 2.693 -0.087 94 HA ARG 11 HA ARG 11 -1.044 2.740 0.065 95 HB2 ARG 11 HB2 ARG 11 -3.169 0.608 0.449 96 HB3 ARG 11 HB3 ARG 11 -1.499 0.145 0.173 97 HG2 ARG 11 HG2 ARG 11 -2.448 1.930 2.460 98 HG3 ARG 11 HG3 ARG 11 -2.078 0.209 2.560 99 HD2 ARG 11 HD2 ARG 11 0.262 0.886 1.586 100 HD3 ARG 11 HD3 ARG 11 -0.143 2.514 2.121 101 HE ARG 11 HE ARG 11 0.448 0.119 3.775 102 HH11 ARG 11 HH11 ARG 11 1.081 0.401 5.823 103 HH12 ARG 11 HH12 ARG 11 0.604 1.912 6.657 104 HH21 ARG 11 HH21 ARG 11 -0.657 3.503 4.025 105 HH22 ARG 11 HH22 ARG 11 -0.242 3.463 5.749 106 H THR 12 H THR 12 0.351 1.673 -1.194 107 HA THR 12 HA THR 12 -0.450 0.795 -3.900 108 HB THR 12 HB THR 12 1.121 2.049 -5.024 109 HG1 THR 12 HG1 THR 12 2.706 3.284 -4.007 110 HG21 THR 12 HG21 THR 12 0.661 4.386 -4.607 111 HG22 THR 12 HG22 THR 12 -0.826 3.466 -4.342 112 HG23 THR 12 HG23 THR 12 0.127 4.045 -2.946 113 H PHE 13 H PHE 13 1.365 -0.318 -5.124 114 HA PHE 13 HA PHE 13 1.923 -2.670 -3.899 115 HB2 PHE 13 HB2 PHE 13 1.970 -2.590 -6.202 116 HB3 PHE 13 HB3 PHE 13 3.191 -1.331 -6.244 117 HD1 PHE 13 HD1 PHE 13 2.614 -4.899 -6.170 118 HD2 PHE 13 HD2 PHE 13 5.621 -1.843 -5.811 119 HE1 PHE 13 HE1 PHE 13 4.383 -6.612 -6.552 120 HE2 PHE 13 HE2 PHE 13 7.395 -3.548 -6.159 121 HZ PHE 13 HZ PHE 13 6.782 -5.928 -6.530 122 H GLU 14 H GLU 14 4.461 -0.160 -4.085 123 HA GLU 14 HA GLU 14 6.400 -1.747 -2.677 124 HB2 GLU 14 HB2 GLU 14 6.980 0.051 -4.165 125 HB3 GLU 14 HB3 GLU 14 6.187 1.255 -3.166 126 HG2 GLU 14 HG2 GLU 14 8.435 -0.457 -2.037 127 HG3 GLU 14 HG3 GLU 14 8.808 0.858 -3.141 128 H GLN 15 H GLN 15 3.909 0.504 -1.526 129 HA GLN 15 HA GLN 15 4.794 0.537 1.251 130 HB2 GLN 15 HB2 GLN 15 2.086 1.178 0.032 131 HB3 GLN 15 HB3 GLN 15 2.616 1.585 1.664 132 HG2 GLN 15 HG2 GLN 15 4.309 3.119 0.796 133 HG3 GLN 15 HG3 GLN 15 3.942 2.653 -0.870 134 HE21 GLN 15 HE21 GLN 15 2.140 5.825 -0.312 135 HE22 GLN 15 HE22 GLN 15 3.823 5.314 -0.379 136 H ARG 16 H ARG 16 2.499 -1.441 -0.640 137 HA ARG 16 HA ARG 16 1.439 -2.973 1.600 138 HB2 ARG 16 HB2 ARG 16 1.695 -3.659 -1.359 139 HB3 ARG 16 HB3 ARG 16 0.737 -4.579 -0.201 140 HG2 ARG 16 HG2 ARG 16 0.131 -1.631 -0.612 141 HG3 ARG 16 HG3 ARG 16 -0.361 -2.801 -1.827 142 HD2 ARG 16 HD2 ARG 16 -2.191 -2.371 -0.311 143 HD3 ARG 16 HD3 ARG 16 -1.645 -4.046 -0.188 144 HE ARG 16 HE ARG 16 -0.650 -1.975 1.750 145 HH11 ARG 16 HH11 ARG 16 -2.708 -4.742 1.315 146 HH12 ARG 16 HH12 ARG 16 -2.625 -5.227 2.992 147 HH21 ARG 16 HH21 ARG 16 -0.560 -2.600 3.908 148 HH22 ARG 16 HH22 ARG 16 -1.461 -4.001 4.427 149 H VAL 17 H VAL 17 4.212 -3.541 -0.584 150 HA VAL 17 HA VAL 17 5.099 -5.944 0.768 151 HB VAL 17 HB VAL 17 6.627 -3.929 -0.930 152 HG11 VAL 17 HG11 VAL 17 8.298 -5.741 -1.222 153 HG12 VAL 17 HG12 VAL 17 8.237 -5.178 0.447 154 HG13 VAL 17 HG13 VAL 17 7.458 -6.713 0.006 155 HG21 VAL 17 HG21 VAL 17 6.401 -5.626 -2.696 156 HG22 VAL 17 HG22 VAL 17 5.508 -6.694 -1.595 157 HG23 VAL 17 HG23 VAL 17 4.796 -5.162 -2.126 158 H GLU 18 H GLU 18 5.918 -2.453 1.326 159 HA GLU 18 HA GLU 18 7.750 -2.850 3.443 160 HB2 GLU 18 HB2 GLU 18 6.987 -0.648 2.224 161 HB3 GLU 18 HB3 GLU 18 5.715 -0.605 3.440 162 HG2 GLU 18 HG2 GLU 18 7.479 0.785 4.206 163 HG3 GLU 18 HG3 GLU 18 7.447 -0.643 5.229 164 H ASP 19 H ASP 19 4.175 -2.480 3.627 165 HA ASP 19 HA ASP 19 3.761 -2.928 6.378 166 HB2 ASP 19 HB2 ASP 19 2.047 -3.633 3.997 167 HB3 ASP 19 HB3 ASP 19 1.537 -3.833 5.664 168 H VAL 20 H VAL 20 3.954 -5.503 3.855 169 HA VAL 20 HA VAL 20 3.543 -7.702 5.639 170 HB VAL 20 HB VAL 20 5.221 -7.556 3.100 171 HG11 VAL 20 HG11 VAL 20 4.995 -10.040 3.019 172 HG12 VAL 20 HG12 VAL 20 6.003 -9.511 4.364 173 HG13 VAL 20 HG13 VAL 20 4.327 -10.022 4.663 174 HG21 VAL 20 HG21 VAL 20 2.430 -8.662 3.642 175 HG22 VAL 20 HG22 VAL 20 2.802 -7.157 2.779 176 HG23 VAL 20 HG23 VAL 20 3.304 -8.698 2.084 177 H ARG 21 H ARG 21 6.639 -6.100 4.690 178 HA ARG 21 HA ARG 21 8.288 -7.760 6.384 179 HB2 ARG 21 HB2 ARG 21 8.704 -5.055 5.064 180 HB3 ARG 21 HB3 ARG 21 9.899 -5.744 6.173 181 HG2 ARG 21 HG2 ARG 21 9.976 -7.817 4.775 182 HG3 ARG 21 HG3 ARG 21 8.928 -7.035 3.582 183 HD2 ARG 21 HD2 ARG 21 11.552 -5.798 4.537 184 HD3 ARG 21 HD3 ARG 21 11.505 -6.986 3.241 185 HE ARG 21 HE ARG 21 10.459 -5.500 1.796 186 HH11 ARG 21 HH11 ARG 21 10.102 -3.416 1.011 187 HH12 ARG 21 HH12 ARG 21 10.110 -2.075 2.143 188 HH21 ARG 21 HH21 ARG 21 10.619 -2.307 4.205 189 HH22 ARG 21 HH22 ARG 21 11.075 -3.864 4.852 190 H LEU 22 H LEU 22 7.095 -4.428 7.015 191 HA LEU 22 HA LEU 22 8.331 -4.371 9.599 192 HB2 LEU 22 HB2 LEU 22 7.417 -2.241 9.862 193 HB3 LEU 22 HB3 LEU 22 7.744 -2.425 8.154 194 HG LEU 22 HG LEU 22 5.138 -3.149 8.117 195 HD11 LEU 22 HD11 LEU 22 5.284 -1.163 10.428 196 HD12 LEU 22 HD12 LEU 22 3.811 -1.760 9.636 197 HD13 LEU 22 HD13 LEU 22 4.811 -2.858 10.594 198 HD21 LEU 22 HD21 LEU 22 6.140 -0.280 8.262 199 HD22 LEU 22 HD22 LEU 22 6.146 -1.326 6.831 200 HD23 LEU 22 HD23 LEU 22 4.611 -0.818 7.527 201 H ILE 23 H ILE 23 5.009 -5.356 8.651 202 HA ILE 23 HA ILE 23 4.169 -5.519 11.402 203 HB ILE 23 HB ILE 23 2.812 -5.295 9.105 204 HG12 ILE 23 HG12 ILE 23 0.777 -6.034 10.415 205 HG13 ILE 23 HG13 ILE 23 1.891 -6.392 11.743 206 HG21 ILE 23 HG21 ILE 23 3.263 -7.579 8.273 207 HG22 ILE 23 HG22 ILE 23 2.429 -8.257 9.693 208 HG23 ILE 23 HG23 ILE 23 1.547 -7.265 8.512 209 HD11 ILE 23 HD11 ILE 23 1.474 -3.715 10.313 210 HD12 ILE 23 HD12 ILE 23 0.965 -4.122 11.967 211 HD13 ILE 23 HD13 ILE 23 2.687 -3.971 11.567 212 H ARG 24 H ARG 24 5.465 -7.956 9.132 213 HA ARG 24 HA ARG 24 5.294 -10.166 11.005 214 HB2 ARG 24 HB2 ARG 24 5.484 -10.256 8.496 215 HB3 ARG 24 HB3 ARG 24 7.160 -9.764 8.611 216 HG2 ARG 24 HG2 ARG 24 5.955 -12.306 9.809 217 HG3 ARG 24 HG3 ARG 24 6.708 -12.207 8.228 218 HD2 ARG 24 HD2 ARG 24 8.059 -12.004 10.919 219 HD3 ARG 24 HD3 ARG 24 8.287 -13.215 9.668 220 HE ARG 24 HE ARG 24 9.172 -11.254 8.227 221 HH11 ARG 24 HH11 ARG 24 11.659 -9.444 9.835 222 HH12 ARG 24 HH12 ARG 24 10.884 -9.730 8.277 223 HH21 ARG 24 HH21 ARG 24 9.930 -11.613 11.664 224 HH22 ARG 24 HH22 ARG 24 11.205 -10.393 11.521 225 H GLU 25 H GLU 25 7.824 -7.710 10.359 226 HA GLU 25 HA GLU 25 9.720 -8.821 12.200 227 HB2 GLU 25 HB2 GLU 25 10.245 -7.211 10.365 228 HB3 GLU 25 HB3 GLU 25 9.424 -5.947 11.285 229 HG2 GLU 25 HG2 GLU 25 11.764 -5.694 11.613 230 HG3 GLU 25 HG3 GLU 25 11.076 -6.234 13.133 231 H GLN 26 H GLN 26 7.251 -6.225 12.797 232 HA GLN 26 HA GLN 26 8.032 -6.056 15.580 233 HB2 GLN 26 HB2 GLN 26 6.391 -4.455 15.851 234 HB3 GLN 26 HB3 GLN 26 6.915 -4.259 14.185 235 HG2 GLN 26 HG2 GLN 26 4.851 -5.642 13.520 236 HG3 GLN 26 HG3 GLN 26 4.343 -5.546 15.206 237 HE21 GLN 26 HE21 GLN 26 2.489 -2.786 13.813 238 HE22 GLN 26 HE22 GLN 26 2.365 -4.439 14.410 239 H HIS 27 H HIS 27 5.648 -8.068 13.877 240 HA HIS 27 HA HIS 27 5.184 -9.625 16.391 241 HB2 HIS 27 HB2 HIS 27 3.038 -8.646 14.469 242 HB3 HIS 27 HB3 HIS 27 2.783 -9.813 15.770 243 HD1 HIS 27 HD1 HIS 27 4.360 -8.047 18.083 244 HD2 HIS 27 HD2 HIS 27 1.168 -7.079 15.492 245 HE1 HIS 27 HE1 HIS 27 2.866 -6.373 19.347 246 HE2 HIS 27 HE2 HIS 27 0.895 -5.834 17.777 247 HA PRO 28 HA PRO 28 6.505 -12.391 12.932 248 HB2 PRO 28 HB2 PRO 28 7.339 -13.977 15.368 249 HB3 PRO 28 HB3 PRO 28 8.169 -13.822 13.791 250 HG2 PRO 28 HG2 PRO 28 9.027 -12.360 15.884 251 HG3 PRO 28 HG3 PRO 28 8.826 -11.559 14.288 252 HD2 PRO 28 HD2 PRO 28 6.935 -11.540 16.658 253 HD3 PRO 28 HD3 PRO 28 7.479 -10.178 15.633 254 H THR 29 H THR 29 4.505 -13.155 15.764 255 HA THR 29 HA THR 29 3.371 -15.578 14.631 256 HB THR 29 HB THR 29 2.036 -15.763 16.530 257 HG1 THR 29 HG1 THR 29 1.721 -14.003 17.939 258 HG21 THR 29 HG21 THR 29 3.510 -15.548 18.415 259 HG22 THR 29 HG22 THR 29 4.511 -15.988 17.023 260 HG23 THR 29 HG23 THR 29 4.494 -14.309 17.611 261 H LYS 30 H LYS 30 2.728 -12.360 13.830 262 HA LYS 30 HA LYS 30 -0.148 -12.871 13.207 263 HB2 LYS 30 HB2 LYS 30 1.522 -10.399 13.601 264 HB3 LYS 30 HB3 LYS 30 0.192 -10.333 12.475 265 HG2 LYS 30 HG2 LYS 30 -0.472 -9.523 14.694 266 HG3 LYS 30 HG3 LYS 30 -1.439 -10.894 14.162 267 HD2 LYS 30 HD2 LYS 30 -0.202 -12.409 15.634 268 HD3 LYS 30 HD3 LYS 30 0.880 -11.123 16.146 269 HE2 LYS 30 HE2 LYS 30 -2.159 -11.049 16.564 270 HE3 LYS 30 HE3 LYS 30 -1.035 -11.789 17.709 271 HZ1 LYS 30 HZ1 LYS 30 0.080 -9.553 17.881 272 HZ2 LYS 30 HZ2 LYS 30 -1.166 -8.862 17.041 273 HZ3 LYS 30 HZ3 LYS 30 -1.435 -9.584 18.455 274 H ILE 31 H ILE 31 -1.026 -12.652 11.259 275 HA ILE 31 HA ILE 31 0.759 -13.110 8.916 276 HB ILE 31 HB ILE 31 -1.907 -14.359 9.655 277 HG12 ILE 31 HG12 ILE 31 -0.127 -15.176 11.137 278 HG13 ILE 31 HG13 ILE 31 -0.714 -16.423 10.059 279 HG21 ILE 31 HG21 ILE 31 -0.071 -14.858 7.288 280 HG22 ILE 31 HG22 ILE 31 -1.417 -15.922 7.767 281 HG23 ILE 31 HG23 ILE 31 -1.749 -14.269 7.249 282 HD11 ILE 31 HD11 ILE 31 1.905 -14.904 9.678 283 HD12 ILE 31 HD12 ILE 31 1.723 -16.538 10.324 284 HD13 ILE 31 HD13 ILE 31 1.303 -16.210 8.637 285 HA PRO 32 HA PRO 32 -1.580 -9.590 7.368 286 HB2 PRO 32 HB2 PRO 32 -0.208 -9.121 5.060 287 HB3 PRO 32 HB3 PRO 32 0.519 -8.887 6.671 288 HG2 PRO 32 HG2 PRO 32 0.777 -11.280 4.819 289 HG3 PRO 32 HG3 PRO 32 2.086 -10.371 5.652 290 HD2 PRO 32 HD2 PRO 32 1.012 -12.683 6.650 291 HD3 PRO 32 HD3 PRO 32 1.597 -11.356 7.706 292 H VAL 33 H VAL 33 -3.659 -9.709 6.569 293 HA VAL 33 HA VAL 33 -4.124 -11.110 4.009 294 HB VAL 33 HB VAL 33 -5.763 -12.536 4.623 295 HG11 VAL 33 HG11 VAL 33 -3.629 -13.300 5.715 296 HG12 VAL 33 HG12 VAL 33 -4.135 -12.504 7.212 297 HG13 VAL 33 HG13 VAL 33 -5.082 -13.853 6.559 298 HG21 VAL 33 HG21 VAL 33 -7.004 -12.516 6.768 299 HG22 VAL 33 HG22 VAL 33 -6.163 -11.010 7.204 300 HG23 VAL 33 HG23 VAL 33 -7.282 -11.067 5.806 301 H ILE 34 H ILE 34 -6.072 -10.609 2.831 302 HA ILE 34 HA ILE 34 -7.186 -7.884 3.471 303 HB ILE 34 HB ILE 34 -6.200 -9.062 0.883 304 HG12 ILE 34 HG12 ILE 34 -5.849 -6.249 2.007 305 HG13 ILE 34 HG13 ILE 34 -4.806 -7.592 2.483 306 HG21 ILE 34 HG21 ILE 34 -8.125 -6.704 1.076 307 HG22 ILE 34 HG22 ILE 34 -7.233 -7.191 -0.378 308 HG23 ILE 34 HG23 ILE 34 -8.447 -8.267 0.277 309 HD11 ILE 34 HD11 ILE 34 -4.232 -7.972 0.073 310 HD12 ILE 34 HD12 ILE 34 -5.101 -6.465 -0.316 311 HD13 ILE 34 HD13 ILE 34 -3.685 -6.424 0.735 312 H ILE 35 H ILE 35 -9.404 -7.531 3.060 313 HA ILE 35 HA ILE 35 -10.964 -9.795 1.999 314 HB ILE 35 HB ILE 35 -11.198 -10.275 4.269 315 HG12 ILE 35 HG12 ILE 35 -13.724 -8.752 3.480 316 HG13 ILE 35 HG13 ILE 35 -13.209 -10.264 2.708 317 HG21 ILE 35 HG21 ILE 35 -12.052 -7.392 4.819 318 HG22 ILE 35 HG22 ILE 35 -12.065 -8.720 5.975 319 HG23 ILE 35 HG23 ILE 35 -10.527 -8.145 5.332 320 HD11 ILE 35 HD11 ILE 35 -14.862 -10.774 4.354 321 HD12 ILE 35 HD12 ILE 35 -13.295 -11.395 4.923 322 HD13 ILE 35 HD13 ILE 35 -13.982 -9.905 5.621 323 H GLU 36 H GLU 36 -11.242 -8.765 0.114 324 HA GLU 36 HA GLU 36 -12.414 -6.044 0.067 325 HB2 GLU 36 HB2 GLU 36 -10.561 -6.684 -1.428 326 HB3 GLU 36 HB3 GLU 36 -11.599 -7.903 -2.188 327 HG2 GLU 36 HG2 GLU 36 -13.149 -6.129 -2.930 328 HG3 GLU 36 HG3 GLU 36 -12.182 -4.914 -2.090 329 H ARG 37 H ARG 37 -14.603 -5.658 -0.054 330 HA ARG 37 HA ARG 37 -16.547 -7.809 -0.488 331 HB2 ARG 37 HB2 ARG 37 -17.046 -5.782 0.873 332 HB3 ARG 37 HB3 ARG 37 -16.858 -4.769 -0.556 333 HG2 ARG 37 HG2 ARG 37 -18.818 -5.804 -1.609 334 HG3 ARG 37 HG3 ARG 37 -18.897 -7.033 -0.342 335 HD2 ARG 37 HD2 ARG 37 -20.619 -5.379 0.021 336 HD3 ARG 37 HD3 ARG 37 -19.438 -5.313 1.337 337 HE ARG 37 HE ARG 37 -18.573 -3.391 -0.507 338 HH11 ARG 37 HH11 ARG 37 -21.475 -3.810 1.436 339 HH12 ARG 37 HH12 ARG 37 -21.803 -2.096 1.453 340 HH21 ARG 37 HH21 ARG 37 -19.024 -1.197 -0.353 341 HH22 ARG 37 HH22 ARG 37 -20.426 -0.674 0.516 342 H TYR 38 H TYR 38 -17.235 -8.599 -2.446 343 HA TYR 38 HA TYR 38 -15.731 -8.077 -4.681 344 HB2 TYR 38 HB2 TYR 38 -16.676 -10.160 -4.612 345 HB3 TYR 38 HB3 TYR 38 -18.291 -9.524 -4.345 346 HD1 TYR 38 HD1 TYR 38 -19.727 -10.214 -6.028 347 HD2 TYR 38 HD2 TYR 38 -15.705 -9.067 -7.093 348 HE1 TYR 38 HE1 TYR 38 -20.334 -10.309 -8.435 349 HE2 TYR 38 HE2 TYR 38 -16.311 -9.182 -9.495 350 HH TYR 38 HH TYR 38 -17.980 -9.588 -11.042 351 H LYS 39 H LYS 39 -15.536 -6.803 -6.358 352 HA LYS 39 HA LYS 39 -16.521 -4.241 -6.341 353 HB2 LYS 39 HB2 LYS 39 -15.509 -5.851 -8.727 354 HB3 LYS 39 HB3 LYS 39 -15.731 -4.096 -8.727 355 HG2 LYS 39 HG2 LYS 39 -14.119 -3.872 -6.856 356 HG3 LYS 39 HG3 LYS 39 -13.837 -5.625 -6.888 357 HD2 LYS 39 HD2 LYS 39 -13.070 -5.459 -9.250 358 HD3 LYS 39 HD3 LYS 39 -13.333 -3.703 -9.209 359 HE2 LYS 39 HE2 LYS 39 -11.689 -3.502 -7.349 360 HE3 LYS 39 HE3 LYS 39 -11.432 -5.249 -7.386 361 HZ1 LYS 39 HZ1 LYS 39 -9.711 -4.096 -8.657 362 HZ2 LYS 39 HZ2 LYS 39 -10.603 -5.002 -9.685 363 HZ3 LYS 39 HZ3 LYS 39 -10.810 -3.383 -9.626 364 H GLY 40 H GLY 40 -17.950 -6.928 -8.169 365 HA2 GLY 40 HA2 GLY 40 -19.984 -5.271 -9.488 366 HA3 GLY 40 HA3 GLY 40 -19.763 -7.012 -9.621 367 H GLU 41 H GLU 41 -19.874 -6.463 -6.320 368 HA GLU 41 HA GLU 41 -22.827 -6.583 -6.085 369 HB2 GLU 41 HB2 GLU 41 -21.842 -8.878 -6.681 370 HB3 GLU 41 HB3 GLU 41 -21.108 -8.862 -5.074 371 HG2 GLU 41 HG2 GLU 41 -23.355 -8.720 -4.045 372 HG3 GLU 41 HG3 GLU 41 -24.092 -8.575 -5.641 373 H LYS 42 H LYS 42 -21.726 -4.471 -5.151 374 HA LYS 42 HA LYS 42 -20.761 -4.630 -2.414 375 HB2 LYS 42 HB2 LYS 42 -21.729 -2.311 -4.124 376 HB3 LYS 42 HB3 LYS 42 -21.064 -2.117 -2.496 377 HG2 LYS 42 HG2 LYS 42 -18.930 -3.103 -3.178 378 HG3 LYS 42 HG3 LYS 42 -19.545 -3.405 -4.807 379 HD2 LYS 42 HD2 LYS 42 -19.852 -1.002 -5.186 380 HD3 LYS 42 HD3 LYS 42 -19.304 -0.641 -3.536 381 HE2 LYS 42 HE2 LYS 42 -17.062 -1.536 -4.030 382 HE3 LYS 42 HE3 LYS 42 -17.597 -2.061 -5.635 383 HZ1 LYS 42 HZ1 LYS 42 -17.485 0.780 -4.736 384 HZ2 LYS 42 HZ2 LYS 42 -16.410 0.068 -5.739 385 HZ3 LYS 42 HZ3 LYS 42 -17.954 0.286 -6.224 386 H GLN 43 H GLN 43 -23.117 -6.116 -2.679 387 HA GLN 43 HA GLN 43 -25.418 -4.667 -1.578 388 HB2 GLN 43 HB2 GLN 43 -24.898 -7.610 -2.168 389 HB3 GLN 43 HB3 GLN 43 -26.438 -6.992 -1.600 390 HG2 GLN 43 HG2 GLN 43 -25.169 -5.987 -4.190 391 HG3 GLN 43 HG3 GLN 43 -26.150 -7.440 -4.106 392 HE21 GLN 43 HE21 GLN 43 -28.857 -5.287 -4.917 393 HE22 GLN 43 HE22 GLN 43 -27.749 -6.510 -5.526 394 H LEU 44 H LEU 44 -23.168 -7.196 -0.368 395 HA LEU 44 HA LEU 44 -24.526 -7.490 2.151 396 HB2 LEU 44 HB2 LEU 44 -21.692 -8.271 1.345 397 HB3 LEU 44 HB3 LEU 44 -22.508 -8.811 2.798 398 HG LEU 44 HG LEU 44 -23.219 -9.534 -0.074 399 HD11 LEU 44 HD11 LEU 44 -22.708 -11.808 0.725 400 HD12 LEU 44 HD12 LEU 44 -21.310 -10.731 0.920 401 HD13 LEU 44 HD13 LEU 44 -22.306 -11.175 2.329 402 HD21 LEU 44 HD21 LEU 44 -24.950 -11.029 0.914 403 HD22 LEU 44 HD22 LEU 44 -24.708 -10.254 2.493 404 HD23 LEU 44 HD23 LEU 44 -25.347 -9.321 1.115 405 HA PRO 45 HA PRO 45 -22.897 -4.122 4.513 406 HB2 PRO 45 HB2 PRO 45 -22.851 -5.120 7.081 407 HB3 PRO 45 HB3 PRO 45 -24.350 -4.701 6.206 408 HG2 PRO 45 HG2 PRO 45 -23.063 -7.440 6.472 409 HG3 PRO 45 HG3 PRO 45 -24.775 -6.985 6.747 410 HD2 PRO 45 HD2 PRO 45 -23.977 -8.057 4.399 411 HD3 PRO 45 HD3 PRO 45 -25.185 -6.735 4.429 412 H VAL 46 H VAL 46 -20.895 -3.333 4.740 413 HA VAL 46 HA VAL 46 -18.607 -5.204 5.060 414 HB VAL 46 HB VAL 46 -18.883 -3.690 3.034 415 HG11 VAL 46 HG11 VAL 46 -19.282 -1.552 4.284 416 HG12 VAL 46 HG12 VAL 46 -17.608 -1.630 4.883 417 HG13 VAL 46 HG13 VAL 46 -17.923 -1.472 3.149 418 HG21 VAL 46 HG21 VAL 46 -16.869 -5.015 3.494 419 HG22 VAL 46 HG22 VAL 46 -16.474 -3.452 2.758 420 HG23 VAL 46 HG23 VAL 46 -16.233 -3.707 4.498 421 H LEU 47 H LEU 47 -20.171 -2.796 6.899 422 HA LEU 47 HA LEU 47 -19.652 -1.711 8.818 423 HB2 LEU 47 HB2 LEU 47 -20.387 -4.179 9.213 424 HB3 LEU 47 HB3 LEU 47 -18.721 -4.442 9.707 425 HG LEU 47 HG LEU 47 -19.101 -2.438 11.364 426 HD11 LEU 47 HD11 LEU 47 -21.220 -1.601 10.422 427 HD12 LEU 47 HD12 LEU 47 -21.986 -3.176 10.701 428 HD13 LEU 47 HD13 LEU 47 -21.464 -2.174 12.074 429 HD21 LEU 47 HD21 LEU 47 -20.134 -3.948 13.022 430 HD22 LEU 47 HD22 LEU 47 -20.579 -5.071 11.718 431 HD23 LEU 47 HD23 LEU 47 -18.871 -4.764 12.086 432 H ASP 48 H ASP 48 -17.662 -0.933 7.310 433 HA ASP 48 HA ASP 48 -15.640 -0.058 7.232 434 HB2 ASP 48 HB2 ASP 48 -16.027 -0.052 10.204 435 HB3 ASP 48 HB3 ASP 48 -14.640 0.679 9.445 436 H LYS 49 H LYS 49 -15.617 -3.082 7.248 437 HA LYS 49 HA LYS 49 -12.741 -3.598 7.833 438 HB2 LYS 49 HB2 LYS 49 -15.090 -5.298 6.950 439 HB3 LYS 49 HB3 LYS 49 -13.458 -5.848 6.659 440 HG2 LYS 49 HG2 LYS 49 -14.316 -6.861 8.631 441 HG3 LYS 49 HG3 LYS 49 -12.910 -5.870 8.998 442 HD2 LYS 49 HD2 LYS 49 -15.702 -4.773 9.442 443 HD3 LYS 49 HD3 LYS 49 -15.009 -5.919 10.594 444 HE2 LYS 49 HE2 LYS 49 -13.060 -4.489 10.991 445 HE3 LYS 49 HE3 LYS 49 -13.577 -3.352 9.749 446 HZ1 LYS 49 HZ1 LYS 49 -15.073 -3.860 12.264 447 HZ2 LYS 49 HZ2 LYS 49 -14.126 -2.559 11.957 448 HZ3 LYS 49 HZ3 LYS 49 -15.515 -2.796 11.083 449 H THR 50 H THR 50 -11.237 -4.246 6.338 450 HA THR 50 HA THR 50 -11.664 -4.157 3.405 451 HB THR 50 HB THR 50 -9.648 -2.524 3.205 452 HG1 THR 50 HG1 THR 50 -9.702 -0.963 5.016 453 HG21 THR 50 HG21 THR 50 -12.129 -1.147 4.254 454 HG22 THR 50 HG22 THR 50 -10.921 -0.526 3.123 455 HG23 THR 50 HG23 THR 50 -11.997 -1.840 2.612 456 H LYS 51 H LYS 51 -9.245 -3.996 6.035 457 HA LYS 51 HA LYS 51 -7.701 -6.284 4.866 458 HB2 LYS 51 HB2 LYS 51 -5.644 -5.116 5.674 459 HB3 LYS 51 HB3 LYS 51 -6.522 -4.249 4.410 460 HG2 LYS 51 HG2 LYS 51 -7.582 -2.805 6.163 461 HG3 LYS 51 HG3 LYS 51 -6.604 -3.589 7.394 462 HD2 LYS 51 HD2 LYS 51 -5.381 -2.163 4.984 463 HD3 LYS 51 HD3 LYS 51 -5.913 -1.298 6.420 464 HE2 LYS 51 HE2 LYS 51 -4.407 -2.907 7.789 465 HE3 LYS 51 HE3 LYS 51 -3.706 -3.399 6.237 466 HZ1 LYS 51 HZ1 LYS 51 -3.723 -0.641 7.420 467 HZ2 LYS 51 HZ2 LYS 51 -2.395 -1.586 7.197 468 HZ3 LYS 51 HZ3 LYS 51 -3.170 -0.949 5.896 469 H PHE 52 H PHE 52 -6.431 -7.532 6.378 470 HA PHE 52 HA PHE 52 -7.095 -7.335 9.197 471 HB2 PHE 52 HB2 PHE 52 -8.041 -9.637 7.572 472 HB3 PHE 52 HB3 PHE 52 -7.572 -9.901 9.237 473 HD1 PHE 52 HD1 PHE 52 -10.356 -9.755 7.422 474 HD2 PHE 52 HD2 PHE 52 -8.621 -7.653 10.760 475 HE1 PHE 52 HE1 PHE 52 -12.625 -9.210 8.285 476 HE2 PHE 52 HE2 PHE 52 -10.889 -7.113 11.599 477 HZ PHE 52 HZ PHE 52 -12.883 -7.967 10.408 478 H LEU 53 H LEU 53 -5.900 -8.579 10.704 479 HA LEU 53 HA LEU 53 -3.292 -9.604 9.706 480 HB2 LEU 53 HB2 LEU 53 -3.060 -7.196 10.348 481 HB3 LEU 53 HB3 LEU 53 -3.680 -7.600 11.957 482 HG LEU 53 HG LEU 53 -1.705 -9.165 12.224 483 HD11 LEU 53 HD11 LEU 53 -1.017 -9.425 9.868 484 HD12 LEU 53 HD12 LEU 53 -0.777 -7.671 9.712 485 HD13 LEU 53 HD13 LEU 53 0.284 -8.633 10.761 486 HD21 LEU 53 HD21 LEU 53 -0.131 -7.332 12.758 487 HD22 LEU 53 HD22 LEU 53 -1.103 -6.215 11.779 488 HD23 LEU 53 HD23 LEU 53 -1.778 -6.928 13.264 489 H VAL 54 H VAL 54 -3.575 -11.688 10.201 490 HA VAL 54 HA VAL 54 -5.251 -12.388 12.539 491 HB VAL 54 HB VAL 54 -4.478 -14.315 10.373 492 HG11 VAL 54 HG11 VAL 54 -6.949 -14.113 12.152 493 HG12 VAL 54 HG12 VAL 54 -6.562 -15.412 11.000 494 HG13 VAL 54 HG13 VAL 54 -5.561 -15.189 12.441 495 HG21 VAL 54 HG21 VAL 54 -5.469 -12.415 9.177 496 HG22 VAL 54 HG22 VAL 54 -6.584 -13.768 9.217 497 HG23 VAL 54 HG23 VAL 54 -6.836 -12.391 10.316 498 HA PRO 55 HA PRO 55 -1.729 -14.233 14.684 499 HB2 PRO 55 HB2 PRO 55 -3.843 -15.797 16.150 500 HB3 PRO 55 HB3 PRO 55 -2.467 -14.867 16.808 501 HG2 PRO 55 HG2 PRO 55 -5.001 -13.888 16.928 502 HG3 PRO 55 HG3 PRO 55 -3.620 -12.810 16.538 503 HD2 PRO 55 HD2 PRO 55 -5.600 -14.089 14.635 504 HD3 PRO 55 HD3 PRO 55 -4.992 -12.404 14.684 505 H ASP 56 H ASP 56 -0.548 -16.063 14.136 506 HA ASP 56 HA ASP 56 -1.365 -17.859 12.154 507 HB2 ASP 56 HB2 ASP 56 0.652 -19.160 12.751 508 HB3 ASP 56 HB3 ASP 56 0.928 -17.436 12.547 509 H HIS 57 H HIS 57 -1.971 -18.146 15.537 510 HA HIS 57 HA HIS 57 -2.612 -20.935 15.769 511 HB2 HIS 57 HB2 HIS 57 -3.488 -18.437 17.289 512 HB3 HIS 57 HB3 HIS 57 -4.007 -20.051 17.729 513 HD1 HIS 57 HD1 HIS 57 -0.306 -18.893 16.963 514 HD2 HIS 57 HD2 HIS 57 -2.879 -20.400 19.973 515 HE1 HIS 57 HE1 HIS 57 1.139 -19.271 19.046 516 HE2 HIS 57 HE2 HIS 57 -0.438 -20.165 20.887 517 H VAL 58 H VAL 58 -4.399 -18.375 14.201 518 HA VAL 58 HA VAL 58 -7.068 -19.497 14.614 519 HB VAL 58 HB VAL 58 -6.041 -17.358 12.734 520 HG11 VAL 58 HG11 VAL 58 -8.133 -18.189 11.811 521 HG12 VAL 58 HG12 VAL 58 -8.915 -18.099 13.410 522 HG13 VAL 58 HG13 VAL 58 -8.415 -16.623 12.562 523 HG21 VAL 58 HG21 VAL 58 -5.835 -16.724 15.111 524 HG22 VAL 58 HG22 VAL 58 -7.157 -15.816 14.365 525 HG23 VAL 58 HG23 VAL 58 -7.521 -17.202 15.405 526 H ASN 59 H ASN 59 -8.006 -21.117 13.477 527 HA ASN 59 HA ASN 59 -6.814 -22.193 11.013 528 HB2 ASN 59 HB2 ASN 59 -9.328 -22.850 12.600 529 HB3 ASN 59 HB3 ASN 59 -8.897 -23.663 11.102 530 HD21 ASN 59 HD21 ASN 59 -7.617 -25.682 13.976 531 HD22 ASN 59 HD22 ASN 59 -9.201 -25.052 13.555 532 H MET 60 H MET 60 -7.796 -22.164 8.905 533 HA MET 60 HA MET 60 -8.881 -19.665 8.141 534 HB2 MET 60 HB2 MET 60 -7.669 -21.182 6.658 535 HB3 MET 60 HB3 MET 60 -8.975 -22.362 6.735 536 HG2 MET 60 HG2 MET 60 -9.108 -21.125 4.649 537 HG3 MET 60 HG3 MET 60 -10.511 -20.765 5.648 538 HE1 MET 60 HE1 MET 60 -11.349 -18.645 4.640 539 HE2 MET 60 HE2 MET 60 -10.315 -17.382 3.950 540 HE3 MET 60 HE3 MET 60 -10.248 -19.034 3.302 541 H SER 61 H SER 61 -10.645 -22.680 8.915 542 HA SER 61 HA SER 61 -13.306 -21.805 8.434 543 HB2 SER 61 HB2 SER 61 -13.847 -23.585 10.124 544 HB3 SER 61 HB3 SER 61 -12.781 -24.121 8.811 545 HG SER 61 HG SER 61 -12.113 -24.723 11.025 546 H GLU 62 H GLU 62 -11.213 -21.350 11.304 547 HA GLU 62 HA GLU 62 -13.263 -19.996 12.859 548 HB2 GLU 62 HB2 GLU 62 -11.360 -21.202 13.886 549 HB3 GLU 62 HB3 GLU 62 -10.244 -20.052 13.170 550 HG2 GLU 62 HG2 GLU 62 -10.511 -19.456 15.447 551 HG3 GLU 62 HG3 GLU 62 -11.282 -18.208 14.484 552 H LEU 63 H LEU 63 -10.639 -18.833 10.674 553 HA LEU 63 HA LEU 63 -11.156 -16.043 11.069 554 HB2 LEU 63 HB2 LEU 63 -9.148 -16.879 9.901 555 HB3 LEU 63 HB3 LEU 63 -10.161 -17.468 8.581 556 HG LEU 63 HG LEU 63 -10.911 -15.083 8.156 557 HD11 LEU 63 HD11 LEU 63 -8.683 -14.461 10.149 558 HD12 LEU 63 HD12 LEU 63 -9.444 -13.269 9.073 559 HD13 LEU 63 HD13 LEU 63 -10.395 -14.055 10.338 560 HD21 LEU 63 HD21 LEU 63 -7.919 -15.527 8.006 561 HD22 LEU 63 HD22 LEU 63 -9.121 -16.184 6.866 562 HD23 LEU 63 HD23 LEU 63 -8.894 -14.433 6.985 563 H ILE 64 H ILE 64 -12.566 -18.334 8.692 564 HA ILE 64 HA ILE 64 -14.480 -16.615 7.478 565 HB ILE 64 HB ILE 64 -14.378 -19.564 8.077 566 HG12 ILE 64 HG12 ILE 64 -14.563 -18.322 5.350 567 HG13 ILE 64 HG13 ILE 64 -13.027 -18.340 6.229 568 HG21 ILE 64 HG21 ILE 64 -16.774 -19.142 8.194 569 HG22 ILE 64 HG22 ILE 64 -16.712 -18.176 6.694 570 HG23 ILE 64 HG23 ILE 64 -16.414 -19.925 6.664 571 HD11 ILE 64 HD11 ILE 64 -14.628 -20.855 5.655 572 HD12 ILE 64 HD12 ILE 64 -13.274 -20.257 4.666 573 HD13 ILE 64 HD13 ILE 64 -13.002 -20.749 6.341 574 H LYS 65 H LYS 65 -14.751 -18.399 10.564 575 HA LYS 65 HA LYS 65 -17.418 -17.564 11.168 576 HB2 LYS 65 HB2 LYS 65 -16.029 -19.479 12.148 577 HB3 LYS 65 HB3 LYS 65 -15.260 -18.270 13.190 578 HG2 LYS 65 HG2 LYS 65 -17.636 -17.621 13.939 579 HG3 LYS 65 HG3 LYS 65 -18.195 -19.067 13.088 580 HD2 LYS 65 HD2 LYS 65 -16.105 -18.997 15.315 581 HD3 LYS 65 HD3 LYS 65 -17.804 -19.391 15.565 582 HE2 LYS 65 HE2 LYS 65 -17.663 -21.442 14.370 583 HE3 LYS 65 HE3 LYS 65 -16.136 -21.003 13.596 584 HZ1 LYS 65 HZ1 LYS 65 -15.000 -21.167 15.690 585 HZ2 LYS 65 HZ2 LYS 65 -16.394 -21.490 16.516 586 HZ3 LYS 65 HZ3 LYS 65 -15.802 -22.573 15.443 587 H ILE 66 H ILE 66 -14.298 -16.059 12.321 588 HA ILE 66 HA ILE 66 -15.749 -13.954 13.683 589 HB ILE 66 HB ILE 66 -13.614 -14.376 14.477 590 HG12 ILE 66 HG12 ILE 66 -14.441 -11.949 14.451 591 HG13 ILE 66 HG13 ILE 66 -12.790 -12.306 14.883 592 HG21 ILE 66 HG21 ILE 66 -11.503 -13.873 13.254 593 HG22 ILE 66 HG22 ILE 66 -12.403 -15.250 12.641 594 HG23 ILE 66 HG23 ILE 66 -12.449 -13.710 11.751 595 HD11 ILE 66 HD11 ILE 66 -12.829 -10.279 13.576 596 HD12 ILE 66 HD12 ILE 66 -11.985 -11.519 12.668 597 HD13 ILE 66 HD13 ILE 66 -13.645 -11.081 12.231 598 H ILE 67 H ILE 67 -14.473 -14.092 10.327 599 HA ILE 67 HA ILE 67 -15.275 -11.406 9.656 600 HB ILE 67 HB ILE 67 -14.715 -13.910 8.084 601 HG12 ILE 67 HG12 ILE 67 -13.024 -12.582 7.026 602 HG13 ILE 67 HG13 ILE 67 -13.694 -11.080 7.658 603 HG21 ILE 67 HG21 ILE 67 -15.210 -12.695 5.948 604 HG22 ILE 67 HG22 ILE 67 -16.664 -13.053 6.858 605 HG23 ILE 67 HG23 ILE 67 -15.997 -11.409 6.883 606 HD11 ILE 67 HD11 ILE 67 -11.572 -11.736 8.744 607 HD12 ILE 67 HD12 ILE 67 -12.896 -11.595 9.904 608 HD13 ILE 67 HD13 ILE 67 -12.339 -13.194 9.360 609 H ARG 68 H ARG 68 -17.134 -14.483 9.323 610 HA ARG 68 HA ARG 68 -19.522 -13.278 8.384 611 HB2 ARG 68 HB2 ARG 68 -19.039 -15.678 8.256 612 HB3 ARG 68 HB3 ARG 68 -19.151 -15.824 10.016 613 HG2 ARG 68 HG2 ARG 68 -21.532 -15.215 9.961 614 HG3 ARG 68 HG3 ARG 68 -21.429 -14.872 8.227 615 HD2 ARG 68 HD2 ARG 68 -22.502 -17.015 8.549 616 HD3 ARG 68 HD3 ARG 68 -20.937 -17.252 7.783 617 HE ARG 68 HE ARG 68 -20.147 -18.377 9.652 618 HH11 ARG 68 HH11 ARG 68 -23.283 -17.038 10.519 619 HH12 ARG 68 HH12 ARG 68 -23.421 -18.062 11.922 620 HH21 ARG 68 HH21 ARG 68 -20.420 -19.660 11.436 621 HH22 ARG 68 HH22 ARG 68 -21.832 -19.490 12.433 622 H ARG 69 H ARG 69 -18.504 -13.861 11.737 623 HA ARG 69 HA ARG 69 -21.013 -12.866 12.848 624 HB2 ARG 69 HB2 ARG 69 -19.716 -14.749 13.774 625 HB3 ARG 69 HB3 ARG 69 -18.406 -13.649 14.218 626 HG2 ARG 69 HG2 ARG 69 -19.809 -12.500 15.825 627 HG3 ARG 69 HG3 ARG 69 -21.268 -13.318 15.221 628 HD2 ARG 69 HD2 ARG 69 -20.386 -15.489 15.969 629 HD3 ARG 69 HD3 ARG 69 -18.905 -14.702 16.555 630 HE ARG 69 HE ARG 69 -21.136 -13.412 17.763 631 HH11 ARG 69 HH11 ARG 69 -19.570 -16.540 17.976 632 HH12 ARG 69 HH12 ARG 69 -20.091 -16.794 19.618 633 HH21 ARG 69 HH21 ARG 69 -21.765 -13.797 19.864 634 HH22 ARG 69 HH22 ARG 69 -21.301 -15.274 20.654 635 H ARG 70 H ARG 70 -17.784 -11.349 12.428 636 HA ARG 70 HA ARG 70 -18.463 -9.094 14.114 637 HB2 ARG 70 HB2 ARG 70 -16.095 -9.890 13.516 638 HB3 ARG 70 HB3 ARG 70 -16.336 -9.175 11.916 639 HG2 ARG 70 HG2 ARG 70 -15.076 -7.638 13.285 640 HG3 ARG 70 HG3 ARG 70 -16.673 -6.936 13.008 641 HD2 ARG 70 HD2 ARG 70 -17.372 -7.725 15.302 642 HD3 ARG 70 HD3 ARG 70 -15.777 -8.427 15.517 643 HE ARG 70 HE ARG 70 -14.841 -6.330 15.868 644 HH11 ARG 70 HH11 ARG 70 -18.205 -5.814 14.970 645 HH12 ARG 70 HH12 ARG 70 -18.233 -4.240 15.713 646 HH21 ARG 70 HH21 ARG 70 -14.948 -4.393 16.787 647 HH22 ARG 70 HH22 ARG 70 -16.405 -3.419 16.678 648 H LEU 71 H LEU 71 -18.740 -9.723 10.639 649 HA LEU 71 HA LEU 71 -19.904 -7.119 9.983 650 HB2 LEU 71 HB2 LEU 71 -20.007 -9.807 8.536 651 HB3 LEU 71 HB3 LEU 71 -20.554 -8.274 7.866 652 HG LEU 71 HG LEU 71 -17.664 -8.944 8.596 653 HD11 LEU 71 HD11 LEU 71 -19.054 -8.618 5.906 654 HD12 LEU 71 HD12 LEU 71 -17.322 -8.914 6.152 655 HD13 LEU 71 HD13 LEU 71 -18.503 -10.151 6.611 656 HD21 LEU 71 HD21 LEU 71 -18.009 -6.555 8.870 657 HD22 LEU 71 HD22 LEU 71 -17.156 -6.834 7.352 658 HD23 LEU 71 HD23 LEU 71 -18.897 -6.476 7.325 659 H GLN 72 H GLN 72 -22.129 -6.670 9.597 660 HA GLN 72 HA GLN 72 -23.965 -8.019 11.368 661 HB2 GLN 72 HB2 GLN 72 -24.248 -5.600 9.574 662 HB3 GLN 72 HB3 GLN 72 -25.578 -6.244 10.554 663 HG2 GLN 72 HG2 GLN 72 -24.232 -6.016 12.609 664 HG3 GLN 72 HG3 GLN 72 -22.911 -5.310 11.681 665 HE21 GLN 72 HE21 GLN 72 -24.848 -2.499 13.179 666 HE22 GLN 72 HE22 GLN 72 -23.922 -3.856 13.804 667 H LEU 73 H LEU 73 -23.195 -9.873 9.537 668 HA LEU 73 HA LEU 73 -25.318 -10.353 7.549 669 HB2 LEU 73 HB2 LEU 73 -22.989 -12.017 8.590 670 HB3 LEU 73 HB3 LEU 73 -24.094 -12.579 7.343 671 HG LEU 73 HG LEU 73 -22.440 -10.037 7.025 672 HD11 LEU 73 HD11 LEU 73 -21.800 -12.870 6.117 673 HD12 LEU 73 HD12 LEU 73 -20.916 -11.397 5.638 674 HD13 LEU 73 HD13 LEU 73 -20.923 -11.914 7.332 675 HD21 LEU 73 HD21 LEU 73 -24.396 -10.236 5.497 676 HD22 LEU 73 HD22 LEU 73 -22.866 -10.406 4.627 677 HD23 LEU 73 HD23 LEU 73 -23.835 -11.848 5.001 678 H ASN 74 H ASN 74 -26.620 -12.318 7.641 679 HA ASN 74 HA ASN 74 -27.310 -13.429 10.273 680 HB2 ASN 74 HB2 ASN 74 -28.503 -11.160 10.007 681 HB3 ASN 74 HB3 ASN 74 -29.376 -11.855 8.645 682 HD21 ASN 74 HD21 ASN 74 -31.721 -12.289 11.367 683 HD22 ASN 74 HD22 ASN 74 -31.186 -11.103 10.183 684 H ALA 75 H ALA 75 -29.021 -15.147 10.002 685 HA ALA 75 HA ALA 75 -28.177 -17.078 8.193 686 HB1 ALA 75 HB1 ALA 75 -30.193 -18.309 8.952 687 HB2 ALA 75 HB2 ALA 75 -29.414 -17.465 10.309 688 HB3 ALA 75 HB3 ALA 75 -30.892 -16.796 9.567 689 H ASN 76 H ASN 76 -30.815 -14.755 7.684 690 HA ASN 76 HA ASN 76 -31.976 -15.980 5.360 691 HB2 ASN 76 HB2 ASN 76 -33.076 -14.338 6.873 692 HB3 ASN 76 HB3 ASN 76 -31.947 -13.083 6.344 693 HD21 ASN 76 HD21 ASN 76 -33.805 -12.326 3.454 694 HD22 ASN 76 HD22 ASN 76 -32.376 -11.996 4.437 695 H GLN 77 H GLN 77 -29.046 -14.059 5.715 696 HA GLN 77 HA GLN 77 -29.011 -13.201 2.884 697 HB2 GLN 77 HB2 GLN 77 -26.861 -12.799 5.000 698 HB3 GLN 77 HB3 GLN 77 -27.023 -11.975 3.456 699 HG2 GLN 77 HG2 GLN 77 -28.684 -11.612 5.971 700 HG3 GLN 77 HG3 GLN 77 -27.699 -10.424 5.129 701 HE21 GLN 77 HE21 GLN 77 -30.264 -9.934 2.537 702 HE22 GLN 77 HE22 GLN 77 -28.520 -9.960 2.730 703 H ALA 78 H ALA 78 -27.840 -14.186 1.293 704 HA ALA 78 HA ALA 78 -26.318 -16.631 1.844 705 HB1 ALA 78 HB1 ALA 78 -25.936 -16.629 -0.585 706 HB2 ALA 78 HB2 ALA 78 -27.656 -16.446 -0.198 707 HB3 ALA 78 HB3 ALA 78 -26.709 -15.037 -0.717 708 H PHE 79 H PHE 79 -24.088 -16.868 1.786 709 HA PHE 79 HA PHE 79 -22.343 -14.587 1.349 710 HB2 PHE 79 HB2 PHE 79 -22.814 -13.862 3.451 711 HB3 PHE 79 HB3 PHE 79 -23.011 -15.478 4.101 712 HD1 PHE 79 HD1 PHE 79 -21.159 -16.791 4.933 713 HD2 PHE 79 HD2 PHE 79 -20.509 -12.901 3.200 714 HE1 PHE 79 HE1 PHE 79 -18.860 -16.770 5.862 715 HE2 PHE 79 HE2 PHE 79 -18.195 -12.877 4.138 716 HZ PHE 79 HZ PHE 79 -17.376 -14.819 5.464 717 H PHE 80 H PHE 80 -20.343 -14.940 0.766 718 HA PHE 80 HA PHE 80 -19.034 -17.521 1.411 719 HB2 PHE 80 HB2 PHE 80 -19.244 -16.333 -1.378 720 HB3 PHE 80 HB3 PHE 80 -18.121 -17.599 -0.905 721 HD1 PHE 80 HD1 PHE 80 -21.670 -16.832 -1.540 722 HD2 PHE 80 HD2 PHE 80 -18.813 -19.902 -0.548 723 HE1 PHE 80 HE1 PHE 80 -23.349 -18.574 -2.108 724 HE2 PHE 80 HE2 PHE 80 -20.486 -21.644 -1.125 725 HZ PHE 80 HZ PHE 80 -22.753 -20.983 -1.913 726 H LEU 81 H LEU 81 -16.955 -17.353 2.041 727 HA LEU 81 HA LEU 81 -15.454 -14.841 1.421 728 HB2 LEU 81 HB2 LEU 81 -15.694 -15.122 3.776 729 HB3 LEU 81 HB3 LEU 81 -15.195 -16.808 3.707 730 HG LEU 81 HG LEU 81 -12.897 -16.179 3.185 731 HD11 LEU 81 HD11 LEU 81 -12.232 -13.729 3.258 732 HD12 LEU 81 HD12 LEU 81 -13.224 -14.105 1.849 733 HD13 LEU 81 HD13 LEU 81 -13.949 -13.294 3.257 734 HD21 LEU 81 HD21 LEU 81 -13.482 -16.225 5.535 735 HD22 LEU 81 HD22 LEU 81 -12.288 -14.966 5.234 736 HD23 LEU 81 HD23 LEU 81 -13.994 -14.533 5.486 737 H LEU 82 H LEU 82 -14.013 -14.976 -0.110 738 HA LEU 82 HA LEU 82 -13.193 -17.622 -1.202 739 HB2 LEU 82 HB2 LEU 82 -13.339 -14.964 -2.663 740 HB3 LEU 82 HB3 LEU 82 -13.286 -16.571 -3.358 741 HG LEU 82 HG LEU 82 -15.668 -15.367 -1.858 742 HD11 LEU 82 HD11 LEU 82 -16.704 -15.227 -4.066 743 HD12 LEU 82 HD12 LEU 82 -15.218 -14.264 -4.014 744 HD13 LEU 82 HD13 LEU 82 -15.224 -15.847 -4.834 745 HD21 LEU 82 HD21 LEU 82 -15.613 -17.837 -1.698 746 HD22 LEU 82 HD22 LEU 82 -16.896 -17.297 -2.777 747 HD23 LEU 82 HD23 LEU 82 -15.402 -17.953 -3.469 748 H VAL 83 H VAL 83 -11.025 -18.062 -1.409 749 HA VAL 83 HA VAL 83 -9.055 -15.869 -0.837 750 HB VAL 83 HB VAL 83 -8.613 -18.871 -0.890 751 HG11 VAL 83 HG11 VAL 83 -6.396 -18.178 0.140 752 HG12 VAL 83 HG12 VAL 83 -6.575 -17.800 -1.577 753 HG13 VAL 83 HG13 VAL 83 -6.761 -16.513 -0.367 754 HG21 VAL 83 HG21 VAL 83 -8.686 -16.885 1.426 755 HG22 VAL 83 HG22 VAL 83 -9.891 -18.146 1.104 756 HG23 VAL 83 HG23 VAL 83 -8.240 -18.601 1.549 757 H ASN 84 H ASN 84 -7.901 -15.037 -2.501 758 HA ASN 84 HA ASN 84 -7.664 -14.426 -4.711 759 HB2 ASN 84 HB2 ASN 84 -6.517 -17.235 -4.597 760 HB3 ASN 84 HB3 ASN 84 -6.294 -16.162 -5.978 761 HD21 ASN 84 HD21 ASN 84 -3.674 -15.718 -3.103 762 HD22 ASN 84 HD22 ASN 84 -4.459 -17.220 -3.600 763 H GLY 85 H GLY 85 -10.212 -14.697 -4.414 764 HA2 GLY 85 HA2 GLY 85 -12.116 -14.641 -5.665 765 HA3 GLY 85 HA3 GLY 85 -11.181 -15.120 -7.076 766 H HIS 86 H HIS 86 -10.869 -17.537 -4.652 767 HA HIS 86 HA HIS 86 -13.187 -19.106 -5.735 768 HB2 HIS 86 HB2 HIS 86 -10.311 -20.036 -5.357 769 HB3 HIS 86 HB3 HIS 86 -11.668 -21.082 -5.782 770 HD1 HIS 86 HD1 HIS 86 -9.430 -18.360 -7.342 771 HD2 HIS 86 HD2 HIS 86 -12.756 -20.818 -8.260 772 HE1 HIS 86 HE1 HIS 86 -9.754 -18.232 -9.897 773 HE2 HIS 86 HE2 HIS 86 -11.773 -19.732 -10.446 774 H SER 87 H SER 87 -14.121 -20.703 -4.362 775 HA SER 87 HA SER 87 -14.282 -19.734 -1.656 776 HB2 SER 87 HB2 SER 87 -16.231 -20.628 -2.808 777 HB3 SER 87 HB3 SER 87 -15.483 -22.243 -2.850 778 HG SER 87 HG SER 87 -16.906 -21.980 -1.056 779 H MET 88 H MET 88 -13.552 -20.414 0.215 780 HA MET 88 HA MET 88 -12.089 -23.012 0.467 781 HB2 MET 88 HB2 MET 88 -11.312 -20.317 1.636 782 HB3 MET 88 HB3 MET 88 -10.587 -21.847 2.135 783 HG2 MET 88 HG2 MET 88 -10.482 -20.728 -0.684 784 HG3 MET 88 HG3 MET 88 -9.208 -20.614 0.534 785 HE1 MET 88 HE1 MET 88 -7.645 -23.060 -2.067 786 HE2 MET 88 HE2 MET 88 -8.725 -21.691 -2.411 787 HE3 MET 88 HE3 MET 88 -7.454 -21.531 -1.181 788 H VAL 89 H VAL 89 -14.942 -22.098 1.039 789 HA VAL 89 HA VAL 89 -15.316 -21.492 3.697 790 HB VAL 89 HB VAL 89 -16.932 -21.375 1.766 791 HG11 VAL 89 HG11 VAL 89 -18.615 -23.107 1.561 792 HG12 VAL 89 HG12 VAL 89 -17.024 -23.810 1.228 793 HG13 VAL 89 HG13 VAL 89 -17.820 -24.104 2.793 794 HG21 VAL 89 HG21 VAL 89 -18.868 -21.277 3.223 795 HG22 VAL 89 HG22 VAL 89 -18.031 -22.220 4.471 796 HG23 VAL 89 HG23 VAL 89 -17.457 -20.595 4.039 797 H SER 90 H SER 90 -14.795 -24.755 2.548 798 HA SER 90 HA SER 90 -15.552 -25.933 5.154 799 HB2 SER 90 HB2 SER 90 -14.655 -27.193 2.542 800 HB3 SER 90 HB3 SER 90 -15.149 -28.083 3.989 801 HG SER 90 HG SER 90 -16.895 -27.815 2.518 802 H VAL 91 H VAL 91 -12.624 -24.609 4.016 803 HA VAL 91 HA VAL 91 -10.969 -26.843 4.833 804 HB VAL 91 HB VAL 91 -10.567 -25.287 2.845 805 HG11 VAL 91 HG11 VAL 91 -10.357 -23.180 4.206 806 HG12 VAL 91 HG12 VAL 91 -8.842 -23.825 4.878 807 HG13 VAL 91 HG13 VAL 91 -8.980 -23.516 3.137 808 HG21 VAL 91 HG21 VAL 91 -8.249 -26.214 4.589 809 HG22 VAL 91 HG22 VAL 91 -9.162 -27.214 3.433 810 HG23 VAL 91 HG23 VAL 91 -8.193 -25.854 2.854 811 H SER 92 H SER 92 -9.790 -27.280 6.553 812 HA SER 92 HA SER 92 -10.228 -25.609 8.942 813 HB2 SER 92 HB2 SER 92 -9.612 -27.676 10.132 814 HB3 SER 92 HB3 SER 92 -10.911 -27.934 8.956 815 HG SER 92 HG SER 92 -9.278 -29.569 8.822 816 H THR 93 H THR 93 -7.632 -25.942 6.787 817 HA THR 93 HA THR 93 -5.462 -26.238 8.507 818 HB THR 93 HB THR 93 -5.569 -26.481 5.987 819 HG1 THR 93 HG1 THR 93 -3.368 -26.338 5.923 820 HG21 THR 93 HG21 THR 93 -4.492 -23.631 6.060 821 HG22 THR 93 HG22 THR 93 -4.696 -24.676 4.642 822 HG23 THR 93 HG23 THR 93 -6.124 -24.060 5.493 823 HA PRO 94 HA PRO 94 -4.711 -22.427 10.652 824 HB2 PRO 94 HB2 PRO 94 -1.797 -22.832 9.991 825 HB3 PRO 94 HB3 PRO 94 -2.553 -22.413 11.561 826 HG2 PRO 94 HG2 PRO 94 -1.768 -24.954 11.095 827 HG3 PRO 94 HG3 PRO 94 -3.373 -24.653 11.842 828 HD2 PRO 94 HD2 PRO 94 -2.724 -25.223 8.942 829 HD3 PRO 94 HD3 PRO 94 -3.984 -25.958 9.979 830 H ILE 95 H ILE 95 -4.532 -20.234 10.222 831 HA ILE 95 HA ILE 95 -4.691 -19.406 7.536 832 HB ILE 95 HB ILE 95 -5.709 -18.272 9.498 833 HG12 ILE 95 HG12 ILE 95 -5.444 -15.962 8.809 834 HG13 ILE 95 HG13 ILE 95 -3.964 -16.321 7.923 835 HG21 ILE 95 HG21 ILE 95 -3.694 -18.345 11.026 836 HG22 ILE 95 HG22 ILE 95 -2.946 -17.071 10.036 837 HG23 ILE 95 HG23 ILE 95 -4.440 -16.761 10.918 838 HD11 ILE 95 HD11 ILE 95 -6.017 -16.074 6.493 839 HD12 ILE 95 HD12 ILE 95 -5.200 -17.622 6.274 840 HD13 ILE 95 HD13 ILE 95 -6.683 -17.540 7.249 841 H SER 96 H SER 96 -1.801 -19.688 9.507 842 HA SER 96 HA SER 96 0.003 -18.123 7.903 843 HB2 SER 96 HB2 SER 96 1.716 -19.600 9.022 844 HB3 SER 96 HB3 SER 96 0.619 -18.757 10.135 845 HG SER 96 HG SER 96 0.922 -21.069 10.578 846 H GLU 97 H GLU 97 -1.029 -21.558 7.724 847 HA GLU 97 HA GLU 97 0.712 -22.253 5.514 848 HB2 GLU 97 HB2 GLU 97 -1.931 -23.501 6.386 849 HB3 GLU 97 HB3 GLU 97 -0.791 -24.218 5.263 850 HG2 GLU 97 HG2 GLU 97 -0.255 -23.623 8.210 851 HG3 GLU 97 HG3 GLU 97 -0.679 -25.188 7.535 852 H VAL 98 H VAL 98 -2.671 -21.086 5.693 853 HA VAL 98 HA VAL 98 -3.064 -21.002 2.848 854 HB VAL 98 HB VAL 98 -4.373 -19.045 4.727 855 HG11 VAL 98 HG11 VAL 98 -5.347 -20.391 2.162 856 HG12 VAL 98 HG12 VAL 98 -6.203 -19.145 3.096 857 HG13 VAL 98 HG13 VAL 98 -4.705 -18.741 2.242 858 HG21 VAL 98 HG21 VAL 98 -4.771 -21.217 5.742 859 HG22 VAL 98 HG22 VAL 98 -6.237 -20.670 4.927 860 HG23 VAL 98 HG23 VAL 98 -5.217 -21.905 4.162 861 H TYR 99 H TYR 99 -1.806 -18.421 5.056 862 HA TYR 99 HA TYR 99 -1.223 -16.587 2.981 863 HB2 TYR 99 HB2 TYR 99 -1.178 -15.625 5.043 864 HB3 TYR 99 HB3 TYR 99 -0.238 -16.923 5.755 865 HD1 TYR 99 HD1 TYR 99 0.037 -14.004 3.410 866 HD2 TYR 99 HD2 TYR 99 2.096 -16.785 5.997 867 HE1 TYR 99 HE1 TYR 99 2.152 -12.699 3.148 868 HE2 TYR 99 HE2 TYR 99 4.180 -15.457 5.771 869 HH TYR 99 HH TYR 99 5.143 -13.509 4.927 870 H GLU 100 H GLU 100 0.986 -19.133 4.175 871 HA GLU 100 HA GLU 100 3.107 -18.364 2.485 872 HB2 GLU 100 HB2 GLU 100 3.288 -19.818 4.471 873 HB3 GLU 100 HB3 GLU 100 2.377 -21.075 3.638 874 HG2 GLU 100 HG2 GLU 100 4.693 -21.639 3.644 875 HG3 GLU 100 HG3 GLU 100 4.179 -21.331 1.993 876 H SER 101 H SER 101 0.275 -20.326 1.753 877 HA SER 101 HA SER 101 1.274 -21.102 -0.914 878 HB2 SER 101 HB2 SER 101 0.029 -22.654 0.552 879 HB3 SER 101 HB3 SER 101 -1.386 -21.582 0.476 880 HG SER 101 HG SER 101 -1.434 -23.358 -1.053 881 H GLU 102 H GLU 102 -1.050 -18.746 0.398 882 HA GLU 102 HA GLU 102 -1.928 -17.987 -2.357 883 HB2 GLU 102 HB2 GLU 102 -3.400 -17.841 0.294 884 HB3 GLU 102 HB3 GLU 102 -4.067 -17.373 -1.239 885 HG2 GLU 102 HG2 GLU 102 -3.137 -20.206 -0.589 886 HG3 GLU 102 HG3 GLU 102 -4.777 -19.631 -0.420 887 H LYS 103 H LYS 103 0.195 -16.585 -0.259 888 HA LYS 103 HA LYS 103 -0.700 -13.851 -0.351 889 HB2 LYS 103 HB2 LYS 103 1.535 -13.201 0.134 890 HB3 LYS 103 HB3 LYS 103 1.205 -14.667 1.052 891 HG2 LYS 103 HG2 LYS 103 2.408 -15.965 -0.828 892 HG3 LYS 103 HG3 LYS 103 2.844 -14.390 -1.502 893 HD2 LYS 103 HD2 LYS 103 4.730 -14.992 -0.318 894 HD3 LYS 103 HD3 LYS 103 3.928 -13.875 0.794 895 HE2 LYS 103 HE2 LYS 103 3.029 -15.788 2.091 896 HE3 LYS 103 HE3 LYS 103 3.626 -16.915 0.870 897 HZ1 LYS 103 HZ1 LYS 103 5.329 -15.278 2.685 898 HZ2 LYS 103 HZ2 LYS 103 5.203 -16.927 2.648 899 HZ3 LYS 103 HZ3 LYS 103 5.920 -16.143 1.424 900 H ASP 104 H ASP 104 -0.461 -12.223 -1.851 901 HA ASP 104 HA ASP 104 -0.002 -13.086 -4.657 902 HB2 ASP 104 HB2 ASP 104 -2.034 -11.869 -4.063 903 HB3 ASP 104 HB3 ASP 104 -1.059 -10.501 -3.491 904 H GLU 105 H GLU 105 1.216 -11.519 -6.111 905 HA GLU 105 HA GLU 105 3.951 -11.161 -5.283 906 HB2 GLU 105 HB2 GLU 105 2.422 -9.829 -7.555 907 HB3 GLU 105 HB3 GLU 105 4.168 -9.832 -7.374 908 HG2 GLU 105 HG2 GLU 105 2.404 -12.266 -7.853 909 HG3 GLU 105 HG3 GLU 105 3.388 -11.425 -9.049 910 H ASP 106 H ASP 106 1.184 -8.926 -5.335 911 HA ASP 106 HA ASP 106 2.601 -6.559 -4.545 912 HB2 ASP 106 HB2 ASP 106 -0.319 -7.344 -4.262 913 HB3 ASP 106 HB3 ASP 106 0.326 -5.757 -3.879 914 H GLY 107 H GLY 107 2.222 -9.345 -2.774 915 HA2 GLY 107 HA2 GLY 107 2.728 -9.775 -0.528 916 HA3 GLY 107 HA3 GLY 107 2.567 -8.058 -0.126 917 H PHE 108 H PHE 108 1.361 -9.705 1.573 918 HA PHE 108 HA PHE 108 -0.505 -10.242 2.621 919 HB2 PHE 108 HB2 PHE 108 -1.730 -8.106 0.921 920 HB3 PHE 108 HB3 PHE 108 -2.715 -9.092 1.974 921 HD1 PHE 108 HD1 PHE 108 -3.182 -8.223 4.080 922 HD2 PHE 108 HD2 PHE 108 0.506 -7.124 2.158 923 HE1 PHE 108 HE1 PHE 108 -2.567 -6.885 6.064 924 HE2 PHE 108 HE2 PHE 108 1.158 -5.829 4.161 925 HZ PHE 108 HZ PHE 108 -0.352 -5.729 6.139 926 H LEU 109 H LEU 109 -2.081 -11.723 2.909 927 HA LEU 109 HA LEU 109 -2.589 -13.622 0.713 928 HB2 LEU 109 HB2 LEU 109 -2.253 -14.148 3.193 929 HB3 LEU 109 HB3 LEU 109 -3.824 -13.429 3.473 930 HG LEU 109 HG LEU 109 -3.164 -15.999 2.000 931 HD11 LEU 109 HD11 LEU 109 -3.340 -16.055 4.480 932 HD12 LEU 109 HD12 LEU 109 -4.924 -15.281 4.392 933 HD13 LEU 109 HD13 LEU 109 -4.697 -16.913 3.745 934 HD21 LEU 109 HD21 LEU 109 -5.628 -16.308 1.705 935 HD22 LEU 109 HD22 LEU 109 -5.857 -14.584 2.092 936 HD23 LEU 109 HD23 LEU 109 -4.939 -15.085 0.643 937 H TYR 110 H TYR 110 -3.883 -12.750 -0.907 938 HA TYR 110 HA TYR 110 -6.035 -10.949 -0.294 939 HB2 TYR 110 HB2 TYR 110 -4.988 -12.069 -2.816 940 HB3 TYR 110 HB3 TYR 110 -6.622 -11.436 -2.802 941 HD1 TYR 110 HD1 TYR 110 -3.058 -10.513 -2.122 942 HD2 TYR 110 HD2 TYR 110 -7.088 -9.106 -2.774 943 HE1 TYR 110 HE1 TYR 110 -2.191 -8.226 -2.539 944 HE2 TYR 110 HE2 TYR 110 -6.213 -6.813 -3.179 945 HH TYR 110 HH TYR 110 -2.710 -6.062 -3.182 946 H MET 111 H MET 111 -8.018 -11.180 0.346 947 HA MET 111 HA MET 111 -9.508 -13.526 -0.669 948 HB2 MET 111 HB2 MET 111 -10.256 -12.339 2.010 949 HB3 MET 111 HB3 MET 111 -10.727 -13.857 1.280 950 HG2 MET 111 HG2 MET 111 -8.309 -14.609 1.498 951 HG3 MET 111 HG3 MET 111 -8.035 -13.174 2.496 952 HE1 MET 111 HE1 MET 111 -7.996 -16.197 4.988 953 HE2 MET 111 HE2 MET 111 -7.390 -16.106 3.337 954 HE3 MET 111 HE3 MET 111 -7.138 -14.738 4.459 955 H VAL 112 H VAL 112 -11.591 -13.193 -1.263 956 HA VAL 112 HA VAL 112 -12.667 -10.406 -1.326 957 HB VAL 112 HB VAL 112 -12.882 -12.559 -3.466 958 HG11 VAL 112 HG11 VAL 112 -14.130 -10.888 -4.800 959 HG12 VAL 112 HG12 VAL 112 -15.019 -11.380 -3.360 960 HG13 VAL 112 HG13 VAL 112 -14.177 -9.807 -3.388 961 HG21 VAL 112 HG21 VAL 112 -11.767 -10.921 -4.939 962 HG22 VAL 112 HG22 VAL 112 -11.607 -9.797 -3.568 963 HG23 VAL 112 HG23 VAL 112 -10.737 -11.344 -3.572 964 H TYR 113 H TYR 113 -15.012 -10.335 -0.837 965 HA TYR 113 HA TYR 113 -16.230 -13.027 -0.318 966 HB2 TYR 113 HB2 TYR 113 -16.908 -12.574 1.825 967 HB3 TYR 113 HB3 TYR 113 -15.338 -11.818 1.835 968 HD1 TYR 113 HD1 TYR 113 -18.911 -11.363 2.208 969 HD2 TYR 113 HD2 TYR 113 -15.188 -9.280 1.597 970 HE1 TYR 113 HE1 TYR 113 -19.949 -9.258 3.063 971 HE2 TYR 113 HE2 TYR 113 -16.219 -7.190 2.477 972 HH TYR 113 HH TYR 113 -19.495 -7.085 3.811 973 H ALA 114 H ALA 114 -18.474 -13.049 -0.518 974 HA ALA 114 HA ALA 114 -19.896 -10.828 -1.842 975 HB1 ALA 114 HB1 ALA 114 -18.940 -13.329 -3.315 976 HB2 ALA 114 HB2 ALA 114 -20.006 -12.077 -3.997 977 HB3 ALA 114 HB3 ALA 114 -18.331 -11.697 -3.578 978 H SER 115 H SER 115 -22.018 -11.800 -2.872 979 HA SER 115 HA SER 115 -23.396 -13.473 -0.867 980 HB2 SER 115 HB2 SER 115 -24.354 -11.403 -1.985 981 HB3 SER 115 HB3 SER 115 -24.420 -12.342 -3.485 982 HG SER 115 HG SER 115 -26.409 -12.425 -2.366 983 H GLN 116 H GLN 116 -21.685 -13.943 -3.819 984 HA GLN 116 HA GLN 116 -22.509 -16.783 -4.030 985 HB2 GLN 116 HB2 GLN 116 -22.379 -16.459 -6.580 986 HB3 GLN 116 HB3 GLN 116 -23.819 -15.935 -5.716 987 HG2 GLN 116 HG2 GLN 116 -23.271 -14.343 -7.437 988 HG3 GLN 116 HG3 GLN 116 -23.142 -13.598 -5.858 989 HE21 GLN 116 HE21 GLN 116 -21.488 -12.119 -5.904 990 HE22 GLN 116 HE22 GLN 116 -19.962 -12.376 -6.776 991 H GLU 117 H GLU 117 -20.924 -18.228 -4.979 992 HA GLU 117 HA GLU 117 -18.186 -17.303 -4.508 993 HB2 GLU 117 HB2 GLU 117 -17.482 -19.550 -4.800 994 HB3 GLU 117 HB3 GLU 117 -18.918 -19.518 -3.777 995 HG2 GLU 117 HG2 GLU 117 -20.289 -20.159 -5.818 996 HG3 GLU 117 HG3 GLU 117 -18.766 -20.330 -6.700 997 H THR 118 H THR 118 -20.081 -18.095 -7.415 998 HA THR 118 HA THR 118 -18.290 -16.394 -8.913 999 HB THR 118 HB THR 118 -17.681 -17.608 -10.690 1000 HG1 THR 118 HG1 THR 118 -18.612 -19.580 -11.292 1001 HG21 THR 118 HG21 THR 118 -16.404 -18.561 -8.795 1002 HG22 THR 118 HG22 THR 118 -17.644 -19.820 -8.598 1003 HG23 THR 118 HG23 THR 118 -16.673 -19.738 -10.077 1004 H PHE 119 H PHE 119 -19.075 -15.407 -10.767 1005 HA PHE 119 HA PHE 119 -21.899 -14.868 -10.550 1006 HB2 PHE 119 HB2 PHE 119 -21.338 -13.055 -12.275 1007 HB3 PHE 119 HB3 PHE 119 -20.779 -12.952 -10.622 1008 HD1 PHE 119 HD1 PHE 119 -19.681 -13.874 -14.078 1009 HD2 PHE 119 HD2 PHE 119 -18.454 -12.807 -10.078 1010 HE1 PHE 119 HE1 PHE 119 -17.335 -13.661 -14.855 1011 HE2 PHE 119 HE2 PHE 119 -16.108 -12.589 -10.859 1012 HZ PHE 119 HZ PHE 119 -15.545 -13.009 -13.249 1013 H GLY 120 H GLY 120 -20.524 -17.203 -12.371 1014 HA2 GLY 120 HA2 GLY 120 -22.428 -17.017 -14.672 1015 HA3 GLY 120 HA3 GLY 120 -21.027 -18.071 -14.559 1016 H1 ASP 10 H1 ASP 10 -7.264 4.769 12.424 1017 H2 ASP 10 H2 ASP 10 -7.590 5.749 13.696 1018 H3 ASP 10 H3 ASP 10 -6.155 4.969 13.619 1019 HA ASP 10 HA ASP 10 -7.579 3.956 15.242 1020 HB2 ASP 10 HB2 ASP 10 -9.546 3.654 12.968 1021 HB3 ASP 10 HB3 ASP 10 -9.619 2.707 14.461 1022 H TYR 11 H TYR 11 -6.960 2.030 15.961 1023 HA TYR 11 HA TYR 11 -5.159 0.622 14.245 1024 HB2 TYR 11 HB2 TYR 11 -5.864 0.255 17.141 1025 HB3 TYR 11 HB3 TYR 11 -4.704 -0.761 16.317 1026 HD1 TYR 11 HD1 TYR 11 -2.966 0.862 14.702 1027 HD2 TYR 11 HD2 TYR 11 -4.799 1.829 18.498 1028 HE1 TYR 11 HE1 TYR 11 -1.142 2.452 15.178 1029 HE2 TYR 11 HE2 TYR 11 -2.969 3.435 18.959 1030 HH TYR 11 HH TYR 11 -1.008 4.384 18.205 1031 H GLU 12 H GLU 12 -8.377 0.078 14.295 1032 HA GLU 12 HA GLU 12 -8.254 -2.790 13.696 1033 HB2 GLU 12 HB2 GLU 12 -10.529 -2.605 13.017 1034 HB3 GLU 12 HB3 GLU 12 -10.291 -1.877 14.593 1035 HG2 GLU 12 HG2 GLU 12 -10.472 0.357 13.714 1036 HG3 GLU 12 HG3 GLU 12 -10.372 -0.208 12.049 1037 H SER 13 H SER 13 -7.089 -0.090 11.931 1038 HA SER 13 HA SER 13 -6.795 -1.700 9.486 1039 HB2 SER 13 HB2 SER 13 -9.072 -1.044 9.122 1040 HB3 SER 13 HB3 SER 13 -8.726 0.612 9.612 1041 HG SER 13 HG SER 13 -8.415 -0.609 7.170 1042 H ASP 14 H ASP 14 -6.146 1.514 10.997 1043 HA ASP 14 HA ASP 14 -4.960 2.500 8.642 1044 HB2 ASP 14 HB2 ASP 14 -5.028 3.578 11.413 1045 HB3 ASP 14 HB3 ASP 14 -4.224 4.422 10.091 1046 H ASP 15 H ASP 15 -2.669 2.939 11.233 1047 HA ASP 15 HA ASP 15 -0.587 1.898 9.397 1048 HB2 ASP 15 HB2 ASP 15 -0.891 4.700 10.381 1049 HB3 ASP 15 HB3 ASP 15 0.715 4.046 10.077 1050 H ASP 16 H ASP 16 1.361 1.226 10.066 1051 HA ASP 16 HA ASP 16 2.799 0.167 11.348 1052 HB2 ASP 16 HB2 ASP 16 2.560 2.755 12.841 1053 HB3 ASP 16 HB3 ASP 16 3.753 1.526 13.246 1054 H SER 17 H SER 17 1.465 1.373 14.362 1055 HA SER 17 HA SER 17 2.009 -1.164 15.585 1056 HB2 SER 17 HB2 SER 17 0.710 1.351 16.693 1057 HB3 SER 17 HB3 SER 17 1.276 -0.028 17.658 1058 HG SER 17 HG SER 17 2.863 1.633 17.528 1059 H TYR 18 H TYR 18 -0.346 -1.151 13.612 1060 HA TYR 18 HA TYR 18 -2.702 -1.468 15.212 1061 HB2 TYR 18 HB2 TYR 18 -3.760 -2.305 13.080 1062 HB3 TYR 18 HB3 TYR 18 -3.193 -0.664 13.140 1063 HD1 TYR 18 HD1 TYR 18 -1.895 -4.058 12.105 1064 HD2 TYR 18 HD2 TYR 18 -2.099 0.150 11.313 1065 HE1 TYR 18 HE1 TYR 18 -1.075 -4.467 9.791 1066 HE2 TYR 18 HE2 TYR 18 -1.125 -0.242 9.033 1067 HH TYR 18 HH TYR 18 -0.374 -3.489 7.798 1068 H GLU 19 H GLU 19 -4.155 -3.165 15.464 1069 HA GLU 19 HA GLU 19 -2.959 -5.921 15.291 1070 HB2 GLU 19 HB2 GLU 19 -5.099 -4.918 17.190 1071 HB3 GLU 19 HB3 GLU 19 -4.516 -6.578 17.080 1072 HG2 GLU 19 HG2 GLU 19 -2.905 -4.138 17.929 1073 HG3 GLU 19 HG3 GLU 19 -3.504 -5.421 18.972 1074 H VAL 20 H VAL 20 -5.531 -3.888 14.151 1075 HA VAL 20 HA VAL 20 -7.009 -4.100 12.558 1076 HB VAL 20 HB VAL 20 -5.758 -6.489 11.344 1077 HG11 VAL 20 HG11 VAL 20 -6.613 -3.816 10.184 1078 HG12 VAL 20 HG12 VAL 20 -6.133 -5.246 9.282 1079 HG13 VAL 20 HG13 VAL 20 -7.655 -5.245 10.212 1080 HG21 VAL 20 HG21 VAL 20 -3.806 -5.218 12.060 1081 HG22 VAL 20 HG22 VAL 20 -4.031 -5.014 10.321 1082 HG23 VAL 20 HG23 VAL 20 -4.524 -3.711 11.416 1083 H LEU 21 H LEU 21 -6.744 -7.377 13.901 1084 HA LEU 21 HA LEU 21 -9.405 -8.220 12.948 1085 HB2 LEU 21 HB2 LEU 21 -7.190 -9.581 13.321 1086 HB3 LEU 21 HB3 LEU 21 -7.665 -9.580 15.012 1087 HG LEU 21 HG LEU 21 -9.842 -10.728 14.300 1088 HD11 LEU 21 HD11 LEU 21 -9.742 -11.881 12.043 1089 HD12 LEU 21 HD12 LEU 21 -9.995 -10.141 11.933 1090 HD13 LEU 21 HD13 LEU 21 -8.382 -10.823 11.615 1091 HD21 LEU 21 HD21 LEU 21 -7.855 -11.961 15.156 1092 HD22 LEU 21 HD22 LEU 21 -8.787 -12.905 13.976 1093 HD23 LEU 21 HD23 LEU 21 -7.266 -12.117 13.490 1094 H ASP 22 H ASP 22 -8.576 -6.057 15.274 1095 HA ASP 22 HA ASP 22 -9.256 -5.425 17.267 1096 HB2 ASP 22 HB2 ASP 22 -10.780 -4.383 15.843 1097 HB3 ASP 22 HB3 ASP 22 -11.773 -5.823 15.706 1098 H LEU 23 H LEU 23 -8.427 -8.000 17.535 1099 HA LEU 23 HA LEU 23 -9.512 -8.701 20.126 1100 HB2 LEU 23 HB2 LEU 23 -10.249 -10.922 19.663 1101 HB3 LEU 23 HB3 LEU 23 -11.068 -9.854 18.555 1102 HG LEU 23 HG LEU 23 -9.134 -10.582 16.858 1103 HD11 LEU 23 HD11 LEU 23 -8.625 -13.043 17.184 1104 HD12 LEU 23 HD12 LEU 23 -7.776 -12.012 18.325 1105 HD13 LEU 23 HD13 LEU 23 -9.218 -12.908 18.847 1106 HD21 LEU 23 HD21 LEU 23 -11.532 -11.000 16.571 1107 HD22 LEU 23 HD22 LEU 23 -10.593 -12.428 16.116 1108 HD23 LEU 23 HD23 LEU 23 -11.446 -12.394 17.674 1109 H THR 24 H THR 24 -8.249 -10.480 21.147 1110 HA THR 24 HA THR 24 -5.581 -10.918 19.979 1111 HB THR 24 HB THR 24 -4.313 -10.411 21.762 1112 HG1 THR 24 HG1 THR 24 -5.074 -10.170 23.851 1113 HG21 THR 24 HG21 THR 24 -5.292 -8.299 20.830 1114 HG22 THR 24 HG22 THR 24 -6.530 -8.345 22.112 1115 HG23 THR 24 HG23 THR 24 -4.815 -8.168 22.533 1116 H GLU 25 H GLU 25 -4.390 -12.778 20.541 1117 HA GLU 25 HA GLU 25 -6.143 -15.090 20.862 1118 HB2 GLU 25 HB2 GLU 25 -4.343 -15.035 19.197 1119 HB3 GLU 25 HB3 GLU 25 -3.145 -14.804 20.463 1120 HG2 GLU 25 HG2 GLU 25 -3.089 -17.074 19.644 1121 HG3 GLU 25 HG3 GLU 25 -3.534 -17.047 21.340 1122 H TYR 26 H TYR 26 -4.001 -13.340 22.998 1123 HA TYR 26 HA TYR 26 -4.219 -15.439 25.067 1124 HB2 TYR 26 HB2 TYR 26 -1.776 -13.909 24.285 1125 HB3 TYR 26 HB3 TYR 26 -1.951 -14.646 25.864 1126 HD1 TYR 26 HD1 TYR 26 -2.412 -17.138 26.069 1127 HD2 TYR 26 HD2 TYR 26 -1.136 -15.268 22.400 1128 HE1 TYR 26 HE1 TYR 26 -1.639 -19.352 25.212 1129 HE2 TYR 26 HE2 TYR 26 -0.359 -17.478 21.544 1130 HH TYR 26 HH TYR 26 -0.573 -20.469 23.518 Start of MODEL 6 1 H1 MET 1 H1 MET 1 -6.760 1.818 6.302 2 H2 MET 1 H2 MET 1 -7.703 0.582 6.761 3 H3 MET 1 H3 MET 1 -7.616 0.971 5.161 4 HA MET 1 HA MET 1 -8.649 2.815 7.248 5 HB2 MET 1 HB2 MET 1 -7.814 3.978 5.285 6 HB3 MET 1 HB3 MET 1 -8.752 2.951 4.202 7 HG2 MET 1 HG2 MET 1 -10.846 3.887 5.110 8 HG3 MET 1 HG3 MET 1 -9.924 4.876 6.253 9 HE1 MET 1 HE1 MET 1 -11.258 7.022 5.441 10 HE2 MET 1 HE2 MET 1 -11.399 7.510 3.737 11 HE3 MET 1 HE3 MET 1 -12.174 6.010 4.290 12 HA PRO 2 HA PRO 2 -12.154 -0.092 7.049 13 HB2 PRO 2 HB2 PRO 2 -13.544 0.954 9.177 14 HB3 PRO 2 HB3 PRO 2 -12.232 -0.252 9.338 15 HG2 PRO 2 HG2 PRO 2 -12.118 2.741 9.725 16 HG3 PRO 2 HG3 PRO 2 -11.333 1.462 10.703 17 HD2 PRO 2 HD2 PRO 2 -10.039 2.922 8.779 18 HD3 PRO 2 HD3 PRO 2 -9.586 1.234 9.180 19 H SER 3 H SER 3 -13.811 0.274 5.678 20 HA SER 3 HA SER 3 -15.322 2.732 5.405 21 HB2 SER 3 HB2 SER 3 -13.134 3.480 4.451 22 HB3 SER 3 HB3 SER 3 -13.164 2.109 3.338 23 HG SER 3 HG SER 3 -14.940 4.356 3.421 24 H GLU 4 H GLU 4 -16.813 2.636 3.548 25 HA GLU 4 HA GLU 4 -17.750 -0.046 2.813 26 HB2 GLU 4 HB2 GLU 4 -18.447 2.673 1.624 27 HB3 GLU 4 HB3 GLU 4 -19.314 1.151 1.369 28 HG2 GLU 4 HG2 GLU 4 -19.787 1.074 3.844 29 HG3 GLU 4 HG3 GLU 4 -19.081 2.682 3.993 30 H LYS 5 H LYS 5 -15.437 2.223 1.548 31 HA LYS 5 HA LYS 5 -15.278 0.958 -1.140 32 HB2 LYS 5 HB2 LYS 5 -14.043 3.474 0.032 33 HB3 LYS 5 HB3 LYS 5 -13.718 2.881 -1.604 34 HG2 LYS 5 HG2 LYS 5 -16.117 3.068 -2.164 35 HG3 LYS 5 HG3 LYS 5 -16.464 3.672 -0.535 36 HD2 LYS 5 HD2 LYS 5 -14.965 5.612 -0.921 37 HD3 LYS 5 HD3 LYS 5 -14.634 5.026 -2.564 38 HE2 LYS 5 HE2 LYS 5 -17.057 5.193 -3.114 39 HE3 LYS 5 HE3 LYS 5 -17.394 5.760 -1.473 40 HZ1 LYS 5 HZ1 LYS 5 -16.011 7.725 -1.935 41 HZ2 LYS 5 HZ2 LYS 5 -15.690 7.201 -3.451 42 HZ3 LYS 5 HZ3 LYS 5 -17.211 7.618 -3.032 43 H THR 6 H THR 6 -13.097 0.603 -2.046 44 HA THR 6 HA THR 6 -11.747 -1.357 -0.514 45 HB THR 6 HB THR 6 -10.538 -1.963 -2.335 46 HG1 THR 6 HG1 THR 6 -10.001 -0.466 -4.000 47 HG21 THR 6 HG21 THR 6 -11.855 -1.837 -4.329 48 HG22 THR 6 HG22 THR 6 -12.987 -1.918 -2.976 49 HG23 THR 6 HG23 THR 6 -12.684 -0.363 -3.794 50 H PHE 7 H PHE 7 -9.450 -1.645 -0.057 51 HA PHE 7 HA PHE 7 -8.479 0.421 1.673 52 HB2 PHE 7 HB2 PHE 7 -6.688 -1.017 2.093 53 HB3 PHE 7 HB3 PHE 7 -7.940 -2.140 1.614 54 HD1 PHE 7 HD1 PHE 7 -4.762 -0.517 0.661 55 HD2 PHE 7 HD2 PHE 7 -7.668 -3.488 -0.462 56 HE1 PHE 7 HE1 PHE 7 -3.195 -1.396 -1.041 57 HE2 PHE 7 HE2 PHE 7 -6.112 -4.359 -2.177 58 HZ PHE 7 HZ PHE 7 -3.874 -3.324 -2.476 59 H LYS 8 H LYS 8 -8.151 0.097 -1.820 60 HA LYS 8 HA LYS 8 -5.682 1.519 -2.211 61 HB2 LYS 8 HB2 LYS 8 -6.808 0.045 -3.875 62 HB3 LYS 8 HB3 LYS 8 -8.122 1.211 -4.011 63 HG2 LYS 8 HG2 LYS 8 -6.667 1.343 -5.916 64 HG3 LYS 8 HG3 LYS 8 -6.632 2.858 -5.030 65 HD2 LYS 8 HD2 LYS 8 -4.461 2.191 -3.987 66 HD3 LYS 8 HD3 LYS 8 -4.493 0.673 -4.890 67 HE2 LYS 8 HE2 LYS 8 -4.427 3.484 -6.098 68 HE3 LYS 8 HE3 LYS 8 -3.016 2.448 -5.879 69 HZ1 LYS 8 HZ1 LYS 8 -5.322 1.838 -7.666 70 HZ2 LYS 8 HZ2 LYS 8 -3.827 2.263 -8.137 71 HZ3 LYS 8 HZ3 LYS 8 -4.054 0.823 -7.414 72 H GLN 9 H GLN 9 -8.749 2.643 -1.201 73 HA GLN 9 HA GLN 9 -8.679 5.406 -1.858 74 HB2 GLN 9 HB2 GLN 9 -10.568 4.100 -0.925 75 HB3 GLN 9 HB3 GLN 9 -9.688 3.922 0.603 76 HG2 GLN 9 HG2 GLN 9 -9.869 6.332 1.014 77 HG3 GLN 9 HG3 GLN 9 -10.620 6.572 -0.577 78 HE21 GLN 9 HE21 GLN 9 -11.454 3.783 1.543 79 HE22 GLN 9 HE22 GLN 9 -13.055 4.386 1.935 80 H ARG 10 H ARG 10 -6.729 3.581 0.473 81 HA ARG 10 HA ARG 10 -5.414 6.141 1.326 82 HB2 ARG 10 HB2 ARG 10 -6.759 5.309 3.155 83 HB3 ARG 10 HB3 ARG 10 -5.972 3.724 3.081 84 HG2 ARG 10 HG2 ARG 10 -3.820 4.716 3.708 85 HG3 ARG 10 HG3 ARG 10 -4.513 6.348 3.629 86 HD2 ARG 10 HD2 ARG 10 -5.954 5.863 5.559 87 HD3 ARG 10 HD3 ARG 10 -5.357 4.186 5.599 88 HE ARG 10 HE ARG 10 -3.479 6.505 5.871 89 HH11 ARG 10 HH11 ARG 10 -1.748 4.773 8.282 90 HH12 ARG 10 HH12 ARG 10 -1.729 6.178 7.227 91 HH21 ARG 10 HH21 ARG 10 -4.901 3.782 7.694 92 HH22 ARG 10 HH22 ARG 10 -3.449 3.730 8.691 93 H ARG 11 H ARG 11 -4.654 2.602 1.122 94 HA ARG 11 HA ARG 11 -1.775 3.370 1.062 95 HB2 ARG 11 HB2 ARG 11 -3.182 0.713 1.586 96 HB3 ARG 11 HB3 ARG 11 -1.441 0.880 1.525 97 HG2 ARG 11 HG2 ARG 11 -3.285 2.236 3.544 98 HG3 ARG 11 HG3 ARG 11 -2.259 0.837 3.811 99 HD2 ARG 11 HD2 ARG 11 -0.340 2.560 2.956 100 HD3 ARG 11 HD3 ARG 11 -1.501 3.735 3.545 101 HE ARG 11 HE ARG 11 -1.030 3.110 5.739 102 HH11 ARG 11 HH11 ARG 11 0.245 2.184 7.332 103 HH12 ARG 11 HH12 ARG 11 1.205 0.740 6.896 104 HH21 ARG 11 HH21 ARG 11 1.323 -0.004 5.074 105 HH22 ARG 11 HH22 ARG 11 0.284 0.482 3.734 106 H THR 12 H THR 12 -0.252 2.154 -0.158 107 HA THR 12 HA THR 12 -1.092 1.392 -2.898 108 HB THR 12 HB THR 12 0.520 2.649 -3.947 109 HG1 THR 12 HG1 THR 12 2.241 3.631 -2.835 110 HG21 THR 12 HG21 THR 12 -0.141 4.501 -1.615 111 HG22 THR 12 HG22 THR 12 0.322 4.959 -3.267 112 HG23 THR 12 HG23 THR 12 -1.239 4.173 -2.975 113 H PHE 13 H PHE 13 0.771 0.284 -4.162 114 HA PHE 13 HA PHE 13 1.369 -2.136 -2.969 115 HB2 PHE 13 HB2 PHE 13 1.381 -2.121 -5.262 116 HB3 PHE 13 HB3 PHE 13 2.474 -0.748 -5.368 117 HD1 PHE 13 HD1 PHE 13 4.926 -1.013 -5.129 118 HD2 PHE 13 HD2 PHE 13 2.263 -4.392 -4.990 119 HE1 PHE 13 HE1 PHE 13 6.862 -2.549 -5.382 120 HE2 PHE 13 HE2 PHE 13 4.194 -5.931 -5.234 121 HZ PHE 13 HZ PHE 13 6.499 -5.011 -5.424 122 H GLU 14 H GLU 14 3.753 0.524 -3.157 123 HA GLU 14 HA GLU 14 5.834 -0.943 -1.818 124 HB2 GLU 14 HB2 GLU 14 5.353 2.063 -1.965 125 HB3 GLU 14 HB3 GLU 14 6.833 1.278 -1.395 126 HG2 GLU 14 HG2 GLU 14 7.041 0.155 -3.639 127 HG3 GLU 14 HG3 GLU 14 5.678 1.126 -4.207 128 H GLN 15 H GLN 15 3.137 1.008 -0.575 129 HA GLN 15 HA GLN 15 4.085 0.942 2.186 130 HB2 GLN 15 HB2 GLN 15 1.324 1.596 1.090 131 HB3 GLN 15 HB3 GLN 15 1.924 1.939 2.716 132 HG2 GLN 15 HG2 GLN 15 2.988 3.181 0.149 133 HG3 GLN 15 HG3 GLN 15 1.931 3.954 1.314 134 HE21 GLN 15 HE21 GLN 15 5.523 4.971 1.933 135 HE22 GLN 15 HE22 GLN 15 4.528 4.964 0.481 136 H ARG 16 H ARG 16 1.854 -1.128 0.255 137 HA ARG 16 HA ARG 16 1.116 -2.837 2.501 138 HB2 ARG 16 HB2 ARG 16 1.229 -3.352 -0.497 139 HB3 ARG 16 HB3 ARG 16 0.778 -4.583 0.671 140 HG2 ARG 16 HG2 ARG 16 -0.923 -2.544 1.411 141 HG3 ARG 16 HG3 ARG 16 -0.789 -2.265 -0.328 142 HD2 ARG 16 HD2 ARG 16 -1.590 -4.872 1.052 143 HD3 ARG 16 HD3 ARG 16 -2.697 -3.751 0.261 144 HE ARG 16 HE ARG 16 -0.771 -4.483 -1.691 145 HH11 ARG 16 HH11 ARG 16 -2.911 -7.713 -1.040 146 HH12 ARG 16 HH12 ARG 16 -3.180 -6.399 0.117 147 HH21 ARG 16 HH21 ARG 16 -0.809 -6.205 -3.055 148 HH22 ARG 16 HH22 ARG 16 -1.720 -7.615 -2.551 149 H VAL 17 H VAL 17 3.782 -3.015 0.108 150 HA VAL 17 HA VAL 17 5.020 -5.388 1.120 151 HB VAL 17 HB VAL 17 6.145 -2.961 -0.333 152 HG11 VAL 17 HG11 VAL 17 8.139 -4.366 -0.841 153 HG12 VAL 17 HG12 VAL 17 8.042 -3.941 0.870 154 HG13 VAL 17 HG13 VAL 17 7.572 -5.573 0.334 155 HG21 VAL 17 HG21 VAL 17 4.555 -4.469 -1.577 156 HG22 VAL 17 HG22 VAL 17 6.179 -4.438 -2.264 157 HG23 VAL 17 HG23 VAL 17 5.666 -5.819 -1.273 158 H GLU 18 H GLU 18 5.610 -1.909 2.052 159 HA GLU 18 HA GLU 18 7.434 -2.562 4.149 160 HB2 GLU 18 HB2 GLU 18 5.616 -0.185 3.654 161 HB3 GLU 18 HB3 GLU 18 6.514 -0.330 5.165 162 HG2 GLU 18 HG2 GLU 18 7.770 -0.272 2.400 163 HG3 GLU 18 HG3 GLU 18 7.698 1.066 3.561 164 H ASP 19 H ASP 19 3.838 -2.202 4.387 165 HA ASP 19 HA ASP 19 3.658 -2.886 7.115 166 HB2 ASP 19 HB2 ASP 19 1.759 -3.378 4.846 167 HB3 ASP 19 HB3 ASP 19 1.460 -4.053 6.438 168 H VAL 20 H VAL 20 3.657 -5.270 4.403 169 HA VAL 20 HA VAL 20 3.591 -7.575 6.085 170 HB VAL 20 HB VAL 20 4.846 -7.193 3.327 171 HG11 VAL 20 HG11 VAL 20 4.597 -9.661 3.076 172 HG12 VAL 20 HG12 VAL 20 5.796 -9.239 4.292 173 HG13 VAL 20 HG13 VAL 20 4.181 -9.791 4.791 174 HG21 VAL 20 HG21 VAL 20 2.160 -8.409 4.114 175 HG22 VAL 20 HG22 VAL 20 2.383 -6.770 3.487 176 HG23 VAL 20 HG23 VAL 20 2.786 -8.150 2.471 177 H ARG 21 H ARG 21 6.462 -5.795 4.775 178 HA ARG 21 HA ARG 21 8.446 -7.523 5.875 179 HB2 ARG 21 HB2 ARG 21 8.830 -5.729 4.159 180 HB3 ARG 21 HB3 ARG 21 8.599 -4.504 5.409 181 HG2 ARG 21 HG2 ARG 21 10.568 -5.499 6.661 182 HG3 ARG 21 HG3 ARG 21 10.775 -6.642 5.329 183 HD2 ARG 21 HD2 ARG 21 12.354 -4.894 4.940 184 HD3 ARG 21 HD3 ARG 21 11.064 -4.671 3.777 185 HE ARG 21 HE ARG 21 10.510 -2.638 4.726 186 HH11 ARG 21 HH11 ARG 21 12.786 -4.182 6.935 187 HH12 ARG 21 HH12 ARG 21 12.939 -2.742 7.894 188 HH21 ARG 21 HH21 ARG 21 10.684 -0.911 6.011 189 HH22 ARG 21 HH22 ARG 21 11.816 -0.901 7.348 190 H LEU 22 H LEU 22 7.031 -4.556 7.285 191 HA LEU 22 HA LEU 22 8.467 -4.702 9.775 192 HB2 LEU 22 HB2 LEU 22 5.857 -3.344 8.965 193 HB3 LEU 22 HB3 LEU 22 6.630 -3.090 10.531 194 HG LEU 22 HG LEU 22 8.128 -2.582 7.932 195 HD11 LEU 22 HD11 LEU 22 6.504 -0.528 9.486 196 HD12 LEU 22 HD12 LEU 22 7.527 -0.230 8.055 197 HD13 LEU 22 HD13 LEU 22 6.066 -1.200 7.898 198 HD21 LEU 22 HD21 LEU 22 8.479 -1.468 10.740 199 HD22 LEU 22 HD22 LEU 22 9.495 -2.707 9.974 200 HD23 LEU 22 HD23 LEU 22 9.463 -1.064 9.317 201 H ILE 23 H ILE 23 5.107 -5.699 8.965 202 HA ILE 23 HA ILE 23 4.495 -6.609 11.602 203 HB ILE 23 HB ILE 23 3.208 -6.775 8.907 204 HG12 ILE 23 HG12 ILE 23 1.347 -5.724 10.092 205 HG13 ILE 23 HG13 ILE 23 2.161 -5.974 11.645 206 HG21 ILE 23 HG21 ILE 23 2.747 -9.020 9.539 207 HG22 ILE 23 HG22 ILE 23 2.187 -8.500 11.163 208 HG23 ILE 23 HG23 ILE 23 1.299 -8.031 9.684 209 HD11 ILE 23 HD11 ILE 23 3.064 -4.075 9.440 210 HD12 ILE 23 HD12 ILE 23 2.233 -3.634 10.933 211 HD13 ILE 23 HD13 ILE 23 3.871 -4.295 11.012 212 H ARG 24 H ARG 24 5.746 -8.507 8.818 213 HA ARG 24 HA ARG 24 5.691 -11.013 10.320 214 HB2 ARG 24 HB2 ARG 24 7.278 -10.168 7.854 215 HB3 ARG 24 HB3 ARG 24 7.228 -11.808 8.485 216 HG2 ARG 24 HG2 ARG 24 4.791 -10.275 7.474 217 HG3 ARG 24 HG3 ARG 24 5.719 -11.444 6.541 218 HD2 ARG 24 HD2 ARG 24 4.134 -12.038 9.068 219 HD3 ARG 24 HD3 ARG 24 3.637 -12.415 7.414 220 HE ARG 24 HE ARG 24 5.767 -13.822 7.284 221 HH11 ARG 24 HH11 ARG 24 3.717 -13.699 10.155 222 HH12 ARG 24 HH12 ARG 24 4.472 -15.117 10.835 223 HH21 ARG 24 HH21 ARG 24 6.622 -15.657 8.218 224 HH22 ARG 24 HH22 ARG 24 5.960 -16.255 9.708 225 H GLU 25 H GLU 25 8.147 -8.441 10.050 226 HA GLU 25 HA GLU 25 10.118 -9.928 11.580 227 HB2 GLU 25 HB2 GLU 25 9.812 -7.003 10.858 228 HB3 GLU 25 HB3 GLU 25 11.098 -7.557 11.916 229 HG2 GLU 25 HG2 GLU 25 10.627 -8.647 9.107 230 HG3 GLU 25 HG3 GLU 25 11.727 -7.322 9.490 231 H GLN 26 H GLN 26 7.801 -7.315 12.614 232 HA GLN 26 HA GLN 26 8.690 -7.624 15.361 233 HB2 GLN 26 HB2 GLN 26 7.049 -6.039 15.986 234 HB3 GLN 26 HB3 GLN 26 7.983 -5.455 14.619 235 HG2 GLN 26 HG2 GLN 26 6.154 -5.472 13.165 236 HG3 GLN 26 HG3 GLN 26 5.282 -6.712 14.074 237 HE21 GLN 26 HE21 GLN 26 3.354 -3.721 14.773 238 HE22 GLN 26 HE22 GLN 26 3.507 -4.980 13.559 239 H HIS 27 H HIS 27 6.041 -9.116 13.565 240 HA HIS 27 HA HIS 27 5.313 -10.713 15.995 241 HB2 HIS 27 HB2 HIS 27 3.329 -9.397 14.105 242 HB3 HIS 27 HB3 HIS 27 2.934 -10.456 15.455 243 HD1 HIS 27 HD1 HIS 27 4.563 -9.143 17.816 244 HD2 HIS 27 HD2 HIS 27 2.273 -7.152 14.883 245 HE1 HIS 27 HE1 HIS 27 3.815 -6.924 18.874 246 HE2 HIS 27 HE2 HIS 27 2.427 -5.707 17.082 247 HA PRO 28 HA PRO 28 6.134 -13.331 12.208 248 HB2 PRO 28 HB2 PRO 28 7.644 -15.291 13.432 249 HB3 PRO 28 HB3 PRO 28 8.293 -13.766 12.768 250 HG2 PRO 28 HG2 PRO 28 7.512 -14.356 15.645 251 HG3 PRO 28 HG3 PRO 28 9.038 -13.633 15.038 252 HD2 PRO 28 HD2 PRO 28 7.059 -12.073 15.971 253 HD3 PRO 28 HD3 PRO 28 7.954 -11.591 14.499 254 H THR 29 H THR 29 4.660 -14.024 15.336 255 HA THR 29 HA THR 29 3.363 -16.478 14.466 256 HB THR 29 HB THR 29 2.202 -16.483 16.499 257 HG1 THR 29 HG1 THR 29 2.111 -14.642 17.826 258 HG21 THR 29 HG21 THR 29 4.842 -15.134 17.229 259 HG22 THR 29 HG22 THR 29 3.893 -16.278 18.194 260 HG23 THR 29 HG23 THR 29 4.699 -16.833 16.717 261 H LYS 30 H LYS 30 2.748 -13.270 13.556 262 HA LYS 30 HA LYS 30 -0.115 -13.878 12.972 263 HB2 LYS 30 HB2 LYS 30 1.247 -11.240 13.578 264 HB3 LYS 30 HB3 LYS 30 -0.358 -11.338 12.841 265 HG2 LYS 30 HG2 LYS 30 -1.252 -12.568 14.728 266 HG3 LYS 30 HG3 LYS 30 0.343 -12.681 15.483 267 HD2 LYS 30 HD2 LYS 30 0.420 -10.267 15.838 268 HD3 LYS 30 HD3 LYS 30 -1.100 -10.047 14.947 269 HE2 LYS 30 HE2 LYS 30 -2.335 -11.344 16.618 270 HE3 LYS 30 HE3 LYS 30 -0.845 -11.745 17.481 271 HZ1 LYS 30 HZ1 LYS 30 -1.880 -8.952 17.178 272 HZ2 LYS 30 HZ2 LYS 30 -2.092 -9.865 18.515 273 HZ3 LYS 30 HZ3 LYS 30 -0.582 -9.408 18.071 274 H ILE 31 H ILE 31 -1.057 -13.228 11.110 275 HA ILE 31 HA ILE 31 0.720 -13.331 8.712 276 HB ILE 31 HB ILE 31 -1.988 -14.581 9.307 277 HG12 ILE 31 HG12 ILE 31 -0.227 -15.744 10.526 278 HG13 ILE 31 HG13 ILE 31 -0.859 -16.730 9.226 279 HG21 ILE 31 HG21 ILE 31 -0.278 -14.696 6.806 280 HG22 ILE 31 HG22 ILE 31 -1.633 -15.802 7.156 281 HG23 ILE 31 HG23 ILE 31 -1.936 -14.079 6.956 282 HD11 ILE 31 HD11 ILE 31 1.805 -15.250 9.135 283 HD12 ILE 31 HD12 ILE 31 1.568 -16.977 9.415 284 HD13 ILE 31 HD13 ILE 31 1.141 -16.276 7.848 285 HA PRO 32 HA PRO 32 -1.579 -9.576 7.627 286 HB2 PRO 32 HB2 PRO 32 -0.241 -8.837 5.376 287 HB3 PRO 32 HB3 PRO 32 0.507 -8.783 6.996 288 HG2 PRO 32 HG2 PRO 32 0.760 -10.968 4.901 289 HG3 PRO 32 HG3 PRO 32 2.069 -10.155 5.815 290 HD2 PRO 32 HD2 PRO 32 1.016 -12.560 6.573 291 HD3 PRO 32 HD3 PRO 32 1.599 -11.348 7.762 292 H VAL 33 H VAL 33 -3.624 -9.708 6.920 293 HA VAL 33 HA VAL 33 -4.237 -10.920 4.264 294 HB VAL 33 HB VAL 33 -5.983 -11.184 6.692 295 HG11 VAL 33 HG11 VAL 33 -7.213 -11.478 4.597 296 HG12 VAL 33 HG12 VAL 33 -6.009 -12.658 4.031 297 HG13 VAL 33 HG13 VAL 33 -7.044 -13.024 5.420 298 HG21 VAL 33 HG21 VAL 33 -3.952 -13.192 5.667 299 HG22 VAL 33 HG22 VAL 33 -4.018 -12.429 7.264 300 HG23 VAL 33 HG23 VAL 33 -5.268 -13.581 6.794 301 H ILE 34 H ILE 34 -5.901 -10.000 3.041 302 HA ILE 34 HA ILE 34 -7.207 -7.534 4.116 303 HB ILE 34 HB ILE 34 -5.518 -7.806 1.665 304 HG12 ILE 34 HG12 ILE 34 -6.267 -5.374 3.327 305 HG13 ILE 34 HG13 ILE 34 -5.037 -6.516 3.871 306 HG21 ILE 34 HG21 ILE 34 -7.959 -5.963 1.687 307 HG22 ILE 34 HG22 ILE 34 -6.643 -5.939 0.500 308 HG23 ILE 34 HG23 ILE 34 -7.697 -7.340 0.589 309 HD11 ILE 34 HD11 ILE 34 -3.681 -6.067 1.863 310 HD12 ILE 34 HD12 ILE 34 -4.866 -4.835 1.344 311 HD13 ILE 34 HD13 ILE 34 -3.954 -4.622 2.845 312 H ILE 35 H ILE 35 -9.287 -7.207 3.622 313 HA ILE 35 HA ILE 35 -10.663 -9.380 2.128 314 HB ILE 35 HB ILE 35 -11.194 -9.414 4.497 315 HG12 ILE 35 HG12 ILE 35 -13.609 -8.568 2.819 316 HG13 ILE 35 HG13 ILE 35 -12.811 -10.143 2.718 317 HG21 ILE 35 HG21 ILE 35 -12.544 -7.670 5.589 318 HG22 ILE 35 HG22 ILE 35 -11.043 -6.968 4.996 319 HG23 ILE 35 HG23 ILE 35 -12.571 -6.715 4.107 320 HD11 ILE 35 HD11 ILE 35 -14.255 -9.009 5.156 321 HD12 ILE 35 HD12 ILE 35 -14.696 -10.415 4.196 322 HD13 ILE 35 HD13 ILE 35 -13.237 -10.467 5.201 323 H GLU 36 H GLU 36 -11.766 -8.826 0.355 324 HA GLU 36 HA GLU 36 -12.787 -6.054 0.044 325 HB2 GLU 36 HB2 GLU 36 -10.970 -7.488 -1.931 326 HB3 GLU 36 HB3 GLU 36 -12.025 -6.171 -2.412 327 HG2 GLU 36 HG2 GLU 36 -9.778 -5.976 -0.366 328 HG3 GLU 36 HG3 GLU 36 -9.727 -5.419 -2.027 329 H ARG 37 H ARG 37 -14.747 -5.903 -0.932 330 HA ARG 37 HA ARG 37 -16.285 -8.299 -1.343 331 HB2 ARG 37 HB2 ARG 37 -17.317 -6.238 -0.613 332 HB3 ARG 37 HB3 ARG 37 -16.793 -5.387 -2.060 333 HG2 ARG 37 HG2 ARG 37 -19.129 -5.787 -2.273 334 HG3 ARG 37 HG3 ARG 37 -18.306 -6.813 -3.437 335 HD2 ARG 37 HD2 ARG 37 -18.507 -8.545 -1.309 336 HD3 ARG 37 HD3 ARG 37 -19.898 -7.502 -0.997 337 HE ARG 37 HE ARG 37 -19.889 -8.301 -3.786 338 HH11 ARG 37 HH11 ARG 37 -21.363 -9.698 -4.554 339 HH12 ARG 37 HH12 ARG 37 -22.175 -10.861 -3.508 340 HH21 ARG 37 HH21 ARG 37 -20.435 -9.832 -0.682 341 HH22 ARG 37 HH22 ARG 37 -21.623 -10.936 -1.342 342 H TYR 38 H TYR 38 -17.002 -9.344 -3.140 343 HA TYR 38 HA TYR 38 -15.367 -9.586 -5.351 344 HB2 TYR 38 HB2 TYR 38 -16.633 -11.419 -4.810 345 HB3 TYR 38 HB3 TYR 38 -18.134 -10.521 -4.780 346 HD1 TYR 38 HD1 TYR 38 -19.601 -10.511 -6.633 347 HD2 TYR 38 HD2 TYR 38 -15.525 -11.861 -7.099 348 HE1 TYR 38 HE1 TYR 38 -20.109 -11.301 -8.943 349 HE2 TYR 38 HE2 TYR 38 -16.045 -12.646 -9.392 350 HH TYR 38 HH TYR 38 -17.644 -12.812 -11.053 351 H LYS 39 H LYS 39 -15.076 -8.916 -7.364 352 HA LYS 39 HA LYS 39 -15.837 -6.222 -7.905 353 HB2 LYS 39 HB2 LYS 39 -14.495 -8.319 -9.665 354 HB3 LYS 39 HB3 LYS 39 -14.651 -6.612 -10.091 355 HG2 LYS 39 HG2 LYS 39 -13.383 -5.958 -8.072 356 HG3 LYS 39 HG3 LYS 39 -13.170 -7.667 -7.641 357 HD2 LYS 39 HD2 LYS 39 -11.967 -8.055 -9.782 358 HD3 LYS 39 HD3 LYS 39 -12.176 -6.344 -10.211 359 HE2 LYS 39 HE2 LYS 39 -10.915 -5.690 -8.156 360 HE3 LYS 39 HE3 LYS 39 -10.686 -7.399 -7.760 361 HZ1 LYS 39 HZ1 LYS 39 -8.744 -6.490 -8.916 362 HZ2 LYS 39 HZ2 LYS 39 -9.424 -7.645 -9.849 363 HZ3 LYS 39 HZ3 LYS 39 -9.641 -6.066 -10.213 364 H GLY 40 H GLY 40 -17.223 -9.220 -9.155 365 HA2 GLY 40 HA2 GLY 40 -18.629 -8.007 -11.362 366 HA3 GLY 40 HA3 GLY 40 -18.887 -9.619 -10.704 367 H GLU 41 H GLU 41 -19.505 -8.388 -7.944 368 HA GLU 41 HA GLU 41 -21.972 -6.897 -8.338 369 HB2 GLU 41 HB2 GLU 41 -22.812 -9.065 -9.031 370 HB3 GLU 41 HB3 GLU 41 -22.026 -9.855 -7.673 371 HG2 GLU 41 HG2 GLU 41 -24.364 -9.838 -7.292 372 HG3 GLU 41 HG3 GLU 41 -23.582 -8.824 -6.102 373 H LYS 42 H LYS 42 -22.248 -5.607 -6.629 374 HA LYS 42 HA LYS 42 -21.147 -6.342 -3.946 375 HB2 LYS 42 HB2 LYS 42 -22.189 -3.689 -4.968 376 HB3 LYS 42 HB3 LYS 42 -21.490 -4.010 -3.375 377 HG2 LYS 42 HG2 LYS 42 -19.361 -4.793 -4.608 378 HG3 LYS 42 HG3 LYS 42 -20.073 -4.097 -6.072 379 HD2 LYS 42 HD2 LYS 42 -20.193 -1.870 -4.928 380 HD3 LYS 42 HD3 LYS 42 -19.517 -2.596 -3.471 381 HE2 LYS 42 HE2 LYS 42 -17.733 -1.437 -4.542 382 HE3 LYS 42 HE3 LYS 42 -17.416 -3.158 -4.726 383 HZ1 LYS 42 HZ1 LYS 42 -18.264 -2.993 -7.036 384 HZ2 LYS 42 HZ2 LYS 42 -18.620 -1.404 -6.831 385 HZ3 LYS 42 HZ3 LYS 42 -17.068 -1.906 -6.813 386 H GLN 43 H GLN 43 -23.206 -7.940 -4.504 387 HA GLN 43 HA GLN 43 -25.812 -7.020 -3.860 388 HB2 GLN 43 HB2 GLN 43 -25.492 -9.136 -4.948 389 HB3 GLN 43 HB3 GLN 43 -24.541 -9.782 -3.599 390 HG2 GLN 43 HG2 GLN 43 -26.502 -9.710 -2.153 391 HG3 GLN 43 HG3 GLN 43 -27.452 -8.935 -3.424 392 HE21 GLN 43 HE21 GLN 43 -28.181 -12.655 -3.299 393 HE22 GLN 43 HE22 GLN 43 -28.206 -11.387 -2.082 394 H LEU 44 H LEU 44 -23.409 -8.557 -1.705 395 HA LEU 44 HA LEU 44 -25.024 -7.868 0.678 396 HB2 LEU 44 HB2 LEU 44 -22.409 -9.357 0.539 397 HB3 LEU 44 HB3 LEU 44 -23.477 -9.211 1.929 398 HG LEU 44 HG LEU 44 -23.965 -10.808 -0.611 399 HD11 LEU 44 HD11 LEU 44 -23.600 -11.606 2.306 400 HD12 LEU 44 HD12 LEU 44 -23.953 -12.719 0.970 401 HD13 LEU 44 HD13 LEU 44 -22.416 -11.839 1.003 402 HD21 LEU 44 HD21 LEU 44 -26.046 -11.615 0.478 403 HD22 LEU 44 HD22 LEU 44 -25.781 -10.481 1.820 404 HD23 LEU 44 HD23 LEU 44 -26.133 -9.871 0.190 405 HA PRO 45 HA PRO 45 -22.752 -4.146 1.079 406 HB2 PRO 45 HB2 PRO 45 -23.365 -3.336 3.613 407 HB3 PRO 45 HB3 PRO 45 -24.573 -3.461 2.299 408 HG2 PRO 45 HG2 PRO 45 -23.983 -5.525 4.455 409 HG3 PRO 45 HG3 PRO 45 -25.576 -4.856 3.972 410 HD2 PRO 45 HD2 PRO 45 -24.647 -7.214 2.995 411 HD3 PRO 45 HD3 PRO 45 -25.586 -6.082 1.972 412 H VAL 46 H VAL 46 -20.880 -3.146 1.819 413 HA VAL 46 HA VAL 46 -19.002 -4.728 3.542 414 HB VAL 46 HB VAL 46 -18.486 -2.246 1.856 415 HG11 VAL 46 HG11 VAL 46 -16.566 -4.062 3.395 416 HG12 VAL 46 HG12 VAL 46 -16.099 -2.738 2.315 417 HG13 VAL 46 HG13 VAL 46 -16.955 -2.378 3.809 418 HG21 VAL 46 HG21 VAL 46 -17.696 -5.150 1.417 419 HG22 VAL 46 HG22 VAL 46 -18.885 -4.238 0.452 420 HG23 VAL 46 HG23 VAL 46 -17.185 -3.766 0.424 421 H LEU 47 H LEU 47 -19.537 -4.387 5.651 422 HA LEU 47 HA LEU 47 -20.824 -1.946 6.506 423 HB2 LEU 47 HB2 LEU 47 -19.782 -4.391 7.990 424 HB3 LEU 47 HB3 LEU 47 -20.393 -2.989 8.840 425 HG LEU 47 HG LEU 47 -22.072 -4.661 8.748 426 HD11 LEU 47 HD11 LEU 47 -22.793 -2.287 8.645 427 HD12 LEU 47 HD12 LEU 47 -22.925 -2.432 6.873 428 HD13 LEU 47 HD13 LEU 47 -23.960 -3.409 7.923 429 HD21 LEU 47 HD21 LEU 47 -23.164 -5.457 6.748 430 HD22 LEU 47 HD22 LEU 47 -22.111 -4.466 5.726 431 HD23 LEU 47 HD23 LEU 47 -21.431 -5.823 6.653 432 H ASP 48 H ASP 48 -17.575 -3.240 7.245 433 HA ASP 48 HA ASP 48 -16.559 -0.529 7.639 434 HB2 ASP 48 HB2 ASP 48 -17.680 -0.653 9.700 435 HB3 ASP 48 HB3 ASP 48 -17.095 -2.280 10.013 436 H LYS 49 H LYS 49 -15.529 -3.893 8.484 437 HA LYS 49 HA LYS 49 -12.781 -3.041 8.482 438 HB2 LYS 49 HB2 LYS 49 -14.015 -5.820 8.691 439 HB3 LYS 49 HB3 LYS 49 -12.283 -5.522 8.711 440 HG2 LYS 49 HG2 LYS 49 -12.485 -5.398 10.910 441 HG3 LYS 49 HG3 LYS 49 -12.971 -3.738 10.621 442 HD2 LYS 49 HD2 LYS 49 -15.414 -4.568 10.671 443 HD3 LYS 49 HD3 LYS 49 -14.772 -6.160 11.093 444 HE2 LYS 49 HE2 LYS 49 -15.228 -5.306 13.210 445 HE3 LYS 49 HE3 LYS 49 -13.517 -4.921 13.024 446 HZ1 LYS 49 HZ1 LYS 49 -14.416 -2.883 13.730 447 HZ2 LYS 49 HZ2 LYS 49 -14.494 -2.651 12.101 448 HZ3 LYS 49 HZ3 LYS 49 -15.831 -3.086 12.920 449 H THR 50 H THR 50 -11.038 -3.707 7.394 450 HA THR 50 HA THR 50 -11.303 -4.619 4.587 451 HB THR 50 HB THR 50 -9.495 -2.304 4.897 452 HG1 THR 50 HG1 THR 50 -11.166 -0.831 4.704 453 HG21 THR 50 HG21 THR 50 -11.577 -3.064 2.811 454 HG22 THR 50 HG22 THR 50 -10.384 -1.757 2.674 455 HG23 THR 50 HG23 THR 50 -9.846 -3.450 2.723 456 H LYS 51 H LYS 51 -9.169 -4.356 7.351 457 HA LYS 51 HA LYS 51 -7.144 -6.099 5.968 458 HB2 LYS 51 HB2 LYS 51 -6.611 -3.774 7.886 459 HB3 LYS 51 HB3 LYS 51 -5.402 -4.934 7.350 460 HG2 LYS 51 HG2 LYS 51 -5.647 -4.153 5.027 461 HG3 LYS 51 HG3 LYS 51 -6.932 -3.043 5.517 462 HD2 LYS 51 HD2 LYS 51 -4.900 -1.797 5.262 463 HD3 LYS 51 HD3 LYS 51 -5.302 -1.845 6.986 464 HE2 LYS 51 HE2 LYS 51 -3.608 -3.744 7.245 465 HE3 LYS 51 HE3 LYS 51 -3.192 -3.532 5.535 466 HZ1 LYS 51 HZ1 LYS 51 -1.635 -2.235 6.865 467 HZ2 LYS 51 HZ2 LYS 51 -2.611 -1.162 6.144 468 HZ3 LYS 51 HZ3 LYS 51 -2.846 -1.532 7.730 469 H PHE 52 H PHE 52 -6.162 -7.663 7.284 470 HA PHE 52 HA PHE 52 -6.486 -7.512 10.105 471 HB2 PHE 52 HB2 PHE 52 -7.414 -9.890 10.355 472 HB3 PHE 52 HB3 PHE 52 -8.410 -8.454 10.302 473 HD1 PHE 52 HD1 PHE 52 -10.094 -8.111 8.617 474 HD2 PHE 52 HD2 PHE 52 -7.395 -11.462 8.395 475 HE1 PHE 52 HE1 PHE 52 -11.579 -9.213 6.981 476 HE2 PHE 52 HE2 PHE 52 -8.884 -12.540 6.724 477 HZ PHE 52 HZ PHE 52 -10.975 -11.427 6.018 478 H LEU 53 H LEU 53 -5.058 -8.284 11.392 479 HA LEU 53 HA LEU 53 -2.811 -9.920 10.289 480 HB2 LEU 53 HB2 LEU 53 -3.190 -8.039 12.637 481 HB3 LEU 53 HB3 LEU 53 -2.019 -9.330 12.765 482 HG LEU 53 HG LEU 53 -0.695 -8.537 10.961 483 HD11 LEU 53 HD11 LEU 53 -2.764 -6.340 10.548 484 HD12 LEU 53 HD12 LEU 53 -1.160 -6.419 9.775 485 HD13 LEU 53 HD13 LEU 53 -2.368 -7.649 9.406 486 HD21 LEU 53 HD21 LEU 53 -0.313 -7.530 13.165 487 HD22 LEU 53 HD22 LEU 53 -0.050 -6.308 11.913 488 HD23 LEU 53 HD23 LEU 53 -1.544 -6.289 12.847 489 H VAL 54 H VAL 54 -3.510 -12.006 10.313 490 HA VAL 54 HA VAL 54 -5.212 -12.944 12.539 491 HB VAL 54 HB VAL 54 -4.403 -14.674 10.232 492 HG11 VAL 54 HG11 VAL 54 -6.553 -15.760 10.748 493 HG12 VAL 54 HG12 VAL 54 -5.550 -15.676 12.205 494 HG13 VAL 54 HG13 VAL 54 -6.899 -14.550 11.996 495 HG21 VAL 54 HG21 VAL 54 -5.312 -12.669 9.173 496 HG22 VAL 54 HG22 VAL 54 -6.474 -13.999 9.069 497 HG23 VAL 54 HG23 VAL 54 -6.711 -12.700 10.258 498 HA PRO 55 HA PRO 55 -1.692 -14.952 14.580 499 HB2 PRO 55 HB2 PRO 55 -3.890 -16.376 16.062 500 HB3 PRO 55 HB3 PRO 55 -2.422 -15.576 16.710 501 HG2 PRO 55 HG2 PRO 55 -4.856 -14.388 16.902 502 HG3 PRO 55 HG3 PRO 55 -3.402 -13.422 16.474 503 HD2 PRO 55 HD2 PRO 55 -5.533 -14.540 14.635 504 HD3 PRO 55 HD3 PRO 55 -4.806 -12.901 14.671 505 H ASP 56 H ASP 56 -0.640 -16.843 14.044 506 HA ASP 56 HA ASP 56 -1.508 -18.381 11.910 507 HB2 ASP 56 HB2 ASP 56 0.395 -19.899 12.427 508 HB3 ASP 56 HB3 ASP 56 0.775 -18.186 12.328 509 H HIS 57 H HIS 57 -2.229 -19.071 15.237 510 HA HIS 57 HA HIS 57 -3.057 -21.835 14.873 511 HB2 HIS 57 HB2 HIS 57 -3.424 -19.790 17.097 512 HB3 HIS 57 HB3 HIS 57 -4.175 -21.378 17.155 513 HD1 HIS 57 HD1 HIS 57 -0.457 -20.273 16.443 514 HD2 HIS 57 HD2 HIS 57 -2.879 -22.939 18.679 515 HE1 HIS 57 HE1 HIS 57 1.135 -21.669 17.896 516 HE2 HIS 57 HE2 HIS 57 -0.341 -23.304 19.244 517 H VAL 58 H VAL 58 -4.673 -18.909 13.989 518 HA VAL 58 HA VAL 58 -7.427 -19.860 14.290 519 HB VAL 58 HB VAL 58 -6.293 -17.700 12.519 520 HG11 VAL 58 HG11 VAL 58 -8.631 -16.835 12.463 521 HG12 VAL 58 HG12 VAL 58 -8.476 -18.391 11.655 522 HG13 VAL 58 HG13 VAL 58 -9.181 -18.303 13.289 523 HG21 VAL 58 HG21 VAL 58 -7.241 -16.164 14.253 524 HG22 VAL 58 HG22 VAL 58 -7.662 -17.569 15.249 525 HG23 VAL 58 HG23 VAL 58 -5.959 -17.188 14.915 526 H ASN 59 H ASN 59 -8.506 -21.267 12.895 527 HA ASN 59 HA ASN 59 -7.170 -22.053 10.353 528 HB2 ASN 59 HB2 ASN 59 -8.590 -23.955 10.299 529 HB3 ASN 59 HB3 ASN 59 -7.840 -23.867 11.885 530 HD21 ASN 59 HD21 ASN 59 -10.999 -23.941 13.471 531 HD22 ASN 59 HD22 ASN 59 -9.259 -24.105 13.631 532 H MET 60 H MET 60 -8.431 -22.235 8.368 533 HA MET 60 HA MET 60 -9.533 -19.724 7.722 534 HB2 MET 60 HB2 MET 60 -8.382 -21.254 6.157 535 HB3 MET 60 HB3 MET 60 -9.756 -22.355 6.226 536 HG2 MET 60 HG2 MET 60 -9.866 -21.038 4.202 537 HG3 MET 60 HG3 MET 60 -11.214 -20.581 5.252 538 HE1 MET 60 HE1 MET 60 -11.838 -18.321 4.261 539 HE2 MET 60 HE2 MET 60 -10.660 -17.152 3.626 540 HE3 MET 60 HE3 MET 60 -10.777 -18.769 2.902 541 H SER 61 H SER 61 -11.346 -22.758 8.426 542 HA SER 61 HA SER 61 -13.958 -21.723 7.890 543 HB2 SER 61 HB2 SER 61 -13.395 -24.122 8.208 544 HB3 SER 61 HB3 SER 61 -13.120 -23.820 9.933 545 HG SER 61 HG SER 61 -15.239 -24.559 9.619 546 H GLU 62 H GLU 62 -12.030 -21.712 10.931 547 HA GLU 62 HA GLU 62 -13.955 -20.327 12.537 548 HB2 GLU 62 HB2 GLU 62 -12.075 -21.570 13.499 549 HB3 GLU 62 HB3 GLU 62 -10.925 -20.489 12.714 550 HG2 GLU 62 HG2 GLU 62 -11.021 -19.902 15.007 551 HG3 GLU 62 HG3 GLU 62 -11.721 -18.588 14.080 552 H LEU 63 H LEU 63 -11.265 -19.054 10.504 553 HA LEU 63 HA LEU 63 -11.680 -16.294 11.057 554 HB2 LEU 63 HB2 LEU 63 -9.684 -17.157 9.952 555 HB3 LEU 63 HB3 LEU 63 -10.637 -17.726 8.586 556 HG LEU 63 HG LEU 63 -11.179 -15.387 7.957 557 HD11 LEU 63 HD11 LEU 63 -11.028 -14.264 10.148 558 HD12 LEU 63 HD12 LEU 63 -9.298 -14.674 10.252 559 HD13 LEU 63 HD13 LEU 63 -9.893 -13.534 9.015 560 HD21 LEU 63 HD21 LEU 63 -9.213 -16.568 7.053 561 HD22 LEU 63 HD22 LEU 63 -8.924 -14.824 7.169 562 HD23 LEU 63 HD23 LEU 63 -8.203 -15.925 8.371 563 H ILE 64 H ILE 64 -13.174 -18.371 8.547 564 HA ILE 64 HA ILE 64 -14.970 -16.456 7.431 565 HB ILE 64 HB ILE 64 -14.645 -19.382 7.525 566 HG12 ILE 64 HG12 ILE 64 -15.604 -17.694 5.248 567 HG13 ILE 64 HG13 ILE 64 -13.907 -17.747 5.771 568 HG21 ILE 64 HG21 ILE 64 -16.864 -19.945 6.561 569 HG22 ILE 64 HG22 ILE 64 -16.990 -19.436 8.230 570 HG23 ILE 64 HG23 ILE 64 -17.436 -18.310 6.929 571 HD11 ILE 64 HD11 ILE 64 -13.836 -20.184 5.416 572 HD12 ILE 64 HD12 ILE 64 -15.497 -20.127 4.786 573 HD13 ILE 64 HD13 ILE 64 -14.202 -19.281 3.930 574 H LYS 65 H LYS 65 -15.412 -18.556 10.313 575 HA LYS 65 HA LYS 65 -18.076 -17.727 10.857 576 HB2 LYS 65 HB2 LYS 65 -16.980 -19.768 11.721 577 HB3 LYS 65 HB3 LYS 65 -15.974 -18.789 12.798 578 HG2 LYS 65 HG2 LYS 65 -17.972 -17.983 13.991 579 HG3 LYS 65 HG3 LYS 65 -19.021 -18.878 12.870 580 HD2 LYS 65 HD2 LYS 65 -17.982 -21.012 13.608 581 HD3 LYS 65 HD3 LYS 65 -16.935 -20.114 14.728 582 HE2 LYS 65 HE2 LYS 65 -18.937 -19.267 15.932 583 HE3 LYS 65 HE3 LYS 65 -19.986 -20.154 14.813 584 HZ1 LYS 65 HZ1 LYS 65 -19.628 -21.404 16.871 585 HZ2 LYS 65 HZ2 LYS 65 -18.987 -22.233 15.623 586 HZ3 LYS 65 HZ3 LYS 65 -18.009 -21.414 16.654 587 H ILE 66 H ILE 66 -15.025 -16.352 12.276 588 HA ILE 66 HA ILE 66 -16.480 -14.358 13.784 589 HB ILE 66 HB ILE 66 -14.353 -14.716 14.567 590 HG12 ILE 66 HG12 ILE 66 -15.015 -12.330 14.694 591 HG13 ILE 66 HG13 ILE 66 -13.298 -12.636 14.769 592 HG21 ILE 66 HG21 ILE 66 -13.170 -14.157 11.830 593 HG22 ILE 66 HG22 ILE 66 -12.230 -14.244 13.333 594 HG23 ILE 66 HG23 ILE 66 -13.118 -15.649 12.790 595 HD11 ILE 66 HD11 ILE 66 -13.381 -10.714 13.466 596 HD12 ILE 66 HD12 ILE 66 -13.267 -11.961 12.218 597 HD13 ILE 66 HD13 ILE 66 -14.811 -11.214 12.575 598 H ILE 67 H ILE 67 -15.049 -14.141 10.492 599 HA ILE 67 HA ILE 67 -15.786 -11.388 10.136 600 HB ILE 67 HB ILE 67 -15.222 -13.615 8.149 601 HG12 ILE 67 HG12 ILE 67 -13.303 -12.975 9.579 602 HG13 ILE 67 HG13 ILE 67 -13.043 -12.589 7.892 603 HG21 ILE 67 HG21 ILE 67 -15.588 -10.636 7.596 604 HG22 ILE 67 HG22 ILE 67 -14.873 -11.815 6.465 605 HG23 ILE 67 HG23 ILE 67 -16.560 -11.967 6.954 606 HD11 ILE 67 HD11 ILE 67 -13.450 -10.184 8.370 607 HD12 ILE 67 HD12 ILE 67 -13.769 -10.575 10.080 608 HD13 ILE 67 HD13 ILE 67 -12.169 -10.856 9.394 609 H ARG 68 H ARG 68 -17.617 -14.367 9.256 610 HA ARG 68 HA ARG 68 -19.898 -13.027 8.199 611 HB2 ARG 68 HB2 ARG 68 -19.286 -15.446 8.032 612 HB3 ARG 68 HB3 ARG 68 -19.794 -15.699 9.689 613 HG2 ARG 68 HG2 ARG 68 -21.687 -14.519 7.612 614 HG3 ARG 68 HG3 ARG 68 -21.369 -16.246 7.645 615 HD2 ARG 68 HD2 ARG 68 -22.550 -14.683 9.980 616 HD3 ARG 68 HD3 ARG 68 -23.463 -15.622 8.827 617 HE ARG 68 HE ARG 68 -21.808 -16.613 11.039 618 HH11 ARG 68 HH11 ARG 68 -23.487 -17.620 8.118 619 HH12 ARG 68 HH12 ARG 68 -23.591 -19.271 8.652 620 HH21 ARG 68 HH21 ARG 68 -21.994 -18.739 11.645 621 HH22 ARG 68 HH22 ARG 68 -22.759 -19.884 10.586 622 H ARG 69 H ARG 69 -19.052 -13.723 11.582 623 HA ARG 69 HA ARG 69 -21.595 -12.794 12.669 624 HB2 ARG 69 HB2 ARG 69 -20.187 -14.541 13.717 625 HB3 ARG 69 HB3 ARG 69 -18.929 -13.350 14.048 626 HG2 ARG 69 HG2 ARG 69 -20.453 -12.114 15.558 627 HG3 ARG 69 HG3 ARG 69 -21.793 -13.160 15.085 628 HD2 ARG 69 HD2 ARG 69 -21.045 -13.893 17.224 629 HD3 ARG 69 HD3 ARG 69 -20.569 -15.120 16.040 630 HE ARG 69 HE ARG 69 -18.458 -13.167 16.531 631 HH11 ARG 69 HH11 ARG 69 -19.898 -16.000 17.993 632 HH12 ARG 69 HH12 ARG 69 -18.450 -16.401 18.875 633 HH21 ARG 69 HH21 ARG 69 -16.633 -13.732 17.694 634 HH22 ARG 69 HH22 ARG 69 -16.653 -15.151 18.692 635 H ARG 70 H ARG 70 -18.387 -11.228 12.317 636 HA ARG 70 HA ARG 70 -19.196 -8.760 13.684 637 HB2 ARG 70 HB2 ARG 70 -16.885 -9.395 11.811 638 HB3 ARG 70 HB3 ARG 70 -17.104 -7.831 12.586 639 HG2 ARG 70 HG2 ARG 70 -16.750 -10.433 14.145 640 HG3 ARG 70 HG3 ARG 70 -15.454 -9.337 13.670 641 HD2 ARG 70 HD2 ARG 70 -15.825 -8.815 15.873 642 HD3 ARG 70 HD3 ARG 70 -16.566 -7.496 14.956 643 HE ARG 70 HE ARG 70 -18.501 -9.556 15.641 644 HH11 ARG 70 HH11 ARG 70 -16.615 -7.071 17.265 645 HH12 ARG 70 HH12 ARG 70 -17.906 -6.711 18.385 646 HH21 ARG 70 HH21 ARG 70 -20.119 -9.016 17.127 647 HH22 ARG 70 HH22 ARG 70 -19.791 -7.832 18.350 648 H LEU 71 H LEU 71 -19.232 -9.738 10.267 649 HA LEU 71 HA LEU 71 -20.334 -7.172 9.360 650 HB2 LEU 71 HB2 LEU 71 -20.400 -9.953 8.111 651 HB3 LEU 71 HB3 LEU 71 -20.905 -8.471 7.300 652 HG LEU 71 HG LEU 71 -18.052 -8.997 8.251 653 HD11 LEU 71 HD11 LEU 71 -18.737 -10.568 6.472 654 HD12 LEU 71 HD12 LEU 71 -19.268 -9.201 5.465 655 HD13 LEU 71 HD13 LEU 71 -17.553 -9.391 5.882 656 HD21 LEU 71 HD21 LEU 71 -19.191 -6.859 6.403 657 HD22 LEU 71 HD22 LEU 71 -18.547 -6.596 8.052 658 HD23 LEU 71 HD23 LEU 71 -17.470 -7.127 6.762 659 H GLN 72 H GLN 72 -22.551 -6.680 8.994 660 HA GLN 72 HA GLN 72 -24.346 -7.886 10.904 661 HB2 GLN 72 HB2 GLN 72 -24.712 -5.575 8.981 662 HB3 GLN 72 HB3 GLN 72 -25.912 -6.083 10.183 663 HG2 GLN 72 HG2 GLN 72 -24.300 -5.703 12.015 664 HG3 GLN 72 HG3 GLN 72 -23.084 -5.160 10.856 665 HE21 GLN 72 HE21 GLN 72 -24.487 -2.029 12.103 666 HE22 GLN 72 HE22 GLN 72 -23.390 -3.301 12.625 667 H LEU 73 H LEU 73 -23.791 -9.873 9.139 668 HA LEU 73 HA LEU 73 -25.973 -10.107 7.138 669 HB2 LEU 73 HB2 LEU 73 -23.563 -11.868 7.702 670 HB3 LEU 73 HB3 LEU 73 -24.694 -12.075 6.372 671 HG LEU 73 HG LEU 73 -22.873 -9.660 6.764 672 HD11 LEU 73 HD11 LEU 73 -22.713 -11.949 4.775 673 HD12 LEU 73 HD12 LEU 73 -21.615 -10.550 4.876 674 HD13 LEU 73 HD13 LEU 73 -21.656 -11.731 6.194 675 HD21 LEU 73 HD21 LEU 73 -23.483 -9.078 4.441 676 HD22 LEU 73 HD22 LEU 73 -24.676 -10.397 4.423 677 HD23 LEU 73 HD23 LEU 73 -24.884 -9.006 5.513 678 H ASN 74 H ASN 74 -27.857 -10.805 7.913 679 HA ASN 74 HA ASN 74 -28.176 -12.674 10.116 680 HB2 ASN 74 HB2 ASN 74 -30.094 -11.699 7.951 681 HB3 ASN 74 HB3 ASN 74 -30.574 -12.706 9.312 682 HD21 ASN 74 HD21 ASN 74 -31.091 -9.004 10.047 683 HD22 ASN 74 HD22 ASN 74 -31.413 -9.916 8.578 684 H ALA 75 H ALA 75 -29.284 -14.809 9.875 685 HA ALA 75 HA ALA 75 -27.653 -16.580 8.461 686 HB1 ALA 75 HB1 ALA 75 -28.934 -17.117 10.491 687 HB2 ALA 75 HB2 ALA 75 -30.458 -17.018 9.576 688 HB3 ALA 75 HB3 ALA 75 -29.276 -18.291 9.205 689 H ASN 76 H ASN 76 -30.552 -15.021 7.223 690 HA ASN 76 HA ASN 76 -31.022 -16.768 4.973 691 HB2 ASN 76 HB2 ASN 76 -31.722 -13.831 5.462 692 HB3 ASN 76 HB3 ASN 76 -32.346 -14.808 4.138 693 HD21 ASN 76 HD21 ASN 76 -34.797 -16.417 6.115 694 HD22 ASN 76 HD22 ASN 76 -33.992 -16.348 4.551 695 H GLN 77 H GLN 77 -28.513 -14.408 5.511 696 HA GLN 77 HA GLN 77 -28.062 -13.771 2.664 697 HB2 GLN 77 HB2 GLN 77 -26.383 -13.142 5.115 698 HB3 GLN 77 HB3 GLN 77 -26.205 -12.413 3.529 699 HG2 GLN 77 HG2 GLN 77 -28.818 -12.083 5.085 700 HG3 GLN 77 HG3 GLN 77 -27.396 -11.142 5.497 701 HE21 GLN 77 HE21 GLN 77 -29.177 -10.310 1.888 702 HE22 GLN 77 HE22 GLN 77 -29.534 -11.860 2.635 703 H ALA 78 H ALA 78 -27.048 -15.233 1.368 704 HA ALA 78 HA ALA 78 -25.443 -17.426 2.409 705 HB1 ALA 78 HB1 ALA 78 -25.188 -17.998 0.037 706 HB2 ALA 78 HB2 ALA 78 -26.886 -17.681 0.453 707 HB3 ALA 78 HB3 ALA 78 -25.945 -16.456 -0.434 708 H PHE 79 H PHE 79 -23.568 -16.822 3.378 709 HA PHE 79 HA PHE 79 -21.860 -14.773 2.159 710 HB2 PHE 79 HB2 PHE 79 -22.305 -14.269 4.348 711 HB3 PHE 79 HB3 PHE 79 -22.023 -15.903 4.905 712 HD1 PHE 79 HD1 PHE 79 -20.392 -12.751 3.934 713 HD2 PHE 79 HD2 PHE 79 -19.762 -16.776 5.332 714 HE1 PHE 79 HE1 PHE 79 -18.062 -12.161 4.549 715 HE2 PHE 79 HE2 PHE 79 -17.435 -16.180 5.961 716 HZ PHE 79 HZ PHE 79 -16.586 -13.885 5.578 717 H PHE 80 H PHE 80 -19.890 -14.863 1.359 718 HA PHE 80 HA PHE 80 -18.321 -17.358 1.618 719 HB2 PHE 80 HB2 PHE 80 -18.921 -15.899 -0.955 720 HB3 PHE 80 HB3 PHE 80 -17.538 -16.944 -0.766 721 HD1 PHE 80 HD1 PHE 80 -17.714 -19.334 -0.923 722 HD2 PHE 80 HD2 PHE 80 -21.258 -16.880 -0.755 723 HE1 PHE 80 HE1 PHE 80 -19.094 -21.266 -1.654 724 HE2 PHE 80 HE2 PHE 80 -22.632 -18.819 -1.484 725 HZ PHE 80 HZ PHE 80 -21.549 -21.011 -1.931 726 H LEU 81 H LEU 81 -16.152 -17.222 1.877 727 HA LEU 81 HA LEU 81 -14.833 -14.569 1.514 728 HB2 LEU 81 HB2 LEU 81 -15.393 -14.994 3.907 729 HB3 LEU 81 HB3 LEU 81 -14.469 -16.492 3.828 730 HG LEU 81 HG LEU 81 -12.395 -15.273 3.534 731 HD11 LEU 81 HD11 LEU 81 -13.212 -13.236 2.325 732 HD12 LEU 81 HD12 LEU 81 -14.191 -12.792 3.739 733 HD13 LEU 81 HD13 LEU 81 -12.417 -12.747 3.828 734 HD21 LEU 81 HD21 LEU 81 -14.056 -14.213 5.847 735 HD22 LEU 81 HD22 LEU 81 -13.071 -15.697 5.821 736 HD23 LEU 81 HD23 LEU 81 -12.282 -14.129 5.724 737 H LEU 82 H LEU 82 -14.006 -15.140 -0.428 738 HA LEU 82 HA LEU 82 -12.864 -17.804 -0.942 739 HB2 LEU 82 HB2 LEU 82 -13.064 -15.429 -2.817 740 HB3 LEU 82 HB3 LEU 82 -12.963 -17.131 -3.236 741 HG LEU 82 HG LEU 82 -15.403 -15.820 -1.928 742 HD11 LEU 82 HD11 LEU 82 -14.940 -14.893 -4.169 743 HD12 LEU 82 HD12 LEU 82 -14.872 -16.545 -4.839 744 HD13 LEU 82 HD13 LEU 82 -16.384 -15.904 -4.167 745 HD21 LEU 82 HD21 LEU 82 -14.985 -18.526 -3.292 746 HD22 LEU 82 HD22 LEU 82 -15.295 -18.255 -1.551 747 HD23 LEU 82 HD23 LEU 82 -16.547 -17.876 -2.749 748 H VAL 83 H VAL 83 -10.620 -18.247 -1.035 749 HA VAL 83 HA VAL 83 -8.736 -16.010 -0.605 750 HB VAL 83 HB VAL 83 -6.971 -17.568 -0.531 751 HG11 VAL 83 HG11 VAL 83 -9.351 -18.758 0.957 752 HG12 VAL 83 HG12 VAL 83 -7.642 -18.851 1.409 753 HG13 VAL 83 HG13 VAL 83 -8.480 -17.286 1.448 754 HG21 VAL 83 HG21 VAL 83 -7.336 -20.038 -0.680 755 HG22 VAL 83 HG22 VAL 83 -8.939 -19.734 -1.385 756 HG23 VAL 83 HG23 VAL 83 -7.458 -19.218 -2.233 757 H ASN 84 H ASN 84 -8.163 -14.699 -2.174 758 HA ASN 84 HA ASN 84 -8.432 -13.753 -4.267 759 HB2 ASN 84 HB2 ASN 84 -6.603 -14.869 -5.859 760 HB3 ASN 84 HB3 ASN 84 -6.240 -13.865 -4.483 761 HD21 ASN 84 HD21 ASN 84 -5.132 -17.764 -4.297 762 HD22 ASN 84 HD22 ASN 84 -6.176 -17.233 -5.628 763 H GLY 85 H GLY 85 -10.660 -15.211 -3.960 764 HA2 GLY 85 HA2 GLY 85 -12.486 -15.475 -5.401 765 HA3 GLY 85 HA3 GLY 85 -11.414 -15.715 -6.768 766 H HIS 86 H HIS 86 -10.149 -17.916 -4.659 767 HA HIS 86 HA HIS 86 -11.889 -20.143 -5.589 768 HB2 HIS 86 HB2 HIS 86 -9.443 -20.305 -5.872 769 HB3 HIS 86 HB3 HIS 86 -9.213 -20.128 -4.136 770 HD1 HIS 86 HD1 HIS 86 -8.335 -22.495 -3.483 771 HD2 HIS 86 HD2 HIS 86 -11.746 -22.531 -5.983 772 HE1 HIS 86 HE1 HIS 86 -9.119 -24.950 -3.627 773 HE2 HIS 86 HE2 HIS 86 -11.196 -24.953 -5.151 774 H SER 87 H SER 87 -13.245 -21.301 -4.289 775 HA SER 87 HA SER 87 -13.966 -20.232 -1.716 776 HB2 SER 87 HB2 SER 87 -15.632 -22.062 -1.672 777 HB3 SER 87 HB3 SER 87 -15.672 -21.105 -3.158 778 HG SER 87 HG SER 87 -14.668 -22.691 -4.256 779 H MET 88 H MET 88 -13.828 -20.949 0.299 780 HA MET 88 HA MET 88 -12.529 -23.507 1.039 781 HB2 MET 88 HB2 MET 88 -11.472 -20.751 1.794 782 HB3 MET 88 HB3 MET 88 -11.117 -22.198 2.730 783 HG2 MET 88 HG2 MET 88 -10.193 -23.266 0.661 784 HG3 MET 88 HG3 MET 88 -10.282 -21.682 -0.123 785 HE1 MET 88 HE1 MET 88 -6.440 -22.568 0.822 786 HE2 MET 88 HE2 MET 88 -7.702 -23.805 0.644 787 HE3 MET 88 HE3 MET 88 -7.603 -22.457 -0.517 788 H VAL 89 H VAL 89 -15.199 -22.944 1.135 789 HA VAL 89 HA VAL 89 -16.279 -21.459 3.169 790 HB VAL 89 HB VAL 89 -17.723 -23.968 2.416 791 HG11 VAL 89 HG11 VAL 89 -18.843 -22.368 3.941 792 HG12 VAL 89 HG12 VAL 89 -18.607 -21.063 2.756 793 HG13 VAL 89 HG13 VAL 89 -19.660 -22.445 2.381 794 HG21 VAL 89 HG21 VAL 89 -17.290 -21.580 0.579 795 HG22 VAL 89 HG22 VAL 89 -16.851 -23.285 0.261 796 HG23 VAL 89 HG23 VAL 89 -18.541 -22.818 0.361 797 H SER 90 H SER 90 -15.225 -24.805 3.666 798 HA SER 90 HA SER 90 -15.722 -24.485 6.600 799 HB2 SER 90 HB2 SER 90 -16.632 -26.770 6.642 800 HB3 SER 90 HB3 SER 90 -17.584 -25.696 5.606 801 HG SER 90 HG SER 90 -17.140 -27.749 4.613 802 H VAL 91 H VAL 91 -13.180 -24.523 4.808 803 HA VAL 91 HA VAL 91 -11.976 -27.059 5.427 804 HB VAL 91 HB VAL 91 -11.620 -25.658 3.338 805 HG11 VAL 91 HG11 VAL 91 -9.319 -24.499 4.973 806 HG12 VAL 91 HG12 VAL 91 -9.667 -24.237 3.256 807 HG13 VAL 91 HG13 VAL 91 -10.777 -23.604 4.492 808 HG21 VAL 91 HG21 VAL 91 -9.454 -26.682 2.920 809 HG22 VAL 91 HG22 VAL 91 -9.227 -27.011 4.644 810 HG23 VAL 91 HG23 VAL 91 -10.533 -27.816 3.744 811 H SER 92 H SER 92 -10.472 -27.760 6.794 812 HA SER 92 HA SER 92 -10.185 -26.359 9.292 813 HB2 SER 92 HB2 SER 92 -8.960 -28.969 8.314 814 HB3 SER 92 HB3 SER 92 -8.987 -28.399 9.991 815 HG SER 92 HG SER 92 -10.727 -29.846 9.534 816 H THR 93 H THR 93 -8.266 -25.968 6.535 817 HA THR 93 HA THR 93 -5.687 -26.116 7.378 818 HB THR 93 HB THR 93 -6.492 -23.897 5.532 819 HG1 THR 93 HG1 THR 93 -6.613 -25.542 3.919 820 HG21 THR 93 HG21 THR 93 -4.079 -24.204 5.895 821 HG22 THR 93 HG22 THR 93 -4.215 -25.927 5.470 822 HG23 THR 93 HG23 THR 93 -4.524 -24.669 4.255 823 HA PRO 94 HA PRO 94 -5.062 -22.694 10.275 824 HB2 PRO 94 HB2 PRO 94 -2.350 -22.804 10.570 825 HB3 PRO 94 HB3 PRO 94 -3.462 -23.985 11.326 826 HG2 PRO 94 HG2 PRO 94 -1.938 -24.265 8.719 827 HG3 PRO 94 HG3 PRO 94 -2.029 -25.437 10.075 828 HD2 PRO 94 HD2 PRO 94 -3.592 -25.669 7.878 829 HD3 PRO 94 HD3 PRO 94 -4.237 -26.057 9.504 830 H ILE 95 H ILE 95 -4.637 -20.535 9.988 831 HA ILE 95 HA ILE 95 -4.674 -19.599 7.358 832 HB ILE 95 HB ILE 95 -5.666 -18.496 9.325 833 HG12 ILE 95 HG12 ILE 95 -5.224 -16.172 8.802 834 HG13 ILE 95 HG13 ILE 95 -3.760 -16.575 7.909 835 HG21 ILE 95 HG21 ILE 95 -2.830 -17.568 10.011 836 HG22 ILE 95 HG22 ILE 95 -4.320 -17.111 10.839 837 HG23 ILE 95 HG23 ILE 95 -3.767 -18.769 10.929 838 HD11 ILE 95 HD11 ILE 95 -6.568 -17.511 7.163 839 HD12 ILE 95 HD12 ILE 95 -5.781 -16.053 6.529 840 HD13 ILE 95 HD13 ILE 95 -5.096 -17.649 6.168 841 H SER 96 H SER 96 -1.798 -20.160 9.291 842 HA SER 96 HA SER 96 0.070 -18.579 7.764 843 HB2 SER 96 HB2 SER 96 1.727 -20.168 8.814 844 HB3 SER 96 HB3 SER 96 0.656 -19.342 9.964 845 HG SER 96 HG SER 96 0.863 -21.672 10.313 846 H GLU 97 H GLU 97 -1.000 -22.009 7.465 847 HA GLU 97 HA GLU 97 0.675 -22.551 5.149 848 HB2 GLU 97 HB2 GLU 97 -1.800 -23.929 6.245 849 HB3 GLU 97 HB3 GLU 97 -0.880 -24.540 4.883 850 HG2 GLU 97 HG2 GLU 97 0.227 -24.099 7.694 851 HG3 GLU 97 HG3 GLU 97 -0.346 -25.636 7.061 852 H VAL 98 H VAL 98 -2.675 -21.370 5.543 853 HA VAL 98 HA VAL 98 -3.239 -21.242 2.714 854 HB VAL 98 HB VAL 98 -4.376 -19.343 4.770 855 HG11 VAL 98 HG11 VAL 98 -5.528 -20.419 2.156 856 HG12 VAL 98 HG12 VAL 98 -6.281 -19.234 3.250 857 HG13 VAL 98 HG13 VAL 98 -4.820 -18.809 2.348 858 HG21 VAL 98 HG21 VAL 98 -5.385 -22.110 3.994 859 HG22 VAL 98 HG22 VAL 98 -4.803 -21.622 5.598 860 HG23 VAL 98 HG23 VAL 98 -6.285 -20.913 4.956 861 H TYR 99 H TYR 99 -1.773 -18.799 4.923 862 HA TYR 99 HA TYR 99 -1.174 -16.903 2.912 863 HB2 TYR 99 HB2 TYR 99 -1.029 -16.032 4.949 864 HB3 TYR 99 HB3 TYR 99 -0.233 -17.415 5.663 865 HD1 TYR 99 HD1 TYR 99 2.190 -17.731 5.544 866 HD2 TYR 99 HD2 TYR 99 0.274 -14.178 4.005 867 HE1 TYR 99 HE1 TYR 99 4.351 -16.504 5.677 868 HE2 TYR 99 HE2 TYR 99 2.444 -12.965 4.128 869 HH TYR 99 HH TYR 99 4.722 -13.128 4.563 870 H GLU 100 H GLU 100 0.924 -19.636 3.886 871 HA GLU 100 HA GLU 100 2.981 -18.960 2.036 872 HB2 GLU 100 HB2 GLU 100 3.242 -20.481 3.962 873 HB3 GLU 100 HB3 GLU 100 2.134 -21.630 3.210 874 HG2 GLU 100 HG2 GLU 100 4.382 -22.393 2.961 875 HG3 GLU 100 HG3 GLU 100 3.714 -22.016 1.380 876 H SER 101 H SER 101 -0.068 -20.656 1.546 877 HA SER 101 HA SER 101 0.591 -21.507 -1.192 878 HB2 SER 101 HB2 SER 101 -2.014 -21.594 0.385 879 HB3 SER 101 HB3 SER 101 -1.731 -22.339 -1.198 880 HG SER 101 HG SER 101 -0.548 -22.993 1.300 881 H GLU 102 H GLU 102 -1.160 -18.807 0.270 882 HA GLU 102 HA GLU 102 -2.094 -17.842 -2.407 883 HB2 GLU 102 HB2 GLU 102 -3.456 -17.545 0.286 884 HB3 GLU 102 HB3 GLU 102 -4.112 -17.085 -1.265 885 HG2 GLU 102 HG2 GLU 102 -3.587 -19.920 -0.308 886 HG3 GLU 102 HG3 GLU 102 -5.135 -19.117 -0.427 887 H LYS 103 H LYS 103 0.394 -16.982 -0.779 888 HA LYS 103 HA LYS 103 0.096 -14.192 -0.244 889 HB2 LYS 103 HB2 LYS 103 2.302 -16.113 -0.641 890 HB3 LYS 103 HB3 LYS 103 2.686 -14.523 -1.285 891 HG2 LYS 103 HG2 LYS 103 2.236 -13.435 0.809 892 HG3 LYS 103 HG3 LYS 103 1.632 -14.918 1.542 893 HD2 LYS 103 HD2 LYS 103 4.468 -14.657 0.451 894 HD3 LYS 103 HD3 LYS 103 4.042 -14.228 2.113 895 HE2 LYS 103 HE2 LYS 103 3.183 -16.521 2.520 896 HE3 LYS 103 HE3 LYS 103 3.559 -16.969 0.853 897 HZ1 LYS 103 HZ1 LYS 103 5.571 -16.215 2.924 898 HZ2 LYS 103 HZ2 LYS 103 5.327 -17.719 2.299 899 HZ3 LYS 103 HZ3 LYS 103 5.936 -16.531 1.355 900 H ASP 104 H ASP 104 -0.076 -12.455 -1.439 901 HA ASP 104 HA ASP 104 -0.106 -12.583 -4.394 902 HB2 ASP 104 HB2 ASP 104 -1.203 -10.493 -4.291 903 HB3 ASP 104 HB3 ASP 104 -1.936 -11.542 -3.095 904 H GLU 105 H GLU 105 0.823 -10.324 -5.335 905 HA GLU 105 HA GLU 105 3.654 -10.668 -5.244 906 HB2 GLU 105 HB2 GLU 105 1.978 -8.421 -6.434 907 HB3 GLU 105 HB3 GLU 105 3.682 -8.674 -6.770 908 HG2 GLU 105 HG2 GLU 105 1.435 -10.620 -7.453 909 HG3 GLU 105 HG3 GLU 105 2.208 -9.503 -8.565 910 H ASP 106 H ASP 106 1.714 -8.722 -3.146 911 HA ASP 106 HA ASP 106 3.939 -6.863 -2.461 912 HB2 ASP 106 HB2 ASP 106 1.200 -6.999 -1.174 913 HB3 ASP 106 HB3 ASP 106 2.380 -5.708 -1.092 914 H GLY 107 H GLY 107 2.572 -9.890 -1.584 915 HA2 GLY 107 HA2 GLY 107 3.485 -11.415 -0.013 916 HA3 GLY 107 HA3 GLY 107 4.125 -10.084 0.946 917 H PHE 108 H PHE 108 0.888 -9.522 -0.029 918 HA PHE 108 HA PHE 108 -0.222 -10.211 2.627 919 HB2 PHE 108 HB2 PHE 108 -0.957 -8.326 0.471 920 HB3 PHE 108 HB3 PHE 108 -2.304 -9.119 1.247 921 HD1 PHE 108 HD1 PHE 108 -2.931 -8.655 3.524 922 HD2 PHE 108 HD2 PHE 108 0.503 -6.760 1.748 923 HE1 PHE 108 HE1 PHE 108 -2.913 -6.987 5.369 924 HE2 PHE 108 HE2 PHE 108 0.523 -5.090 3.590 925 HZ PHE 108 HZ PHE 108 -1.160 -5.211 5.410 926 H LEU 109 H LEU 109 -2.205 -11.405 2.866 927 HA LEU 109 HA LEU 109 -2.711 -13.406 0.697 928 HB2 LEU 109 HB2 LEU 109 -2.274 -13.968 3.187 929 HB3 LEU 109 HB3 LEU 109 -3.875 -13.315 3.479 930 HG LEU 109 HG LEU 109 -3.117 -15.774 1.854 931 HD11 LEU 109 HD11 LEU 109 -4.515 -16.892 3.602 932 HD12 LEU 109 HD12 LEU 109 -3.142 -16.028 4.301 933 HD13 LEU 109 HD13 LEU 109 -4.755 -15.319 4.393 934 HD21 LEU 109 HD21 LEU 109 -5.876 -14.508 2.163 935 HD22 LEU 109 HD22 LEU 109 -5.009 -14.871 0.648 936 HD23 LEU 109 HD23 LEU 109 -5.594 -16.189 1.650 937 H TYR 110 H TYR 110 -4.209 -12.717 -0.805 938 HA TYR 110 HA TYR 110 -6.299 -10.826 -0.074 939 HB2 TYR 110 HB2 TYR 110 -5.556 -12.118 -2.653 940 HB3 TYR 110 HB3 TYR 110 -7.167 -11.473 -2.462 941 HD1 TYR 110 HD1 TYR 110 -7.189 -8.991 -1.253 942 HD2 TYR 110 HD2 TYR 110 -4.157 -10.654 -3.835 943 HE1 TYR 110 HE1 TYR 110 -6.548 -6.704 -1.978 944 HE2 TYR 110 HE2 TYR 110 -3.533 -8.363 -4.578 945 HH TYR 110 HH TYR 110 -4.089 -6.114 -4.507 946 H MET 111 H MET 111 -8.272 -11.102 0.699 947 HA MET 111 HA MET 111 -9.652 -13.675 0.042 948 HB2 MET 111 HB2 MET 111 -9.940 -12.078 2.609 949 HB3 MET 111 HB3 MET 111 -10.880 -13.502 2.115 950 HG2 MET 111 HG2 MET 111 -8.695 -14.762 1.894 951 HG3 MET 111 HG3 MET 111 -7.920 -13.399 2.711 952 HE1 MET 111 HE1 MET 111 -7.940 -16.373 5.261 953 HE2 MET 111 HE2 MET 111 -7.852 -16.493 3.499 954 HE3 MET 111 HE3 MET 111 -6.954 -15.214 4.350 955 H VAL 112 H VAL 112 -11.209 -13.426 -1.352 956 HA VAL 112 HA VAL 112 -12.505 -10.799 -1.709 957 HB VAL 112 HB VAL 112 -12.868 -13.265 -3.410 958 HG11 VAL 112 HG11 VAL 112 -14.711 -11.621 -3.561 959 HG12 VAL 112 HG12 VAL 112 -13.533 -10.322 -3.868 960 HG13 VAL 112 HG13 VAL 112 -13.748 -11.642 -5.048 961 HG21 VAL 112 HG21 VAL 112 -11.045 -10.860 -3.834 962 HG22 VAL 112 HG22 VAL 112 -10.516 -12.533 -3.544 963 HG23 VAL 112 HG23 VAL 112 -11.383 -12.132 -5.028 964 H TYR 113 H TYR 113 -14.144 -10.359 -0.494 965 HA TYR 113 HA TYR 113 -15.929 -12.365 0.637 966 HB2 TYR 113 HB2 TYR 113 -15.582 -10.848 2.196 967 HB3 TYR 113 HB3 TYR 113 -15.427 -9.514 1.075 968 HD1 TYR 113 HD1 TYR 113 -18.305 -11.888 1.813 969 HD2 TYR 113 HD2 TYR 113 -16.816 -7.821 1.725 970 HE1 TYR 113 HE1 TYR 113 -20.552 -11.023 2.491 971 HE2 TYR 113 HE2 TYR 113 -19.047 -6.997 2.444 972 HH TYR 113 HH TYR 113 -21.137 -7.560 3.160 973 H ALA 114 H ALA 114 -17.723 -13.189 -0.166 974 HA ALA 114 HA ALA 114 -19.066 -11.784 -2.430 975 HB1 ALA 114 HB1 ALA 114 -17.879 -14.580 -2.641 976 HB2 ALA 114 HB2 ALA 114 -18.656 -13.635 -3.935 977 HB3 ALA 114 HB3 ALA 114 -17.105 -13.114 -3.275 978 H SER 115 H SER 115 -20.864 -13.193 -3.345 979 HA SER 115 HA SER 115 -22.306 -14.760 -1.265 980 HB2 SER 115 HB2 SER 115 -24.386 -13.928 -2.599 981 HB3 SER 115 HB3 SER 115 -23.576 -12.873 -1.445 982 HG SER 115 HG SER 115 -23.580 -12.762 -4.250 983 H GLN 116 H GLN 116 -20.495 -15.272 -3.816 984 HA GLN 116 HA GLN 116 -21.475 -17.893 -4.436 985 HB2 GLN 116 HB2 GLN 116 -21.644 -17.566 -6.861 986 HB3 GLN 116 HB3 GLN 116 -22.901 -16.671 -6.034 987 HG2 GLN 116 HG2 GLN 116 -20.326 -15.405 -7.094 988 HG3 GLN 116 HG3 GLN 116 -21.802 -15.544 -8.023 989 HE21 GLN 116 HE21 GLN 116 -20.289 -13.099 -6.957 990 HE22 GLN 116 HE22 GLN 116 -21.613 -12.193 -6.223 991 H GLU 117 H GLU 117 -19.709 -19.103 -5.583 992 HA GLU 117 HA GLU 117 -17.042 -17.947 -5.226 993 HB2 GLU 117 HB2 GLU 117 -17.495 -20.370 -5.006 994 HB3 GLU 117 HB3 GLU 117 -17.903 -20.442 -6.729 995 HG2 GLU 117 HG2 GLU 117 -15.596 -19.738 -7.307 996 HG3 GLU 117 HG3 GLU 117 -15.212 -19.570 -5.585 997 H THR 118 H THR 118 -19.142 -18.615 -8.038 998 HA THR 118 HA THR 118 -18.153 -16.305 -9.482 999 HB THR 118 HB THR 118 -16.397 -17.901 -10.102 1000 HG1 THR 118 HG1 THR 118 -16.587 -17.556 -12.263 1001 HG21 THR 118 HG21 THR 118 -18.604 -19.621 -11.334 1002 HG22 THR 118 HG22 THR 118 -16.852 -19.868 -11.478 1003 HG23 THR 118 HG23 THR 118 -17.636 -20.054 -9.905 1004 H PHE 119 H PHE 119 -19.459 -15.782 -11.336 1005 HA PHE 119 HA PHE 119 -22.144 -16.975 -11.308 1006 HB2 PHE 119 HB2 PHE 119 -21.060 -14.501 -12.593 1007 HB3 PHE 119 HB3 PHE 119 -22.584 -15.198 -13.113 1008 HD1 PHE 119 HD1 PHE 119 -21.153 -12.928 -10.805 1009 HD2 PHE 119 HD2 PHE 119 -24.324 -15.820 -11.229 1010 HE1 PHE 119 HE1 PHE 119 -22.437 -11.800 -9.000 1011 HE2 PHE 119 HE2 PHE 119 -25.590 -14.703 -9.405 1012 HZ PHE 119 HZ PHE 119 -24.649 -12.689 -8.294 1013 H GLY 120 H GLY 120 -19.350 -17.751 -12.925 1014 HA2 GLY 120 HA2 GLY 120 -18.976 -19.512 -14.397 1015 HA3 GLY 120 HA3 GLY 120 -20.716 -19.741 -14.585 1016 H1 ASP 10 H1 ASP 10 -10.195 -0.721 19.072 1017 H2 ASP 10 H2 ASP 10 -11.544 0.165 19.427 1018 H3 ASP 10 H3 ASP 10 -11.449 -0.661 18.000 1019 HA ASP 10 HA ASP 10 -11.175 1.646 17.627 1020 HB2 ASP 10 HB2 ASP 10 -8.846 1.447 19.547 1021 HB3 ASP 10 HB3 ASP 10 -9.126 2.795 18.439 1022 H TYR 11 H TYR 11 -10.519 1.980 15.633 1023 HA TYR 11 HA TYR 11 -9.703 1.477 13.648 1024 HB2 TYR 11 HB2 TYR 11 -7.273 1.969 13.335 1025 HB3 TYR 11 HB3 TYR 11 -8.346 3.173 13.993 1026 HD1 TYR 11 HD1 TYR 11 -8.141 4.006 16.295 1027 HD2 TYR 11 HD2 TYR 11 -5.539 0.954 14.730 1028 HE1 TYR 11 HE1 TYR 11 -6.594 4.338 18.224 1029 HE2 TYR 11 HE2 TYR 11 -3.982 1.289 16.659 1030 HH TYR 11 HH TYR 11 -3.571 2.446 18.603 1031 H GLU 12 H GLU 12 -10.583 -0.777 14.223 1032 HA GLU 12 HA GLU 12 -8.830 -3.034 14.191 1033 HB2 GLU 12 HB2 GLU 12 -11.729 -2.977 13.308 1034 HB3 GLU 12 HB3 GLU 12 -10.814 -4.365 13.874 1035 HG2 GLU 12 HG2 GLU 12 -11.709 -3.940 15.867 1036 HG3 GLU 12 HG3 GLU 12 -10.434 -2.759 16.029 1037 H SER 13 H SER 13 -8.852 -0.972 11.699 1038 HA SER 13 HA SER 13 -7.845 -2.947 9.786 1039 HB2 SER 13 HB2 SER 13 -10.501 -1.636 9.475 1040 HB3 SER 13 HB3 SER 13 -9.522 -1.801 8.009 1041 HG SER 13 HG SER 13 -9.925 -3.968 9.809 1042 H ASP 14 H ASP 14 -6.609 -0.609 11.160 1043 HA ASP 14 HA ASP 14 -5.632 0.709 8.696 1044 HB2 ASP 14 HB2 ASP 14 -6.264 2.057 11.247 1045 HB3 ASP 14 HB3 ASP 14 -4.897 2.643 10.309 1046 H ASP 15 H ASP 15 -3.656 1.328 11.445 1047 HA ASP 15 HA ASP 15 -1.681 -0.615 10.663 1048 HB2 ASP 15 HB2 ASP 15 0.026 1.085 9.880 1049 HB3 ASP 15 HB3 ASP 15 -1.228 0.562 8.785 1050 H ASP 16 H ASP 16 0.431 -0.427 11.617 1051 HA ASP 16 HA ASP 16 1.792 -0.355 13.379 1052 HB2 ASP 16 HB2 ASP 16 2.410 1.641 12.430 1053 HB3 ASP 16 HB3 ASP 16 1.013 2.498 13.071 1054 H SER 17 H SER 17 1.072 -1.782 14.810 1055 HA SER 17 HA SER 17 0.254 -2.687 16.725 1056 HB2 SER 17 HB2 SER 17 2.011 -1.187 17.629 1057 HB3 SER 17 HB3 SER 17 0.768 0.032 17.967 1058 HG SER 17 HG SER 17 1.197 -1.328 19.789 1059 H TYR 18 H TYR 18 -1.792 -2.996 15.748 1060 HA TYR 18 HA TYR 18 -3.957 -1.261 16.770 1061 HB2 TYR 18 HB2 TYR 18 -5.070 -1.256 14.621 1062 HB3 TYR 18 HB3 TYR 18 -3.567 -0.358 14.686 1063 HD1 TYR 18 HD1 TYR 18 -5.463 -1.889 12.503 1064 HD2 TYR 18 HD2 TYR 18 -1.393 -2.132 13.855 1065 HE1 TYR 18 HE1 TYR 18 -4.772 -2.898 10.314 1066 HE2 TYR 18 HE2 TYR 18 -0.732 -3.223 11.744 1067 HH TYR 18 HH TYR 18 -1.446 -4.034 9.669 1068 H GLU 19 H GLU 19 -6.125 -2.021 16.803 1069 HA GLU 19 HA GLU 19 -6.215 -4.761 17.820 1070 HB2 GLU 19 HB2 GLU 19 -8.348 -2.618 17.662 1071 HB3 GLU 19 HB3 GLU 19 -8.503 -4.172 18.506 1072 HG2 GLU 19 HG2 GLU 19 -6.612 -3.598 19.976 1073 HG3 GLU 19 HG3 GLU 19 -6.434 -2.035 19.179 1074 H VAL 20 H VAL 20 -5.590 -5.114 15.290 1075 HA VAL 20 HA VAL 20 -7.715 -5.051 13.406 1076 HB VAL 20 HB VAL 20 -5.775 -7.036 12.581 1077 HG11 VAL 20 HG11 VAL 20 -7.150 -5.590 11.131 1078 HG12 VAL 20 HG12 VAL 20 -6.310 -4.170 11.735 1079 HG13 VAL 20 HG13 VAL 20 -5.420 -5.383 10.784 1080 HG21 VAL 20 HG21 VAL 20 -4.540 -4.472 13.634 1081 HG22 VAL 20 HG22 VAL 20 -4.142 -6.133 14.118 1082 HG23 VAL 20 HG23 VAL 20 -3.773 -5.559 12.483 1083 H LEU 21 H LEU 21 -8.950 -6.650 12.331 1084 HA LEU 21 HA LEU 21 -10.322 -8.547 12.231 1085 HB2 LEU 21 HB2 LEU 21 -7.825 -9.617 12.886 1086 HB3 LEU 21 HB3 LEU 21 -8.819 -10.186 14.204 1087 HG LEU 21 HG LEU 21 -9.288 -10.677 11.230 1088 HD11 LEU 21 HD11 LEU 21 -8.605 -12.940 11.704 1089 HD12 LEU 21 HD12 LEU 21 -7.329 -11.843 12.292 1090 HD13 LEU 21 HD13 LEU 21 -8.455 -12.602 13.437 1091 HD21 LEU 21 HD21 LEU 21 -11.398 -10.683 12.331 1092 HD22 LEU 21 HD22 LEU 21 -10.935 -12.347 11.936 1093 HD23 LEU 21 HD23 LEU 21 -10.792 -11.766 13.616 1094 H ASP 22 H ASP 22 -10.083 -6.406 14.537 1095 HA ASP 22 HA ASP 22 -10.930 -5.902 16.453 1096 HB2 ASP 22 HB2 ASP 22 -12.912 -5.738 15.222 1097 HB3 ASP 22 HB3 ASP 22 -13.271 -7.451 15.402 1098 H LEU 23 H LEU 23 -9.026 -7.606 16.669 1099 HA LEU 23 HA LEU 23 -9.492 -9.133 19.175 1100 HB2 LEU 23 HB2 LEU 23 -8.048 -10.085 16.660 1101 HB3 LEU 23 HB3 LEU 23 -7.849 -10.852 18.219 1102 HG LEU 23 HG LEU 23 -10.456 -10.769 16.666 1103 HD11 LEU 23 HD11 LEU 23 -8.662 -12.226 15.690 1104 HD12 LEU 23 HD12 LEU 23 -8.530 -13.077 17.238 1105 HD13 LEU 23 HD13 LEU 23 -10.030 -13.161 16.300 1106 HD21 LEU 23 HD21 LEU 23 -10.892 -10.899 19.090 1107 HD22 LEU 23 HD22 LEU 23 -11.201 -12.464 18.326 1108 HD23 LEU 23 HD23 LEU 23 -9.701 -12.219 19.246 1109 H THR 24 H THR 24 -7.384 -9.649 20.235 1110 HA THR 24 HA THR 24 -5.136 -7.907 19.449 1111 HB THR 24 HB THR 24 -4.596 -7.003 21.420 1112 HG1 THR 24 HG1 THR 24 -5.422 -7.695 23.420 1113 HG21 THR 24 HG21 THR 24 -7.622 -7.125 21.755 1114 HG22 THR 24 HG22 THR 24 -6.514 -5.889 22.392 1115 HG23 THR 24 HG23 THR 24 -6.770 -6.019 20.648 1116 H GLU 25 H GLU 25 -5.791 -10.633 21.658 1117 HA GLU 25 HA GLU 25 -4.674 -12.552 22.055 1118 HB2 GLU 25 HB2 GLU 25 -4.113 -12.388 19.078 1119 HB3 GLU 25 HB3 GLU 25 -3.893 -13.838 20.044 1120 HG2 GLU 25 HG2 GLU 25 -6.543 -12.377 19.659 1121 HG3 GLU 25 HG3 GLU 25 -6.031 -13.822 18.801 1122 H TYR 26 H TYR 26 -3.227 -10.265 22.714 1123 HA TYR 26 HA TYR 26 -0.452 -10.559 22.146 1124 HB2 TYR 26 HB2 TYR 26 -1.051 -8.430 22.655 1125 HB3 TYR 26 HB3 TYR 26 -1.977 -8.898 24.067 1126 HD1 TYR 26 HD1 TYR 26 1.453 -8.332 22.787 1127 HD2 TYR 26 HD2 TYR 26 -0.977 -9.163 26.251 1128 HE1 TYR 26 HE1 TYR 26 3.380 -7.775 24.274 1129 HE2 TYR 26 HE2 TYR 26 0.945 -8.608 27.739 1130 HH TYR 26 HH TYR 26 3.147 -7.931 27.854 Start of MODEL 7 1 H1 MET 1 H1 MET 1 -6.130 0.925 5.543 2 H2 MET 1 H2 MET 1 -6.874 0.053 6.686 3 H3 MET 1 H3 MET 1 -7.466 0.016 5.148 4 HA MET 1 HA MET 1 -7.387 2.410 6.889 5 HB2 MET 1 HB2 MET 1 -7.281 2.822 4.405 6 HB3 MET 1 HB3 MET 1 -8.828 2.022 4.217 7 HG2 MET 1 HG2 MET 1 -9.819 3.760 5.791 8 HG3 MET 1 HG3 MET 1 -8.246 4.573 5.775 9 HE1 MET 1 HE1 MET 1 -10.822 6.177 5.076 10 HE2 MET 1 HE2 MET 1 -9.192 6.866 4.929 11 HE3 MET 1 HE3 MET 1 -10.345 7.027 3.587 12 HA PRO 2 HA PRO 2 -11.187 0.426 8.489 13 HB2 PRO 2 HB2 PRO 2 -11.322 2.844 10.264 14 HB3 PRO 2 HB3 PRO 2 -11.352 1.111 10.684 15 HG2 PRO 2 HG2 PRO 2 -9.155 2.651 11.145 16 HG3 PRO 2 HG3 PRO 2 -8.990 0.964 10.545 17 HD2 PRO 2 HD2 PRO 2 -8.971 3.530 8.916 18 HD3 PRO 2 HD3 PRO 2 -7.776 2.200 8.925 19 H SER 3 H SER 3 -12.071 0.857 6.330 20 HA SER 3 HA SER 3 -14.114 2.998 6.226 21 HB2 SER 3 HB2 SER 3 -12.075 4.106 5.408 22 HB3 SER 3 HB3 SER 3 -11.804 2.787 4.254 23 HG SER 3 HG SER 3 -13.652 4.890 4.176 24 H GLU 4 H GLU 4 -15.522 2.854 4.405 25 HA GLU 4 HA GLU 4 -16.316 0.215 3.498 26 HB2 GLU 4 HB2 GLU 4 -17.947 1.933 3.752 27 HB3 GLU 4 HB3 GLU 4 -17.016 3.086 2.792 28 HG2 GLU 4 HG2 GLU 4 -17.445 1.835 0.745 29 HG3 GLU 4 HG3 GLU 4 -18.296 0.585 1.660 30 H LYS 5 H LYS 5 -14.088 2.646 2.350 31 HA LYS 5 HA LYS 5 -13.990 1.866 -0.453 32 HB2 LYS 5 HB2 LYS 5 -12.201 3.679 1.237 33 HB3 LYS 5 HB3 LYS 5 -12.117 3.528 -0.518 34 HG2 LYS 5 HG2 LYS 5 -14.448 4.341 -0.719 35 HG3 LYS 5 HG3 LYS 5 -14.536 4.530 1.045 36 HD2 LYS 5 HD2 LYS 5 -12.682 6.175 0.982 37 HD3 LYS 5 HD3 LYS 5 -12.521 5.933 -0.759 38 HE2 LYS 5 HE2 LYS 5 -13.697 7.984 -0.426 39 HE3 LYS 5 HE3 LYS 5 -14.811 6.806 -1.126 40 HZ1 LYS 5 HZ1 LYS 5 -15.786 6.494 1.099 41 HZ2 LYS 5 HZ2 LYS 5 -14.701 7.533 1.769 42 HZ3 LYS 5 HZ3 LYS 5 -15.819 8.072 0.710 43 H THR 6 H THR 6 -11.973 1.328 -1.564 44 HA THR 6 HA THR 6 -10.826 -1.079 -0.547 45 HB THR 6 HB THR 6 -9.880 -1.502 -2.529 46 HG1 THR 6 HG1 THR 6 -9.176 0.220 -3.949 47 HG21 THR 6 HG21 THR 6 -12.289 -0.901 -2.996 48 HG22 THR 6 HG22 THR 6 -11.719 0.708 -3.513 49 HG23 THR 6 HG23 THR 6 -11.199 -0.743 -4.383 50 H PHE 7 H PHE 7 -8.572 -1.707 -0.248 51 HA PHE 7 HA PHE 7 -7.067 0.335 1.203 52 HB2 PHE 7 HB2 PHE 7 -7.120 -1.743 2.232 53 HB3 PHE 7 HB3 PHE 7 -6.638 -2.583 0.773 54 HD1 PHE 7 HD1 PHE 7 -5.054 0.365 2.553 55 HD2 PHE 7 HD2 PHE 7 -4.665 -3.720 1.231 56 HE1 PHE 7 HE1 PHE 7 -2.813 0.245 3.597 57 HE2 PHE 7 HE2 PHE 7 -2.410 -3.829 2.269 58 HZ PHE 7 HZ PHE 7 -1.487 -1.857 3.463 59 H LYS 8 H LYS 8 -6.972 -0.834 -2.094 60 HA LYS 8 HA LYS 8 -4.379 0.348 -2.714 61 HB2 LYS 8 HB2 LYS 8 -5.290 -1.379 -4.129 62 HB3 LYS 8 HB3 LYS 8 -6.768 -0.475 -4.407 63 HG2 LYS 8 HG2 LYS 8 -5.329 -0.446 -6.375 64 HG3 LYS 8 HG3 LYS 8 -5.609 1.176 -5.752 65 HD2 LYS 8 HD2 LYS 8 -3.311 1.115 -4.688 66 HD3 LYS 8 HD3 LYS 8 -3.101 -0.514 -5.319 67 HE2 LYS 8 HE2 LYS 8 -1.909 1.147 -6.678 68 HE3 LYS 8 HE3 LYS 8 -3.134 0.295 -7.621 69 HZ1 LYS 8 HZ1 LYS 8 -3.511 3.027 -6.458 70 HZ2 LYS 8 HZ2 LYS 8 -3.109 2.725 -8.012 71 HZ3 LYS 8 HZ3 LYS 8 -4.561 2.259 -7.460 72 H GLN 9 H GLN 9 -7.670 1.637 -2.591 73 HA GLN 9 HA GLN 9 -7.098 4.275 -3.561 74 HB2 GLN 9 HB2 GLN 9 -9.295 3.637 -3.474 75 HB3 GLN 9 HB3 GLN 9 -9.224 2.992 -1.863 76 HG2 GLN 9 HG2 GLN 9 -9.042 5.970 -2.466 77 HG3 GLN 9 HG3 GLN 9 -10.552 5.105 -2.216 78 HE21 GLN 9 HE21 GLN 9 -9.271 3.352 0.082 79 HE22 GLN 9 HE22 GLN 9 -9.350 4.530 1.386 80 H ARG 10 H ARG 10 -6.244 2.787 -0.517 81 HA ARG 10 HA ARG 10 -5.433 5.363 0.743 82 HB2 ARG 10 HB2 ARG 10 -6.769 3.695 2.004 83 HB3 ARG 10 HB3 ARG 10 -5.512 2.498 1.735 84 HG2 ARG 10 HG2 ARG 10 -5.130 3.124 3.870 85 HG3 ARG 10 HG3 ARG 10 -3.915 4.057 3.053 86 HD2 ARG 10 HD2 ARG 10 -5.016 6.098 3.414 87 HD3 ARG 10 HD3 ARG 10 -6.589 5.331 3.668 88 HE ARG 10 HE ARG 10 -5.134 4.236 5.708 89 HH11 ARG 10 HH11 ARG 10 -5.025 6.635 8.125 90 HH12 ARG 10 HH12 ARG 10 -4.878 4.944 7.740 91 HH21 ARG 10 HH21 ARG 10 -5.477 8.128 6.536 92 HH22 ARG 10 HH22 ARG 10 -5.705 7.613 4.894 93 H ARG 11 H ARG 11 -3.877 2.273 -0.275 94 HA ARG 11 HA ARG 11 -1.221 3.676 -0.277 95 HB2 ARG 11 HB2 ARG 11 -1.879 0.926 0.842 96 HB3 ARG 11 HB3 ARG 11 -0.237 1.536 0.643 97 HG2 ARG 11 HG2 ARG 11 -2.368 2.603 2.518 98 HG3 ARG 11 HG3 ARG 11 -0.954 1.662 2.955 99 HD2 ARG 11 HD2 ARG 11 0.552 3.452 2.333 100 HD3 ARG 11 HD3 ARG 11 -0.752 4.429 1.684 101 HE ARG 11 HE ARG 11 -0.222 3.808 4.576 102 HH11 ARG 11 HH11 ARG 11 -2.207 7.088 3.556 103 HH12 ARG 11 HH12 ARG 11 -2.019 5.866 2.321 104 HH21 ARG 11 HH21 ARG 11 -1.466 6.698 5.675 105 HH22 ARG 11 HH22 ARG 11 -0.589 5.192 5.979 106 H THR 12 H THR 12 0.189 3.272 -1.815 107 HA THR 12 HA THR 12 -0.528 1.625 -4.138 108 HB THR 12 HB THR 12 1.329 2.511 -5.258 109 HG1 THR 12 HG1 THR 12 2.940 3.681 -4.187 110 HG21 THR 12 HG21 THR 12 -0.520 4.154 -4.884 111 HG22 THR 12 HG22 THR 12 0.379 4.801 -3.482 112 HG23 THR 12 HG23 THR 12 1.063 4.908 -5.114 113 H PHE 13 H PHE 13 1.150 0.090 -5.127 114 HA PHE 13 HA PHE 13 1.473 -2.092 -3.454 115 HB2 PHE 13 HB2 PHE 13 1.435 -2.556 -5.695 116 HB3 PHE 13 HB3 PHE 13 2.690 -1.394 -6.078 117 HD1 PHE 13 HD1 PHE 13 2.064 -4.806 -4.769 118 HD2 PHE 13 HD2 PHE 13 5.064 -1.915 -5.895 119 HE1 PHE 13 HE1 PHE 13 3.791 -6.598 -4.793 120 HE2 PHE 13 HE2 PHE 13 6.786 -3.697 -5.873 121 HZ PHE 13 HZ PHE 13 6.153 -6.040 -5.323 122 H GLU 14 H GLU 14 4.158 0.176 -4.107 123 HA GLU 14 HA GLU 14 6.046 -1.230 -2.460 124 HB2 GLU 14 HB2 GLU 14 5.844 1.721 -3.175 125 HB3 GLU 14 HB3 GLU 14 7.242 0.990 -2.398 126 HG2 GLU 14 HG2 GLU 14 6.174 0.243 -5.163 127 HG3 GLU 14 HG3 GLU 14 7.497 1.354 -4.852 128 H GLN 15 H GLN 15 3.611 1.245 -1.654 129 HA GLN 15 HA GLN 15 4.473 1.613 1.096 130 HB2 GLN 15 HB2 GLN 15 1.821 2.173 -0.268 131 HB3 GLN 15 HB3 GLN 15 2.295 2.739 1.338 132 HG2 GLN 15 HG2 GLN 15 4.015 4.166 0.434 133 HG3 GLN 15 HG3 GLN 15 3.823 3.496 -1.186 134 HE21 GLN 15 HE21 GLN 15 1.994 6.742 -1.119 135 HE22 GLN 15 HE22 GLN 15 3.665 6.257 -0.872 136 H ARG 16 H ARG 16 2.041 -0.484 -0.500 137 HA ARG 16 HA ARG 16 1.074 -1.705 1.967 138 HB2 ARG 16 HB2 ARG 16 0.947 -2.684 -0.923 139 HB3 ARG 16 HB3 ARG 16 0.128 -3.437 0.456 140 HG2 ARG 16 HG2 ARG 16 -1.027 -1.239 0.893 141 HG3 ARG 16 HG3 ARG 16 -0.362 -0.624 -0.612 142 HD2 ARG 16 HD2 ARG 16 -2.306 -2.943 -0.316 143 HD3 ARG 16 HD3 ARG 16 -2.671 -1.328 -0.892 144 HE ARG 16 HE ARG 16 -1.592 -1.737 -2.936 145 HH11 ARG 16 HH11 ARG 16 -1.127 -3.203 -4.658 146 HH12 ARG 16 HH12 ARG 16 -0.885 -4.892 -4.227 147 HH21 ARG 16 HH21 ARG 16 -1.495 -4.666 -0.964 148 HH22 ARG 16 HH22 ARG 16 -1.071 -5.630 -2.383 149 H VAL 17 H VAL 17 3.705 -2.554 -0.278 150 HA VAL 17 HA VAL 17 4.493 -4.969 1.103 151 HB VAL 17 HB VAL 17 5.942 -3.060 -0.765 152 HG11 VAL 17 HG11 VAL 17 7.707 -3.997 0.634 153 HG12 VAL 17 HG12 VAL 17 7.029 -5.630 0.457 154 HG13 VAL 17 HG13 VAL 17 7.735 -4.784 -0.941 155 HG21 VAL 17 HG21 VAL 17 5.039 -5.967 -1.073 156 HG22 VAL 17 HG22 VAL 17 4.151 -4.572 -1.698 157 HG23 VAL 17 HG23 VAL 17 5.759 -4.936 -2.329 158 H GLU 18 H GLU 18 5.549 -1.502 1.517 159 HA GLU 18 HA GLU 18 7.281 -2.038 3.729 160 HB2 GLU 18 HB2 GLU 18 5.708 0.403 2.885 161 HB3 GLU 18 HB3 GLU 18 6.642 0.378 4.394 162 HG2 GLU 18 HG2 GLU 18 8.686 -0.169 3.224 163 HG3 GLU 18 HG3 GLU 18 7.843 -0.285 1.681 164 H ASP 19 H ASP 19 3.773 -1.222 3.814 165 HA ASP 19 HA ASP 19 3.339 -1.558 6.595 166 HB2 ASP 19 HB2 ASP 19 1.754 -0.493 5.188 167 HB3 ASP 19 HB3 ASP 19 1.564 -1.923 4.197 168 H VAL 20 H VAL 20 2.972 -4.149 4.118 169 HA VAL 20 HA VAL 20 2.603 -6.133 6.077 170 HB VAL 20 HB VAL 20 2.224 -6.157 3.466 171 HG11 VAL 20 HG11 VAL 20 4.676 -7.952 3.650 172 HG12 VAL 20 HG12 VAL 20 3.626 -7.650 2.254 173 HG13 VAL 20 HG13 VAL 20 4.655 -6.365 2.858 174 HG21 VAL 20 HG21 VAL 20 1.272 -7.680 5.076 175 HG22 VAL 20 HG22 VAL 20 1.838 -8.575 3.665 176 HG23 VAL 20 HG23 VAL 20 2.800 -8.598 5.169 177 H ARG 21 H ARG 21 5.682 -5.078 4.674 178 HA ARG 21 HA ARG 21 7.250 -7.156 5.928 179 HB2 ARG 21 HB2 ARG 21 7.829 -5.937 3.853 180 HB3 ARG 21 HB3 ARG 21 8.123 -4.458 4.769 181 HG2 ARG 21 HG2 ARG 21 9.596 -7.034 5.434 182 HG3 ARG 21 HG3 ARG 21 10.095 -6.059 4.054 183 HD2 ARG 21 HD2 ARG 21 10.621 -4.164 5.389 184 HD3 ARG 21 HD3 ARG 21 9.894 -4.827 6.836 185 HE ARG 21 HE ARG 21 12.539 -5.405 5.770 186 HH11 ARG 21 HH11 ARG 21 10.026 -6.802 7.847 187 HH12 ARG 21 HH12 ARG 21 11.234 -7.640 8.804 188 HH21 ARG 21 HH21 ARG 21 13.943 -6.645 7.016 189 HH22 ARG 21 HH22 ARG 21 13.292 -7.632 8.301 190 H LEU 22 H LEU 22 6.408 -3.847 6.970 191 HA LEU 22 HA LEU 22 7.947 -3.942 9.452 192 HB2 LEU 22 HB2 LEU 22 5.534 -2.332 8.505 193 HB3 LEU 22 HB3 LEU 22 6.219 -2.126 10.112 194 HG LEU 22 HG LEU 22 7.930 -1.857 7.633 195 HD11 LEU 22 HD11 LEU 22 6.054 -0.257 7.436 196 HD12 LEU 22 HD12 LEU 22 6.419 0.368 9.059 197 HD13 LEU 22 HD13 LEU 22 7.588 0.571 7.732 198 HD21 LEU 22 HD21 LEU 22 9.146 -2.087 9.770 199 HD22 LEU 22 HD22 LEU 22 9.338 -0.465 9.094 200 HD23 LEU 22 HD23 LEU 22 8.216 -0.732 10.446 201 H ILE 23 H ILE 23 4.518 -4.665 8.638 202 HA ILE 23 HA ILE 23 3.752 -5.441 11.256 203 HB ILE 23 HB ILE 23 2.722 -6.036 8.481 204 HG12 ILE 23 HG12 ILE 23 2.202 -3.820 9.254 205 HG13 ILE 23 HG13 ILE 23 0.738 -4.772 9.303 206 HG21 ILE 23 HG21 ILE 23 1.516 -7.204 11.009 207 HG22 ILE 23 HG22 ILE 23 0.722 -7.094 9.404 208 HG23 ILE 23 HG23 ILE 23 2.153 -8.088 9.597 209 HD11 ILE 23 HD11 ILE 23 2.421 -3.746 11.610 210 HD12 ILE 23 HD12 ILE 23 0.719 -3.431 11.252 211 HD13 ILE 23 HD13 ILE 23 1.211 -5.020 11.856 212 H ARG 24 H ARG 24 5.075 -7.591 8.672 213 HA ARG 24 HA ARG 24 5.034 -9.882 10.437 214 HB2 ARG 24 HB2 ARG 24 5.313 -9.707 7.784 215 HB3 ARG 24 HB3 ARG 24 7.033 -9.623 8.167 216 HG2 ARG 24 HG2 ARG 24 6.626 -11.929 7.826 217 HG3 ARG 24 HG3 ARG 24 6.624 -11.772 9.586 218 HD2 ARG 24 HD2 ARG 24 4.002 -11.425 9.242 219 HD3 ARG 24 HD3 ARG 24 4.286 -12.203 7.691 220 HE ARG 24 HE ARG 24 4.134 -13.416 10.294 221 HH11 ARG 24 HH11 ARG 24 5.561 -14.084 7.147 222 HH12 ARG 24 HH12 ARG 24 6.129 -15.645 7.654 223 HH21 ARG 24 HH21 ARG 24 4.970 -15.347 10.880 224 HH22 ARG 24 HH22 ARG 24 5.674 -16.407 9.679 225 H GLU 25 H GLU 25 7.473 -7.319 10.020 226 HA GLU 25 HA GLU 25 9.508 -8.587 11.603 227 HB2 GLU 25 HB2 GLU 25 9.713 -6.490 10.101 228 HB3 GLU 25 HB3 GLU 25 9.008 -5.590 11.417 229 HG2 GLU 25 HG2 GLU 25 11.343 -5.322 11.597 230 HG3 GLU 25 HG3 GLU 25 10.859 -6.364 12.924 231 H GLN 26 H GLN 26 7.001 -6.157 12.574 232 HA GLN 26 HA GLN 26 7.751 -6.392 15.371 233 HB2 GLN 26 HB2 GLN 26 5.926 -4.864 15.824 234 HB3 GLN 26 HB3 GLN 26 6.997 -4.274 14.569 235 HG2 GLN 26 HG2 GLN 26 5.342 -4.149 13.023 236 HG3 GLN 26 HG3 GLN 26 4.695 -5.729 13.440 237 HE21 GLN 26 HE21 GLN 26 1.846 -4.099 14.766 238 HE22 GLN 26 HE22 GLN 26 2.500 -5.451 13.859 239 H HIS 27 H HIS 27 5.452 -8.173 13.431 240 HA HIS 27 HA HIS 27 4.614 -9.729 15.867 241 HB2 HIS 27 HB2 HIS 27 2.822 -8.613 13.659 242 HB3 HIS 27 HB3 HIS 27 2.326 -9.864 14.785 243 HD1 HIS 27 HD1 HIS 27 4.015 -7.666 17.095 244 HD2 HIS 27 HD2 HIS 27 0.385 -7.752 14.926 245 HE1 HIS 27 HE1 HIS 27 2.322 -6.236 18.417 246 HE2 HIS 27 HE2 HIS 27 0.103 -6.327 17.096 247 HA PRO 28 HA PRO 28 6.328 -12.425 12.450 248 HB2 PRO 28 HB2 PRO 28 7.378 -13.865 14.896 249 HB3 PRO 28 HB3 PRO 28 8.151 -13.640 13.296 250 HG2 PRO 28 HG2 PRO 28 8.882 -12.082 15.367 251 HG3 PRO 28 HG3 PRO 28 8.585 -11.324 13.766 252 HD2 PRO 28 HD2 PRO 28 6.719 -11.472 16.153 253 HD3 PRO 28 HD3 PRO 28 7.144 -10.069 15.124 254 H THR 29 H THR 29 4.671 -13.461 15.469 255 HA THR 29 HA THR 29 3.723 -15.943 14.351 256 HB THR 29 HB THR 29 2.653 -16.414 16.319 257 HG1 THR 29 HG1 THR 29 1.968 -14.913 17.761 258 HG21 THR 29 HG21 THR 29 4.163 -15.926 18.127 259 HG22 THR 29 HG22 THR 29 5.147 -16.114 16.666 260 HG23 THR 29 HG23 THR 29 4.803 -14.489 17.313 261 H LYS 30 H LYS 30 2.613 -12.840 13.702 262 HA LYS 30 HA LYS 30 -0.130 -13.799 13.045 263 HB2 LYS 30 HB2 LYS 30 1.081 -11.023 13.167 264 HB3 LYS 30 HB3 LYS 30 -0.404 -11.345 12.299 265 HG2 LYS 30 HG2 LYS 30 -0.911 -10.492 14.489 266 HG3 LYS 30 HG3 LYS 30 -1.542 -12.123 14.299 267 HD2 LYS 30 HD2 LYS 30 0.156 -13.051 15.738 268 HD3 LYS 30 HD3 LYS 30 1.073 -11.533 15.746 269 HE2 LYS 30 HE2 LYS 30 -0.946 -10.414 16.820 270 HE3 LYS 30 HE3 LYS 30 -1.704 -11.997 16.941 271 HZ1 LYS 30 HZ1 LYS 30 -0.548 -11.443 19.015 272 HZ2 LYS 30 HZ2 LYS 30 0.267 -12.694 18.334 273 HZ3 LYS 30 HZ3 LYS 30 0.869 -11.176 18.255 274 H ILE 31 H ILE 31 -1.002 -13.491 11.052 275 HA ILE 31 HA ILE 31 0.829 -13.763 8.720 276 HB ILE 31 HB ILE 31 -1.831 -15.087 9.373 277 HG12 ILE 31 HG12 ILE 31 -0.013 -16.049 10.693 278 HG13 ILE 31 HG13 ILE 31 -0.604 -17.176 9.490 279 HG21 ILE 31 HG21 ILE 31 -1.380 -16.450 7.320 280 HG22 ILE 31 HG22 ILE 31 -1.792 -14.760 7.001 281 HG23 ILE 31 HG23 ILE 31 -0.096 -15.292 6.897 282 HD11 ILE 31 HD11 ILE 31 1.998 -15.588 9.276 283 HD12 ILE 31 HD12 ILE 31 1.829 -17.298 9.678 284 HD13 ILE 31 HD13 ILE 31 1.380 -16.740 8.062 285 HA PRO 32 HA PRO 32 -1.539 -10.132 7.533 286 HB2 PRO 32 HB2 PRO 32 -0.240 -9.433 5.263 287 HB3 PRO 32 HB3 PRO 32 0.551 -9.371 6.870 288 HG2 PRO 32 HG2 PRO 32 0.736 -11.571 4.769 289 HG3 PRO 32 HG3 PRO 32 2.078 -10.773 5.644 290 HD2 PRO 32 HD2 PRO 32 1.001 -13.154 6.444 291 HD3 PRO 32 HD3 PRO 32 1.645 -11.950 7.605 292 H VAL 33 H VAL 33 -3.561 -10.080 6.698 293 HA VAL 33 HA VAL 33 -4.148 -11.470 4.125 294 HB VAL 33 HB VAL 33 -6.059 -11.425 6.459 295 HG11 VAL 33 HG11 VAL 33 -5.903 -13.173 3.971 296 HG12 VAL 33 HG12 VAL 33 -7.117 -13.297 5.267 297 HG13 VAL 33 HG13 VAL 33 -7.072 -11.863 4.247 298 HG21 VAL 33 HG21 VAL 33 -4.175 -12.696 7.289 299 HG22 VAL 33 HG22 VAL 33 -5.465 -13.813 6.859 300 HG23 VAL 33 HG23 VAL 33 -4.065 -13.618 5.776 301 H ILE 34 H ILE 34 -5.488 -10.467 2.671 302 HA ILE 34 HA ILE 34 -6.724 -7.840 3.473 303 HB ILE 34 HB ILE 34 -5.935 -8.841 0.719 304 HG12 ILE 34 HG12 ILE 34 -4.015 -8.048 1.884 305 HG13 ILE 34 HG13 ILE 34 -4.452 -6.853 0.684 306 HG21 ILE 34 HG21 ILE 34 -7.997 -7.598 0.452 307 HG22 ILE 34 HG22 ILE 34 -7.423 -6.292 1.513 308 HG23 ILE 34 HG23 ILE 34 -6.670 -6.571 -0.069 309 HD11 ILE 34 HD11 ILE 34 -3.743 -5.730 2.692 310 HD12 ILE 34 HD12 ILE 34 -5.498 -5.487 2.566 311 HD13 ILE 34 HD13 ILE 34 -4.820 -6.684 3.704 312 H ILE 35 H ILE 35 -8.884 -7.580 3.271 313 HA ILE 35 HA ILE 35 -10.484 -9.832 2.167 314 HB ILE 35 HB ILE 35 -10.698 -10.144 4.474 315 HG12 ILE 35 HG12 ILE 35 -13.198 -8.630 3.560 316 HG13 ILE 35 HG13 ILE 35 -12.738 -10.239 2.978 317 HG21 ILE 35 HG21 ILE 35 -9.977 -7.953 5.359 318 HG22 ILE 35 HG22 ILE 35 -11.504 -7.214 4.798 319 HG23 ILE 35 HG23 ILE 35 -11.512 -8.438 6.061 320 HD11 ILE 35 HD11 ILE 35 -12.761 -11.052 5.380 321 HD12 ILE 35 HD12 ILE 35 -13.493 -9.498 5.833 322 HD13 ILE 35 HD13 ILE 35 -14.336 -10.569 4.709 323 H GLU 36 H GLU 36 -11.516 -9.173 0.419 324 HA GLU 36 HA GLU 36 -12.384 -6.297 0.217 325 HB2 GLU 36 HB2 GLU 36 -10.192 -6.577 -0.794 326 HB3 GLU 36 HB3 GLU 36 -10.773 -7.943 -1.762 327 HG2 GLU 36 HG2 GLU 36 -12.326 -6.460 -2.964 328 HG3 GLU 36 HG3 GLU 36 -11.808 -5.089 -1.972 329 H ARG 37 H ARG 37 -14.378 -6.008 -0.316 330 HA ARG 37 HA ARG 37 -16.254 -8.010 -1.093 331 HB2 ARG 37 HB2 ARG 37 -16.662 -5.828 0.005 332 HB3 ARG 37 HB3 ARG 37 -16.267 -4.981 -1.484 333 HG2 ARG 37 HG2 ARG 37 -18.246 -5.767 -2.563 334 HG3 ARG 37 HG3 ARG 37 -18.563 -6.966 -1.299 335 HD2 ARG 37 HD2 ARG 37 -20.034 -4.950 -1.159 336 HD3 ARG 37 HD3 ARG 37 -19.146 -5.276 0.312 337 HE ARG 37 HE ARG 37 -18.780 -3.010 -1.569 338 HH11 ARG 37 HH11 ARG 37 -17.542 -4.422 1.453 339 HH12 ARG 37 HH12 ARG 37 -16.644 -2.972 1.800 340 HH21 ARG 37 HH21 ARG 37 -17.555 -1.257 -1.023 341 HH22 ARG 37 HH22 ARG 37 -16.624 -1.247 0.436 342 H TYR 38 H TYR 38 -16.891 -8.824 -3.041 343 HA TYR 38 HA TYR 38 -15.095 -8.821 -5.102 344 HB2 TYR 38 HB2 TYR 38 -16.346 -10.708 -4.925 345 HB3 TYR 38 HB3 TYR 38 -17.864 -9.841 -4.885 346 HD1 TYR 38 HD1 TYR 38 -19.246 -9.898 -6.748 347 HD2 TYR 38 HD2 TYR 38 -15.010 -10.566 -7.261 348 HE1 TYR 38 HE1 TYR 38 -19.604 -10.337 -9.169 349 HE2 TYR 38 HE2 TYR 38 -15.369 -10.939 -9.689 350 HH TYR 38 HH TYR 38 -18.627 -10.912 -11.185 351 H LYS 39 H LYS 39 -14.704 -8.141 -7.125 352 HA LYS 39 HA LYS 39 -15.115 -5.395 -7.606 353 HB2 LYS 39 HB2 LYS 39 -14.244 -7.651 -9.459 354 HB3 LYS 39 HB3 LYS 39 -14.250 -5.970 -9.959 355 HG2 LYS 39 HG2 LYS 39 -12.600 -7.099 -7.658 356 HG3 LYS 39 HG3 LYS 39 -12.039 -6.749 -9.295 357 HD2 LYS 39 HD2 LYS 39 -12.936 -4.311 -8.809 358 HD3 LYS 39 HD3 LYS 39 -12.823 -4.797 -7.113 359 HE2 LYS 39 HE2 LYS 39 -10.564 -4.828 -9.180 360 HE3 LYS 39 HE3 LYS 39 -10.810 -3.586 -7.952 361 HZ1 LYS 39 HZ1 LYS 39 -10.429 -5.266 -6.222 362 HZ2 LYS 39 HZ2 LYS 39 -10.190 -6.440 -7.357 363 HZ3 LYS 39 HZ3 LYS 39 -9.148 -5.191 -7.235 364 H GLY 40 H GLY 40 -16.695 -8.076 -9.350 365 HA2 GLY 40 HA2 GLY 40 -18.138 -6.328 -11.126 366 HA3 GLY 40 HA3 GLY 40 -18.328 -8.071 -10.974 367 H GLU 41 H GLU 41 -19.004 -7.637 -7.980 368 HA GLU 41 HA GLU 41 -21.578 -6.229 -8.082 369 HB2 GLU 41 HB2 GLU 41 -22.229 -8.392 -8.996 370 HB3 GLU 41 HB3 GLU 41 -21.387 -9.231 -7.702 371 HG2 GLU 41 HG2 GLU 41 -23.660 -9.400 -7.188 372 HG3 GLU 41 HG3 GLU 41 -22.995 -8.251 -6.048 373 H LYS 42 H LYS 42 -21.801 -5.144 -6.290 374 HA LYS 42 HA LYS 42 -20.335 -5.946 -3.811 375 HB2 LYS 42 HB2 LYS 42 -21.125 -3.195 -4.849 376 HB3 LYS 42 HB3 LYS 42 -20.288 -3.515 -3.328 377 HG2 LYS 42 HG2 LYS 42 -18.416 -4.593 -4.622 378 HG3 LYS 42 HG3 LYS 42 -19.229 -4.131 -6.123 379 HD2 LYS 42 HD2 LYS 42 -19.033 -1.722 -5.450 380 HD3 LYS 42 HD3 LYS 42 -18.212 -2.224 -3.975 381 HE2 LYS 42 HE2 LYS 42 -16.499 -1.521 -5.446 382 HE3 LYS 42 HE3 LYS 42 -16.385 -3.272 -5.370 383 HZ1 LYS 42 HZ1 LYS 42 -17.503 -3.393 -7.558 384 HZ2 LYS 42 HZ2 LYS 42 -17.753 -1.771 -7.572 385 HZ3 LYS 42 HZ3 LYS 42 -16.242 -2.362 -7.675 386 H GLN 43 H GLN 43 -22.593 -7.271 -4.095 387 HA GLN 43 HA GLN 43 -24.993 -5.929 -3.290 388 HB2 GLN 43 HB2 GLN 43 -24.723 -8.013 -4.684 389 HB3 GLN 43 HB3 GLN 43 -24.418 -8.923 -3.207 390 HG2 GLN 43 HG2 GLN 43 -26.659 -8.277 -2.366 391 HG3 GLN 43 HG3 GLN 43 -26.910 -7.280 -3.812 392 HE21 GLN 43 HE21 GLN 43 -27.257 -10.265 -5.959 393 HE22 GLN 43 HE22 GLN 43 -26.451 -8.694 -6.002 394 H LEU 44 H LEU 44 -22.746 -7.997 -1.406 395 HA LEU 44 HA LEU 44 -24.406 -8.040 0.957 396 HB2 LEU 44 HB2 LEU 44 -21.511 -8.770 0.383 397 HB3 LEU 44 HB3 LEU 44 -22.162 -8.871 2.010 398 HG LEU 44 HG LEU 44 -23.241 -10.424 -0.381 399 HD11 LEU 44 HD11 LEU 44 -20.983 -11.129 0.391 400 HD12 LEU 44 HD12 LEU 44 -21.625 -11.289 2.047 401 HD13 LEU 44 HD13 LEU 44 -22.214 -12.352 0.751 402 HD21 LEU 44 HD21 LEU 44 -24.459 -11.740 1.362 403 HD22 LEU 44 HD22 LEU 44 -23.952 -10.566 2.594 404 HD23 LEU 44 HD23 LEU 44 -25.042 -10.081 1.275 405 HA PRO 45 HA PRO 45 -23.647 -4.422 3.298 406 HB2 PRO 45 HB2 PRO 45 -22.491 -6.303 5.375 407 HB3 PRO 45 HB3 PRO 45 -23.527 -4.855 5.623 408 HG2 PRO 45 HG2 PRO 45 -24.683 -7.298 5.552 409 HG3 PRO 45 HG3 PRO 45 -25.420 -5.954 4.622 410 HD2 PRO 45 HD2 PRO 45 -23.719 -8.218 3.598 411 HD3 PRO 45 HD3 PRO 45 -25.146 -7.438 2.870 412 H VAL 46 H VAL 46 -22.222 -2.857 3.583 413 HA VAL 46 HA VAL 46 -19.485 -3.339 2.657 414 HB VAL 46 HB VAL 46 -19.592 -1.176 1.728 415 HG11 VAL 46 HG11 VAL 46 -21.353 -1.369 0.135 416 HG12 VAL 46 HG12 VAL 46 -20.846 -3.014 0.553 417 HG13 VAL 46 HG13 VAL 46 -22.346 -2.347 1.223 418 HG21 VAL 46 HG21 VAL 46 -20.760 0.162 3.447 419 HG22 VAL 46 HG22 VAL 46 -21.569 0.323 1.893 420 HG23 VAL 46 HG23 VAL 46 -22.262 -0.725 3.136 421 H LEU 47 H LEU 47 -19.804 -3.799 5.409 422 HA LEU 47 HA LEU 47 -19.275 -1.627 7.115 423 HB2 LEU 47 HB2 LEU 47 -18.641 -4.587 7.329 424 HB3 LEU 47 HB3 LEU 47 -18.188 -3.481 8.606 425 HG LEU 47 HG LEU 47 -20.208 -4.641 9.172 426 HD11 LEU 47 HD11 LEU 47 -20.896 -1.725 8.650 427 HD12 LEU 47 HD12 LEU 47 -21.607 -2.807 9.856 428 HD13 LEU 47 HD13 LEU 47 -19.908 -2.327 10.005 429 HD21 LEU 47 HD21 LEU 47 -21.632 -3.277 6.862 430 HD22 LEU 47 HD22 LEU 47 -21.086 -4.983 6.870 431 HD23 LEU 47 HD23 LEU 47 -22.298 -4.424 8.033 432 H ASP 48 H ASP 48 -17.476 -0.951 8.273 433 HA ASP 48 HA ASP 48 -15.368 -0.299 6.474 434 HB2 ASP 48 HB2 ASP 48 -14.680 1.342 8.252 435 HB3 ASP 48 HB3 ASP 48 -16.261 1.497 7.532 436 H LYS 49 H LYS 49 -14.789 -2.803 6.673 437 HA LYS 49 HA LYS 49 -12.062 -2.698 7.844 438 HB2 LYS 49 HB2 LYS 49 -13.935 -5.078 8.230 439 HB3 LYS 49 HB3 LYS 49 -12.190 -5.130 8.439 440 HG2 LYS 49 HG2 LYS 49 -12.750 -4.794 10.589 441 HG3 LYS 49 HG3 LYS 49 -12.557 -3.120 10.093 442 HD2 LYS 49 HD2 LYS 49 -15.175 -3.179 9.705 443 HD3 LYS 49 HD3 LYS 49 -15.117 -4.725 10.542 444 HE2 LYS 49 HE2 LYS 49 -15.638 -3.199 12.246 445 HE3 LYS 49 HE3 LYS 49 -13.911 -3.494 12.464 446 HZ1 LYS 49 HZ1 LYS 49 -13.543 -1.360 11.179 447 HZ2 LYS 49 HZ2 LYS 49 -15.163 -1.118 11.137 448 HZ3 LYS 49 HZ3 LYS 49 -14.384 -1.114 12.572 449 H THR 50 H THR 50 -10.499 -3.615 6.732 450 HA THR 50 HA THR 50 -11.096 -4.953 4.158 451 HB THR 50 HB THR 50 -9.082 -2.796 3.916 452 HG1 THR 50 HG1 THR 50 -10.825 -1.319 3.426 453 HG21 THR 50 HG21 THR 50 -10.111 -2.558 1.689 454 HG22 THR 50 HG22 THR 50 -9.650 -4.242 1.984 455 HG23 THR 50 HG23 THR 50 -11.356 -3.754 2.125 456 H LYS 51 H LYS 51 -9.076 -5.052 6.853 457 HA LYS 51 HA LYS 51 -7.322 -7.027 5.535 458 HB2 LYS 51 HB2 LYS 51 -5.233 -5.823 6.034 459 HB3 LYS 51 HB3 LYS 51 -6.258 -4.946 4.900 460 HG2 LYS 51 HG2 LYS 51 -7.123 -3.665 7.047 461 HG3 LYS 51 HG3 LYS 51 -5.652 -4.271 7.792 462 HD2 LYS 51 HD2 LYS 51 -5.810 -2.587 5.238 463 HD3 LYS 51 HD3 LYS 51 -5.496 -1.989 6.860 464 HE2 LYS 51 HE2 LYS 51 -3.525 -3.865 6.715 465 HE3 LYS 51 HE3 LYS 51 -3.674 -3.473 4.988 466 HZ1 LYS 51 HZ1 LYS 51 -3.223 -1.562 7.227 467 HZ2 LYS 51 HZ2 LYS 51 -2.105 -1.917 6.082 468 HZ3 LYS 51 HZ3 LYS 51 -3.469 -1.060 5.708 469 H PHE 52 H PHE 52 -6.248 -8.367 6.895 470 HA PHE 52 HA PHE 52 -6.715 -8.109 9.779 471 HB2 PHE 52 HB2 PHE 52 -7.785 -10.355 8.126 472 HB3 PHE 52 HB3 PHE 52 -7.410 -10.566 9.830 473 HD1 PHE 52 HD1 PHE 52 -9.949 -9.512 7.565 474 HD2 PHE 52 HD2 PHE 52 -8.366 -8.775 11.505 475 HE1 PHE 52 HE1 PHE 52 -12.117 -8.501 8.261 476 HE2 PHE 52 HE2 PHE 52 -10.528 -7.801 12.189 477 HZ PHE 52 HZ PHE 52 -12.403 -7.646 10.575 478 H LEU 53 H LEU 53 -5.277 -8.809 11.186 479 HA LEU 53 HA LEU 53 -2.764 -10.098 10.154 480 HB2 LEU 53 HB2 LEU 53 -3.379 -8.007 12.279 481 HB3 LEU 53 HB3 LEU 53 -1.958 -9.031 12.433 482 HG LEU 53 HG LEU 53 -0.997 -8.239 10.404 483 HD11 LEU 53 HD11 LEU 53 -3.485 -6.541 9.972 484 HD12 LEU 53 HD12 LEU 53 -1.941 -6.317 9.111 485 HD13 LEU 53 HD13 LEU 53 -2.837 -7.812 8.900 486 HD21 LEU 53 HD21 LEU 53 -0.577 -6.890 12.389 487 HD22 LEU 53 HD22 LEU 53 -0.744 -5.808 10.987 488 HD23 LEU 53 HD23 LEU 53 -2.069 -5.970 12.140 489 H VAL 54 H VAL 54 -3.408 -12.201 10.341 490 HA VAL 54 HA VAL 54 -4.921 -13.029 12.725 491 HB VAL 54 HB VAL 54 -4.398 -14.785 10.350 492 HG11 VAL 54 HG11 VAL 54 -5.432 -15.767 12.407 493 HG12 VAL 54 HG12 VAL 54 -6.764 -14.595 12.277 494 HG13 VAL 54 HG13 VAL 54 -6.510 -15.815 11.009 495 HG21 VAL 54 HG21 VAL 54 -6.490 -14.020 9.340 496 HG22 VAL 54 HG22 VAL 54 -6.673 -12.772 10.597 497 HG23 VAL 54 HG23 VAL 54 -5.344 -12.693 9.413 498 HA PRO 55 HA PRO 55 -1.419 -15.147 14.612 499 HB2 PRO 55 HB2 PRO 55 -3.633 -16.675 15.982 500 HB3 PRO 55 HB3 PRO 55 -2.136 -15.985 16.674 501 HG2 PRO 55 HG2 PRO 55 -4.521 -14.726 16.980 502 HG3 PRO 55 HG3 PRO 55 -3.045 -13.776 16.612 503 HD2 PRO 55 HD2 PRO 55 -5.245 -14.654 14.737 504 HD3 PRO 55 HD3 PRO 55 -4.407 -13.071 14.852 505 H ASP 56 H ASP 56 -0.307 -16.895 13.909 506 HA ASP 56 HA ASP 56 -1.035 -18.192 11.637 507 HB2 ASP 56 HB2 ASP 56 0.915 -19.733 12.070 508 HB3 ASP 56 HB3 ASP 56 1.208 -17.998 12.108 509 H HIS 57 H HIS 57 -1.798 -19.501 14.773 510 HA HIS 57 HA HIS 57 -2.518 -22.156 13.772 511 HB2 HIS 57 HB2 HIS 57 -2.682 -20.797 16.484 512 HB3 HIS 57 HB3 HIS 57 -3.399 -22.372 16.196 513 HD1 HIS 57 HD1 HIS 57 0.188 -20.855 15.664 514 HD2 HIS 57 HD2 HIS 57 -1.915 -24.332 16.864 515 HE1 HIS 57 HE1 HIS 57 1.959 -22.566 16.411 516 HE2 HIS 57 HE2 HIS 57 0.675 -24.679 17.137 517 H VAL 58 H VAL 58 -4.298 -19.226 13.705 518 HA VAL 58 HA VAL 58 -6.970 -20.216 14.308 519 HB VAL 58 HB VAL 58 -5.998 -17.886 12.636 520 HG11 VAL 58 HG11 VAL 58 -8.833 -18.482 13.557 521 HG12 VAL 58 HG12 VAL 58 -8.289 -16.945 12.867 522 HG13 VAL 58 HG13 VAL 58 -8.265 -18.398 11.870 523 HG21 VAL 58 HG21 VAL 58 -6.708 -16.544 14.602 524 HG22 VAL 58 HG22 VAL 58 -7.190 -18.031 15.447 525 HG23 VAL 58 HG23 VAL 58 -5.484 -17.730 15.061 526 H ASN 59 H ASN 59 -8.322 -21.476 13.013 527 HA ASN 59 HA ASN 59 -7.389 -22.197 10.286 528 HB2 ASN 59 HB2 ASN 59 -9.002 -23.987 10.384 529 HB3 ASN 59 HB3 ASN 59 -8.026 -23.994 11.842 530 HD21 ASN 59 HD21 ASN 59 -10.935 -23.921 13.848 531 HD22 ASN 59 HD22 ASN 59 -9.233 -24.328 13.717 532 H MET 60 H MET 60 -9.062 -22.353 8.504 533 HA MET 60 HA MET 60 -10.032 -19.748 7.950 534 HB2 MET 60 HB2 MET 60 -10.567 -22.442 6.672 535 HB3 MET 60 HB3 MET 60 -11.305 -20.973 6.052 536 HG2 MET 60 HG2 MET 60 -8.316 -21.459 6.336 537 HG3 MET 60 HG3 MET 60 -9.242 -21.542 4.841 538 HE1 MET 60 HE1 MET 60 -11.208 -18.904 5.082 539 HE2 MET 60 HE2 MET 60 -10.192 -17.811 4.131 540 HE3 MET 60 HE3 MET 60 -10.360 -19.505 3.635 541 H SER 61 H SER 61 -11.927 -22.519 9.245 542 HA SER 61 HA SER 61 -14.483 -21.179 9.029 543 HB2 SER 61 HB2 SER 61 -14.247 -23.610 9.305 544 HB3 SER 61 HB3 SER 61 -13.569 -23.374 10.928 545 HG SER 61 HG SER 61 -15.852 -23.836 10.933 546 H GLU 62 H GLU 62 -12.056 -21.315 11.668 547 HA GLU 62 HA GLU 62 -13.531 -19.665 13.494 548 HB2 GLU 62 HB2 GLU 62 -11.654 -21.170 14.126 549 HB3 GLU 62 HB3 GLU 62 -10.539 -20.119 13.268 550 HG2 GLU 62 HG2 GLU 62 -10.359 -19.629 15.583 551 HG3 GLU 62 HG3 GLU 62 -11.125 -18.249 14.818 552 H LEU 63 H LEU 63 -11.071 -18.796 11.017 553 HA LEU 63 HA LEU 63 -11.138 -15.971 11.415 554 HB2 LEU 63 HB2 LEU 63 -9.472 -17.151 9.986 555 HB3 LEU 63 HB3 LEU 63 -10.751 -17.608 8.871 556 HG LEU 63 HG LEU 63 -11.147 -15.148 8.387 557 HD11 LEU 63 HD11 LEU 63 -9.297 -13.588 8.966 558 HD12 LEU 63 HD12 LEU 63 -10.114 -14.182 10.421 559 HD13 LEU 63 HD13 LEU 63 -8.552 -14.871 9.962 560 HD21 LEU 63 HD21 LEU 63 -8.345 -16.192 7.829 561 HD22 LEU 63 HD22 LEU 63 -9.800 -16.571 6.877 562 HD23 LEU 63 HD23 LEU 63 -9.192 -14.916 6.919 563 H ILE 64 H ILE 64 -13.213 -18.042 9.343 564 HA ILE 64 HA ILE 64 -14.875 -15.971 8.299 565 HB ILE 64 HB ILE 64 -15.195 -18.949 8.691 566 HG12 ILE 64 HG12 ILE 64 -15.152 -17.279 6.147 567 HG13 ILE 64 HG13 ILE 64 -13.676 -17.809 6.950 568 HG21 ILE 64 HG21 ILE 64 -17.265 -18.916 7.335 569 HG22 ILE 64 HG22 ILE 64 -17.501 -18.163 8.896 570 HG23 ILE 64 HG23 ILE 64 -17.313 -17.138 7.449 571 HD11 ILE 64 HD11 ILE 64 -14.176 -19.334 5.159 572 HD12 ILE 64 HD12 ILE 64 -14.361 -20.182 6.709 573 HD13 ILE 64 HD13 ILE 64 -15.795 -19.649 5.807 574 H LYS 65 H LYS 65 -15.234 -17.785 11.378 575 HA LYS 65 HA LYS 65 -17.726 -16.588 12.146 576 HB2 LYS 65 HB2 LYS 65 -15.436 -17.734 13.772 577 HB3 LYS 65 HB3 LYS 65 -16.917 -17.119 14.512 578 HG2 LYS 65 HG2 LYS 65 -18.282 -18.770 13.513 579 HG3 LYS 65 HG3 LYS 65 -17.070 -19.200 12.307 580 HD2 LYS 65 HD2 LYS 65 -17.215 -20.954 13.992 581 HD3 LYS 65 HD3 LYS 65 -15.628 -20.188 14.015 582 HE2 LYS 65 HE2 LYS 65 -16.512 -18.730 15.959 583 HE3 LYS 65 HE3 LYS 65 -17.914 -19.811 16.000 584 HZ1 LYS 65 HZ1 LYS 65 -15.057 -20.605 16.374 585 HZ2 LYS 65 HZ2 LYS 65 -16.192 -20.543 17.557 586 HZ3 LYS 65 HZ3 LYS 65 -16.314 -21.670 16.381 587 H ILE 66 H ILE 66 -14.397 -15.416 12.972 588 HA ILE 66 HA ILE 66 -15.501 -13.037 14.239 589 HB ILE 66 HB ILE 66 -13.448 -13.707 15.037 590 HG12 ILE 66 HG12 ILE 66 -13.784 -11.224 14.886 591 HG13 ILE 66 HG13 ILE 66 -12.150 -11.791 15.109 592 HG21 ILE 66 HG21 ILE 66 -12.435 -14.979 13.301 593 HG22 ILE 66 HG22 ILE 66 -12.249 -13.553 12.258 594 HG23 ILE 66 HG23 ILE 66 -11.314 -13.718 13.762 595 HD11 ILE 66 HD11 ILE 66 -11.704 -11.370 12.645 596 HD12 ILE 66 HD12 ILE 66 -13.261 -10.520 12.594 597 HD13 ILE 66 HD13 ILE 66 -11.983 -9.953 13.660 598 H ILE 67 H ILE 67 -14.297 -13.592 10.917 599 HA ILE 67 HA ILE 67 -14.696 -10.869 10.052 600 HB ILE 67 HB ILE 67 -14.282 -13.519 8.722 601 HG12 ILE 67 HG12 ILE 67 -12.441 -12.418 7.639 602 HG13 ILE 67 HG13 ILE 67 -13.021 -10.820 8.090 603 HG21 ILE 67 HG21 ILE 67 -14.533 -12.548 6.478 604 HG22 ILE 67 HG22 ILE 67 -16.076 -12.704 7.317 605 HG23 ILE 67 HG23 ILE 67 -15.292 -11.105 7.178 606 HD11 ILE 67 HD11 ILE 67 -11.993 -12.847 10.104 607 HD12 ILE 67 HD12 ILE 67 -11.003 -11.594 9.353 608 HD13 ILE 67 HD13 ILE 67 -12.354 -11.126 10.389 609 H ARG 68 H ARG 68 -17.021 -13.648 9.979 610 HA ARG 68 HA ARG 68 -19.229 -12.146 8.934 611 HB2 ARG 68 HB2 ARG 68 -19.033 -14.593 10.737 612 HB3 ARG 68 HB3 ARG 68 -20.582 -13.807 10.467 613 HG2 ARG 68 HG2 ARG 68 -20.285 -14.077 7.990 614 HG3 ARG 68 HG3 ARG 68 -18.823 -15.023 8.292 615 HD2 ARG 68 HD2 ARG 68 -20.075 -16.721 9.468 616 HD3 ARG 68 HD3 ARG 68 -21.503 -15.711 9.594 617 HE ARG 68 HE ARG 68 -20.627 -17.287 7.274 618 HH11 ARG 68 HH11 ARG 68 -22.916 -14.807 8.340 619 HH12 ARG 68 HH12 ARG 68 -24.052 -15.229 7.085 620 HH21 ARG 68 HH21 ARG 68 -22.183 -17.724 5.700 621 HH22 ARG 68 HH22 ARG 68 -23.605 -16.700 5.608 622 H ARG 69 H ARG 69 -18.222 -12.520 12.353 623 HA ARG 69 HA ARG 69 -20.288 -10.823 13.375 624 HB2 ARG 69 HB2 ARG 69 -19.076 -12.404 14.777 625 HB3 ARG 69 HB3 ARG 69 -17.552 -11.572 14.504 626 HG2 ARG 69 HG2 ARG 69 -18.439 -11.082 16.731 627 HG3 ARG 69 HG3 ARG 69 -18.324 -9.616 15.765 628 HD2 ARG 69 HD2 ARG 69 -20.852 -9.923 15.260 629 HD3 ARG 69 HD3 ARG 69 -20.826 -11.208 16.453 630 HE ARG 69 HE ARG 69 -20.594 -9.649 18.170 631 HH11 ARG 69 HH11 ARG 69 -20.301 -7.856 15.120 632 HH12 ARG 69 HH12 ARG 69 -20.628 -6.346 15.923 633 HH21 ARG 69 HH21 ARG 69 -20.946 -7.672 19.071 634 HH22 ARG 69 HH22 ARG 69 -20.966 -6.240 18.087 635 H ARG 70 H ARG 70 -17.048 -9.935 12.193 636 HA ARG 70 HA ARG 70 -17.366 -7.078 12.857 637 HB2 ARG 70 HB2 ARG 70 -15.299 -8.777 11.476 638 HB3 ARG 70 HB3 ARG 70 -15.392 -7.099 10.976 639 HG2 ARG 70 HG2 ARG 70 -13.792 -7.217 12.723 640 HG3 ARG 70 HG3 ARG 70 -15.188 -6.345 13.326 641 HD2 ARG 70 HD2 ARG 70 -15.583 -9.106 14.016 642 HD3 ARG 70 HD3 ARG 70 -13.902 -8.749 14.340 643 HE ARG 70 HE ARG 70 -16.283 -7.503 15.633 644 HH11 ARG 70 HH11 ARG 70 -12.742 -7.375 15.519 645 HH12 ARG 70 HH12 ARG 70 -12.716 -7.010 17.251 646 HH21 ARG 70 HH21 ARG 70 -15.961 -6.799 17.789 647 HH22 ARG 70 HH22 ARG 70 -14.295 -6.621 18.339 648 H LEU 71 H LEU 71 -18.002 -8.970 9.926 649 HA LEU 71 HA LEU 71 -18.949 -6.589 8.470 650 HB2 LEU 71 HB2 LEU 71 -18.970 -9.546 7.774 651 HB3 LEU 71 HB3 LEU 71 -19.511 -8.255 6.700 652 HG LEU 71 HG LEU 71 -16.656 -8.661 7.676 653 HD11 LEU 71 HD11 LEU 71 -17.447 -10.294 5.985 654 HD12 LEU 71 HD12 LEU 71 -17.969 -8.957 4.935 655 HD13 LEU 71 HD13 LEU 71 -16.248 -9.179 5.299 656 HD21 LEU 71 HD21 LEU 71 -17.873 -6.545 5.840 657 HD22 LEU 71 HD22 LEU 71 -17.000 -6.273 7.371 658 HD23 LEU 71 HD23 LEU 71 -16.133 -6.892 5.964 659 H GLN 72 H GLN 72 -20.386 -8.247 10.935 660 HA GLN 72 HA GLN 72 -22.446 -8.549 11.718 661 HB2 GLN 72 HB2 GLN 72 -22.309 -6.028 11.254 662 HB3 GLN 72 HB3 GLN 72 -23.409 -6.319 9.901 663 HG2 GLN 72 HG2 GLN 72 -25.092 -7.251 11.502 664 HG3 GLN 72 HG3 GLN 72 -23.942 -7.044 12.823 665 HE21 GLN 72 HE21 GLN 72 -26.143 -4.138 13.144 666 HE22 GLN 72 HE22 GLN 72 -26.164 -5.865 13.466 667 H LEU 73 H LEU 73 -21.742 -10.309 9.671 668 HA LEU 73 HA LEU 73 -24.192 -10.787 8.025 669 HB2 LEU 73 HB2 LEU 73 -21.462 -12.113 7.924 670 HB3 LEU 73 HB3 LEU 73 -22.795 -12.379 6.795 671 HG LEU 73 HG LEU 73 -21.236 -9.803 7.185 672 HD11 LEU 73 HD11 LEU 73 -20.356 -10.264 4.947 673 HD12 LEU 73 HD12 LEU 73 -19.986 -11.605 6.041 674 HD13 LEU 73 HD13 LEU 73 -21.315 -11.758 4.870 675 HD21 LEU 73 HD21 LEU 73 -23.527 -9.255 6.492 676 HD22 LEU 73 HD22 LEU 73 -22.384 -8.997 5.175 677 HD23 LEU 73 HD23 LEU 73 -23.423 -10.445 5.166 678 H ASN 74 H ASN 74 -25.591 -11.490 9.637 679 HA ASN 74 HA ASN 74 -25.120 -13.771 11.341 680 HB2 ASN 74 HB2 ASN 74 -26.868 -11.912 11.567 681 HB3 ASN 74 HB3 ASN 74 -27.768 -12.678 10.256 682 HD21 ASN 74 HD21 ASN 74 -29.424 -14.005 13.187 683 HD22 ASN 74 HD22 ASN 74 -29.424 -12.607 12.121 684 H ALA 75 H ALA 75 -26.449 -15.857 11.091 685 HA ALA 75 HA ALA 75 -25.552 -17.315 8.857 686 HB1 ALA 75 HB1 ALA 75 -26.106 -18.259 11.062 687 HB2 ALA 75 HB2 ALA 75 -27.834 -17.938 10.786 688 HB3 ALA 75 HB3 ALA 75 -26.969 -19.114 9.773 689 H ASN 76 H ASN 76 -28.546 -15.497 9.142 690 HA ASN 76 HA ASN 76 -30.030 -16.476 6.937 691 HB2 ASN 76 HB2 ASN 76 -31.023 -14.946 8.484 692 HB3 ASN 76 HB3 ASN 76 -29.728 -13.768 8.294 693 HD21 ASN 76 HD21 ASN 76 -32.870 -13.603 5.752 694 HD22 ASN 76 HD22 ASN 76 -32.761 -14.891 6.946 695 H GLN 77 H GLN 77 -27.179 -14.317 6.941 696 HA GLN 77 HA GLN 77 -27.485 -13.655 4.090 697 HB2 GLN 77 HB2 GLN 77 -25.317 -12.994 6.120 698 HB3 GLN 77 HB3 GLN 77 -25.318 -12.448 4.446 699 HG2 GLN 77 HG2 GLN 77 -27.478 -11.763 6.498 700 HG3 GLN 77 HG3 GLN 77 -26.137 -10.727 6.030 701 HE21 GLN 77 HE21 GLN 77 -29.392 -10.852 3.603 702 HE22 GLN 77 HE22 GLN 77 -29.376 -11.781 5.094 703 H ALA 78 H ALA 78 -26.841 -14.932 2.506 704 HA ALA 78 HA ALA 78 -24.982 -17.146 2.803 705 HB1 ALA 78 HB1 ALA 78 -26.808 -17.185 1.147 706 HB2 ALA 78 HB2 ALA 78 -26.123 -15.764 0.330 707 HB3 ALA 78 HB3 ALA 78 -25.231 -17.302 0.342 708 H PHE 79 H PHE 79 -22.796 -17.056 2.720 709 HA PHE 79 HA PHE 79 -21.356 -14.885 1.442 710 HB2 PHE 79 HB2 PHE 79 -21.801 -13.596 3.265 711 HB3 PHE 79 HB3 PHE 79 -21.734 -14.938 4.390 712 HD1 PHE 79 HD1 PHE 79 -19.579 -15.871 5.199 713 HD2 PHE 79 HD2 PHE 79 -19.765 -12.335 2.739 714 HE1 PHE 79 HE1 PHE 79 -17.273 -15.260 5.886 715 HE2 PHE 79 HE2 PHE 79 -17.508 -11.675 3.521 716 HZ PHE 79 HZ PHE 79 -16.238 -13.171 5.026 717 H PHE 80 H PHE 80 -19.304 -15.195 0.898 718 HA PHE 80 HA PHE 80 -17.922 -17.651 1.864 719 HB2 PHE 80 HB2 PHE 80 -18.364 -16.814 -1.020 720 HB3 PHE 80 HB3 PHE 80 -17.267 -18.087 -0.505 721 HD1 PHE 80 HD1 PHE 80 -20.822 -17.123 -0.838 722 HD2 PHE 80 HD2 PHE 80 -18.068 -20.295 0.114 723 HE1 PHE 80 HE1 PHE 80 -22.673 -18.775 -0.993 724 HE2 PHE 80 HE2 PHE 80 -19.919 -21.949 -0.027 725 HZ PHE 80 HZ PHE 80 -22.219 -21.191 -0.583 726 H LEU 81 H LEU 81 -15.767 -17.487 2.201 727 HA LEU 81 HA LEU 81 -14.341 -15.009 1.331 728 HB2 LEU 81 HB2 LEU 81 -13.603 -17.217 3.310 729 HB3 LEU 81 HB3 LEU 81 -12.436 -16.049 2.694 730 HG LEU 81 HG LEU 81 -14.871 -15.414 4.394 731 HD11 LEU 81 HD11 LEU 81 -12.750 -16.368 5.461 732 HD12 LEU 81 HD12 LEU 81 -11.904 -14.922 4.900 733 HD13 LEU 81 HD13 LEU 81 -13.243 -14.769 6.056 734 HD21 LEU 81 HD21 LEU 81 -12.869 -13.561 3.013 735 HD22 LEU 81 HD22 LEU 81 -14.653 -13.539 2.884 736 HD23 LEU 81 HD23 LEU 81 -13.864 -13.064 4.386 737 H LEU 82 H LEU 82 -13.548 -15.051 -0.541 738 HA LEU 82 HA LEU 82 -12.884 -17.566 -1.943 739 HB2 LEU 82 HB2 LEU 82 -13.199 -14.759 -3.067 740 HB3 LEU 82 HB3 LEU 82 -13.159 -16.276 -3.946 741 HG LEU 82 HG LEU 82 -15.396 -15.280 -2.123 742 HD11 LEU 82 HD11 LEU 82 -15.197 -15.810 -5.118 743 HD12 LEU 82 HD12 LEU 82 -16.690 -15.414 -4.258 744 HD13 LEU 82 HD13 LEU 82 -15.372 -14.229 -4.313 745 HD21 LEU 82 HD21 LEU 82 -16.604 -17.324 -2.889 746 HD22 LEU 82 HD22 LEU 82 -15.096 -17.911 -3.627 747 HD23 LEU 82 HD23 LEU 82 -15.234 -17.720 -1.861 748 H VAL 83 H VAL 83 -10.897 -18.045 -1.065 749 HA VAL 83 HA VAL 83 -8.754 -16.087 -0.868 750 HB VAL 83 HB VAL 83 -8.405 -19.079 -0.763 751 HG11 VAL 83 HG11 VAL 83 -6.485 -18.522 0.618 752 HG12 VAL 83 HG12 VAL 83 -6.348 -17.658 -0.910 753 HG13 VAL 83 HG13 VAL 83 -6.877 -16.783 0.545 754 HG21 VAL 83 HG21 VAL 83 -10.137 -18.618 0.874 755 HG22 VAL 83 HG22 VAL 83 -8.608 -18.838 1.729 756 HG23 VAL 83 HG23 VAL 83 -9.260 -17.205 1.481 757 H ASN 84 H ASN 84 -7.458 -15.410 -2.446 758 HA ASN 84 HA ASN 84 -6.890 -14.983 -4.609 759 HB2 ASN 84 HB2 ASN 84 -5.276 -16.764 -3.810 760 HB3 ASN 84 HB3 ASN 84 -6.237 -17.955 -4.684 761 HD21 ASN 84 HD21 ASN 84 -3.592 -17.267 -7.024 762 HD22 ASN 84 HD22 ASN 84 -3.971 -18.224 -5.582 763 H GLY 85 H GLY 85 -9.655 -15.303 -4.316 764 HA2 GLY 85 HA2 GLY 85 -11.355 -14.977 -5.842 765 HA3 GLY 85 HA3 GLY 85 -10.411 -15.741 -7.114 766 H HIS 86 H HIS 86 -10.413 -18.064 -4.692 767 HA HIS 86 HA HIS 86 -13.121 -19.133 -5.420 768 HB2 HIS 86 HB2 HIS 86 -10.496 -20.666 -5.551 769 HB3 HIS 86 HB3 HIS 86 -12.091 -21.387 -5.732 770 HD1 HIS 86 HD1 HIS 86 -9.430 -20.005 -7.867 771 HD2 HIS 86 HD2 HIS 86 -13.653 -19.947 -7.790 772 HE1 HIS 86 HE1 HIS 86 -10.192 -19.281 -10.218 773 HE2 HIS 86 HE2 HIS 86 -12.763 -19.239 -10.180 774 H SER 87 H SER 87 -14.157 -20.538 -3.993 775 HA SER 87 HA SER 87 -13.905 -19.669 -1.309 776 HB2 SER 87 HB2 SER 87 -16.029 -20.354 -2.226 777 HB3 SER 87 HB3 SER 87 -15.439 -22.017 -2.443 778 HG SER 87 HG SER 87 -16.505 -22.041 -0.516 779 H MET 88 H MET 88 -13.131 -20.452 0.541 780 HA MET 88 HA MET 88 -12.060 -23.242 0.661 781 HB2 MET 88 HB2 MET 88 -10.714 -20.784 1.836 782 HB3 MET 88 HB3 MET 88 -10.263 -22.456 2.190 783 HG2 MET 88 HG2 MET 88 -9.899 -22.802 -0.283 784 HG3 MET 88 HG3 MET 88 -10.060 -21.051 -0.477 785 HE1 MET 88 HE1 MET 88 -7.647 -21.139 -1.685 786 HE2 MET 88 HE2 MET 88 -6.187 -21.802 -0.909 787 HE3 MET 88 HE3 MET 88 -7.521 -22.886 -1.367 788 H VAL 89 H VAL 89 -14.689 -21.990 1.465 789 HA VAL 89 HA VAL 89 -14.752 -21.513 4.281 790 HB VAL 89 HB VAL 89 -16.930 -22.399 2.346 791 HG11 VAL 89 HG11 VAL 89 -18.572 -21.486 3.973 792 HG12 VAL 89 HG12 VAL 89 -17.770 -22.933 4.574 793 HG13 VAL 89 HG13 VAL 89 -17.277 -21.336 5.180 794 HG21 VAL 89 HG21 VAL 89 -15.925 -20.188 1.833 795 HG22 VAL 89 HG22 VAL 89 -17.584 -20.016 2.427 796 HG23 VAL 89 HG23 VAL 89 -16.221 -19.664 3.503 797 H SER 90 H SER 90 -14.928 -24.582 2.517 798 HA SER 90 HA SER 90 -15.763 -26.181 4.796 799 HB2 SER 90 HB2 SER 90 -15.314 -28.063 3.255 800 HB3 SER 90 HB3 SER 90 -16.334 -26.809 2.530 801 HG SER 90 HG SER 90 -14.641 -27.504 1.108 802 H VAL 91 H VAL 91 -12.645 -24.884 4.007 803 HA VAL 91 HA VAL 91 -11.220 -27.294 4.705 804 HB VAL 91 HB VAL 91 -10.563 -25.538 2.942 805 HG11 VAL 91 HG11 VAL 91 -8.809 -23.995 3.586 806 HG12 VAL 91 HG12 VAL 91 -10.269 -23.628 4.524 807 HG13 VAL 91 HG13 VAL 91 -8.918 -24.483 5.288 808 HG21 VAL 91 HG21 VAL 91 -9.380 -27.642 3.342 809 HG22 VAL 91 HG22 VAL 91 -8.247 -26.325 3.025 810 HG23 VAL 91 HG23 VAL 91 -8.477 -26.908 4.683 811 H SER 92 H SER 92 -10.136 -27.967 6.443 812 HA SER 92 HA SER 92 -10.512 -26.515 8.967 813 HB2 SER 92 HB2 SER 92 -9.285 -29.225 8.345 814 HB3 SER 92 HB3 SER 92 -9.595 -28.584 9.970 815 HG SER 92 HG SER 92 -11.309 -29.937 9.217 816 H THR 93 H THR 93 -8.006 -26.441 6.689 817 HA THR 93 HA THR 93 -5.788 -26.707 8.385 818 HB THR 93 HB THR 93 -5.897 -27.012 5.875 819 HG1 THR 93 HG1 THR 93 -3.718 -26.934 5.874 820 HG21 THR 93 HG21 THR 93 -4.985 -25.249 4.500 821 HG22 THR 93 HG22 THR 93 -6.426 -24.598 5.298 822 HG23 THR 93 HG23 THR 93 -4.809 -24.160 5.888 823 HA PRO 94 HA PRO 94 -5.175 -22.799 10.366 824 HB2 PRO 94 HB2 PRO 94 -2.218 -23.275 10.041 825 HB3 PRO 94 HB3 PRO 94 -3.146 -22.843 11.512 826 HG2 PRO 94 HG2 PRO 94 -2.315 -25.388 11.149 827 HG3 PRO 94 HG3 PRO 94 -3.981 -25.073 11.735 828 HD2 PRO 94 HD2 PRO 94 -3.072 -25.639 8.897 829 HD3 PRO 94 HD3 PRO 94 -4.387 -26.409 9.833 830 H ILE 95 H ILE 95 -4.731 -20.638 9.943 831 HA ILE 95 HA ILE 95 -4.770 -19.797 7.286 832 HB ILE 95 HB ILE 95 -5.692 -18.581 9.219 833 HG12 ILE 95 HG12 ILE 95 -5.132 -16.281 8.622 834 HG13 ILE 95 HG13 ILE 95 -3.718 -16.808 7.706 835 HG21 ILE 95 HG21 ILE 95 -2.834 -17.716 9.875 836 HG22 ILE 95 HG22 ILE 95 -4.318 -17.212 10.689 837 HG23 ILE 95 HG23 ILE 95 -3.788 -18.879 10.826 838 HD11 ILE 95 HD11 ILE 95 -6.582 -17.656 7.059 839 HD12 ILE 95 HD12 ILE 95 -5.763 -16.259 6.340 840 HD13 ILE 95 HD13 ILE 95 -5.135 -17.889 6.051 841 H SER 96 H SER 96 -1.897 -20.271 9.293 842 HA SER 96 HA SER 96 0.001 -18.905 7.626 843 HB2 SER 96 HB2 SER 96 0.487 -19.664 9.883 844 HB3 SER 96 HB3 SER 96 0.357 -21.361 9.379 845 HG SER 96 HG SER 96 2.546 -20.664 9.388 846 H GLU 97 H GLU 97 -1.310 -22.264 7.412 847 HA GLU 97 HA GLU 97 0.409 -23.022 5.201 848 HB2 GLU 97 HB2 GLU 97 -0.612 -24.694 6.693 849 HB3 GLU 97 HB3 GLU 97 -2.219 -24.166 6.213 850 HG2 GLU 97 HG2 GLU 97 -1.722 -26.215 5.095 851 HG3 GLU 97 HG3 GLU 97 -1.838 -24.932 3.903 852 H VAL 98 H VAL 98 -2.862 -21.622 5.431 853 HA VAL 98 HA VAL 98 -3.376 -21.533 2.603 854 HB VAL 98 HB VAL 98 -4.396 -19.521 4.616 855 HG11 VAL 98 HG11 VAL 98 -6.328 -19.408 3.092 856 HG12 VAL 98 HG12 VAL 98 -4.829 -19.004 2.237 857 HG13 VAL 98 HG13 VAL 98 -5.561 -20.604 2.023 858 HG21 VAL 98 HG21 VAL 98 -5.544 -22.262 3.955 859 HG22 VAL 98 HG22 VAL 98 -4.938 -21.728 5.539 860 HG23 VAL 98 HG23 VAL 98 -6.382 -20.990 4.871 861 H TYR 99 H TYR 99 -1.784 -19.194 4.777 862 HA TYR 99 HA TYR 99 -1.135 -17.282 2.792 863 HB2 TYR 99 HB2 TYR 99 -1.086 -16.440 4.860 864 HB3 TYR 99 HB3 TYR 99 -0.270 -17.820 5.561 865 HD1 TYR 99 HD1 TYR 99 0.248 -14.616 3.777 866 HD2 TYR 99 HD2 TYR 99 2.126 -18.038 5.625 867 HE1 TYR 99 HE1 TYR 99 2.395 -13.372 3.917 868 HE2 TYR 99 HE2 TYR 99 4.272 -16.782 5.768 869 HH TYR 99 HH TYR 99 4.654 -13.489 4.426 870 H GLU 100 H GLU 100 0.856 -20.070 3.772 871 HA GLU 100 HA GLU 100 2.937 -19.429 1.858 872 HB2 GLU 100 HB2 GLU 100 2.180 -21.984 3.319 873 HB3 GLU 100 HB3 GLU 100 3.565 -21.883 2.237 874 HG2 GLU 100 HG2 GLU 100 3.181 -20.150 4.714 875 HG3 GLU 100 HG3 GLU 100 4.127 -21.632 4.655 876 H SER 101 H SER 101 0.077 -21.591 1.634 877 HA SER 101 HA SER 101 0.815 -22.589 -0.972 878 HB2 SER 101 HB2 SER 101 -1.418 -23.617 -1.000 879 HB3 SER 101 HB3 SER 101 -0.503 -23.966 0.476 880 HG SER 101 HG SER 101 -1.741 -22.610 1.613 881 H GLU 102 H GLU 102 -1.166 -19.814 -0.020 882 HA GLU 102 HA GLU 102 -1.520 -19.130 -2.912 883 HB2 GLU 102 HB2 GLU 102 -3.260 -18.387 -0.545 884 HB3 GLU 102 HB3 GLU 102 -3.488 -17.781 -2.176 885 HG2 GLU 102 HG2 GLU 102 -3.683 -20.703 -1.333 886 HG3 GLU 102 HG3 GLU 102 -5.032 -19.616 -1.613 887 H LYS 103 H LYS 103 0.857 -18.653 -1.403 888 HA LYS 103 HA LYS 103 1.219 -15.908 -0.785 889 HB2 LYS 103 HB2 LYS 103 2.686 -17.836 -0.181 890 HB3 LYS 103 HB3 LYS 103 3.224 -17.940 -1.853 891 HG2 LYS 103 HG2 LYS 103 4.386 -15.843 -1.698 892 HG3 LYS 103 HG3 LYS 103 3.514 -15.386 -0.227 893 HD2 LYS 103 HD2 LYS 103 5.776 -16.037 0.359 894 HD3 LYS 103 HD3 LYS 103 4.606 -17.180 1.037 895 HE2 LYS 103 HE2 LYS 103 5.076 -18.723 -0.928 896 HE3 LYS 103 HE3 LYS 103 6.340 -17.597 -1.447 897 HZ1 LYS 103 HZ1 LYS 103 7.265 -19.395 -0.103 898 HZ2 LYS 103 HZ2 LYS 103 7.434 -17.998 0.731 899 HZ3 LYS 103 HZ3 LYS 103 6.260 -19.074 1.150 900 H ASP 104 H ASP 104 1.889 -14.175 -1.927 901 HA ASP 104 HA ASP 104 2.473 -14.302 -4.830 902 HB2 ASP 104 HB2 ASP 104 -0.029 -14.049 -4.511 903 HB3 ASP 104 HB3 ASP 104 0.279 -12.542 -3.647 904 H GLU 105 H GLU 105 3.134 -12.074 -5.627 905 HA GLU 105 HA GLU 105 5.411 -11.211 -4.169 906 HB2 GLU 105 HB2 GLU 105 3.918 -9.847 -6.447 907 HB3 GLU 105 HB3 GLU 105 5.538 -9.417 -5.927 908 HG2 GLU 105 HG2 GLU 105 4.713 -12.120 -7.082 909 HG3 GLU 105 HG3 GLU 105 5.505 -10.821 -7.960 910 H ASP 106 H ASP 106 2.152 -9.939 -4.015 911 HA ASP 106 HA ASP 106 2.721 -7.449 -2.737 912 HB2 ASP 106 HB2 ASP 106 0.281 -9.232 -2.781 913 HB3 ASP 106 HB3 ASP 106 0.336 -7.771 -1.816 914 H GLY 107 H GLY 107 3.212 -10.564 -1.480 915 HA2 GLY 107 HA2 GLY 107 3.886 -11.324 0.587 916 HA3 GLY 107 HA3 GLY 107 3.826 -9.679 1.223 917 H PHE 108 H PHE 108 1.125 -9.048 0.743 918 HA PHE 108 HA PHE 108 -0.363 -10.361 2.774 919 HB2 PHE 108 HB2 PHE 108 -1.098 -8.479 0.544 920 HB3 PHE 108 HB3 PHE 108 -2.328 -9.264 1.494 921 HD1 PHE 108 HD1 PHE 108 0.126 -6.564 1.469 922 HD2 PHE 108 HD2 PHE 108 -2.540 -8.874 3.940 923 HE1 PHE 108 HE1 PHE 108 0.176 -4.783 3.201 924 HE2 PHE 108 HE2 PHE 108 -2.451 -7.116 5.692 925 HZ PHE 108 HZ PHE 108 -1.083 -5.068 5.325 926 H LEU 109 H LEU 109 -1.795 -11.999 2.926 927 HA LEU 109 HA LEU 109 -2.289 -13.753 0.621 928 HB2 LEU 109 HB2 LEU 109 -1.997 -14.756 2.798 929 HB3 LEU 109 HB3 LEU 109 -3.228 -13.710 3.506 930 HG LEU 109 HG LEU 109 -4.990 -14.828 2.158 931 HD11 LEU 109 HD11 LEU 109 -3.704 -15.615 0.225 932 HD12 LEU 109 HD12 LEU 109 -2.700 -16.637 1.272 933 HD13 LEU 109 HD13 LEU 109 -4.422 -16.997 1.058 934 HD21 LEU 109 HD21 LEU 109 -3.269 -16.752 3.767 935 HD22 LEU 109 HD22 LEU 109 -4.429 -15.595 4.439 936 HD23 LEU 109 HD23 LEU 109 -5.000 -16.921 3.415 937 H TYR 110 H TYR 110 -3.837 -13.289 -0.890 938 HA TYR 110 HA TYR 110 -5.899 -11.338 -0.280 939 HB2 TYR 110 HB2 TYR 110 -5.033 -12.641 -2.816 940 HB3 TYR 110 HB3 TYR 110 -6.590 -11.842 -2.720 941 HD1 TYR 110 HD1 TYR 110 -3.019 -11.308 -3.025 942 HD2 TYR 110 HD2 TYR 110 -6.788 -9.430 -2.049 943 HE1 TYR 110 HE1 TYR 110 -2.038 -9.078 -3.508 944 HE2 TYR 110 HE2 TYR 110 -5.788 -7.199 -2.505 945 HH TYR 110 HH TYR 110 -2.383 -6.840 -3.583 946 H MET 111 H MET 111 -7.879 -11.533 0.427 947 HA MET 111 HA MET 111 -9.444 -13.930 -0.441 948 HB2 MET 111 HB2 MET 111 -9.795 -12.482 2.216 949 HB3 MET 111 HB3 MET 111 -10.678 -13.888 1.608 950 HG2 MET 111 HG2 MET 111 -8.402 -15.094 1.550 951 HG3 MET 111 HG3 MET 111 -7.780 -13.735 2.489 952 HE1 MET 111 HE1 MET 111 -7.655 -16.852 3.371 953 HE2 MET 111 HE2 MET 111 -6.921 -15.468 4.217 954 HE3 MET 111 HE3 MET 111 -7.948 -16.606 5.108 955 H VAL 112 H VAL 112 -10.911 -13.310 -1.880 956 HA VAL 112 HA VAL 112 -12.102 -10.566 -1.733 957 HB VAL 112 HB VAL 112 -12.321 -12.773 -3.810 958 HG11 VAL 112 HG11 VAL 112 -14.469 -11.610 -3.778 959 HG12 VAL 112 HG12 VAL 112 -13.639 -10.031 -3.770 960 HG13 VAL 112 HG13 VAL 112 -13.545 -11.087 -5.190 961 HG21 VAL 112 HG21 VAL 112 -11.069 -9.992 -3.912 962 HG22 VAL 112 HG22 VAL 112 -10.182 -11.535 -3.850 963 HG23 VAL 112 HG23 VAL 112 -11.167 -11.140 -5.265 964 H TYR 113 H TYR 113 -14.494 -10.404 -1.301 965 HA TYR 113 HA TYR 113 -15.679 -13.020 -0.393 966 HB2 TYR 113 HB2 TYR 113 -16.577 -12.153 1.517 967 HB3 TYR 113 HB3 TYR 113 -14.933 -11.569 1.530 968 HD1 TYR 113 HD1 TYR 113 -18.496 -10.622 1.155 969 HD2 TYR 113 HD2 TYR 113 -14.459 -9.186 1.530 970 HE1 TYR 113 HE1 TYR 113 -19.363 -8.377 1.810 971 HE2 TYR 113 HE2 TYR 113 -15.330 -6.941 2.210 972 HH TYR 113 HH TYR 113 -18.780 -6.304 2.740 973 H ALA 114 H ALA 114 -17.756 -13.366 -0.742 974 HA ALA 114 HA ALA 114 -19.461 -11.487 -2.272 975 HB1 ALA 114 HB1 ALA 114 -17.844 -12.445 -3.943 976 HB2 ALA 114 HB2 ALA 114 -18.389 -14.072 -3.492 977 HB3 ALA 114 HB3 ALA 114 -19.514 -12.933 -4.261 978 H SER 115 H SER 115 -21.556 -12.522 -2.858 979 HA SER 115 HA SER 115 -22.679 -14.237 -0.792 980 HB2 SER 115 HB2 SER 115 -24.727 -13.988 -2.185 981 HB3 SER 115 HB3 SER 115 -23.962 -12.431 -1.799 982 HG SER 115 HG SER 115 -24.531 -12.621 -4.038 983 H GLN 116 H GLN 116 -20.907 -14.944 -3.611 984 HA GLN 116 HA GLN 116 -22.106 -17.670 -3.958 985 HB2 GLN 116 HB2 GLN 116 -20.628 -15.943 -5.971 986 HB3 GLN 116 HB3 GLN 116 -21.310 -17.530 -6.280 987 HG2 GLN 116 HG2 GLN 116 -23.323 -16.667 -6.792 988 HG3 GLN 116 HG3 GLN 116 -23.413 -15.733 -5.311 989 HE21 GLN 116 HE21 GLN 116 -22.166 -12.720 -6.859 990 HE22 GLN 116 HE22 GLN 116 -22.659 -13.468 -5.339 991 H GLU 117 H GLU 117 -20.646 -19.410 -4.323 992 HA GLU 117 HA GLU 117 -18.142 -19.320 -2.933 993 HB2 GLU 117 HB2 GLU 117 -17.951 -21.613 -3.504 994 HB3 GLU 117 HB3 GLU 117 -19.622 -21.304 -3.065 995 HG2 GLU 117 HG2 GLU 117 -18.570 -21.565 -5.929 996 HG3 GLU 117 HG3 GLU 117 -19.227 -22.884 -4.985 997 H THR 118 H THR 118 -18.785 -18.316 -6.103 998 HA THR 118 HA THR 118 -15.975 -18.082 -6.796 999 HB THR 118 HB THR 118 -16.466 -20.428 -7.460 1000 HG1 THR 118 HG1 THR 118 -15.584 -20.146 -9.527 1001 HG21 THR 118 HG21 THR 118 -18.859 -20.121 -8.214 1002 HG22 THR 118 HG22 THR 118 -18.260 -19.196 -9.609 1003 HG23 THR 118 HG23 THR 118 -17.823 -20.906 -9.415 1004 H PHE 119 H PHE 119 -15.617 -16.960 -8.811 1005 HA PHE 119 HA PHE 119 -17.940 -15.587 -9.971 1006 HB2 PHE 119 HB2 PHE 119 -16.661 -13.475 -10.322 1007 HB3 PHE 119 HB3 PHE 119 -17.293 -13.831 -8.733 1008 HD1 PHE 119 HD1 PHE 119 -15.883 -13.935 -6.802 1009 HD2 PHE 119 HD2 PHE 119 -14.165 -13.777 -10.751 1010 HE1 PHE 119 HE1 PHE 119 -13.644 -13.458 -5.822 1011 HE2 PHE 119 HE2 PHE 119 -11.944 -13.284 -9.773 1012 HZ PHE 119 HZ PHE 119 -11.679 -13.097 -7.309 1013 H GLY 120 H GLY 120 -16.217 -17.882 -10.637 1014 HA2 GLY 120 HA2 GLY 120 -15.872 -18.946 -12.742 1015 HA3 GLY 120 HA3 GLY 120 -15.842 -17.378 -13.545 1016 H1 ASP 10 H1 ASP 10 -11.544 2.526 17.632 1017 H2 ASP 10 H2 ASP 10 -11.714 3.944 16.824 1018 H3 ASP 10 H3 ASP 10 -12.002 2.521 16.057 1019 HA ASP 10 HA ASP 10 -9.888 3.457 15.405 1020 HB2 ASP 10 HB2 ASP 10 -7.979 3.393 17.066 1021 HB3 ASP 10 HB3 ASP 10 -9.144 4.693 17.180 1022 H TYR 11 H TYR 11 -7.837 2.217 15.078 1023 HA TYR 11 HA TYR 11 -6.933 0.391 14.218 1024 HB2 TYR 11 HB2 TYR 11 -7.609 -0.594 16.959 1025 HB3 TYR 11 HB3 TYR 11 -6.652 -1.542 15.853 1026 HD1 TYR 11 HD1 TYR 11 -4.547 -0.427 14.718 1027 HD2 TYR 11 HD2 TYR 11 -6.528 1.041 18.275 1028 HE1 TYR 11 HE1 TYR 11 -2.526 0.910 15.318 1029 HE2 TYR 11 HE2 TYR 11 -4.484 2.325 18.883 1030 HH TYR 11 HH TYR 11 -1.542 2.333 16.834 1031 H GLU 12 H GLU 12 -7.664 -2.468 14.764 1032 HA GLU 12 HA GLU 12 -8.586 -4.161 13.703 1033 HB2 GLU 12 HB2 GLU 12 -10.401 -3.420 15.122 1034 HB3 GLU 12 HB3 GLU 12 -11.063 -2.452 13.807 1035 HG2 GLU 12 HG2 GLU 12 -12.391 -4.394 14.066 1036 HG3 GLU 12 HG3 GLU 12 -11.546 -4.544 12.538 1037 H SER 13 H SER 13 -8.408 -1.399 11.741 1038 HA SER 13 HA SER 13 -7.544 -3.115 9.543 1039 HB2 SER 13 HB2 SER 13 -10.218 -1.807 9.393 1040 HB3 SER 13 HB3 SER 13 -9.207 -1.655 7.950 1041 HG SER 13 HG SER 13 -9.647 -4.123 9.276 1042 H ASP 14 H ASP 14 -6.115 -1.312 11.164 1043 HA ASP 14 HA ASP 14 -5.924 1.299 9.839 1044 HB2 ASP 14 HB2 ASP 14 -5.740 0.872 12.310 1045 HB3 ASP 14 HB3 ASP 14 -4.202 0.070 12.011 1046 H ASP 15 H ASP 15 -3.483 2.051 9.513 1047 HA ASP 15 HA ASP 15 -2.197 0.208 7.535 1048 HB2 ASP 15 HB2 ASP 15 -2.825 3.158 7.178 1049 HB3 ASP 15 HB3 ASP 15 -2.025 2.094 6.005 1050 H ASP 16 H ASP 16 -0.060 0.373 7.126 1051 HA ASP 16 HA ASP 16 2.070 0.417 7.756 1052 HB2 ASP 16 HB2 ASP 16 3.146 2.711 7.781 1053 HB3 ASP 16 HB3 ASP 16 2.375 2.061 6.358 1054 H SER 17 H SER 17 2.200 -0.774 9.548 1055 HA SER 17 HA SER 17 2.855 -1.402 11.599 1056 HB2 SER 17 HB2 SER 17 4.774 0.046 11.183 1057 HB3 SER 17 HB3 SER 17 3.940 1.384 12.003 1058 HG SER 17 HG SER 17 5.301 0.231 13.453 1059 H TYR 18 H TYR 18 1.168 -2.009 12.756 1060 HA TYR 18 HA TYR 18 -0.209 -0.271 14.647 1061 HB2 TYR 18 HB2 TYR 18 -2.450 -0.564 13.480 1062 HB3 TYR 18 HB3 TYR 18 -1.313 0.497 12.696 1063 HD1 TYR 18 HD1 TYR 18 -0.340 -0.012 10.557 1064 HD2 TYR 18 HD2 TYR 18 -2.875 -2.818 12.551 1065 HE1 TYR 18 HE1 TYR 18 -0.288 -1.485 8.536 1066 HE2 TYR 18 HE2 TYR 18 -2.940 -4.248 10.466 1067 HH TYR 18 HH TYR 18 -0.827 -3.510 7.680 1068 H GLU 19 H GLU 19 -2.582 -1.661 15.032 1069 HA GLU 19 HA GLU 19 -1.928 -4.497 15.554 1070 HB2 GLU 19 HB2 GLU 19 -1.598 -3.290 17.668 1071 HB3 GLU 19 HB3 GLU 19 -3.145 -2.473 17.463 1072 HG2 GLU 19 HG2 GLU 19 -3.431 -4.130 19.121 1073 HG3 GLU 19 HG3 GLU 19 -4.337 -4.652 17.707 1074 H VAL 20 H VAL 20 -3.639 -5.884 15.037 1075 HA VAL 20 HA VAL 20 -6.351 -4.860 14.384 1076 HB VAL 20 HB VAL 20 -4.284 -5.740 12.348 1077 HG11 VAL 20 HG11 VAL 20 -5.983 -6.133 10.641 1078 HG12 VAL 20 HG12 VAL 20 -6.087 -7.350 11.919 1079 HG13 VAL 20 HG13 VAL 20 -7.274 -6.024 11.848 1080 HG21 VAL 20 HG21 VAL 20 -5.324 -3.954 10.984 1081 HG22 VAL 20 HG22 VAL 20 -6.542 -3.716 12.253 1082 HG23 VAL 20 HG23 VAL 20 -4.883 -3.309 12.569 1083 H LEU 21 H LEU 21 -7.816 -6.660 13.952 1084 HA LEU 21 HA LEU 21 -8.811 -8.550 14.353 1085 HB2 LEU 21 HB2 LEU 21 -6.756 -9.730 13.373 1086 HB3 LEU 21 HB3 LEU 21 -6.269 -10.011 15.038 1087 HG LEU 21 HG LEU 21 -8.751 -10.949 15.311 1088 HD11 LEU 21 HD11 LEU 21 -9.554 -12.087 13.247 1089 HD12 LEU 21 HD12 LEU 21 -9.558 -10.331 13.050 1090 HD13 LEU 21 HD13 LEU 21 -8.280 -11.302 12.302 1091 HD21 LEU 21 HD21 LEU 21 -6.722 -12.314 15.557 1092 HD22 LEU 21 HD22 LEU 21 -8.004 -13.202 14.701 1093 HD23 LEU 21 HD23 LEU 21 -6.648 -12.500 13.785 1094 H ASP 22 H ASP 22 -9.335 -6.908 15.850 1095 HA ASP 22 HA ASP 22 -8.520 -6.556 18.412 1096 HB2 ASP 22 HB2 ASP 22 -9.800 -4.885 17.638 1097 HB3 ASP 22 HB3 ASP 22 -10.946 -5.933 16.868 1098 H LEU 23 H LEU 23 -10.134 -9.489 17.644 1099 HA LEU 23 HA LEU 23 -10.980 -10.061 20.368 1100 HB2 LEU 23 HB2 LEU 23 -11.250 -12.343 19.673 1101 HB3 LEU 23 HB3 LEU 23 -12.031 -11.224 18.579 1102 HG LEU 23 HG LEU 23 -10.354 -11.639 16.859 1103 HD11 LEU 23 HD11 LEU 23 -9.035 -13.524 18.859 1104 HD12 LEU 23 HD12 LEU 23 -8.777 -13.624 17.116 1105 HD13 LEU 23 HD13 LEU 23 -8.276 -12.170 17.963 1106 HD21 LEU 23 HD21 LEU 23 -11.342 -14.253 18.079 1107 HD22 LEU 23 HD22 LEU 23 -12.352 -13.133 17.139 1108 HD23 LEU 23 HD23 LEU 23 -10.978 -13.950 16.368 1109 H THR 24 H THR 24 -7.881 -9.778 19.047 1110 HA THR 24 HA THR 24 -5.845 -10.174 19.672 1111 HB THR 24 HB THR 24 -6.466 -10.719 22.524 1112 HG1 THR 24 HG1 THR 24 -6.857 -8.557 22.856 1113 HG21 THR 24 HG21 THR 24 -4.562 -9.168 22.865 1114 HG22 THR 24 HG22 THR 24 -4.103 -10.539 21.853 1115 HG23 THR 24 HG23 THR 24 -4.418 -8.962 21.100 1116 H GLU 25 H GLU 25 -7.711 -12.826 20.996 1117 HA GLU 25 HA GLU 25 -7.401 -15.012 21.273 1118 HB2 GLU 25 HB2 GLU 25 -6.945 -15.150 18.908 1119 HB3 GLU 25 HB3 GLU 25 -5.260 -14.716 19.164 1120 HG2 GLU 25 HG2 GLU 25 -5.390 -17.041 18.693 1121 HG3 GLU 25 HG3 GLU 25 -4.820 -16.812 20.338 1122 H TYR 26 H TYR 26 -4.283 -13.350 21.447 1123 HA TYR 26 HA TYR 26 -3.069 -15.136 23.305 1124 HB2 TYR 26 HB2 TYR 26 -2.346 -12.417 22.291 1125 HB3 TYR 26 HB3 TYR 26 -1.485 -13.138 23.640 1126 HD1 TYR 26 HD1 TYR 26 0.202 -14.766 23.337 1127 HD2 TYR 26 HD2 TYR 26 -2.430 -13.772 20.062 1128 HE1 TYR 26 HE1 TYR 26 1.640 -16.078 21.793 1129 HE2 TYR 26 HE2 TYR 26 -0.984 -15.112 18.513 1130 HH TYR 26 HH TYR 26 1.892 -16.896 19.653 Start of MODEL 8 1 H1 MET 1 H1 MET 1 -10.378 5.754 7.699 2 H2 MET 1 H2 MET 1 -8.978 5.310 8.425 3 H3 MET 1 H3 MET 1 -8.967 6.305 7.124 4 HA MET 1 HA MET 1 -9.770 4.690 5.657 5 HB2 MET 1 HB2 MET 1 -7.962 3.072 5.449 6 HB3 MET 1 HB3 MET 1 -7.516 4.760 5.523 7 HG2 MET 1 HG2 MET 1 -6.817 4.395 7.944 8 HG3 MET 1 HG3 MET 1 -7.037 2.657 7.638 9 HE1 MET 1 HE1 MET 1 -4.555 2.179 8.368 10 HE2 MET 1 HE2 MET 1 -3.141 3.014 7.679 11 HE3 MET 1 HE3 MET 1 -4.295 3.912 8.692 12 HA PRO 2 HA PRO 2 -11.281 0.646 7.602 13 HB2 PRO 2 HB2 PRO 2 -11.805 0.536 10.305 14 HB3 PRO 2 HB3 PRO 2 -10.304 -0.033 9.538 15 HG2 PRO 2 HG2 PRO 2 -10.843 2.668 10.824 16 HG3 PRO 2 HG3 PRO 2 -9.482 1.556 11.157 17 HD2 PRO 2 HD2 PRO 2 -9.154 3.602 9.468 18 HD3 PRO 2 HD3 PRO 2 -8.505 1.999 9.029 19 H SER 3 H SER 3 -13.045 1.331 6.473 20 HA SER 3 HA SER 3 -15.402 2.475 7.799 21 HB2 SER 3 HB2 SER 3 -15.446 4.511 6.476 22 HB3 SER 3 HB3 SER 3 -13.915 4.461 7.337 23 HG SER 3 HG SER 3 -12.930 3.676 5.399 24 H GLU 4 H GLU 4 -16.971 3.180 5.778 25 HA GLU 4 HA GLU 4 -17.546 0.821 4.243 26 HB2 GLU 4 HB2 GLU 4 -19.224 2.427 5.012 27 HB3 GLU 4 HB3 GLU 4 -18.522 3.691 3.987 28 HG2 GLU 4 HG2 GLU 4 -19.124 2.433 1.969 29 HG3 GLU 4 HG3 GLU 4 -19.720 1.091 2.954 30 H LYS 5 H LYS 5 -15.554 3.645 3.555 31 HA LYS 5 HA LYS 5 -15.364 3.104 0.660 32 HB2 LYS 5 HB2 LYS 5 -15.384 5.396 1.557 33 HB3 LYS 5 HB3 LYS 5 -13.857 5.104 2.392 34 HG2 LYS 5 HG2 LYS 5 -12.654 4.867 0.331 35 HG3 LYS 5 HG3 LYS 5 -14.138 4.744 -0.618 36 HD2 LYS 5 HD2 LYS 5 -13.252 7.262 0.858 37 HD3 LYS 5 HD3 LYS 5 -12.921 6.914 -0.843 38 HE2 LYS 5 HE2 LYS 5 -15.385 6.736 -1.277 39 HE3 LYS 5 HE3 LYS 5 -15.699 7.191 0.406 40 HZ1 LYS 5 HZ1 LYS 5 -14.294 8.898 -1.596 41 HZ2 LYS 5 HZ2 LYS 5 -15.823 9.114 -1.072 42 HZ3 LYS 5 HZ3 LYS 5 -14.580 9.326 -0.038 43 H THR 6 H THR 6 -13.386 2.531 -0.413 44 HA THR 6 HA THR 6 -11.996 0.396 0.965 45 HB THR 6 HB THR 6 -11.169 -0.395 -0.958 46 HG1 THR 6 HG1 THR 6 -10.841 0.925 -2.819 47 HG21 THR 6 HG21 THR 6 -13.465 1.196 -2.182 48 HG22 THR 6 HG22 THR 6 -12.803 -0.367 -2.711 49 HG23 THR 6 HG23 THR 6 -13.684 -0.259 -1.182 50 H PHE 7 H PHE 7 -9.575 0.081 0.836 51 HA PHE 7 HA PHE 7 -8.329 2.281 2.173 52 HB2 PHE 7 HB2 PHE 7 -7.390 -0.426 1.471 53 HB3 PHE 7 HB3 PHE 7 -6.197 0.805 1.817 54 HD1 PHE 7 HD1 PHE 7 -9.519 -0.262 3.312 55 HD2 PHE 7 HD2 PHE 7 -5.440 0.949 3.982 56 HE1 PHE 7 HE1 PHE 7 -9.815 -0.640 5.743 57 HE2 PHE 7 HE2 PHE 7 -5.725 0.538 6.413 58 HZ PHE 7 HZ PHE 7 -7.918 -0.271 7.293 59 H LYS 8 H LYS 8 -8.750 2.094 -1.133 60 HA LYS 8 HA LYS 8 -6.429 3.578 -2.007 61 HB2 LYS 8 HB2 LYS 8 -9.320 3.560 -2.987 62 HB3 LYS 8 HB3 LYS 8 -8.008 4.361 -3.837 63 HG2 LYS 8 HG2 LYS 8 -8.211 1.372 -3.279 64 HG3 LYS 8 HG3 LYS 8 -8.565 2.160 -4.802 65 HD2 LYS 8 HD2 LYS 8 -5.844 1.951 -3.440 66 HD3 LYS 8 HD3 LYS 8 -6.369 1.070 -4.857 67 HE2 LYS 8 HE2 LYS 8 -5.982 4.102 -4.725 68 HE3 LYS 8 HE3 LYS 8 -4.822 2.945 -5.376 69 HZ1 LYS 8 HZ1 LYS 8 -6.476 2.323 -7.076 70 HZ2 LYS 8 HZ2 LYS 8 -7.535 3.436 -6.507 71 HZ3 LYS 8 HZ3 LYS 8 -6.123 3.911 -7.159 72 H GLN 9 H GLN 9 -8.947 4.527 0.100 73 HA GLN 9 HA GLN 9 -8.870 7.357 -0.093 74 HB2 GLN 9 HB2 GLN 9 -10.489 5.947 1.197 75 HB3 GLN 9 HB3 GLN 9 -9.191 5.511 2.309 76 HG2 GLN 9 HG2 GLN 9 -8.995 8.056 2.817 77 HG3 GLN 9 HG3 GLN 9 -10.535 8.210 1.963 78 HE21 GLN 9 HE21 GLN 9 -12.366 6.590 4.643 79 HE22 GLN 9 HE22 GLN 9 -12.453 7.169 2.993 80 H ARG 10 H ARG 10 -6.509 5.085 1.328 81 HA ARG 10 HA ARG 10 -4.611 7.344 1.797 82 HB2 ARG 10 HB2 ARG 10 -5.301 5.279 3.933 83 HB3 ARG 10 HB3 ARG 10 -3.905 6.355 3.974 84 HG2 ARG 10 HG2 ARG 10 -5.635 8.302 3.725 85 HG3 ARG 10 HG3 ARG 10 -6.840 7.080 4.162 86 HD2 ARG 10 HD2 ARG 10 -6.216 8.243 6.168 87 HD3 ARG 10 HD3 ARG 10 -5.487 6.622 6.260 88 HE ARG 10 HE ARG 10 -3.663 8.534 5.074 89 HH11 ARG 10 HH11 ARG 10 -1.816 9.185 7.888 90 HH12 ARG 10 HH12 ARG 10 -1.884 9.273 6.154 91 HH21 ARG 10 HH21 ARG 10 -4.895 7.721 8.254 92 HH22 ARG 10 HH22 ARG 10 -3.475 8.328 9.053 93 H ARG 11 H ARG 11 -4.819 3.735 1.749 94 HA ARG 11 HA ARG 11 -1.879 3.630 1.463 95 HB2 ARG 11 HB2 ARG 11 -4.031 1.539 1.935 96 HB3 ARG 11 HB3 ARG 11 -2.379 1.082 1.583 97 HG2 ARG 11 HG2 ARG 11 -3.214 2.792 3.972 98 HG3 ARG 11 HG3 ARG 11 -2.867 1.060 3.997 99 HD2 ARG 11 HD2 ARG 11 -0.584 1.644 2.995 100 HD3 ARG 11 HD3 ARG 11 -0.914 3.320 3.458 101 HE ARG 11 HE ARG 11 -0.429 0.957 5.222 102 HH11 ARG 11 HH11 ARG 11 0.735 1.284 6.947 103 HH12 ARG 11 HH12 ARG 11 0.703 2.831 7.787 104 HH21 ARG 11 HH21 ARG 11 -0.960 4.460 5.257 105 HH22 ARG 11 HH22 ARG 11 -0.109 4.593 6.771 106 H THR 12 H THR 12 -0.807 2.333 0.000 107 HA THR 12 HA THR 12 -1.915 1.868 -2.719 108 HB THR 12 HB THR 12 0.146 2.978 -3.660 109 HG1 THR 12 HG1 THR 12 1.425 4.179 -2.375 110 HG21 THR 12 HG21 THR 12 -0.561 5.286 -3.480 111 HG22 THR 12 HG22 THR 12 -2.003 4.260 -3.589 112 HG23 THR 12 HG23 THR 12 -1.508 4.939 -2.019 113 H PHE 13 H PHE 13 -0.252 0.491 -3.961 114 HA PHE 13 HA PHE 13 0.409 -1.748 -2.482 115 HB2 PHE 13 HB2 PHE 13 0.140 -2.006 -4.779 116 HB3 PHE 13 HB3 PHE 13 1.371 -0.811 -5.150 117 HD1 PHE 13 HD1 PHE 13 0.886 -4.272 -3.834 118 HD2 PHE 13 HD2 PHE 13 3.684 -1.384 -5.393 119 HE1 PHE 13 HE1 PHE 13 2.609 -6.050 -4.039 120 HE2 PHE 13 HE2 PHE 13 5.407 -3.165 -5.588 121 HZ PHE 13 HZ PHE 13 4.871 -5.499 -4.915 122 H GLU 14 H GLU 14 2.790 0.806 -3.249 123 HA GLU 14 HA GLU 14 4.991 -0.506 -1.996 124 HB2 GLU 14 HB2 GLU 14 5.168 1.388 -3.588 125 HB3 GLU 14 HB3 GLU 14 4.378 2.444 -2.423 126 HG2 GLU 14 HG2 GLU 14 6.681 2.934 -2.382 127 HG3 GLU 14 HG3 GLU 14 6.295 2.156 -0.856 128 H GLN 15 H GLN 15 2.490 1.657 -0.594 129 HA GLN 15 HA GLN 15 3.710 1.707 2.056 130 HB2 GLN 15 HB2 GLN 15 0.866 2.279 1.155 131 HB3 GLN 15 HB3 GLN 15 1.500 2.535 2.789 132 HG2 GLN 15 HG2 GLN 15 3.086 4.212 1.980 133 HG3 GLN 15 HG3 GLN 15 2.538 3.971 0.313 134 HE21 GLN 15 HE21 GLN 15 -0.582 5.722 0.818 135 HE22 GLN 15 HE22 GLN 15 0.360 4.699 -0.284 136 H ARG 16 H ARG 16 1.262 -0.390 0.459 137 HA ARG 16 HA ARG 16 0.722 -1.988 2.824 138 HB2 ARG 16 HB2 ARG 16 0.427 -2.701 -0.125 139 HB3 ARG 16 HB3 ARG 16 -0.124 -3.686 1.236 140 HG2 ARG 16 HG2 ARG 16 -1.467 -1.603 1.989 141 HG3 ARG 16 HG3 ARG 16 -1.180 -0.982 0.357 142 HD2 ARG 16 HD2 ARG 16 -2.575 -3.573 1.126 143 HD3 ARG 16 HD3 ARG 16 -3.356 -2.130 0.510 144 HE ARG 16 HE ARG 16 -1.740 -4.123 -0.987 145 HH11 ARG 16 HH11 ARG 16 -2.858 -3.043 -4.042 146 HH12 ARG 16 HH12 ARG 16 -2.015 -4.283 -3.169 147 HH21 ARG 16 HH21 ARG 16 -3.566 -1.143 -1.273 148 HH22 ARG 16 HH22 ARG 16 -3.751 -1.323 -2.995 149 H VAL 17 H VAL 17 3.162 -2.310 0.240 150 HA VAL 17 HA VAL 17 4.354 -4.771 1.100 151 HB VAL 17 HB VAL 17 5.406 -2.333 -0.381 152 HG11 VAL 17 HG11 VAL 17 7.446 -3.662 -0.935 153 HG12 VAL 17 HG12 VAL 17 7.395 -3.147 0.750 154 HG13 VAL 17 HG13 VAL 17 6.994 -4.826 0.325 155 HG21 VAL 17 HG21 VAL 17 3.855 -3.928 -1.543 156 HG22 VAL 17 HG22 VAL 17 5.465 -3.868 -2.269 157 HG23 VAL 17 HG23 VAL 17 5.000 -5.226 -1.219 158 H GLU 18 H GLU 18 5.150 -1.348 2.078 159 HA GLU 18 HA GLU 18 7.059 -2.093 4.069 160 HB2 GLU 18 HB2 GLU 18 5.229 0.319 3.844 161 HB3 GLU 18 HB3 GLU 18 6.423 0.118 5.137 162 HG2 GLU 18 HG2 GLU 18 8.233 -0.089 3.483 163 HG3 GLU 18 HG3 GLU 18 7.083 0.129 2.165 164 H ASP 19 H ASP 19 3.525 -1.483 4.541 165 HA ASP 19 HA ASP 19 3.323 -2.196 7.243 166 HB2 ASP 19 HB2 ASP 19 1.386 -2.559 4.958 167 HB3 ASP 19 HB3 ASP 19 0.992 -2.996 6.604 168 H VAL 20 H VAL 20 3.057 -4.484 4.504 169 HA VAL 20 HA VAL 20 2.662 -6.851 6.099 170 HB VAL 20 HB VAL 20 3.586 -6.378 3.233 171 HG11 VAL 20 HG11 VAL 20 3.137 -8.788 2.824 172 HG12 VAL 20 HG12 VAL 20 4.521 -8.557 3.876 173 HG13 VAL 20 HG13 VAL 20 2.956 -9.047 4.569 174 HG21 VAL 20 HG21 VAL 20 1.338 -7.129 2.662 175 HG22 VAL 20 HG22 VAL 20 0.980 -7.508 4.365 176 HG23 VAL 20 HG23 VAL 20 1.198 -5.833 3.848 177 H ARG 21 H ARG 21 5.631 -5.422 4.610 178 HA ARG 21 HA ARG 21 7.339 -7.573 5.392 179 HB2 ARG 21 HB2 ARG 21 7.704 -5.883 3.584 180 HB3 ARG 21 HB3 ARG 21 8.111 -4.676 4.811 181 HG2 ARG 21 HG2 ARG 21 10.044 -6.019 5.522 182 HG3 ARG 21 HG3 ARG 21 9.571 -7.342 4.447 183 HD2 ARG 21 HD2 ARG 21 10.369 -4.543 3.542 184 HD3 ARG 21 HD3 ARG 21 11.420 -5.971 3.532 185 HE ARG 21 HE ARG 21 9.037 -6.568 2.051 186 HH11 ARG 21 HH11 ARG 21 11.961 -4.663 1.663 187 HH12 ARG 21 HH12 ARG 21 11.889 -4.763 -0.072 188 HH21 ARG 21 HH21 ARG 21 8.977 -6.636 -0.123 189 HH22 ARG 21 HH22 ARG 21 10.244 -5.877 -1.066 190 H LEU 22 H LEU 22 6.783 -4.393 7.052 191 HA LEU 22 HA LEU 22 8.392 -5.029 9.316 192 HB2 LEU 22 HB2 LEU 22 6.116 -3.076 8.770 193 HB3 LEU 22 HB3 LEU 22 6.677 -3.359 10.415 194 HG LEU 22 HG LEU 22 9.045 -2.968 9.536 195 HD11 LEU 22 HD11 LEU 22 7.557 -1.454 7.365 196 HD12 LEU 22 HD12 LEU 22 9.296 -1.381 7.687 197 HD13 LEU 22 HD13 LEU 22 8.579 -2.886 7.102 198 HD21 LEU 22 HD21 LEU 22 8.840 -0.525 9.899 199 HD22 LEU 22 HD22 LEU 22 7.079 -0.650 9.685 200 HD23 LEU 22 HD23 LEU 22 7.873 -1.435 11.067 201 H ILE 23 H ILE 23 4.815 -5.628 8.844 202 HA ILE 23 HA ILE 23 4.557 -6.576 11.511 203 HB ILE 23 HB ILE 23 2.761 -5.815 9.817 204 HG12 ILE 23 HG12 ILE 23 2.225 -6.101 12.075 205 HG13 ILE 23 HG13 ILE 23 1.017 -6.890 11.091 206 HG21 ILE 23 HG21 ILE 23 2.456 -8.825 9.403 207 HG22 ILE 23 HG22 ILE 23 1.361 -7.535 8.864 208 HG23 ILE 23 HG23 ILE 23 2.979 -7.652 8.176 209 HD11 ILE 23 HD11 ILE 23 3.115 -8.230 12.829 210 HD12 ILE 23 HD12 ILE 23 1.369 -8.260 13.023 211 HD13 ILE 23 HD13 ILE 23 2.098 -9.126 11.663 212 H ARG 24 H ARG 24 5.186 -8.441 8.492 213 HA ARG 24 HA ARG 24 5.089 -10.989 9.830 214 HB2 ARG 24 HB2 ARG 24 4.849 -10.518 7.323 215 HB3 ARG 24 HB3 ARG 24 6.592 -10.265 7.267 216 HG2 ARG 24 HG2 ARG 24 6.176 -12.494 6.515 217 HG3 ARG 24 HG3 ARG 24 6.890 -12.638 8.119 218 HD2 ARG 24 HD2 ARG 24 4.515 -12.879 9.037 219 HD3 ARG 24 HD3 ARG 24 3.951 -12.943 7.363 220 HE ARG 24 HE ARG 24 5.430 -14.933 7.050 221 HH11 ARG 24 HH11 ARG 24 6.036 -16.910 7.905 222 HH12 ARG 24 HH12 ARG 24 5.548 -17.343 9.510 223 HH21 ARG 24 HH21 ARG 24 4.021 -14.362 10.240 224 HH22 ARG 24 HH22 ARG 24 4.633 -15.863 10.871 225 H GLU 25 H GLU 25 7.766 -8.720 9.333 226 HA GLU 25 HA GLU 25 9.781 -10.492 10.427 227 HB2 GLU 25 HB2 GLU 25 10.221 -8.667 8.848 228 HB3 GLU 25 HB3 GLU 25 9.820 -7.465 10.068 229 HG2 GLU 25 HG2 GLU 25 11.984 -9.588 10.476 230 HG3 GLU 25 HG3 GLU 25 12.301 -8.121 9.573 231 H GLN 26 H GLN 26 7.857 -7.788 11.910 232 HA GLN 26 HA GLN 26 9.249 -8.023 14.403 233 HB2 GLN 26 HB2 GLN 26 7.868 -6.307 15.208 234 HB3 GLN 26 HB3 GLN 26 8.112 -5.978 13.500 235 HG2 GLN 26 HG2 GLN 26 5.840 -7.126 13.115 236 HG3 GLN 26 HG3 GLN 26 5.616 -7.077 14.858 237 HE21 GLN 26 HE21 GLN 26 3.836 -4.093 13.766 238 HE22 GLN 26 HE22 GLN 26 3.589 -5.817 13.942 239 H HIS 27 H HIS 27 6.302 -9.629 13.233 240 HA HIS 27 HA HIS 27 6.266 -11.266 15.753 241 HB2 HIS 27 HB2 HIS 27 3.816 -10.114 14.372 242 HB3 HIS 27 HB3 HIS 27 3.796 -11.244 15.729 243 HD1 HIS 27 HD1 HIS 27 5.868 -9.776 17.681 244 HD2 HIS 27 HD2 HIS 27 2.631 -8.098 15.552 245 HE1 HIS 27 HE1 HIS 27 5.103 -7.721 19.025 246 HE2 HIS 27 HE2 HIS 27 3.153 -6.687 17.711 247 HA PRO 28 HA PRO 28 6.572 -14.155 12.161 248 HB2 PRO 28 HB2 PRO 28 7.865 -15.691 14.427 249 HB3 PRO 28 HB3 PRO 28 8.296 -15.672 12.687 250 HG2 PRO 28 HG2 PRO 28 9.738 -14.199 14.412 251 HG3 PRO 28 HG3 PRO 28 9.195 -13.444 12.875 252 HD2 PRO 28 HD2 PRO 28 7.936 -13.214 15.627 253 HD3 PRO 28 HD3 PRO 28 8.333 -11.921 14.453 254 H THR 29 H THR 29 5.222 -14.545 15.409 255 HA THR 29 HA THR 29 3.619 -16.878 14.826 256 HB THR 29 HB THR 29 2.630 -16.633 16.910 257 HG1 THR 29 HG1 THR 29 2.727 -14.680 18.079 258 HG21 THR 29 HG21 THR 29 5.126 -17.066 17.026 259 HG22 THR 29 HG22 THR 29 5.358 -15.336 17.375 260 HG23 THR 29 HG23 THR 29 4.421 -16.355 18.485 261 H LYS 30 H LYS 30 3.220 -13.725 13.660 262 HA LYS 30 HA LYS 30 0.286 -14.157 13.258 263 HB2 LYS 30 HB2 LYS 30 1.860 -11.574 13.609 264 HB3 LYS 30 HB3 LYS 30 0.206 -11.633 12.981 265 HG2 LYS 30 HG2 LYS 30 -0.559 -12.809 15.012 266 HG3 LYS 30 HG3 LYS 30 1.078 -12.720 15.694 267 HD2 LYS 30 HD2 LYS 30 0.970 -10.299 15.858 268 HD3 LYS 30 HD3 LYS 30 -0.469 -10.239 14.828 269 HE2 LYS 30 HE2 LYS 30 -1.254 -9.891 17.046 270 HE3 LYS 30 HE3 LYS 30 -1.769 -11.500 16.547 271 HZ1 LYS 30 HZ1 LYS 30 0.307 -10.766 18.534 272 HZ2 LYS 30 HZ2 LYS 30 -0.959 -11.736 18.710 273 HZ3 LYS 30 HZ3 LYS 30 0.334 -12.291 17.854 274 H ILE 31 H ILE 31 -0.695 -13.569 11.442 275 HA ILE 31 HA ILE 31 0.930 -13.839 8.953 276 HB ILE 31 HB ILE 31 -1.832 -14.895 9.679 277 HG12 ILE 31 HG12 ILE 31 -0.108 -16.136 10.891 278 HG13 ILE 31 HG13 ILE 31 -0.845 -17.123 9.650 279 HG21 ILE 31 HG21 ILE 31 -0.179 -15.249 7.162 280 HG22 ILE 31 HG22 ILE 31 -1.642 -16.184 7.561 281 HG23 ILE 31 HG23 ILE 31 -1.751 -14.439 7.298 282 HD11 ILE 31 HD11 ILE 31 1.594 -17.484 9.798 283 HD12 ILE 31 HD12 ILE 31 1.139 -16.878 8.203 284 HD13 ILE 31 HD13 ILE 31 1.891 -15.794 9.393 285 HA PRO 32 HA PRO 32 -1.303 -9.993 7.937 286 HB2 PRO 32 HB2 PRO 32 0.011 -9.339 5.629 287 HB3 PRO 32 HB3 PRO 32 0.725 -9.122 7.253 288 HG2 PRO 32 HG2 PRO 32 1.175 -11.379 5.297 289 HG3 PRO 32 HG3 PRO 32 2.399 -10.489 6.255 290 HD2 PRO 32 HD2 PRO 32 1.376 -12.928 6.996 291 HD3 PRO 32 HD3 PRO 32 1.920 -11.704 8.186 292 H VAL 33 H VAL 33 -3.262 -9.983 7.059 293 HA VAL 33 HA VAL 33 -3.823 -11.535 4.594 294 HB VAL 33 HB VAL 33 -5.701 -11.521 6.963 295 HG11 VAL 33 HG11 VAL 33 -6.800 -13.386 5.756 296 HG12 VAL 33 HG12 VAL 33 -6.864 -11.888 4.838 297 HG13 VAL 33 HG13 VAL 33 -5.688 -13.148 4.388 298 HG21 VAL 33 HG21 VAL 33 -3.763 -13.704 6.140 299 HG22 VAL 33 HG22 VAL 33 -3.793 -12.811 7.673 300 HG23 VAL 33 HG23 VAL 33 -5.111 -13.917 7.276 301 H ILE 34 H ILE 34 -5.372 -10.631 3.178 302 HA ILE 34 HA ILE 34 -6.728 -8.120 4.089 303 HB ILE 34 HB ILE 34 -5.241 -8.503 1.466 304 HG12 ILE 34 HG12 ILE 34 -5.008 -6.583 3.827 305 HG13 ILE 34 HG13 ILE 34 -3.825 -7.766 3.284 306 HG21 ILE 34 HG21 ILE 34 -6.168 -6.334 0.743 307 HG22 ILE 34 HG22 ILE 34 -7.462 -7.478 0.979 308 HG23 ILE 34 HG23 ILE 34 -7.154 -6.238 2.217 309 HD11 ILE 34 HD11 ILE 34 -3.034 -5.605 2.690 310 HD12 ILE 34 HD12 ILE 34 -3.527 -6.398 1.180 311 HD13 ILE 34 HD13 ILE 34 -4.561 -5.144 1.933 312 H ILE 35 H ILE 35 -8.804 -8.015 3.742 313 HA ILE 35 HA ILE 35 -10.184 -10.037 2.033 314 HB ILE 35 HB ILE 35 -10.828 -10.099 4.418 315 HG12 ILE 35 HG12 ILE 35 -13.149 -9.010 2.771 316 HG13 ILE 35 HG13 ILE 35 -12.432 -10.601 2.496 317 HG21 ILE 35 HG21 ILE 35 -12.189 -8.210 5.401 318 HG22 ILE 35 HG22 ILE 35 -10.529 -7.751 5.089 319 HG23 ILE 35 HG23 ILE 35 -11.836 -7.240 3.987 320 HD11 ILE 35 HD11 ILE 35 -12.949 -11.242 4.868 321 HD12 ILE 35 HD12 ILE 35 -13.786 -9.689 5.084 322 HD13 ILE 35 HD13 ILE 35 -14.388 -10.854 3.912 323 H GLU 36 H GLU 36 -11.659 -9.196 0.451 324 HA GLU 36 HA GLU 36 -11.727 -6.218 0.135 325 HB2 GLU 36 HB2 GLU 36 -9.920 -7.252 -1.208 326 HB3 GLU 36 HB3 GLU 36 -11.096 -8.257 -2.028 327 HG2 GLU 36 HG2 GLU 36 -11.945 -5.473 -2.202 328 HG3 GLU 36 HG3 GLU 36 -10.240 -5.553 -2.571 329 H ARG 37 H ARG 37 -13.690 -5.398 -0.172 330 HA ARG 37 HA ARG 37 -16.115 -6.890 -0.624 331 HB2 ARG 37 HB2 ARG 37 -16.139 -4.622 0.338 332 HB3 ARG 37 HB3 ARG 37 -15.302 -3.978 -1.055 333 HG2 ARG 37 HG2 ARG 37 -17.430 -3.188 -1.315 334 HG3 ARG 37 HG3 ARG 37 -17.387 -4.511 -2.467 335 HD2 ARG 37 HD2 ARG 37 -18.523 -4.909 0.330 336 HD3 ARG 37 HD3 ARG 37 -19.462 -4.104 -0.906 337 HE ARG 37 HE ARG 37 -19.436 -6.101 -2.302 338 HH11 ARG 37 HH11 ARG 37 -18.177 -6.762 0.913 339 HH12 ARG 37 HH12 ARG 37 -18.375 -8.469 0.700 340 HH21 ARG 37 HH21 ARG 37 -20.203 -8.186 -2.174 341 HH22 ARG 37 HH22 ARG 37 -19.101 -9.230 -1.285 342 H TYR 38 H TYR 38 -16.396 -8.143 -2.383 343 HA TYR 38 HA TYR 38 -14.706 -8.060 -4.526 344 HB2 TYR 38 HB2 TYR 38 -15.632 -10.085 -4.054 345 HB3 TYR 38 HB3 TYR 38 -17.274 -9.463 -4.128 346 HD1 TYR 38 HD1 TYR 38 -14.305 -10.190 -6.291 347 HD2 TYR 38 HD2 TYR 38 -18.576 -9.628 -6.076 348 HE1 TYR 38 HE1 TYR 38 -14.521 -10.950 -8.650 349 HE2 TYR 38 HE2 TYR 38 -18.792 -10.386 -8.440 350 HH TYR 38 HH TYR 38 -15.936 -11.258 -10.428 351 H LYS 39 H LYS 39 -14.409 -7.298 -6.488 352 HA LYS 39 HA LYS 39 -15.354 -4.768 -7.074 353 HB2 LYS 39 HB2 LYS 39 -14.226 -6.841 -9.011 354 HB3 LYS 39 HB3 LYS 39 -14.421 -5.124 -9.380 355 HG2 LYS 39 HG2 LYS 39 -12.910 -4.522 -7.514 356 HG3 LYS 39 HG3 LYS 39 -12.665 -6.249 -7.164 357 HD2 LYS 39 HD2 LYS 39 -11.699 -6.595 -9.413 358 HD3 LYS 39 HD3 LYS 39 -12.040 -4.912 -9.834 359 HE2 LYS 39 HE2 LYS 39 -9.696 -5.132 -9.330 360 HE3 LYS 39 HE3 LYS 39 -10.466 -4.125 -8.104 361 HZ1 LYS 39 HZ1 LYS 39 -9.834 -7.017 -7.734 362 HZ2 LYS 39 HZ2 LYS 39 -8.925 -5.786 -7.155 363 HZ3 LYS 39 HZ3 LYS 39 -10.430 -6.001 -6.572 364 H GLY 40 H GLY 40 -16.818 -7.773 -8.244 365 HA2 GLY 40 HA2 GLY 40 -18.601 -6.455 -10.143 366 HA3 GLY 40 HA3 GLY 40 -18.589 -8.154 -9.690 367 H GLU 41 H GLU 41 -18.853 -6.861 -6.684 368 HA GLU 41 HA GLU 41 -21.725 -6.227 -6.762 369 HB2 GLU 41 HB2 GLU 41 -21.996 -8.515 -7.018 370 HB3 GLU 41 HB3 GLU 41 -20.705 -8.928 -5.908 371 HG2 GLU 41 HG2 GLU 41 -23.030 -7.417 -4.761 372 HG3 GLU 41 HG3 GLU 41 -23.336 -9.067 -5.294 373 H LYS 42 H LYS 42 -22.094 -4.698 -5.376 374 HA LYS 42 HA LYS 42 -20.597 -4.534 -2.800 375 HB2 LYS 42 HB2 LYS 42 -21.905 -2.377 -4.472 376 HB3 LYS 42 HB3 LYS 42 -21.259 -2.120 -2.848 377 HG2 LYS 42 HG2 LYS 42 -19.019 -2.847 -3.573 378 HG3 LYS 42 HG3 LYS 42 -19.616 -3.083 -5.226 379 HD2 LYS 42 HD2 LYS 42 -20.183 -0.712 -5.412 380 HD3 LYS 42 HD3 LYS 42 -19.709 -0.426 -3.725 381 HE2 LYS 42 HE2 LYS 42 -17.369 -1.020 -4.228 382 HE3 LYS 42 HE3 LYS 42 -17.809 -1.449 -5.888 383 HZ1 LYS 42 HZ1 LYS 42 -16.881 0.791 -5.782 384 HZ2 LYS 42 HZ2 LYS 42 -18.435 0.886 -6.261 385 HZ3 LYS 42 HZ3 LYS 42 -18.024 1.286 -4.727 386 H GLN 43 H GLN 43 -22.745 -6.385 -2.999 387 HA GLN 43 HA GLN 43 -25.072 -5.110 -1.674 388 HB2 GLN 43 HB2 GLN 43 -24.609 -7.954 -2.644 389 HB3 GLN 43 HB3 GLN 43 -26.062 -7.394 -1.829 390 HG2 GLN 43 HG2 GLN 43 -25.039 -6.342 -4.503 391 HG3 GLN 43 HG3 GLN 43 -26.375 -7.462 -4.266 392 HE21 GLN 43 HE21 GLN 43 -28.569 -4.840 -2.950 393 HE22 GLN 43 HE22 GLN 43 -28.242 -6.558 -2.800 394 H LEU 44 H LEU 44 -22.583 -7.628 -0.859 395 HA LEU 44 HA LEU 44 -23.644 -7.788 1.862 396 HB2 LEU 44 HB2 LEU 44 -20.982 -8.830 0.863 397 HB3 LEU 44 HB3 LEU 44 -21.747 -9.181 2.408 398 HG LEU 44 HG LEU 44 -22.672 -10.105 -0.327 399 HD11 LEU 44 HD11 LEU 44 -20.764 -11.319 0.795 400 HD12 LEU 44 HD12 LEU 44 -21.833 -11.602 2.194 401 HD13 LEU 44 HD13 LEU 44 -22.223 -12.314 0.627 402 HD21 LEU 44 HD21 LEU 44 -24.034 -10.463 2.392 403 HD22 LEU 44 HD22 LEU 44 -24.703 -9.629 0.969 404 HD23 LEU 44 HD23 LEU 44 -24.433 -11.375 0.923 405 HA PRO 45 HA PRO 45 -21.776 -4.170 3.421 406 HB2 PRO 45 HB2 PRO 45 -21.940 -4.533 6.139 407 HB3 PRO 45 HB3 PRO 45 -23.370 -4.313 5.085 408 HG2 PRO 45 HG2 PRO 45 -22.163 -6.935 6.049 409 HG3 PRO 45 HG3 PRO 45 -23.874 -6.403 6.153 410 HD2 PRO 45 HD2 PRO 45 -23.031 -7.987 4.129 411 HD3 PRO 45 HD3 PRO 45 -24.185 -6.660 3.817 412 H VAL 46 H VAL 46 -19.726 -3.430 3.547 413 HA VAL 46 HA VAL 46 -17.553 -5.157 4.557 414 HB VAL 46 HB VAL 46 -17.437 -3.733 2.462 415 HG11 VAL 46 HG11 VAL 46 -18.218 -1.574 3.433 416 HG12 VAL 46 HG12 VAL 46 -16.735 -1.511 4.423 417 HG13 VAL 46 HG13 VAL 46 -16.634 -1.459 2.655 418 HG21 VAL 46 HG21 VAL 46 -15.493 -4.889 3.444 419 HG22 VAL 46 HG22 VAL 46 -15.056 -3.352 2.683 420 HG23 VAL 46 HG23 VAL 46 -15.162 -3.460 4.449 421 H LEU 47 H LEU 47 -19.403 -2.522 5.768 422 HA LEU 47 HA LEU 47 -19.420 -1.232 7.593 423 HB2 LEU 47 HB2 LEU 47 -18.195 -3.603 9.018 424 HB3 LEU 47 HB3 LEU 47 -19.043 -2.246 9.755 425 HG LEU 47 HG LEU 47 -20.247 -4.385 7.945 426 HD11 LEU 47 HD11 LEU 47 -20.747 -3.706 10.872 427 HD12 LEU 47 HD12 LEU 47 -21.461 -5.046 9.950 428 HD13 LEU 47 HD13 LEU 47 -19.720 -5.034 10.302 429 HD21 LEU 47 HD21 LEU 47 -21.446 -2.271 7.526 430 HD22 LEU 47 HD22 LEU 47 -22.445 -3.345 8.512 431 HD23 LEU 47 HD23 LEU 47 -21.590 -1.985 9.275 432 H ASP 48 H ASP 48 -16.342 -2.807 8.339 433 HA ASP 48 HA ASP 48 -14.846 -0.340 7.882 434 HB2 ASP 48 HB2 ASP 48 -13.934 -0.233 10.206 435 HB3 ASP 48 HB3 ASP 48 -15.609 0.225 10.012 436 H LYS 49 H LYS 49 -14.822 -3.534 7.384 437 HA LYS 49 HA LYS 49 -11.967 -3.959 8.152 438 HB2 LYS 49 HB2 LYS 49 -14.333 -5.800 7.896 439 HB3 LYS 49 HB3 LYS 49 -12.681 -6.438 7.852 440 HG2 LYS 49 HG2 LYS 49 -12.162 -5.730 10.021 441 HG3 LYS 49 HG3 LYS 49 -13.407 -4.496 10.041 442 HD2 LYS 49 HD2 LYS 49 -15.181 -6.226 10.225 443 HD3 LYS 49 HD3 LYS 49 -13.935 -7.489 10.182 444 HE2 LYS 49 HE2 LYS 49 -14.383 -7.177 12.510 445 HE3 LYS 49 HE3 LYS 49 -12.850 -6.383 12.187 446 HZ1 LYS 49 HZ1 LYS 49 -15.446 -5.102 12.756 447 HZ2 LYS 49 HZ2 LYS 49 -13.964 -4.844 13.426 448 HZ3 LYS 49 HZ3 LYS 49 -14.343 -4.252 11.913 449 H THR 50 H THR 50 -10.459 -4.003 6.827 450 HA THR 50 HA THR 50 -10.704 -5.305 4.207 451 HB THR 50 HB THR 50 -9.179 -2.764 4.149 452 HG1 THR 50 HG1 THR 50 -11.151 -1.800 3.317 453 HG21 THR 50 HG21 THR 50 -10.808 -4.213 2.030 454 HG22 THR 50 HG22 THR 50 -9.752 -2.803 1.783 455 HG23 THR 50 HG23 THR 50 -9.048 -4.363 2.240 456 H LYS 51 H LYS 51 -8.202 -3.758 6.278 457 HA LYS 51 HA LYS 51 -6.283 -5.905 5.578 458 HB2 LYS 51 HB2 LYS 51 -6.162 -3.589 7.564 459 HB3 LYS 51 HB3 LYS 51 -4.863 -4.766 7.300 460 HG2 LYS 51 HG2 LYS 51 -4.630 -4.058 4.954 461 HG3 LYS 51 HG3 LYS 51 -5.992 -2.939 5.129 462 HD2 LYS 51 HD2 LYS 51 -3.911 -1.701 5.267 463 HD3 LYS 51 HD3 LYS 51 -4.756 -1.651 6.828 464 HE2 LYS 51 HE2 LYS 51 -3.262 -3.469 7.681 465 HE3 LYS 51 HE3 LYS 51 -2.404 -3.488 6.135 466 HZ1 LYS 51 HZ1 LYS 51 -1.589 -1.248 6.569 467 HZ2 LYS 51 HZ2 LYS 51 -2.579 -1.063 7.884 468 HZ3 LYS 51 HZ3 LYS 51 -1.315 -2.107 7.910 469 H PHE 52 H PHE 52 -5.540 -7.494 7.005 470 HA PHE 52 HA PHE 52 -6.677 -7.678 9.700 471 HB2 PHE 52 HB2 PHE 52 -6.938 -9.821 7.609 472 HB3 PHE 52 HB3 PHE 52 -7.006 -10.192 9.322 473 HD1 PHE 52 HD1 PHE 52 -8.726 -8.270 10.579 474 HD2 PHE 52 HD2 PHE 52 -9.039 -10.083 6.681 475 HE1 PHE 52 HE1 PHE 52 -11.180 -7.995 10.653 476 HE2 PHE 52 HE2 PHE 52 -11.500 -9.859 6.791 477 HZ PHE 52 HZ PHE 52 -12.579 -8.790 8.750 478 H LEU 53 H LEU 53 -5.470 -8.593 11.279 479 HA LEU 53 HA LEU 53 -2.848 -9.904 10.541 480 HB2 LEU 53 HB2 LEU 53 -3.620 -7.995 12.756 481 HB3 LEU 53 HB3 LEU 53 -2.530 -9.296 13.153 482 HG LEU 53 HG LEU 53 -0.850 -8.553 11.632 483 HD11 LEU 53 HD11 LEU 53 -2.754 -6.349 10.762 484 HD12 LEU 53 HD12 LEU 53 -1.032 -6.407 10.379 485 HD13 LEU 53 HD13 LEU 53 -2.106 -7.659 9.757 486 HD21 LEU 53 HD21 LEU 53 -2.029 -6.293 13.308 487 HD22 LEU 53 HD22 LEU 53 -0.944 -7.565 13.882 488 HD23 LEU 53 HD23 LEU 53 -0.348 -6.355 12.750 489 H VAL 54 H VAL 54 -3.007 -12.055 10.863 490 HA VAL 54 HA VAL 54 -4.998 -13.017 12.866 491 HB VAL 54 HB VAL 54 -4.350 -14.612 10.431 492 HG11 VAL 54 HG11 VAL 54 -6.770 -14.500 12.296 493 HG12 VAL 54 HG12 VAL 54 -6.510 -15.643 10.956 494 HG13 VAL 54 HG13 VAL 54 -5.463 -15.706 12.385 495 HG21 VAL 54 HG21 VAL 54 -6.438 -13.758 9.429 496 HG22 VAL 54 HG22 VAL 54 -6.582 -12.558 10.736 497 HG23 VAL 54 HG23 VAL 54 -5.237 -12.472 9.581 498 HA PRO 55 HA PRO 55 -1.515 -15.093 14.813 499 HB2 PRO 55 HB2 PRO 55 -3.712 -16.526 16.302 500 HB3 PRO 55 HB3 PRO 55 -2.239 -15.732 16.944 501 HG2 PRO 55 HG2 PRO 55 -4.659 -14.544 17.158 502 HG3 PRO 55 HG3 PRO 55 -3.205 -13.579 16.725 503 HD2 PRO 55 HD2 PRO 55 -5.350 -14.678 14.893 504 HD3 PRO 55 HD3 PRO 55 -4.617 -13.044 14.938 505 H ASP 56 H ASP 56 -0.444 -16.999 14.364 506 HA ASP 56 HA ASP 56 -1.094 -18.543 12.216 507 HB2 ASP 56 HB2 ASP 56 1.095 -18.609 12.721 508 HB3 ASP 56 HB3 ASP 56 0.829 -18.769 14.450 509 H HIS 57 H HIS 57 -2.032 -19.463 15.493 510 HA HIS 57 HA HIS 57 -2.959 -22.109 14.714 511 HB2 HIS 57 HB2 HIS 57 -2.895 -20.483 17.250 512 HB3 HIS 57 HB3 HIS 57 -4.053 -21.795 17.153 513 HD1 HIS 57 HD1 HIS 57 -0.366 -21.947 15.809 514 HD2 HIS 57 HD2 HIS 57 -3.003 -23.557 18.711 515 HE1 HIS 57 HE1 HIS 57 0.927 -23.793 17.031 516 HE2 HIS 57 HE2 HIS 57 -0.682 -24.790 18.780 517 H VAL 58 H VAL 58 -4.478 -19.164 14.072 518 HA VAL 58 HA VAL 58 -7.254 -19.947 14.547 519 HB VAL 58 HB VAL 58 -6.004 -17.869 12.732 520 HG11 VAL 58 HG11 VAL 58 -8.293 -16.863 12.594 521 HG12 VAL 58 HG12 VAL 58 -8.165 -18.407 11.747 522 HG13 VAL 58 HG13 VAL 58 -8.952 -18.324 13.344 523 HG21 VAL 58 HG21 VAL 58 -6.930 -16.293 14.432 524 HG22 VAL 58 HG22 VAL 58 -7.502 -17.670 15.388 525 HG23 VAL 58 HG23 VAL 58 -5.757 -17.409 15.153 526 H ASN 59 H ASN 59 -8.460 -21.366 13.405 527 HA ASN 59 HA ASN 59 -7.489 -22.672 10.985 528 HB2 ASN 59 HB2 ASN 59 -10.257 -22.725 12.281 529 HB3 ASN 59 HB3 ASN 59 -9.643 -23.868 11.098 530 HD21 ASN 59 HD21 ASN 59 -7.862 -25.769 13.521 531 HD22 ASN 59 HD22 ASN 59 -8.124 -25.490 11.797 532 H MET 60 H MET 60 -8.380 -22.472 8.832 533 HA MET 60 HA MET 60 -9.202 -19.913 7.952 534 HB2 MET 60 HB2 MET 60 -8.187 -21.661 6.547 535 HB3 MET 60 HB3 MET 60 -9.648 -22.647 6.693 536 HG2 MET 60 HG2 MET 60 -9.651 -21.533 4.546 537 HG3 MET 60 HG3 MET 60 -10.956 -20.887 5.539 538 HE1 MET 60 HE1 MET 60 -10.501 -17.452 4.209 539 HE2 MET 60 HE2 MET 60 -11.024 -19.025 3.557 540 HE3 MET 60 HE3 MET 60 -11.506 -18.530 5.196 541 H SER 61 H SER 61 -11.248 -22.709 8.852 542 HA SER 61 HA SER 61 -13.809 -21.551 8.390 543 HB2 SER 61 HB2 SER 61 -14.519 -23.270 10.077 544 HB3 SER 61 HB3 SER 61 -13.518 -23.915 8.762 545 HG SER 61 HG SER 61 -12.907 -24.597 10.951 546 H GLU 62 H GLU 62 -11.623 -21.339 11.221 547 HA GLU 62 HA GLU 62 -13.480 -19.872 12.877 548 HB2 GLU 62 HB2 GLU 62 -11.640 -21.209 13.816 549 HB3 GLU 62 HB3 GLU 62 -10.466 -20.164 13.037 550 HG2 GLU 62 HG2 GLU 62 -10.548 -19.569 15.322 551 HG3 GLU 62 HG3 GLU 62 -11.237 -18.242 14.404 552 H LEU 63 H LEU 63 -10.828 -18.805 10.680 553 HA LEU 63 HA LEU 63 -11.186 -15.989 11.085 554 HB2 LEU 63 HB2 LEU 63 -9.258 -16.914 9.852 555 HB3 LEU 63 HB3 LEU 63 -10.337 -17.528 8.599 556 HG LEU 63 HG LEU 63 -11.012 -15.136 8.073 557 HD11 LEU 63 HD11 LEU 63 -9.481 -13.333 8.857 558 HD12 LEU 63 HD12 LEU 63 -10.395 -14.038 10.198 559 HD13 LEU 63 HD13 LEU 63 -8.698 -14.491 9.962 560 HD21 LEU 63 HD21 LEU 63 -9.291 -16.371 6.788 561 HD22 LEU 63 HD22 LEU 63 -9.002 -14.624 6.814 562 HD23 LEU 63 HD23 LEU 63 -8.034 -15.693 7.862 563 H ILE 64 H ILE 64 -12.771 -18.213 8.741 564 HA ILE 64 HA ILE 64 -14.638 -16.359 7.663 565 HB ILE 64 HB ILE 64 -14.435 -19.321 7.928 566 HG12 ILE 64 HG12 ILE 64 -15.075 -17.545 5.572 567 HG13 ILE 64 HG13 ILE 64 -13.437 -17.911 6.145 568 HG21 ILE 64 HG21 ILE 64 -17.081 -18.037 7.133 569 HG22 ILE 64 HG22 ILE 64 -16.661 -19.748 6.920 570 HG23 ILE 64 HG23 ILE 64 -16.810 -19.099 8.540 571 HD11 ILE 64 HD11 ILE 64 -15.416 -19.924 5.061 572 HD12 ILE 64 HD12 ILE 64 -13.927 -19.356 4.290 573 HD13 ILE 64 HD13 ILE 64 -13.831 -20.333 5.772 574 H LYS 65 H LYS 65 -14.932 -18.266 10.691 575 HA LYS 65 HA LYS 65 -17.543 -17.337 11.334 576 HB2 LYS 65 HB2 LYS 65 -16.320 -19.312 12.311 577 HB3 LYS 65 HB3 LYS 65 -15.380 -18.186 13.302 578 HG2 LYS 65 HG2 LYS 65 -17.495 -17.344 14.325 579 HG3 LYS 65 HG3 LYS 65 -18.412 -18.487 13.315 580 HD2 LYS 65 HD2 LYS 65 -17.227 -20.386 14.399 581 HD3 LYS 65 HD3 LYS 65 -16.294 -19.237 15.385 582 HE2 LYS 65 HE2 LYS 65 -18.398 -18.401 16.410 583 HE3 LYS 65 HE3 LYS 65 -19.333 -19.537 15.430 584 HZ1 LYS 65 HZ1 LYS 65 -18.917 -20.419 17.668 585 HZ2 LYS 65 HZ2 LYS 65 -18.171 -21.372 16.573 586 HZ3 LYS 65 HZ3 LYS 65 -17.301 -20.319 17.472 587 H ILE 66 H ILE 66 -14.388 -15.886 12.410 588 HA ILE 66 HA ILE 66 -15.749 -13.755 13.821 589 HB ILE 66 HB ILE 66 -13.601 -14.151 14.536 590 HG12 ILE 66 HG12 ILE 66 -14.329 -11.725 14.486 591 HG13 ILE 66 HG13 ILE 66 -12.642 -12.080 14.760 592 HG21 ILE 66 HG21 ILE 66 -12.467 -15.141 12.695 593 HG22 ILE 66 HG22 ILE 66 -12.515 -13.642 11.745 594 HG23 ILE 66 HG23 ILE 66 -11.522 -13.764 13.220 595 HD11 ILE 66 HD11 ILE 66 -12.751 -10.129 13.395 596 HD12 ILE 66 HD12 ILE 66 -12.081 -11.425 12.420 597 HD13 ILE 66 HD13 ILE 66 -13.774 -10.921 12.198 598 H ILE 67 H ILE 67 -14.574 -13.885 10.428 599 HA ILE 67 HA ILE 67 -15.431 -11.207 9.784 600 HB ILE 67 HB ILE 67 -14.810 -13.689 8.184 601 HG12 ILE 67 HG12 ILE 67 -13.153 -12.268 7.123 602 HG13 ILE 67 HG13 ILE 67 -13.798 -10.825 7.895 603 HG21 ILE 67 HG21 ILE 67 -15.262 -12.419 6.058 604 HG22 ILE 67 HG22 ILE 67 -16.733 -12.833 6.928 605 HG23 ILE 67 HG23 ILE 67 -16.085 -11.177 7.005 606 HD11 ILE 67 HD11 ILE 67 -12.445 -13.110 9.376 607 HD12 ILE 67 HD12 ILE 67 -11.636 -11.651 8.858 608 HD13 ILE 67 HD13 ILE 67 -12.922 -11.539 10.062 609 H ARG 68 H ARG 68 -17.232 -14.311 9.475 610 HA ARG 68 HA ARG 68 -19.646 -13.182 8.495 611 HB2 ARG 68 HB2 ARG 68 -18.975 -15.620 8.514 612 HB3 ARG 68 HB3 ARG 68 -19.336 -15.672 10.241 613 HG2 ARG 68 HG2 ARG 68 -21.720 -14.952 9.652 614 HG3 ARG 68 HG3 ARG 68 -21.245 -15.092 7.947 615 HD2 ARG 68 HD2 ARG 68 -22.468 -17.040 8.591 616 HD3 ARG 68 HD3 ARG 68 -20.784 -17.475 8.248 617 HE ARG 68 HE ARG 68 -21.702 -16.982 11.066 618 HH11 ARG 68 HH11 ARG 68 -21.351 -18.553 12.589 619 HH12 ARG 68 HH12 ARG 68 -20.789 -20.123 12.107 620 HH21 ARG 68 HH21 ARG 68 -20.623 -19.398 8.760 621 HH22 ARG 68 HH22 ARG 68 -20.366 -20.592 10.001 622 H ARG 69 H ARG 69 -18.732 -13.844 11.876 623 HA ARG 69 HA ARG 69 -21.158 -12.845 13.054 624 HB2 ARG 69 HB2 ARG 69 -19.622 -14.431 14.134 625 HB3 ARG 69 HB3 ARG 69 -18.357 -13.215 14.190 626 HG2 ARG 69 HG2 ARG 69 -19.335 -13.515 16.364 627 HG3 ARG 69 HG3 ARG 69 -19.661 -11.876 15.821 628 HD2 ARG 69 HD2 ARG 69 -21.695 -14.115 15.477 629 HD3 ARG 69 HD3 ARG 69 -21.521 -13.241 17.011 630 HE ARG 69 HE ARG 69 -21.810 -11.244 15.056 631 HH11 ARG 69 HH11 ARG 69 -23.820 -13.832 16.305 632 HH12 ARG 69 HH12 ARG 69 -25.292 -12.937 16.052 633 HH21 ARG 69 HH21 ARG 69 -23.710 -10.134 14.818 634 HH22 ARG 69 HH22 ARG 69 -25.222 -10.891 15.224 635 H ARG 70 H ARG 70 -17.986 -11.200 12.585 636 HA ARG 70 HA ARG 70 -18.888 -8.716 13.822 637 HB2 ARG 70 HB2 ARG 70 -16.521 -9.369 12.004 638 HB3 ARG 70 HB3 ARG 70 -16.783 -7.783 12.710 639 HG2 ARG 70 HG2 ARG 70 -16.395 -10.335 14.339 640 HG3 ARG 70 HG3 ARG 70 -15.154 -9.138 13.973 641 HD2 ARG 70 HD2 ARG 70 -16.652 -7.399 15.104 642 HD3 ARG 70 HD3 ARG 70 -17.645 -8.735 15.679 643 HE ARG 70 HE ARG 70 -14.773 -8.169 16.323 644 HH11 ARG 70 HH11 ARG 70 -17.756 -9.733 17.368 645 HH12 ARG 70 HH12 ARG 70 -17.105 -10.097 18.939 646 HH21 ARG 70 HH21 ARG 70 -14.012 -8.715 18.335 647 HH22 ARG 70 HH22 ARG 70 -15.057 -9.515 19.472 648 H LEU 71 H LEU 71 -18.911 -9.785 10.441 649 HA LEU 71 HA LEU 71 -20.101 -7.215 9.594 650 HB2 LEU 71 HB2 LEU 71 -19.521 -9.713 7.985 651 HB3 LEU 71 HB3 LEU 71 -20.009 -8.145 7.343 652 HG LEU 71 HG LEU 71 -17.383 -8.759 8.777 653 HD11 LEU 71 HD11 LEU 71 -17.666 -9.569 6.388 654 HD12 LEU 71 HD12 LEU 71 -17.904 -7.871 5.935 655 HD13 LEU 71 HD13 LEU 71 -16.358 -8.386 6.630 656 HD21 LEU 71 HD21 LEU 71 -18.420 -6.147 7.605 657 HD22 LEU 71 HD22 LEU 71 -17.981 -6.454 9.307 658 HD23 LEU 71 HD23 LEU 71 -16.732 -6.446 8.056 659 H GLN 72 H GLN 72 -21.444 -9.545 11.332 660 HA GLN 72 HA GLN 72 -23.534 -10.221 11.788 661 HB2 GLN 72 HB2 GLN 72 -24.352 -7.615 10.449 662 HB3 GLN 72 HB3 GLN 72 -25.276 -8.552 11.633 663 HG2 GLN 72 HG2 GLN 72 -23.240 -8.244 13.215 664 HG3 GLN 72 HG3 GLN 72 -22.712 -6.987 12.087 665 HE21 GLN 72 HE21 GLN 72 -25.593 -4.861 12.924 666 HE22 GLN 72 HE22 GLN 72 -24.548 -5.270 11.574 667 H LEU 73 H LEU 73 -22.563 -11.460 9.478 668 HA LEU 73 HA LEU 73 -24.680 -11.518 7.432 669 HB2 LEU 73 HB2 LEU 73 -22.156 -13.142 7.786 670 HB3 LEU 73 HB3 LEU 73 -23.202 -13.195 6.364 671 HG LEU 73 HG LEU 73 -21.576 -10.804 7.344 672 HD11 LEU 73 HD11 LEU 73 -20.282 -12.719 6.331 673 HD12 LEU 73 HD12 LEU 73 -21.240 -12.516 4.856 674 HD13 LEU 73 HD13 LEU 73 -20.177 -11.208 5.425 675 HD21 LEU 73 HD21 LEU 73 -23.324 -11.132 4.854 676 HD22 LEU 73 HD22 LEU 73 -23.574 -9.981 6.192 677 HD23 LEU 73 HD23 LEU 73 -22.172 -9.807 5.136 678 H ASN 74 H ASN 74 -26.508 -12.216 8.436 679 HA ASN 74 HA ASN 74 -26.795 -14.576 10.034 680 HB2 ASN 74 HB2 ASN 74 -28.379 -12.664 9.995 681 HB3 ASN 74 HB3 ASN 74 -28.790 -13.013 8.318 682 HD21 ASN 74 HD21 ASN 74 -30.721 -14.996 11.243 683 HD22 ASN 74 HD22 ASN 74 -29.558 -13.731 11.612 684 H ALA 75 H ALA 75 -27.605 -16.672 9.475 685 HA ALA 75 HA ALA 75 -26.464 -17.864 7.211 686 HB1 ALA 75 HB1 ALA 75 -27.712 -19.864 7.948 687 HB2 ALA 75 HB2 ALA 75 -27.019 -19.008 9.334 688 HB3 ALA 75 HB3 ALA 75 -28.754 -18.852 8.974 689 H ASN 76 H ASN 76 -29.582 -16.265 7.337 690 HA ASN 76 HA ASN 76 -30.718 -17.488 4.963 691 HB2 ASN 76 HB2 ASN 76 -31.274 -14.883 6.449 692 HB3 ASN 76 HB3 ASN 76 -32.162 -15.390 5.022 693 HD21 ASN 76 HD21 ASN 76 -33.084 -17.127 8.556 694 HD22 ASN 76 HD22 ASN 76 -31.749 -15.974 8.447 695 H GLN 77 H GLN 77 -28.200 -15.074 5.363 696 HA GLN 77 HA GLN 77 -28.429 -14.049 2.602 697 HB2 GLN 77 HB2 GLN 77 -26.208 -13.643 4.649 698 HB3 GLN 77 HB3 GLN 77 -26.412 -12.790 3.125 699 HG2 GLN 77 HG2 GLN 77 -28.144 -12.578 5.616 700 HG3 GLN 77 HG3 GLN 77 -27.096 -11.344 4.914 701 HE21 GLN 77 HE21 GLN 77 -29.466 -10.605 2.219 702 HE22 GLN 77 HE22 GLN 77 -27.741 -10.635 2.561 703 H ALA 78 H ALA 78 -27.228 -14.759 0.873 704 HA ALA 78 HA ALA 78 -25.559 -17.163 1.112 705 HB1 ALA 78 HB1 ALA 78 -26.045 -15.283 -1.231 706 HB2 ALA 78 HB2 ALA 78 -25.218 -16.852 -1.300 707 HB3 ALA 78 HB3 ALA 78 -26.938 -16.783 -0.886 708 H PHE 79 H PHE 79 -23.332 -17.232 1.219 709 HA PHE 79 HA PHE 79 -21.725 -14.828 0.967 710 HB2 PHE 79 HB2 PHE 79 -22.341 -14.202 3.048 711 HB3 PHE 79 HB3 PHE 79 -22.515 -15.843 3.630 712 HD1 PHE 79 HD1 PHE 79 -20.940 -16.722 5.098 713 HD2 PHE 79 HD2 PHE 79 -19.795 -13.494 2.483 714 HE1 PHE 79 HE1 PHE 79 -18.736 -16.591 6.224 715 HE2 PHE 79 HE2 PHE 79 -17.583 -13.360 3.627 716 HZ PHE 79 HZ PHE 79 -17.052 -14.918 5.488 717 H PHE 80 H PHE 80 -19.749 -15.035 0.360 718 HA PHE 80 HA PHE 80 -18.241 -17.514 0.958 719 HB2 PHE 80 HB2 PHE 80 -18.528 -16.196 -1.763 720 HB3 PHE 80 HB3 PHE 80 -17.304 -17.388 -1.358 721 HD1 PHE 80 HD1 PHE 80 -20.851 -16.862 -2.086 722 HD2 PHE 80 HD2 PHE 80 -17.880 -19.769 -0.923 723 HE1 PHE 80 HE1 PHE 80 -22.419 -18.692 -2.673 724 HE2 PHE 80 HE2 PHE 80 -19.458 -21.600 -1.497 725 HZ PHE 80 HZ PHE 80 -21.728 -21.069 -2.367 726 H LEU 81 H LEU 81 -16.315 -17.189 1.809 727 HA LEU 81 HA LEU 81 -14.874 -14.620 1.297 728 HB2 LEU 81 HB2 LEU 81 -15.300 -15.022 3.633 729 HB3 LEU 81 HB3 LEU 81 -14.637 -16.651 3.540 730 HG LEU 81 HG LEU 81 -12.394 -15.860 3.316 731 HD11 LEU 81 HD11 LEU 81 -11.885 -13.375 3.264 732 HD12 LEU 81 HD12 LEU 81 -12.696 -13.922 1.791 733 HD13 LEU 81 HD13 LEU 81 -13.622 -13.064 3.042 734 HD21 LEU 81 HD21 LEU 81 -12.078 -14.500 5.327 735 HD22 LEU 81 HD22 LEU 81 -13.805 -14.075 5.342 736 HD23 LEU 81 HD23 LEU 81 -13.291 -15.751 5.610 737 H LEU 82 H LEU 82 -14.058 -15.000 -0.666 738 HA LEU 82 HA LEU 82 -13.041 -17.624 -1.492 739 HB2 LEU 82 HB2 LEU 82 -13.334 -14.978 -2.956 740 HB3 LEU 82 HB3 LEU 82 -12.915 -16.507 -3.717 741 HG LEU 82 HG LEU 82 -15.566 -15.931 -2.305 742 HD11 LEU 82 HD11 LEU 82 -15.303 -14.552 -4.324 743 HD12 LEU 82 HD12 LEU 82 -14.908 -16.002 -5.274 744 HD13 LEU 82 HD13 LEU 82 -16.521 -15.814 -4.556 745 HD21 LEU 82 HD21 LEU 82 -15.055 -18.331 -2.347 746 HD22 LEU 82 HD22 LEU 82 -16.332 -17.971 -3.514 747 HD23 LEU 82 HD23 LEU 82 -14.682 -18.242 -4.096 748 H VAL 83 H VAL 83 -11.038 -18.111 -0.792 749 HA VAL 83 HA VAL 83 -8.899 -16.144 -0.463 750 HB VAL 83 HB VAL 83 -8.614 -19.160 -0.486 751 HG11 VAL 83 HG11 VAL 83 -6.648 -18.685 0.909 752 HG12 VAL 83 HG12 VAL 83 -6.502 -17.861 -0.645 753 HG13 VAL 83 HG13 VAL 83 -6.967 -16.933 0.799 754 HG21 VAL 83 HG21 VAL 83 -9.388 -17.297 1.791 755 HG22 VAL 83 HG22 VAL 83 -10.269 -18.718 1.206 756 HG23 VAL 83 HG23 VAL 83 -8.725 -18.931 2.034 757 H ASN 84 H ASN 84 -7.591 -15.386 -2.030 758 HA ASN 84 HA ASN 84 -6.964 -14.916 -4.165 759 HB2 ASN 84 HB2 ASN 84 -5.310 -16.535 -3.209 760 HB3 ASN 84 HB3 ASN 84 -6.149 -17.842 -4.055 761 HD21 ASN 84 HD21 ASN 84 -3.570 -17.265 -6.428 762 HD22 ASN 84 HD22 ASN 84 -4.111 -18.273 -5.071 763 H GLY 85 H GLY 85 -9.719 -15.363 -4.166 764 HA2 GLY 85 HA2 GLY 85 -11.347 -15.331 -5.813 765 HA3 GLY 85 HA3 GLY 85 -10.190 -15.948 -6.984 766 H HIS 86 H HIS 86 -10.264 -18.124 -4.324 767 HA HIS 86 HA HIS 86 -12.554 -19.689 -5.465 768 HB2 HIS 86 HB2 HIS 86 -10.365 -20.502 -6.345 769 HB3 HIS 86 HB3 HIS 86 -9.833 -20.835 -4.704 770 HD1 HIS 86 HD1 HIS 86 -10.553 -23.230 -3.777 771 HD2 HIS 86 HD2 HIS 86 -12.714 -21.887 -7.157 772 HE1 HIS 86 HE1 HIS 86 -12.083 -25.170 -4.477 773 HE2 HIS 86 HE2 HIS 86 -13.384 -24.355 -6.549 774 H SER 87 H SER 87 -13.586 -21.211 -4.065 775 HA SER 87 HA SER 87 -13.974 -20.150 -1.399 776 HB2 SER 87 HB2 SER 87 -15.814 -21.111 -2.703 777 HB3 SER 87 HB3 SER 87 -15.029 -22.701 -2.668 778 HG SER 87 HG SER 87 -16.581 -22.521 -1.003 779 H MET 88 H MET 88 -13.488 -20.930 0.578 780 HA MET 88 HA MET 88 -12.120 -23.555 0.876 781 HB2 MET 88 HB2 MET 88 -11.099 -20.963 2.118 782 HB3 MET 88 HB3 MET 88 -10.557 -22.586 2.556 783 HG2 MET 88 HG2 MET 88 -9.945 -22.940 0.121 784 HG3 MET 88 HG3 MET 88 -10.147 -21.190 -0.085 785 HE1 MET 88 HE1 MET 88 -7.510 -23.091 -0.607 786 HE2 MET 88 HE2 MET 88 -7.561 -21.366 -1.035 787 HE3 MET 88 HE3 MET 88 -6.226 -22.001 -0.051 788 H VAL 89 H VAL 89 -14.931 -22.480 1.439 789 HA VAL 89 HA VAL 89 -15.173 -21.971 4.234 790 HB VAL 89 HB VAL 89 -17.337 -23.032 2.386 791 HG11 VAL 89 HG11 VAL 89 -18.885 -21.776 3.889 792 HG12 VAL 89 HG12 VAL 89 -18.081 -23.101 4.723 793 HG13 VAL 89 HG13 VAL 89 -17.529 -21.423 4.978 794 HG21 VAL 89 HG21 VAL 89 -16.557 -20.139 2.984 795 HG22 VAL 89 HG22 VAL 89 -16.326 -20.970 1.433 796 HG23 VAL 89 HG23 VAL 89 -17.953 -20.668 2.028 797 H SER 90 H SER 90 -15.157 -25.061 2.561 798 HA SER 90 HA SER 90 -16.068 -26.642 4.816 799 HB2 SER 90 HB2 SER 90 -16.290 -27.288 2.431 800 HB3 SER 90 HB3 SER 90 -14.527 -27.430 2.315 801 HG SER 90 HG SER 90 -16.334 -29.026 3.837 802 H VAL 91 H VAL 91 -12.916 -25.258 4.103 803 HA VAL 91 HA VAL 91 -11.483 -27.500 5.242 804 HB VAL 91 HB VAL 91 -9.536 -26.806 4.448 805 HG11 VAL 91 HG11 VAL 91 -9.818 -26.110 2.164 806 HG12 VAL 91 HG12 VAL 91 -11.171 -27.164 2.599 807 HG13 VAL 91 HG13 VAL 91 -11.407 -25.400 2.502 808 HG21 VAL 91 HG21 VAL 91 -10.494 -23.933 4.482 809 HG22 VAL 91 HG22 VAL 91 -9.194 -24.658 5.449 810 HG23 VAL 91 HG23 VAL 91 -8.983 -24.469 3.711 811 H SER 92 H SER 92 -10.508 -27.859 7.082 812 HA SER 92 HA SER 92 -10.803 -25.982 9.329 813 HB2 SER 92 HB2 SER 92 -9.914 -27.873 10.637 814 HB3 SER 92 HB3 SER 92 -11.302 -28.347 9.643 815 HG SER 92 HG SER 92 -9.568 -29.865 9.502 816 H THR 93 H THR 93 -8.437 -26.418 6.935 817 HA THR 93 HA THR 93 -6.048 -26.544 8.015 818 HB THR 93 HB THR 93 -6.468 -24.537 5.837 819 HG1 THR 93 HG1 THR 93 -6.621 -26.386 4.451 820 HG21 THR 93 HG21 THR 93 -4.144 -24.977 6.438 821 HG22 THR 93 HG22 THR 93 -4.397 -26.731 6.254 822 HG23 THR 93 HG23 THR 93 -4.502 -25.647 4.846 823 HA PRO 94 HA PRO 94 -5.102 -22.991 10.603 824 HB2 PRO 94 HB2 PRO 94 -2.265 -23.699 9.847 825 HB3 PRO 94 HB3 PRO 94 -2.936 -23.292 11.458 826 HG2 PRO 94 HG2 PRO 94 -2.461 -25.872 10.808 827 HG3 PRO 94 HG3 PRO 94 -3.992 -25.437 11.634 828 HD2 PRO 94 HD2 PRO 94 -3.522 -25.916 8.675 829 HD3 PRO 94 HD3 PRO 94 -4.823 -26.542 9.734 830 H ILE 95 H ILE 95 -4.797 -20.825 10.210 831 HA ILE 95 HA ILE 95 -4.894 -19.960 7.544 832 HB ILE 95 HB ILE 95 -5.875 -18.811 9.531 833 HG12 ILE 95 HG12 ILE 95 -5.512 -16.489 8.838 834 HG13 ILE 95 HG13 ILE 95 -4.116 -16.947 7.868 835 HG21 ILE 95 HG21 ILE 95 -3.882 -18.928 11.051 836 HG22 ILE 95 HG22 ILE 95 -3.065 -17.715 10.038 837 HG23 ILE 95 HG23 ILE 95 -4.537 -17.302 10.912 838 HD11 ILE 95 HD11 ILE 95 -6.233 -16.615 6.563 839 HD12 ILE 95 HD12 ILE 95 -5.554 -18.231 6.345 840 HD13 ILE 95 HD13 ILE 95 -6.958 -17.992 7.412 841 H SER 96 H SER 96 -2.033 -20.394 9.544 842 HA SER 96 HA SER 96 -0.194 -18.885 7.907 843 HB2 SER 96 HB2 SER 96 1.516 -20.236 9.106 844 HB3 SER 96 HB3 SER 96 0.361 -19.423 10.172 845 HG SER 96 HG SER 96 0.573 -21.452 10.902 846 H GLU 97 H GLU 97 -1.269 -22.307 7.829 847 HA GLU 97 HA GLU 97 0.499 -23.038 5.623 848 HB2 GLU 97 HB2 GLU 97 -2.015 -24.365 6.706 849 HB3 GLU 97 HB3 GLU 97 -0.942 -25.038 5.461 850 HG2 GLU 97 HG2 GLU 97 0.955 -24.850 7.127 851 HG3 GLU 97 HG3 GLU 97 -0.241 -24.427 8.362 852 H VAL 98 H VAL 98 -2.909 -21.936 5.829 853 HA VAL 98 HA VAL 98 -3.398 -21.934 2.975 854 HB VAL 98 HB VAL 98 -4.591 -20.139 5.115 855 HG11 VAL 98 HG11 VAL 98 -5.571 -20.796 2.306 856 HG12 VAL 98 HG12 VAL 98 -6.483 -19.882 3.527 857 HG13 VAL 98 HG13 VAL 98 -4.988 -19.218 2.868 858 HG21 VAL 98 HG21 VAL 98 -6.511 -21.729 5.007 859 HG22 VAL 98 HG22 VAL 98 -5.563 -22.779 3.939 860 HG23 VAL 98 HG23 VAL 98 -5.045 -22.505 5.614 861 H TYR 99 H TYR 99 -1.993 -19.459 5.158 862 HA TYR 99 HA TYR 99 -1.481 -17.506 3.214 863 HB2 TYR 99 HB2 TYR 99 -1.335 -16.711 5.305 864 HB3 TYR 99 HB3 TYR 99 -0.382 -18.048 5.903 865 HD1 TYR 99 HD1 TYR 99 -0.225 -14.704 4.497 866 HD2 TYR 99 HD2 TYR 99 2.067 -18.245 5.435 867 HE1 TYR 99 HE1 TYR 99 1.868 -13.393 4.384 868 HE2 TYR 99 HE2 TYR 99 4.167 -16.918 5.287 869 HH TYR 99 HH TYR 99 4.163 -13.442 4.402 870 H GLU 100 H GLU 100 0.759 -20.163 4.055 871 HA GLU 100 HA GLU 100 2.661 -19.337 2.055 872 HB2 GLU 100 HB2 GLU 100 3.283 -20.708 3.976 873 HB3 GLU 100 HB3 GLU 100 2.165 -21.970 3.475 874 HG2 GLU 100 HG2 GLU 100 4.400 -22.640 2.982 875 HG3 GLU 100 HG3 GLU 100 3.502 -22.454 1.491 876 H SER 101 H SER 101 -0.155 -21.521 1.930 877 HA SER 101 HA SER 101 0.377 -22.607 -0.670 878 HB2 SER 101 HB2 SER 101 -1.088 -23.643 1.013 879 HB3 SER 101 HB3 SER 101 -2.244 -22.311 0.835 880 HG SER 101 HG SER 101 -2.714 -24.253 -0.438 881 H GLU 102 H GLU 102 -1.576 -19.776 0.328 882 HA GLU 102 HA GLU 102 -2.034 -19.069 -2.545 883 HB2 GLU 102 HB2 GLU 102 -3.822 -18.634 -0.134 884 HB3 GLU 102 HB3 GLU 102 -4.154 -18.013 -1.744 885 HG2 GLU 102 HG2 GLU 102 -3.951 -20.950 -0.983 886 HG3 GLU 102 HG3 GLU 102 -5.427 -20.028 -1.236 887 H LYS 103 H LYS 103 0.284 -18.249 -1.070 888 HA LYS 103 HA LYS 103 0.133 -15.567 -0.151 889 HB2 LYS 103 HB2 LYS 103 1.987 -17.475 0.002 890 HB3 LYS 103 HB3 LYS 103 2.624 -16.726 -1.447 891 HG2 LYS 103 HG2 LYS 103 3.061 -14.672 -0.302 892 HG3 LYS 103 HG3 LYS 103 1.996 -15.091 1.045 893 HD2 LYS 103 HD2 LYS 103 4.304 -15.315 1.777 894 HD3 LYS 103 HD3 LYS 103 3.504 -16.888 1.763 895 HE2 LYS 103 HE2 LYS 103 4.566 -17.327 -0.510 896 HE3 LYS 103 HE3 LYS 103 5.460 -15.812 -0.331 897 HZ1 LYS 103 HZ1 LYS 103 6.796 -17.686 0.412 898 HZ2 LYS 103 HZ2 LYS 103 6.448 -16.787 1.728 899 HZ3 LYS 103 HZ3 LYS 103 5.653 -18.206 1.456 900 H ASP 104 H ASP 104 0.100 -13.635 -1.160 901 HA ASP 104 HA ASP 104 0.417 -13.488 -4.122 902 HB2 ASP 104 HB2 ASP 104 -1.767 -12.807 -3.093 903 HB3 ASP 104 HB3 ASP 104 -0.915 -11.516 -2.239 904 H GLU 105 H GLU 105 1.365 -11.596 -4.945 905 HA GLU 105 HA GLU 105 3.734 -11.411 -5.351 906 HB2 GLU 105 HB2 GLU 105 2.234 -9.612 -6.015 907 HB3 GLU 105 HB3 GLU 105 2.396 -8.852 -4.442 908 HG2 GLU 105 HG2 GLU 105 3.723 -7.645 -6.021 909 HG3 GLU 105 HG3 GLU 105 4.807 -8.418 -4.878 910 H ASP 106 H ASP 106 3.508 -9.132 -2.580 911 HA ASP 106 HA ASP 106 6.336 -9.579 -2.141 912 HB2 ASP 106 HB2 ASP 106 5.714 -7.374 -2.063 913 HB3 ASP 106 HB3 ASP 106 4.341 -7.678 -1.005 914 H GLY 107 H GLY 107 3.646 -11.104 -0.749 915 HA2 GLY 107 HA2 GLY 107 4.329 -13.065 0.692 916 HA3 GLY 107 HA3 GLY 107 5.219 -11.926 1.693 917 H PHE 108 H PHE 108 1.875 -11.757 0.323 918 HA PHE 108 HA PHE 108 0.797 -11.833 3.079 919 HB2 PHE 108 HB2 PHE 108 -0.886 -10.091 2.501 920 HB3 PHE 108 HB3 PHE 108 0.761 -9.549 2.726 921 HD1 PHE 108 HD1 PHE 108 2.144 -8.742 0.785 922 HD2 PHE 108 HD2 PHE 108 -1.981 -9.932 0.337 923 HE1 PHE 108 HE1 PHE 108 2.036 -7.567 -1.405 924 HE2 PHE 108 HE2 PHE 108 -2.070 -8.779 -1.858 925 HZ PHE 108 HZ PHE 108 -0.056 -7.605 -2.732 926 H LEU 109 H LEU 109 -1.423 -12.526 3.382 927 HA LEU 109 HA LEU 109 -2.276 -14.366 1.188 928 HB2 LEU 109 HB2 LEU 109 -2.069 -15.338 3.372 929 HB3 LEU 109 HB3 LEU 109 -3.093 -14.096 4.083 930 HG LEU 109 HG LEU 109 -5.040 -14.952 2.808 931 HD11 LEU 109 HD11 LEU 109 -3.054 -17.036 1.798 932 HD12 LEU 109 HD12 LEU 109 -4.806 -17.214 1.717 933 HD13 LEU 109 HD13 LEU 109 -4.020 -15.918 0.820 934 HD21 LEU 109 HD21 LEU 109 -4.539 -15.814 5.065 935 HD22 LEU 109 HD22 LEU 109 -5.275 -17.073 4.050 936 HD23 LEU 109 HD23 LEU 109 -3.535 -17.097 4.369 937 H TYR 110 H TYR 110 -3.848 -13.790 -0.197 938 HA TYR 110 HA TYR 110 -5.592 -11.510 0.532 939 HB2 TYR 110 HB2 TYR 110 -4.167 -10.608 -0.938 940 HB3 TYR 110 HB3 TYR 110 -4.078 -12.042 -1.935 941 HD1 TYR 110 HD1 TYR 110 -5.330 -12.259 -3.887 942 HD2 TYR 110 HD2 TYR 110 -6.392 -9.249 -0.978 943 HE1 TYR 110 HE1 TYR 110 -6.918 -11.245 -5.517 944 HE2 TYR 110 HE2 TYR 110 -7.971 -8.228 -2.624 945 HH TYR 110 HH TYR 110 -8.355 -9.507 -5.954 946 H MET 111 H MET 111 -7.700 -11.395 0.323 947 HA MET 111 HA MET 111 -9.128 -13.741 -0.843 948 HB2 MET 111 HB2 MET 111 -9.881 -12.490 1.825 949 HB3 MET 111 HB3 MET 111 -10.486 -13.973 1.081 950 HG2 MET 111 HG2 MET 111 -8.173 -14.955 1.397 951 HG3 MET 111 HG3 MET 111 -7.765 -13.523 2.351 952 HE1 MET 111 HE1 MET 111 -8.119 -16.545 4.878 953 HE2 MET 111 HE2 MET 111 -7.555 -16.596 3.199 954 HE3 MET 111 HE3 MET 111 -7.030 -15.280 4.275 955 H VAL 112 H VAL 112 -11.107 -13.304 -1.749 956 HA VAL 112 HA VAL 112 -12.135 -10.514 -1.557 957 HB VAL 112 HB VAL 112 -12.971 -10.422 -3.663 958 HG11 VAL 112 HG11 VAL 112 -11.061 -10.697 -5.135 959 HG12 VAL 112 HG12 VAL 112 -10.487 -10.175 -3.544 960 HG13 VAL 112 HG13 VAL 112 -10.310 -11.872 -4.040 961 HG21 VAL 112 HG21 VAL 112 -13.951 -12.658 -3.916 962 HG22 VAL 112 HG22 VAL 112 -12.979 -12.222 -5.323 963 HG23 VAL 112 HG23 VAL 112 -12.317 -13.348 -4.126 964 H TYR 113 H TYR 113 -14.315 -10.153 -1.341 965 HA TYR 113 HA TYR 113 -15.781 -12.425 -0.115 966 HB2 TYR 113 HB2 TYR 113 -15.028 -11.470 1.721 967 HB3 TYR 113 HB3 TYR 113 -14.841 -9.897 0.999 968 HD1 TYR 113 HD1 TYR 113 -15.782 -8.342 2.345 969 HD2 TYR 113 HD2 TYR 113 -17.964 -12.011 1.614 970 HE1 TYR 113 HE1 TYR 113 -17.674 -7.485 3.687 971 HE2 TYR 113 HE2 TYR 113 -19.805 -11.154 3.053 972 HH TYR 113 HH TYR 113 -19.788 -7.907 4.519 973 H ALA 114 H ALA 114 -17.675 -12.959 -0.874 974 HA ALA 114 HA ALA 114 -19.368 -10.902 -2.225 975 HB1 ALA 114 HB1 ALA 114 -19.364 -12.247 -4.280 976 HB2 ALA 114 HB2 ALA 114 -17.712 -11.774 -3.868 977 HB3 ALA 114 HB3 ALA 114 -18.259 -13.421 -3.527 978 H SER 115 H SER 115 -21.470 -11.620 -2.805 979 HA SER 115 HA SER 115 -22.717 -13.647 -1.080 980 HB2 SER 115 HB2 SER 115 -23.934 -11.640 -1.570 981 HB3 SER 115 HB3 SER 115 -23.698 -11.836 -3.307 982 HG SER 115 HG SER 115 -25.796 -12.487 -2.665 983 H GLN 116 H GLN 116 -21.430 -13.522 -4.305 984 HA GLN 116 HA GLN 116 -22.538 -16.159 -5.108 985 HB2 GLN 116 HB2 GLN 116 -20.805 -14.290 -6.779 986 HB3 GLN 116 HB3 GLN 116 -21.825 -15.611 -7.308 987 HG2 GLN 116 HG2 GLN 116 -22.868 -13.590 -7.975 988 HG3 GLN 116 HG3 GLN 116 -23.854 -14.301 -6.694 989 HE21 GLN 116 HE21 GLN 116 -21.682 -11.072 -5.308 990 HE22 GLN 116 HE22 GLN 116 -20.834 -12.232 -6.336 991 H GLU 117 H GLU 117 -21.127 -17.916 -5.752 992 HA GLU 117 HA GLU 117 -18.458 -17.962 -4.580 993 HB2 GLU 117 HB2 GLU 117 -18.362 -20.183 -5.214 994 HB3 GLU 117 HB3 GLU 117 -20.029 -19.942 -4.738 995 HG2 GLU 117 HG2 GLU 117 -18.984 -20.117 -7.603 996 HG3 GLU 117 HG3 GLU 117 -19.705 -21.425 -6.693 997 H THR 118 H THR 118 -19.789 -17.217 -7.738 998 HA THR 118 HA THR 118 -17.379 -15.948 -8.568 999 HB THR 118 HB THR 118 -16.846 -18.286 -9.273 1000 HG1 THR 118 HG1 THR 118 -16.120 -17.582 -11.273 1001 HG21 THR 118 HG21 THR 118 -19.029 -17.871 -11.373 1002 HG22 THR 118 HG22 THR 118 -17.906 -19.242 -11.238 1003 HG23 THR 118 HG23 THR 118 -19.147 -18.995 -10.003 1004 H PHE 119 H PHE 119 -17.725 -14.633 -10.558 1005 HA PHE 119 HA PHE 119 -20.494 -14.358 -11.437 1006 HB2 PHE 119 HB2 PHE 119 -20.820 -13.206 -9.453 1007 HB3 PHE 119 HB3 PHE 119 -19.306 -12.338 -9.596 1008 HD1 PHE 119 HD1 PHE 119 -19.100 -10.324 -11.029 1009 HD2 PHE 119 HD2 PHE 119 -22.792 -12.513 -10.697 1010 HE1 PHE 119 HE1 PHE 119 -20.322 -8.404 -12.023 1011 HE2 PHE 119 HE2 PHE 119 -24.025 -10.585 -11.693 1012 HZ PHE 119 HZ PHE 119 -22.782 -8.529 -12.351 1013 H GLY 120 H GLY 120 -17.404 -12.574 -11.625 1014 HA2 GLY 120 HA2 GLY 120 -17.000 -12.964 -14.388 1015 HA3 GLY 120 HA3 GLY 120 -17.875 -11.440 -14.212 1016 H1 ASP 10 H1 ASP 10 -10.346 1.815 16.143 1017 H2 ASP 10 H2 ASP 10 -9.830 1.922 17.694 1018 H3 ASP 10 H3 ASP 10 -10.400 3.261 16.925 1019 HA ASP 10 HA ASP 10 -8.638 3.284 15.387 1020 HB2 ASP 10 HB2 ASP 10 -7.700 3.281 18.250 1021 HB3 ASP 10 HB3 ASP 10 -6.654 3.689 16.888 1022 H TYR 11 H TYR 11 -7.169 0.960 17.720 1023 HA TYR 11 HA TYR 11 -5.492 0.195 15.595 1024 HB2 TYR 11 HB2 TYR 11 -5.589 -0.802 18.402 1025 HB3 TYR 11 HB3 TYR 11 -4.460 -1.430 17.217 1026 HD1 TYR 11 HD1 TYR 11 -4.686 0.861 19.771 1027 HD2 TYR 11 HD2 TYR 11 -3.286 0.643 15.672 1028 HE1 TYR 11 HE1 TYR 11 -3.164 2.785 20.173 1029 HE2 TYR 11 HE2 TYR 11 -1.811 2.565 16.088 1030 HH TYR 11 HH TYR 11 -1.048 4.121 17.603 1031 H GLU 12 H GLU 12 -8.481 -0.922 15.649 1032 HA GLU 12 HA GLU 12 -8.070 -3.551 14.554 1033 HB2 GLU 12 HB2 GLU 12 -10.290 -3.364 13.685 1034 HB3 GLU 12 HB3 GLU 12 -10.267 -2.840 15.355 1035 HG2 GLU 12 HG2 GLU 12 -10.243 -0.929 12.957 1036 HG3 GLU 12 HG3 GLU 12 -11.713 -1.536 13.704 1037 H SER 13 H SER 13 -7.137 -0.525 13.349 1038 HA SER 13 HA SER 13 -5.800 -1.679 11.117 1039 HB2 SER 13 HB2 SER 13 -8.346 -0.215 10.480 1040 HB3 SER 13 HB3 SER 13 -6.969 -0.080 9.371 1041 HG SER 13 HG SER 13 -8.041 -2.531 10.301 1042 H ASP 14 H ASP 14 -6.505 1.187 13.047 1043 HA ASP 14 HA ASP 14 -5.300 3.141 11.447 1044 HB2 ASP 14 HB2 ASP 14 -6.679 3.682 13.346 1045 HB3 ASP 14 HB3 ASP 14 -5.500 2.964 14.458 1046 H ASP 15 H ASP 15 -3.316 3.799 10.972 1047 HA ASP 15 HA ASP 15 -1.304 2.116 10.664 1048 HB2 ASP 15 HB2 ASP 15 -1.416 3.981 9.334 1049 HB3 ASP 15 HB3 ASP 15 -1.381 5.094 10.690 1050 H ASP 16 H ASP 16 0.533 1.311 11.359 1051 HA ASP 16 HA ASP 16 2.021 0.501 12.700 1052 HB2 ASP 16 HB2 ASP 16 2.304 3.336 13.603 1053 HB3 ASP 16 HB3 ASP 16 3.263 2.060 14.314 1054 H SER 17 H SER 17 2.713 -0.544 14.506 1055 HA SER 17 HA SER 17 2.375 -1.836 16.334 1056 HB2 SER 17 HB2 SER 17 1.566 0.859 17.451 1057 HB3 SER 17 HB3 SER 17 1.970 -0.562 18.433 1058 HG SER 17 HG SER 17 3.782 0.824 18.087 1059 H TYR 18 H TYR 18 0.036 -1.837 14.591 1060 HA TYR 18 HA TYR 18 -2.292 -1.787 16.248 1061 HB2 TYR 18 HB2 TYR 18 -3.452 -2.401 14.063 1062 HB3 TYR 18 HB3 TYR 18 -2.695 -0.859 14.288 1063 HD1 TYR 18 HD1 TYR 18 -0.992 -4.085 13.299 1064 HD2 TYR 18 HD2 TYR 18 -2.213 -0.111 12.229 1065 HE1 TYR 18 HE1 TYR 18 0.144 -4.337 11.101 1066 HE2 TYR 18 HE2 TYR 18 -1.055 -0.342 10.019 1067 HH TYR 18 HH TYR 18 0.694 -3.332 9.098 1068 H GLU 19 H GLU 19 -4.133 -3.281 16.058 1069 HA GLU 19 HA GLU 19 -3.263 -6.063 16.719 1070 HB2 GLU 19 HB2 GLU 19 -4.291 -4.906 18.519 1071 HB3 GLU 19 HB3 GLU 19 -5.663 -4.410 17.558 1072 HG2 GLU 19 HG2 GLU 19 -5.008 -7.349 18.046 1073 HG3 GLU 19 HG3 GLU 19 -5.883 -6.383 19.228 1074 H VAL 20 H VAL 20 -5.640 -4.254 14.769 1075 HA VAL 20 HA VAL 20 -6.896 -4.817 13.029 1076 HB VAL 20 HB VAL 20 -4.669 -6.320 11.818 1077 HG11 VAL 20 HG11 VAL 20 -6.820 -5.596 10.562 1078 HG12 VAL 20 HG12 VAL 20 -6.161 -3.965 10.655 1079 HG13 VAL 20 HG13 VAL 20 -5.242 -5.226 9.829 1080 HG21 VAL 20 HG21 VAL 20 -3.483 -4.558 13.010 1081 HG22 VAL 20 HG22 VAL 20 -3.532 -4.169 11.287 1082 HG23 VAL 20 HG23 VAL 20 -4.638 -3.346 12.401 1083 H LEU 21 H LEU 21 -7.708 -6.619 14.946 1084 HA LEU 21 HA LEU 21 -9.289 -8.247 13.062 1085 HB2 LEU 21 HB2 LEU 21 -7.195 -9.596 13.751 1086 HB3 LEU 21 HB3 LEU 21 -7.902 -9.683 15.351 1087 HG LEU 21 HG LEU 21 -9.831 -10.953 14.429 1088 HD11 LEU 21 HD11 LEU 21 -10.016 -10.105 12.137 1089 HD12 LEU 21 HD12 LEU 21 -8.373 -10.675 11.758 1090 HD13 LEU 21 HD13 LEU 21 -9.686 -11.828 12.065 1091 HD21 LEU 21 HD21 LEU 21 -7.177 -12.071 13.462 1092 HD22 LEU 21 HD22 LEU 21 -7.732 -12.113 15.144 1093 HD23 LEU 21 HD23 LEU 21 -8.634 -12.998 13.895 1094 H ASP 22 H ASP 22 -9.037 -6.604 16.050 1095 HA ASP 22 HA ASP 22 -10.164 -6.328 17.802 1096 HB2 ASP 22 HB2 ASP 22 -12.577 -5.764 17.775 1097 HB3 ASP 22 HB3 ASP 22 -11.445 -4.834 16.812 1098 H LEU 23 H LEU 23 -9.295 -8.767 17.701 1099 HA LEU 23 HA LEU 23 -11.194 -10.225 19.517 1100 HB2 LEU 23 HB2 LEU 23 -8.923 -11.333 17.817 1101 HB3 LEU 23 HB3 LEU 23 -9.783 -12.244 19.058 1102 HG LEU 23 HG LEU 23 -10.981 -11.189 16.470 1103 HD11 LEU 23 HD11 LEU 23 -9.492 -13.212 16.319 1104 HD12 LEU 23 HD12 LEU 23 -10.516 -14.027 17.507 1105 HD13 LEU 23 HD13 LEU 23 -11.174 -13.576 15.919 1106 HD21 LEU 23 HD21 LEU 23 -12.289 -12.737 18.752 1107 HD22 LEU 23 HD22 LEU 23 -12.742 -11.121 18.166 1108 HD23 LEU 23 HD23 LEU 23 -12.999 -12.530 17.140 1109 H THR 24 H THR 24 -8.300 -8.420 19.354 1110 HA THR 24 HA THR 24 -6.768 -7.854 20.767 1111 HB THR 24 HB THR 24 -7.078 -7.282 22.864 1112 HG1 THR 24 HG1 THR 24 -7.227 -9.255 23.865 1113 HG21 THR 24 HG21 THR 24 -9.009 -6.475 21.507 1114 HG22 THR 24 HG22 THR 24 -9.967 -7.855 22.093 1115 HG23 THR 24 HG23 THR 24 -9.374 -6.635 23.228 1116 H GLU 25 H GLU 25 -6.524 -10.483 19.610 1117 HA GLU 25 HA GLU 25 -4.746 -11.967 21.404 1118 HB2 GLU 25 HB2 GLU 25 -5.289 -12.269 18.424 1119 HB3 GLU 25 HB3 GLU 25 -4.386 -13.420 19.392 1120 HG2 GLU 25 HG2 GLU 25 -7.328 -12.723 19.758 1121 HG3 GLU 25 HG3 GLU 25 -6.694 -14.138 18.941 1122 H TYR 26 H TYR 26 -3.941 -9.228 21.020 1123 HA TYR 26 HA TYR 26 -1.895 -8.955 19.070 1124 HB2 TYR 26 HB2 TYR 26 -2.991 -7.025 19.551 1125 HB3 TYR 26 HB3 TYR 26 -2.847 -7.237 21.287 1126 HD1 TYR 26 HD1 TYR 26 -1.128 -6.064 18.257 1127 HD2 TYR 26 HD2 TYR 26 -0.814 -6.642 22.515 1128 HE1 TYR 26 HE1 TYR 26 0.826 -4.516 18.316 1129 HE2 TYR 26 HE2 TYR 26 1.157 -5.105 22.573 1130 HH TYR 26 HH TYR 26 2.444 -3.522 19.625 Start of MODEL 9 1 H1 MET 1 H1 MET 1 -6.470 3.282 6.627 2 H2 MET 1 H2 MET 1 -6.405 2.656 5.103 3 H3 MET 1 H3 MET 1 -6.038 4.230 5.384 4 HA MET 1 HA MET 1 -8.343 4.680 6.091 5 HB2 MET 1 HB2 MET 1 -7.559 5.249 3.824 6 HB3 MET 1 HB3 MET 1 -8.017 3.650 3.232 7 HG2 MET 1 HG2 MET 1 -10.397 4.138 3.731 8 HG3 MET 1 HG3 MET 1 -9.937 5.704 4.405 9 HE1 MET 1 HE1 MET 1 -12.211 5.551 2.334 10 HE2 MET 1 HE2 MET 1 -11.567 7.093 2.939 11 HE3 MET 1 HE3 MET 1 -11.781 6.846 1.195 12 HA PRO 2 HA PRO 2 -10.373 0.603 6.834 13 HB2 PRO 2 HB2 PRO 2 -11.694 2.121 9.051 14 HB3 PRO 2 HB3 PRO 2 -10.886 0.531 9.111 15 HG2 PRO 2 HG2 PRO 2 -9.703 2.688 10.194 16 HG3 PRO 2 HG3 PRO 2 -8.747 1.507 9.234 17 HD2 PRO 2 HD2 PRO 2 -9.945 4.138 8.289 18 HD3 PRO 2 HD3 PRO 2 -8.255 3.571 8.158 19 H SER 3 H SER 3 -11.825 3.870 6.866 20 HA SER 3 HA SER 3 -14.501 3.245 6.818 21 HB2 SER 3 HB2 SER 3 -13.145 5.680 5.633 22 HB3 SER 3 HB3 SER 3 -14.866 5.540 6.058 23 HG SER 3 HG SER 3 -13.658 6.502 7.755 24 H GLU 4 H GLU 4 -15.675 2.144 5.502 25 HA GLU 4 HA GLU 4 -16.698 1.209 3.761 26 HB2 GLU 4 HB2 GLU 4 -17.804 3.330 4.098 27 HB3 GLU 4 HB3 GLU 4 -16.724 4.112 2.954 28 HG2 GLU 4 HG2 GLU 4 -18.871 3.713 1.921 29 HG3 GLU 4 HG3 GLU 4 -17.637 2.785 1.095 30 H LYS 5 H LYS 5 -14.487 3.398 2.057 31 HA LYS 5 HA LYS 5 -14.791 2.086 -0.509 32 HB2 LYS 5 HB2 LYS 5 -14.255 4.569 0.061 33 HB3 LYS 5 HB3 LYS 5 -12.611 4.034 0.376 34 HG2 LYS 5 HG2 LYS 5 -12.689 4.997 -1.788 35 HG3 LYS 5 HG3 LYS 5 -12.456 3.270 -2.030 36 HD2 LYS 5 HD2 LYS 5 -14.861 3.010 -2.611 37 HD3 LYS 5 HD3 LYS 5 -15.151 4.715 -2.207 38 HE2 LYS 5 HE2 LYS 5 -13.553 5.400 -3.997 39 HE3 LYS 5 HE3 LYS 5 -13.331 3.698 -4.441 40 HZ1 LYS 5 HZ1 LYS 5 -15.920 5.184 -4.571 41 HZ2 LYS 5 HZ2 LYS 5 -14.996 4.788 -5.856 42 HZ3 LYS 5 HZ3 LYS 5 -15.728 3.613 -4.994 43 H THR 6 H THR 6 -13.040 1.063 -1.751 44 HA THR 6 HA THR 6 -11.682 -0.957 -0.360 45 HB THR 6 HB THR 6 -10.827 -1.790 -2.273 46 HG1 THR 6 HG1 THR 6 -10.376 -0.409 -4.112 47 HG21 THR 6 HG21 THR 6 -13.309 -1.443 -2.608 48 HG22 THR 6 HG22 THR 6 -12.909 0.028 -3.548 49 HG23 THR 6 HG23 THR 6 -12.361 -1.565 -4.095 50 H PHE 7 H PHE 7 -9.562 -1.472 0.156 51 HA PHE 7 HA PHE 7 -7.889 0.727 1.122 52 HB2 PHE 7 HB2 PHE 7 -6.666 -0.960 2.093 53 HB3 PHE 7 HB3 PHE 7 -8.064 -1.943 1.734 54 HD1 PHE 7 HD1 PHE 7 -7.977 -3.626 -0.128 55 HD2 PHE 7 HD2 PHE 7 -4.605 -1.125 0.824 56 HE1 PHE 7 HE1 PHE 7 -6.582 -4.895 -1.737 57 HE2 PHE 7 HE2 PHE 7 -3.214 -2.386 -0.766 58 HZ PHE 7 HZ PHE 7 -4.197 -4.311 -2.049 59 H LYS 8 H LYS 8 -8.041 -1.297 -1.848 60 HA LYS 8 HA LYS 8 -5.496 -0.653 -2.919 61 HB2 LYS 8 HB2 LYS 8 -6.793 -2.594 -3.610 62 HB3 LYS 8 HB3 LYS 8 -8.084 -1.571 -4.232 63 HG2 LYS 8 HG2 LYS 8 -6.820 -2.475 -6.057 64 HG3 LYS 8 HG3 LYS 8 -6.592 -0.733 -6.014 65 HD2 LYS 8 HD2 LYS 8 -4.355 -1.164 -4.818 66 HD3 LYS 8 HD3 LYS 8 -4.604 -2.885 -5.121 67 HE2 LYS 8 HE2 LYS 8 -4.423 -0.671 -7.231 68 HE3 LYS 8 HE3 LYS 8 -3.111 -1.756 -6.781 69 HZ1 LYS 8 HZ1 LYS 8 -4.494 -3.643 -7.590 70 HZ2 LYS 8 HZ2 LYS 8 -5.665 -2.599 -8.080 71 HZ3 LYS 8 HZ3 LYS 8 -4.192 -2.563 -8.775 72 H GLN 9 H GLN 9 -8.528 1.088 -3.146 73 HA GLN 9 HA GLN 9 -7.751 3.102 -5.019 74 HB2 GLN 9 HB2 GLN 9 -9.977 3.023 -4.634 75 HB3 GLN 9 HB3 GLN 9 -9.852 2.717 -2.929 76 HG2 GLN 9 HG2 GLN 9 -9.304 5.442 -4.182 77 HG3 GLN 9 HG3 GLN 9 -10.875 4.912 -3.606 78 HE21 GLN 9 HE21 GLN 9 -9.534 4.874 -0.078 79 HE22 GLN 9 HE22 GLN 9 -9.896 3.499 -1.104 80 H ARG 10 H ARG 10 -6.737 2.666 -1.671 81 HA ARG 10 HA ARG 10 -5.439 5.359 -1.666 82 HB2 ARG 10 HB2 ARG 10 -7.012 4.485 0.254 83 HB3 ARG 10 HB3 ARG 10 -5.639 3.490 0.708 84 HG2 ARG 10 HG2 ARG 10 -5.130 5.319 1.989 85 HG3 ARG 10 HG3 ARG 10 -4.342 5.872 0.522 86 HD2 ARG 10 HD2 ARG 10 -7.040 6.679 1.652 87 HD3 ARG 10 HD3 ARG 10 -5.639 7.702 1.411 88 HE ARG 10 HE ARG 10 -7.649 6.834 -0.590 89 HH11 ARG 10 HH11 ARG 10 -4.896 9.477 -1.696 90 HH12 ARG 10 HH12 ARG 10 -4.640 8.609 -0.203 91 HH21 ARG 10 HH21 ARG 10 -6.702 9.056 -2.947 92 HH22 ARG 10 HH22 ARG 10 -7.865 7.856 -2.408 93 H ARG 11 H ARG 11 -4.598 1.897 -1.108 94 HA ARG 11 HA ARG 11 -1.692 2.632 -1.372 95 HB2 ARG 11 HB2 ARG 11 -2.927 0.415 0.327 96 HB3 ARG 11 HB3 ARG 11 -1.205 0.762 0.160 97 HG2 ARG 11 HG2 ARG 11 -1.720 3.111 1.030 98 HG3 ARG 11 HG3 ARG 11 -3.338 2.504 1.445 99 HD2 ARG 11 HD2 ARG 11 -2.362 0.858 2.978 100 HD3 ARG 11 HD3 ARG 11 -0.721 1.324 2.483 101 HE ARG 11 HE ARG 11 -2.309 3.579 3.420 102 HH11 ARG 11 HH11 ARG 11 -1.635 4.725 5.170 103 HH12 ARG 11 HH12 ARG 11 -0.676 3.940 6.402 104 HH21 ARG 11 HH21 ARG 11 -0.211 0.992 4.725 105 HH22 ARG 11 HH22 ARG 11 0.283 2.037 6.013 106 H THR 12 H THR 12 -0.312 1.350 -2.478 107 HA THR 12 HA THR 12 -1.219 -1.192 -3.566 108 HB THR 12 HB THR 12 -1.859 0.495 -5.276 109 HG1 THR 12 HG1 THR 12 -1.026 -1.032 -6.874 110 HG21 THR 12 HG21 THR 12 1.080 0.338 -6.059 111 HG22 THR 12 HG22 THR 12 -0.243 1.165 -6.896 112 HG23 THR 12 HG23 THR 12 0.325 1.775 -5.331 113 H PHE 13 H PHE 13 0.929 -1.853 -5.219 114 HA PHE 13 HA PHE 13 2.327 -3.348 -3.570 115 HB2 PHE 13 HB2 PHE 13 3.172 -2.262 -6.211 116 HB3 PHE 13 HB3 PHE 13 4.267 -3.289 -5.300 117 HD1 PHE 13 HD1 PHE 13 1.273 -3.267 -7.380 118 HD2 PHE 13 HD2 PHE 13 3.613 -5.586 -4.594 119 HE1 PHE 13 HE1 PHE 13 0.096 -5.339 -8.104 120 HE2 PHE 13 HE2 PHE 13 2.438 -7.651 -5.319 121 HZ PHE 13 HZ PHE 13 0.665 -7.528 -7.065 122 H GLU 14 H GLU 14 3.946 -0.197 -4.262 123 HA GLU 14 HA GLU 14 6.163 -0.850 -2.562 124 HB2 GLU 14 HB2 GLU 14 5.022 1.873 -3.312 125 HB3 GLU 14 HB3 GLU 14 6.589 1.625 -2.560 126 HG2 GLU 14 HG2 GLU 14 5.751 0.596 -5.308 127 HG3 GLU 14 HG3 GLU 14 6.726 2.020 -4.995 128 H GLN 15 H GLN 15 3.094 0.805 -1.797 129 HA GLN 15 HA GLN 15 3.766 1.314 0.996 130 HB2 GLN 15 HB2 GLN 15 1.099 1.218 -0.476 131 HB3 GLN 15 HB3 GLN 15 1.292 1.725 1.197 132 HG2 GLN 15 HG2 GLN 15 2.583 3.105 -1.199 133 HG3 GLN 15 HG3 GLN 15 1.109 3.633 -0.398 134 HE21 GLN 15 HE21 GLN 15 4.172 5.476 0.952 135 HE22 GLN 15 HE22 GLN 15 3.705 5.102 -0.699 136 H ARG 16 H ARG 16 2.058 -1.310 -0.742 137 HA ARG 16 HA ARG 16 1.335 -2.782 1.644 138 HB2 ARG 16 HB2 ARG 16 1.532 -3.533 -1.291 139 HB3 ARG 16 HB3 ARG 16 1.264 -4.757 -0.049 140 HG2 ARG 16 HG2 ARG 16 -0.684 -3.429 0.810 141 HG3 ARG 16 HG3 ARG 16 -0.517 -2.336 -0.572 142 HD2 ARG 16 HD2 ARG 16 -0.740 -5.336 -0.943 143 HD3 ARG 16 HD3 ARG 16 -2.161 -4.410 -0.596 144 HE ARG 16 HE ARG 16 -2.026 -3.256 -2.673 145 HH11 ARG 16 HH11 ARG 16 0.232 -5.948 -2.622 146 HH12 ARG 16 HH12 ARG 16 0.546 -5.794 -4.324 147 HH21 ARG 16 HH21 ARG 16 -1.529 -3.169 -4.910 148 HH22 ARG 16 HH22 ARG 16 -0.527 -4.430 -5.542 149 H VAL 17 H VAL 17 4.207 -3.037 -0.455 150 HA VAL 17 HA VAL 17 5.414 -5.248 0.966 151 HB VAL 17 HB VAL 17 6.508 -3.057 -0.848 152 HG11 VAL 17 HG11 VAL 17 8.391 -3.635 0.589 153 HG12 VAL 17 HG12 VAL 17 8.054 -5.371 0.399 154 HG13 VAL 17 HG13 VAL 17 8.610 -4.398 -0.985 155 HG21 VAL 17 HG21 VAL 17 6.750 -4.907 -2.434 156 HG22 VAL 17 HG22 VAL 17 6.247 -6.086 -1.201 157 HG23 VAL 17 HG23 VAL 17 5.085 -4.905 -1.835 158 H GLU 18 H GLU 18 5.742 -1.640 1.386 159 HA GLU 18 HA GLU 18 7.449 -1.825 3.681 160 HB2 GLU 18 HB2 GLU 18 5.500 0.279 2.715 161 HB3 GLU 18 HB3 GLU 18 6.348 0.430 4.266 162 HG2 GLU 18 HG2 GLU 18 8.513 0.209 3.175 163 HG3 GLU 18 HG3 GLU 18 7.749 0.014 1.592 164 H ASP 19 H ASP 19 3.823 -1.694 3.575 165 HA ASP 19 HA ASP 19 3.452 -2.066 6.339 166 HB2 ASP 19 HB2 ASP 19 1.705 -2.805 3.993 167 HB3 ASP 19 HB3 ASP 19 1.262 -3.216 5.641 168 H VAL 20 H VAL 20 3.785 -4.739 3.950 169 HA VAL 20 HA VAL 20 3.631 -6.818 5.935 170 HB VAL 20 HB VAL 20 4.947 -6.766 3.186 171 HG11 VAL 20 HG11 VAL 20 4.471 -9.144 5.042 172 HG12 VAL 20 HG12 VAL 20 4.890 -9.255 3.323 173 HG13 VAL 20 HG13 VAL 20 6.046 -8.560 4.450 174 HG21 VAL 20 HG21 VAL 20 2.483 -6.527 3.235 175 HG22 VAL 20 HG22 VAL 20 2.948 -8.082 2.552 176 HG23 VAL 20 HG23 VAL 20 2.340 -7.991 4.221 177 H ARG 21 H ARG 21 6.536 -5.093 4.603 178 HA ARG 21 HA ARG 21 8.451 -6.628 6.113 179 HB2 ARG 21 HB2 ARG 21 8.549 -3.836 4.911 180 HB3 ARG 21 HB3 ARG 21 9.919 -4.558 5.762 181 HG2 ARG 21 HG2 ARG 21 10.025 -6.420 4.208 182 HG3 ARG 21 HG3 ARG 21 8.573 -5.867 3.359 183 HD2 ARG 21 HD2 ARG 21 9.728 -3.782 2.711 184 HD3 ARG 21 HD3 ARG 21 11.185 -4.313 3.581 185 HE ARG 21 HE ARG 21 10.504 -6.358 1.744 186 HH11 ARG 21 HH11 ARG 21 12.417 -5.326 -0.923 187 HH12 ARG 21 HH12 ARG 21 11.541 -6.640 -0.202 188 HH21 ARG 21 HH21 ARG 21 12.521 -3.353 0.048 189 HH22 ARG 21 HH22 ARG 21 11.726 -3.071 1.571 190 H LEU 22 H LEU 22 6.803 -3.583 6.976 191 HA LEU 22 HA LEU 22 8.032 -3.310 9.572 192 HB2 LEU 22 HB2 LEU 22 5.399 -2.333 8.389 193 HB3 LEU 22 HB3 LEU 22 5.926 -1.892 10.013 194 HG LEU 22 HG LEU 22 7.705 -1.375 7.601 195 HD11 LEU 22 HD11 LEU 22 5.537 -0.263 7.193 196 HD12 LEU 22 HD12 LEU 22 5.639 0.519 8.785 197 HD13 LEU 22 HD13 LEU 22 6.823 0.903 7.508 198 HD21 LEU 22 HD21 LEU 22 8.656 0.367 9.041 199 HD22 LEU 22 HD22 LEU 22 7.522 -0.053 10.341 200 HD23 LEU 22 HD23 LEU 22 8.765 -1.211 9.826 201 H ILE 23 H ILE 23 4.909 -4.867 8.597 202 HA ILE 23 HA ILE 23 4.329 -5.691 11.281 203 HB ILE 23 HB ILE 23 3.191 -6.211 8.579 204 HG12 ILE 23 HG12 ILE 23 1.137 -5.490 9.727 205 HG13 ILE 23 HG13 ILE 23 1.970 -5.508 11.284 206 HG21 ILE 23 HG21 ILE 23 1.551 -7.841 9.425 207 HG22 ILE 23 HG22 ILE 23 3.171 -8.506 9.355 208 HG23 ILE 23 HG23 ILE 23 2.487 -8.011 10.927 209 HD11 ILE 23 HD11 ILE 23 3.386 -3.597 10.538 210 HD12 ILE 23 HD12 ILE 23 2.481 -3.567 9.002 211 HD13 ILE 23 HD13 ILE 23 1.670 -3.232 10.528 212 H ARG 24 H ARG 24 6.108 -7.428 8.725 213 HA ARG 24 HA ARG 24 6.464 -9.848 10.226 214 HB2 ARG 24 HB2 ARG 24 6.799 -9.769 7.823 215 HB3 ARG 24 HB3 ARG 24 8.056 -8.551 7.974 216 HG2 ARG 24 HG2 ARG 24 9.008 -10.742 7.458 217 HG3 ARG 24 HG3 ARG 24 9.583 -10.140 9.007 218 HD2 ARG 24 HD2 ARG 24 7.803 -11.650 10.122 219 HD3 ARG 24 HD3 ARG 24 7.469 -12.281 8.512 220 HE ARG 24 HE ARG 24 9.434 -13.499 8.570 221 HH11 ARG 24 HH11 ARG 24 11.206 -14.441 9.485 222 HH12 ARG 24 HH12 ARG 24 11.892 -13.801 10.944 223 HH21 ARG 24 HH21 ARG 24 9.643 -11.205 11.260 224 HH22 ARG 24 HH22 ARG 24 11.049 -12.013 11.904 225 H GLU 25 H GLU 25 8.244 -6.779 10.375 226 HA GLU 25 HA GLU 25 10.237 -7.810 12.256 227 HB2 GLU 25 HB2 GLU 25 10.717 -5.938 10.791 228 HB3 GLU 25 HB3 GLU 25 9.410 -4.980 11.506 229 HG2 GLU 25 HG2 GLU 25 10.555 -4.964 13.679 230 HG3 GLU 25 HG3 GLU 25 11.809 -6.038 13.054 231 H GLN 26 H GLN 26 7.186 -5.937 12.584 232 HA GLN 26 HA GLN 26 7.278 -5.609 15.413 233 HB2 GLN 26 HB2 GLN 26 4.965 -5.704 13.453 234 HB3 GLN 26 HB3 GLN 26 4.771 -5.265 15.155 235 HG2 GLN 26 HG2 GLN 26 6.019 -3.269 14.935 236 HG3 GLN 26 HG3 GLN 26 6.646 -3.708 13.349 237 HE21 GLN 26 HE21 GLN 26 2.636 -2.920 12.999 238 HE22 GLN 26 HE22 GLN 26 3.161 -4.365 13.853 239 H HIS 27 H HIS 27 5.573 -8.115 13.494 240 HA HIS 27 HA HIS 27 5.087 -9.744 15.967 241 HB2 HIS 27 HB2 HIS 27 2.982 -8.987 13.891 242 HB3 HIS 27 HB3 HIS 27 2.727 -9.956 15.340 243 HD1 HIS 27 HD1 HIS 27 3.791 -8.150 17.636 244 HD2 HIS 27 HD2 HIS 27 1.624 -6.829 14.250 245 HE1 HIS 27 HE1 HIS 27 2.570 -6.006 18.350 246 HE2 HIS 27 HE2 HIS 27 1.242 -5.208 16.295 247 HA PRO 28 HA PRO 28 6.749 -12.305 12.426 248 HB2 PRO 28 HB2 PRO 28 7.874 -13.754 14.832 249 HB3 PRO 28 HB3 PRO 28 8.625 -13.479 13.234 250 HG2 PRO 28 HG2 PRO 28 9.333 -11.934 15.327 251 HG3 PRO 28 HG3 PRO 28 9.000 -11.153 13.745 252 HD2 PRO 28 HD2 PRO 28 7.169 -11.381 16.144 253 HD3 PRO 28 HD3 PRO 28 7.527 -9.962 15.111 254 H THR 29 H THR 29 4.982 -13.280 15.351 255 HA THR 29 HA THR 29 4.174 -15.870 14.347 256 HB THR 29 HB THR 29 2.984 -16.189 16.316 257 HG1 THR 29 HG1 THR 29 2.393 -14.486 17.672 258 HG21 THR 29 HG21 THR 29 5.177 -14.277 17.242 259 HG22 THR 29 HG22 THR 29 4.466 -15.644 18.121 260 HG23 THR 29 HG23 THR 29 5.476 -15.949 16.696 261 H LYS 30 H LYS 30 3.054 -12.861 13.363 262 HA LYS 30 HA LYS 30 0.304 -13.919 12.851 263 HB2 LYS 30 HB2 LYS 30 1.159 -11.019 13.120 264 HB3 LYS 30 HB3 LYS 30 -0.471 -11.619 12.762 265 HG2 LYS 30 HG2 LYS 30 -0.490 -12.824 14.955 266 HG3 LYS 30 HG3 LYS 30 1.102 -12.154 15.330 267 HD2 LYS 30 HD2 LYS 30 0.163 -9.861 15.296 268 HD3 LYS 30 HD3 LYS 30 -1.398 -10.491 14.773 269 HE2 LYS 30 HE2 LYS 30 -1.540 -9.990 17.126 270 HE3 LYS 30 HE3 LYS 30 -1.667 -11.735 16.899 271 HZ1 LYS 30 HZ1 LYS 30 0.787 -10.292 17.816 272 HZ2 LYS 30 HZ2 LYS 30 -0.213 -11.166 18.766 273 HZ3 LYS 30 HZ3 LYS 30 0.683 -11.927 17.631 274 H ILE 31 H ILE 31 -0.664 -13.790 11.014 275 HA ILE 31 HA ILE 31 0.919 -13.591 8.546 276 HB ILE 31 HB ILE 31 -1.954 -14.444 9.079 277 HG12 ILE 31 HG12 ILE 31 -0.535 -15.935 10.309 278 HG13 ILE 31 HG13 ILE 31 -1.159 -16.758 8.890 279 HG21 ILE 31 HG21 ILE 31 -1.656 -13.816 6.739 280 HG22 ILE 31 HG22 ILE 31 -0.206 -14.830 6.617 281 HG23 ILE 31 HG23 ILE 31 -1.816 -15.560 6.894 282 HD11 ILE 31 HD11 ILE 31 1.671 -15.676 9.195 283 HD12 ILE 31 HD12 ILE 31 1.163 -17.369 9.273 284 HD13 ILE 31 HD13 ILE 31 1.032 -16.477 7.745 285 HA PRO 32 HA PRO 32 -1.243 -9.645 7.649 286 HB2 PRO 32 HB2 PRO 32 0.126 -8.878 5.438 287 HB3 PRO 32 HB3 PRO 32 0.872 -8.856 7.059 288 HG2 PRO 32 HG2 PRO 32 1.113 -10.985 4.919 289 HG3 PRO 32 HG3 PRO 32 2.427 -10.213 5.863 290 HD2 PRO 32 HD2 PRO 32 1.283 -12.644 6.517 291 HD3 PRO 32 HD3 PRO 32 1.961 -11.527 7.741 292 H VAL 33 H VAL 33 -3.199 -9.496 6.685 293 HA VAL 33 HA VAL 33 -3.824 -11.118 4.263 294 HB VAL 33 HB VAL 33 -5.643 -10.826 6.669 295 HG11 VAL 33 HG11 VAL 33 -5.789 -12.640 4.230 296 HG12 VAL 33 HG12 VAL 33 -6.885 -12.699 5.626 297 HG13 VAL 33 HG13 VAL 33 -6.874 -11.277 4.594 298 HG21 VAL 33 HG21 VAL 33 -3.857 -13.175 5.932 299 HG22 VAL 33 HG22 VAL 33 -3.786 -12.194 7.411 300 HG23 VAL 33 HG23 VAL 33 -5.178 -13.238 7.113 301 H ILE 34 H ILE 34 -5.210 -10.257 2.771 302 HA ILE 34 HA ILE 34 -6.338 -7.506 3.273 303 HB ILE 34 HB ILE 34 -5.700 -8.909 0.653 304 HG12 ILE 34 HG12 ILE 34 -3.657 -8.124 1.654 305 HG13 ILE 34 HG13 ILE 34 -4.054 -7.145 0.260 306 HG21 ILE 34 HG21 ILE 34 -6.316 -6.734 -0.401 307 HG22 ILE 34 HG22 ILE 34 -7.685 -7.558 0.313 308 HG23 ILE 34 HG23 ILE 34 -6.948 -6.173 1.165 309 HD11 ILE 34 HD11 ILE 34 -4.855 -5.319 1.758 310 HD12 ILE 34 HD12 ILE 34 -4.404 -6.312 3.168 311 HD13 ILE 34 HD13 ILE 34 -3.163 -5.754 2.037 312 H ILE 35 H ILE 35 -8.537 -7.203 3.008 313 HA ILE 35 HA ILE 35 -10.141 -9.428 1.923 314 HB ILE 35 HB ILE 35 -10.383 -9.756 4.285 315 HG12 ILE 35 HG12 ILE 35 -12.898 -8.524 3.038 316 HG13 ILE 35 HG13 ILE 35 -12.275 -10.148 2.700 317 HG21 ILE 35 HG21 ILE 35 -11.398 -8.077 5.763 318 HG22 ILE 35 HG22 ILE 35 -9.913 -7.432 5.084 319 HG23 ILE 35 HG23 ILE 35 -11.499 -6.909 4.451 320 HD11 ILE 35 HD11 ILE 35 -13.358 -9.181 5.366 321 HD12 ILE 35 HD12 ILE 35 -14.078 -10.358 4.259 322 HD13 ILE 35 HD13 ILE 35 -12.562 -10.754 5.095 323 H GLU 36 H GLU 36 -11.457 -8.735 0.320 324 HA GLU 36 HA GLU 36 -12.530 -5.965 0.533 325 HB2 GLU 36 HB2 GLU 36 -11.093 -7.161 -1.842 326 HB3 GLU 36 HB3 GLU 36 -12.321 -5.928 -2.078 327 HG2 GLU 36 HG2 GLU 36 -9.809 -5.615 -0.384 328 HG3 GLU 36 HG3 GLU 36 -10.058 -4.979 -1.998 329 H ARG 37 H ARG 37 -14.490 -5.501 -0.268 330 HA ARG 37 HA ARG 37 -16.425 -7.657 -0.537 331 HB2 ARG 37 HB2 ARG 37 -16.953 -5.414 0.357 332 HB3 ARG 37 HB3 ARG 37 -16.613 -4.686 -1.213 333 HG2 ARG 37 HG2 ARG 37 -18.516 -5.787 -2.231 334 HG3 ARG 37 HG3 ARG 37 -18.733 -6.842 -0.825 335 HD2 ARG 37 HD2 ARG 37 -20.410 -5.050 -0.827 336 HD3 ARG 37 HD3 ARG 37 -19.346 -4.964 0.578 337 HE ARG 37 HE ARG 37 -18.398 -3.257 -1.579 338 HH11 ARG 37 HH11 ARG 37 -20.842 -3.283 0.932 339 HH12 ARG 37 HH12 ARG 37 -20.645 -1.562 1.235 340 HH21 ARG 37 HH21 ARG 37 -19.225 -0.377 0.161 341 HH22 ARG 37 HH22 ARG 37 -18.238 -1.052 -1.111 342 H TYR 38 H TYR 38 -17.119 -8.699 -2.275 343 HA TYR 38 HA TYR 38 -15.411 -9.007 -4.384 344 HB2 TYR 38 HB2 TYR 38 -16.547 -10.834 -3.727 345 HB3 TYR 38 HB3 TYR 38 -18.102 -10.021 -3.735 346 HD1 TYR 38 HD1 TYR 38 -19.659 -10.579 -5.328 347 HD2 TYR 38 HD2 TYR 38 -15.468 -11.236 -6.153 348 HE1 TYR 38 HE1 TYR 38 -20.252 -11.764 -7.435 349 HE2 TYR 38 HE2 TYR 38 -16.068 -12.395 -8.264 350 HH TYR 38 HH TYR 38 -17.765 -13.104 -9.642 351 H LYS 39 H LYS 39 -15.250 -8.780 -6.586 352 HA LYS 39 HA LYS 39 -15.944 -6.170 -7.496 353 HB2 LYS 39 HB2 LYS 39 -13.925 -7.502 -8.121 354 HB3 LYS 39 HB3 LYS 39 -14.940 -8.540 -9.137 355 HG2 LYS 39 HG2 LYS 39 -15.540 -6.591 -10.547 356 HG3 LYS 39 HG3 LYS 39 -14.637 -5.517 -9.458 357 HD2 LYS 39 HD2 LYS 39 -12.539 -6.777 -10.010 358 HD3 LYS 39 HD3 LYS 39 -13.473 -7.759 -11.168 359 HE2 LYS 39 HE2 LYS 39 -14.124 -5.659 -12.372 360 HE3 LYS 39 HE3 LYS 39 -13.147 -4.716 -11.236 361 HZ1 LYS 39 HZ1 LYS 39 -11.918 -5.185 -13.280 362 HZ2 LYS 39 HZ2 LYS 39 -11.172 -5.930 -12.033 363 HZ3 LYS 39 HZ3 LYS 39 -12.080 -6.795 -13.085 364 H GLY 40 H GLY 40 -17.495 -9.283 -8.124 365 HA2 GLY 40 HA2 GLY 40 -19.290 -8.305 -10.198 366 HA3 GLY 40 HA3 GLY 40 -19.341 -9.870 -9.398 367 H GLU 41 H GLU 41 -19.484 -8.149 -6.714 368 HA GLU 41 HA GLU 41 -22.172 -7.023 -6.862 369 HB2 GLU 41 HB2 GLU 41 -23.007 -9.145 -6.713 370 HB3 GLU 41 HB3 GLU 41 -21.701 -9.760 -5.733 371 HG2 GLU 41 HG2 GLU 41 -23.596 -7.693 -4.574 372 HG3 GLU 41 HG3 GLU 41 -24.127 -9.353 -4.752 373 H LYS 42 H LYS 42 -22.252 -5.315 -5.659 374 HA LYS 42 HA LYS 42 -20.430 -4.928 -3.320 375 HB2 LYS 42 HB2 LYS 42 -22.071 -2.965 -4.963 376 HB3 LYS 42 HB3 LYS 42 -20.917 -2.523 -3.710 377 HG2 LYS 42 HG2 LYS 42 -20.195 -3.890 -6.346 378 HG3 LYS 42 HG3 LYS 42 -20.040 -2.172 -5.986 379 HD2 LYS 42 HD2 LYS 42 -18.390 -2.668 -4.198 380 HD3 LYS 42 HD3 LYS 42 -18.571 -4.400 -4.496 381 HE2 LYS 42 HE2 LYS 42 -16.525 -3.600 -5.516 382 HE3 LYS 42 HE3 LYS 42 -17.647 -4.183 -6.749 383 HZ1 LYS 42 HZ1 LYS 42 -18.191 -1.858 -7.283 384 HZ2 LYS 42 HZ2 LYS 42 -17.226 -1.299 -6.080 385 HZ3 LYS 42 HZ3 LYS 42 -16.582 -2.060 -7.367 386 H GLN 43 H GLN 43 -23.204 -6.312 -3.399 387 HA GLN 43 HA GLN 43 -25.099 -4.540 -2.186 388 HB2 GLN 43 HB2 GLN 43 -25.652 -6.426 -3.672 389 HB3 GLN 43 HB3 GLN 43 -25.028 -7.562 -2.476 390 HG2 GLN 43 HG2 GLN 43 -27.367 -7.608 -2.370 391 HG3 GLN 43 HG3 GLN 43 -26.757 -6.905 -0.881 392 HE21 GLN 43 HE21 GLN 43 -29.579 -4.718 -1.576 393 HE22 GLN 43 HE22 GLN 43 -29.183 -6.251 -0.812 394 H LEU 44 H LEU 44 -22.982 -7.090 -0.754 395 HA LEU 44 HA LEU 44 -24.161 -6.915 1.842 396 HB2 LEU 44 HB2 LEU 44 -21.387 -7.821 0.992 397 HB3 LEU 44 HB3 LEU 44 -22.021 -8.015 2.618 398 HG LEU 44 HG LEU 44 -23.105 -9.362 0.109 399 HD11 LEU 44 HD11 LEU 44 -22.330 -11.404 1.333 400 HD12 LEU 44 HD12 LEU 44 -20.995 -10.285 0.966 401 HD13 LEU 44 HD13 LEU 44 -21.667 -10.375 2.609 402 HD21 LEU 44 HD21 LEU 44 -25.004 -8.955 1.611 403 HD22 LEU 44 HD22 LEU 44 -24.543 -10.654 1.688 404 HD23 LEU 44 HD23 LEU 44 -24.072 -9.562 2.999 405 HA PRO 45 HA PRO 45 -22.144 -3.321 3.688 406 HB2 PRO 45 HB2 PRO 45 -22.369 -3.894 6.343 407 HB3 PRO 45 HB3 PRO 45 -23.791 -3.512 5.334 408 HG2 PRO 45 HG2 PRO 45 -22.743 -6.270 6.072 409 HG3 PRO 45 HG3 PRO 45 -24.418 -5.646 6.240 410 HD2 PRO 45 HD2 PRO 45 -23.637 -7.107 4.081 411 HD3 PRO 45 HD3 PRO 45 -24.793 -5.751 3.916 412 H VAL 46 H VAL 46 -20.155 -2.787 4.829 413 HA VAL 46 HA VAL 46 -18.149 -5.011 4.911 414 HB VAL 46 HB VAL 46 -18.092 -3.356 2.995 415 HG11 VAL 46 HG11 VAL 46 -16.697 -1.559 5.028 416 HG12 VAL 46 HG12 VAL 46 -16.933 -1.275 3.300 417 HG13 VAL 46 HG13 VAL 46 -18.333 -1.276 4.387 418 HG21 VAL 46 HG21 VAL 46 -16.214 -4.907 3.558 419 HG22 VAL 46 HG22 VAL 46 -15.691 -3.380 2.830 420 HG23 VAL 46 HG23 VAL 46 -15.513 -3.643 4.577 421 H LEU 47 H LEU 47 -19.433 -2.566 6.944 422 HA LEU 47 HA LEU 47 -18.844 -1.757 9.002 423 HB2 LEU 47 HB2 LEU 47 -18.155 -4.705 9.205 424 HB3 LEU 47 HB3 LEU 47 -18.015 -3.652 10.586 425 HG LEU 47 HG LEU 47 -20.076 -4.913 10.628 426 HD11 LEU 47 HD11 LEU 47 -19.942 -2.717 11.758 427 HD12 LEU 47 HD12 LEU 47 -20.622 -1.934 10.308 428 HD13 LEU 47 HD13 LEU 47 -21.581 -3.109 11.219 429 HD21 LEU 47 HD21 LEU 47 -21.077 -3.257 8.290 430 HD22 LEU 47 HD22 LEU 47 -20.570 -4.962 8.165 431 HD23 LEU 47 HD23 LEU 47 -21.951 -4.495 9.190 432 H ASP 48 H ASP 48 -17.023 -0.990 7.168 433 HA ASP 48 HA ASP 48 -14.991 -0.117 6.857 434 HB2 ASP 48 HB2 ASP 48 -15.407 0.411 9.791 435 HB3 ASP 48 HB3 ASP 48 -14.135 1.170 8.839 436 H LYS 49 H LYS 49 -14.624 -2.838 6.862 437 HA LYS 49 HA LYS 49 -11.811 -3.046 7.871 438 HB2 LYS 49 HB2 LYS 49 -14.055 -5.072 8.033 439 HB3 LYS 49 HB3 LYS 49 -12.359 -5.515 8.245 440 HG2 LYS 49 HG2 LYS 49 -12.096 -4.203 10.195 441 HG3 LYS 49 HG3 LYS 49 -13.522 -3.237 9.863 442 HD2 LYS 49 HD2 LYS 49 -14.985 -5.230 10.319 443 HD3 LYS 49 HD3 LYS 49 -13.526 -6.117 10.794 444 HE2 LYS 49 HE2 LYS 49 -14.403 -5.286 12.849 445 HE3 LYS 49 HE3 LYS 49 -13.023 -4.270 12.455 446 HZ1 LYS 49 HZ1 LYS 49 -14.565 -2.643 12.922 447 HZ2 LYS 49 HZ2 LYS 49 -14.983 -2.810 11.340 448 HZ3 LYS 49 HZ3 LYS 49 -15.871 -3.549 12.489 449 H THR 50 H THR 50 -10.360 -3.297 6.455 450 HA THR 50 HA THR 50 -10.852 -4.624 3.845 451 HB THR 50 HB THR 50 -9.736 -2.886 2.679 452 HG1 THR 50 HG1 THR 50 -9.048 -1.003 3.962 453 HG21 THR 50 HG21 THR 50 -12.140 -2.389 3.257 454 HG22 THR 50 HG22 THR 50 -11.562 -1.426 4.639 455 HG23 THR 50 HG23 THR 50 -11.139 -0.958 2.979 456 H LYS 51 H LYS 51 -8.584 -4.076 6.431 457 HA LYS 51 HA LYS 51 -6.725 -6.103 5.238 458 HB2 LYS 51 HB2 LYS 51 -5.958 -3.689 6.910 459 HB3 LYS 51 HB3 LYS 51 -4.864 -4.943 6.315 460 HG2 LYS 51 HG2 LYS 51 -5.115 -4.209 4.033 461 HG3 LYS 51 HG3 LYS 51 -6.453 -3.131 4.437 462 HD2 LYS 51 HD2 LYS 51 -4.333 -1.903 4.062 463 HD3 LYS 51 HD3 LYS 51 -5.037 -1.647 5.667 464 HE2 LYS 51 HE2 LYS 51 -3.449 -3.424 6.552 465 HE3 LYS 51 HE3 LYS 51 -2.661 -3.452 4.972 466 HZ1 LYS 51 HZ1 LYS 51 -1.709 -1.968 6.802 467 HZ2 LYS 51 HZ2 LYS 51 -1.825 -1.260 5.349 468 HZ3 LYS 51 HZ3 LYS 51 -2.946 -0.931 6.551 469 H PHE 52 H PHE 52 -5.763 -7.512 6.714 470 HA PHE 52 HA PHE 52 -6.538 -7.404 9.537 471 HB2 PHE 52 HB2 PHE 52 -7.328 -9.665 7.720 472 HB3 PHE 52 HB3 PHE 52 -7.152 -9.896 9.446 473 HD1 PHE 52 HD1 PHE 52 -9.593 -9.804 7.219 474 HD2 PHE 52 HD2 PHE 52 -8.391 -7.547 10.691 475 HE1 PHE 52 HE1 PHE 52 -11.956 -9.207 7.664 476 HE2 PHE 52 HE2 PHE 52 -10.753 -6.950 11.128 477 HZ PHE 52 HZ PHE 52 -12.548 -7.815 9.622 478 H LEU 53 H LEU 53 -5.384 -8.599 11.042 479 HA LEU 53 HA LEU 53 -2.921 -9.971 10.059 480 HB2 LEU 53 HB2 LEU 53 -3.221 -7.856 12.153 481 HB3 LEU 53 HB3 LEU 53 -2.326 -9.270 12.652 482 HG LEU 53 HG LEU 53 -0.709 -9.009 10.865 483 HD11 LEU 53 HD11 LEU 53 -1.985 -7.953 9.082 484 HD12 LEU 53 HD12 LEU 53 -2.264 -6.511 10.065 485 HD13 LEU 53 HD13 LEU 53 -0.632 -6.918 9.512 486 HD21 LEU 53 HD21 LEU 53 -1.134 -6.395 12.382 487 HD22 LEU 53 HD22 LEU 53 -0.429 -7.873 13.072 488 HD23 LEU 53 HD23 LEU 53 0.398 -7.029 11.765 489 H VAL 54 H VAL 54 -2.780 -12.039 10.794 490 HA VAL 54 HA VAL 54 -4.745 -12.920 12.868 491 HB VAL 54 HB VAL 54 -4.209 -14.579 10.424 492 HG11 VAL 54 HG11 VAL 54 -6.543 -14.499 12.391 493 HG12 VAL 54 HG12 VAL 54 -6.312 -15.654 11.059 494 HG13 VAL 54 HG13 VAL 54 -5.201 -15.666 12.438 495 HG21 VAL 54 HG21 VAL 54 -6.477 -12.580 10.754 496 HG22 VAL 54 HG22 VAL 54 -5.168 -12.493 9.549 497 HG23 VAL 54 HG23 VAL 54 -6.334 -13.804 9.472 498 HA PRO 55 HA PRO 55 -1.013 -14.931 14.407 499 HB2 PRO 55 HB2 PRO 55 -2.011 -16.166 16.638 500 HB3 PRO 55 HB3 PRO 55 -1.650 -14.422 16.551 501 HG2 PRO 55 HG2 PRO 55 -4.327 -15.780 16.237 502 HG3 PRO 55 HG3 PRO 55 -3.932 -14.299 17.156 503 HD2 PRO 55 HD2 PRO 55 -5.028 -14.240 14.650 504 HD3 PRO 55 HD3 PRO 55 -3.905 -12.981 15.234 505 H ASP 56 H ASP 56 -0.086 -16.888 14.105 506 HA ASP 56 HA ASP 56 -1.153 -18.480 12.139 507 HB2 ASP 56 HB2 ASP 56 0.728 -20.072 12.605 508 HB3 ASP 56 HB3 ASP 56 1.140 -18.387 12.319 509 H HIS 57 H HIS 57 -1.676 -19.128 15.526 510 HA HIS 57 HA HIS 57 -2.506 -21.862 15.261 511 HB2 HIS 57 HB2 HIS 57 -3.262 -21.653 17.528 512 HB3 HIS 57 HB3 HIS 57 -1.777 -20.740 17.376 513 HD1 HIS 57 HD1 HIS 57 -5.586 -20.174 17.765 514 HD2 HIS 57 HD2 HIS 57 -1.864 -18.219 18.177 515 HE1 HIS 57 HE1 HIS 57 -6.079 -17.908 18.881 516 HE2 HIS 57 HE2 HIS 57 -3.816 -16.715 19.137 517 H VAL 58 H VAL 58 -4.188 -19.051 14.201 518 HA VAL 58 HA VAL 58 -6.925 -19.895 14.744 519 HB VAL 58 HB VAL 58 -5.713 -17.849 12.871 520 HG11 VAL 58 HG11 VAL 58 -8.659 -18.379 13.429 521 HG12 VAL 58 HG12 VAL 58 -8.031 -16.873 12.727 522 HG13 VAL 58 HG13 VAL 58 -7.832 -18.390 11.850 523 HG21 VAL 58 HG21 VAL 58 -6.599 -16.257 14.536 524 HG22 VAL 58 HG22 VAL 58 -7.306 -17.590 15.473 525 HG23 VAL 58 HG23 VAL 58 -5.543 -17.430 15.333 526 H ASN 59 H ASN 59 -8.123 -21.384 13.675 527 HA ASN 59 HA ASN 59 -7.277 -22.750 11.253 528 HB2 ASN 59 HB2 ASN 59 -9.995 -22.624 12.653 529 HB3 ASN 59 HB3 ASN 59 -9.550 -23.765 11.401 530 HD21 ASN 59 HD21 ASN 59 -7.894 -25.940 13.651 531 HD22 ASN 59 HD22 ASN 59 -8.272 -25.579 11.965 532 H MET 60 H MET 60 -8.103 -22.485 9.090 533 HA MET 60 HA MET 60 -8.831 -19.867 8.267 534 HB2 MET 60 HB2 MET 60 -7.796 -21.615 6.851 535 HB3 MET 60 HB3 MET 60 -9.300 -22.529 6.879 536 HG2 MET 60 HG2 MET 60 -9.168 -21.331 4.794 537 HG3 MET 60 HG3 MET 60 -10.452 -20.615 5.754 538 HE1 MET 60 HE1 MET 60 -10.654 -18.096 6.034 539 HE2 MET 60 HE2 MET 60 -9.756 -17.122 4.859 540 HE3 MET 60 HE3 MET 60 -10.610 -18.583 4.318 541 H SER 61 H SER 61 -10.978 -22.649 8.983 542 HA SER 61 HA SER 61 -13.487 -21.403 8.481 543 HB2 SER 61 HB2 SER 61 -14.322 -23.137 10.077 544 HB3 SER 61 HB3 SER 61 -13.288 -23.786 8.797 545 HG SER 61 HG SER 61 -12.791 -24.543 10.987 546 H GLU 62 H GLU 62 -11.384 -21.300 11.375 547 HA GLU 62 HA GLU 62 -13.279 -19.839 13.008 548 HB2 GLU 62 HB2 GLU 62 -11.507 -21.213 14.003 549 HB3 GLU 62 HB3 GLU 62 -10.279 -20.206 13.258 550 HG2 GLU 62 HG2 GLU 62 -10.415 -19.633 15.555 551 HG3 GLU 62 HG3 GLU 62 -10.988 -18.268 14.611 552 H LEU 63 H LEU 63 -10.517 -18.777 10.951 553 HA LEU 63 HA LEU 63 -10.825 -15.964 11.375 554 HB2 LEU 63 HB2 LEU 63 -8.891 -16.863 10.198 555 HB3 LEU 63 HB3 LEU 63 -9.916 -17.537 8.935 556 HG LEU 63 HG LEU 63 -10.565 -15.227 8.226 557 HD11 LEU 63 HD11 LEU 63 -9.170 -13.318 9.058 558 HD12 LEU 63 HD12 LEU 63 -10.231 -13.976 10.311 559 HD13 LEU 63 HD13 LEU 63 -8.505 -14.387 10.318 560 HD21 LEU 63 HD21 LEU 63 -8.668 -16.428 7.178 561 HD22 LEU 63 HD22 LEU 63 -8.470 -14.668 7.145 562 HD23 LEU 63 HD23 LEU 63 -7.557 -15.640 8.327 563 H ILE 64 H ILE 64 -12.433 -18.138 9.015 564 HA ILE 64 HA ILE 64 -14.155 -16.168 7.858 565 HB ILE 64 HB ILE 64 -14.274 -19.183 8.144 566 HG12 ILE 64 HG12 ILE 64 -13.992 -17.260 5.808 567 HG13 ILE 64 HG13 ILE 64 -12.658 -18.004 6.654 568 HG21 ILE 64 HG21 ILE 64 -16.239 -19.256 6.645 569 HG22 ILE 64 HG22 ILE 64 -16.645 -18.534 8.189 570 HG23 ILE 64 HG23 ILE 64 -16.402 -17.486 6.767 571 HD11 ILE 64 HD11 ILE 64 -12.957 -19.222 4.632 572 HD12 ILE 64 HD12 ILE 64 -13.516 -20.268 5.952 573 HD13 ILE 64 HD13 ILE 64 -14.690 -19.403 4.908 574 H LYS 65 H LYS 65 -14.709 -18.217 10.749 575 HA LYS 65 HA LYS 65 -17.284 -17.221 11.332 576 HB2 LYS 65 HB2 LYS 65 -16.021 -19.244 12.291 577 HB3 LYS 65 HB3 LYS 65 -15.295 -18.116 13.450 578 HG2 LYS 65 HG2 LYS 65 -17.608 -17.443 14.162 579 HG3 LYS 65 HG3 LYS 65 -18.272 -18.584 12.976 580 HD2 LYS 65 HD2 LYS 65 -17.161 -20.467 14.169 581 HD3 LYS 65 HD3 LYS 65 -16.485 -19.326 15.347 582 HE2 LYS 65 HE2 LYS 65 -18.789 -18.642 16.002 583 HE3 LYS 65 HE3 LYS 65 -19.463 -19.781 14.830 584 HZ1 LYS 65 HZ1 LYS 65 -17.791 -20.550 17.175 585 HZ2 LYS 65 HZ2 LYS 65 -19.408 -20.751 17.063 586 HZ3 LYS 65 HZ3 LYS 65 -18.419 -21.602 16.088 587 H ILE 66 H ILE 66 -14.125 -15.832 12.478 588 HA ILE 66 HA ILE 66 -15.477 -13.727 13.929 589 HB ILE 66 HB ILE 66 -13.381 -14.051 14.682 590 HG12 ILE 66 HG12 ILE 66 -14.043 -11.618 14.507 591 HG13 ILE 66 HG13 ILE 66 -12.372 -11.991 14.824 592 HG21 ILE 66 HG21 ILE 66 -12.210 -15.142 12.933 593 HG22 ILE 66 HG22 ILE 66 -12.180 -13.678 11.928 594 HG23 ILE 66 HG23 ILE 66 -11.255 -13.759 13.438 595 HD11 ILE 66 HD11 ILE 66 -13.427 -10.962 12.168 596 HD12 ILE 66 HD12 ILE 66 -12.456 -10.098 13.358 597 HD13 ILE 66 HD13 ILE 66 -11.748 -11.443 12.478 598 H ILE 67 H ILE 67 -14.319 -13.759 10.510 599 HA ILE 67 HA ILE 67 -15.264 -11.072 10.013 600 HB ILE 67 HB ILE 67 -14.615 -13.413 8.211 601 HG12 ILE 67 HG12 ILE 67 -13.095 -11.584 7.229 602 HG13 ILE 67 HG13 ILE 67 -13.579 -10.559 8.579 603 HG21 ILE 67 HG21 ILE 67 -15.807 -10.760 7.269 604 HG22 ILE 67 HG22 ILE 67 -15.089 -12.001 6.224 605 HG23 ILE 67 HG23 ILE 67 -16.570 -12.359 7.099 606 HD11 ILE 67 HD11 ILE 67 -12.512 -12.193 10.135 607 HD12 ILE 67 HD12 ILE 67 -12.078 -13.208 8.732 608 HD13 ILE 67 HD13 ILE 67 -11.377 -11.600 8.920 609 H ARG 68 H ARG 68 -16.959 -14.201 9.613 610 HA ARG 68 HA ARG 68 -19.440 -13.183 8.703 611 HB2 ARG 68 HB2 ARG 68 -18.680 -15.556 8.639 612 HB3 ARG 68 HB3 ARG 68 -18.808 -15.646 10.389 613 HG2 ARG 68 HG2 ARG 68 -20.653 -16.769 9.314 614 HG3 ARG 68 HG3 ARG 68 -21.264 -15.420 10.267 615 HD2 ARG 68 HD2 ARG 68 -21.936 -14.222 8.390 616 HD3 ARG 68 HD3 ARG 68 -20.654 -14.869 7.377 617 HE ARG 68 HE ARG 68 -21.852 -17.018 7.243 618 HH11 ARG 68 HH11 ARG 68 -23.905 -14.365 8.275 619 HH12 ARG 68 HH12 ARG 68 -25.281 -14.980 7.410 620 HH21 ARG 68 HH21 ARG 68 -23.700 -17.744 6.167 621 HH22 ARG 68 HH22 ARG 68 -25.096 -16.691 6.097 622 H ARG 69 H ARG 69 -18.296 -13.517 12.060 623 HA ARG 69 HA ARG 69 -20.841 -12.516 13.139 624 HB2 ARG 69 HB2 ARG 69 -19.581 -14.268 14.315 625 HB3 ARG 69 HB3 ARG 69 -18.194 -13.196 14.489 626 HG2 ARG 69 HG2 ARG 69 -19.437 -13.351 16.589 627 HG3 ARG 69 HG3 ARG 69 -19.483 -11.705 15.971 628 HD2 ARG 69 HD2 ARG 69 -21.811 -12.256 14.999 629 HD3 ARG 69 HD3 ARG 69 -21.702 -13.786 15.864 630 HE ARG 69 HE ARG 69 -22.025 -12.691 17.889 631 HH11 ARG 69 HH11 ARG 69 -21.582 -10.166 15.440 632 HH12 ARG 69 HH12 ARG 69 -22.358 -8.977 16.453 633 HH21 ARG 69 HH21 ARG 69 -22.927 -11.085 19.106 634 HH22 ARG 69 HH22 ARG 69 -23.038 -9.469 18.484 635 H ARG 70 H ARG 70 -17.670 -11.013 12.519 636 HA ARG 70 HA ARG 70 -18.369 -8.483 13.851 637 HB2 ARG 70 HB2 ARG 70 -16.243 -9.194 11.788 638 HB3 ARG 70 HB3 ARG 70 -16.407 -7.594 12.503 639 HG2 ARG 70 HG2 ARG 70 -15.837 -10.127 14.110 640 HG3 ARG 70 HG3 ARG 70 -14.631 -8.991 13.514 641 HD2 ARG 70 HD2 ARG 70 -14.866 -8.391 15.721 642 HD3 ARG 70 HD3 ARG 70 -15.847 -7.189 14.871 643 HE ARG 70 HE ARG 70 -17.349 -9.535 15.805 644 HH11 ARG 70 HH11 ARG 70 -18.949 -9.198 17.368 645 HH12 ARG 70 HH12 ARG 70 -18.830 -7.824 18.423 646 HH21 ARG 70 HH21 ARG 70 -17.236 -6.344 18.211 647 HH22 ARG 70 HH22 ARG 70 -15.944 -6.583 17.059 648 H LEU 71 H LEU 71 -18.688 -9.663 10.505 649 HA LEU 71 HA LEU 71 -19.978 -7.213 9.548 650 HB2 LEU 71 HB2 LEU 71 -20.041 -10.091 8.537 651 HB3 LEU 71 HB3 LEU 71 -20.784 -8.733 7.702 652 HG LEU 71 HG LEU 71 -17.779 -8.990 8.224 653 HD11 LEU 71 HD11 LEU 71 -19.408 -9.395 5.676 654 HD12 LEU 71 HD12 LEU 71 -17.640 -9.487 5.817 655 HD13 LEU 71 HD13 LEU 71 -18.650 -10.688 6.643 656 HD21 LEU 71 HD21 LEU 71 -19.379 -7.020 6.540 657 HD22 LEU 71 HD22 LEU 71 -18.416 -6.641 7.988 658 HD23 LEU 71 HD23 LEU 71 -17.612 -7.187 6.519 659 H GLN 72 H GLN 72 -22.237 -6.789 9.490 660 HA GLN 72 HA GLN 72 -23.803 -8.137 11.529 661 HB2 GLN 72 HB2 GLN 72 -24.362 -5.714 9.801 662 HB3 GLN 72 HB3 GLN 72 -25.487 -6.355 11.013 663 HG2 GLN 72 HG2 GLN 72 -23.766 -6.102 12.778 664 HG3 GLN 72 HG3 GLN 72 -22.649 -5.396 11.613 665 HE21 GLN 72 HE21 GLN 72 -24.285 -2.577 13.414 666 HE22 GLN 72 HE22 GLN 72 -23.242 -3.919 13.865 667 H LEU 73 H LEU 73 -23.441 -10.124 10.050 668 HA LEU 73 HA LEU 73 -25.817 -10.561 8.270 669 HB2 LEU 73 HB2 LEU 73 -22.933 -11.481 7.906 670 HB3 LEU 73 HB3 LEU 73 -24.286 -11.998 6.901 671 HG LEU 73 HG LEU 73 -23.299 -9.120 7.143 672 HD11 LEU 73 HD11 LEU 73 -22.348 -9.450 4.926 673 HD12 LEU 73 HD12 LEU 73 -21.670 -10.650 6.041 674 HD13 LEU 73 HD13 LEU 73 -22.926 -11.138 4.888 675 HD21 LEU 73 HD21 LEU 73 -24.711 -8.738 5.140 676 HD22 LEU 73 HD22 LEU 73 -25.308 -10.407 5.234 677 HD23 LEU 73 HD23 LEU 73 -25.686 -9.224 6.510 678 H ASN 74 H ASN 74 -27.029 -11.509 9.861 679 HA ASN 74 HA ASN 74 -26.207 -13.731 11.493 680 HB2 ASN 74 HB2 ASN 74 -28.953 -12.770 10.570 681 HB3 ASN 74 HB3 ASN 74 -28.704 -13.987 11.817 682 HD21 ASN 74 HD21 ASN 74 -29.161 -10.581 13.372 683 HD22 ASN 74 HD22 ASN 74 -30.052 -11.399 12.099 684 H ALA 75 H ALA 75 -27.349 -15.920 11.361 685 HA ALA 75 HA ALA 75 -26.296 -17.417 9.284 686 HB1 ALA 75 HB1 ALA 75 -27.026 -18.249 11.501 687 HB2 ALA 75 HB2 ALA 75 -28.726 -18.022 11.018 688 HB3 ALA 75 HB3 ALA 75 -27.715 -19.224 10.189 689 H ASN 76 H ASN 76 -29.539 -15.981 9.378 690 HA ASN 76 HA ASN 76 -30.703 -17.308 7.137 691 HB2 ASN 76 HB2 ASN 76 -31.924 -16.058 8.879 692 HB3 ASN 76 HB3 ASN 76 -31.183 -14.546 8.356 693 HD21 ASN 76 HD21 ASN 76 -33.502 -14.031 5.758 694 HD22 ASN 76 HD22 ASN 76 -32.046 -13.458 6.578 695 H GLN 77 H GLN 77 -28.369 -14.642 7.241 696 HA GLN 77 HA GLN 77 -28.924 -13.732 4.508 697 HB2 GLN 77 HB2 GLN 77 -26.548 -13.041 6.282 698 HB3 GLN 77 HB3 GLN 77 -27.112 -12.185 4.855 699 HG2 GLN 77 HG2 GLN 77 -28.395 -12.296 7.602 700 HG3 GLN 77 HG3 GLN 77 -27.768 -10.895 6.741 701 HE21 GLN 77 HE21 GLN 77 -30.739 -10.627 4.637 702 HE22 GLN 77 HE22 GLN 77 -29.019 -10.271 4.658 703 H ALA 78 H ALA 78 -27.873 -14.321 2.664 704 HA ALA 78 HA ALA 78 -26.094 -16.608 2.645 705 HB1 ALA 78 HB1 ALA 78 -27.725 -16.183 0.846 706 HB2 ALA 78 HB2 ALA 78 -26.888 -14.671 0.428 707 HB3 ALA 78 HB3 ALA 78 -26.070 -16.232 0.220 708 H PHE 79 H PHE 79 -23.917 -16.675 2.589 709 HA PHE 79 HA PHE 79 -22.277 -14.432 1.830 710 HB2 PHE 79 HB2 PHE 79 -22.593 -13.523 3.916 711 HB3 PHE 79 HB3 PHE 79 -22.595 -15.080 4.717 712 HD1 PHE 79 HD1 PHE 79 -20.557 -12.247 3.778 713 HD2 PHE 79 HD2 PHE 79 -20.428 -16.378 5.007 714 HE1 PHE 79 HE1 PHE 79 -18.179 -11.982 4.462 715 HE2 PHE 79 HE2 PHE 79 -18.057 -16.108 5.671 716 HZ PHE 79 HZ PHE 79 -16.930 -13.907 5.402 717 H PHE 80 H PHE 80 -20.255 -14.842 1.212 718 HA PHE 80 HA PHE 80 -18.989 -17.434 1.899 719 HB2 PHE 80 HB2 PHE 80 -19.290 -16.357 -0.927 720 HB3 PHE 80 HB3 PHE 80 -18.240 -17.684 -0.452 721 HD1 PHE 80 HD1 PHE 80 -19.138 -19.893 0.208 722 HD2 PHE 80 HD2 PHE 80 -21.709 -16.682 -1.069 723 HE1 PHE 80 HE1 PHE 80 -20.991 -21.512 -0.144 724 HE2 PHE 80 HE2 PHE 80 -23.566 -18.298 -1.417 725 HZ PHE 80 HZ PHE 80 -23.204 -20.718 -0.954 726 H LEU 81 H LEU 81 -16.923 -17.210 2.519 727 HA LEU 81 HA LEU 81 -15.443 -14.722 1.807 728 HB2 LEU 81 HB2 LEU 81 -15.611 -15.415 4.187 729 HB3 LEU 81 HB3 LEU 81 -14.774 -16.904 3.795 730 HG LEU 81 HG LEU 81 -13.385 -15.206 4.924 731 HD11 LEU 81 HD11 LEU 81 -11.413 -15.498 3.719 732 HD12 LEU 81 HD12 LEU 81 -12.393 -16.919 3.319 733 HD13 LEU 81 HD13 LEU 81 -12.223 -15.577 2.149 734 HD21 LEU 81 HD21 LEU 81 -13.531 -13.532 2.383 735 HD22 LEU 81 HD22 LEU 81 -14.353 -13.158 3.921 736 HD23 LEU 81 HD23 LEU 81 -12.583 -13.196 3.838 737 H LEU 82 H LEU 82 -14.143 -14.775 0.157 738 HA LEU 82 HA LEU 82 -13.473 -17.337 -1.178 739 HB2 LEU 82 HB2 LEU 82 -13.788 -14.571 -2.365 740 HB3 LEU 82 HB3 LEU 82 -13.663 -16.087 -3.240 741 HG LEU 82 HG LEU 82 -16.016 -15.181 -1.520 742 HD11 LEU 82 HD11 LEU 82 -15.761 -13.977 -3.678 743 HD12 LEU 82 HD12 LEU 82 -15.766 -15.537 -4.532 744 HD13 LEU 82 HD13 LEU 82 -17.202 -14.993 -3.631 745 HD21 LEU 82 HD21 LEU 82 -15.594 -17.707 -3.172 746 HD22 LEU 82 HD22 LEU 82 -15.894 -17.602 -1.421 747 HD23 LEU 82 HD23 LEU 82 -17.170 -17.162 -2.560 748 H VAL 83 H VAL 83 -11.438 -17.778 -0.327 749 HA VAL 83 HA VAL 83 -9.281 -15.774 -0.248 750 HB VAL 83 HB VAL 83 -9.050 -18.779 -0.005 751 HG11 VAL 83 HG11 VAL 83 -7.191 -16.509 0.818 752 HG12 VAL 83 HG12 VAL 83 -6.935 -18.240 1.147 753 HG13 VAL 83 HG13 VAL 83 -6.912 -17.654 -0.511 754 HG21 VAL 83 HG21 VAL 83 -10.511 -18.035 1.784 755 HG22 VAL 83 HG22 VAL 83 -8.899 -18.305 2.461 756 HG23 VAL 83 HG23 VAL 83 -9.459 -16.649 2.133 757 H ASN 84 H ASN 84 -7.875 -15.311 -1.896 758 HA ASN 84 HA ASN 84 -7.380 -15.022 -4.126 759 HB2 ASN 84 HB2 ASN 84 -5.925 -16.886 -3.226 760 HB3 ASN 84 HB3 ASN 84 -6.998 -18.041 -4.014 761 HD21 ASN 84 HD21 ASN 84 -4.223 -17.617 -6.333 762 HD22 ASN 84 HD22 ASN 84 -4.597 -18.370 -4.766 763 H GLY 85 H GLY 85 -10.057 -14.890 -3.859 764 HA2 GLY 85 HA2 GLY 85 -11.946 -14.753 -5.137 765 HA3 GLY 85 HA3 GLY 85 -11.058 -15.464 -6.483 766 H HIS 86 H HIS 86 -10.984 -17.675 -3.852 767 HA HIS 86 HA HIS 86 -13.440 -19.094 -4.826 768 HB2 HIS 86 HB2 HIS 86 -10.650 -20.242 -4.469 769 HB3 HIS 86 HB3 HIS 86 -12.102 -21.188 -4.806 770 HD1 HIS 86 HD1 HIS 86 -9.660 -18.805 -6.578 771 HD2 HIS 86 HD2 HIS 86 -13.299 -20.867 -7.237 772 HE1 HIS 86 HE1 HIS 86 -10.090 -18.743 -9.120 773 HE2 HIS 86 HE2 HIS 86 -12.309 -19.993 -9.512 774 H SER 87 H SER 87 -14.573 -20.357 -3.420 775 HA SER 87 HA SER 87 -14.641 -19.415 -0.755 776 HB2 SER 87 HB2 SER 87 -16.609 -20.243 -1.910 777 HB3 SER 87 HB3 SER 87 -15.932 -21.887 -1.932 778 HG SER 87 HG SER 87 -17.329 -21.691 -0.183 779 H MET 88 H MET 88 -13.992 -20.084 1.189 780 HA MET 88 HA MET 88 -12.685 -22.761 1.489 781 HB2 MET 88 HB2 MET 88 -11.643 -20.113 2.549 782 HB3 MET 88 HB3 MET 88 -11.107 -21.680 3.141 783 HG2 MET 88 HG2 MET 88 -10.614 -22.275 0.685 784 HG3 MET 88 HG3 MET 88 -10.708 -20.531 0.390 785 HE1 MET 88 HE1 MET 88 -8.190 -22.594 -0.139 786 HE2 MET 88 HE2 MET 88 -8.210 -20.892 -0.640 787 HE3 MET 88 HE3 MET 88 -6.845 -21.524 0.308 788 H VAL 89 H VAL 89 -15.483 -21.612 2.225 789 HA VAL 89 HA VAL 89 -15.582 -21.398 5.062 790 HB VAL 89 HB VAL 89 -17.927 -21.453 4.952 791 HG11 VAL 89 HG11 VAL 89 -16.864 -19.450 3.946 792 HG12 VAL 89 HG12 VAL 89 -17.005 -20.190 2.332 793 HG13 VAL 89 HG13 VAL 89 -18.459 -19.802 3.268 794 HG21 VAL 89 HG21 VAL 89 -18.361 -23.459 3.648 795 HG22 VAL 89 HG22 VAL 89 -19.205 -22.091 2.927 796 HG23 VAL 89 HG23 VAL 89 -17.710 -22.695 2.183 797 H SER 90 H SER 90 -15.341 -24.317 3.223 798 HA SER 90 HA SER 90 -16.209 -26.040 5.454 799 HB2 SER 90 HB2 SER 90 -15.778 -27.844 3.830 800 HB3 SER 90 HB3 SER 90 -16.864 -26.602 3.185 801 HG SER 90 HG SER 90 -15.203 -27.202 1.680 802 H VAL 91 H VAL 91 -13.194 -24.561 4.619 803 HA VAL 91 HA VAL 91 -11.667 -26.956 5.286 804 HB VAL 91 HB VAL 91 -11.233 -25.432 3.277 805 HG11 VAL 91 HG11 VAL 91 -9.511 -23.799 3.492 806 HG12 VAL 91 HG12 VAL 91 -10.766 -23.367 4.670 807 HG13 VAL 91 HG13 VAL 91 -9.269 -24.149 5.212 808 HG21 VAL 91 HG21 VAL 91 -8.947 -26.577 4.934 809 HG22 VAL 91 HG22 VAL 91 -9.982 -27.474 3.795 810 HG23 VAL 91 HG23 VAL 91 -8.914 -26.201 3.201 811 H SER 92 H SER 92 -10.676 -27.513 7.056 812 HA SER 92 HA SER 92 -10.803 -25.744 9.389 813 HB2 SER 92 HB2 SER 92 -11.497 -28.117 9.425 814 HB3 SER 92 HB3 SER 92 -9.824 -28.606 9.109 815 HG SER 92 HG SER 92 -10.403 -28.665 11.351 816 H THR 93 H THR 93 -8.312 -26.467 7.109 817 HA THR 93 HA THR 93 -6.089 -26.691 8.673 818 HB THR 93 HB THR 93 -6.354 -27.021 6.177 819 HG1 THR 93 HG1 THR 93 -4.172 -27.101 6.031 820 HG21 THR 93 HG21 THR 93 -5.395 -25.347 4.722 821 HG22 THR 93 HG22 THR 93 -6.731 -24.577 5.597 822 HG23 THR 93 HG23 THR 93 -5.045 -24.271 6.084 823 HA PRO 94 HA PRO 94 -5.046 -22.935 10.684 824 HB2 PRO 94 HB2 PRO 94 -2.163 -23.567 10.041 825 HB3 PRO 94 HB3 PRO 94 -2.891 -23.073 11.603 826 HG2 PRO 94 HG2 PRO 94 -2.301 -25.667 11.169 827 HG3 PRO 94 HG3 PRO 94 -3.889 -25.237 11.892 828 HD2 PRO 94 HD2 PRO 94 -3.249 -25.859 8.999 829 HD3 PRO 94 HD3 PRO 94 -4.555 -26.522 10.029 830 H ILE 95 H ILE 95 -4.583 -20.766 10.318 831 HA ILE 95 HA ILE 95 -4.675 -19.844 7.662 832 HB ILE 95 HB ILE 95 -5.531 -18.642 9.643 833 HG12 ILE 95 HG12 ILE 95 -4.933 -16.361 9.051 834 HG13 ILE 95 HG13 ILE 95 -3.516 -16.894 8.154 835 HG21 ILE 95 HG21 ILE 95 -4.039 -17.311 11.079 836 HG22 ILE 95 HG22 ILE 95 -3.658 -19.021 11.224 837 HG23 ILE 95 HG23 ILE 95 -2.614 -17.956 10.256 838 HD11 ILE 95 HD11 ILE 95 -5.522 -16.288 6.751 839 HD12 ILE 95 HD12 ILE 95 -4.918 -17.921 6.450 840 HD13 ILE 95 HD13 ILE 95 -6.379 -17.687 7.438 841 H SER 96 H SER 96 -1.811 -20.614 9.547 842 HA SER 96 HA SER 96 0.141 -19.251 7.922 843 HB2 SER 96 HB2 SER 96 1.695 -20.914 8.966 844 HB3 SER 96 HB3 SER 96 0.723 -19.989 10.123 845 HG SER 96 HG SER 96 0.792 -22.312 10.531 846 H GLU 97 H GLU 97 -1.406 -22.485 7.662 847 HA GLU 97 HA GLU 97 0.235 -23.335 5.415 848 HB2 GLU 97 HB2 GLU 97 -0.913 -24.931 6.938 849 HB3 GLU 97 HB3 GLU 97 -2.470 -24.308 6.417 850 HG2 GLU 97 HG2 GLU 97 -2.116 -26.361 5.302 851 HG3 GLU 97 HG3 GLU 97 -2.030 -25.088 4.101 852 H VAL 98 H VAL 98 -2.994 -21.819 5.720 853 HA VAL 98 HA VAL 98 -3.442 -21.565 2.885 854 HB VAL 98 HB VAL 98 -4.538 -19.654 4.948 855 HG11 VAL 98 HG11 VAL 98 -5.606 -20.616 2.254 856 HG12 VAL 98 HG12 VAL 98 -6.403 -19.462 3.345 857 HG13 VAL 98 HG13 VAL 98 -4.884 -19.028 2.558 858 HG21 VAL 98 HG21 VAL 98 -6.541 -21.180 4.958 859 HG22 VAL 98 HG22 VAL 98 -5.567 -22.400 4.123 860 HG23 VAL 98 HG23 VAL 98 -5.125 -21.859 5.765 861 H TYR 99 H TYR 99 -1.729 -19.416 5.187 862 HA TYR 99 HA TYR 99 -1.032 -17.435 3.302 863 HB2 TYR 99 HB2 TYR 99 -0.664 -16.810 5.449 864 HB3 TYR 99 HB3 TYR 99 0.150 -18.286 5.887 865 HD1 TYR 99 HD1 TYR 99 0.571 -15.042 4.106 866 HD2 TYR 99 HD2 TYR 99 2.523 -18.582 5.632 867 HE1 TYR 99 HE1 TYR 99 2.799 -13.970 3.793 868 HE2 TYR 99 HE2 TYR 99 4.737 -17.512 5.285 869 HH TYR 99 HH TYR 99 5.868 -15.620 4.618 870 H GLU 100 H GLU 100 0.940 -20.332 4.070 871 HA GLU 100 HA GLU 100 2.896 -19.751 2.120 872 HB2 GLU 100 HB2 GLU 100 3.302 -21.351 3.865 873 HB3 GLU 100 HB3 GLU 100 1.934 -22.334 3.372 874 HG2 GLU 100 HG2 GLU 100 3.982 -23.425 2.778 875 HG3 GLU 100 HG3 GLU 100 3.054 -23.033 1.338 876 H SER 101 H SER 101 -0.248 -21.306 1.746 877 HA SER 101 HA SER 101 0.190 -22.141 -1.019 878 HB2 SER 101 HB2 SER 101 -2.343 -21.970 0.660 879 HB3 SER 101 HB3 SER 101 -2.212 -22.715 -0.941 880 HG SER 101 HG SER 101 -0.985 -23.533 1.488 881 H GLU 102 H GLU 102 -1.402 -19.308 0.482 882 HA GLU 102 HA GLU 102 -2.188 -18.317 -2.234 883 HB2 GLU 102 HB2 GLU 102 -3.692 -17.966 0.374 884 HB3 GLU 102 HB3 GLU 102 -4.229 -17.472 -1.220 885 HG2 GLU 102 HG2 GLU 102 -3.860 -20.331 -0.234 886 HG3 GLU 102 HG3 GLU 102 -5.376 -19.486 -0.455 887 H LYS 103 H LYS 103 0.121 -17.454 -0.100 888 HA LYS 103 HA LYS 103 -0.280 -14.593 -0.015 889 HB2 LYS 103 HB2 LYS 103 2.059 -14.411 0.534 890 HB3 LYS 103 HB3 LYS 103 1.328 -15.713 1.458 891 HG2 LYS 103 HG2 LYS 103 2.300 -17.344 -0.290 892 HG3 LYS 103 HG3 LYS 103 3.162 -15.950 -0.966 893 HD2 LYS 103 HD2 LYS 103 4.117 -15.590 1.397 894 HD3 LYS 103 HD3 LYS 103 3.492 -17.188 1.801 895 HE2 LYS 103 HE2 LYS 103 5.436 -16.534 -0.469 896 HE3 LYS 103 HE3 LYS 103 5.922 -17.130 1.116 897 HZ1 LYS 103 HZ1 LYS 103 5.766 -18.874 -0.634 898 HZ2 LYS 103 HZ2 LYS 103 4.896 -19.234 0.682 899 HZ3 LYS 103 HZ3 LYS 103 4.144 -18.701 -0.694 900 H ASP 104 H ASP 104 0.295 -12.974 -1.383 901 HA ASP 104 HA ASP 104 1.106 -13.670 -4.172 902 HB2 ASP 104 HB2 ASP 104 -0.958 -12.317 -3.714 903 HB3 ASP 104 HB3 ASP 104 0.076 -11.070 -3.015 904 H GLU 105 H GLU 105 2.548 -11.791 -5.118 905 HA GLU 105 HA GLU 105 5.133 -12.190 -4.042 906 HB2 GLU 105 HB2 GLU 105 4.131 -10.224 -6.138 907 HB3 GLU 105 HB3 GLU 105 5.842 -10.573 -5.819 908 HG2 GLU 105 HG2 GLU 105 5.423 -12.985 -6.311 909 HG3 GLU 105 HG3 GLU 105 3.765 -12.580 -6.774 910 H ASP 106 H ASP 106 2.924 -9.766 -3.020 911 HA ASP 106 HA ASP 106 4.975 -7.907 -1.989 912 HB2 ASP 106 HB2 ASP 106 3.066 -6.737 -0.967 913 HB3 ASP 106 HB3 ASP 106 2.917 -6.900 -2.708 914 H GLY 107 H GLY 107 3.472 -10.821 -1.047 915 HA2 GLY 107 HA2 GLY 107 4.002 -12.141 0.830 916 HA3 GLY 107 HA3 GLY 107 4.483 -10.712 1.741 917 H PHE 108 H PHE 108 1.532 -9.903 0.287 918 HA PHE 108 HA PHE 108 0.005 -10.488 2.719 919 HB2 PHE 108 HB2 PHE 108 -0.541 -8.840 0.300 920 HB3 PHE 108 HB3 PHE 108 -1.888 -9.474 1.192 921 HD1 PHE 108 HD1 PHE 108 0.563 -6.833 1.078 922 HD2 PHE 108 HD2 PHE 108 -2.167 -8.955 3.630 923 HE1 PHE 108 HE1 PHE 108 0.556 -4.925 2.674 924 HE2 PHE 108 HE2 PHE 108 -2.181 -7.049 5.229 925 HZ PHE 108 HZ PHE 108 -0.792 -5.037 4.754 926 H LEU 109 H LEU 109 -1.639 -11.884 3.057 927 HA LEU 109 HA LEU 109 -2.180 -13.950 0.998 928 HB2 LEU 109 HB2 LEU 109 -1.841 -14.319 3.547 929 HB3 LEU 109 HB3 LEU 109 -3.462 -13.667 3.727 930 HG LEU 109 HG LEU 109 -2.611 -16.200 2.259 931 HD11 LEU 109 HD11 LEU 109 -2.735 -16.270 4.747 932 HD12 LEU 109 HD12 LEU 109 -4.404 -15.702 4.680 933 HD13 LEU 109 HD13 LEU 109 -3.971 -17.294 4.012 934 HD21 LEU 109 HD21 LEU 109 -5.107 -16.644 2.070 935 HD22 LEU 109 HD22 LEU 109 -5.363 -14.899 2.362 936 HD23 LEU 109 HD23 LEU 109 -4.451 -15.471 0.939 937 H TYR 110 H TYR 110 -3.785 -13.611 -0.497 938 HA TYR 110 HA TYR 110 -5.613 -11.372 -0.049 939 HB2 TYR 110 HB2 TYR 110 -4.738 -12.751 -2.539 940 HB3 TYR 110 HB3 TYR 110 -6.175 -11.741 -2.512 941 HD1 TYR 110 HD1 TYR 110 -6.064 -9.347 -2.431 942 HD2 TYR 110 HD2 TYR 110 -2.514 -11.721 -1.779 943 HE1 TYR 110 HE1 TYR 110 -4.659 -7.282 -2.463 944 HE2 TYR 110 HE2 TYR 110 -1.137 -9.654 -1.778 945 HH TYR 110 HH TYR 110 -1.126 -7.413 -1.877 946 H MET 111 H MET 111 -7.673 -11.266 0.371 947 HA MET 111 HA MET 111 -9.401 -13.593 -0.296 948 HB2 MET 111 HB2 MET 111 -9.657 -12.079 2.333 949 HB3 MET 111 HB3 MET 111 -10.471 -13.556 1.833 950 HG2 MET 111 HG2 MET 111 -8.187 -14.684 1.828 951 HG3 MET 111 HG3 MET 111 -7.545 -13.228 2.593 952 HE1 MET 111 HE1 MET 111 -7.333 -16.261 3.501 953 HE2 MET 111 HE2 MET 111 -6.534 -14.956 4.415 954 HE3 MET 111 HE3 MET 111 -7.546 -16.143 5.257 955 H VAL 112 H VAL 112 -11.520 -13.094 -0.816 956 HA VAL 112 HA VAL 112 -12.446 -10.315 -0.512 957 HB VAL 112 HB VAL 112 -13.433 -10.122 -2.659 958 HG11 VAL 112 HG11 VAL 112 -11.525 -9.974 -4.133 959 HG12 VAL 112 HG12 VAL 112 -11.020 -9.506 -2.503 960 HG13 VAL 112 HG13 VAL 112 -10.595 -11.112 -3.141 961 HG21 VAL 112 HG21 VAL 112 -14.102 -12.399 -3.140 962 HG22 VAL 112 HG22 VAL 112 -13.129 -11.769 -4.468 963 HG23 VAL 112 HG23 VAL 112 -12.396 -12.895 -3.309 964 H TYR 113 H TYR 113 -14.961 -10.217 -0.537 965 HA TYR 113 HA TYR 113 -16.113 -12.911 0.162 966 HB2 TYR 113 HB2 TYR 113 -16.931 -12.230 2.233 967 HB3 TYR 113 HB3 TYR 113 -15.289 -11.614 2.240 968 HD1 TYR 113 HD1 TYR 113 -18.816 -10.775 2.438 969 HD2 TYR 113 HD2 TYR 113 -14.883 -9.141 1.768 970 HE1 TYR 113 HE1 TYR 113 -19.693 -8.480 2.857 971 HE2 TYR 113 HE2 TYR 113 -15.778 -6.845 2.159 972 HH TYR 113 HH TYR 113 -19.109 -6.266 3.185 973 H ALA 114 H ALA 114 -18.372 -13.010 -0.005 974 HA ALA 114 HA ALA 114 -19.793 -10.895 -1.542 975 HB1 ALA 114 HB1 ALA 114 -18.272 -12.283 -3.088 976 HB2 ALA 114 HB2 ALA 114 -19.224 -13.694 -2.630 977 HB3 ALA 114 HB3 ALA 114 -19.998 -12.335 -3.479 978 H SER 115 H SER 115 -22.018 -11.479 -2.024 979 HA SER 115 HA SER 115 -23.420 -13.121 -0.041 980 HB2 SER 115 HB2 SER 115 -24.403 -11.087 -0.997 981 HB3 SER 115 HB3 SER 115 -24.313 -11.778 -2.624 982 HG SER 115 HG SER 115 -26.414 -12.006 -1.672 983 H GLN 116 H GLN 116 -22.161 -13.559 -3.264 984 HA GLN 116 HA GLN 116 -22.771 -16.460 -3.332 985 HB2 GLN 116 HB2 GLN 116 -23.650 -16.331 -5.542 986 HB3 GLN 116 HB3 GLN 116 -24.580 -15.238 -4.531 987 HG2 GLN 116 HG2 GLN 116 -22.473 -14.441 -6.591 988 HG3 GLN 116 HG3 GLN 116 -24.211 -14.324 -6.773 989 HE21 GLN 116 HE21 GLN 116 -22.230 -11.476 -4.534 990 HE22 GLN 116 HE22 GLN 116 -21.376 -12.902 -5.163 991 H GLU 117 H GLU 117 -21.164 -17.686 -4.452 992 HA GLU 117 HA GLU 117 -18.565 -16.474 -4.631 993 HB2 GLU 117 HB2 GLU 117 -18.944 -18.780 -3.987 994 HB3 GLU 117 HB3 GLU 117 -19.564 -19.174 -5.600 995 HG2 GLU 117 HG2 GLU 117 -17.399 -18.887 -6.594 996 HG3 GLU 117 HG3 GLU 117 -16.769 -18.076 -5.161 997 H THR 118 H THR 118 -21.045 -16.901 -7.065 998 HA THR 118 HA THR 118 -19.594 -15.199 -8.930 999 HB THR 118 HB THR 118 -18.640 -17.332 -9.589 1000 HG1 THR 118 HG1 THR 118 -19.143 -17.148 -11.722 1001 HG21 THR 118 HG21 THR 118 -20.430 -18.909 -8.856 1002 HG22 THR 118 HG22 THR 118 -21.489 -18.298 -10.144 1003 HG23 THR 118 HG23 THR 118 -19.982 -19.147 -10.551 1004 H PHE 119 H PHE 119 -20.942 -14.302 -10.548 1005 HA PHE 119 HA PHE 119 -23.802 -14.337 -9.991 1006 HB2 PHE 119 HB2 PHE 119 -23.920 -12.743 -11.966 1007 HB3 PHE 119 HB3 PHE 119 -23.165 -12.231 -10.474 1008 HD1 PHE 119 HD1 PHE 119 -22.459 -13.332 -13.958 1009 HD2 PHE 119 HD2 PHE 119 -20.831 -11.609 -10.356 1010 HE1 PHE 119 HE1 PHE 119 -20.391 -12.699 -15.190 1011 HE2 PHE 119 HE2 PHE 119 -18.772 -10.970 -11.593 1012 HZ PHE 119 HZ PHE 119 -18.548 -11.517 -14.009 1013 H GLY 120 H GLY 120 -21.870 -16.319 -11.884 1014 HA2 GLY 120 HA2 GLY 120 -22.463 -18.219 -13.090 1015 HA3 GLY 120 HA3 GLY 120 -24.168 -17.816 -12.887 1016 H1 ASP 10 H1 ASP 10 -8.581 -1.162 20.671 1017 H2 ASP 10 H2 ASP 10 -7.286 -2.160 20.500 1018 H3 ASP 10 H3 ASP 10 -7.215 -0.886 21.540 1019 HA ASP 10 HA ASP 10 -7.340 0.694 19.789 1020 HB2 ASP 10 HB2 ASP 10 -5.127 -1.336 19.426 1021 HB3 ASP 10 HB3 ASP 10 -5.175 0.211 18.588 1022 H TYR 11 H TYR 11 -6.776 1.000 17.337 1023 HA TYR 11 HA TYR 11 -9.213 0.236 16.155 1024 HB2 TYR 11 HB2 TYR 11 -8.306 1.484 14.113 1025 HB3 TYR 11 HB3 TYR 11 -8.669 2.320 15.608 1026 HD1 TYR 11 HD1 TYR 11 -5.833 0.908 13.605 1027 HD2 TYR 11 HD2 TYR 11 -7.031 3.602 16.768 1028 HE1 TYR 11 HE1 TYR 11 -3.533 1.879 13.660 1029 HE2 TYR 11 HE2 TYR 11 -4.734 4.552 16.821 1030 HH TYR 11 HH TYR 11 -2.612 4.496 15.927 1031 H GLU 12 H GLU 12 -9.938 -0.762 14.422 1032 HA GLU 12 HA GLU 12 -8.529 -3.127 13.457 1033 HB2 GLU 12 HB2 GLU 12 -10.511 -3.430 12.056 1034 HB3 GLU 12 HB3 GLU 12 -10.913 -3.266 13.758 1035 HG2 GLU 12 HG2 GLU 12 -11.060 -0.805 12.001 1036 HG3 GLU 12 HG3 GLU 12 -12.253 -2.068 11.776 1037 H SER 13 H SER 13 -8.299 -3.552 11.165 1038 HA SER 13 HA SER 13 -7.378 -3.310 9.130 1039 HB2 SER 13 HB2 SER 13 -9.849 -2.924 9.142 1040 HB3 SER 13 HB3 SER 13 -9.522 -1.200 8.927 1041 HG SER 13 HG SER 13 -8.450 -1.714 6.964 1042 H ASP 14 H ASP 14 -6.829 -0.163 10.686 1043 HA ASP 14 HA ASP 14 -6.096 1.125 8.279 1044 HB2 ASP 14 HB2 ASP 14 -6.890 2.237 10.353 1045 HB3 ASP 14 HB3 ASP 14 -5.303 1.980 11.069 1046 H ASP 15 H ASP 15 -3.411 1.366 10.633 1047 HA ASP 15 HA ASP 15 -1.668 -0.375 9.120 1048 HB2 ASP 15 HB2 ASP 15 -0.113 1.209 8.246 1049 HB3 ASP 15 HB3 ASP 15 -1.694 1.572 7.612 1050 H ASP 16 H ASP 16 0.738 0.159 9.738 1051 HA ASP 16 HA ASP 16 2.333 -0.065 11.239 1052 HB2 ASP 16 HB2 ASP 16 1.052 2.446 12.253 1053 HB3 ASP 16 HB3 ASP 16 2.565 1.814 12.887 1054 H SER 17 H SER 17 1.164 1.027 14.204 1055 HA SER 17 HA SER 17 1.797 -1.544 15.373 1056 HB2 SER 17 HB2 SER 17 1.476 -0.326 17.511 1057 HB3 SER 17 HB3 SER 17 2.592 0.483 16.402 1058 HG SER 17 HG SER 17 1.083 1.964 17.327 1059 H TYR 18 H TYR 18 -0.883 -0.991 13.809 1060 HA TYR 18 HA TYR 18 -3.016 -1.095 15.540 1061 HB2 TYR 18 HB2 TYR 18 -4.378 -1.927 13.654 1062 HB3 TYR 18 HB3 TYR 18 -3.462 -0.473 13.405 1063 HD1 TYR 18 HD1 TYR 18 -4.633 -1.367 11.210 1064 HD2 TYR 18 HD2 TYR 18 -1.025 -3.052 12.819 1065 HE1 TYR 18 HE1 TYR 18 -4.044 -2.275 8.955 1066 HE2 TYR 18 HE2 TYR 18 -0.444 -3.934 10.593 1067 HH TYR 18 HH TYR 18 -1.099 -4.161 8.290 1068 H GLU 19 H GLU 19 -4.529 -2.496 16.364 1069 HA GLU 19 HA GLU 19 -3.694 -5.298 16.829 1070 HB2 GLU 19 HB2 GLU 19 -6.046 -3.615 17.732 1071 HB3 GLU 19 HB3 GLU 19 -5.974 -5.367 18.013 1072 HG2 GLU 19 HG2 GLU 19 -3.828 -5.146 19.188 1073 HG3 GLU 19 HG3 GLU 19 -3.830 -3.401 18.925 1074 H VAL 20 H VAL 20 -5.723 -3.595 14.618 1075 HA VAL 20 HA VAL 20 -6.663 -4.065 12.736 1076 HB VAL 20 HB VAL 20 -5.435 -6.690 12.182 1077 HG11 VAL 20 HG11 VAL 20 -4.941 -5.562 10.065 1078 HG12 VAL 20 HG12 VAL 20 -6.649 -5.330 10.489 1079 HG13 VAL 20 HG13 VAL 20 -5.485 -4.016 10.729 1080 HG21 VAL 20 HG21 VAL 20 -3.244 -5.442 11.692 1081 HG22 VAL 20 HG22 VAL 20 -3.829 -4.236 12.830 1082 HG23 VAL 20 HG23 VAL 20 -3.556 -5.888 13.375 1083 H LEU 21 H LEU 21 -6.902 -7.162 14.442 1084 HA LEU 21 HA LEU 21 -9.175 -8.051 12.775 1085 HB2 LEU 21 HB2 LEU 21 -7.105 -9.394 13.546 1086 HB3 LEU 21 HB3 LEU 21 -7.818 -9.382 15.145 1087 HG LEU 21 HG LEU 21 -9.815 -10.645 14.178 1088 HD11 LEU 21 HD11 LEU 21 -9.639 -10.054 11.806 1089 HD12 LEU 21 HD12 LEU 21 -8.002 -10.742 11.723 1090 HD13 LEU 21 HD13 LEU 21 -9.403 -11.794 11.978 1091 HD21 LEU 21 HD21 LEU 21 -7.077 -11.908 13.809 1092 HD22 LEU 21 HD22 LEU 21 -7.966 -11.783 15.342 1093 HD23 LEU 21 HD23 LEU 21 -8.619 -12.778 14.027 1094 H ASP 22 H ASP 22 -8.980 -6.105 15.466 1095 HA ASP 22 HA ASP 22 -10.168 -5.578 17.234 1096 HB2 ASP 22 HB2 ASP 22 -11.783 -4.775 15.848 1097 HB3 ASP 22 HB3 ASP 22 -12.358 -6.365 15.379 1098 H LEU 23 H LEU 23 -11.110 -8.888 16.455 1099 HA LEU 23 HA LEU 23 -11.584 -9.867 19.098 1100 HB2 LEU 23 HB2 LEU 23 -12.294 -11.123 17.170 1101 HB3 LEU 23 HB3 LEU 23 -10.678 -11.078 16.472 1102 HG LEU 23 HG LEU 23 -9.856 -12.592 18.271 1103 HD11 LEU 23 HD11 LEU 23 -12.821 -12.904 18.925 1104 HD12 LEU 23 HD12 LEU 23 -11.489 -13.877 19.591 1105 HD13 LEU 23 HD13 LEU 23 -11.619 -12.166 19.997 1106 HD21 LEU 23 HD21 LEU 23 -10.511 -13.459 16.061 1107 HD22 LEU 23 HD22 LEU 23 -10.786 -14.625 17.349 1108 HD23 LEU 23 HD23 LEU 23 -12.165 -13.724 16.671 1109 H THR 24 H THR 24 -10.248 -10.589 20.696 1110 HA THR 24 HA THR 24 -7.567 -9.966 20.931 1111 HB THR 24 HB THR 24 -8.610 -12.319 22.447 1112 HG1 THR 24 HG1 THR 24 -9.815 -10.926 23.752 1113 HG21 THR 24 HG21 THR 24 -7.091 -9.793 23.248 1114 HG22 THR 24 HG22 THR 24 -7.586 -11.084 24.361 1115 HG23 THR 24 HG23 THR 24 -6.409 -11.432 23.094 1116 H GLU 25 H GLU 25 -5.567 -11.026 20.903 1117 HA GLU 25 HA GLU 25 -5.201 -12.796 18.709 1118 HB2 GLU 25 HB2 GLU 25 -2.850 -12.766 19.320 1119 HB3 GLU 25 HB3 GLU 25 -3.548 -11.148 19.369 1120 HG2 GLU 25 HG2 GLU 25 -3.699 -11.248 21.830 1121 HG3 GLU 25 HG3 GLU 25 -3.094 -12.903 21.818 1122 H TYR 26 H TYR 26 -6.183 -13.730 21.807 1123 HA TYR 26 HA TYR 26 -5.632 -16.523 21.162 1124 HB2 TYR 26 HB2 TYR 26 -4.844 -15.312 23.778 1125 HB3 TYR 26 HB3 TYR 26 -5.258 -17.009 23.631 1126 HD1 TYR 26 HD1 TYR 26 -4.054 -18.442 21.836 1127 HD2 TYR 26 HD2 TYR 26 -2.595 -14.653 23.289 1128 HE1 TYR 26 HE1 TYR 26 -1.762 -19.012 21.033 1129 HE2 TYR 26 HE2 TYR 26 -0.308 -15.220 22.487 1130 HH TYR 26 HH TYR 26 1.021 -16.788 21.455 Start of MODEL 10 1 H1 MET 1 H1 MET 1 -11.708 -0.935 6.095 2 H2 MET 1 H2 MET 1 -10.146 -1.055 6.646 3 H3 MET 1 H3 MET 1 -11.377 -1.363 7.645 4 HA MET 1 HA MET 1 -10.432 0.746 8.159 5 HB2 MET 1 HB2 MET 1 -9.522 1.259 5.937 6 HB3 MET 1 HB3 MET 1 -11.151 1.486 5.292 7 HG2 MET 1 HG2 MET 1 -10.098 3.628 5.766 8 HG3 MET 1 HG3 MET 1 -11.503 3.414 6.799 9 HE1 MET 1 HE1 MET 1 -9.295 5.666 7.294 10 HE2 MET 1 HE2 MET 1 -10.693 5.427 8.372 11 HE3 MET 1 HE3 MET 1 -9.059 5.537 9.048 12 HA PRO 2 HA PRO 2 -14.739 0.662 9.167 13 HB2 PRO 2 HB2 PRO 2 -14.746 1.709 11.658 14 HB3 PRO 2 HB3 PRO 2 -13.992 0.124 11.258 15 HG2 PRO 2 HG2 PRO 2 -12.587 2.823 11.412 16 HG3 PRO 2 HG3 PRO 2 -12.176 1.314 12.305 17 HD2 PRO 2 HD2 PRO 2 -10.933 1.885 9.981 18 HD3 PRO 2 HD3 PRO 2 -11.489 0.220 10.334 19 H SER 3 H SER 3 -13.060 3.776 8.917 20 HA SER 3 HA SER 3 -15.431 5.367 9.263 21 HB2 SER 3 HB2 SER 3 -12.809 6.120 7.944 22 HB3 SER 3 HB3 SER 3 -14.106 7.232 8.421 23 HG SER 3 HG SER 3 -12.581 7.150 10.080 24 H GLU 4 H GLU 4 -13.574 4.971 6.171 25 HA GLU 4 HA GLU 4 -16.064 4.986 4.588 26 HB2 GLU 4 HB2 GLU 4 -13.997 7.225 4.552 27 HB3 GLU 4 HB3 GLU 4 -15.126 6.964 3.240 28 HG2 GLU 4 HG2 GLU 4 -15.867 7.711 6.088 29 HG3 GLU 4 HG3 GLU 4 -15.803 8.787 4.701 30 H LYS 5 H LYS 5 -15.871 4.352 2.512 31 HA LYS 5 HA LYS 5 -15.156 3.363 0.627 32 HB2 LYS 5 HB2 LYS 5 -12.695 5.062 1.158 33 HB3 LYS 5 HB3 LYS 5 -13.020 4.248 -0.366 34 HG2 LYS 5 HG2 LYS 5 -15.155 5.473 -0.600 35 HG3 LYS 5 HG3 LYS 5 -14.819 6.353 0.907 36 HD2 LYS 5 HD2 LYS 5 -12.694 7.214 -0.108 37 HD3 LYS 5 HD3 LYS 5 -13.122 6.446 -1.636 38 HE2 LYS 5 HE2 LYS 5 -14.772 8.583 -0.198 39 HE3 LYS 5 HE3 LYS 5 -13.644 8.905 -1.510 40 HZ1 LYS 5 HZ1 LYS 5 -15.028 7.498 -2.969 41 HZ2 LYS 5 HZ2 LYS 5 -16.113 7.253 -1.762 42 HZ3 LYS 5 HZ3 LYS 5 -15.886 8.742 -2.375 43 H THR 6 H THR 6 -13.396 2.154 -0.585 44 HA THR 6 HA THR 6 -12.729 -0.248 0.886 45 HB THR 6 HB THR 6 -12.141 -1.279 -1.039 46 HG1 THR 6 HG1 THR 6 -11.434 -0.157 -2.897 47 HG21 THR 6 HG21 THR 6 -13.732 -0.804 -2.768 48 HG22 THR 6 HG22 THR 6 -14.524 -0.462 -1.227 49 HG23 THR 6 HG23 THR 6 -13.928 0.878 -2.241 50 H PHE 7 H PHE 7 -10.463 -1.285 0.638 51 HA PHE 7 HA PHE 7 -8.835 0.307 2.334 52 HB2 PHE 7 HB2 PHE 7 -8.906 -1.926 2.801 53 HB3 PHE 7 HB3 PHE 7 -8.522 -2.409 1.163 54 HD1 PHE 7 HD1 PHE 7 -6.545 -3.616 1.084 55 HD2 PHE 7 HD2 PHE 7 -6.848 -0.267 3.775 56 HE1 PHE 7 HE1 PHE 7 -4.294 -4.121 1.979 57 HE2 PHE 7 HE2 PHE 7 -4.588 -0.758 4.653 58 HZ PHE 7 HZ PHE 7 -3.297 -2.701 3.749 59 H LYS 8 H LYS 8 -8.785 0.307 -1.059 60 HA LYS 8 HA LYS 8 -6.183 1.343 -1.587 61 HB2 LYS 8 HB2 LYS 8 -7.806 0.597 -3.286 62 HB3 LYS 8 HB3 LYS 8 -8.903 1.899 -2.843 63 HG2 LYS 8 HG2 LYS 8 -7.820 2.399 -4.921 64 HG3 LYS 8 HG3 LYS 8 -7.323 3.578 -3.709 65 HD2 LYS 8 HD2 LYS 8 -5.169 2.330 -3.400 66 HD3 LYS 8 HD3 LYS 8 -5.660 1.178 -4.642 67 HE2 LYS 8 HE2 LYS 8 -5.272 4.187 -5.037 68 HE3 LYS 8 HE3 LYS 8 -4.069 2.958 -5.417 69 HZ1 LYS 8 HZ1 LYS 8 -5.276 3.574 -7.409 70 HZ2 LYS 8 HZ2 LYS 8 -5.641 2.024 -7.063 71 HZ3 LYS 8 HZ3 LYS 8 -6.724 3.216 -6.748 72 H GLN 9 H GLN 9 -8.916 2.882 -0.002 73 HA GLN 9 HA GLN 9 -8.044 5.604 -0.191 74 HB2 GLN 9 HB2 GLN 9 -10.305 4.788 0.423 75 HB3 GLN 9 HB3 GLN 9 -9.699 4.218 1.977 76 HG2 GLN 9 HG2 GLN 9 -9.210 7.117 1.280 77 HG3 GLN 9 HG3 GLN 9 -10.874 6.638 1.554 78 HE21 GLN 9 HE21 GLN 9 -10.405 6.003 5.075 79 HE22 GLN 9 HE22 GLN 9 -11.355 5.421 3.716 80 H ARG 10 H ARG 10 -7.101 2.977 2.020 81 HA ARG 10 HA ARG 10 -5.335 4.801 3.599 82 HB2 ARG 10 HB2 ARG 10 -6.197 1.914 3.975 83 HB3 ARG 10 HB3 ARG 10 -4.937 2.656 4.952 84 HG2 ARG 10 HG2 ARG 10 -7.815 3.665 4.813 85 HG3 ARG 10 HG3 ARG 10 -7.156 2.590 6.041 86 HD2 ARG 10 HD2 ARG 10 -7.015 4.636 7.112 87 HD3 ARG 10 HD3 ARG 10 -5.382 4.441 6.477 88 HE ARG 10 HE ARG 10 -7.417 5.981 4.882 89 HH11 ARG 10 HH11 ARG 10 -7.016 7.914 4.238 90 HH12 ARG 10 HH12 ARG 10 -5.640 8.840 4.822 91 HH21 ARG 10 HH21 ARG 10 -4.244 7.897 6.312 92 HH22 ARG 10 HH22 ARG 10 -4.542 6.282 6.884 93 H ARG 11 H ARG 11 -4.967 1.900 1.519 94 HA ARG 11 HA ARG 11 -2.017 2.482 1.478 95 HB2 ARG 11 HB2 ARG 11 -3.498 -0.142 1.913 96 HB3 ARG 11 HB3 ARG 11 -1.800 -0.090 1.479 97 HG2 ARG 11 HG2 ARG 11 -2.942 1.138 4.020 98 HG3 ARG 11 HG3 ARG 11 -2.124 -0.421 3.879 99 HD2 ARG 11 HD2 ARG 11 -0.127 0.830 2.919 100 HD3 ARG 11 HD3 ARG 11 -0.894 2.329 3.459 101 HE ARG 11 HE ARG 11 0.075 0.046 5.163 102 HH11 ARG 11 HH11 ARG 11 -1.012 3.420 5.246 103 HH12 ARG 11 HH12 ARG 11 -0.247 3.646 6.798 104 HH21 ARG 11 HH21 ARG 11 1.094 0.494 6.944 105 HH22 ARG 11 HH22 ARG 11 0.793 2.016 7.801 106 H THR 12 H THR 12 -0.743 1.718 -0.092 107 HA THR 12 HA THR 12 -1.897 0.804 -2.659 108 HB THR 12 HB THR 12 -0.620 2.211 -3.980 109 HG1 THR 12 HG1 THR 12 1.059 3.493 -3.155 110 HG21 THR 12 HG21 THR 12 -1.286 4.074 -1.658 111 HG22 THR 12 HG22 THR 12 -1.127 4.489 -3.375 112 HG23 THR 12 HG23 THR 12 -2.479 3.486 -2.840 113 H PHE 13 H PHE 13 -0.167 -0.248 -4.119 114 HA PHE 13 HA PHE 13 0.868 -2.454 -2.820 115 HB2 PHE 13 HB2 PHE 13 0.537 -2.723 -5.056 116 HB3 PHE 13 HB3 PHE 13 1.413 -1.262 -5.489 117 HD1 PHE 13 HD1 PHE 13 3.839 -1.210 -5.741 118 HD2 PHE 13 HD2 PHE 13 1.794 -4.829 -4.588 119 HE1 PHE 13 HE1 PHE 13 5.888 -2.519 -6.218 120 HE2 PHE 13 HE2 PHE 13 3.850 -6.138 -5.063 121 HZ PHE 13 HZ PHE 13 5.901 -4.988 -5.883 122 H GLU 14 H GLU 14 2.914 0.398 -3.552 123 HA GLU 14 HA GLU 14 5.301 -0.748 -2.449 124 HB2 GLU 14 HB2 GLU 14 5.266 1.168 -3.955 125 HB3 GLU 14 HB3 GLU 14 4.436 2.155 -2.735 126 HG2 GLU 14 HG2 GLU 14 6.373 2.003 -1.241 127 HG3 GLU 14 HG3 GLU 14 7.188 0.911 -2.369 128 H GLN 15 H GLN 15 2.660 1.116 -0.900 129 HA GLN 15 HA GLN 15 3.993 1.233 1.693 130 HB2 GLN 15 HB2 GLN 15 1.065 1.616 0.992 131 HB3 GLN 15 HB3 GLN 15 1.844 2.064 2.513 132 HG2 GLN 15 HG2 GLN 15 2.390 3.287 -0.229 133 HG3 GLN 15 HG3 GLN 15 1.493 4.027 1.084 134 HE21 GLN 15 HE21 GLN 15 5.073 5.306 1.009 135 HE22 GLN 15 HE22 GLN 15 3.855 5.147 -0.249 136 H ARG 16 H ARG 16 1.826 -1.115 0.125 137 HA ARG 16 HA ARG 16 1.520 -2.731 2.557 138 HB2 ARG 16 HB2 ARG 16 0.977 -3.380 -0.354 139 HB3 ARG 16 HB3 ARG 16 0.650 -4.471 1.012 140 HG2 ARG 16 HG2 ARG 16 -0.747 -2.620 2.065 141 HG3 ARG 16 HG3 ARG 16 -0.572 -1.718 0.551 142 HD2 ARG 16 HD2 ARG 16 -1.852 -4.445 0.873 143 HD3 ARG 16 HD3 ARG 16 -2.706 -2.910 0.696 144 HE ARG 16 HE ARG 16 -0.913 -4.134 -1.411 145 HH11 ARG 16 HH11 ARG 16 -2.801 -3.242 -4.000 146 HH12 ARG 16 HH12 ARG 16 -1.389 -4.080 -3.352 147 HH21 ARG 16 HH21 ARG 16 -3.853 -2.253 -0.837 148 HH22 ARG 16 HH22 ARG 16 -4.188 -2.202 -2.543 149 H VAL 17 H VAL 17 3.797 -2.788 -0.183 150 HA VAL 17 HA VAL 17 5.307 -5.085 0.655 151 HB VAL 17 HB VAL 17 6.034 -2.602 -0.925 152 HG11 VAL 17 HG11 VAL 17 8.126 -3.783 -1.586 153 HG12 VAL 17 HG12 VAL 17 8.142 -3.287 0.111 154 HG13 VAL 17 HG13 VAL 17 7.829 -4.986 -0.311 155 HG21 VAL 17 HG21 VAL 17 4.526 -4.328 -1.964 156 HG22 VAL 17 HG22 VAL 17 6.080 -4.173 -2.795 157 HG23 VAL 17 HG23 VAL 17 5.782 -5.543 -1.704 158 H GLU 18 H GLU 18 5.506 -1.591 1.678 159 HA GLU 18 HA GLU 18 7.519 -2.155 3.677 160 HB2 GLU 18 HB2 GLU 18 5.503 0.102 3.450 161 HB3 GLU 18 HB3 GLU 18 6.654 -0.023 4.774 162 HG2 GLU 18 HG2 GLU 18 7.361 0.206 1.824 163 HG3 GLU 18 HG3 GLU 18 7.427 1.495 3.025 164 H ASP 19 H ASP 19 3.888 -2.008 4.033 165 HA ASP 19 HA ASP 19 3.920 -2.746 6.736 166 HB2 ASP 19 HB2 ASP 19 1.807 -3.175 4.647 167 HB3 ASP 19 HB3 ASP 19 1.629 -3.807 6.269 168 H VAL 20 H VAL 20 4.059 -5.099 4.024 169 HA VAL 20 HA VAL 20 4.012 -7.334 5.827 170 HB VAL 20 HB VAL 20 3.481 -7.602 3.458 171 HG11 VAL 20 HG11 VAL 20 5.289 -6.291 2.437 172 HG12 VAL 20 HG12 VAL 20 6.496 -7.487 2.964 173 HG13 VAL 20 HG13 VAL 20 5.234 -7.924 1.801 174 HG21 VAL 20 HG21 VAL 20 5.756 -9.377 4.447 175 HG22 VAL 20 HG22 VAL 20 4.049 -9.509 4.928 176 HG23 VAL 20 HG23 VAL 20 4.528 -9.803 3.250 177 H ARG 21 H ARG 21 6.769 -5.483 4.473 178 HA ARG 21 HA ARG 21 8.879 -6.986 5.704 179 HB2 ARG 21 HB2 ARG 21 9.328 -5.418 3.946 180 HB3 ARG 21 HB3 ARG 21 8.567 -4.089 4.818 181 HG2 ARG 21 HG2 ARG 21 10.380 -4.085 6.485 182 HG3 ARG 21 HG3 ARG 21 11.162 -5.445 5.645 183 HD2 ARG 21 HD2 ARG 21 11.453 -4.079 3.642 184 HD3 ARG 21 HD3 ARG 21 10.506 -2.770 4.338 185 HE ARG 21 HE ARG 21 13.210 -3.670 5.268 186 HH11 ARG 21 HH11 ARG 21 14.549 -2.171 6.173 187 HH12 ARG 21 HH12 ARG 21 14.046 -0.514 6.316 188 HH21 ARG 21 HH21 ARG 21 10.910 -0.964 4.973 189 HH22 ARG 21 HH22 ARG 21 12.057 0.131 5.693 190 H LEU 22 H LEU 22 7.066 -4.170 6.890 191 HA LEU 22 HA LEU 22 8.389 -3.989 9.431 192 HB2 LEU 22 HB2 LEU 22 5.713 -2.976 8.402 193 HB3 LEU 22 HB3 LEU 22 6.361 -2.554 9.988 194 HG LEU 22 HG LEU 22 7.947 -2.002 7.463 195 HD11 LEU 22 HD11 LEU 22 6.024 -0.115 8.880 196 HD12 LEU 22 HD12 LEU 22 7.098 0.289 7.512 197 HD13 LEU 22 HD13 LEU 22 5.765 -0.847 7.281 198 HD21 LEU 22 HD21 LEU 22 9.034 -0.305 8.883 199 HD22 LEU 22 HD22 LEU 22 8.024 -0.806 10.260 200 HD23 LEU 22 HD23 LEU 22 9.218 -1.923 9.565 201 H ILE 23 H ILE 23 5.188 -5.548 8.609 202 HA ILE 23 HA ILE 23 4.827 -6.387 11.316 203 HB ILE 23 HB ILE 23 3.139 -6.071 9.399 204 HG12 ILE 23 HG12 ILE 23 2.315 -6.469 11.538 205 HG13 ILE 23 HG13 ILE 23 1.494 -7.536 10.417 206 HG21 ILE 23 HG21 ILE 23 3.469 -9.069 9.025 207 HG22 ILE 23 HG22 ILE 23 2.323 -7.952 8.239 208 HG23 ILE 23 HG23 ILE 23 4.054 -7.838 7.897 209 HD11 ILE 23 HD11 ILE 23 3.537 -8.296 12.516 210 HD12 ILE 23 HD12 ILE 23 1.838 -8.752 12.432 211 HD13 ILE 23 HD13 ILE 23 2.974 -9.434 11.257 212 H ARG 24 H ARG 24 6.400 -8.066 8.556 213 HA ARG 24 HA ARG 24 6.966 -10.547 9.888 214 HB2 ARG 24 HB2 ARG 24 8.413 -8.980 7.728 215 HB3 ARG 24 HB3 ARG 24 9.042 -10.501 8.322 216 HG2 ARG 24 HG2 ARG 24 6.224 -10.276 7.196 217 HG3 ARG 24 HG3 ARG 24 7.649 -10.545 6.186 218 HD2 ARG 24 HD2 ARG 24 8.178 -12.575 7.577 219 HD3 ARG 24 HD3 ARG 24 6.604 -12.378 8.376 220 HE ARG 24 HE ARG 24 5.909 -12.363 5.729 221 HH11 ARG 24 HH11 ARG 24 7.816 -14.731 7.530 222 HH12 ARG 24 HH12 ARG 24 7.414 -15.989 6.387 223 HH21 ARG 24 HH21 ARG 24 5.441 -14.083 4.391 224 HH22 ARG 24 HH22 ARG 24 6.098 -15.666 4.767 225 H GLU 25 H GLU 25 8.684 -7.416 10.106 226 HA GLU 25 HA GLU 25 10.660 -8.492 11.979 227 HB2 GLU 25 HB2 GLU 25 9.900 -5.675 11.161 228 HB3 GLU 25 HB3 GLU 25 11.135 -6.012 12.361 229 HG2 GLU 25 HG2 GLU 25 11.188 -7.035 9.486 230 HG3 GLU 25 HG3 GLU 25 12.001 -5.582 10.052 231 H GLN 26 H GLN 26 7.562 -6.735 12.384 232 HA GLN 26 HA GLN 26 7.827 -6.216 15.180 233 HB2 GLN 26 HB2 GLN 26 5.373 -6.580 13.437 234 HB3 GLN 26 HB3 GLN 26 5.290 -6.016 15.101 235 HG2 GLN 26 HG2 GLN 26 6.222 -3.949 14.634 236 HG3 GLN 26 HG3 GLN 26 7.037 -4.502 13.177 237 HE21 GLN 26 HE21 GLN 26 2.995 -4.122 12.475 238 HE22 GLN 26 HE22 GLN 26 3.511 -5.169 13.783 239 H HIS 27 H HIS 27 6.001 -8.840 13.550 240 HA HIS 27 HA HIS 27 5.984 -10.507 16.031 241 HB2 HIS 27 HB2 HIS 27 3.441 -9.523 14.662 242 HB3 HIS 27 HB3 HIS 27 3.514 -10.708 15.961 243 HD1 HIS 27 HD1 HIS 27 5.086 -9.392 18.222 244 HD2 HIS 27 HD2 HIS 27 2.398 -7.380 15.651 245 HE1 HIS 27 HE1 HIS 27 4.244 -7.336 19.515 246 HE2 HIS 27 HE2 HIS 27 2.621 -6.108 17.944 247 HA PRO 28 HA PRO 28 6.637 -12.856 12.113 248 HB2 PRO 28 HB2 PRO 28 8.065 -14.662 14.062 249 HB3 PRO 28 HB3 PRO 28 8.548 -14.166 12.405 250 HG2 PRO 28 HG2 PRO 28 9.708 -12.986 14.553 251 HG3 PRO 28 HG3 PRO 28 9.174 -11.967 13.180 252 HD2 PRO 28 HD2 PRO 28 7.740 -12.478 15.782 253 HD3 PRO 28 HD3 PRO 28 8.050 -10.931 14.934 254 H THR 29 H THR 29 5.244 -13.925 15.174 255 HA THR 29 HA THR 29 3.965 -16.312 14.172 256 HB THR 29 HB THR 29 2.850 -16.476 16.213 257 HG1 THR 29 HG1 THR 29 2.697 -14.721 17.646 258 HG21 THR 29 HG21 THR 29 4.538 -16.264 17.910 259 HG22 THR 29 HG22 THR 29 5.367 -16.700 16.408 260 HG23 THR 29 HG23 THR 29 5.413 -15.019 17.003 261 H LYS 30 H LYS 30 3.219 -13.079 13.444 262 HA LYS 30 HA LYS 30 0.346 -13.749 12.986 263 HB2 LYS 30 HB2 LYS 30 1.706 -11.063 13.301 264 HB3 LYS 30 HB3 LYS 30 0.032 -11.272 12.742 265 HG2 LYS 30 HG2 LYS 30 -0.543 -12.496 14.805 266 HG3 LYS 30 HG3 LYS 30 1.124 -12.332 15.386 267 HD2 LYS 30 HD2 LYS 30 0.885 -9.899 15.543 268 HD3 LYS 30 HD3 LYS 30 -0.702 -9.970 14.774 269 HE2 LYS 30 HE2 LYS 30 -1.017 -9.676 17.155 270 HE3 LYS 30 HE3 LYS 30 -1.607 -11.268 16.674 271 HZ1 LYS 30 HZ1 LYS 30 -0.365 -11.481 18.699 272 HZ2 LYS 30 HZ2 LYS 30 0.538 -12.205 17.558 273 HZ3 LYS 30 HZ3 LYS 30 0.952 -10.706 18.110 274 H ILE 31 H ILE 31 -0.648 -13.512 11.166 275 HA ILE 31 HA ILE 31 1.010 -13.736 8.723 276 HB ILE 31 HB ILE 31 -1.683 -14.922 9.471 277 HG12 ILE 31 HG12 ILE 31 0.047 -15.903 10.872 278 HG13 ILE 31 HG13 ILE 31 -0.506 -17.057 9.677 279 HG21 ILE 31 HG21 ILE 31 -1.597 -14.744 7.085 280 HG22 ILE 31 HG22 ILE 31 0.091 -15.282 7.053 281 HG23 ILE 31 HG23 ILE 31 -1.200 -16.419 7.490 282 HD11 ILE 31 HD11 ILE 31 1.916 -17.204 9.976 283 HD12 ILE 31 HD12 ILE 31 1.547 -16.684 8.326 284 HD13 ILE 31 HD13 ILE 31 2.120 -15.509 9.532 285 HA PRO 32 HA PRO 32 -1.236 -10.131 7.362 286 HB2 PRO 32 HB2 PRO 32 0.169 -9.492 5.131 287 HB3 PRO 32 HB3 PRO 32 0.905 -9.465 6.759 288 HG2 PRO 32 HG2 PRO 32 0.999 -11.673 4.686 289 HG3 PRO 32 HG3 PRO 32 2.375 -10.941 5.571 290 HD2 PRO 32 HD2 PRO 32 1.159 -13.265 6.374 291 HD3 PRO 32 HD3 PRO 32 1.864 -12.092 7.523 292 H VAL 33 H VAL 33 -3.220 -9.839 6.471 293 HA VAL 33 HA VAL 33 -3.973 -11.297 3.980 294 HB VAL 33 HB VAL 33 -6.014 -12.135 5.104 295 HG11 VAL 33 HG11 VAL 33 -3.509 -13.134 6.553 296 HG12 VAL 33 HG12 VAL 33 -5.037 -13.989 6.346 297 HG13 VAL 33 HG13 VAL 33 -4.006 -13.650 4.937 298 HG21 VAL 33 HG21 VAL 33 -5.902 -10.496 7.043 299 HG22 VAL 33 HG22 VAL 33 -6.256 -12.173 7.488 300 HG23 VAL 33 HG23 VAL 33 -4.623 -11.479 7.738 301 H ILE 34 H ILE 34 -5.742 -10.421 2.825 302 HA ILE 34 HA ILE 34 -6.805 -7.748 3.721 303 HB ILE 34 HB ILE 34 -5.808 -8.536 0.956 304 HG12 ILE 34 HG12 ILE 34 -4.786 -6.307 2.768 305 HG13 ILE 34 HG13 ILE 34 -4.073 -7.907 2.712 306 HG21 ILE 34 HG21 ILE 34 -7.159 -5.960 1.905 307 HG22 ILE 34 HG22 ILE 34 -6.378 -6.167 0.328 308 HG23 ILE 34 HG23 ILE 34 -7.795 -7.117 0.712 309 HD11 ILE 34 HD11 ILE 34 -4.154 -5.995 0.366 310 HD12 ILE 34 HD12 ILE 34 -2.752 -6.489 1.332 311 HD13 ILE 34 HD13 ILE 34 -3.575 -7.677 0.316 312 H ILE 35 H ILE 35 -9.000 -7.459 3.433 313 HA ILE 35 HA ILE 35 -10.491 -9.599 1.990 314 HB ILE 35 HB ILE 35 -10.823 -10.047 4.284 315 HG12 ILE 35 HG12 ILE 35 -13.314 -8.717 3.132 316 HG13 ILE 35 HG13 ILE 35 -12.734 -10.352 2.781 317 HG21 ILE 35 HG21 ILE 35 -11.671 -8.545 5.940 318 HG22 ILE 35 HG22 ILE 35 -10.362 -7.675 5.167 319 HG23 ILE 35 HG23 ILE 35 -12.063 -7.311 4.735 320 HD11 ILE 35 HD11 ILE 35 -12.896 -10.817 5.299 321 HD12 ILE 35 HD12 ILE 35 -13.785 -9.289 5.435 322 HD13 ILE 35 HD13 ILE 35 -14.447 -10.592 4.448 323 H GLU 36 H GLU 36 -11.749 -8.941 0.387 324 HA GLU 36 HA GLU 36 -12.617 -6.077 0.312 325 HB2 GLU 36 HB2 GLU 36 -10.604 -6.150 -0.974 326 HB3 GLU 36 HB3 GLU 36 -11.078 -7.650 -1.759 327 HG2 GLU 36 HG2 GLU 36 -11.205 -5.863 -3.331 328 HG3 GLU 36 HG3 GLU 36 -12.809 -6.501 -3.048 329 H ARG 37 H ARG 37 -14.666 -5.744 -0.259 330 HA ARG 37 HA ARG 37 -16.479 -7.951 -0.689 331 HB2 ARG 37 HB2 ARG 37 -17.239 -5.961 0.441 332 HB3 ARG 37 HB3 ARG 37 -16.825 -4.944 -0.943 333 HG2 ARG 37 HG2 ARG 37 -18.606 -5.913 -2.292 334 HG3 ARG 37 HG3 ARG 37 -18.883 -7.180 -1.095 335 HD2 ARG 37 HD2 ARG 37 -20.636 -5.562 -0.975 336 HD3 ARG 37 HD3 ARG 37 -19.699 -5.512 0.526 337 HE ARG 37 HE ARG 37 -18.562 -3.534 -1.110 338 HH11 ARG 37 HH11 ARG 37 -21.807 -4.036 0.142 339 HH12 ARG 37 HH12 ARG 37 -22.156 -2.326 0.131 340 HH21 ARG 37 HH21 ARG 37 -19.059 -1.358 -0.987 341 HH22 ARG 37 HH22 ARG 37 -20.618 -0.862 -0.422 342 H TYR 38 H TYR 38 -17.309 -8.823 -2.509 343 HA TYR 38 HA TYR 38 -15.849 -8.734 -4.852 344 HB2 TYR 38 HB2 TYR 38 -16.944 -10.694 -4.445 345 HB3 TYR 38 HB3 TYR 38 -18.496 -9.915 -4.207 346 HD1 TYR 38 HD1 TYR 38 -20.107 -10.035 -5.906 347 HD2 TYR 38 HD2 TYR 38 -15.931 -10.525 -6.884 348 HE1 TYR 38 HE1 TYR 38 -20.701 -10.543 -8.283 349 HE2 TYR 38 HE2 TYR 38 -16.535 -11.006 -9.245 350 HH TYR 38 HH TYR 38 -18.240 -11.252 -10.776 351 H LYS 39 H LYS 39 -15.713 -7.755 -6.736 352 HA LYS 39 HA LYS 39 -16.692 -5.103 -6.874 353 HB2 LYS 39 HB2 LYS 39 -15.381 -6.856 -8.998 354 HB3 LYS 39 HB3 LYS 39 -15.682 -5.126 -9.195 355 HG2 LYS 39 HG2 LYS 39 -14.291 -4.631 -7.204 356 HG3 LYS 39 HG3 LYS 39 -13.943 -6.358 -7.010 357 HD2 LYS 39 HD2 LYS 39 -12.898 -6.406 -9.261 358 HD3 LYS 39 HD3 LYS 39 -13.251 -4.675 -9.462 359 HE2 LYS 39 HE2 LYS 39 -11.849 -4.177 -7.458 360 HE3 LYS 39 HE3 LYS 39 -11.501 -5.898 -7.269 361 HZ1 LYS 39 HZ1 LYS 39 -10.737 -4.256 -9.639 362 HZ2 LYS 39 HZ2 LYS 39 -9.714 -4.754 -8.472 363 HZ3 LYS 39 HZ3 LYS 39 -10.409 -5.847 -9.466 364 H GLY 40 H GLY 40 -17.838 -7.959 -8.655 365 HA2 GLY 40 HA2 GLY 40 -19.535 -6.485 -10.462 366 HA3 GLY 40 HA3 GLY 40 -19.474 -8.231 -10.259 367 H GLU 41 H GLU 41 -20.179 -7.824 -7.280 368 HA GLU 41 HA GLU 41 -22.957 -6.862 -7.389 369 HB2 GLU 41 HB2 GLU 41 -23.163 -9.181 -8.198 370 HB3 GLU 41 HB3 GLU 41 -22.273 -9.760 -6.802 371 HG2 GLU 41 HG2 GLU 41 -24.505 -10.292 -6.414 372 HG3 GLU 41 HG3 GLU 41 -24.122 -8.987 -5.310 373 H LYS 42 H LYS 42 -22.273 -5.296 -5.992 374 HA LYS 42 HA LYS 42 -21.025 -5.902 -3.414 375 HB2 LYS 42 HB2 LYS 42 -22.116 -3.308 -4.586 376 HB3 LYS 42 HB3 LYS 42 -21.181 -3.437 -3.099 377 HG2 LYS 42 HG2 LYS 42 -19.267 -4.406 -4.395 378 HG3 LYS 42 HG3 LYS 42 -20.178 -4.123 -5.892 379 HD2 LYS 42 HD2 LYS 42 -20.272 -1.668 -5.311 380 HD3 LYS 42 HD3 LYS 42 -19.305 -2.012 -3.876 381 HE2 LYS 42 HE2 LYS 42 -17.776 -1.171 -5.472 382 HE3 LYS 42 HE3 LYS 42 -17.460 -2.897 -5.378 383 HZ1 LYS 42 HZ1 LYS 42 -18.728 -3.178 -7.488 384 HZ2 LYS 42 HZ2 LYS 42 -19.115 -1.583 -7.507 385 HZ3 LYS 42 HZ3 LYS 42 -17.568 -2.043 -7.699 386 H GLN 43 H GLN 43 -23.463 -7.274 -3.646 387 HA GLN 43 HA GLN 43 -25.716 -5.824 -2.672 388 HB2 GLN 43 HB2 GLN 43 -25.836 -7.780 -4.082 389 HB3 GLN 43 HB3 GLN 43 -25.186 -8.819 -2.816 390 HG2 GLN 43 HG2 GLN 43 -27.691 -7.157 -2.355 391 HG3 GLN 43 HG3 GLN 43 -27.789 -8.634 -3.301 392 HE21 GLN 43 HE21 GLN 43 -28.555 -9.436 0.303 393 HE22 GLN 43 HE22 GLN 43 -29.200 -8.229 -0.805 394 H LEU 44 H LEU 44 -23.440 -7.955 -0.877 395 HA LEU 44 HA LEU 44 -24.852 -7.529 1.663 396 HB2 LEU 44 HB2 LEU 44 -22.133 -8.733 1.009 397 HB3 LEU 44 HB3 LEU 44 -22.820 -8.638 2.628 398 HG LEU 44 HG LEU 44 -24.014 -10.215 0.328 399 HD11 LEU 44 HD11 LEU 44 -22.602 -11.120 2.874 400 HD12 LEU 44 HD12 LEU 44 -23.250 -12.163 1.596 401 HD13 LEU 44 HD13 LEU 44 -21.870 -11.110 1.251 402 HD21 LEU 44 HD21 LEU 44 -24.827 -10.035 3.274 403 HD22 LEU 44 HD22 LEU 44 -25.803 -9.537 1.871 404 HD23 LEU 44 HD23 LEU 44 -25.434 -11.241 2.120 405 HA PRO 45 HA PRO 45 -22.812 -3.715 2.678 406 HB2 PRO 45 HB2 PRO 45 -22.957 -3.625 5.384 407 HB3 PRO 45 HB3 PRO 45 -24.408 -3.531 4.347 408 HG2 PRO 45 HG2 PRO 45 -23.291 -5.994 5.734 409 HG3 PRO 45 HG3 PRO 45 -24.976 -5.384 5.752 410 HD2 PRO 45 HD2 PRO 45 -24.172 -7.332 4.023 411 HD3 PRO 45 HD3 PRO 45 -25.359 -6.085 3.533 412 H VAL 46 H VAL 46 -20.712 -2.979 3.004 413 HA VAL 46 HA VAL 46 -18.675 -4.914 3.849 414 HB VAL 46 HB VAL 46 -18.396 -3.249 1.963 415 HG11 VAL 46 HG11 VAL 46 -19.000 -1.172 3.218 416 HG12 VAL 46 HG12 VAL 46 -17.552 -1.390 4.236 417 HG13 VAL 46 HG13 VAL 46 -17.386 -1.098 2.497 418 HG21 VAL 46 HG21 VAL 46 -16.172 -3.496 4.020 419 HG22 VAL 46 HG22 VAL 46 -16.604 -4.718 2.799 420 HG23 VAL 46 HG23 VAL 46 -15.985 -3.140 2.290 421 H LEU 47 H LEU 47 -20.302 -2.260 5.333 422 HA LEU 47 HA LEU 47 -20.367 -1.316 7.346 423 HB2 LEU 47 HB2 LEU 47 -19.392 -3.978 8.395 424 HB3 LEU 47 HB3 LEU 47 -20.122 -2.691 9.344 425 HG LEU 47 HG LEU 47 -21.505 -4.311 7.161 426 HD11 LEU 47 HD11 LEU 47 -22.791 -5.244 9.015 427 HD12 LEU 47 HD12 LEU 47 -21.057 -5.509 9.277 428 HD13 LEU 47 HD13 LEU 47 -21.900 -4.231 10.179 429 HD21 LEU 47 HD21 LEU 47 -22.611 -2.136 9.005 430 HD22 LEU 47 HD22 LEU 47 -22.485 -2.041 7.237 431 HD23 LEU 47 HD23 LEU 47 -23.590 -3.202 7.972 432 H ASP 48 H ASP 48 -17.360 -3.174 7.691 433 HA ASP 48 HA ASP 48 -15.867 -0.717 8.276 434 HB2 ASP 48 HB2 ASP 48 -15.154 -1.570 10.532 435 HB3 ASP 48 HB3 ASP 48 -16.816 -1.006 10.412 436 H LYS 49 H LYS 49 -15.520 -4.263 8.430 437 HA LYS 49 HA LYS 49 -12.622 -4.047 8.521 438 HB2 LYS 49 HB2 LYS 49 -14.621 -6.254 8.658 439 HB3 LYS 49 HB3 LYS 49 -12.982 -6.685 8.151 440 HG2 LYS 49 HG2 LYS 49 -13.194 -7.022 10.527 441 HG3 LYS 49 HG3 LYS 49 -12.053 -5.714 10.217 442 HD2 LYS 49 HD2 LYS 49 -13.856 -4.048 10.706 443 HD3 LYS 49 HD3 LYS 49 -14.980 -5.404 11.006 444 HE2 LYS 49 HE2 LYS 49 -13.710 -6.108 12.936 445 HE3 LYS 49 HE3 LYS 49 -12.444 -4.915 12.624 446 HZ1 LYS 49 HZ1 LYS 49 -15.279 -4.042 13.040 447 HZ2 LYS 49 HZ2 LYS 49 -14.258 -4.287 14.330 448 HZ3 LYS 49 HZ3 LYS 49 -13.923 -3.158 13.198 449 H THR 50 H THR 50 -11.128 -4.205 7.139 450 HA THR 50 HA THR 50 -11.512 -5.222 4.402 451 HB THR 50 HB THR 50 -10.186 -2.603 4.401 452 HG1 THR 50 HG1 THR 50 -12.994 -2.586 4.412 453 HG21 THR 50 HG21 THR 50 -11.532 -2.321 2.332 454 HG22 THR 50 HG22 THR 50 -10.548 -3.801 2.298 455 HG23 THR 50 HG23 THR 50 -12.292 -3.897 2.621 456 H LYS 51 H LYS 51 -9.249 -4.082 6.853 457 HA LYS 51 HA LYS 51 -7.033 -5.618 5.501 458 HB2 LYS 51 HB2 LYS 51 -6.714 -3.130 5.898 459 HB3 LYS 51 HB3 LYS 51 -6.865 -3.443 7.627 460 HG2 LYS 51 HG2 LYS 51 -4.846 -5.019 7.408 461 HG3 LYS 51 HG3 LYS 51 -4.708 -4.459 5.724 462 HD2 LYS 51 HD2 LYS 51 -4.647 -2.069 6.700 463 HD3 LYS 51 HD3 LYS 51 -4.465 -2.834 8.291 464 HE2 LYS 51 HE2 LYS 51 -2.379 -3.956 7.498 465 HE3 LYS 51 HE3 LYS 51 -2.584 -3.199 5.916 466 HZ1 LYS 51 HZ1 LYS 51 -1.106 -1.778 7.077 467 HZ2 LYS 51 HZ2 LYS 51 -2.544 -0.991 7.249 468 HZ3 LYS 51 HZ3 LYS 51 -1.953 -1.832 8.495 469 H PHE 52 H PHE 52 -6.043 -7.298 6.749 470 HA PHE 52 HA PHE 52 -6.589 -7.352 9.555 471 HB2 PHE 52 HB2 PHE 52 -7.474 -9.607 9.813 472 HB3 PHE 52 HB3 PHE 52 -8.572 -8.396 9.237 473 HD1 PHE 52 HD1 PHE 52 -8.881 -11.375 9.377 474 HD2 PHE 52 HD2 PHE 52 -7.878 -8.761 6.096 475 HE1 PHE 52 HE1 PHE 52 -9.730 -13.048 7.772 476 HE2 PHE 52 HE2 PHE 52 -8.570 -10.534 4.523 477 HZ PHE 52 HZ PHE 52 -9.539 -12.642 5.335 478 H LEU 53 H LEU 53 -5.490 -8.985 10.864 479 HA LEU 53 HA LEU 53 -3.200 -10.294 9.555 480 HB2 LEU 53 HB2 LEU 53 -2.848 -8.697 12.105 481 HB3 LEU 53 HB3 LEU 53 -1.644 -9.703 11.351 482 HG LEU 53 HG LEU 53 -2.697 -7.152 10.073 483 HD11 LEU 53 HD11 LEU 53 -1.593 -6.528 12.139 484 HD12 LEU 53 HD12 LEU 53 -0.293 -7.692 11.871 485 HD13 LEU 53 HD13 LEU 53 -0.438 -6.246 10.848 486 HD21 LEU 53 HD21 LEU 53 -0.528 -7.307 8.812 487 HD22 LEU 53 HD22 LEU 53 -0.368 -8.982 9.418 488 HD23 LEU 53 HD23 LEU 53 -1.764 -8.478 8.405 489 H VAL 54 H VAL 54 -2.792 -12.298 10.579 490 HA VAL 54 HA VAL 54 -4.690 -12.992 12.788 491 HB VAL 54 HB VAL 54 -4.108 -14.934 10.590 492 HG11 VAL 54 HG11 VAL 54 -6.477 -14.581 12.493 493 HG12 VAL 54 HG12 VAL 54 -6.246 -15.898 11.320 494 HG13 VAL 54 HG13 VAL 54 -5.151 -15.744 12.697 495 HG21 VAL 54 HG21 VAL 54 -6.235 -14.304 9.513 496 HG22 VAL 54 HG22 VAL 54 -6.331 -12.871 10.565 497 HG23 VAL 54 HG23 VAL 54 -5.008 -13.058 9.381 498 HA PRO 55 HA PRO 55 -1.108 -14.944 14.707 499 HB2 PRO 55 HB2 PRO 55 -3.189 -16.384 16.331 500 HB3 PRO 55 HB3 PRO 55 -1.731 -15.503 16.885 501 HG2 PRO 55 HG2 PRO 55 -4.203 -14.417 17.151 502 HG3 PRO 55 HG3 PRO 55 -2.802 -13.411 16.664 503 HD2 PRO 55 HD2 PRO 55 -4.959 -14.607 14.908 504 HD3 PRO 55 HD3 PRO 55 -4.270 -12.957 14.897 505 H ASP 56 H ASP 56 -0.046 -16.792 14.112 506 HA ASP 56 HA ASP 56 -0.935 -18.222 11.955 507 HB2 ASP 56 HB2 ASP 56 1.010 -19.757 12.354 508 HB3 ASP 56 HB3 ASP 56 1.343 -18.033 12.296 509 H HIS 57 H HIS 57 -1.516 -19.232 15.228 510 HA HIS 57 HA HIS 57 -2.278 -21.975 14.587 511 HB2 HIS 57 HB2 HIS 57 -2.465 -20.263 17.091 512 HB3 HIS 57 HB3 HIS 57 -3.175 -21.866 17.008 513 HD1 HIS 57 HD1 HIS 57 0.425 -20.474 16.230 514 HD2 HIS 57 HD2 HIS 57 -1.707 -23.659 18.036 515 HE1 HIS 57 HE1 HIS 57 2.182 -22.052 17.245 516 HE2 HIS 57 HE2 HIS 57 0.881 -23.991 18.340 517 H VAL 58 H VAL 58 -4.038 -19.082 14.088 518 HA VAL 58 HA VAL 58 -6.720 -20.076 14.699 519 HB VAL 58 HB VAL 58 -5.869 -17.856 12.851 520 HG11 VAL 58 HG11 VAL 58 -8.186 -17.026 13.124 521 HG12 VAL 58 HG12 VAL 58 -8.162 -18.600 12.330 522 HG13 VAL 58 HG13 VAL 58 -8.598 -18.486 14.046 523 HG21 VAL 58 HG21 VAL 58 -5.204 -17.413 15.200 524 HG22 VAL 58 HG22 VAL 58 -6.569 -16.385 14.754 525 HG23 VAL 58 HG23 VAL 58 -6.838 -17.826 15.747 526 H ASN 59 H ASN 59 -7.925 -21.506 13.535 527 HA ASN 59 HA ASN 59 -6.970 -22.528 10.947 528 HB2 ASN 59 HB2 ASN 59 -9.390 -23.216 12.658 529 HB3 ASN 59 HB3 ASN 59 -8.941 -24.058 11.174 530 HD21 ASN 59 HD21 ASN 59 -7.584 -25.940 14.118 531 HD22 ASN 59 HD22 ASN 59 -9.187 -25.341 13.715 532 H MET 60 H MET 60 -8.212 -22.539 8.967 533 HA MET 60 HA MET 60 -9.216 -20.045 8.208 534 HB2 MET 60 HB2 MET 60 -9.619 -22.815 7.051 535 HB3 MET 60 HB3 MET 60 -10.362 -21.419 6.290 536 HG2 MET 60 HG2 MET 60 -7.408 -21.961 6.646 537 HG3 MET 60 HG3 MET 60 -8.333 -21.891 5.147 538 HE1 MET 60 HE1 MET 60 -9.140 -17.965 4.998 539 HE2 MET 60 HE2 MET 60 -9.711 -19.586 4.521 540 HE3 MET 60 HE3 MET 60 -10.060 -18.958 6.146 541 H SER 61 H SER 61 -11.307 -22.856 9.133 542 HA SER 61 HA SER 61 -13.769 -21.461 8.809 543 HB2 SER 61 HB2 SER 61 -14.675 -23.210 10.312 544 HB3 SER 61 HB3 SER 61 -13.642 -23.877 9.034 545 HG SER 61 HG SER 61 -13.165 -24.780 11.121 546 H GLU 62 H GLU 62 -11.588 -21.611 11.659 547 HA GLU 62 HA GLU 62 -13.277 -20.070 13.402 548 HB2 GLU 62 HB2 GLU 62 -11.418 -21.527 14.174 549 HB3 GLU 62 HB3 GLU 62 -10.260 -20.426 13.437 550 HG2 GLU 62 HG2 GLU 62 -10.287 -19.968 15.758 551 HG3 GLU 62 HG3 GLU 62 -11.013 -18.595 14.948 552 H LEU 63 H LEU 63 -10.632 -19.063 11.211 553 HA LEU 63 HA LEU 63 -10.781 -16.252 11.749 554 HB2 LEU 63 HB2 LEU 63 -8.920 -17.353 10.549 555 HB3 LEU 63 HB3 LEU 63 -9.999 -17.804 9.235 556 HG LEU 63 HG LEU 63 -10.315 -15.422 8.635 557 HD11 LEU 63 HD11 LEU 63 -8.438 -14.975 10.999 558 HD12 LEU 63 HD12 LEU 63 -8.687 -13.767 9.729 559 HD13 LEU 63 HD13 LEU 63 -10.053 -14.271 10.731 560 HD21 LEU 63 HD21 LEU 63 -8.530 -16.724 7.589 561 HD22 LEU 63 HD22 LEU 63 -8.010 -15.045 7.810 562 HD23 LEU 63 HD23 LEU 63 -7.416 -16.317 8.913 563 H ILE 64 H ILE 64 -12.534 -18.307 9.429 564 HA ILE 64 HA ILE 64 -14.059 -16.175 8.232 565 HB ILE 64 HB ILE 64 -14.280 -19.188 8.283 566 HG12 ILE 64 HG12 ILE 64 -13.687 -17.203 6.038 567 HG13 ILE 64 HG13 ILE 64 -12.428 -17.881 7.043 568 HG21 ILE 64 HG21 ILE 64 -15.994 -19.058 6.519 569 HG22 ILE 64 HG22 ILE 64 -16.597 -18.403 8.027 570 HG23 ILE 64 HG23 ILE 64 -16.093 -17.296 6.723 571 HD11 ILE 64 HD11 ILE 64 -13.147 -20.188 6.301 572 HD12 ILE 64 HD12 ILE 64 -14.163 -19.366 5.078 573 HD13 ILE 64 HD13 ILE 64 -12.414 -19.144 5.066 574 H LYS 65 H LYS 65 -14.739 -18.225 11.096 575 HA LYS 65 HA LYS 65 -17.354 -17.175 11.626 576 HB2 LYS 65 HB2 LYS 65 -15.209 -18.346 13.419 577 HB3 LYS 65 HB3 LYS 65 -16.753 -17.775 14.059 578 HG2 LYS 65 HG2 LYS 65 -18.011 -19.399 12.890 579 HG3 LYS 65 HG3 LYS 65 -16.697 -19.763 11.772 580 HD2 LYS 65 HD2 LYS 65 -16.936 -21.590 13.368 581 HD3 LYS 65 HD3 LYS 65 -15.380 -20.792 13.562 582 HE2 LYS 65 HE2 LYS 65 -16.505 -19.420 15.470 583 HE3 LYS 65 HE3 LYS 65 -17.842 -20.563 15.352 584 HZ1 LYS 65 HZ1 LYS 65 -14.993 -21.196 15.991 585 HZ2 LYS 65 HZ2 LYS 65 -16.253 -21.279 17.032 586 HZ3 LYS 65 HZ3 LYS 65 -16.156 -22.354 15.800 587 H ILE 66 H ILE 66 -14.196 -15.882 12.898 588 HA ILE 66 HA ILE 66 -15.502 -13.660 14.197 589 HB ILE 66 HB ILE 66 -13.408 -14.057 15.005 590 HG12 ILE 66 HG12 ILE 66 -13.989 -11.588 14.673 591 HG13 ILE 66 HG13 ILE 66 -12.352 -12.019 15.106 592 HG21 ILE 66 HG21 ILE 66 -11.270 -13.963 13.805 593 HG22 ILE 66 HG22 ILE 66 -12.302 -15.264 13.246 594 HG23 ILE 66 HG23 ILE 66 -12.134 -13.788 12.265 595 HD11 ILE 66 HD11 ILE 66 -13.177 -11.147 12.305 596 HD12 ILE 66 HD12 ILE 66 -12.346 -10.180 13.517 597 HD13 ILE 66 HD13 ILE 66 -11.538 -11.578 12.833 598 H ILE 67 H ILE 67 -14.180 -13.896 10.887 599 HA ILE 67 HA ILE 67 -14.840 -11.198 10.167 600 HB ILE 67 HB ILE 67 -14.385 -13.748 8.590 601 HG12 ILE 67 HG12 ILE 67 -12.423 -12.800 9.752 602 HG13 ILE 67 HG13 ILE 67 -12.255 -12.760 8.008 603 HG21 ILE 67 HG21 ILE 67 -15.814 -12.462 7.127 604 HG22 ILE 67 HG22 ILE 67 -14.892 -10.972 7.443 605 HG23 ILE 67 HG23 ILE 67 -14.161 -12.333 6.549 606 HD11 ILE 67 HD11 ILE 67 -11.354 -10.739 9.106 607 HD12 ILE 67 HD12 ILE 67 -12.661 -10.323 7.985 608 HD13 ILE 67 HD13 ILE 67 -12.936 -10.334 9.744 609 H ARG 68 H ARG 68 -16.811 -14.181 9.676 610 HA ARG 68 HA ARG 68 -19.096 -12.877 8.581 611 HB2 ARG 68 HB2 ARG 68 -18.606 -15.355 8.643 612 HB3 ARG 68 HB3 ARG 68 -19.016 -15.367 10.360 613 HG2 ARG 68 HG2 ARG 68 -21.335 -14.537 9.744 614 HG3 ARG 68 HG3 ARG 68 -20.861 -14.625 8.041 615 HD2 ARG 68 HD2 ARG 68 -22.109 -16.600 8.558 616 HD3 ARG 68 HD3 ARG 68 -20.416 -17.070 8.341 617 HE ARG 68 HE ARG 68 -21.389 -16.501 11.105 618 HH11 ARG 68 HH11 ARG 68 -20.754 -19.077 8.815 619 HH12 ARG 68 HH12 ARG 68 -20.630 -20.283 10.067 620 HH21 ARG 68 HH21 ARG 68 -21.196 -18.082 12.652 621 HH22 ARG 68 HH22 ARG 68 -20.934 -19.729 12.181 622 H ARG 69 H ARG 69 -18.311 -13.532 12.008 623 HA ARG 69 HA ARG 69 -20.724 -12.362 13.040 624 HB2 ARG 69 HB2 ARG 69 -19.406 -14.014 14.305 625 HB3 ARG 69 HB3 ARG 69 -18.037 -12.913 14.386 626 HG2 ARG 69 HG2 ARG 69 -19.199 -12.939 16.525 627 HG3 ARG 69 HG3 ARG 69 -19.342 -11.348 15.799 628 HD2 ARG 69 HD2 ARG 69 -21.675 -12.200 14.911 629 HD3 ARG 69 HD3 ARG 69 -21.449 -13.520 16.041 630 HE ARG 69 HE ARG 69 -21.760 -12.069 17.847 631 HH11 ARG 69 HH11 ARG 69 -21.583 -10.042 14.958 632 HH12 ARG 69 HH12 ARG 69 -22.605 -8.819 15.654 633 HH21 ARG 69 HH21 ARG 69 -22.902 -10.386 18.719 634 HH22 ARG 69 HH22 ARG 69 -23.225 -8.960 17.777 635 H ARG 70 H ARG 70 -17.465 -10.886 12.617 636 HA ARG 70 HA ARG 70 -18.257 -8.293 13.687 637 HB2 ARG 70 HB2 ARG 70 -15.988 -9.166 11.844 638 HB3 ARG 70 HB3 ARG 70 -16.165 -7.513 12.424 639 HG2 ARG 70 HG2 ARG 70 -15.856 -9.930 14.271 640 HG3 ARG 70 HG3 ARG 70 -14.527 -8.912 13.715 641 HD2 ARG 70 HD2 ARG 70 -15.602 -6.939 14.784 642 HD3 ARG 70 HD3 ARG 70 -16.885 -7.968 15.409 643 HE ARG 70 HE ARG 70 -14.017 -7.914 16.244 644 HH11 ARG 70 HH11 ARG 70 -17.188 -9.299 16.934 645 HH12 ARG 70 HH12 ARG 70 -16.700 -9.762 18.539 646 HH21 ARG 70 HH21 ARG 70 -13.515 -8.467 18.217 647 HH22 ARG 70 HH22 ARG 70 -14.655 -9.304 19.265 648 H LEU 71 H LEU 71 -18.367 -9.625 10.401 649 HA LEU 71 HA LEU 71 -19.552 -7.258 9.212 650 HB2 LEU 71 HB2 LEU 71 -19.476 -10.186 8.392 651 HB3 LEU 71 HB3 LEU 71 -20.155 -8.924 7.380 652 HG LEU 71 HG LEU 71 -17.256 -8.848 8.311 653 HD11 LEU 71 HD11 LEU 71 -18.452 -9.916 5.723 654 HD12 LEU 71 HD12 LEU 71 -16.722 -9.682 6.035 655 HD13 LEU 71 HD13 LEU 71 -17.650 -10.868 6.973 656 HD21 LEU 71 HD21 LEU 71 -18.785 -7.382 6.120 657 HD22 LEU 71 HD22 LEU 71 -18.119 -6.666 7.605 658 HD23 LEU 71 HD23 LEU 71 -17.030 -7.303 6.370 659 H GLN 72 H GLN 72 -20.883 -9.064 11.631 660 HA GLN 72 HA GLN 72 -22.920 -9.341 12.510 661 HB2 GLN 72 HB2 GLN 72 -23.913 -7.141 10.685 662 HB3 GLN 72 HB3 GLN 72 -24.553 -7.617 12.248 663 HG2 GLN 72 HG2 GLN 72 -21.886 -6.247 11.722 664 HG3 GLN 72 HG3 GLN 72 -23.314 -5.524 12.432 665 HE21 GLN 72 HE21 GLN 72 -20.692 -6.785 15.007 666 HE22 GLN 72 HE22 GLN 72 -20.358 -6.272 13.351 667 H LEU 73 H LEU 73 -22.314 -10.949 10.035 668 HA LEU 73 HA LEU 73 -24.890 -11.210 8.645 669 HB2 LEU 73 HB2 LEU 73 -22.310 -12.780 8.397 670 HB3 LEU 73 HB3 LEU 73 -23.703 -12.932 7.326 671 HG LEU 73 HG LEU 73 -22.026 -10.407 7.688 672 HD11 LEU 73 HD11 LEU 73 -21.093 -10.901 5.521 673 HD12 LEU 73 HD12 LEU 73 -20.786 -12.260 6.612 674 HD13 LEU 73 HD13 LEU 73 -22.074 -12.377 5.390 675 HD21 LEU 73 HD21 LEU 73 -24.296 -9.839 6.943 676 HD22 LEU 73 HD22 LEU 73 -23.157 -9.649 5.608 677 HD23 LEU 73 HD23 LEU 73 -24.213 -11.081 5.670 678 H ASN 74 H ASN 74 -26.522 -12.282 9.466 679 HA ASN 74 HA ASN 74 -26.239 -14.436 11.435 680 HB2 ASN 74 HB2 ASN 74 -28.653 -13.272 9.971 681 HB3 ASN 74 HB3 ASN 74 -28.752 -14.503 11.229 682 HD21 ASN 74 HD21 ASN 74 -29.104 -10.931 12.605 683 HD22 ASN 74 HD22 ASN 74 -29.718 -11.592 11.098 684 H ALA 75 H ALA 75 -27.215 -16.568 11.149 685 HA ALA 75 HA ALA 75 -26.063 -18.064 9.103 686 HB1 ALA 75 HB1 ALA 75 -26.857 -18.899 11.303 687 HB2 ALA 75 HB2 ALA 75 -28.544 -18.686 10.768 688 HB3 ALA 75 HB3 ALA 75 -27.499 -19.880 9.970 689 H ASN 76 H ASN 76 -29.244 -16.537 9.065 690 HA ASN 76 HA ASN 76 -30.417 -17.913 6.859 691 HB2 ASN 76 HB2 ASN 76 -31.661 -16.608 8.519 692 HB3 ASN 76 HB3 ASN 76 -30.827 -15.127 8.039 693 HD21 ASN 76 HD21 ASN 76 -33.028 -14.467 5.381 694 HD22 ASN 76 HD22 ASN 76 -31.579 -13.981 6.264 695 H GLN 77 H GLN 77 -27.949 -15.378 6.878 696 HA GLN 77 HA GLN 77 -28.564 -14.425 4.175 697 HB2 GLN 77 HB2 GLN 77 -26.074 -13.882 5.845 698 HB3 GLN 77 HB3 GLN 77 -26.646 -12.989 4.441 699 HG2 GLN 77 HG2 GLN 77 -27.791 -13.017 7.253 700 HG3 GLN 77 HG3 GLN 77 -27.158 -11.654 6.333 701 HE21 GLN 77 HE21 GLN 77 -30.239 -11.322 4.385 702 HE22 GLN 77 HE22 GLN 77 -28.507 -11.070 4.266 703 H ALA 78 H ALA 78 -27.620 -15.043 2.264 704 HA ALA 78 HA ALA 78 -25.837 -17.346 2.136 705 HB1 ALA 78 HB1 ALA 78 -26.669 -15.330 0.001 706 HB2 ALA 78 HB2 ALA 78 -25.824 -16.870 -0.279 707 HB3 ALA 78 HB3 ALA 78 -27.482 -16.873 0.359 708 H PHE 79 H PHE 79 -23.663 -17.313 2.358 709 HA PHE 79 HA PHE 79 -22.145 -14.836 1.941 710 HB2 PHE 79 HB2 PHE 79 -22.692 -14.343 4.082 711 HB3 PHE 79 HB3 PHE 79 -22.692 -16.017 4.603 712 HD1 PHE 79 HD1 PHE 79 -20.780 -17.046 5.581 713 HD2 PHE 79 HD2 PHE 79 -20.394 -13.227 3.633 714 HE1 PHE 79 HE1 PHE 79 -18.506 -16.791 6.534 715 HE2 PHE 79 HE2 PHE 79 -18.127 -12.948 4.622 716 HZ PHE 79 HZ PHE 79 -17.185 -14.726 6.090 717 H PHE 80 H PHE 80 -20.172 -14.869 1.327 718 HA PHE 80 HA PHE 80 -18.598 -17.356 1.510 719 HB2 PHE 80 HB2 PHE 80 -19.181 -15.779 -1.000 720 HB3 PHE 80 HB3 PHE 80 -17.808 -16.855 -0.846 721 HD1 PHE 80 HD1 PHE 80 -18.042 -19.285 -0.828 722 HD2 PHE 80 HD2 PHE 80 -21.501 -16.715 -0.956 723 HE1 PHE 80 HE1 PHE 80 -19.464 -21.222 -1.459 724 HE2 PHE 80 HE2 PHE 80 -22.927 -18.656 -1.561 725 HZ PHE 80 HZ PHE 80 -21.905 -20.914 -1.820 726 H LEU 81 H LEU 81 -16.536 -17.239 1.993 727 HA LEU 81 HA LEU 81 -15.109 -14.620 1.772 728 HB2 LEU 81 HB2 LEU 81 -15.719 -15.284 4.096 729 HB3 LEU 81 HB3 LEU 81 -14.813 -16.765 3.921 730 HG LEU 81 HG LEU 81 -13.703 -15.037 5.271 731 HD11 LEU 81 HD11 LEU 81 -12.327 -16.724 3.992 732 HD12 LEU 81 HD12 LEU 81 -12.021 -15.458 2.783 733 HD13 LEU 81 HD13 LEU 81 -11.502 -15.232 4.473 734 HD21 LEU 81 HD21 LEU 81 -14.485 -13.031 4.103 735 HD22 LEU 81 HD22 LEU 81 -12.723 -13.042 4.333 736 HD23 LEU 81 HD23 LEU 81 -13.419 -13.392 2.732 737 H LEU 82 H LEU 82 -14.372 -15.036 -0.253 738 HA LEU 82 HA LEU 82 -13.350 -17.670 -1.014 739 HB2 LEU 82 HB2 LEU 82 -13.575 -15.115 -2.628 740 HB3 LEU 82 HB3 LEU 82 -13.343 -16.732 -3.257 741 HG LEU 82 HG LEU 82 -15.857 -15.794 -1.798 742 HD11 LEU 82 HD11 LEU 82 -15.368 -16.216 -4.775 743 HD12 LEU 82 HD12 LEU 82 -16.896 -15.746 -3.999 744 HD13 LEU 82 HD13 LEU 82 -15.519 -14.642 -3.958 745 HD21 LEU 82 HD21 LEU 82 -15.531 -18.232 -1.632 746 HD22 LEU 82 HD22 LEU 82 -16.833 -17.875 -2.775 747 HD23 LEU 82 HD23 LEU 82 -15.235 -18.333 -3.387 748 H VAL 83 H VAL 83 -11.347 -18.124 -0.245 749 HA VAL 83 HA VAL 83 -9.147 -16.183 -0.140 750 HB VAL 83 HB VAL 83 -9.057 -19.214 0.067 751 HG11 VAL 83 HG11 VAL 83 -6.943 -18.817 1.273 752 HG12 VAL 83 HG12 VAL 83 -6.843 -18.159 -0.361 753 HG13 VAL 83 HG13 VAL 83 -7.118 -17.068 1.021 754 HG21 VAL 83 HG21 VAL 83 -10.525 -18.380 1.837 755 HG22 VAL 83 HG22 VAL 83 -8.956 -18.816 2.525 756 HG23 VAL 83 HG23 VAL 83 -9.346 -17.113 2.257 757 H ASN 84 H ASN 84 -8.104 -15.483 -1.912 758 HA ASN 84 HA ASN 84 -7.783 -15.172 -4.158 759 HB2 ASN 84 HB2 ASN 84 -6.497 -17.878 -3.662 760 HB3 ASN 84 HB3 ASN 84 -6.306 -16.997 -5.172 761 HD21 ASN 84 HD21 ASN 84 -3.416 -16.147 -3.078 762 HD22 ASN 84 HD22 ASN 84 -4.079 -17.619 -3.773 763 H GLY 85 H GLY 85 -10.418 -15.750 -3.824 764 HA2 GLY 85 HA2 GLY 85 -12.189 -15.983 -5.307 765 HA3 GLY 85 HA3 GLY 85 -11.117 -16.693 -6.502 766 H HIS 86 H HIS 86 -10.778 -18.522 -3.644 767 HA HIS 86 HA HIS 86 -12.959 -20.431 -4.437 768 HB2 HIS 86 HB2 HIS 86 -10.141 -21.086 -3.493 769 HB3 HIS 86 HB3 HIS 86 -11.403 -22.255 -3.891 770 HD1 HIS 86 HD1 HIS 86 -8.658 -20.321 -5.538 771 HD2 HIS 86 HD2 HIS 86 -12.378 -22.031 -6.588 772 HE1 HIS 86 HE1 HIS 86 -8.693 -20.461 -8.110 773 HE2 HIS 86 HE2 HIS 86 -10.953 -21.523 -8.744 774 H SER 87 H SER 87 -14.115 -21.506 -2.841 775 HA SER 87 HA SER 87 -14.325 -20.069 -0.322 776 HB2 SER 87 HB2 SER 87 -16.293 -20.946 -1.513 777 HB3 SER 87 HB3 SER 87 -15.725 -22.610 -1.232 778 HG SER 87 HG SER 87 -17.197 -21.962 0.398 779 H MET 88 H MET 88 -13.811 -20.654 1.718 780 HA MET 88 HA MET 88 -12.577 -23.318 2.264 781 HB2 MET 88 HB2 MET 88 -11.368 -20.616 2.964 782 HB3 MET 88 HB3 MET 88 -10.841 -22.139 3.681 783 HG2 MET 88 HG2 MET 88 -10.457 -23.012 1.322 784 HG3 MET 88 HG3 MET 88 -10.659 -21.340 0.770 785 HE1 MET 88 HE1 MET 88 -8.337 -21.488 -0.418 786 HE2 MET 88 HE2 MET 88 -6.820 -21.941 0.385 787 HE3 MET 88 HE3 MET 88 -8.094 -23.154 0.160 788 H VAL 89 H VAL 89 -15.270 -21.949 2.962 789 HA VAL 89 HA VAL 89 -15.202 -21.229 5.711 790 HB VAL 89 HB VAL 89 -17.522 -21.102 5.723 791 HG11 VAL 89 HG11 VAL 89 -16.376 -19.484 4.177 792 HG12 VAL 89 HG12 VAL 89 -16.796 -20.545 2.814 793 HG13 VAL 89 HG13 VAL 89 -18.070 -19.796 3.786 794 HG21 VAL 89 HG21 VAL 89 -18.193 -23.306 4.917 795 HG22 VAL 89 HG22 VAL 89 -18.995 -22.050 3.976 796 HG23 VAL 89 HG23 VAL 89 -17.606 -22.919 3.281 797 H SER 90 H SER 90 -15.433 -24.456 4.413 798 HA SER 90 HA SER 90 -16.093 -25.607 7.064 799 HB2 SER 90 HB2 SER 90 -16.318 -27.696 5.786 800 HB3 SER 90 HB3 SER 90 -17.319 -26.391 5.118 801 HG SER 90 HG SER 90 -16.141 -27.538 3.479 802 H VAL 91 H VAL 91 -13.173 -24.776 5.498 803 HA VAL 91 HA VAL 91 -11.864 -27.302 6.060 804 HB VAL 91 HB VAL 91 -11.549 -25.845 3.972 805 HG11 VAL 91 HG11 VAL 91 -9.202 -24.807 5.616 806 HG12 VAL 91 HG12 VAL 91 -9.582 -24.470 3.917 807 HG13 VAL 91 HG13 VAL 91 -10.646 -23.853 5.199 808 HG21 VAL 91 HG21 VAL 91 -9.394 -26.919 3.558 809 HG22 VAL 91 HG22 VAL 91 -9.208 -27.286 5.286 810 HG23 VAL 91 HG23 VAL 91 -10.513 -28.039 4.342 811 H SER 92 H SER 92 -10.288 -27.895 7.405 812 HA SER 92 HA SER 92 -10.129 -26.434 9.914 813 HB2 SER 92 HB2 SER 92 -8.971 -28.479 10.682 814 HB3 SER 92 HB3 SER 92 -10.509 -28.829 9.877 815 HG SER 92 HG SER 92 -8.804 -30.215 9.151 816 H THR 93 H THR 93 -8.116 -26.345 7.138 817 HA THR 93 HA THR 93 -5.604 -26.461 8.082 818 HB THR 93 HB THR 93 -6.184 -24.380 6.016 819 HG1 THR 93 HG1 THR 93 -6.432 -26.122 4.533 820 HG21 THR 93 HG21 THR 93 -4.098 -26.593 6.210 821 HG22 THR 93 HG22 THR 93 -4.270 -25.444 4.865 822 HG23 THR 93 HG23 THR 93 -3.820 -24.852 6.468 823 HA PRO 94 HA PRO 94 -4.829 -22.800 10.620 824 HB2 PRO 94 HB2 PRO 94 -2.098 -22.911 10.817 825 HB3 PRO 94 HB3 PRO 94 -3.194 -23.994 11.728 826 HG2 PRO 94 HG2 PRO 94 -1.775 -24.567 9.098 827 HG3 PRO 94 HG3 PRO 94 -1.831 -25.588 10.579 828 HD2 PRO 94 HD2 PRO 94 -3.492 -26.040 8.504 829 HD3 PRO 94 HD3 PRO 94 -4.086 -26.197 10.181 830 H ILE 95 H ILE 95 -4.513 -20.675 10.093 831 HA ILE 95 HA ILE 95 -4.501 -19.959 7.405 832 HB ILE 95 HB ILE 95 -5.514 -18.625 9.159 833 HG12 ILE 95 HG12 ILE 95 -4.828 -16.335 8.524 834 HG13 ILE 95 HG13 ILE 95 -3.384 -16.946 7.729 835 HG21 ILE 95 HG21 ILE 95 -4.260 -17.249 10.714 836 HG22 ILE 95 HG22 ILE 95 -3.680 -18.890 10.902 837 HG23 ILE 95 HG23 ILE 95 -2.712 -17.712 9.995 838 HD11 ILE 95 HD11 ILE 95 -4.804 -18.147 6.072 839 HD12 ILE 95 HD12 ILE 95 -6.250 -17.523 6.903 840 HD13 ILE 95 HD13 ILE 95 -5.129 -16.410 6.106 841 H SER 96 H SER 96 -1.624 -20.213 9.458 842 HA SER 96 HA SER 96 0.169 -18.697 7.820 843 HB2 SER 96 HB2 SER 96 0.699 -19.403 10.098 844 HB3 SER 96 HB3 SER 96 0.716 -21.108 9.592 845 HG SER 96 HG SER 96 2.842 -20.218 9.649 846 H GLU 97 H GLU 97 -0.708 -22.181 7.640 847 HA GLU 97 HA GLU 97 1.134 -22.819 5.509 848 HB2 GLU 97 HB2 GLU 97 0.224 -24.540 6.996 849 HB3 GLU 97 HB3 GLU 97 -1.416 -24.129 6.516 850 HG2 GLU 97 HG2 GLU 97 -0.814 -26.168 5.446 851 HG3 GLU 97 HG3 GLU 97 -0.991 -24.928 4.218 852 H VAL 98 H VAL 98 -2.337 -21.962 5.550 853 HA VAL 98 HA VAL 98 -2.717 -21.987 2.717 854 HB VAL 98 HB VAL 98 -4.194 -20.130 4.596 855 HG11 VAL 98 HG11 VAL 98 -6.022 -20.415 2.996 856 HG12 VAL 98 HG12 VAL 98 -4.593 -19.830 2.134 857 HG13 VAL 98 HG13 VAL 98 -5.046 -21.542 2.025 858 HG21 VAL 98 HG21 VAL 98 -4.706 -23.077 4.043 859 HG22 VAL 98 HG22 VAL 98 -4.368 -22.324 5.621 860 HG23 VAL 98 HG23 VAL 98 -5.878 -21.974 4.780 861 H TYR 99 H TYR 99 -1.722 -19.287 4.872 862 HA TYR 99 HA TYR 99 -1.411 -17.382 2.824 863 HB2 TYR 99 HB2 TYR 99 -1.502 -16.470 4.919 864 HB3 TYR 99 HB3 TYR 99 -0.342 -17.614 5.581 865 HD1 TYR 99 HD1 TYR 99 1.894 -17.026 5.873 866 HD2 TYR 99 HD2 TYR 99 -0.531 -14.796 3.091 867 HE1 TYR 99 HE1 TYR 99 3.722 -15.387 5.591 868 HE2 TYR 99 HE2 TYR 99 1.329 -13.201 2.746 869 HH TYR 99 HH TYR 99 3.393 -12.515 3.437 870 H GLU 100 H GLU 100 1.263 -19.442 4.091 871 HA GLU 100 HA GLU 100 3.114 -18.286 2.256 872 HB2 GLU 100 HB2 GLU 100 3.086 -20.909 3.765 873 HB3 GLU 100 HB3 GLU 100 4.402 -20.518 2.668 874 HG2 GLU 100 HG2 GLU 100 3.555 -18.781 5.030 875 HG3 GLU 100 HG3 GLU 100 4.868 -19.956 5.061 876 H SER 101 H SER 101 0.765 -20.870 1.721 877 HA SER 101 HA SER 101 1.743 -21.528 -0.951 878 HB2 SER 101 HB2 SER 101 0.473 -23.102 0.450 879 HB3 SER 101 HB3 SER 101 -0.935 -22.022 0.396 880 HG SER 101 HG SER 101 -0.987 -23.758 -1.181 881 H GLU 102 H GLU 102 -0.821 -19.346 0.296 882 HA GLU 102 HA GLU 102 -1.579 -18.579 -2.473 883 HB2 GLU 102 HB2 GLU 102 -3.059 -18.419 0.164 884 HB3 GLU 102 HB3 GLU 102 -3.715 -17.871 -1.354 885 HG2 GLU 102 HG2 GLU 102 -2.918 -20.745 -0.769 886 HG3 GLU 102 HG3 GLU 102 -4.545 -20.084 -0.681 887 H LYS 103 H LYS 103 0.459 -17.123 -0.323 888 HA LYS 103 HA LYS 103 -0.348 -14.424 -0.333 889 HB2 LYS 103 HB2 LYS 103 2.030 -13.869 -0.087 890 HB3 LYS 103 HB3 LYS 103 1.514 -15.168 0.986 891 HG2 LYS 103 HG2 LYS 103 2.585 -16.849 -0.461 892 HG3 LYS 103 HG3 LYS 103 3.054 -15.582 -1.609 893 HD2 LYS 103 HD2 LYS 103 4.383 -14.474 0.185 894 HD3 LYS 103 HD3 LYS 103 4.024 -15.815 1.277 895 HE2 LYS 103 HE2 LYS 103 5.359 -16.152 -1.461 896 HE3 LYS 103 HE3 LYS 103 6.279 -15.836 0.009 897 HZ1 LYS 103 HZ1 LYS 103 6.139 -18.223 -0.482 898 HZ2 LYS 103 HZ2 LYS 103 5.478 -17.875 0.972 899 HZ3 LYS 103 HZ3 LYS 103 4.509 -18.225 -0.311 900 H ASP 104 H ASP 104 -0.300 -12.744 -1.687 901 HA ASP 104 HA ASP 104 0.367 -13.202 -4.573 902 HB2 ASP 104 HB2 ASP 104 -1.939 -12.445 -3.760 903 HB3 ASP 104 HB3 ASP 104 -1.179 -10.925 -3.279 904 H GLU 105 H GLU 105 1.119 -10.960 -5.585 905 HA GLU 105 HA GLU 105 3.782 -10.538 -4.840 906 HB2 GLU 105 HB2 GLU 105 1.924 -8.737 -6.446 907 HB3 GLU 105 HB3 GLU 105 3.673 -8.566 -6.403 908 HG2 GLU 105 HG2 GLU 105 2.169 -11.009 -7.431 909 HG3 GLU 105 HG3 GLU 105 2.848 -9.726 -8.421 910 H ASP 106 H ASP 106 1.010 -8.761 -3.586 911 HA ASP 106 HA ASP 106 2.381 -6.572 -2.345 912 HB2 ASP 106 HB2 ASP 106 -0.157 -8.087 -1.643 913 HB3 ASP 106 HB3 ASP 106 0.400 -6.689 -0.738 914 H GLY 107 H GLY 107 2.608 -9.914 -1.598 915 HA2 GLY 107 HA2 GLY 107 3.732 -11.029 0.095 916 HA3 GLY 107 HA3 GLY 107 3.995 -9.518 0.968 917 H PHE 108 H PHE 108 0.783 -9.787 0.045 918 HA PHE 108 HA PHE 108 -0.162 -10.820 2.665 919 HB2 PHE 108 HB2 PHE 108 -1.237 -8.651 0.865 920 HB3 PHE 108 HB3 PHE 108 -2.258 -9.462 2.023 921 HD1 PHE 108 HD1 PHE 108 -2.553 -8.523 4.131 922 HD2 PHE 108 HD2 PHE 108 1.014 -7.574 1.916 923 HE1 PHE 108 HE1 PHE 108 -1.927 -6.885 5.870 924 HE2 PHE 108 HE2 PHE 108 1.644 -5.930 3.659 925 HZ PHE 108 HZ PHE 108 0.184 -5.591 5.643 926 H LEU 109 H LEU 109 -2.063 -12.112 2.790 927 HA LEU 109 HA LEU 109 -2.701 -13.688 0.360 928 HB2 LEU 109 HB2 LEU 109 -2.728 -14.265 3.095 929 HB3 LEU 109 HB3 LEU 109 -4.429 -13.982 2.761 930 HG LEU 109 HG LEU 109 -2.616 -16.024 1.416 931 HD11 LEU 109 HD11 LEU 109 -5.117 -16.451 3.104 932 HD12 LEU 109 HD12 LEU 109 -3.934 -17.656 2.571 933 HD13 LEU 109 HD13 LEU 109 -3.488 -16.460 3.796 934 HD21 LEU 109 HD21 LEU 109 -4.807 -16.850 0.419 935 HD22 LEU 109 HD22 LEU 109 -5.531 -15.306 0.889 936 HD23 LEU 109 HD23 LEU 109 -4.191 -15.365 -0.288 937 H TYR 110 H TYR 110 -4.666 -13.460 -0.821 938 HA TYR 110 HA TYR 110 -6.423 -11.223 -0.018 939 HB2 TYR 110 HB2 TYR 110 -5.748 -12.209 -2.740 940 HB3 TYR 110 HB3 TYR 110 -7.256 -11.377 -2.432 941 HD1 TYR 110 HD1 TYR 110 -7.371 -9.012 -1.965 942 HD2 TYR 110 HD2 TYR 110 -3.564 -11.011 -2.367 943 HE1 TYR 110 HE1 TYR 110 -6.232 -6.808 -2.225 944 HE2 TYR 110 HE2 TYR 110 -2.439 -8.811 -2.641 945 HH TYR 110 HH TYR 110 -2.741 -6.578 -2.973 946 H MET 111 H MET 111 -8.441 -11.285 0.433 947 HA MET 111 HA MET 111 -9.982 -13.810 -0.027 948 HB2 MET 111 HB2 MET 111 -9.973 -11.961 2.398 949 HB3 MET 111 HB3 MET 111 -11.189 -13.193 2.069 950 HG2 MET 111 HG2 MET 111 -9.762 -14.224 3.543 951 HG3 MET 111 HG3 MET 111 -9.283 -14.890 1.984 952 HE1 MET 111 HE1 MET 111 -7.419 -15.843 3.691 953 HE2 MET 111 HE2 MET 111 -6.165 -14.833 4.448 954 HE3 MET 111 HE3 MET 111 -7.837 -14.761 5.045 955 H VAL 112 H VAL 112 -11.548 -13.482 -1.489 956 HA VAL 112 HA VAL 112 -12.788 -10.802 -1.705 957 HB VAL 112 HB VAL 112 -13.558 -13.064 -3.502 958 HG11 VAL 112 HG11 VAL 112 -13.529 -10.033 -3.815 959 HG12 VAL 112 HG12 VAL 112 -14.158 -11.220 -4.983 960 HG13 VAL 112 HG13 VAL 112 -14.955 -11.011 -3.412 961 HG21 VAL 112 HG21 VAL 112 -11.132 -12.927 -3.761 962 HG22 VAL 112 HG22 VAL 112 -11.925 -12.158 -5.139 963 HG23 VAL 112 HG23 VAL 112 -11.218 -11.150 -3.852 964 H TYR 113 H TYR 113 -14.370 -10.292 -0.458 965 HA TYR 113 HA TYR 113 -16.112 -12.330 0.743 966 HB2 TYR 113 HB2 TYR 113 -15.398 -11.091 2.430 967 HB3 TYR 113 HB3 TYR 113 -15.293 -9.612 1.491 968 HD1 TYR 113 HD1 TYR 113 -18.200 -11.900 2.318 969 HD2 TYR 113 HD2 TYR 113 -16.459 -7.950 2.542 970 HE1 TYR 113 HE1 TYR 113 -20.305 -11.008 3.310 971 HE2 TYR 113 HE2 TYR 113 -18.565 -7.083 3.543 972 HH TYR 113 HH TYR 113 -20.719 -7.565 4.178 973 H ALA 114 H ALA 114 -18.120 -12.876 0.129 974 HA ALA 114 HA ALA 114 -19.609 -11.024 -1.663 975 HB1 ALA 114 HB1 ALA 114 -17.907 -12.233 -3.045 976 HB2 ALA 114 HB2 ALA 114 -18.560 -13.774 -2.490 977 HB3 ALA 114 HB3 ALA 114 -19.553 -12.694 -3.498 978 H SER 115 H SER 115 -21.684 -11.795 -2.385 979 HA SER 115 HA SER 115 -23.253 -13.346 -0.476 980 HB2 SER 115 HB2 SER 115 -25.043 -12.829 -2.189 981 HB3 SER 115 HB3 SER 115 -24.220 -11.404 -1.535 982 HG SER 115 HG SER 115 -24.432 -11.378 -3.851 983 H GLN 116 H GLN 116 -21.374 -14.153 -3.230 984 HA GLN 116 HA GLN 116 -22.385 -16.898 -3.449 985 HB2 GLN 116 HB2 GLN 116 -22.405 -16.459 -6.054 986 HB3 GLN 116 HB3 GLN 116 -23.831 -16.240 -5.056 987 HG2 GLN 116 HG2 GLN 116 -23.544 -14.479 -6.753 988 HG3 GLN 116 HG3 GLN 116 -23.656 -13.870 -5.118 989 HE21 GLN 116 HE21 GLN 116 -20.743 -11.963 -5.710 990 HE22 GLN 116 HE22 GLN 116 -22.351 -12.062 -4.960 991 H GLU 117 H GLU 117 -20.999 -18.243 -4.917 992 HA GLU 117 HA GLU 117 -18.184 -17.523 -4.591 993 HB2 GLU 117 HB2 GLU 117 -17.690 -19.703 -5.066 994 HB3 GLU 117 HB3 GLU 117 -19.153 -19.810 -4.121 995 HG2 GLU 117 HG2 GLU 117 -18.941 -20.125 -7.152 996 HG3 GLU 117 HG3 GLU 117 -18.959 -21.428 -5.989 997 H THR 118 H THR 118 -20.513 -17.254 -7.169 998 HA THR 118 HA THR 118 -18.597 -15.978 -8.968 999 HB THR 118 HB THR 118 -19.739 -17.473 -10.889 1000 HG1 THR 118 HG1 THR 118 -20.842 -18.940 -9.613 1001 HG21 THR 118 HG21 THR 118 -17.301 -18.489 -9.399 1002 HG22 THR 118 HG22 THR 118 -17.754 -18.819 -11.086 1003 HG23 THR 118 HG23 THR 118 -17.322 -17.172 -10.600 1004 H PHE 119 H PHE 119 -19.744 -14.677 -10.441 1005 HA PHE 119 HA PHE 119 -22.651 -14.869 -10.594 1006 HB2 PHE 119 HB2 PHE 119 -22.583 -13.565 -8.701 1007 HB3 PHE 119 HB3 PHE 119 -21.259 -12.584 -9.285 1008 HD1 PHE 119 HD1 PHE 119 -21.636 -10.733 -10.890 1009 HD2 PHE 119 HD2 PHE 119 -24.867 -13.117 -9.324 1010 HE1 PHE 119 HE1 PHE 119 -23.268 -9.000 -11.625 1011 HE2 PHE 119 HE2 PHE 119 -26.504 -11.388 -10.067 1012 HZ PHE 119 HZ PHE 119 -25.705 -9.330 -11.214 1013 H GLY 120 H GLY 120 -23.692 -13.967 -12.322 1014 HA2 GLY 120 HA2 GLY 120 -23.251 -12.426 -14.385 1015 HA3 GLY 120 HA3 GLY 120 -21.920 -13.544 -14.683 1016 H1 ASP 10 H1 ASP 10 -7.519 3.990 11.072 1017 H2 ASP 10 H2 ASP 10 -7.834 5.308 12.023 1018 H3 ASP 10 H3 ASP 10 -6.474 4.406 12.264 1019 HA ASP 10 HA ASP 10 -8.027 3.964 13.950 1020 HB2 ASP 10 HB2 ASP 10 -9.960 3.334 11.736 1021 HB3 ASP 10 HB3 ASP 10 -10.161 2.710 13.380 1022 H TYR 11 H TYR 11 -8.139 2.011 15.092 1023 HA TYR 11 HA TYR 11 -5.934 0.518 14.321 1024 HB2 TYR 11 HB2 TYR 11 -7.743 0.266 16.675 1025 HB3 TYR 11 HB3 TYR 11 -6.431 -0.862 16.419 1026 HD1 TYR 11 HD1 TYR 11 -4.138 0.523 15.496 1027 HD2 TYR 11 HD2 TYR 11 -7.148 1.900 18.272 1028 HE1 TYR 11 HE1 TYR 11 -2.470 2.028 16.568 1029 HE2 TYR 11 HE2 TYR 11 -5.488 3.420 19.315 1030 HH TYR 11 HH TYR 11 -3.310 4.161 19.335 1031 H GLU 12 H GLU 12 -8.939 -0.413 13.146 1032 HA GLU 12 HA GLU 12 -8.111 -3.214 12.750 1033 HB2 GLU 12 HB2 GLU 12 -10.345 -2.999 12.792 1034 HB3 GLU 12 HB3 GLU 12 -10.392 -1.511 11.859 1035 HG2 GLU 12 HG2 GLU 12 -9.674 -4.216 10.631 1036 HG3 GLU 12 HG3 GLU 12 -11.316 -3.601 10.772 1037 H SER 13 H SER 13 -7.540 -0.116 11.077 1038 HA SER 13 HA SER 13 -6.305 -1.498 8.732 1039 HB2 SER 13 HB2 SER 13 -7.600 1.198 9.060 1040 HB3 SER 13 HB3 SER 13 -6.566 0.814 7.675 1041 HG SER 13 HG SER 13 -8.804 -0.730 8.517 1042 H ASP 14 H ASP 14 -5.247 0.329 11.431 1043 HA ASP 14 HA ASP 14 -3.203 1.806 10.144 1044 HB2 ASP 14 HB2 ASP 14 -3.860 1.359 13.031 1045 HB3 ASP 14 HB3 ASP 14 -2.516 2.374 12.525 1046 H ASP 15 H ASP 15 -1.160 1.208 12.465 1047 HA ASP 15 HA ASP 15 0.346 -0.959 11.280 1048 HB2 ASP 15 HB2 ASP 15 2.253 0.577 10.533 1049 HB3 ASP 15 HB3 ASP 15 0.837 0.397 9.530 1050 H ASP 16 H ASP 16 2.748 -0.876 11.975 1051 HA ASP 16 HA ASP 16 4.263 -1.203 13.525 1052 HB2 ASP 16 HB2 ASP 16 4.701 1.008 13.591 1053 HB3 ASP 16 HB3 ASP 16 3.227 1.412 14.457 1054 H SER 17 H SER 17 1.347 -0.615 15.417 1055 HA SER 17 HA SER 17 1.345 -3.302 16.440 1056 HB2 SER 17 HB2 SER 17 2.998 -2.346 18.043 1057 HB3 SER 17 HB3 SER 17 1.818 -1.093 18.493 1058 HG SER 17 HG SER 17 1.777 -2.908 19.926 1059 H TYR 18 H TYR 18 -0.814 -3.728 16.223 1060 HA TYR 18 HA TYR 18 -2.790 -1.750 17.046 1061 HB2 TYR 18 HB2 TYR 18 -3.860 -1.549 14.888 1062 HB3 TYR 18 HB3 TYR 18 -2.291 -0.790 14.989 1063 HD1 TYR 18 HD1 TYR 18 -0.300 -2.821 14.071 1064 HD2 TYR 18 HD2 TYR 18 -4.284 -1.888 12.738 1065 HE1 TYR 18 HE1 TYR 18 0.236 -3.764 11.847 1066 HE2 TYR 18 HE2 TYR 18 -3.739 -2.827 10.497 1067 HH TYR 18 HH TYR 18 -0.552 -4.235 9.648 1068 H GLU 19 H GLU 19 -4.995 -2.338 17.049 1069 HA GLU 19 HA GLU 19 -5.447 -4.999 17.971 1070 HB2 GLU 19 HB2 GLU 19 -7.514 -2.997 16.976 1071 HB3 GLU 19 HB3 GLU 19 -7.832 -4.384 18.004 1072 HG2 GLU 19 HG2 GLU 19 -6.202 -1.924 18.747 1073 HG3 GLU 19 HG3 GLU 19 -7.835 -2.288 19.265 1074 H VAL 20 H VAL 20 -5.896 -3.597 14.817 1075 HA VAL 20 HA VAL 20 -6.349 -4.310 12.813 1076 HB VAL 20 HB VAL 20 -4.045 -4.855 13.382 1077 HG11 VAL 20 HG11 VAL 20 -4.772 -7.796 13.116 1078 HG12 VAL 20 HG12 VAL 20 -3.212 -7.039 13.524 1079 HG13 VAL 20 HG13 VAL 20 -4.503 -6.994 14.685 1080 HG21 VAL 20 HG21 VAL 20 -5.117 -4.758 11.080 1081 HG22 VAL 20 HG22 VAL 20 -3.605 -5.630 11.223 1082 HG23 VAL 20 HG23 VAL 20 -5.150 -6.525 11.115 1083 H LEU 21 H LEU 21 -6.634 -7.504 14.393 1084 HA LEU 21 HA LEU 21 -8.795 -8.379 12.543 1085 HB2 LEU 21 HB2 LEU 21 -6.859 -9.770 13.494 1086 HB3 LEU 21 HB3 LEU 21 -7.640 -9.651 15.056 1087 HG LEU 21 HG LEU 21 -9.577 -10.949 14.188 1088 HD11 LEU 21 HD11 LEU 21 -7.931 -11.058 11.616 1089 HD12 LEU 21 HD12 LEU 21 -9.346 -12.076 11.955 1090 HD13 LEU 21 HD13 LEU 21 -9.553 -10.326 11.787 1091 HD21 LEU 21 HD21 LEU 21 -8.412 -13.080 13.950 1092 HD22 LEU 21 HD22 LEU 21 -6.908 -12.244 13.488 1093 HD23 LEU 21 HD23 LEU 21 -7.541 -12.083 15.134 1094 H ASP 22 H ASP 22 -8.726 -6.156 14.964 1095 HA ASP 22 HA ASP 22 -9.928 -5.628 16.831 1096 HB2 ASP 22 HB2 ASP 22 -11.086 -4.637 14.940 1097 HB3 ASP 22 HB3 ASP 22 -12.048 -6.099 14.747 1098 H LEU 23 H LEU 23 -9.059 -8.077 17.299 1099 HA LEU 23 HA LEU 23 -11.286 -9.561 18.648 1100 HB2 LEU 23 HB2 LEU 23 -10.638 -10.592 16.504 1101 HB3 LEU 23 HB3 LEU 23 -8.963 -10.667 17.029 1102 HG LEU 23 HG LEU 23 -9.608 -12.311 18.818 1103 HD11 LEU 23 HD11 LEU 23 -12.337 -12.217 17.444 1104 HD12 LEU 23 HD12 LEU 23 -11.823 -13.407 18.663 1105 HD13 LEU 23 HD13 LEU 23 -11.978 -11.707 19.108 1106 HD21 LEU 23 HD21 LEU 23 -8.746 -13.193 16.757 1107 HD22 LEU 23 HD22 LEU 23 -10.060 -14.220 17.298 1108 HD23 LEU 23 HD23 LEU 23 -10.333 -13.070 15.970 1109 H THR 24 H THR 24 -8.135 -8.172 19.137 1110 HA THR 24 HA THR 24 -6.547 -8.426 20.659 1111 HB THR 24 HB THR 24 -8.343 -9.344 22.833 1112 HG1 THR 24 HG1 THR 24 -9.245 -7.311 22.975 1113 HG21 THR 24 HG21 THR 24 -5.988 -8.661 23.315 1114 HG22 THR 24 HG22 THR 24 -6.321 -7.063 22.611 1115 HG23 THR 24 HG23 THR 24 -7.172 -7.594 24.083 1116 H GLU 25 H GLU 25 -6.654 -10.560 19.017 1117 HA GLU 25 HA GLU 25 -5.986 -12.645 18.594 1118 HB2 GLU 25 HB2 GLU 25 -3.779 -13.191 19.276 1119 HB3 GLU 25 HB3 GLU 25 -3.921 -11.466 18.961 1120 HG2 GLU 25 HG2 GLU 25 -3.942 -10.971 21.358 1121 HG3 GLU 25 HG3 GLU 25 -3.953 -12.695 21.750 1122 H TYR 26 H TYR 26 -7.957 -12.590 20.946 1123 HA TYR 26 HA TYR 26 -7.730 -15.472 21.528 1124 HB2 TYR 26 HB2 TYR 26 -8.102 -13.338 23.582 1125 HB3 TYR 26 HB3 TYR 26 -8.698 -14.971 23.823 1126 HD1 TYR 26 HD1 TYR 26 -7.134 -16.950 23.749 1127 HD2 TYR 26 HD2 TYR 26 -5.739 -12.869 23.853 1128 HE1 TYR 26 HE1 TYR 26 -4.893 -17.733 24.525 1129 HE2 TYR 26 HE2 TYR 26 -3.495 -13.654 24.623 1130 HH TYR 26 HH TYR 26 -2.765 -17.128 25.143 Start of MODEL 11 1 H1 MET 1 H1 MET 1 -8.251 4.357 8.711 2 H2 MET 1 H2 MET 1 -7.959 5.806 8.027 3 H3 MET 1 H3 MET 1 -9.438 5.506 8.633 4 HA MET 1 HA MET 1 -9.399 5.466 6.228 5 HB2 MET 1 HB2 MET 1 -8.242 3.939 4.910 6 HB3 MET 1 HB3 MET 1 -7.070 4.637 6.013 7 HG2 MET 1 HG2 MET 1 -7.027 2.547 7.323 8 HG3 MET 1 HG3 MET 1 -8.326 1.880 6.322 9 HE1 MET 1 HE1 MET 1 -5.892 0.023 6.585 10 HE2 MET 1 HE2 MET 1 -7.287 -0.226 5.514 11 HE3 MET 1 HE3 MET 1 -5.641 -0.389 4.872 12 HA PRO 2 HA PRO 2 -11.613 1.196 6.662 13 HB2 PRO 2 HB2 PRO 2 -12.978 0.758 9.050 14 HB3 PRO 2 HB3 PRO 2 -11.394 0.071 8.635 15 HG2 PRO 2 HG2 PRO 2 -11.990 2.553 10.251 16 HG3 PRO 2 HG3 PRO 2 -10.841 1.228 10.626 17 HD2 PRO 2 HD2 PRO 2 -10.025 3.527 9.581 18 HD3 PRO 2 HD3 PRO 2 -9.301 1.989 9.003 19 H SER 3 H SER 3 -13.272 1.594 5.411 20 HA SER 3 HA SER 3 -15.563 3.326 6.087 21 HB2 SER 3 HB2 SER 3 -13.758 4.895 5.438 22 HB3 SER 3 HB3 SER 3 -13.526 4.016 3.919 23 HG SER 3 HG SER 3 -14.916 5.993 3.921 24 H GLU 4 H GLU 4 -16.893 3.581 3.933 25 HA GLU 4 HA GLU 4 -17.664 1.027 2.818 26 HB2 GLU 4 HB2 GLU 4 -18.040 3.870 1.787 27 HB3 GLU 4 HB3 GLU 4 -18.866 2.453 1.139 28 HG2 GLU 4 HG2 GLU 4 -20.021 2.109 3.275 29 HG3 GLU 4 HG3 GLU 4 -19.170 3.485 3.991 30 H LYS 5 H LYS 5 -15.402 3.534 1.839 31 HA LYS 5 HA LYS 5 -14.778 2.394 -0.813 32 HB2 LYS 5 HB2 LYS 5 -13.739 4.785 0.741 33 HB3 LYS 5 HB3 LYS 5 -13.018 4.242 -0.765 34 HG2 LYS 5 HG2 LYS 5 -14.505 6.042 -1.247 35 HG3 LYS 5 HG3 LYS 5 -15.144 4.564 -1.965 36 HD2 LYS 5 HD2 LYS 5 -16.869 4.408 -0.261 37 HD3 LYS 5 HD3 LYS 5 -16.137 5.741 0.670 38 HE2 LYS 5 HE2 LYS 5 -16.598 7.272 -1.253 39 HE3 LYS 5 HE3 LYS 5 -17.347 5.932 -2.123 40 HZ1 LYS 5 HZ1 LYS 5 -19.031 7.272 -0.996 41 HZ2 LYS 5 HZ2 LYS 5 -19.016 5.795 -0.298 42 HZ3 LYS 5 HZ3 LYS 5 -18.325 7.069 0.456 43 H THR 6 H THR 6 -12.867 1.401 -1.414 44 HA THR 6 HA THR 6 -11.553 -0.171 0.617 45 HB THR 6 HB THR 6 -10.543 -1.425 -0.923 46 HG1 THR 6 HG1 THR 6 -9.947 -0.601 -3.010 47 HG21 THR 6 HG21 THR 6 -11.922 -1.823 -2.859 48 HG22 THR 6 HG22 THR 6 -12.996 -1.381 -1.526 49 HG23 THR 6 HG23 THR 6 -12.609 -0.193 -2.800 50 H PHE 7 H PHE 7 -9.152 -0.398 0.886 51 HA PHE 7 HA PHE 7 -8.037 2.100 1.780 52 HB2 PHE 7 HB2 PHE 7 -5.970 0.801 2.189 53 HB3 PHE 7 HB3 PHE 7 -7.422 0.113 2.893 54 HD1 PHE 7 HD1 PHE 7 -5.145 -0.195 -0.072 55 HD2 PHE 7 HD2 PHE 7 -8.036 -2.143 2.482 56 HE1 PHE 7 HE1 PHE 7 -4.832 -2.319 -1.327 57 HE2 PHE 7 HE2 PHE 7 -7.712 -4.249 1.226 58 HZ PHE 7 HZ PHE 7 -6.126 -4.334 -0.696 59 H LYS 8 H LYS 8 -8.106 0.845 -1.454 60 HA LYS 8 HA LYS 8 -5.574 1.824 -2.386 61 HB2 LYS 8 HB2 LYS 8 -6.935 0.160 -3.574 62 HB3 LYS 8 HB3 LYS 8 -8.212 1.349 -3.833 63 HG2 LYS 8 HG2 LYS 8 -6.973 0.981 -5.866 64 HG3 LYS 8 HG3 LYS 8 -6.770 2.641 -5.334 65 HD2 LYS 8 HD2 LYS 8 -4.526 1.969 -4.336 66 HD3 LYS 8 HD3 LYS 8 -4.738 0.369 -5.051 67 HE2 LYS 8 HE2 LYS 8 -4.633 3.036 -6.560 68 HE3 LYS 8 HE3 LYS 8 -3.270 1.940 -6.353 69 HZ1 LYS 8 HZ1 LYS 8 -4.312 1.586 -8.504 70 HZ2 LYS 8 HZ2 LYS 8 -4.528 0.240 -7.613 71 HZ3 LYS 8 HZ3 LYS 8 -5.772 1.282 -7.846 72 H GLN 9 H GLN 9 -8.462 3.523 -1.585 73 HA GLN 9 HA GLN 9 -8.012 6.032 -2.879 74 HB2 GLN 9 HB2 GLN 9 -10.083 5.228 -1.746 75 HB3 GLN 9 HB3 GLN 9 -9.284 5.389 -0.179 76 HG2 GLN 9 HG2 GLN 9 -9.150 7.812 -0.443 77 HG3 GLN 9 HG3 GLN 9 -9.702 7.694 -2.126 78 HE21 GLN 9 HE21 GLN 9 -12.495 7.238 0.877 79 HE22 GLN 9 HE22 GLN 9 -10.802 6.952 1.253 80 H ARG 10 H ARG 10 -6.221 4.493 -0.337 81 HA ARG 10 HA ARG 10 -4.658 6.986 0.230 82 HB2 ARG 10 HB2 ARG 10 -6.204 6.641 2.027 83 HB3 ARG 10 HB3 ARG 10 -5.751 4.939 2.182 84 HG2 ARG 10 HG2 ARG 10 -3.524 5.541 2.991 85 HG3 ARG 10 HG3 ARG 10 -3.835 7.264 2.706 86 HD2 ARG 10 HD2 ARG 10 -5.472 7.379 4.424 87 HD3 ARG 10 HD3 ARG 10 -5.640 5.636 4.531 88 HE ARG 10 HE ARG 10 -3.583 7.320 5.780 89 HH11 ARG 10 HH11 ARG 10 -2.162 6.386 7.270 90 HH12 ARG 10 HH12 ARG 10 -2.026 4.627 7.291 91 HH21 ARG 10 HH21 ARG 10 -4.325 3.946 4.958 92 HH22 ARG 10 HH22 ARG 10 -3.111 3.388 6.108 93 H ARG 11 H ARG 11 -4.423 3.347 0.409 94 HA ARG 11 HA ARG 11 -1.463 3.604 0.506 95 HB2 ARG 11 HB2 ARG 11 -3.349 1.234 0.833 96 HB3 ARG 11 HB3 ARG 11 -1.606 1.108 0.948 97 HG2 ARG 11 HG2 ARG 11 -3.106 2.992 2.806 98 HG3 ARG 11 HG3 ARG 11 -3.091 1.257 3.093 99 HD2 ARG 11 HD2 ARG 11 -1.384 2.083 4.426 100 HD3 ARG 11 HD3 ARG 11 -0.561 1.312 3.080 101 HE ARG 11 HE ARG 11 -0.257 3.644 2.104 102 HH11 ARG 11 HH11 ARG 11 0.872 5.396 2.484 103 HH12 ARG 11 HH12 ARG 11 1.275 5.888 4.116 104 HH21 ARG 11 HH21 ARG 11 -0.486 3.344 5.641 105 HH22 ARG 11 HH22 ARG 11 0.592 4.698 5.840 106 H THR 12 H THR 12 -0.088 2.371 -0.798 107 HA THR 12 HA THR 12 -1.096 1.485 -3.446 108 HB THR 12 HB THR 12 0.546 2.563 -4.675 109 HG1 THR 12 HG1 THR 12 2.302 3.607 -3.729 110 HG21 THR 12 HG21 THR 12 0.360 4.927 -4.240 111 HG22 THR 12 HG22 THR 12 -1.201 4.169 -3.884 112 HG23 THR 12 HG23 THR 12 -0.116 4.652 -2.554 113 H PHE 13 H PHE 13 0.560 0.121 -4.693 114 HA PHE 13 HA PHE 13 1.069 -2.173 -3.194 115 HB2 PHE 13 HB2 PHE 13 0.768 -2.440 -5.468 116 HB3 PHE 13 HB3 PHE 13 2.004 -1.269 -5.881 117 HD1 PHE 13 HD1 PHE 13 1.356 -4.781 -5.171 118 HD2 PHE 13 HD2 PHE 13 4.449 -1.825 -5.693 119 HE1 PHE 13 HE1 PHE 13 3.039 -6.591 -5.514 120 HE2 PHE 13 HE2 PHE 13 6.120 -3.626 -6.012 121 HZ PHE 13 HZ PHE 13 5.421 -6.009 -5.917 122 H GLU 14 H GLU 14 3.588 0.234 -4.009 123 HA GLU 14 HA GLU 14 5.699 -1.182 -2.665 124 HB2 GLU 14 HB2 GLU 14 5.333 1.785 -3.247 125 HB3 GLU 14 HB3 GLU 14 6.832 1.075 -2.664 126 HG2 GLU 14 HG2 GLU 14 5.472 0.374 -5.303 127 HG3 GLU 14 HG3 GLU 14 6.796 1.510 -5.112 128 H GLN 15 H GLN 15 3.354 1.243 -1.484 129 HA GLN 15 HA GLN 15 4.514 1.531 1.149 130 HB2 GLN 15 HB2 GLN 15 1.648 1.944 0.208 131 HB3 GLN 15 HB3 GLN 15 2.309 2.464 1.760 132 HG2 GLN 15 HG2 GLN 15 3.840 4.019 0.657 133 HG3 GLN 15 HG3 GLN 15 3.325 3.464 -0.938 134 HE21 GLN 15 HE21 GLN 15 1.285 6.439 -0.604 135 HE22 GLN 15 HE22 GLN 15 2.882 5.927 -1.135 136 H ARG 16 H ARG 16 1.940 -0.610 -0.167 137 HA ARG 16 HA ARG 16 1.401 -1.933 2.356 138 HB2 ARG 16 HB2 ARG 16 0.840 -2.781 -0.511 139 HB3 ARG 16 HB3 ARG 16 0.345 -3.694 0.924 140 HG2 ARG 16 HG2 ARG 16 -0.812 -1.563 1.756 141 HG3 ARG 16 HG3 ARG 16 -0.548 -0.899 0.141 142 HD2 ARG 16 HD2 ARG 16 -2.180 -3.367 0.860 143 HD3 ARG 16 HD3 ARG 16 -2.796 -1.813 0.337 144 HE ARG 16 HE ARG 16 -2.014 -2.182 -1.888 145 HH11 ARG 16 HH11 ARG 16 -1.777 -3.653 -3.640 146 HH12 ARG 16 HH12 ARG 16 -1.476 -5.344 -3.220 147 HH21 ARG 16 HH21 ARG 16 -1.646 -5.130 0.068 148 HH22 ARG 16 HH22 ARG 16 -1.466 -6.071 -1.425 149 H VAL 17 H VAL 17 3.721 -2.676 -0.266 150 HA VAL 17 HA VAL 17 4.678 -5.159 0.866 151 HB VAL 17 HB VAL 17 5.865 -3.136 -1.064 152 HG11 VAL 17 HG11 VAL 17 7.142 -5.738 -0.122 153 HG12 VAL 17 HG12 VAL 17 7.640 -4.819 -1.562 154 HG13 VAL 17 HG13 VAL 17 7.825 -4.101 0.036 155 HG21 VAL 17 HG21 VAL 17 3.986 -4.662 -1.814 156 HG22 VAL 17 HG22 VAL 17 5.498 -4.916 -2.693 157 HG23 VAL 17 HG23 VAL 17 5.015 -6.043 -1.410 158 H GLU 18 H GLU 18 5.876 -1.732 1.263 159 HA GLU 18 HA GLU 18 7.897 -2.378 3.183 160 HB2 GLU 18 HB2 GLU 18 6.256 0.109 2.637 161 HB3 GLU 18 HB3 GLU 18 7.368 0.032 4.013 162 HG2 GLU 18 HG2 GLU 18 9.241 -0.470 2.590 163 HG3 GLU 18 HG3 GLU 18 8.212 -0.549 1.150 164 H ASP 19 H ASP 19 4.482 -1.426 3.758 165 HA ASP 19 HA ASP 19 4.457 -1.832 6.554 166 HB2 ASP 19 HB2 ASP 19 2.732 -0.598 5.690 167 HB3 ASP 19 HB3 ASP 19 2.356 -1.784 4.450 168 H VAL 20 H VAL 20 3.665 -4.357 4.096 169 HA VAL 20 HA VAL 20 3.260 -6.291 6.103 170 HB VAL 20 HB VAL 20 2.680 -6.333 3.546 171 HG11 VAL 20 HG11 VAL 20 3.907 -7.973 2.286 172 HG12 VAL 20 HG12 VAL 20 4.996 -6.657 2.701 173 HG13 VAL 20 HG13 VAL 20 5.087 -8.203 3.586 174 HG21 VAL 20 HG21 VAL 20 3.246 -8.801 5.223 175 HG22 VAL 20 HG22 VAL 20 1.772 -7.796 5.245 176 HG23 VAL 20 HG23 VAL 20 2.179 -8.724 3.797 177 H ARG 21 H ARG 21 6.288 -5.472 4.471 178 HA ARG 21 HA ARG 21 7.881 -7.545 5.726 179 HB2 ARG 21 HB2 ARG 21 8.604 -4.824 4.546 180 HB3 ARG 21 HB3 ARG 21 9.804 -5.961 5.147 181 HG2 ARG 21 HG2 ARG 21 7.839 -6.625 2.910 182 HG3 ARG 21 HG3 ARG 21 9.460 -5.984 2.659 183 HD2 ARG 21 HD2 ARG 21 10.402 -7.983 3.865 184 HD3 ARG 21 HD3 ARG 21 8.770 -8.629 3.988 185 HE ARG 21 HE ARG 21 8.719 -9.122 1.723 186 HH11 ARG 21 HH11 ARG 21 11.744 -7.451 2.362 187 HH12 ARG 21 HH12 ARG 21 12.437 -7.949 0.846 188 HH21 ARG 21 HH21 ARG 21 9.664 -9.695 -0.201 189 HH22 ARG 21 HH22 ARG 21 11.285 -9.184 -0.561 190 H LEU 22 H LEU 22 7.230 -4.157 6.689 191 HA LEU 22 HA LEU 22 8.721 -4.231 9.136 192 HB2 LEU 22 HB2 LEU 22 6.303 -2.622 8.212 193 HB3 LEU 22 HB3 LEU 22 7.031 -2.377 9.798 194 HG LEU 22 HG LEU 22 8.736 -2.285 7.303 195 HD11 LEU 22 HD11 LEU 22 8.436 0.138 7.167 196 HD12 LEU 22 HD12 LEU 22 6.885 -0.672 6.944 197 HD13 LEU 22 HD13 LEU 22 7.254 0.092 8.504 198 HD21 LEU 22 HD21 LEU 22 9.906 -2.339 9.482 199 HD22 LEU 22 HD22 LEU 22 10.144 -0.793 8.666 200 HD23 LEU 22 HD23 LEU 22 8.994 -0.917 10.017 201 H ILE 23 H ILE 23 5.232 -4.900 8.548 202 HA ILE 23 HA ILE 23 4.555 -5.606 11.193 203 HB ILE 23 HB ILE 23 3.390 -6.004 8.487 204 HG12 ILE 23 HG12 ILE 23 1.455 -4.990 9.451 205 HG13 ILE 23 HG13 ILE 23 2.013 -5.283 11.095 206 HG21 ILE 23 HG21 ILE 23 3.061 -8.287 9.245 207 HG22 ILE 23 HG22 ILE 23 2.375 -7.707 10.792 208 HG23 ILE 23 HG23 ILE 23 1.558 -7.405 9.242 209 HD11 ILE 23 HD11 ILE 23 3.787 -3.535 10.777 210 HD12 ILE 23 HD12 ILE 23 3.148 -3.236 9.148 211 HD13 ILE 23 HD13 ILE 23 2.141 -2.926 10.564 212 H ARG 24 H ARG 24 5.748 -7.852 8.627 213 HA ARG 24 HA ARG 24 5.585 -10.107 10.423 214 HB2 ARG 24 HB2 ARG 24 5.800 -9.925 7.736 215 HB3 ARG 24 HB3 ARG 24 7.518 -10.073 8.096 216 HG2 ARG 24 HG2 ARG 24 6.783 -12.302 7.750 217 HG3 ARG 24 HG3 ARG 24 6.857 -12.156 9.505 218 HD2 ARG 24 HD2 ARG 24 4.289 -11.435 9.231 219 HD3 ARG 24 HD3 ARG 24 4.426 -12.273 7.690 220 HE ARG 24 HE ARG 24 4.176 -13.409 10.322 221 HH11 ARG 24 HH11 ARG 24 4.845 -15.372 10.975 222 HH12 ARG 24 HH12 ARG 24 5.465 -16.533 9.818 223 HH21 ARG 24 HH21 ARG 24 5.513 -14.300 7.190 224 HH22 ARG 24 HH22 ARG 24 5.989 -15.875 7.759 225 H GLU 25 H GLU 25 8.101 -7.689 9.985 226 HA GLU 25 HA GLU 25 10.042 -9.108 11.654 227 HB2 GLU 25 HB2 GLU 25 9.869 -6.260 10.637 228 HB3 GLU 25 HB3 GLU 25 11.138 -6.822 11.737 229 HG2 GLU 25 HG2 GLU 25 11.823 -8.554 10.148 230 HG3 GLU 25 HG3 GLU 25 10.552 -8.089 9.027 231 H GLN 26 H GLN 26 7.715 -6.390 12.342 232 HA GLN 26 HA GLN 26 8.523 -6.346 15.124 233 HB2 GLN 26 HB2 GLN 26 6.671 -4.850 15.531 234 HB3 GLN 26 HB3 GLN 26 7.713 -4.308 14.225 235 HG2 GLN 26 HG2 GLN 26 6.072 -4.532 12.606 236 HG3 GLN 26 HG3 GLN 26 5.207 -5.808 13.487 237 HE21 GLN 26 HE21 GLN 26 2.846 -3.114 13.880 238 HE22 GLN 26 HE22 GLN 26 3.207 -4.546 12.940 239 H HIS 27 H HIS 27 5.964 -8.155 13.465 240 HA HIS 27 HA HIS 27 5.435 -9.653 16.009 241 HB2 HIS 27 HB2 HIS 27 3.279 -8.563 14.157 242 HB3 HIS 27 HB3 HIS 27 3.016 -9.565 15.587 243 HD1 HIS 27 HD1 HIS 27 4.501 -8.082 17.853 244 HD2 HIS 27 HD2 HIS 27 2.321 -6.245 14.738 245 HE1 HIS 27 HE1 HIS 27 3.769 -5.776 18.740 246 HE2 HIS 27 HE2 HIS 27 2.465 -4.650 16.826 247 HA PRO 28 HA PRO 28 6.398 -12.418 12.370 248 HB2 PRO 28 HB2 PRO 28 7.463 -14.061 14.676 249 HB3 PRO 28 HB3 PRO 28 8.130 -13.864 13.025 250 HG2 PRO 28 HG2 PRO 28 9.204 -12.495 15.098 251 HG3 PRO 28 HG3 PRO 28 8.918 -11.654 13.542 252 HD2 PRO 28 HD2 PRO 28 7.227 -11.595 16.048 253 HD3 PRO 28 HD3 PRO 28 7.716 -10.253 14.974 254 H THR 29 H THR 29 4.847 -13.279 15.471 255 HA THR 29 HA THR 29 3.551 -15.650 14.479 256 HB THR 29 HB THR 29 2.451 -15.847 16.509 257 HG1 THR 29 HG1 THR 29 2.205 -14.118 17.937 258 HG21 THR 29 HG21 THR 29 4.970 -16.005 16.716 259 HG22 THR 29 HG22 THR 29 4.974 -14.328 17.314 260 HG23 THR 29 HG23 THR 29 4.120 -15.590 18.218 261 H LYS 30 H LYS 30 2.756 -12.387 13.868 262 HA LYS 30 HA LYS 30 -0.070 -13.072 13.227 263 HB2 LYS 30 HB2 LYS 30 1.426 -10.436 13.256 264 HB3 LYS 30 HB3 LYS 30 -0.192 -10.625 12.565 265 HG2 LYS 30 HG2 LYS 30 -1.103 -11.393 14.691 266 HG3 LYS 30 HG3 LYS 30 0.499 -11.352 15.447 267 HD2 LYS 30 HD2 LYS 30 0.615 -8.921 15.202 268 HD3 LYS 30 HD3 LYS 30 -0.909 -8.897 14.297 269 HE2 LYS 30 HE2 LYS 30 -2.173 -9.643 16.239 270 HE3 LYS 30 HE3 LYS 30 -0.701 -9.940 17.162 271 HZ1 LYS 30 HZ1 LYS 30 -0.276 -7.589 17.271 272 HZ2 LYS 30 HZ2 LYS 30 -1.461 -7.222 16.196 273 HZ3 LYS 30 HZ3 LYS 30 -1.848 -7.756 17.686 274 H ILE 31 H ILE 31 -0.945 -12.903 11.275 275 HA ILE 31 HA ILE 31 0.834 -13.424 8.939 276 HB ILE 31 HB ILE 31 -1.861 -14.609 9.704 277 HG12 ILE 31 HG12 ILE 31 -0.115 -15.452 11.188 278 HG13 ILE 31 HG13 ILE 31 -0.704 -16.699 10.104 279 HG21 ILE 31 HG21 ILE 31 -0.057 -15.200 7.341 280 HG22 ILE 31 HG22 ILE 31 -1.444 -16.202 7.838 281 HG23 ILE 31 HG23 ILE 31 -1.707 -14.542 7.292 282 HD11 ILE 31 HD11 ILE 31 1.331 -16.498 8.704 283 HD12 ILE 31 HD12 ILE 31 1.941 -15.211 9.769 284 HD13 ILE 31 HD13 ILE 31 1.729 -16.850 10.392 285 HA PRO 32 HA PRO 32 -1.445 -9.920 7.369 286 HB2 PRO 32 HB2 PRO 32 -0.215 -9.522 4.988 287 HB3 PRO 32 HB3 PRO 32 0.643 -9.339 6.554 288 HG2 PRO 32 HG2 PRO 32 0.589 -11.770 4.733 289 HG3 PRO 32 HG3 PRO 32 2.032 -10.942 5.400 290 HD2 PRO 32 HD2 PRO 32 0.948 -13.139 6.592 291 HD3 PRO 32 HD3 PRO 32 1.652 -11.800 7.547 292 H VAL 33 H VAL 33 -3.432 -9.714 6.564 293 HA VAL 33 HA VAL 33 -4.355 -11.430 4.304 294 HB VAL 33 HB VAL 33 -5.866 -10.962 6.901 295 HG11 VAL 33 HG11 VAL 33 -6.563 -12.610 4.435 296 HG12 VAL 33 HG12 VAL 33 -7.442 -12.670 5.982 297 HG13 VAL 33 HG13 VAL 33 -7.440 -11.185 5.041 298 HG21 VAL 33 HG21 VAL 33 -4.479 -13.457 5.857 299 HG22 VAL 33 HG22 VAL 33 -4.104 -12.564 7.344 300 HG23 VAL 33 HG23 VAL 33 -5.630 -13.440 7.206 301 H ILE 34 H ILE 34 -5.885 -10.489 2.924 302 HA ILE 34 HA ILE 34 -6.973 -7.803 3.695 303 HB ILE 34 HB ILE 34 -5.480 -8.499 1.185 304 HG12 ILE 34 HG12 ILE 34 -5.726 -5.863 2.710 305 HG13 ILE 34 HG13 ILE 34 -4.591 -7.120 3.183 306 HG21 ILE 34 HG21 ILE 34 -7.789 -6.512 1.328 307 HG22 ILE 34 HG22 ILE 34 -6.551 -6.522 0.051 308 HG23 ILE 34 HG23 ILE 34 -7.621 -7.902 0.224 309 HD11 ILE 34 HD11 ILE 34 -3.388 -5.533 1.897 310 HD12 ILE 34 HD12 ILE 34 -3.544 -7.003 0.909 311 HD13 ILE 34 HD13 ILE 34 -4.560 -5.587 0.573 312 H ILE 35 H ILE 35 -9.145 -7.684 3.479 313 HA ILE 35 HA ILE 35 -10.467 -9.735 1.794 314 HB ILE 35 HB ILE 35 -10.968 -10.078 4.177 315 HG12 ILE 35 HG12 ILE 35 -13.400 -9.268 2.502 316 HG13 ILE 35 HG13 ILE 35 -12.483 -10.767 2.296 317 HG21 ILE 35 HG21 ILE 35 -11.038 -7.653 4.867 318 HG22 ILE 35 HG22 ILE 35 -12.593 -7.491 4.032 319 HG23 ILE 35 HG23 ILE 35 -12.416 -8.586 5.425 320 HD11 ILE 35 HD11 ILE 35 -12.977 -11.373 4.675 321 HD12 ILE 35 HD12 ILE 35 -14.073 -9.973 4.758 322 HD13 ILE 35 HD13 ILE 35 -14.406 -11.290 3.625 323 H GLU 36 H GLU 36 -11.839 -9.059 0.225 324 HA GLU 36 HA GLU 36 -12.730 -6.204 0.126 325 HB2 GLU 36 HB2 GLU 36 -10.436 -6.396 -0.988 326 HB3 GLU 36 HB3 GLU 36 -11.134 -7.600 -2.078 327 HG2 GLU 36 HG2 GLU 36 -12.849 -5.739 -2.710 328 HG3 GLU 36 HG3 GLU 36 -11.759 -4.631 -1.885 329 H ARG 37 H ARG 37 -14.610 -5.981 -0.631 330 HA ARG 37 HA ARG 37 -16.407 -8.120 -1.272 331 HB2 ARG 37 HB2 ARG 37 -16.784 -5.940 -0.183 332 HB3 ARG 37 HB3 ARG 37 -16.578 -5.115 -1.736 333 HG2 ARG 37 HG2 ARG 37 -18.636 -6.253 -2.569 334 HG3 ARG 37 HG3 ARG 37 -18.804 -7.068 -0.995 335 HD2 ARG 37 HD2 ARG 37 -18.792 -4.032 -1.422 336 HD3 ARG 37 HD3 ARG 37 -20.211 -5.020 -1.135 337 HE ARG 37 HE ARG 37 -19.661 -5.330 1.101 338 HH11 ARG 37 HH11 ARG 37 -17.183 -3.192 -0.279 339 HH12 ARG 37 HH12 ARG 37 -16.539 -2.837 1.294 340 HH21 ARG 37 HH21 ARG 37 -18.798 -4.746 3.024 341 HH22 ARG 37 HH22 ARG 37 -17.437 -3.662 3.128 342 H TYR 38 H TYR 38 -17.310 -8.771 -3.214 343 HA TYR 38 HA TYR 38 -15.618 -8.934 -5.368 344 HB2 TYR 38 HB2 TYR 38 -16.992 -10.676 -5.142 345 HB3 TYR 38 HB3 TYR 38 -18.431 -9.692 -4.926 346 HD1 TYR 38 HD1 TYR 38 -20.056 -9.912 -6.558 347 HD2 TYR 38 HD2 TYR 38 -15.897 -10.383 -7.652 348 HE1 TYR 38 HE1 TYR 38 -20.720 -10.414 -8.897 349 HE2 TYR 38 HE2 TYR 38 -16.584 -10.854 -9.999 350 HH TYR 38 HH TYR 38 -20.016 -10.958 -11.021 351 H LYS 39 H LYS 39 -14.984 -7.932 -7.118 352 HA LYS 39 HA LYS 39 -15.652 -5.203 -7.528 353 HB2 LYS 39 HB2 LYS 39 -14.147 -7.237 -9.213 354 HB3 LYS 39 HB3 LYS 39 -14.401 -5.581 -9.763 355 HG2 LYS 39 HG2 LYS 39 -13.285 -4.679 -7.773 356 HG3 LYS 39 HG3 LYS 39 -12.995 -6.322 -7.164 357 HD2 LYS 39 HD2 LYS 39 -11.547 -6.846 -9.046 358 HD3 LYS 39 HD3 LYS 39 -12.039 -5.387 -9.901 359 HE2 LYS 39 HE2 LYS 39 -9.818 -5.080 -9.060 360 HE3 LYS 39 HE3 LYS 39 -10.916 -3.961 -8.251 361 HZ1 LYS 39 HZ1 LYS 39 -10.832 -5.298 -6.261 362 HZ2 LYS 39 HZ2 LYS 39 -10.039 -6.533 -7.022 363 HZ3 LYS 39 HZ3 LYS 39 -9.297 -5.107 -6.752 364 H GLY 40 H GLY 40 -16.955 -8.051 -9.190 365 HA2 GLY 40 HA2 GLY 40 -18.201 -6.596 -11.349 366 HA3 GLY 40 HA3 GLY 40 -18.520 -8.265 -10.885 367 H GLU 41 H GLU 41 -19.344 -7.474 -8.092 368 HA GLU 41 HA GLU 41 -21.567 -5.614 -8.379 369 HB2 GLU 41 HB2 GLU 41 -22.622 -7.669 -9.266 370 HB3 GLU 41 HB3 GLU 41 -22.087 -8.558 -7.847 371 HG2 GLU 41 HG2 GLU 41 -24.362 -8.163 -7.495 372 HG3 GLU 41 HG3 GLU 41 -23.535 -7.076 -6.418 373 H LYS 42 H LYS 42 -21.724 -4.491 -6.564 374 HA LYS 42 HA LYS 42 -20.591 -5.321 -3.979 375 HB2 LYS 42 HB2 LYS 42 -22.340 -2.946 -4.752 376 HB3 LYS 42 HB3 LYS 42 -21.457 -3.111 -3.240 377 HG2 LYS 42 HG2 LYS 42 -20.121 -2.914 -5.988 378 HG3 LYS 42 HG3 LYS 42 -20.476 -1.548 -4.941 379 HD2 LYS 42 HD2 LYS 42 -18.991 -2.421 -3.195 380 HD3 LYS 42 HD3 LYS 42 -18.682 -3.878 -4.152 381 HE2 LYS 42 HE2 LYS 42 -16.788 -2.317 -4.287 382 HE3 LYS 42 HE3 LYS 42 -17.508 -2.598 -5.865 383 HZ1 LYS 42 HZ1 LYS 42 -18.034 -0.181 -4.186 384 HZ2 LYS 42 HZ2 LYS 42 -17.014 -0.236 -5.460 385 HZ3 LYS 42 HZ3 LYS 42 -18.607 -0.430 -5.707 386 H GLN 43 H GLN 43 -22.112 -7.331 -4.483 387 HA GLN 43 HA GLN 43 -24.933 -7.084 -4.127 388 HB2 GLN 43 HB2 GLN 43 -23.569 -8.945 -5.294 389 HB3 GLN 43 HB3 GLN 43 -23.273 -9.623 -3.701 390 HG2 GLN 43 HG2 GLN 43 -25.606 -10.060 -3.351 391 HG3 GLN 43 HG3 GLN 43 -26.082 -8.982 -4.666 392 HE21 GLN 43 HE21 GLN 43 -26.633 -12.321 -6.051 393 HE22 GLN 43 HE22 GLN 43 -27.359 -11.268 -4.846 394 H LEU 44 H LEU 44 -22.409 -7.786 -1.816 395 HA LEU 44 HA LEU 44 -24.402 -8.126 0.361 396 HB2 LEU 44 HB2 LEU 44 -21.575 -9.074 -0.112 397 HB3 LEU 44 HB3 LEU 44 -22.313 -9.132 1.501 398 HG LEU 44 HG LEU 44 -23.043 -10.720 -0.962 399 HD11 LEU 44 HD11 LEU 44 -22.703 -12.614 0.544 400 HD12 LEU 44 HD12 LEU 44 -21.288 -11.547 0.612 401 HD13 LEU 44 HD13 LEU 44 -22.494 -11.531 1.924 402 HD21 LEU 44 HD21 LEU 44 -24.722 -10.464 1.567 403 HD22 LEU 44 HD22 LEU 44 -25.231 -10.080 -0.099 404 HD23 LEU 44 HD23 LEU 44 -24.899 -11.746 0.348 405 HA PRO 45 HA PRO 45 -23.997 -4.499 2.402 406 HB2 PRO 45 HB2 PRO 45 -22.650 -5.924 4.717 407 HB3 PRO 45 HB3 PRO 45 -23.896 -4.632 4.779 408 HG2 PRO 45 HG2 PRO 45 -24.668 -7.211 4.957 409 HG3 PRO 45 HG3 PRO 45 -25.569 -6.100 3.880 410 HD2 PRO 45 HD2 PRO 45 -23.545 -8.203 3.139 411 HD3 PRO 45 HD3 PRO 45 -25.025 -7.680 2.280 412 H VAL 46 H VAL 46 -22.869 -2.698 2.415 413 HA VAL 46 HA VAL 46 -20.051 -2.769 1.759 414 HB VAL 46 HB VAL 46 -21.490 -0.160 1.849 415 HG11 VAL 46 HG11 VAL 46 -19.531 -1.395 -0.150 416 HG12 VAL 46 HG12 VAL 46 -20.107 0.284 -0.119 417 HG13 VAL 46 HG13 VAL 46 -19.067 -0.311 1.177 418 HG21 VAL 46 HG21 VAL 46 -22.299 -0.567 -0.479 419 HG22 VAL 46 HG22 VAL 46 -21.916 -2.293 -0.280 420 HG23 VAL 46 HG23 VAL 46 -23.159 -1.515 0.731 421 H LEU 47 H LEU 47 -20.508 -3.510 4.419 422 HA LEU 47 HA LEU 47 -19.759 -1.457 6.280 423 HB2 LEU 47 HB2 LEU 47 -19.501 -4.489 6.363 424 HB3 LEU 47 HB3 LEU 47 -19.137 -3.449 7.738 425 HG LEU 47 HG LEU 47 -21.873 -3.539 6.388 426 HD11 LEU 47 HD11 LEU 47 -22.565 -4.887 8.322 427 HD12 LEU 47 HD12 LEU 47 -21.317 -5.699 7.371 428 HD13 LEU 47 HD13 LEU 47 -20.890 -4.911 8.921 429 HD21 LEU 47 HD21 LEU 47 -22.630 -2.485 8.510 430 HD22 LEU 47 HD22 LEU 47 -20.945 -2.361 9.051 431 HD23 LEU 47 HD23 LEU 47 -21.506 -1.442 7.638 432 H ASP 48 H ASP 48 -17.830 -1.310 7.496 433 HA ASP 48 HA ASP 48 -15.674 -0.733 5.708 434 HB2 ASP 48 HB2 ASP 48 -14.777 0.519 7.714 435 HB3 ASP 48 HB3 ASP 48 -16.294 1.011 6.996 436 H LYS 49 H LYS 49 -15.767 -3.532 6.080 437 HA LYS 49 HA LYS 49 -13.290 -4.234 7.638 438 HB2 LYS 49 HB2 LYS 49 -15.581 -5.789 6.394 439 HB3 LYS 49 HB3 LYS 49 -14.084 -6.598 6.796 440 HG2 LYS 49 HG2 LYS 49 -15.889 -6.837 8.474 441 HG3 LYS 49 HG3 LYS 49 -14.361 -6.307 9.115 442 HD2 LYS 49 HD2 LYS 49 -16.545 -4.272 8.526 443 HD3 LYS 49 HD3 LYS 49 -16.596 -5.266 9.965 444 HE2 LYS 49 HE2 LYS 49 -14.270 -4.494 10.602 445 HE3 LYS 49 HE3 LYS 49 -14.294 -3.384 9.244 446 HZ1 LYS 49 HZ1 LYS 49 -16.183 -2.222 10.224 447 HZ2 LYS 49 HZ2 LYS 49 -16.286 -3.301 11.468 448 HZ3 LYS 49 HZ3 LYS 49 -14.983 -2.319 11.323 449 H THR 50 H THR 50 -11.402 -4.035 6.623 450 HA THR 50 HA THR 50 -11.171 -4.858 3.796 451 HB THR 50 HB THR 50 -10.298 -2.979 2.896 452 HG1 THR 50 HG1 THR 50 -9.761 -1.114 4.251 453 HG21 THR 50 HG21 THR 50 -11.763 -1.088 3.335 454 HG22 THR 50 HG22 THR 50 -12.716 -2.574 3.369 455 HG23 THR 50 HG23 THR 50 -12.258 -1.768 4.894 456 H LYS 51 H LYS 51 -8.632 -3.291 5.663 457 HA LYS 51 HA LYS 51 -6.769 -5.453 4.953 458 HB2 LYS 51 HB2 LYS 51 -6.309 -2.962 4.926 459 HB3 LYS 51 HB3 LYS 51 -6.365 -2.984 6.694 460 HG2 LYS 51 HG2 LYS 51 -4.465 -4.699 6.621 461 HG3 LYS 51 HG3 LYS 51 -4.389 -4.428 4.867 462 HD2 LYS 51 HD2 LYS 51 -4.011 -1.964 5.330 463 HD3 LYS 51 HD3 LYS 51 -4.039 -2.342 7.066 464 HE2 LYS 51 HE2 LYS 51 -2.189 -4.108 6.406 465 HE3 LYS 51 HE3 LYS 51 -2.004 -3.107 4.959 466 HZ1 LYS 51 HZ1 LYS 51 -1.682 -2.262 7.784 467 HZ2 LYS 51 HZ2 LYS 51 -0.503 -2.359 6.681 468 HZ3 LYS 51 HZ3 LYS 51 -1.644 -1.164 6.580 469 H PHE 52 H PHE 52 -5.907 -7.048 6.286 470 HA PHE 52 HA PHE 52 -6.624 -7.052 9.139 471 HB2 PHE 52 HB2 PHE 52 -7.526 -9.103 7.165 472 HB3 PHE 52 HB3 PHE 52 -7.230 -9.550 8.836 473 HD1 PHE 52 HD1 PHE 52 -8.423 -8.315 10.722 474 HD2 PHE 52 HD2 PHE 52 -9.553 -7.953 6.576 475 HE1 PHE 52 HE1 PHE 52 -10.606 -7.338 11.397 476 HE2 PHE 52 HE2 PHE 52 -11.735 -6.979 7.264 477 HZ PHE 52 HZ PHE 52 -12.245 -6.659 9.683 478 H LEU 53 H LEU 53 -5.473 -8.192 10.630 479 HA LEU 53 HA LEU 53 -3.131 -9.744 9.665 480 HB2 LEU 53 HB2 LEU 53 -3.042 -7.864 12.053 481 HB3 LEU 53 HB3 LEU 53 -1.789 -8.993 11.572 482 HG LEU 53 HG LEU 53 -2.615 -6.492 10.037 483 HD11 LEU 53 HD11 LEU 53 -0.347 -5.749 10.685 484 HD12 LEU 53 HD12 LEU 53 -1.314 -6.103 12.124 485 HD13 LEU 53 HD13 LEU 53 -0.079 -7.258 11.573 486 HD21 LEU 53 HD21 LEU 53 -0.586 -6.931 8.659 487 HD22 LEU 53 HD22 LEU 53 -0.478 -8.561 9.391 488 HD23 LEU 53 HD23 LEU 53 -1.874 -8.080 8.387 489 H VAL 54 H VAL 54 -3.089 -11.716 10.593 490 HA VAL 54 HA VAL 54 -5.086 -12.271 12.753 491 HB VAL 54 HB VAL 54 -4.505 -14.113 10.439 492 HG11 VAL 54 HG11 VAL 54 -5.497 -15.126 12.508 493 HG12 VAL 54 HG12 VAL 54 -6.857 -13.988 12.388 494 HG13 VAL 54 HG13 VAL 54 -6.591 -15.198 11.121 495 HG21 VAL 54 HG21 VAL 54 -6.685 -13.391 9.497 496 HG22 VAL 54 HG22 VAL 54 -6.771 -12.098 10.712 497 HG23 VAL 54 HG23 VAL 54 -5.491 -12.096 9.475 498 HA PRO 55 HA PRO 55 -1.556 -14.264 14.750 499 HB2 PRO 55 HB2 PRO 55 -3.708 -15.678 16.321 500 HB3 PRO 55 HB3 PRO 55 -2.222 -14.883 16.911 501 HG2 PRO 55 HG2 PRO 55 -4.616 -13.642 17.156 502 HG3 PRO 55 HG3 PRO 55 -3.185 -12.708 16.618 503 HD2 PRO 55 HD2 PRO 55 -5.397 -13.902 14.920 504 HD3 PRO 55 HD3 PRO 55 -4.673 -12.262 14.855 505 H ASP 56 H ASP 56 -0.455 -16.132 14.223 506 HA ASP 56 HA ASP 56 -1.340 -17.949 12.311 507 HB2 ASP 56 HB2 ASP 56 0.639 -19.310 12.944 508 HB3 ASP 56 HB3 ASP 56 0.967 -17.601 12.688 509 H HIS 57 H HIS 57 -1.981 -18.136 15.680 510 HA HIS 57 HA HIS 57 -2.649 -20.898 16.046 511 HB2 HIS 57 HB2 HIS 57 -3.724 -18.327 17.322 512 HB3 HIS 57 HB3 HIS 57 -4.108 -19.941 17.878 513 HD1 HIS 57 HD1 HIS 57 -0.409 -18.771 17.156 514 HD2 HIS 57 HD2 HIS 57 -3.198 -19.575 20.243 515 HE1 HIS 57 HE1 HIS 57 0.844 -18.507 19.375 516 HE2 HIS 57 HE2 HIS 57 -0.880 -18.935 21.253 517 H VAL 58 H VAL 58 -4.412 -18.327 14.397 518 HA VAL 58 HA VAL 58 -7.067 -19.348 14.904 519 HB VAL 58 HB VAL 58 -6.017 -17.268 12.977 520 HG11 VAL 58 HG11 VAL 58 -8.370 -16.405 12.900 521 HG12 VAL 58 HG12 VAL 58 -8.141 -17.947 12.082 522 HG13 VAL 58 HG13 VAL 58 -8.899 -17.901 13.693 523 HG21 VAL 58 HG21 VAL 58 -7.431 -17.038 15.674 524 HG22 VAL 58 HG22 VAL 58 -5.724 -16.658 15.361 525 HG23 VAL 58 HG23 VAL 58 -6.993 -15.669 14.633 526 H ASN 59 H ASN 59 -8.295 -20.735 13.789 527 HA ASN 59 HA ASN 59 -7.289 -22.094 11.379 528 HB2 ASN 59 HB2 ASN 59 -9.802 -22.302 13.071 529 HB3 ASN 59 HB3 ASN 59 -9.664 -23.148 11.541 530 HD21 ASN 59 HD21 ASN 59 -8.619 -25.547 14.106 531 HD22 ASN 59 HD22 ASN 59 -10.097 -24.708 13.658 532 H MET 60 H MET 60 -8.201 -22.048 9.260 533 HA MET 60 HA MET 60 -9.059 -19.521 8.285 534 HB2 MET 60 HB2 MET 60 -7.966 -21.229 6.945 535 HB3 MET 60 HB3 MET 60 -9.322 -22.325 7.151 536 HG2 MET 60 HG2 MET 60 -9.447 -21.478 4.975 537 HG3 MET 60 HG3 MET 60 -10.755 -20.697 5.839 538 HE1 MET 60 HE1 MET 60 -10.426 -18.024 6.766 539 HE2 MET 60 HE2 MET 60 -10.116 -17.023 5.339 540 HE3 MET 60 HE3 MET 60 -11.282 -18.357 5.243 541 H SER 61 H SER 61 -11.077 -22.388 9.116 542 HA SER 61 HA SER 61 -13.635 -21.260 8.663 543 HB2 SER 61 HB2 SER 61 -14.371 -23.011 10.285 544 HB3 SER 61 HB3 SER 61 -13.315 -23.622 8.999 545 HG SER 61 HG SER 61 -12.775 -24.319 11.220 546 H GLU 62 H GLU 62 -11.508 -21.018 11.498 547 HA GLU 62 HA GLU 62 -13.392 -19.663 13.223 548 HB2 GLU 62 HB2 GLU 62 -11.509 -20.963 14.035 549 HB3 GLU 62 HB3 GLU 62 -10.374 -19.861 13.249 550 HG2 GLU 62 HG2 GLU 62 -11.184 -18.022 14.744 551 HG3 GLU 62 HG3 GLU 62 -12.198 -19.214 15.577 552 H LEU 63 H LEU 63 -10.739 -18.433 11.103 553 HA LEU 63 HA LEU 63 -11.229 -15.637 11.509 554 HB2 LEU 63 HB2 LEU 63 -9.205 -16.422 10.404 555 HB3 LEU 63 HB3 LEU 63 -10.142 -17.208 9.140 556 HG LEU 63 HG LEU 63 -10.923 -14.964 8.327 557 HD11 LEU 63 HD11 LEU 63 -8.932 -13.925 10.399 558 HD12 LEU 63 HD12 LEU 63 -9.669 -12.952 9.101 559 HD13 LEU 63 HD13 LEU 63 -10.684 -13.635 10.382 560 HD21 LEU 63 HD21 LEU 63 -8.835 -14.340 7.265 561 HD22 LEU 63 HD22 LEU 63 -7.902 -15.231 8.509 562 HD23 LEU 63 HD23 LEU 63 -8.949 -16.102 7.366 563 H ILE 64 H ILE 64 -12.636 -17.925 9.130 564 HA ILE 64 HA ILE 64 -14.495 -16.147 7.906 565 HB ILE 64 HB ILE 64 -14.290 -19.106 8.325 566 HG12 ILE 64 HG12 ILE 64 -14.871 -17.677 5.734 567 HG13 ILE 64 HG13 ILE 64 -13.262 -17.553 6.449 568 HG21 ILE 64 HG21 ILE 64 -16.853 -17.826 7.286 569 HG22 ILE 64 HG22 ILE 64 -16.408 -19.527 7.060 570 HG23 ILE 64 HG23 ILE 64 -16.680 -18.916 8.683 571 HD11 ILE 64 HD11 ILE 64 -12.884 -19.909 6.347 572 HD12 ILE 64 HD12 ILE 64 -14.564 -20.244 5.944 573 HD13 ILE 64 HD13 ILE 64 -13.518 -19.411 4.769 574 H LYS 65 H LYS 65 -14.938 -18.068 10.922 575 HA LYS 65 HA LYS 65 -17.603 -17.230 11.386 576 HB2 LYS 65 HB2 LYS 65 -16.412 -19.159 12.448 577 HB3 LYS 65 HB3 LYS 65 -15.527 -18.027 13.479 578 HG2 LYS 65 HG2 LYS 65 -17.667 -17.224 14.447 579 HG3 LYS 65 HG3 LYS 65 -18.556 -18.312 13.359 580 HD2 LYS 65 HD2 LYS 65 -17.470 -20.272 14.412 581 HD3 LYS 65 HD3 LYS 65 -16.564 -19.195 15.501 582 HE2 LYS 65 HE2 LYS 65 -18.703 -18.341 16.435 583 HE3 LYS 65 HE3 LYS 65 -19.609 -19.397 15.346 584 HZ1 LYS 65 HZ1 LYS 65 -17.743 -20.344 17.475 585 HZ2 LYS 65 HZ2 LYS 65 -19.372 -20.402 17.551 586 HZ3 LYS 65 HZ3 LYS 65 -18.584 -21.321 16.461 587 H ILE 66 H ILE 66 -14.600 -15.727 12.751 588 HA ILE 66 HA ILE 66 -16.103 -13.600 14.023 589 HB ILE 66 HB ILE 66 -13.985 -14.060 14.893 590 HG12 ILE 66 HG12 ILE 66 -14.817 -11.631 14.840 591 HG13 ILE 66 HG13 ILE 66 -13.180 -11.973 15.343 592 HG21 ILE 66 HG21 ILE 66 -12.703 -14.904 13.057 593 HG22 ILE 66 HG22 ILE 66 -12.696 -13.336 12.232 594 HG23 ILE 66 HG23 ILE 66 -11.830 -13.564 13.772 595 HD11 ILE 66 HD11 ILE 66 -13.244 -9.951 14.009 596 HD12 ILE 66 HD12 ILE 66 -12.273 -11.174 13.208 597 HD13 ILE 66 HD13 ILE 66 -13.910 -10.823 12.618 598 H ILE 67 H ILE 67 -14.581 -13.758 10.770 599 HA ILE 67 HA ILE 67 -15.229 -11.029 10.095 600 HB ILE 67 HB ILE 67 -14.583 -13.494 8.459 601 HG12 ILE 67 HG12 ILE 67 -12.755 -12.533 9.831 602 HG13 ILE 67 HG13 ILE 67 -12.432 -12.488 8.114 603 HG21 ILE 67 HG21 ILE 67 -15.053 -10.690 7.375 604 HG22 ILE 67 HG22 ILE 67 -14.226 -12.008 6.511 605 HG23 ILE 67 HG23 ILE 67 -15.920 -12.186 6.943 606 HD11 ILE 67 HD11 ILE 67 -13.262 -10.086 9.818 607 HD12 ILE 67 HD12 ILE 67 -11.635 -10.470 9.258 608 HD13 ILE 67 HD13 ILE 67 -12.885 -10.046 8.079 609 H ARG 68 H ARG 68 -17.077 -14.055 9.429 610 HA ARG 68 HA ARG 68 -19.282 -12.832 8.100 611 HB2 ARG 68 HB2 ARG 68 -18.702 -15.313 8.297 612 HB3 ARG 68 HB3 ARG 68 -19.336 -15.273 9.939 613 HG2 ARG 68 HG2 ARG 68 -21.532 -14.395 8.835 614 HG3 ARG 68 HG3 ARG 68 -20.805 -14.893 7.304 615 HD2 ARG 68 HD2 ARG 68 -20.454 -17.138 8.921 616 HD3 ARG 68 HD3 ARG 68 -21.980 -16.505 9.526 617 HE ARG 68 HE ARG 68 -21.466 -17.858 7.022 618 HH11 ARG 68 HH11 ARG 68 -23.696 -15.458 8.345 619 HH12 ARG 68 HH12 ARG 68 -24.963 -15.938 7.246 620 HH21 ARG 68 HH21 ARG 68 -23.189 -18.393 5.675 621 HH22 ARG 68 HH22 ARG 68 -24.626 -17.383 5.721 622 H ARG 69 H ARG 69 -18.796 -13.435 11.591 623 HA ARG 69 HA ARG 69 -21.240 -12.210 12.510 624 HB2 ARG 69 HB2 ARG 69 -19.894 -13.780 13.831 625 HB3 ARG 69 HB3 ARG 69 -18.561 -12.621 13.922 626 HG2 ARG 69 HG2 ARG 69 -19.959 -11.059 15.218 627 HG3 ARG 69 HG3 ARG 69 -21.350 -12.151 15.059 628 HD2 ARG 69 HD2 ARG 69 -20.113 -13.900 16.299 629 HD3 ARG 69 HD3 ARG 69 -18.717 -12.805 16.452 630 HE ARG 69 HE ARG 69 -21.035 -11.489 17.475 631 HH11 ARG 69 HH11 ARG 69 -18.948 -14.148 18.418 632 HH12 ARG 69 HH12 ARG 69 -19.300 -13.937 20.112 633 HH21 ARG 69 HH21 ARG 69 -21.433 -11.274 19.645 634 HH22 ARG 69 HH22 ARG 69 -20.672 -12.348 20.782 635 H ARG 70 H ARG 70 -17.946 -10.781 12.182 636 HA ARG 70 HA ARG 70 -18.735 -8.165 13.078 637 HB2 ARG 70 HB2 ARG 70 -16.389 -9.249 12.907 638 HB3 ARG 70 HB3 ARG 70 -16.384 -8.711 11.218 639 HG2 ARG 70 HG2 ARG 70 -16.690 -6.358 12.003 640 HG3 ARG 70 HG3 ARG 70 -16.809 -6.933 13.669 641 HD2 ARG 70 HD2 ARG 70 -14.466 -7.870 13.460 642 HD3 ARG 70 HD3 ARG 70 -14.357 -7.121 11.868 643 HE ARG 70 HE ARG 70 -14.107 -4.995 12.875 644 HH11 ARG 70 HH11 ARG 70 -14.906 -7.248 15.530 645 HH12 ARG 70 HH12 ARG 70 -14.378 -6.012 16.672 646 HH21 ARG 70 HH21 ARG 70 -13.713 -3.628 14.409 647 HH22 ARG 70 HH22 ARG 70 -13.795 -4.132 16.127 648 H LEU 71 H LEU 71 -18.830 -9.615 9.873 649 HA LEU 71 HA LEU 71 -19.809 -7.214 8.511 650 HB2 LEU 71 HB2 LEU 71 -19.741 -10.168 7.781 651 HB3 LEU 71 HB3 LEU 71 -20.356 -8.930 6.700 652 HG LEU 71 HG LEU 71 -17.494 -8.919 7.726 653 HD11 LEU 71 HD11 LEU 71 -18.647 -9.931 5.091 654 HD12 LEU 71 HD12 LEU 71 -16.922 -9.801 5.490 655 HD13 LEU 71 HD13 LEU 71 -17.951 -10.943 6.373 656 HD21 LEU 71 HD21 LEU 71 -18.927 -7.422 5.487 657 HD22 LEU 71 HD22 LEU 71 -18.222 -6.711 6.963 658 HD23 LEU 71 HD23 LEU 71 -17.170 -7.441 5.737 659 H GLN 72 H GLN 72 -21.327 -8.936 10.898 660 HA GLN 72 HA GLN 72 -23.415 -9.217 11.626 661 HB2 GLN 72 HB2 GLN 72 -24.176 -6.986 9.712 662 HB3 GLN 72 HB3 GLN 72 -25.093 -7.540 11.112 663 HG2 GLN 72 HG2 GLN 72 -23.212 -6.897 12.614 664 HG3 GLN 72 HG3 GLN 72 -22.328 -6.257 11.223 665 HE21 GLN 72 HE21 GLN 72 -23.933 -3.327 12.759 666 HE22 GLN 72 HE22 GLN 72 -22.635 -4.452 13.140 667 H LEU 73 H LEU 73 -22.615 -10.927 9.350 668 HA LEU 73 HA LEU 73 -25.154 -11.387 7.886 669 HB2 LEU 73 HB2 LEU 73 -22.493 -12.795 7.563 670 HB3 LEU 73 HB3 LEU 73 -23.864 -12.854 6.463 671 HG LEU 73 HG LEU 73 -22.152 -10.414 7.094 672 HD11 LEU 73 HD11 LEU 73 -21.225 -10.651 4.900 673 HD12 LEU 73 HD12 LEU 73 -20.993 -12.165 5.789 674 HD13 LEU 73 HD13 LEU 73 -22.273 -12.045 4.552 675 HD21 LEU 73 HD21 LEU 73 -24.448 -9.728 6.429 676 HD22 LEU 73 HD22 LEU 73 -23.245 -9.326 5.202 677 HD23 LEU 73 HD23 LEU 73 -24.305 -10.731 4.960 678 H ASN 74 H ASN 74 -26.557 -12.221 9.338 679 HA ASN 74 HA ASN 74 -25.995 -14.302 11.248 680 HB2 ASN 74 HB2 ASN 74 -28.610 -13.275 10.049 681 HB3 ASN 74 HB3 ASN 74 -28.523 -14.382 11.413 682 HD21 ASN 74 HD21 ASN 74 -28.823 -10.789 12.585 683 HD22 ASN 74 HD22 ASN 74 -29.674 -11.652 11.317 684 H ALA 75 H ALA 75 -27.168 -16.445 11.295 685 HA ALA 75 HA ALA 75 -26.044 -18.136 9.417 686 HB1 ALA 75 HB1 ALA 75 -27.495 -19.869 10.438 687 HB2 ALA 75 HB2 ALA 75 -26.823 -18.777 11.668 688 HB3 ALA 75 HB3 ALA 75 -28.519 -18.599 11.144 689 H ASN 76 H ASN 76 -29.331 -16.778 9.259 690 HA ASN 76 HA ASN 76 -30.268 -18.359 7.038 691 HB2 ASN 76 HB2 ASN 76 -31.714 -17.245 8.709 692 HB3 ASN 76 HB3 ASN 76 -31.139 -15.663 8.172 693 HD21 ASN 76 HD21 ASN 76 -33.672 -15.484 5.748 694 HD22 ASN 76 HD22 ASN 76 -32.561 -14.652 6.826 695 H GLN 77 H GLN 77 -28.250 -15.468 7.172 696 HA GLN 77 HA GLN 77 -28.742 -14.671 4.390 697 HB2 GLN 77 HB2 GLN 77 -28.364 -12.946 6.031 698 HB3 GLN 77 HB3 GLN 77 -26.860 -13.687 6.567 699 HG2 GLN 77 HG2 GLN 77 -26.453 -11.704 5.215 700 HG3 GLN 77 HG3 GLN 77 -25.736 -13.139 4.496 701 HE21 GLN 77 HE21 GLN 77 -27.336 -12.399 1.423 702 HE22 GLN 77 HE22 GLN 77 -25.938 -13.073 2.257 703 H ALA 78 H ALA 78 -27.625 -15.357 2.633 704 HA ALA 78 HA ALA 78 -25.582 -17.382 2.791 705 HB1 ALA 78 HB1 ALA 78 -27.184 -17.227 0.932 706 HB2 ALA 78 HB2 ALA 78 -26.501 -15.650 0.455 707 HB3 ALA 78 HB3 ALA 78 -25.516 -17.122 0.340 708 H PHE 79 H PHE 79 -23.377 -17.272 2.406 709 HA PHE 79 HA PHE 79 -22.040 -14.767 1.838 710 HB2 PHE 79 HB2 PHE 79 -22.273 -14.267 4.081 711 HB3 PHE 79 HB3 PHE 79 -21.998 -15.910 4.592 712 HD1 PHE 79 HD1 PHE 79 -20.239 -12.918 3.225 713 HD2 PHE 79 HD2 PHE 79 -19.845 -16.726 5.207 714 HE1 PHE 79 HE1 PHE 79 -17.902 -12.346 3.868 715 HE2 PHE 79 HE2 PHE 79 -17.505 -16.161 5.813 716 HZ PHE 79 HZ PHE 79 -16.542 -13.961 5.166 717 H PHE 80 H PHE 80 -20.214 -14.923 0.761 718 HA PHE 80 HA PHE 80 -18.713 -17.473 0.861 719 HB2 PHE 80 HB2 PHE 80 -19.471 -15.882 -1.553 720 HB3 PHE 80 HB3 PHE 80 -18.039 -16.874 -1.525 721 HD1 PHE 80 HD1 PHE 80 -18.136 -19.244 -1.842 722 HD2 PHE 80 HD2 PHE 80 -21.736 -17.010 -1.043 723 HE1 PHE 80 HE1 PHE 80 -19.503 -21.220 -2.463 724 HE2 PHE 80 HE2 PHE 80 -23.103 -18.991 -1.662 725 HZ PHE 80 HZ PHE 80 -21.986 -21.097 -2.371 726 H LEU 81 H LEU 81 -16.767 -17.475 1.529 727 HA LEU 81 HA LEU 81 -15.080 -15.023 1.300 728 HB2 LEU 81 HB2 LEU 81 -15.623 -15.851 3.602 729 HB3 LEU 81 HB3 LEU 81 -14.859 -17.380 3.225 730 HG LEU 81 HG LEU 81 -13.475 -15.949 4.620 731 HD11 LEU 81 HD11 LEU 81 -12.391 -17.500 2.948 732 HD12 LEU 81 HD12 LEU 81 -12.082 -16.066 1.930 733 HD13 LEU 81 HD13 LEU 81 -11.391 -16.168 3.550 734 HD21 LEU 81 HD21 LEU 81 -13.329 -13.960 2.331 735 HD22 LEU 81 HD22 LEU 81 -14.243 -13.753 3.841 736 HD23 LEU 81 HD23 LEU 81 -12.477 -13.876 3.889 737 H LEU 82 H LEU 82 -13.801 -15.159 -0.409 738 HA LEU 82 HA LEU 82 -13.033 -17.827 -1.477 739 HB2 LEU 82 HB2 LEU 82 -13.240 -15.212 -2.966 740 HB3 LEU 82 HB3 LEU 82 -13.139 -16.825 -3.638 741 HG LEU 82 HG LEU 82 -15.535 -15.655 -2.139 742 HD11 LEU 82 HD11 LEU 82 -15.102 -16.281 -5.091 743 HD12 LEU 82 HD12 LEU 82 -16.591 -15.661 -4.345 744 HD13 LEU 82 HD13 LEU 82 -15.145 -14.658 -4.360 745 HD21 LEU 82 HD21 LEU 82 -15.519 -18.045 -1.798 746 HD22 LEU 82 HD22 LEU 82 -16.684 -17.702 -3.068 747 HD23 LEU 82 HD23 LEU 82 -15.097 -18.347 -3.514 748 H VAL 83 H VAL 83 -10.906 -18.280 -0.817 749 HA VAL 83 HA VAL 83 -8.877 -16.139 -0.634 750 HB VAL 83 HB VAL 83 -8.672 -19.159 -0.426 751 HG11 VAL 83 HG11 VAL 83 -6.330 -18.739 0.350 752 HG12 VAL 83 HG12 VAL 83 -6.554 -18.396 -1.365 753 HG13 VAL 83 HG13 VAL 83 -6.480 -17.052 -0.203 754 HG21 VAL 83 HG21 VAL 83 -8.109 -18.626 1.938 755 HG22 VAL 83 HG22 VAL 83 -8.272 -16.898 1.582 756 HG23 VAL 83 HG23 VAL 83 -9.697 -17.951 1.524 757 H ASN 84 H ASN 84 -7.903 -15.308 -2.358 758 HA ASN 84 HA ASN 84 -7.585 -14.827 -4.568 759 HB2 ASN 84 HB2 ASN 84 -6.333 -17.590 -4.397 760 HB3 ASN 84 HB3 ASN 84 -6.028 -16.437 -5.694 761 HD21 ASN 84 HD21 ASN 84 -3.464 -16.161 -2.885 762 HD22 ASN 84 HD22 ASN 84 -4.135 -17.581 -3.682 763 H GLY 85 H GLY 85 -10.246 -15.692 -4.174 764 HA2 GLY 85 HA2 GLY 85 -12.040 -15.821 -5.679 765 HA3 GLY 85 HA3 GLY 85 -10.974 -16.418 -6.935 766 H HIS 86 H HIS 86 -10.158 -18.558 -4.615 767 HA HIS 86 HA HIS 86 -12.274 -20.526 -5.369 768 HB2 HIS 86 HB2 HIS 86 -9.946 -21.230 -5.638 769 HB3 HIS 86 HB3 HIS 86 -9.594 -20.825 -3.957 770 HD1 HIS 86 HD1 HIS 86 -9.600 -22.954 -2.457 771 HD2 HIS 86 HD2 HIS 86 -12.332 -23.083 -5.683 772 HE1 HIS 86 HE1 HIS 86 -10.845 -25.202 -2.269 773 HE2 HIS 86 HE2 HIS 86 -12.495 -25.278 -4.249 774 H SER 87 H SER 87 -13.829 -21.268 -3.951 775 HA SER 87 HA SER 87 -14.314 -19.802 -1.543 776 HB2 SER 87 HB2 SER 87 -16.126 -20.848 -2.801 777 HB3 SER 87 HB3 SER 87 -15.493 -22.460 -2.388 778 HG SER 87 HG SER 87 -17.113 -21.856 -0.895 779 H MET 88 H MET 88 -13.754 -19.973 0.464 780 HA MET 88 HA MET 88 -12.216 -22.374 1.377 781 HB2 MET 88 HB2 MET 88 -11.546 -19.586 1.326 782 HB3 MET 88 HB3 MET 88 -11.772 -20.012 3.015 783 HG2 MET 88 HG2 MET 88 -9.478 -20.365 2.434 784 HG3 MET 88 HG3 MET 88 -10.212 -21.927 2.728 785 HE1 MET 88 HE1 MET 88 -7.370 -21.258 1.207 786 HE2 MET 88 HE2 MET 88 -7.933 -22.893 1.627 787 HE3 MET 88 HE3 MET 88 -7.413 -22.532 -0.032 788 H VAL 89 H VAL 89 -15.279 -21.425 1.647 789 HA VAL 89 HA VAL 89 -15.780 -20.862 4.349 790 HB VAL 89 HB VAL 89 -17.649 -22.239 2.407 791 HG11 VAL 89 HG11 VAL 89 -18.231 -20.591 4.913 792 HG12 VAL 89 HG12 VAL 89 -19.439 -21.136 3.732 793 HG13 VAL 89 HG13 VAL 89 -18.570 -22.327 4.691 794 HG21 VAL 89 HG21 VAL 89 -17.187 -19.274 3.003 795 HG22 VAL 89 HG22 VAL 89 -16.782 -20.104 1.478 796 HG23 VAL 89 HG23 VAL 89 -18.468 -19.932 1.957 797 H SER 90 H SER 90 -15.421 -24.083 2.887 798 HA SER 90 HA SER 90 -16.140 -25.486 5.371 799 HB2 SER 90 HB2 SER 90 -15.762 -27.499 3.976 800 HB3 SER 90 HB3 SER 90 -16.898 -26.354 3.241 801 HG SER 90 HG SER 90 -15.311 -27.127 1.732 802 H VAL 91 H VAL 91 -13.256 -24.011 4.444 803 HA VAL 91 HA VAL 91 -11.439 -26.260 4.940 804 HB VAL 91 HB VAL 91 -10.891 -23.338 4.349 805 HG11 VAL 91 HG11 VAL 91 -8.930 -24.285 5.460 806 HG12 VAL 91 HG12 VAL 91 -8.990 -25.712 4.395 807 HG13 VAL 91 HG13 VAL 91 -8.609 -24.108 3.737 808 HG21 VAL 91 HG21 VAL 91 -12.007 -24.526 2.476 809 HG22 VAL 91 HG22 VAL 91 -10.312 -24.204 2.086 810 HG23 VAL 91 HG23 VAL 91 -10.811 -25.829 2.588 811 H SER 92 H SER 92 -10.717 -26.896 6.847 812 HA SER 92 HA SER 92 -11.013 -25.274 9.272 813 HB2 SER 92 HB2 SER 92 -11.546 -27.674 9.185 814 HB3 SER 92 HB3 SER 92 -9.860 -28.052 8.801 815 HG SER 92 HG SER 92 -10.384 -28.292 11.052 816 H THR 93 H THR 93 -8.353 -26.034 7.097 817 HA THR 93 HA THR 93 -6.158 -26.150 8.516 818 HB THR 93 HB THR 93 -6.091 -24.427 6.073 819 HG1 THR 93 HG1 THR 93 -6.267 -26.391 4.900 820 HG21 THR 93 HG21 THR 93 -4.137 -25.836 5.515 821 HG22 THR 93 HG22 THR 93 -3.916 -24.986 7.044 822 HG23 THR 93 HG23 THR 93 -4.326 -26.719 7.043 823 HA PRO 94 HA PRO 94 -5.194 -22.480 10.862 824 HB2 PRO 94 HB2 PRO 94 -2.339 -23.287 10.288 825 HB3 PRO 94 HB3 PRO 94 -3.059 -22.723 11.826 826 HG2 PRO 94 HG2 PRO 94 -2.666 -25.363 11.440 827 HG3 PRO 94 HG3 PRO 94 -4.234 -24.804 12.118 828 HD2 PRO 94 HD2 PRO 94 -3.584 -25.574 9.263 829 HD3 PRO 94 HD3 PRO 94 -4.994 -26.028 10.269 830 H ILE 95 H ILE 95 -4.791 -20.333 10.472 831 HA ILE 95 HA ILE 95 -4.845 -19.504 7.800 832 HB ILE 95 HB ILE 95 -5.807 -18.290 9.739 833 HG12 ILE 95 HG12 ILE 95 -5.354 -15.991 9.043 834 HG13 ILE 95 HG13 ILE 95 -3.927 -16.487 8.138 835 HG21 ILE 95 HG21 ILE 95 -3.824 -18.448 11.301 836 HG22 ILE 95 HG22 ILE 95 -2.976 -17.252 10.293 837 HG23 ILE 95 HG23 ILE 95 -4.455 -16.815 11.143 838 HD11 ILE 95 HD11 ILE 95 -6.754 -17.476 7.538 839 HD12 ILE 95 HD12 ILE 95 -5.978 -16.084 6.751 840 HD13 ILE 95 HD13 ILE 95 -5.299 -17.705 6.532 841 H SER 96 H SER 96 -1.992 -19.878 9.841 842 HA SER 96 HA SER 96 -0.099 -18.449 8.214 843 HB2 SER 96 HB2 SER 96 1.545 -19.930 9.428 844 HB3 SER 96 HB3 SER 96 0.448 -19.014 10.479 845 HG SER 96 HG SER 96 0.656 -21.307 11.028 846 H GLU 97 H GLU 97 -1.134 -21.895 8.237 847 HA GLU 97 HA GLU 97 0.591 -22.694 6.062 848 HB2 GLU 97 HB2 GLU 97 -1.992 -23.893 7.125 849 HB3 GLU 97 HB3 GLU 97 -0.934 -24.695 5.973 850 HG2 GLU 97 HG2 GLU 97 -0.181 -23.889 8.824 851 HG3 GLU 97 HG3 GLU 97 -0.680 -25.494 8.313 852 H VAL 98 H VAL 98 -2.806 -21.549 6.150 853 HA VAL 98 HA VAL 98 -3.235 -21.720 3.300 854 HB VAL 98 HB VAL 98 -4.493 -19.734 5.225 855 HG11 VAL 98 HG11 VAL 98 -5.400 -20.764 2.501 856 HG12 VAL 98 HG12 VAL 98 -6.335 -19.684 3.570 857 HG13 VAL 98 HG13 VAL 98 -4.826 -19.122 2.845 858 HG21 VAL 98 HG21 VAL 98 -4.949 -22.035 5.995 859 HG22 VAL 98 HG22 VAL 98 -6.399 -21.334 5.271 860 HG23 VAL 98 HG23 VAL 98 -5.429 -22.503 4.348 861 H TYR 99 H TYR 99 -1.917 -19.047 5.324 862 HA TYR 99 HA TYR 99 -1.310 -17.320 3.168 863 HB2 TYR 99 HB2 TYR 99 -1.302 -16.253 5.139 864 HB3 TYR 99 HB3 TYR 99 -0.467 -17.539 5.978 865 HD1 TYR 99 HD1 TYR 99 0.059 -14.554 3.827 866 HD2 TYR 99 HD2 TYR 99 1.891 -17.695 6.153 867 HE1 TYR 99 HE1 TYR 99 2.206 -13.297 3.851 868 HE2 TYR 99 HE2 TYR 99 4.021 -16.425 6.189 869 HH TYR 99 HH TYR 99 4.417 -13.255 4.570 870 H GLU 100 H GLU 100 0.953 -19.748 4.558 871 HA GLU 100 HA GLU 100 3.030 -19.224 2.687 872 HB2 GLU 100 HB2 GLU 100 2.224 -21.749 4.168 873 HB3 GLU 100 HB3 GLU 100 3.677 -21.656 3.188 874 HG2 GLU 100 HG2 GLU 100 3.086 -19.838 5.563 875 HG3 GLU 100 HG3 GLU 100 4.032 -21.315 5.643 876 H SER 101 H SER 101 0.050 -21.042 2.204 877 HA SER 101 HA SER 101 0.905 -22.185 -0.370 878 HB2 SER 101 HB2 SER 101 -0.536 -23.393 1.222 879 HB3 SER 101 HB3 SER 101 -1.788 -22.151 1.026 880 HG SER 101 HG SER 101 -2.063 -24.055 -0.326 881 H GLU 102 H GLU 102 -1.183 -19.477 0.688 882 HA GLU 102 HA GLU 102 -1.731 -18.771 -2.171 883 HB2 GLU 102 HB2 GLU 102 -3.522 -18.748 0.265 884 HB3 GLU 102 HB3 GLU 102 -3.987 -18.024 -1.257 885 HG2 GLU 102 HG2 GLU 102 -3.290 -20.969 -0.869 886 HG3 GLU 102 HG3 GLU 102 -4.905 -20.300 -0.878 887 H LYS 103 H LYS 103 0.194 -17.462 0.065 888 HA LYS 103 HA LYS 103 -0.374 -14.694 0.106 889 HB2 LYS 103 HB2 LYS 103 1.405 -15.643 1.384 890 HB3 LYS 103 HB3 LYS 103 2.160 -16.360 -0.046 891 HG2 LYS 103 HG2 LYS 103 2.793 -14.078 -0.826 892 HG3 LYS 103 HG3 LYS 103 2.004 -13.400 0.602 893 HD2 LYS 103 HD2 LYS 103 4.380 -13.530 1.066 894 HD3 LYS 103 HD3 LYS 103 3.543 -14.732 2.047 895 HE2 LYS 103 HE2 LYS 103 5.584 -15.696 1.246 896 HE3 LYS 103 HE3 LYS 103 4.233 -16.532 0.497 897 HZ1 LYS 103 HZ1 LYS 103 4.651 -15.241 -1.555 898 HZ2 LYS 103 HZ2 LYS 103 5.879 -14.422 -0.830 899 HZ3 LYS 103 HZ3 LYS 103 6.008 -16.019 -1.104 900 H ASP 104 H ASP 104 -0.495 -13.135 -1.395 901 HA ASP 104 HA ASP 104 0.145 -13.689 -4.225 902 HB2 ASP 104 HB2 ASP 104 -1.981 -12.600 -3.378 903 HB3 ASP 104 HB3 ASP 104 -1.010 -11.203 -2.909 904 H GLU 105 H GLU 105 1.206 -11.730 -5.403 905 HA GLU 105 HA GLU 105 3.938 -11.747 -4.741 906 HB2 GLU 105 HB2 GLU 105 2.402 -9.821 -6.533 907 HB3 GLU 105 HB3 GLU 105 4.148 -9.998 -6.534 908 HG2 GLU 105 HG2 GLU 105 2.161 -12.202 -7.245 909 HG3 GLU 105 HG3 GLU 105 3.034 -11.202 -8.391 910 H ASP 106 H ASP 106 1.565 -9.360 -3.705 911 HA ASP 106 HA ASP 106 3.584 -7.437 -2.785 912 HB2 ASP 106 HB2 ASP 106 1.658 -6.200 -1.867 913 HB3 ASP 106 HB3 ASP 106 1.535 -6.545 -3.581 914 H GLY 107 H GLY 107 2.689 -10.386 -1.603 915 HA2 GLY 107 HA2 GLY 107 3.480 -11.404 0.324 916 HA3 GLY 107 HA3 GLY 107 3.738 -9.843 1.094 917 H PHE 108 H PHE 108 0.587 -9.691 -0.083 918 HA PHE 108 HA PHE 108 -0.517 -10.547 2.518 919 HB2 PHE 108 HB2 PHE 108 -1.567 -8.731 0.390 920 HB3 PHE 108 HB3 PHE 108 -2.648 -9.460 1.549 921 HD1 PHE 108 HD1 PHE 108 -2.760 -8.758 3.824 922 HD2 PHE 108 HD2 PHE 108 0.248 -7.147 1.197 923 HE1 PHE 108 HE1 PHE 108 -2.265 -6.995 5.497 924 HE2 PHE 108 HE2 PHE 108 0.711 -5.340 2.855 925 HZ PHE 108 HZ PHE 108 -0.510 -5.290 5.011 926 H LEU 109 H LEU 109 -2.159 -11.984 2.942 927 HA LEU 109 HA LEU 109 -2.814 -13.930 0.807 928 HB2 LEU 109 HB2 LEU 109 -2.323 -14.782 3.027 929 HB3 LEU 109 HB3 LEU 109 -3.525 -13.713 3.745 930 HG LEU 109 HG LEU 109 -5.347 -14.930 2.588 931 HD11 LEU 109 HD11 LEU 109 -4.175 -15.792 0.611 932 HD12 LEU 109 HD12 LEU 109 -3.095 -16.754 1.646 933 HD13 LEU 109 HD13 LEU 109 -4.825 -17.134 1.557 934 HD21 LEU 109 HD21 LEU 109 -5.242 -16.952 3.939 935 HD22 LEU 109 HD22 LEU 109 -3.485 -16.782 4.131 936 HD23 LEU 109 HD23 LEU 109 -4.573 -15.595 4.864 937 H TYR 110 H TYR 110 -4.221 -13.107 -0.696 938 HA TYR 110 HA TYR 110 -6.322 -11.274 0.083 939 HB2 TYR 110 HB2 TYR 110 -5.289 -12.202 -2.523 940 HB3 TYR 110 HB3 TYR 110 -6.959 -11.666 -2.462 941 HD1 TYR 110 HD1 TYR 110 -7.482 -9.406 -2.631 942 HD2 TYR 110 HD2 TYR 110 -3.497 -10.554 -1.424 943 HE1 TYR 110 HE1 TYR 110 -6.759 -7.040 -2.780 944 HE2 TYR 110 HE2 TYR 110 -2.790 -8.175 -1.549 945 HH TYR 110 HH TYR 110 -4.963 -5.591 -2.728 946 H MET 111 H MET 111 -8.384 -11.389 0.334 947 HA MET 111 HA MET 111 -9.812 -13.965 -0.177 948 HB2 MET 111 HB2 MET 111 -10.194 -12.162 2.249 949 HB3 MET 111 HB3 MET 111 -10.962 -13.720 1.912 950 HG2 MET 111 HG2 MET 111 -8.622 -14.728 1.942 951 HG3 MET 111 HG3 MET 111 -8.053 -13.193 2.610 952 HE1 MET 111 HE1 MET 111 -7.823 -16.267 3.697 953 HE2 MET 111 HE2 MET 111 -6.957 -14.883 4.400 954 HE3 MET 111 HE3 MET 111 -7.913 -15.952 5.433 955 H VAL 112 H VAL 112 -11.383 -13.618 -1.662 956 HA VAL 112 HA VAL 112 -12.587 -10.932 -1.895 957 HB VAL 112 HB VAL 112 -13.287 -13.188 -3.735 958 HG11 VAL 112 HG11 VAL 112 -13.775 -11.333 -5.279 959 HG12 VAL 112 HG12 VAL 112 -14.752 -11.203 -3.812 960 HG13 VAL 112 HG13 VAL 112 -13.329 -10.156 -4.029 961 HG21 VAL 112 HG21 VAL 112 -11.590 -12.285 -5.298 962 HG22 VAL 112 HG22 VAL 112 -10.960 -11.253 -3.996 963 HG23 VAL 112 HG23 VAL 112 -10.858 -13.028 -3.875 964 H TYR 113 H TYR 113 -14.579 -10.385 -1.367 965 HA TYR 113 HA TYR 113 -16.265 -12.361 0.049 966 HB2 TYR 113 HB2 TYR 113 -15.614 -11.078 1.710 967 HB3 TYR 113 HB3 TYR 113 -15.384 -9.659 0.720 968 HD1 TYR 113 HD1 TYR 113 -18.474 -11.729 1.561 969 HD2 TYR 113 HD2 TYR 113 -16.475 -7.895 1.634 970 HE1 TYR 113 HE1 TYR 113 -20.462 -10.673 2.645 971 HE2 TYR 113 HE2 TYR 113 -18.454 -6.893 2.719 972 HH TYR 113 HH TYR 113 -20.676 -7.181 3.335 973 H ALA 114 H ALA 114 -18.140 -12.996 -0.674 974 HA ALA 114 HA ALA 114 -19.717 -11.230 -2.479 975 HB1 ALA 114 HB1 ALA 114 -19.511 -12.891 -4.314 976 HB2 ALA 114 HB2 ALA 114 -17.911 -12.308 -3.843 977 HB3 ALA 114 HB3 ALA 114 -18.453 -13.895 -3.292 978 H SER 115 H SER 115 -21.689 -12.464 -3.357 979 HA SER 115 HA SER 115 -22.972 -14.091 -1.215 980 HB2 SER 115 HB2 SER 115 -24.049 -12.078 -2.476 981 HB3 SER 115 HB3 SER 115 -24.224 -13.215 -3.827 982 HG SER 115 HG SER 115 -26.093 -13.280 -2.526 983 H GLN 116 H GLN 116 -21.029 -14.691 -3.855 984 HA GLN 116 HA GLN 116 -21.947 -17.453 -4.322 985 HB2 GLN 116 HB2 GLN 116 -22.406 -17.125 -6.590 986 HB3 GLN 116 HB3 GLN 116 -23.174 -15.732 -5.847 987 HG2 GLN 116 HG2 GLN 116 -20.529 -15.754 -7.338 988 HG3 GLN 116 HG3 GLN 116 -22.058 -15.185 -7.957 989 HE21 GLN 116 HE21 GLN 116 -20.013 -12.245 -6.908 990 HE22 GLN 116 HE22 GLN 116 -19.602 -13.694 -7.836 991 H GLU 117 H GLU 117 -20.289 -18.729 -5.541 992 HA GLU 117 HA GLU 117 -17.563 -17.812 -4.998 993 HB2 GLU 117 HB2 GLU 117 -18.146 -20.112 -4.634 994 HB3 GLU 117 HB3 GLU 117 -18.610 -20.324 -6.332 995 HG2 GLU 117 HG2 GLU 117 -16.359 -20.090 -7.088 996 HG3 GLU 117 HG3 GLU 117 -15.812 -19.465 -5.522 997 H THR 118 H THR 118 -19.559 -17.955 -7.916 998 HA THR 118 HA THR 118 -17.317 -17.615 -9.677 999 HB THR 118 HB THR 118 -18.638 -17.803 -11.484 1000 HG1 THR 118 HG1 THR 118 -20.853 -17.324 -11.493 1001 HG21 THR 118 HG21 THR 118 -20.409 -19.191 -9.426 1002 HG22 THR 118 HG22 THR 118 -20.153 -19.632 -11.126 1003 HG23 THR 118 HG23 THR 118 -18.831 -19.822 -9.958 1004 H PHE 119 H PHE 119 -16.876 -15.991 -11.228 1005 HA PHE 119 HA PHE 119 -17.518 -13.261 -10.337 1006 HB2 PHE 119 HB2 PHE 119 -15.038 -12.689 -10.533 1007 HB3 PHE 119 HB3 PHE 119 -15.672 -13.493 -9.120 1008 HD1 PHE 119 HD1 PHE 119 -13.793 -14.106 -12.285 1009 HD2 PHE 119 HD2 PHE 119 -14.879 -15.623 -8.399 1010 HE1 PHE 119 HE1 PHE 119 -12.143 -15.949 -12.541 1011 HE2 PHE 119 HE2 PHE 119 -13.237 -17.468 -8.661 1012 HZ PHE 119 HZ PHE 119 -11.868 -17.637 -10.729 1013 H GLY 120 H GLY 120 -18.507 -14.603 -12.632 1014 HA2 GLY 120 HA2 GLY 120 -19.197 -13.913 -14.760 1015 HA3 GLY 120 HA3 GLY 120 -18.145 -12.508 -14.647 1016 H1 ASP 10 H1 ASP 10 -6.651 0.449 22.000 1017 H2 ASP 10 H2 ASP 10 -7.580 1.426 21.062 1018 H3 ASP 10 H3 ASP 10 -8.224 0.071 21.735 1019 HA ASP 10 HA ASP 10 -6.071 0.073 19.753 1020 HB2 ASP 10 HB2 ASP 10 -6.621 -2.391 19.492 1021 HB3 ASP 10 HB3 ASP 10 -5.734 -1.868 20.909 1022 H TYR 11 H TYR 11 -6.595 -0.920 17.639 1023 HA TYR 11 HA TYR 11 -9.317 -0.430 16.713 1024 HB2 TYR 11 HB2 TYR 11 -8.369 1.056 14.799 1025 HB3 TYR 11 HB3 TYR 11 -8.823 1.695 16.358 1026 HD1 TYR 11 HD1 TYR 11 -7.284 2.851 17.732 1027 HD2 TYR 11 HD2 TYR 11 -5.873 0.631 14.312 1028 HE1 TYR 11 HE1 TYR 11 -5.026 3.868 18.004 1029 HE2 TYR 11 HE2 TYR 11 -3.610 1.673 14.586 1030 HH TYR 11 HH TYR 11 -2.244 2.936 16.013 1031 H GLU 12 H GLU 12 -9.860 -0.835 14.540 1032 HA GLU 12 HA GLU 12 -8.866 -3.472 13.768 1033 HB2 GLU 12 HB2 GLU 12 -10.822 -3.517 12.259 1034 HB3 GLU 12 HB3 GLU 12 -11.168 -3.330 13.982 1035 HG2 GLU 12 HG2 GLU 12 -11.628 -0.927 13.647 1036 HG3 GLU 12 HG3 GLU 12 -11.219 -1.074 11.932 1037 H SER 13 H SER 13 -9.938 -2.416 10.868 1038 HA SER 13 HA SER 13 -7.497 -2.788 9.576 1039 HB2 SER 13 HB2 SER 13 -10.079 -1.628 8.491 1040 HB3 SER 13 HB3 SER 13 -8.773 -2.342 7.538 1041 HG SER 13 HG SER 13 -9.161 -4.325 8.552 1042 H ASP 14 H ASP 14 -6.522 -0.795 11.001 1043 HA ASP 14 HA ASP 14 -6.080 1.407 9.056 1044 HB2 ASP 14 HB2 ASP 14 -5.833 1.407 12.032 1045 HB3 ASP 14 HB3 ASP 14 -5.005 2.608 11.040 1046 H ASP 15 H ASP 15 -3.463 1.408 11.120 1047 HA ASP 15 HA ASP 15 -1.705 -0.244 9.477 1048 HB2 ASP 15 HB2 ASP 15 -1.580 2.775 9.452 1049 HB3 ASP 15 HB3 ASP 15 -0.140 1.816 9.203 1050 H ASP 16 H ASP 16 0.540 -0.313 10.214 1051 HA ASP 16 HA ASP 16 2.084 -0.731 11.727 1052 HB2 ASP 16 HB2 ASP 16 1.372 2.105 12.391 1053 HB3 ASP 16 HB3 ASP 16 2.733 1.277 13.140 1054 H SER 17 H SER 17 0.367 1.036 14.259 1055 HA SER 17 HA SER 17 1.276 -0.988 16.177 1056 HB2 SER 17 HB2 SER 17 0.605 0.729 17.839 1057 HB3 SER 17 HB3 SER 17 1.727 1.343 16.614 1058 HG SER 17 HG SER 17 -0.025 2.792 16.966 1059 H TYR 18 H TYR 18 -1.501 -0.674 14.433 1060 HA TYR 18 HA TYR 18 -3.651 -1.142 16.139 1061 HB2 TYR 18 HB2 TYR 18 -4.755 -2.039 14.106 1062 HB3 TYR 18 HB3 TYR 18 -3.956 -0.502 13.906 1063 HD1 TYR 18 HD1 TYR 18 -1.208 -2.768 13.656 1064 HD2 TYR 18 HD2 TYR 18 -4.801 -1.521 11.640 1065 HE1 TYR 18 HE1 TYR 18 -0.267 -3.541 11.550 1066 HE2 TYR 18 HE2 TYR 18 -3.903 -2.478 9.504 1067 HH TYR 18 HH TYR 18 -0.656 -3.970 9.318 1068 H GLU 19 H GLU 19 -5.075 -2.960 16.448 1069 HA GLU 19 HA GLU 19 -3.695 -5.611 16.643 1070 HB2 GLU 19 HB2 GLU 19 -6.220 -4.590 17.972 1071 HB3 GLU 19 HB3 GLU 19 -5.663 -6.255 18.065 1072 HG2 GLU 19 HG2 GLU 19 -4.143 -3.823 19.084 1073 HG3 GLU 19 HG3 GLU 19 -5.061 -4.950 20.061 1074 H VAL 20 H VAL 20 -6.090 -3.943 14.826 1075 HA VAL 20 HA VAL 20 -7.117 -4.334 13.003 1076 HB VAL 20 HB VAL 20 -5.759 -6.743 12.026 1077 HG11 VAL 20 HG11 VAL 20 -7.251 -5.245 10.660 1078 HG12 VAL 20 HG12 VAL 20 -6.124 -3.906 10.973 1079 HG13 VAL 20 HG13 VAL 20 -5.577 -5.290 10.041 1080 HG21 VAL 20 HG21 VAL 20 -3.718 -5.275 11.511 1081 HG22 VAL 20 HG22 VAL 20 -4.271 -4.250 12.831 1082 HG23 VAL 20 HG23 VAL 20 -3.840 -5.928 13.162 1083 H LEU 21 H LEU 21 -6.921 -7.616 14.337 1084 HA LEU 21 HA LEU 21 -9.503 -8.374 13.139 1085 HB2 LEU 21 HB2 LEU 21 -7.406 -9.841 13.601 1086 HB3 LEU 21 HB3 LEU 21 -7.904 -9.807 15.288 1087 HG LEU 21 HG LEU 21 -10.105 -10.883 14.570 1088 HD11 LEU 21 HD11 LEU 21 -8.624 -11.113 11.902 1089 HD12 LEU 21 HD12 LEU 21 -10.091 -12.012 12.334 1090 HD13 LEU 21 HD13 LEU 21 -10.155 -10.256 12.179 1091 HD21 LEU 21 HD21 LEU 21 -9.082 -13.108 14.217 1092 HD22 LEU 21 HD22 LEU 21 -7.515 -12.324 13.884 1093 HD23 LEU 21 HD23 LEU 21 -8.254 -12.196 15.488 1094 H ASP 22 H ASP 22 -8.636 -6.469 15.760 1095 HA ASP 22 HA ASP 22 -9.414 -5.995 17.808 1096 HB2 ASP 22 HB2 ASP 22 -10.768 -4.648 16.417 1097 HB3 ASP 22 HB3 ASP 22 -11.873 -5.968 16.110 1098 H LEU 23 H LEU 23 -8.711 -8.496 17.958 1099 HA LEU 23 HA LEU 23 -10.513 -9.764 19.916 1100 HB2 LEU 23 HB2 LEU 23 -11.413 -10.588 17.818 1101 HB3 LEU 23 HB3 LEU 23 -9.801 -10.943 17.210 1102 HG LEU 23 HG LEU 23 -9.539 -12.754 18.892 1103 HD11 LEU 23 HD11 LEU 23 -12.454 -12.121 19.566 1104 HD12 LEU 23 HD12 LEU 23 -11.555 -13.556 20.105 1105 HD13 LEU 23 HD13 LEU 23 -11.068 -11.957 20.667 1106 HD21 LEU 23 HD21 LEU 23 -12.076 -12.974 17.221 1107 HD22 LEU 23 HD22 LEU 23 -10.420 -13.223 16.626 1108 HD23 LEU 23 HD23 LEU 23 -11.092 -14.319 17.839 1109 H THR 24 H THR 24 -9.226 -10.319 21.571 1110 HA THR 24 HA THR 24 -6.415 -10.754 21.351 1111 HB THR 24 HB THR 24 -7.891 -11.634 23.786 1112 HG1 THR 24 HG1 THR 24 -8.062 -9.505 24.453 1113 HG21 THR 24 HG21 THR 24 -5.437 -11.771 23.811 1114 HG22 THR 24 HG22 THR 24 -5.321 -10.056 23.347 1115 HG23 THR 24 HG23 THR 24 -5.997 -10.522 24.925 1116 H GLU 25 H GLU 25 -5.087 -12.538 21.518 1117 HA GLU 25 HA GLU 25 -6.215 -15.180 22.014 1118 HB2 GLU 25 HB2 GLU 25 -6.621 -14.997 19.613 1119 HB3 GLU 25 HB3 GLU 25 -4.977 -14.433 19.349 1120 HG2 GLU 25 HG2 GLU 25 -5.186 -16.670 18.554 1121 HG3 GLU 25 HG3 GLU 25 -4.082 -16.645 19.912 1122 H TYR 26 H TYR 26 -4.750 -16.657 22.773 1123 HA TYR 26 HA TYR 26 -1.915 -15.911 22.985 1124 HB2 TYR 26 HB2 TYR 26 -3.709 -16.380 25.331 1125 HB3 TYR 26 HB3 TYR 26 -1.984 -16.671 25.412 1126 HD1 TYR 26 HD1 TYR 26 -4.512 -14.166 25.720 1127 HD2 TYR 26 HD2 TYR 26 -0.361 -14.778 24.719 1128 HE1 TYR 26 HE1 TYR 26 -4.040 -11.774 26.230 1129 HE2 TYR 26 HE2 TYR 26 0.112 -12.374 25.209 1130 HH TYR 26 HH TYR 26 -2.449 -10.115 26.315 Start of MODEL 12 1 H1 MET 1 H1 MET 1 -6.744 2.578 7.235 2 H2 MET 1 H2 MET 1 -7.382 1.682 8.421 3 H3 MET 1 H3 MET 1 -7.400 1.120 6.864 4 HA MET 1 HA MET 1 -8.967 3.339 8.047 5 HB2 MET 1 HB2 MET 1 -8.016 4.179 5.961 6 HB3 MET 1 HB3 MET 1 -8.585 2.765 5.080 7 HG2 MET 1 HG2 MET 1 -10.009 4.704 4.659 8 HG3 MET 1 HG3 MET 1 -10.912 3.411 5.421 9 HE1 MET 1 HE1 MET 1 -8.524 6.325 6.951 10 HE2 MET 1 HE2 MET 1 -9.527 7.053 5.669 11 HE3 MET 1 HE3 MET 1 -9.803 7.482 7.367 12 HA PRO 2 HA PRO 2 -11.706 -0.389 8.011 13 HB2 PRO 2 HB2 PRO 2 -12.943 -0.021 10.427 14 HB3 PRO 2 HB3 PRO 2 -11.319 -0.742 10.299 15 HG2 PRO 2 HG2 PRO 2 -12.022 2.161 10.882 16 HG3 PRO 2 HG3 PRO 2 -10.904 1.080 11.768 17 HD2 PRO 2 HD2 PRO 2 -10.030 2.851 9.887 18 HD3 PRO 2 HD3 PRO 2 -9.273 1.238 10.105 19 H SER 3 H SER 3 -12.734 0.621 6.189 20 HA SER 3 HA SER 3 -15.253 2.096 6.772 21 HB2 SER 3 HB2 SER 3 -13.438 3.778 6.473 22 HB3 SER 3 HB3 SER 3 -13.119 3.115 4.858 23 HG SER 3 HG SER 3 -14.573 5.013 4.991 24 H GLU 4 H GLU 4 -16.376 2.555 4.571 25 HA GLU 4 HA GLU 4 -17.077 0.083 3.264 26 HB2 GLU 4 HB2 GLU 4 -18.651 1.866 3.529 27 HB3 GLU 4 HB3 GLU 4 -17.635 3.025 2.694 28 HG2 GLU 4 HG2 GLU 4 -18.564 0.561 1.211 29 HG3 GLU 4 HG3 GLU 4 -19.742 1.809 1.570 30 H LYS 5 H LYS 5 -14.833 2.674 2.419 31 HA LYS 5 HA LYS 5 -14.316 1.592 -0.269 32 HB2 LYS 5 HB2 LYS 5 -13.101 3.973 1.198 33 HB3 LYS 5 HB3 LYS 5 -12.737 3.511 -0.478 34 HG2 LYS 5 HG2 LYS 5 -15.140 3.696 -1.061 35 HG3 LYS 5 HG3 LYS 5 -15.494 4.186 0.609 36 HD2 LYS 5 HD2 LYS 5 -14.257 6.253 0.357 37 HD3 LYS 5 HD3 LYS 5 -13.695 5.764 -1.250 38 HE2 LYS 5 HE2 LYS 5 -15.556 7.361 -1.416 39 HE3 LYS 5 HE3 LYS 5 -15.958 5.806 -2.147 40 HZ1 LYS 5 HZ1 LYS 5 -17.783 6.674 -0.778 41 HZ2 LYS 5 HZ2 LYS 5 -17.271 5.247 -0.158 42 HZ3 LYS 5 HZ3 LYS 5 -16.854 6.670 0.563 43 H THR 6 H THR 6 -12.344 0.874 -1.069 44 HA THR 6 HA THR 6 -10.912 -0.891 0.694 45 HB THR 6 HB THR 6 -9.892 -1.854 -1.043 46 HG1 THR 6 HG1 THR 6 -9.394 -0.691 -2.991 47 HG21 THR 6 HG21 THR 6 -11.294 -1.996 -2.990 48 HG22 THR 6 HG22 THR 6 -12.361 -1.823 -1.589 49 HG23 THR 6 HG23 THR 6 -12.049 -0.430 -2.659 50 H PHE 7 H PHE 7 -8.440 -1.030 0.738 51 HA PHE 7 HA PHE 7 -7.363 1.318 2.006 52 HB2 PHE 7 HB2 PHE 7 -5.227 0.107 1.957 53 HB3 PHE 7 HB3 PHE 7 -6.534 -0.923 2.506 54 HD1 PHE 7 HD1 PHE 7 -7.150 -2.935 1.293 55 HD2 PHE 7 HD2 PHE 7 -4.300 -0.153 -0.391 56 HE1 PHE 7 HE1 PHE 7 -6.714 -4.501 -0.579 57 HE2 PHE 7 HE2 PHE 7 -3.844 -1.745 -2.234 58 HZ PHE 7 HZ PHE 7 -5.079 -3.896 -2.359 59 H LYS 8 H LYS 8 -7.680 0.585 -1.430 60 HA LYS 8 HA LYS 8 -5.251 1.839 -2.298 61 HB2 LYS 8 HB2 LYS 8 -6.484 0.167 -3.597 62 HB3 LYS 8 HB3 LYS 8 -7.831 1.287 -3.802 63 HG2 LYS 8 HG2 LYS 8 -6.443 1.105 -5.816 64 HG3 LYS 8 HG3 LYS 8 -6.501 2.750 -5.194 65 HD2 LYS 8 HD2 LYS 8 -4.219 2.458 -4.205 66 HD3 LYS 8 HD3 LYS 8 -4.214 0.776 -4.732 67 HE2 LYS 8 HE2 LYS 8 -2.849 2.167 -6.198 68 HE3 LYS 8 HE3 LYS 8 -4.207 1.463 -7.078 69 HZ1 LYS 8 HZ1 LYS 8 -3.849 3.842 -7.595 70 HZ2 LYS 8 HZ2 LYS 8 -5.336 3.614 -6.979 71 HZ3 LYS 8 HZ3 LYS 8 -4.153 4.267 -6.051 72 H GLN 9 H GLN 9 -8.278 3.258 -1.374 73 HA GLN 9 HA GLN 9 -7.936 5.881 -2.487 74 HB2 GLN 9 HB2 GLN 9 -10.021 5.088 -1.544 75 HB3 GLN 9 HB3 GLN 9 -9.302 4.850 0.045 76 HG2 GLN 9 HG2 GLN 9 -9.184 7.646 -1.104 77 HG3 GLN 9 HG3 GLN 9 -10.766 7.020 -0.676 78 HE21 GLN 9 HE21 GLN 9 -11.045 6.147 1.631 79 HE22 GLN 9 HE22 GLN 9 -10.084 6.927 2.876 80 H ARG 10 H ARG 10 -6.445 4.266 0.293 81 HA ARG 10 HA ARG 10 -5.109 6.782 1.167 82 HB2 ARG 10 HB2 ARG 10 -6.548 5.193 2.703 83 HB3 ARG 10 HB3 ARG 10 -5.141 4.141 2.667 84 HG2 ARG 10 HG2 ARG 10 -4.592 5.350 4.537 85 HG3 ARG 10 HG3 ARG 10 -3.880 6.452 3.359 86 HD2 ARG 10 HD2 ARG 10 -6.594 6.672 4.718 87 HD3 ARG 10 HD3 ARG 10 -5.202 7.713 4.979 88 HE ARG 10 HE ARG 10 -7.097 7.727 2.687 89 HH11 ARG 10 HH11 ARG 10 -6.077 10.709 1.478 90 HH12 ARG 10 HH12 ARG 10 -7.216 9.371 1.402 91 HH21 ARG 10 HH21 ARG 10 -4.210 9.254 4.003 92 HH22 ARG 10 HH22 ARG 10 -4.380 10.629 2.949 93 H ARG 11 H ARG 11 -4.207 3.396 0.262 94 HA ARG 11 HA ARG 11 -1.338 4.276 0.073 95 HB2 ARG 11 HB2 ARG 11 -2.434 1.748 1.353 96 HB3 ARG 11 HB3 ARG 11 -0.725 2.089 1.137 97 HG2 ARG 11 HG2 ARG 11 -2.575 3.764 2.908 98 HG3 ARG 11 HG3 ARG 11 -1.660 2.389 3.457 99 HD2 ARG 11 HD2 ARG 11 -0.373 4.220 4.103 100 HD3 ARG 11 HD3 ARG 11 0.468 3.542 2.699 101 HE ARG 11 HE ARG 11 -1.337 5.637 1.869 102 HH11 ARG 11 HH11 ARG 11 -0.633 7.582 1.225 103 HH12 ARG 11 HH12 ARG 11 0.919 8.186 1.742 104 HH21 ARG 11 HH21 ARG 11 1.723 5.369 3.559 105 HH22 ARG 11 HH22 ARG 11 2.254 6.934 3.007 106 H THR 12 H THR 12 0.012 3.198 -1.272 107 HA THR 12 HA THR 12 -1.161 1.802 -3.584 108 HB THR 12 HB THR 12 0.814 2.158 -4.749 109 HG1 THR 12 HG1 THR 12 2.735 2.821 -3.694 110 HG21 THR 12 HG21 THR 12 1.315 4.508 -4.601 111 HG22 THR 12 HG22 THR 12 -0.414 4.290 -4.299 112 HG23 THR 12 HG23 THR 12 0.697 4.609 -2.940 113 H PHE 13 H PHE 13 0.010 -0.091 -4.602 114 HA PHE 13 HA PHE 13 0.243 -2.270 -2.793 115 HB2 PHE 13 HB2 PHE 13 -0.407 -2.863 -4.906 116 HB3 PHE 13 HB3 PHE 13 0.873 -1.949 -5.680 117 HD1 PHE 13 HD1 PHE 13 0.053 -5.140 -4.013 118 HD2 PHE 13 HD2 PHE 13 3.169 -2.811 -5.882 119 HE1 PHE 13 HE1 PHE 13 1.472 -7.183 -4.205 120 HE2 PHE 13 HE2 PHE 13 4.580 -4.845 -6.054 121 HZ PHE 13 HZ PHE 13 3.735 -7.024 -5.207 122 H GLU 14 H GLU 14 2.916 -0.291 -4.121 123 HA GLU 14 HA GLU 14 4.992 -1.824 -2.809 124 HB2 GLU 14 HB2 GLU 14 4.911 1.108 -3.637 125 HB3 GLU 14 HB3 GLU 14 6.351 0.232 -3.078 126 HG2 GLU 14 HG2 GLU 14 6.059 -1.389 -4.962 127 HG3 GLU 14 HG3 GLU 14 4.711 -0.419 -5.566 128 H GLN 15 H GLN 15 2.890 0.824 -1.648 129 HA GLN 15 HA GLN 15 4.188 0.986 0.949 130 HB2 GLN 15 HB2 GLN 15 1.478 1.874 -0.051 131 HB3 GLN 15 HB3 GLN 15 2.058 2.168 1.596 132 HG2 GLN 15 HG2 GLN 15 3.864 3.543 0.856 133 HG3 GLN 15 HG3 GLN 15 3.704 3.028 -0.820 134 HE21 GLN 15 HE21 GLN 15 3.848 5.681 -0.578 135 HE22 GLN 15 HE22 GLN 15 2.246 6.383 -0.779 136 H ARG 16 H ARG 16 1.605 -1.143 -0.358 137 HA ARG 16 HA ARG 16 1.023 -2.424 2.168 138 HB2 ARG 16 HB2 ARG 16 0.991 -3.734 -0.588 139 HB3 ARG 16 HB3 ARG 16 0.325 -4.423 0.852 140 HG2 ARG 16 HG2 ARG 16 -0.758 -1.830 -0.294 141 HG3 ARG 16 HG3 ARG 16 -1.246 -3.415 -0.876 142 HD2 ARG 16 HD2 ARG 16 -2.911 -2.854 0.642 143 HD3 ARG 16 HD3 ARG 16 -1.920 -3.994 1.518 144 HE ARG 16 HE ARG 16 -2.077 -1.021 1.872 145 HH11 ARG 16 HH11 ARG 16 -0.977 -4.060 3.295 146 HH12 ARG 16 HH12 ARG 16 -0.412 -3.229 4.743 147 HH21 ARG 16 HH21 ARG 16 -1.282 -0.102 3.764 148 HH22 ARG 16 HH22 ARG 16 -0.550 -1.161 4.958 149 H VAL 17 H VAL 17 3.501 -3.142 -0.315 150 HA VAL 17 HA VAL 17 4.730 -5.320 1.016 151 HB VAL 17 HB VAL 17 6.212 -3.263 -0.671 152 HG11 VAL 17 HG11 VAL 17 7.739 -4.745 0.526 153 HG12 VAL 17 HG12 VAL 17 6.804 -6.170 0.038 154 HG13 VAL 17 HG13 VAL 17 7.695 -5.211 -1.172 155 HG21 VAL 17 HG21 VAL 17 5.859 -4.885 -2.545 156 HG22 VAL 17 HG22 VAL 17 4.661 -5.718 -1.537 157 HG23 VAL 17 HG23 VAL 17 4.407 -4.049 -2.036 158 H GLU 18 H GLU 18 5.588 -1.828 1.346 159 HA GLU 18 HA GLU 18 7.607 -2.232 3.320 160 HB2 GLU 18 HB2 GLU 18 5.808 0.134 2.699 161 HB3 GLU 18 HB3 GLU 18 7.068 0.175 3.947 162 HG2 GLU 18 HG2 GLU 18 8.784 -0.418 2.304 163 HG3 GLU 18 HG3 GLU 18 7.575 -0.489 1.019 164 H ASP 19 H ASP 19 4.123 -1.440 3.859 165 HA ASP 19 HA ASP 19 4.135 -1.558 6.707 166 HB2 ASP 19 HB2 ASP 19 2.321 -0.607 5.483 167 HB3 ASP 19 HB3 ASP 19 2.027 -2.123 4.634 168 H VAL 20 H VAL 20 3.481 -4.255 4.414 169 HA VAL 20 HA VAL 20 3.193 -6.247 6.458 170 HB VAL 20 HB VAL 20 3.916 -6.451 3.508 171 HG11 VAL 20 HG11 VAL 20 4.814 -8.474 4.505 172 HG12 VAL 20 HG12 VAL 20 3.386 -8.651 5.550 173 HG13 VAL 20 HG13 VAL 20 3.256 -8.885 3.795 174 HG21 VAL 20 HG21 VAL 20 1.606 -5.645 4.128 175 HG22 VAL 20 HG22 VAL 20 1.586 -7.213 3.323 176 HG23 VAL 20 HG23 VAL 20 1.375 -7.119 5.083 177 H ARG 21 H ARG 21 6.180 -5.114 4.728 178 HA ARG 21 HA ARG 21 7.890 -7.078 5.956 179 HB2 ARG 21 HB2 ARG 21 8.690 -5.824 4.038 180 HB3 ARG 21 HB3 ARG 21 8.563 -4.291 4.917 181 HG2 ARG 21 HG2 ARG 21 10.255 -5.041 6.543 182 HG3 ARG 21 HG3 ARG 21 10.329 -6.627 5.774 183 HD2 ARG 21 HD2 ARG 21 11.351 -5.642 3.789 184 HD3 ARG 21 HD3 ARG 21 11.146 -4.005 4.469 185 HE ARG 21 HE ARG 21 12.473 -5.429 6.460 186 HH11 ARG 21 HH11 ARG 21 13.446 -4.638 3.170 187 HH12 ARG 21 HH12 ARG 21 15.132 -4.765 3.589 188 HH21 ARG 21 HH21 ARG 21 14.421 -5.547 6.909 189 HH22 ARG 21 HH22 ARG 21 15.716 -5.264 5.745 190 H LEU 22 H LEU 22 7.282 -3.669 7.027 191 HA LEU 22 HA LEU 22 8.773 -3.888 9.429 192 HB2 LEU 22 HB2 LEU 22 6.472 -2.115 8.505 193 HB3 LEU 22 HB3 LEU 22 7.022 -2.083 10.177 194 HG LEU 22 HG LEU 22 9.404 -1.778 9.234 195 HD11 LEU 22 HD11 LEU 22 9.581 -0.513 7.144 196 HD12 LEU 22 HD12 LEU 22 8.956 -2.134 6.840 197 HD13 LEU 22 HD13 LEU 22 7.846 -0.739 6.844 198 HD21 LEU 22 HD21 LEU 22 9.110 0.674 9.190 199 HD22 LEU 22 HD22 LEU 22 7.354 0.460 9.007 200 HD23 LEU 22 HD23 LEU 22 8.175 -0.068 10.497 201 H ILE 23 H ILE 23 5.331 -4.709 8.826 202 HA ILE 23 HA ILE 23 4.723 -5.498 11.499 203 HB ILE 23 HB ILE 23 3.578 -6.162 8.791 204 HG12 ILE 23 HG12 ILE 23 3.085 -3.926 9.609 205 HG13 ILE 23 HG13 ILE 23 1.635 -4.903 9.585 206 HG21 ILE 23 HG21 ILE 23 1.678 -7.260 9.928 207 HG22 ILE 23 HG22 ILE 23 3.151 -8.203 9.971 208 HG23 ILE 23 HG23 ILE 23 2.634 -7.324 11.434 209 HD11 ILE 23 HD11 ILE 23 3.246 -3.983 11.997 210 HD12 ILE 23 HD12 ILE 23 1.607 -3.529 11.548 211 HD13 ILE 23 HD13 ILE 23 1.925 -5.178 12.117 212 H ARG 24 H ARG 24 5.939 -7.573 8.794 213 HA ARG 24 HA ARG 24 6.021 -9.963 10.418 214 HB2 ARG 24 HB2 ARG 24 7.489 -9.129 7.879 215 HB3 ARG 24 HB3 ARG 24 7.702 -10.711 8.607 216 HG2 ARG 24 HG2 ARG 24 5.012 -9.619 7.671 217 HG3 ARG 24 HG3 ARG 24 6.063 -10.659 6.717 218 HD2 ARG 24 HD2 ARG 24 4.726 -11.405 9.347 219 HD3 ARG 24 HD3 ARG 24 4.241 -11.920 7.723 220 HE ARG 24 HE ARG 24 6.786 -12.799 7.749 221 HH11 ARG 24 HH11 ARG 24 7.707 -14.629 8.619 222 HH12 ARG 24 HH12 ARG 24 6.853 -15.530 9.831 223 HH21 ARG 24 HH21 ARG 24 4.159 -13.417 10.039 224 HH22 ARG 24 HH22 ARG 24 5.008 -14.778 10.718 225 H GLU 25 H GLU 25 8.419 -7.405 9.972 226 HA GLU 25 HA GLU 25 10.511 -8.676 11.488 227 HB2 GLU 25 HB2 GLU 25 9.909 -5.777 10.843 228 HB3 GLU 25 HB3 GLU 25 11.320 -6.279 11.784 229 HG2 GLU 25 HG2 GLU 25 12.104 -7.705 9.949 230 HG3 GLU 25 HG3 GLU 25 10.703 -7.283 8.971 231 H GLN 26 H GLN 26 7.733 -6.680 12.647 232 HA GLN 26 HA GLN 26 8.718 -6.991 15.430 233 HB2 GLN 26 HB2 GLN 26 6.920 -5.577 16.107 234 HB3 GLN 26 HB3 GLN 26 7.813 -4.832 14.787 235 HG2 GLN 26 HG2 GLN 26 6.037 -5.181 13.245 236 HG3 GLN 26 HG3 GLN 26 5.237 -6.362 14.275 237 HE21 GLN 26 HE21 GLN 26 3.012 -3.686 14.994 238 HE22 GLN 26 HE22 GLN 26 3.232 -5.235 14.214 239 H HIS 27 H HIS 27 6.352 -8.610 13.394 240 HA HIS 27 HA HIS 27 5.476 -10.317 15.708 241 HB2 HIS 27 HB2 HIS 27 3.681 -9.049 13.604 242 HB3 HIS 27 HB3 HIS 27 3.171 -10.214 14.816 243 HD1 HIS 27 HD1 HIS 27 4.871 -8.455 17.215 244 HD2 HIS 27 HD2 HIS 27 1.669 -7.523 14.617 245 HE1 HIS 27 HE1 HIS 27 3.429 -6.704 18.432 246 HE2 HIS 27 HE2 HIS 27 1.475 -6.139 16.844 247 HA PRO 28 HA PRO 28 6.669 -12.989 12.078 248 HB2 PRO 28 HB2 PRO 28 8.274 -14.785 13.396 249 HB3 PRO 28 HB3 PRO 28 8.829 -13.225 12.725 250 HG2 PRO 28 HG2 PRO 28 7.999 -13.819 15.587 251 HG3 PRO 28 HG3 PRO 28 9.493 -13.006 15.017 252 HD2 PRO 28 HD2 PRO 28 7.361 -11.567 15.840 253 HD3 PRO 28 HD3 PRO 28 8.313 -11.045 14.415 254 H THR 29 H THR 29 5.176 -13.640 15.206 255 HA THR 29 HA THR 29 4.043 -16.213 14.459 256 HB THR 29 HB THR 29 2.929 -16.243 16.486 257 HG1 THR 29 HG1 THR 29 2.634 -14.370 17.736 258 HG21 THR 29 HG21 THR 29 4.561 -15.751 18.180 259 HG22 THR 29 HG22 THR 29 5.447 -16.281 16.739 260 HG23 THR 29 HG23 THR 29 5.383 -14.554 17.163 261 H LYS 30 H LYS 30 3.217 -13.146 13.323 262 HA LYS 30 HA LYS 30 0.368 -13.972 12.901 263 HB2 LYS 30 HB2 LYS 30 1.549 -11.187 13.152 264 HB3 LYS 30 HB3 LYS 30 -0.116 -11.538 12.661 265 HG2 LYS 30 HG2 LYS 30 -0.569 -12.674 14.784 266 HG3 LYS 30 HG3 LYS 30 1.103 -12.438 15.310 267 HD2 LYS 30 HD2 LYS 30 0.811 -10.002 15.355 268 HD3 LYS 30 HD3 LYS 30 -0.794 -10.155 14.633 269 HE2 LYS 30 HE2 LYS 30 -0.995 -9.710 17.012 270 HE3 LYS 30 HE3 LYS 30 -1.641 -11.304 16.627 271 HZ1 LYS 30 HZ1 LYS 30 0.406 -12.278 17.578 272 HZ2 LYS 30 HZ2 LYS 30 1.034 -10.783 17.867 273 HZ3 LYS 30 HZ3 LYS 30 -0.327 -11.266 18.650 274 H ILE 31 H ILE 31 -0.666 -13.613 11.054 275 HA ILE 31 HA ILE 31 1.019 -13.817 8.615 276 HB ILE 31 HB ILE 31 -1.755 -14.867 9.270 277 HG12 ILE 31 HG12 ILE 31 -0.111 -16.052 10.599 278 HG13 ILE 31 HG13 ILE 31 -0.738 -17.088 9.335 279 HG21 ILE 31 HG21 ILE 31 -1.616 -14.504 6.884 280 HG22 ILE 31 HG22 ILE 31 -0.005 -15.244 6.811 281 HG23 ILE 31 HG23 ILE 31 -1.436 -16.234 7.192 282 HD11 ILE 31 HD11 ILE 31 1.655 -17.446 9.614 283 HD12 ILE 31 HD12 ILE 31 1.351 -16.758 8.010 284 HD13 ILE 31 HD13 ILE 31 1.999 -15.739 9.318 285 HA PRO 32 HA PRO 32 -1.049 -9.953 7.522 286 HB2 PRO 32 HB2 PRO 32 0.277 -9.326 5.241 287 HB3 PRO 32 HB3 PRO 32 1.053 -9.272 6.849 288 HG2 PRO 32 HG2 PRO 32 1.179 -11.521 4.798 289 HG3 PRO 32 HG3 PRO 32 2.539 -10.769 5.681 290 HD2 PRO 32 HD2 PRO 32 1.358 -13.089 6.481 291 HD3 PRO 32 HD3 PRO 32 2.012 -11.906 7.658 292 H VAL 33 H VAL 33 -3.155 -10.390 7.090 293 HA VAL 33 HA VAL 33 -3.869 -11.478 4.414 294 HB VAL 33 HB VAL 33 -5.686 -11.419 6.820 295 HG11 VAL 33 HG11 VAL 33 -5.794 -12.969 4.206 296 HG12 VAL 33 HG12 VAL 33 -6.943 -13.117 5.567 297 HG13 VAL 33 HG13 VAL 33 -6.852 -11.616 4.657 298 HG21 VAL 33 HG21 VAL 33 -5.228 -13.860 7.028 299 HG22 VAL 33 HG22 VAL 33 -3.890 -13.674 5.859 300 HG23 VAL 33 HG23 VAL 33 -3.833 -12.861 7.433 301 H ILE 34 H ILE 34 -5.117 -10.374 3.029 302 HA ILE 34 HA ILE 34 -6.182 -7.686 3.840 303 HB ILE 34 HB ILE 34 -5.355 -8.515 1.050 304 HG12 ILE 34 HG12 ILE 34 -3.283 -8.593 2.335 305 HG13 ILE 34 HG13 ILE 34 -3.300 -7.272 1.195 306 HG21 ILE 34 HG21 ILE 34 -6.916 -6.671 1.059 307 HG22 ILE 34 HG22 ILE 34 -5.995 -5.820 2.319 308 HG23 ILE 34 HG23 ILE 34 -5.307 -6.025 0.698 309 HD11 ILE 34 HD11 ILE 34 -3.826 -6.950 4.184 310 HD12 ILE 34 HD12 ILE 34 -2.290 -6.640 3.363 311 HD13 ILE 34 HD13 ILE 34 -3.705 -5.640 2.985 312 H ILE 35 H ILE 35 -8.327 -7.264 3.330 313 HA ILE 35 HA ILE 35 -9.802 -9.327 1.772 314 HB ILE 35 HB ILE 35 -10.236 -9.570 4.236 315 HG12 ILE 35 HG12 ILE 35 -12.711 -8.896 2.570 316 HG13 ILE 35 HG13 ILE 35 -11.743 -10.365 2.351 317 HG21 ILE 35 HG21 ILE 35 -11.909 -7.025 3.899 318 HG22 ILE 35 HG22 ILE 35 -11.761 -8.007 5.353 319 HG23 ILE 35 HG23 ILE 35 -10.357 -7.111 4.787 320 HD11 ILE 35 HD11 ILE 35 -13.678 -10.858 3.724 321 HD12 ILE 35 HD12 ILE 35 -12.201 -11.056 4.676 322 HD13 ILE 35 HD13 ILE 35 -13.240 -9.621 4.898 323 H GLU 36 H GLU 36 -11.285 -8.645 0.336 324 HA GLU 36 HA GLU 36 -12.132 -5.774 0.295 325 HB2 GLU 36 HB2 GLU 36 -10.099 -6.190 -1.195 326 HB3 GLU 36 HB3 GLU 36 -11.093 -7.326 -2.110 327 HG2 GLU 36 HG2 GLU 36 -12.709 -5.319 -2.454 328 HG3 GLU 36 HG3 GLU 36 -11.403 -4.321 -1.834 329 H ARG 37 H ARG 37 -14.331 -5.537 -0.274 330 HA ARG 37 HA ARG 37 -15.972 -7.897 -0.742 331 HB2 ARG 37 HB2 ARG 37 -16.928 -5.870 0.304 332 HB3 ARG 37 HB3 ARG 37 -16.531 -4.922 -1.125 333 HG2 ARG 37 HG2 ARG 37 -18.874 -5.339 -1.202 334 HG3 ARG 37 HG3 ARG 37 -18.137 -6.312 -2.465 335 HD2 ARG 37 HD2 ARG 37 -18.173 -8.159 -0.479 336 HD3 ARG 37 HD3 ARG 37 -19.484 -7.127 0.096 337 HE ARG 37 HE ARG 37 -19.935 -7.632 -2.684 338 HH11 ARG 37 HH11 ARG 37 -21.903 -10.428 -2.528 339 HH12 ARG 37 HH12 ARG 37 -21.319 -9.067 -3.462 340 HH21 ARG 37 HH21 ARG 37 -19.922 -9.568 0.232 341 HH22 ARG 37 HH22 ARG 37 -21.059 -10.719 -0.419 342 H TYR 38 H TYR 38 -16.609 -8.840 -2.641 343 HA TYR 38 HA TYR 38 -14.903 -8.606 -4.804 344 HB2 TYR 38 HB2 TYR 38 -15.778 -10.670 -4.485 345 HB3 TYR 38 HB3 TYR 38 -17.429 -10.087 -4.404 346 HD1 TYR 38 HD1 TYR 38 -14.626 -10.117 -6.937 347 HD2 TYR 38 HD2 TYR 38 -18.818 -10.784 -6.131 348 HE1 TYR 38 HE1 TYR 38 -14.996 -10.674 -9.330 349 HE2 TYR 38 HE2 TYR 38 -19.172 -11.387 -8.522 350 HH TYR 38 HH TYR 38 -16.626 -11.051 -10.981 351 H LYS 39 H LYS 39 -14.670 -7.693 -6.723 352 HA LYS 39 HA LYS 39 -15.643 -5.094 -6.975 353 HB2 LYS 39 HB2 LYS 39 -14.222 -6.913 -8.941 354 HB3 LYS 39 HB3 LYS 39 -14.678 -5.262 -9.364 355 HG2 LYS 39 HG2 LYS 39 -13.404 -4.348 -7.489 356 HG3 LYS 39 HG3 LYS 39 -12.922 -5.985 -6.985 357 HD2 LYS 39 HD2 LYS 39 -11.655 -6.317 -9.027 358 HD3 LYS 39 HD3 LYS 39 -12.336 -4.863 -9.755 359 HE2 LYS 39 HE2 LYS 39 -10.057 -4.432 -9.100 360 HE3 LYS 39 HE3 LYS 39 -11.164 -3.423 -8.171 361 HZ1 LYS 39 HZ1 LYS 39 -9.375 -4.454 -6.817 362 HZ2 LYS 39 HZ2 LYS 39 -10.848 -4.841 -6.250 363 HZ3 LYS 39 HZ3 LYS 39 -9.968 -5.943 -7.120 364 H GLY 40 H GLY 40 -17.205 -4.041 -7.875 365 HA2 GLY 40 HA2 GLY 40 -19.101 -3.504 -9.058 366 HA3 GLY 40 HA3 GLY 40 -18.848 -4.928 -10.070 367 H GLU 41 H GLU 41 -19.014 -5.900 -6.804 368 HA GLU 41 HA GLU 41 -21.926 -6.542 -7.005 369 HB2 GLU 41 HB2 GLU 41 -20.302 -8.324 -7.915 370 HB3 GLU 41 HB3 GLU 41 -19.745 -8.505 -6.258 371 HG2 GLU 41 HG2 GLU 41 -21.286 -10.226 -6.592 372 HG3 GLU 41 HG3 GLU 41 -22.160 -9.070 -5.604 373 H LYS 42 H LYS 42 -21.256 -4.480 -5.453 374 HA LYS 42 HA LYS 42 -20.870 -5.213 -2.639 375 HB2 LYS 42 HB2 LYS 42 -21.761 -2.642 -3.994 376 HB3 LYS 42 HB3 LYS 42 -21.478 -2.807 -2.256 377 HG2 LYS 42 HG2 LYS 42 -19.110 -3.362 -2.640 378 HG3 LYS 42 HG3 LYS 42 -19.337 -3.246 -4.390 379 HD2 LYS 42 HD2 LYS 42 -19.908 -0.873 -4.211 380 HD3 LYS 42 HD3 LYS 42 -19.846 -0.948 -2.445 381 HE2 LYS 42 HE2 LYS 42 -17.392 -1.486 -2.560 382 HE3 LYS 42 HE3 LYS 42 -17.471 -1.392 -4.318 383 HZ1 LYS 42 HZ1 LYS 42 -18.178 0.964 -4.062 384 HZ2 LYS 42 HZ2 LYS 42 -18.023 0.871 -2.427 385 HZ3 LYS 42 HZ3 LYS 42 -16.714 0.710 -3.390 386 H GLN 43 H GLN 43 -22.795 -6.881 -3.532 387 HA GLN 43 HA GLN 43 -25.491 -5.873 -3.191 388 HB2 GLN 43 HB2 GLN 43 -24.857 -7.741 -4.715 389 HB3 GLN 43 HB3 GLN 43 -24.481 -8.751 -3.311 390 HG2 GLN 43 HG2 GLN 43 -26.867 -8.496 -2.542 391 HG3 GLN 43 HG3 GLN 43 -27.195 -7.507 -3.969 392 HE21 GLN 43 HE21 GLN 43 -26.677 -11.590 -4.421 393 HE22 GLN 43 HE22 GLN 43 -26.089 -10.818 -2.956 394 H LEU 44 H LEU 44 -23.443 -8.005 -1.145 395 HA LEU 44 HA LEU 44 -25.321 -7.825 1.120 396 HB2 LEU 44 HB2 LEU 44 -22.457 -8.864 1.033 397 HB3 LEU 44 HB3 LEU 44 -23.568 -9.019 2.377 398 HG LEU 44 HG LEU 44 -23.689 -10.443 -0.288 399 HD11 LEU 44 HD11 LEU 44 -22.253 -11.425 1.472 400 HD12 LEU 44 HD12 LEU 44 -23.604 -11.369 2.623 401 HD13 LEU 44 HD13 LEU 44 -23.681 -12.432 1.220 402 HD21 LEU 44 HD21 LEU 44 -25.832 -10.353 1.874 403 HD22 LEU 44 HD22 LEU 44 -26.008 -9.838 0.179 404 HD23 LEU 44 HD23 LEU 44 -25.772 -11.550 0.555 405 HA PRO 45 HA PRO 45 -24.129 -4.074 2.948 406 HB2 PRO 45 HB2 PRO 45 -23.260 -5.655 5.386 407 HB3 PRO 45 HB3 PRO 45 -24.176 -4.113 5.323 408 HG2 PRO 45 HG2 PRO 45 -25.528 -6.426 5.636 409 HG3 PRO 45 HG3 PRO 45 -26.112 -5.242 4.419 410 HD2 PRO 45 HD2 PRO 45 -24.474 -7.740 3.982 411 HD3 PRO 45 HD3 PRO 45 -25.869 -7.117 3.044 412 H VAL 46 H VAL 46 -22.450 -3.024 2.124 413 HA VAL 46 HA VAL 46 -19.727 -4.067 2.282 414 HB VAL 46 HB VAL 46 -20.583 -3.239 0.197 415 HG11 VAL 46 HG11 VAL 46 -20.665 -0.457 1.418 416 HG12 VAL 46 HG12 VAL 46 -20.794 -0.844 -0.298 417 HG13 VAL 46 HG13 VAL 46 -22.033 -1.406 0.829 418 HG21 VAL 46 HG21 VAL 46 -18.611 -1.938 -0.459 419 HG22 VAL 46 HG22 VAL 46 -18.202 -1.675 1.240 420 HG23 VAL 46 HG23 VAL 46 -18.196 -3.316 0.572 421 H LEU 47 H LEU 47 -19.990 -4.039 4.581 422 HA LEU 47 HA LEU 47 -19.716 -1.600 6.142 423 HB2 LEU 47 HB2 LEU 47 -19.441 -4.571 6.747 424 HB3 LEU 47 HB3 LEU 47 -19.386 -3.340 8.003 425 HG LEU 47 HG LEU 47 -21.786 -3.630 6.153 426 HD11 LEU 47 HD11 LEU 47 -21.346 -4.879 8.887 427 HD12 LEU 47 HD12 LEU 47 -22.867 -4.869 7.955 428 HD13 LEU 47 HD13 LEU 47 -21.456 -5.742 7.325 429 HD21 LEU 47 HD21 LEU 47 -21.459 -2.361 8.900 430 HD22 LEU 47 HD22 LEU 47 -21.625 -1.477 7.365 431 HD23 LEU 47 HD23 LEU 47 -22.964 -2.461 7.961 432 H ASP 48 H ASP 48 -17.928 -1.973 7.974 433 HA ASP 48 HA ASP 48 -15.469 -1.094 6.881 434 HB2 ASP 48 HB2 ASP 48 -14.721 -1.143 9.296 435 HB3 ASP 48 HB3 ASP 48 -16.151 -0.214 8.909 436 H LYS 49 H LYS 49 -13.418 -1.937 8.086 437 HA LYS 49 HA LYS 49 -11.657 -3.302 8.236 438 HB2 LYS 49 HB2 LYS 49 -13.515 -5.656 7.872 439 HB3 LYS 49 HB3 LYS 49 -11.831 -5.734 8.342 440 HG2 LYS 49 HG2 LYS 49 -12.194 -4.940 10.470 441 HG3 LYS 49 HG3 LYS 49 -13.604 -3.974 10.021 442 HD2 LYS 49 HD2 LYS 49 -14.966 -6.017 9.763 443 HD3 LYS 49 HD3 LYS 49 -13.576 -7.006 10.219 444 HE2 LYS 49 HE2 LYS 49 -15.051 -6.743 12.121 445 HE3 LYS 49 HE3 LYS 49 -13.519 -5.942 12.452 446 HZ1 LYS 49 HZ1 LYS 49 -14.537 -3.818 12.239 447 HZ2 LYS 49 HZ2 LYS 49 -15.808 -4.352 11.384 448 HZ3 LYS 49 HZ3 LYS 49 -15.689 -4.672 13.003 449 H THR 50 H THR 50 -10.043 -3.940 7.094 450 HA THR 50 HA THR 50 -10.267 -4.718 4.225 451 HB THR 50 HB THR 50 -8.741 -2.986 3.493 452 HG1 THR 50 HG1 THR 50 -8.036 -1.410 4.946 453 HG21 THR 50 HG21 THR 50 -11.179 -2.310 3.568 454 HG22 THR 50 HG22 THR 50 -10.862 -1.560 5.157 455 HG23 THR 50 HG23 THR 50 -10.038 -0.963 3.705 456 H LYS 51 H LYS 51 -8.375 -4.635 7.202 457 HA LYS 51 HA LYS 51 -6.327 -6.480 6.003 458 HB2 LYS 51 HB2 LYS 51 -5.876 -4.072 7.826 459 HB3 LYS 51 HB3 LYS 51 -4.637 -5.257 7.397 460 HG2 LYS 51 HG2 LYS 51 -4.607 -4.541 5.101 461 HG3 LYS 51 HG3 LYS 51 -6.066 -3.574 5.301 462 HD2 LYS 51 HD2 LYS 51 -4.142 -2.114 5.263 463 HD3 LYS 51 HD3 LYS 51 -4.934 -2.050 6.842 464 HE2 LYS 51 HE2 LYS 51 -3.181 -3.762 7.666 465 HE3 LYS 51 HE3 LYS 51 -2.375 -3.549 6.114 466 HZ1 LYS 51 HZ1 LYS 51 -2.382 -1.041 6.804 467 HZ2 LYS 51 HZ2 LYS 51 -2.670 -1.576 8.320 468 HZ3 LYS 51 HZ3 LYS 51 -1.299 -2.045 7.509 469 H PHE 52 H PHE 52 -5.702 -8.150 7.306 470 HA PHE 52 HA PHE 52 -6.401 -8.095 10.220 471 HB2 PHE 52 HB2 PHE 52 -6.880 -10.497 8.432 472 HB3 PHE 52 HB3 PHE 52 -7.268 -10.337 10.137 473 HD1 PHE 52 HD1 PHE 52 -8.780 -10.631 7.111 474 HD2 PHE 52 HD2 PHE 52 -8.787 -7.962 10.499 475 HE1 PHE 52 HE1 PHE 52 -11.122 -9.992 6.615 476 HE2 PHE 52 HE2 PHE 52 -11.117 -7.336 10.003 477 HZ PHE 52 HZ PHE 52 -12.305 -8.349 8.052 478 H LEU 53 H LEU 53 -4.538 -8.423 11.320 479 HA LEU 53 HA LEU 53 -2.346 -10.078 10.123 480 HB2 LEU 53 HB2 LEU 53 -2.342 -8.319 12.610 481 HB3 LEU 53 HB3 LEU 53 -0.967 -9.199 11.936 482 HG LEU 53 HG LEU 53 -2.432 -6.847 10.640 483 HD11 LEU 53 HD11 LEU 53 -0.212 -5.747 10.983 484 HD12 LEU 53 HD12 LEU 53 -0.997 -6.194 12.506 485 HD13 LEU 53 HD13 LEU 53 0.330 -7.180 11.888 486 HD21 LEU 53 HD21 LEU 53 -1.741 -8.217 8.827 487 HD22 LEU 53 HD22 LEU 53 -0.550 -6.933 8.970 488 HD23 LEU 53 HD23 LEU 53 -0.162 -8.566 9.585 489 H VAL 54 H VAL 54 -3.243 -12.088 10.297 490 HA VAL 54 HA VAL 54 -4.707 -12.814 12.734 491 HB VAL 54 HB VAL 54 -4.278 -14.642 10.385 492 HG11 VAL 54 HG11 VAL 54 -5.285 -15.607 12.457 493 HG12 VAL 54 HG12 VAL 54 -6.550 -14.358 12.424 494 HG13 VAL 54 HG13 VAL 54 -6.452 -15.559 11.125 495 HG21 VAL 54 HG21 VAL 54 -5.172 -12.574 9.420 496 HG22 VAL 54 HG22 VAL 54 -6.436 -13.804 9.488 497 HG23 VAL 54 HG23 VAL 54 -6.408 -12.494 10.693 498 HA PRO 55 HA PRO 55 -1.203 -15.001 14.578 499 HB2 PRO 55 HB2 PRO 55 -3.384 -16.439 16.092 500 HB3 PRO 55 HB3 PRO 55 -1.852 -15.732 16.696 501 HG2 PRO 55 HG2 PRO 55 -4.204 -14.423 17.050 502 HG3 PRO 55 HG3 PRO 55 -2.743 -13.513 16.555 503 HD2 PRO 55 HD2 PRO 55 -5.021 -14.506 14.816 504 HD3 PRO 55 HD3 PRO 55 -4.218 -12.902 14.837 505 H ASP 56 H ASP 56 -0.144 -16.819 13.963 506 HA ASP 56 HA ASP 56 -0.863 -18.152 11.718 507 HB2 ASP 56 HB2 ASP 56 0.958 -19.813 12.283 508 HB3 ASP 56 HB3 ASP 56 1.362 -18.102 12.265 509 H HIS 57 H HIS 57 -1.459 -19.541 14.900 510 HA HIS 57 HA HIS 57 -2.342 -22.097 14.016 511 HB2 HIS 57 HB2 HIS 57 -1.512 -21.466 16.294 512 HB3 HIS 57 HB3 HIS 57 -3.004 -20.583 16.585 513 HD1 HIS 57 HD1 HIS 57 -2.108 -24.271 15.601 514 HD2 HIS 57 HD2 HIS 57 -4.600 -21.941 18.091 515 HE1 HIS 57 HE1 HIS 57 -3.488 -25.930 17.017 516 HE2 HIS 57 HE2 HIS 57 -5.007 -24.503 18.524 517 H VAL 58 H VAL 58 -4.130 -19.132 13.796 518 HA VAL 58 HA VAL 58 -6.781 -20.081 14.394 519 HB VAL 58 HB VAL 58 -5.820 -17.778 12.671 520 HG11 VAL 58 HG11 VAL 58 -8.646 -18.354 13.656 521 HG12 VAL 58 HG12 VAL 58 -8.109 -16.812 12.967 522 HG13 VAL 58 HG13 VAL 58 -8.114 -18.258 11.960 523 HG21 VAL 58 HG21 VAL 58 -5.249 -17.607 15.090 524 HG22 VAL 58 HG22 VAL 58 -6.460 -16.406 14.631 525 HG23 VAL 58 HG23 VAL 58 -6.955 -17.870 15.508 526 H ASN 59 H ASN 59 -8.219 -21.238 13.256 527 HA ASN 59 HA ASN 59 -7.510 -22.481 10.722 528 HB2 ASN 59 HB2 ASN 59 -10.171 -22.467 12.225 529 HB3 ASN 59 HB3 ASN 59 -9.661 -23.630 11.013 530 HD21 ASN 59 HD21 ASN 59 -7.767 -25.549 13.347 531 HD22 ASN 59 HD22 ASN 59 -8.108 -25.265 11.635 532 H MET 60 H MET 60 -8.556 -22.175 8.640 533 HA MET 60 HA MET 60 -9.594 -19.621 7.953 534 HB2 MET 60 HB2 MET 60 -9.780 -22.358 6.676 535 HB3 MET 60 HB3 MET 60 -10.828 -21.080 6.070 536 HG2 MET 60 HG2 MET 60 -7.816 -21.078 6.164 537 HG3 MET 60 HG3 MET 60 -8.858 -21.169 4.733 538 HE1 MET 60 HE1 MET 60 -11.059 -18.768 5.631 539 HE2 MET 60 HE2 MET 60 -10.353 -17.413 4.740 540 HE3 MET 60 HE3 MET 60 -10.469 -19.010 3.969 541 H SER 61 H SER 61 -11.481 -22.549 8.839 542 HA SER 61 HA SER 61 -14.059 -21.480 8.774 543 HB2 SER 61 HB2 SER 61 -14.557 -23.217 10.501 544 HB3 SER 61 HB3 SER 61 -13.642 -23.825 9.109 545 HG SER 61 HG SER 61 -12.827 -24.472 11.252 546 H GLU 62 H GLU 62 -11.643 -21.110 11.374 547 HA GLU 62 HA GLU 62 -13.454 -19.756 13.196 548 HB2 GLU 62 HB2 GLU 62 -11.511 -21.014 13.993 549 HB3 GLU 62 HB3 GLU 62 -10.427 -19.954 13.111 550 HG2 GLU 62 HG2 GLU 62 -10.342 -19.379 15.409 551 HG3 GLU 62 HG3 GLU 62 -11.073 -18.045 14.529 552 H LEU 63 H LEU 63 -10.889 -18.543 10.975 553 HA LEU 63 HA LEU 63 -11.320 -15.725 11.373 554 HB2 LEU 63 HB2 LEU 63 -9.361 -16.666 10.228 555 HB3 LEU 63 HB3 LEU 63 -10.386 -17.383 8.987 556 HG LEU 63 HG LEU 63 -11.021 -15.098 8.196 557 HD11 LEU 63 HD11 LEU 63 -8.890 -14.223 10.200 558 HD12 LEU 63 HD12 LEU 63 -9.565 -13.192 8.920 559 HD13 LEU 63 HD13 LEU 63 -10.616 -13.779 10.221 560 HD21 LEU 63 HD21 LEU 63 -8.024 -15.635 8.252 561 HD22 LEU 63 HD22 LEU 63 -9.198 -16.360 7.128 562 HD23 LEU 63 HD23 LEU 63 -8.907 -14.619 7.071 563 H ILE 64 H ILE 64 -12.883 -18.030 9.132 564 HA ILE 64 HA ILE 64 -14.758 -16.233 7.920 565 HB ILE 64 HB ILE 64 -14.618 -19.206 8.392 566 HG12 ILE 64 HG12 ILE 64 -14.855 -17.712 5.779 567 HG13 ILE 64 HG13 ILE 64 -13.304 -17.878 6.607 568 HG21 ILE 64 HG21 ILE 64 -16.682 -19.548 7.028 569 HG22 ILE 64 HG22 ILE 64 -17.025 -18.820 8.582 570 HG23 ILE 64 HG23 ILE 64 -17.001 -17.803 7.114 571 HD11 ILE 64 HD11 ILE 64 -15.015 -20.203 5.676 572 HD12 ILE 64 HD12 ILE 64 -13.562 -19.585 4.877 573 HD13 ILE 64 HD13 ILE 64 -13.449 -20.328 6.482 574 H LYS 65 H LYS 65 -15.115 -18.235 10.902 575 HA LYS 65 HA LYS 65 -17.791 -17.460 11.420 576 HB2 LYS 65 HB2 LYS 65 -16.561 -19.410 12.390 577 HB3 LYS 65 HB3 LYS 65 -15.664 -18.303 13.442 578 HG2 LYS 65 HG2 LYS 65 -17.811 -17.571 14.470 579 HG3 LYS 65 HG3 LYS 65 -18.686 -18.662 13.377 580 HD2 LYS 65 HD2 LYS 65 -17.508 -20.610 14.372 581 HD3 LYS 65 HD3 LYS 65 -16.601 -19.519 15.444 582 HE2 LYS 65 HE2 LYS 65 -18.742 -18.746 16.462 583 HE3 LYS 65 HE3 LYS 65 -19.642 -19.839 15.408 584 HZ1 LYS 65 HZ1 LYS 65 -18.488 -21.720 16.476 585 HZ2 LYS 65 HZ2 LYS 65 -17.647 -20.709 17.449 586 HZ3 LYS 65 HZ3 LYS 65 -19.266 -20.832 17.601 587 H ILE 66 H ILE 66 -14.785 -15.944 12.721 588 HA ILE 66 HA ILE 66 -16.249 -13.912 14.169 589 HB ILE 66 HB ILE 66 -14.046 -14.405 14.833 590 HG12 ILE 66 HG12 ILE 66 -14.929 -12.051 15.140 591 HG13 ILE 66 HG13 ILE 66 -13.216 -12.333 15.357 592 HG21 ILE 66 HG21 ILE 66 -12.011 -13.721 13.599 593 HG22 ILE 66 HG22 ILE 66 -12.893 -15.023 12.823 594 HG23 ILE 66 HG23 ILE 66 -12.998 -13.394 12.156 595 HD11 ILE 66 HD11 ILE 66 -14.463 -10.937 12.955 596 HD12 ILE 66 HD12 ILE 66 -13.497 -10.216 14.248 597 HD13 ILE 66 HD13 ILE 66 -12.751 -11.341 13.115 598 H ILE 67 H ILE 67 -14.846 -13.817 10.824 599 HA ILE 67 HA ILE 67 -15.727 -11.139 10.310 600 HB ILE 67 HB ILE 67 -15.028 -13.462 8.493 601 HG12 ILE 67 HG12 ILE 67 -13.624 -10.789 9.020 602 HG13 ILE 67 HG13 ILE 67 -13.293 -12.246 9.950 603 HG21 ILE 67 HG21 ILE 67 -16.601 -12.087 7.186 604 HG22 ILE 67 HG22 ILE 67 -15.729 -10.607 7.647 605 HG23 ILE 67 HG23 ILE 67 -14.978 -11.821 6.593 606 HD11 ILE 67 HD11 ILE 67 -12.768 -11.888 6.984 607 HD12 ILE 67 HD12 ILE 67 -11.593 -12.050 8.300 608 HD13 ILE 67 HD13 ILE 67 -12.623 -13.429 7.861 609 H ARG 68 H ARG 68 -17.400 -14.246 9.642 610 HA ARG 68 HA ARG 68 -19.726 -13.188 8.434 611 HB2 ARG 68 HB2 ARG 68 -19.112 -15.558 8.442 612 HB3 ARG 68 HB3 ARG 68 -19.391 -15.663 10.186 613 HG2 ARG 68 HG2 ARG 68 -21.786 -15.242 9.878 614 HG3 ARG 68 HG3 ARG 68 -21.535 -14.922 8.155 615 HD2 ARG 68 HD2 ARG 68 -22.479 -17.133 8.432 616 HD3 ARG 68 HD3 ARG 68 -20.836 -17.263 7.816 617 HE ARG 68 HE ARG 68 -20.149 -18.311 9.758 618 HH11 ARG 68 HH11 ARG 68 -23.405 -17.138 10.359 619 HH12 ARG 68 HH12 ARG 68 -23.626 -18.185 11.726 620 HH21 ARG 68 HH21 ARG 68 -20.531 -19.662 11.495 621 HH22 ARG 68 HH22 ARG 68 -22.031 -19.555 12.359 622 H ARG 69 H ARG 69 -19.024 -13.554 11.911 623 HA ARG 69 HA ARG 69 -21.689 -12.559 12.672 624 HB2 ARG 69 HB2 ARG 69 -20.513 -14.359 13.871 625 HB3 ARG 69 HB3 ARG 69 -19.263 -13.218 14.394 626 HG2 ARG 69 HG2 ARG 69 -20.822 -11.993 15.759 627 HG3 ARG 69 HG3 ARG 69 -22.221 -12.758 14.990 628 HD2 ARG 69 HD2 ARG 69 -21.584 -14.948 15.933 629 HD3 ARG 69 HD3 ARG 69 -20.147 -14.234 16.662 630 HE ARG 69 HE ARG 69 -21.419 -13.190 18.313 631 HH11 ARG 69 HH11 ARG 69 -23.655 -14.770 16.113 632 HH12 ARG 69 HH12 ARG 69 -24.981 -14.637 17.234 633 HH21 ARG 69 HH21 ARG 69 -23.149 -13.055 19.677 634 HH22 ARG 69 HH22 ARG 69 -24.696 -13.692 19.194 635 H ARG 70 H ARG 70 -18.472 -11.104 12.417 636 HA ARG 70 HA ARG 70 -19.232 -8.530 13.601 637 HB2 ARG 70 HB2 ARG 70 -16.924 -9.587 11.964 638 HB3 ARG 70 HB3 ARG 70 -17.217 -7.862 11.920 639 HG2 ARG 70 HG2 ARG 70 -15.556 -8.509 13.628 640 HG3 ARG 70 HG3 ARG 70 -16.918 -7.597 14.276 641 HD2 ARG 70 HD2 ARG 70 -17.886 -9.574 15.258 642 HD3 ARG 70 HD3 ARG 70 -16.695 -10.623 14.466 643 HE ARG 70 HE ARG 70 -15.153 -8.805 15.921 644 HH11 ARG 70 HH11 ARG 70 -17.604 -11.129 16.940 645 HH12 ARG 70 HH12 ARG 70 -16.861 -11.291 18.508 646 HH21 ARG 70 HH21 ARG 70 -14.352 -9.015 17.764 647 HH22 ARG 70 HH22 ARG 70 -15.018 -10.076 19.020 648 H LEU 71 H LEU 71 -19.331 -9.796 10.281 649 HA LEU 71 HA LEU 71 -20.570 -7.395 9.179 650 HB2 LEU 71 HB2 LEU 71 -20.453 -10.274 8.204 651 HB3 LEU 71 HB3 LEU 71 -21.111 -8.943 7.257 652 HG LEU 71 HG LEU 71 -18.205 -9.099 8.195 653 HD11 LEU 71 HD11 LEU 71 -18.739 -10.905 6.622 654 HD12 LEU 71 HD12 LEU 71 -19.467 -9.735 5.502 655 HD13 LEU 71 HD13 LEU 71 -17.720 -9.680 5.839 656 HD21 LEU 71 HD21 LEU 71 -18.886 -6.788 7.771 657 HD22 LEU 71 HD22 LEU 71 -17.823 -7.357 6.489 658 HD23 LEU 71 HD23 LEU 71 -19.575 -7.256 6.191 659 H GLN 72 H GLN 72 -22.783 -7.109 8.593 660 HA GLN 72 HA GLN 72 -24.685 -8.166 10.508 661 HB2 GLN 72 HB2 GLN 72 -24.935 -6.202 8.220 662 HB3 GLN 72 HB3 GLN 72 -26.283 -6.670 9.266 663 HG2 GLN 72 HG2 GLN 72 -25.114 -5.849 11.254 664 HG3 GLN 72 HG3 GLN 72 -23.679 -5.466 10.322 665 HE21 GLN 72 HE21 GLN 72 -25.404 -2.242 10.755 666 HE22 GLN 72 HE22 GLN 72 -24.525 -3.392 11.749 667 H LEU 73 H LEU 73 -24.684 -10.392 10.013 668 HA LEU 73 HA LEU 73 -26.262 -11.214 7.613 669 HB2 LEU 73 HB2 LEU 73 -23.738 -12.515 8.699 670 HB3 LEU 73 HB3 LEU 73 -24.699 -13.141 7.365 671 HG LEU 73 HG LEU 73 -23.229 -10.457 7.294 672 HD11 LEU 73 HD11 LEU 73 -21.647 -12.299 7.496 673 HD12 LEU 73 HD12 LEU 73 -22.446 -13.171 6.179 674 HD13 LEU 73 HD13 LEU 73 -21.601 -11.628 5.861 675 HD21 LEU 73 HD21 LEU 73 -25.132 -10.622 5.689 676 HD22 LEU 73 HD22 LEU 73 -23.568 -10.594 4.877 677 HD23 LEU 73 HD23 LEU 73 -24.446 -12.139 5.054 678 H ASN 74 H ASN 74 -27.285 -13.230 7.743 679 HA ASN 74 HA ASN 74 -27.647 -14.534 10.377 680 HB2 ASN 74 HB2 ASN 74 -29.893 -13.390 8.648 681 HB3 ASN 74 HB3 ASN 74 -30.158 -14.560 9.936 682 HD21 ASN 74 HD21 ASN 74 -29.991 -10.715 10.964 683 HD22 ASN 74 HD22 ASN 74 -30.107 -11.248 9.291 684 H ALA 75 H ALA 75 -28.809 -16.668 10.102 685 HA ALA 75 HA ALA 75 -27.333 -18.315 8.435 686 HB1 ALA 75 HB1 ALA 75 -30.108 -18.795 9.609 687 HB2 ALA 75 HB2 ALA 75 -28.966 -20.054 9.092 688 HB3 ALA 75 HB3 ALA 75 -28.558 -19.007 10.466 689 H ASN 76 H ASN 76 -30.453 -16.837 7.637 690 HA ASN 76 HA ASN 76 -30.966 -18.398 5.252 691 HB2 ASN 76 HB2 ASN 76 -32.697 -17.323 6.674 692 HB3 ASN 76 HB3 ASN 76 -32.059 -15.728 6.258 693 HD21 ASN 76 HD21 ASN 76 -34.201 -15.568 3.473 694 HD22 ASN 76 HD22 ASN 76 -33.327 -14.736 4.754 695 H GLN 77 H GLN 77 -28.865 -15.643 5.804 696 HA GLN 77 HA GLN 77 -29.086 -14.610 3.069 697 HB2 GLN 77 HB2 GLN 77 -28.818 -13.126 5.052 698 HB3 GLN 77 HB3 GLN 77 -27.227 -13.836 5.354 699 HG2 GLN 77 HG2 GLN 77 -27.058 -11.648 4.248 700 HG3 GLN 77 HG3 GLN 77 -26.377 -12.926 3.237 701 HE21 GLN 77 HE21 GLN 77 -29.842 -11.028 2.011 702 HE22 GLN 77 HE22 GLN 77 -29.276 -10.807 3.659 703 H ALA 78 H ALA 78 -27.737 -15.077 1.368 704 HA ALA 78 HA ALA 78 -25.903 -17.340 1.658 705 HB1 ALA 78 HB1 ALA 78 -25.765 -17.175 -0.788 706 HB2 ALA 78 HB2 ALA 78 -27.452 -17.185 -0.229 707 HB3 ALA 78 HB3 ALA 78 -26.698 -15.661 -0.759 708 H PHE 79 H PHE 79 -24.074 -16.824 2.711 709 HA PHE 79 HA PHE 79 -22.390 -14.589 1.727 710 HB2 PHE 79 HB2 PHE 79 -22.945 -13.910 3.803 711 HB3 PHE 79 HB3 PHE 79 -22.923 -15.524 4.484 712 HD1 PHE 79 HD1 PHE 79 -20.777 -12.679 3.483 713 HD2 PHE 79 HD2 PHE 79 -20.882 -16.589 5.288 714 HE1 PHE 79 HE1 PHE 79 -18.471 -12.337 4.360 715 HE2 PHE 79 HE2 PHE 79 -18.576 -16.256 6.138 716 HZ PHE 79 HZ PHE 79 -17.373 -14.122 5.694 717 H PHE 80 H PHE 80 -20.289 -14.661 1.275 718 HA PHE 80 HA PHE 80 -18.837 -17.177 1.723 719 HB2 PHE 80 HB2 PHE 80 -19.307 -15.967 -0.993 720 HB3 PHE 80 HB3 PHE 80 -17.903 -16.950 -0.644 721 HD1 PHE 80 HD1 PHE 80 -21.560 -17.015 -1.080 722 HD2 PHE 80 HD2 PHE 80 -18.034 -19.365 -0.278 723 HE1 PHE 80 HE1 PHE 80 -22.796 -19.066 -1.713 724 HE2 PHE 80 HE2 PHE 80 -19.294 -21.429 -0.869 725 HZ PHE 80 HZ PHE 80 -21.660 -21.284 -1.600 726 H LEU 81 H LEU 81 -16.728 -17.110 2.145 727 HA LEU 81 HA LEU 81 -15.248 -14.558 1.641 728 HB2 LEU 81 HB2 LEU 81 -15.534 -14.690 4.002 729 HB3 LEU 81 HB3 LEU 81 -15.130 -16.400 4.033 730 HG LEU 81 HG LEU 81 -12.790 -15.966 3.597 731 HD11 LEU 81 HD11 LEU 81 -13.683 -13.067 3.214 732 HD12 LEU 81 HD12 LEU 81 -11.990 -13.535 3.478 733 HD13 LEU 81 HD13 LEU 81 -12.836 -14.087 2.029 734 HD21 LEU 81 HD21 LEU 81 -12.174 -14.658 5.549 735 HD22 LEU 81 HD22 LEU 81 -13.811 -13.940 5.622 736 HD23 LEU 81 HD23 LEU 81 -13.572 -15.669 5.927 737 H LEU 82 H LEU 82 -14.029 -14.862 -0.034 738 HA LEU 82 HA LEU 82 -13.216 -17.607 -0.838 739 HB2 LEU 82 HB2 LEU 82 -13.282 -15.047 -2.458 740 HB3 LEU 82 HB3 LEU 82 -13.142 -16.687 -3.067 741 HG LEU 82 HG LEU 82 -15.620 -15.422 -1.803 742 HD11 LEU 82 HD11 LEU 82 -15.012 -16.358 -4.644 743 HD12 LEU 82 HD12 LEU 82 -16.561 -15.718 -4.075 744 HD13 LEU 82 HD13 LEU 82 -15.131 -14.669 -4.110 745 HD21 LEU 82 HD21 LEU 82 -15.184 -18.211 -2.943 746 HD22 LEU 82 HD22 LEU 82 -15.583 -17.809 -1.248 747 HD23 LEU 82 HD23 LEU 82 -16.755 -17.527 -2.541 748 H VAL 83 H VAL 83 -11.169 -18.200 -1.221 749 HA VAL 83 HA VAL 83 -8.980 -16.177 -0.879 750 HB VAL 83 HB VAL 83 -8.750 -19.171 -0.443 751 HG11 VAL 83 HG11 VAL 83 -6.786 -16.871 -0.007 752 HG12 VAL 83 HG12 VAL 83 -6.524 -18.557 0.486 753 HG13 VAL 83 HG13 VAL 83 -6.644 -18.159 -1.233 754 HG21 VAL 83 HG21 VAL 83 -8.408 -18.535 1.954 755 HG22 VAL 83 HG22 VAL 83 -8.838 -16.861 1.547 756 HG23 VAL 83 HG23 VAL 83 -10.041 -18.146 1.395 757 H ASN 84 H ASN 84 -7.705 -15.823 -2.606 758 HA ASN 84 HA ASN 84 -7.319 -15.500 -4.776 759 HB2 ASN 84 HB2 ASN 84 -6.360 -17.257 -6.028 760 HB3 ASN 84 HB3 ASN 84 -5.962 -17.527 -4.344 761 HD21 ASN 84 HD21 ASN 84 -6.860 -20.893 -4.899 762 HD22 ASN 84 HD22 ASN 84 -5.625 -19.752 -4.373 763 H GLY 85 H GLY 85 -10.222 -15.740 -4.033 764 HA2 GLY 85 HA2 GLY 85 -12.181 -15.291 -5.212 765 HA3 GLY 85 HA3 GLY 85 -11.399 -15.726 -6.729 766 H HIS 86 H HIS 86 -10.991 -18.239 -4.389 767 HA HIS 86 HA HIS 86 -13.519 -19.625 -5.222 768 HB2 HIS 86 HB2 HIS 86 -10.757 -20.843 -4.847 769 HB3 HIS 86 HB3 HIS 86 -12.233 -21.755 -5.154 770 HD1 HIS 86 HD1 HIS 86 -9.650 -19.624 -6.943 771 HD2 HIS 86 HD2 HIS 86 -13.395 -21.464 -7.644 772 HE1 HIS 86 HE1 HIS 86 -10.046 -19.543 -9.504 773 HE2 HIS 86 HE2 HIS 86 -12.329 -20.668 -9.911 774 H SER 87 H SER 87 -14.438 -21.109 -3.706 775 HA SER 87 HA SER 87 -14.615 -19.854 -1.154 776 HB2 SER 87 HB2 SER 87 -16.551 -20.835 -2.204 777 HB3 SER 87 HB3 SER 87 -15.815 -22.452 -2.116 778 HG SER 87 HG SER 87 -17.162 -22.232 -0.355 779 H MET 88 H MET 88 -14.042 -20.310 0.831 780 HA MET 88 HA MET 88 -12.687 -22.884 1.514 781 HB2 MET 88 HB2 MET 88 -12.001 -20.108 2.554 782 HB3 MET 88 HB3 MET 88 -11.334 -21.606 3.208 783 HG2 MET 88 HG2 MET 88 -10.940 -20.642 0.354 784 HG3 MET 88 HG3 MET 88 -9.801 -20.457 1.688 785 HE1 MET 88 HE1 MET 88 -7.834 -21.474 0.264 786 HE2 MET 88 HE2 MET 88 -7.951 -23.033 -0.582 787 HE3 MET 88 HE3 MET 88 -8.962 -21.665 -1.104 788 H VAL 89 H VAL 89 -15.574 -21.837 1.654 789 HA VAL 89 HA VAL 89 -16.282 -20.925 4.138 790 HB VAL 89 HB VAL 89 -17.633 -21.073 2.018 791 HG11 VAL 89 HG11 VAL 89 -17.689 -23.575 1.825 792 HG12 VAL 89 HG12 VAL 89 -18.706 -23.634 3.283 793 HG13 VAL 89 HG13 VAL 89 -19.289 -22.824 1.817 794 HG21 VAL 89 HG21 VAL 89 -19.084 -21.547 4.641 795 HG22 VAL 89 HG22 VAL 89 -18.425 -19.996 4.075 796 HG23 VAL 89 HG23 VAL 89 -19.733 -20.782 3.177 797 H SER 90 H SER 90 -15.764 -24.347 3.500 798 HA SER 90 HA SER 90 -16.479 -25.005 6.326 799 HB2 SER 90 HB2 SER 90 -16.836 -27.290 5.472 800 HB3 SER 90 HB3 SER 90 -17.852 -26.102 4.641 801 HG SER 90 HG SER 90 -16.825 -27.565 3.173 802 H VAL 91 H VAL 91 -13.732 -24.156 4.892 803 HA VAL 91 HA VAL 91 -12.096 -26.563 5.226 804 HB VAL 91 HB VAL 91 -11.446 -23.735 4.343 805 HG11 VAL 91 HG11 VAL 91 -9.324 -24.681 3.473 806 HG12 VAL 91 HG12 VAL 91 -9.389 -24.663 5.232 807 HG13 VAL 91 HG13 VAL 91 -9.655 -26.192 4.344 808 HG21 VAL 91 HG21 VAL 91 -11.735 -26.373 2.830 809 HG22 VAL 91 HG22 VAL 91 -12.885 -25.019 2.774 810 HG23 VAL 91 HG23 VAL 91 -11.260 -24.831 2.111 811 H SER 92 H SER 92 -10.988 -27.173 6.951 812 HA SER 92 HA SER 92 -10.873 -25.524 9.365 813 HB2 SER 92 HB2 SER 92 -10.029 -27.600 10.383 814 HB3 SER 92 HB3 SER 92 -11.534 -27.858 9.480 815 HG SER 92 HG SER 92 -9.936 -29.476 9.025 816 H THR 93 H THR 93 -8.652 -26.035 6.765 817 HA THR 93 HA THR 93 -6.237 -26.282 7.865 818 HB THR 93 HB THR 93 -6.604 -24.354 5.596 819 HG1 THR 93 HG1 THR 93 -6.735 -26.249 4.300 820 HG21 THR 93 HG21 THR 93 -4.272 -24.731 6.252 821 HG22 THR 93 HG22 THR 93 -4.506 -26.493 6.178 822 HG23 THR 93 HG23 THR 93 -4.597 -25.508 4.701 823 HA PRO 94 HA PRO 94 -5.163 -22.694 10.339 824 HB2 PRO 94 HB2 PRO 94 -2.346 -23.512 9.630 825 HB3 PRO 94 HB3 PRO 94 -3.022 -23.047 11.222 826 HG2 PRO 94 HG2 PRO 94 -2.625 -25.658 10.638 827 HG3 PRO 94 HG3 PRO 94 -4.152 -25.151 11.438 828 HD2 PRO 94 HD2 PRO 94 -3.670 -25.714 8.501 829 HD3 PRO 94 HD3 PRO 94 -5.003 -26.270 9.559 830 H ILE 95 H ILE 95 -4.718 -20.570 9.938 831 HA ILE 95 HA ILE 95 -4.716 -19.660 7.277 832 HB ILE 95 HB ILE 95 -5.712 -18.494 9.202 833 HG12 ILE 95 HG12 ILE 95 -5.125 -16.179 8.672 834 HG13 ILE 95 HG13 ILE 95 -3.690 -16.699 7.789 835 HG21 ILE 95 HG21 ILE 95 -2.870 -17.659 9.982 836 HG22 ILE 95 HG22 ILE 95 -4.377 -17.141 10.745 837 HG23 ILE 95 HG23 ILE 95 -3.877 -18.816 10.870 838 HD11 ILE 95 HD11 ILE 95 -5.098 -17.791 6.093 839 HD12 ILE 95 HD12 ILE 95 -6.553 -17.475 7.071 840 HD13 ILE 95 HD13 ILE 95 -5.657 -16.131 6.349 841 H SER 96 H SER 96 -1.937 -20.284 9.366 842 HA SER 96 HA SER 96 0.071 -18.930 7.806 843 HB2 SER 96 HB2 SER 96 1.604 -20.533 8.959 844 HB3 SER 96 HB3 SER 96 0.515 -19.663 10.059 845 HG SER 96 HG SER 96 0.633 -21.983 10.459 846 H GLU 97 H GLU 97 -1.104 -22.330 7.707 847 HA GLU 97 HA GLU 97 0.554 -23.101 5.488 848 HB2 GLU 97 HB2 GLU 97 -2.045 -24.306 6.520 849 HB3 GLU 97 HB3 GLU 97 -0.975 -25.043 5.317 850 HG2 GLU 97 HG2 GLU 97 0.894 -24.920 7.025 851 HG3 GLU 97 HG3 GLU 97 -0.304 -24.422 8.223 852 H VAL 98 H VAL 98 -2.761 -21.779 5.608 853 HA VAL 98 HA VAL 98 -3.186 -21.823 2.737 854 HB VAL 98 HB VAL 98 -4.362 -19.955 4.832 855 HG11 VAL 98 HG11 VAL 98 -6.162 -19.564 3.197 856 HG12 VAL 98 HG12 VAL 98 -4.619 -19.002 2.556 857 HG13 VAL 98 HG13 VAL 98 -5.300 -20.545 1.987 858 HG21 VAL 98 HG21 VAL 98 -5.375 -22.553 3.595 859 HG22 VAL 98 HG22 VAL 98 -4.961 -22.277 5.304 860 HG23 VAL 98 HG23 VAL 98 -6.349 -21.461 4.589 861 H TYR 99 H TYR 99 -1.757 -19.315 4.913 862 HA TYR 99 HA TYR 99 -1.062 -17.530 2.839 863 HB2 TYR 99 HB2 TYR 99 -1.000 -16.550 4.850 864 HB3 TYR 99 HB3 TYR 99 -0.189 -17.887 5.642 865 HD1 TYR 99 HD1 TYR 99 0.327 -14.768 3.777 866 HD2 TYR 99 HD2 TYR 99 2.229 -18.220 5.535 867 HE1 TYR 99 HE1 TYR 99 2.534 -13.607 3.708 868 HE2 TYR 99 HE2 TYR 99 4.428 -17.070 5.435 869 HH TYR 99 HH TYR 99 5.551 -15.121 4.896 870 H GLU 100 H GLU 100 0.946 -20.246 4.006 871 HA GLU 100 HA GLU 100 3.064 -19.731 2.120 872 HB2 GLU 100 HB2 GLU 100 2.160 -22.314 3.447 873 HB3 GLU 100 HB3 GLU 100 3.628 -22.163 2.497 874 HG2 GLU 100 HG2 GLU 100 3.038 -20.628 5.061 875 HG3 GLU 100 HG3 GLU 100 4.011 -22.086 4.941 876 H SER 101 H SER 101 0.011 -21.501 1.762 877 HA SER 101 HA SER 101 0.654 -22.614 -0.855 878 HB2 SER 101 HB2 SER 101 -2.004 -22.312 0.601 879 HB3 SER 101 HB3 SER 101 -1.734 -23.264 -0.869 880 HG SER 101 HG SER 101 -0.686 -23.697 1.735 881 H GLU 102 H GLU 102 -0.985 -19.673 0.202 882 HA GLU 102 HA GLU 102 -1.672 -18.901 -2.620 883 HB2 GLU 102 HB2 GLU 102 -3.202 -18.393 -0.046 884 HB3 GLU 102 HB3 GLU 102 -3.703 -17.880 -1.653 885 HG2 GLU 102 HG2 GLU 102 -3.422 -20.762 -0.672 886 HG3 GLU 102 HG3 GLU 102 -4.916 -19.866 -0.851 887 H LYS 103 H LYS 103 0.786 -18.226 -1.168 888 HA LYS 103 HA LYS 103 0.842 -15.514 -0.339 889 HB2 LYS 103 HB2 LYS 103 2.519 -17.479 -0.087 890 HB3 LYS 103 HB3 LYS 103 3.072 -17.085 -1.702 891 HG2 LYS 103 HG2 LYS 103 3.666 -14.805 -0.948 892 HG3 LYS 103 HG3 LYS 103 3.064 -15.173 0.679 893 HD2 LYS 103 HD2 LYS 103 5.294 -16.683 -0.744 894 HD3 LYS 103 HD3 LYS 103 5.571 -15.381 0.432 895 HE2 LYS 103 HE2 LYS 103 4.427 -16.712 2.189 896 HE3 LYS 103 HE3 LYS 103 4.104 -17.996 1.016 897 HZ1 LYS 103 HZ1 LYS 103 6.562 -18.221 0.746 898 HZ2 LYS 103 HZ2 LYS 103 6.786 -17.190 2.006 899 HZ3 LYS 103 HZ3 LYS 103 6.011 -18.630 2.226 900 H ASP 104 H ASP 104 0.480 -13.704 -1.521 901 HA ASP 104 HA ASP 104 0.654 -13.723 -4.451 902 HB2 ASP 104 HB2 ASP 104 -1.125 -12.565 -3.202 903 HB3 ASP 104 HB3 ASP 104 0.080 -11.463 -2.510 904 H GLU 105 H GLU 105 1.788 -11.755 -5.439 905 HA GLU 105 HA GLU 105 4.320 -12.306 -5.910 906 HB2 GLU 105 HB2 GLU 105 2.917 -10.691 -7.137 907 HB3 GLU 105 HB3 GLU 105 3.095 -9.519 -5.838 908 HG2 GLU 105 HG2 GLU 105 4.497 -8.848 -7.633 909 HG3 GLU 105 HG3 GLU 105 5.519 -9.329 -6.295 910 H ASP 106 H ASP 106 3.589 -9.970 -3.290 911 HA ASP 106 HA ASP 106 6.419 -10.115 -2.482 912 HB2 ASP 106 HB2 ASP 106 4.746 -7.683 -2.745 913 HB3 ASP 106 HB3 ASP 106 6.063 -7.722 -1.578 914 H GLY 107 H GLY 107 4.297 -11.819 -1.487 915 HA2 GLY 107 HA2 GLY 107 4.537 -13.094 0.449 916 HA3 GLY 107 HA3 GLY 107 5.471 -11.816 1.208 917 H PHE 108 H PHE 108 2.127 -11.674 -0.088 918 HA PHE 108 HA PHE 108 1.008 -11.870 2.570 919 HB2 PHE 108 HB2 PHE 108 -0.449 -9.777 2.265 920 HB3 PHE 108 HB3 PHE 108 1.162 -9.710 2.926 921 HD1 PHE 108 HD1 PHE 108 -0.999 -8.390 0.366 922 HD2 PHE 108 HD2 PHE 108 3.128 -8.948 1.470 923 HE1 PHE 108 HE1 PHE 108 -0.319 -6.584 -1.198 924 HE2 PHE 108 HE2 PHE 108 3.798 -7.188 -0.102 925 HZ PHE 108 HZ PHE 108 2.079 -5.983 -1.449 926 H LEU 109 H LEU 109 -1.333 -12.022 2.818 927 HA LEU 109 HA LEU 109 -2.243 -13.851 0.641 928 HB2 LEU 109 HB2 LEU 109 -1.821 -14.908 2.761 929 HB3 LEU 109 HB3 LEU 109 -2.811 -13.727 3.618 930 HG LEU 109 HG LEU 109 -4.852 -14.590 2.512 931 HD11 LEU 109 HD11 LEU 109 -2.916 -16.550 1.220 932 HD12 LEU 109 HD12 LEU 109 -4.678 -16.766 1.265 933 HD13 LEU 109 HD13 LEU 109 -3.983 -15.406 0.376 934 HD21 LEU 109 HD21 LEU 109 -3.167 -16.832 3.709 935 HD22 LEU 109 HD22 LEU 109 -4.029 -15.602 4.648 936 HD23 LEU 109 HD23 LEU 109 -4.937 -16.749 3.650 937 H TYR 110 H TYR 110 -3.690 -13.009 -0.735 938 HA TYR 110 HA TYR 110 -5.666 -11.061 0.212 939 HB2 TYR 110 HB2 TYR 110 -4.870 -11.934 -2.527 940 HB3 TYR 110 HB3 TYR 110 -6.410 -11.141 -2.255 941 HD1 TYR 110 HD1 TYR 110 -6.587 -8.788 -1.728 942 HD2 TYR 110 HD2 TYR 110 -2.730 -10.712 -1.999 943 HE1 TYR 110 HE1 TYR 110 -5.476 -6.562 -1.767 944 HE2 TYR 110 HE2 TYR 110 -1.631 -8.483 -2.059 945 HH TYR 110 HH TYR 110 -3.475 -5.421 -1.910 946 H MET 111 H MET 111 -7.784 -11.187 0.457 947 HA MET 111 HA MET 111 -9.198 -13.644 -0.448 948 HB2 MET 111 HB2 MET 111 -9.798 -12.274 2.199 949 HB3 MET 111 HB3 MET 111 -10.477 -13.771 1.550 950 HG2 MET 111 HG2 MET 111 -8.124 -14.746 1.692 951 HG3 MET 111 HG3 MET 111 -7.701 -13.327 2.659 952 HE1 MET 111 HE1 MET 111 -7.825 -16.263 5.221 953 HE2 MET 111 HE2 MET 111 -7.534 -16.553 3.493 954 HE3 MET 111 HE3 MET 111 -6.804 -15.146 4.296 955 H VAL 112 H VAL 112 -11.403 -13.314 -1.045 956 HA VAL 112 HA VAL 112 -12.322 -10.511 -0.916 957 HB VAL 112 HB VAL 112 -13.262 -10.311 -2.963 958 HG11 VAL 112 HG11 VAL 112 -10.783 -10.116 -2.985 959 HG12 VAL 112 HG12 VAL 112 -10.670 -11.812 -3.517 960 HG13 VAL 112 HG13 VAL 112 -11.454 -10.604 -4.548 961 HG21 VAL 112 HG21 VAL 112 -13.445 -12.019 -4.680 962 HG22 VAL 112 HG22 VAL 112 -12.713 -13.221 -3.608 963 HG23 VAL 112 HG23 VAL 112 -14.317 -12.534 -3.232 964 H TYR 113 H TYR 113 -14.165 -9.999 -0.212 965 HA TYR 113 HA TYR 113 -15.943 -12.057 0.891 966 HB2 TYR 113 HB2 TYR 113 -15.605 -10.614 2.536 967 HB3 TYR 113 HB3 TYR 113 -15.386 -9.242 1.483 968 HD1 TYR 113 HD1 TYR 113 -18.400 -11.509 2.006 969 HD2 TYR 113 HD2 TYR 113 -16.639 -7.576 2.365 970 HE1 TYR 113 HE1 TYR 113 -20.577 -10.575 2.805 971 HE2 TYR 113 HE2 TYR 113 -18.832 -6.661 3.118 972 HH TYR 113 HH TYR 113 -21.033 -7.134 3.619 973 H ALA 114 H ALA 114 -17.681 -12.847 -0.017 974 HA ALA 114 HA ALA 114 -18.959 -11.424 -2.330 975 HB1 ALA 114 HB1 ALA 114 -18.492 -13.395 -3.731 976 HB2 ALA 114 HB2 ALA 114 -16.979 -12.767 -3.077 977 HB3 ALA 114 HB3 ALA 114 -17.720 -14.215 -2.362 978 H SER 115 H SER 115 -20.617 -13.142 -3.277 979 HA SER 115 HA SER 115 -22.133 -14.561 -1.167 980 HB2 SER 115 HB2 SER 115 -24.263 -13.443 -2.144 981 HB3 SER 115 HB3 SER 115 -23.250 -12.589 -0.989 982 HG SER 115 HG SER 115 -23.629 -12.066 -3.700 983 H GLN 116 H GLN 116 -20.405 -15.413 -3.240 984 HA GLN 116 HA GLN 116 -22.050 -17.355 -4.718 985 HB2 GLN 116 HB2 GLN 116 -19.842 -15.724 -6.073 986 HB3 GLN 116 HB3 GLN 116 -20.922 -16.902 -6.800 987 HG2 GLN 116 HG2 GLN 116 -21.698 -14.861 -7.590 988 HG3 GLN 116 HG3 GLN 116 -22.842 -15.279 -6.323 989 HE21 GLN 116 HE21 GLN 116 -22.228 -11.769 -5.646 990 HE22 GLN 116 HE22 GLN 116 -23.274 -12.834 -6.579 991 H GLU 117 H GLU 117 -20.731 -19.242 -5.270 992 HA GLU 117 HA GLU 117 -18.627 -19.822 -3.427 993 HB2 GLU 117 HB2 GLU 117 -20.163 -21.476 -4.373 994 HB3 GLU 117 HB3 GLU 117 -19.499 -21.213 -5.995 995 HG2 GLU 117 HG2 GLU 117 -17.343 -22.142 -5.326 996 HG3 GLU 117 HG3 GLU 117 -17.891 -22.287 -3.647 997 H THR 118 H THR 118 -18.510 -18.430 -6.622 998 HA THR 118 HA THR 118 -15.744 -17.731 -6.340 999 HB THR 118 HB THR 118 -15.485 -20.014 -7.233 1000 HG1 THR 118 HG1 THR 118 -13.986 -18.418 -7.794 1001 HG21 THR 118 HG21 THR 118 -17.533 -20.226 -8.600 1002 HG22 THR 118 HG22 THR 118 -16.920 -18.987 -9.724 1003 HG23 THR 118 HG23 THR 118 -16.076 -20.537 -9.551 1004 H PHE 119 H PHE 119 -15.010 -16.312 -8.188 1005 HA PHE 119 HA PHE 119 -16.974 -14.345 -8.769 1006 HB2 PHE 119 HB2 PHE 119 -15.165 -13.397 -10.316 1007 HB3 PHE 119 HB3 PHE 119 -15.024 -13.377 -8.572 1008 HD1 PHE 119 HD1 PHE 119 -14.263 -16.408 -10.667 1009 HD2 PHE 119 HD2 PHE 119 -12.679 -13.061 -8.444 1010 HE1 PHE 119 HE1 PHE 119 -11.989 -17.370 -10.830 1011 HE2 PHE 119 HE2 PHE 119 -10.403 -14.029 -8.624 1012 HZ PHE 119 HZ PHE 119 -10.053 -16.193 -9.804 1013 H GLY 120 H GLY 120 -17.657 -13.391 -10.738 1014 HA2 GLY 120 HA2 GLY 120 -19.046 -15.261 -12.448 1015 HA3 GLY 120 HA3 GLY 120 -18.977 -13.509 -12.633 1016 H1 ASP 10 H1 ASP 10 -14.026 0.834 14.575 1017 H2 ASP 10 H2 ASP 10 -13.255 -0.434 15.251 1018 H3 ASP 10 H3 ASP 10 -14.446 0.350 16.083 1019 HA ASP 10 HA ASP 10 -13.134 2.380 16.062 1020 HB2 ASP 10 HB2 ASP 10 -12.014 0.043 17.590 1021 HB3 ASP 10 HB3 ASP 10 -11.398 1.693 17.750 1022 H TYR 11 H TYR 11 -10.414 0.100 15.898 1023 HA TYR 11 HA TYR 11 -9.420 1.471 13.465 1024 HB2 TYR 11 HB2 TYR 11 -7.191 1.795 14.477 1025 HB3 TYR 11 HB3 TYR 11 -8.468 2.790 15.143 1026 HD1 TYR 11 HD1 TYR 11 -9.073 2.675 17.510 1027 HD2 TYR 11 HD2 TYR 11 -6.377 -0.183 15.740 1028 HE1 TYR 11 HE1 TYR 11 -8.518 1.786 19.779 1029 HE2 TYR 11 HE2 TYR 11 -5.829 -1.063 17.996 1030 HH TYR 11 HH TYR 11 -6.259 -0.992 20.188 1031 H GLU 12 H GLU 12 -10.451 -1.269 14.064 1032 HA GLU 12 HA GLU 12 -8.411 -3.219 14.201 1033 HB2 GLU 12 HB2 GLU 12 -10.141 -4.775 13.751 1034 HB3 GLU 12 HB3 GLU 12 -10.711 -3.561 14.870 1035 HG2 GLU 12 HG2 GLU 12 -11.318 -3.310 11.903 1036 HG3 GLU 12 HG3 GLU 12 -12.209 -4.437 12.915 1037 H SER 13 H SER 13 -8.544 -1.242 11.635 1038 HA SER 13 HA SER 13 -7.073 -3.151 9.930 1039 HB2 SER 13 HB2 SER 13 -9.539 -1.683 9.017 1040 HB3 SER 13 HB3 SER 13 -8.269 -2.163 7.877 1041 HG SER 13 HG SER 13 -9.149 -4.124 9.672 1042 H ASP 14 H ASP 14 -6.386 -0.791 11.692 1043 HA ASP 14 HA ASP 14 -5.223 1.057 9.719 1044 HB2 ASP 14 HB2 ASP 14 -5.599 1.332 12.664 1045 HB3 ASP 14 HB3 ASP 14 -4.541 2.389 11.737 1046 H ASP 15 H ASP 15 -3.145 0.903 12.404 1047 HA ASP 15 HA ASP 15 -1.172 -0.694 10.986 1048 HB2 ASP 15 HB2 ASP 15 0.428 1.264 10.709 1049 HB3 ASP 15 HB3 ASP 15 -0.896 1.080 9.579 1050 H ASP 16 H ASP 16 1.034 -0.623 11.814 1051 HA ASP 16 HA ASP 16 2.449 -1.185 13.413 1052 HB2 ASP 16 HB2 ASP 16 1.573 1.510 14.388 1053 HB3 ASP 16 HB3 ASP 16 2.876 0.610 15.145 1054 H SER 17 H SER 17 0.589 0.167 16.071 1055 HA SER 17 HA SER 17 1.051 -2.334 17.551 1056 HB2 SER 17 HB2 SER 17 0.402 -0.973 19.506 1057 HB3 SER 17 HB3 SER 17 1.704 -0.228 18.569 1058 HG SER 17 HG SER 17 0.081 1.301 19.126 1059 H TYR 18 H TYR 18 -1.470 -1.258 15.666 1060 HA TYR 18 HA TYR 18 -3.755 -1.435 17.160 1061 HB2 TYR 18 HB2 TYR 18 -4.972 -1.772 15.131 1062 HB3 TYR 18 HB3 TYR 18 -3.739 -0.545 14.944 1063 HD1 TYR 18 HD1 TYR 18 -1.342 -2.564 14.183 1064 HD2 TYR 18 HD2 TYR 18 -5.451 -2.173 12.931 1065 HE1 TYR 18 HE1 TYR 18 -0.750 -3.507 12.009 1066 HE2 TYR 18 HE2 TYR 18 -4.825 -3.144 10.702 1067 HH TYR 18 HH TYR 18 -1.503 -4.155 9.895 1068 H GLU 19 H GLU 19 -5.006 -2.921 18.146 1069 HA GLU 19 HA GLU 19 -4.613 -5.760 17.897 1070 HB2 GLU 19 HB2 GLU 19 -6.934 -4.209 19.128 1071 HB3 GLU 19 HB3 GLU 19 -6.637 -5.935 19.258 1072 HG2 GLU 19 HG2 GLU 19 -5.805 -5.202 21.248 1073 HG3 GLU 19 HG3 GLU 19 -4.348 -5.346 20.276 1074 H VAL 20 H VAL 20 -4.660 -5.856 15.565 1075 HA VAL 20 HA VAL 20 -6.916 -5.343 14.001 1076 HB VAL 20 HB VAL 20 -5.249 -7.599 13.021 1077 HG11 VAL 20 HG11 VAL 20 -6.857 -6.373 11.582 1078 HG12 VAL 20 HG12 VAL 20 -6.014 -4.865 11.927 1079 HG13 VAL 20 HG13 VAL 20 -5.194 -6.133 11.005 1080 HG21 VAL 20 HG21 VAL 20 -3.442 -6.508 14.153 1081 HG22 VAL 20 HG22 VAL 20 -3.369 -6.007 12.459 1082 HG23 VAL 20 HG23 VAL 20 -4.029 -4.906 13.660 1083 H LEU 21 H LEU 21 -8.530 -6.586 12.938 1084 HA LEU 21 HA LEU 21 -10.226 -8.132 12.804 1085 HB2 LEU 21 HB2 LEU 21 -8.267 -9.648 12.325 1086 HB3 LEU 21 HB3 LEU 21 -8.277 -10.105 14.012 1087 HG LEU 21 HG LEU 21 -10.583 -11.083 13.693 1088 HD11 LEU 21 HD11 LEU 21 -9.927 -10.742 10.736 1089 HD12 LEU 21 HD12 LEU 21 -11.286 -11.636 11.408 1090 HD13 LEU 21 HD13 LEU 21 -11.224 -9.873 11.589 1091 HD21 LEU 21 HD21 LEU 21 -8.365 -12.180 11.933 1092 HD22 LEU 21 HD22 LEU 21 -8.512 -12.442 13.685 1093 HD23 LEU 21 HD23 LEU 21 -9.742 -13.089 12.595 1094 H ASP 22 H ASP 22 -9.498 -6.529 15.273 1095 HA ASP 22 HA ASP 22 -9.995 -6.057 17.276 1096 HB2 ASP 22 HB2 ASP 22 -12.433 -5.921 17.861 1097 HB3 ASP 22 HB3 ASP 22 -11.867 -5.152 16.392 1098 H LEU 23 H LEU 23 -10.467 -9.405 16.951 1099 HA LEU 23 HA LEU 23 -11.414 -9.970 19.565 1100 HB2 LEU 23 HB2 LEU 23 -11.446 -12.155 18.920 1101 HB3 LEU 23 HB3 LEU 23 -11.610 -11.326 17.388 1102 HG LEU 23 HG LEU 23 -9.081 -12.642 18.490 1103 HD11 LEU 23 HD11 LEU 23 -10.841 -14.225 17.783 1104 HD12 LEU 23 HD12 LEU 23 -10.917 -13.435 16.198 1105 HD13 LEU 23 HD13 LEU 23 -9.441 -14.287 16.708 1106 HD21 LEU 23 HD21 LEU 23 -8.121 -12.320 16.233 1107 HD22 LEU 23 HD22 LEU 23 -9.554 -11.380 15.772 1108 HD23 LEU 23 HD23 LEU 23 -8.438 -10.768 17.009 1109 H THR 24 H THR 24 -10.479 -11.220 21.256 1110 HA THR 24 HA THR 24 -8.084 -10.141 22.209 1111 HB THR 24 HB THR 24 -9.117 -12.543 23.597 1112 HG1 THR 24 HG1 THR 24 -10.941 -11.435 24.296 1113 HG21 THR 24 HG21 THR 24 -8.572 -9.677 24.506 1114 HG22 THR 24 HG22 THR 24 -8.997 -11.047 25.559 1115 HG23 THR 24 HG23 THR 24 -7.458 -11.048 24.694 1116 H GLU 25 H GLU 25 -8.138 -12.693 20.079 1117 HA GLU 25 HA GLU 25 -5.927 -14.265 21.083 1118 HB2 GLU 25 HB2 GLU 25 -6.963 -13.952 18.238 1119 HB3 GLU 25 HB3 GLU 25 -5.863 -15.207 18.778 1120 HG2 GLU 25 HG2 GLU 25 -8.744 -14.837 19.700 1121 HG3 GLU 25 HG3 GLU 25 -8.165 -16.017 18.537 1122 H TYR 26 H TYR 26 -5.976 -11.159 19.555 1123 HA TYR 26 HA TYR 26 -3.460 -11.274 18.231 1124 HB2 TYR 26 HB2 TYR 26 -4.945 -9.687 17.436 1125 HB3 TYR 26 HB3 TYR 26 -5.206 -8.995 19.031 1126 HD1 TYR 26 HD1 TYR 26 -3.342 -7.696 20.182 1127 HD2 TYR 26 HD2 TYR 26 -3.238 -8.782 16.011 1128 HE1 TYR 26 HE1 TYR 26 -1.550 -6.018 19.798 1129 HE2 TYR 26 HE2 TYR 26 -1.405 -7.117 15.635 1130 HH TYR 26 HH TYR 26 -0.264 -4.938 18.210 Start of MODEL 13 1 H1 MET 1 H1 MET 1 -7.514 2.195 8.464 2 H2 MET 1 H2 MET 1 -6.609 3.355 7.788 3 H3 MET 1 H3 MET 1 -7.802 3.775 8.807 4 HA MET 1 HA MET 1 -8.344 4.220 6.492 5 HB2 MET 1 HB2 MET 1 -7.127 2.441 5.410 6 HB3 MET 1 HB3 MET 1 -8.180 1.222 6.091 7 HG2 MET 1 HG2 MET 1 -8.871 1.442 3.917 8 HG3 MET 1 HG3 MET 1 -10.108 2.309 4.791 9 HE1 MET 1 HE1 MET 1 -10.046 5.798 3.324 10 HE2 MET 1 HE2 MET 1 -10.916 4.514 4.175 11 HE3 MET 1 HE3 MET 1 -9.593 5.391 4.981 12 HA PRO 2 HA PRO 2 -12.509 1.704 7.181 13 HB2 PRO 2 HB2 PRO 2 -12.045 1.281 10.166 14 HB3 PRO 2 HB3 PRO 2 -13.224 0.456 9.087 15 HG2 PRO 2 HG2 PRO 2 -10.853 -0.692 9.544 16 HG3 PRO 2 HG3 PRO 2 -11.409 -0.563 7.838 17 HD2 PRO 2 HD2 PRO 2 -9.506 1.223 9.352 18 HD3 PRO 2 HD3 PRO 2 -9.322 0.514 7.709 19 H SER 3 H SER 3 -13.416 3.580 6.606 20 HA SER 3 HA SER 3 -14.812 5.234 8.530 21 HB2 SER 3 HB2 SER 3 -13.659 7.363 7.995 22 HB3 SER 3 HB3 SER 3 -12.598 6.236 8.845 23 HG SER 3 HG SER 3 -11.612 5.709 6.895 24 H GLU 4 H GLU 4 -13.962 4.570 5.120 25 HA GLU 4 HA GLU 4 -16.408 5.895 4.199 26 HB2 GLU 4 HB2 GLU 4 -14.941 7.828 4.583 27 HB3 GLU 4 HB3 GLU 4 -13.709 7.117 3.529 28 HG2 GLU 4 HG2 GLU 4 -15.200 7.315 1.592 29 HG3 GLU 4 HG3 GLU 4 -16.522 7.847 2.635 30 H LYS 5 H LYS 5 -13.269 4.614 3.001 31 HA LYS 5 HA LYS 5 -14.645 3.253 0.761 32 HB2 LYS 5 HB2 LYS 5 -14.430 5.592 0.028 33 HB3 LYS 5 HB3 LYS 5 -12.687 5.550 0.297 34 HG2 LYS 5 HG2 LYS 5 -12.376 3.995 -1.543 35 HG3 LYS 5 HG3 LYS 5 -14.131 3.740 -1.689 36 HD2 LYS 5 HD2 LYS 5 -14.427 6.119 -2.328 37 HD3 LYS 5 HD3 LYS 5 -12.672 6.372 -2.192 38 HE2 LYS 5 HE2 LYS 5 -12.288 4.680 -3.971 39 HE3 LYS 5 HE3 LYS 5 -14.029 4.388 -4.079 40 HZ1 LYS 5 HZ1 LYS 5 -13.288 5.940 -5.801 41 HZ2 LYS 5 HZ2 LYS 5 -14.314 6.709 -4.796 42 HZ3 LYS 5 HZ3 LYS 5 -12.706 6.993 -4.698 43 H THR 6 H THR 6 -13.442 1.810 -0.443 44 HA THR 6 HA THR 6 -11.845 0.035 0.723 45 HB THR 6 HB THR 6 -11.401 0.446 -2.198 46 HG1 THR 6 HG1 THR 6 -13.511 -0.170 -2.632 47 HG21 THR 6 HG21 THR 6 -12.094 -1.940 -2.332 48 HG22 THR 6 HG22 THR 6 -10.722 -1.722 -1.224 49 HG23 THR 6 HG23 THR 6 -12.367 -1.956 -0.580 50 H PHE 7 H PHE 7 -9.788 -0.528 1.143 51 HA PHE 7 HA PHE 7 -7.975 1.339 1.827 52 HB2 PHE 7 HB2 PHE 7 -7.979 -0.773 2.770 53 HB3 PHE 7 HB3 PHE 7 -7.700 -1.535 1.201 54 HD1 PHE 7 HD1 PHE 7 -5.850 -2.854 1.279 55 HD2 PHE 7 HD2 PHE 7 -5.733 1.043 3.138 56 HE1 PHE 7 HE1 PHE 7 -3.549 -3.300 2.062 57 HE2 PHE 7 HE2 PHE 7 -3.453 0.553 3.987 58 HZ PHE 7 HZ PHE 7 -2.336 -1.603 3.404 59 H LYS 8 H LYS 8 -7.901 0.096 -1.447 60 HA LYS 8 HA LYS 8 -5.386 1.089 -2.331 61 HB2 LYS 8 HB2 LYS 8 -6.740 -0.393 -3.684 62 HB3 LYS 8 HB3 LYS 8 -8.089 0.730 -3.688 63 HG2 LYS 8 HG2 LYS 8 -7.032 0.686 -5.856 64 HG3 LYS 8 HG3 LYS 8 -6.897 2.278 -5.131 65 HD2 LYS 8 HD2 LYS 8 -4.488 1.693 -4.489 66 HD3 LYS 8 HD3 LYS 8 -4.716 0.147 -5.300 67 HE2 LYS 8 HE2 LYS 8 -3.496 1.697 -6.722 68 HE3 LYS 8 HE3 LYS 8 -5.042 1.259 -7.458 69 HZ1 LYS 8 HZ1 LYS 8 -5.925 3.424 -6.811 70 HZ2 LYS 8 HZ2 LYS 8 -4.568 3.809 -5.970 71 HZ3 LYS 8 HZ3 LYS 8 -4.523 3.668 -7.593 72 H GLN 9 H GLN 9 -8.288 2.922 -1.539 73 HA GLN 9 HA GLN 9 -7.618 5.398 -2.803 74 HB2 GLN 9 HB2 GLN 9 -9.800 4.780 -1.863 75 HB3 GLN 9 HB3 GLN 9 -9.162 4.819 -0.231 76 HG2 GLN 9 HG2 GLN 9 -9.174 7.233 -2.113 77 HG3 GLN 9 HG3 GLN 9 -10.524 6.823 -1.057 78 HE21 GLN 9 HE21 GLN 9 -8.942 6.049 1.340 79 HE22 GLN 9 HE22 GLN 9 -8.312 7.585 1.920 80 H ARG 10 H ARG 10 -6.466 3.930 0.226 81 HA ARG 10 HA ARG 10 -4.872 6.369 0.884 82 HB2 ARG 10 HB2 ARG 10 -6.419 5.526 2.581 83 HB3 ARG 10 HB3 ARG 10 -5.668 3.941 2.527 84 HG2 ARG 10 HG2 ARG 10 -4.974 5.060 4.512 85 HG3 ARG 10 HG3 ARG 10 -3.565 4.903 3.486 86 HD2 ARG 10 HD2 ARG 10 -5.262 7.432 3.671 87 HD3 ARG 10 HD3 ARG 10 -3.870 7.111 4.721 88 HE ARG 10 HE ARG 10 -2.803 6.794 2.206 89 HH11 ARG 10 HH11 ARG 10 -4.423 9.487 3.771 90 HH12 ARG 10 HH12 ARG 10 -3.639 10.664 2.753 91 HH21 ARG 10 HH21 ARG 10 -1.874 8.340 0.927 92 HH22 ARG 10 HH22 ARG 10 -2.214 10.022 1.198 93 H ARG 11 H ARG 11 -4.365 2.857 0.307 94 HA ARG 11 HA ARG 11 -1.394 3.355 0.510 95 HB2 ARG 11 HB2 ARG 11 -2.986 1.925 2.167 96 HB3 ARG 11 HB3 ARG 11 -2.615 0.654 1.027 97 HG2 ARG 11 HG2 ARG 11 -1.048 0.450 2.774 98 HG3 ARG 11 HG3 ARG 11 -0.128 1.179 1.466 99 HD2 ARG 11 HD2 ARG 11 -0.293 3.379 2.539 100 HD3 ARG 11 HD3 ARG 11 -1.455 2.770 3.716 101 HE ARG 11 HE ARG 11 0.449 1.186 4.464 102 HH11 ARG 11 HH11 ARG 11 2.126 1.477 5.807 103 HH12 ARG 11 HH12 ARG 11 2.948 3.020 5.907 104 HH21 ARG 11 HH21 ARG 11 1.163 4.511 3.380 105 HH22 ARG 11 HH22 ARG 11 2.372 4.692 4.612 106 H THR 12 H THR 12 -0.416 3.345 -1.351 107 HA THR 12 HA THR 12 -1.204 1.734 -3.682 108 HB THR 12 HB THR 12 0.777 2.782 -4.732 109 HG1 THR 12 HG1 THR 12 2.085 4.086 -3.598 110 HG21 THR 12 HG21 THR 12 -0.892 4.845 -3.219 111 HG22 THR 12 HG22 THR 12 0.030 5.098 -4.718 112 HG23 THR 12 HG23 THR 12 -1.383 4.031 -4.726 113 H PHE 13 H PHE 13 0.523 0.384 -4.808 114 HA PHE 13 HA PHE 13 1.078 -1.824 -3.259 115 HB2 PHE 13 HB2 PHE 13 0.868 -2.162 -5.518 116 HB3 PHE 13 HB3 PHE 13 2.071 -0.957 -5.929 117 HD1 PHE 13 HD1 PHE 13 1.587 -4.446 -4.821 118 HD2 PHE 13 HD2 PHE 13 4.476 -1.429 -5.902 119 HE1 PHE 13 HE1 PHE 13 3.339 -6.193 -5.045 120 HE2 PHE 13 HE2 PHE 13 6.225 -3.182 -6.112 121 HZ PHE 13 HZ PHE 13 5.650 -5.569 -5.678 122 H GLU 14 H GLU 14 3.619 0.594 -4.002 123 HA GLU 14 HA GLU 14 5.651 -0.832 -2.581 124 HB2 GLU 14 HB2 GLU 14 6.943 1.198 -2.666 125 HB3 GLU 14 HB3 GLU 14 6.134 0.908 -4.205 126 HG2 GLU 14 HG2 GLU 14 4.380 2.600 -3.534 127 HG3 GLU 14 HG3 GLU 14 5.324 2.934 -2.080 128 H GLN 15 H GLN 15 3.197 1.466 -1.401 129 HA GLN 15 HA GLN 15 4.271 1.668 1.305 130 HB2 GLN 15 HB2 GLN 15 1.494 2.175 0.172 131 HB3 GLN 15 HB3 GLN 15 2.001 2.523 1.822 132 HG2 GLN 15 HG2 GLN 15 3.653 4.154 1.005 133 HG3 GLN 15 HG3 GLN 15 3.179 3.813 -0.668 134 HE21 GLN 15 HE21 GLN 15 0.305 5.901 -0.502 135 HE22 GLN 15 HE22 GLN 15 1.338 4.871 -1.504 136 H ARG 16 H ARG 16 1.903 -0.464 -0.310 137 HA ARG 16 HA ARG 16 1.176 -1.953 2.095 138 HB2 ARG 16 HB2 ARG 16 0.930 -2.631 -0.869 139 HB3 ARG 16 HB3 ARG 16 0.270 -3.608 0.444 140 HG2 ARG 16 HG2 ARG 16 -1.007 -1.544 1.227 141 HG3 ARG 16 HG3 ARG 16 -0.525 -0.757 -0.279 142 HD2 ARG 16 HD2 ARG 16 -2.234 -3.220 0.079 143 HD3 ARG 16 HD3 ARG 16 -2.755 -1.666 -0.544 144 HE ARG 16 HE ARG 16 -1.055 -3.718 -1.946 145 HH11 ARG 16 HH11 ARG 16 -1.139 -3.948 -3.912 146 HH12 ARG 16 HH12 ARG 16 -1.943 -2.824 -5.017 147 HH21 ARG 16 HH21 ARG 16 -2.729 -0.625 -2.404 148 HH22 ARG 16 HH22 ARG 16 -2.875 -0.955 -4.116 149 H VAL 17 H VAL 17 3.679 -2.451 -0.380 150 HA VAL 17 HA VAL 17 4.715 -4.910 0.700 151 HB VAL 17 HB VAL 17 5.951 -2.697 -0.979 152 HG11 VAL 17 HG11 VAL 17 7.831 -4.272 -1.439 153 HG12 VAL 17 HG12 VAL 17 7.838 -3.700 0.226 154 HG13 VAL 17 HG13 VAL 17 7.243 -5.335 -0.144 155 HG21 VAL 17 HG21 VAL 17 5.198 -5.591 -1.608 156 HG22 VAL 17 HG22 VAL 17 4.217 -4.181 -2.032 157 HG23 VAL 17 HG23 VAL 17 5.815 -4.382 -2.755 158 H GLU 18 H GLU 18 5.527 -1.427 1.503 159 HA GLU 18 HA GLU 18 7.353 -2.205 3.590 160 HB2 GLU 18 HB2 GLU 18 5.713 0.320 3.212 161 HB3 GLU 18 HB3 GLU 18 6.786 0.074 4.583 162 HG2 GLU 18 HG2 GLU 18 7.626 0.059 1.664 163 HG3 GLU 18 HG3 GLU 18 7.843 1.380 2.809 164 H ASP 19 H ASP 19 3.793 -1.545 3.813 165 HA ASP 19 HA ASP 19 3.511 -2.215 6.552 166 HB2 ASP 19 HB2 ASP 19 1.604 -2.593 4.246 167 HB3 ASP 19 HB3 ASP 19 1.206 -3.030 5.893 168 H VAL 20 H VAL 20 3.504 -4.561 3.837 169 HA VAL 20 HA VAL 20 3.255 -6.765 5.619 170 HB VAL 20 HB VAL 20 2.789 -6.621 3.046 171 HG11 VAL 20 HG11 VAL 20 5.475 -8.085 3.077 172 HG12 VAL 20 HG12 VAL 20 4.345 -7.933 1.729 173 HG13 VAL 20 HG13 VAL 20 5.172 -6.503 2.315 174 HG21 VAL 20 HG21 VAL 20 2.081 -8.385 4.580 175 HG22 VAL 20 HG22 VAL 20 2.655 -9.059 3.052 176 HG23 VAL 20 HG23 VAL 20 3.696 -9.144 4.489 177 H ARG 21 H ARG 21 6.171 -5.298 4.265 178 HA ARG 21 HA ARG 21 8.102 -7.159 5.306 179 HB2 ARG 21 HB2 ARG 21 8.670 -5.596 3.561 180 HB3 ARG 21 HB3 ARG 21 8.168 -4.214 4.532 181 HG2 ARG 21 HG2 ARG 21 10.057 -4.551 6.072 182 HG3 ARG 21 HG3 ARG 21 10.577 -5.974 5.146 183 HD2 ARG 21 HD2 ARG 21 10.983 -4.585 3.179 184 HD3 ARG 21 HD3 ARG 21 10.277 -3.179 3.971 185 HE ARG 21 HE ARG 21 12.865 -4.500 4.676 186 HH11 ARG 21 HH11 ARG 21 10.928 -1.517 4.769 187 HH12 ARG 21 HH12 ARG 21 12.245 -0.642 5.500 188 HH21 ARG 21 HH21 ARG 21 14.160 -1.584 5.938 189 HH22 ARG 21 HH22 ARG 21 14.445 -3.265 5.614 190 H LEU 22 H LEU 22 6.919 -4.063 6.636 191 HA LEU 22 HA LEU 22 8.441 -4.158 9.045 192 HB2 LEU 22 HB2 LEU 22 5.837 -2.746 8.342 193 HB3 LEU 22 HB3 LEU 22 6.727 -2.464 9.831 194 HG LEU 22 HG LEU 22 8.025 -2.042 7.102 195 HD11 LEU 22 HD11 LEU 22 6.612 0.017 8.843 196 HD12 LEU 22 HD12 LEU 22 7.531 0.342 7.345 197 HD13 LEU 22 HD13 LEU 22 6.033 -0.591 7.275 198 HD21 LEU 22 HD21 LEU 22 8.691 -0.975 9.872 199 HD22 LEU 22 HD22 LEU 22 9.590 -2.236 8.995 200 HD23 LEU 22 HD23 LEU 22 9.544 -0.589 8.363 201 H ILE 23 H ILE 23 4.971 -5.166 8.492 202 HA ILE 23 HA ILE 23 4.670 -5.953 11.191 203 HB ILE 23 HB ILE 23 2.891 -5.453 9.490 204 HG12 ILE 23 HG12 ILE 23 2.560 -6.368 11.838 205 HG13 ILE 23 HG13 ILE 23 1.258 -6.419 10.674 206 HG21 ILE 23 HG21 ILE 23 1.854 -7.228 8.219 207 HG22 ILE 23 HG22 ILE 23 3.534 -7.042 7.723 208 HG23 ILE 23 HG23 ILE 23 3.084 -8.411 8.737 209 HD11 ILE 23 HD11 ILE 23 2.954 -8.852 11.362 210 HD12 ILE 23 HD12 ILE 23 1.422 -8.447 12.126 211 HD13 ILE 23 HD13 ILE 23 1.459 -8.818 10.398 212 H ARG 24 H ARG 24 5.743 -7.936 8.392 213 HA ARG 24 HA ARG 24 5.873 -10.416 9.806 214 HB2 ARG 24 HB2 ARG 24 6.022 -10.142 7.326 215 HB3 ARG 24 HB3 ARG 24 7.604 -9.392 7.512 216 HG2 ARG 24 HG2 ARG 24 7.894 -11.667 6.783 217 HG3 ARG 24 HG3 ARG 24 8.506 -11.531 8.426 218 HD2 ARG 24 HD2 ARG 24 6.361 -12.514 9.272 219 HD3 ARG 24 HD3 ARG 24 5.792 -12.667 7.607 220 HE ARG 24 HE ARG 24 8.063 -14.157 8.896 221 HH11 ARG 24 HH11 ARG 24 5.733 -14.141 6.182 222 HH12 ARG 24 HH12 ARG 24 6.044 -15.864 5.949 223 HH21 ARG 24 HH21 ARG 24 8.296 -16.345 8.313 224 HH22 ARG 24 HH22 ARG 24 7.292 -16.945 6.991 225 H GLU 25 H GLU 25 8.175 -7.698 9.755 226 HA GLU 25 HA GLU 25 10.117 -9.079 11.432 227 HB2 GLU 25 HB2 GLU 25 9.754 -6.157 10.709 228 HB3 GLU 25 HB3 GLU 25 11.050 -6.741 11.737 229 HG2 GLU 25 HG2 GLU 25 10.574 -7.669 8.878 230 HG3 GLU 25 HG3 GLU 25 11.697 -6.401 9.353 231 H GLN 26 H GLN 26 7.654 -6.518 12.285 232 HA GLN 26 HA GLN 26 8.512 -6.866 15.076 233 HB2 GLN 26 HB2 GLN 26 7.325 -4.887 15.645 234 HB3 GLN 26 HB3 GLN 26 8.418 -4.671 14.299 235 HG2 GLN 26 HG2 GLN 26 6.544 -3.358 13.827 236 HG3 GLN 26 HG3 GLN 26 6.463 -4.715 12.728 237 HE21 GLN 26 HE21 GLN 26 3.033 -4.740 13.607 238 HE22 GLN 26 HE22 GLN 26 4.198 -4.248 12.418 239 H HIS 27 H HIS 27 5.834 -8.186 13.342 240 HA HIS 27 HA HIS 27 5.016 -9.478 15.917 241 HB2 HIS 27 HB2 HIS 27 3.088 -8.381 13.840 242 HB3 HIS 27 HB3 HIS 27 2.626 -9.508 15.115 243 HD1 HIS 27 HD1 HIS 27 4.252 -7.816 17.496 244 HD2 HIS 27 HD2 HIS 27 1.292 -6.620 14.733 245 HE1 HIS 27 HE1 HIS 27 2.928 -5.921 18.622 246 HE2 HIS 27 HE2 HIS 27 1.155 -5.156 16.911 247 HA PRO 28 HA PRO 28 6.241 -12.399 12.484 248 HB2 PRO 28 HB2 PRO 28 7.439 -13.840 14.854 249 HB3 PRO 28 HB3 PRO 28 8.078 -13.666 13.185 250 HG2 PRO 28 HG2 PRO 28 9.076 -12.131 15.168 251 HG3 PRO 28 HG3 PRO 28 8.687 -11.382 13.584 252 HD2 PRO 28 HD2 PRO 28 7.018 -11.393 16.113 253 HD3 PRO 28 HD3 PRO 28 7.433 -10.030 15.042 254 H THR 29 H THR 29 4.695 -13.088 15.624 255 HA THR 29 HA THR 29 3.567 -15.629 14.838 256 HB THR 29 HB THR 29 2.504 -15.744 16.874 257 HG1 THR 29 HG1 THR 29 2.150 -13.919 18.177 258 HG21 THR 29 HG21 THR 29 4.879 -13.952 17.561 259 HG22 THR 29 HG22 THR 29 4.131 -15.212 18.564 260 HG23 THR 29 HG23 THR 29 5.022 -15.671 17.103 261 H LYS 30 H LYS 30 2.679 -12.570 13.778 262 HA LYS 30 HA LYS 30 -0.135 -13.465 13.293 263 HB2 LYS 30 HB2 LYS 30 0.921 -10.635 13.610 264 HB3 LYS 30 HB3 LYS 30 -0.717 -11.067 13.081 265 HG2 LYS 30 HG2 LYS 30 -1.105 -12.295 15.184 266 HG3 LYS 30 HG3 LYS 30 0.529 -11.899 15.733 267 HD2 LYS 30 HD2 LYS 30 -0.034 -9.499 15.790 268 HD3 LYS 30 HD3 LYS 30 -1.630 -9.837 15.105 269 HE2 LYS 30 HE2 LYS 30 -1.888 -9.520 17.493 270 HE3 LYS 30 HE3 LYS 30 -2.232 -11.196 17.086 271 HZ1 LYS 30 HZ1 LYS 30 0.073 -11.749 17.889 272 HZ2 LYS 30 HZ2 LYS 30 0.298 -10.180 18.324 273 HZ3 LYS 30 HZ3 LYS 30 -0.842 -11.097 19.062 274 H ILE 31 H ILE 31 -1.034 -13.338 11.446 275 HA ILE 31 HA ILE 31 0.726 -13.402 9.076 276 HB ILE 31 HB ILE 31 -2.014 -14.599 9.661 277 HG12 ILE 31 HG12 ILE 31 -0.389 -15.636 11.117 278 HG13 ILE 31 HG13 ILE 31 -0.849 -16.752 9.847 279 HG21 ILE 31 HG21 ILE 31 -0.133 -14.909 7.309 280 HG22 ILE 31 HG22 ILE 31 -1.485 -16.022 7.655 281 HG23 ILE 31 HG23 ILE 31 -1.807 -14.321 7.288 282 HD11 ILE 31 HD11 ILE 31 1.295 -16.298 8.656 283 HD12 ILE 31 HD12 ILE 31 1.774 -15.199 9.969 284 HD13 ILE 31 HD13 ILE 31 1.536 -16.920 10.295 285 HA PRO 32 HA PRO 32 -1.649 -9.792 7.727 286 HB2 PRO 32 HB2 PRO 32 -0.206 -9.032 5.574 287 HB3 PRO 32 HB3 PRO 32 0.441 -8.907 7.235 288 HG2 PRO 32 HG2 PRO 32 0.962 -11.113 5.220 289 HG3 PRO 32 HG3 PRO 32 2.152 -10.222 6.222 290 HD2 PRO 32 HD2 PRO 32 1.122 -12.678 6.918 291 HD3 PRO 32 HD3 PRO 32 1.630 -11.451 8.122 292 H VAL 33 H VAL 33 -3.488 -9.688 6.611 293 HA VAL 33 HA VAL 33 -3.918 -11.345 4.169 294 HB VAL 33 HB VAL 33 -5.870 -11.225 6.488 295 HG11 VAL 33 HG11 VAL 33 -6.918 -11.611 4.279 296 HG12 VAL 33 HG12 VAL 33 -5.816 -12.977 3.998 297 HG13 VAL 33 HG13 VAL 33 -7.023 -13.028 5.311 298 HG21 VAL 33 HG21 VAL 33 -5.353 -13.615 6.888 299 HG22 VAL 33 HG22 VAL 33 -3.973 -13.491 5.770 300 HG23 VAL 33 HG23 VAL 33 -4.004 -12.553 7.283 301 H ILE 34 H ILE 34 -5.003 -10.286 2.580 302 HA ILE 34 HA ILE 34 -6.539 -7.808 3.300 303 HB ILE 34 HB ILE 34 -4.757 -8.405 1.001 304 HG12 ILE 34 HG12 ILE 34 -4.395 -5.988 1.056 305 HG13 ILE 34 HG13 ILE 34 -5.716 -5.767 2.197 306 HG21 ILE 34 HG21 ILE 34 -7.312 -6.800 0.570 307 HG22 ILE 34 HG22 ILE 34 -5.921 -6.876 -0.533 308 HG23 ILE 34 HG23 ILE 34 -6.873 -8.327 -0.236 309 HD11 ILE 34 HD11 ILE 34 -3.384 -5.643 3.169 310 HD12 ILE 34 HD12 ILE 34 -4.472 -6.772 3.986 311 HD13 ILE 34 HD13 ILE 34 -3.228 -7.384 2.870 312 H ILE 35 H ILE 35 -8.620 -7.638 2.700 313 HA ILE 35 HA ILE 35 -9.925 -9.952 1.386 314 HB ILE 35 HB ILE 35 -10.250 -10.369 3.729 315 HG12 ILE 35 HG12 ILE 35 -12.793 -9.244 2.441 316 HG13 ILE 35 HG13 ILE 35 -12.113 -10.846 2.159 317 HG21 ILE 35 HG21 ILE 35 -9.957 -7.973 4.537 318 HG22 ILE 35 HG22 ILE 35 -11.610 -7.646 3.999 319 HG23 ILE 35 HG23 ILE 35 -11.306 -8.836 5.274 320 HD11 ILE 35 HD11 ILE 35 -13.301 -9.787 4.760 321 HD12 ILE 35 HD12 ILE 35 -13.965 -11.020 3.696 322 HD13 ILE 35 HD13 ILE 35 -12.472 -11.355 4.609 323 H GLU 36 H GLU 36 -11.290 -9.312 -0.234 324 HA GLU 36 HA GLU 36 -12.352 -6.491 -0.130 325 HB2 GLU 36 HB2 GLU 36 -10.255 -6.773 -1.543 326 HB3 GLU 36 HB3 GLU 36 -11.191 -7.844 -2.603 327 HG2 GLU 36 HG2 GLU 36 -12.773 -5.980 -3.046 328 HG3 GLU 36 HG3 GLU 36 -11.874 -4.941 -1.936 329 H ARG 37 H ARG 37 -14.312 -6.154 -0.714 330 HA ARG 37 HA ARG 37 -16.226 -8.310 -1.068 331 HB2 ARG 37 HB2 ARG 37 -16.487 -6.131 0.053 332 HB3 ARG 37 HB3 ARG 37 -16.394 -5.290 -1.500 333 HG2 ARG 37 HG2 ARG 37 -18.504 -6.382 -2.211 334 HG3 ARG 37 HG3 ARG 37 -18.574 -7.264 -0.672 335 HD2 ARG 37 HD2 ARG 37 -18.606 -4.216 -0.981 336 HD3 ARG 37 HD3 ARG 37 -19.991 -5.239 -0.634 337 HE ARG 37 HE ARG 37 -19.235 -5.669 1.550 338 HH11 ARG 37 HH11 ARG 37 -16.953 -3.344 0.138 339 HH12 ARG 37 HH12 ARG 37 -16.207 -3.113 1.702 340 HH21 ARG 37 HH21 ARG 37 -18.160 -5.348 3.364 341 HH22 ARG 37 HH22 ARG 37 -16.835 -4.180 3.439 342 H TYR 38 H TYR 38 -17.074 -9.119 -2.977 343 HA TYR 38 HA TYR 38 -15.433 -9.071 -5.164 344 HB2 TYR 38 HB2 TYR 38 -16.697 -10.941 -4.968 345 HB3 TYR 38 HB3 TYR 38 -18.211 -10.048 -4.856 346 HD1 TYR 38 HD1 TYR 38 -15.405 -10.506 -7.341 347 HD2 TYR 38 HD2 TYR 38 -19.669 -10.232 -6.674 348 HE1 TYR 38 HE1 TYR 38 -15.806 -10.810 -9.771 349 HE2 TYR 38 HE2 TYR 38 -20.057 -10.578 -9.110 350 HH TYR 38 HH TYR 38 -17.389 -10.647 -11.468 351 H LYS 39 H LYS 39 -14.840 -7.852 -6.747 352 HA LYS 39 HA LYS 39 -15.630 -5.198 -6.957 353 HB2 LYS 39 HB2 LYS 39 -14.253 -6.964 -9.033 354 HB3 LYS 39 HB3 LYS 39 -14.378 -5.206 -9.148 355 HG2 LYS 39 HG2 LYS 39 -13.162 -4.940 -7.022 356 HG3 LYS 39 HG3 LYS 39 -13.000 -6.702 -6.875 357 HD2 LYS 39 HD2 LYS 39 -11.742 -6.771 -9.012 358 HD3 LYS 39 HD3 LYS 39 -11.898 -5.004 -9.162 359 HE2 LYS 39 HE2 LYS 39 -10.680 -4.717 -7.017 360 HE3 LYS 39 HE3 LYS 39 -10.515 -6.468 -6.862 361 HZ1 LYS 39 HZ1 LYS 39 -9.339 -4.828 -9.059 362 HZ2 LYS 39 HZ2 LYS 39 -8.510 -5.479 -7.815 363 HZ3 LYS 39 HZ3 LYS 39 -9.191 -6.455 -8.931 364 H GLY 40 H GLY 40 -16.909 -7.917 -8.848 365 HA2 GLY 40 HA2 GLY 40 -18.389 -6.301 -10.760 366 HA3 GLY 40 HA3 GLY 40 -18.467 -8.043 -10.558 367 H GLU 41 H GLU 41 -19.193 -7.437 -7.532 368 HA GLU 41 HA GLU 41 -21.789 -6.158 -7.720 369 HB2 GLU 41 HB2 GLU 41 -22.444 -8.355 -8.595 370 HB3 GLU 41 HB3 GLU 41 -21.658 -9.155 -7.248 371 HG2 GLU 41 HG2 GLU 41 -23.954 -9.247 -6.787 372 HG3 GLU 41 HG3 GLU 41 -23.299 -8.067 -5.670 373 H LYS 42 H LYS 42 -21.628 -4.869 -6.040 374 HA LYS 42 HA LYS 42 -20.577 -5.821 -3.419 375 HB2 LYS 42 HB2 LYS 42 -21.268 -3.037 -4.397 376 HB3 LYS 42 HB3 LYS 42 -20.572 -3.449 -2.823 377 HG2 LYS 42 HG2 LYS 42 -18.519 -4.280 -3.880 378 HG3 LYS 42 HG3 LYS 42 -19.190 -4.012 -5.492 379 HD2 LYS 42 HD2 LYS 42 -19.383 -1.578 -5.022 380 HD3 LYS 42 HD3 LYS 42 -18.632 -1.834 -3.435 381 HE2 LYS 42 HE2 LYS 42 -16.575 -2.677 -4.508 382 HE3 LYS 42 HE3 LYS 42 -17.335 -2.575 -6.105 383 HZ1 LYS 42 HZ1 LYS 42 -15.930 -0.634 -5.687 384 HZ2 LYS 42 HZ2 LYS 42 -17.481 -0.152 -5.824 385 HZ3 LYS 42 HZ3 LYS 42 -16.771 -0.226 -4.348 386 H GLN 43 H GLN 43 -22.697 -7.136 -3.750 387 HA GLN 43 HA GLN 43 -25.239 -5.941 -3.089 388 HB2 GLN 43 HB2 GLN 43 -25.980 -8.225 -2.702 389 HB3 GLN 43 HB3 GLN 43 -25.208 -7.989 -4.263 390 HG2 GLN 43 HG2 GLN 43 -24.508 -9.721 -1.970 391 HG3 GLN 43 HG3 GLN 43 -24.641 -10.083 -3.675 392 HE21 GLN 43 HE21 GLN 43 -21.169 -9.937 -4.140 393 HE22 GLN 43 HE22 GLN 43 -22.681 -10.743 -4.564 394 H LEU 44 H LEU 44 -22.825 -7.554 -1.064 395 HA LEU 44 HA LEU 44 -24.417 -7.158 1.360 396 HB2 LEU 44 HB2 LEU 44 -21.655 -8.282 0.780 397 HB3 LEU 44 HB3 LEU 44 -22.389 -8.290 2.393 398 HG LEU 44 HG LEU 44 -23.626 -9.636 -0.063 399 HD11 LEU 44 HD11 LEU 44 -22.126 -10.898 2.262 400 HD12 LEU 44 HD12 LEU 44 -22.851 -11.737 0.878 401 HD13 LEU 44 HD13 LEU 44 -21.455 -10.671 0.625 402 HD21 LEU 44 HD21 LEU 44 -24.331 -9.784 2.892 403 HD22 LEU 44 HD22 LEU 44 -25.340 -9.139 1.572 404 HD23 LEU 44 HD23 LEU 44 -24.976 -10.861 1.635 405 HA PRO 45 HA PRO 45 -23.423 -3.284 2.791 406 HB2 PRO 45 HB2 PRO 45 -22.035 -4.502 5.190 407 HB3 PRO 45 HB3 PRO 45 -23.163 -3.105 5.143 408 HG2 PRO 45 HG2 PRO 45 -24.114 -5.559 5.795 409 HG3 PRO 45 HG3 PRO 45 -25.026 -4.548 4.625 410 HD2 PRO 45 HD2 PRO 45 -23.201 -6.887 4.078 411 HD3 PRO 45 HD3 PRO 45 -24.742 -6.429 3.284 412 H VAL 46 H VAL 46 -22.010 -1.796 2.140 413 HA VAL 46 HA VAL 46 -19.423 -2.606 1.296 414 HB VAL 46 HB VAL 46 -19.370 -0.623 -0.001 415 HG11 VAL 46 HG11 VAL 46 -21.352 -0.840 -1.315 416 HG12 VAL 46 HG12 VAL 46 -20.972 -2.447 -0.671 417 HG13 VAL 46 HG13 VAL 46 -22.286 -1.490 0.040 418 HG21 VAL 46 HG21 VAL 46 -20.129 1.108 1.598 419 HG22 VAL 46 HG22 VAL 46 -21.083 1.148 0.116 420 HG23 VAL 46 HG23 VAL 46 -21.760 0.413 1.579 421 H LEU 47 H LEU 47 -19.321 -2.588 4.090 422 HA LEU 47 HA LEU 47 -17.872 -0.318 5.131 423 HB2 LEU 47 HB2 LEU 47 -17.782 -3.234 6.001 424 HB3 LEU 47 HB3 LEU 47 -17.214 -1.860 6.947 425 HG LEU 47 HG LEU 47 -20.124 -2.346 6.144 426 HD11 LEU 47 HD11 LEU 47 -18.691 -2.687 8.815 427 HD12 LEU 47 HD12 LEU 47 -20.430 -2.886 8.522 428 HD13 LEU 47 HD13 LEU 47 -19.277 -3.996 7.763 429 HD21 LEU 47 HD21 LEU 47 -20.619 -0.582 7.819 430 HD22 LEU 47 HD22 LEU 47 -18.878 -0.277 8.015 431 HD23 LEU 47 HD23 LEU 47 -19.685 0.057 6.464 432 H ASP 48 H ASP 48 -15.725 0.223 5.168 433 HA ASP 48 HA ASP 48 -14.051 -1.045 3.181 434 HB2 ASP 48 HB2 ASP 48 -12.568 0.916 3.497 435 HB3 ASP 48 HB3 ASP 48 -14.195 1.211 2.930 436 H LYS 49 H LYS 49 -14.277 -2.863 5.170 437 HA LYS 49 HA LYS 49 -11.899 -2.773 6.919 438 HB2 LYS 49 HB2 LYS 49 -13.878 -5.069 6.540 439 HB3 LYS 49 HB3 LYS 49 -12.716 -4.840 7.848 440 HG2 LYS 49 HG2 LYS 49 -14.055 -2.581 8.269 441 HG3 LYS 49 HG3 LYS 49 -15.299 -3.368 7.303 442 HD2 LYS 49 HD2 LYS 49 -15.920 -4.006 9.476 443 HD3 LYS 49 HD3 LYS 49 -15.012 -5.408 8.935 444 HE2 LYS 49 HE2 LYS 49 -14.084 -5.072 11.023 445 HE3 LYS 49 HE3 LYS 49 -12.920 -4.219 10.025 446 HZ1 LYS 49 HZ1 LYS 49 -13.644 -2.960 12.040 447 HZ2 LYS 49 HZ2 LYS 49 -13.973 -2.105 10.670 448 HZ3 LYS 49 HZ3 LYS 49 -15.172 -2.871 11.483 449 H THR 50 H THR 50 -10.943 -2.557 4.396 450 HA THR 50 HA THR 50 -10.625 -5.002 3.044 451 HB THR 50 HB THR 50 -8.661 -2.914 2.447 452 HG1 THR 50 HG1 THR 50 -11.429 -2.573 1.907 453 HG21 THR 50 HG21 THR 50 -9.331 -3.266 0.128 454 HG22 THR 50 HG22 THR 50 -8.897 -4.808 0.882 455 HG23 THR 50 HG23 THR 50 -10.611 -4.382 0.640 456 H LYS 51 H LYS 51 -8.670 -4.059 5.674 457 HA LYS 51 HA LYS 51 -6.654 -6.164 4.958 458 HB2 LYS 51 HB2 LYS 51 -4.860 -4.821 5.865 459 HB3 LYS 51 HB3 LYS 51 -5.672 -3.955 4.560 460 HG2 LYS 51 HG2 LYS 51 -6.951 -2.633 6.278 461 HG3 LYS 51 HG3 LYS 51 -6.023 -3.425 7.555 462 HD2 LYS 51 HD2 LYS 51 -4.845 -1.733 5.317 463 HD3 LYS 51 HD3 LYS 51 -5.212 -1.146 6.941 464 HE2 LYS 51 HE2 LYS 51 -3.623 -2.842 7.899 465 HE3 LYS 51 HE3 LYS 51 -3.172 -3.324 6.255 466 HZ1 LYS 51 HZ1 LYS 51 -2.279 -1.085 5.881 467 HZ2 LYS 51 HZ2 LYS 51 -2.836 -0.554 7.337 468 HZ3 LYS 51 HZ3 LYS 51 -1.629 -1.663 7.257 469 H PHE 52 H PHE 52 -5.876 -7.441 6.509 470 HA PHE 52 HA PHE 52 -6.686 -7.161 9.306 471 HB2 PHE 52 HB2 PHE 52 -7.602 -9.400 7.533 472 HB3 PHE 52 HB3 PHE 52 -7.359 -9.664 9.245 473 HD1 PHE 52 HD1 PHE 52 -8.583 -8.203 10.953 474 HD2 PHE 52 HD2 PHE 52 -9.608 -8.345 6.783 475 HE1 PHE 52 HE1 PHE 52 -10.851 -7.319 11.483 476 HE2 PHE 52 HE2 PHE 52 -11.881 -7.464 7.305 477 HZ PHE 52 HZ PHE 52 -12.502 -6.974 9.660 478 H LEU 53 H LEU 53 -5.696 -8.457 10.842 479 HA LEU 53 HA LEU 53 -3.175 -9.858 10.064 480 HB2 LEU 53 HB2 LEU 53 -3.683 -7.763 12.146 481 HB3 LEU 53 HB3 LEU 53 -2.884 -9.197 12.736 482 HG LEU 53 HG LEU 53 -1.032 -8.915 11.182 483 HD11 LEU 53 HD11 LEU 53 -0.752 -6.888 9.828 484 HD12 LEU 53 HD12 LEU 53 -2.166 -7.777 9.286 485 HD13 LEU 53 HD13 LEU 53 -2.367 -6.328 10.296 486 HD21 LEU 53 HD21 LEU 53 -0.239 -6.682 12.231 487 HD22 LEU 53 HD22 LEU 53 -1.866 -6.534 12.885 488 HD23 LEU 53 HD23 LEU 53 -0.855 -7.897 13.363 489 H VAL 54 H VAL 54 -3.060 -11.926 10.966 490 HA VAL 54 HA VAL 54 -5.178 -12.698 12.916 491 HB VAL 54 HB VAL 54 -4.490 -14.543 10.647 492 HG11 VAL 54 HG11 VAL 54 -6.667 -15.518 11.176 493 HG12 VAL 54 HG12 VAL 54 -5.683 -15.416 12.647 494 HG13 VAL 54 HG13 VAL 54 -6.989 -14.245 12.369 495 HG21 VAL 54 HG21 VAL 54 -6.730 -12.487 10.562 496 HG22 VAL 54 HG22 VAL 54 -5.316 -12.566 9.477 497 HG23 VAL 54 HG23 VAL 54 -6.520 -13.854 9.442 498 HA PRO 55 HA PRO 55 -1.657 -14.645 14.942 499 HB2 PRO 55 HB2 PRO 55 -3.796 -16.214 16.369 500 HB3 PRO 55 HB3 PRO 55 -2.351 -15.393 17.035 501 HG2 PRO 55 HG2 PRO 55 -4.812 -14.261 17.269 502 HG3 PRO 55 HG3 PRO 55 -3.387 -13.253 16.862 503 HD2 PRO 55 HD2 PRO 55 -5.509 -14.346 14.996 504 HD3 PRO 55 HD3 PRO 55 -4.777 -12.713 15.059 505 H ASP 56 H ASP 56 -0.477 -16.439 14.434 506 HA ASP 56 HA ASP 56 -1.131 -17.861 12.176 507 HB2 ASP 56 HB2 ASP 56 0.849 -19.316 12.710 508 HB3 ASP 56 HB3 ASP 56 1.104 -17.575 12.692 509 H HIS 57 H HIS 57 -1.927 -18.948 15.378 510 HA HIS 57 HA HIS 57 -2.585 -21.688 14.593 511 HB2 HIS 57 HB2 HIS 57 -2.901 -20.099 17.163 512 HB3 HIS 57 HB3 HIS 57 -3.560 -21.709 16.980 513 HD1 HIS 57 HD1 HIS 57 0.016 -20.172 16.455 514 HD2 HIS 57 HD2 HIS 57 -2.081 -23.534 17.949 515 HE1 HIS 57 HE1 HIS 57 1.780 -21.748 17.460 516 HE2 HIS 57 HE2 HIS 57 0.502 -23.803 18.357 517 H VAL 58 H VAL 58 -4.377 -18.813 14.113 518 HA VAL 58 HA VAL 58 -7.046 -19.841 14.669 519 HB VAL 58 HB VAL 58 -6.127 -17.602 12.847 520 HG11 VAL 58 HG11 VAL 58 -8.378 -18.280 12.160 521 HG12 VAL 58 HG12 VAL 58 -8.928 -18.235 13.858 522 HG13 VAL 58 HG13 VAL 58 -8.454 -16.748 13.020 523 HG21 VAL 58 HG21 VAL 58 -5.603 -17.180 15.230 524 HG22 VAL 58 HG22 VAL 58 -6.912 -16.122 14.690 525 HG23 VAL 58 HG23 VAL 58 -7.279 -17.546 15.674 526 H ASN 59 H ASN 59 -8.311 -21.186 13.447 527 HA ASN 59 HA ASN 59 -7.323 -22.161 10.835 528 HB2 ASN 59 HB2 ASN 59 -9.685 -22.958 12.583 529 HB3 ASN 59 HB3 ASN 59 -9.301 -23.714 11.039 530 HD21 ASN 59 HD21 ASN 59 -7.791 -25.715 13.839 531 HD22 ASN 59 HD22 ASN 59 -9.417 -25.109 13.548 532 H MET 60 H MET 60 -8.579 -22.141 8.870 533 HA MET 60 HA MET 60 -9.670 -19.678 8.148 534 HB2 MET 60 HB2 MET 60 -10.084 -22.457 6.999 535 HB3 MET 60 HB3 MET 60 -10.884 -21.058 6.288 536 HG2 MET 60 HG2 MET 60 -7.903 -21.527 6.515 537 HG3 MET 60 HG3 MET 60 -8.901 -21.526 5.050 538 HE1 MET 60 HE1 MET 60 -10.752 -18.851 5.555 539 HE2 MET 60 HE2 MET 60 -9.784 -17.710 4.613 540 HE3 MET 60 HE3 MET 60 -10.023 -19.355 4.002 541 H SER 61 H SER 61 -11.678 -22.514 9.160 542 HA SER 61 HA SER 61 -14.179 -21.194 8.960 543 HB2 SER 61 HB2 SER 61 -13.944 -23.594 9.269 544 HB3 SER 61 HB3 SER 61 -13.275 -23.358 10.897 545 HG SER 61 HG SER 61 -15.552 -23.856 10.891 546 H GLU 62 H GLU 62 -11.828 -21.114 11.673 547 HA GLU 62 HA GLU 62 -13.576 -19.623 13.428 548 HB2 GLU 62 HB2 GLU 62 -11.687 -21.075 14.192 549 HB3 GLU 62 HB3 GLU 62 -10.554 -19.928 13.497 550 HG2 GLU 62 HG2 GLU 62 -10.661 -19.528 15.836 551 HG3 GLU 62 HG3 GLU 62 -11.412 -18.157 15.041 552 H LEU 63 H LEU 63 -10.956 -18.597 11.179 553 HA LEU 63 HA LEU 63 -11.212 -15.759 11.623 554 HB2 LEU 63 HB2 LEU 63 -9.337 -16.670 10.365 555 HB3 LEU 63 HB3 LEU 63 -10.416 -17.420 9.198 556 HG LEU 63 HG LEU 63 -11.139 -15.146 8.407 557 HD11 LEU 63 HD11 LEU 63 -8.879 -14.198 10.228 558 HD12 LEU 63 HD12 LEU 63 -9.694 -13.209 8.990 559 HD13 LEU 63 HD13 LEU 63 -10.599 -13.794 10.396 560 HD21 LEU 63 HD21 LEU 63 -9.107 -14.671 7.135 561 HD22 LEU 63 HD22 LEU 63 -8.144 -15.656 8.267 562 HD23 LEU 63 HD23 LEU 63 -9.389 -16.414 7.240 563 H ILE 64 H ILE 64 -12.935 -17.968 9.398 564 HA ILE 64 HA ILE 64 -14.552 -15.967 8.153 565 HB ILE 64 HB ILE 64 -14.783 -18.972 8.435 566 HG12 ILE 64 HG12 ILE 64 -14.208 -17.163 6.059 567 HG13 ILE 64 HG13 ILE 64 -12.942 -17.820 7.057 568 HG21 ILE 64 HG21 ILE 64 -16.612 -17.174 6.777 569 HG22 ILE 64 HG22 ILE 64 -16.532 -18.954 6.685 570 HG23 ILE 64 HG23 ILE 64 -17.102 -18.189 8.158 571 HD11 ILE 64 HD11 ILE 64 -14.784 -19.332 5.207 572 HD12 ILE 64 HD12 ILE 64 -13.027 -19.240 5.183 573 HD13 ILE 64 HD13 ILE 64 -13.828 -20.159 6.474 574 H LYS 65 H LYS 65 -15.208 -17.898 11.107 575 HA LYS 65 HA LYS 65 -17.810 -16.833 11.638 576 HB2 LYS 65 HB2 LYS 65 -15.621 -17.893 13.454 577 HB3 LYS 65 HB3 LYS 65 -17.187 -17.356 14.075 578 HG2 LYS 65 HG2 LYS 65 -18.389 -19.056 12.956 579 HG3 LYS 65 HG3 LYS 65 -17.067 -19.401 11.842 580 HD2 LYS 65 HD2 LYS 65 -17.251 -21.194 13.473 581 HD3 LYS 65 HD3 LYS 65 -15.713 -20.346 13.647 582 HE2 LYS 65 HE2 LYS 65 -16.829 -18.989 15.535 583 HE3 LYS 65 HE3 LYS 65 -18.178 -20.129 15.434 584 HZ1 LYS 65 HZ1 LYS 65 -16.535 -21.923 15.907 585 HZ2 LYS 65 HZ2 LYS 65 -15.335 -20.799 16.047 586 HZ3 LYS 65 HZ3 LYS 65 -16.574 -20.826 17.117 587 H ILE 66 H ILE 66 -14.645 -15.496 12.813 588 HA ILE 66 HA ILE 66 -15.987 -13.244 14.049 589 HB ILE 66 HB ILE 66 -13.916 -13.818 14.933 590 HG12 ILE 66 HG12 ILE 66 -14.556 -11.340 14.811 591 HG13 ILE 66 HG13 ILE 66 -12.933 -11.787 15.290 592 HG21 ILE 66 HG21 ILE 66 -12.727 -14.829 13.116 593 HG22 ILE 66 HG22 ILE 66 -12.583 -13.290 12.246 594 HG23 ILE 66 HG23 ILE 66 -11.733 -13.547 13.787 595 HD11 ILE 66 HD11 ILE 66 -12.828 -9.831 13.885 596 HD12 ILE 66 HD12 ILE 66 -12.055 -11.174 13.050 597 HD13 ILE 66 HD13 ILE 66 -13.673 -10.642 12.564 598 H ILE 67 H ILE 67 -14.517 -13.579 10.793 599 HA ILE 67 HA ILE 67 -15.062 -10.863 10.004 600 HB ILE 67 HB ILE 67 -14.716 -13.426 8.405 601 HG12 ILE 67 HG12 ILE 67 -12.713 -12.695 9.654 602 HG13 ILE 67 HG13 ILE 67 -12.485 -12.621 7.921 603 HG21 ILE 67 HG21 ILE 67 -15.974 -11.970 6.948 604 HG22 ILE 67 HG22 ILE 67 -14.945 -10.577 7.341 605 HG23 ILE 67 HG23 ILE 67 -14.293 -11.956 6.426 606 HD11 ILE 67 HD11 ILE 67 -12.728 -10.145 8.010 607 HD12 ILE 67 HD12 ILE 67 -12.963 -10.242 9.775 608 HD13 ILE 67 HD13 ILE 67 -11.428 -10.736 9.054 609 H ARG 68 H ARG 68 -17.098 -13.818 9.628 610 HA ARG 68 HA ARG 68 -19.324 -12.553 8.403 611 HB2 ARG 68 HB2 ARG 68 -18.976 -15.018 8.614 612 HB3 ARG 68 HB3 ARG 68 -19.293 -14.901 10.349 613 HG2 ARG 68 HG2 ARG 68 -21.610 -13.932 9.683 614 HG3 ARG 68 HG3 ARG 68 -21.234 -14.451 8.042 615 HD2 ARG 68 HD2 ARG 68 -21.312 -16.251 10.494 616 HD3 ARG 68 HD3 ARG 68 -22.645 -16.034 9.377 617 HE ARG 68 HE ARG 68 -20.055 -17.425 8.858 618 HH11 ARG 68 HH11 ARG 68 -23.284 -16.745 7.670 619 HH12 ARG 68 HH12 ARG 68 -23.246 -18.073 6.542 620 HH21 ARG 68 HH21 ARG 68 -20.069 -19.089 7.365 621 HH22 ARG 68 HH22 ARG 68 -21.466 -19.326 6.359 622 H ARG 69 H ARG 69 -18.567 -12.898 11.882 623 HA ARG 69 HA ARG 69 -20.954 -11.570 12.825 624 HB2 ARG 69 HB2 ARG 69 -19.658 -13.149 14.178 625 HB3 ARG 69 HB3 ARG 69 -18.266 -12.055 14.179 626 HG2 ARG 69 HG2 ARG 69 -19.527 -10.370 15.453 627 HG3 ARG 69 HG3 ARG 69 -21.004 -11.340 15.327 628 HD2 ARG 69 HD2 ARG 69 -19.912 -13.160 16.647 629 HD3 ARG 69 HD3 ARG 69 -18.442 -12.192 16.744 630 HE ARG 69 HE ARG 69 -19.426 -10.739 18.284 631 HH11 ARG 69 HH11 ARG 69 -21.862 -13.080 17.321 632 HH12 ARG 69 HH12 ARG 69 -22.876 -12.706 18.686 633 HH21 ARG 69 HH21 ARG 69 -20.786 -10.285 19.956 634 HH22 ARG 69 HH22 ARG 69 -22.285 -11.147 20.127 635 H ARG 70 H ARG 70 -17.665 -10.297 12.188 636 HA ARG 70 HA ARG 70 -18.266 -7.680 13.253 637 HB2 ARG 70 HB2 ARG 70 -15.987 -8.807 12.985 638 HB3 ARG 70 HB3 ARG 70 -16.023 -8.307 11.284 639 HG2 ARG 70 HG2 ARG 70 -15.996 -6.012 11.833 640 HG3 ARG 70 HG3 ARG 70 -16.489 -6.277 13.503 641 HD2 ARG 70 HD2 ARG 70 -13.835 -7.357 12.489 642 HD3 ARG 70 HD3 ARG 70 -14.001 -5.696 13.047 643 HE ARG 70 HE ARG 70 -14.404 -8.142 14.713 644 HH11 ARG 70 HH11 ARG 70 -13.677 -4.627 14.672 645 HH12 ARG 70 HH12 ARG 70 -13.482 -4.690 16.415 646 HH21 ARG 70 HH21 ARG 70 -13.967 -7.903 16.944 647 HH22 ARG 70 HH22 ARG 70 -13.521 -6.300 17.510 648 H LEU 71 H LEU 71 -18.525 -9.021 9.996 649 HA LEU 71 HA LEU 71 -19.383 -6.520 8.728 650 HB2 LEU 71 HB2 LEU 71 -19.696 -9.458 7.978 651 HB3 LEU 71 HB3 LEU 71 -20.216 -8.131 6.947 652 HG LEU 71 HG LEU 71 -17.314 -8.539 7.805 653 HD11 LEU 71 HD11 LEU 71 -18.100 -10.439 6.453 654 HD12 LEU 71 HD12 LEU 71 -18.749 -9.327 5.233 655 HD13 LEU 71 HD13 LEU 71 -16.998 -9.421 5.511 656 HD21 LEU 71 HD21 LEU 71 -16.867 -7.040 5.864 657 HD22 LEU 71 HD22 LEU 71 -18.616 -6.784 5.676 658 HD23 LEU 71 HD23 LEU 71 -17.771 -6.226 7.146 659 H GLN 72 H GLN 72 -21.581 -5.919 8.232 660 HA GLN 72 HA GLN 72 -23.465 -6.631 10.306 661 HB2 GLN 72 HB2 GLN 72 -23.612 -4.626 8.045 662 HB3 GLN 72 HB3 GLN 72 -24.886 -4.873 9.251 663 HG2 GLN 72 HG2 GLN 72 -23.289 -4.377 11.085 664 HG3 GLN 72 HG3 GLN 72 -22.012 -4.080 9.905 665 HE21 GLN 72 HE21 GLN 72 -25.054 -1.301 10.279 666 HE22 GLN 72 HE22 GLN 72 -25.290 -2.917 10.921 667 H LEU 73 H LEU 73 -23.171 -8.929 9.168 668 HA LEU 73 HA LEU 73 -25.214 -9.501 7.116 669 HB2 LEU 73 HB2 LEU 73 -23.354 -11.345 8.661 670 HB3 LEU 73 HB3 LEU 73 -24.326 -11.801 7.268 671 HG LEU 73 HG LEU 73 -22.040 -9.784 7.211 672 HD11 LEU 73 HD11 LEU 73 -21.325 -12.104 7.589 673 HD12 LEU 73 HD12 LEU 73 -22.218 -12.623 6.147 674 HD13 LEU 73 HD13 LEU 73 -20.825 -11.514 6.001 675 HD21 LEU 73 HD21 LEU 73 -23.695 -10.984 4.949 676 HD22 LEU 73 HD22 LEU 73 -23.684 -9.273 5.454 677 HD23 LEU 73 HD23 LEU 73 -22.228 -9.984 4.750 678 H ASN 74 H ASN 74 -26.567 -11.497 7.512 679 HA ASN 74 HA ASN 74 -27.784 -11.796 10.168 680 HB2 ASN 74 HB2 ASN 74 -28.826 -9.713 9.267 681 HB3 ASN 74 HB3 ASN 74 -29.266 -10.562 7.788 682 HD21 ASN 74 HD21 ASN 74 -31.663 -10.871 11.042 683 HD22 ASN 74 HD22 ASN 74 -30.175 -9.943 11.111 684 H ALA 75 H ALA 75 -29.288 -13.673 10.172 685 HA ALA 75 HA ALA 75 -28.421 -15.864 8.637 686 HB1 ALA 75 HB1 ALA 75 -29.544 -15.994 10.831 687 HB2 ALA 75 HB2 ALA 75 -31.073 -15.453 10.092 688 HB3 ALA 75 HB3 ALA 75 -30.363 -17.014 9.636 689 H ASN 76 H ASN 76 -30.881 -13.496 7.769 690 HA ASN 76 HA ASN 76 -32.037 -15.044 5.579 691 HB2 ASN 76 HB2 ASN 76 -32.163 -12.090 6.338 692 HB3 ASN 76 HB3 ASN 76 -33.063 -12.812 5.010 693 HD21 ASN 76 HD21 ASN 76 -34.487 -13.252 8.770 694 HD22 ASN 76 HD22 ASN 76 -32.948 -12.434 8.478 695 H GLN 77 H GLN 77 -29.058 -13.253 5.828 696 HA GLN 77 HA GLN 77 -28.951 -12.638 2.936 697 HB2 GLN 77 HB2 GLN 77 -27.050 -12.045 5.237 698 HB3 GLN 77 HB3 GLN 77 -26.666 -11.708 3.558 699 HG2 GLN 77 HG2 GLN 77 -29.025 -10.527 5.084 700 HG3 GLN 77 HG3 GLN 77 -27.507 -9.702 4.746 701 HE21 GLN 77 HE21 GLN 77 -30.141 -8.839 2.121 702 HE22 GLN 77 HE22 GLN 77 -30.220 -8.854 3.878 703 H ALA 78 H ALA 78 -27.755 -13.662 1.452 704 HA ALA 78 HA ALA 78 -26.413 -16.208 2.101 705 HB1 ALA 78 HB1 ALA 78 -26.077 -16.299 -0.353 706 HB2 ALA 78 HB2 ALA 78 -27.782 -16.033 0.074 707 HB3 ALA 78 HB3 ALA 78 -26.793 -14.678 -0.506 708 H PHE 79 H PHE 79 -24.230 -16.453 2.351 709 HA PHE 79 HA PHE 79 -22.354 -14.378 1.507 710 HB2 PHE 79 HB2 PHE 79 -22.798 -13.315 3.471 711 HB3 PHE 79 HB3 PHE 79 -23.038 -14.804 4.364 712 HD1 PHE 79 HD1 PHE 79 -21.173 -16.102 5.278 713 HD2 PHE 79 HD2 PHE 79 -20.512 -12.393 3.194 714 HE1 PHE 79 HE1 PHE 79 -18.888 -15.970 6.247 715 HE2 PHE 79 HE2 PHE 79 -18.226 -12.254 4.176 716 HZ PHE 79 HZ PHE 79 -17.418 -14.035 5.703 717 H PHE 80 H PHE 80 -20.391 -14.929 0.982 718 HA PHE 80 HA PHE 80 -19.237 -17.453 1.982 719 HB2 PHE 80 HB2 PHE 80 -19.516 -16.773 -0.956 720 HB3 PHE 80 HB3 PHE 80 -18.414 -17.982 -0.322 721 HD1 PHE 80 HD1 PHE 80 -21.896 -17.244 -1.107 722 HD2 PHE 80 HD2 PHE 80 -19.243 -20.062 0.779 723 HE1 PHE 80 HE1 PHE 80 -23.700 -18.954 -1.151 724 HE2 PHE 80 HE2 PHE 80 -21.036 -21.786 0.728 725 HZ PHE 80 HZ PHE 80 -23.267 -21.236 -0.237 726 H LEU 81 H LEU 81 -17.214 -17.295 2.634 727 HA LEU 81 HA LEU 81 -15.545 -14.997 1.744 728 HB2 LEU 81 HB2 LEU 81 -15.857 -15.287 4.146 729 HB3 LEU 81 HB3 LEU 81 -15.241 -16.925 4.063 730 HG LEU 81 HG LEU 81 -13.683 -15.244 5.018 731 HD11 LEU 81 HD11 LEU 81 -11.720 -16.090 4.175 732 HD12 LEU 81 HD12 LEU 81 -12.873 -17.362 3.754 733 HD13 LEU 81 HD13 LEU 81 -12.304 -16.212 2.515 734 HD21 LEU 81 HD21 LEU 81 -13.407 -14.087 2.226 735 HD22 LEU 81 HD22 LEU 81 -14.276 -13.338 3.584 736 HD23 LEU 81 HD23 LEU 81 -12.524 -13.626 3.690 737 H LEU 82 H LEU 82 -13.936 -15.271 0.392 738 HA LEU 82 HA LEU 82 -13.329 -18.000 -0.610 739 HB2 LEU 82 HB2 LEU 82 -13.214 -15.501 -2.279 740 HB3 LEU 82 HB3 LEU 82 -13.481 -17.150 -2.789 741 HG LEU 82 HG LEU 82 -15.553 -15.389 -1.398 742 HD11 LEU 82 HD11 LEU 82 -15.316 -16.189 -4.319 743 HD12 LEU 82 HD12 LEU 82 -16.605 -15.219 -3.584 744 HD13 LEU 82 HD13 LEU 82 -14.959 -14.575 -3.656 745 HD21 LEU 82 HD21 LEU 82 -16.039 -17.776 -1.043 746 HD22 LEU 82 HD22 LEU 82 -17.165 -17.081 -2.208 747 HD23 LEU 82 HD23 LEU 82 -15.829 -18.088 -2.783 748 H VAL 83 H VAL 83 -11.182 -18.495 -1.124 749 HA VAL 83 HA VAL 83 -9.066 -16.386 -0.621 750 HB VAL 83 HB VAL 83 -8.992 -19.418 -0.414 751 HG11 VAL 83 HG11 VAL 83 -6.983 -18.843 -1.670 752 HG12 VAL 83 HG12 VAL 83 -6.622 -17.502 -0.552 753 HG13 VAL 83 HG13 VAL 83 -6.541 -19.192 0.002 754 HG21 VAL 83 HG21 VAL 83 -8.075 -17.211 1.479 755 HG22 VAL 83 HG22 VAL 83 -9.643 -18.051 1.608 756 HG23 VAL 83 HG23 VAL 83 -8.123 -18.946 1.826 757 H ASN 84 H ASN 84 -8.131 -15.639 -2.473 758 HA ASN 84 HA ASN 84 -8.291 -15.122 -4.714 759 HB2 ASN 84 HB2 ASN 84 -6.811 -17.743 -4.476 760 HB3 ASN 84 HB3 ASN 84 -7.026 -17.008 -6.059 761 HD21 ASN 84 HD21 ASN 84 -3.832 -15.705 -4.684 762 HD22 ASN 84 HD22 ASN 84 -4.475 -17.362 -4.770 763 H GLY 85 H GLY 85 -10.692 -15.384 -4.164 764 HA2 GLY 85 HA2 GLY 85 -12.715 -15.429 -5.195 765 HA3 GLY 85 HA3 GLY 85 -11.914 -15.988 -6.664 766 H HIS 86 H HIS 86 -11.360 -18.285 -4.163 767 HA HIS 86 HA HIS 86 -13.843 -19.833 -4.860 768 HB2 HIS 86 HB2 HIS 86 -11.026 -20.906 -4.508 769 HB3 HIS 86 HB3 HIS 86 -12.473 -21.873 -4.770 770 HD1 HIS 86 HD1 HIS 86 -10.156 -19.451 -6.709 771 HD2 HIS 86 HD2 HIS 86 -13.561 -21.912 -7.221 772 HE1 HIS 86 HE1 HIS 86 -10.545 -19.641 -9.248 773 HE2 HIS 86 HE2 HIS 86 -12.620 -21.141 -9.554 774 H SER 87 H SER 87 -15.009 -20.683 -3.252 775 HA SER 87 HA SER 87 -14.806 -19.611 -0.700 776 HB2 SER 87 HB2 SER 87 -16.904 -20.347 -1.606 777 HB3 SER 87 HB3 SER 87 -16.344 -22.031 -1.651 778 HG SER 87 HG SER 87 -17.561 -21.769 0.197 779 H MET 88 H MET 88 -14.188 -20.138 1.264 780 HA MET 88 HA MET 88 -12.839 -22.772 1.758 781 HB2 MET 88 HB2 MET 88 -11.966 -20.017 2.692 782 HB3 MET 88 HB3 MET 88 -11.280 -21.523 3.318 783 HG2 MET 88 HG2 MET 88 -11.196 -20.630 0.415 784 HG3 MET 88 HG3 MET 88 -9.879 -20.537 1.581 785 HE1 MET 88 HE1 MET 88 -8.302 -21.745 -0.258 786 HE2 MET 88 HE2 MET 88 -8.744 -23.283 -1.023 787 HE3 MET 88 HE3 MET 88 -9.719 -21.831 -1.336 788 H VAL 89 H VAL 89 -15.674 -21.527 2.430 789 HA VAL 89 HA VAL 89 -15.732 -21.281 5.278 790 HB VAL 89 HB VAL 89 -18.055 -21.172 5.205 791 HG11 VAL 89 HG11 VAL 89 -16.892 -19.269 4.096 792 HG12 VAL 89 HG12 VAL 89 -17.140 -20.054 2.519 793 HG13 VAL 89 HG13 VAL 89 -18.533 -19.542 3.492 794 HG21 VAL 89 HG21 VAL 89 -17.992 -22.521 2.484 795 HG22 VAL 89 HG22 VAL 89 -18.672 -23.178 3.990 796 HG23 VAL 89 HG23 VAL 89 -19.428 -21.777 3.227 797 H SER 90 H SER 90 -15.655 -24.205 3.442 798 HA SER 90 HA SER 90 -16.513 -25.868 5.730 799 HB2 SER 90 HB2 SER 90 -16.278 -27.704 4.104 800 HB3 SER 90 HB3 SER 90 -17.332 -26.410 3.511 801 HG SER 90 HG SER 90 -15.819 -27.111 1.911 802 H VAL 91 H VAL 91 -13.516 -24.504 4.761 803 HA VAL 91 HA VAL 91 -12.010 -26.951 5.240 804 HB VAL 91 HB VAL 91 -11.634 -25.219 3.340 805 HG11 VAL 91 HG11 VAL 91 -9.771 -23.738 3.670 806 HG12 VAL 91 HG12 VAL 91 -11.016 -23.335 4.866 807 HG13 VAL 91 HG13 VAL 91 -9.564 -24.245 5.351 808 HG21 VAL 91 HG21 VAL 91 -9.357 -26.093 3.067 809 HG22 VAL 91 HG22 VAL 91 -9.368 -26.697 4.733 810 HG23 VAL 91 HG23 VAL 91 -10.493 -27.363 3.529 811 H SER 92 H SER 92 -10.482 -27.485 6.693 812 HA SER 92 HA SER 92 -10.691 -26.178 9.308 813 HB2 SER 92 HB2 SER 92 -9.517 -28.203 10.073 814 HB3 SER 92 HB3 SER 92 -10.958 -28.574 9.110 815 HG SER 92 HG SER 92 -9.129 -29.849 8.483 816 H THR 93 H THR 93 -8.446 -25.879 6.728 817 HA THR 93 HA THR 93 -6.023 -26.058 7.841 818 HB THR 93 HB THR 93 -6.444 -23.863 5.864 819 HG1 THR 93 HG1 THR 93 -6.602 -25.519 4.273 820 HG21 THR 93 HG21 THR 93 -4.394 -26.111 6.053 821 HG22 THR 93 HG22 THR 93 -4.461 -24.880 4.779 822 HG23 THR 93 HG23 THR 93 -4.105 -24.396 6.439 823 HA PRO 94 HA PRO 94 -5.272 -22.546 10.577 824 HB2 PRO 94 HB2 PRO 94 -2.567 -22.773 10.934 825 HB3 PRO 94 HB3 PRO 94 -3.767 -23.838 11.733 826 HG2 PRO 94 HG2 PRO 94 -2.208 -24.379 9.189 827 HG3 PRO 94 HG3 PRO 94 -2.397 -25.445 10.617 828 HD2 PRO 94 HD2 PRO 94 -3.934 -25.742 8.412 829 HD3 PRO 94 HD3 PRO 94 -4.643 -25.950 10.036 830 H ILE 95 H ILE 95 -4.828 -20.446 10.212 831 HA ILE 95 HA ILE 95 -4.736 -19.566 7.574 832 HB ILE 95 HB ILE 95 -5.772 -18.393 9.482 833 HG12 ILE 95 HG12 ILE 95 -5.234 -16.082 8.913 834 HG13 ILE 95 HG13 ILE 95 -3.778 -16.573 8.053 835 HG21 ILE 95 HG21 ILE 95 -4.511 -17.029 11.035 836 HG22 ILE 95 HG22 ILE 95 -3.870 -18.664 11.137 837 HG23 ILE 95 HG23 ILE 95 -2.979 -17.409 10.251 838 HD11 ILE 95 HD11 ILE 95 -6.604 -17.444 7.303 839 HD12 ILE 95 HD12 ILE 95 -5.750 -16.066 6.589 840 HD13 ILE 95 HD13 ILE 95 -5.123 -17.703 6.348 841 H SER 96 H SER 96 -1.950 -19.937 9.739 842 HA SER 96 HA SER 96 -0.048 -18.442 8.192 843 HB2 SER 96 HB2 SER 96 0.340 -19.153 10.495 844 HB3 SER 96 HB3 SER 96 0.345 -20.858 10.000 845 HG SER 96 HG SER 96 2.485 -20.035 10.151 846 H GLU 97 H GLU 97 -1.076 -21.886 7.945 847 HA GLU 97 HA GLU 97 0.855 -22.521 5.860 848 HB2 GLU 97 HB2 GLU 97 -1.700 -23.906 6.757 849 HB3 GLU 97 HB3 GLU 97 -0.599 -24.566 5.555 850 HG2 GLU 97 HG2 GLU 97 0.129 -23.935 8.455 851 HG3 GLU 97 HG3 GLU 97 -0.304 -25.524 7.835 852 H VAL 98 H VAL 98 -2.577 -21.498 5.841 853 HA VAL 98 HA VAL 98 -2.896 -21.561 2.977 854 HB VAL 98 HB VAL 98 -4.258 -19.595 4.837 855 HG11 VAL 98 HG11 VAL 98 -5.126 -20.814 2.179 856 HG12 VAL 98 HG12 VAL 98 -6.062 -19.664 3.166 857 HG13 VAL 98 HG13 VAL 98 -4.552 -19.150 2.402 858 HG21 VAL 98 HG21 VAL 98 -4.657 -21.840 5.742 859 HG22 VAL 98 HG22 VAL 98 -6.109 -21.246 4.943 860 HG23 VAL 98 HG23 VAL 98 -5.082 -22.440 4.122 861 H TYR 99 H TYR 99 -1.710 -18.978 5.149 862 HA TYR 99 HA TYR 99 -1.118 -17.129 3.080 863 HB2 TYR 99 HB2 TYR 99 -1.350 -16.139 5.095 864 HB3 TYR 99 HB3 TYR 99 -0.433 -17.370 5.938 865 HD1 TYR 99 HD1 TYR 99 1.815 -17.145 6.463 866 HD2 TYR 99 HD2 TYR 99 -0.017 -14.411 3.680 867 HE1 TYR 99 HE1 TYR 99 3.765 -15.637 6.663 868 HE2 TYR 99 HE2 TYR 99 1.993 -12.934 3.818 869 HH TYR 99 HH TYR 99 4.058 -12.601 4.747 870 H GLU 100 H GLU 100 1.304 -19.290 4.645 871 HA GLU 100 HA GLU 100 3.388 -18.406 2.893 872 HB2 GLU 100 HB2 GLU 100 3.003 -20.926 4.526 873 HB3 GLU 100 HB3 GLU 100 4.450 -20.665 3.571 874 HG2 GLU 100 HG2 GLU 100 3.476 -18.757 5.740 875 HG3 GLU 100 HG3 GLU 100 4.642 -20.044 6.003 876 H SER 101 H SER 101 0.816 -20.725 2.280 877 HA SER 101 HA SER 101 2.051 -21.764 -0.173 878 HB2 SER 101 HB2 SER 101 0.635 -23.167 1.260 879 HB3 SER 101 HB3 SER 101 -0.744 -22.086 0.977 880 HG SER 101 HG SER 101 -0.699 -23.972 -0.411 881 H GLU 102 H GLU 102 -0.645 -19.477 0.571 882 HA GLU 102 HA GLU 102 -0.934 -18.910 -2.350 883 HB2 GLU 102 HB2 GLU 102 -2.691 -20.231 -1.035 884 HB3 GLU 102 HB3 GLU 102 -3.067 -18.732 -0.214 885 HG2 GLU 102 HG2 GLU 102 -4.662 -19.189 -1.928 886 HG3 GLU 102 HG3 GLU 102 -3.804 -17.727 -2.344 887 H LYS 103 H LYS 103 0.578 -17.298 0.034 888 HA LYS 103 HA LYS 103 -0.471 -14.648 -0.358 889 HB2 LYS 103 HB2 LYS 103 1.658 -13.816 0.443 890 HB3 LYS 103 HB3 LYS 103 1.064 -15.110 1.470 891 HG2 LYS 103 HG2 LYS 103 2.647 -16.695 0.204 892 HG3 LYS 103 HG3 LYS 103 3.303 -15.258 -0.595 893 HD2 LYS 103 HD2 LYS 103 3.952 -14.318 1.614 894 HD3 LYS 103 HD3 LYS 103 3.196 -15.702 2.420 895 HE2 LYS 103 HE2 LYS 103 5.565 -16.060 2.412 896 HE3 LYS 103 HE3 LYS 103 4.807 -17.250 1.355 897 HZ1 LYS 103 HZ1 LYS 103 6.811 -16.280 0.363 898 HZ2 LYS 103 HZ2 LYS 103 5.523 -15.921 -0.570 899 HZ3 LYS 103 HZ3 LYS 103 6.184 -14.780 0.405 900 H ASP 104 H ASP 104 0.015 -13.046 -1.747 901 HA ASP 104 HA ASP 104 1.216 -13.889 -4.336 902 HB2 ASP 104 HB2 ASP 104 -1.393 -12.554 -3.762 903 HB3 ASP 104 HB3 ASP 104 -0.625 -12.360 -5.334 904 H GLU 105 H GLU 105 0.906 -11.401 -5.728 905 HA GLU 105 HA GLU 105 3.580 -10.656 -5.512 906 HB2 GLU 105 HB2 GLU 105 1.247 -9.063 -6.650 907 HB3 GLU 105 HB3 GLU 105 2.935 -8.698 -6.961 908 HG2 GLU 105 HG2 GLU 105 1.515 -11.287 -7.735 909 HG3 GLU 105 HG3 GLU 105 1.838 -9.933 -8.806 910 H ASP 106 H ASP 106 0.859 -8.997 -3.889 911 HA ASP 106 HA ASP 106 2.399 -6.818 -2.828 912 HB2 ASP 106 HB2 ASP 106 -0.160 -8.112 -1.870 913 HB3 ASP 106 HB3 ASP 106 0.566 -6.691 -1.124 914 H GLY 107 H GLY 107 2.640 -10.088 -2.047 915 HA2 GLY 107 HA2 GLY 107 4.061 -11.133 -0.558 916 HA3 GLY 107 HA3 GLY 107 4.245 -9.657 0.378 917 H PHE 108 H PHE 108 0.987 -9.827 0.148 918 HA PHE 108 HA PHE 108 0.672 -11.592 2.504 919 HB2 PHE 108 HB2 PHE 108 -1.414 -10.244 3.015 920 HB3 PHE 108 HB3 PHE 108 0.179 -9.602 3.339 921 HD1 PHE 108 HD1 PHE 108 -2.215 -9.613 0.405 922 HD2 PHE 108 HD2 PHE 108 0.371 -7.324 2.999 923 HE1 PHE 108 HE1 PHE 108 -2.865 -7.529 -0.759 924 HE2 PHE 108 HE2 PHE 108 -0.293 -5.255 1.840 925 HZ PHE 108 HZ PHE 108 -1.906 -5.363 -0.072 926 H LEU 109 H LEU 109 -1.533 -12.490 2.959 927 HA LEU 109 HA LEU 109 -2.316 -14.164 0.672 928 HB2 LEU 109 HB2 LEU 109 -2.147 -15.133 2.886 929 HB3 LEU 109 HB3 LEU 109 -3.254 -13.929 3.544 930 HG LEU 109 HG LEU 109 -5.119 -14.878 2.222 931 HD11 LEU 109 HD11 LEU 109 -3.060 -16.987 1.398 932 HD12 LEU 109 HD12 LEU 109 -4.815 -17.097 1.131 933 HD13 LEU 109 HD13 LEU 109 -3.883 -15.857 0.299 934 HD21 LEU 109 HD21 LEU 109 -3.580 -16.955 3.853 935 HD22 LEU 109 HD22 LEU 109 -4.608 -15.670 4.519 936 HD23 LEU 109 HD23 LEU 109 -5.322 -16.953 3.519 937 H TYR 110 H TYR 110 -3.834 -13.645 -0.773 938 HA TYR 110 HA TYR 110 -5.768 -11.517 -0.211 939 HB2 TYR 110 HB2 TYR 110 -4.909 -12.855 -2.720 940 HB3 TYR 110 HB3 TYR 110 -6.499 -12.136 -2.646 941 HD1 TYR 110 HD1 TYR 110 -6.870 -9.778 -2.631 942 HD2 TYR 110 HD2 TYR 110 -2.862 -11.365 -2.423 943 HE1 TYR 110 HE1 TYR 110 -5.956 -7.553 -3.260 944 HE2 TYR 110 HE2 TYR 110 -1.953 -9.140 -3.082 945 HH TYR 110 HH TYR 110 -2.457 -7.005 -3.779 946 H MET 111 H MET 111 -7.798 -11.598 0.240 947 HA MET 111 HA MET 111 -9.351 -14.079 -0.296 948 HB2 MET 111 HB2 MET 111 -9.671 -12.246 2.114 949 HB3 MET 111 HB3 MET 111 -10.689 -13.638 1.710 950 HG2 MET 111 HG2 MET 111 -8.588 -15.063 1.836 951 HG3 MET 111 HG3 MET 111 -7.758 -13.658 2.517 952 HE1 MET 111 HE1 MET 111 -6.946 -15.197 4.400 953 HE2 MET 111 HE2 MET 111 -8.010 -16.162 5.443 954 HE3 MET 111 HE3 MET 111 -7.856 -16.565 3.726 955 H VAL 112 H VAL 112 -11.481 -13.798 -0.964 956 HA VAL 112 HA VAL 112 -12.405 -11.028 -1.546 957 HB VAL 112 HB VAL 112 -12.775 -13.423 -3.368 958 HG11 VAL 112 HG11 VAL 112 -14.799 -12.022 -3.451 959 HG12 VAL 112 HG12 VAL 112 -13.794 -10.571 -3.697 960 HG13 VAL 112 HG13 VAL 112 -13.862 -11.843 -4.935 961 HG21 VAL 112 HG21 VAL 112 -10.526 -12.437 -3.599 962 HG22 VAL 112 HG22 VAL 112 -11.510 -12.093 -5.022 963 HG23 VAL 112 HG23 VAL 112 -11.242 -10.827 -3.799 964 H TYR 113 H TYR 113 -14.769 -10.755 -1.170 965 HA TYR 113 HA TYR 113 -16.144 -13.241 -0.242 966 HB2 TYR 113 HB2 TYR 113 -16.559 -12.580 1.857 967 HB3 TYR 113 HB3 TYR 113 -15.100 -11.646 1.675 968 HD1 TYR 113 HD1 TYR 113 -18.794 -11.567 1.792 969 HD2 TYR 113 HD2 TYR 113 -15.205 -9.184 1.636 970 HE1 TYR 113 HE1 TYR 113 -20.079 -9.581 2.569 971 HE2 TYR 113 HE2 TYR 113 -16.500 -7.201 2.409 972 HH TYR 113 HH TYR 113 -19.957 -7.417 3.337 973 H ALA 114 H ALA 114 -18.360 -13.182 -0.460 974 HA ALA 114 HA ALA 114 -19.762 -11.037 -1.905 975 HB1 ALA 114 HB1 ALA 114 -19.908 -12.255 -3.990 976 HB2 ALA 114 HB2 ALA 114 -18.195 -12.156 -3.590 977 HB3 ALA 114 HB3 ALA 114 -19.060 -13.667 -3.298 978 H SER 115 H SER 115 -21.962 -12.134 -2.776 979 HA SER 115 HA SER 115 -23.077 -13.819 -0.621 980 HB2 SER 115 HB2 SER 115 -25.204 -13.466 -1.739 981 HB3 SER 115 HB3 SER 115 -24.374 -11.921 -1.466 982 HG SER 115 HG SER 115 -25.326 -12.498 -3.700 983 H GLN 116 H GLN 116 -21.413 -14.422 -3.495 984 HA GLN 116 HA GLN 116 -22.533 -17.155 -3.802 985 HB2 GLN 116 HB2 GLN 116 -23.033 -16.835 -6.041 986 HB3 GLN 116 HB3 GLN 116 -23.588 -15.337 -5.318 987 HG2 GLN 116 HG2 GLN 116 -21.071 -15.784 -6.942 988 HG3 GLN 116 HG3 GLN 116 -22.509 -14.928 -7.451 989 HE21 GLN 116 HE21 GLN 116 -19.694 -12.592 -6.317 990 HE22 GLN 116 HE22 GLN 116 -19.614 -14.101 -7.229 991 H GLU 117 H GLU 117 -21.193 -18.663 -4.964 992 HA GLU 117 HA GLU 117 -18.305 -18.355 -4.602 993 HB2 GLU 117 HB2 GLU 117 -19.315 -20.501 -4.212 994 HB3 GLU 117 HB3 GLU 117 -20.141 -20.468 -5.758 995 HG2 GLU 117 HG2 GLU 117 -18.445 -22.082 -5.896 996 HG3 GLU 117 HG3 GLU 117 -18.015 -20.769 -6.967 997 H THR 118 H THR 118 -20.519 -18.064 -7.372 998 HA THR 118 HA THR 118 -18.523 -18.356 -9.455 999 HB THR 118 HB THR 118 -20.478 -17.390 -10.856 1000 HG1 THR 118 HG1 THR 118 -22.471 -17.342 -9.806 1001 HG21 THR 118 HG21 THR 118 -20.062 -19.805 -10.648 1002 HG22 THR 118 HG22 THR 118 -21.049 -19.860 -9.168 1003 HG23 THR 118 HG23 THR 118 -21.789 -19.439 -10.730 1004 H PHE 119 H PHE 119 -18.112 -16.714 -11.076 1005 HA PHE 119 HA PHE 119 -18.625 -13.927 -10.440 1006 HB2 PHE 119 HB2 PHE 119 -16.251 -13.255 -11.027 1007 HB3 PHE 119 HB3 PHE 119 -16.617 -13.831 -9.417 1008 HD1 PHE 119 HD1 PHE 119 -15.733 -15.954 -8.551 1009 HD2 PHE 119 HD2 PHE 119 -14.910 -14.663 -12.585 1010 HE1 PHE 119 HE1 PHE 119 -13.947 -17.664 -8.735 1011 HE2 PHE 119 HE2 PHE 119 -13.121 -16.381 -12.767 1012 HZ PHE 119 HZ PHE 119 -12.631 -17.876 -10.840 1013 H GLY 120 H GLY 120 -18.661 -12.466 -12.120 1014 HA2 GLY 120 HA2 GLY 120 -19.629 -13.554 -14.605 1015 HA3 GLY 120 HA3 GLY 120 -19.382 -11.846 -14.229 1016 H1 ASP 10 H1 ASP 10 -8.600 4.357 16.732 1017 H2 ASP 10 H2 ASP 10 -8.992 2.948 16.003 1018 H3 ASP 10 H3 ASP 10 -8.361 2.948 17.518 1019 HA ASP 10 HA ASP 10 -6.994 3.854 15.071 1020 HB2 ASP 10 HB2 ASP 10 -5.919 3.799 17.883 1021 HB3 ASP 10 HB3 ASP 10 -4.897 3.885 16.447 1022 H TYR 11 H TYR 11 -6.127 1.371 17.554 1023 HA TYR 11 HA TYR 11 -4.673 0.066 15.536 1024 HB2 TYR 11 HB2 TYR 11 -5.125 -0.660 18.392 1025 HB3 TYR 11 HB3 TYR 11 -4.143 -1.638 17.324 1026 HD1 TYR 11 HD1 TYR 11 -3.774 0.591 19.821 1027 HD2 TYR 11 HD2 TYR 11 -2.495 0.145 15.704 1028 HE1 TYR 11 HE1 TYR 11 -1.779 2.011 20.262 1029 HE2 TYR 11 HE2 TYR 11 -0.514 1.526 16.167 1030 HH TYR 11 HH TYR 11 0.657 2.741 17.733 1031 H GLU 12 H GLU 12 -7.840 -0.251 15.482 1032 HA GLU 12 HA GLU 12 -7.924 -3.030 14.519 1033 HB2 GLU 12 HB2 GLU 12 -9.831 -1.826 15.571 1034 HB3 GLU 12 HB3 GLU 12 -9.955 -0.793 14.111 1035 HG2 GLU 12 HG2 GLU 12 -10.485 -2.761 12.755 1036 HG3 GLU 12 HG3 GLU 12 -10.192 -3.830 14.132 1037 H SER 13 H SER 13 -6.525 -0.173 13.275 1038 HA SER 13 HA SER 13 -6.033 -1.458 10.683 1039 HB2 SER 13 HB2 SER 13 -8.289 -0.531 10.324 1040 HB3 SER 13 HB3 SER 13 -7.720 1.058 10.845 1041 HG SER 13 HG SER 13 -6.869 -0.399 8.532 1042 H ASP 14 H ASP 14 -5.415 1.343 12.811 1043 HA ASP 14 HA ASP 14 -3.657 2.555 10.839 1044 HB2 ASP 14 HB2 ASP 14 -4.650 3.432 13.528 1045 HB3 ASP 14 HB3 ASP 14 -3.482 4.349 12.584 1046 H ASP 15 H ASP 15 -1.626 2.655 10.595 1047 HA ASP 15 HA ASP 15 0.554 2.494 10.779 1048 HB2 ASP 15 HB2 ASP 15 0.225 4.558 11.733 1049 HB3 ASP 15 HB3 ASP 15 -0.144 3.872 13.313 1050 H ASP 16 H ASP 16 0.594 0.214 10.598 1051 HA ASP 16 HA ASP 16 1.536 -1.758 10.883 1052 HB2 ASP 16 HB2 ASP 16 3.352 -0.658 10.124 1053 HB3 ASP 16 HB3 ASP 16 3.623 0.202 11.635 1054 H SER 17 H SER 17 2.077 -0.426 14.173 1055 HA SER 17 HA SER 17 2.643 -3.072 15.253 1056 HB2 SER 17 HB2 SER 17 2.703 -1.940 17.424 1057 HB3 SER 17 HB3 SER 17 3.690 -1.108 16.209 1058 HG SER 17 HG SER 17 2.407 0.362 17.417 1059 H TYR 18 H TYR 18 -0.157 -1.915 14.164 1060 HA TYR 18 HA TYR 18 -2.143 -2.235 16.025 1061 HB2 TYR 18 HB2 TYR 18 -3.564 -2.757 13.902 1062 HB3 TYR 18 HB3 TYR 18 -2.823 -1.213 14.135 1063 HD1 TYR 18 HD1 TYR 18 -1.180 -4.369 12.793 1064 HD2 TYR 18 HD2 TYR 18 -2.554 -0.386 12.084 1065 HE1 TYR 18 HE1 TYR 18 -0.326 -4.504 10.465 1066 HE2 TYR 18 HE2 TYR 18 -1.703 -0.484 9.744 1067 HH TYR 18 HH TYR 18 -0.059 -3.404 8.439 1068 H GLU 19 H GLU 19 -3.968 -3.585 16.194 1069 HA GLU 19 HA GLU 19 -3.320 -6.500 16.306 1070 HB2 GLU 19 HB2 GLU 19 -5.744 -4.916 17.253 1071 HB3 GLU 19 HB3 GLU 19 -5.500 -6.658 17.451 1072 HG2 GLU 19 HG2 GLU 19 -3.431 -6.189 18.781 1073 HG3 GLU 19 HG3 GLU 19 -3.780 -4.457 18.677 1074 H VAL 20 H VAL 20 -5.492 -4.196 14.700 1075 HA VAL 20 HA VAL 20 -6.841 -4.212 12.986 1076 HB VAL 20 HB VAL 20 -5.442 -6.431 11.606 1077 HG11 VAL 20 HG11 VAL 20 -5.817 -5.059 9.641 1078 HG12 VAL 20 HG12 VAL 20 -7.372 -5.276 10.466 1079 HG13 VAL 20 HG13 VAL 20 -6.480 -3.756 10.612 1080 HG21 VAL 20 HG21 VAL 20 -3.807 -4.719 10.807 1081 HG22 VAL 20 HG22 VAL 20 -4.470 -3.577 11.980 1082 HG23 VAL 20 HG23 VAL 20 -3.642 -5.055 12.534 1083 H LEU 21 H LEU 21 -6.692 -7.517 14.199 1084 HA LEU 21 HA LEU 21 -9.343 -8.186 13.141 1085 HB2 LEU 21 HB2 LEU 21 -7.226 -9.671 13.728 1086 HB3 LEU 21 HB3 LEU 21 -7.867 -9.642 15.354 1087 HG LEU 21 HG LEU 21 -9.967 -10.730 14.504 1088 HD11 LEU 21 HD11 LEU 21 -9.856 -11.775 12.194 1089 HD12 LEU 21 HD12 LEU 21 -10.036 -10.026 12.150 1090 HD13 LEU 21 HD13 LEU 21 -8.441 -10.761 11.847 1091 HD21 LEU 21 HD21 LEU 21 -7.400 -12.140 13.661 1092 HD22 LEU 21 HD22 LEU 21 -8.005 -12.056 15.324 1093 HD23 LEU 21 HD23 LEU 21 -8.945 -12.918 14.092 1094 H ASP 22 H ASP 22 -8.237 -6.371 15.823 1095 HA ASP 22 HA ASP 22 -8.923 -6.013 17.916 1096 HB2 ASP 22 HB2 ASP 22 -9.993 -4.274 16.837 1097 HB3 ASP 22 HB3 ASP 22 -11.254 -5.316 16.205 1098 H LEU 23 H LEU 23 -8.541 -8.474 18.078 1099 HA LEU 23 HA LEU 23 -10.795 -9.745 19.547 1100 HB2 LEU 23 HB2 LEU 23 -10.934 -10.484 17.192 1101 HB3 LEU 23 HB3 LEU 23 -9.226 -10.912 17.221 1102 HG LEU 23 HG LEU 23 -9.773 -12.662 19.001 1103 HD11 LEU 23 HD11 LEU 23 -11.956 -11.761 19.740 1104 HD12 LEU 23 HD12 LEU 23 -12.627 -12.050 18.121 1105 HD13 LEU 23 HD13 LEU 23 -12.111 -13.415 19.142 1106 HD21 LEU 23 HD21 LEU 23 -10.713 -14.276 17.386 1107 HD22 LEU 23 HD22 LEU 23 -11.044 -12.939 16.264 1108 HD23 LEU 23 HD23 LEU 23 -9.372 -13.338 16.732 1109 H THR 24 H THR 24 -10.190 -11.004 21.278 1110 HA THR 24 HA THR 24 -7.576 -11.004 22.284 1111 HB THR 24 HB THR 24 -9.428 -13.182 23.123 1112 HG1 THR 24 HG1 THR 24 -10.573 -11.699 24.363 1113 HG21 THR 24 HG21 THR 24 -7.659 -11.221 24.661 1114 HG22 THR 24 HG22 THR 24 -8.589 -12.566 25.357 1115 HG23 THR 24 HG23 THR 24 -7.236 -12.903 24.265 1116 H GLU 25 H GLU 25 -5.778 -12.018 21.856 1117 HA GLU 25 HA GLU 25 -5.648 -14.226 19.959 1118 HB2 GLU 25 HB2 GLU 25 -3.245 -13.967 20.184 1119 HB3 GLU 25 HB3 GLU 25 -4.024 -12.396 19.979 1120 HG2 GLU 25 HG2 GLU 25 -3.900 -12.072 22.480 1121 HG3 GLU 25 HG3 GLU 25 -3.003 -13.588 22.594 1122 H TYR 26 H TYR 26 -4.229 -16.147 20.407 1123 HA TYR 26 HA TYR 26 -4.186 -17.105 23.146 1124 HB2 TYR 26 HB2 TYR 26 -5.016 -19.393 22.468 1125 HB3 TYR 26 HB3 TYR 26 -6.150 -18.102 22.783 1126 HD1 TYR 26 HD1 TYR 26 -4.597 -20.122 20.083 1127 HD2 TYR 26 HD2 TYR 26 -7.681 -17.293 21.116 1128 HE1 TYR 26 HE1 TYR 26 -5.794 -20.644 17.951 1129 HE2 TYR 26 HE2 TYR 26 -8.871 -17.803 18.988 1130 HH TYR 26 HH TYR 26 -8.979 -19.229 17.173 Start of MODEL 14 1 H1 MET 1 H1 MET 1 -9.227 -0.655 4.918 2 H2 MET 1 H2 MET 1 -8.082 0.045 5.873 3 H3 MET 1 H3 MET 1 -9.354 -0.730 6.544 4 HA MET 1 HA MET 1 -9.564 1.738 6.646 5 HB2 MET 1 HB2 MET 1 -8.363 2.181 4.550 6 HB3 MET 1 HB3 MET 1 -9.663 1.450 3.611 7 HG2 MET 1 HG2 MET 1 -9.816 3.858 3.519 8 HG3 MET 1 HG3 MET 1 -11.224 3.233 4.360 9 HE1 MET 1 HE1 MET 1 -10.621 6.729 6.033 10 HE2 MET 1 HE2 MET 1 -10.362 6.290 4.334 11 HE3 MET 1 HE3 MET 1 -11.789 5.674 5.202 12 HA PRO 2 HA PRO 2 -13.657 -0.367 6.627 13 HB2 PRO 2 HB2 PRO 2 -14.528 0.282 9.109 14 HB3 PRO 2 HB3 PRO 2 -13.198 -0.887 8.857 15 HG2 PRO 2 HG2 PRO 2 -12.921 2.075 9.479 16 HG3 PRO 2 HG3 PRO 2 -12.167 0.691 10.333 17 HD2 PRO 2 HD2 PRO 2 -10.854 2.057 8.387 18 HD3 PRO 2 HD3 PRO 2 -10.681 0.280 8.564 19 H SER 3 H SER 3 -14.028 1.160 4.843 20 HA SER 3 HA SER 3 -16.281 2.952 5.367 21 HB2 SER 3 HB2 SER 3 -14.194 4.349 5.796 22 HB3 SER 3 HB3 SER 3 -13.772 4.115 4.090 23 HG SER 3 HG SER 3 -14.990 6.085 4.585 24 H GLU 4 H GLU 4 -16.540 4.188 3.025 25 HA GLU 4 HA GLU 4 -17.161 2.168 1.014 26 HB2 GLU 4 HB2 GLU 4 -17.090 5.211 0.876 27 HB3 GLU 4 HB3 GLU 4 -17.707 4.139 -0.394 28 HG2 GLU 4 HG2 GLU 4 -19.377 3.230 1.223 29 HG3 GLU 4 HG3 GLU 4 -18.838 4.406 2.425 30 H LYS 5 H LYS 5 -16.364 2.267 -1.200 31 HA LYS 5 HA LYS 5 -14.785 1.914 -2.770 32 HB2 LYS 5 HB2 LYS 5 -13.288 4.240 -1.496 33 HB3 LYS 5 HB3 LYS 5 -12.951 3.533 -3.069 34 HG2 LYS 5 HG2 LYS 5 -15.218 4.132 -3.870 35 HG3 LYS 5 HG3 LYS 5 -15.597 4.825 -2.288 36 HD2 LYS 5 HD2 LYS 5 -15.071 6.623 -3.757 37 HD3 LYS 5 HD3 LYS 5 -13.761 6.488 -2.578 38 HE2 LYS 5 HE2 LYS 5 -12.354 5.321 -4.264 39 HE3 LYS 5 HE3 LYS 5 -13.699 5.351 -5.415 40 HZ1 LYS 5 HZ1 LYS 5 -13.575 7.797 -5.397 41 HZ2 LYS 5 HZ2 LYS 5 -12.345 7.775 -4.328 42 HZ3 LYS 5 HZ3 LYS 5 -12.128 7.176 -5.830 43 H THR 6 H THR 6 -12.374 1.465 -3.221 44 HA THR 6 HA THR 6 -11.785 -0.854 -1.577 45 HB THR 6 HB THR 6 -10.555 -1.734 -3.218 46 HG1 THR 6 HG1 THR 6 -9.405 -0.434 -4.749 47 HG21 THR 6 HG21 THR 6 -11.991 0.328 -4.950 48 HG22 THR 6 HG22 THR 6 -11.449 -1.294 -5.408 49 HG23 THR 6 HG23 THR 6 -12.778 -1.108 -4.253 50 H PHE 7 H PHE 7 -9.274 -1.417 -1.197 51 HA PHE 7 HA PHE 7 -8.298 0.544 0.707 52 HB2 PHE 7 HB2 PHE 7 -6.369 -0.886 0.983 53 HB3 PHE 7 HB3 PHE 7 -7.853 -1.801 1.045 54 HD1 PHE 7 HD1 PHE 7 -8.403 -3.515 -0.658 55 HD2 PHE 7 HD2 PHE 7 -4.769 -1.186 -0.846 56 HE1 PHE 7 HE1 PHE 7 -7.470 -5.082 -2.338 57 HE2 PHE 7 HE2 PHE 7 -3.825 -2.785 -2.468 58 HZ PHE 7 HZ PHE 7 -5.176 -4.727 -3.245 59 H LYS 8 H LYS 8 -8.052 0.473 -2.733 60 HA LYS 8 HA LYS 8 -5.441 1.543 -3.131 61 HB2 LYS 8 HB2 LYS 8 -6.887 0.581 -4.869 62 HB3 LYS 8 HB3 LYS 8 -7.972 1.982 -4.767 63 HG2 LYS 8 HG2 LYS 8 -6.223 3.470 -5.582 64 HG3 LYS 8 HG3 LYS 8 -5.009 2.172 -5.472 65 HD2 LYS 8 HD2 LYS 8 -6.217 0.893 -7.217 66 HD3 LYS 8 HD3 LYS 8 -7.438 2.186 -7.322 67 HE2 LYS 8 HE2 LYS 8 -5.647 3.804 -7.953 68 HE3 LYS 8 HE3 LYS 8 -4.446 2.514 -7.857 69 HZ1 LYS 8 HZ1 LYS 8 -6.747 2.552 -9.758 70 HZ2 LYS 8 HZ2 LYS 8 -5.196 2.875 -10.156 71 HZ3 LYS 8 HZ3 LYS 8 -5.616 1.372 -9.680 72 H GLN 9 H GLN 9 -8.287 3.145 -1.915 73 HA GLN 9 HA GLN 9 -7.511 5.853 -2.248 74 HB2 GLN 9 HB2 GLN 9 -9.212 6.362 -0.706 75 HB3 GLN 9 HB3 GLN 9 -9.755 4.917 -1.557 76 HG2 GLN 9 HG2 GLN 9 -8.897 3.561 0.460 77 HG3 GLN 9 HG3 GLN 9 -8.665 5.104 1.287 78 HE21 GLN 9 HE21 GLN 9 -12.458 3.623 0.815 79 HE22 GLN 9 HE22 GLN 9 -11.045 2.777 0.160 80 H ARG 10 H ARG 10 -6.128 3.470 -0.080 81 HA ARG 10 HA ARG 10 -4.307 5.595 1.010 82 HB2 ARG 10 HB2 ARG 10 -5.607 3.335 2.577 83 HB3 ARG 10 HB3 ARG 10 -4.146 4.163 3.123 84 HG2 ARG 10 HG2 ARG 10 -5.339 6.348 3.037 85 HG3 ARG 10 HG3 ARG 10 -6.815 5.501 2.572 86 HD2 ARG 10 HD2 ARG 10 -7.013 5.888 4.904 87 HD3 ARG 10 HD3 ARG 10 -6.654 4.178 4.725 88 HE ARG 10 HE ARG 10 -4.617 4.481 5.826 89 HH11 ARG 10 HH11 ARG 10 -3.246 5.550 7.251 90 HH12 ARG 10 HH12 ARG 10 -3.300 7.284 7.320 91 HH21 ARG 10 HH21 ARG 10 -5.845 7.686 5.075 92 HH22 ARG 10 HH22 ARG 10 -4.740 8.457 6.180 93 H ARG 11 H ARG 11 -4.460 2.217 -0.100 94 HA ARG 11 HA ARG 11 -1.469 2.075 0.143 95 HB2 ARG 11 HB2 ARG 11 -3.618 0.313 1.171 96 HB3 ARG 11 HB3 ARG 11 -2.470 -0.572 0.189 97 HG2 ARG 11 HG2 ARG 11 -1.844 -0.660 2.533 98 HG3 ARG 11 HG3 ARG 11 -0.604 0.148 1.583 99 HD2 ARG 11 HD2 ARG 11 -1.398 2.349 2.378 100 HD3 ARG 11 HD3 ARG 11 -2.719 1.554 3.275 101 HE ARG 11 HE ARG 11 -0.334 0.367 4.196 102 HH11 ARG 11 HH11 ARG 11 0.766 0.996 5.998 103 HH12 ARG 11 HH12 ARG 11 0.365 2.578 6.722 104 HH21 ARG 11 HH21 ARG 11 -0.906 3.885 5.912 105 HH22 ARG 11 HH22 ARG 11 -1.694 3.663 4.343 106 H THR 12 H THR 12 -0.252 1.231 -1.329 107 HA THR 12 HA THR 12 -1.267 -0.188 -3.678 108 HB THR 12 HB THR 12 -0.226 1.028 -5.317 109 HG1 THR 12 HG1 THR 12 1.227 2.733 -4.881 110 HG21 THR 12 HG21 THR 12 -1.032 3.320 -5.252 111 HG22 THR 12 HG22 THR 12 -2.248 2.269 -4.517 112 HG23 THR 12 HG23 THR 12 -1.195 3.271 -3.486 113 H PHE 13 H PHE 13 0.938 -0.871 -5.043 114 HA PHE 13 HA PHE 13 1.927 -2.955 -3.595 115 HB2 PHE 13 HB2 PHE 13 2.013 -3.037 -5.917 116 HB3 PHE 13 HB3 PHE 13 3.013 -1.596 -6.025 117 HD1 PHE 13 HD1 PHE 13 3.026 -5.200 -5.727 118 HD2 PHE 13 HD2 PHE 13 5.474 -1.673 -5.357 119 HE1 PHE 13 HE1 PHE 13 5.068 -6.621 -5.764 120 HE2 PHE 13 HE2 PHE 13 7.513 -3.086 -5.394 121 HZ PHE 13 HZ PHE 13 7.312 -5.563 -5.583 122 H GLU 14 H GLU 14 3.734 0.112 -3.814 123 HA GLU 14 HA GLU 14 5.988 -0.882 -2.305 124 HB2 GLU 14 HB2 GLU 14 5.008 1.964 -2.752 125 HB3 GLU 14 HB3 GLU 14 6.568 1.515 -2.031 126 HG2 GLU 14 HG2 GLU 14 7.140 0.254 -4.119 127 HG3 GLU 14 HG3 GLU 14 5.650 0.850 -4.860 128 H GLN 15 H GLN 15 3.007 0.829 -1.297 129 HA GLN 15 HA GLN 15 3.787 0.995 1.512 130 HB2 GLN 15 HB2 GLN 15 1.044 1.188 0.198 131 HB3 GLN 15 HB3 GLN 15 1.400 1.594 1.871 132 HG2 GLN 15 HG2 GLN 15 2.493 3.020 -0.591 133 HG3 GLN 15 HG3 GLN 15 1.220 3.597 0.465 134 HE21 GLN 15 HE21 GLN 15 4.508 5.221 1.402 135 HE22 GLN 15 HE22 GLN 15 3.659 5.056 -0.129 136 H ARG 16 H ARG 16 1.995 -1.372 -0.445 137 HA ARG 16 HA ARG 16 1.202 -3.158 1.688 138 HB2 ARG 16 HB2 ARG 16 1.763 -3.481 -1.286 139 HB3 ARG 16 HB3 ARG 16 1.379 -4.870 -0.309 140 HG2 ARG 16 HG2 ARG 16 -0.454 -2.452 -0.211 141 HG3 ARG 16 HG3 ARG 16 -0.501 -3.507 -1.621 142 HD2 ARG 16 HD2 ARG 16 -0.895 -4.482 1.243 143 HD3 ARG 16 HD3 ARG 16 -2.194 -4.093 0.119 144 HE ARG 16 HE ARG 16 -1.520 -5.866 -1.363 145 HH11 ARG 16 HH11 ARG 16 0.451 -7.890 1.428 146 HH12 ARG 16 HH12 ARG 16 0.023 -6.236 1.838 147 HH21 ARG 16 HH21 ARG 16 -0.700 -7.877 -1.694 148 HH22 ARG 16 HH22 ARG 16 -0.050 -8.780 -0.343 149 H VAL 17 H VAL 17 4.159 -3.129 -0.336 150 HA VAL 17 HA VAL 17 5.450 -5.323 1.004 151 HB VAL 17 HB VAL 17 6.503 -2.989 -0.645 152 HG11 VAL 17 HG11 VAL 17 8.093 -5.360 0.440 153 HG12 VAL 17 HG12 VAL 17 8.646 -4.242 -0.830 154 HG13 VAL 17 HG13 VAL 17 8.371 -3.638 0.799 155 HG21 VAL 17 HG21 VAL 17 6.825 -4.713 -2.350 156 HG22 VAL 17 HG22 VAL 17 6.303 -5.986 -1.224 157 HG23 VAL 17 HG23 VAL 17 5.147 -4.776 -1.801 158 H GLU 18 H GLU 18 5.688 -1.721 1.636 159 HA GLU 18 HA GLU 18 7.401 -2.065 3.910 160 HB2 GLU 18 HB2 GLU 18 5.454 0.145 3.186 161 HB3 GLU 18 HB3 GLU 18 6.394 0.168 4.671 162 HG2 GLU 18 HG2 GLU 18 7.512 0.147 1.854 163 HG3 GLU 18 HG3 GLU 18 7.444 1.510 2.975 164 H ASP 19 H ASP 19 3.783 -1.898 3.847 165 HA ASP 19 HA ASP 19 3.393 -2.255 6.606 166 HB2 ASP 19 HB2 ASP 19 1.729 -3.142 4.238 167 HB3 ASP 19 HB3 ASP 19 1.246 -3.447 5.898 168 H VAL 20 H VAL 20 3.828 -4.858 4.188 169 HA VAL 20 HA VAL 20 3.730 -7.040 6.083 170 HB VAL 20 HB VAL 20 4.977 -6.697 3.317 171 HG11 VAL 20 HG11 VAL 20 6.313 -8.441 4.353 172 HG12 VAL 20 HG12 VAL 20 4.865 -9.218 5.024 173 HG13 VAL 20 HG13 VAL 20 5.163 -9.200 3.264 174 HG21 VAL 20 HG21 VAL 20 2.478 -6.712 3.505 175 HG22 VAL 20 HG22 VAL 20 3.105 -8.098 2.614 176 HG23 VAL 20 HG23 VAL 20 2.564 -8.293 4.299 177 H ARG 21 H ARG 21 6.562 -5.156 4.805 178 HA ARG 21 HA ARG 21 8.589 -6.570 6.238 179 HB2 ARG 21 HB2 ARG 21 9.122 -5.129 4.399 180 HB3 ARG 21 HB3 ARG 21 8.376 -3.736 5.175 181 HG2 ARG 21 HG2 ARG 21 10.130 -3.644 6.867 182 HG3 ARG 21 HG3 ARG 21 10.883 -5.109 6.210 183 HD2 ARG 21 HD2 ARG 21 11.366 -3.977 4.106 184 HD3 ARG 21 HD3 ARG 21 10.424 -2.569 4.587 185 HE ARG 21 HE ARG 21 13.062 -3.413 5.704 186 HH11 ARG 21 HH11 ARG 21 10.710 -0.771 5.320 187 HH12 ARG 21 HH12 ARG 21 11.805 0.360 6.061 188 HH21 ARG 21 HH21 ARG 21 14.342 -1.872 6.627 189 HH22 ARG 21 HH22 ARG 21 13.794 -0.228 6.749 190 H LEU 22 H LEU 22 6.793 -3.651 7.193 191 HA LEU 22 HA LEU 22 7.963 -3.338 9.788 192 HB2 LEU 22 HB2 LEU 22 5.293 -2.489 8.600 193 HB3 LEU 22 HB3 LEU 22 5.825 -1.987 10.207 194 HG LEU 22 HG LEU 22 7.598 -1.506 7.800 195 HD11 LEU 22 HD11 LEU 22 6.654 0.713 7.487 196 HD12 LEU 22 HD12 LEU 22 5.380 -0.492 7.269 197 HD13 LEU 22 HD13 LEU 22 5.462 0.426 8.786 198 HD21 LEU 22 HD21 LEU 22 8.445 0.350 9.149 199 HD22 LEU 22 HD22 LEU 22 7.284 -0.028 10.441 200 HD23 LEU 22 HD23 LEU 22 8.582 -1.177 10.032 201 H ILE 23 H ILE 23 4.901 -5.016 8.806 202 HA ILE 23 HA ILE 23 4.355 -5.890 11.494 203 HB ILE 23 HB ILE 23 3.197 -6.407 8.797 204 HG12 ILE 23 HG12 ILE 23 1.145 -5.723 9.916 205 HG13 ILE 23 HG13 ILE 23 1.921 -5.797 11.495 206 HG21 ILE 23 HG21 ILE 23 2.650 -8.257 11.129 207 HG22 ILE 23 HG22 ILE 23 1.569 -8.016 9.754 208 HG23 ILE 23 HG23 ILE 23 3.184 -8.669 9.474 209 HD11 ILE 23 HD11 ILE 23 3.338 -3.819 10.869 210 HD12 ILE 23 HD12 ILE 23 2.496 -3.756 9.304 211 HD13 ILE 23 HD13 ILE 23 1.613 -3.484 10.807 212 H ARG 24 H ARG 24 6.232 -7.515 8.925 213 HA ARG 24 HA ARG 24 6.697 -9.925 10.447 214 HB2 ARG 24 HB2 ARG 24 8.264 -8.482 8.268 215 HB3 ARG 24 HB3 ARG 24 8.881 -9.942 9.013 216 HG2 ARG 24 HG2 ARG 24 6.195 -9.749 7.578 217 HG3 ARG 24 HG3 ARG 24 7.694 -10.332 6.859 218 HD2 ARG 24 HD2 ARG 24 6.158 -11.607 9.160 219 HD3 ARG 24 HD3 ARG 24 6.260 -12.210 7.526 220 HE ARG 24 HE ARG 24 8.280 -12.440 9.643 221 HH11 ARG 24 HH11 ARG 24 7.822 -12.783 6.173 222 HH12 ARG 24 HH12 ARG 24 9.224 -13.802 6.009 223 HH21 ARG 24 HH21 ARG 24 10.047 -13.727 9.345 224 HH22 ARG 24 HH22 ARG 24 10.434 -14.337 7.764 225 H GLU 25 H GLU 25 8.255 -6.739 10.652 226 HA GLU 25 HA GLU 25 10.167 -7.642 12.663 227 HB2 GLU 25 HB2 GLU 25 10.662 -5.764 11.238 228 HB3 GLU 25 HB3 GLU 25 9.285 -4.847 11.874 229 HG2 GLU 25 HG2 GLU 25 10.284 -4.809 14.112 230 HG3 GLU 25 HG3 GLU 25 11.624 -5.821 13.560 231 H GLN 26 H GLN 26 7.120 -5.681 12.967 232 HA GLN 26 HA GLN 26 7.403 -5.733 15.868 233 HB2 GLN 26 HB2 GLN 26 5.494 -4.307 15.961 234 HB3 GLN 26 HB3 GLN 26 6.638 -3.722 14.760 235 HG2 GLN 26 HG2 GLN 26 5.202 -4.248 12.948 236 HG3 GLN 26 HG3 GLN 26 4.240 -5.377 13.909 237 HE21 GLN 26 HE21 GLN 26 1.964 -2.607 13.739 238 HE22 GLN 26 HE22 GLN 26 2.268 -4.258 13.225 239 H HIS 27 H HIS 27 5.532 -7.759 13.701 240 HA HIS 27 HA HIS 27 4.303 -9.183 16.025 241 HB2 HIS 27 HB2 HIS 27 2.732 -8.230 13.597 242 HB3 HIS 27 HB3 HIS 27 2.110 -9.226 14.903 243 HD1 HIS 27 HD1 HIS 27 3.246 -7.219 17.322 244 HD2 HIS 27 HD2 HIS 27 0.756 -6.528 13.985 245 HE1 HIS 27 HE1 HIS 27 1.586 -5.365 18.008 246 HE2 HIS 27 HE2 HIS 27 0.090 -4.935 15.946 247 HA PRO 28 HA PRO 28 6.178 -11.785 12.531 248 HB2 PRO 28 HB2 PRO 28 7.752 -13.465 14.077 249 HB3 PRO 28 HB3 PRO 28 8.279 -11.889 13.410 250 HG2 PRO 28 HG2 PRO 28 7.176 -12.474 16.179 251 HG3 PRO 28 HG3 PRO 28 8.651 -11.548 15.741 252 HD2 PRO 28 HD2 PRO 28 6.368 -10.251 16.296 253 HD3 PRO 28 HD3 PRO 28 7.368 -9.723 14.909 254 H THR 29 H THR 29 4.543 -12.765 15.531 255 HA THR 29 HA THR 29 3.832 -15.421 14.588 256 HB THR 29 HB THR 29 2.629 -15.727 16.551 257 HG1 THR 29 HG1 THR 29 2.043 -13.991 17.888 258 HG21 THR 29 HG21 THR 29 4.113 -15.153 18.344 259 HG22 THR 29 HG22 THR 29 5.120 -15.464 16.920 260 HG23 THR 29 HG23 THR 29 4.809 -13.788 17.449 261 H LYS 30 H LYS 30 2.648 -12.466 13.539 262 HA LYS 30 HA LYS 30 -0.053 -13.602 12.977 263 HB2 LYS 30 HB2 LYS 30 0.776 -10.737 13.500 264 HB3 LYS 30 HB3 LYS 30 -0.804 -11.191 12.832 265 HG2 LYS 30 HG2 LYS 30 -1.433 -12.400 14.782 266 HG3 LYS 30 HG3 LYS 30 0.207 -12.401 15.434 267 HD2 LYS 30 HD2 LYS 30 0.097 -9.993 15.861 268 HD3 LYS 30 HD3 LYS 30 -1.541 -9.909 15.171 269 HE2 LYS 30 HE2 LYS 30 -2.427 -11.346 16.902 270 HE3 LYS 30 HE3 LYS 30 -0.808 -11.795 17.461 271 HZ1 LYS 30 HZ1 LYS 30 -0.512 -9.542 18.293 272 HZ2 LYS 30 HZ2 LYS 30 -1.977 -9.051 17.729 273 HZ3 LYS 30 HZ3 LYS 30 -1.885 -10.192 18.914 274 H ILE 31 H ILE 31 -1.009 -13.417 11.131 275 HA ILE 31 HA ILE 31 0.692 -13.235 8.696 276 HB ILE 31 HB ILE 31 -1.905 -14.699 9.282 277 HG12 ILE 31 HG12 ILE 31 -0.187 -15.638 10.704 278 HG13 ILE 31 HG13 ILE 31 -0.672 -16.766 9.459 279 HG21 ILE 31 HG21 ILE 31 -1.669 -14.301 6.887 280 HG22 ILE 31 HG22 ILE 31 -0.023 -14.965 6.908 281 HG23 ILE 31 HG23 ILE 31 -1.404 -16.017 7.248 282 HD11 ILE 31 HD11 ILE 31 1.762 -16.814 9.850 283 HD12 ILE 31 HD12 ILE 31 1.402 -16.333 8.190 284 HD13 ILE 31 HD13 ILE 31 1.899 -15.111 9.382 285 HA PRO 32 HA PRO 32 -2.069 -9.753 7.674 286 HB2 PRO 32 HB2 PRO 32 -0.294 -9.686 5.243 287 HB3 PRO 32 HB3 PRO 32 -0.921 -8.332 6.221 288 HG2 PRO 32 HG2 PRO 32 1.636 -9.207 6.544 289 HG3 PRO 32 HG3 PRO 32 0.623 -8.751 7.948 290 HD2 PRO 32 HD2 PRO 32 1.284 -11.509 6.943 291 HD3 PRO 32 HD3 PRO 32 1.193 -10.906 8.611 292 H VAL 33 H VAL 33 -3.825 -9.521 6.451 293 HA VAL 33 HA VAL 33 -4.403 -11.327 4.132 294 HB VAL 33 HB VAL 33 -6.042 -10.907 6.673 295 HG11 VAL 33 HG11 VAL 33 -6.933 -12.154 4.042 296 HG12 VAL 33 HG12 VAL 33 -7.812 -12.291 5.584 297 HG13 VAL 33 HG13 VAL 33 -7.634 -10.717 4.828 298 HG21 VAL 33 HG21 VAL 33 -5.085 -13.467 5.337 299 HG22 VAL 33 HG22 VAL 33 -4.437 -12.763 6.833 300 HG23 VAL 33 HG23 VAL 33 -6.099 -13.357 6.790 301 H ILE 34 H ILE 34 -4.958 -10.002 2.468 302 HA ILE 34 HA ILE 34 -6.264 -7.367 3.016 303 HB ILE 34 HB ILE 34 -5.507 -8.609 0.359 304 HG12 ILE 34 HG12 ILE 34 -3.425 -8.341 1.544 305 HG13 ILE 34 HG13 ILE 34 -3.559 -7.119 0.301 306 HG21 ILE 34 HG21 ILE 34 -5.662 -6.211 -0.406 307 HG22 ILE 34 HG22 ILE 34 -7.206 -6.910 0.100 308 HG23 ILE 34 HG23 ILE 34 -6.339 -5.790 1.174 309 HD11 ILE 34 HD11 ILE 34 -2.602 -6.192 2.368 310 HD12 ILE 34 HD12 ILE 34 -4.145 -5.405 2.000 311 HD13 ILE 34 HD13 ILE 34 -4.045 -6.645 3.277 312 H ILE 35 H ILE 35 -8.456 -7.086 2.681 313 HA ILE 35 HA ILE 35 -10.000 -9.371 1.602 314 HB ILE 35 HB ILE 35 -10.192 -9.452 4.015 315 HG12 ILE 35 HG12 ILE 35 -12.839 -8.592 2.759 316 HG13 ILE 35 HG13 ILE 35 -12.057 -10.153 2.453 317 HG21 ILE 35 HG21 ILE 35 -11.458 -7.667 5.235 318 HG22 ILE 35 HG22 ILE 35 -9.938 -7.077 4.588 319 HG23 ILE 35 HG23 ILE 35 -11.475 -6.690 3.765 320 HD11 ILE 35 HD11 ILE 35 -13.721 -10.519 4.095 321 HD12 ILE 35 HD12 ILE 35 -12.161 -10.624 4.934 322 HD13 ILE 35 HD13 ILE 35 -13.181 -9.165 5.090 323 H GLU 36 H GLU 36 -11.911 -8.774 0.376 324 HA GLU 36 HA GLU 36 -12.635 -5.916 0.280 325 HB2 GLU 36 HB2 GLU 36 -10.776 -6.433 -1.478 326 HB3 GLU 36 HB3 GLU 36 -12.021 -7.376 -2.309 327 HG2 GLU 36 HG2 GLU 36 -13.439 -5.254 -2.339 328 HG3 GLU 36 HG3 GLU 36 -12.049 -4.405 -1.666 329 H ARG 37 H ARG 37 -14.765 -5.546 -0.285 330 HA ARG 37 HA ARG 37 -16.664 -7.736 -0.476 331 HB2 ARG 37 HB2 ARG 37 -17.353 -5.512 0.263 332 HB3 ARG 37 HB3 ARG 37 -16.864 -4.800 -1.278 333 HG2 ARG 37 HG2 ARG 37 -18.655 -5.978 -2.467 334 HG3 ARG 37 HG3 ARG 37 -19.018 -6.943 -1.026 335 HD2 ARG 37 HD2 ARG 37 -20.687 -5.254 -1.309 336 HD3 ARG 37 HD3 ARG 37 -19.761 -4.909 0.166 337 HE ARG 37 HE ARG 37 -18.497 -3.395 -1.796 338 HH11 ARG 37 HH11 ARG 37 -21.782 -3.474 -0.556 339 HH12 ARG 37 HH12 ARG 37 -22.111 -1.844 -1.081 340 HH21 ARG 37 HH21 ARG 37 -18.957 -1.276 -2.349 341 HH22 ARG 37 HH22 ARG 37 -20.532 -0.627 -2.026 342 H TYR 38 H TYR 38 -17.352 -8.925 -2.217 343 HA TYR 38 HA TYR 38 -15.614 -9.207 -4.314 344 HB2 TYR 38 HB2 TYR 38 -16.714 -11.086 -3.728 345 HB3 TYR 38 HB3 TYR 38 -18.293 -10.307 -3.776 346 HD1 TYR 38 HD1 TYR 38 -15.530 -11.299 -6.160 347 HD2 TYR 38 HD2 TYR 38 -19.773 -10.916 -5.437 348 HE1 TYR 38 HE1 TYR 38 -16.003 -12.303 -8.377 349 HE2 TYR 38 HE2 TYR 38 -20.229 -11.964 -7.646 350 HH TYR 38 HH TYR 38 -17.631 -12.842 -9.937 351 H LYS 39 H LYS 39 -15.263 -8.796 -6.366 352 HA LYS 39 HA LYS 39 -16.000 -6.272 -7.331 353 HB2 LYS 39 HB2 LYS 39 -13.921 -7.446 -7.863 354 HB3 LYS 39 HB3 LYS 39 -14.794 -8.667 -8.795 355 HG2 LYS 39 HG2 LYS 39 -15.467 -6.964 -10.453 356 HG3 LYS 39 HG3 LYS 39 -14.679 -5.701 -9.485 357 HD2 LYS 39 HD2 LYS 39 -12.488 -6.813 -9.811 358 HD3 LYS 39 HD3 LYS 39 -13.279 -8.100 -10.752 359 HE2 LYS 39 HE2 LYS 39 -14.057 -6.397 -12.400 360 HE3 LYS 39 HE3 LYS 39 -13.257 -5.124 -11.467 361 HZ1 LYS 39 HZ1 LYS 39 -11.119 -6.229 -11.909 362 HZ2 LYS 39 HZ2 LYS 39 -11.854 -7.413 -12.769 363 HZ3 LYS 39 HZ3 LYS 39 -11.866 -5.878 -13.320 364 H GLY 40 H GLY 40 -17.270 -9.426 -8.393 365 HA2 GLY 40 HA2 GLY 40 -18.736 -8.402 -10.630 366 HA3 GLY 40 HA3 GLY 40 -18.881 -10.012 -9.931 367 H GLU 41 H GLU 41 -19.724 -8.781 -7.247 368 HA GLU 41 HA GLU 41 -22.317 -7.542 -7.854 369 HB2 GLU 41 HB2 GLU 41 -22.799 -9.913 -8.232 370 HB3 GLU 41 HB3 GLU 41 -22.075 -10.327 -6.690 371 HG2 GLU 41 HG2 GLU 41 -24.383 -10.497 -6.377 372 HG3 GLU 41 HG3 GLU 41 -23.914 -9.025 -5.544 373 H LYS 42 H LYS 42 -22.199 -5.857 -6.538 374 HA LYS 42 HA LYS 42 -20.925 -6.074 -3.876 375 HB2 LYS 42 HB2 LYS 42 -21.664 -3.660 -5.576 376 HB3 LYS 42 HB3 LYS 42 -20.872 -3.587 -4.004 377 HG2 LYS 42 HG2 LYS 42 -18.997 -4.985 -4.910 378 HG3 LYS 42 HG3 LYS 42 -19.747 -4.880 -6.512 379 HD2 LYS 42 HD2 LYS 42 -19.562 -2.356 -6.349 380 HD3 LYS 42 HD3 LYS 42 -18.760 -2.552 -4.794 381 HE2 LYS 42 HE2 LYS 42 -17.021 -2.167 -6.352 382 HE3 LYS 42 HE3 LYS 42 -16.929 -3.870 -5.942 383 HZ1 LYS 42 HZ1 LYS 42 -18.246 -2.782 -8.402 384 HZ2 LYS 42 HZ2 LYS 42 -16.762 -3.441 -8.374 385 HZ3 LYS 42 HZ3 LYS 42 -18.069 -4.385 -8.077 386 H GLN 43 H GLN 43 -23.360 -7.330 -3.905 387 HA GLN 43 HA GLN 43 -25.599 -5.755 -3.010 388 HB2 GLN 43 HB2 GLN 43 -24.828 -8.680 -2.751 389 HB3 GLN 43 HB3 GLN 43 -26.351 -8.080 -2.103 390 HG2 GLN 43 HG2 GLN 43 -25.612 -7.507 -4.982 391 HG3 GLN 43 HG3 GLN 43 -26.182 -9.112 -4.511 392 HE21 GLN 43 HE21 GLN 43 -29.219 -7.617 -5.659 393 HE22 GLN 43 HE22 GLN 43 -27.706 -8.361 -6.238 394 H LEU 44 H LEU 44 -23.093 -7.477 -1.178 395 HA LEU 44 HA LEU 44 -24.390 -7.105 1.378 396 HB2 LEU 44 HB2 LEU 44 -21.564 -7.959 0.624 397 HB3 LEU 44 HB3 LEU 44 -22.238 -8.066 2.252 398 HG LEU 44 HG LEU 44 -23.135 -9.618 -0.214 399 HD11 LEU 44 HD11 LEU 44 -22.447 -11.565 1.161 400 HD12 LEU 44 HD12 LEU 44 -21.101 -10.438 0.852 401 HD13 LEU 44 HD13 LEU 44 -21.908 -10.463 2.443 402 HD21 LEU 44 HD21 LEU 44 -24.674 -10.835 1.337 403 HD22 LEU 44 HD22 LEU 44 -24.374 -9.593 2.569 404 HD23 LEU 44 HD23 LEU 44 -25.167 -9.172 1.025 405 HA PRO 45 HA PRO 45 -23.461 -3.091 2.454 406 HB2 PRO 45 HB2 PRO 45 -22.961 -3.107 5.178 407 HB3 PRO 45 HB3 PRO 45 -24.562 -3.386 4.434 408 HG2 PRO 45 HG2 PRO 45 -22.536 -5.473 5.312 409 HG3 PRO 45 HG3 PRO 45 -24.292 -5.397 5.700 410 HD2 PRO 45 HD2 PRO 45 -23.424 -6.955 3.702 411 HD3 PRO 45 HD3 PRO 45 -24.887 -5.966 3.452 412 H VAL 46 H VAL 46 -22.012 -1.434 3.152 413 HA VAL 46 HA VAL 46 -19.281 -1.872 2.418 414 HB VAL 46 HB VAL 46 -19.034 0.483 2.516 415 HG11 VAL 46 HG11 VAL 46 -21.881 -0.025 1.563 416 HG12 VAL 46 HG12 VAL 46 -20.783 1.264 1.059 417 HG13 VAL 46 HG13 VAL 46 -20.396 -0.413 0.660 418 HG21 VAL 46 HG21 VAL 46 -21.690 0.670 4.012 419 HG22 VAL 46 HG22 VAL 46 -20.086 1.043 4.675 420 HG23 VAL 46 HG23 VAL 46 -20.749 2.033 3.377 421 H LEU 47 H LEU 47 -20.044 -3.219 4.937 422 HA LEU 47 HA LEU 47 -18.342 -2.044 7.027 423 HB2 LEU 47 HB2 LEU 47 -19.675 -4.758 6.715 424 HB3 LEU 47 HB3 LEU 47 -18.757 -4.267 8.136 425 HG LEU 47 HG LEU 47 -21.255 -2.803 7.164 426 HD11 LEU 47 HD11 LEU 47 -20.913 -4.874 9.363 427 HD12 LEU 47 HD12 LEU 47 -22.396 -3.938 9.030 428 HD13 LEU 47 HD13 LEU 47 -21.792 -5.090 7.829 429 HD21 LEU 47 HD21 LEU 47 -21.255 -1.869 9.468 430 HD22 LEU 47 HD22 LEU 47 -19.703 -2.674 9.792 431 HD23 LEU 47 HD23 LEU 47 -19.813 -1.383 8.573 432 H ASP 48 H ASP 48 -17.508 -3.285 4.135 433 HA ASP 48 HA ASP 48 -15.458 -5.143 4.505 434 HB2 ASP 48 HB2 ASP 48 -16.355 -4.462 2.330 435 HB3 ASP 48 HB3 ASP 48 -15.717 -2.846 2.537 436 H LYS 49 H LYS 49 -14.130 -4.859 6.260 437 HA LYS 49 HA LYS 49 -12.810 -2.395 6.920 438 HB2 LYS 49 HB2 LYS 49 -11.975 -5.200 7.768 439 HB3 LYS 49 HB3 LYS 49 -11.523 -3.667 8.530 440 HG2 LYS 49 HG2 LYS 49 -14.078 -3.279 8.859 441 HG3 LYS 49 HG3 LYS 49 -14.259 -4.977 8.416 442 HD2 LYS 49 HD2 LYS 49 -14.193 -5.184 10.705 443 HD3 LYS 49 HD3 LYS 49 -12.500 -5.429 10.305 444 HE2 LYS 49 HE2 LYS 49 -12.409 -3.996 12.137 445 HE3 LYS 49 HE3 LYS 49 -12.157 -2.909 10.770 446 HZ1 LYS 49 HZ1 LYS 49 -13.756 -1.976 12.373 447 HZ2 LYS 49 HZ2 LYS 49 -14.574 -2.282 10.983 448 HZ3 LYS 49 HZ3 LYS 49 -14.730 -3.284 12.272 449 H THR 50 H THR 50 -12.134 -4.331 4.288 450 HA THR 50 HA THR 50 -10.547 -4.617 2.873 451 HB THR 50 HB THR 50 -9.561 -2.920 1.838 452 HG1 THR 50 HG1 THR 50 -8.115 -2.032 3.159 453 HG21 THR 50 HG21 THR 50 -11.952 -2.361 2.063 454 HG22 THR 50 HG22 THR 50 -11.596 -1.461 3.552 455 HG23 THR 50 HG23 THR 50 -10.922 -0.914 2.007 456 H LYS 51 H LYS 51 -8.986 -4.026 5.937 457 HA LYS 51 HA LYS 51 -6.879 -5.988 5.076 458 HB2 LYS 51 HB2 LYS 51 -6.523 -3.446 6.717 459 HB3 LYS 51 HB3 LYS 51 -5.356 -4.777 6.728 460 HG2 LYS 51 HG2 LYS 51 -4.946 -4.540 4.343 461 HG3 LYS 51 HG3 LYS 51 -6.215 -3.323 4.192 462 HD2 LYS 51 HD2 LYS 51 -4.047 -2.251 4.163 463 HD3 LYS 51 HD3 LYS 51 -4.970 -1.755 5.603 464 HE2 LYS 51 HE2 LYS 51 -3.674 -3.357 6.999 465 HE3 LYS 51 HE3 LYS 51 -2.756 -3.879 5.576 466 HZ1 LYS 51 HZ1 LYS 51 -1.629 -2.154 7.014 467 HZ2 LYS 51 HZ2 LYS 51 -1.701 -1.707 5.464 468 HZ3 LYS 51 HZ3 LYS 51 -2.752 -1.047 6.558 469 H PHE 52 H PHE 52 -6.165 -7.418 6.562 470 HA PHE 52 HA PHE 52 -7.121 -7.407 9.312 471 HB2 PHE 52 HB2 PHE 52 -7.830 -9.583 7.348 472 HB3 PHE 52 HB3 PHE 52 -7.653 -9.948 9.050 473 HD1 PHE 52 HD1 PHE 52 -10.059 -9.254 6.665 474 HD2 PHE 52 HD2 PHE 52 -8.898 -8.108 10.640 475 HE1 PHE 52 HE1 PHE 52 -12.408 -8.597 7.174 476 HE2 PHE 52 HE2 PHE 52 -11.252 -7.497 11.166 477 HZ PHE 52 HZ PHE 52 -13.015 -7.767 9.427 478 H LEU 53 H LEU 53 -5.982 -8.807 10.781 479 HA LEU 53 HA LEU 53 -3.453 -10.013 9.786 480 HB2 LEU 53 HB2 LEU 53 -3.696 -7.768 11.693 481 HB3 LEU 53 HB3 LEU 53 -3.061 -9.181 12.494 482 HG LEU 53 HG LEU 53 -1.280 -9.332 10.699 483 HD11 LEU 53 HD11 LEU 53 -2.404 -7.895 8.969 484 HD12 LEU 53 HD12 LEU 53 -2.217 -6.506 10.045 485 HD13 LEU 53 HD13 LEU 53 -0.786 -7.313 9.391 486 HD21 LEU 53 HD21 LEU 53 -0.855 -8.364 12.933 487 HD22 LEU 53 HD22 LEU 53 0.064 -7.502 11.690 488 HD23 LEU 53 HD23 LEU 53 -1.410 -6.776 12.365 489 H VAL 54 H VAL 54 -3.097 -12.033 10.734 490 HA VAL 54 HA VAL 54 -5.104 -12.946 12.741 491 HB VAL 54 HB VAL 54 -4.343 -14.778 10.509 492 HG11 VAL 54 HG11 VAL 54 -5.607 -15.577 12.497 493 HG12 VAL 54 HG12 VAL 54 -6.897 -14.412 12.133 494 HG13 VAL 54 HG13 VAL 54 -6.532 -15.736 11.002 495 HG21 VAL 54 HG21 VAL 54 -6.563 -12.721 10.281 496 HG22 VAL 54 HG22 VAL 54 -5.106 -12.830 9.256 497 HG23 VAL 54 HG23 VAL 54 -6.302 -14.115 9.202 498 HA PRO 55 HA PRO 55 -1.451 -14.791 14.679 499 HB2 PRO 55 HB2 PRO 55 -3.519 -16.409 16.153 500 HB3 PRO 55 HB3 PRO 55 -2.083 -15.553 16.790 501 HG2 PRO 55 HG2 PRO 55 -4.569 -14.494 17.090 502 HG3 PRO 55 HG3 PRO 55 -3.178 -13.445 16.668 503 HD2 PRO 55 HD2 PRO 55 -5.310 -14.565 14.832 504 HD3 PRO 55 HD3 PRO 55 -4.624 -12.915 14.896 505 H ASP 56 H ASP 56 -0.270 -16.558 14.048 506 HA ASP 56 HA ASP 56 -1.070 -18.009 11.844 507 HB2 ASP 56 HB2 ASP 56 0.954 -19.434 12.243 508 HB3 ASP 56 HB3 ASP 56 1.195 -17.692 12.200 509 H HIS 57 H HIS 57 -1.586 -19.061 15.128 510 HA HIS 57 HA HIS 57 -2.270 -21.815 14.478 511 HB2 HIS 57 HB2 HIS 57 -2.532 -20.101 16.974 512 HB3 HIS 57 HB3 HIS 57 -3.187 -21.730 16.892 513 HD1 HIS 57 HD1 HIS 57 0.371 -20.235 16.109 514 HD2 HIS 57 HD2 HIS 57 -1.666 -23.442 17.980 515 HE1 HIS 57 HE1 HIS 57 2.169 -21.729 17.173 516 HE2 HIS 57 HE2 HIS 57 0.931 -23.683 18.305 517 H VAL 58 H VAL 58 -4.111 -18.985 13.961 518 HA VAL 58 HA VAL 58 -6.770 -19.981 14.617 519 HB VAL 58 HB VAL 58 -5.757 -17.779 12.807 520 HG11 VAL 58 HG11 VAL 58 -8.647 -18.470 13.426 521 HG12 VAL 58 HG12 VAL 58 -8.116 -16.905 12.791 522 HG13 VAL 58 HG13 VAL 58 -7.869 -18.359 11.830 523 HG21 VAL 58 HG21 VAL 58 -7.193 -17.787 15.502 524 HG22 VAL 58 HG22 VAL 58 -5.480 -17.399 15.235 525 HG23 VAL 58 HG23 VAL 58 -6.743 -16.333 14.599 526 H ASN 59 H ASN 59 -8.193 -21.140 13.383 527 HA ASN 59 HA ASN 59 -7.203 -22.495 10.956 528 HB2 ASN 59 HB2 ASN 59 -9.814 -22.683 12.495 529 HB3 ASN 59 HB3 ASN 59 -9.440 -23.649 11.070 530 HD21 ASN 59 HD21 ASN 59 -8.630 -25.643 14.120 531 HD22 ASN 59 HD22 ASN 59 -10.077 -24.847 13.529 532 H MET 60 H MET 60 -8.225 -22.458 8.863 533 HA MET 60 HA MET 60 -8.871 -19.860 7.939 534 HB2 MET 60 HB2 MET 60 -7.906 -21.690 6.590 535 HB3 MET 60 HB3 MET 60 -9.436 -22.555 6.650 536 HG2 MET 60 HG2 MET 60 -9.291 -21.479 4.538 537 HG3 MET 60 HG3 MET 60 -10.535 -20.641 5.461 538 HE1 MET 60 HE1 MET 60 -10.736 -18.438 4.392 539 HE2 MET 60 HE2 MET 60 -10.402 -18.095 6.111 540 HE3 MET 60 HE3 MET 60 -9.634 -17.125 4.836 541 H SER 61 H SER 61 -11.194 -22.588 8.541 542 HA SER 61 HA SER 61 -13.586 -21.131 8.099 543 HB2 SER 61 HB2 SER 61 -14.607 -22.883 9.525 544 HB3 SER 61 HB3 SER 61 -13.512 -23.551 8.300 545 HG SER 61 HG SER 61 -13.217 -24.441 10.465 546 H GLU 62 H GLU 62 -11.534 -21.275 11.004 547 HA GLU 62 HA GLU 62 -13.310 -19.863 12.772 548 HB2 GLU 62 HB2 GLU 62 -11.482 -21.288 13.516 549 HB3 GLU 62 HB3 GLU 62 -10.306 -20.195 12.787 550 HG2 GLU 62 HG2 GLU 62 -11.035 -18.406 14.376 551 HG3 GLU 62 HG3 GLU 62 -12.103 -19.588 15.151 552 H LEU 63 H LEU 63 -10.598 -18.661 10.690 553 HA LEU 63 HA LEU 63 -10.961 -15.866 11.217 554 HB2 LEU 63 HB2 LEU 63 -8.998 -16.701 10.005 555 HB3 LEU 63 HB3 LEU 63 -10.016 -17.348 8.723 556 HG LEU 63 HG LEU 63 -10.742 -14.970 8.162 557 HD11 LEU 63 HD11 LEU 63 -10.215 -13.872 10.301 558 HD12 LEU 63 HD12 LEU 63 -8.508 -14.283 10.113 559 HD13 LEU 63 HD13 LEU 63 -9.281 -13.138 8.990 560 HD21 LEU 63 HD21 LEU 63 -7.760 -15.498 7.989 561 HD22 LEU 63 HD22 LEU 63 -8.994 -16.126 6.878 562 HD23 LEU 63 HD23 LEU 63 -8.713 -14.387 6.968 563 H ILE 64 H ILE 64 -12.511 -17.983 8.774 564 HA ILE 64 HA ILE 64 -14.149 -15.999 7.548 565 HB ILE 64 HB ILE 64 -14.449 -19.003 7.875 566 HG12 ILE 64 HG12 ILE 64 -13.690 -17.178 5.573 567 HG13 ILE 64 HG13 ILE 64 -12.581 -18.110 6.523 568 HG21 ILE 64 HG21 ILE 64 -16.748 -18.137 7.633 569 HG22 ILE 64 HG22 ILE 64 -16.239 -17.201 6.200 570 HG23 ILE 64 HG23 ILE 64 -16.231 -18.982 6.190 571 HD11 ILE 64 HD11 ILE 64 -13.722 -20.221 5.722 572 HD12 ILE 64 HD12 ILE 64 -14.626 -19.195 4.570 573 HD13 ILE 64 HD13 ILE 64 -12.867 -19.292 4.483 574 H LYS 65 H LYS 65 -14.840 -17.994 10.438 575 HA LYS 65 HA LYS 65 -17.497 -17.032 10.804 576 HB2 LYS 65 HB2 LYS 65 -16.286 -19.090 11.803 577 HB3 LYS 65 HB3 LYS 65 -15.668 -17.995 13.044 578 HG2 LYS 65 HG2 LYS 65 -18.050 -17.379 13.595 579 HG3 LYS 65 HG3 LYS 65 -18.596 -18.498 12.328 580 HD2 LYS 65 HD2 LYS 65 -17.537 -20.395 13.557 581 HD3 LYS 65 HD3 LYS 65 -16.946 -19.272 14.783 582 HE2 LYS 65 HE2 LYS 65 -18.860 -20.344 15.701 583 HE3 LYS 65 HE3 LYS 65 -19.309 -18.674 15.364 584 HZ1 LYS 65 HZ1 LYS 65 -19.992 -21.009 13.630 585 HZ2 LYS 65 HZ2 LYS 65 -21.021 -20.270 14.652 586 HZ3 LYS 65 HZ3 LYS 65 -20.469 -19.468 13.345 587 H ILE 66 H ILE 66 -14.426 -15.756 12.240 588 HA ILE 66 HA ILE 66 -15.845 -13.616 13.601 589 HB ILE 66 HB ILE 66 -13.809 -14.266 14.523 590 HG12 ILE 66 HG12 ILE 66 -14.518 -11.796 14.587 591 HG13 ILE 66 HG13 ILE 66 -12.923 -12.252 15.136 592 HG21 ILE 66 HG21 ILE 66 -12.362 -13.468 11.965 593 HG22 ILE 66 HG22 ILE 66 -11.573 -13.782 13.533 594 HG23 ILE 66 HG23 ILE 66 -12.465 -15.070 12.723 595 HD11 ILE 66 HD11 ILE 66 -13.485 -10.920 12.456 596 HD12 ILE 66 HD12 ILE 66 -12.786 -10.179 13.906 597 HD13 ILE 66 HD13 ILE 66 -11.902 -11.431 13.042 598 H ILE 67 H ILE 67 -14.373 -13.771 10.335 599 HA ILE 67 HA ILE 67 -14.973 -11.031 9.652 600 HB ILE 67 HB ILE 67 -14.313 -13.531 8.146 601 HG12 ILE 67 HG12 ILE 67 -12.588 -12.170 7.167 602 HG13 ILE 67 HG13 ILE 67 -13.343 -10.682 7.727 603 HG21 ILE 67 HG21 ILE 67 -14.633 -12.467 5.950 604 HG22 ILE 67 HG22 ILE 67 -16.180 -12.743 6.744 605 HG23 ILE 67 HG23 ILE 67 -15.478 -11.103 6.711 606 HD11 ILE 67 HD11 ILE 67 -12.091 -12.740 9.577 607 HD12 ILE 67 HD12 ILE 67 -11.283 -11.291 8.959 608 HD13 ILE 67 HD13 ILE 67 -12.688 -11.125 10.025 609 H ARG 68 H ARG 68 -17.047 -13.957 9.237 610 HA ARG 68 HA ARG 68 -19.304 -12.603 8.154 611 HB2 ARG 68 HB2 ARG 68 -18.881 -15.143 8.447 612 HB3 ARG 68 HB3 ARG 68 -19.458 -14.955 10.105 613 HG2 ARG 68 HG2 ARG 68 -21.586 -13.925 9.067 614 HG3 ARG 68 HG3 ARG 68 -20.979 -14.477 7.506 615 HD2 ARG 68 HD2 ARG 68 -20.787 -16.762 9.080 616 HD3 ARG 68 HD3 ARG 68 -22.205 -15.991 9.764 617 HE ARG 68 HE ARG 68 -21.988 -17.406 7.272 618 HH11 ARG 68 HH11 ARG 68 -23.776 -17.675 5.918 619 HH12 ARG 68 HH12 ARG 68 -25.045 -16.466 5.952 620 HH21 ARG 68 HH21 ARG 68 -23.818 -14.706 8.584 621 HH22 ARG 68 HH22 ARG 68 -25.148 -14.982 7.488 622 H ARG 69 H ARG 69 -18.452 -13.123 11.578 623 HA ARG 69 HA ARG 69 -20.692 -11.725 12.716 624 HB2 ARG 69 HB2 ARG 69 -19.334 -13.403 13.891 625 HB3 ARG 69 HB3 ARG 69 -17.940 -12.315 13.901 626 HG2 ARG 69 HG2 ARG 69 -19.098 -10.738 15.359 627 HG3 ARG 69 HG3 ARG 69 -20.625 -11.608 15.164 628 HD2 ARG 69 HD2 ARG 69 -19.689 -12.113 17.331 629 HD3 ARG 69 HD3 ARG 69 -19.705 -13.557 16.328 630 HE ARG 69 HE ARG 69 -17.263 -11.847 16.794 631 HH11 ARG 69 HH11 ARG 69 -18.617 -15.082 16.722 632 HH12 ARG 69 HH12 ARG 69 -17.098 -15.821 17.154 633 HH21 ARG 69 HH21 ARG 69 -15.366 -12.861 17.340 634 HH22 ARG 69 HH22 ARG 69 -15.310 -14.590 17.470 635 H ARG 70 H ARG 70 -17.363 -10.506 12.047 636 HA ARG 70 HA ARG 70 -17.903 -7.799 12.948 637 HB2 ARG 70 HB2 ARG 70 -15.822 -8.950 11.032 638 HB3 ARG 70 HB3 ARG 70 -15.847 -7.255 11.498 639 HG2 ARG 70 HG2 ARG 70 -15.612 -9.526 13.516 640 HG3 ARG 70 HG3 ARG 70 -14.239 -8.700 12.768 641 HD2 ARG 70 HD2 ARG 70 -14.832 -6.592 13.766 642 HD3 ARG 70 HD3 ARG 70 -16.341 -7.230 14.394 643 HE ARG 70 HE ARG 70 -13.576 -7.883 15.342 644 HH11 ARG 70 HH11 ARG 70 -17.031 -8.124 15.989 645 HH12 ARG 70 HH12 ARG 70 -16.776 -8.505 17.664 646 HH21 ARG 70 HH21 ARG 70 -13.359 -8.264 17.553 647 HH22 ARG 70 HH22 ARG 70 -14.766 -8.662 18.484 648 H LEU 71 H LEU 71 -18.420 -9.319 9.808 649 HA LEU 71 HA LEU 71 -19.449 -6.872 8.561 650 HB2 LEU 71 HB2 LEU 71 -19.579 -9.815 7.791 651 HB3 LEU 71 HB3 LEU 71 -20.177 -8.503 6.776 652 HG LEU 71 HG LEU 71 -17.258 -8.764 7.618 653 HD11 LEU 71 HD11 LEU 71 -16.924 -9.508 5.271 654 HD12 LEU 71 HD12 LEU 71 -17.960 -10.629 6.180 655 HD13 LEU 71 HD13 LEU 71 -18.688 -9.490 5.027 656 HD21 LEU 71 HD21 LEU 71 -18.688 -6.963 5.615 657 HD22 LEU 71 HD22 LEU 71 -17.823 -6.456 7.086 658 HD23 LEU 71 HD23 LEU 71 -16.925 -7.146 5.731 659 H GLN 72 H GLN 72 -20.781 -8.494 11.095 660 HA GLN 72 HA GLN 72 -22.807 -8.734 12.000 661 HB2 GLN 72 HB2 GLN 72 -23.662 -6.513 10.122 662 HB3 GLN 72 HB3 GLN 72 -24.509 -7.036 11.571 663 HG2 GLN 72 HG2 GLN 72 -22.566 -6.397 12.980 664 HG3 GLN 72 HG3 GLN 72 -21.703 -5.833 11.549 665 HE21 GLN 72 HE21 GLN 72 -23.107 -2.766 12.967 666 HE22 GLN 72 HE22 GLN 72 -21.829 -3.915 13.330 667 H LEU 73 H LEU 73 -22.276 -10.394 9.521 668 HA LEU 73 HA LEU 73 -24.903 -10.603 8.231 669 HB2 LEU 73 HB2 LEU 73 -22.353 -12.192 7.827 670 HB3 LEU 73 HB3 LEU 73 -23.806 -12.333 6.833 671 HG LEU 73 HG LEU 73 -22.134 -9.806 7.148 672 HD11 LEU 73 HD11 LEU 73 -21.281 -10.228 4.934 673 HD12 LEU 73 HD12 LEU 73 -20.934 -11.620 5.975 674 HD13 LEU 73 HD13 LEU 73 -22.266 -11.698 4.796 675 HD21 LEU 73 HD21 LEU 73 -24.446 -9.243 6.525 676 HD22 LEU 73 HD22 LEU 73 -23.371 -9.021 5.142 677 HD23 LEU 73 HD23 LEU 73 -24.405 -10.463 5.221 678 H ASN 74 H ASN 74 -26.424 -11.357 9.530 679 HA ASN 74 HA ASN 74 -26.200 -13.455 11.465 680 HB2 ASN 74 HB2 ASN 74 -27.908 -11.619 11.395 681 HB3 ASN 74 HB3 ASN 74 -28.626 -12.343 9.955 682 HD21 ASN 74 HD21 ASN 74 -29.740 -13.694 13.578 683 HD22 ASN 74 HD22 ASN 74 -28.656 -12.321 13.403 684 H ALA 75 H ALA 75 -27.058 -15.663 11.372 685 HA ALA 75 HA ALA 75 -26.302 -17.188 9.119 686 HB1 ALA 75 HB1 ALA 75 -27.453 -19.023 10.316 687 HB2 ALA 75 HB2 ALA 75 -26.487 -18.036 11.430 688 HB3 ALA 75 HB3 ALA 75 -28.261 -17.846 11.369 689 H ASN 76 H ASN 76 -29.378 -15.570 9.717 690 HA ASN 76 HA ASN 76 -31.016 -16.876 7.794 691 HB2 ASN 76 HB2 ASN 76 -31.855 -15.380 9.545 692 HB3 ASN 76 HB3 ASN 76 -30.956 -14.019 8.870 693 HD21 ASN 76 HD21 ASN 76 -34.505 -15.119 7.164 694 HD22 ASN 76 HD22 ASN 76 -33.711 -16.209 8.298 695 H GLN 77 H GLN 77 -28.429 -14.497 7.274 696 HA GLN 77 HA GLN 77 -29.288 -14.170 4.439 697 HB2 GLN 77 HB2 GLN 77 -27.875 -12.159 4.374 698 HB3 GLN 77 HB3 GLN 77 -29.300 -12.083 5.406 699 HG2 GLN 77 HG2 GLN 77 -27.844 -12.455 7.418 700 HG3 GLN 77 HG3 GLN 77 -26.418 -12.343 6.365 701 HE21 GLN 77 HE21 GLN 77 -27.563 -8.709 5.821 702 HE22 GLN 77 HE22 GLN 77 -27.659 -10.061 4.712 703 H ALA 78 H ALA 78 -28.031 -14.530 2.730 704 HA ALA 78 HA ALA 78 -26.184 -16.699 3.008 705 HB1 ALA 78 HB1 ALA 78 -26.164 -16.634 0.542 706 HB2 ALA 78 HB2 ALA 78 -27.816 -16.526 1.183 707 HB3 ALA 78 HB3 ALA 78 -27.001 -15.069 0.566 708 H PHE 79 H PHE 79 -24.029 -16.852 2.768 709 HA PHE 79 HA PHE 79 -22.355 -14.719 1.828 710 HB2 PHE 79 HB2 PHE 79 -22.476 -13.615 3.760 711 HB3 PHE 79 HB3 PHE 79 -22.755 -15.038 4.732 712 HD1 PHE 79 HD1 PHE 79 -20.202 -12.699 3.585 713 HD2 PHE 79 HD2 PHE 79 -20.873 -16.589 5.315 714 HE1 PHE 79 HE1 PHE 79 -17.899 -12.691 4.531 715 HE2 PHE 79 HE2 PHE 79 -18.581 -16.589 6.231 716 HZ PHE 79 HZ PHE 79 -17.093 -14.636 5.864 717 H PHE 80 H PHE 80 -20.355 -15.173 1.231 718 HA PHE 80 HA PHE 80 -19.033 -17.671 2.135 719 HB2 PHE 80 HB2 PHE 80 -19.271 -16.833 -0.784 720 HB3 PHE 80 HB3 PHE 80 -18.342 -18.193 -0.167 721 HD1 PHE 80 HD1 PHE 80 -21.678 -16.968 -1.081 722 HD2 PHE 80 HD2 PHE 80 -19.491 -20.235 0.687 723 HE1 PHE 80 HE1 PHE 80 -23.652 -18.451 -1.380 724 HE2 PHE 80 HE2 PHE 80 -21.467 -21.714 0.391 725 HZ PHE 80 HZ PHE 80 -23.548 -20.820 -0.635 726 H LEU 81 H LEU 81 -16.910 -17.326 2.559 727 HA LEU 81 HA LEU 81 -15.613 -14.796 1.636 728 HB2 LEU 81 HB2 LEU 81 -15.694 -15.109 4.030 729 HB3 LEU 81 HB3 LEU 81 -14.960 -16.691 3.892 730 HG LEU 81 HG LEU 81 -13.461 -14.970 4.774 731 HD11 LEU 81 HD11 LEU 81 -11.513 -15.567 3.701 732 HD12 LEU 81 HD12 LEU 81 -12.585 -16.923 3.326 733 HD13 LEU 81 HD13 LEU 81 -12.249 -15.676 2.096 734 HD21 LEU 81 HD21 LEU 81 -13.542 -13.608 2.054 735 HD22 LEU 81 HD22 LEU 81 -14.316 -13.016 3.545 736 HD23 LEU 81 HD23 LEU 81 -12.553 -13.156 3.459 737 H LEU 82 H LEU 82 -14.250 -14.906 0.048 738 HA LEU 82 HA LEU 82 -13.490 -17.534 -1.069 739 HB2 LEU 82 HB2 LEU 82 -13.719 -14.925 -2.577 740 HB3 LEU 82 HB3 LEU 82 -13.785 -16.564 -3.205 741 HG LEU 82 HG LEU 82 -15.974 -15.149 -1.586 742 HD11 LEU 82 HD11 LEU 82 -15.705 -14.343 -3.919 743 HD12 LEU 82 HD12 LEU 82 -15.833 -16.009 -4.511 744 HD13 LEU 82 HD13 LEU 82 -17.211 -15.234 -3.704 745 HD21 LEU 82 HD21 LEU 82 -16.052 -17.582 -1.151 746 HD22 LEU 82 HD22 LEU 82 -17.357 -17.134 -2.257 747 HD23 LEU 82 HD23 LEU 82 -15.895 -17.921 -2.888 748 H VAL 83 H VAL 83 -11.391 -17.996 -0.535 749 HA VAL 83 HA VAL 83 -9.322 -15.875 -0.407 750 HB VAL 83 HB VAL 83 -8.897 -18.858 -0.133 751 HG11 VAL 83 HG11 VAL 83 -6.835 -18.169 1.045 752 HG12 VAL 83 HG12 VAL 83 -6.839 -17.588 -0.621 753 HG13 VAL 83 HG13 VAL 83 -7.198 -16.462 0.704 754 HG21 VAL 83 HG21 VAL 83 -10.447 -18.160 1.642 755 HG22 VAL 83 HG22 VAL 83 -8.836 -18.432 2.320 756 HG23 VAL 83 HG23 VAL 83 -9.417 -16.775 2.036 757 H ASN 84 H ASN 84 -7.985 -15.348 -2.079 758 HA ASN 84 HA ASN 84 -7.558 -15.048 -4.317 759 HB2 ASN 84 HB2 ASN 84 -5.942 -16.800 -3.472 760 HB3 ASN 84 HB3 ASN 84 -6.961 -18.029 -4.223 761 HD21 ASN 84 HD21 ASN 84 -4.332 -17.385 -6.671 762 HD22 ASN 84 HD22 ASN 84 -4.543 -18.180 -5.102 763 H GLY 85 H GLY 85 -10.194 -15.018 -4.037 764 HA2 GLY 85 HA2 GLY 85 -12.107 -14.985 -5.284 765 HA3 GLY 85 HA3 GLY 85 -11.206 -15.667 -6.633 766 H HIS 86 H HIS 86 -11.038 -17.860 -3.987 767 HA HIS 86 HA HIS 86 -13.444 -19.374 -4.955 768 HB2 HIS 86 HB2 HIS 86 -10.645 -20.444 -4.437 769 HB3 HIS 86 HB3 HIS 86 -12.064 -21.430 -4.782 770 HD1 HIS 86 HD1 HIS 86 -9.696 -18.954 -6.580 771 HD2 HIS 86 HD2 HIS 86 -13.043 -21.451 -7.280 772 HE1 HIS 86 HE1 HIS 86 -9.959 -19.123 -9.137 773 HE2 HIS 86 HE2 HIS 86 -12.002 -20.641 -9.557 774 H SER 87 H SER 87 -14.616 -20.573 -3.516 775 HA SER 87 HA SER 87 -14.696 -19.508 -0.859 776 HB2 SER 87 HB2 SER 87 -16.705 -20.268 -2.023 777 HB3 SER 87 HB3 SER 87 -16.110 -21.943 -1.981 778 HG SER 87 HG SER 87 -17.509 -21.577 -0.229 779 H MET 88 H MET 88 -14.041 -20.173 1.074 780 HA MET 88 HA MET 88 -12.733 -22.858 1.383 781 HB2 MET 88 HB2 MET 88 -11.779 -20.210 2.529 782 HB3 MET 88 HB3 MET 88 -11.077 -21.783 2.903 783 HG2 MET 88 HG2 MET 88 -11.184 -20.601 0.101 784 HG3 MET 88 HG3 MET 88 -9.834 -20.417 1.205 785 HE1 MET 88 HE1 MET 88 -8.812 -22.705 2.468 786 HE2 MET 88 HE2 MET 88 -7.951 -23.671 1.247 787 HE3 MET 88 HE3 MET 88 -7.794 -21.906 1.249 788 H VAL 89 H VAL 89 -15.516 -21.812 2.069 789 HA VAL 89 HA VAL 89 -15.793 -21.129 4.720 790 HB VAL 89 HB VAL 89 -17.467 -21.030 2.865 791 HG11 VAL 89 HG11 VAL 89 -19.140 -22.773 2.668 792 HG12 VAL 89 HG12 VAL 89 -17.556 -23.466 2.302 793 HG13 VAL 89 HG13 VAL 89 -18.324 -23.778 3.878 794 HG21 VAL 89 HG21 VAL 89 -18.478 -21.917 5.589 795 HG22 VAL 89 HG22 VAL 89 -17.977 -20.272 5.137 796 HG23 VAL 89 HG23 VAL 89 -19.387 -21.004 4.368 797 H SER 90 H SER 90 -15.563 -24.494 3.650 798 HA SER 90 HA SER 90 -16.031 -25.450 6.420 799 HB2 SER 90 HB2 SER 90 -15.759 -26.940 3.783 800 HB3 SER 90 HB3 SER 90 -16.102 -27.690 5.354 801 HG SER 90 HG SER 90 -18.032 -27.274 4.194 802 H VAL 91 H VAL 91 -13.287 -24.306 5.048 803 HA VAL 91 HA VAL 91 -11.541 -26.633 5.293 804 HB VAL 91 HB VAL 91 -10.910 -23.716 4.714 805 HG11 VAL 91 HG11 VAL 91 -9.162 -26.208 4.520 806 HG12 VAL 91 HG12 VAL 91 -8.761 -24.632 3.810 807 HG13 VAL 91 HG13 VAL 91 -8.888 -24.788 5.561 808 HG21 VAL 91 HG21 VAL 91 -12.305 -24.824 2.971 809 HG22 VAL 91 HG22 VAL 91 -10.665 -24.541 2.387 810 HG23 VAL 91 HG23 VAL 91 -11.146 -26.167 2.898 811 H SER 92 H SER 92 -10.787 -27.411 7.140 812 HA SER 92 HA SER 92 -10.644 -25.863 9.595 813 HB2 SER 92 HB2 SER 92 -9.868 -27.997 10.552 814 HB3 SER 92 HB3 SER 92 -11.342 -28.189 9.588 815 HG SER 92 HG SER 92 -9.757 -29.814 9.115 816 H THR 93 H THR 93 -8.341 -26.439 7.057 817 HA THR 93 HA THR 93 -5.948 -26.621 8.244 818 HB THR 93 HB THR 93 -6.289 -24.824 5.869 819 HG1 THR 93 HG1 THR 93 -6.399 -26.778 4.664 820 HG21 THR 93 HG21 THR 93 -3.977 -25.143 6.542 821 HG22 THR 93 HG22 THR 93 -4.191 -26.916 6.586 822 HG23 THR 93 HG23 THR 93 -4.285 -26.027 5.047 823 HA PRO 94 HA PRO 94 -4.936 -22.910 10.529 824 HB2 PRO 94 HB2 PRO 94 -2.100 -23.601 9.735 825 HB3 PRO 94 HB3 PRO 94 -2.734 -23.096 11.335 826 HG2 PRO 94 HG2 PRO 94 -2.246 -25.710 10.862 827 HG3 PRO 94 HG3 PRO 94 -3.774 -25.233 11.673 828 HD2 PRO 94 HD2 PRO 94 -3.328 -25.910 8.755 829 HD3 PRO 94 HD3 PRO 94 -4.613 -26.476 9.870 830 H ILE 95 H ILE 95 -4.618 -20.770 10.091 831 HA ILE 95 HA ILE 95 -4.857 -19.898 7.416 832 HB ILE 95 HB ILE 95 -5.681 -18.920 9.585 833 HG12 ILE 95 HG12 ILE 95 -5.925 -17.816 7.373 834 HG13 ILE 95 HG13 ILE 95 -6.086 -16.838 8.823 835 HG21 ILE 95 HG21 ILE 95 -2.954 -17.569 9.767 836 HG22 ILE 95 HG22 ILE 95 -4.381 -17.236 10.770 837 HG23 ILE 95 HG23 ILE 95 -3.599 -18.806 10.868 838 HD11 ILE 95 HD11 ILE 95 -4.933 -15.635 7.043 839 HD12 ILE 95 HD12 ILE 95 -3.889 -15.818 8.459 840 HD13 ILE 95 HD13 ILE 95 -3.641 -16.843 7.026 841 H SER 96 H SER 96 -1.907 -20.209 9.405 842 HA SER 96 HA SER 96 -0.111 -18.788 7.659 843 HB2 SER 96 HB2 SER 96 1.625 -20.113 8.861 844 HB3 SER 96 HB3 SER 96 0.487 -19.287 9.943 845 HG SER 96 HG SER 96 0.887 -21.555 10.489 846 H GLU 97 H GLU 97 -1.208 -22.203 7.690 847 HA GLU 97 HA GLU 97 0.529 -23.021 5.512 848 HB2 GLU 97 HB2 GLU 97 -0.283 -24.645 7.123 849 HB3 GLU 97 HB3 GLU 97 -1.949 -24.232 6.755 850 HG2 GLU 97 HG2 GLU 97 -1.454 -26.330 5.747 851 HG3 GLU 97 HG3 GLU 97 -1.718 -25.152 4.477 852 H VAL 98 H VAL 98 -2.832 -21.797 5.664 853 HA VAL 98 HA VAL 98 -3.310 -21.949 2.818 854 HB VAL 98 HB VAL 98 -4.478 -19.914 4.742 855 HG11 VAL 98 HG11 VAL 98 -6.333 -19.830 3.107 856 HG12 VAL 98 HG12 VAL 98 -4.818 -19.304 2.369 857 HG13 VAL 98 HG13 VAL 98 -5.443 -20.933 2.029 858 HG21 VAL 98 HG21 VAL 98 -6.434 -21.472 4.805 859 HG22 VAL 98 HG22 VAL 98 -5.481 -22.677 3.911 860 HG23 VAL 98 HG23 VAL 98 -5.003 -22.182 5.546 861 H TYR 99 H TYR 99 -1.805 -19.371 4.845 862 HA TYR 99 HA TYR 99 -1.123 -17.680 2.677 863 HB2 TYR 99 HB2 TYR 99 -0.866 -16.589 4.655 864 HB3 TYR 99 HB3 TYR 99 -0.113 -17.949 5.455 865 HD1 TYR 99 HD1 TYR 99 0.583 -15.625 2.562 866 HD2 TYR 99 HD2 TYR 99 2.186 -17.894 5.866 867 HE1 TYR 99 HE1 TYR 99 2.879 -14.791 2.038 868 HE2 TYR 99 HE2 TYR 99 4.459 -17.049 5.345 869 HH TYR 99 HH TYR 99 5.735 -15.657 4.005 870 H GLU 100 H GLU 100 0.919 -20.307 4.005 871 HA GLU 100 HA GLU 100 3.067 -19.948 2.247 872 HB2 GLU 100 HB2 GLU 100 3.150 -21.359 4.232 873 HB3 GLU 100 HB3 GLU 100 1.924 -22.431 3.571 874 HG2 GLU 100 HG2 GLU 100 4.049 -23.499 3.427 875 HG3 GLU 100 HG3 GLU 100 3.445 -23.188 1.809 876 H SER 101 H SER 101 0.009 -21.669 1.628 877 HA SER 101 HA SER 101 0.770 -22.629 -1.014 878 HB2 SER 101 HB2 SER 101 -0.940 -23.747 0.332 879 HB3 SER 101 HB3 SER 101 -1.954 -22.292 0.292 880 HG SER 101 HG SER 101 -2.502 -23.906 -1.322 881 H GLU 102 H GLU 102 -1.306 -19.897 0.091 882 HA GLU 102 HA GLU 102 -1.579 -18.883 -2.679 883 HB2 GLU 102 HB2 GLU 102 -2.920 -18.086 -0.088 884 HB3 GLU 102 HB3 GLU 102 -3.350 -17.460 -1.677 885 HG2 GLU 102 HG2 GLU 102 -3.625 -20.362 -0.777 886 HG3 GLU 102 HG3 GLU 102 -4.909 -19.173 -0.834 887 H LYS 103 H LYS 103 1.015 -18.597 -1.445 888 HA LYS 103 HA LYS 103 1.510 -15.906 -0.654 889 HB2 LYS 103 HB2 LYS 103 2.866 -17.927 -0.201 890 HB3 LYS 103 HB3 LYS 103 3.334 -17.999 -1.902 891 HG2 LYS 103 HG2 LYS 103 4.461 -15.789 -1.686 892 HG3 LYS 103 HG3 LYS 103 4.008 -15.726 0.026 893 HD2 LYS 103 HD2 LYS 103 5.723 -17.876 -1.290 894 HD3 LYS 103 HD3 LYS 103 6.342 -16.512 -0.333 895 HE2 LYS 103 HE2 LYS 103 5.083 -17.366 1.660 896 HE3 LYS 103 HE3 LYS 103 4.492 -18.722 0.690 897 HZ1 LYS 103 HZ1 LYS 103 7.306 -18.246 1.491 898 HZ2 LYS 103 HZ2 LYS 103 6.323 -19.511 1.890 899 HZ3 LYS 103 HZ3 LYS 103 6.877 -19.361 0.362 900 H ASP 104 H ASP 104 2.033 -14.114 -1.750 901 HA ASP 104 HA ASP 104 2.488 -14.123 -4.656 902 HB2 ASP 104 HB2 ASP 104 0.207 -12.802 -3.257 903 HB3 ASP 104 HB3 ASP 104 0.919 -11.991 -4.647 904 H GLU 105 H GLU 105 3.257 -12.149 -5.647 905 HA GLU 105 HA GLU 105 5.755 -11.574 -4.481 906 HB2 GLU 105 HB2 GLU 105 4.264 -10.135 -6.711 907 HB3 GLU 105 HB3 GLU 105 5.963 -9.891 -6.357 908 HG2 GLU 105 HG2 GLU 105 4.696 -12.534 -7.211 909 HG3 GLU 105 HG3 GLU 105 5.551 -11.417 -8.266 910 H ASP 106 H ASP 106 2.817 -9.577 -4.268 911 HA ASP 106 HA ASP 106 4.256 -7.289 -3.084 912 HB2 ASP 106 HB2 ASP 106 2.088 -6.245 -2.922 913 HB3 ASP 106 HB3 ASP 106 2.324 -6.910 -4.534 914 H GLY 107 H GLY 107 3.548 -10.266 -1.936 915 HA2 GLY 107 HA2 GLY 107 4.011 -11.082 0.166 916 HA3 GLY 107 HA3 GLY 107 3.896 -9.470 0.855 917 H PHE 108 H PHE 108 2.654 -12.350 1.212 918 HA PHE 108 HA PHE 108 0.955 -13.183 2.297 919 HB2 PHE 108 HB2 PHE 108 0.871 -10.405 3.317 920 HB3 PHE 108 HB3 PHE 108 -0.266 -11.598 3.889 921 HD1 PHE 108 HD1 PHE 108 3.251 -10.606 3.881 922 HD2 PHE 108 HD2 PHE 108 0.474 -13.695 5.003 923 HE1 PHE 108 HE1 PHE 108 4.962 -11.589 5.393 924 HE2 PHE 108 HE2 PHE 108 2.203 -14.684 6.509 925 HZ PHE 108 HZ PHE 108 4.422 -13.628 6.716 926 H LEU 109 H LEU 109 -1.604 -12.712 3.129 927 HA LEU 109 HA LEU 109 -2.711 -14.047 0.804 928 HB2 LEU 109 HB2 LEU 109 -3.564 -13.493 3.643 929 HB3 LEU 109 HB3 LEU 109 -4.766 -14.103 2.523 930 HG LEU 109 HG LEU 109 -2.114 -15.533 2.863 931 HD11 LEU 109 HD11 LEU 109 -3.251 -17.013 4.496 932 HD12 LEU 109 HD12 LEU 109 -3.140 -15.345 5.098 933 HD13 LEU 109 HD13 LEU 109 -4.678 -15.972 4.458 934 HD21 LEU 109 HD21 LEU 109 -4.913 -16.462 2.042 935 HD22 LEU 109 HD22 LEU 109 -3.574 -16.129 0.920 936 HD23 LEU 109 HD23 LEU 109 -3.436 -17.448 2.086 937 H TYR 110 H TYR 110 -4.543 -13.757 -0.310 938 HA TYR 110 HA TYR 110 -5.999 -11.194 -0.116 939 HB2 TYR 110 HB2 TYR 110 -5.065 -12.576 -2.601 940 HB3 TYR 110 HB3 TYR 110 -6.548 -11.652 -2.622 941 HD1 TYR 110 HD1 TYR 110 -2.902 -11.435 -2.463 942 HD2 TYR 110 HD2 TYR 110 -6.601 -9.217 -2.224 943 HE1 TYR 110 HE1 TYR 110 -1.675 -9.335 -2.886 944 HE2 TYR 110 HE2 TYR 110 -5.358 -7.102 -2.629 945 HH TYR 110 HH TYR 110 -1.832 -7.072 -3.274 946 H MET 111 H MET 111 -8.109 -11.164 0.166 947 HA MET 111 HA MET 111 -9.713 -13.603 -0.454 948 HB2 MET 111 HB2 MET 111 -9.879 -12.072 2.182 949 HB3 MET 111 HB3 MET 111 -10.772 -13.527 1.723 950 HG2 MET 111 HG2 MET 111 -8.564 -14.746 1.606 951 HG3 MET 111 HG3 MET 111 -7.787 -13.300 2.252 952 HE1 MET 111 HE1 MET 111 -7.433 -15.788 5.154 953 HE2 MET 111 HE2 MET 111 -7.436 -16.210 3.429 954 HE3 MET 111 HE3 MET 111 -6.624 -14.728 3.987 955 H VAL 112 H VAL 112 -11.879 -13.200 -1.010 956 HA VAL 112 HA VAL 112 -12.874 -10.451 -0.654 957 HB VAL 112 HB VAL 112 -13.857 -10.215 -2.782 958 HG11 VAL 112 HG11 VAL 112 -11.426 -9.633 -2.651 959 HG12 VAL 112 HG12 VAL 112 -11.033 -11.228 -3.323 960 HG13 VAL 112 HG13 VAL 112 -11.963 -10.063 -4.278 961 HG21 VAL 112 HG21 VAL 112 -12.833 -12.981 -3.498 962 HG22 VAL 112 HG22 VAL 112 -14.536 -12.507 -3.274 963 HG23 VAL 112 HG23 VAL 112 -13.599 -11.846 -4.620 964 H TYR 113 H TYR 113 -15.225 -10.271 -0.341 965 HA TYR 113 HA TYR 113 -16.414 -12.974 0.322 966 HB2 TYR 113 HB2 TYR 113 -17.391 -12.119 2.270 967 HB3 TYR 113 HB3 TYR 113 -15.705 -11.654 2.330 968 HD1 TYR 113 HD1 TYR 113 -15.036 -9.271 1.971 969 HD2 TYR 113 HD2 TYR 113 -19.150 -10.506 2.158 970 HE1 TYR 113 HE1 TYR 113 -15.725 -6.912 2.462 971 HE2 TYR 113 HE2 TYR 113 -19.848 -8.152 2.623 972 HH TYR 113 HH TYR 113 -19.147 -5.954 2.922 973 H ALA 114 H ALA 114 -18.598 -13.256 0.002 974 HA ALA 114 HA ALA 114 -20.108 -11.262 -1.609 975 HB1 ALA 114 HB1 ALA 114 -20.121 -12.789 -3.544 976 HB2 ALA 114 HB2 ALA 114 -18.435 -12.501 -3.090 977 HB3 ALA 114 HB3 ALA 114 -19.198 -14.003 -2.614 978 H SER 115 H SER 115 -22.293 -12.033 -2.214 979 HA SER 115 HA SER 115 -23.591 -13.802 -0.271 980 HB2 SER 115 HB2 SER 115 -25.606 -13.240 -1.624 981 HB3 SER 115 HB3 SER 115 -24.720 -11.812 -1.054 982 HG SER 115 HG SER 115 -25.322 -11.707 -3.300 983 H GLN 116 H GLN 116 -21.993 -14.292 -3.244 984 HA GLN 116 HA GLN 116 -22.644 -17.128 -3.432 985 HB2 GLN 116 HB2 GLN 116 -23.000 -16.643 -6.038 986 HB3 GLN 116 HB3 GLN 116 -24.332 -16.743 -4.892 987 HG2 GLN 116 HG2 GLN 116 -24.596 -14.898 -6.490 988 HG3 GLN 116 HG3 GLN 116 -24.576 -14.341 -4.827 989 HE21 GLN 116 HE21 GLN 116 -22.041 -12.011 -5.604 990 HE22 GLN 116 HE22 GLN 116 -23.445 -12.432 -4.616 991 H GLU 117 H GLU 117 -21.100 -18.284 -4.885 992 HA GLU 117 HA GLU 117 -18.480 -17.177 -4.455 993 HB2 GLU 117 HB2 GLU 117 -18.996 -19.555 -4.327 994 HB3 GLU 117 HB3 GLU 117 -19.313 -19.611 -6.072 995 HG2 GLU 117 HG2 GLU 117 -17.008 -19.166 -6.592 996 HG3 GLU 117 HG3 GLU 117 -16.659 -18.682 -4.930 997 H THR 118 H THR 118 -20.532 -17.104 -7.338 998 HA THR 118 HA THR 118 -18.721 -15.286 -8.756 999 HB THR 118 HB THR 118 -19.101 -16.813 -10.877 1000 HG1 THR 118 HG1 THR 118 -18.980 -19.016 -10.465 1001 HG21 THR 118 HG21 THR 118 -16.918 -17.647 -8.933 1002 HG22 THR 118 HG22 THR 118 -16.910 -17.792 -10.702 1003 HG23 THR 118 HG23 THR 118 -16.867 -16.190 -9.949 1004 H PHE 119 H PHE 119 -20.080 -13.884 -9.798 1005 HA PHE 119 HA PHE 119 -22.881 -14.282 -9.398 1006 HB2 PHE 119 HB2 PHE 119 -22.008 -12.170 -8.975 1007 HB3 PHE 119 HB3 PHE 119 -21.331 -12.023 -10.597 1008 HD1 PHE 119 HD1 PHE 119 -24.585 -12.554 -8.847 1009 HD2 PHE 119 HD2 PHE 119 -22.555 -10.794 -12.222 1010 HE1 PHE 119 HE1 PHE 119 -26.704 -11.435 -9.542 1011 HE2 PHE 119 HE2 PHE 119 -24.672 -9.691 -12.923 1012 HZ PHE 119 HZ PHE 119 -26.746 -10.007 -11.580 1013 H GLY 120 H GLY 120 -21.006 -14.587 -12.338 1014 HA2 GLY 120 HA2 GLY 120 -22.849 -16.274 -13.648 1015 HA3 GLY 120 HA3 GLY 120 -23.131 -14.643 -14.252 1016 H1 ASP 10 H1 ASP 10 -10.869 3.493 16.079 1017 H2 ASP 10 H2 ASP 10 -10.749 2.063 15.295 1018 H3 ASP 10 H3 ASP 10 -10.249 2.194 16.854 1019 HA ASP 10 HA ASP 10 -9.073 3.627 14.572 1020 HB2 ASP 10 HB2 ASP 10 -8.227 3.685 17.461 1021 HB3 ASP 10 HB3 ASP 10 -7.159 4.150 16.135 1022 H TYR 11 H TYR 11 -7.570 1.347 16.933 1023 HA TYR 11 HA TYR 11 -5.811 0.567 14.880 1024 HB2 TYR 11 HB2 TYR 11 -6.037 -0.320 17.700 1025 HB3 TYR 11 HB3 TYR 11 -4.920 -1.103 16.612 1026 HD1 TYR 11 HD1 TYR 11 -5.057 1.353 19.015 1027 HD2 TYR 11 HD2 TYR 11 -3.544 0.778 14.994 1028 HE1 TYR 11 HE1 TYR 11 -3.371 3.137 19.380 1029 HE2 TYR 11 HE2 TYR 11 -1.872 2.554 15.378 1030 HH TYR 11 HH TYR 11 -1.632 4.346 18.482 1031 H GLU 12 H GLU 12 -8.701 -0.341 14.572 1032 HA GLU 12 HA GLU 12 -8.366 -3.066 13.560 1033 HB2 GLU 12 HB2 GLU 12 -10.555 -2.748 12.611 1034 HB3 GLU 12 HB3 GLU 12 -10.536 -2.210 14.288 1035 HG2 GLU 12 HG2 GLU 12 -9.963 0.144 12.857 1036 HG3 GLU 12 HG3 GLU 12 -11.022 -0.714 11.756 1037 H SER 13 H SER 13 -7.333 0.023 12.484 1038 HA SER 13 HA SER 13 -6.378 -0.929 9.891 1039 HB2 SER 13 HB2 SER 13 -8.808 -0.466 9.470 1040 HB3 SER 13 HB3 SER 13 -8.552 1.217 9.952 1041 HG SER 13 HG SER 13 -7.052 1.380 8.169 1042 H ASP 14 H ASP 14 -6.744 1.805 12.219 1043 HA ASP 14 HA ASP 14 -5.255 3.731 10.804 1044 HB2 ASP 14 HB2 ASP 14 -6.651 4.269 12.698 1045 HB3 ASP 14 HB3 ASP 14 -5.619 3.319 13.776 1046 H ASP 15 H ASP 15 -3.193 4.015 10.341 1047 HA ASP 15 HA ASP 15 -1.419 2.164 10.047 1048 HB2 ASP 15 HB2 ASP 15 -0.934 5.104 10.396 1049 HB3 ASP 15 HB3 ASP 15 0.378 4.015 9.991 1050 H ASP 16 H ASP 16 0.526 1.351 10.542 1051 HA ASP 16 HA ASP 16 2.106 0.425 11.705 1052 HB2 ASP 16 HB2 ASP 16 2.178 3.036 13.170 1053 HB3 ASP 16 HB3 ASP 16 3.293 1.716 13.497 1054 H SER 17 H SER 17 0.927 1.705 14.779 1055 HA SER 17 HA SER 17 1.575 -0.760 16.036 1056 HB2 SER 17 HB2 SER 17 0.084 1.666 17.092 1057 HB3 SER 17 HB3 SER 17 0.733 0.354 18.093 1058 HG SER 17 HG SER 17 2.204 2.104 17.960 1059 H TYR 18 H TYR 18 -0.647 -1.139 14.086 1060 HA TYR 18 HA TYR 18 -3.060 -1.486 15.588 1061 HB2 TYR 18 HB2 TYR 18 -3.963 -2.403 13.401 1062 HB3 TYR 18 HB3 TYR 18 -3.447 -0.749 13.483 1063 HD1 TYR 18 HD1 TYR 18 -1.759 -4.049 12.732 1064 HD2 TYR 18 HD2 TYR 18 -2.533 0.009 11.555 1065 HE1 TYR 18 HE1 TYR 18 -0.750 -4.508 10.520 1066 HE2 TYR 18 HE2 TYR 18 -1.450 -0.420 9.338 1067 HH TYR 18 HH TYR 18 -0.246 -3.694 8.454 1068 H GLU 19 H GLU 19 -4.540 -3.252 15.486 1069 HA GLU 19 HA GLU 19 -3.257 -5.965 15.599 1070 HB2 GLU 19 HB2 GLU 19 -5.565 -4.871 17.239 1071 HB3 GLU 19 HB3 GLU 19 -5.148 -6.581 17.166 1072 HG2 GLU 19 HG2 GLU 19 -3.305 -4.357 18.156 1073 HG3 GLU 19 HG3 GLU 19 -4.251 -5.444 19.172 1074 H VAL 20 H VAL 20 -5.740 -3.984 14.195 1075 HA VAL 20 HA VAL 20 -6.999 -4.181 12.434 1076 HB VAL 20 HB VAL 20 -5.657 -6.539 11.290 1077 HG11 VAL 20 HG11 VAL 20 -5.810 -5.267 9.245 1078 HG12 VAL 20 HG12 VAL 20 -7.402 -5.177 10.035 1079 HG13 VAL 20 HG13 VAL 20 -6.283 -3.807 10.114 1080 HG21 VAL 20 HG21 VAL 20 -4.391 -3.802 11.640 1081 HG22 VAL 20 HG22 VAL 20 -3.735 -5.360 12.224 1082 HG23 VAL 20 HG23 VAL 20 -3.822 -5.014 10.496 1083 H LEU 21 H LEU 21 -6.921 -7.386 13.916 1084 HA LEU 21 HA LEU 21 -9.454 -8.230 12.672 1085 HB2 LEU 21 HB2 LEU 21 -7.334 -9.592 13.362 1086 HB3 LEU 21 HB3 LEU 21 -7.972 -9.515 14.991 1087 HG LEU 21 HG LEU 21 -9.999 -10.760 14.211 1088 HD11 LEU 21 HD11 LEU 21 -10.071 -10.204 11.820 1089 HD12 LEU 21 HD12 LEU 21 -8.432 -10.875 11.577 1090 HD13 LEU 21 HD13 LEU 21 -9.793 -11.939 11.972 1091 HD21 LEU 21 HD21 LEU 21 -7.377 -12.108 13.456 1092 HD22 LEU 21 HD22 LEU 21 -7.944 -11.898 15.119 1093 HD23 LEU 21 HD23 LEU 21 -8.875 -12.909 13.994 1094 H ASP 22 H ASP 22 -8.749 -6.176 15.228 1095 HA ASP 22 HA ASP 22 -9.624 -5.645 17.204 1096 HB2 ASP 22 HB2 ASP 22 -11.133 -4.471 15.809 1097 HB3 ASP 22 HB3 ASP 22 -12.148 -5.897 15.586 1098 H LEU 23 H LEU 23 -8.644 -7.971 17.372 1099 HA LEU 23 HA LEU 23 -10.048 -9.445 19.451 1100 HB2 LEU 23 HB2 LEU 23 -11.034 -10.398 17.417 1101 HB3 LEU 23 HB3 LEU 23 -9.459 -10.700 16.718 1102 HG LEU 23 HG LEU 23 -10.139 -11.999 19.366 1103 HD11 LEU 23 HD11 LEU 23 -11.100 -12.996 16.653 1104 HD12 LEU 23 HD12 LEU 23 -11.194 -13.888 18.191 1105 HD13 LEU 23 HD13 LEU 23 -12.126 -12.397 17.985 1106 HD21 LEU 23 HD21 LEU 23 -7.851 -12.365 18.278 1107 HD22 LEU 23 HD22 LEU 23 -8.779 -13.842 18.547 1108 HD23 LEU 23 HD23 LEU 23 -8.689 -13.140 16.925 1109 H THR 24 H THR 24 -8.537 -10.554 20.755 1110 HA THR 24 HA THR 24 -5.703 -10.475 19.891 1111 HB THR 24 HB THR 24 -4.833 -9.598 21.763 1112 HG1 THR 24 HG1 THR 24 -5.942 -9.339 23.699 1113 HG21 THR 24 HG21 THR 24 -6.079 -7.842 20.486 1114 HG22 THR 24 HG22 THR 24 -7.460 -8.055 21.586 1115 HG23 THR 24 HG23 THR 24 -5.909 -7.461 22.203 1116 H GLU 25 H GLU 25 -4.206 -11.876 20.660 1117 HA GLU 25 HA GLU 25 -5.136 -14.576 20.956 1118 HB2 GLU 25 HB2 GLU 25 -2.837 -15.169 20.878 1119 HB3 GLU 25 HB3 GLU 25 -3.126 -13.938 19.667 1120 HG2 GLU 25 HG2 GLU 25 -1.842 -13.436 22.402 1121 HG3 GLU 25 HG3 GLU 25 -0.959 -13.787 20.931 1122 H TYR 26 H TYR 26 -4.518 -16.091 22.600 1123 HA TYR 26 HA TYR 26 -3.917 -15.092 25.269 1124 HB2 TYR 26 HB2 TYR 26 -6.177 -14.822 25.488 1125 HB3 TYR 26 HB3 TYR 26 -6.551 -16.284 24.597 1126 HD1 TYR 26 HD1 TYR 26 -6.684 -18.452 25.648 1127 HD2 TYR 26 HD2 TYR 26 -5.370 -14.994 27.866 1128 HE1 TYR 26 HE1 TYR 26 -6.950 -19.720 27.781 1129 HE2 TYR 26 HE2 TYR 26 -5.633 -16.260 29.999 1130 HH TYR 26 HH TYR 26 -6.216 -18.256 30.976 Start of MODEL 15 1 H1 MET 1 H1 MET 1 -7.125 3.361 8.213 2 H2 MET 1 H2 MET 1 -6.623 4.422 7.085 3 H3 MET 1 H3 MET 1 -8.121 4.562 7.703 4 HA MET 1 HA MET 1 -8.161 3.690 5.465 5 HB2 MET 1 HB2 MET 1 -7.341 1.550 4.804 6 HB3 MET 1 HB3 MET 1 -6.043 2.575 5.377 7 HG2 MET 1 HG2 MET 1 -6.049 1.298 7.573 8 HG3 MET 1 HG3 MET 1 -7.269 0.230 6.865 9 HE1 MET 1 HE1 MET 1 -2.792 0.360 5.735 10 HE2 MET 1 HE2 MET 1 -3.811 1.777 5.425 11 HE3 MET 1 HE3 MET 1 -3.537 1.219 7.094 12 HA PRO 2 HA PRO 2 -11.070 0.253 6.959 13 HB2 PRO 2 HB2 PRO 2 -11.905 0.161 9.582 14 HB3 PRO 2 HB3 PRO 2 -10.555 -0.810 8.921 15 HG2 PRO 2 HG2 PRO 2 -10.434 1.858 10.366 16 HG3 PRO 2 HG3 PRO 2 -9.502 0.363 10.704 17 HD2 PRO 2 HD2 PRO 2 -8.425 2.334 9.266 18 HD3 PRO 2 HD3 PRO 2 -8.193 0.631 8.755 19 H SER 3 H SER 3 -12.780 1.026 6.018 20 HA SER 3 HA SER 3 -14.670 2.926 7.205 21 HB2 SER 3 HB2 SER 3 -14.423 4.572 5.390 22 HB3 SER 3 HB3 SER 3 -12.929 4.446 6.323 23 HG SER 3 HG SER 3 -11.996 3.258 4.687 24 H GLU 4 H GLU 4 -16.432 3.406 5.428 25 HA GLU 4 HA GLU 4 -17.251 0.883 4.187 26 HB2 GLU 4 HB2 GLU 4 -18.566 3.622 4.216 27 HB3 GLU 4 HB3 GLU 4 -19.279 2.129 3.568 28 HG2 GLU 4 HG2 GLU 4 -19.055 1.061 5.810 29 HG3 GLU 4 HG3 GLU 4 -18.492 2.598 6.466 30 H LYS 5 H LYS 5 -14.827 1.750 3.113 31 HA LYS 5 HA LYS 5 -15.431 1.951 0.240 32 HB2 LYS 5 HB2 LYS 5 -15.306 4.325 1.124 33 HB3 LYS 5 HB3 LYS 5 -13.677 3.999 1.673 34 HG2 LYS 5 HG2 LYS 5 -13.591 5.255 -0.386 35 HG3 LYS 5 HG3 LYS 5 -12.927 3.661 -0.658 36 HD2 LYS 5 HD2 LYS 5 -14.305 4.378 -2.557 37 HD3 LYS 5 HD3 LYS 5 -14.968 2.937 -1.811 38 HE2 LYS 5 HE2 LYS 5 -16.780 4.380 -2.396 39 HE3 LYS 5 HE3 LYS 5 -16.689 4.316 -0.636 40 HZ1 LYS 5 HZ1 LYS 5 -15.631 6.543 -2.328 41 HZ2 LYS 5 HZ2 LYS 5 -17.020 6.592 -1.477 42 HZ3 LYS 5 HZ3 LYS 5 -15.600 6.520 -0.684 43 H THR 6 H THR 6 -13.817 1.083 -1.071 44 HA THR 6 HA THR 6 -12.291 -0.924 -0.020 45 HB THR 6 HB THR 6 -11.528 0.088 -2.713 46 HG1 THR 6 HG1 THR 6 -13.511 -0.561 -3.551 47 HG21 THR 6 HG21 THR 6 -12.495 -2.602 -1.662 48 HG22 THR 6 HG22 THR 6 -11.937 -2.282 -3.320 49 HG23 THR 6 HG23 THR 6 -10.796 -2.153 -1.966 50 H PHE 7 H PHE 7 -10.164 -1.466 0.356 51 HA PHE 7 HA PHE 7 -8.459 0.372 1.510 52 HB2 PHE 7 HB2 PHE 7 -8.229 -1.841 2.087 53 HB3 PHE 7 HB3 PHE 7 -8.077 -2.382 0.431 54 HD1 PHE 7 HD1 PHE 7 -6.212 -0.225 2.912 55 HD2 PHE 7 HD2 PHE 7 -5.988 -2.975 -0.405 56 HE1 PHE 7 HE1 PHE 7 -3.782 -0.475 3.281 57 HE2 PHE 7 HE2 PHE 7 -3.533 -3.148 -0.089 58 HZ PHE 7 HZ PHE 7 -2.432 -1.910 1.776 59 H LYS 8 H LYS 8 -8.386 -0.406 -1.921 60 HA LYS 8 HA LYS 8 -5.979 0.813 -2.714 61 HB2 LYS 8 HB2 LYS 8 -7.422 -0.601 -4.114 62 HB3 LYS 8 HB3 LYS 8 -8.690 0.622 -4.100 63 HG2 LYS 8 HG2 LYS 8 -7.550 0.568 -6.229 64 HG3 LYS 8 HG3 LYS 8 -7.322 2.132 -5.448 65 HD2 LYS 8 HD2 LYS 8 -5.010 1.487 -4.800 66 HD3 LYS 8 HD3 LYS 8 -5.293 -0.148 -5.404 67 HE2 LYS 8 HE2 LYS 8 -3.968 1.056 -7.020 68 HE3 LYS 8 HE3 LYS 8 -5.551 0.702 -7.706 69 HZ1 LYS 8 HZ1 LYS 8 -4.781 3.350 -6.555 70 HZ2 LYS 8 HZ2 LYS 8 -4.817 3.001 -8.150 71 HZ3 LYS 8 HZ3 LYS 8 -6.202 3.011 -7.299 72 H GLN 9 H GLN 9 -8.811 2.453 -1.511 73 HA GLN 9 HA GLN 9 -8.382 5.076 -2.544 74 HB2 GLN 9 HB2 GLN 9 -10.412 4.228 -1.417 75 HB3 GLN 9 HB3 GLN 9 -9.549 4.152 0.113 76 HG2 GLN 9 HG2 GLN 9 -9.467 6.847 -1.167 77 HG3 GLN 9 HG3 GLN 9 -11.090 6.262 -0.869 78 HE21 GLN 9 HE21 GLN 9 -10.646 6.243 2.763 79 HE22 GLN 9 HE22 GLN 9 -11.403 5.269 1.512 80 H ARG 10 H ARG 10 -6.625 3.289 -0.041 81 HA ARG 10 HA ARG 10 -5.102 5.771 0.661 82 HB2 ARG 10 HB2 ARG 10 -5.872 3.447 2.429 83 HB3 ARG 10 HB3 ARG 10 -4.644 4.631 2.891 84 HG2 ARG 10 HG2 ARG 10 -7.369 5.597 2.000 85 HG3 ARG 10 HG3 ARG 10 -7.186 4.918 3.600 86 HD2 ARG 10 HD2 ARG 10 -7.060 7.404 3.550 87 HD3 ARG 10 HD3 ARG 10 -5.689 6.608 4.305 88 HE ARG 10 HE ARG 10 -4.258 7.345 2.667 89 HH11 ARG 10 HH11 ARG 10 -7.492 8.217 1.538 90 HH12 ARG 10 HH12 ARG 10 -6.872 9.558 0.621 91 HH21 ARG 10 HH21 ARG 10 -3.573 8.950 1.325 92 HH22 ARG 10 HH22 ARG 10 -4.720 9.910 0.438 93 H ARG 11 H ARG 11 -4.277 2.258 0.995 94 HA ARG 11 HA ARG 11 -1.547 3.094 0.090 95 HB2 ARG 11 HB2 ARG 11 -2.430 0.641 1.616 96 HB3 ARG 11 HB3 ARG 11 -0.831 0.800 0.895 97 HG2 ARG 11 HG2 ARG 11 -0.573 2.995 2.134 98 HG3 ARG 11 HG3 ARG 11 -2.060 2.618 3.017 99 HD2 ARG 11 HD2 ARG 11 -1.027 0.702 4.074 100 HD3 ARG 11 HD3 ARG 11 0.390 0.797 3.013 101 HE ARG 11 HE ARG 11 0.665 3.172 4.041 102 HH11 ARG 11 HH11 ARG 11 -0.086 0.323 6.020 103 HH12 ARG 11 HH12 ARG 11 0.326 1.213 7.485 104 HH21 ARG 11 HH21 ARG 11 1.178 4.117 5.957 105 HH22 ARG 11 HH22 ARG 11 0.984 3.226 7.447 106 H THR 12 H THR 12 -0.515 2.451 -1.597 107 HA THR 12 HA THR 12 -1.812 1.007 -3.836 108 HB THR 12 HB THR 12 0.582 1.306 -4.742 109 HG1 THR 12 HG1 THR 12 1.887 2.774 -3.671 110 HG21 THR 12 HG21 THR 12 -0.905 3.851 -3.929 111 HG22 THR 12 HG22 THR 12 0.321 3.735 -5.206 112 HG23 THR 12 HG23 THR 12 -1.231 2.890 -5.386 113 H PHE 13 H PHE 13 -0.533 -0.871 -4.793 114 HA PHE 13 HA PHE 13 0.195 -2.848 -2.913 115 HB2 PHE 13 HB2 PHE 13 -0.559 -3.465 -5.054 116 HB3 PHE 13 HB3 PHE 13 0.743 -2.603 -5.849 117 HD1 PHE 13 HD1 PHE 13 3.117 -3.485 -5.772 118 HD2 PHE 13 HD2 PHE 13 -0.258 -5.716 -4.276 119 HE1 PHE 13 HE1 PHE 13 4.449 -5.581 -5.872 120 HE2 PHE 13 HE2 PHE 13 1.066 -7.815 -4.420 121 HZ PHE 13 HZ PHE 13 3.421 -7.745 -5.217 122 H GLU 14 H GLU 14 2.345 -0.443 -4.422 123 HA GLU 14 HA GLU 14 4.792 -1.494 -3.357 124 HB2 GLU 14 HB2 GLU 14 4.678 0.107 -5.191 125 HB3 GLU 14 HB3 GLU 14 3.996 1.344 -4.119 126 HG2 GLU 14 HG2 GLU 14 6.053 1.403 -2.798 127 HG3 GLU 14 HG3 GLU 14 6.736 0.070 -3.739 128 H GLN 15 H GLN 15 2.541 0.998 -1.978 129 HA GLN 15 HA GLN 15 4.006 1.260 0.511 130 HB2 GLN 15 HB2 GLN 15 1.119 1.802 -0.262 131 HB3 GLN 15 HB3 GLN 15 1.771 2.133 1.350 132 HG2 GLN 15 HG2 GLN 15 3.381 3.721 0.484 133 HG3 GLN 15 HG3 GLN 15 2.953 3.334 -1.185 134 HE21 GLN 15 HE21 GLN 15 -0.038 5.302 -1.174 135 HE22 GLN 15 HE22 GLN 15 0.881 4.062 -2.035 136 H ARG 16 H ARG 16 1.462 -0.948 -0.564 137 HA ARG 16 HA ARG 16 0.972 -2.322 1.895 138 HB2 ARG 16 HB2 ARG 16 -0.306 -2.285 -0.345 139 HB3 ARG 16 HB3 ARG 16 0.833 -3.502 -0.906 140 HG2 ARG 16 HG2 ARG 16 -1.122 -3.718 1.384 141 HG3 ARG 16 HG3 ARG 16 -1.332 -4.342 -0.244 142 HD2 ARG 16 HD2 ARG 16 0.646 -5.343 1.848 143 HD3 ARG 16 HD3 ARG 16 -0.814 -6.143 1.277 144 HE ARG 16 HE ARG 16 1.155 -5.551 -0.843 145 HH11 ARG 16 HH11 ARG 16 1.689 -8.896 -1.495 146 HH12 ARG 16 HH12 ARG 16 1.965 -7.257 -2.039 147 HH21 ARG 16 HH21 ARG 16 -0.044 -8.043 1.317 148 HH22 ARG 16 HH22 ARG 16 0.544 -9.326 0.276 149 H VAL 17 H VAL 17 3.464 -2.913 -0.631 150 HA VAL 17 HA VAL 17 4.594 -5.253 0.637 151 HB VAL 17 HB VAL 17 5.680 -3.259 -1.381 152 HG11 VAL 17 HG11 VAL 17 7.670 -4.040 -0.188 153 HG12 VAL 17 HG12 VAL 17 7.099 -5.725 -0.285 154 HG13 VAL 17 HG13 VAL 17 7.570 -4.845 -1.751 155 HG21 VAL 17 HG21 VAL 17 4.953 -6.222 -1.523 156 HG22 VAL 17 HG22 VAL 17 3.941 -4.898 -2.117 157 HG23 VAL 17 HG23 VAL 17 5.498 -5.213 -2.882 158 H GLU 18 H GLU 18 5.388 -1.725 0.992 159 HA GLU 18 HA GLU 18 7.451 -2.142 2.961 160 HB2 GLU 18 HB2 GLU 18 5.613 0.199 2.362 161 HB3 GLU 18 HB3 GLU 18 6.759 0.222 3.711 162 HG2 GLU 18 HG2 GLU 18 8.628 -0.202 2.229 163 HG3 GLU 18 HG3 GLU 18 7.553 -0.297 0.825 164 H ASP 19 H ASP 19 3.978 -1.442 3.435 165 HA ASP 19 HA ASP 19 3.794 -1.731 6.254 166 HB2 ASP 19 HB2 ASP 19 2.164 -0.659 4.894 167 HB3 ASP 19 HB3 ASP 19 1.875 -2.121 3.970 168 H VAL 20 H VAL 20 3.187 -4.340 3.860 169 HA VAL 20 HA VAL 20 2.945 -6.333 5.870 170 HB VAL 20 HB VAL 20 2.235 -6.328 3.342 171 HG11 VAL 20 HG11 VAL 20 4.609 -6.409 2.465 172 HG12 VAL 20 HG12 VAL 20 4.739 -8.050 3.125 173 HG13 VAL 20 HG13 VAL 20 3.538 -7.680 1.868 174 HG21 VAL 20 HG21 VAL 20 1.523 -7.930 4.941 175 HG22 VAL 20 HG22 VAL 20 1.973 -8.761 3.449 176 HG23 VAL 20 HG23 VAL 20 3.081 -8.805 4.853 177 H ARG 21 H ARG 21 5.932 -5.252 4.198 178 HA ARG 21 HA ARG 21 7.554 -7.277 5.503 179 HB2 ARG 21 HB2 ARG 21 8.430 -6.170 3.516 180 HB3 ARG 21 HB3 ARG 21 8.397 -4.589 4.327 181 HG2 ARG 21 HG2 ARG 21 10.040 -5.345 5.985 182 HG3 ARG 21 HG3 ARG 21 9.944 -7.005 5.387 183 HD2 ARG 21 HD2 ARG 21 11.030 -6.323 3.293 184 HD3 ARG 21 HD3 ARG 21 11.100 -4.642 3.877 185 HE ARG 21 HE ARG 21 12.254 -6.306 5.883 186 HH11 ARG 21 HH11 ARG 21 14.887 -5.548 3.008 187 HH12 ARG 21 HH12 ARG 21 13.198 -5.326 2.633 188 HH21 ARG 21 HH21 ARG 21 14.228 -6.555 6.270 189 HH22 ARG 21 HH22 ARG 21 15.498 -6.247 5.078 190 H LEU 22 H LEU 22 6.880 -3.832 6.394 191 HA LEU 22 HA LEU 22 8.437 -3.834 8.775 192 HB2 LEU 22 HB2 LEU 22 5.915 -2.344 7.942 193 HB3 LEU 22 HB3 LEU 22 6.668 -2.052 9.509 194 HG LEU 22 HG LEU 22 8.333 -1.917 6.999 195 HD11 LEU 22 HD11 LEU 22 6.746 0.411 8.164 196 HD12 LEU 22 HD12 LEU 22 7.917 0.495 6.826 197 HD13 LEU 22 HD13 LEU 22 6.408 -0.397 6.617 198 HD21 LEU 22 HD21 LEU 22 9.509 -1.879 9.172 199 HD22 LEU 22 HD22 LEU 22 9.686 -0.345 8.319 200 HD23 LEU 22 HD23 LEU 22 8.536 -0.475 9.673 201 H ILE 23 H ILE 23 5.007 -4.759 8.333 202 HA ILE 23 HA ILE 23 4.512 -5.644 10.982 203 HB ILE 23 HB ILE 23 3.392 -6.370 8.259 204 HG12 ILE 23 HG12 ILE 23 2.700 -4.193 8.932 205 HG13 ILE 23 HG13 ILE 23 1.339 -5.247 9.189 206 HG21 ILE 23 HG21 ILE 23 1.544 -7.562 9.360 207 HG22 ILE 23 HG22 ILE 23 3.077 -8.404 9.472 208 HG23 ILE 23 HG23 ILE 23 2.456 -7.535 10.900 209 HD11 ILE 23 HD11 ILE 23 2.072 -5.272 11.696 210 HD12 ILE 23 HD12 ILE 23 3.133 -3.914 11.231 211 HD13 ILE 23 HD13 ILE 23 1.391 -3.770 11.028 212 H ARG 24 H ARG 24 5.877 -7.622 8.265 213 HA ARG 24 HA ARG 24 6.258 -9.941 9.931 214 HB2 ARG 24 HB2 ARG 24 6.169 -10.144 7.534 215 HB3 ARG 24 HB3 ARG 24 7.505 -9.027 7.311 216 HG2 ARG 24 HG2 ARG 24 8.201 -11.327 6.887 217 HG3 ARG 24 HG3 ARG 24 9.107 -10.611 8.210 218 HD2 ARG 24 HD2 ARG 24 7.502 -11.851 9.814 219 HD3 ARG 24 HD3 ARG 24 6.831 -12.622 8.395 220 HE ARG 24 HE ARG 24 8.708 -13.959 8.203 221 HH11 ARG 24 HH11 ARG 24 9.512 -11.462 10.585 222 HH12 ARG 24 HH12 ARG 24 10.977 -12.298 11.042 223 HH21 ARG 24 HH21 ARG 24 10.573 -14.929 8.874 224 HH22 ARG 24 HH22 ARG 24 11.547 -14.212 10.116 225 H GLU 25 H GLU 25 8.353 -7.124 9.421 226 HA GLU 25 HA GLU 25 10.650 -8.210 10.807 227 HB2 GLU 25 HB2 GLU 25 9.775 -5.343 10.344 228 HB3 GLU 25 HB3 GLU 25 11.329 -5.797 11.010 229 HG2 GLU 25 HG2 GLU 25 10.401 -6.717 8.260 230 HG3 GLU 25 HG3 GLU 25 11.191 -5.174 8.530 231 H GLN 26 H GLN 26 7.939 -6.111 11.984 232 HA GLN 26 HA GLN 26 8.977 -6.286 14.722 233 HB2 GLN 26 HB2 GLN 26 7.143 -4.882 15.368 234 HB3 GLN 26 HB3 GLN 26 8.066 -4.191 14.044 235 HG2 GLN 26 HG2 GLN 26 6.290 -4.247 12.571 236 HG3 GLN 26 HG3 GLN 26 5.578 -5.700 13.290 237 HE21 GLN 26 HE21 GLN 26 3.141 -3.282 14.337 238 HE22 GLN 26 HE22 GLN 26 3.423 -4.739 13.401 239 H HIS 27 H HIS 27 6.529 -8.111 12.975 240 HA HIS 27 HA HIS 27 5.725 -9.572 15.478 241 HB2 HIS 27 HB2 HIS 27 4.036 -7.877 13.621 242 HB3 HIS 27 HB3 HIS 27 3.333 -9.329 14.298 243 HD1 HIS 27 HD1 HIS 27 5.566 -7.443 16.748 244 HD2 HIS 27 HD2 HIS 27 1.537 -7.747 15.508 245 HE1 HIS 27 HE1 HIS 27 4.139 -6.318 18.584 246 HE2 HIS 27 HE2 HIS 27 1.676 -6.581 17.855 247 HA PRO 28 HA PRO 28 6.738 -12.468 11.995 248 HB2 PRO 28 HB2 PRO 28 7.906 -14.014 14.306 249 HB3 PRO 28 HB3 PRO 28 8.555 -13.781 12.654 250 HG2 PRO 28 HG2 PRO 28 9.589 -12.380 14.724 251 HG3 PRO 28 HG3 PRO 28 9.243 -11.541 13.173 252 HD2 PRO 28 HD2 PRO 28 7.522 -11.638 15.668 253 HD3 PRO 28 HD3 PRO 28 8.027 -10.223 14.704 254 H THR 29 H THR 29 5.122 -13.048 15.091 255 HA THR 29 HA THR 29 4.182 -15.702 14.461 256 HB THR 29 HB THR 29 3.193 -15.791 16.535 257 HG1 THR 29 HG1 THR 29 2.728 -13.934 17.747 258 HG21 THR 29 HG21 THR 29 5.452 -13.801 17.053 259 HG22 THR 29 HG22 THR 29 4.843 -15.082 18.122 260 HG23 THR 29 HG23 THR 29 5.717 -15.512 16.647 261 H LYS 30 H LYS 30 3.003 -12.820 13.262 262 HA LYS 30 HA LYS 30 0.233 -13.918 12.970 263 HB2 LYS 30 HB2 LYS 30 1.155 -11.052 13.345 264 HB3 LYS 30 HB3 LYS 30 -0.474 -11.495 12.808 265 HG2 LYS 30 HG2 LYS 30 -1.064 -12.480 14.839 266 HG3 LYS 30 HG3 LYS 30 0.610 -12.737 15.344 267 HD2 LYS 30 HD2 LYS 30 0.916 -10.344 15.748 268 HD3 LYS 30 HD3 LYS 30 -0.751 -10.008 15.200 269 HE2 LYS 30 HE2 LYS 30 -1.689 -11.342 17.007 270 HE3 LYS 30 HE3 LYS 30 -0.093 -11.941 17.476 271 HZ1 LYS 30 HZ1 LYS 30 0.497 -9.707 18.208 272 HZ2 LYS 30 HZ2 LYS 30 -0.954 -9.083 17.734 273 HZ3 LYS 30 HZ3 LYS 30 -0.880 -10.191 18.945 274 H ILE 31 H ILE 31 -0.888 -13.642 11.179 275 HA ILE 31 HA ILE 31 0.623 -13.427 8.627 276 HB ILE 31 HB ILE 31 -2.064 -14.667 9.322 277 HG12 ILE 31 HG12 ILE 31 -0.306 -15.895 10.437 278 HG13 ILE 31 HG13 ILE 31 -0.995 -16.832 9.121 279 HG21 ILE 31 HG21 ILE 31 -0.481 -14.656 6.731 280 HG22 ILE 31 HG22 ILE 31 -1.784 -15.804 7.073 281 HG23 ILE 31 HG23 ILE 31 -2.128 -14.069 7.010 282 HD11 ILE 31 HD11 ILE 31 1.413 -17.146 9.219 283 HD12 ILE 31 HD12 ILE 31 0.985 -16.340 7.705 284 HD13 ILE 31 HD13 ILE 31 1.697 -15.412 9.052 285 HA PRO 32 HA PRO 32 -1.909 -9.626 8.199 286 HB2 PRO 32 HB2 PRO 32 -0.414 -8.430 6.201 287 HB3 PRO 32 HB3 PRO 32 -0.121 -8.268 7.949 288 HG2 PRO 32 HG2 PRO 32 1.252 -10.097 5.997 289 HG3 PRO 32 HG3 PRO 32 1.978 -9.149 7.320 290 HD2 PRO 32 HD2 PRO 32 1.446 -11.824 7.507 291 HD3 PRO 32 HD3 PRO 32 1.328 -10.728 8.918 292 H VAL 33 H VAL 33 -3.610 -9.332 7.016 293 HA VAL 33 HA VAL 33 -3.881 -10.537 4.324 294 HB VAL 33 HB VAL 33 -6.100 -10.619 6.342 295 HG11 VAL 33 HG11 VAL 33 -6.941 -12.436 4.893 296 HG12 VAL 33 HG12 VAL 33 -6.775 -10.921 4.016 297 HG13 VAL 33 HG13 VAL 33 -5.555 -12.197 3.801 298 HG21 VAL 33 HG21 VAL 33 -4.432 -11.927 7.450 299 HG22 VAL 33 HG22 VAL 33 -5.604 -13.033 6.739 300 HG23 VAL 33 HG23 VAL 33 -4.025 -12.790 5.953 301 H ILE 34 H ILE 34 -4.715 -9.249 2.813 302 HA ILE 34 HA ILE 34 -6.175 -6.743 3.586 303 HB ILE 34 HB ILE 34 -5.232 -7.735 0.876 304 HG12 ILE 34 HG12 ILE 34 -3.258 -7.227 2.146 305 HG13 ILE 34 HG13 ILE 34 -3.519 -5.969 0.958 306 HG21 ILE 34 HG21 ILE 34 -5.680 -5.378 0.149 307 HG22 ILE 34 HG22 ILE 34 -7.132 -6.266 0.580 308 HG23 ILE 34 HG23 ILE 34 -6.461 -5.074 1.717 309 HD11 ILE 34 HD11 ILE 34 -2.779 -4.980 3.054 310 HD12 ILE 34 HD12 ILE 34 -4.456 -4.483 2.770 311 HD13 ILE 34 HD13 ILE 34 -4.090 -5.762 3.948 312 H ILE 35 H ILE 35 -8.399 -6.524 3.189 313 HA ILE 35 HA ILE 35 -9.737 -8.771 1.811 314 HB ILE 35 HB ILE 35 -10.095 -9.354 4.074 315 HG12 ILE 35 HG12 ILE 35 -12.612 -7.966 3.006 316 HG13 ILE 35 HG13 ILE 35 -12.057 -9.596 2.580 317 HG21 ILE 35 HG21 ILE 35 -10.997 -6.488 4.513 318 HG22 ILE 35 HG22 ILE 35 -11.130 -7.766 5.727 319 HG23 ILE 35 HG23 ILE 35 -9.540 -7.268 5.182 320 HD11 ILE 35 HD11 ILE 35 -12.345 -10.295 4.951 321 HD12 ILE 35 HD12 ILE 35 -13.091 -8.707 5.289 322 HD13 ILE 35 HD13 ILE 35 -13.844 -9.806 4.133 323 H GLU 36 H GLU 36 -11.284 -8.315 0.390 324 HA GLU 36 HA GLU 36 -12.387 -5.547 0.239 325 HB2 GLU 36 HB2 GLU 36 -11.023 -6.974 -2.081 326 HB3 GLU 36 HB3 GLU 36 -11.969 -5.482 -2.191 327 HG2 GLU 36 HG2 GLU 36 -10.344 -4.400 -0.604 328 HG3 GLU 36 HG3 GLU 36 -9.328 -5.849 -0.726 329 H ARG 37 H ARG 37 -14.446 -5.395 -0.604 330 HA ARG 37 HA ARG 37 -16.095 -7.744 -0.961 331 HB2 ARG 37 HB2 ARG 37 -16.967 -5.551 -0.245 332 HB3 ARG 37 HB3 ARG 37 -16.516 -4.836 -1.788 333 HG2 ARG 37 HG2 ARG 37 -18.177 -6.159 -2.975 334 HG3 ARG 37 HG3 ARG 37 -18.471 -7.161 -1.551 335 HD2 ARG 37 HD2 ARG 37 -20.293 -5.624 -1.879 336 HD3 ARG 37 HD3 ARG 37 -19.453 -5.245 -0.361 337 HE ARG 37 HE ARG 37 -18.273 -3.576 -2.276 338 HH11 ARG 37 HH11 ARG 37 -21.579 -3.957 -1.141 339 HH12 ARG 37 HH12 ARG 37 -21.959 -2.282 -1.450 340 HH21 ARG 37 HH21 ARG 37 -18.824 -1.437 -2.590 341 HH22 ARG 37 HH22 ARG 37 -20.431 -0.901 -2.219 342 H TYR 38 H TYR 38 -16.707 -8.879 -2.747 343 HA TYR 38 HA TYR 38 -15.054 -8.959 -4.956 344 HB2 TYR 38 HB2 TYR 38 -16.016 -10.923 -4.400 345 HB3 TYR 38 HB3 TYR 38 -17.641 -10.257 -4.373 346 HD1 TYR 38 HD1 TYR 38 -19.089 -11.013 -6.032 347 HD2 TYR 38 HD2 TYR 38 -14.856 -10.764 -6.879 348 HE1 TYR 38 HE1 TYR 38 -19.475 -11.923 -8.298 349 HE2 TYR 38 HE2 TYR 38 -15.262 -11.677 -9.151 350 HH TYR 38 HH TYR 38 -16.819 -12.520 -10.634 351 H LYS 39 H LYS 39 -14.714 -8.173 -6.830 352 HA LYS 39 HA LYS 39 -15.932 -5.658 -7.449 353 HB2 LYS 39 HB2 LYS 39 -13.974 -7.338 -9.078 354 HB3 LYS 39 HB3 LYS 39 -14.335 -5.624 -9.336 355 HG2 LYS 39 HG2 LYS 39 -13.513 -5.105 -7.047 356 HG3 LYS 39 HG3 LYS 39 -13.114 -6.811 -6.804 357 HD2 LYS 39 HD2 LYS 39 -11.608 -6.650 -8.861 358 HD3 LYS 39 HD3 LYS 39 -11.806 -4.894 -8.767 359 HE2 LYS 39 HE2 LYS 39 -10.740 -6.716 -6.549 360 HE3 LYS 39 HE3 LYS 39 -9.724 -5.772 -7.635 361 HZ1 LYS 39 HZ1 LYS 39 -10.526 -3.751 -6.667 362 HZ2 LYS 39 HZ2 LYS 39 -11.716 -4.505 -5.822 363 HZ3 LYS 39 HZ3 LYS 39 -10.173 -4.735 -5.394 364 H GLY 40 H GLY 40 -16.467 -8.864 -8.802 365 HA2 GLY 40 HA2 GLY 40 -17.863 -7.998 -11.187 366 HA3 GLY 40 HA3 GLY 40 -17.796 -9.626 -10.529 367 H GLU 41 H GLU 41 -18.940 -8.659 -7.874 368 HA GLU 41 HA GLU 41 -21.622 -7.685 -8.532 369 HB2 GLU 41 HB2 GLU 41 -21.853 -10.080 -9.016 370 HB3 GLU 41 HB3 GLU 41 -21.181 -10.477 -7.442 371 HG2 GLU 41 HG2 GLU 41 -23.511 -10.826 -7.310 372 HG3 GLU 41 HG3 GLU 41 -23.139 -9.426 -6.334 373 H LYS 42 H LYS 42 -21.317 -5.961 -7.243 374 HA LYS 42 HA LYS 42 -20.329 -6.145 -4.501 375 HB2 LYS 42 HB2 LYS 42 -21.350 -3.840 -6.200 376 HB3 LYS 42 HB3 LYS 42 -20.729 -3.643 -4.558 377 HG2 LYS 42 HG2 LYS 42 -18.539 -4.508 -5.193 378 HG3 LYS 42 HG3 LYS 42 -19.100 -4.830 -6.847 379 HD2 LYS 42 HD2 LYS 42 -19.522 -2.447 -7.224 380 HD3 LYS 42 HD3 LYS 42 -19.041 -2.065 -5.558 381 HE2 LYS 42 HE2 LYS 42 -16.746 -2.845 -5.995 382 HE3 LYS 42 HE3 LYS 42 -17.206 -3.391 -7.612 383 HZ1 LYS 42 HZ1 LYS 42 -17.251 -0.545 -6.712 384 HZ2 LYS 42 HZ2 LYS 42 -16.127 -1.207 -7.695 385 HZ3 LYS 42 HZ3 LYS 42 -17.667 -1.062 -8.207 386 H GLN 43 H GLN 43 -22.651 -7.706 -4.771 387 HA GLN 43 HA GLN 43 -25.056 -6.280 -4.072 388 HB2 GLN 43 HB2 GLN 43 -24.897 -8.408 -5.336 389 HB3 GLN 43 HB3 GLN 43 -24.447 -9.256 -3.849 390 HG2 GLN 43 HG2 GLN 43 -26.668 -8.511 -2.869 391 HG3 GLN 43 HG3 GLN 43 -27.068 -7.822 -4.449 392 HE21 GLN 43 HE21 GLN 43 -27.220 -11.272 -5.897 393 HE22 GLN 43 HE22 GLN 43 -26.396 -9.773 -6.321 394 H LEU 44 H LEU 44 -22.716 -8.094 -2.061 395 HA LEU 44 HA LEU 44 -24.228 -7.872 0.407 396 HB2 LEU 44 HB2 LEU 44 -21.294 -8.396 -0.227 397 HB3 LEU 44 HB3 LEU 44 -21.897 -8.362 1.422 398 HG LEU 44 HG LEU 44 -22.906 -10.299 -0.707 399 HD11 LEU 44 HD11 LEU 44 -20.943 -10.661 1.586 400 HD12 LEU 44 HD12 LEU 44 -21.576 -11.970 0.561 401 HD13 LEU 44 HD13 LEU 44 -20.549 -10.708 -0.150 402 HD21 LEU 44 HD21 LEU 44 -23.317 -10.194 2.324 403 HD22 LEU 44 HD22 LEU 44 -24.572 -9.941 1.088 404 HD23 LEU 44 HD23 LEU 44 -23.814 -11.526 1.267 405 HA PRO 45 HA PRO 45 -23.238 -3.676 1.565 406 HB2 PRO 45 HB2 PRO 45 -23.145 -3.780 4.299 407 HB3 PRO 45 HB3 PRO 45 -24.665 -3.950 3.372 408 HG2 PRO 45 HG2 PRO 45 -22.904 -6.176 4.455 409 HG3 PRO 45 HG3 PRO 45 -24.677 -5.970 4.660 410 HD2 PRO 45 HD2 PRO 45 -23.647 -7.573 2.732 411 HD3 PRO 45 HD3 PRO 45 -25.092 -6.567 2.406 412 H VAL 46 H VAL 46 -21.496 -2.376 2.341 413 HA VAL 46 HA VAL 46 -18.958 -3.810 2.960 414 HB VAL 46 HB VAL 46 -18.891 -2.665 0.795 415 HG11 VAL 46 HG11 VAL 46 -20.251 -0.649 1.308 416 HG12 VAL 46 HG12 VAL 46 -18.976 -0.075 2.403 417 HG13 VAL 46 HG13 VAL 46 -18.652 -0.237 0.670 418 HG21 VAL 46 HG21 VAL 46 -16.962 -1.548 2.872 419 HG22 VAL 46 HG22 VAL 46 -16.844 -3.144 2.082 420 HG23 VAL 46 HG23 VAL 46 -16.692 -1.669 1.124 421 H LEU 47 H LEU 47 -17.806 -3.296 4.704 422 HA LEU 47 HA LEU 47 -18.836 -1.244 6.599 423 HB2 LEU 47 HB2 LEU 47 -18.301 -4.173 7.279 424 HB3 LEU 47 HB3 LEU 47 -18.612 -2.889 8.429 425 HG LEU 47 HG LEU 47 -20.869 -2.588 6.984 426 HD11 LEU 47 HD11 LEU 47 -21.783 -4.818 6.405 427 HD12 LEU 47 HD12 LEU 47 -20.400 -4.439 5.376 428 HD13 LEU 47 HD13 LEU 47 -20.205 -5.560 6.727 429 HD21 LEU 47 HD21 LEU 47 -20.401 -4.712 9.116 430 HD22 LEU 47 HD22 LEU 47 -20.779 -2.996 9.388 431 HD23 LEU 47 HD23 LEU 47 -21.984 -4.055 8.641 432 H ASP 48 H ASP 48 -17.258 -1.073 8.499 433 HA ASP 48 HA ASP 48 -14.730 -0.350 7.375 434 HB2 ASP 48 HB2 ASP 48 -14.246 0.636 9.623 435 HB3 ASP 48 HB3 ASP 48 -15.638 1.227 8.739 436 H LYS 49 H LYS 49 -14.559 -2.908 6.960 437 HA LYS 49 HA LYS 49 -12.113 -3.604 8.524 438 HB2 LYS 49 HB2 LYS 49 -14.438 -5.524 8.049 439 HB3 LYS 49 HB3 LYS 49 -12.778 -6.058 8.317 440 HG2 LYS 49 HG2 LYS 49 -13.412 -6.129 10.474 441 HG3 LYS 49 HG3 LYS 49 -12.887 -4.459 10.428 442 HD2 LYS 49 HD2 LYS 49 -15.474 -3.979 9.881 443 HD3 LYS 49 HD3 LYS 49 -15.690 -5.619 10.485 444 HE2 LYS 49 HE2 LYS 49 -15.960 -4.346 12.443 445 HE3 LYS 49 HE3 LYS 49 -14.253 -4.825 12.536 446 HZ1 LYS 49 HZ1 LYS 49 -15.364 -2.187 11.714 447 HZ2 LYS 49 HZ2 LYS 49 -14.313 -2.488 12.959 448 HZ3 LYS 49 HZ3 LYS 49 -13.824 -2.568 11.396 449 H THR 50 H THR 50 -10.978 -2.690 6.871 450 HA THR 50 HA THR 50 -11.019 -3.770 4.103 451 HB THR 50 HB THR 50 -9.048 -2.022 4.051 452 HG1 THR 50 HG1 THR 50 -8.821 -0.790 5.815 453 HG21 THR 50 HG21 THR 50 -11.824 -1.051 4.869 454 HG22 THR 50 HG22 THR 50 -10.571 -0.085 4.056 455 HG23 THR 50 HG23 THR 50 -11.317 -1.452 3.211 456 H LYS 51 H LYS 51 -9.268 -4.296 7.112 457 HA LYS 51 HA LYS 51 -7.254 -6.069 5.832 458 HB2 LYS 51 HB2 LYS 51 -6.355 -3.797 5.578 459 HB3 LYS 51 HB3 LYS 51 -6.660 -3.443 7.278 460 HG2 LYS 51 HG2 LYS 51 -4.951 -5.133 7.938 461 HG3 LYS 51 HG3 LYS 51 -4.647 -5.474 6.221 462 HD2 LYS 51 HD2 LYS 51 -4.001 -3.068 5.901 463 HD3 LYS 51 HD3 LYS 51 -4.317 -2.781 7.630 464 HE2 LYS 51 HE2 LYS 51 -2.608 -4.613 8.127 465 HE3 LYS 51 HE3 LYS 51 -2.204 -4.616 6.398 466 HZ1 LYS 51 HZ1 LYS 51 -1.930 -2.280 8.253 467 HZ2 LYS 51 HZ2 LYS 51 -0.689 -3.132 7.542 468 HZ3 LYS 51 HZ3 LYS 51 -1.611 -2.223 6.626 469 H PHE 52 H PHE 52 -6.337 -7.545 7.254 470 HA PHE 52 HA PHE 52 -6.472 -7.066 10.097 471 HB2 PHE 52 HB2 PHE 52 -7.474 -9.349 10.654 472 HB3 PHE 52 HB3 PHE 52 -8.507 -7.993 10.258 473 HD1 PHE 52 HD1 PHE 52 -6.929 -11.005 8.676 474 HD2 PHE 52 HD2 PHE 52 -10.225 -8.233 8.657 475 HE1 PHE 52 HE1 PHE 52 -8.103 -12.415 7.011 476 HE2 PHE 52 HE2 PHE 52 -11.410 -9.669 7.028 477 HZ PHE 52 HZ PHE 52 -10.348 -11.752 6.174 478 H LEU 53 H LEU 53 -5.085 -8.152 11.468 479 HA LEU 53 HA LEU 53 -3.044 -9.914 10.137 480 HB2 LEU 53 HB2 LEU 53 -2.831 -7.922 12.413 481 HB3 LEU 53 HB3 LEU 53 -1.732 -9.275 12.301 482 HG LEU 53 HG LEU 53 -0.769 -8.511 10.265 483 HD11 LEU 53 HD11 LEU 53 -1.301 -6.315 9.235 484 HD12 LEU 53 HD12 LEU 53 -2.638 -7.462 9.058 485 HD13 LEU 53 HD13 LEU 53 -2.730 -6.178 10.291 486 HD21 LEU 53 HD21 LEU 53 -1.103 -6.207 12.246 487 HD22 LEU 53 HD22 LEU 53 0.107 -7.509 12.338 488 HD23 LEU 53 HD23 LEU 53 0.169 -6.329 11.025 489 H VAL 54 H VAL 54 -3.099 -11.971 10.779 490 HA VAL 54 HA VAL 54 -4.895 -12.700 13.056 491 HB VAL 54 HB VAL 54 -4.330 -14.412 10.643 492 HG11 VAL 54 HG11 VAL 54 -6.383 -15.553 11.268 493 HG12 VAL 54 HG12 VAL 54 -5.294 -15.519 12.663 494 HG13 VAL 54 HG13 VAL 54 -6.674 -14.406 12.590 495 HG21 VAL 54 HG21 VAL 54 -6.508 -13.691 9.721 496 HG22 VAL 54 HG22 VAL 54 -6.604 -12.421 10.967 497 HG23 VAL 54 HG23 VAL 54 -5.315 -12.395 9.733 498 HA PRO 55 HA PRO 55 -1.218 -14.820 14.659 499 HB2 PRO 55 HB2 PRO 55 -2.276 -16.045 16.873 500 HB3 PRO 55 HB3 PRO 55 -1.863 -14.306 16.796 501 HG2 PRO 55 HG2 PRO 55 -4.570 -15.605 16.429 502 HG3 PRO 55 HG3 PRO 55 -4.152 -14.150 17.393 503 HD2 PRO 55 HD2 PRO 55 -5.221 -14.018 14.873 504 HD3 PRO 55 HD3 PRO 55 -4.060 -12.795 15.479 505 H ASP 56 H ASP 56 -0.362 -16.844 14.408 506 HA ASP 56 HA ASP 56 -1.436 -18.351 12.377 507 HB2 ASP 56 HB2 ASP 56 0.363 -20.016 12.832 508 HB3 ASP 56 HB3 ASP 56 0.843 -18.341 12.598 509 H HIS 57 H HIS 57 -2.075 -19.011 15.729 510 HA HIS 57 HA HIS 57 -2.978 -21.718 15.419 511 HB2 HIS 57 HB2 HIS 57 -2.260 -20.361 17.524 512 HB3 HIS 57 HB3 HIS 57 -3.925 -19.816 17.592 513 HD1 HIS 57 HD1 HIS 57 -5.457 -22.551 17.111 514 HD2 HIS 57 HD2 HIS 57 -2.054 -21.948 19.533 515 HE1 HIS 57 HE1 HIS 57 -5.508 -24.399 18.919 516 HE2 HIS 57 HE2 HIS 57 -3.415 -24.031 20.376 517 H VAL 58 H VAL 58 -4.590 -18.792 14.457 518 HA VAL 58 HA VAL 58 -7.355 -19.755 14.711 519 HB VAL 58 HB VAL 58 -6.116 -17.591 12.981 520 HG11 VAL 58 HG11 VAL 58 -8.223 -18.210 11.938 521 HG12 VAL 58 HG12 VAL 58 -9.062 -18.175 13.514 522 HG13 VAL 58 HG13 VAL 58 -8.439 -16.683 12.779 523 HG21 VAL 58 HG21 VAL 58 -7.750 -17.365 15.544 524 HG22 VAL 58 HG22 VAL 58 -5.986 -17.150 15.437 525 HG23 VAL 58 HG23 VAL 58 -7.064 -16.021 14.611 526 H ASN 59 H ASN 59 -8.507 -21.043 13.259 527 HA ASN 59 HA ASN 59 -7.099 -21.902 10.772 528 HB2 ASN 59 HB2 ASN 59 -8.471 -23.813 10.727 529 HB3 ASN 59 HB3 ASN 59 -7.889 -23.656 12.367 530 HD21 ASN 59 HD21 ASN 59 -11.214 -23.770 13.576 531 HD22 ASN 59 HD22 ASN 59 -9.506 -23.980 13.917 532 H MET 60 H MET 60 -8.354 -22.116 8.766 533 HA MET 60 HA MET 60 -9.314 -19.611 7.962 534 HB2 MET 60 HB2 MET 60 -8.364 -21.430 6.507 535 HB3 MET 60 HB3 MET 60 -9.894 -22.289 6.634 536 HG2 MET 60 HG2 MET 60 -9.880 -21.103 4.553 537 HG3 MET 60 HG3 MET 60 -11.060 -20.336 5.606 538 HE1 MET 60 HE1 MET 60 -10.603 -18.736 3.240 539 HE2 MET 60 HE2 MET 60 -11.328 -17.970 4.677 540 HE3 MET 60 HE3 MET 60 -10.038 -17.142 3.790 541 H SER 61 H SER 61 -11.353 -22.458 8.815 542 HA SER 61 HA SER 61 -13.886 -21.191 8.236 543 HB2 SER 61 HB2 SER 61 -13.593 -23.619 8.407 544 HB3 SER 61 HB3 SER 61 -13.184 -23.469 10.128 545 HG SER 61 HG SER 61 -15.420 -24.003 9.748 546 H GLU 62 H GLU 62 -11.913 -21.367 11.242 547 HA GLU 62 HA GLU 62 -13.781 -19.941 12.877 548 HB2 GLU 62 HB2 GLU 62 -11.882 -21.340 13.708 549 HB3 GLU 62 HB3 GLU 62 -10.761 -20.103 13.148 550 HG2 GLU 62 HG2 GLU 62 -11.052 -19.811 15.489 551 HG3 GLU 62 HG3 GLU 62 -11.834 -18.455 14.692 552 H LEU 63 H LEU 63 -11.042 -18.720 10.889 553 HA LEU 63 HA LEU 63 -11.422 -15.925 11.424 554 HB2 LEU 63 HB2 LEU 63 -9.438 -16.774 10.261 555 HB3 LEU 63 HB3 LEU 63 -10.430 -17.417 8.959 556 HG LEU 63 HG LEU 63 -11.109 -15.044 8.362 557 HD11 LEU 63 HD11 LEU 63 -9.683 -13.210 9.205 558 HD12 LEU 63 HD12 LEU 63 -10.574 -13.954 10.534 559 HD13 LEU 63 HD13 LEU 63 -8.855 -14.335 10.304 560 HD21 LEU 63 HD21 LEU 63 -9.057 -14.537 7.188 561 HD22 LEU 63 HD22 LEU 63 -8.123 -15.599 8.273 562 HD23 LEU 63 HD23 LEU 63 -9.339 -16.279 7.155 563 H ILE 64 H ILE 64 -12.915 -18.016 8.896 564 HA ILE 64 HA ILE 64 -14.581 -16.019 7.722 565 HB ILE 64 HB ILE 64 -14.745 -19.024 7.942 566 HG12 ILE 64 HG12 ILE 64 -14.432 -17.319 5.451 567 HG13 ILE 64 HG13 ILE 64 -13.046 -17.719 6.470 568 HG21 ILE 64 HG21 ILE 64 -16.734 -17.291 6.413 569 HG22 ILE 64 HG22 ILE 64 -16.574 -19.056 6.269 570 HG23 ILE 64 HG23 ILE 64 -17.097 -18.369 7.791 571 HD11 ILE 64 HD11 ILE 64 -13.217 -19.300 4.611 572 HD12 ILE 64 HD12 ILE 64 -13.431 -20.124 6.165 573 HD13 ILE 64 HD13 ILE 64 -14.836 -19.778 5.141 574 H LYS 65 H LYS 65 -15.320 -18.175 10.511 575 HA LYS 65 HA LYS 65 -17.965 -17.223 10.977 576 HB2 LYS 65 HB2 LYS 65 -15.867 -18.384 12.838 577 HB3 LYS 65 HB3 LYS 65 -17.497 -17.980 13.381 578 HG2 LYS 65 HG2 LYS 65 -18.523 -19.615 12.014 579 HG3 LYS 65 HG3 LYS 65 -17.103 -19.798 10.988 580 HD2 LYS 65 HD2 LYS 65 -17.310 -21.737 12.443 581 HD3 LYS 65 HD3 LYS 65 -15.843 -20.832 12.815 582 HE2 LYS 65 HE2 LYS 65 -17.217 -19.700 14.709 583 HE3 LYS 65 HE3 LYS 65 -18.455 -20.924 14.398 584 HZ1 LYS 65 HZ1 LYS 65 -16.697 -22.620 14.867 585 HZ2 LYS 65 HZ2 LYS 65 -15.627 -21.412 15.223 586 HZ3 LYS 65 HZ3 LYS 65 -16.949 -21.645 16.158 587 H ILE 66 H ILE 66 -14.939 -15.984 12.512 588 HA ILE 66 HA ILE 66 -16.378 -13.903 13.911 589 HB ILE 66 HB ILE 66 -14.308 -14.663 14.760 590 HG12 ILE 66 HG12 ILE 66 -15.083 -12.212 15.063 591 HG13 ILE 66 HG13 ILE 66 -13.507 -12.720 15.616 592 HG21 ILE 66 HG21 ILE 66 -12.096 -14.108 13.821 593 HG22 ILE 66 HG22 ILE 66 -13.003 -15.206 12.805 594 HG23 ILE 66 HG23 ILE 66 -12.868 -13.513 12.334 595 HD11 ILE 66 HD11 ILE 66 -13.396 -10.508 14.608 596 HD12 ILE 66 HD12 ILE 66 -12.394 -11.659 13.717 597 HD13 ILE 66 HD13 ILE 66 -13.964 -11.145 13.055 598 H ILE 67 H ILE 67 -14.660 -13.832 10.747 599 HA ILE 67 HA ILE 67 -15.177 -11.011 10.378 600 HB ILE 67 HB ILE 67 -14.442 -13.194 8.406 601 HG12 ILE 67 HG12 ILE 67 -12.669 -12.786 10.049 602 HG13 ILE 67 HG13 ILE 67 -12.203 -12.199 8.470 603 HG21 ILE 67 HG21 ILE 67 -14.594 -10.175 7.999 604 HG22 ILE 67 HG22 ILE 67 -13.752 -11.299 6.906 605 HG23 ILE 67 HG23 ILE 67 -15.498 -11.430 7.132 606 HD11 ILE 67 HD11 ILE 67 -12.697 -9.850 9.250 607 HD12 ILE 67 HD12 ILE 67 -13.074 -10.506 10.856 608 HD13 ILE 67 HD13 ILE 67 -11.448 -10.681 10.188 609 H ARG 68 H ARG 68 -17.070 -13.885 9.278 610 HA ARG 68 HA ARG 68 -19.099 -12.467 7.879 611 HB2 ARG 68 HB2 ARG 68 -18.813 -14.943 7.891 612 HB3 ARG 68 HB3 ARG 68 -19.325 -14.999 9.576 613 HG2 ARG 68 HG2 ARG 68 -21.547 -14.068 8.890 614 HG3 ARG 68 HG3 ARG 68 -21.034 -14.122 7.202 615 HD2 ARG 68 HD2 ARG 68 -21.176 -16.537 9.057 616 HD3 ARG 68 HD3 ARG 68 -22.503 -16.021 8.023 617 HE ARG 68 HE ARG 68 -21.108 -16.412 6.043 618 HH11 ARG 68 HH11 ARG 68 -20.513 -18.349 8.887 619 HH12 ARG 68 HH12 ARG 68 -19.785 -19.631 7.966 620 HH21 ARG 68 HH21 ARG 68 -19.965 -18.017 4.924 621 HH22 ARG 68 HH22 ARG 68 -19.566 -19.465 5.792 622 H ARG 69 H ARG 69 -18.941 -13.235 11.367 623 HA ARG 69 HA ARG 69 -21.323 -11.775 12.094 624 HB2 ARG 69 HB2 ARG 69 -20.441 -13.567 13.457 625 HB3 ARG 69 HB3 ARG 69 -18.921 -12.726 13.708 626 HG2 ARG 69 HG2 ARG 69 -20.395 -12.682 15.689 627 HG3 ARG 69 HG3 ARG 69 -19.938 -11.080 15.132 628 HD2 ARG 69 HD2 ARG 69 -22.279 -11.169 15.864 629 HD3 ARG 69 HD3 ARG 69 -22.136 -10.704 14.170 630 HE ARG 69 HE ARG 69 -22.626 -13.580 14.740 631 HH11 ARG 69 HH11 ARG 69 -24.201 -10.521 13.947 632 HH12 ARG 69 HH12 ARG 69 -25.600 -11.357 13.292 633 HH21 ARG 69 HH21 ARG 69 -24.531 -14.500 13.950 634 HH22 ARG 69 HH22 ARG 69 -25.798 -13.430 13.377 635 H ARG 70 H ARG 70 -17.867 -10.698 12.179 636 HA ARG 70 HA ARG 70 -18.558 -8.032 13.130 637 HB2 ARG 70 HB2 ARG 70 -16.062 -9.046 11.699 638 HB3 ARG 70 HB3 ARG 70 -16.233 -7.422 12.354 639 HG2 ARG 70 HG2 ARG 70 -16.188 -10.006 13.945 640 HG3 ARG 70 HG3 ARG 70 -14.972 -8.734 13.901 641 HD2 ARG 70 HD2 ARG 70 -16.657 -7.165 14.916 642 HD3 ARG 70 HD3 ARG 70 -17.772 -8.515 15.106 643 HE ARG 70 HE ARG 70 -15.418 -7.893 16.724 644 HH11 ARG 70 HH11 ARG 70 -17.502 -10.634 15.944 645 HH12 ARG 70 HH12 ARG 70 -17.184 -11.367 17.491 646 HH21 ARG 70 HH21 ARG 70 -15.112 -8.800 18.519 647 HH22 ARG 70 HH22 ARG 70 -15.833 -10.348 18.966 648 H LEU 71 H LEU 71 -18.564 -9.332 9.878 649 HA LEU 71 HA LEU 71 -19.200 -6.724 8.678 650 HB2 LEU 71 HB2 LEU 71 -19.306 -9.575 7.627 651 HB3 LEU 71 HB3 LEU 71 -19.687 -8.161 6.652 652 HG LEU 71 HG LEU 71 -16.963 -8.660 7.930 653 HD11 LEU 71 HD11 LEU 71 -16.244 -9.181 5.639 654 HD12 LEU 71 HD12 LEU 71 -17.530 -10.287 6.158 655 HD13 LEU 71 HD13 LEU 71 -17.901 -8.952 5.042 656 HD21 LEU 71 HD21 LEU 71 -16.207 -6.890 6.349 657 HD22 LEU 71 HD22 LEU 71 -17.901 -6.559 5.928 658 HD23 LEU 71 HD23 LEU 71 -17.300 -6.276 7.589 659 H GLN 72 H GLN 72 -20.964 -8.273 10.866 660 HA GLN 72 HA GLN 72 -23.078 -8.367 11.510 661 HB2 GLN 72 HB2 GLN 72 -23.547 -6.138 9.500 662 HB3 GLN 72 HB3 GLN 72 -24.634 -6.597 10.815 663 HG2 GLN 72 HG2 GLN 72 -22.898 -6.067 12.489 664 HG3 GLN 72 HG3 GLN 72 -21.792 -5.571 11.199 665 HE21 GLN 72 HE21 GLN 72 -23.221 -2.419 12.421 666 HE22 GLN 72 HE22 GLN 72 -22.081 -3.643 12.963 667 H LEU 73 H LEU 73 -22.314 -10.157 9.210 668 HA LEU 73 HA LEU 73 -24.907 -10.560 7.830 669 HB2 LEU 73 HB2 LEU 73 -22.294 -12.066 7.553 670 HB3 LEU 73 HB3 LEU 73 -23.701 -12.203 6.507 671 HG LEU 73 HG LEU 73 -21.899 -9.756 6.817 672 HD11 LEU 73 HD11 LEU 73 -20.907 -11.644 5.577 673 HD12 LEU 73 HD12 LEU 73 -22.315 -11.647 4.480 674 HD13 LEU 73 HD13 LEU 73 -21.214 -10.250 4.532 675 HD21 LEU 73 HD21 LEU 73 -23.151 -8.835 4.878 676 HD22 LEU 73 HD22 LEU 73 -24.292 -10.199 4.962 677 HD23 LEU 73 HD23 LEU 73 -24.192 -9.015 6.287 678 H ASN 74 H ASN 74 -26.444 -11.706 8.790 679 HA ASN 74 HA ASN 74 -25.885 -13.787 10.798 680 HB2 ASN 74 HB2 ASN 74 -28.442 -12.737 9.512 681 HB3 ASN 74 HB3 ASN 74 -28.424 -14.050 10.688 682 HD21 ASN 74 HD21 ASN 74 -28.937 -10.675 12.371 683 HD22 ASN 74 HD22 ASN 74 -29.622 -11.299 10.880 684 H ALA 75 H ALA 75 -26.862 -15.991 10.543 685 HA ALA 75 HA ALA 75 -25.508 -17.339 8.496 686 HB1 ALA 75 HB1 ALA 75 -26.654 -19.333 9.389 687 HB2 ALA 75 HB2 ALA 75 -26.102 -18.276 10.699 688 HB3 ALA 75 HB3 ALA 75 -27.822 -18.301 10.237 689 H ASN 76 H ASN 76 -28.755 -16.016 8.292 690 HA ASN 76 HA ASN 76 -29.653 -17.578 6.025 691 HB2 ASN 76 HB2 ASN 76 -30.466 -14.832 7.069 692 HB3 ASN 76 HB3 ASN 76 -31.301 -15.684 5.780 693 HD21 ASN 76 HD21 ASN 76 -32.992 -16.339 9.089 694 HD22 ASN 76 HD22 ASN 76 -32.435 -14.855 8.332 695 H GLN 77 H GLN 77 -27.352 -14.936 6.247 696 HA GLN 77 HA GLN 77 -27.586 -14.208 3.395 697 HB2 GLN 77 HB2 GLN 77 -25.520 -13.329 5.450 698 HB3 GLN 77 HB3 GLN 77 -25.804 -12.632 3.859 699 HG2 GLN 77 HG2 GLN 77 -27.581 -12.460 6.318 700 HG3 GLN 77 HG3 GLN 77 -26.757 -11.150 5.478 701 HE21 GLN 77 HE21 GLN 77 -29.237 -11.163 2.755 702 HE22 GLN 77 HE22 GLN 77 -27.518 -10.905 3.016 703 H ALA 78 H ALA 78 -26.369 -15.073 1.780 704 HA ALA 78 HA ALA 78 -24.421 -17.185 2.309 705 HB1 ALA 78 HB1 ALA 78 -25.176 -15.735 -0.267 706 HB2 ALA 78 HB2 ALA 78 -24.181 -17.205 -0.140 707 HB3 ALA 78 HB3 ALA 78 -25.886 -17.250 0.338 708 H PHE 79 H PHE 79 -22.281 -16.922 2.680 709 HA PHE 79 HA PHE 79 -20.793 -14.717 1.543 710 HB2 PHE 79 HB2 PHE 79 -21.490 -13.415 3.277 711 HB3 PHE 79 HB3 PHE 79 -21.404 -14.704 4.457 712 HD1 PHE 79 HD1 PHE 79 -19.606 -11.986 2.869 713 HD2 PHE 79 HD2 PHE 79 -19.125 -15.475 5.351 714 HE1 PHE 79 HE1 PHE 79 -17.413 -11.140 3.655 715 HE2 PHE 79 HE2 PHE 79 -16.930 -14.634 6.115 716 HZ PHE 79 HZ PHE 79 -16.062 -12.475 5.249 717 H PHE 80 H PHE 80 -18.787 -15.078 1.045 718 HA PHE 80 HA PHE 80 -17.312 -17.393 2.249 719 HB2 PHE 80 HB2 PHE 80 -17.553 -16.680 -0.715 720 HB3 PHE 80 HB3 PHE 80 -16.651 -18.029 -0.044 721 HD1 PHE 80 HD1 PHE 80 -20.075 -16.698 -0.718 722 HD2 PHE 80 HD2 PHE 80 -17.721 -20.144 0.352 723 HE1 PHE 80 HE1 PHE 80 -22.051 -18.161 -1.059 724 HE2 PHE 80 HE2 PHE 80 -19.698 -21.600 0.016 725 HZ PHE 80 HZ PHE 80 -21.870 -20.609 -0.685 726 H LEU 81 H LEU 81 -15.136 -16.935 2.625 727 HA LEU 81 HA LEU 81 -13.954 -14.391 1.560 728 HB2 LEU 81 HB2 LEU 81 -13.014 -16.369 3.685 729 HB3 LEU 81 HB3 LEU 81 -12.002 -15.078 3.046 730 HG LEU 81 HG LEU 81 -14.575 -14.692 4.620 731 HD11 LEU 81 HD11 LEU 81 -11.682 -14.042 5.322 732 HD12 LEU 81 HD12 LEU 81 -13.102 -13.823 6.359 733 HD13 LEU 81 HD13 LEU 81 -12.568 -15.459 5.926 734 HD21 LEU 81 HD21 LEU 81 -14.373 -12.843 3.085 735 HD22 LEU 81 HD22 LEU 81 -13.820 -12.269 4.656 736 HD23 LEU 81 HD23 LEU 81 -12.629 -12.651 3.407 737 H LEU 82 H LEU 82 -13.216 -14.634 -0.460 738 HA LEU 82 HA LEU 82 -12.169 -17.247 -1.363 739 HB2 LEU 82 HB2 LEU 82 -12.564 -14.786 -3.063 740 HB3 LEU 82 HB3 LEU 82 -12.495 -16.465 -3.549 741 HG LEU 82 HG LEU 82 -14.822 -15.148 -2.036 742 HD11 LEU 82 HD11 LEU 82 -14.635 -14.404 -4.362 743 HD12 LEU 82 HD12 LEU 82 -14.478 -16.084 -4.925 744 HD13 LEU 82 HD13 LEU 82 -15.995 -15.526 -4.201 745 HD21 LEU 82 HD21 LEU 82 -14.502 -17.955 -3.237 746 HD22 LEU 82 HD22 LEU 82 -14.606 -17.579 -1.500 747 HD23 LEU 82 HD23 LEU 82 -15.995 -17.281 -2.556 748 H VAL 83 H VAL 83 -10.083 -17.554 -0.796 749 HA VAL 83 HA VAL 83 -8.219 -15.357 -0.466 750 HB VAL 83 HB VAL 83 -7.313 -18.219 -0.563 751 HG11 VAL 83 HG11 VAL 83 -6.506 -15.797 1.123 752 HG12 VAL 83 HG12 VAL 83 -5.716 -17.391 1.099 753 HG13 VAL 83 HG13 VAL 83 -5.668 -16.357 -0.341 754 HG21 VAL 83 HG21 VAL 83 -7.770 -18.344 1.904 755 HG22 VAL 83 HG22 VAL 83 -8.783 -16.889 1.745 756 HG23 VAL 83 HG23 VAL 83 -9.222 -18.398 0.910 757 H ASN 84 H ASN 84 -7.126 -14.347 -2.066 758 HA ASN 84 HA ASN 84 -6.634 -13.768 -4.227 759 HB2 ASN 84 HB2 ASN 84 -5.608 -16.623 -4.429 760 HB3 ASN 84 HB3 ASN 84 -5.133 -15.272 -5.450 761 HD21 ASN 84 HD21 ASN 84 -2.829 -15.964 -2.413 762 HD22 ASN 84 HD22 ASN 84 -3.856 -17.131 -3.244 763 H GLY 85 H GLY 85 -9.379 -14.819 -3.821 764 HA2 GLY 85 HA2 GLY 85 -11.225 -15.011 -5.267 765 HA3 GLY 85 HA3 GLY 85 -10.159 -15.338 -6.623 766 H HIS 86 H HIS 86 -9.053 -17.522 -4.427 767 HA HIS 86 HA HIS 86 -10.786 -19.745 -5.385 768 HB2 HIS 86 HB2 HIS 86 -8.433 -20.067 -5.670 769 HB3 HIS 86 HB3 HIS 86 -8.074 -19.529 -4.041 770 HD1 HIS 86 HD1 HIS 86 -6.899 -21.565 -3.079 771 HD2 HIS 86 HD2 HIS 86 -10.598 -22.408 -4.970 772 HE1 HIS 86 HE1 HIS 86 -7.446 -24.046 -2.578 773 HE2 HIS 86 HE2 HIS 86 -9.706 -24.533 -3.723 774 H SER 87 H SER 87 -12.385 -20.620 -4.117 775 HA SER 87 HA SER 87 -12.866 -19.657 -1.413 776 HB2 SER 87 HB2 SER 87 -14.713 -20.293 -2.872 777 HB3 SER 87 HB3 SER 87 -14.134 -21.975 -2.899 778 HG SER 87 HG SER 87 -15.731 -21.712 -1.302 779 H MET 88 H MET 88 -12.404 -20.528 0.524 780 HA MET 88 HA MET 88 -11.292 -23.301 0.697 781 HB2 MET 88 HB2 MET 88 -10.157 -20.854 2.100 782 HB3 MET 88 HB3 MET 88 -9.661 -22.533 2.371 783 HG2 MET 88 HG2 MET 88 -9.000 -22.689 -0.040 784 HG3 MET 88 HG3 MET 88 -9.397 -20.977 -0.223 785 HE1 MET 88 HE1 MET 88 -7.397 -23.018 2.647 786 HE2 MET 88 HE2 MET 88 -6.879 -23.632 1.061 787 HE3 MET 88 HE3 MET 88 -5.752 -22.698 2.067 788 H VAL 89 H VAL 89 -14.031 -21.995 1.321 789 HA VAL 89 HA VAL 89 -14.163 -21.835 4.175 790 HB VAL 89 HB VAL 89 -16.402 -21.343 4.061 791 HG11 VAL 89 HG11 VAL 89 -15.492 -20.435 1.298 792 HG12 VAL 89 HG12 VAL 89 -16.615 -19.640 2.419 793 HG13 VAL 89 HG13 VAL 89 -14.887 -19.713 2.799 794 HG21 VAL 89 HG21 VAL 89 -17.299 -23.276 2.852 795 HG22 VAL 89 HG22 VAL 89 -17.894 -21.781 2.145 796 HG23 VAL 89 HG23 VAL 89 -16.594 -22.679 1.334 797 H SER 90 H SER 90 -14.390 -24.640 2.196 798 HA SER 90 HA SER 90 -15.679 -26.359 4.159 799 HB2 SER 90 HB2 SER 90 -14.918 -28.154 2.622 800 HB3 SER 90 HB3 SER 90 -15.791 -26.857 1.784 801 HG SER 90 HG SER 90 -13.844 -27.468 0.690 802 H VAL 91 H VAL 91 -12.511 -25.030 4.006 803 HA VAL 91 HA VAL 91 -11.243 -27.396 5.212 804 HB VAL 91 HB VAL 91 -9.657 -24.992 4.396 805 HG11 VAL 91 HG11 VAL 91 -9.104 -27.995 4.264 806 HG12 VAL 91 HG12 VAL 91 -7.948 -26.684 3.957 807 HG13 VAL 91 HG13 VAL 91 -8.580 -26.944 5.587 808 HG21 VAL 91 HG21 VAL 91 -11.005 -25.413 2.390 809 HG22 VAL 91 HG22 VAL 91 -9.357 -25.988 2.145 810 HG23 VAL 91 HG23 VAL 91 -10.656 -27.148 2.496 811 H SER 92 H SER 92 -10.495 -27.609 7.216 812 HA SER 92 HA SER 92 -10.713 -25.302 9.097 813 HB2 SER 92 HB2 SER 92 -11.990 -27.471 9.444 814 HB3 SER 92 HB3 SER 92 -10.432 -28.230 9.817 815 HG SER 92 HG SER 92 -11.529 -27.441 11.699 816 H THR 93 H THR 93 -8.486 -25.393 7.284 817 HA THR 93 HA THR 93 -6.192 -26.370 8.793 818 HB THR 93 HB THR 93 -6.443 -26.624 6.303 819 HG1 THR 93 HG1 THR 93 -4.260 -26.704 6.159 820 HG21 THR 93 HG21 THR 93 -6.795 -24.158 5.784 821 HG22 THR 93 HG22 THR 93 -5.106 -23.886 6.270 822 HG23 THR 93 HG23 THR 93 -5.477 -24.930 4.886 823 HA PRO 94 HA PRO 94 -5.056 -22.657 10.943 824 HB2 PRO 94 HB2 PRO 94 -2.227 -23.367 10.167 825 HB3 PRO 94 HB3 PRO 94 -2.862 -22.849 11.758 826 HG2 PRO 94 HG2 PRO 94 -2.378 -25.458 11.302 827 HG3 PRO 94 HG3 PRO 94 -3.909 -24.981 12.113 828 HD2 PRO 94 HD2 PRO 94 -3.450 -25.672 9.201 829 HD3 PRO 94 HD3 PRO 94 -4.751 -26.223 10.300 830 H ILE 95 H ILE 95 -4.568 -20.472 10.544 831 HA ILE 95 HA ILE 95 -4.684 -19.578 7.861 832 HB ILE 95 HB ILE 95 -5.560 -18.356 9.811 833 HG12 ILE 95 HG12 ILE 95 -4.905 -16.076 9.226 834 HG13 ILE 95 HG13 ILE 95 -3.530 -16.661 8.296 835 HG21 ILE 95 HG21 ILE 95 -4.085 -17.020 11.261 836 HG22 ILE 95 HG22 ILE 95 -3.697 -18.727 11.413 837 HG23 ILE 95 HG23 ILE 95 -2.651 -17.658 10.450 838 HD11 ILE 95 HD11 ILE 95 -6.444 -17.336 7.677 839 HD12 ILE 95 HD12 ILE 95 -5.549 -15.978 6.955 840 HD13 ILE 95 HD13 ILE 95 -5.030 -17.640 6.638 841 H SER 96 H SER 96 -1.853 -20.377 9.772 842 HA SER 96 HA SER 96 0.140 -19.149 8.065 843 HB2 SER 96 HB2 SER 96 1.640 -20.801 9.219 844 HB3 SER 96 HB3 SER 96 0.719 -19.752 10.310 845 HG SER 96 HG SER 96 0.684 -22.051 10.881 846 H GLU 97 H GLU 97 -1.495 -22.342 8.086 847 HA GLU 97 HA GLU 97 -0.020 -23.388 5.796 848 HB2 GLU 97 HB2 GLU 97 -2.670 -24.241 7.013 849 HB3 GLU 97 HB3 GLU 97 -1.802 -25.125 5.767 850 HG2 GLU 97 HG2 GLU 97 -0.801 -24.578 8.596 851 HG3 GLU 97 HG3 GLU 97 -1.496 -26.086 8.020 852 H VAL 98 H VAL 98 -3.120 -21.638 6.219 853 HA VAL 98 HA VAL 98 -3.860 -21.579 3.435 854 HB VAL 98 HB VAL 98 -4.277 -19.433 5.545 855 HG11 VAL 98 HG11 VAL 98 -6.160 -18.669 4.097 856 HG12 VAL 98 HG12 VAL 98 -4.593 -18.459 3.312 857 HG13 VAL 98 HG13 VAL 98 -5.636 -19.813 2.849 858 HG21 VAL 98 HG21 VAL 98 -5.376 -21.562 6.171 859 HG22 VAL 98 HG22 VAL 98 -6.541 -20.307 5.760 860 HG23 VAL 98 HG23 VAL 98 -6.186 -21.598 4.588 861 H TYR 99 H TYR 99 -1.785 -19.327 5.370 862 HA TYR 99 HA TYR 99 -0.877 -17.799 3.202 863 HB2 TYR 99 HB2 TYR 99 -0.409 -16.820 5.150 864 HB3 TYR 99 HB3 TYR 99 0.178 -18.287 5.908 865 HD1 TYR 99 HD1 TYR 99 1.098 -16.026 3.028 866 HD2 TYR 99 HD2 TYR 99 2.469 -18.538 6.255 867 HE1 TYR 99 HE1 TYR 99 3.457 -15.315 2.597 868 HE2 TYR 99 HE2 TYR 99 4.811 -17.840 5.811 869 HH TYR 99 HH TYR 99 6.196 -16.439 4.595 870 H GLU 100 H GLU 100 0.834 -20.745 4.365 871 HA GLU 100 HA GLU 100 2.749 -20.735 2.301 872 HB2 GLU 100 HB2 GLU 100 2.966 -22.136 4.246 873 HB3 GLU 100 HB3 GLU 100 1.455 -22.963 3.892 874 HG2 GLU 100 HG2 GLU 100 3.301 -24.409 3.415 875 HG3 GLU 100 HG3 GLU 100 2.413 -24.051 1.946 876 H SER 101 H SER 101 -0.612 -21.878 2.148 877 HA SER 101 HA SER 101 -0.350 -23.080 -0.508 878 HB2 SER 101 HB2 SER 101 -2.802 -22.297 1.124 879 HB3 SER 101 HB3 SER 101 -2.811 -23.241 -0.371 880 HG SER 101 HG SER 101 -1.691 -23.942 2.148 881 H GLU 102 H GLU 102 -1.271 -19.883 0.686 882 HA GLU 102 HA GLU 102 -1.991 -18.963 -2.066 883 HB2 GLU 102 HB2 GLU 102 -3.339 -18.406 0.589 884 HB3 GLU 102 HB3 GLU 102 -3.736 -17.569 -0.886 885 HG2 GLU 102 HG2 GLU 102 -4.003 -20.579 -0.482 886 HG3 GLU 102 HG3 GLU 102 -5.287 -19.405 -0.298 887 H LYS 103 H LYS 103 0.597 -18.608 -0.494 888 HA LYS 103 HA LYS 103 1.315 -16.014 0.014 889 HB2 LYS 103 HB2 LYS 103 2.623 -18.279 -1.477 890 HB3 LYS 103 HB3 LYS 103 3.367 -16.693 -1.639 891 HG2 LYS 103 HG2 LYS 103 3.896 -16.497 0.604 892 HG3 LYS 103 HG3 LYS 103 2.719 -17.708 1.121 893 HD2 LYS 103 HD2 LYS 103 4.041 -19.516 0.145 894 HD3 LYS 103 HD3 LYS 103 5.211 -18.341 -0.510 895 HE2 LYS 103 HE2 LYS 103 5.810 -17.609 1.744 896 HE3 LYS 103 HE3 LYS 103 4.561 -18.641 2.456 897 HZ1 LYS 103 HZ1 LYS 103 5.748 -20.590 1.755 898 HZ2 LYS 103 HZ2 LYS 103 6.868 -19.711 0.910 899 HZ3 LYS 103 HZ3 LYS 103 6.813 -19.641 2.542 900 H ASP 104 H ASP 104 0.945 -14.114 -0.858 901 HA ASP 104 HA ASP 104 0.079 -13.852 -3.644 902 HB2 ASP 104 HB2 ASP 104 -0.526 -11.687 -3.074 903 HB3 ASP 104 HB3 ASP 104 -0.850 -12.633 -1.635 904 H GLU 105 H GLU 105 1.139 -11.741 -4.782 905 HA GLU 105 HA GLU 105 3.494 -12.775 -5.895 906 HB2 GLU 105 HB2 GLU 105 2.371 -9.948 -6.009 907 HB3 GLU 105 HB3 GLU 105 3.629 -10.553 -7.080 908 HG2 GLU 105 HG2 GLU 105 0.780 -11.634 -6.887 909 HG3 GLU 105 HG3 GLU 105 1.392 -10.533 -8.118 910 H ASP 106 H ASP 106 3.300 -10.505 -3.207 911 HA ASP 106 HA ASP 106 6.215 -10.642 -2.960 912 HB2 ASP 106 HB2 ASP 106 4.817 -8.026 -3.317 913 HB3 ASP 106 HB3 ASP 106 6.269 -8.119 -2.344 914 H GLY 107 H GLY 107 3.434 -11.103 -1.317 915 HA2 GLY 107 HA2 GLY 107 4.854 -11.173 1.275 916 HA3 GLY 107 HA3 GLY 107 3.542 -10.012 1.117 917 H PHE 108 H PHE 108 2.156 -10.890 2.548 918 HA PHE 108 HA PHE 108 1.775 -13.721 2.764 919 HB2 PHE 108 HB2 PHE 108 0.801 -11.470 4.427 920 HB3 PHE 108 HB3 PHE 108 0.224 -13.108 4.661 921 HD1 PHE 108 HD1 PHE 108 1.467 -14.739 5.838 922 HD2 PHE 108 HD2 PHE 108 3.412 -11.105 4.581 923 HE1 PHE 108 HE1 PHE 108 3.439 -15.318 7.213 924 HE2 PHE 108 HE2 PHE 108 5.400 -11.713 5.917 925 HZ PHE 108 HZ PHE 108 5.416 -13.827 7.238 926 H LEU 109 H LEU 109 -1.207 -11.869 3.148 927 HA LEU 109 HA LEU 109 -2.388 -13.646 1.038 928 HB2 LEU 109 HB2 LEU 109 -3.215 -13.206 3.927 929 HB3 LEU 109 HB3 LEU 109 -4.302 -13.914 2.739 930 HG LEU 109 HG LEU 109 -1.665 -15.142 3.638 931 HD11 LEU 109 HD11 LEU 109 -3.550 -15.174 5.306 932 HD12 LEU 109 HD12 LEU 109 -4.563 -15.992 4.096 933 HD13 LEU 109 HD13 LEU 109 -3.101 -16.785 4.729 934 HD21 LEU 109 HD21 LEU 109 -2.700 -17.146 2.390 935 HD22 LEU 109 HD22 LEU 109 -3.786 -15.985 1.621 936 HD23 LEU 109 HD23 LEU 109 -2.033 -15.857 1.384 937 H TYR 110 H TYR 110 -4.206 -13.143 0.062 938 HA TYR 110 HA TYR 110 -5.614 -10.602 0.629 939 HB2 TYR 110 HB2 TYR 110 -4.821 -11.679 -2.067 940 HB3 TYR 110 HB3 TYR 110 -6.194 -10.617 -1.863 941 HD1 TYR 110 HD1 TYR 110 -2.502 -10.827 -1.393 942 HD2 TYR 110 HD2 TYR 110 -5.955 -8.261 -1.730 943 HE1 TYR 110 HE1 TYR 110 -1.019 -8.866 -1.752 944 HE2 TYR 110 HE2 TYR 110 -4.468 -6.292 -2.023 945 HH TYR 110 HH TYR 110 -2.301 -5.570 -2.342 946 H MET 111 H MET 111 -7.797 -10.759 0.941 947 HA MET 111 HA MET 111 -9.152 -13.256 -0.051 948 HB2 MET 111 HB2 MET 111 -9.578 -11.901 2.645 949 HB3 MET 111 HB3 MET 111 -10.545 -13.230 1.983 950 HG2 MET 111 HG2 MET 111 -8.451 -14.620 1.876 951 HG3 MET 111 HG3 MET 111 -7.599 -13.317 2.713 952 HE1 MET 111 HE1 MET 111 -7.442 -16.231 3.671 953 HE2 MET 111 HE2 MET 111 -6.704 -14.891 4.579 954 HE3 MET 111 HE3 MET 111 -7.724 -16.083 5.416 955 H VAL 112 H VAL 112 -10.495 -12.690 -1.635 956 HA VAL 112 HA VAL 112 -11.949 -10.100 -1.416 957 HB VAL 112 HB VAL 112 -10.787 -10.531 -3.531 958 HG11 VAL 112 HG11 VAL 112 -12.925 -12.636 -4.048 959 HG12 VAL 112 HG12 VAL 112 -11.709 -12.039 -5.194 960 HG13 VAL 112 HG13 VAL 112 -11.196 -12.968 -3.779 961 HG21 VAL 112 HG21 VAL 112 -12.656 -8.971 -3.391 962 HG22 VAL 112 HG22 VAL 112 -12.664 -9.816 -4.948 963 HG23 VAL 112 HG23 VAL 112 -13.808 -10.302 -3.670 964 H TYR 113 H TYR 113 -14.110 -10.050 -0.766 965 HA TYR 113 HA TYR 113 -15.180 -12.763 -0.058 966 HB2 TYR 113 HB2 TYR 113 -16.199 -11.846 1.771 967 HB3 TYR 113 HB3 TYR 113 -14.621 -11.096 1.740 968 HD1 TYR 113 HD1 TYR 113 -14.372 -8.744 1.692 969 HD2 TYR 113 HD2 TYR 113 -18.230 -10.529 1.050 970 HE1 TYR 113 HE1 TYR 113 -15.460 -6.550 2.198 971 HE2 TYR 113 HE2 TYR 113 -19.329 -8.323 1.520 972 HH TYR 113 HH TYR 113 -19.002 -6.142 2.283 973 H ALA 114 H ALA 114 -17.246 -13.340 -0.512 974 HA ALA 114 HA ALA 114 -18.916 -11.707 -2.395 975 HB1 ALA 114 HB1 ALA 114 -17.632 -14.402 -3.007 976 HB2 ALA 114 HB2 ALA 114 -18.683 -13.454 -4.080 977 HB3 ALA 114 HB3 ALA 114 -17.076 -12.853 -3.671 978 H SER 115 H SER 115 -20.978 -12.612 -2.823 979 HA SER 115 HA SER 115 -22.056 -14.450 -0.800 980 HB2 SER 115 HB2 SER 115 -24.227 -13.905 -2.015 981 HB3 SER 115 HB3 SER 115 -23.413 -12.580 -1.176 982 HG SER 115 HG SER 115 -24.075 -11.978 -3.291 983 H GLN 116 H GLN 116 -20.386 -14.977 -3.572 984 HA GLN 116 HA GLN 116 -21.302 -17.744 -3.783 985 HB2 GLN 116 HB2 GLN 116 -21.652 -17.708 -6.163 986 HB3 GLN 116 HB3 GLN 116 -22.772 -16.601 -5.399 987 HG2 GLN 116 HG2 GLN 116 -20.270 -15.817 -6.973 988 HG3 GLN 116 HG3 GLN 116 -21.933 -15.734 -7.531 989 HE21 GLN 116 HE21 GLN 116 -22.633 -13.029 -5.064 990 HE22 GLN 116 HE22 GLN 116 -23.426 -14.391 -5.847 991 H GLU 117 H GLU 117 -19.643 -19.139 -4.481 992 HA GLU 117 HA GLU 117 -16.951 -17.991 -4.840 993 HB2 GLU 117 HB2 GLU 117 -16.134 -20.101 -4.578 994 HB3 GLU 117 HB3 GLU 117 -17.476 -20.068 -3.456 995 HG2 GLU 117 HG2 GLU 117 -17.388 -21.435 -6.188 996 HG3 GLU 117 HG3 GLU 117 -17.149 -22.211 -4.644 997 H THR 118 H THR 118 -19.550 -19.249 -6.810 998 HA THR 118 HA THR 118 -18.399 -18.106 -9.199 999 HB THR 118 HB THR 118 -17.288 -20.303 -9.284 1000 HG1 THR 118 HG1 THR 118 -17.861 -20.675 -11.375 1001 HG21 THR 118 HG21 THR 118 -19.011 -21.714 -8.124 1002 HG22 THR 118 HG22 THR 118 -20.088 -21.516 -9.521 1003 HG23 THR 118 HG23 THR 118 -18.537 -22.358 -9.699 1004 H PHE 119 H PHE 119 -19.942 -17.892 -10.916 1005 HA PHE 119 HA PHE 119 -22.738 -18.002 -10.058 1006 HB2 PHE 119 HB2 PHE 119 -21.421 -16.813 -12.477 1007 HB3 PHE 119 HB3 PHE 119 -23.163 -16.985 -12.345 1008 HD1 PHE 119 HD1 PHE 119 -24.361 -16.015 -10.255 1009 HD2 PHE 119 HD2 PHE 119 -20.366 -14.919 -11.467 1010 HE1 PHE 119 HE1 PHE 119 -24.513 -13.944 -8.890 1011 HE2 PHE 119 HE2 PHE 119 -20.528 -12.846 -10.116 1012 HZ PHE 119 HZ PHE 119 -22.594 -12.369 -8.811 1013 H GLY 120 H GLY 120 -20.757 -20.239 -11.452 1014 HA2 GLY 120 HA2 GLY 120 -21.168 -22.411 -12.176 1015 HA3 GLY 120 HA3 GLY 120 -22.896 -22.158 -11.935 1016 H1 ASP 10 H1 ASP 10 -11.113 -5.779 21.390 1017 H2 ASP 10 H2 ASP 10 -12.341 -5.141 22.270 1018 H3 ASP 10 H3 ASP 10 -12.395 -5.098 20.632 1019 HA ASP 10 HA ASP 10 -11.904 -2.949 21.481 1020 HB2 ASP 10 HB2 ASP 10 -11.022 -3.387 23.594 1021 HB3 ASP 10 HB3 ASP 10 -9.679 -4.320 22.946 1022 H TYR 11 H TYR 11 -8.727 -4.457 20.668 1023 HA TYR 11 HA TYR 11 -8.256 -2.429 18.796 1024 HB2 TYR 11 HB2 TYR 11 -6.774 -4.766 19.739 1025 HB3 TYR 11 HB3 TYR 11 -6.409 -4.310 18.107 1026 HD1 TYR 11 HD1 TYR 11 -5.710 -1.933 17.544 1027 HD2 TYR 11 HD2 TYR 11 -5.883 -3.464 21.586 1028 HE1 TYR 11 HE1 TYR 11 -4.197 -0.108 18.308 1029 HE2 TYR 11 HE2 TYR 11 -4.343 -1.658 22.334 1030 HH TYR 11 HH TYR 11 -3.107 0.196 21.710 1031 H GLU 12 H GLU 12 -8.912 -1.963 16.952 1032 HA GLU 12 HA GLU 12 -9.063 -4.011 14.805 1033 HB2 GLU 12 HB2 GLU 12 -10.879 -2.824 13.740 1034 HB3 GLU 12 HB3 GLU 12 -11.339 -3.419 15.340 1035 HG2 GLU 12 HG2 GLU 12 -10.987 -1.115 16.268 1036 HG3 GLU 12 HG3 GLU 12 -10.571 -0.544 14.645 1037 H SER 13 H SER 13 -8.821 -2.862 12.572 1038 HA SER 13 HA SER 13 -6.208 -2.176 12.491 1039 HB2 SER 13 HB2 SER 13 -8.358 -1.752 10.437 1040 HB3 SER 13 HB3 SER 13 -6.652 -1.384 10.104 1041 HG SER 13 HG SER 13 -7.662 -3.725 9.883 1042 H ASP 14 H ASP 14 -4.825 -0.586 12.342 1043 HA ASP 14 HA ASP 14 -5.653 2.161 11.823 1044 HB2 ASP 14 HB2 ASP 14 -5.853 2.193 14.210 1045 HB3 ASP 14 HB3 ASP 14 -4.272 1.451 14.409 1046 H ASP 15 H ASP 15 -2.445 1.682 13.165 1047 HA ASP 15 HA ASP 15 -1.221 0.643 10.785 1048 HB2 ASP 15 HB2 ASP 15 -1.682 3.169 10.231 1049 HB3 ASP 15 HB3 ASP 15 -0.468 3.527 11.454 1050 H ASP 16 H ASP 16 1.135 0.533 11.071 1051 HA ASP 16 HA ASP 16 2.923 -0.167 12.203 1052 HB2 ASP 16 HB2 ASP 16 3.484 2.034 11.903 1053 HB3 ASP 16 HB3 ASP 16 2.477 2.578 13.244 1054 H SER 17 H SER 17 2.001 1.290 15.295 1055 HA SER 17 HA SER 17 2.895 -1.142 16.621 1056 HB2 SER 17 HB2 SER 17 2.661 0.210 18.666 1057 HB3 SER 17 HB3 SER 17 3.580 1.051 17.411 1058 HG SER 17 HG SER 17 2.009 2.432 18.376 1059 H TYR 18 H TYR 18 -0.114 -0.299 15.472 1060 HA TYR 18 HA TYR 18 -1.936 -0.936 17.543 1061 HB2 TYR 18 HB2 TYR 18 -3.562 -0.868 15.831 1062 HB3 TYR 18 HB3 TYR 18 -2.333 0.261 15.311 1063 HD1 TYR 18 HD1 TYR 18 -4.544 -2.102 14.156 1064 HD2 TYR 18 HD2 TYR 18 -0.361 -1.154 13.802 1065 HE1 TYR 18 HE1 TYR 18 -4.439 -3.207 11.875 1066 HE2 TYR 18 HE2 TYR 18 -0.262 -2.254 11.607 1067 HH TYR 18 HH TYR 18 -1.391 -3.806 10.243 1068 H GLU 19 H GLU 19 -3.488 -2.721 17.486 1069 HA GLU 19 HA GLU 19 -2.513 -5.368 16.538 1070 HB2 GLU 19 HB2 GLU 19 -3.917 -4.703 19.156 1071 HB3 GLU 19 HB3 GLU 19 -3.812 -6.334 18.504 1072 HG2 GLU 19 HG2 GLU 19 -1.437 -4.566 19.229 1073 HG3 GLU 19 HG3 GLU 19 -2.092 -5.862 20.218 1074 H VAL 20 H VAL 20 -4.547 -6.926 16.419 1075 HA VAL 20 HA VAL 20 -6.815 -5.475 15.227 1076 HB VAL 20 HB VAL 20 -5.715 -7.456 13.328 1077 HG11 VAL 20 HG11 VAL 20 -6.775 -4.608 13.103 1078 HG12 VAL 20 HG12 VAL 20 -6.318 -5.592 11.724 1079 HG13 VAL 20 HG13 VAL 20 -7.681 -6.092 12.720 1080 HG21 VAL 20 HG21 VAL 20 -3.565 -6.413 13.899 1081 HG22 VAL 20 HG22 VAL 20 -4.108 -5.902 12.287 1082 HG23 VAL 20 HG23 VAL 20 -4.279 -4.810 13.662 1083 H LEU 21 H LEU 21 -8.436 -6.924 14.127 1084 HA LEU 21 HA LEU 21 -9.803 -8.655 13.908 1085 HB2 LEU 21 HB2 LEU 21 -7.622 -10.008 13.878 1086 HB3 LEU 21 HB3 LEU 21 -7.992 -10.429 15.543 1087 HG LEU 21 HG LEU 21 -10.135 -11.508 14.762 1088 HD11 LEU 21 HD11 LEU 21 -10.307 -12.044 12.327 1089 HD12 LEU 21 HD12 LEU 21 -10.491 -10.310 12.626 1090 HD13 LEU 21 HD13 LEU 21 -8.952 -10.948 11.996 1091 HD21 LEU 21 HD21 LEU 21 -7.545 -12.448 13.471 1092 HD22 LEU 21 HD22 LEU 21 -8.077 -12.804 15.126 1093 HD23 LEU 21 HD23 LEU 21 -8.992 -13.455 13.757 1094 H ASP 22 H ASP 22 -9.308 -6.998 16.573 1095 HA ASP 22 HA ASP 22 -10.472 -6.340 18.221 1096 HB2 ASP 22 HB2 ASP 22 -12.026 -5.628 16.775 1097 HB3 ASP 22 HB3 ASP 22 -12.621 -7.251 16.417 1098 H LEU 23 H LEU 23 -11.304 -9.750 17.944 1099 HA LEU 23 HA LEU 23 -11.829 -10.019 20.817 1100 HB2 LEU 23 HB2 LEU 23 -11.697 -12.481 20.316 1101 HB3 LEU 23 HB3 LEU 23 -12.963 -11.569 19.532 1102 HG LEU 23 HG LEU 23 -11.879 -11.681 17.382 1103 HD11 LEU 23 HD11 LEU 23 -9.855 -13.111 17.024 1104 HD12 LEU 23 HD12 LEU 23 -9.495 -11.618 17.892 1105 HD13 LEU 23 HD13 LEU 23 -9.611 -13.157 18.780 1106 HD21 LEU 23 HD21 LEU 23 -12.011 -14.111 17.026 1107 HD22 LEU 23 HD22 LEU 23 -11.851 -14.388 18.774 1108 HD23 LEU 23 HD23 LEU 23 -13.289 -13.566 18.128 1109 H THR 24 H THR 24 -10.513 -11.575 22.157 1110 HA THR 24 HA THR 24 -7.818 -10.596 22.297 1111 HB THR 24 HB THR 24 -7.519 -11.599 24.311 1112 HG1 THR 24 HG1 THR 24 -8.725 -13.337 25.059 1113 HG21 THR 24 HG21 THR 24 -10.552 -11.269 24.283 1114 HG22 THR 24 HG22 THR 24 -9.453 -11.107 25.665 1115 HG23 THR 24 HG23 THR 24 -9.397 -9.913 24.361 1116 H GLU 25 H GLU 25 -5.827 -11.599 22.187 1117 HA GLU 25 HA GLU 25 -5.633 -13.602 20.054 1118 HB2 GLU 25 HB2 GLU 25 -3.284 -13.109 20.048 1119 HB3 GLU 25 HB3 GLU 25 -4.212 -11.610 20.069 1120 HG2 GLU 25 HG2 GLU 25 -3.813 -11.459 22.563 1121 HG3 GLU 25 HG3 GLU 25 -2.777 -12.883 22.442 1122 H TYR 26 H TYR 26 -4.048 -15.387 20.209 1123 HA TYR 26 HA TYR 26 -4.727 -17.200 22.281 1124 HB2 TYR 26 HB2 TYR 26 -2.883 -17.395 19.936 1125 HB3 TYR 26 HB3 TYR 26 -2.886 -18.628 21.178 1126 HD1 TYR 26 HD1 TYR 26 -4.635 -20.235 21.421 1127 HD2 TYR 26 HD2 TYR 26 -5.035 -16.986 18.611 1128 HE1 TYR 26 HE1 TYR 26 -6.584 -21.379 20.378 1129 HE2 TYR 26 HE2 TYR 26 -6.993 -18.133 17.578 1130 HH TYR 26 HH TYR 26 -8.267 -21.239 18.788 Start of MODEL 16 1 H1 MET 1 H1 MET 1 -9.189 6.078 4.493 2 H2 MET 1 H2 MET 1 -10.789 5.940 4.778 3 H3 MET 1 H3 MET 1 -9.712 5.356 5.862 4 HA MET 1 HA MET 1 -10.112 4.386 3.099 5 HB2 MET 1 HB2 MET 1 -7.978 3.813 3.241 6 HB3 MET 1 HB3 MET 1 -7.943 3.721 5.000 7 HG2 MET 1 HG2 MET 1 -8.960 1.489 4.917 8 HG3 MET 1 HG3 MET 1 -9.101 1.585 3.161 9 HE1 MET 1 HE1 MET 1 -7.354 -0.186 5.778 10 HE2 MET 1 HE2 MET 1 -7.898 -0.935 4.256 11 HE3 MET 1 HE3 MET 1 -6.179 -0.959 4.693 12 HA PRO 2 HA PRO 2 -12.100 0.828 5.312 13 HB2 PRO 2 HB2 PRO 2 -12.439 1.468 8.214 14 HB3 PRO 2 HB3 PRO 2 -11.876 -0.037 7.427 15 HG2 PRO 2 HG2 PRO 2 -10.162 1.603 8.695 16 HG3 PRO 2 HG3 PRO 2 -9.705 0.798 7.155 17 HD2 PRO 2 HD2 PRO 2 -10.768 3.607 7.574 18 HD3 PRO 2 HD3 PRO 2 -9.313 3.080 6.680 19 H SER 3 H SER 3 -13.952 1.191 4.250 20 HA SER 3 HA SER 3 -16.353 2.381 5.412 21 HB2 SER 3 HB2 SER 3 -14.901 4.380 4.856 22 HB3 SER 3 HB3 SER 3 -14.884 3.856 3.169 23 HG SER 3 HG SER 3 -16.510 5.493 3.813 24 H GLU 4 H GLU 4 -17.732 2.952 3.123 25 HA GLU 4 HA GLU 4 -18.265 0.457 1.752 26 HB2 GLU 4 HB2 GLU 4 -20.007 2.067 2.138 27 HB3 GLU 4 HB3 GLU 4 -19.105 3.329 1.304 28 HG2 GLU 4 HG2 GLU 4 -20.953 2.550 -0.048 29 HG3 GLU 4 HG3 GLU 4 -19.417 2.258 -0.845 30 H LYS 5 H LYS 5 -16.029 3.083 1.158 31 HA LYS 5 HA LYS 5 -15.301 2.263 -1.590 32 HB2 LYS 5 HB2 LYS 5 -13.857 4.138 0.329 33 HB3 LYS 5 HB3 LYS 5 -13.568 3.967 -1.395 34 HG2 LYS 5 HG2 LYS 5 -16.063 5.118 -0.068 35 HG3 LYS 5 HG3 LYS 5 -14.805 6.004 -0.924 36 HD2 LYS 5 HD2 LYS 5 -15.428 4.800 -3.043 37 HD3 LYS 5 HD3 LYS 5 -16.763 4.012 -2.165 38 HE2 LYS 5 HE2 LYS 5 -17.713 6.229 -1.599 39 HE3 LYS 5 HE3 LYS 5 -16.387 7.028 -2.450 40 HZ1 LYS 5 HZ1 LYS 5 -18.398 5.232 -3.739 41 HZ2 LYS 5 HZ2 LYS 5 -18.366 6.861 -3.857 42 HZ3 LYS 5 HZ3 LYS 5 -17.172 5.980 -4.521 43 H THR 6 H THR 6 -13.532 1.085 -2.184 44 HA THR 6 HA THR 6 -12.417 -0.749 -0.212 45 HB THR 6 HB THR 6 -13.131 -1.513 -2.426 46 HG1 THR 6 HG1 THR 6 -11.310 -2.836 -2.661 47 HG21 THR 6 HG21 THR 6 -10.517 -0.334 -3.464 48 HG22 THR 6 HG22 THR 6 -11.691 -1.343 -4.344 49 HG23 THR 6 HG23 THR 6 -12.131 0.300 -3.863 50 H PHE 7 H PHE 7 -10.193 -1.305 0.043 51 HA PHE 7 HA PHE 7 -8.687 0.900 1.118 52 HB2 PHE 7 HB2 PHE 7 -7.149 -0.804 1.791 53 HB3 PHE 7 HB3 PHE 7 -8.720 -1.577 1.851 54 HD1 PHE 7 HD1 PHE 7 -9.300 -3.351 0.137 55 HD2 PHE 7 HD2 PHE 7 -5.432 -1.420 0.192 56 HE1 PHE 7 HE1 PHE 7 -8.441 -4.998 -1.503 57 HE2 PHE 7 HE2 PHE 7 -4.594 -3.059 -1.455 58 HZ PHE 7 HZ PHE 7 -6.101 -4.860 -2.311 59 H LYS 8 H LYS 8 -8.489 -0.807 -2.009 60 HA LYS 8 HA LYS 8 -5.851 -0.168 -2.726 61 HB2 LYS 8 HB2 LYS 8 -7.252 -1.900 -3.778 62 HB3 LYS 8 HB3 LYS 8 -8.315 -0.671 -4.454 63 HG2 LYS 8 HG2 LYS 8 -6.899 -1.554 -6.174 64 HG3 LYS 8 HG3 LYS 8 -6.505 0.142 -5.921 65 HD2 LYS 8 HD2 LYS 8 -4.532 -0.602 -4.497 66 HD3 LYS 8 HD3 LYS 8 -4.908 -2.273 -4.924 67 HE2 LYS 8 HE2 LYS 8 -4.195 -0.014 -6.866 68 HE3 LYS 8 HE3 LYS 8 -3.074 -1.242 -6.280 69 HZ1 LYS 8 HZ1 LYS 8 -4.474 -2.943 -7.376 70 HZ2 LYS 8 HZ2 LYS 8 -5.467 -1.785 -7.977 71 HZ3 LYS 8 HZ3 LYS 8 -3.916 -1.855 -8.456 72 H GLN 9 H GLN 9 -8.578 1.957 -2.754 73 HA GLN 9 HA GLN 9 -7.652 4.023 -4.481 74 HB2 GLN 9 HB2 GLN 9 -9.948 3.703 -3.432 75 HB3 GLN 9 HB3 GLN 9 -9.257 4.242 -1.899 76 HG2 GLN 9 HG2 GLN 9 -8.619 6.431 -3.142 77 HG3 GLN 9 HG3 GLN 9 -9.647 5.845 -4.455 78 HE21 GLN 9 HE21 GLN 9 -12.667 6.310 -2.467 79 HE22 GLN 9 HE22 GLN 9 -12.014 5.345 -3.787 80 H ARG 10 H ARG 10 -6.620 3.103 -1.215 81 HA ARG 10 HA ARG 10 -4.934 5.583 -0.974 82 HB2 ARG 10 HB2 ARG 10 -6.156 3.923 1.265 83 HB3 ARG 10 HB3 ARG 10 -5.202 5.390 1.451 84 HG2 ARG 10 HG2 ARG 10 -7.944 5.191 0.131 85 HG3 ARG 10 HG3 ARG 10 -7.605 5.821 1.736 86 HD2 ARG 10 HD2 ARG 10 -6.367 7.697 0.838 87 HD3 ARG 10 HD3 ARG 10 -6.500 7.070 -0.811 88 HE ARG 10 HE ARG 10 -9.006 7.291 -0.577 89 HH11 ARG 10 HH11 ARG 10 -6.955 9.549 1.177 90 HH12 ARG 10 HH12 ARG 10 -8.184 10.785 1.137 91 HH21 ARG 10 HH21 ARG 10 -10.437 8.825 -0.600 92 HH22 ARG 10 HH22 ARG 10 -10.145 10.383 0.153 93 H ARG 11 H ARG 11 -4.845 2.117 0.131 94 HA ARG 11 HA ARG 11 -1.907 2.484 0.542 95 HB2 ARG 11 HB2 ARG 11 -3.821 0.324 1.508 96 HB3 ARG 11 HB3 ARG 11 -2.071 0.358 1.795 97 HG2 ARG 11 HG2 ARG 11 -2.334 2.630 2.875 98 HG3 ARG 11 HG3 ARG 11 -4.085 2.458 2.712 99 HD2 ARG 11 HD2 ARG 11 -3.977 0.380 4.096 100 HD3 ARG 11 HD3 ARG 11 -2.242 0.625 4.308 101 HE ARG 11 HE ARG 11 -4.476 2.286 5.409 102 HH11 ARG 11 HH11 ARG 11 -4.069 3.503 7.263 103 HH12 ARG 11 HH12 ARG 11 -2.418 3.644 7.842 104 HH21 ARG 11 HH21 ARG 11 -0.981 1.743 5.458 105 HH22 ARG 11 HH22 ARG 11 -0.832 2.604 6.987 106 H THR 12 H THR 12 -1.170 2.521 -1.487 107 HA THR 12 HA THR 12 -1.437 0.258 -3.311 108 HB THR 12 HB THR 12 -0.199 1.416 -4.866 109 HG1 THR 12 HG1 THR 12 1.112 3.202 -4.316 110 HG21 THR 12 HG21 THR 12 -2.380 2.570 -4.348 111 HG22 THR 12 HG22 THR 12 -1.478 3.709 -3.314 112 HG23 THR 12 HG23 THR 12 -1.140 3.621 -5.054 113 H PHE 13 H PHE 13 0.687 -0.618 -4.361 114 HA PHE 13 HA PHE 13 1.798 -2.365 -2.547 115 HB2 PHE 13 HB2 PHE 13 2.630 -1.589 -5.305 116 HB3 PHE 13 HB3 PHE 13 3.658 -2.637 -4.354 117 HD1 PHE 13 HD1 PHE 13 2.819 -4.797 -3.418 118 HD2 PHE 13 HD2 PHE 13 0.583 -2.506 -6.312 119 HE1 PHE 13 HE1 PHE 13 1.499 -6.815 -3.998 120 HE2 PHE 13 HE2 PHE 13 -0.746 -4.527 -6.876 121 HZ PHE 13 HZ PHE 13 -0.290 -6.685 -5.722 122 H GLU 14 H GLU 14 3.309 0.801 -3.220 123 HA GLU 14 HA GLU 14 5.764 0.143 -1.854 124 HB2 GLU 14 HB2 GLU 14 4.354 2.820 -2.173 125 HB3 GLU 14 HB3 GLU 14 6.009 2.621 -1.613 126 HG2 GLU 14 HG2 GLU 14 4.944 1.835 -4.362 127 HG3 GLU 14 HG3 GLU 14 5.854 3.289 -3.991 128 H GLN 15 H GLN 15 2.698 1.528 -0.662 129 HA GLN 15 HA GLN 15 3.558 1.767 2.106 130 HB2 GLN 15 HB2 GLN 15 0.744 1.553 0.935 131 HB3 GLN 15 HB3 GLN 15 1.147 2.055 2.574 132 HG2 GLN 15 HG2 GLN 15 1.843 3.541 -0.001 133 HG3 GLN 15 HG3 GLN 15 0.603 3.989 1.156 134 HE21 GLN 15 HE21 GLN 15 3.771 6.006 1.738 135 HE22 GLN 15 HE22 GLN 15 2.856 5.663 0.279 136 H ARG 16 H ARG 16 1.776 -0.753 0.258 137 HA ARG 16 HA ARG 16 1.361 -2.504 2.498 138 HB2 ARG 16 HB2 ARG 16 1.711 -3.295 -0.419 139 HB3 ARG 16 HB3 ARG 16 1.146 -4.304 0.905 140 HG2 ARG 16 HG2 ARG 16 -0.642 -2.198 1.043 141 HG3 ARG 16 HG3 ARG 16 -0.315 -2.292 -0.694 142 HD2 ARG 16 HD2 ARG 16 -1.409 -4.452 1.142 143 HD3 ARG 16 HD3 ARG 16 -2.208 -3.701 -0.242 144 HE ARG 16 HE ARG 16 0.298 -5.348 -0.596 145 HH11 ARG 16 HH11 ARG 16 -2.934 -6.347 -2.651 146 HH12 ARG 16 HH12 ARG 16 -3.039 -4.948 -1.612 147 HH21 ARG 16 HH21 ARG 16 0.290 -7.111 -1.690 148 HH22 ARG 16 HH22 ARG 16 -1.023 -7.542 -2.771 149 H VAL 17 H VAL 17 4.116 -2.333 0.190 150 HA VAL 17 HA VAL 17 5.480 -4.665 1.112 151 HB VAL 17 HB VAL 17 6.335 -2.186 -0.407 152 HG11 VAL 17 HG11 VAL 17 8.510 -3.309 -0.890 153 HG12 VAL 17 HG12 VAL 17 8.382 -2.777 0.783 154 HG13 VAL 17 HG13 VAL 17 8.161 -4.494 0.382 155 HG21 VAL 17 HG21 VAL 17 6.332 -5.148 -1.170 156 HG22 VAL 17 HG22 VAL 17 4.971 -4.064 -1.487 157 HG23 VAL 17 HG23 VAL 17 6.540 -3.758 -2.253 158 H GLU 18 H GLU 18 5.808 -1.196 2.201 159 HA GLU 18 HA GLU 18 7.763 -1.823 4.227 160 HB2 GLU 18 HB2 GLU 18 5.636 0.348 4.096 161 HB3 GLU 18 HB3 GLU 18 6.766 0.199 5.434 162 HG2 GLU 18 HG2 GLU 18 7.495 0.688 2.527 163 HG3 GLU 18 HG3 GLU 18 7.467 1.883 3.831 164 H ASP 19 H ASP 19 4.181 -1.566 4.544 165 HA ASP 19 HA ASP 19 4.099 -2.371 7.241 166 HB2 ASP 19 HB2 ASP 19 2.246 -1.262 6.415 167 HB3 ASP 19 HB3 ASP 19 2.093 -2.340 5.026 168 H VAL 20 H VAL 20 3.756 -4.530 4.406 169 HA VAL 20 HA VAL 20 3.344 -6.879 5.921 170 HB VAL 20 HB VAL 20 2.929 -6.451 3.434 171 HG11 VAL 20 HG11 VAL 20 5.334 -6.028 2.834 172 HG12 VAL 20 HG12 VAL 20 5.651 -7.755 3.110 173 HG13 VAL 20 HG13 VAL 20 4.507 -7.240 1.852 174 HG21 VAL 20 HG21 VAL 20 2.320 -8.500 4.553 175 HG22 VAL 20 HG22 VAL 20 2.972 -8.851 2.948 176 HG23 VAL 20 HG23 VAL 20 3.981 -9.135 4.385 177 H ARG 21 H ARG 21 6.411 -5.408 4.849 178 HA ARG 21 HA ARG 21 8.107 -7.523 5.930 179 HB2 ARG 21 HB2 ARG 21 8.623 -4.618 5.163 180 HB3 ARG 21 HB3 ARG 21 9.877 -5.702 5.777 181 HG2 ARG 21 HG2 ARG 21 9.616 -7.223 3.899 182 HG3 ARG 21 HG3 ARG 21 8.199 -6.345 3.313 183 HD2 ARG 21 HD2 ARG 21 10.091 -5.723 1.948 184 HD3 ARG 21 HD3 ARG 21 9.582 -4.342 2.901 185 HE ARG 21 HE ARG 21 11.565 -4.376 4.113 186 HH11 ARG 21 HH11 ARG 21 11.552 -7.252 2.091 187 HH12 ARG 21 HH12 ARG 21 13.249 -7.533 2.345 188 HH21 ARG 21 HH21 ARG 21 13.722 -4.827 4.403 189 HH22 ARG 21 HH22 ARG 21 14.434 -6.196 3.612 190 H LEU 22 H LEU 22 6.974 -4.388 7.223 191 HA LEU 22 HA LEU 22 8.335 -4.530 9.723 192 HB2 LEU 22 HB2 LEU 22 5.800 -3.126 8.817 193 HB3 LEU 22 HB3 LEU 22 6.413 -2.944 10.459 194 HG LEU 22 HG LEU 22 8.213 -2.414 8.094 195 HD11 LEU 22 HD11 LEU 22 6.180 -0.990 7.793 196 HD12 LEU 22 HD12 LEU 22 6.417 -0.344 9.431 197 HD13 LEU 22 HD13 LEU 22 7.620 -0.041 8.149 198 HD21 LEU 22 HD21 LEU 22 9.350 -0.908 9.663 199 HD22 LEU 22 HD22 LEU 22 8.171 -1.310 10.932 200 HD23 LEU 22 HD23 LEU 22 9.279 -2.556 10.307 201 H ILE 23 H ILE 23 4.920 -5.545 8.990 202 HA ILE 23 HA ILE 23 4.490 -6.436 11.651 203 HB ILE 23 HB ILE 23 2.785 -5.805 9.978 204 HG12 ILE 23 HG12 ILE 23 2.240 -6.848 12.157 205 HG13 ILE 23 HG13 ILE 23 1.057 -7.014 10.891 206 HG21 ILE 23 HG21 ILE 23 2.931 -8.659 8.910 207 HG22 ILE 23 HG22 ILE 23 1.783 -7.360 8.472 208 HG23 ILE 23 HG23 ILE 23 3.490 -7.207 8.072 209 HD11 ILE 23 HD11 ILE 23 2.865 -9.270 11.858 210 HD12 ILE 23 HD12 ILE 23 1.178 -9.026 12.268 211 HD13 ILE 23 HD13 ILE 23 1.619 -9.403 10.599 212 H ARG 24 H ARG 24 5.581 -8.363 8.788 213 HA ARG 24 HA ARG 24 5.745 -10.847 10.275 214 HB2 ARG 24 HB2 ARG 24 7.205 -9.874 7.783 215 HB3 ARG 24 HB3 ARG 24 7.353 -11.507 8.412 216 HG2 ARG 24 HG2 ARG 24 4.755 -10.238 7.452 217 HG3 ARG 24 HG3 ARG 24 5.760 -11.361 6.537 218 HD2 ARG 24 HD2 ARG 24 4.274 -11.980 9.114 219 HD3 ARG 24 HD3 ARG 24 3.803 -12.470 7.481 220 HE ARG 24 HE ARG 24 6.198 -13.597 7.505 221 HH11 ARG 24 HH11 ARG 24 3.730 -13.763 10.034 222 HH12 ARG 24 HH12 ARG 24 4.470 -15.176 10.731 223 HH21 ARG 24 HH21 ARG 24 6.995 -15.456 8.431 224 HH22 ARG 24 HH22 ARG 24 6.153 -16.185 9.765 225 H GLU 25 H GLU 25 8.064 -8.173 10.001 226 HA GLU 25 HA GLU 25 10.146 -9.561 11.444 227 HB2 GLU 25 HB2 GLU 25 10.668 -7.674 10.014 228 HB3 GLU 25 HB3 GLU 25 9.623 -6.619 10.953 229 HG2 GLU 25 HG2 GLU 25 11.881 -6.123 11.498 230 HG3 GLU 25 HG3 GLU 25 11.099 -6.803 12.911 231 H GLN 26 H GLN 26 7.654 -7.171 12.578 232 HA GLN 26 HA GLN 26 8.599 -7.410 15.299 233 HB2 GLN 26 HB2 GLN 26 6.798 -6.011 15.959 234 HB3 GLN 26 HB3 GLN 26 7.678 -5.323 14.611 235 HG2 GLN 26 HG2 GLN 26 5.880 -5.395 13.178 236 HG3 GLN 26 HG3 GLN 26 5.173 -6.835 13.932 237 HE21 GLN 26 HE21 GLN 26 2.772 -4.409 15.076 238 HE22 GLN 26 HE22 GLN 26 3.037 -5.587 13.785 239 H HIS 27 H HIS 27 5.990 -9.100 13.588 240 HA HIS 27 HA HIS 27 5.631 -10.871 15.980 241 HB2 HIS 27 HB2 HIS 27 3.339 -9.647 14.383 242 HB3 HIS 27 HB3 HIS 27 3.184 -10.813 15.698 243 HD1 HIS 27 HD1 HIS 27 4.912 -9.435 17.969 244 HD2 HIS 27 HD2 HIS 27 2.124 -7.593 15.389 245 HE1 HIS 27 HE1 HIS 27 4.022 -7.371 19.217 246 HE2 HIS 27 HE2 HIS 27 2.351 -6.229 17.623 247 HA PRO 28 HA PRO 28 6.220 -13.325 12.100 248 HB2 PRO 28 HB2 PRO 28 7.713 -15.159 13.923 249 HB3 PRO 28 HB3 PRO 28 8.136 -14.553 12.285 250 HG2 PRO 28 HG2 PRO 28 9.350 -13.576 14.545 251 HG3 PRO 28 HG3 PRO 28 8.968 -12.531 13.147 252 HD2 PRO 28 HD2 PRO 28 7.441 -12.844 15.733 253 HD3 PRO 28 HD3 PRO 28 7.843 -11.359 14.816 254 H THR 29 H THR 29 4.858 -14.134 15.234 255 HA THR 29 HA THR 29 3.531 -16.586 14.388 256 HB THR 29 HB THR 29 2.350 -16.511 16.428 257 HG1 THR 29 HG1 THR 29 2.377 -14.642 17.732 258 HG21 THR 29 HG21 THR 29 5.061 -15.268 17.108 259 HG22 THR 29 HG22 THR 29 4.073 -16.350 18.105 260 HG23 THR 29 HG23 THR 29 4.837 -16.969 16.630 261 H LYS 30 H LYS 30 2.902 -13.314 13.555 262 HA LYS 30 HA LYS 30 0.043 -13.935 12.999 263 HB2 LYS 30 HB2 LYS 30 1.390 -11.276 13.571 264 HB3 LYS 30 HB3 LYS 30 -0.252 -11.422 12.914 265 HG2 LYS 30 HG2 LYS 30 -0.962 -12.770 14.832 266 HG3 LYS 30 HG3 LYS 30 0.670 -12.722 15.513 267 HD2 LYS 30 HD2 LYS 30 0.489 -10.278 15.830 268 HD3 LYS 30 HD3 LYS 30 -1.145 -10.294 15.124 269 HE2 LYS 30 HE2 LYS 30 -1.935 -11.828 16.894 270 HE3 LYS 30 HE3 LYS 30 -0.295 -11.943 17.555 271 HZ1 LYS 30 HZ1 LYS 30 -1.580 -10.402 18.857 272 HZ2 LYS 30 HZ2 LYS 30 -0.448 -9.520 18.072 273 HZ3 LYS 30 HZ3 LYS 30 -2.024 -9.502 17.577 274 H ILE 31 H ILE 31 -0.954 -13.362 11.200 275 HA ILE 31 HA ILE 31 0.727 -13.533 8.753 276 HB ILE 31 HB ILE 31 -2.026 -14.614 9.442 277 HG12 ILE 31 HG12 ILE 31 -0.324 -15.852 10.647 278 HG13 ILE 31 HG13 ILE 31 -0.997 -16.826 9.358 279 HG21 ILE 31 HG21 ILE 31 -0.396 -14.841 6.897 280 HG22 ILE 31 HG22 ILE 31 -1.782 -15.893 7.306 281 HG23 ILE 31 HG23 ILE 31 -2.026 -14.163 7.089 282 HD11 ILE 31 HD11 ILE 31 1.731 -15.467 9.282 283 HD12 ILE 31 HD12 ILE 31 1.405 -17.184 9.522 284 HD13 ILE 31 HD13 ILE 31 1.029 -16.438 7.967 285 HA PRO 32 HA PRO 32 -1.460 -9.746 7.546 286 HB2 PRO 32 HB2 PRO 32 -0.050 -9.117 5.308 287 HB3 PRO 32 HB3 PRO 32 0.667 -9.033 6.943 288 HG2 PRO 32 HG2 PRO 32 0.904 -11.272 4.905 289 HG3 PRO 32 HG3 PRO 32 2.213 -10.486 5.841 290 HD2 PRO 32 HD2 PRO 32 1.042 -12.837 6.606 291 HD3 PRO 32 HD3 PRO 32 1.676 -11.640 7.780 292 H VAL 33 H VAL 33 -3.478 -9.655 6.640 293 HA VAL 33 HA VAL 33 -3.981 -11.139 4.109 294 HB VAL 33 HB VAL 33 -5.978 -11.098 6.339 295 HG11 VAL 33 HG11 VAL 33 -6.879 -13.093 5.120 296 HG12 VAL 33 HG12 VAL 33 -6.924 -11.628 4.158 297 HG13 VAL 33 HG13 VAL 33 -5.662 -12.846 3.863 298 HG21 VAL 33 HG21 VAL 33 -3.892 -13.245 5.845 299 HG22 VAL 33 HG22 VAL 33 -4.121 -12.281 7.319 300 HG23 VAL 33 HG23 VAL 33 -5.342 -13.464 6.844 301 H ILE 34 H ILE 34 -5.152 -10.250 2.580 302 HA ILE 34 HA ILE 34 -6.494 -7.613 3.041 303 HB ILE 34 HB ILE 34 -5.883 -9.076 0.445 304 HG12 ILE 34 HG12 ILE 34 -3.793 -8.356 1.354 305 HG13 ILE 34 HG13 ILE 34 -4.209 -7.357 -0.021 306 HG21 ILE 34 HG21 ILE 34 -7.035 -6.290 0.941 307 HG22 ILE 34 HG22 ILE 34 -6.466 -6.897 -0.628 308 HG23 ILE 34 HG23 ILE 34 -7.839 -7.666 0.151 309 HD11 ILE 34 HD11 ILE 34 -3.204 -6.009 1.751 310 HD12 ILE 34 HD12 ILE 34 -4.883 -5.503 1.508 311 HD13 ILE 34 HD13 ILE 34 -4.441 -6.518 2.908 312 H ILE 35 H ILE 35 -8.699 -7.452 2.908 313 HA ILE 35 HA ILE 35 -10.247 -9.730 1.828 314 HB ILE 35 HB ILE 35 -10.531 -10.119 4.125 315 HG12 ILE 35 HG12 ILE 35 -13.010 -8.575 3.197 316 HG13 ILE 35 HG13 ILE 35 -12.540 -10.157 2.569 317 HG21 ILE 35 HG21 ILE 35 -9.832 -7.974 5.089 318 HG22 ILE 35 HG22 ILE 35 -11.277 -7.169 4.426 319 HG23 ILE 35 HG23 ILE 35 -11.435 -8.374 5.696 320 HD11 ILE 35 HD11 ILE 35 -12.744 -11.134 4.844 321 HD12 ILE 35 HD12 ILE 35 -13.316 -9.561 5.456 322 HD13 ILE 35 HD13 ILE 35 -14.259 -10.434 4.243 323 H GLU 36 H GLU 36 -11.599 -9.116 0.266 324 HA GLU 36 HA GLU 36 -12.631 -6.294 0.265 325 HB2 GLU 36 HB2 GLU 36 -10.523 -6.684 -1.155 326 HB3 GLU 36 HB3 GLU 36 -11.538 -7.699 -2.196 327 HG2 GLU 36 HG2 GLU 36 -13.048 -5.744 -2.548 328 HG3 GLU 36 HG3 GLU 36 -12.052 -4.778 -1.469 329 H ARG 37 H ARG 37 -14.733 -6.022 -0.488 330 HA ARG 37 HA ARG 37 -16.460 -8.309 -0.975 331 HB2 ARG 37 HB2 ARG 37 -17.355 -6.195 -0.184 332 HB3 ARG 37 HB3 ARG 37 -16.712 -5.340 -1.588 333 HG2 ARG 37 HG2 ARG 37 -18.276 -6.649 -3.069 334 HG3 ARG 37 HG3 ARG 37 -18.896 -7.477 -1.634 335 HD2 ARG 37 HD2 ARG 37 -20.396 -5.686 -2.270 336 HD3 ARG 37 HD3 ARG 37 -19.635 -5.312 -0.716 337 HE ARG 37 HE ARG 37 -18.177 -4.146 -2.967 338 HH11 ARG 37 HH11 ARG 37 -18.032 -1.829 -2.970 339 HH12 ARG 37 HH12 ARG 37 -19.333 -0.964 -2.145 340 HH21 ARG 37 HH21 ARG 37 -21.105 -3.543 -1.097 341 HH22 ARG 37 HH22 ARG 37 -20.770 -1.793 -1.106 342 H TYR 38 H TYR 38 -16.837 -9.428 -2.877 343 HA TYR 38 HA TYR 38 -14.914 -9.312 -4.873 344 HB2 TYR 38 HB2 TYR 38 -15.857 -11.372 -4.556 345 HB3 TYR 38 HB3 TYR 38 -17.496 -10.747 -4.705 346 HD1 TYR 38 HD1 TYR 38 -18.627 -11.731 -6.488 347 HD2 TYR 38 HD2 TYR 38 -14.448 -10.701 -6.964 348 HE1 TYR 38 HE1 TYR 38 -18.756 -12.301 -8.891 349 HE2 TYR 38 HE2 TYR 38 -14.596 -11.276 -9.378 350 HH TYR 38 HH TYR 38 -17.584 -12.530 -10.887 351 H LYS 39 H LYS 39 -14.406 -8.188 -6.570 352 HA LYS 39 HA LYS 39 -15.591 -5.788 -7.189 353 HB2 LYS 39 HB2 LYS 39 -14.096 -5.672 -9.093 354 HB3 LYS 39 HB3 LYS 39 -13.283 -6.364 -7.700 355 HG2 LYS 39 HG2 LYS 39 -13.622 -8.666 -8.683 356 HG3 LYS 39 HG3 LYS 39 -14.330 -7.919 -10.117 357 HD2 LYS 39 HD2 LYS 39 -11.491 -7.441 -9.108 358 HD3 LYS 39 HD3 LYS 39 -11.947 -8.574 -10.387 359 HE2 LYS 39 HE2 LYS 39 -12.901 -6.663 -11.710 360 HE3 LYS 39 HE3 LYS 39 -12.330 -5.543 -10.467 361 HZ1 LYS 39 HZ1 LYS 39 -10.040 -6.294 -10.935 362 HZ2 LYS 39 HZ2 LYS 39 -10.576 -7.318 -12.095 363 HZ3 LYS 39 HZ3 LYS 39 -10.733 -5.709 -12.292 364 H GLY 40 H GLY 40 -16.430 -8.862 -8.692 365 HA2 GLY 40 HA2 GLY 40 -18.026 -7.680 -10.849 366 HA3 GLY 40 HA3 GLY 40 -17.817 -9.391 -10.472 367 H GLU 41 H GLU 41 -18.735 -8.182 -7.533 368 HA GLU 41 HA GLU 41 -21.649 -8.130 -8.064 369 HB2 GLU 41 HB2 GLU 41 -20.954 -10.531 -7.964 370 HB3 GLU 41 HB3 GLU 41 -20.374 -10.266 -6.324 371 HG2 GLU 41 HG2 GLU 41 -23.102 -9.238 -6.585 372 HG3 GLU 41 HG3 GLU 41 -23.040 -10.841 -7.283 373 H LYS 42 H LYS 42 -20.971 -5.920 -7.344 374 HA LYS 42 HA LYS 42 -20.357 -5.440 -4.556 375 HB2 LYS 42 HB2 LYS 42 -21.278 -3.559 -6.761 376 HB3 LYS 42 HB3 LYS 42 -20.688 -3.048 -5.174 377 HG2 LYS 42 HG2 LYS 42 -18.497 -4.076 -5.593 378 HG3 LYS 42 HG3 LYS 42 -19.036 -4.638 -7.186 379 HD2 LYS 42 HD2 LYS 42 -19.426 -2.307 -7.898 380 HD3 LYS 42 HD3 LYS 42 -18.887 -1.719 -6.312 381 HE2 LYS 42 HE2 LYS 42 -16.638 -2.668 -6.680 382 HE3 LYS 42 HE3 LYS 42 -17.168 -3.391 -8.208 383 HZ1 LYS 42 HZ1 LYS 42 -17.060 -0.457 -7.670 384 HZ2 LYS 42 HZ2 LYS 42 -15.986 -1.283 -8.577 385 HZ3 LYS 42 HZ3 LYS 42 -17.529 -1.139 -9.082 386 H GLN 43 H GLN 43 -22.774 -7.028 -4.897 387 HA GLN 43 HA GLN 43 -25.124 -5.386 -4.306 388 HB2 GLN 43 HB2 GLN 43 -24.639 -8.385 -4.256 389 HB3 GLN 43 HB3 GLN 43 -26.207 -7.625 -3.955 390 HG2 GLN 43 HG2 GLN 43 -26.095 -6.558 -6.222 391 HG3 GLN 43 HG3 GLN 43 -24.622 -7.472 -6.552 392 HE21 GLN 43 HE21 GLN 43 -26.679 -10.651 -6.394 393 HE22 GLN 43 HE22 GLN 43 -25.275 -10.073 -5.497 394 H LEU 44 H LEU 44 -23.084 -7.618 -2.341 395 HA LEU 44 HA LEU 44 -24.414 -7.065 0.162 396 HB2 LEU 44 HB2 LEU 44 -21.561 -7.982 -0.435 397 HB3 LEU 44 HB3 LEU 44 -22.297 -8.003 1.157 398 HG LEU 44 HG LEU 44 -23.205 -9.678 -1.228 399 HD11 LEU 44 HD11 LEU 44 -22.324 -11.548 0.131 400 HD12 LEU 44 HD12 LEU 44 -21.046 -10.385 -0.276 401 HD13 LEU 44 HD13 LEU 44 -21.751 -10.395 1.355 402 HD21 LEU 44 HD21 LEU 44 -24.593 -10.878 0.452 403 HD22 LEU 44 HD22 LEU 44 -24.165 -9.658 1.670 404 HD23 LEU 44 HD23 LEU 44 -25.126 -9.211 0.238 405 HA PRO 45 HA PRO 45 -22.407 -3.120 1.187 406 HB2 PRO 45 HB2 PRO 45 -22.463 -3.100 3.901 407 HB3 PRO 45 HB3 PRO 45 -23.964 -2.996 2.928 408 HG2 PRO 45 HG2 PRO 45 -22.749 -5.482 4.192 409 HG3 PRO 45 HG3 PRO 45 -24.432 -4.886 4.327 410 HD2 PRO 45 HD2 PRO 45 -23.696 -6.781 2.507 411 HD3 PRO 45 HD3 PRO 45 -24.945 -5.554 2.129 412 H VAL 46 H VAL 46 -20.384 -2.316 2.145 413 HA VAL 46 HA VAL 46 -18.550 -4.328 3.263 414 HB VAL 46 HB VAL 46 -17.905 -4.122 0.917 415 HG11 VAL 46 HG11 VAL 46 -16.768 -2.177 0.065 416 HG12 VAL 46 HG12 VAL 46 -18.392 -1.699 0.571 417 HG13 VAL 46 HG13 VAL 46 -16.990 -1.317 1.594 418 HG21 VAL 46 HG21 VAL 46 -15.513 -3.890 1.307 419 HG22 VAL 46 HG22 VAL 46 -15.798 -3.025 2.831 420 HG23 VAL 46 HG23 VAL 46 -16.237 -4.737 2.682 421 H LEU 47 H LEU 47 -17.342 -3.777 4.910 422 HA LEU 47 HA LEU 47 -17.953 -1.140 6.178 423 HB2 LEU 47 HB2 LEU 47 -18.091 -3.918 7.440 424 HB3 LEU 47 HB3 LEU 47 -18.276 -2.390 8.283 425 HG LEU 47 HG LEU 47 -20.218 -2.017 6.432 426 HD11 LEU 47 HD11 LEU 47 -20.224 -5.033 6.968 427 HD12 LEU 47 HD12 LEU 47 -21.520 -4.103 6.182 428 HD13 LEU 47 HD13 LEU 47 -19.959 -4.280 5.385 429 HD21 LEU 47 HD21 LEU 47 -21.809 -2.787 8.153 430 HD22 LEU 47 HD22 LEU 47 -20.480 -3.612 9.012 431 HD23 LEU 47 HD23 LEU 47 -20.496 -1.842 8.859 432 H ASP 48 H ASP 48 -16.641 -1.168 8.406 433 HA ASP 48 HA ASP 48 -14.030 -0.602 7.521 434 HB2 ASP 48 HB2 ASP 48 -13.610 0.137 9.901 435 HB3 ASP 48 HB3 ASP 48 -14.887 0.910 8.974 436 H LYS 49 H LYS 49 -14.891 -3.660 8.236 437 HA LYS 49 HA LYS 49 -12.250 -4.495 9.330 438 HB2 LYS 49 HB2 LYS 49 -14.812 -5.986 8.655 439 HB3 LYS 49 HB3 LYS 49 -13.295 -6.848 8.820 440 HG2 LYS 49 HG2 LYS 49 -14.339 -7.031 10.867 441 HG3 LYS 49 HG3 LYS 49 -12.953 -5.989 11.084 442 HD2 LYS 49 HD2 LYS 49 -15.559 -4.571 10.583 443 HD3 LYS 49 HD3 LYS 49 -15.472 -5.519 12.068 444 HE2 LYS 49 HE2 LYS 49 -13.368 -4.382 12.711 445 HE3 LYS 49 HE3 LYS 49 -13.489 -3.346 11.279 446 HZ1 LYS 49 HZ1 LYS 49 -14.408 -2.290 13.296 447 HZ2 LYS 49 HZ2 LYS 49 -15.556 -2.454 12.133 448 HZ3 LYS 49 HZ3 LYS 49 -15.538 -3.466 13.446 449 H THR 50 H THR 50 -12.137 -2.976 6.935 450 HA THR 50 HA THR 50 -12.068 -4.578 4.619 451 HB THR 50 HB THR 50 -10.582 -2.033 4.490 452 HG1 THR 50 HG1 THR 50 -13.373 -2.041 5.040 453 HG21 THR 50 HG21 THR 50 -12.110 -1.596 2.619 454 HG22 THR 50 HG22 THR 50 -11.320 -3.173 2.425 455 HG23 THR 50 HG23 THR 50 -13.006 -3.089 2.974 456 H LYS 51 H LYS 51 -9.930 -5.104 6.832 457 HA LYS 51 HA LYS 51 -7.886 -6.389 5.241 458 HB2 LYS 51 HB2 LYS 51 -7.186 -3.970 5.094 459 HB3 LYS 51 HB3 LYS 51 -7.195 -3.868 6.847 460 HG2 LYS 51 HG2 LYS 51 -5.337 -5.559 6.924 461 HG3 LYS 51 HG3 LYS 51 -5.351 -5.614 5.147 462 HD2 LYS 51 HD2 LYS 51 -4.839 -3.170 5.094 463 HD3 LYS 51 HD3 LYS 51 -4.831 -3.141 6.872 464 HE2 LYS 51 HE2 LYS 51 -2.982 -4.875 6.827 465 HE3 LYS 51 HE3 LYS 51 -2.959 -4.735 5.059 466 HZ1 LYS 51 HZ1 LYS 51 -2.376 -2.346 5.352 467 HZ2 LYS 51 HZ2 LYS 51 -2.349 -2.534 6.997 468 HZ3 LYS 51 HZ3 LYS 51 -1.265 -3.312 6.080 469 H PHE 52 H PHE 52 -6.529 -7.739 6.779 470 HA PHE 52 HA PHE 52 -6.790 -7.180 9.579 471 HB2 PHE 52 HB2 PHE 52 -7.651 -9.442 10.300 472 HB3 PHE 52 HB3 PHE 52 -8.789 -8.262 9.722 473 HD1 PHE 52 HD1 PHE 52 -10.329 -8.791 7.993 474 HD2 PHE 52 HD2 PHE 52 -6.883 -11.268 8.687 475 HE1 PHE 52 HE1 PHE 52 -11.264 -10.537 6.499 476 HE2 PHE 52 HE2 PHE 52 -7.815 -13.007 7.196 477 HZ PHE 52 HZ PHE 52 -10.007 -12.632 6.058 478 H LEU 53 H LEU 53 -5.622 -8.553 11.105 479 HA LEU 53 HA LEU 53 -3.351 -10.043 9.872 480 HB2 LEU 53 HB2 LEU 53 -3.397 -8.630 12.566 481 HB3 LEU 53 HB3 LEU 53 -2.057 -9.550 11.902 482 HG LEU 53 HG LEU 53 -3.114 -6.914 10.790 483 HD11 LEU 53 HD11 LEU 53 -0.922 -6.069 11.673 484 HD12 LEU 53 HD12 LEU 53 -2.023 -6.637 12.936 485 HD13 LEU 53 HD13 LEU 53 -0.651 -7.640 12.454 486 HD21 LEU 53 HD21 LEU 53 -2.166 -8.184 8.977 487 HD22 LEU 53 HD22 LEU 53 -1.004 -6.940 9.447 488 HD23 LEU 53 HD23 LEU 53 -0.742 -8.627 9.957 489 H VAL 54 H VAL 54 -3.079 -12.149 10.678 490 HA VAL 54 HA VAL 54 -5.018 -12.998 12.798 491 HB VAL 54 HB VAL 54 -4.386 -14.832 10.517 492 HG11 VAL 54 HG11 VAL 54 -6.808 -14.588 12.355 493 HG12 VAL 54 HG12 VAL 54 -6.528 -15.847 11.139 494 HG13 VAL 54 HG13 VAL 54 -5.468 -15.742 12.560 495 HG21 VAL 54 HG21 VAL 54 -6.499 -14.189 9.418 496 HG22 VAL 54 HG22 VAL 54 -6.652 -12.817 10.540 497 HG23 VAL 54 HG23 VAL 54 -5.295 -12.896 9.378 498 HA PRO 55 HA PRO 55 -1.392 -15.035 14.540 499 HB2 PRO 55 HB2 PRO 55 -2.549 -16.316 16.668 500 HB3 PRO 55 HB3 PRO 55 -2.169 -14.569 16.656 501 HG2 PRO 55 HG2 PRO 55 -4.822 -15.903 16.103 502 HG3 PRO 55 HG3 PRO 55 -4.490 -14.469 17.116 503 HD2 PRO 55 HD2 PRO 55 -5.409 -14.285 14.549 504 HD3 PRO 55 HD3 PRO 55 -4.301 -13.064 15.252 505 H ASP 56 H ASP 56 -0.489 -16.976 14.131 506 HA ASP 56 HA ASP 56 -1.542 -18.508 12.110 507 HB2 ASP 56 HB2 ASP 56 0.336 -20.105 12.539 508 HB3 ASP 56 HB3 ASP 56 0.741 -18.407 12.309 509 H HIS 57 H HIS 57 -2.160 -19.189 15.453 510 HA HIS 57 HA HIS 57 -3.012 -21.910 15.205 511 HB2 HIS 57 HB2 HIS 57 -3.957 -19.778 17.174 512 HB3 HIS 57 HB3 HIS 57 -4.084 -21.516 17.394 513 HD1 HIS 57 HD1 HIS 57 -1.288 -22.646 17.049 514 HD2 HIS 57 HD2 HIS 57 -2.176 -18.925 18.843 515 HE1 HIS 57 HE1 HIS 57 0.684 -22.103 18.615 516 HE2 HIS 57 HE2 HIS 57 0.139 -19.831 19.694 517 H VAL 58 H VAL 58 -4.661 -19.064 14.060 518 HA VAL 58 HA VAL 58 -7.388 -20.056 14.392 519 HB VAL 58 HB VAL 58 -6.274 -17.875 12.621 520 HG11 VAL 58 HG11 VAL 58 -8.444 -18.581 11.705 521 HG12 VAL 58 HG12 VAL 58 -9.176 -18.497 13.329 522 HG13 VAL 58 HG13 VAL 58 -8.612 -17.022 12.519 523 HG21 VAL 58 HG21 VAL 58 -6.020 -17.456 15.056 524 HG22 VAL 58 HG22 VAL 58 -7.214 -16.361 14.345 525 HG23 VAL 58 HG23 VAL 58 -7.749 -17.760 15.294 526 H ASN 59 H ASN 59 -8.575 -21.363 13.062 527 HA ASN 59 HA ASN 59 -7.378 -22.360 10.519 528 HB2 ASN 59 HB2 ASN 59 -9.738 -23.327 12.180 529 HB3 ASN 59 HB3 ASN 59 -9.178 -24.085 10.695 530 HD21 ASN 59 HD21 ASN 59 -7.700 -25.816 13.719 531 HD22 ASN 59 HD22 ASN 59 -9.346 -25.328 13.337 532 H MET 60 H MET 60 -8.709 -22.464 8.553 533 HA MET 60 HA MET 60 -9.851 -19.981 7.920 534 HB2 MET 60 HB2 MET 60 -10.039 -22.693 6.591 535 HB3 MET 60 HB3 MET 60 -10.984 -21.351 5.961 536 HG2 MET 60 HG2 MET 60 -7.981 -21.497 6.214 537 HG3 MET 60 HG3 MET 60 -8.943 -21.504 4.734 538 HE1 MET 60 HE1 MET 60 -11.057 -18.924 5.876 539 HE2 MET 60 HE2 MET 60 -10.325 -17.688 4.841 540 HE3 MET 60 HE3 MET 60 -10.633 -19.318 4.194 541 H SER 61 H SER 61 -11.767 -22.899 8.822 542 HA SER 61 HA SER 61 -14.317 -21.712 8.518 543 HB2 SER 61 HB2 SER 61 -14.003 -24.085 8.887 544 HB3 SER 61 HB3 SER 61 -13.360 -23.793 10.513 545 HG SER 61 HG SER 61 -15.608 -24.394 10.507 546 H GLU 62 H GLU 62 -12.089 -21.483 11.335 547 HA GLU 62 HA GLU 62 -13.942 -19.986 12.975 548 HB2 GLU 62 HB2 GLU 62 -12.082 -21.273 13.950 549 HB3 GLU 62 HB3 GLU 62 -10.920 -20.271 13.094 550 HG2 GLU 62 HG2 GLU 62 -10.956 -19.565 15.360 551 HG3 GLU 62 HG3 GLU 62 -11.647 -18.276 14.389 552 H LEU 63 H LEU 63 -11.241 -18.967 10.819 553 HA LEU 63 HA LEU 63 -11.501 -16.150 11.235 554 HB2 LEU 63 HB2 LEU 63 -9.576 -17.193 10.099 555 HB3 LEU 63 HB3 LEU 63 -10.622 -17.735 8.789 556 HG LEU 63 HG LEU 63 -11.093 -15.314 8.228 557 HD11 LEU 63 HD11 LEU 63 -10.544 -14.309 10.436 558 HD12 LEU 63 HD12 LEU 63 -8.847 -14.806 10.242 559 HD13 LEU 63 HD13 LEU 63 -9.574 -13.601 9.151 560 HD21 LEU 63 HD21 LEU 63 -8.143 -16.046 8.221 561 HD22 LEU 63 HD22 LEU 63 -9.355 -16.689 7.083 562 HD23 LEU 63 HD23 LEU 63 -9.001 -14.961 7.092 563 H ILE 64 H ILE 64 -13.105 -18.283 8.875 564 HA ILE 64 HA ILE 64 -14.722 -16.340 7.535 565 HB ILE 64 HB ILE 64 -14.946 -19.312 8.066 566 HG12 ILE 64 HG12 ILE 64 -14.556 -17.801 5.470 567 HG13 ILE 64 HG13 ILE 64 -13.224 -18.294 6.490 568 HG21 ILE 64 HG21 ILE 64 -16.824 -19.477 6.493 569 HG22 ILE 64 HG22 ILE 64 -17.281 -18.592 7.936 570 HG23 ILE 64 HG23 ILE 64 -16.947 -17.701 6.431 571 HD11 ILE 64 HD11 ILE 64 -13.401 -19.901 4.769 572 HD12 ILE 64 HD12 ILE 64 -14.023 -20.689 6.234 573 HD13 ILE 64 HD13 ILE 64 -15.147 -20.070 4.986 574 H LYS 65 H LYS 65 -15.409 -18.212 10.520 575 HA LYS 65 HA LYS 65 -18.018 -17.150 10.908 576 HB2 LYS 65 HB2 LYS 65 -16.937 -19.219 11.927 577 HB3 LYS 65 HB3 LYS 65 -16.134 -18.151 13.091 578 HG2 LYS 65 HG2 LYS 65 -18.372 -17.333 13.836 579 HG3 LYS 65 HG3 LYS 65 -19.140 -18.385 12.625 580 HD2 LYS 65 HD2 LYS 65 -18.171 -20.378 13.746 581 HD3 LYS 65 HD3 LYS 65 -17.408 -19.335 14.960 582 HE2 LYS 65 HE2 LYS 65 -19.657 -18.504 15.654 583 HE3 LYS 65 HE3 LYS 65 -20.417 -19.555 14.446 584 HZ1 LYS 65 HZ1 LYS 65 -20.426 -20.602 16.646 585 HZ2 LYS 65 HZ2 LYS 65 -19.489 -21.486 15.647 586 HZ3 LYS 65 HZ3 LYS 65 -18.800 -20.513 16.768 587 H ILE 66 H ILE 66 -14.888 -15.931 12.276 588 HA ILE 66 HA ILE 66 -16.205 -13.768 13.674 589 HB ILE 66 HB ILE 66 -14.113 -14.409 14.469 590 HG12 ILE 66 HG12 ILE 66 -14.738 -11.955 14.594 591 HG13 ILE 66 HG13 ILE 66 -13.104 -12.428 14.958 592 HG21 ILE 66 HG21 ILE 66 -12.835 -13.677 11.810 593 HG22 ILE 66 HG22 ILE 66 -11.952 -14.018 13.316 594 HG23 ILE 66 HG23 ILE 66 -12.950 -15.266 12.581 595 HD11 ILE 66 HD11 ILE 66 -13.028 -10.338 13.760 596 HD12 ILE 66 HD12 ILE 66 -12.316 -11.580 12.749 597 HD13 ILE 66 HD13 ILE 66 -13.956 -10.995 12.409 598 H ILE 67 H ILE 67 -14.789 -13.856 10.357 599 HA ILE 67 HA ILE 67 -15.437 -11.098 9.800 600 HB ILE 67 HB ILE 67 -14.777 -13.494 8.121 601 HG12 ILE 67 HG12 ILE 67 -13.040 -12.026 7.235 602 HG13 ILE 67 HG13 ILE 67 -13.707 -10.636 8.083 603 HG21 ILE 67 HG21 ILE 67 -16.601 -12.508 6.799 604 HG22 ILE 67 HG22 ILE 67 -15.870 -10.894 6.943 605 HG23 ILE 67 HG23 ILE 67 -15.054 -12.175 6.027 606 HD11 ILE 67 HD11 ILE 67 -12.398 -13.056 9.371 607 HD12 ILE 67 HD12 ILE 67 -11.678 -11.454 9.156 608 HD13 ILE 67 HD13 ILE 67 -13.051 -11.641 10.246 609 H ARG 68 H ARG 68 -17.421 -14.067 9.280 610 HA ARG 68 HA ARG 68 -19.677 -12.759 8.161 611 HB2 ARG 68 HB2 ARG 68 -19.121 -15.254 8.376 612 HB3 ARG 68 HB3 ARG 68 -19.799 -15.202 9.992 613 HG2 ARG 68 HG2 ARG 68 -21.248 -14.518 7.390 614 HG3 ARG 68 HG3 ARG 68 -21.299 -16.081 8.185 615 HD2 ARG 68 HD2 ARG 68 -22.522 -13.491 9.145 616 HD3 ARG 68 HD3 ARG 68 -23.353 -14.931 8.592 617 HE ARG 68 HE ARG 68 -22.154 -16.068 10.624 618 HH11 ARG 68 HH11 ARG 68 -23.718 -12.922 10.651 619 HH12 ARG 68 HH12 ARG 68 -24.042 -12.994 12.365 620 HH21 ARG 68 HH21 ARG 68 -22.591 -16.094 12.806 621 HH22 ARG 68 HH22 ARG 68 -23.443 -14.775 13.544 622 H ARG 69 H ARG 69 -18.930 -13.333 11.625 623 HA ARG 69 HA ARG 69 -21.315 -12.001 12.612 624 HB2 ARG 69 HB2 ARG 69 -20.076 -13.714 13.861 625 HB3 ARG 69 HB3 ARG 69 -18.674 -12.639 13.996 626 HG2 ARG 69 HG2 ARG 69 -19.950 -11.055 15.364 627 HG3 ARG 69 HG3 ARG 69 -21.447 -11.963 15.086 628 HD2 ARG 69 HD2 ARG 69 -20.526 -13.899 16.293 629 HD3 ARG 69 HD3 ARG 69 -18.992 -13.034 16.546 630 HE ARG 69 HE ARG 69 -21.036 -11.377 17.562 631 HH11 ARG 69 HH11 ARG 69 -19.761 -14.533 18.403 632 HH12 ARG 69 HH12 ARG 69 -20.235 -14.378 20.073 633 HH21 ARG 69 HH21 ARG 69 -21.597 -11.239 19.711 634 HH22 ARG 69 HH22 ARG 69 -21.244 -12.556 20.783 635 H ARG 70 H ARG 70 -18.038 -10.769 11.955 636 HA ARG 70 HA ARG 70 -18.536 -8.102 13.049 637 HB2 ARG 70 HB2 ARG 70 -16.365 -9.437 11.446 638 HB3 ARG 70 HB3 ARG 70 -16.509 -7.702 11.283 639 HG2 ARG 70 HG2 ARG 70 -14.888 -8.358 13.016 640 HG3 ARG 70 HG3 ARG 70 -16.175 -7.319 13.629 641 HD2 ARG 70 HD2 ARG 70 -17.273 -9.185 14.710 642 HD3 ARG 70 HD3 ARG 70 -16.138 -10.335 13.968 643 HE ARG 70 HE ARG 70 -14.580 -8.421 15.384 644 HH11 ARG 70 HH11 ARG 70 -13.743 -8.664 17.209 645 HH12 ARG 70 HH12 ARG 70 -14.318 -9.825 18.419 646 HH21 ARG 70 HH21 ARG 70 -16.890 -10.907 16.341 647 HH22 ARG 70 HH22 ARG 70 -16.106 -11.110 17.887 648 H LEU 71 H LEU 71 -18.866 -9.425 9.757 649 HA LEU 71 HA LEU 71 -19.821 -6.910 8.615 650 HB2 LEU 71 HB2 LEU 71 -20.164 -9.815 7.747 651 HB3 LEU 71 HB3 LEU 71 -20.690 -8.430 6.790 652 HG LEU 71 HG LEU 71 -17.775 -8.944 7.558 653 HD11 LEU 71 HD11 LEU 71 -17.508 -9.676 5.218 654 HD12 LEU 71 HD12 LEU 71 -18.659 -10.713 6.079 655 HD13 LEU 71 HD13 LEU 71 -19.252 -9.481 4.942 656 HD21 LEU 71 HD21 LEU 71 -19.053 -7.024 5.554 657 HD22 LEU 71 HD22 LEU 71 -18.183 -6.582 7.052 658 HD23 LEU 71 HD23 LEU 71 -17.315 -7.337 5.712 659 H GLN 72 H GLN 72 -22.008 -6.284 8.210 660 HA GLN 72 HA GLN 72 -23.905 -7.155 10.225 661 HB2 GLN 72 HB2 GLN 72 -24.025 -5.003 8.099 662 HB3 GLN 72 HB3 GLN 72 -25.342 -5.357 9.234 663 HG2 GLN 72 HG2 GLN 72 -23.850 -4.952 11.160 664 HG3 GLN 72 HG3 GLN 72 -22.519 -4.562 10.074 665 HE21 GLN 72 HE21 GLN 72 -23.939 -1.314 11.121 666 HE22 GLN 72 HE22 GLN 72 -23.058 -2.634 11.869 667 H LEU 73 H LEU 73 -23.585 -9.383 9.066 668 HA LEU 73 HA LEU 73 -25.902 -9.873 7.222 669 HB2 LEU 73 HB2 LEU 73 -23.132 -11.134 7.157 670 HB3 LEU 73 HB3 LEU 73 -24.492 -11.613 6.143 671 HG LEU 73 HG LEU 73 -23.181 -8.848 6.081 672 HD11 LEU 73 HD11 LEU 73 -22.890 -11.168 4.143 673 HD12 LEU 73 HD12 LEU 73 -22.148 -9.558 3.995 674 HD13 LEU 73 HD13 LEU 73 -21.654 -10.641 5.306 675 HD21 LEU 73 HD21 LEU 73 -25.181 -10.170 4.185 676 HD22 LEU 73 HD22 LEU 73 -25.522 -8.803 5.273 677 HD23 LEU 73 HD23 LEU 73 -24.389 -8.597 3.940 678 H ASN 74 H ASN 74 -27.384 -10.846 8.442 679 HA ASN 74 HA ASN 74 -26.797 -12.723 10.590 680 HB2 ASN 74 HB2 ASN 74 -28.857 -11.244 10.362 681 HB3 ASN 74 HB3 ASN 74 -29.390 -12.267 9.026 682 HD21 ASN 74 HD21 ASN 74 -31.241 -13.688 11.778 683 HD22 ASN 74 HD22 ASN 74 -31.319 -12.426 10.555 684 H ALA 75 H ALA 75 -27.417 -15.054 10.514 685 HA ALA 75 HA ALA 75 -26.073 -16.427 8.427 686 HB1 ALA 75 HB1 ALA 75 -28.067 -17.453 10.495 687 HB2 ALA 75 HB2 ALA 75 -26.896 -18.444 9.595 688 HB3 ALA 75 HB3 ALA 75 -26.320 -17.228 10.749 689 H ASN 76 H ASN 76 -29.431 -15.436 8.535 690 HA ASN 76 HA ASN 76 -30.476 -17.199 6.513 691 HB2 ASN 76 HB2 ASN 76 -31.841 -15.918 8.149 692 HB3 ASN 76 HB3 ASN 76 -31.309 -14.397 7.416 693 HD21 ASN 76 HD21 ASN 76 -34.125 -16.685 5.492 694 HD22 ASN 76 HD22 ASN 76 -33.112 -17.426 6.720 695 H GLN 77 H GLN 77 -28.403 -14.349 6.256 696 HA GLN 77 HA GLN 77 -29.124 -13.685 3.507 697 HB2 GLN 77 HB2 GLN 77 -26.692 -12.872 5.159 698 HB3 GLN 77 HB3 GLN 77 -27.176 -12.180 3.620 699 HG2 GLN 77 HG2 GLN 77 -28.751 -12.011 6.235 700 HG3 GLN 77 HG3 GLN 77 -27.807 -10.719 5.496 701 HE21 GLN 77 HE21 GLN 77 -30.272 -10.195 2.832 702 HE22 GLN 77 HE22 GLN 77 -28.543 -10.134 3.114 703 H ALA 78 H ALA 78 -28.048 -14.233 1.606 704 HA ALA 78 HA ALA 78 -26.347 -16.588 1.589 705 HB1 ALA 78 HB1 ALA 78 -27.063 -14.625 -0.627 706 HB2 ALA 78 HB2 ALA 78 -26.273 -16.203 -0.832 707 HB3 ALA 78 HB3 ALA 78 -27.934 -16.124 -0.225 708 H PHE 79 H PHE 79 -24.275 -16.541 2.209 709 HA PHE 79 HA PHE 79 -22.435 -14.503 1.237 710 HB2 PHE 79 HB2 PHE 79 -23.044 -13.249 3.050 711 HB3 PHE 79 HB3 PHE 79 -23.231 -14.642 4.110 712 HD1 PHE 79 HD1 PHE 79 -21.251 -15.820 5.065 713 HD2 PHE 79 HD2 PHE 79 -20.867 -12.169 2.807 714 HE1 PHE 79 HE1 PHE 79 -18.919 -15.563 5.887 715 HE2 PHE 79 HE2 PHE 79 -18.549 -11.890 3.673 716 HZ PHE 79 HZ PHE 79 -17.569 -13.599 5.169 717 H PHE 80 H PHE 80 -20.369 -15.010 0.989 718 HA PHE 80 HA PHE 80 -19.225 -17.389 2.344 719 HB2 PHE 80 HB2 PHE 80 -19.199 -16.953 -0.666 720 HB3 PHE 80 HB3 PHE 80 -18.308 -18.202 0.202 721 HD1 PHE 80 HD1 PHE 80 -21.674 -17.082 -0.869 722 HD2 PHE 80 HD2 PHE 80 -19.365 -20.264 0.887 723 HE1 PHE 80 HE1 PHE 80 -23.584 -18.639 -1.199 724 HE2 PHE 80 HE2 PHE 80 -21.263 -21.831 0.533 725 HZ PHE 80 HZ PHE 80 -23.371 -21.019 -0.511 726 H LEU 81 H LEU 81 -17.189 -16.926 3.067 727 HA LEU 81 HA LEU 81 -15.665 -14.663 1.855 728 HB2 LEU 81 HB2 LEU 81 -15.693 -14.485 4.219 729 HB3 LEU 81 HB3 LEU 81 -15.374 -16.188 4.439 730 HG LEU 81 HG LEU 81 -13.045 -15.838 3.482 731 HD11 LEU 81 HD11 LEU 81 -13.939 -12.920 3.635 732 HD12 LEU 81 HD12 LEU 81 -12.246 -13.424 3.477 733 HD13 LEU 81 HD13 LEU 81 -13.392 -13.784 2.180 734 HD21 LEU 81 HD21 LEU 81 -13.244 -15.903 5.876 735 HD22 LEU 81 HD22 LEU 81 -12.101 -14.648 5.432 736 HD23 LEU 81 HD23 LEU 81 -13.746 -14.193 5.934 737 H LEU 82 H LEU 82 -14.193 -15.052 0.392 738 HA LEU 82 HA LEU 82 -13.548 -17.851 -0.336 739 HB2 LEU 82 HB2 LEU 82 -13.437 -15.449 -2.173 740 HB3 LEU 82 HB3 LEU 82 -13.579 -17.138 -2.594 741 HG LEU 82 HG LEU 82 -15.771 -15.347 -1.459 742 HD11 LEU 82 HD11 LEU 82 -15.473 -16.737 -4.154 743 HD12 LEU 82 HD12 LEU 82 -16.821 -15.704 -3.639 744 HD13 LEU 82 HD13 LEU 82 -15.208 -15.004 -3.854 745 HD21 LEU 82 HD21 LEU 82 -17.273 -17.272 -1.906 746 HD22 LEU 82 HD22 LEU 82 -15.867 -18.281 -2.251 747 HD23 LEU 82 HD23 LEU 82 -16.116 -17.639 -0.615 748 H VAL 83 H VAL 83 -11.429 -18.468 -0.532 749 HA VAL 83 HA VAL 83 -9.315 -16.384 -0.159 750 HB VAL 83 HB VAL 83 -8.887 -19.365 -0.052 751 HG11 VAL 83 HG11 VAL 83 -6.774 -18.679 1.018 752 HG12 VAL 83 HG12 VAL 83 -6.900 -17.986 -0.598 753 HG13 VAL 83 HG13 VAL 83 -7.217 -16.970 0.819 754 HG21 VAL 83 HG21 VAL 83 -9.419 -17.353 2.176 755 HG22 VAL 83 HG22 VAL 83 -10.339 -18.826 1.810 756 HG23 VAL 83 HG23 VAL 83 -8.692 -18.960 2.439 757 H ASN 84 H ASN 84 -8.134 -15.717 -1.841 758 HA ASN 84 HA ASN 84 -7.889 -15.210 -4.069 759 HB2 ASN 84 HB2 ASN 84 -6.142 -16.916 -3.325 760 HB3 ASN 84 HB3 ASN 84 -7.044 -18.125 -4.231 761 HD21 ASN 84 HD21 ASN 84 -4.357 -16.914 -6.440 762 HD22 ASN 84 HD22 ASN 84 -4.517 -17.814 -4.919 763 H GLY 85 H GLY 85 -10.556 -15.573 -3.659 764 HA2 GLY 85 HA2 GLY 85 -12.425 -15.484 -4.995 765 HA3 GLY 85 HA3 GLY 85 -11.496 -16.127 -6.340 766 H HIS 86 H HIS 86 -11.195 -18.438 -3.859 767 HA HIS 86 HA HIS 86 -13.733 -19.839 -4.674 768 HB2 HIS 86 HB2 HIS 86 -11.603 -20.832 -5.557 769 HB3 HIS 86 HB3 HIS 86 -11.082 -21.127 -3.902 770 HD1 HIS 86 HD1 HIS 86 -12.725 -23.021 -2.501 771 HD2 HIS 86 HD2 HIS 86 -13.157 -22.584 -6.697 772 HE1 HIS 86 HE1 HIS 86 -13.945 -25.118 -3.345 773 HE2 HIS 86 HE2 HIS 86 -14.216 -24.846 -5.891 774 H SER 87 H SER 87 -15.011 -20.785 -3.119 775 HA SER 87 HA SER 87 -14.953 -19.810 -0.447 776 HB2 SER 87 HB2 SER 87 -16.991 -20.557 -1.532 777 HB3 SER 87 HB3 SER 87 -16.369 -22.223 -1.613 778 HG SER 87 HG SER 87 -17.678 -22.065 0.200 779 H MET 88 H MET 88 -14.544 -20.742 1.545 780 HA MET 88 HA MET 88 -13.086 -23.322 1.688 781 HB2 MET 88 HB2 MET 88 -11.966 -20.663 2.659 782 HB3 MET 88 HB3 MET 88 -11.398 -22.213 3.265 783 HG2 MET 88 HG2 MET 88 -11.062 -22.860 0.771 784 HG3 MET 88 HG3 MET 88 -11.111 -21.117 0.482 785 HE1 MET 88 HE1 MET 88 -7.295 -22.279 0.258 786 HE2 MET 88 HE2 MET 88 -8.680 -23.341 -0.083 787 HE3 MET 88 HE3 MET 88 -8.687 -21.654 -0.652 788 H VAL 89 H VAL 89 -15.841 -22.439 2.568 789 HA VAL 89 HA VAL 89 -15.893 -22.101 5.405 790 HB VAL 89 HB VAL 89 -18.052 -23.374 3.705 791 HG11 VAL 89 HG11 VAL 89 -18.523 -23.648 6.099 792 HG12 VAL 89 HG12 VAL 89 -18.167 -21.928 6.397 793 HG13 VAL 89 HG13 VAL 89 -19.578 -22.407 5.430 794 HG21 VAL 89 HG21 VAL 89 -19.013 -21.102 3.543 795 HG22 VAL 89 HG22 VAL 89 -17.606 -20.433 4.392 796 HG23 VAL 89 HG23 VAL 89 -17.428 -21.147 2.779 797 H SER 90 H SER 90 -15.706 -25.114 3.547 798 HA SER 90 HA SER 90 -15.984 -26.826 5.908 799 HB2 SER 90 HB2 SER 90 -15.538 -28.633 4.276 800 HB3 SER 90 HB3 SER 90 -16.833 -27.543 3.755 801 HG SER 90 HG SER 90 -15.326 -27.983 2.055 802 H VAL 91 H VAL 91 -13.355 -24.948 4.926 803 HA VAL 91 HA VAL 91 -11.289 -27.011 5.040 804 HB VAL 91 HB VAL 91 -11.103 -24.007 4.705 805 HG11 VAL 91 HG11 VAL 91 -8.954 -26.128 4.401 806 HG12 VAL 91 HG12 VAL 91 -8.814 -24.444 3.857 807 HG13 VAL 91 HG13 VAL 91 -8.977 -24.781 5.578 808 HG21 VAL 91 HG21 VAL 91 -12.218 -25.190 2.813 809 HG22 VAL 91 HG22 VAL 91 -10.616 -24.617 2.338 810 HG23 VAL 91 HG23 VAL 91 -10.858 -26.323 2.727 811 H SER 92 H SER 92 -10.348 -27.765 6.751 812 HA SER 92 HA SER 92 -10.417 -26.455 9.372 813 HB2 SER 92 HB2 SER 92 -9.389 -28.578 10.117 814 HB3 SER 92 HB3 SER 92 -10.864 -28.845 9.166 815 HG SER 92 HG SER 92 -9.130 -30.233 8.509 816 H THR 93 H THR 93 -8.166 -26.493 6.745 817 HA THR 93 HA THR 93 -5.723 -26.530 7.868 818 HB THR 93 HB THR 93 -6.356 -24.579 5.672 819 HG1 THR 93 HG1 THR 93 -6.209 -26.430 4.303 820 HG21 THR 93 HG21 THR 93 -4.236 -25.355 4.705 821 HG22 THR 93 HG22 THR 93 -3.988 -24.665 6.306 822 HG23 THR 93 HG23 THR 93 -3.978 -26.435 6.091 823 HA PRO 94 HA PRO 94 -5.199 -22.852 10.402 824 HB2 PRO 94 HB2 PRO 94 -2.481 -22.850 10.750 825 HB3 PRO 94 HB3 PRO 94 -3.581 -23.992 11.582 826 HG2 PRO 94 HG2 PRO 94 -2.001 -24.457 9.033 827 HG3 PRO 94 HG3 PRO 94 -2.088 -25.506 10.487 828 HD2 PRO 94 HD2 PRO 94 -3.626 -25.998 8.330 829 HD3 PRO 94 HD3 PRO 94 -4.299 -26.189 9.976 830 H ILE 95 H ILE 95 -4.695 -20.728 10.129 831 HA ILE 95 HA ILE 95 -4.706 -19.785 7.493 832 HB ILE 95 HB ILE 95 -5.717 -18.690 9.465 833 HG12 ILE 95 HG12 ILE 95 -5.259 -16.359 8.962 834 HG13 ILE 95 HG13 ILE 95 -3.795 -16.776 8.075 835 HG21 ILE 95 HG21 ILE 95 -3.830 -18.988 11.091 836 HG22 ILE 95 HG22 ILE 95 -2.897 -17.764 10.207 837 HG23 ILE 95 HG23 ILE 95 -4.401 -17.329 11.022 838 HD11 ILE 95 HD11 ILE 95 -6.601 -17.713 7.313 839 HD12 ILE 95 HD12 ILE 95 -5.801 -16.275 6.653 840 HD13 ILE 95 HD13 ILE 95 -5.120 -17.877 6.341 841 H SER 96 H SER 96 -1.861 -20.406 9.461 842 HA SER 96 HA SER 96 0.038 -18.812 7.980 843 HB2 SER 96 HB2 SER 96 1.677 -20.396 9.049 844 HB3 SER 96 HB3 SER 96 0.589 -19.568 10.178 845 HG SER 96 HG SER 96 0.819 -21.912 10.516 846 H GLU 97 H GLU 97 -1.039 -22.227 7.656 847 HA GLU 97 HA GLU 97 0.733 -22.811 5.444 848 HB2 GLU 97 HB2 GLU 97 -0.163 -24.581 6.850 849 HB3 GLU 97 HB3 GLU 97 -1.811 -24.100 6.471 850 HG2 GLU 97 HG2 GLU 97 -1.321 -26.093 5.264 851 HG3 GLU 97 HG3 GLU 97 -1.511 -24.779 4.117 852 H VAL 98 H VAL 98 -2.656 -21.682 5.621 853 HA VAL 98 HA VAL 98 -3.062 -21.493 2.771 854 HB VAL 98 HB VAL 98 -4.370 -19.810 4.933 855 HG11 VAL 98 HG11 VAL 98 -6.247 -19.643 3.345 856 HG12 VAL 98 HG12 VAL 98 -4.782 -18.953 2.636 857 HG13 VAL 98 HG13 VAL 98 -5.324 -20.566 2.138 858 HG21 VAL 98 HG21 VAL 98 -4.741 -22.178 5.477 859 HG22 VAL 98 HG22 VAL 98 -6.217 -21.495 4.806 860 HG23 VAL 98 HG23 VAL 98 -5.186 -22.519 3.791 861 H TYR 99 H TYR 99 -1.651 -19.184 5.124 862 HA TYR 99 HA TYR 99 -1.172 -17.116 3.268 863 HB2 TYR 99 HB2 TYR 99 -0.898 -16.371 5.302 864 HB3 TYR 99 HB3 TYR 99 -0.086 -17.791 5.920 865 HD1 TYR 99 HD1 TYR 99 2.324 -18.067 5.736 866 HD2 TYR 99 HD2 TYR 99 0.372 -14.510 4.253 867 HE1 TYR 99 HE1 TYR 99 4.520 -16.902 5.648 868 HE2 TYR 99 HE2 TYR 99 2.572 -13.345 4.198 869 HH TYR 99 HH TYR 99 5.643 -14.985 4.996 870 H GLU 100 H GLU 100 1.066 -19.807 4.009 871 HA GLU 100 HA GLU 100 3.013 -18.960 2.141 872 HB2 GLU 100 HB2 GLU 100 2.331 -21.672 3.318 873 HB3 GLU 100 HB3 GLU 100 3.638 -21.495 2.153 874 HG2 GLU 100 HG2 GLU 100 3.470 -19.976 4.783 875 HG3 GLU 100 HG3 GLU 100 4.385 -21.454 4.522 876 H SER 101 H SER 101 0.109 -20.975 1.516 877 HA SER 101 HA SER 101 0.943 -21.517 -1.227 878 HB2 SER 101 HB2 SER 101 -1.152 -22.717 -1.412 879 HB3 SER 101 HB3 SER 101 -0.276 -23.182 0.054 880 HG SER 101 HG SER 101 -2.536 -22.835 0.386 881 H GLU 102 H GLU 102 -0.808 -18.901 0.234 882 HA GLU 102 HA GLU 102 -1.752 -17.957 -2.455 883 HB2 GLU 102 HB2 GLU 102 -3.136 -17.594 0.216 884 HB3 GLU 102 HB3 GLU 102 -3.713 -17.006 -1.334 885 HG2 GLU 102 HG2 GLU 102 -3.392 -19.941 -0.586 886 HG3 GLU 102 HG3 GLU 102 -4.885 -19.038 -0.586 887 H LYS 103 H LYS 103 0.809 -17.293 -1.256 888 HA LYS 103 HA LYS 103 0.808 -14.533 -0.424 889 HB2 LYS 103 HB2 LYS 103 2.980 -16.121 -1.858 890 HB3 LYS 103 HB3 LYS 103 3.184 -14.539 -1.108 891 HG2 LYS 103 HG2 LYS 103 2.477 -15.588 1.100 892 HG3 LYS 103 HG3 LYS 103 2.586 -17.161 0.292 893 HD2 LYS 103 HD2 LYS 103 4.859 -15.164 0.595 894 HD3 LYS 103 HD3 LYS 103 4.619 -16.569 1.618 895 HE2 LYS 103 HE2 LYS 103 5.104 -16.712 -1.397 896 HE3 LYS 103 HE3 LYS 103 6.372 -16.817 -0.182 897 HZ1 LYS 103 HZ1 LYS 103 5.302 -18.808 0.730 898 HZ2 LYS 103 HZ2 LYS 103 4.123 -18.773 -0.417 899 HZ3 LYS 103 HZ3 LYS 103 5.680 -19.027 -0.846 900 H ASP 104 H ASP 104 0.163 -12.841 -1.548 901 HA ASP 104 HA ASP 104 0.195 -12.635 -4.467 902 HB2 ASP 104 HB2 ASP 104 -1.497 -11.578 -3.012 903 HB3 ASP 104 HB3 ASP 104 -0.239 -10.577 -2.268 904 H GLU 105 H GLU 105 1.319 -10.430 -5.291 905 HA GLU 105 HA GLU 105 3.997 -11.056 -5.593 906 HB2 GLU 105 HB2 GLU 105 2.622 -8.365 -5.939 907 HB3 GLU 105 HB3 GLU 105 4.214 -8.737 -6.578 908 HG2 GLU 105 HG2 GLU 105 1.637 -10.178 -7.343 909 HG3 GLU 105 HG3 GLU 105 2.412 -8.904 -8.269 910 H ASP 106 H ASP 106 2.781 -9.051 -2.955 911 HA ASP 106 HA ASP 106 5.557 -8.375 -2.110 912 HB2 ASP 106 HB2 ASP 106 4.483 -6.810 -0.541 913 HB3 ASP 106 HB3 ASP 106 4.158 -6.464 -2.234 914 H GLY 107 H GLY 107 3.284 -10.762 -1.549 915 HA2 GLY 107 HA2 GLY 107 3.707 -12.543 0.009 916 HA3 GLY 107 HA3 GLY 107 4.333 -11.396 1.178 917 H PHE 108 H PHE 108 1.560 -9.814 0.160 918 HA PHE 108 HA PHE 108 0.027 -10.618 2.430 919 HB2 PHE 108 HB2 PHE 108 -0.496 -8.867 0.099 920 HB3 PHE 108 HB3 PHE 108 -1.892 -9.546 0.889 921 HD1 PHE 108 HD1 PHE 108 0.877 -7.152 1.264 922 HD2 PHE 108 HD2 PHE 108 -2.420 -9.105 3.231 923 HE1 PHE 108 HE1 PHE 108 0.919 -5.430 3.065 924 HE2 PHE 108 HE2 PHE 108 -2.372 -7.389 5.031 925 HZ PHE 108 HZ PHE 108 -0.663 -5.578 4.957 926 H LEU 109 H LEU 109 -1.612 -12.003 2.891 927 HA LEU 109 HA LEU 109 -2.269 -14.086 0.917 928 HB2 LEU 109 HB2 LEU 109 -1.965 -14.366 3.446 929 HB3 LEU 109 HB3 LEU 109 -3.512 -13.568 3.629 930 HG LEU 109 HG LEU 109 -2.926 -16.251 2.318 931 HD11 LEU 109 HD11 LEU 109 -3.014 -16.123 4.824 932 HD12 LEU 109 HD12 LEU 109 -4.639 -15.442 4.710 933 HD13 LEU 109 HD13 LEU 109 -4.321 -17.107 4.156 934 HD21 LEU 109 HD21 LEU 109 -5.439 -16.526 2.220 935 HD22 LEU 109 HD22 LEU 109 -5.572 -14.756 2.394 936 HD23 LEU 109 HD23 LEU 109 -4.742 -15.489 0.992 937 H TYR 110 H TYR 110 -3.870 -13.828 -0.590 938 HA TYR 110 HA TYR 110 -5.804 -11.649 -0.295 939 HB2 TYR 110 HB2 TYR 110 -4.783 -13.161 -2.595 940 HB3 TYR 110 HB3 TYR 110 -6.477 -12.712 -2.677 941 HD1 TYR 110 HD1 TYR 110 -3.429 -10.895 -1.296 942 HD2 TYR 110 HD2 TYR 110 -6.782 -10.889 -4.029 943 HE1 TYR 110 HE1 TYR 110 -2.916 -8.561 -1.939 944 HE2 TYR 110 HE2 TYR 110 -6.241 -8.562 -4.689 945 HH TYR 110 HH TYR 110 -4.774 -6.817 -4.482 946 H MET 111 H MET 111 -7.778 -11.638 0.349 947 HA MET 111 HA MET 111 -9.477 -13.990 -0.252 948 HB2 MET 111 HB2 MET 111 -9.685 -12.402 2.340 949 HB3 MET 111 HB3 MET 111 -10.659 -13.787 1.826 950 HG2 MET 111 HG2 MET 111 -8.492 -15.132 1.778 951 HG3 MET 111 HG3 MET 111 -7.743 -13.770 2.620 952 HE1 MET 111 HE1 MET 111 -7.917 -16.521 5.322 953 HE2 MET 111 HE2 MET 111 -7.632 -16.723 3.584 954 HE3 MET 111 HE3 MET 111 -6.897 -15.361 4.457 955 H VAL 112 H VAL 112 -11.582 -13.547 -0.817 956 HA VAL 112 HA VAL 112 -12.497 -10.766 -0.768 957 HB VAL 112 HB VAL 112 -13.405 -10.697 -2.968 958 HG11 VAL 112 HG11 VAL 112 -10.541 -11.702 -3.268 959 HG12 VAL 112 HG12 VAL 112 -11.434 -10.644 -4.375 960 HG13 VAL 112 HG13 VAL 112 -10.997 -10.058 -2.763 961 HG21 VAL 112 HG21 VAL 112 -12.335 -13.509 -3.394 962 HG22 VAL 112 HG22 VAL 112 -14.046 -13.017 -3.317 963 HG23 VAL 112 HG23 VAL 112 -13.031 -12.471 -4.657 964 H TYR 113 H TYR 113 -14.965 -10.616 -0.809 965 HA TYR 113 HA TYR 113 -16.184 -13.311 -0.235 966 HB2 TYR 113 HB2 TYR 113 -17.367 -12.540 1.653 967 HB3 TYR 113 HB3 TYR 113 -15.681 -12.151 1.909 968 HD1 TYR 113 HD1 TYR 113 -14.902 -9.790 1.882 969 HD2 TYR 113 HD2 TYR 113 -19.058 -10.827 1.347 970 HE1 TYR 113 HE1 TYR 113 -15.574 -7.456 2.477 971 HE2 TYR 113 HE2 TYR 113 -19.714 -8.494 1.925 972 HH TYR 113 HH TYR 113 -18.981 -6.407 2.487 973 H ALA 114 H ALA 114 -18.399 -13.498 -0.576 974 HA ALA 114 HA ALA 114 -19.747 -11.526 -2.327 975 HB1 ALA 114 HB1 ALA 114 -19.727 -13.048 -4.228 976 HB2 ALA 114 HB2 ALA 114 -18.054 -12.760 -3.739 977 HB3 ALA 114 HB3 ALA 114 -18.846 -14.279 -3.296 978 H SER 115 H SER 115 -21.885 -12.520 -3.153 979 HA SER 115 HA SER 115 -23.205 -14.007 -0.982 980 HB2 SER 115 HB2 SER 115 -25.249 -13.634 -2.160 981 HB3 SER 115 HB3 SER 115 -24.317 -12.121 -2.168 982 HG SER 115 HG SER 115 -24.187 -12.201 -4.218 983 H GLN 116 H GLN 116 -21.230 -15.083 -3.391 984 HA GLN 116 HA GLN 116 -22.471 -17.766 -3.512 985 HB2 GLN 116 HB2 GLN 116 -22.410 -17.926 -5.838 986 HB3 GLN 116 HB3 GLN 116 -23.209 -16.398 -5.508 987 HG2 GLN 116 HG2 GLN 116 -20.321 -16.764 -6.379 988 HG3 GLN 116 HG3 GLN 116 -21.663 -16.351 -7.440 989 HE21 GLN 116 HE21 GLN 116 -21.748 -13.013 -5.496 990 HE22 GLN 116 HE22 GLN 116 -22.896 -14.340 -5.546 991 H GLU 117 H GLU 117 -20.968 -19.453 -4.278 992 HA GLU 117 HA GLU 117 -18.597 -19.263 -2.694 993 HB2 GLU 117 HB2 GLU 117 -18.280 -21.632 -3.295 994 HB3 GLU 117 HB3 GLU 117 -19.896 -21.251 -2.684 995 HG2 GLU 117 HG2 GLU 117 -20.797 -21.292 -4.983 996 HG3 GLU 117 HG3 GLU 117 -19.190 -21.578 -5.631 997 H THR 118 H THR 118 -18.812 -18.669 -6.121 998 HA THR 118 HA THR 118 -15.977 -18.193 -6.154 999 HB THR 118 HB THR 118 -15.179 -19.440 -7.833 1000 HG1 THR 118 HG1 THR 118 -16.516 -20.525 -9.370 1001 HG21 THR 118 HG21 THR 118 -17.256 -21.404 -6.809 1002 HG22 THR 118 HG22 THR 118 -15.772 -21.800 -7.691 1003 HG23 THR 118 HG23 THR 118 -15.663 -21.095 -6.079 1004 H PHE 119 H PHE 119 -15.208 -17.121 -8.220 1005 HA PHE 119 HA PHE 119 -16.881 -14.906 -8.858 1006 HB2 PHE 119 HB2 PHE 119 -15.113 -14.490 -10.670 1007 HB3 PHE 119 HB3 PHE 119 -14.679 -14.402 -8.977 1008 HD1 PHE 119 HD1 PHE 119 -14.265 -16.342 -12.087 1009 HD2 PHE 119 HD2 PHE 119 -13.294 -16.124 -7.898 1010 HE1 PHE 119 HE1 PHE 119 -12.470 -18.038 -12.418 1011 HE2 PHE 119 HE2 PHE 119 -11.495 -17.823 -8.227 1012 HZ PHE 119 HZ PHE 119 -11.082 -18.773 -10.488 1013 H GLY 120 H GLY 120 -17.118 -18.014 -10.175 1014 HA2 GLY 120 HA2 GLY 120 -18.474 -18.913 -11.803 1015 HA3 GLY 120 HA3 GLY 120 -19.294 -17.355 -11.911 1016 H1 ASP 10 H1 ASP 10 -9.355 -4.432 21.288 1017 H2 ASP 10 H2 ASP 10 -10.488 -3.709 20.348 1018 H3 ASP 10 H3 ASP 10 -9.757 -5.080 19.827 1019 HA ASP 10 HA ASP 10 -8.461 -2.485 20.260 1020 HB2 ASP 10 HB2 ASP 10 -7.226 -5.110 19.470 1021 HB3 ASP 10 HB3 ASP 10 -6.472 -3.576 19.045 1022 H TYR 11 H TYR 11 -7.312 -1.642 18.227 1023 HA TYR 11 HA TYR 11 -9.494 -0.982 16.545 1024 HB2 TYR 11 HB2 TYR 11 -7.690 0.495 15.386 1025 HB3 TYR 11 HB3 TYR 11 -8.397 0.861 16.947 1026 HD1 TYR 11 HD1 TYR 11 -5.289 -0.383 15.266 1027 HD2 TYR 11 HD2 TYR 11 -7.149 0.848 18.978 1028 HE1 TYR 11 HE1 TYR 11 -3.056 -0.255 16.384 1029 HE2 TYR 11 HE2 TYR 11 -4.919 0.917 20.075 1030 HH TYR 11 HH TYR 11 -2.656 0.634 19.815 1031 H GLU 12 H GLU 12 -9.961 -0.977 14.473 1032 HA GLU 12 HA GLU 12 -8.924 -3.234 12.878 1033 HB2 GLU 12 HB2 GLU 12 -10.886 -2.876 11.478 1034 HB3 GLU 12 HB3 GLU 12 -11.321 -3.111 13.170 1035 HG2 GLU 12 HG2 GLU 12 -11.067 -0.310 11.976 1036 HG3 GLU 12 HG3 GLU 12 -12.513 -1.278 11.722 1037 H SER 13 H SER 13 -8.143 -0.010 13.043 1038 HA SER 13 HA SER 13 -6.270 -0.325 10.918 1039 HB2 SER 13 HB2 SER 13 -8.658 1.421 10.340 1040 HB3 SER 13 HB3 SER 13 -7.061 1.854 9.694 1041 HG SER 13 HG SER 13 -8.152 -0.742 9.439 1042 H ASP 14 H ASP 14 -4.575 0.804 11.261 1043 HA ASP 14 HA ASP 14 -4.406 3.493 12.297 1044 HB2 ASP 14 HB2 ASP 14 -4.701 1.963 14.393 1045 HB3 ASP 14 HB3 ASP 14 -3.114 1.303 14.002 1046 H ASP 15 H ASP 15 -1.635 3.357 12.930 1047 HA ASP 15 HA ASP 15 -0.283 1.843 10.791 1048 HB2 ASP 15 HB2 ASP 15 -0.100 4.808 11.182 1049 HB3 ASP 15 HB3 ASP 15 1.270 3.905 10.542 1050 H ASP 16 H ASP 16 2.050 1.709 10.925 1051 HA ASP 16 HA ASP 16 3.812 0.775 11.818 1052 HB2 ASP 16 HB2 ASP 16 3.304 2.689 14.075 1053 HB3 ASP 16 HB3 ASP 16 4.665 1.581 14.060 1054 H SER 17 H SER 17 1.250 0.437 14.250 1055 HA SER 17 HA SER 17 1.597 -2.433 14.109 1056 HB2 SER 17 HB2 SER 17 3.353 -1.841 15.818 1057 HB3 SER 17 HB3 SER 17 2.054 -1.198 16.850 1058 HG SER 17 HG SER 17 2.371 -3.341 17.412 1059 H TYR 18 H TYR 18 -0.092 -3.610 15.041 1060 HA TYR 18 HA TYR 18 -2.434 -2.546 16.218 1061 HB2 TYR 18 HB2 TYR 18 -3.913 -2.695 14.102 1062 HB3 TYR 18 HB3 TYR 18 -2.964 -1.281 14.412 1063 HD1 TYR 18 HD1 TYR 18 -1.053 -4.127 12.951 1064 HD2 TYR 18 HD2 TYR 18 -3.490 -0.666 12.175 1065 HE1 TYR 18 HE1 TYR 18 -0.247 -4.090 10.604 1066 HE2 TYR 18 HE2 TYR 18 -2.745 -0.694 9.777 1067 HH TYR 18 HH TYR 18 -0.178 -2.850 8.636 1068 H GLU 19 H GLU 19 -4.415 -3.962 16.081 1069 HA GLU 19 HA GLU 19 -3.681 -6.841 15.677 1070 HB2 GLU 19 HB2 GLU 19 -6.067 -5.562 17.047 1071 HB3 GLU 19 HB3 GLU 19 -5.836 -7.295 16.836 1072 HG2 GLU 19 HG2 GLU 19 -4.023 -5.427 18.418 1073 HG3 GLU 19 HG3 GLU 19 -5.199 -6.562 19.080 1074 H VAL 20 H VAL 20 -6.061 -4.429 14.507 1075 HA VAL 20 HA VAL 20 -7.159 -4.238 12.635 1076 HB VAL 20 HB VAL 20 -5.615 -6.311 11.178 1077 HG11 VAL 20 HG11 VAL 20 -6.398 -3.483 10.366 1078 HG12 VAL 20 HG12 VAL 20 -5.850 -4.803 9.322 1079 HG13 VAL 20 HG13 VAL 20 -7.457 -4.860 10.078 1080 HG21 VAL 20 HG21 VAL 20 -3.882 -5.110 12.418 1081 HG22 VAL 20 HG22 VAL 20 -3.878 -4.573 10.739 1082 HG23 VAL 20 HG23 VAL 20 -4.635 -3.559 11.977 1083 H LEU 21 H LEU 21 -7.026 -7.679 13.417 1084 HA LEU 21 HA LEU 21 -9.679 -8.367 12.288 1085 HB2 LEU 21 HB2 LEU 21 -7.594 -9.830 12.572 1086 HB3 LEU 21 HB3 LEU 21 -7.917 -9.824 14.295 1087 HG LEU 21 HG LEU 21 -10.115 -11.008 13.798 1088 HD11 LEU 21 HD11 LEU 21 -10.372 -12.069 11.594 1089 HD12 LEU 21 HD12 LEU 21 -10.399 -10.317 11.402 1090 HD13 LEU 21 HD13 LEU 21 -8.938 -11.253 10.988 1091 HD21 LEU 21 HD21 LEU 21 -8.062 -12.219 14.448 1092 HD22 LEU 21 HD22 LEU 21 -9.044 -13.158 13.308 1093 HD23 LEU 21 HD23 LEU 21 -7.583 -12.311 12.743 1094 H ASP 22 H ASP 22 -9.092 -6.254 14.489 1095 HA ASP 22 HA ASP 22 -9.625 -5.428 16.386 1096 HB2 ASP 22 HB2 ASP 22 -12.005 -5.167 16.954 1097 HB3 ASP 22 HB3 ASP 22 -11.504 -4.712 15.327 1098 H LEU 23 H LEU 23 -10.416 -8.810 16.565 1099 HA LEU 23 HA LEU 23 -10.503 -8.931 19.440 1100 HB2 LEU 23 HB2 LEU 23 -10.478 -11.268 19.194 1101 HB3 LEU 23 HB3 LEU 23 -11.383 -10.639 17.845 1102 HG LEU 23 HG LEU 23 -9.036 -10.885 16.555 1103 HD11 LEU 23 HD11 LEU 23 -8.859 -13.049 18.713 1104 HD12 LEU 23 HD12 LEU 23 -7.847 -12.938 17.258 1105 HD13 LEU 23 HD13 LEU 23 -7.710 -11.711 18.514 1106 HD21 LEU 23 HD21 LEU 23 -10.915 -13.176 17.254 1107 HD22 LEU 23 HD22 LEU 23 -11.076 -12.016 15.913 1108 HD23 LEU 23 HD23 LEU 23 -9.760 -13.196 15.912 1109 H THR 24 H THR 24 -8.918 -9.554 20.917 1110 HA THR 24 HA THR 24 -6.134 -8.965 20.106 1111 HB THR 24 HB THR 24 -6.986 -8.867 22.957 1112 HG1 THR 24 HG1 THR 24 -7.518 -6.734 22.694 1113 HG21 THR 24 HG21 THR 24 -4.890 -7.349 21.343 1114 HG22 THR 24 HG22 THR 24 -5.204 -7.169 23.079 1115 HG23 THR 24 HG23 THR 24 -4.577 -8.700 22.456 1116 H GLU 25 H GLU 25 -4.470 -10.328 20.280 1117 HA GLU 25 HA GLU 25 -4.529 -12.583 22.133 1118 HB2 GLU 25 HB2 GLU 25 -5.696 -13.588 20.259 1119 HB3 GLU 25 HB3 GLU 25 -4.521 -12.946 19.122 1120 HG2 GLU 25 HG2 GLU 25 -4.184 -15.290 19.337 1121 HG3 GLU 25 HG3 GLU 25 -2.788 -14.463 19.986 1122 H TYR 26 H TYR 26 -2.510 -13.220 22.765 1123 HA TYR 26 HA TYR 26 -0.141 -12.423 21.316 1124 HB2 TYR 26 HB2 TYR 26 0.853 -11.293 23.401 1125 HB3 TYR 26 HB3 TYR 26 -0.168 -10.413 22.284 1126 HD1 TYR 26 HD1 TYR 26 -0.255 -12.214 25.571 1127 HD2 TYR 26 HD2 TYR 26 -2.094 -9.263 23.021 1128 HE1 TYR 26 HE1 TYR 26 -1.739 -11.512 27.451 1129 HE2 TYR 26 HE2 TYR 26 -3.570 -8.548 24.907 1130 HH TYR 26 HH TYR 26 -4.160 -8.888 27.106 Start of MODEL 17 1 H1 MET 1 H1 MET 1 -9.553 5.502 6.524 2 H2 MET 1 H2 MET 1 -8.769 4.547 7.609 3 H3 MET 1 H3 MET 1 -8.046 4.962 6.214 4 HA MET 1 HA MET 1 -9.607 3.740 4.886 5 HB2 MET 1 HB2 MET 1 -7.697 2.477 5.289 6 HB3 MET 1 HB3 MET 1 -8.142 2.120 6.964 7 HG2 MET 1 HG2 MET 1 -10.069 0.718 6.037 8 HG3 MET 1 HG3 MET 1 -9.416 1.028 4.433 9 HE1 MET 1 HE1 MET 1 -9.399 -1.096 7.593 10 HE2 MET 1 HE2 MET 1 -7.772 -1.804 7.678 11 HE3 MET 1 HE3 MET 1 -8.010 -0.081 8.043 12 HA PRO 2 HA PRO 2 -12.768 1.285 7.345 13 HB2 PRO 2 HB2 PRO 2 -13.406 1.913 9.977 14 HB3 PRO 2 HB3 PRO 2 -12.263 0.644 9.453 15 HG2 PRO 2 HG2 PRO 2 -11.633 3.495 10.268 16 HG3 PRO 2 HG3 PRO 2 -10.852 1.979 10.826 17 HD2 PRO 2 HD2 PRO 2 -9.710 3.427 8.907 18 HD3 PRO 2 HD3 PRO 2 -9.804 1.654 8.710 19 H SER 3 H SER 3 -14.278 2.066 6.112 20 HA SER 3 HA SER 3 -16.154 4.178 6.836 21 HB2 SER 3 HB2 SER 3 -15.551 5.687 5.025 22 HB3 SER 3 HB3 SER 3 -14.121 5.448 6.028 23 HG SER 3 HG SER 3 -13.291 4.042 4.504 24 H GLU 4 H GLU 4 -17.379 4.693 4.521 25 HA GLU 4 HA GLU 4 -18.439 2.168 3.516 26 HB2 GLU 4 HB2 GLU 4 -18.942 5.062 2.721 27 HB3 GLU 4 HB3 GLU 4 -19.839 3.661 2.105 28 HG2 GLU 4 HG2 GLU 4 -20.512 3.081 4.435 29 HG3 GLU 4 HG3 GLU 4 -19.734 4.561 5.010 30 H LYS 5 H LYS 5 -15.575 3.723 2.681 31 HA LYS 5 HA LYS 5 -15.693 2.769 -0.154 32 HB2 LYS 5 HB2 LYS 5 -14.314 4.679 -0.829 33 HB3 LYS 5 HB3 LYS 5 -15.893 5.133 -0.203 34 HG2 LYS 5 HG2 LYS 5 -14.875 5.792 1.964 35 HG3 LYS 5 HG3 LYS 5 -13.285 5.294 1.363 36 HD2 LYS 5 HD2 LYS 5 -13.455 7.683 1.206 37 HD3 LYS 5 HD3 LYS 5 -13.466 7.027 -0.441 38 HE2 LYS 5 HE2 LYS 5 -15.935 7.280 -0.530 39 HE3 LYS 5 HE3 LYS 5 -15.946 7.848 1.144 40 HZ1 LYS 5 HZ1 LYS 5 -14.625 9.260 -1.123 41 HZ2 LYS 5 HZ2 LYS 5 -16.019 9.717 -0.416 42 HZ3 LYS 5 HZ3 LYS 5 -14.624 9.782 0.431 43 H THR 6 H THR 6 -13.576 2.458 -1.189 44 HA THR 6 HA THR 6 -12.417 0.345 0.330 45 HB THR 6 HB THR 6 -11.629 -0.624 -1.510 46 HG1 THR 6 HG1 THR 6 -11.043 0.585 -3.403 47 HG21 THR 6 HG21 THR 6 -14.082 -0.151 -1.881 48 HG22 THR 6 HG22 THR 6 -13.610 1.243 -2.888 49 HG23 THR 6 HG23 THR 6 -13.152 -0.406 -3.357 50 H PHE 7 H PHE 7 -10.285 -0.333 0.606 51 HA PHE 7 HA PHE 7 -8.543 1.557 1.855 52 HB2 PHE 7 HB2 PHE 7 -8.676 -0.602 2.709 53 HB3 PHE 7 HB3 PHE 7 -8.423 -1.344 1.147 54 HD1 PHE 7 HD1 PHE 7 -6.534 -2.647 1.100 55 HD2 PHE 7 HD2 PHE 7 -6.427 1.103 3.235 56 HE1 PHE 7 HE1 PHE 7 -4.242 -3.150 1.870 57 HE2 PHE 7 HE2 PHE 7 -4.182 0.541 4.095 58 HZ PHE 7 HZ PHE 7 -3.040 -1.551 3.349 59 H LYS 8 H LYS 8 -8.594 0.445 -1.457 60 HA LYS 8 HA LYS 8 -5.949 1.153 -2.265 61 HB2 LYS 8 HB2 LYS 8 -7.431 -0.295 -3.563 62 HB3 LYS 8 HB3 LYS 8 -8.615 0.996 -3.734 63 HG2 LYS 8 HG2 LYS 8 -7.492 0.652 -5.814 64 HG3 LYS 8 HG3 LYS 8 -7.104 2.253 -5.200 65 HD2 LYS 8 HD2 LYS 8 -4.899 1.299 -4.336 66 HD3 LYS 8 HD3 LYS 8 -5.304 -0.218 -5.155 67 HE2 LYS 8 HE2 LYS 8 -4.995 2.528 -6.476 68 HE3 LYS 8 HE3 LYS 8 -3.746 1.278 -6.431 69 HZ1 LYS 8 HZ1 LYS 8 -6.375 1.016 -7.820 70 HZ2 LYS 8 HZ2 LYS 8 -4.925 1.195 -8.536 71 HZ3 LYS 8 HZ3 LYS 8 -5.255 -0.177 -7.725 72 H GLN 9 H GLN 9 -8.686 3.235 -1.611 73 HA GLN 9 HA GLN 9 -7.814 5.555 -3.023 74 HB2 GLN 9 HB2 GLN 9 -10.056 5.117 -1.991 75 HB3 GLN 9 HB3 GLN 9 -9.370 5.425 -0.400 76 HG2 GLN 9 HG2 GLN 9 -8.967 7.546 -2.527 77 HG3 GLN 9 HG3 GLN 9 -10.611 7.270 -1.992 78 HE21 GLN 9 HE21 GLN 9 -9.979 8.460 1.397 79 HE22 GLN 9 HE22 GLN 9 -10.831 7.151 0.595 80 H ARG 10 H ARG 10 -6.693 4.152 0.038 81 HA ARG 10 HA ARG 10 -4.862 6.503 0.474 82 HB2 ARG 10 HB2 ARG 10 -5.549 4.294 2.458 83 HB3 ARG 10 HB3 ARG 10 -4.578 5.734 2.743 84 HG2 ARG 10 HG2 ARG 10 -7.566 5.529 2.332 85 HG3 ARG 10 HG3 ARG 10 -6.692 6.133 3.736 86 HD2 ARG 10 HD2 ARG 10 -7.010 7.457 1.039 87 HD3 ARG 10 HD3 ARG 10 -7.726 7.983 2.562 88 HE ARG 10 HE ARG 10 -5.164 8.214 3.239 89 HH11 ARG 10 HH11 ARG 10 -5.522 10.531 -0.006 90 HH12 ARG 10 HH12 ARG 10 -6.718 9.292 0.266 91 HH21 ARG 10 HH21 ARG 10 -3.674 9.820 2.815 92 HH22 ARG 10 HH22 ARG 10 -3.863 10.837 1.420 93 H ARG 11 H ARG 11 -4.684 2.889 0.584 94 HA ARG 11 HA ARG 11 -1.719 3.156 0.412 95 HB2 ARG 11 HB2 ARG 11 -3.592 1.009 1.346 96 HB3 ARG 11 HB3 ARG 11 -2.015 0.527 0.767 97 HG2 ARG 11 HG2 ARG 11 -1.920 0.765 3.145 98 HG3 ARG 11 HG3 ARG 11 -0.858 1.928 2.400 99 HD2 ARG 11 HD2 ARG 11 -3.634 2.863 3.136 100 HD3 ARG 11 HD3 ARG 11 -2.490 2.498 4.436 101 HE ARG 11 HE ARG 11 -1.242 4.204 2.455 102 HH11 ARG 11 HH11 ARG 11 -0.500 6.088 3.028 103 HH12 ARG 11 HH12 ARG 11 -1.130 6.943 4.423 104 HH21 ARG 11 HH21 ARG 11 -3.312 4.413 5.290 105 HH22 ARG 11 HH22 ARG 11 -2.688 5.987 5.702 106 H THR 12 H THR 12 -0.407 1.925 -0.835 107 HA THR 12 HA THR 12 -1.317 0.913 -3.479 108 HB THR 12 HB THR 12 0.546 2.207 -4.528 109 HG1 THR 12 HG1 THR 12 1.669 3.675 -3.373 110 HG21 THR 12 HG21 THR 12 -1.335 4.108 -3.055 111 HG22 THR 12 HG22 THR 12 -0.459 4.409 -4.564 112 HG23 THR 12 HG23 THR 12 -1.760 3.204 -4.530 113 H PHE 13 H PHE 13 0.661 -0.225 -4.549 114 HA PHE 13 HA PHE 13 1.597 -2.212 -2.893 115 HB2 PHE 13 HB2 PHE 13 2.454 -1.305 -5.589 116 HB3 PHE 13 HB3 PHE 13 3.462 -2.454 -4.741 117 HD1 PHE 13 HD1 PHE 13 2.498 -4.586 -3.843 118 HD2 PHE 13 HD2 PHE 13 0.433 -2.112 -6.711 119 HE1 PHE 13 HE1 PHE 13 1.168 -6.540 -4.556 120 HE2 PHE 13 HE2 PHE 13 -0.946 -4.065 -7.393 121 HZ PHE 13 HZ PHE 13 -0.586 -6.282 -6.322 122 H GLU 14 H GLU 14 3.604 0.690 -3.558 123 HA GLU 14 HA GLU 14 5.851 -0.289 -2.079 124 HB2 GLU 14 HB2 GLU 14 4.917 2.570 -2.568 125 HB3 GLU 14 HB3 GLU 14 6.493 2.110 -1.896 126 HG2 GLU 14 HG2 GLU 14 6.959 0.785 -3.965 127 HG3 GLU 14 HG3 GLU 14 5.449 1.372 -4.663 128 H GLN 15 H GLN 15 2.947 1.465 -0.987 129 HA GLN 15 HA GLN 15 3.844 1.792 1.767 130 HB2 GLN 15 HB2 GLN 15 1.046 1.855 0.567 131 HB3 GLN 15 HB3 GLN 15 1.482 2.345 2.209 132 HG2 GLN 15 HG2 GLN 15 2.858 4.182 1.371 133 HG3 GLN 15 HG3 GLN 15 2.579 3.690 -0.301 134 HE21 GLN 15 HE21 GLN 15 -0.644 5.234 -0.461 135 HE22 GLN 15 HE22 GLN 15 0.588 4.310 -1.337 136 H ARG 16 H ARG 16 1.813 -0.631 0.062 137 HA ARG 16 HA ARG 16 1.233 -2.200 2.435 138 HB2 ARG 16 HB2 ARG 16 1.133 -2.938 -0.524 139 HB3 ARG 16 HB3 ARG 16 0.605 -3.991 0.797 140 HG2 ARG 16 HG2 ARG 16 -0.931 -2.072 1.552 141 HG3 ARG 16 HG3 ARG 16 -0.601 -1.317 -0.012 142 HD2 ARG 16 HD2 ARG 16 -1.758 -4.100 0.425 143 HD3 ARG 16 HD3 ARG 16 -2.704 -2.672 0.030 144 HE ARG 16 HE ARG 16 -0.838 -4.172 -1.750 145 HH11 ARG 16 HH11 ARG 16 -3.284 -1.675 -1.546 146 HH12 ARG 16 HH12 ARG 16 -3.508 -1.626 -3.271 147 HH21 ARG 16 HH21 ARG 16 -1.077 -3.964 -3.964 148 HH22 ARG 16 HH22 ARG 16 -2.277 -2.893 -4.596 149 H VAL 17 H VAL 17 3.842 -2.443 0.032 150 HA VAL 17 HA VAL 17 5.049 -4.865 0.979 151 HB VAL 17 HB VAL 17 6.081 -2.406 -0.473 152 HG11 VAL 17 HG11 VAL 17 8.054 -3.133 0.755 153 HG12 VAL 17 HG12 VAL 17 7.750 -4.828 0.315 154 HG13 VAL 17 HG13 VAL 17 8.202 -3.644 -0.928 155 HG21 VAL 17 HG21 VAL 17 6.232 -3.912 -2.356 156 HG22 VAL 17 HG22 VAL 17 5.947 -5.323 -1.319 157 HG23 VAL 17 HG23 VAL 17 4.640 -4.172 -1.634 158 H GLU 18 H GLU 18 5.650 -1.411 1.972 159 HA GLU 18 HA GLU 18 7.486 -2.104 4.075 160 HB2 GLU 18 HB2 GLU 18 5.699 0.308 3.648 161 HB3 GLU 18 HB3 GLU 18 6.811 0.147 5.020 162 HG2 GLU 18 HG2 GLU 18 8.716 -0.123 3.513 163 HG3 GLU 18 HG3 GLU 18 7.667 0.010 2.100 164 H ASP 19 H ASP 19 3.917 -1.498 4.282 165 HA ASP 19 HA ASP 19 3.684 -2.052 7.029 166 HB2 ASP 19 HB2 ASP 19 1.921 -0.978 5.949 167 HB3 ASP 19 HB3 ASP 19 1.775 -2.240 4.728 168 H VAL 20 H VAL 20 3.462 -4.430 4.378 169 HA VAL 20 HA VAL 20 3.082 -6.783 5.999 170 HB VAL 20 HB VAL 20 4.262 -6.304 3.232 171 HG11 VAL 20 HG11 VAL 20 3.887 -8.987 4.629 172 HG12 VAL 20 HG12 VAL 20 4.117 -8.782 2.886 173 HG13 VAL 20 HG13 VAL 20 5.403 -8.316 3.990 174 HG21 VAL 20 HG21 VAL 20 1.787 -6.055 3.534 175 HG22 VAL 20 HG22 VAL 20 2.206 -7.434 2.502 176 HG23 VAL 20 HG23 VAL 20 1.720 -7.705 4.187 177 H ARG 21 H ARG 21 6.110 -5.156 4.813 178 HA ARG 21 HA ARG 21 7.904 -7.096 5.871 179 HB2 ARG 21 HB2 ARG 21 8.537 -5.435 4.187 180 HB3 ARG 21 HB3 ARG 21 8.330 -4.123 5.352 181 HG2 ARG 21 HG2 ARG 21 10.185 -4.992 6.718 182 HG3 ARG 21 HG3 ARG 21 10.347 -6.389 5.643 183 HD2 ARG 21 HD2 ARG 21 10.901 -4.878 3.759 184 HD3 ARG 21 HD3 ARG 21 10.736 -3.479 4.809 185 HE ARG 21 HE ARG 21 12.892 -5.529 4.817 186 HH11 ARG 21 HH11 ARG 21 11.754 -2.560 6.318 187 HH12 ARG 21 HH12 ARG 21 13.307 -2.226 7.024 188 HH21 ARG 21 HH21 ARG 21 14.818 -5.061 5.793 189 HH22 ARG 21 HH22 ARG 21 14.995 -3.607 6.729 190 H LEU 22 H LEU 22 6.709 -4.073 7.444 191 HA LEU 22 HA LEU 22 7.986 -4.408 9.932 192 HB2 LEU 22 HB2 LEU 22 5.397 -3.079 9.049 193 HB3 LEU 22 HB3 LEU 22 5.743 -3.300 10.759 194 HG LEU 22 HG LEU 22 8.047 -2.223 10.262 195 HD11 LEU 22 HD11 LEU 22 8.054 -0.498 8.531 196 HD12 LEU 22 HD12 LEU 22 7.944 -2.112 7.822 197 HD13 LEU 22 HD13 LEU 22 6.494 -1.085 7.923 198 HD21 LEU 22 HD21 LEU 22 5.482 -0.565 10.183 199 HD22 LEU 22 HD22 LEU 22 6.272 -1.200 11.646 200 HD23 LEU 22 HD23 LEU 22 7.086 0.027 10.669 201 H ILE 23 H ILE 23 4.611 -5.609 9.159 202 HA ILE 23 HA ILE 23 4.511 -6.900 11.700 203 HB ILE 23 HB ILE 23 2.463 -6.277 10.666 204 HG12 ILE 23 HG12 ILE 23 1.146 -8.370 10.927 205 HG13 ILE 23 HG13 ILE 23 2.610 -9.335 10.924 206 HG21 ILE 23 HG21 ILE 23 3.063 -6.765 8.277 207 HG22 ILE 23 HG22 ILE 23 2.831 -8.496 8.595 208 HG23 ILE 23 HG23 ILE 23 1.480 -7.342 8.758 209 HD11 ILE 23 HD11 ILE 23 1.952 -7.179 12.990 210 HD12 ILE 23 HD12 ILE 23 1.674 -8.917 13.198 211 HD13 ILE 23 HD13 ILE 23 3.328 -8.304 13.037 212 H ARG 24 H ARG 24 5.373 -8.301 8.534 213 HA ARG 24 HA ARG 24 5.468 -10.994 9.506 214 HB2 ARG 24 HB2 ARG 24 5.137 -10.399 7.145 215 HB3 ARG 24 HB3 ARG 24 6.741 -9.667 7.067 216 HG2 ARG 24 HG2 ARG 24 6.694 -11.863 5.983 217 HG3 ARG 24 HG3 ARG 24 7.820 -11.827 7.326 218 HD2 ARG 24 HD2 ARG 24 6.006 -12.954 8.761 219 HD3 ARG 24 HD3 ARG 24 5.035 -13.066 7.297 220 HE ARG 24 HE ARG 24 6.370 -14.778 6.516 221 HH11 ARG 24 HH11 ARG 24 7.876 -16.398 6.677 222 HH12 ARG 24 HH12 ARG 24 9.105 -16.347 7.906 223 HH21 ARG 24 HH21 ARG 24 8.106 -13.341 9.260 224 HH22 ARG 24 HH22 ARG 24 9.234 -14.666 9.314 225 H GLU 25 H GLU 25 7.918 -8.472 9.577 226 HA GLU 25 HA GLU 25 10.014 -10.309 10.533 227 HB2 GLU 25 HB2 GLU 25 10.570 -8.372 9.155 228 HB3 GLU 25 HB3 GLU 25 9.910 -7.278 10.387 229 HG2 GLU 25 HG2 GLU 25 11.606 -7.999 11.996 230 HG3 GLU 25 HG3 GLU 25 12.204 -9.219 10.872 231 H GLN 26 H GLN 26 7.962 -7.713 12.032 232 HA GLN 26 HA GLN 26 9.268 -8.016 14.556 233 HB2 GLN 26 HB2 GLN 26 7.926 -6.270 15.324 234 HB3 GLN 26 HB3 GLN 26 8.181 -5.959 13.616 235 HG2 GLN 26 HG2 GLN 26 5.836 -7.223 13.375 236 HG3 GLN 26 HG3 GLN 26 5.677 -6.812 15.076 237 HE21 GLN 26 HE21 GLN 26 4.016 -4.069 13.252 238 HE22 GLN 26 HE22 GLN 26 3.677 -5.754 13.628 239 H HIS 27 H HIS 27 6.276 -9.501 13.326 240 HA HIS 27 HA HIS 27 6.177 -11.237 15.764 241 HB2 HIS 27 HB2 HIS 27 3.664 -9.998 14.600 242 HB3 HIS 27 HB3 HIS 27 3.789 -11.035 16.013 243 HD1 HIS 27 HD1 HIS 27 5.954 -9.469 17.724 244 HD2 HIS 27 HD2 HIS 27 2.686 -7.825 15.612 245 HE1 HIS 27 HE1 HIS 27 5.399 -7.226 18.862 246 HE2 HIS 27 HE2 HIS 27 3.448 -6.194 17.521 247 HA PRO 28 HA PRO 28 6.043 -13.633 11.756 248 HB2 PRO 28 HB2 PRO 28 7.502 -15.808 12.636 249 HB3 PRO 28 HB3 PRO 28 8.214 -14.311 11.966 250 HG2 PRO 28 HG2 PRO 28 7.797 -15.016 14.887 251 HG3 PRO 28 HG3 PRO 28 9.289 -14.405 14.097 252 HD2 PRO 28 HD2 PRO 28 7.653 -12.731 15.400 253 HD3 PRO 28 HD3 PRO 28 8.369 -12.232 13.838 254 H THR 29 H THR 29 5.054 -14.365 15.053 255 HA THR 29 HA THR 29 3.401 -16.647 14.477 256 HB THR 29 HB THR 29 2.473 -16.352 16.643 257 HG1 THR 29 HG1 THR 29 2.823 -14.424 17.804 258 HG21 THR 29 HG21 THR 29 5.354 -15.364 16.919 259 HG22 THR 29 HG22 THR 29 4.378 -16.259 18.105 260 HG23 THR 29 HG23 THR 29 4.893 -17.057 16.614 261 H LYS 30 H LYS 30 2.966 -13.434 13.458 262 HA LYS 30 HA LYS 30 0.043 -13.903 13.059 263 HB2 LYS 30 HB2 LYS 30 1.519 -11.292 13.522 264 HB3 LYS 30 HB3 LYS 30 -0.140 -11.391 12.909 265 HG2 LYS 30 HG2 LYS 30 -0.888 -12.536 14.932 266 HG3 LYS 30 HG3 LYS 30 0.764 -12.548 15.584 267 HD2 LYS 30 HD2 LYS 30 0.784 -10.100 15.714 268 HD3 LYS 30 HD3 LYS 30 -0.763 -10.003 14.868 269 HE2 LYS 30 HE2 LYS 30 -1.143 -9.628 17.232 270 HE3 LYS 30 HE3 LYS 30 -1.904 -11.140 16.746 271 HZ1 LYS 30 HZ1 LYS 30 -0.730 -11.373 18.849 272 HZ2 LYS 30 HZ2 LYS 30 0.009 -12.332 17.769 273 HZ3 LYS 30 HZ3 LYS 30 0.696 -10.914 18.207 274 H ILE 31 H ILE 31 -0.908 -13.291 11.204 275 HA ILE 31 HA ILE 31 0.830 -13.398 8.784 276 HB ILE 31 HB ILE 31 -2.015 -14.348 9.269 277 HG12 ILE 31 HG12 ILE 31 -0.533 -15.755 10.542 278 HG13 ILE 31 HG13 ILE 31 -1.135 -16.624 9.138 279 HG21 ILE 31 HG21 ILE 31 -0.222 -14.706 6.834 280 HG22 ILE 31 HG22 ILE 31 -1.792 -15.510 7.109 281 HG23 ILE 31 HG23 ILE 31 -1.720 -13.761 6.916 282 HD11 ILE 31 HD11 ILE 31 1.036 -16.325 7.979 283 HD12 ILE 31 HD12 ILE 31 1.666 -15.454 9.395 284 HD13 ILE 31 HD13 ILE 31 1.215 -17.157 9.529 285 HA PRO 32 HA PRO 32 -1.244 -9.470 7.719 286 HB2 PRO 32 HB2 PRO 32 -0.001 -8.951 5.342 287 HB3 PRO 32 HB3 PRO 32 0.813 -8.739 6.919 288 HG2 PRO 32 HG2 PRO 32 1.022 -11.092 5.020 289 HG3 PRO 32 HG3 PRO 32 2.339 -10.230 5.868 290 HD2 PRO 32 HD2 PRO 32 1.248 -12.572 6.775 291 HD3 PRO 32 HD3 PRO 32 1.896 -11.321 7.881 292 H VAL 33 H VAL 33 -3.308 -9.522 7.002 293 HA VAL 33 HA VAL 33 -3.976 -11.014 4.510 294 HB VAL 33 HB VAL 33 -5.779 -10.829 6.908 295 HG11 VAL 33 HG11 VAL 33 -7.004 -12.671 5.836 296 HG12 VAL 33 HG12 VAL 33 -6.965 -11.256 4.789 297 HG13 VAL 33 HG13 VAL 33 -5.875 -12.622 4.456 298 HG21 VAL 33 HG21 VAL 33 -5.281 -13.253 7.304 299 HG22 VAL 33 HG22 VAL 33 -3.927 -13.109 6.166 300 HG23 VAL 33 HG23 VAL 33 -3.937 -12.171 7.673 301 H ILE 34 H ILE 34 -5.354 -10.089 3.066 302 HA ILE 34 HA ILE 34 -6.611 -7.451 3.784 303 HB ILE 34 HB ILE 34 -5.553 -8.325 1.079 304 HG12 ILE 34 HG12 ILE 34 -4.615 -6.141 3.004 305 HG13 ILE 34 HG13 ILE 34 -3.773 -7.650 2.666 306 HG21 ILE 34 HG21 ILE 34 -6.962 -5.735 1.894 307 HG22 ILE 34 HG22 ILE 34 -6.250 -6.074 0.302 308 HG23 ILE 34 HG23 ILE 34 -7.631 -7.000 0.836 309 HD11 ILE 34 HD11 ILE 34 -3.596 -6.935 0.241 310 HD12 ILE 34 HD12 ILE 34 -4.153 -5.327 0.760 311 HD13 ILE 34 HD13 ILE 34 -2.654 -6.000 1.426 312 H ILE 35 H ILE 35 -8.784 -7.231 3.341 313 HA ILE 35 HA ILE 35 -10.218 -9.495 2.078 314 HB ILE 35 HB ILE 35 -10.425 -9.989 4.402 315 HG12 ILE 35 HG12 ILE 35 -13.017 -8.698 3.389 316 HG13 ILE 35 HG13 ILE 35 -12.389 -10.263 2.872 317 HG21 ILE 35 HG21 ILE 35 -9.933 -7.785 5.402 318 HG22 ILE 35 HG22 ILE 35 -11.493 -7.155 4.812 319 HG23 ILE 35 HG23 ILE 35 -11.441 -8.409 6.033 320 HD11 ILE 35 HD11 ILE 35 -14.076 -10.688 4.513 321 HD12 ILE 35 HD12 ILE 35 -12.514 -11.073 5.265 322 HD13 ILE 35 HD13 ILE 35 -13.363 -9.562 5.670 323 H GLU 36 H GLU 36 -11.638 -8.800 0.527 324 HA GLU 36 HA GLU 36 -12.961 -6.167 0.900 325 HB2 GLU 36 HB2 GLU 36 -10.956 -5.525 -0.199 326 HB3 GLU 36 HB3 GLU 36 -11.029 -6.876 -1.311 327 HG2 GLU 36 HG2 GLU 36 -11.418 -4.751 -2.388 328 HG3 GLU 36 HG3 GLU 36 -12.742 -5.865 -2.599 329 H ARG 37 H ARG 37 -14.890 -5.858 -0.111 330 HA ARG 37 HA ARG 37 -16.482 -8.081 -1.019 331 HB2 ARG 37 HB2 ARG 37 -17.514 -5.983 -0.249 332 HB3 ARG 37 HB3 ARG 37 -16.774 -5.088 -1.581 333 HG2 ARG 37 HG2 ARG 37 -18.123 -6.295 -3.234 334 HG3 ARG 37 HG3 ARG 37 -18.699 -7.415 -1.994 335 HD2 ARG 37 HD2 ARG 37 -20.437 -5.901 -2.516 336 HD3 ARG 37 HD3 ARG 37 -19.887 -5.555 -0.866 337 HE ARG 37 HE ARG 37 -18.450 -3.788 -2.504 338 HH11 ARG 37 HH11 ARG 37 -19.055 -1.648 -2.852 339 HH12 ARG 37 HH12 ARG 37 -20.729 -1.205 -2.773 340 HH21 ARG 37 HH21 ARG 37 -21.883 -4.338 -1.956 341 HH22 ARG 37 HH22 ARG 37 -22.286 -2.671 -2.282 342 H TYR 38 H TYR 38 -16.643 -9.131 -2.960 343 HA TYR 38 HA TYR 38 -14.579 -8.869 -4.801 344 HB2 TYR 38 HB2 TYR 38 -15.473 -10.968 -4.609 345 HB3 TYR 38 HB3 TYR 38 -17.116 -10.385 -4.851 346 HD1 TYR 38 HD1 TYR 38 -13.887 -10.346 -6.819 347 HD2 TYR 38 HD2 TYR 38 -18.141 -11.114 -6.802 348 HE1 TYR 38 HE1 TYR 38 -13.790 -10.917 -9.226 349 HE2 TYR 38 HE2 TYR 38 -18.027 -11.672 -9.238 350 HH TYR 38 HH TYR 38 -14.973 -11.585 -11.096 351 H LYS 39 H LYS 39 -14.030 -7.814 -6.542 352 HA LYS 39 HA LYS 39 -15.347 -5.384 -7.160 353 HB2 LYS 39 HB2 LYS 39 -13.150 -6.914 -8.622 354 HB3 LYS 39 HB3 LYS 39 -13.660 -5.279 -9.050 355 HG2 LYS 39 HG2 LYS 39 -13.017 -4.424 -6.850 356 HG3 LYS 39 HG3 LYS 39 -12.622 -6.050 -6.289 357 HD2 LYS 39 HD2 LYS 39 -10.581 -4.889 -6.823 358 HD3 LYS 39 HD3 LYS 39 -10.810 -6.223 -7.966 359 HE2 LYS 39 HE2 LYS 39 -11.677 -4.605 -9.662 360 HE3 LYS 39 HE3 LYS 39 -11.462 -3.281 -8.512 361 HZ1 LYS 39 HZ1 LYS 39 -9.264 -4.981 -9.604 362 HZ2 LYS 39 HZ2 LYS 39 -9.573 -3.443 -10.042 363 HZ3 LYS 39 HZ3 LYS 39 -9.051 -3.766 -8.528 364 H GLY 40 H GLY 40 -15.472 -8.453 -8.935 365 HA2 GLY 40 HA2 GLY 40 -16.757 -7.346 -11.290 366 HA3 GLY 40 HA3 GLY 40 -16.519 -9.044 -10.914 367 H GLU 41 H GLU 41 -18.050 -8.519 -8.251 368 HA GLU 41 HA GLU 41 -20.771 -7.906 -9.172 369 HB2 GLU 41 HB2 GLU 41 -20.575 -10.276 -9.763 370 HB3 GLU 41 HB3 GLU 41 -20.044 -10.656 -8.128 371 HG2 GLU 41 HG2 GLU 41 -22.384 -11.263 -8.439 372 HG3 GLU 41 HG3 GLU 41 -22.245 -10.008 -7.226 373 H LYS 42 H LYS 42 -20.658 -6.189 -7.797 374 HA LYS 42 HA LYS 42 -20.038 -6.398 -4.964 375 HB2 LYS 42 HB2 LYS 42 -21.082 -4.161 -6.736 376 HB3 LYS 42 HB3 LYS 42 -20.742 -3.947 -5.022 377 HG2 LYS 42 HG2 LYS 42 -18.388 -4.548 -5.329 378 HG3 LYS 42 HG3 LYS 42 -18.658 -4.866 -7.048 379 HD2 LYS 42 HD2 LYS 42 -19.268 -2.529 -7.436 380 HD3 LYS 42 HD3 LYS 42 -19.092 -2.159 -5.707 381 HE2 LYS 42 HE2 LYS 42 -16.685 -2.657 -5.793 382 HE3 LYS 42 HE3 LYS 42 -16.824 -3.206 -7.467 383 HZ1 LYS 42 HZ1 LYS 42 -17.443 -0.931 -8.107 384 HZ2 LYS 42 HZ2 LYS 42 -17.363 -0.413 -6.560 385 HZ3 LYS 42 HZ3 LYS 42 -16.009 -0.907 -7.330 386 H GLN 43 H GLN 43 -22.100 -8.193 -5.537 387 HA GLN 43 HA GLN 43 -24.719 -7.115 -5.169 388 HB2 GLN 43 HB2 GLN 43 -24.230 -9.202 -6.329 389 HB3 GLN 43 HB3 GLN 43 -23.688 -9.966 -4.821 390 HG2 GLN 43 HG2 GLN 43 -25.946 -9.826 -3.901 391 HG3 GLN 43 HG3 GLN 43 -26.469 -8.824 -5.261 392 HE21 GLN 43 HE21 GLN 43 -27.831 -12.063 -6.190 393 HE22 GLN 43 HE22 GLN 43 -28.198 -10.673 -5.179 394 H LEU 44 H LEU 44 -22.591 -8.753 -2.783 395 HA LEU 44 HA LEU 44 -24.371 -8.405 -0.535 396 HB2 LEU 44 HB2 LEU 44 -21.366 -8.864 -0.806 397 HB3 LEU 44 HB3 LEU 44 -22.143 -8.717 0.767 398 HG LEU 44 HG LEU 44 -22.774 -10.862 -1.294 399 HD11 LEU 44 HD11 LEU 44 -21.684 -12.355 0.368 400 HD12 LEU 44 HD12 LEU 44 -20.568 -11.134 -0.263 401 HD13 LEU 44 HD13 LEU 44 -21.268 -10.932 1.356 402 HD21 LEU 44 HD21 LEU 44 -23.771 -10.474 1.571 403 HD22 LEU 44 HD22 LEU 44 -24.765 -10.441 0.090 404 HD23 LEU 44 HD23 LEU 44 -24.003 -11.942 0.587 405 HA PRO 45 HA PRO 45 -23.498 -4.126 0.592 406 HB2 PRO 45 HB2 PRO 45 -23.716 -4.161 3.318 407 HB3 PRO 45 HB3 PRO 45 -25.125 -4.321 2.227 408 HG2 PRO 45 HG2 PRO 45 -23.562 -6.550 3.580 409 HG3 PRO 45 HG3 PRO 45 -25.339 -6.306 3.547 410 HD2 PRO 45 HD2 PRO 45 -24.098 -7.986 1.816 411 HD3 PRO 45 HD3 PRO 45 -25.489 -6.986 1.290 412 H VAL 46 H VAL 46 -21.713 -2.894 1.208 413 HA VAL 46 HA VAL 46 -19.260 -4.328 2.045 414 HB VAL 46 HB VAL 46 -19.212 -2.777 0.094 415 HG11 VAL 46 HG11 VAL 46 -20.529 -0.880 1.037 416 HG12 VAL 46 HG12 VAL 46 -19.200 -0.557 2.179 417 HG13 VAL 46 HG13 VAL 46 -18.934 -0.398 0.433 418 HG21 VAL 46 HG21 VAL 46 -17.180 -3.558 1.260 419 HG22 VAL 46 HG22 VAL 46 -17.001 -1.935 0.586 420 HG23 VAL 46 HG23 VAL 46 -17.257 -2.135 2.325 421 H LEU 47 H LEU 47 -18.108 -3.894 3.896 422 HA LEU 47 HA LEU 47 -19.202 -1.953 5.857 423 HB2 LEU 47 HB2 LEU 47 -18.589 -4.878 6.448 424 HB3 LEU 47 HB3 LEU 47 -18.708 -3.627 7.670 425 HG LEU 47 HG LEU 47 -21.093 -3.164 6.478 426 HD11 LEU 47 HD11 LEU 47 -20.857 -5.042 4.821 427 HD12 LEU 47 HD12 LEU 47 -20.717 -6.177 6.169 428 HD13 LEU 47 HD13 LEU 47 -22.216 -5.266 5.919 429 HD21 LEU 47 HD21 LEU 47 -20.525 -5.317 8.542 430 HD22 LEU 47 HD22 LEU 47 -20.775 -3.590 8.841 431 HD23 LEU 47 HD23 LEU 47 -22.113 -4.571 8.228 432 H ASP 48 H ASP 48 -17.638 -1.559 7.648 433 HA ASP 48 HA ASP 48 -15.404 -0.424 6.362 434 HB2 ASP 48 HB2 ASP 48 -14.856 0.499 8.634 435 HB3 ASP 48 HB3 ASP 48 -16.411 0.879 7.926 436 H LYS 49 H LYS 49 -15.303 -3.540 7.730 437 HA LYS 49 HA LYS 49 -12.428 -3.408 8.380 438 HB2 LYS 49 HB2 LYS 49 -14.410 -5.711 8.345 439 HB3 LYS 49 HB3 LYS 49 -12.682 -5.913 8.669 440 HG2 LYS 49 HG2 LYS 49 -12.815 -4.315 10.553 441 HG3 LYS 49 HG3 LYS 49 -14.553 -4.127 10.290 442 HD2 LYS 49 HD2 LYS 49 -14.921 -6.520 10.737 443 HD3 LYS 49 HD3 LYS 49 -13.205 -6.789 10.934 444 HE2 LYS 49 HE2 LYS 49 -14.985 -5.088 12.734 445 HE3 LYS 49 HE3 LYS 49 -14.346 -6.693 13.097 446 HZ1 LYS 49 HZ1 LYS 49 -12.039 -5.651 12.977 447 HZ2 LYS 49 HZ2 LYS 49 -12.771 -4.181 12.876 448 HZ3 LYS 49 HZ3 LYS 49 -12.971 -5.125 14.210 449 H THR 50 H THR 50 -10.998 -3.225 6.854 450 HA THR 50 HA THR 50 -11.201 -4.879 4.406 451 HB THR 50 HB THR 50 -9.528 -2.465 4.257 452 HG1 THR 50 HG1 THR 50 -11.362 -1.187 3.868 453 HG21 THR 50 HG21 THR 50 -9.800 -3.886 2.264 454 HG22 THR 50 HG22 THR 50 -11.569 -3.724 2.376 455 HG23 THR 50 HG23 THR 50 -10.568 -2.310 2.010 456 H LYS 51 H LYS 51 -9.303 -4.863 7.110 457 HA LYS 51 HA LYS 51 -7.177 -6.484 5.785 458 HB2 LYS 51 HB2 LYS 51 -6.587 -4.230 7.748 459 HB3 LYS 51 HB3 LYS 51 -5.405 -5.307 7.006 460 HG2 LYS 51 HG2 LYS 51 -5.847 -4.270 4.784 461 HG3 LYS 51 HG3 LYS 51 -7.081 -3.240 5.522 462 HD2 LYS 51 HD2 LYS 51 -5.166 -1.873 5.440 463 HD3 LYS 51 HD3 LYS 51 -5.293 -2.369 7.124 464 HE2 LYS 51 HE2 LYS 51 -3.627 -4.274 6.533 465 HE3 LYS 51 HE3 LYS 51 -3.417 -3.474 4.977 466 HZ1 LYS 51 HZ1 LYS 51 -2.725 -2.367 7.663 467 HZ2 LYS 51 HZ2 LYS 51 -1.706 -2.728 6.448 468 HZ3 LYS 51 HZ3 LYS 51 -2.717 -1.443 6.297 469 H PHE 52 H PHE 52 -6.047 -7.865 7.260 470 HA PHE 52 HA PHE 52 -6.782 -7.793 10.102 471 HB2 PHE 52 HB2 PHE 52 -7.221 -10.313 8.437 472 HB3 PHE 52 HB3 PHE 52 -7.210 -10.255 10.190 473 HD1 PHE 52 HD1 PHE 52 -8.842 -8.247 11.156 474 HD2 PHE 52 HD2 PHE 52 -9.338 -10.478 7.506 475 HE1 PHE 52 HE1 PHE 52 -11.252 -7.770 11.206 476 HE2 PHE 52 HE2 PHE 52 -11.775 -10.026 7.577 477 HZ PHE 52 HZ PHE 52 -12.744 -8.664 9.404 478 H LEU 53 H LEU 53 -5.203 -8.485 11.524 479 HA LEU 53 HA LEU 53 -2.723 -9.691 10.334 480 HB2 LEU 53 HB2 LEU 53 -2.920 -7.924 12.811 481 HB3 LEU 53 HB3 LEU 53 -1.483 -8.743 12.217 482 HG LEU 53 HG LEU 53 -2.941 -6.407 10.913 483 HD11 LEU 53 HD11 LEU 53 -0.680 -5.336 11.188 484 HD12 LEU 53 HD12 LEU 53 -1.462 -5.754 12.710 485 HD13 LEU 53 HD13 LEU 53 -0.141 -6.755 12.089 486 HD21 LEU 53 HD21 LEU 53 -0.703 -8.120 9.772 487 HD22 LEU 53 HD22 LEU 53 -2.273 -7.736 9.045 488 HD23 LEU 53 HD23 LEU 53 -1.065 -6.466 9.211 489 H VAL 54 H VAL 54 -3.481 -11.766 10.468 490 HA VAL 54 HA VAL 54 -5.034 -12.597 12.812 491 HB VAL 54 HB VAL 54 -4.371 -14.322 10.435 492 HG11 VAL 54 HG11 VAL 54 -6.695 -14.360 12.417 493 HG12 VAL 54 HG12 VAL 54 -6.453 -15.474 11.055 494 HG13 VAL 54 HG13 VAL 54 -5.327 -15.490 12.414 495 HG21 VAL 54 HG21 VAL 54 -6.747 -12.459 10.799 496 HG22 VAL 54 HG22 VAL 54 -5.465 -12.272 9.587 497 HG23 VAL 54 HG23 VAL 54 -6.558 -13.657 9.505 498 HA PRO 55 HA PRO 55 -1.565 -14.751 14.803 499 HB2 PRO 55 HB2 PRO 55 -3.783 -16.117 16.310 500 HB3 PRO 55 HB3 PRO 55 -2.294 -15.351 16.941 501 HG2 PRO 55 HG2 PRO 55 -4.689 -14.092 17.150 502 HG3 PRO 55 HG3 PRO 55 -3.219 -13.170 16.694 503 HD2 PRO 55 HD2 PRO 55 -5.390 -14.261 14.876 504 HD3 PRO 55 HD3 PRO 55 -4.642 -12.631 14.909 505 H ASP 56 H ASP 56 -0.559 -16.692 14.341 506 HA ASP 56 HA ASP 56 -1.462 -18.253 12.227 507 HB2 ASP 56 HB2 ASP 56 0.433 -19.756 12.727 508 HB3 ASP 56 HB3 ASP 56 0.836 -18.048 12.655 509 H HIS 57 H HIS 57 -2.199 -18.827 15.566 510 HA HIS 57 HA HIS 57 -3.001 -21.610 15.284 511 HB2 HIS 57 HB2 HIS 57 -3.386 -19.507 17.449 512 HB3 HIS 57 HB3 HIS 57 -4.145 -21.090 17.544 513 HD1 HIS 57 HD1 HIS 57 -0.423 -20.043 16.808 514 HD2 HIS 57 HD2 HIS 57 -2.874 -22.580 19.152 515 HE1 HIS 57 HE1 HIS 57 1.152 -21.394 18.329 516 HE2 HIS 57 HE2 HIS 57 -0.340 -22.944 19.739 517 H VAL 58 H VAL 58 -4.613 -18.735 14.290 518 HA VAL 58 HA VAL 58 -7.365 -19.706 14.559 519 HB VAL 58 HB VAL 58 -6.184 -17.556 12.779 520 HG11 VAL 58 HG11 VAL 58 -8.328 -18.215 11.844 521 HG12 VAL 58 HG12 VAL 58 -9.097 -18.131 13.457 522 HG13 VAL 58 HG13 VAL 58 -8.505 -16.661 12.650 523 HG21 VAL 58 HG21 VAL 58 -7.624 -17.363 15.461 524 HG22 VAL 58 HG22 VAL 58 -5.911 -17.008 15.175 525 HG23 VAL 58 HG23 VAL 58 -7.148 -15.980 14.451 526 H ASN 59 H ASN 59 -8.596 -20.833 13.009 527 HA ASN 59 HA ASN 59 -7.173 -21.759 10.536 528 HB2 ASN 59 HB2 ASN 59 -8.587 -23.702 10.544 529 HB3 ASN 59 HB3 ASN 59 -7.724 -23.594 12.073 530 HD21 ASN 59 HD21 ASN 59 -10.752 -23.715 13.891 531 HD22 ASN 59 HD22 ASN 59 -9.002 -23.840 13.923 532 H MET 60 H MET 60 -8.606 -22.108 8.611 533 HA MET 60 HA MET 60 -9.843 -19.624 7.973 534 HB2 MET 60 HB2 MET 60 -9.900 -22.332 6.615 535 HB3 MET 60 HB3 MET 60 -10.782 -20.961 5.950 536 HG2 MET 60 HG2 MET 60 -7.802 -21.143 6.434 537 HG3 MET 60 HG3 MET 60 -8.628 -21.148 4.876 538 HE1 MET 60 HE1 MET 60 -10.262 -19.010 4.198 539 HE2 MET 60 HE2 MET 60 -10.811 -18.542 5.829 540 HE3 MET 60 HE3 MET 60 -9.977 -17.361 4.804 541 H SER 61 H SER 61 -11.542 -22.719 8.768 542 HA SER 61 HA SER 61 -14.158 -21.708 8.455 543 HB2 SER 61 HB2 SER 61 -13.663 -24.072 8.786 544 HB3 SER 61 HB3 SER 61 -13.105 -23.765 10.438 545 HG SER 61 HG SER 61 -15.293 -24.516 10.350 546 H GLU 62 H GLU 62 -12.066 -21.558 11.381 547 HA GLU 62 HA GLU 62 -13.896 -20.151 13.044 548 HB2 GLU 62 HB2 GLU 62 -11.981 -21.309 13.958 549 HB3 GLU 62 HB3 GLU 62 -10.874 -20.284 13.055 550 HG2 GLU 62 HG2 GLU 62 -10.863 -19.609 15.352 551 HG3 GLU 62 HG3 GLU 62 -11.514 -18.313 14.368 552 H LEU 63 H LEU 63 -11.284 -18.800 10.938 553 HA LEU 63 HA LEU 63 -11.836 -16.030 11.405 554 HB2 LEU 63 HB2 LEU 63 -9.832 -16.914 10.188 555 HB3 LEU 63 HB3 LEU 63 -10.872 -17.457 8.883 556 HG LEU 63 HG LEU 63 -11.523 -14.992 8.515 557 HD11 LEU 63 HD11 LEU 63 -10.694 -14.109 10.698 558 HD12 LEU 63 HD12 LEU 63 -9.037 -14.575 10.243 559 HD13 LEU 63 HD13 LEU 63 -9.901 -13.321 9.325 560 HD21 LEU 63 HD21 LEU 63 -9.481 -14.492 7.229 561 HD22 LEU 63 HD22 LEU 63 -8.614 -15.787 8.088 562 HD23 LEU 63 HD23 LEU 63 -9.976 -16.167 7.008 563 H ILE 64 H ILE 64 -13.279 -18.313 9.078 564 HA ILE 64 HA ILE 64 -14.911 -16.398 7.733 565 HB ILE 64 HB ILE 64 -14.864 -19.412 7.918 566 HG12 ILE 64 HG12 ILE 64 -14.397 -17.424 5.660 567 HG13 ILE 64 HG13 ILE 64 -13.114 -18.010 6.694 568 HG21 ILE 64 HG21 ILE 64 -17.250 -18.888 7.567 569 HG22 ILE 64 HG22 ILE 64 -16.816 -17.819 6.209 570 HG23 ILE 64 HG23 ILE 64 -16.532 -19.575 6.124 571 HD11 ILE 64 HD11 ILE 64 -14.696 -19.598 4.677 572 HD12 ILE 64 HD12 ILE 64 -12.959 -19.294 4.732 573 HD13 ILE 64 HD13 ILE 64 -13.696 -20.376 5.942 574 H LYS 65 H LYS 65 -15.786 -18.473 10.566 575 HA LYS 65 HA LYS 65 -18.475 -17.388 10.615 576 HB2 LYS 65 HB2 LYS 65 -18.702 -18.362 12.864 577 HB3 LYS 65 HB3 LYS 65 -18.167 -19.485 11.613 578 HG2 LYS 65 HG2 LYS 65 -15.862 -19.312 12.406 579 HG3 LYS 65 HG3 LYS 65 -16.342 -18.214 13.696 580 HD2 LYS 65 HD2 LYS 65 -17.682 -20.926 13.425 581 HD3 LYS 65 HD3 LYS 65 -16.049 -20.868 14.046 582 HE2 LYS 65 HE2 LYS 65 -18.400 -19.359 15.284 583 HE3 LYS 65 HE3 LYS 65 -17.805 -20.938 15.804 584 HZ1 LYS 65 HZ1 LYS 65 -16.349 -18.361 16.001 585 HZ2 LYS 65 HZ2 LYS 65 -16.733 -19.397 17.199 586 HZ3 LYS 65 HZ3 LYS 65 -15.563 -19.788 16.108 587 H ILE 66 H ILE 66 -15.490 -16.191 12.265 588 HA ILE 66 HA ILE 66 -17.044 -14.085 13.566 589 HB ILE 66 HB ILE 66 -15.032 -14.642 14.602 590 HG12 ILE 66 HG12 ILE 66 -15.866 -12.215 14.593 591 HG13 ILE 66 HG13 ILE 66 -14.282 -12.588 15.238 592 HG21 ILE 66 HG21 ILE 66 -13.455 -13.759 12.155 593 HG22 ILE 66 HG22 ILE 66 -12.775 -14.101 13.762 594 HG23 ILE 66 HG23 ILE 66 -13.561 -15.384 12.855 595 HD11 ILE 66 HD11 ILE 66 -14.749 -11.290 12.521 596 HD12 ILE 66 HD12 ILE 66 -14.227 -10.493 14.008 597 HD13 ILE 66 HD13 ILE 66 -13.180 -11.684 13.237 598 H ILE 67 H ILE 67 -15.245 -14.141 10.439 599 HA ILE 67 HA ILE 67 -15.935 -11.437 9.751 600 HB ILE 67 HB ILE 67 -14.985 -13.836 8.226 601 HG12 ILE 67 HG12 ILE 67 -13.200 -12.320 7.533 602 HG13 ILE 67 HG13 ILE 67 -14.040 -10.931 8.222 603 HG21 ILE 67 HG21 ILE 67 -15.049 -12.620 6.079 604 HG22 ILE 67 HG22 ILE 67 -16.679 -12.950 6.668 605 HG23 ILE 67 HG23 ILE 67 -15.997 -11.317 6.831 606 HD11 ILE 67 HD11 ILE 67 -12.878 -13.227 9.835 607 HD12 ILE 67 HD12 ILE 67 -12.100 -11.686 9.561 608 HD13 ILE 67 HD13 ILE 67 -13.605 -11.734 10.489 609 H ARG 68 H ARG 68 -17.784 -14.470 9.020 610 HA ARG 68 HA ARG 68 -19.941 -13.223 7.668 611 HB2 ARG 68 HB2 ARG 68 -19.627 -15.671 7.773 612 HB3 ARG 68 HB3 ARG 68 -19.976 -15.667 9.505 613 HG2 ARG 68 HG2 ARG 68 -22.255 -14.769 9.024 614 HG3 ARG 68 HG3 ARG 68 -21.921 -14.862 7.294 615 HD2 ARG 68 HD2 ARG 68 -21.652 -17.352 8.970 616 HD3 ARG 68 HD3 ARG 68 -23.264 -16.727 8.681 617 HE ARG 68 HE ARG 68 -21.494 -18.024 6.750 618 HH11 ARG 68 HH11 ARG 68 -24.332 -15.926 6.918 619 HH12 ARG 68 HH12 ARG 68 -25.035 -16.621 5.485 620 HH21 ARG 68 HH21 ARG 68 -22.485 -18.852 4.913 621 HH22 ARG 68 HH22 ARG 68 -24.039 -18.243 4.435 622 H ARG 69 H ARG 69 -19.581 -13.699 11.199 623 HA ARG 69 HA ARG 69 -22.022 -12.335 11.909 624 HB2 ARG 69 HB2 ARG 69 -20.985 -13.896 13.416 625 HB3 ARG 69 HB3 ARG 69 -19.499 -12.970 13.482 626 HG2 ARG 69 HG2 ARG 69 -20.904 -12.773 15.524 627 HG3 ARG 69 HG3 ARG 69 -20.491 -11.233 14.796 628 HD2 ARG 69 HD2 ARG 69 -22.815 -11.337 15.655 629 HD3 ARG 69 HD3 ARG 69 -22.723 -10.919 13.953 630 HE ARG 69 HE ARG 69 -23.266 -13.735 14.830 631 HH11 ARG 69 HH11 ARG 69 -24.575 -10.873 13.156 632 HH12 ARG 69 HH12 ARG 69 -25.853 -11.861 12.466 633 HH21 ARG 69 HH21 ARG 69 -24.995 -14.794 13.875 634 HH22 ARG 69 HH22 ARG 69 -26.097 -13.873 12.866 635 H ARG 70 H ARG 70 -18.643 -11.045 11.731 636 HA ARG 70 HA ARG 70 -19.482 -8.356 12.473 637 HB2 ARG 70 HB2 ARG 70 -17.015 -9.274 10.926 638 HB3 ARG 70 HB3 ARG 70 -17.276 -7.646 11.558 639 HG2 ARG 70 HG2 ARG 70 -16.908 -10.189 13.174 640 HG3 ARG 70 HG3 ARG 70 -15.825 -8.816 13.060 641 HD2 ARG 70 HD2 ARG 70 -17.623 -7.427 14.209 642 HD3 ARG 70 HD3 ARG 70 -18.542 -8.920 14.424 643 HE ARG 70 HE ARG 70 -16.950 -9.767 15.937 644 HH11 ARG 70 HH11 ARG 70 -16.184 -6.404 15.173 645 HH12 ARG 70 HH12 ARG 70 -14.795 -6.443 16.263 646 HH21 ARG 70 HH21 ARG 70 -15.231 -9.546 17.436 647 HH22 ARG 70 HH22 ARG 70 -14.442 -7.964 17.511 648 H LEU 71 H LEU 71 -19.376 -9.912 9.293 649 HA LEU 71 HA LEU 71 -20.305 -7.497 7.921 650 HB2 LEU 71 HB2 LEU 71 -20.300 -10.423 7.094 651 HB3 LEU 71 HB3 LEU 71 -20.717 -9.084 6.033 652 HG LEU 71 HG LEU 71 -17.957 -9.491 7.265 653 HD11 LEU 71 HD11 LEU 71 -18.549 -11.231 5.613 654 HD12 LEU 71 HD12 LEU 71 -18.997 -9.969 4.435 655 HD13 LEU 71 HD13 LEU 71 -17.312 -10.131 4.969 656 HD21 LEU 71 HD21 LEU 71 -18.364 -7.135 6.788 657 HD22 LEU 71 HD22 LEU 71 -17.244 -7.814 5.607 658 HD23 LEU 71 HD23 LEU 71 -18.932 -7.541 5.143 659 H GLN 72 H GLN 72 -21.875 -9.449 10.121 660 HA GLN 72 HA GLN 72 -23.936 -9.957 10.713 661 HB2 GLN 72 HB2 GLN 72 -24.687 -7.392 9.285 662 HB3 GLN 72 HB3 GLN 72 -25.679 -8.223 10.471 663 HG2 GLN 72 HG2 GLN 72 -22.934 -7.019 11.036 664 HG3 GLN 72 HG3 GLN 72 -24.475 -6.275 11.412 665 HE21 GLN 72 HE21 GLN 72 -23.440 -7.689 14.613 666 HE22 GLN 72 HE22 GLN 72 -22.993 -6.361 13.552 667 H LEU 73 H LEU 73 -23.142 -11.338 8.419 668 HA LEU 73 HA LEU 73 -25.598 -11.597 6.746 669 HB2 LEU 73 HB2 LEU 73 -22.843 -12.834 6.405 670 HB3 LEU 73 HB3 LEU 73 -24.169 -12.904 5.245 671 HG LEU 73 HG LEU 73 -22.724 -10.375 6.151 672 HD11 LEU 73 HD11 LEU 73 -21.309 -11.847 4.799 673 HD12 LEU 73 HD12 LEU 73 -22.539 -11.808 3.495 674 HD13 LEU 73 HD13 LEU 73 -21.690 -10.325 3.977 675 HD21 LEU 73 HD21 LEU 73 -24.739 -10.727 3.894 676 HD22 LEU 73 HD22 LEU 73 -25.036 -9.857 5.423 677 HD23 LEU 73 HD23 LEU 73 -23.840 -9.244 4.282 678 H ASN 74 H ASN 74 -26.906 -12.460 8.415 679 HA ASN 74 HA ASN 74 -26.313 -14.683 10.039 680 HB2 ASN 74 HB2 ASN 74 -28.963 -13.596 8.987 681 HB3 ASN 74 HB3 ASN 74 -28.867 -14.825 10.248 682 HD21 ASN 74 HD21 ASN 74 -29.128 -11.397 11.801 683 HD22 ASN 74 HD22 ASN 74 -30.039 -12.158 10.503 684 H ALA 75 H ALA 75 -27.529 -16.838 10.057 685 HA ALA 75 HA ALA 75 -26.429 -18.473 8.120 686 HB1 ALA 75 HB1 ALA 75 -27.882 -20.225 9.088 687 HB2 ALA 75 HB2 ALA 75 -27.232 -19.170 10.359 688 HB3 ALA 75 HB3 ALA 75 -28.917 -18.978 9.818 689 H ASN 76 H ASN 76 -29.696 -17.067 7.991 690 HA ASN 76 HA ASN 76 -30.634 -18.543 5.696 691 HB2 ASN 76 HB2 ASN 76 -32.084 -17.484 7.388 692 HB3 ASN 76 HB3 ASN 76 -31.470 -15.887 6.954 693 HD21 ASN 76 HD21 ASN 76 -34.004 -15.515 4.554 694 HD22 ASN 76 HD22 ASN 76 -32.907 -14.778 5.715 695 H GLN 77 H GLN 77 -28.534 -15.744 5.964 696 HA GLN 77 HA GLN 77 -28.985 -14.799 3.212 697 HB2 GLN 77 HB2 GLN 77 -28.704 -13.139 4.925 698 HB3 GLN 77 HB3 GLN 77 -27.221 -13.879 5.504 699 HG2 GLN 77 HG2 GLN 77 -26.771 -11.841 4.276 700 HG3 GLN 77 HG3 GLN 77 -25.999 -13.233 3.522 701 HE21 GLN 77 HE21 GLN 77 -27.439 -12.334 0.403 702 HE22 GLN 77 HE22 GLN 77 -26.077 -13.044 1.268 703 H ALA 78 H ALA 78 -27.859 -15.457 1.483 704 HA ALA 78 HA ALA 78 -25.808 -17.451 1.587 705 HB1 ALA 78 HB1 ALA 78 -26.614 -15.555 -0.664 706 HB2 ALA 78 HB2 ALA 78 -25.620 -17.022 -0.832 707 HB3 ALA 78 HB3 ALA 78 -27.313 -17.160 -0.330 708 H PHE 79 H PHE 79 -23.627 -17.308 1.654 709 HA PHE 79 HA PHE 79 -22.144 -14.939 1.019 710 HB2 PHE 79 HB2 PHE 79 -22.662 -13.991 3.035 711 HB3 PHE 79 HB3 PHE 79 -22.675 -15.514 3.891 712 HD1 PHE 79 HD1 PHE 79 -20.435 -12.884 2.500 713 HD2 PHE 79 HD2 PHE 79 -20.677 -16.484 4.858 714 HE1 PHE 79 HE1 PHE 79 -18.125 -12.512 3.335 715 HE2 PHE 79 HE2 PHE 79 -18.354 -16.132 5.634 716 HZ PHE 79 HZ PHE 79 -17.070 -14.159 4.849 717 H PHE 80 H PHE 80 -20.090 -15.248 0.460 718 HA PHE 80 HA PHE 80 -18.689 -17.684 1.411 719 HB2 PHE 80 HB2 PHE 80 -18.950 -16.784 -1.459 720 HB3 PHE 80 HB3 PHE 80 -17.768 -17.956 -0.892 721 HD1 PHE 80 HD1 PHE 80 -18.445 -20.189 -0.048 722 HD2 PHE 80 HD2 PHE 80 -21.306 -17.405 -1.653 723 HE1 PHE 80 HE1 PHE 80 -20.086 -22.036 -0.327 724 HE2 PHE 80 HE2 PHE 80 -22.952 -19.249 -1.936 725 HZ PHE 80 HZ PHE 80 -22.333 -21.570 -1.282 726 H LEU 81 H LEU 81 -16.716 -17.375 2.169 727 HA LEU 81 HA LEU 81 -15.254 -14.857 1.558 728 HB2 LEU 81 HB2 LEU 81 -15.545 -15.619 3.909 729 HB3 LEU 81 HB3 LEU 81 -14.665 -17.087 3.519 730 HG LEU 81 HG LEU 81 -13.379 -15.420 4.800 731 HD11 LEU 81 HD11 LEU 81 -12.027 -15.711 2.104 732 HD12 LEU 81 HD12 LEU 81 -11.324 -15.648 3.718 733 HD13 LEU 81 HD13 LEU 81 -12.256 -17.074 3.239 734 HD21 LEU 81 HD21 LEU 81 -14.292 -13.343 3.772 735 HD22 LEU 81 HD22 LEU 81 -12.520 -13.383 3.859 736 HD23 LEU 81 HD23 LEU 81 -13.331 -13.671 2.310 737 H LEU 82 H LEU 82 -13.889 -14.854 -0.028 738 HA LEU 82 HA LEU 82 -13.080 -17.378 -1.357 739 HB2 LEU 82 HB2 LEU 82 -13.415 -14.580 -2.465 740 HB3 LEU 82 HB3 LEU 82 -13.103 -16.036 -3.391 741 HG LEU 82 HG LEU 82 -15.658 -15.353 -1.881 742 HD11 LEU 82 HD11 LEU 82 -15.395 -14.137 -3.996 743 HD12 LEU 82 HD12 LEU 82 -15.023 -15.656 -4.851 744 HD13 LEU 82 HD13 LEU 82 -16.632 -15.389 -4.161 745 HD21 LEU 82 HD21 LEU 82 -16.554 -17.415 -2.962 746 HD22 LEU 82 HD22 LEU 82 -14.909 -17.822 -3.491 747 HD23 LEU 82 HD23 LEU 82 -15.325 -17.768 -1.753 748 H VAL 83 H VAL 83 -11.102 -17.810 -0.366 749 HA VAL 83 HA VAL 83 -8.974 -15.770 -0.240 750 HB VAL 83 HB VAL 83 -8.651 -18.760 0.065 751 HG11 VAL 83 HG11 VAL 83 -6.598 -18.127 1.269 752 HG12 VAL 83 HG12 VAL 83 -6.547 -17.550 -0.397 753 HG13 VAL 83 HG13 VAL 83 -6.901 -16.410 0.919 754 HG21 VAL 83 HG21 VAL 83 -10.204 -18.012 1.801 755 HG22 VAL 83 HG22 VAL 83 -8.607 -18.267 2.524 756 HG23 VAL 83 HG23 VAL 83 -9.176 -16.620 2.169 757 H ASN 84 H ASN 84 -7.613 -15.260 -1.878 758 HA ASN 84 HA ASN 84 -7.124 -14.980 -4.101 759 HB2 ASN 84 HB2 ASN 84 -5.515 -16.692 -3.185 760 HB3 ASN 84 HB3 ASN 84 -6.509 -17.957 -3.914 761 HD21 ASN 84 HD21 ASN 84 -3.929 -17.515 -6.387 762 HD22 ASN 84 HD22 ASN 84 -4.293 -18.343 -4.861 763 H GLY 85 H GLY 85 -9.785 -15.022 -3.882 764 HA2 GLY 85 HA2 GLY 85 -11.640 -15.003 -5.197 765 HA3 GLY 85 HA3 GLY 85 -10.686 -15.670 -6.526 766 H HIS 86 H HIS 86 -10.616 -17.850 -3.862 767 HA HIS 86 HA HIS 86 -12.972 -19.372 -4.924 768 HB2 HIS 86 HB2 HIS 86 -10.178 -20.435 -4.356 769 HB3 HIS 86 HB3 HIS 86 -11.567 -21.418 -4.806 770 HD1 HIS 86 HD1 HIS 86 -9.045 -18.961 -6.357 771 HD2 HIS 86 HD2 HIS 86 -12.583 -21.053 -7.348 772 HE1 HIS 86 HE1 HIS 86 -9.289 -18.809 -8.911 773 HE2 HIS 86 HE2 HIS 86 -11.445 -20.057 -9.524 774 H SER 87 H SER 87 -14.191 -20.571 -3.536 775 HA SER 87 HA SER 87 -14.374 -19.632 -0.883 776 HB2 SER 87 HB2 SER 87 -16.297 -20.449 -2.063 777 HB3 SER 87 HB3 SER 87 -15.590 -22.080 -2.180 778 HG SER 87 HG SER 87 -16.950 -22.122 -0.438 779 H MET 88 H MET 88 -13.756 -20.256 1.059 780 HA MET 88 HA MET 88 -12.321 -22.870 1.426 781 HB2 MET 88 HB2 MET 88 -11.631 -20.210 2.714 782 HB3 MET 88 HB3 MET 88 -10.829 -21.747 3.037 783 HG2 MET 88 HG2 MET 88 -10.826 -20.250 0.397 784 HG3 MET 88 HG3 MET 88 -9.504 -20.366 1.553 785 HE1 MET 88 HE1 MET 88 -7.942 -20.959 -0.585 786 HE2 MET 88 HE2 MET 88 -8.321 -22.297 -1.688 787 HE3 MET 88 HE3 MET 88 -9.400 -20.887 -1.606 788 H VAL 89 H VAL 89 -15.246 -21.989 2.009 789 HA VAL 89 HA VAL 89 -15.492 -21.626 4.819 790 HB VAL 89 HB VAL 89 -17.828 -21.920 4.621 791 HG11 VAL 89 HG11 VAL 89 -16.891 -19.853 3.628 792 HG12 VAL 89 HG12 VAL 89 -16.856 -20.632 2.033 793 HG13 VAL 89 HG13 VAL 89 -18.402 -20.359 2.858 794 HG21 VAL 89 HG21 VAL 89 -18.938 -22.720 2.573 795 HG22 VAL 89 HG22 VAL 89 -17.368 -23.168 1.883 796 HG23 VAL 89 HG23 VAL 89 -17.986 -23.997 3.332 797 H SER 90 H SER 90 -15.070 -24.660 3.157 798 HA SER 90 HA SER 90 -15.759 -26.212 5.584 799 HB2 SER 90 HB2 SER 90 -14.791 -27.094 2.841 800 HB3 SER 90 HB3 SER 90 -15.283 -28.168 4.165 801 HG SER 90 HG SER 90 -17.008 -27.778 2.692 802 H VAL 91 H VAL 91 -13.013 -24.493 4.850 803 HA VAL 91 HA VAL 91 -11.022 -26.618 5.181 804 HB VAL 91 HB VAL 91 -10.729 -23.620 4.830 805 HG11 VAL 91 HG11 VAL 91 -8.592 -25.800 4.779 806 HG12 VAL 91 HG12 VAL 91 -8.366 -24.118 4.256 807 HG13 VAL 91 HG13 VAL 91 -8.718 -24.444 5.947 808 HG21 VAL 91 HG21 VAL 91 -10.334 -25.955 2.902 809 HG22 VAL 91 HG22 VAL 91 -11.667 -24.786 2.852 810 HG23 VAL 91 HG23 VAL 91 -10.014 -24.244 2.549 811 H SER 92 H SER 92 -10.422 -27.414 7.050 812 HA SER 92 HA SER 92 -10.605 -25.916 9.579 813 HB2 SER 92 HB2 SER 92 -10.065 -28.109 10.567 814 HB3 SER 92 HB3 SER 92 -11.437 -28.194 9.451 815 HG SER 92 HG SER 92 -9.923 -29.906 9.086 816 H THR 93 H THR 93 -8.142 -26.293 7.240 817 HA THR 93 HA THR 93 -5.938 -26.646 8.953 818 HB THR 93 HB THR 93 -6.106 -27.019 6.427 819 HG1 THR 93 HG1 THR 93 -3.897 -27.135 6.428 820 HG21 THR 93 HG21 THR 93 -4.656 -24.334 6.414 821 HG22 THR 93 HG22 THR 93 -4.994 -25.401 5.034 822 HG23 THR 93 HG23 THR 93 -6.320 -24.540 5.841 823 HA PRO 94 HA PRO 94 -5.043 -22.778 10.855 824 HB2 PRO 94 HB2 PRO 94 -2.130 -23.359 10.336 825 HB3 PRO 94 HB3 PRO 94 -2.934 -22.850 11.854 826 HG2 PRO 94 HG2 PRO 94 -2.246 -25.435 11.508 827 HG3 PRO 94 HG3 PRO 94 -3.863 -25.031 12.183 828 HD2 PRO 94 HD2 PRO 94 -3.145 -25.726 9.325 829 HD3 PRO 94 HD3 PRO 94 -4.458 -26.382 10.353 830 H ILE 95 H ILE 95 -4.575 -20.626 10.423 831 HA ILE 95 HA ILE 95 -4.723 -19.800 7.733 832 HB ILE 95 HB ILE 95 -5.617 -18.580 9.691 833 HG12 ILE 95 HG12 ILE 95 -4.984 -16.255 9.077 834 HG13 ILE 95 HG13 ILE 95 -3.709 -16.865 8.029 835 HG21 ILE 95 HG21 ILE 95 -3.709 -18.835 11.262 836 HG22 ILE 95 HG22 ILE 95 -2.734 -17.736 10.261 837 HG23 ILE 95 HG23 ILE 95 -4.182 -17.156 11.084 838 HD11 ILE 95 HD11 ILE 95 -6.686 -17.507 7.747 839 HD12 ILE 95 HD12 ILE 95 -5.824 -16.248 6.846 840 HD13 ILE 95 HD13 ILE 95 -5.399 -17.954 6.596 841 H SER 96 H SER 96 -1.826 -20.348 9.659 842 HA SER 96 HA SER 96 0.072 -18.935 8.027 843 HB2 SER 96 HB2 SER 96 1.693 -20.488 9.146 844 HB3 SER 96 HB3 SER 96 0.638 -19.594 10.256 845 HG SER 96 HG SER 96 0.826 -21.912 10.707 846 H GLU 97 H GLU 97 -1.204 -22.285 7.865 847 HA GLU 97 HA GLU 97 0.472 -23.150 5.670 848 HB2 GLU 97 HB2 GLU 97 -2.289 -24.129 6.510 849 HB3 GLU 97 HB3 GLU 97 -1.197 -24.972 5.431 850 HG2 GLU 97 HG2 GLU 97 -0.676 -24.367 8.381 851 HG3 GLU 97 HG3 GLU 97 -1.249 -25.894 7.729 852 H VAL 98 H VAL 98 -2.786 -21.696 5.821 853 HA VAL 98 HA VAL 98 -3.171 -21.592 2.963 854 HB VAL 98 HB VAL 98 -4.477 -19.729 4.959 855 HG11 VAL 98 HG11 VAL 98 -5.402 -20.826 2.261 856 HG12 VAL 98 HG12 VAL 98 -6.311 -19.722 3.322 857 HG13 VAL 98 HG13 VAL 98 -4.813 -19.172 2.549 858 HG21 VAL 98 HG21 VAL 98 -6.326 -21.503 4.863 859 HG22 VAL 98 HG22 VAL 98 -5.126 -22.602 4.191 860 HG23 VAL 98 HG23 VAL 98 -4.911 -21.922 5.824 861 H TYR 99 H TYR 99 -1.694 -19.252 5.233 862 HA TYR 99 HA TYR 99 -1.093 -17.285 3.290 863 HB2 TYR 99 HB2 TYR 99 -0.843 -16.461 5.319 864 HB3 TYR 99 HB3 TYR 99 -0.116 -17.898 6.001 865 HD1 TYR 99 HD1 TYR 99 0.601 -14.779 4.082 866 HD2 TYR 99 HD2 TYR 99 2.257 -18.279 6.013 867 HE1 TYR 99 HE1 TYR 99 2.875 -13.773 4.001 868 HE2 TYR 99 HE2 TYR 99 4.520 -17.259 5.915 869 HH TYR 99 HH TYR 99 5.142 -14.144 4.279 870 H GLU 100 H GLU 100 1.067 -19.993 4.225 871 HA GLU 100 HA GLU 100 3.051 -19.384 2.285 872 HB2 GLU 100 HB2 GLU 100 3.382 -20.865 4.179 873 HB3 GLU 100 HB3 GLU 100 2.230 -22.044 3.528 874 HG2 GLU 100 HG2 GLU 100 3.667 -22.501 1.626 875 HG3 GLU 100 HG3 GLU 100 4.757 -21.183 2.069 876 H SER 101 H SER 101 -0.020 -21.104 1.907 877 HA SER 101 HA SER 101 0.576 -22.048 -0.793 878 HB2 SER 101 HB2 SER 101 -2.017 -21.990 0.788 879 HB3 SER 101 HB3 SER 101 -1.766 -22.802 -0.767 880 HG SER 101 HG SER 101 -0.591 -23.396 1.751 881 H GLU 102 H GLU 102 -1.325 -19.308 0.525 882 HA GLU 102 HA GLU 102 -2.017 -18.451 -2.261 883 HB2 GLU 102 HB2 GLU 102 -3.704 -18.272 0.252 884 HB3 GLU 102 HB3 GLU 102 -4.191 -17.738 -1.348 885 HG2 GLU 102 HG2 GLU 102 -3.664 -20.607 -0.486 886 HG3 GLU 102 HG3 GLU 102 -5.225 -19.858 -0.745 887 H LYS 103 H LYS 103 0.110 -17.331 -0.103 888 HA LYS 103 HA LYS 103 -0.538 -14.562 0.030 889 HB2 LYS 103 HB2 LYS 103 1.715 -14.078 0.395 890 HB3 LYS 103 HB3 LYS 103 1.422 -15.594 1.195 891 HG2 LYS 103 HG2 LYS 103 2.934 -15.130 -1.412 892 HG3 LYS 103 HG3 LYS 103 3.608 -15.546 0.160 893 HD2 LYS 103 HD2 LYS 103 2.467 -17.763 0.050 894 HD3 LYS 103 HD3 LYS 103 1.904 -17.366 -1.586 895 HE2 LYS 103 HE2 LYS 103 4.314 -17.033 -2.264 896 HE3 LYS 103 HE3 LYS 103 4.799 -17.576 -0.653 897 HZ1 LYS 103 HZ1 LYS 103 3.331 -19.192 -2.687 898 HZ2 LYS 103 HZ2 LYS 103 4.858 -19.448 -2.164 899 HZ3 LYS 103 HZ3 LYS 103 3.593 -19.711 -1.152 900 H ASP 104 H ASP 104 -0.455 -12.872 -1.337 901 HA ASP 104 HA ASP 104 -0.297 -13.443 -4.236 902 HB2 ASP 104 HB2 ASP 104 -2.139 -12.166 -3.122 903 HB3 ASP 104 HB3 ASP 104 -0.975 -10.892 -2.734 904 H GLU 105 H GLU 105 0.758 -11.391 -5.419 905 HA GLU 105 HA GLU 105 3.374 -11.896 -5.684 906 HB2 GLU 105 HB2 GLU 105 1.982 -10.599 -7.233 907 HB3 GLU 105 HB3 GLU 105 1.975 -9.236 -6.115 908 HG2 GLU 105 HG2 GLU 105 3.466 -8.741 -7.908 909 HG3 GLU 105 HG3 GLU 105 4.399 -8.907 -6.432 910 H ASP 106 H ASP 106 2.250 -9.344 -3.456 911 HA ASP 106 HA ASP 106 5.020 -9.047 -2.503 912 HB2 ASP 106 HB2 ASP 106 2.963 -6.947 -2.829 913 HB3 ASP 106 HB3 ASP 106 4.233 -6.756 -1.635 914 H GLY 107 H GLY 107 3.231 -11.100 -1.594 915 HA2 GLY 107 HA2 GLY 107 3.663 -12.391 0.273 916 HA3 GLY 107 HA3 GLY 107 4.357 -11.005 1.103 917 H PHE 108 H PHE 108 1.366 -9.838 0.262 918 HA PHE 108 HA PHE 108 0.177 -10.581 2.830 919 HB2 PHE 108 HB2 PHE 108 -1.792 -9.214 2.051 920 HB3 PHE 108 HB3 PHE 108 -0.274 -8.402 2.373 921 HD1 PHE 108 HD1 PHE 108 0.946 -7.206 0.638 922 HD2 PHE 108 HD2 PHE 108 -2.530 -9.576 -0.338 923 HE1 PHE 108 HE1 PHE 108 0.899 -6.207 -1.627 924 HE2 PHE 108 HE2 PHE 108 -2.589 -8.545 -2.593 925 HZ PHE 108 HZ PHE 108 -0.883 -6.874 -3.244 926 H LEU 109 H LEU 109 -1.534 -11.930 3.331 927 HA LEU 109 HA LEU 109 -2.295 -13.894 1.278 928 HB2 LEU 109 HB2 LEU 109 -1.940 -14.669 3.523 929 HB3 LEU 109 HB3 LEU 109 -3.084 -13.491 4.165 930 HG LEU 109 HG LEU 109 -4.965 -14.642 3.092 931 HD11 LEU 109 HD11 LEU 109 -3.946 -15.564 1.061 932 HD12 LEU 109 HD12 LEU 109 -2.856 -16.578 2.031 933 HD13 LEU 109 HD13 LEU 109 -4.605 -16.871 2.033 934 HD21 LEU 109 HD21 LEU 109 -4.899 -16.721 4.393 935 HD22 LEU 109 HD22 LEU 109 -3.142 -16.597 4.555 936 HD23 LEU 109 HD23 LEU 109 -4.187 -15.388 5.330 937 H TYR 110 H TYR 110 -3.731 -13.440 -0.221 938 HA TYR 110 HA TYR 110 -5.563 -11.191 0.133 939 HB2 TYR 110 HB2 TYR 110 -4.311 -10.868 -1.703 940 HB3 TYR 110 HB3 TYR 110 -4.354 -12.550 -2.187 941 HD1 TYR 110 HD1 TYR 110 -5.549 -13.134 -4.048 942 HD2 TYR 110 HD2 TYR 110 -6.727 -9.639 -1.810 943 HE1 TYR 110 HE1 TYR 110 -7.266 -12.612 -5.777 944 HE2 TYR 110 HE2 TYR 110 -8.438 -9.108 -3.548 945 HH TYR 110 HH TYR 110 -8.817 -11.070 -6.520 946 H MET 111 H MET 111 -7.634 -11.171 0.565 947 HA MET 111 HA MET 111 -9.292 -13.536 -0.199 948 HB2 MET 111 HB2 MET 111 -9.644 -11.957 2.380 949 HB3 MET 111 HB3 MET 111 -10.466 -13.430 1.885 950 HG2 MET 111 HG2 MET 111 -8.216 -14.605 2.028 951 HG3 MET 111 HG3 MET 111 -7.576 -13.129 2.764 952 HE1 MET 111 HE1 MET 111 -7.863 -15.897 5.606 953 HE2 MET 111 HE2 MET 111 -7.566 -16.181 3.880 954 HE3 MET 111 HE3 MET 111 -6.732 -14.857 4.723 955 H VAL 112 H VAL 112 -11.340 -13.109 -0.944 956 HA VAL 112 HA VAL 112 -12.397 -10.379 -0.624 957 HB VAL 112 HB VAL 112 -13.296 -10.233 -2.853 958 HG11 VAL 112 HG11 VAL 112 -10.989 -9.399 -2.478 959 HG12 VAL 112 HG12 VAL 112 -10.362 -10.961 -3.063 960 HG13 VAL 112 HG13 VAL 112 -11.283 -9.907 -4.151 961 HG21 VAL 112 HG21 VAL 112 -13.726 -12.538 -3.410 962 HG22 VAL 112 HG22 VAL 112 -12.695 -11.801 -4.641 963 HG23 VAL 112 HG23 VAL 112 -11.975 -12.898 -3.442 964 H TYR 113 H TYR 113 -14.897 -10.322 -0.981 965 HA TYR 113 HA TYR 113 -16.044 -13.021 -0.464 966 HB2 TYR 113 HB2 TYR 113 -17.606 -12.161 1.195 967 HB3 TYR 113 HB3 TYR 113 -15.933 -12.140 1.717 968 HD1 TYR 113 HD1 TYR 113 -14.791 -10.048 2.245 969 HD2 TYR 113 HD2 TYR 113 -18.773 -10.036 0.618 970 HE1 TYR 113 HE1 TYR 113 -15.067 -7.664 2.918 971 HE2 TYR 113 HE2 TYR 113 -19.040 -7.661 1.234 972 HH TYR 113 HH TYR 113 -16.453 -5.849 2.987 973 H ALA 114 H ALA 114 -18.180 -13.459 -0.988 974 HA ALA 114 HA ALA 114 -19.711 -11.511 -2.575 975 HB1 ALA 114 HB1 ALA 114 -19.473 -12.652 -4.673 976 HB2 ALA 114 HB2 ALA 114 -17.851 -12.336 -4.062 977 HB3 ALA 114 HB3 ALA 114 -18.524 -13.970 -3.924 978 H SER 115 H SER 115 -21.641 -12.659 -3.642 979 HA SER 115 HA SER 115 -22.995 -14.466 -1.780 980 HB2 SER 115 HB2 SER 115 -23.789 -13.053 -4.342 981 HB3 SER 115 HB3 SER 115 -24.854 -14.219 -3.522 982 HG SER 115 HG SER 115 -25.350 -12.220 -2.705 983 H GLN 116 H GLN 116 -20.636 -15.303 -3.777 984 HA GLN 116 HA GLN 116 -21.788 -17.899 -4.595 985 HB2 GLN 116 HB2 GLN 116 -20.988 -17.643 -6.876 986 HB3 GLN 116 HB3 GLN 116 -22.224 -16.455 -6.518 987 HG2 GLN 116 HG2 GLN 116 -19.271 -15.709 -6.371 988 HG3 GLN 116 HG3 GLN 116 -20.108 -15.832 -7.906 989 HE21 GLN 116 HE21 GLN 116 -20.471 -12.317 -7.211 990 HE22 GLN 116 HE22 GLN 116 -19.276 -13.455 -7.844 991 H GLU 117 H GLU 117 -20.266 -19.555 -4.930 992 HA GLU 117 HA GLU 117 -17.995 -19.353 -3.191 993 HB2 GLU 117 HB2 GLU 117 -17.662 -21.715 -3.707 994 HB3 GLU 117 HB3 GLU 117 -19.354 -21.359 -3.340 995 HG2 GLU 117 HG2 GLU 117 -19.861 -21.382 -5.789 996 HG3 GLU 117 HG3 GLU 117 -18.173 -21.770 -6.121 997 H THR 118 H THR 118 -18.138 -18.686 -6.545 998 HA THR 118 HA THR 118 -15.234 -18.503 -6.789 999 HB THR 118 HB THR 118 -15.687 -20.925 -7.191 1000 HG1 THR 118 HG1 THR 118 -14.439 -20.957 -9.082 1001 HG21 THR 118 HG21 THR 118 -16.689 -21.669 -9.264 1002 HG22 THR 118 HG22 THR 118 -17.887 -20.687 -8.413 1003 HG23 THR 118 HG23 THR 118 -17.002 -20.004 -9.792 1004 H PHE 119 H PHE 119 -14.519 -17.732 -8.875 1005 HA PHE 119 HA PHE 119 -16.539 -16.644 -10.665 1006 HB2 PHE 119 HB2 PHE 119 -15.350 -14.455 -10.986 1007 HB3 PHE 119 HB3 PHE 119 -16.407 -14.696 -9.629 1008 HD1 PHE 119 HD1 PHE 119 -12.829 -14.504 -10.608 1009 HD2 PHE 119 HD2 PHE 119 -15.670 -14.423 -7.368 1010 HE1 PHE 119 HE1 PHE 119 -11.082 -13.587 -9.104 1011 HE2 PHE 119 HE2 PHE 119 -13.931 -13.497 -5.868 1012 HZ PHE 119 HZ PHE 119 -11.638 -13.049 -6.736 1013 H GLY 120 H GLY 120 -14.610 -18.853 -10.676 1014 HA2 GLY 120 HA2 GLY 120 -13.956 -20.071 -12.617 1015 HA3 GLY 120 HA3 GLY 120 -13.735 -18.570 -13.513 1016 H1 ASP 10 H1 ASP 10 -10.957 1.234 20.015 1017 H2 ASP 10 H2 ASP 10 -11.076 0.708 18.464 1018 H3 ASP 10 H3 ASP 10 -11.002 -0.378 19.689 1019 HA ASP 10 HA ASP 10 -8.899 1.509 18.925 1020 HB2 ASP 10 HB2 ASP 10 -8.826 -0.545 21.118 1021 HB3 ASP 10 HB3 ASP 10 -7.378 0.139 20.386 1022 H TYR 11 H TYR 11 -8.729 -2.065 19.243 1023 HA TYR 11 HA TYR 11 -7.047 -2.023 16.923 1024 HB2 TYR 11 HB2 TYR 11 -7.650 -4.182 18.882 1025 HB3 TYR 11 HB3 TYR 11 -6.745 -4.492 17.409 1026 HD1 TYR 11 HD1 TYR 11 -4.865 -2.604 16.837 1027 HD2 TYR 11 HD2 TYR 11 -6.333 -3.648 20.768 1028 HE1 TYR 11 HE1 TYR 11 -2.801 -1.658 17.872 1029 HE2 TYR 11 HE2 TYR 11 -4.243 -2.750 21.782 1030 HH TYR 11 HH TYR 11 -1.649 -1.251 19.811 1031 H GLU 12 H GLU 12 -8.989 -1.143 15.729 1032 HA GLU 12 HA GLU 12 -9.716 -3.353 13.842 1033 HB2 GLU 12 HB2 GLU 12 -11.858 -2.276 13.427 1034 HB3 GLU 12 HB3 GLU 12 -11.718 -2.807 15.091 1035 HG2 GLU 12 HG2 GLU 12 -11.136 0.070 14.256 1036 HG3 GLU 12 HG3 GLU 12 -12.778 -0.491 14.509 1037 H SER 13 H SER 13 -7.827 -0.806 14.077 1038 HA SER 13 HA SER 13 -6.892 -0.775 11.501 1039 HB2 SER 13 HB2 SER 13 -8.935 0.431 10.747 1040 HB3 SER 13 HB3 SER 13 -8.651 1.674 11.984 1041 HG SER 13 HG SER 13 -6.930 1.047 9.770 1042 H ASP 14 H ASP 14 -4.817 -0.269 11.974 1043 HA ASP 14 HA ASP 14 -4.115 2.287 13.178 1044 HB2 ASP 14 HB2 ASP 14 -4.556 0.554 15.115 1045 HB3 ASP 14 HB3 ASP 14 -3.091 -0.220 14.545 1046 H ASP 15 H ASP 15 -1.511 1.933 13.568 1047 HA ASP 15 HA ASP 15 -0.266 0.654 11.167 1048 HB2 ASP 15 HB2 ASP 15 -0.694 3.087 10.822 1049 HB3 ASP 15 HB3 ASP 15 0.244 3.445 12.271 1050 H ASP 16 H ASP 16 2.201 0.705 11.428 1051 HA ASP 16 HA ASP 16 3.985 -0.218 12.331 1052 HB2 ASP 16 HB2 ASP 16 4.471 1.729 13.356 1053 HB3 ASP 16 HB3 ASP 16 3.221 1.550 14.576 1054 H SER 17 H SER 17 2.377 -0.743 15.444 1055 HA SER 17 HA SER 17 2.459 -3.696 14.954 1056 HB2 SER 17 HB2 SER 17 4.418 -3.149 16.295 1057 HB3 SER 17 HB3 SER 17 3.415 -2.232 17.433 1058 HG SER 17 HG SER 17 3.314 -4.089 18.425 1059 H TYR 18 H TYR 18 0.397 -4.373 14.961 1060 HA TYR 18 HA TYR 18 -1.515 -3.484 17.002 1061 HB2 TYR 18 HB2 TYR 18 -3.004 -2.392 15.408 1062 HB3 TYR 18 HB3 TYR 18 -1.459 -1.603 15.431 1063 HD1 TYR 18 HD1 TYR 18 0.218 -2.080 13.495 1064 HD2 TYR 18 HD2 TYR 18 -3.967 -3.081 13.391 1065 HE1 TYR 18 HE1 TYR 18 0.348 -2.274 11.020 1066 HE2 TYR 18 HE2 TYR 18 -3.846 -3.215 10.877 1067 HH TYR 18 HH TYR 18 -0.761 -2.915 9.101 1068 H GLU 19 H GLU 19 -3.855 -4.125 16.047 1069 HA GLU 19 HA GLU 19 -3.912 -6.681 14.616 1070 HB2 GLU 19 HB2 GLU 19 -3.714 -6.917 17.254 1071 HB3 GLU 19 HB3 GLU 19 -5.419 -6.509 17.248 1072 HG2 GLU 19 HG2 GLU 19 -4.215 -8.757 15.566 1073 HG3 GLU 19 HG3 GLU 19 -4.693 -9.002 17.234 1074 H VAL 20 H VAL 20 -6.337 -7.168 14.073 1075 HA VAL 20 HA VAL 20 -7.856 -4.657 13.679 1076 HB VAL 20 HB VAL 20 -7.675 -6.313 11.259 1077 HG11 VAL 20 HG11 VAL 20 -7.634 -3.311 11.693 1078 HG12 VAL 20 HG12 VAL 20 -7.839 -4.146 10.145 1079 HG13 VAL 20 HG13 VAL 20 -9.100 -4.279 11.372 1080 HG21 VAL 20 HG21 VAL 20 -5.444 -4.416 12.021 1081 HG22 VAL 20 HG22 VAL 20 -5.271 -6.164 11.767 1082 HG23 VAL 20 HG23 VAL 20 -5.687 -5.119 10.405 1083 H LEU 21 H LEU 21 -8.064 -8.015 14.238 1084 HA LEU 21 HA LEU 21 -10.934 -8.337 13.671 1085 HB2 LEU 21 HB2 LEU 21 -8.881 -9.939 15.224 1086 HB3 LEU 21 HB3 LEU 21 -10.526 -10.486 14.957 1087 HG LEU 21 HG LEU 21 -8.651 -9.943 12.631 1088 HD11 LEU 21 HD11 LEU 21 -8.132 -12.365 12.658 1089 HD12 LEU 21 HD12 LEU 21 -7.482 -11.510 14.069 1090 HD13 LEU 21 HD13 LEU 21 -8.944 -12.517 14.226 1091 HD21 LEU 21 HD21 LEU 21 -11.159 -10.310 12.263 1092 HD22 LEU 21 HD22 LEU 21 -10.100 -11.466 11.441 1093 HD23 LEU 21 HD23 LEU 21 -10.934 -11.937 12.935 1094 H ASP 22 H ASP 22 -9.445 -6.349 15.778 1095 HA ASP 22 HA ASP 22 -9.474 -5.705 17.847 1096 HB2 ASP 22 HB2 ASP 22 -11.676 -4.965 18.760 1097 HB3 ASP 22 HB3 ASP 22 -11.180 -4.395 17.185 1098 H LEU 23 H LEU 23 -9.059 -8.540 17.818 1099 HA LEU 23 HA LEU 23 -9.928 -9.189 20.608 1100 HB2 LEU 23 HB2 LEU 23 -9.362 -11.560 20.063 1101 HB3 LEU 23 HB3 LEU 23 -10.779 -10.844 19.329 1102 HG LEU 23 HG LEU 23 -9.432 -10.531 17.203 1103 HD11 LEU 23 HD11 LEU 23 -7.561 -12.095 16.823 1104 HD12 LEU 23 HD12 LEU 23 -7.145 -10.908 18.054 1105 HD13 LEU 23 HD13 LEU 23 -7.596 -12.567 18.535 1106 HD21 LEU 23 HD21 LEU 23 -11.156 -12.254 17.451 1107 HD22 LEU 23 HD22 LEU 23 -9.811 -12.858 16.488 1108 HD23 LEU 23 HD23 LEU 23 -9.967 -13.350 18.188 1109 H THR 24 H THR 24 -7.106 -8.498 18.677 1110 HA THR 24 HA THR 24 -4.958 -8.290 19.235 1111 HB THR 24 HB THR 24 -6.241 -6.368 20.126 1112 HG1 THR 24 HG1 THR 24 -4.283 -5.434 20.683 1113 HG21 THR 24 HG21 THR 24 -5.977 -5.716 22.398 1114 HG22 THR 24 HG22 THR 24 -6.792 -7.281 22.408 1115 HG23 THR 24 HG23 THR 24 -5.064 -7.171 22.815 1116 H GLU 25 H GLU 25 -5.505 -10.908 19.697 1117 HA GLU 25 HA GLU 25 -4.419 -11.877 22.143 1118 HB2 GLU 25 HB2 GLU 25 -4.779 -13.142 19.409 1119 HB3 GLU 25 HB3 GLU 25 -4.115 -14.043 20.762 1120 HG2 GLU 25 HG2 GLU 25 -6.836 -12.677 20.775 1121 HG3 GLU 25 HG3 GLU 25 -6.560 -14.372 20.396 1122 H TYR 26 H TYR 26 -2.533 -13.075 22.567 1123 HA TYR 26 HA TYR 26 -0.239 -11.614 22.331 1124 HB2 TYR 26 HB2 TYR 26 -0.377 -12.969 24.147 1125 HB3 TYR 26 HB3 TYR 26 -0.713 -14.408 23.201 1126 HD1 TYR 26 HD1 TYR 26 1.975 -12.133 24.353 1127 HD2 TYR 26 HD2 TYR 26 1.035 -15.768 22.222 1128 HE1 TYR 26 HE1 TYR 26 4.363 -12.819 24.473 1129 HE2 TYR 26 HE2 TYR 26 3.429 -16.461 22.349 1130 HH TYR 26 HH TYR 26 5.929 -14.427 23.928 Start of MODEL 18 1 H1 MET 1 H1 MET 1 -6.799 1.574 5.121 2 H2 MET 1 H2 MET 1 -5.885 2.677 5.922 3 H3 MET 1 H3 MET 1 -6.681 1.505 6.754 4 HA MET 1 HA MET 1 -7.814 3.660 6.973 5 HB2 MET 1 HB2 MET 1 -7.130 4.625 4.863 6 HB3 MET 1 HB3 MET 1 -8.074 3.450 3.949 7 HG2 MET 1 HG2 MET 1 -10.164 4.361 4.829 8 HG3 MET 1 HG3 MET 1 -9.277 5.425 5.932 9 HE1 MET 1 HE1 MET 1 -11.638 6.301 3.908 10 HE2 MET 1 HE2 MET 1 -10.845 7.394 5.070 11 HE3 MET 1 HE3 MET 1 -10.991 7.867 3.361 12 HA PRO 2 HA PRO 2 -10.897 0.381 7.367 13 HB2 PRO 2 HB2 PRO 2 -12.071 2.133 9.484 14 HB3 PRO 2 HB3 PRO 2 -11.540 0.431 9.594 15 HG2 PRO 2 HG2 PRO 2 -10.091 2.422 10.731 16 HG3 PRO 2 HG3 PRO 2 -9.298 1.042 9.911 17 HD2 PRO 2 HD2 PRO 2 -9.852 3.804 8.812 18 HD3 PRO 2 HD3 PRO 2 -8.336 2.848 8.777 19 H SER 3 H SER 3 -11.933 3.822 7.478 20 HA SER 3 HA SER 3 -14.646 3.429 7.132 21 HB2 SER 3 HB2 SER 3 -12.971 5.842 6.348 22 HB3 SER 3 HB3 SER 3 -14.733 5.828 6.546 23 HG SER 3 HG SER 3 -13.681 6.519 8.472 24 H GLU 4 H GLU 4 -15.890 2.767 5.619 25 HA GLU 4 HA GLU 4 -16.972 2.349 3.714 26 HB2 GLU 4 HB2 GLU 4 -17.316 4.742 3.993 27 HB3 GLU 4 HB3 GLU 4 -15.903 5.076 2.991 28 HG2 GLU 4 HG2 GLU 4 -17.074 3.869 1.079 29 HG3 GLU 4 HG3 GLU 4 -18.492 3.730 2.124 30 H LYS 5 H LYS 5 -14.081 3.858 2.298 31 HA LYS 5 HA LYS 5 -14.454 2.357 -0.195 32 HB2 LYS 5 HB2 LYS 5 -12.360 4.409 0.645 33 HB3 LYS 5 HB3 LYS 5 -12.554 3.764 -0.990 34 HG2 LYS 5 HG2 LYS 5 -14.875 4.672 -1.069 35 HG3 LYS 5 HG3 LYS 5 -14.647 5.372 0.547 36 HD2 LYS 5 HD2 LYS 5 -12.800 6.780 -0.308 37 HD3 LYS 5 HD3 LYS 5 -12.957 6.035 -1.899 38 HE2 LYS 5 HE2 LYS 5 -14.019 8.164 -2.000 39 HE3 LYS 5 HE3 LYS 5 -15.264 6.923 -2.113 40 HZ1 LYS 5 HZ1 LYS 5 -14.620 8.416 0.389 41 HZ2 LYS 5 HZ2 LYS 5 -15.872 8.751 -0.598 42 HZ3 LYS 5 HZ3 LYS 5 -15.859 7.343 0.217 43 H THR 6 H THR 6 -12.737 1.271 -1.327 44 HA THR 6 HA THR 6 -11.285 -0.636 0.287 45 HB THR 6 HB THR 6 -10.653 -1.790 -1.528 46 HG1 THR 6 HG1 THR 6 -10.408 -0.830 -3.604 47 HG21 THR 6 HG21 THR 6 -12.990 -0.305 -2.802 48 HG22 THR 6 HG22 THR 6 -12.432 -1.951 -3.137 49 HG23 THR 6 HG23 THR 6 -13.172 -1.586 -1.574 50 H PHE 7 H PHE 7 -8.886 -1.057 0.123 51 HA PHE 7 HA PHE 7 -7.538 1.263 1.142 52 HB2 PHE 7 HB2 PHE 7 -5.553 -0.162 1.228 53 HB3 PHE 7 HB3 PHE 7 -6.959 -0.998 1.850 54 HD1 PHE 7 HD1 PHE 7 -7.672 -3.098 0.903 55 HD2 PHE 7 HD2 PHE 7 -4.728 -0.683 -1.140 56 HE1 PHE 7 HE1 PHE 7 -7.295 -4.928 -0.731 57 HE2 PHE 7 HE2 PHE 7 -4.358 -2.522 -2.769 58 HZ PHE 7 HZ PHE 7 -5.632 -4.649 -2.557 59 H LYS 8 H LYS 8 -7.847 0.130 -2.176 60 HA LYS 8 HA LYS 8 -5.325 0.990 -3.163 61 HB2 LYS 8 HB2 LYS 8 -6.806 -0.654 -4.237 62 HB3 LYS 8 HB3 LYS 8 -7.997 0.596 -4.574 63 HG2 LYS 8 HG2 LYS 8 -6.778 0.021 -6.579 64 HG3 LYS 8 HG3 LYS 8 -6.449 1.696 -6.151 65 HD2 LYS 8 HD2 LYS 8 -4.263 0.950 -5.113 66 HD3 LYS 8 HD3 LYS 8 -4.599 -0.695 -5.658 67 HE2 LYS 8 HE2 LYS 8 -4.307 1.763 -7.456 68 HE3 LYS 8 HE3 LYS 8 -3.025 0.606 -7.114 69 HZ1 LYS 8 HZ1 LYS 8 -4.409 -1.136 -8.171 70 HZ2 LYS 8 HZ2 LYS 8 -5.565 -0.039 -8.540 71 HZ3 LYS 8 HZ3 LYS 8 -4.092 0.075 -9.215 72 H GLN 9 H GLN 9 -8.105 2.899 -2.455 73 HA GLN 9 HA GLN 9 -7.529 5.277 -3.922 74 HB2 GLN 9 HB2 GLN 9 -9.639 4.866 -2.939 75 HB3 GLN 9 HB3 GLN 9 -8.986 4.670 -1.330 76 HG2 GLN 9 HG2 GLN 9 -8.774 7.326 -2.820 77 HG3 GLN 9 HG3 GLN 9 -10.248 6.849 -1.984 78 HE21 GLN 9 HE21 GLN 9 -8.407 6.948 1.302 79 HE22 GLN 9 HE22 GLN 9 -9.036 5.591 0.390 80 H ARG 10 H ARG 10 -5.849 3.920 -1.152 81 HA ARG 10 HA ARG 10 -4.037 6.308 -1.120 82 HB2 ARG 10 HB2 ARG 10 -5.659 6.518 0.708 83 HB3 ARG 10 HB3 ARG 10 -5.199 4.933 1.340 84 HG2 ARG 10 HG2 ARG 10 -2.936 5.747 1.855 85 HG3 ARG 10 HG3 ARG 10 -3.286 7.296 1.071 86 HD2 ARG 10 HD2 ARG 10 -5.073 7.731 2.771 87 HD3 ARG 10 HD3 ARG 10 -4.705 6.190 3.532 88 HE ARG 10 HE ARG 10 -2.715 7.035 4.414 89 HH11 ARG 10 HH11 ARG 10 -1.646 10.291 4.636 90 HH12 ARG 10 HH12 ARG 10 -1.450 8.668 5.214 91 HH21 ARG 10 HH21 ARG 10 -4.136 9.534 2.387 92 HH22 ARG 10 HH22 ARG 10 -3.129 10.780 3.082 93 H ARG 11 H ARG 11 -4.270 2.816 -0.270 94 HA ARG 11 HA ARG 11 -1.316 2.719 0.103 95 HB2 ARG 11 HB2 ARG 11 -3.449 1.589 1.515 96 HB3 ARG 11 HB3 ARG 11 -2.950 0.250 0.500 97 HG2 ARG 11 HG2 ARG 11 -1.827 0.048 2.571 98 HG3 ARG 11 HG3 ARG 11 -0.606 0.533 1.393 99 HD2 ARG 11 HD2 ARG 11 -0.759 2.873 2.281 100 HD3 ARG 11 HD3 ARG 11 -1.935 2.320 3.473 101 HE ARG 11 HE ARG 11 -0.049 0.639 4.173 102 HH11 ARG 11 HH11 ARG 11 2.690 2.144 5.416 103 HH12 ARG 11 HH12 ARG 11 1.666 0.713 5.318 104 HH21 ARG 11 HH21 ARG 11 0.831 3.907 3.092 105 HH22 ARG 11 HH22 ARG 11 2.121 3.968 4.257 106 H THR 12 H THR 12 -0.180 2.461 -1.691 107 HA THR 12 HA THR 12 -1.122 1.063 -4.118 108 HB THR 12 HB THR 12 1.220 1.750 -4.868 109 HG1 THR 12 HG1 THR 12 2.429 2.991 -3.539 110 HG21 THR 12 HG21 THR 12 0.745 4.152 -5.017 111 HG22 THR 12 HG22 THR 12 -0.735 3.222 -5.314 112 HG23 THR 12 HG23 THR 12 -0.485 4.019 -3.744 113 H PHE 13 H PHE 13 0.493 -0.517 -5.171 114 HA PHE 13 HA PHE 13 1.038 -2.768 -3.643 115 HB2 PHE 13 HB2 PHE 13 0.902 -3.075 -5.914 116 HB3 PHE 13 HB3 PHE 13 2.087 -1.831 -6.266 117 HD1 PHE 13 HD1 PHE 13 1.628 -5.341 -5.245 118 HD2 PHE 13 HD2 PHE 13 4.514 -2.256 -6.115 119 HE1 PHE 13 HE1 PHE 13 3.431 -7.049 -5.349 120 HE2 PHE 13 HE2 PHE 13 6.316 -3.960 -6.193 121 HZ PHE 13 HZ PHE 13 5.778 -6.358 -5.804 122 H GLU 14 H GLU 14 3.455 -0.213 -4.281 123 HA GLU 14 HA GLU 14 5.566 -1.473 -2.793 124 HB2 GLU 14 HB2 GLU 14 4.988 1.467 -3.337 125 HB3 GLU 14 HB3 GLU 14 6.491 0.871 -2.649 126 HG2 GLU 14 HG2 GLU 14 5.400 0.140 -5.400 127 HG3 GLU 14 HG3 GLU 14 6.620 1.365 -5.074 128 H GLN 15 H GLN 15 2.946 0.760 -1.742 129 HA GLN 15 HA GLN 15 3.825 0.808 1.023 130 HB2 GLN 15 HB2 GLN 15 1.168 1.441 -0.284 131 HB3 GLN 15 HB3 GLN 15 1.492 1.620 1.439 132 HG2 GLN 15 HG2 GLN 15 3.222 3.280 1.034 133 HG3 GLN 15 HG3 GLN 15 3.064 3.086 -0.717 134 HE21 GLN 15 HE21 GLN 15 0.013 4.985 -0.900 135 HE22 GLN 15 HE22 GLN 15 1.241 4.064 -1.795 136 H ARG 16 H ARG 16 1.877 -1.504 -0.835 137 HA ARG 16 HA ARG 16 0.958 -2.961 1.542 138 HB2 ARG 16 HB2 ARG 16 1.232 -4.103 -1.263 139 HB3 ARG 16 HB3 ARG 16 0.275 -4.708 0.064 140 HG2 ARG 16 HG2 ARG 16 -0.377 -2.638 -1.939 141 HG3 ARG 16 HG3 ARG 16 -1.388 -3.835 -1.176 142 HD2 ARG 16 HD2 ARG 16 -0.591 -1.121 -0.131 143 HD3 ARG 16 HD3 ARG 16 -2.173 -1.623 -0.674 144 HE ARG 16 HE ARG 16 -0.948 -2.061 1.957 145 HH11 ARG 16 HH11 ARG 16 -3.285 -4.161 3.226 146 HH12 ARG 16 HH12 ARG 16 -1.884 -3.117 3.510 147 HH21 ARG 16 HH21 ARG 16 -4.364 -3.980 1.254 148 HH22 ARG 16 HH22 ARG 16 -3.513 -3.327 -0.109 149 H VAL 17 H VAL 17 3.773 -3.287 -0.637 150 HA VAL 17 HA VAL 17 4.950 -5.526 0.756 151 HB VAL 17 HB VAL 17 6.242 -3.259 -0.814 152 HG11 VAL 17 HG11 VAL 17 8.215 -4.777 -1.000 153 HG12 VAL 17 HG12 VAL 17 7.950 -4.208 0.655 154 HG13 VAL 17 HG13 VAL 17 7.468 -5.859 0.197 155 HG21 VAL 17 HG21 VAL 17 6.430 -4.921 -2.602 156 HG22 VAL 17 HG22 VAL 17 5.688 -6.158 -1.574 157 HG23 VAL 17 HG23 VAL 17 4.736 -4.769 -2.135 158 H GLU 18 H GLU 18 5.281 -1.952 1.295 159 HA GLU 18 HA GLU 18 6.926 -2.153 3.618 160 HB2 GLU 18 HB2 GLU 18 4.924 -0.052 2.744 161 HB3 GLU 18 HB3 GLU 18 5.927 0.105 4.193 162 HG2 GLU 18 HG2 GLU 18 7.970 -0.054 2.886 163 HG3 GLU 18 HG3 GLU 18 7.066 -0.329 1.399 164 H ASP 19 H ASP 19 3.311 -2.032 3.475 165 HA ASP 19 HA ASP 19 2.728 -2.389 6.203 166 HB2 ASP 19 HB2 ASP 19 1.383 -3.542 3.757 167 HB3 ASP 19 HB3 ASP 19 0.788 -3.814 5.380 168 H VAL 20 H VAL 20 3.276 -5.070 3.862 169 HA VAL 20 HA VAL 20 3.116 -7.180 5.780 170 HB VAL 20 HB VAL 20 4.512 -6.986 3.080 171 HG11 VAL 20 HG11 VAL 20 4.140 -9.445 4.843 172 HG12 VAL 20 HG12 VAL 20 4.523 -9.499 3.118 173 HG13 VAL 20 HG13 VAL 20 5.674 -8.785 4.234 174 HG21 VAL 20 HG21 VAL 20 2.593 -8.265 2.310 175 HG22 VAL 20 HG22 VAL 20 1.955 -8.406 3.963 176 HG23 VAL 20 HG23 VAL 20 2.026 -6.834 3.145 177 H ARG 21 H ARG 21 6.041 -5.498 4.469 178 HA ARG 21 HA ARG 21 7.931 -7.068 5.906 179 HB2 ARG 21 HB2 ARG 21 8.613 -5.743 3.997 180 HB3 ARG 21 HB3 ARG 21 8.073 -4.246 4.759 181 HG2 ARG 21 HG2 ARG 21 10.494 -4.374 4.810 182 HG3 ARG 21 HG3 ARG 21 9.852 -4.403 6.443 183 HD2 ARG 21 HD2 ARG 21 10.081 -6.994 6.294 184 HD3 ARG 21 HD3 ARG 21 11.070 -6.709 4.868 185 HE ARG 21 HE ARG 21 11.657 -6.037 7.714 186 HH11 ARG 21 HH11 ARG 21 13.526 -5.723 8.375 187 HH12 ARG 21 HH12 ARG 21 14.925 -5.506 7.314 188 HH21 ARG 21 HH21 ARG 21 12.979 -5.834 4.447 189 HH22 ARG 21 HH22 ARG 21 14.585 -5.585 5.074 190 H LEU 22 H LEU 22 6.594 -3.857 6.790 191 HA LEU 22 HA LEU 22 7.982 -3.686 9.316 192 HB2 LEU 22 HB2 LEU 22 5.396 -2.417 8.296 193 HB3 LEU 22 HB3 LEU 22 6.132 -1.997 9.839 194 HG LEU 22 HG LEU 22 7.604 -1.717 7.197 195 HD11 LEU 22 HD11 LEU 22 7.042 0.678 7.298 196 HD12 LEU 22 HD12 LEU 22 5.582 -0.311 7.158 197 HD13 LEU 22 HD13 LEU 22 6.026 0.386 8.732 198 HD21 LEU 22 HD21 LEU 22 9.072 -1.749 9.183 199 HD22 LEU 22 HD22 LEU 22 9.017 -0.136 8.469 200 HD23 LEU 22 HD23 LEU 22 8.085 -0.482 9.943 201 H ILE 23 H ILE 23 4.612 -4.762 8.542 202 HA ILE 23 HA ILE 23 4.081 -5.120 11.313 203 HB ILE 23 HB ILE 23 2.479 -4.662 9.278 204 HG12 ILE 23 HG12 ILE 23 0.594 -5.630 10.691 205 HG13 ILE 23 HG13 ILE 23 1.844 -6.171 11.812 206 HG21 ILE 23 HG21 ILE 23 2.150 -7.696 9.500 207 HG22 ILE 23 HG22 ILE 23 1.173 -6.564 8.535 208 HG23 ILE 23 HG23 ILE 23 2.864 -6.844 8.123 209 HD11 ILE 23 HD11 ILE 23 0.891 -3.990 12.472 210 HD12 ILE 23 HD12 ILE 23 2.595 -3.772 12.040 211 HD13 ILE 23 HD13 ILE 23 1.320 -3.292 10.899 212 H ARG 24 H ARG 24 5.069 -7.574 8.868 213 HA ARG 24 HA ARG 24 4.689 -9.724 10.811 214 HB2 ARG 24 HB2 ARG 24 4.532 -10.075 8.355 215 HB3 ARG 24 HB3 ARG 24 6.247 -9.715 8.192 216 HG2 ARG 24 HG2 ARG 24 5.856 -12.113 8.105 217 HG3 ARG 24 HG3 ARG 24 6.824 -11.718 9.527 218 HD2 ARG 24 HD2 ARG 24 4.814 -11.932 10.964 219 HD3 ARG 24 HD3 ARG 24 3.825 -12.248 9.523 220 HE ARG 24 HE ARG 24 5.981 -14.152 9.670 221 HH11 ARG 24 HH11 ARG 24 5.533 -16.339 10.333 222 HH12 ARG 24 HH12 ARG 24 4.039 -16.611 11.238 223 HH21 ARG 24 HH21 ARG 24 2.946 -13.462 11.259 224 HH22 ARG 24 HH22 ARG 24 2.671 -15.148 11.677 225 H GLU 25 H GLU 25 7.494 -7.692 9.905 226 HA GLU 25 HA GLU 25 9.366 -9.130 11.575 227 HB2 GLU 25 HB2 GLU 25 10.065 -7.665 9.777 228 HB3 GLU 25 HB3 GLU 25 9.389 -6.248 10.609 229 HG2 GLU 25 HG2 GLU 25 10.975 -6.469 12.430 230 HG3 GLU 25 HG3 GLU 25 11.557 -8.018 11.801 231 H GLN 26 H GLN 26 7.329 -6.209 12.255 232 HA GLN 26 HA GLN 26 8.265 -6.157 15.013 233 HB2 GLN 26 HB2 GLN 26 7.295 -4.105 15.188 234 HB3 GLN 26 HB3 GLN 26 7.738 -4.185 13.504 235 HG2 GLN 26 HG2 GLN 26 5.661 -3.406 13.120 236 HG3 GLN 26 HG3 GLN 26 5.178 -5.086 13.283 237 HE21 GLN 26 HE21 GLN 26 2.798 -3.697 15.594 238 HE22 GLN 26 HE22 GLN 26 3.008 -4.479 14.029 239 H HIS 27 H HIS 27 5.675 -7.861 13.494 240 HA HIS 27 HA HIS 27 4.706 -8.748 16.172 241 HB2 HIS 27 HB2 HIS 27 3.286 -6.964 14.707 242 HB3 HIS 27 HB3 HIS 27 2.631 -8.408 13.997 243 HD1 HIS 27 HD1 HIS 27 2.142 -10.223 16.630 244 HD2 HIS 27 HD2 HIS 27 1.480 -6.056 16.229 245 HE1 HIS 27 HE1 HIS 27 0.427 -9.567 18.428 246 HE2 HIS 27 HE2 HIS 27 0.011 -7.044 18.175 247 HA PRO 28 HA PRO 28 5.979 -12.176 13.190 248 HB2 PRO 28 HB2 PRO 28 7.126 -13.265 15.761 249 HB3 PRO 28 HB3 PRO 28 7.792 -13.346 14.104 250 HG2 PRO 28 HG2 PRO 28 8.777 -11.541 15.840 251 HG3 PRO 28 HG3 PRO 28 8.397 -11.020 14.164 252 HD2 PRO 28 HD2 PRO 28 6.699 -10.708 16.666 253 HD3 PRO 28 HD3 PRO 28 7.151 -9.482 15.451 254 H THR 29 H THR 29 4.115 -12.226 16.147 255 HA THR 29 HA THR 29 3.135 -14.942 16.028 256 HB THR 29 HB THR 29 1.480 -14.092 17.668 257 HG1 THR 29 HG1 THR 29 1.494 -11.925 18.172 258 HG21 THR 29 HG21 THR 29 3.819 -14.603 18.468 259 HG22 THR 29 HG22 THR 29 4.212 -12.877 18.277 260 HG23 THR 29 HG23 THR 29 2.963 -13.381 19.428 261 H LYS 30 H LYS 30 2.313 -12.216 14.009 262 HA LYS 30 HA LYS 30 -0.272 -13.556 13.289 263 HB2 LYS 30 HB2 LYS 30 0.224 -10.574 13.537 264 HB3 LYS 30 HB3 LYS 30 -1.233 -11.360 12.864 265 HG2 LYS 30 HG2 LYS 30 -1.817 -12.286 14.986 266 HG3 LYS 30 HG3 LYS 30 -0.359 -11.665 15.758 267 HD2 LYS 30 HD2 LYS 30 -1.243 -9.541 15.960 268 HD3 LYS 30 HD3 LYS 30 -2.125 -9.632 14.434 269 HE2 LYS 30 HE2 LYS 30 -3.824 -11.079 15.388 270 HE3 LYS 30 HE3 LYS 30 -2.973 -11.146 16.944 271 HZ1 LYS 30 HZ1 LYS 30 -4.026 -8.603 15.757 272 HZ2 LYS 30 HZ2 LYS 30 -4.846 -9.491 16.865 273 HZ3 LYS 30 HZ3 LYS 30 -3.411 -8.806 17.265 274 H ILE 31 H ILE 31 -1.020 -13.541 11.310 275 HA ILE 31 HA ILE 31 0.809 -13.218 9.042 276 HB ILE 31 HB ILE 31 -2.024 -14.291 9.313 277 HG12 ILE 31 HG12 ILE 31 -0.497 -15.691 10.508 278 HG13 ILE 31 HG13 ILE 31 -1.092 -16.509 9.072 279 HG21 ILE 31 HG21 ILE 31 -0.192 -14.464 6.886 280 HG22 ILE 31 HG22 ILE 31 -1.744 -15.322 7.109 281 HG23 ILE 31 HG23 ILE 31 -1.722 -13.571 6.994 282 HD11 ILE 31 HD11 ILE 31 1.024 -16.187 7.899 283 HD12 ILE 31 HD12 ILE 31 1.665 -15.229 9.247 284 HD13 ILE 31 HD13 ILE 31 1.314 -16.946 9.470 285 HA PRO 32 HA PRO 32 -1.425 -9.433 7.739 286 HB2 PRO 32 HB2 PRO 32 -0.065 -8.899 5.443 287 HB3 PRO 32 HB3 PRO 32 0.672 -8.668 7.052 288 HG2 PRO 32 HG2 PRO 32 0.985 -11.028 5.171 289 HG3 PRO 32 HG3 PRO 32 2.264 -10.119 6.041 290 HD2 PRO 32 HD2 PRO 32 1.198 -12.474 6.951 291 HD3 PRO 32 HD3 PRO 32 1.799 -11.197 8.053 292 H VAL 33 H VAL 33 -3.427 -9.499 6.867 293 HA VAL 33 HA VAL 33 -3.974 -11.232 4.495 294 HB VAL 33 HB VAL 33 -5.906 -10.939 6.798 295 HG11 VAL 33 HG11 VAL 33 -5.790 -12.905 4.474 296 HG12 VAL 33 HG12 VAL 33 -6.980 -12.926 5.786 297 HG13 VAL 33 HG13 VAL 33 -6.966 -11.584 4.650 298 HG21 VAL 33 HG21 VAL 33 -5.314 -13.303 7.376 299 HG22 VAL 33 HG22 VAL 33 -3.933 -13.186 6.273 300 HG23 VAL 33 HG23 VAL 33 -4.019 -12.147 7.714 301 H ILE 34 H ILE 34 -5.390 -10.482 2.933 302 HA ILE 34 HA ILE 34 -6.538 -7.718 3.303 303 HB ILE 34 HB ILE 34 -5.277 -9.076 0.923 304 HG12 ILE 34 HG12 ILE 34 -5.211 -6.198 1.944 305 HG13 ILE 34 HG13 ILE 34 -4.092 -7.454 2.452 306 HG21 ILE 34 HG21 ILE 34 -7.491 -8.455 0.017 307 HG22 ILE 34 HG22 ILE 34 -7.317 -6.818 0.690 308 HG23 ILE 34 HG23 ILE 34 -6.258 -7.392 -0.619 309 HD11 ILE 34 HD11 ILE 34 -2.947 -6.228 0.778 310 HD12 ILE 34 HD12 ILE 34 -3.428 -7.748 0.005 311 HD13 ILE 34 HD13 ILE 34 -4.329 -6.251 -0.321 312 H ILE 35 H ILE 35 -8.673 -7.381 2.862 313 HA ILE 35 HA ILE 35 -10.216 -9.557 1.590 314 HB ILE 35 HB ILE 35 -10.599 -9.928 3.927 315 HG12 ILE 35 HG12 ILE 35 -13.052 -8.631 2.620 316 HG13 ILE 35 HG13 ILE 35 -12.439 -10.255 2.270 317 HG21 ILE 35 HG21 ILE 35 -11.601 -8.345 5.430 318 HG22 ILE 35 HG22 ILE 35 -10.184 -7.555 4.743 319 HG23 ILE 35 HG23 ILE 35 -11.818 -7.137 4.156 320 HD11 ILE 35 HD11 ILE 35 -14.283 -10.458 3.813 321 HD12 ILE 35 HD12 ILE 35 -12.789 -10.854 4.691 322 HD13 ILE 35 HD13 ILE 35 -13.595 -9.283 4.922 323 H GLU 36 H GLU 36 -11.116 -8.791 -0.174 324 HA GLU 36 HA GLU 36 -11.935 -5.900 -0.265 325 HB2 GLU 36 HB2 GLU 36 -10.032 -6.609 -1.734 326 HB3 GLU 36 HB3 GLU 36 -11.151 -7.705 -2.563 327 HG2 GLU 36 HG2 GLU 36 -12.599 -5.665 -3.061 328 HG3 GLU 36 HG3 GLU 36 -11.314 -4.664 -2.391 329 H ARG 37 H ARG 37 -14.038 -5.408 -0.644 330 HA ARG 37 HA ARG 37 -16.169 -7.328 -0.876 331 HB2 ARG 37 HB2 ARG 37 -16.364 -4.955 -0.075 332 HB3 ARG 37 HB3 ARG 37 -15.976 -4.389 -1.689 333 HG2 ARG 37 HG2 ARG 37 -18.225 -4.076 -1.600 334 HG3 ARG 37 HG3 ARG 37 -18.143 -5.607 -2.460 335 HD2 ARG 37 HD2 ARG 37 -18.485 -5.529 0.576 336 HD3 ARG 37 HD3 ARG 37 -19.849 -5.242 -0.494 337 HE ARG 37 HE ARG 37 -18.370 -7.808 -0.191 338 HH11 ARG 37 HH11 ARG 37 -21.370 -6.274 -1.078 339 HH12 ARG 37 HH12 ARG 37 -21.796 -7.643 -2.126 340 HH21 ARG 37 HH21 ARG 37 -19.101 -9.447 -1.627 341 HH22 ARG 37 HH22 ARG 37 -20.716 -9.319 -2.293 342 H TYR 38 H TYR 38 -16.624 -8.617 -2.620 343 HA TYR 38 HA TYR 38 -14.871 -8.677 -4.733 344 HB2 TYR 38 HB2 TYR 38 -15.764 -10.685 -4.104 345 HB3 TYR 38 HB3 TYR 38 -17.421 -10.118 -4.262 346 HD1 TYR 38 HD1 TYR 38 -14.377 -10.637 -6.431 347 HD2 TYR 38 HD2 TYR 38 -18.682 -10.943 -6.067 348 HE1 TYR 38 HE1 TYR 38 -14.520 -11.570 -8.734 349 HE2 TYR 38 HE2 TYR 38 -18.803 -11.873 -8.350 350 HH TYR 38 HH TYR 38 -17.617 -12.569 -10.223 351 H LYS 39 H LYS 39 -14.585 -8.153 -6.776 352 HA LYS 39 HA LYS 39 -15.649 -5.695 -7.627 353 HB2 LYS 39 HB2 LYS 39 -14.251 -7.817 -9.312 354 HB3 LYS 39 HB3 LYS 39 -14.457 -6.118 -9.745 355 HG2 LYS 39 HG2 LYS 39 -13.127 -5.457 -7.722 356 HG3 LYS 39 HG3 LYS 39 -12.830 -7.174 -7.388 357 HD2 LYS 39 HD2 LYS 39 -11.842 -7.371 -9.715 358 HD3 LYS 39 HD3 LYS 39 -11.963 -5.618 -9.865 359 HE2 LYS 39 HE2 LYS 39 -10.342 -7.156 -7.772 360 HE3 LYS 39 HE3 LYS 39 -9.704 -6.411 -9.239 361 HZ1 LYS 39 HZ1 LYS 39 -9.328 -4.928 -7.428 362 HZ2 LYS 39 HZ2 LYS 39 -10.519 -4.226 -8.305 363 HZ3 LYS 39 HZ3 LYS 39 -10.852 -4.996 -6.879 364 H GLY 40 H GLY 40 -16.772 -8.929 -8.486 365 HA2 GLY 40 HA2 GLY 40 -18.602 -8.022 -10.582 366 HA3 GLY 40 HA3 GLY 40 -18.437 -9.647 -9.942 367 H GLU 41 H GLU 41 -18.909 -8.075 -7.119 368 HA GLU 41 HA GLU 41 -21.763 -7.492 -7.320 369 HB2 GLU 41 HB2 GLU 41 -22.053 -9.792 -7.296 370 HB3 GLU 41 HB3 GLU 41 -20.826 -10.083 -6.077 371 HG2 GLU 41 HG2 GLU 41 -23.230 -8.390 -5.356 372 HG3 GLU 41 HG3 GLU 41 -23.463 -10.121 -5.555 373 H LYS 42 H LYS 42 -21.886 -5.669 -6.251 374 HA LYS 42 HA LYS 42 -20.698 -5.423 -3.521 375 HB2 LYS 42 HB2 LYS 42 -21.531 -3.309 -5.527 376 HB3 LYS 42 HB3 LYS 42 -21.098 -2.960 -3.855 377 HG2 LYS 42 HG2 LYS 42 -18.859 -3.968 -4.183 378 HG3 LYS 42 HG3 LYS 42 -19.248 -4.298 -5.879 379 HD2 LYS 42 HD2 LYS 42 -19.521 -1.905 -6.326 380 HD3 LYS 42 HD3 LYS 42 -19.246 -1.516 -4.618 381 HE2 LYS 42 HE2 LYS 42 -16.934 -2.372 -4.742 382 HE3 LYS 42 HE3 LYS 42 -17.193 -2.900 -6.405 383 HZ1 LYS 42 HZ1 LYS 42 -16.059 -0.748 -6.328 384 HZ2 LYS 42 HZ2 LYS 42 -17.517 -0.557 -7.038 385 HZ3 LYS 42 HZ3 LYS 42 -17.290 -0.060 -5.500 386 H GLN 43 H GLN 43 -23.179 -6.922 -4.173 387 HA GLN 43 HA GLN 43 -25.480 -5.396 -3.417 388 HB2 GLN 43 HB2 GLN 43 -25.472 -7.406 -4.849 389 HB3 GLN 43 HB3 GLN 43 -25.064 -8.421 -3.467 390 HG2 GLN 43 HG2 GLN 43 -27.512 -6.639 -3.308 391 HG3 GLN 43 HG3 GLN 43 -27.568 -8.058 -4.344 392 HE21 GLN 43 HE21 GLN 43 -27.423 -10.419 -1.600 393 HE22 GLN 43 HE22 GLN 43 -26.997 -10.230 -3.296 394 H LEU 44 H LEU 44 -23.617 -7.883 -1.554 395 HA LEU 44 HA LEU 44 -24.898 -7.279 0.960 396 HB2 LEU 44 HB2 LEU 44 -22.087 -8.386 0.597 397 HB3 LEU 44 HB3 LEU 44 -23.096 -8.514 2.019 398 HG LEU 44 HG LEU 44 -23.593 -9.859 -0.652 399 HD11 LEU 44 HD11 LEU 44 -21.757 -10.872 0.563 400 HD12 LEU 44 HD12 LEU 44 -22.721 -10.909 2.070 401 HD13 LEU 44 HD13 LEU 44 -23.171 -11.927 0.701 402 HD21 LEU 44 HD21 LEU 44 -25.142 -10.059 1.982 403 HD22 LEU 44 HD22 LEU 44 -25.760 -9.385 0.457 404 HD23 LEU 44 HD23 LEU 44 -25.392 -11.110 0.576 405 HA PRO 45 HA PRO 45 -23.362 -3.378 1.899 406 HB2 PRO 45 HB2 PRO 45 -23.161 -3.281 4.651 407 HB3 PRO 45 HB3 PRO 45 -24.700 -3.345 3.744 408 HG2 PRO 45 HG2 PRO 45 -23.179 -5.677 4.961 409 HG3 PRO 45 HG3 PRO 45 -24.918 -5.273 5.149 410 HD2 PRO 45 HD2 PRO 45 -24.132 -7.092 3.344 411 HD3 PRO 45 HD3 PRO 45 -25.394 -5.905 2.908 412 H VAL 46 H VAL 46 -21.631 -2.053 2.242 413 HA VAL 46 HA VAL 46 -19.008 -3.378 2.395 414 HB VAL 46 HB VAL 46 -19.325 -0.474 1.696 415 HG11 VAL 46 HG11 VAL 46 -17.328 -2.647 0.890 416 HG12 VAL 46 HG12 VAL 46 -17.265 -0.932 0.431 417 HG13 VAL 46 HG13 VAL 46 -17.049 -1.396 2.119 418 HG21 VAL 46 HG21 VAL 46 -20.860 -1.504 0.160 419 HG22 VAL 46 HG22 VAL 46 -19.361 -1.165 -0.694 420 HG23 VAL 46 HG23 VAL 46 -19.725 -2.830 -0.174 421 H LEU 47 H LEU 47 -19.137 -3.886 4.627 422 HA LEU 47 HA LEU 47 -19.165 -1.833 6.654 423 HB2 LEU 47 HB2 LEU 47 -18.465 -4.774 6.597 424 HB3 LEU 47 HB3 LEU 47 -18.018 -3.828 7.997 425 HG LEU 47 HG LEU 47 -20.096 -4.990 8.379 426 HD11 LEU 47 HD11 LEU 47 -21.454 -3.213 9.244 427 HD12 LEU 47 HD12 LEU 47 -19.744 -2.810 9.491 428 HD13 LEU 47 HD13 LEU 47 -20.682 -2.021 8.198 429 HD21 LEU 47 HD21 LEU 47 -20.958 -5.048 6.050 430 HD22 LEU 47 HD22 LEU 47 -22.161 -4.502 7.224 431 HD23 LEU 47 HD23 LEU 47 -21.356 -3.315 6.181 432 H ASP 48 H ASP 48 -17.447 -1.363 8.150 433 HA ASP 48 HA ASP 48 -15.342 -0.144 6.654 434 HB2 ASP 48 HB2 ASP 48 -14.873 1.085 8.784 435 HB3 ASP 48 HB3 ASP 48 -16.455 1.250 8.066 436 H LYS 49 H LYS 49 -14.654 -2.734 6.450 437 HA LYS 49 HA LYS 49 -11.955 -2.653 7.651 438 HB2 LYS 49 HB2 LYS 49 -13.650 -5.180 7.874 439 HB3 LYS 49 HB3 LYS 49 -11.923 -5.045 8.180 440 HG2 LYS 49 HG2 LYS 49 -12.633 -4.901 10.324 441 HG3 LYS 49 HG3 LYS 49 -12.606 -3.198 9.924 442 HD2 LYS 49 HD2 LYS 49 -15.131 -3.439 9.390 443 HD3 LYS 49 HD3 LYS 49 -15.026 -5.074 10.066 444 HE2 LYS 49 HE2 LYS 49 -14.338 -4.202 12.235 445 HE3 LYS 49 HE3 LYS 49 -14.119 -2.577 11.563 446 HZ1 LYS 49 HZ1 LYS 49 -16.235 -2.784 12.771 447 HZ2 LYS 49 HZ2 LYS 49 -16.473 -2.378 11.207 448 HZ3 LYS 49 HZ3 LYS 49 -16.779 -3.921 11.724 449 H THR 50 H THR 50 -10.377 -3.375 6.429 450 HA THR 50 HA THR 50 -10.903 -4.686 3.796 451 HB THR 50 HB THR 50 -9.711 -3.084 2.538 452 HG1 THR 50 HG1 THR 50 -8.825 -1.213 3.640 453 HG21 THR 50 HG21 THR 50 -12.051 -2.344 3.065 454 HG22 THR 50 HG22 THR 50 -11.399 -1.380 4.420 455 HG23 THR 50 HG23 THR 50 -10.929 -1.010 2.755 456 H LYS 51 H LYS 51 -8.658 -4.150 6.423 457 HA LYS 51 HA LYS 51 -6.827 -6.204 5.282 458 HB2 LYS 51 HB2 LYS 51 -4.848 -4.794 5.840 459 HB3 LYS 51 HB3 LYS 51 -5.831 -4.193 4.504 460 HG2 LYS 51 HG2 LYS 51 -6.903 -2.535 6.007 461 HG3 LYS 51 HG3 LYS 51 -5.888 -3.082 7.343 462 HD2 LYS 51 HD2 LYS 51 -4.778 -1.953 4.726 463 HD3 LYS 51 HD3 LYS 51 -5.177 -0.961 6.137 464 HE2 LYS 51 HE2 LYS 51 -3.621 -2.219 7.545 465 HE3 LYS 51 HE3 LYS 51 -3.152 -3.251 6.184 466 HZ1 LYS 51 HZ1 LYS 51 -2.781 -0.264 6.240 467 HZ2 LYS 51 HZ2 LYS 51 -1.603 -1.364 6.590 468 HZ3 LYS 51 HZ3 LYS 51 -2.188 -1.273 5.087 469 H PHE 52 H PHE 52 -5.940 -7.527 6.693 470 HA PHE 52 HA PHE 52 -6.624 -7.235 9.548 471 HB2 PHE 52 HB2 PHE 52 -7.486 -9.441 7.725 472 HB3 PHE 52 HB3 PHE 52 -7.272 -9.741 9.436 473 HD1 PHE 52 HD1 PHE 52 -8.489 -8.203 11.124 474 HD2 PHE 52 HD2 PHE 52 -9.546 -8.502 6.960 475 HE1 PHE 52 HE1 PHE 52 -10.776 -7.354 11.640 476 HE2 PHE 52 HE2 PHE 52 -11.836 -7.671 7.502 477 HZ PHE 52 HZ PHE 52 -12.451 -7.152 9.833 478 H LEU 53 H LEU 53 -5.640 -8.620 11.106 479 HA LEU 53 HA LEU 53 -2.988 -9.664 10.278 480 HB2 LEU 53 HB2 LEU 53 -3.016 -7.205 11.193 481 HB3 LEU 53 HB3 LEU 53 -3.305 -7.964 12.763 482 HG LEU 53 HG LEU 53 -1.193 -9.286 12.363 483 HD11 LEU 53 HD11 LEU 53 0.454 -8.345 10.796 484 HD12 LEU 53 HD12 LEU 53 -0.907 -9.093 9.967 485 HD13 LEU 53 HD13 LEU 53 -0.827 -7.323 10.081 486 HD21 LEU 53 HD21 LEU 53 -1.293 -7.297 13.841 487 HD22 LEU 53 HD22 LEU 53 0.280 -7.469 13.044 488 HD23 LEU 53 HD23 LEU 53 -0.897 -6.272 12.453 489 H VAL 54 H VAL 54 -3.634 -11.765 10.489 490 HA VAL 54 HA VAL 54 -5.313 -12.547 12.801 491 HB VAL 54 HB VAL 54 -4.578 -14.212 10.386 492 HG11 VAL 54 HG11 VAL 54 -6.578 -15.523 10.955 493 HG12 VAL 54 HG12 VAL 54 -5.484 -15.492 12.338 494 HG13 VAL 54 HG13 VAL 54 -6.929 -14.463 12.333 495 HG21 VAL 54 HG21 VAL 54 -7.056 -12.475 10.778 496 HG22 VAL 54 HG22 VAL 54 -5.756 -12.166 9.614 497 HG23 VAL 54 HG23 VAL 54 -6.756 -13.599 9.434 498 HA PRO 55 HA PRO 55 -1.692 -14.339 14.753 499 HB2 PRO 55 HB2 PRO 55 -2.784 -15.847 16.740 500 HB3 PRO 55 HB3 PRO 55 -2.698 -14.057 16.801 501 HG2 PRO 55 HG2 PRO 55 -5.019 -15.784 15.954 502 HG3 PRO 55 HG3 PRO 55 -5.045 -14.379 17.061 503 HD2 PRO 55 HD2 PRO 55 -5.763 -14.181 14.447 504 HD3 PRO 55 HD3 PRO 55 -4.904 -12.855 15.274 505 H ASP 56 H ASP 56 -0.440 -16.047 14.331 506 HA ASP 56 HA ASP 56 -1.036 -17.640 12.206 507 HB2 ASP 56 HB2 ASP 56 1.030 -18.088 14.365 508 HB3 ASP 56 HB3 ASP 56 0.940 -19.065 12.902 509 H HIS 57 H HIS 57 -1.806 -18.530 15.474 510 HA HIS 57 HA HIS 57 -2.379 -21.336 14.941 511 HB2 HIS 57 HB2 HIS 57 -3.193 -19.658 17.344 512 HB3 HIS 57 HB3 HIS 57 -3.009 -21.406 17.275 513 HD1 HIS 57 HD1 HIS 57 -1.260 -18.631 18.653 514 HD2 HIS 57 HD2 HIS 57 -0.160 -21.966 16.294 515 HE1 HIS 57 HE1 HIS 57 1.286 -18.955 18.986 516 HE2 HIS 57 HE2 HIS 57 1.944 -20.996 17.545 517 H VAL 58 H VAL 58 -4.336 -18.497 14.431 518 HA VAL 58 HA VAL 58 -6.978 -19.681 14.967 519 HB VAL 58 HB VAL 58 -5.964 -17.238 13.577 520 HG11 VAL 58 HG11 VAL 58 -7.657 -17.911 11.954 521 HG12 VAL 58 HG12 VAL 58 -8.813 -18.271 13.264 522 HG13 VAL 58 HG13 VAL 58 -8.302 -16.605 12.957 523 HG21 VAL 58 HG21 VAL 58 -6.523 -17.410 16.060 524 HG22 VAL 58 HG22 VAL 58 -7.419 -16.148 15.187 525 HG23 VAL 58 HG23 VAL 58 -8.205 -17.687 15.596 526 H ASN 59 H ASN 59 -8.125 -21.053 13.600 527 HA ASN 59 HA ASN 59 -6.805 -21.910 11.091 528 HB2 ASN 59 HB2 ASN 59 -8.274 -23.776 11.101 529 HB3 ASN 59 HB3 ASN 59 -7.584 -23.616 12.707 530 HD21 ASN 59 HD21 ASN 59 -10.817 -23.553 14.138 531 HD22 ASN 59 HD22 ASN 59 -9.092 -23.766 14.388 532 H MET 60 H MET 60 -8.070 -22.218 9.116 533 HA MET 60 HA MET 60 -9.052 -19.753 8.203 534 HB2 MET 60 HB2 MET 60 -7.969 -21.565 6.884 535 HB3 MET 60 HB3 MET 60 -9.432 -22.525 7.021 536 HG2 MET 60 HG2 MET 60 -9.361 -21.535 4.868 537 HG3 MET 60 HG3 MET 60 -10.687 -20.790 5.747 538 HE1 MET 60 HE1 MET 60 -10.117 -17.157 5.381 539 HE2 MET 60 HE2 MET 60 -11.193 -18.566 5.357 540 HE3 MET 60 HE3 MET 60 -10.344 -18.122 6.848 541 H SER 61 H SER 61 -11.039 -22.610 9.169 542 HA SER 61 HA SER 61 -13.576 -21.431 8.546 543 HB2 SER 61 HB2 SER 61 -13.262 -23.827 8.892 544 HB3 SER 61 HB3 SER 61 -12.831 -23.557 10.587 545 HG SER 61 HG SER 61 -15.056 -24.153 10.294 546 H GLU 62 H GLU 62 -11.648 -21.370 11.574 547 HA GLU 62 HA GLU 62 -13.512 -19.846 13.116 548 HB2 GLU 62 HB2 GLU 62 -11.687 -21.098 14.148 549 HB3 GLU 62 HB3 GLU 62 -10.496 -20.125 13.303 550 HG2 GLU 62 HG2 GLU 62 -10.592 -19.417 15.583 551 HG3 GLU 62 HG3 GLU 62 -11.159 -18.115 14.560 552 H LEU 63 H LEU 63 -10.779 -18.738 11.033 553 HA LEU 63 HA LEU 63 -11.180 -15.934 11.435 554 HB2 LEU 63 HB2 LEU 63 -9.177 -16.816 10.359 555 HB3 LEU 63 HB3 LEU 63 -10.131 -17.491 9.044 556 HG LEU 63 HG LEU 63 -10.762 -15.192 8.302 557 HD11 LEU 63 HD11 LEU 63 -10.613 -13.956 10.424 558 HD12 LEU 63 HD12 LEU 63 -8.885 -14.323 10.551 559 HD13 LEU 63 HD13 LEU 63 -9.493 -13.252 9.252 560 HD21 LEU 63 HD21 LEU 63 -7.763 -15.595 8.642 561 HD22 LEU 63 HD22 LEU 63 -8.768 -16.288 7.345 562 HD23 LEU 63 HD23 LEU 63 -8.561 -14.537 7.444 563 H ILE 64 H ILE 64 -12.681 -18.147 9.023 564 HA ILE 64 HA ILE 64 -14.383 -16.216 7.777 565 HB ILE 64 HB ILE 64 -14.422 -19.199 8.124 566 HG12 ILE 64 HG12 ILE 64 -14.584 -17.590 5.587 567 HG13 ILE 64 HG13 ILE 64 -13.053 -17.852 6.432 568 HG21 ILE 64 HG21 ILE 64 -16.746 -17.668 6.877 569 HG22 ILE 64 HG22 ILE 64 -16.487 -19.416 6.759 570 HG23 ILE 64 HG23 ILE 64 -16.824 -18.705 8.325 571 HD11 ILE 64 HD11 ILE 64 -14.861 -20.033 5.359 572 HD12 ILE 64 HD12 ILE 64 -13.343 -19.494 4.644 573 HD13 ILE 64 HD13 ILE 64 -13.330 -20.298 6.228 574 H LYS 65 H LYS 65 -14.985 -18.154 10.734 575 HA LYS 65 HA LYS 65 -17.631 -17.178 11.159 576 HB2 LYS 65 HB2 LYS 65 -16.539 -19.205 12.186 577 HB3 LYS 65 HB3 LYS 65 -15.667 -18.132 13.292 578 HG2 LYS 65 HG2 LYS 65 -17.847 -17.283 14.160 579 HG3 LYS 65 HG3 LYS 65 -18.700 -18.329 13.004 580 HD2 LYS 65 HD2 LYS 65 -17.714 -20.336 14.075 581 HD3 LYS 65 HD3 LYS 65 -16.843 -19.297 15.227 582 HE2 LYS 65 HE2 LYS 65 -19.007 -18.401 16.063 583 HE3 LYS 65 HE3 LYS 65 -19.881 -19.431 14.926 584 HZ1 LYS 65 HZ1 LYS 65 -18.138 -20.428 17.132 585 HZ2 LYS 65 HZ2 LYS 65 -19.766 -20.452 17.130 586 HZ3 LYS 65 HZ3 LYS 65 -18.944 -21.383 16.072 587 H ILE 66 H ILE 66 -14.556 -15.900 12.593 588 HA ILE 66 HA ILE 66 -15.944 -13.731 13.911 589 HB ILE 66 HB ILE 66 -13.851 -14.419 14.759 590 HG12 ILE 66 HG12 ILE 66 -14.594 -11.983 14.959 591 HG13 ILE 66 HG13 ILE 66 -12.954 -12.416 15.400 592 HG21 ILE 66 HG21 ILE 66 -12.559 -15.122 12.884 593 HG22 ILE 66 HG22 ILE 66 -12.513 -13.493 12.182 594 HG23 ILE 66 HG23 ILE 66 -11.660 -13.849 13.699 595 HD11 ILE 66 HD11 ILE 66 -12.957 -10.286 14.258 596 HD12 ILE 66 HD12 ILE 66 -12.076 -11.478 13.298 597 HD13 ILE 66 HD13 ILE 66 -13.704 -10.985 12.812 598 H ILE 67 H ILE 67 -14.399 -13.889 10.668 599 HA ILE 67 HA ILE 67 -14.904 -11.118 10.076 600 HB ILE 67 HB ILE 67 -14.425 -13.522 8.290 601 HG12 ILE 67 HG12 ILE 67 -12.538 -12.803 9.769 602 HG13 ILE 67 HG13 ILE 67 -12.193 -12.708 8.052 603 HG21 ILE 67 HG21 ILE 67 -14.704 -10.581 7.508 604 HG22 ILE 67 HG22 ILE 67 -13.873 -11.788 6.510 605 HG23 ILE 67 HG23 ILE 67 -15.596 -11.977 6.862 606 HD11 ILE 67 HD11 ILE 67 -12.842 -10.338 9.864 607 HD12 ILE 67 HD12 ILE 67 -11.239 -10.818 9.292 608 HD13 ILE 67 HD13 ILE 67 -12.444 -10.245 8.132 609 H ARG 68 H ARG 68 -16.974 -14.009 9.430 610 HA ARG 68 HA ARG 68 -19.104 -12.661 8.114 611 HB2 ARG 68 HB2 ARG 68 -18.808 -15.170 8.517 612 HB3 ARG 68 HB3 ARG 68 -19.406 -14.921 10.153 613 HG2 ARG 68 HG2 ARG 68 -21.488 -13.857 9.042 614 HG3 ARG 68 HG3 ARG 68 -20.872 -14.487 7.515 615 HD2 ARG 68 HD2 ARG 68 -20.772 -16.683 9.288 616 HD3 ARG 68 HD3 ARG 68 -22.251 -15.852 9.748 617 HE ARG 68 HE ARG 68 -21.752 -17.432 7.382 618 HH11 ARG 68 HH11 ARG 68 -23.740 -14.690 8.374 619 HH12 ARG 68 HH12 ARG 68 -24.994 -15.097 7.241 620 HH21 ARG 68 HH21 ARG 68 -23.407 -17.847 5.938 621 HH22 ARG 68 HH22 ARG 68 -24.712 -16.691 5.782 622 H ARG 69 H ARG 69 -18.582 -13.046 11.632 623 HA ARG 69 HA ARG 69 -20.874 -11.454 12.401 624 HB2 ARG 69 HB2 ARG 69 -19.955 -13.128 13.886 625 HB3 ARG 69 HB3 ARG 69 -18.382 -12.340 13.911 626 HG2 ARG 69 HG2 ARG 69 -19.615 -11.946 15.997 627 HG3 ARG 69 HG3 ARG 69 -19.288 -10.439 15.157 628 HD2 ARG 69 HD2 ARG 69 -21.709 -10.592 14.225 629 HD3 ARG 69 HD3 ARG 69 -21.927 -11.951 15.317 630 HE ARG 69 HE ARG 69 -21.954 -10.519 17.149 631 HH11 ARG 69 HH11 ARG 69 -21.041 -8.539 14.344 632 HH12 ARG 69 HH12 ARG 69 -21.338 -7.069 15.228 633 HH21 ARG 69 HH21 ARG 69 -22.294 -8.590 18.152 634 HH22 ARG 69 HH22 ARG 69 -22.046 -7.098 17.304 635 H ARG 70 H ARG 70 -17.448 -10.517 11.939 636 HA ARG 70 HA ARG 70 -17.870 -7.721 12.710 637 HB2 ARG 70 HB2 ARG 70 -15.664 -9.326 11.419 638 HB3 ARG 70 HB3 ARG 70 -15.642 -7.589 11.189 639 HG2 ARG 70 HG2 ARG 70 -14.289 -8.287 13.118 640 HG3 ARG 70 HG3 ARG 70 -15.561 -7.140 13.535 641 HD2 ARG 70 HD2 ARG 70 -16.919 -8.919 14.526 642 HD3 ARG 70 HD3 ARG 70 -15.730 -10.135 14.020 643 HE ARG 70 HE ARG 70 -14.413 -8.095 15.542 644 HH11 ARG 70 HH11 ARG 70 -16.623 -10.741 16.299 645 HH12 ARG 70 HH12 ARG 70 -16.016 -10.834 17.929 646 HH21 ARG 70 HH21 ARG 70 -13.777 -8.231 17.434 647 HH22 ARG 70 HH22 ARG 70 -14.404 -9.389 18.613 648 H LEU 71 H LEU 71 -18.287 -9.384 9.650 649 HA LEU 71 HA LEU 71 -18.998 -6.939 8.192 650 HB2 LEU 71 HB2 LEU 71 -19.339 -9.897 7.578 651 HB3 LEU 71 HB3 LEU 71 -19.756 -8.608 6.458 652 HG LEU 71 HG LEU 71 -16.929 -9.074 7.501 653 HD11 LEU 71 HD11 LEU 71 -16.505 -9.992 5.254 654 HD12 LEU 71 HD12 LEU 71 -17.750 -10.939 6.094 655 HD13 LEU 71 HD13 LEU 71 -18.216 -9.779 4.828 656 HD21 LEU 71 HD21 LEU 71 -18.050 -7.254 5.335 657 HD22 LEU 71 HD22 LEU 71 -17.197 -6.768 6.823 658 HD23 LEU 71 HD23 LEU 71 -16.325 -7.621 5.548 659 H GLN 72 H GLN 72 -20.615 -8.414 10.687 660 HA GLN 72 HA GLN 72 -22.701 -8.489 11.479 661 HB2 GLN 72 HB2 GLN 72 -23.255 -6.173 9.597 662 HB3 GLN 72 HB3 GLN 72 -24.208 -6.637 11.007 663 HG2 GLN 72 HG2 GLN 72 -22.225 -6.215 12.471 664 HG3 GLN 72 HG3 GLN 72 -21.321 -5.648 11.063 665 HE21 GLN 72 HE21 GLN 72 -22.582 -2.577 12.643 666 HE22 GLN 72 HE22 GLN 72 -21.362 -3.803 12.951 667 H LEU 73 H LEU 73 -22.171 -10.299 9.247 668 HA LEU 73 HA LEU 73 -24.740 -10.456 7.772 669 HB2 LEU 73 HB2 LEU 73 -22.175 -12.066 7.554 670 HB3 LEU 73 HB3 LEU 73 -23.583 -12.254 6.506 671 HG LEU 73 HG LEU 73 -21.953 -9.688 6.768 672 HD11 LEU 73 HD11 LEU 73 -20.949 -10.234 4.671 673 HD12 LEU 73 HD12 LEU 73 -20.651 -11.563 5.799 674 HD13 LEU 73 HD13 LEU 73 -21.905 -11.730 4.542 675 HD21 LEU 73 HD21 LEU 73 -23.065 -9.061 4.637 676 HD22 LEU 73 HD22 LEU 73 -24.080 -10.518 4.738 677 HD23 LEU 73 HD23 LEU 73 -24.226 -9.225 5.956 678 H ASN 74 H ASN 74 -26.284 -11.103 9.173 679 HA ASN 74 HA ASN 74 -26.043 -13.214 11.104 680 HB2 ASN 74 HB2 ASN 74 -28.471 -11.943 9.750 681 HB3 ASN 74 HB3 ASN 74 -28.578 -13.042 11.120 682 HD21 ASN 74 HD21 ASN 74 -28.576 -9.436 12.276 683 HD22 ASN 74 HD22 ASN 74 -29.441 -10.216 10.962 684 H ALA 75 H ALA 75 -27.357 -15.245 11.101 685 HA ALA 75 HA ALA 75 -26.312 -16.986 9.194 686 HB1 ALA 75 HB1 ALA 75 -27.759 -18.666 10.282 687 HB2 ALA 75 HB2 ALA 75 -27.010 -17.591 11.472 688 HB3 ALA 75 HB3 ALA 75 -28.717 -17.367 11.029 689 H ASN 76 H ASN 76 -29.388 -15.273 8.964 690 HA ASN 76 HA ASN 76 -30.502 -16.855 6.805 691 HB2 ASN 76 HB2 ASN 76 -31.059 -14.024 7.789 692 HB3 ASN 76 HB3 ASN 76 -32.011 -14.849 6.560 693 HD21 ASN 76 HD21 ASN 76 -33.618 -15.283 9.942 694 HD22 ASN 76 HD22 ASN 76 -32.987 -13.865 9.117 695 H GLN 77 H GLN 77 -28.009 -14.384 6.796 696 HA GLN 77 HA GLN 77 -28.359 -13.726 3.952 697 HB2 GLN 77 HB2 GLN 77 -26.221 -12.995 5.992 698 HB3 GLN 77 HB3 GLN 77 -26.148 -12.520 4.304 699 HG2 GLN 77 HG2 GLN 77 -28.393 -11.777 6.232 700 HG3 GLN 77 HG3 GLN 77 -27.066 -10.726 5.754 701 HE21 GLN 77 HE21 GLN 77 -30.148 -10.078 3.608 702 HE22 GLN 77 HE22 GLN 77 -29.944 -10.195 5.351 703 H ALA 78 H ALA 78 -27.491 -14.702 2.256 704 HA ALA 78 HA ALA 78 -25.736 -17.013 2.476 705 HB1 ALA 78 HB1 ALA 78 -25.783 -16.896 0.001 706 HB2 ALA 78 HB2 ALA 78 -27.417 -16.804 0.691 707 HB3 ALA 78 HB3 ALA 78 -26.625 -15.329 0.089 708 H PHE 79 H PHE 79 -23.541 -17.011 2.542 709 HA PHE 79 HA PHE 79 -22.026 -14.660 1.682 710 HB2 PHE 79 HB2 PHE 79 -22.437 -13.842 3.750 711 HB3 PHE 79 HB3 PHE 79 -22.365 -15.405 4.524 712 HD1 PHE 79 HD1 PHE 79 -20.372 -16.284 5.478 713 HD2 PHE 79 HD2 PHE 79 -20.207 -12.755 3.012 714 HE1 PHE 79 HE1 PHE 79 -18.095 -15.790 6.335 715 HE2 PHE 79 HE2 PHE 79 -17.920 -12.269 3.877 716 HZ PHE 79 HZ PHE 79 -16.893 -13.761 5.575 717 H PHE 80 H PHE 80 -20.101 -14.808 0.984 718 HA PHE 80 HA PHE 80 -18.576 -17.326 1.232 719 HB2 PHE 80 HB2 PHE 80 -19.475 -16.003 -1.316 720 HB3 PHE 80 HB3 PHE 80 -18.042 -17.004 -1.241 721 HD1 PHE 80 HD1 PHE 80 -18.137 -19.402 -1.159 722 HD2 PHE 80 HD2 PHE 80 -21.730 -17.054 -0.780 723 HE1 PHE 80 HE1 PHE 80 -19.514 -21.432 -1.551 724 HE2 PHE 80 HE2 PHE 80 -23.107 -19.081 -1.171 725 HZ PHE 80 HZ PHE 80 -21.998 -21.280 -1.554 726 H LEU 81 H LEU 81 -16.874 -16.724 2.391 727 HA LEU 81 HA LEU 81 -15.216 -14.427 1.460 728 HB2 LEU 81 HB2 LEU 81 -15.590 -14.540 3.825 729 HB3 LEU 81 HB3 LEU 81 -15.122 -16.235 3.897 730 HG LEU 81 HG LEU 81 -12.784 -15.653 3.444 731 HD11 LEU 81 HD11 LEU 81 -12.134 -13.200 3.414 732 HD12 LEU 81 HD12 LEU 81 -13.058 -13.677 1.981 733 HD13 LEU 81 HD13 LEU 81 -13.859 -12.791 3.297 734 HD21 LEU 81 HD21 LEU 81 -13.434 -15.591 5.770 735 HD22 LEU 81 HD22 LEU 81 -12.297 -14.279 5.466 736 HD23 LEU 81 HD23 LEU 81 -14.040 -13.931 5.607 737 H LEU 82 H LEU 82 -13.745 -14.855 -0.077 738 HA LEU 82 HA LEU 82 -13.027 -17.701 -0.695 739 HB2 LEU 82 HB2 LEU 82 -13.289 -15.296 -2.528 740 HB3 LEU 82 HB3 LEU 82 -13.047 -16.963 -3.025 741 HG LEU 82 HG LEU 82 -15.573 -15.876 -1.674 742 HD11 LEU 82 HD11 LEU 82 -16.595 -15.985 -3.850 743 HD12 LEU 82 HD12 LEU 82 -15.159 -14.977 -3.966 744 HD13 LEU 82 HD13 LEU 82 -15.109 -16.641 -4.581 745 HD21 LEU 82 HD21 LEU 82 -14.913 -18.567 -2.970 746 HD22 LEU 82 HD22 LEU 82 -15.321 -18.280 -1.258 747 HD23 LEU 82 HD23 LEU 82 -16.540 -18.054 -2.523 748 H VAL 83 H VAL 83 -10.895 -18.221 -0.754 749 HA VAL 83 HA VAL 83 -8.855 -16.072 -0.540 750 HB VAL 83 HB VAL 83 -8.769 -17.924 1.094 751 HG11 VAL 83 HG11 VAL 83 -9.328 -19.838 -0.462 752 HG12 VAL 83 HG12 VAL 83 -7.718 -19.655 -1.180 753 HG13 VAL 83 HG13 VAL 83 -7.882 -20.082 0.534 754 HG21 VAL 83 HG21 VAL 83 -6.339 -18.216 0.951 755 HG22 VAL 83 HG22 VAL 83 -6.354 -17.597 -0.715 756 HG23 VAL 83 HG23 VAL 83 -6.814 -16.538 0.631 757 H ASN 84 H ASN 84 -7.674 -15.408 -2.203 758 HA ASN 84 HA ASN 84 -7.286 -15.023 -4.422 759 HB2 ASN 84 HB2 ASN 84 -5.620 -16.765 -3.572 760 HB3 ASN 84 HB3 ASN 84 -6.549 -17.971 -4.459 761 HD21 ASN 84 HD21 ASN 84 -3.804 -17.090 -6.669 762 HD22 ASN 84 HD22 ASN 84 -4.118 -17.975 -5.163 763 H GLY 85 H GLY 85 -10.012 -15.398 -4.011 764 HA2 GLY 85 HA2 GLY 85 -11.928 -15.477 -5.275 765 HA3 GLY 85 HA3 GLY 85 -10.999 -16.035 -6.662 766 H HIS 86 H HIS 86 -10.354 -18.280 -4.231 767 HA HIS 86 HA HIS 86 -12.544 -20.115 -5.137 768 HB2 HIS 86 HB2 HIS 86 -10.207 -20.722 -5.730 769 HB3 HIS 86 HB3 HIS 86 -9.768 -20.712 -4.027 770 HD1 HIS 86 HD1 HIS 86 -9.777 -23.136 -3.054 771 HD2 HIS 86 HD2 HIS 86 -12.609 -22.479 -6.126 772 HE1 HIS 86 HE1 HIS 86 -11.039 -25.356 -3.373 773 HE2 HIS 86 HE2 HIS 86 -12.749 -24.955 -5.257 774 H SER 87 H SER 87 -13.733 -21.342 -3.637 775 HA SER 87 HA SER 87 -14.036 -20.230 -0.977 776 HB2 SER 87 HB2 SER 87 -15.923 -21.132 -2.237 777 HB3 SER 87 HB3 SER 87 -15.192 -22.757 -2.196 778 HG SER 87 HG SER 87 -16.734 -22.477 -0.524 779 H MET 88 H MET 88 -13.684 -21.105 1.012 780 HA MET 88 HA MET 88 -12.180 -23.628 1.339 781 HB2 MET 88 HB2 MET 88 -10.398 -22.644 2.644 782 HB3 MET 88 HB3 MET 88 -10.416 -21.974 1.022 783 HG2 MET 88 HG2 MET 88 -11.570 -20.585 3.473 784 HG3 MET 88 HG3 MET 88 -9.939 -20.351 2.843 785 HE1 MET 88 HE1 MET 88 -11.983 -17.879 3.360 786 HE2 MET 88 HE2 MET 88 -10.256 -17.825 2.899 787 HE3 MET 88 HE3 MET 88 -11.464 -16.928 1.955 788 H VAL 89 H VAL 89 -14.939 -22.652 2.066 789 HA VAL 89 HA VAL 89 -14.944 -22.107 4.879 790 HB VAL 89 HB VAL 89 -17.265 -22.103 4.863 791 HG11 VAL 89 HG11 VAL 89 -17.881 -20.685 3.016 792 HG12 VAL 89 HG12 VAL 89 -16.215 -20.296 3.470 793 HG13 VAL 89 HG13 VAL 89 -16.543 -21.268 2.021 794 HG21 VAL 89 HG21 VAL 89 -17.795 -24.270 3.875 795 HG22 VAL 89 HG22 VAL 89 -18.665 -22.994 3.024 796 HG23 VAL 89 HG23 VAL 89 -17.223 -23.721 2.283 797 H SER 90 H SER 90 -14.691 -25.164 3.323 798 HA SER 90 HA SER 90 -15.408 -26.714 5.719 799 HB2 SER 90 HB2 SER 90 -14.762 -28.628 4.291 800 HB3 SER 90 HB3 SER 90 -15.938 -27.570 3.495 801 HG SER 90 HG SER 90 -14.186 -28.144 2.099 802 H VAL 91 H VAL 91 -12.626 -24.948 4.898 803 HA VAL 91 HA VAL 91 -10.656 -26.998 5.556 804 HB VAL 91 HB VAL 91 -10.328 -24.056 4.876 805 HG11 VAL 91 HG11 VAL 91 -8.358 -24.769 6.084 806 HG12 VAL 91 HG12 VAL 91 -8.239 -26.259 5.094 807 HG13 VAL 91 HG13 VAL 91 -7.971 -24.662 4.368 808 HG21 VAL 91 HG21 VAL 91 -9.977 -26.591 3.204 809 HG22 VAL 91 HG22 VAL 91 -11.264 -25.390 3.004 810 HG23 VAL 91 HG23 VAL 91 -9.590 -24.941 2.670 811 H SER 92 H SER 92 -9.928 -27.507 7.473 812 HA SER 92 HA SER 92 -10.187 -25.659 9.788 813 HB2 SER 92 HB2 SER 92 -9.683 -28.649 9.618 814 HB3 SER 92 HB3 SER 92 -9.779 -27.720 11.127 815 HG SER 92 HG SER 92 -11.806 -28.683 10.517 816 H THR 93 H THR 93 -7.792 -26.034 7.615 817 HA THR 93 HA THR 93 -5.530 -26.453 9.287 818 HB THR 93 HB THR 93 -5.726 -26.744 6.755 819 HG1 THR 93 HG1 THR 93 -3.525 -26.741 6.687 820 HG21 THR 93 HG21 THR 93 -4.779 -25.016 5.380 821 HG22 THR 93 HG22 THR 93 -6.105 -24.256 6.276 822 HG23 THR 93 HG23 THR 93 -4.431 -23.986 6.782 823 HA PRO 94 HA PRO 94 -4.705 -22.536 11.233 824 HB2 PRO 94 HB2 PRO 94 -1.802 -23.050 10.606 825 HB3 PRO 94 HB3 PRO 94 -2.559 -22.558 12.158 826 HG2 PRO 94 HG2 PRO 94 -1.812 -25.124 11.773 827 HG3 PRO 94 HG3 PRO 94 -3.409 -24.772 12.519 828 HD2 PRO 94 HD2 PRO 94 -2.789 -25.446 9.637 829 HD3 PRO 94 HD3 PRO 94 -4.037 -26.144 10.711 830 H ILE 95 H ILE 95 -4.377 -20.361 10.680 831 HA ILE 95 HA ILE 95 -4.576 -19.702 7.947 832 HB ILE 95 HB ILE 95 -5.522 -18.423 9.850 833 HG12 ILE 95 HG12 ILE 95 -5.111 -16.130 9.029 834 HG13 ILE 95 HG13 ILE 95 -3.785 -16.703 8.022 835 HG21 ILE 95 HG21 ILE 95 -3.619 -18.448 11.408 836 HG22 ILE 95 HG22 ILE 95 -2.669 -17.428 10.312 837 HG23 ILE 95 HG23 ILE 95 -4.121 -16.796 11.086 838 HD11 ILE 95 HD11 ILE 95 -6.668 -17.707 7.815 839 HD12 ILE 95 HD12 ILE 95 -6.000 -16.395 6.832 840 HD13 ILE 95 HD13 ILE 95 -5.351 -18.033 6.671 841 H SER 96 H SER 96 -1.649 -20.035 9.859 842 HA SER 96 HA SER 96 0.178 -18.645 8.123 843 HB2 SER 96 HB2 SER 96 1.862 -20.116 9.232 844 HB3 SER 96 HB3 SER 96 0.811 -19.252 10.372 845 HG SER 96 HG SER 96 1.073 -21.543 10.855 846 H GLU 97 H GLU 97 -1.072 -22.013 8.084 847 HA GLU 97 HA GLU 97 0.571 -22.873 5.856 848 HB2 GLU 97 HB2 GLU 97 -2.100 -23.947 6.844 849 HB3 GLU 97 HB3 GLU 97 -1.031 -24.765 5.725 850 HG2 GLU 97 HG2 GLU 97 -0.396 -24.095 8.637 851 HG3 GLU 97 HG3 GLU 97 -0.902 -25.661 8.023 852 H VAL 98 H VAL 98 -2.718 -21.483 6.090 853 HA VAL 98 HA VAL 98 -3.224 -21.455 3.266 854 HB VAL 98 HB VAL 98 -4.304 -19.348 5.125 855 HG11 VAL 98 HG11 VAL 98 -5.543 -20.783 2.730 856 HG12 VAL 98 HG12 VAL 98 -6.234 -19.412 3.621 857 HG13 VAL 98 HG13 VAL 98 -4.770 -19.194 2.652 858 HG21 VAL 98 HG21 VAL 98 -6.231 -20.844 5.567 859 HG22 VAL 98 HG22 VAL 98 -5.360 -22.183 4.795 860 HG23 VAL 98 HG23 VAL 98 -4.751 -21.455 6.299 861 H TYR 99 H TYR 99 -1.598 -19.056 5.365 862 HA TYR 99 HA TYR 99 -0.991 -17.210 3.310 863 HB2 TYR 99 HB2 TYR 99 -0.799 -16.319 5.344 864 HB3 TYR 99 HB3 TYR 99 0.046 -17.685 6.038 865 HD1 TYR 99 HD1 TYR 99 2.465 -17.996 5.774 866 HD2 TYR 99 HD2 TYR 99 0.443 -14.496 4.242 867 HE1 TYR 99 HE1 TYR 99 4.643 -16.810 5.611 868 HE2 TYR 99 HE2 TYR 99 2.630 -13.316 4.096 869 HH TYR 99 HH TYR 99 5.725 -14.855 5.045 870 H GLU 100 H GLU 100 1.118 -19.912 4.357 871 HA GLU 100 HA GLU 100 3.116 -19.407 2.385 872 HB2 GLU 100 HB2 GLU 100 2.206 -21.973 3.732 873 HB3 GLU 100 HB3 GLU 100 3.605 -21.902 2.678 874 HG2 GLU 100 HG2 GLU 100 3.289 -20.254 5.223 875 HG3 GLU 100 HG3 GLU 100 4.132 -21.789 5.116 876 H SER 101 H SER 101 -0.016 -20.978 2.045 877 HA SER 101 HA SER 101 0.549 -22.047 -0.619 878 HB2 SER 101 HB2 SER 101 -0.904 -23.186 1.006 879 HB3 SER 101 HB3 SER 101 -2.049 -21.830 0.934 880 HG SER 101 HG SER 101 -2.566 -23.645 -0.477 881 H GLU 102 H GLU 102 -1.367 -19.267 0.625 882 HA GLU 102 HA GLU 102 -1.828 -18.368 -2.190 883 HB2 GLU 102 HB2 GLU 102 -3.743 -18.346 0.152 884 HB3 GLU 102 HB3 GLU 102 -4.079 -17.615 -1.412 885 HG2 GLU 102 HG2 GLU 102 -3.585 -20.572 -0.933 886 HG3 GLU 102 HG3 GLU 102 -5.144 -19.801 -1.128 887 H LYS 103 H LYS 103 0.215 -17.271 -0.072 888 HA LYS 103 HA LYS 103 -0.559 -14.478 0.074 889 HB2 LYS 103 HB2 LYS 103 1.758 -13.991 0.596 890 HB3 LYS 103 HB3 LYS 103 1.117 -15.306 1.570 891 HG2 LYS 103 HG2 LYS 103 2.281 -16.927 -0.065 892 HG3 LYS 103 HG3 LYS 103 3.075 -15.505 -0.760 893 HD2 LYS 103 HD2 LYS 103 4.090 -14.980 1.443 894 HD3 LYS 103 HD3 LYS 103 3.185 -16.305 2.181 895 HE2 LYS 103 HE2 LYS 103 5.425 -17.066 1.870 896 HE3 LYS 103 HE3 LYS 103 4.376 -17.954 0.769 897 HZ1 LYS 103 HZ1 LYS 103 6.438 -17.206 -0.311 898 HZ2 LYS 103 HZ2 LYS 103 5.161 -16.519 -1.050 899 HZ3 LYS 103 HZ3 LYS 103 6.091 -15.640 -0.018 900 H ASP 104 H ASP 104 -0.456 -12.877 -1.308 901 HA ASP 104 HA ASP 104 0.099 -13.386 -4.151 902 HB2 ASP 104 HB2 ASP 104 -1.905 -12.159 -3.252 903 HB3 ASP 104 HB3 ASP 104 -0.828 -10.882 -2.684 904 H GLU 105 H GLU 105 1.273 -11.401 -5.280 905 HA GLU 105 HA GLU 105 4.012 -11.737 -4.701 906 HB2 GLU 105 HB2 GLU 105 2.611 -9.684 -6.450 907 HB3 GLU 105 HB3 GLU 105 4.360 -9.987 -6.445 908 HG2 GLU 105 HG2 GLU 105 3.922 -12.382 -7.019 909 HG3 GLU 105 HG3 GLU 105 2.201 -12.014 -7.173 910 H ASP 106 H ASP 106 1.924 -9.214 -3.422 911 HA ASP 106 HA ASP 106 4.153 -7.550 -2.478 912 HB2 ASP 106 HB2 ASP 106 2.395 -6.315 -1.218 913 HB3 ASP 106 HB3 ASP 106 2.205 -6.346 -2.965 914 H GLY 107 H GLY 107 2.817 -10.458 -1.471 915 HA2 GLY 107 HA2 GLY 107 3.589 -11.788 0.285 916 HA3 GLY 107 HA3 GLY 107 4.099 -10.368 1.187 917 H PHE 108 H PHE 108 0.939 -9.650 0.167 918 HA PHE 108 HA PHE 108 -0.206 -10.428 2.737 919 HB2 PHE 108 HB2 PHE 108 -1.226 -8.843 0.420 920 HB3 PHE 108 HB3 PHE 108 -2.371 -9.574 1.508 921 HD1 PHE 108 HD1 PHE 108 -2.462 -9.030 3.867 922 HD2 PHE 108 HD2 PHE 108 0.008 -6.849 1.127 923 HE1 PHE 108 HE1 PHE 108 -2.359 -7.147 5.502 924 HE2 PHE 108 HE2 PHE 108 0.121 -4.965 2.727 925 HZ PHE 108 HZ PHE 108 -1.033 -5.123 4.942 926 H LEU 109 H LEU 109 -1.630 -11.998 3.306 927 HA LEU 109 HA LEU 109 -2.241 -14.108 1.339 928 HB2 LEU 109 HB2 LEU 109 -1.860 -14.812 3.580 929 HB3 LEU 109 HB3 LEU 109 -2.995 -13.628 4.231 930 HG LEU 109 HG LEU 109 -4.888 -14.799 3.261 931 HD11 LEU 109 HD11 LEU 109 -4.653 -17.001 2.200 932 HD12 LEU 109 HD12 LEU 109 -3.898 -15.766 1.216 933 HD13 LEU 109 HD13 LEU 109 -2.883 -16.835 2.203 934 HD21 LEU 109 HD21 LEU 109 -4.751 -16.898 4.577 935 HD22 LEU 109 HD22 LEU 109 -3.012 -16.655 4.769 936 HD23 LEU 109 HD23 LEU 109 -4.150 -15.493 5.477 937 H TYR 110 H TYR 110 -3.742 -13.810 -0.174 938 HA TYR 110 HA TYR 110 -5.573 -11.547 0.116 939 HB2 TYR 110 HB2 TYR 110 -4.247 -11.142 -1.632 940 HB3 TYR 110 HB3 TYR 110 -4.203 -12.812 -2.154 941 HD1 TYR 110 HD1 TYR 110 -5.229 -13.365 -4.121 942 HD2 TYR 110 HD2 TYR 110 -6.740 -10.024 -1.843 943 HE1 TYR 110 HE1 TYR 110 -6.858 -12.864 -5.934 944 HE2 TYR 110 HE2 TYR 110 -8.366 -9.525 -3.665 945 HH TYR 110 HH TYR 110 -8.481 -11.423 -6.707 946 H MET 111 H MET 111 -7.617 -11.555 0.554 947 HA MET 111 HA MET 111 -9.273 -13.747 -0.575 948 HB2 MET 111 HB2 MET 111 -9.558 -12.352 2.120 949 HB3 MET 111 HB3 MET 111 -10.845 -13.259 1.356 950 HG2 MET 111 HG2 MET 111 -9.945 -14.657 2.954 951 HG3 MET 111 HG3 MET 111 -9.451 -15.312 1.393 952 HE1 MET 111 HE1 MET 111 -7.952 -16.799 3.369 953 HE2 MET 111 HE2 MET 111 -6.786 -15.964 4.423 954 HE3 MET 111 HE3 MET 111 -8.513 -15.637 4.607 955 H VAL 112 H VAL 112 -11.385 -13.308 -1.183 956 HA VAL 112 HA VAL 112 -12.242 -10.465 -1.295 957 HB VAL 112 HB VAL 112 -13.237 -10.613 -3.402 958 HG11 VAL 112 HG11 VAL 112 -10.451 -11.816 -3.685 959 HG12 VAL 112 HG12 VAL 112 -11.331 -10.840 -4.880 960 HG13 VAL 112 HG13 VAL 112 -10.803 -10.103 -3.360 961 HG21 VAL 112 HG21 VAL 112 -14.002 -12.950 -3.439 962 HG22 VAL 112 HG22 VAL 112 -13.090 -12.553 -4.899 963 HG23 VAL 112 HG23 VAL 112 -12.312 -13.502 -3.614 964 H TYR 113 H TYR 113 -14.458 -10.084 -1.176 965 HA TYR 113 HA TYR 113 -15.965 -12.202 0.249 966 HB2 TYR 113 HB2 TYR 113 -15.491 -10.973 1.990 967 HB3 TYR 113 HB3 TYR 113 -15.130 -9.536 1.058 968 HD1 TYR 113 HD1 TYR 113 -18.350 -11.484 1.610 969 HD2 TYR 113 HD2 TYR 113 -16.212 -7.744 1.997 970 HE1 TYR 113 HE1 TYR 113 -20.428 -10.346 2.395 971 HE2 TYR 113 HE2 TYR 113 -18.292 -6.634 2.767 972 HH TYR 113 HH TYR 113 -20.561 -6.849 3.137 973 H ALA 114 H ALA 114 -17.772 -12.900 -0.537 974 HA ALA 114 HA ALA 114 -19.443 -11.219 -2.372 975 HB1 ALA 114 HB1 ALA 114 -19.378 -13.072 -3.941 976 HB2 ALA 114 HB2 ALA 114 -17.744 -12.475 -3.632 977 HB3 ALA 114 HB3 ALA 114 -18.287 -13.974 -2.863 978 H SER 115 H SER 115 -21.582 -12.137 -2.797 979 HA SER 115 HA SER 115 -22.766 -13.715 -0.586 980 HB2 SER 115 HB2 SER 115 -24.870 -13.318 -1.666 981 HB3 SER 115 HB3 SER 115 -23.969 -11.793 -1.680 982 HG SER 115 HG SER 115 -25.012 -12.421 -3.724 983 H GLN 116 H GLN 116 -21.085 -14.470 -3.381 984 HA GLN 116 HA GLN 116 -22.144 -17.218 -3.642 985 HB2 GLN 116 HB2 GLN 116 -22.734 -16.944 -5.885 986 HB3 GLN 116 HB3 GLN 116 -23.394 -15.506 -5.132 987 HG2 GLN 116 HG2 GLN 116 -20.938 -15.712 -6.907 988 HG3 GLN 116 HG3 GLN 116 -22.490 -14.992 -7.292 989 HE21 GLN 116 HE21 GLN 116 -21.537 -12.081 -5.015 990 HE22 GLN 116 HE22 GLN 116 -22.836 -13.243 -4.914 991 H GLU 117 H GLU 117 -20.535 -18.699 -4.571 992 HA GLU 117 HA GLU 117 -17.771 -17.696 -4.643 993 HB2 GLU 117 HB2 GLU 117 -18.258 -19.974 -3.892 994 HB3 GLU 117 HB3 GLU 117 -18.879 -20.392 -5.503 995 HG2 GLU 117 HG2 GLU 117 -16.677 -20.016 -6.498 996 HG3 GLU 117 HG3 GLU 117 -16.061 -19.341 -4.988 997 H THR 118 H THR 118 -20.243 -18.569 -7.025 998 HA THR 118 HA THR 118 -19.162 -16.690 -8.955 999 HB THR 118 HB THR 118 -17.813 -18.645 -9.556 1000 HG1 THR 118 HG1 THR 118 -18.357 -18.584 -11.704 1001 HG21 THR 118 HG21 THR 118 -18.807 -20.664 -10.512 1002 HG22 THR 118 HG22 THR 118 -19.329 -20.491 -8.833 1003 HG23 THR 118 HG23 THR 118 -20.445 -20.078 -10.155 1004 H PHE 119 H PHE 119 -20.686 -16.194 -10.642 1005 HA PHE 119 HA PHE 119 -23.474 -16.744 -9.933 1006 HB2 PHE 119 HB2 PHE 119 -22.217 -14.936 -11.979 1007 HB3 PHE 119 HB3 PHE 119 -23.940 -15.267 -11.948 1008 HD1 PHE 119 HD1 PHE 119 -21.318 -13.280 -10.480 1009 HD2 PHE 119 HD2 PHE 119 -25.275 -14.854 -9.789 1010 HE1 PHE 119 HE1 PHE 119 -21.683 -11.586 -8.709 1011 HE2 PHE 119 HE2 PHE 119 -25.637 -13.158 -8.010 1012 HZ PHE 119 HZ PHE 119 -23.846 -11.519 -7.471 1013 H GLY 120 H GLY 120 -21.257 -18.317 -11.904 1014 HA2 GLY 120 HA2 GLY 120 -22.672 -20.565 -12.559 1015 HA3 GLY 120 HA3 GLY 120 -23.172 -19.454 -13.835 1016 H1 ASP 10 H1 ASP 10 -11.059 -0.465 16.778 1017 H2 ASP 10 H2 ASP 10 -10.795 -1.415 18.094 1018 H3 ASP 10 H3 ASP 10 -11.284 0.147 18.291 1019 HA ASP 10 HA ASP 10 -9.293 1.005 17.392 1020 HB2 ASP 10 HB2 ASP 10 -8.821 -0.919 19.673 1021 HB3 ASP 10 HB3 ASP 10 -7.603 0.210 19.070 1022 H TYR 11 H TYR 11 -7.803 0.960 15.898 1023 HA TYR 11 HA TYR 11 -6.531 0.283 14.256 1024 HB2 TYR 11 HB2 TYR 11 -5.571 -1.659 16.318 1025 HB3 TYR 11 HB3 TYR 11 -4.806 -1.461 14.756 1026 HD1 TYR 11 HD1 TYR 11 -3.712 0.739 14.073 1027 HD2 TYR 11 HD2 TYR 11 -5.229 -0.026 18.053 1028 HE1 TYR 11 HE1 TYR 11 -2.366 2.605 14.948 1029 HE2 TYR 11 HE2 TYR 11 -3.875 1.872 18.918 1030 HH TYR 11 HH TYR 11 -1.780 3.862 16.784 1031 H GLU 12 H GLU 12 -9.212 -1.119 14.247 1032 HA GLU 12 HA GLU 12 -8.957 -3.717 13.252 1033 HB2 GLU 12 HB2 GLU 12 -11.292 -3.506 12.581 1034 HB3 GLU 12 HB3 GLU 12 -10.994 -2.973 14.219 1035 HG2 GLU 12 HG2 GLU 12 -11.191 -1.045 11.843 1036 HG3 GLU 12 HG3 GLU 12 -12.607 -1.634 12.705 1037 H SER 13 H SER 13 -8.303 -0.916 11.323 1038 HA SER 13 HA SER 13 -7.355 -2.583 9.186 1039 HB2 SER 13 HB2 SER 13 -9.998 -1.231 8.714 1040 HB3 SER 13 HB3 SER 13 -8.827 -1.294 7.380 1041 HG SER 13 HG SER 13 -9.449 -3.582 8.908 1042 H ASP 14 H ASP 14 -6.088 -0.943 10.819 1043 HA ASP 14 HA ASP 14 -5.867 1.761 9.768 1044 HB2 ASP 14 HB2 ASP 14 -4.850 0.360 12.194 1045 HB3 ASP 14 HB3 ASP 14 -4.207 1.938 11.751 1046 H ASP 15 H ASP 15 -3.377 2.649 10.095 1047 HA ASP 15 HA ASP 15 -1.783 1.204 8.072 1048 HB2 ASP 15 HB2 ASP 15 -2.651 4.065 7.895 1049 HB3 ASP 15 HB3 ASP 15 -1.263 3.430 7.008 1050 H ASP 16 H ASP 16 0.444 1.820 7.781 1051 HA ASP 16 HA ASP 16 2.507 1.774 8.526 1052 HB2 ASP 16 HB2 ASP 16 2.568 4.018 8.671 1053 HB3 ASP 16 HB3 ASP 16 1.531 4.096 10.094 1054 H SER 17 H SER 17 0.615 1.599 11.552 1055 HA SER 17 HA SER 17 1.933 -0.937 12.204 1056 HB2 SER 17 HB2 SER 17 3.595 0.675 13.076 1057 HB3 SER 17 HB3 SER 17 2.324 1.452 14.049 1058 HG SER 17 HG SER 17 3.520 -0.113 15.258 1059 H TYR 18 H TYR 18 0.642 -2.220 13.450 1060 HA TYR 18 HA TYR 18 -1.641 -1.235 14.914 1061 HB2 TYR 18 HB2 TYR 18 -3.275 -2.390 13.228 1062 HB3 TYR 18 HB3 TYR 18 -2.727 -0.760 13.004 1063 HD1 TYR 18 HD1 TYR 18 -1.844 -4.235 11.902 1064 HD2 TYR 18 HD2 TYR 18 -1.736 -0.022 11.086 1065 HE1 TYR 18 HE1 TYR 18 -1.221 -4.735 9.542 1066 HE2 TYR 18 HE2 TYR 18 -0.843 -0.528 8.784 1067 HH TYR 18 HH TYR 18 -0.676 -3.869 7.518 1068 H GLU 19 H GLU 19 -3.117 -2.715 15.842 1069 HA GLU 19 HA GLU 19 -1.945 -5.376 16.385 1070 HB2 GLU 19 HB2 GLU 19 -2.663 -3.897 18.229 1071 HB3 GLU 19 HB3 GLU 19 -4.310 -3.909 17.615 1072 HG2 GLU 19 HG2 GLU 19 -4.033 -5.432 19.528 1073 HG3 GLU 19 HG3 GLU 19 -4.537 -6.285 18.077 1074 H VAL 20 H VAL 20 -5.134 -4.159 15.276 1075 HA VAL 20 HA VAL 20 -6.768 -4.954 14.093 1076 HB VAL 20 HB VAL 20 -5.263 -6.840 12.406 1077 HG11 VAL 20 HG11 VAL 20 -6.937 -4.373 11.836 1078 HG12 VAL 20 HG12 VAL 20 -6.222 -5.379 10.614 1079 HG13 VAL 20 HG13 VAL 20 -7.483 -6.051 11.640 1080 HG21 VAL 20 HG21 VAL 20 -4.071 -5.056 11.209 1081 HG22 VAL 20 HG22 VAL 20 -4.602 -3.888 12.432 1082 HG23 VAL 20 HG23 VAL 20 -3.482 -5.217 12.870 1083 H LEU 21 H LEU 21 -8.225 -6.547 13.275 1084 HA LEU 21 HA LEU 21 -9.601 -8.293 13.366 1085 HB2 LEU 21 HB2 LEU 21 -7.414 -9.695 13.242 1086 HB3 LEU 21 HB3 LEU 21 -7.683 -9.976 14.954 1087 HG LEU 21 HG LEU 21 -9.956 -10.975 14.334 1088 HD11 LEU 21 HD11 LEU 21 -10.313 -10.033 12.100 1089 HD12 LEU 21 HD12 LEU 21 -8.784 -10.747 11.518 1090 HD13 LEU 21 HD13 LEU 21 -10.151 -11.780 11.966 1091 HD21 LEU 21 HD21 LEU 21 -7.943 -12.343 14.800 1092 HD22 LEU 21 HD22 LEU 21 -8.976 -13.085 13.570 1093 HD23 LEU 21 HD23 LEU 21 -7.491 -12.230 13.083 1094 H ASP 22 H ASP 22 -8.807 -6.358 15.681 1095 HA ASP 22 HA ASP 22 -9.463 -5.783 17.685 1096 HB2 ASP 22 HB2 ASP 22 -11.921 -5.244 17.713 1097 HB3 ASP 22 HB3 ASP 22 -10.938 -4.678 16.370 1098 H LEU 23 H LEU 23 -8.826 -8.554 17.950 1099 HA LEU 23 HA LEU 23 -10.113 -9.018 20.551 1100 HB2 LEU 23 HB2 LEU 23 -11.091 -10.975 20.161 1101 HB3 LEU 23 HB3 LEU 23 -11.297 -10.336 18.546 1102 HG LEU 23 HG LEU 23 -9.110 -12.302 19.410 1103 HD11 LEU 23 HD11 LEU 23 -11.330 -13.318 19.581 1104 HD12 LEU 23 HD12 LEU 23 -11.706 -12.817 17.920 1105 HD13 LEU 23 HD13 LEU 23 -10.419 -14.006 18.232 1106 HD21 LEU 23 HD21 LEU 23 -8.789 -12.738 17.033 1107 HD22 LEU 23 HD22 LEU 23 -10.039 -11.535 16.617 1108 HD23 LEU 23 HD23 LEU 23 -8.506 -11.018 17.354 1109 H THR 24 H THR 24 -8.984 -10.442 21.965 1110 HA THR 24 HA THR 24 -6.123 -10.798 21.320 1111 HB THR 24 HB THR 24 -5.478 -10.806 23.472 1112 HG1 THR 24 HG1 THR 24 -6.851 -11.079 25.225 1113 HG21 THR 24 HG21 THR 24 -6.326 -8.540 22.798 1114 HG22 THR 24 HG22 THR 24 -7.870 -8.914 23.603 1115 HG23 THR 24 HG23 THR 24 -6.369 -8.821 24.542 1116 H GLU 25 H GLU 25 -5.031 -12.717 21.371 1117 HA GLU 25 HA GLU 25 -6.432 -15.238 21.844 1118 HB2 GLU 25 HB2 GLU 25 -6.103 -14.060 19.122 1119 HB3 GLU 25 HB3 GLU 25 -5.522 -15.704 19.256 1120 HG2 GLU 25 HG2 GLU 25 -8.333 -14.748 19.877 1121 HG3 GLU 25 HG3 GLU 25 -7.812 -15.660 18.474 1122 H TYR 26 H TYR 26 -5.112 -17.121 21.335 1123 HA TYR 26 HA TYR 26 -2.464 -16.938 22.403 1124 HB2 TYR 26 HB2 TYR 26 -3.516 -18.834 23.054 1125 HB3 TYR 26 HB3 TYR 26 -4.186 -19.152 21.463 1126 HD1 TYR 26 HD1 TYR 26 -3.318 -20.911 20.216 1127 HD2 TYR 26 HD2 TYR 26 -0.815 -18.968 23.140 1128 HE1 TYR 26 HE1 TYR 26 -1.520 -22.569 19.769 1129 HE2 TYR 26 HE2 TYR 26 0.995 -20.625 22.682 1130 HH TYR 26 HH TYR 26 0.599 -23.288 20.307 Start of MODEL 19 1 H1 MET 1 H1 MET 1 -6.914 3.397 6.776 2 H2 MET 1 H2 MET 1 -7.598 2.287 7.744 3 H3 MET 1 H3 MET 1 -7.119 1.858 6.239 4 HA MET 1 HA MET 1 -9.294 3.806 6.828 5 HB2 MET 1 HB2 MET 1 -8.273 2.817 4.126 6 HB3 MET 1 HB3 MET 1 -9.844 3.562 4.371 7 HG2 MET 1 HG2 MET 1 -8.727 5.589 5.341 8 HG3 MET 1 HG3 MET 1 -7.174 4.874 4.916 9 HE1 MET 1 HE1 MET 1 -10.133 7.036 3.787 10 HE2 MET 1 HE2 MET 1 -10.263 6.756 2.039 11 HE3 MET 1 HE3 MET 1 -10.753 5.484 3.178 12 HA PRO 2 HA PRO 2 -11.389 -0.298 6.913 13 HB2 PRO 2 HB2 PRO 2 -12.733 -0.192 9.244 14 HB3 PRO 2 HB3 PRO 2 -10.980 -0.512 9.171 15 HG2 PRO 2 HG2 PRO 2 -12.380 2.080 9.849 16 HG3 PRO 2 HG3 PRO 2 -10.966 1.329 10.635 17 HD2 PRO 2 HD2 PRO 2 -10.852 3.342 8.669 18 HD3 PRO 2 HD3 PRO 2 -9.524 2.226 9.067 19 H SER 3 H SER 3 -13.019 2.789 7.911 20 HA SER 3 HA SER 3 -15.630 1.857 7.397 21 HB2 SER 3 HB2 SER 3 -14.602 4.705 7.617 22 HB3 SER 3 HB3 SER 3 -16.298 4.199 7.745 23 HG SER 3 HG SER 3 -15.320 4.382 9.814 24 H GLU 4 H GLU 4 -13.479 3.565 5.152 25 HA GLU 4 HA GLU 4 -15.607 3.515 3.063 26 HB2 GLU 4 HB2 GLU 4 -13.997 5.977 3.854 27 HB3 GLU 4 HB3 GLU 4 -15.027 5.830 2.422 28 HG2 GLU 4 HG2 GLU 4 -16.986 5.386 3.923 29 HG3 GLU 4 HG3 GLU 4 -15.949 5.724 5.319 30 H LYS 5 H LYS 5 -14.938 3.518 0.964 31 HA LYS 5 HA LYS 5 -13.732 2.892 -0.837 32 HB2 LYS 5 HB2 LYS 5 -11.465 4.431 0.495 33 HB3 LYS 5 HB3 LYS 5 -11.538 3.954 -1.205 34 HG2 LYS 5 HG2 LYS 5 -13.617 5.301 -1.488 35 HG3 LYS 5 HG3 LYS 5 -13.473 5.848 0.194 36 HD2 LYS 5 HD2 LYS 5 -11.203 6.768 -0.330 37 HD3 LYS 5 HD3 LYS 5 -11.449 6.365 -2.032 38 HE2 LYS 5 HE2 LYS 5 -13.209 8.242 -0.370 39 HE3 LYS 5 HE3 LYS 5 -11.911 8.767 -1.438 40 HZ1 LYS 5 HZ1 LYS 5 -14.386 7.359 -2.322 41 HZ2 LYS 5 HZ2 LYS 5 -14.024 8.927 -2.573 42 HZ3 LYS 5 HZ3 LYS 5 -13.154 7.772 -3.320 43 H THR 6 H THR 6 -11.596 1.847 -1.666 44 HA THR 6 HA THR 6 -11.254 -0.659 -0.201 45 HB THR 6 HB THR 6 -10.285 -1.620 -2.002 46 HG1 THR 6 HG1 THR 6 -9.341 -0.246 -3.700 47 HG21 THR 6 HG21 THR 6 -12.568 -0.763 -2.671 48 HG22 THR 6 HG22 THR 6 -11.748 0.604 -3.479 49 HG23 THR 6 HG23 THR 6 -11.452 -1.059 -4.010 50 H PHE 7 H PHE 7 -9.240 -1.628 0.478 51 HA PHE 7 HA PHE 7 -7.360 0.365 1.535 52 HB2 PHE 7 HB2 PHE 7 -7.694 -1.298 3.040 53 HB3 PHE 7 HB3 PHE 7 -7.514 -2.589 1.854 54 HD1 PHE 7 HD1 PHE 7 -5.529 -3.837 2.017 55 HD2 PHE 7 HD2 PHE 7 -5.529 0.279 3.261 56 HE1 PHE 7 HE1 PHE 7 -3.144 -4.038 2.756 57 HE2 PHE 7 HE2 PHE 7 -3.229 0.043 4.096 58 HZ PHE 7 HZ PHE 7 -1.985 -2.092 3.747 59 H LYS 8 H LYS 8 -7.477 -1.505 -1.402 60 HA LYS 8 HA LYS 8 -4.697 -1.179 -2.224 61 HB2 LYS 8 HB2 LYS 8 -6.248 -2.748 -3.318 62 HB3 LYS 8 HB3 LYS 8 -7.331 -1.439 -3.740 63 HG2 LYS 8 HG2 LYS 8 -6.228 -2.066 -5.716 64 HG3 LYS 8 HG3 LYS 8 -5.610 -0.483 -5.278 65 HD2 LYS 8 HD2 LYS 8 -3.549 -1.622 -4.312 66 HD3 LYS 8 HD3 LYS 8 -4.223 -3.173 -4.869 67 HE2 LYS 8 HE2 LYS 8 -4.396 -2.070 -7.202 68 HE3 LYS 8 HE3 LYS 8 -3.397 -0.760 -6.554 69 HZ1 LYS 8 HZ1 LYS 8 -2.590 -3.633 -6.738 70 HZ2 LYS 8 HZ2 LYS 8 -2.032 -2.426 -7.678 71 HZ3 LYS 8 HZ3 LYS 8 -1.654 -2.451 -6.088 72 H GLN 9 H GLN 9 -7.533 0.936 -2.427 73 HA GLN 9 HA GLN 9 -6.255 3.128 -3.755 74 HB2 GLN 9 HB2 GLN 9 -8.538 3.075 -3.808 75 HB3 GLN 9 HB3 GLN 9 -8.750 2.710 -2.124 76 HG2 GLN 9 HG2 GLN 9 -7.786 5.412 -3.146 77 HG3 GLN 9 HG3 GLN 9 -9.476 4.990 -2.892 78 HE21 GLN 9 HE21 GLN 9 -8.581 4.772 0.838 79 HE22 GLN 9 HE22 GLN 9 -8.775 3.403 -0.254 80 H ARG 10 H ARG 10 -6.004 2.091 -0.379 81 HA ARG 10 HA ARG 10 -4.749 4.662 0.391 82 HB2 ARG 10 HB2 ARG 10 -6.383 3.610 1.937 83 HB3 ARG 10 HB3 ARG 10 -5.363 2.182 2.045 84 HG2 ARG 10 HG2 ARG 10 -5.012 3.515 4.034 85 HG3 ARG 10 HG3 ARG 10 -3.541 3.569 3.079 86 HD2 ARG 10 HD2 ARG 10 -4.555 5.840 2.124 87 HD3 ARG 10 HD3 ARG 10 -5.631 5.715 3.505 88 HE ARG 10 HE ARG 10 -3.910 6.193 4.960 89 HH11 ARG 10 HH11 ARG 10 -2.340 5.676 1.819 90 HH12 ARG 10 HH12 ARG 10 -1.054 6.770 2.226 91 HH21 ARG 10 HH21 ARG 10 -0.913 7.676 4.222 92 HH22 ARG 10 HH22 ARG 10 -2.188 7.496 5.390 93 H ARG 11 H ARG 11 -3.708 1.216 0.228 94 HA ARG 11 HA ARG 11 -0.857 2.222 0.087 95 HB2 ARG 11 HB2 ARG 11 -1.891 -0.376 1.288 96 HB3 ARG 11 HB3 ARG 11 -0.186 0.003 1.068 97 HG2 ARG 11 HG2 ARG 11 -2.076 1.664 2.778 98 HG3 ARG 11 HG3 ARG 11 -1.102 0.324 3.399 99 HD2 ARG 11 HD2 ARG 11 0.919 1.435 3.157 100 HD3 ARG 11 HD3 ARG 11 0.259 2.578 1.971 101 HE ARG 11 HE ARG 11 -0.321 3.983 3.626 102 HH11 ARG 11 HH11 ARG 11 0.189 0.908 5.377 103 HH12 ARG 11 HH12 ARG 11 -0.407 1.641 6.843 104 HH21 ARG 11 HH21 ARG 11 -0.900 4.746 5.648 105 HH22 ARG 11 HH22 ARG 11 -1.057 3.606 6.967 106 H THR 12 H THR 12 0.011 2.074 -1.792 107 HA THR 12 HA THR 12 -0.691 0.050 -3.841 108 HB THR 12 HB THR 12 0.985 1.305 -5.193 109 HG1 THR 12 HG1 THR 12 1.868 3.189 -4.304 110 HG21 THR 12 HG21 THR 12 -1.008 3.194 -3.857 111 HG22 THR 12 HG22 THR 12 -0.262 3.368 -5.460 112 HG23 THR 12 HG23 THR 12 -1.405 2.045 -5.160 113 H PHE 13 H PHE 13 1.414 -0.935 -4.962 114 HA PHE 13 HA PHE 13 2.180 -2.932 -3.262 115 HB2 PHE 13 HB2 PHE 13 2.222 -3.428 -5.494 116 HB3 PHE 13 HB3 PHE 13 3.289 -2.095 -5.897 117 HD1 PHE 13 HD1 PHE 13 3.181 -5.466 -4.340 118 HD2 PHE 13 HD2 PHE 13 5.701 -2.283 -5.794 119 HE1 PHE 13 HE1 PHE 13 5.160 -6.958 -4.170 120 HE2 PHE 13 HE2 PHE 13 7.678 -3.782 -5.629 121 HZ PHE 13 HZ PHE 13 7.411 -6.112 -4.809 122 H GLU 14 H GLU 14 4.493 -0.260 -3.950 123 HA GLU 14 HA GLU 14 6.536 -1.370 -2.258 124 HB2 GLU 14 HB2 GLU 14 5.996 1.524 -3.048 125 HB3 GLU 14 HB3 GLU 14 7.456 0.940 -2.240 126 HG2 GLU 14 HG2 GLU 14 7.855 -0.630 -4.163 127 HG3 GLU 14 HG3 GLU 14 6.485 0.101 -5.004 128 H GLN 15 H GLN 15 3.681 0.560 -1.484 129 HA GLN 15 HA GLN 15 4.511 1.049 1.293 130 HB2 GLN 15 HB2 GLN 15 1.732 1.359 0.113 131 HB3 GLN 15 HB3 GLN 15 2.413 2.089 1.573 132 HG2 GLN 15 HG2 GLN 15 3.141 2.760 -1.299 133 HG3 GLN 15 HG3 GLN 15 2.215 3.752 -0.186 134 HE21 GLN 15 HE21 GLN 15 5.842 4.898 -0.330 135 HE22 GLN 15 HE22 GLN 15 4.673 4.537 -1.593 136 H ARG 16 H ARG 16 2.463 -1.314 -0.447 137 HA ARG 16 HA ARG 16 1.562 -2.796 1.872 138 HB2 ARG 16 HB2 ARG 16 2.094 -3.661 -1.004 139 HB3 ARG 16 HB3 ARG 16 1.396 -4.709 0.209 140 HG2 ARG 16 HG2 ARG 16 0.085 -2.065 -0.520 141 HG3 ARG 16 HG3 ARG 16 -0.176 -3.541 -1.442 142 HD2 ARG 16 HD2 ARG 16 -0.820 -4.661 0.813 143 HD3 ARG 16 HD3 ARG 16 -0.841 -3.035 1.480 144 HE ARG 16 HE ARG 16 -2.817 -2.577 0.335 145 HH11 ARG 16 HH11 ARG 16 -4.708 -3.149 -0.699 146 HH12 ARG 16 HH12 ARG 16 -4.730 -4.544 -1.744 147 HH21 ARG 16 HH21 ARG 16 -1.517 -5.505 -1.145 148 HH22 ARG 16 HH22 ARG 16 -3.001 -5.788 -2.023 149 H VAL 17 H VAL 17 4.514 -3.076 -0.102 150 HA VAL 17 HA VAL 17 5.730 -5.268 1.288 151 HB VAL 17 HB VAL 17 6.894 -2.885 -0.198 152 HG11 VAL 17 HG11 VAL 17 9.053 -4.119 -0.241 153 HG12 VAL 17 HG12 VAL 17 8.638 -3.549 1.376 154 HG13 VAL 17 HG13 VAL 17 8.404 -5.257 0.958 155 HG21 VAL 17 HG21 VAL 17 6.751 -5.847 -0.895 156 HG22 VAL 17 HG22 VAL 17 5.660 -4.607 -1.531 157 HG23 VAL 17 HG23 VAL 17 7.377 -4.543 -1.924 158 H GLU 18 H GLU 18 5.882 -1.687 2.012 159 HA GLU 18 HA GLU 18 7.390 -2.094 4.405 160 HB2 GLU 18 HB2 GLU 18 6.964 0.138 3.145 161 HB3 GLU 18 HB3 GLU 18 5.419 0.161 4.022 162 HG2 GLU 18 HG2 GLU 18 6.934 1.545 5.187 163 HG3 GLU 18 HG3 GLU 18 6.568 0.128 6.155 164 H ASP 19 H ASP 19 3.799 -1.834 4.000 165 HA ASP 19 HA ASP 19 3.092 -2.251 6.686 166 HB2 ASP 19 HB2 ASP 19 1.663 -3.022 4.151 167 HB3 ASP 19 HB3 ASP 19 1.043 -3.464 5.726 168 H VAL 20 H VAL 20 3.713 -4.933 4.335 169 HA VAL 20 HA VAL 20 3.398 -6.880 6.457 170 HB VAL 20 HB VAL 20 4.086 -8.579 5.027 171 HG11 VAL 20 HG11 VAL 20 1.843 -7.500 4.630 172 HG12 VAL 20 HG12 VAL 20 2.560 -6.607 3.287 173 HG13 VAL 20 HG13 VAL 20 2.508 -8.384 3.243 174 HG21 VAL 20 HG21 VAL 20 5.057 -6.506 3.045 175 HG22 VAL 20 HG22 VAL 20 6.079 -7.631 3.963 176 HG23 VAL 20 HG23 VAL 20 4.943 -8.251 2.759 177 H ARG 21 H ARG 21 6.272 -5.098 5.335 178 HA ARG 21 HA ARG 21 8.174 -6.619 6.894 179 HB2 ARG 21 HB2 ARG 21 8.700 -4.987 5.029 180 HB3 ARG 21 HB3 ARG 21 8.311 -3.661 6.135 181 HG2 ARG 21 HG2 ARG 21 10.125 -4.496 7.689 182 HG3 ARG 21 HG3 ARG 21 10.488 -5.759 6.503 183 HD2 ARG 21 HD2 ARG 21 12.078 -4.097 6.029 184 HD3 ARG 21 HD3 ARG 21 10.848 -3.853 4.800 185 HE ARG 21 HE ARG 21 10.250 -1.795 5.755 186 HH11 ARG 21 HH11 ARG 21 12.647 -3.318 7.856 187 HH12 ARG 21 HH12 ARG 21 12.918 -1.838 8.733 188 HH21 ARG 21 HH21 ARG 21 10.556 -0.028 6.978 189 HH22 ARG 21 HH22 ARG 21 11.788 -0.003 8.224 190 H LEU 22 H LEU 22 6.300 -3.688 7.650 191 HA LEU 22 HA LEU 22 7.104 -3.326 10.379 192 HB2 LEU 22 HB2 LEU 22 4.578 -2.637 8.815 193 HB3 LEU 22 HB3 LEU 22 4.794 -2.162 10.490 194 HG LEU 22 HG LEU 22 6.852 -1.378 8.391 195 HD11 LEU 22 HD11 LEU 22 4.743 -0.525 7.496 196 HD12 LEU 22 HD12 LEU 22 4.270 0.096 9.100 197 HD13 LEU 22 HD13 LEU 22 5.636 0.805 8.209 198 HD21 LEU 22 HD21 LEU 22 7.268 0.470 9.951 199 HD22 LEU 22 HD22 LEU 22 5.979 -0.118 11.024 200 HD23 LEU 22 HD23 LEU 22 7.448 -1.085 10.774 201 H ILE 23 H ILE 23 4.272 -5.100 9.023 202 HA ILE 23 HA ILE 23 3.363 -6.098 11.537 203 HB ILE 23 HB ILE 23 2.938 -6.907 8.652 204 HG12 ILE 23 HG12 ILE 23 1.842 -4.840 9.321 205 HG13 ILE 23 HG13 ILE 23 0.644 -6.091 9.068 206 HG21 ILE 23 HG21 ILE 23 2.658 -9.018 9.775 207 HG22 ILE 23 HG22 ILE 23 1.638 -8.278 11.030 208 HG23 ILE 23 HG23 ILE 23 1.079 -8.368 9.345 209 HD11 ILE 23 HD11 ILE 23 0.696 -6.389 11.672 210 HD12 ILE 23 HD12 ILE 23 1.586 -4.852 11.672 211 HD13 ILE 23 HD13 ILE 23 -0.047 -4.928 11.017 212 H ARG 24 H ARG 24 5.579 -7.716 9.209 213 HA ARG 24 HA ARG 24 5.945 -10.080 10.776 214 HB2 ARG 24 HB2 ARG 24 6.555 -9.917 8.409 215 HB3 ARG 24 HB3 ARG 24 7.744 -8.667 8.763 216 HG2 ARG 24 HG2 ARG 24 8.844 -10.764 8.323 217 HG3 ARG 24 HG3 ARG 24 9.140 -10.272 9.987 218 HD2 ARG 24 HD2 ARG 24 7.470 -11.903 10.789 219 HD3 ARG 24 HD3 ARG 24 7.081 -12.347 9.109 220 HE ARG 24 HE ARG 24 9.883 -12.650 9.507 221 HH11 ARG 24 HH11 ARG 24 10.836 -14.633 9.667 222 HH12 ARG 24 HH12 ARG 24 9.914 -16.012 10.186 223 HH21 ARG 24 HH21 ARG 24 6.973 -14.303 10.637 224 HH22 ARG 24 HH22 ARG 24 7.791 -15.833 10.694 225 H GLU 25 H GLU 25 7.731 -6.972 10.863 226 HA GLU 25 HA GLU 25 9.582 -7.766 12.914 227 HB2 GLU 25 HB2 GLU 25 9.989 -5.862 11.445 228 HB3 GLU 25 HB3 GLU 25 8.541 -5.055 12.031 229 HG2 GLU 25 HG2 GLU 25 10.445 -4.005 13.002 230 HG3 GLU 25 HG3 GLU 25 9.528 -4.799 14.271 231 H GLN 26 H GLN 26 6.379 -6.150 13.149 232 HA GLN 26 HA GLN 26 6.411 -5.808 16.002 233 HB2 GLN 26 HB2 GLN 26 4.158 -6.003 13.973 234 HB3 GLN 26 HB3 GLN 26 3.888 -5.634 15.680 235 HG2 GLN 26 HG2 GLN 26 4.992 -3.553 15.554 236 HG3 GLN 26 HG3 GLN 26 5.760 -3.925 14.013 237 HE21 GLN 26 HE21 GLN 26 1.757 -3.417 13.380 238 HE22 GLN 26 HE22 GLN 26 2.266 -4.679 14.482 239 H HIS 27 H HIS 27 4.909 -8.356 13.975 240 HA HIS 27 HA HIS 27 4.511 -10.109 16.382 241 HB2 HIS 27 HB2 HIS 27 2.370 -9.518 14.291 242 HB3 HIS 27 HB3 HIS 27 2.199 -10.468 15.772 243 HD1 HIS 27 HD1 HIS 27 3.006 -8.496 18.025 244 HD2 HIS 27 HD2 HIS 27 0.835 -7.515 14.532 245 HE1 HIS 27 HE1 HIS 27 1.592 -6.424 18.604 246 HE2 HIS 27 HE2 HIS 27 0.270 -5.819 16.463 247 HA PRO 28 HA PRO 28 6.586 -12.153 12.790 248 HB2 PRO 28 HB2 PRO 28 7.506 -13.933 15.060 249 HB3 PRO 28 HB3 PRO 28 8.417 -13.387 13.611 250 HG2 PRO 28 HG2 PRO 28 8.797 -12.141 15.978 251 HG3 PRO 28 HG3 PRO 28 8.605 -11.158 14.494 252 HD2 PRO 28 HD2 PRO 28 6.546 -11.791 16.613 253 HD3 PRO 28 HD3 PRO 28 6.906 -10.233 15.808 254 H THR 29 H THR 29 4.603 -13.754 15.264 255 HA THR 29 HA THR 29 4.018 -16.089 13.629 256 HB THR 29 HB THR 29 2.761 -16.928 15.398 257 HG1 THR 29 HG1 THR 29 2.070 -15.618 17.115 258 HG21 THR 29 HG21 THR 29 4.175 -16.814 17.338 259 HG22 THR 29 HG22 THR 29 5.230 -16.735 15.918 260 HG23 THR 29 HG23 THR 29 4.870 -15.257 16.844 261 H LYS 30 H LYS 30 2.750 -12.977 13.334 262 HA LYS 30 HA LYS 30 0.068 -14.016 12.545 263 HB2 LYS 30 HB2 LYS 30 0.914 -11.172 13.139 264 HB3 LYS 30 HB3 LYS 30 -0.678 -11.671 12.527 265 HG2 LYS 30 HG2 LYS 30 -1.038 -13.077 14.517 266 HG3 LYS 30 HG3 LYS 30 0.539 -12.610 15.163 267 HD2 LYS 30 HD2 LYS 30 -0.197 -10.263 15.351 268 HD3 LYS 30 HD3 LYS 30 -1.765 -10.670 14.631 269 HE2 LYS 30 HE2 LYS 30 -2.337 -12.131 16.482 270 HE3 LYS 30 HE3 LYS 30 -0.709 -12.024 17.163 271 HZ1 LYS 30 HZ1 LYS 30 -2.437 -10.588 18.269 272 HZ2 LYS 30 HZ2 LYS 30 -1.126 -9.723 17.758 273 HZ3 LYS 30 HZ3 LYS 30 -2.549 -9.666 16.938 274 H ILE 31 H ILE 31 -0.799 -13.829 10.694 275 HA ILE 31 HA ILE 31 0.838 -13.399 8.295 276 HB ILE 31 HB ILE 31 -2.007 -14.417 8.644 277 HG12 ILE 31 HG12 ILE 31 -0.592 -15.899 9.904 278 HG13 ILE 31 HG13 ILE 31 -1.126 -16.693 8.435 279 HG21 ILE 31 HG21 ILE 31 -1.721 -15.433 6.438 280 HG22 ILE 31 HG22 ILE 31 -1.597 -13.679 6.348 281 HG23 ILE 31 HG23 ILE 31 -0.121 -14.664 6.268 282 HD11 ILE 31 HD11 ILE 31 1.122 -16.266 7.401 283 HD12 ILE 31 HD12 ILE 31 1.652 -15.540 8.934 284 HD13 ILE 31 HD13 ILE 31 1.196 -17.249 8.869 285 HA PRO 32 HA PRO 32 -1.464 -9.488 7.584 286 HB2 PRO 32 HB2 PRO 32 -0.254 -8.671 5.290 287 HB3 PRO 32 HB3 PRO 32 0.562 -8.598 6.879 288 HG2 PRO 32 HG2 PRO 32 0.862 -10.718 4.736 289 HG3 PRO 32 HG3 PRO 32 2.147 -9.904 5.672 290 HD2 PRO 32 HD2 PRO 32 1.130 -12.377 6.301 291 HD3 PRO 32 HD3 PRO 32 1.779 -11.245 7.531 292 H VAL 33 H VAL 33 -3.491 -9.372 6.714 293 HA VAL 33 HA VAL 33 -4.129 -10.970 4.271 294 HB VAL 33 HB VAL 33 -5.916 -10.773 6.704 295 HG11 VAL 33 HG11 VAL 33 -6.081 -12.536 4.231 296 HG12 VAL 33 HG12 VAL 33 -7.172 -12.592 5.635 297 HG13 VAL 33 HG13 VAL 33 -7.154 -11.164 4.600 298 HG21 VAL 33 HG21 VAL 33 -4.054 -13.015 5.828 299 HG22 VAL 33 HG22 VAL 33 -4.037 -12.133 7.369 300 HG23 VAL 33 HG23 VAL 33 -5.376 -13.221 6.990 301 H ILE 34 H ILE 34 -5.440 -10.119 2.789 302 HA ILE 34 HA ILE 34 -6.503 -7.344 3.185 303 HB ILE 34 HB ILE 34 -6.134 -8.825 0.566 304 HG12 ILE 34 HG12 ILE 34 -3.907 -8.677 1.480 305 HG13 ILE 34 HG13 ILE 34 -4.091 -7.564 0.142 306 HG21 ILE 34 HG21 ILE 34 -6.631 -5.896 1.262 307 HG22 ILE 34 HG22 ILE 34 -6.211 -6.484 -0.362 308 HG23 ILE 34 HG23 ILE 34 -7.712 -7.011 0.398 309 HD11 ILE 34 HD11 ILE 34 -2.774 -6.585 1.956 310 HD12 ILE 34 HD12 ILE 34 -4.263 -5.672 1.655 311 HD13 ILE 34 HD13 ILE 34 -4.144 -6.742 3.071 312 H ILE 35 H ILE 35 -8.750 -7.023 2.992 313 HA ILE 35 HA ILE 35 -10.334 -9.299 2.014 314 HB ILE 35 HB ILE 35 -10.485 -9.621 4.376 315 HG12 ILE 35 HG12 ILE 35 -13.088 -8.485 3.224 316 HG13 ILE 35 HG13 ILE 35 -12.419 -10.088 2.881 317 HG21 ILE 35 HG21 ILE 35 -11.547 -7.935 5.867 318 HG22 ILE 35 HG22 ILE 35 -10.062 -7.305 5.169 319 HG23 ILE 35 HG23 ILE 35 -11.639 -6.788 4.531 320 HD11 ILE 35 HD11 ILE 35 -12.589 -10.658 5.313 321 HD12 ILE 35 HD12 ILE 35 -13.460 -9.123 5.561 322 HD13 ILE 35 HD13 ILE 35 -14.139 -10.364 4.502 323 H GLU 36 H GLU 36 -11.705 -8.764 0.449 324 HA GLU 36 HA GLU 36 -12.955 -6.060 0.433 325 HB2 GLU 36 HB2 GLU 36 -11.244 -7.161 -1.838 326 HB3 GLU 36 HB3 GLU 36 -12.350 -5.816 -2.013 327 HG2 GLU 36 HG2 GLU 36 -9.882 -5.843 -0.221 328 HG3 GLU 36 HG3 GLU 36 -10.000 -5.136 -1.819 329 H ARG 37 H ARG 37 -14.879 -5.976 -0.446 330 HA ARG 37 HA ARG 37 -16.410 -8.323 -1.140 331 HB2 ARG 37 HB2 ARG 37 -17.168 -6.138 -0.190 332 HB3 ARG 37 HB3 ARG 37 -16.896 -5.374 -1.754 333 HG2 ARG 37 HG2 ARG 37 -18.724 -6.573 -2.742 334 HG3 ARG 37 HG3 ARG 37 -18.807 -7.715 -1.383 335 HD2 ARG 37 HD2 ARG 37 -20.623 -6.051 -1.291 336 HD3 ARG 37 HD3 ARG 37 -19.605 -5.987 0.136 337 HE ARG 37 HE ARG 37 -19.914 -3.946 -1.979 338 HH11 ARG 37 HH11 ARG 37 -18.383 -4.651 1.095 339 HH12 ARG 37 HH12 ARG 37 -17.498 -3.149 1.103 340 HH21 ARG 37 HH21 ARG 37 -18.787 -2.008 -1.880 341 HH22 ARG 37 HH22 ARG 37 -17.762 -1.681 -0.525 342 H TYR 38 H TYR 38 -17.094 -9.076 -3.190 343 HA TYR 38 HA TYR 38 -15.148 -9.081 -5.148 344 HB2 TYR 38 HB2 TYR 38 -16.405 -10.967 -5.097 345 HB3 TYR 38 HB3 TYR 38 -17.928 -10.093 -5.118 346 HD1 TYR 38 HD1 TYR 38 -19.188 -10.027 -7.072 347 HD2 TYR 38 HD2 TYR 38 -14.940 -10.768 -7.326 348 HE1 TYR 38 HE1 TYR 38 -19.379 -10.331 -9.535 349 HE2 TYR 38 HE2 TYR 38 -15.136 -11.037 -9.787 350 HH TYR 38 HH TYR 38 -18.275 -10.880 -11.501 351 H LYS 39 H LYS 39 -14.642 -8.330 -7.107 352 HA LYS 39 HA LYS 39 -15.001 -5.568 -7.482 353 HB2 LYS 39 HB2 LYS 39 -14.018 -7.728 -9.393 354 HB3 LYS 39 HB3 LYS 39 -13.933 -6.001 -9.749 355 HG2 LYS 39 HG2 LYS 39 -12.511 -5.603 -7.800 356 HG3 LYS 39 HG3 LYS 39 -12.606 -7.313 -7.338 357 HD2 LYS 39 HD2 LYS 39 -11.559 -7.984 -9.471 358 HD3 LYS 39 HD3 LYS 39 -11.453 -6.297 -9.979 359 HE2 LYS 39 HE2 LYS 39 -10.080 -7.465 -7.508 360 HE3 LYS 39 HE3 LYS 39 -9.319 -7.314 -9.090 361 HZ1 LYS 39 HZ1 LYS 39 -10.291 -5.015 -7.459 362 HZ2 LYS 39 HZ2 LYS 39 -8.735 -5.420 -7.712 363 HZ3 LYS 39 HZ3 LYS 39 -9.637 -4.887 -8.956 364 H GLY 40 H GLY 40 -16.518 -8.169 -9.390 365 HA2 GLY 40 HA2 GLY 40 -17.735 -6.338 -11.260 366 HA3 GLY 40 HA3 GLY 40 -17.971 -8.080 -11.176 367 H GLU 41 H GLU 41 -18.939 -7.530 -8.208 368 HA GLU 41 HA GLU 41 -21.606 -6.369 -8.753 369 HB2 GLU 41 HB2 GLU 41 -21.908 -8.604 -9.577 370 HB3 GLU 41 HB3 GLU 41 -21.111 -9.295 -8.178 371 HG2 GLU 41 HG2 GLU 41 -23.413 -9.761 -8.001 372 HG3 GLU 41 HG3 GLU 41 -22.965 -8.650 -6.728 373 H LYS 42 H LYS 42 -21.633 -4.885 -7.201 374 HA LYS 42 HA LYS 42 -20.644 -5.410 -4.467 375 HB2 LYS 42 HB2 LYS 42 -21.940 -2.903 -5.617 376 HB3 LYS 42 HB3 LYS 42 -21.058 -3.032 -4.106 377 HG2 LYS 42 HG2 LYS 42 -19.943 -3.134 -6.928 378 HG3 LYS 42 HG3 LYS 42 -19.694 -1.906 -5.690 379 HD2 LYS 42 HD2 LYS 42 -18.527 -3.761 -4.307 380 HD3 LYS 42 HD3 LYS 42 -18.535 -4.711 -5.794 381 HE2 LYS 42 HE2 LYS 42 -17.142 -2.031 -5.292 382 HE3 LYS 42 HE3 LYS 42 -16.363 -3.591 -5.482 383 HZ1 LYS 42 HZ1 LYS 42 -16.245 -2.319 -7.546 384 HZ2 LYS 42 HZ2 LYS 42 -17.183 -3.630 -7.829 385 HZ3 LYS 42 HZ3 LYS 42 -17.864 -2.147 -7.632 386 H GLN 43 H GLN 43 -22.606 -7.181 -4.788 387 HA GLN 43 HA GLN 43 -25.274 -6.175 -4.306 388 HB2 GLN 43 HB2 GLN 43 -24.656 -8.295 -5.467 389 HB3 GLN 43 HB3 GLN 43 -24.230 -9.020 -3.915 390 HG2 GLN 43 HG2 GLN 43 -26.567 -8.737 -3.159 391 HG3 GLN 43 HG3 GLN 43 -26.963 -7.884 -4.662 392 HE21 GLN 43 HE21 GLN 43 -26.733 -10.990 -6.638 393 HE22 GLN 43 HE22 GLN 43 -26.269 -9.293 -6.773 394 H LEU 44 H LEU 44 -22.907 -7.704 -2.111 395 HA LEU 44 HA LEU 44 -24.597 -7.360 0.227 396 HB2 LEU 44 HB2 LEU 44 -21.716 -8.136 -0.279 397 HB3 LEU 44 HB3 LEU 44 -22.229 -7.787 1.368 398 HG LEU 44 HG LEU 44 -23.560 -9.895 -0.390 399 HD11 LEU 44 HD11 LEU 44 -21.485 -10.195 1.815 400 HD12 LEU 44 HD12 LEU 44 -22.307 -11.527 0.961 401 HD13 LEU 44 HD13 LEU 44 -21.204 -10.457 0.076 402 HD21 LEU 44 HD21 LEU 44 -25.039 -9.132 1.447 403 HD22 LEU 44 HD22 LEU 44 -24.424 -10.748 1.790 404 HD23 LEU 44 HD23 LEU 44 -23.715 -9.354 2.617 405 HA PRO 45 HA PRO 45 -24.059 -3.210 1.239 406 HB2 PRO 45 HB2 PRO 45 -23.270 -3.860 4.063 407 HB3 PRO 45 HB3 PRO 45 -24.598 -2.833 3.469 408 HG2 PRO 45 HG2 PRO 45 -25.057 -5.360 4.419 409 HG3 PRO 45 HG3 PRO 45 -25.958 -4.720 3.001 410 HD2 PRO 45 HD2 PRO 45 -23.583 -6.588 3.048 411 HD3 PRO 45 HD3 PRO 45 -25.074 -6.638 2.056 412 H VAL 46 H VAL 46 -22.692 -1.416 1.884 413 HA VAL 46 HA VAL 46 -19.811 -1.787 1.468 414 HB VAL 46 HB VAL 46 -21.218 0.806 2.168 415 HG11 VAL 46 HG11 VAL 46 -18.646 0.257 0.617 416 HG12 VAL 46 HG12 VAL 46 -19.335 1.843 0.993 417 HG13 VAL 46 HG13 VAL 46 -18.726 0.832 2.299 418 HG21 VAL 46 HG21 VAL 46 -20.809 -0.429 -0.583 419 HG22 VAL 46 HG22 VAL 46 -22.361 -0.040 0.191 420 HG23 VAL 46 HG23 VAL 46 -21.274 1.260 -0.275 421 H LEU 47 H LEU 47 -19.768 -3.289 3.286 422 HA LEU 47 HA LEU 47 -19.886 -2.335 6.015 423 HB2 LEU 47 HB2 LEU 47 -18.670 -4.850 4.790 424 HB3 LEU 47 HB3 LEU 47 -18.929 -4.604 6.518 425 HG LEU 47 HG LEU 47 -21.204 -4.546 4.480 426 HD11 LEU 47 HD11 LEU 47 -20.227 -6.851 6.147 427 HD12 LEU 47 HD12 LEU 47 -21.723 -6.820 5.198 428 HD13 LEU 47 HD13 LEU 47 -20.155 -6.717 4.369 429 HD21 LEU 47 HD21 LEU 47 -21.162 -4.808 7.509 430 HD22 LEU 47 HD22 LEU 47 -21.790 -3.435 6.573 431 HD23 LEU 47 HD23 LEU 47 -22.599 -5.005 6.491 432 H ASP 48 H ASP 48 -18.162 -2.230 7.546 433 HA ASP 48 HA ASP 48 -15.983 -0.663 6.505 434 HB2 ASP 48 HB2 ASP 48 -15.469 -0.159 8.876 435 HB3 ASP 48 HB3 ASP 48 -17.073 0.257 8.309 436 H LYS 49 H LYS 49 -15.490 -3.108 5.528 437 HA LYS 49 HA LYS 49 -13.114 -4.150 7.041 438 HB2 LYS 49 HB2 LYS 49 -15.402 -5.618 5.742 439 HB3 LYS 49 HB3 LYS 49 -13.797 -6.303 5.586 440 HG2 LYS 49 HG2 LYS 49 -14.769 -7.330 7.467 441 HG3 LYS 49 HG3 LYS 49 -13.485 -6.280 8.026 442 HD2 LYS 49 HD2 LYS 49 -16.086 -4.875 8.080 443 HD3 LYS 49 HD3 LYS 49 -16.157 -6.414 8.937 444 HE2 LYS 49 HE2 LYS 49 -14.120 -5.807 10.225 445 HE3 LYS 49 HE3 LYS 49 -14.075 -4.243 9.417 446 HZ1 LYS 49 HZ1 LYS 49 -16.322 -5.177 11.114 447 HZ2 LYS 49 HZ2 LYS 49 -15.099 -4.167 11.589 448 HZ3 LYS 49 HZ3 LYS 49 -16.185 -3.698 10.419 449 H THR 50 H THR 50 -11.287 -3.916 6.092 450 HA THR 50 HA THR 50 -10.992 -4.091 3.134 451 HB THR 50 HB THR 50 -9.698 -2.152 2.956 452 HG1 THR 50 HG1 THR 50 -9.569 -0.814 4.965 453 HG21 THR 50 HG21 THR 50 -12.063 -1.315 4.681 454 HG22 THR 50 HG22 THR 50 -11.197 -0.343 3.474 455 HG23 THR 50 HG23 THR 50 -12.168 -1.723 2.952 456 H LYS 51 H LYS 51 -9.425 -4.392 6.284 457 HA LYS 51 HA LYS 51 -7.215 -6.059 5.176 458 HB2 LYS 51 HB2 LYS 51 -6.507 -3.708 5.070 459 HB3 LYS 51 HB3 LYS 51 -7.001 -3.451 6.734 460 HG2 LYS 51 HG2 LYS 51 -5.179 -4.948 7.518 461 HG3 LYS 51 HG3 LYS 51 -4.682 -5.219 5.829 462 HD2 LYS 51 HD2 LYS 51 -4.236 -2.843 5.541 463 HD3 LYS 51 HD3 LYS 51 -4.898 -2.470 7.142 464 HE2 LYS 51 HE2 LYS 51 -3.068 -3.795 8.199 465 HE3 LYS 51 HE3 LYS 51 -2.358 -4.088 6.609 466 HZ1 LYS 51 HZ1 LYS 51 -1.723 -1.814 6.426 467 HZ2 LYS 51 HZ2 LYS 51 -2.822 -1.299 7.548 468 HZ3 LYS 51 HZ3 LYS 51 -1.493 -2.104 8.011 469 H PHE 52 H PHE 52 -6.222 -7.395 6.721 470 HA PHE 52 HA PHE 52 -7.004 -7.350 9.519 471 HB2 PHE 52 HB2 PHE 52 -7.930 -9.552 7.704 472 HB3 PHE 52 HB3 PHE 52 -7.579 -9.899 9.381 473 HD1 PHE 52 HD1 PHE 52 -10.206 -9.198 7.277 474 HD2 PHE 52 HD2 PHE 52 -8.622 -8.042 11.104 475 HE1 PHE 52 HE1 PHE 52 -12.483 -8.504 8.020 476 HE2 PHE 52 HE2 PHE 52 -10.887 -7.340 11.837 477 HZ PHE 52 HZ PHE 52 -12.815 -7.583 10.307 478 H LEU 53 H LEU 53 -5.944 -8.978 10.913 479 HA LEU 53 HA LEU 53 -3.387 -10.047 9.812 480 HB2 LEU 53 HB2 LEU 53 -3.746 -8.991 12.632 481 HB3 LEU 53 HB3 LEU 53 -2.264 -9.609 11.920 482 HG LEU 53 HG LEU 53 -3.653 -7.006 11.167 483 HD11 LEU 53 HD11 LEU 53 -1.077 -7.538 12.705 484 HD12 LEU 53 HD12 LEU 53 -1.758 -5.937 12.307 485 HD13 LEU 53 HD13 LEU 53 -2.612 -7.017 13.422 486 HD21 LEU 53 HD21 LEU 53 -1.590 -6.503 9.908 487 HD22 LEU 53 HD22 LEU 53 -0.962 -8.126 10.294 488 HD23 LEU 53 HD23 LEU 53 -2.379 -7.933 9.250 489 H VAL 54 H VAL 54 -2.986 -12.226 10.527 490 HA VAL 54 HA VAL 54 -4.936 -13.328 12.499 491 HB VAL 54 HB VAL 54 -4.408 -14.853 9.981 492 HG11 VAL 54 HG11 VAL 54 -6.596 -15.036 12.114 493 HG12 VAL 54 HG12 VAL 54 -6.418 -16.095 10.705 494 HG13 VAL 54 HG13 VAL 54 -5.191 -16.118 11.974 495 HG21 VAL 54 HG21 VAL 54 -5.603 -12.804 9.289 496 HG22 VAL 54 HG22 VAL 54 -6.650 -14.219 9.185 497 HG23 VAL 54 HG23 VAL 54 -6.826 -13.090 10.543 498 HA PRO 55 HA PRO 55 -1.202 -15.342 14.075 499 HB2 PRO 55 HB2 PRO 55 -3.177 -17.043 15.565 500 HB3 PRO 55 HB3 PRO 55 -1.739 -16.185 16.173 501 HG2 PRO 55 HG2 PRO 55 -4.251 -15.242 16.615 502 HG3 PRO 55 HG3 PRO 55 -2.883 -14.138 16.281 503 HD2 PRO 55 HD2 PRO 55 -5.062 -15.056 14.414 504 HD3 PRO 55 HD3 PRO 55 -4.324 -13.439 14.591 505 H ASP 56 H ASP 56 -0.085 -17.045 13.274 506 HA ASP 56 HA ASP 56 -0.880 -18.373 11.040 507 HB2 ASP 56 HB2 ASP 56 1.101 -19.877 11.421 508 HB3 ASP 56 HB3 ASP 56 1.364 -18.143 11.417 509 H HIS 57 H HIS 57 -1.375 -19.706 14.245 510 HA HIS 57 HA HIS 57 -2.153 -22.331 13.256 511 HB2 HIS 57 HB2 HIS 57 -0.989 -21.589 15.500 512 HB3 HIS 57 HB3 HIS 57 -2.628 -21.368 16.091 513 HD1 HIS 57 HD1 HIS 57 -4.105 -23.925 15.209 514 HD2 HIS 57 HD2 HIS 57 -0.066 -23.776 16.427 515 HE1 HIS 57 HE1 HIS 57 -3.514 -26.293 16.084 516 HE2 HIS 57 HE2 HIS 57 -1.039 -26.188 16.797 517 H VAL 58 H VAL 58 -3.994 -19.456 13.298 518 HA VAL 58 HA VAL 58 -6.549 -20.432 14.264 519 HB VAL 58 HB VAL 58 -5.852 -18.208 12.339 520 HG11 VAL 58 HG11 VAL 58 -8.560 -18.872 13.582 521 HG12 VAL 58 HG12 VAL 58 -8.159 -17.342 12.775 522 HG13 VAL 58 HG13 VAL 58 -8.161 -18.837 11.845 523 HG21 VAL 58 HG21 VAL 58 -5.108 -17.863 14.677 524 HG22 VAL 58 HG22 VAL 58 -6.464 -16.787 14.299 525 HG23 VAL 58 HG23 VAL 58 -6.737 -18.247 15.266 526 H ASN 59 H ASN 59 -7.981 -21.797 13.328 527 HA ASN 59 HA ASN 59 -7.499 -23.056 10.751 528 HB2 ASN 59 HB2 ASN 59 -9.983 -23.126 12.523 529 HB3 ASN 59 HB3 ASN 59 -9.571 -24.272 11.257 530 HD21 ASN 59 HD21 ASN 59 -7.370 -26.141 13.347 531 HD22 ASN 59 HD22 ASN 59 -7.897 -25.858 11.686 532 H MET 60 H MET 60 -8.650 -22.740 8.765 533 HA MET 60 HA MET 60 -9.605 -20.160 8.198 534 HB2 MET 60 HB2 MET 60 -10.029 -22.809 6.808 535 HB3 MET 60 HB3 MET 60 -10.738 -21.331 6.169 536 HG2 MET 60 HG2 MET 60 -7.800 -21.951 6.554 537 HG3 MET 60 HG3 MET 60 -8.677 -21.783 5.038 538 HE1 MET 60 HE1 MET 60 -9.937 -19.467 4.412 539 HE2 MET 60 HE2 MET 60 -10.427 -18.942 6.037 540 HE3 MET 60 HE3 MET 60 -9.441 -17.873 5.019 541 H SER 61 H SER 61 -11.733 -23.017 8.904 542 HA SER 61 HA SER 61 -14.167 -21.593 8.728 543 HB2 SER 61 HB2 SER 61 -15.067 -23.378 10.183 544 HB3 SER 61 HB3 SER 61 -14.052 -24.013 8.871 545 HG SER 61 HG SER 61 -13.600 -24.963 10.975 546 H GLU 62 H GLU 62 -11.918 -21.787 11.499 547 HA GLU 62 HA GLU 62 -13.560 -20.288 13.335 548 HB2 GLU 62 HB2 GLU 62 -11.738 -21.720 14.126 549 HB3 GLU 62 HB3 GLU 62 -10.560 -20.771 13.239 550 HG2 GLU 62 HG2 GLU 62 -10.382 -20.186 15.519 551 HG3 GLU 62 HG3 GLU 62 -11.015 -18.798 14.658 552 H LEU 63 H LEU 63 -10.988 -19.259 11.028 553 HA LEU 63 HA LEU 63 -11.160 -16.456 11.603 554 HB2 LEU 63 HB2 LEU 63 -9.311 -17.389 10.295 555 HB3 LEU 63 HB3 LEU 63 -10.421 -17.923 9.041 556 HG LEU 63 HG LEU 63 -10.998 -15.530 8.548 557 HD11 LEU 63 HD11 LEU 63 -9.456 -13.768 9.410 558 HD12 LEU 63 HD12 LEU 63 -10.432 -14.465 10.705 559 HD13 LEU 63 HD13 LEU 63 -8.738 -14.957 10.520 560 HD21 LEU 63 HD21 LEU 63 -9.282 -16.695 7.238 561 HD22 LEU 63 HD22 LEU 63 -8.885 -14.984 7.425 562 HD23 LEU 63 HD23 LEU 63 -8.043 -16.201 8.419 563 H ILE 64 H ILE 64 -13.006 -18.453 9.223 564 HA ILE 64 HA ILE 64 -14.619 -16.312 8.251 565 HB ILE 64 HB ILE 64 -14.872 -19.309 8.303 566 HG12 ILE 64 HG12 ILE 64 -15.438 -18.550 5.774 567 HG13 ILE 64 HG13 ILE 64 -14.626 -17.078 6.255 568 HG21 ILE 64 HG21 ILE 64 -17.073 -19.283 7.215 569 HG22 ILE 64 HG22 ILE 64 -17.179 -18.724 8.871 570 HG23 ILE 64 HG23 ILE 64 -17.230 -17.543 7.533 571 HD11 ILE 64 HD11 ILE 64 -13.162 -18.780 5.137 572 HD12 ILE 64 HD12 ILE 64 -12.593 -18.319 6.751 573 HD13 ILE 64 HD13 ILE 64 -13.434 -19.880 6.499 574 H LYS 65 H LYS 65 -15.115 -18.291 11.185 575 HA LYS 65 HA LYS 65 -17.666 -17.216 11.836 576 HB2 LYS 65 HB2 LYS 65 -16.502 -19.255 12.801 577 HB3 LYS 65 HB3 LYS 65 -15.559 -18.162 13.825 578 HG2 LYS 65 HG2 LYS 65 -17.688 -17.279 14.799 579 HG3 LYS 65 HG3 LYS 65 -18.593 -18.386 13.734 580 HD2 LYS 65 HD2 LYS 65 -17.519 -20.337 14.849 581 HD3 LYS 65 HD3 LYS 65 -16.549 -19.244 15.837 582 HE2 LYS 65 HE2 LYS 65 -18.323 -20.036 17.211 583 HE3 LYS 65 HE3 LYS 65 -18.627 -18.334 16.879 584 HZ1 LYS 65 HZ1 LYS 65 -20.298 -19.020 15.221 585 HZ2 LYS 65 HZ2 LYS 65 -19.955 -20.607 15.467 586 HZ3 LYS 65 HZ3 LYS 65 -20.636 -19.717 16.652 587 H ILE 66 H ILE 66 -14.432 -16.018 12.954 588 HA ILE 66 HA ILE 66 -15.599 -13.700 14.259 589 HB ILE 66 HB ILE 66 -13.532 -14.356 15.069 590 HG12 ILE 66 HG12 ILE 66 -13.884 -11.910 15.078 591 HG13 ILE 66 HG13 ILE 66 -12.220 -12.433 15.183 592 HG21 ILE 66 HG21 ILE 66 -12.455 -15.516 13.296 593 HG22 ILE 66 HG22 ILE 66 -12.271 -14.042 12.325 594 HG23 ILE 66 HG23 ILE 66 -11.375 -14.242 13.848 595 HD11 ILE 66 HD11 ILE 66 -12.001 -11.853 12.669 596 HD12 ILE 66 HD12 ILE 66 -13.515 -10.970 12.881 597 HD13 ILE 66 HD13 ILE 66 -12.105 -10.534 13.839 598 H ILE 67 H ILE 67 -14.269 -14.142 10.961 599 HA ILE 67 HA ILE 67 -14.559 -11.415 10.167 600 HB ILE 67 HB ILE 67 -14.493 -14.009 8.601 601 HG12 ILE 67 HG12 ILE 67 -12.415 -13.383 9.832 602 HG13 ILE 67 HG13 ILE 67 -12.216 -13.479 8.092 603 HG21 ILE 67 HG21 ILE 67 -13.931 -12.607 6.580 604 HG22 ILE 67 HG22 ILE 67 -15.615 -12.540 7.091 605 HG23 ILE 67 HG23 ILE 67 -14.523 -11.184 7.473 606 HD11 ILE 67 HD11 ILE 67 -12.197 -11.026 7.951 607 HD12 ILE 67 HD12 ILE 67 -12.447 -10.920 9.719 608 HD13 ILE 67 HD13 ILE 67 -10.963 -11.625 9.075 609 H ARG 68 H ARG 68 -16.967 -14.099 9.742 610 HA ARG 68 HA ARG 68 -18.933 -12.447 8.460 611 HB2 ARG 68 HB2 ARG 68 -18.834 -15.012 8.619 612 HB3 ARG 68 HB3 ARG 68 -19.509 -14.854 10.243 613 HG2 ARG 68 HG2 ARG 68 -21.425 -13.492 9.105 614 HG3 ARG 68 HG3 ARG 68 -20.758 -14.058 7.576 615 HD2 ARG 68 HD2 ARG 68 -20.991 -16.391 9.145 616 HD3 ARG 68 HD3 ARG 68 -22.415 -15.462 9.586 617 HE ARG 68 HE ARG 68 -21.864 -16.846 7.092 618 HH11 ARG 68 HH11 ARG 68 -23.760 -14.137 8.309 619 HH12 ARG 68 HH12 ARG 68 -24.997 -14.358 7.112 620 HH21 ARG 68 HH21 ARG 68 -23.489 -17.021 5.556 621 HH22 ARG 68 HH22 ARG 68 -24.770 -15.826 5.512 622 H ARG 69 H ARG 69 -18.409 -13.127 11.951 623 HA ARG 69 HA ARG 69 -20.611 -11.464 12.815 624 HB2 ARG 69 HB2 ARG 69 -19.710 -13.219 14.250 625 HB3 ARG 69 HB3 ARG 69 -18.130 -12.447 14.299 626 HG2 ARG 69 HG2 ARG 69 -19.355 -12.050 16.389 627 HG3 ARG 69 HG3 ARG 69 -19.060 -10.533 15.558 628 HD2 ARG 69 HD2 ARG 69 -21.487 -10.780 14.612 629 HD3 ARG 69 HD3 ARG 69 -21.667 -12.073 15.779 630 HE ARG 69 HE ARG 69 -21.632 -10.526 17.539 631 HH11 ARG 69 HH11 ARG 69 -20.915 -8.693 14.588 632 HH12 ARG 69 HH12 ARG 69 -21.643 -7.248 15.250 633 HH21 ARG 69 HH21 ARG 69 -22.350 -8.584 18.323 634 HH22 ARG 69 HH22 ARG 69 -22.305 -7.166 17.318 635 H ARG 70 H ARG 70 -17.156 -10.669 12.354 636 HA ARG 70 HA ARG 70 -17.450 -7.861 13.153 637 HB2 ARG 70 HB2 ARG 70 -15.310 -9.531 11.837 638 HB3 ARG 70 HB3 ARG 70 -15.222 -7.794 11.654 639 HG2 ARG 70 HG2 ARG 70 -13.903 -8.569 13.568 640 HG3 ARG 70 HG3 ARG 70 -15.143 -7.401 14.019 641 HD2 ARG 70 HD2 ARG 70 -16.530 -9.113 15.007 642 HD3 ARG 70 HD3 ARG 70 -15.475 -10.401 14.383 643 HE ARG 70 HE ARG 70 -13.885 -8.613 15.935 644 HH11 ARG 70 HH11 ARG 70 -16.418 -10.956 16.687 645 HH12 ARG 70 HH12 ARG 70 -15.761 -11.213 18.280 646 HH21 ARG 70 HH21 ARG 70 -13.148 -8.995 17.769 647 HH22 ARG 70 HH22 ARG 70 -13.909 -10.090 18.934 648 H LEU 71 H LEU 71 -17.995 -9.492 10.100 649 HA LEU 71 HA LEU 71 -18.581 -7.013 8.626 650 HB2 LEU 71 HB2 LEU 71 -19.066 -9.991 8.170 651 HB3 LEU 71 HB3 LEU 71 -19.651 -8.798 7.044 652 HG LEU 71 HG LEU 71 -16.701 -9.016 7.730 653 HD11 LEU 71 HD11 LEU 71 -17.543 -11.148 6.766 654 HD12 LEU 71 HD12 LEU 71 -18.254 -10.232 5.413 655 HD13 LEU 71 HD13 LEU 71 -16.489 -10.282 5.630 656 HD21 LEU 71 HD21 LEU 71 -16.407 -7.866 5.576 657 HD22 LEU 71 HD22 LEU 71 -18.155 -7.835 5.314 658 HD23 LEU 71 HD23 LEU 71 -17.444 -6.871 6.627 659 H GLN 72 H GLN 72 -20.229 -8.519 11.161 660 HA GLN 72 HA GLN 72 -22.302 -8.497 11.998 661 HB2 GLN 72 HB2 GLN 72 -22.687 -5.975 10.351 662 HB3 GLN 72 HB3 GLN 72 -23.627 -6.478 11.752 663 HG2 GLN 72 HG2 GLN 72 -20.886 -6.496 12.612 664 HG3 GLN 72 HG3 GLN 72 -21.101 -5.028 11.665 665 HE21 GLN 72 HE21 GLN 72 -23.561 -3.703 14.047 666 HE22 GLN 72 HE22 GLN 72 -23.165 -3.677 12.332 667 H LEU 73 H LEU 73 -21.964 -10.045 9.471 668 HA LEU 73 HA LEU 73 -24.596 -9.793 8.125 669 HB2 LEU 73 HB2 LEU 73 -22.162 -11.532 7.596 670 HB3 LEU 73 HB3 LEU 73 -23.658 -11.644 6.671 671 HG LEU 73 HG LEU 73 -21.991 -9.104 6.871 672 HD11 LEU 73 HD11 LEU 73 -20.781 -10.949 5.724 673 HD12 LEU 73 HD12 LEU 73 -22.160 -11.137 4.622 674 HD13 LEU 73 HD13 LEU 73 -21.214 -9.633 4.618 675 HD21 LEU 73 HD21 LEU 73 -24.305 -9.902 5.043 676 HD22 LEU 73 HD22 LEU 73 -24.340 -8.628 6.284 677 HD23 LEU 73 HD23 LEU 73 -23.315 -8.442 4.862 678 H ASN 74 H ASN 74 -26.214 -10.509 9.270 679 HA ASN 74 HA ASN 74 -26.330 -12.699 11.072 680 HB2 ASN 74 HB2 ASN 74 -27.927 -10.797 10.944 681 HB3 ASN 74 HB3 ASN 74 -28.483 -11.345 9.368 682 HD21 ASN 74 HD21 ASN 74 -30.093 -12.983 12.684 683 HD22 ASN 74 HD22 ASN 74 -28.871 -11.724 12.801 684 H ALA 75 H ALA 75 -27.345 -14.825 10.812 685 HA ALA 75 HA ALA 75 -26.354 -16.357 8.680 686 HB1 ALA 75 HB1 ALA 75 -26.927 -17.210 10.917 687 HB2 ALA 75 HB2 ALA 75 -28.658 -16.935 10.593 688 HB3 ALA 75 HB3 ALA 75 -27.753 -18.143 9.655 689 H ASN 76 H ASN 76 -29.402 -14.578 8.791 690 HA ASN 76 HA ASN 76 -30.667 -15.875 6.536 691 HB2 ASN 76 HB2 ASN 76 -31.051 -13.167 7.885 692 HB3 ASN 76 HB3 ASN 76 -32.023 -13.720 6.528 693 HD21 ASN 76 HD21 ASN 76 -32.845 -15.193 10.208 694 HD22 ASN 76 HD22 ASN 76 -31.483 -14.100 9.963 695 H GLN 77 H GLN 77 -28.035 -13.545 6.653 696 HA GLN 77 HA GLN 77 -28.398 -12.668 3.866 697 HB2 GLN 77 HB2 GLN 77 -25.967 -12.346 5.673 698 HB3 GLN 77 HB3 GLN 77 -26.271 -11.544 4.138 699 HG2 GLN 77 HG2 GLN 77 -27.575 -11.042 6.819 700 HG3 GLN 77 HG3 GLN 77 -26.684 -9.924 5.784 701 HE21 GLN 77 HE21 GLN 77 -29.568 -9.448 3.556 702 HE22 GLN 77 HE22 GLN 77 -27.814 -9.510 3.520 703 H ALA 78 H ALA 78 -27.736 -13.797 2.125 704 HA ALA 78 HA ALA 78 -26.104 -16.194 2.298 705 HB1 ALA 78 HB1 ALA 78 -27.809 -15.913 0.549 706 HB2 ALA 78 HB2 ALA 78 -26.932 -14.512 -0.107 707 HB3 ALA 78 HB3 ALA 78 -26.198 -16.133 -0.158 708 H PHE 79 H PHE 79 -23.974 -16.244 2.558 709 HA PHE 79 HA PHE 79 -22.204 -14.284 1.360 710 HB2 PHE 79 HB2 PHE 79 -22.533 -12.935 3.155 711 HB3 PHE 79 HB3 PHE 79 -22.743 -14.257 4.284 712 HD1 PHE 79 HD1 PHE 79 -20.790 -15.520 5.193 713 HD2 PHE 79 HD2 PHE 79 -20.285 -12.016 2.740 714 HE1 PHE 79 HE1 PHE 79 -18.464 -15.295 6.003 715 HE2 PHE 79 HE2 PHE 79 -17.969 -11.768 3.585 716 HZ PHE 79 HZ PHE 79 -17.048 -13.400 5.205 717 H PHE 80 H PHE 80 -20.254 -14.889 0.848 718 HA PHE 80 HA PHE 80 -19.072 -17.285 2.141 719 HB2 PHE 80 HB2 PHE 80 -19.259 -16.820 -0.843 720 HB3 PHE 80 HB3 PHE 80 -18.243 -18.033 -0.080 721 HD1 PHE 80 HD1 PHE 80 -19.185 -20.091 0.878 722 HD2 PHE 80 HD2 PHE 80 -21.723 -17.060 -0.840 723 HE1 PHE 80 HE1 PHE 80 -21.093 -21.686 0.860 724 HE2 PHE 80 HE2 PHE 80 -23.633 -18.642 -0.840 725 HZ PHE 80 HZ PHE 80 -23.315 -20.966 0.008 726 H LEU 81 H LEU 81 -17.030 -17.091 2.697 727 HA LEU 81 HA LEU 81 -15.464 -14.726 1.828 728 HB2 LEU 81 HB2 LEU 81 -15.767 -15.260 4.233 729 HB3 LEU 81 HB3 LEU 81 -14.965 -16.799 3.984 730 HG LEU 81 HG LEU 81 -13.596 -15.059 5.081 731 HD11 LEU 81 HD11 LEU 81 -11.569 -15.522 3.998 732 HD12 LEU 81 HD12 LEU 81 -12.591 -16.947 3.774 733 HD13 LEU 81 HD13 LEU 81 -12.327 -15.800 2.424 734 HD21 LEU 81 HD21 LEU 81 -14.433 -13.079 3.809 735 HD22 LEU 81 HD22 LEU 81 -12.675 -13.159 3.906 736 HD23 LEU 81 HD23 LEU 81 -13.489 -13.611 2.400 737 H LEU 82 H LEU 82 -14.250 -14.939 0.145 738 HA LEU 82 HA LEU 82 -13.601 -17.600 -0.994 739 HB2 LEU 82 HB2 LEU 82 -13.898 -14.915 -2.387 740 HB3 LEU 82 HB3 LEU 82 -13.759 -16.496 -3.143 741 HG LEU 82 HG LEU 82 -16.131 -15.480 -1.504 742 HD11 LEU 82 HD11 LEU 82 -15.934 -14.428 -3.693 743 HD12 LEU 82 HD12 LEU 82 -15.771 -16.018 -4.480 744 HD13 LEU 82 HD13 LEU 82 -17.295 -15.566 -3.678 745 HD21 LEU 82 HD21 LEU 82 -15.964 -17.891 -1.219 746 HD22 LEU 82 HD22 LEU 82 -17.262 -17.535 -2.361 747 HD23 LEU 82 HD23 LEU 82 -15.700 -18.113 -2.972 748 H VAL 83 H VAL 83 -11.541 -18.021 -0.162 749 HA VAL 83 HA VAL 83 -9.444 -15.966 -0.175 750 HB VAL 83 HB VAL 83 -9.069 -18.951 0.155 751 HG11 VAL 83 HG11 VAL 83 -7.005 -17.680 -0.373 752 HG12 VAL 83 HG12 VAL 83 -7.373 -16.536 0.936 753 HG13 VAL 83 HG13 VAL 83 -6.998 -18.239 1.300 754 HG21 VAL 83 HG21 VAL 83 -8.957 -18.401 2.602 755 HG22 VAL 83 HG22 VAL 83 -9.615 -16.792 2.241 756 HG23 VAL 83 HG23 VAL 83 -10.583 -18.241 1.917 757 H ASN 84 H ASN 84 -8.230 -15.374 -1.843 758 HA ASN 84 HA ASN 84 -7.789 -15.068 -4.071 759 HB2 ASN 84 HB2 ASN 84 -6.079 -16.678 -3.136 760 HB3 ASN 84 HB3 ASN 84 -6.986 -17.993 -3.880 761 HD21 ASN 84 HD21 ASN 84 -4.437 -17.438 -6.338 762 HD22 ASN 84 HD22 ASN 84 -4.796 -18.286 -4.819 763 H GLY 85 H GLY 85 -10.534 -15.529 -3.711 764 HA2 GLY 85 HA2 GLY 85 -12.307 -15.526 -5.220 765 HA3 GLY 85 HA3 GLY 85 -11.299 -16.293 -6.438 766 H HIS 86 H HIS 86 -11.018 -18.370 -3.808 767 HA HIS 86 HA HIS 86 -13.493 -19.900 -4.564 768 HB2 HIS 86 HB2 HIS 86 -11.428 -20.907 -5.474 769 HB3 HIS 86 HB3 HIS 86 -10.749 -21.011 -3.853 770 HD1 HIS 86 HD1 HIS 86 -11.382 -23.224 -2.525 771 HD2 HIS 86 HD2 HIS 86 -13.873 -22.353 -5.827 772 HE1 HIS 86 HE1 HIS 86 -13.004 -25.204 -2.752 773 HE2 HIS 86 HE2 HIS 86 -14.512 -24.672 -4.779 774 H SER 87 H SER 87 -14.700 -20.940 -2.978 775 HA SER 87 HA SER 87 -14.759 -19.670 -0.418 776 HB2 SER 87 HB2 SER 87 -16.755 -20.567 -1.459 777 HB3 SER 87 HB3 SER 87 -16.105 -22.215 -1.357 778 HG SER 87 HG SER 87 -17.424 -21.905 0.411 779 H MET 88 H MET 88 -14.092 -20.169 1.565 780 HA MET 88 HA MET 88 -12.931 -22.861 2.135 781 HB2 MET 88 HB2 MET 88 -11.662 -20.196 2.860 782 HB3 MET 88 HB3 MET 88 -11.206 -21.730 3.599 783 HG2 MET 88 HG2 MET 88 -10.762 -22.637 1.280 784 HG3 MET 88 HG3 MET 88 -10.906 -20.977 0.686 785 HE1 MET 88 HE1 MET 88 -8.367 -22.900 0.248 786 HE2 MET 88 HE2 MET 88 -8.493 -21.248 -0.399 787 HE3 MET 88 HE3 MET 88 -7.046 -21.743 0.508 788 H VAL 89 H VAL 89 -15.611 -21.488 2.735 789 HA VAL 89 HA VAL 89 -15.605 -20.700 5.460 790 HB VAL 89 HB VAL 89 -17.967 -20.629 5.408 791 HG11 VAL 89 HG11 VAL 89 -17.061 -19.973 2.571 792 HG12 VAL 89 HG12 VAL 89 -18.433 -19.294 3.466 793 HG13 VAL 89 HG13 VAL 89 -16.779 -18.950 3.996 794 HG21 VAL 89 HG21 VAL 89 -19.332 -21.552 3.554 795 HG22 VAL 89 HG22 VAL 89 -17.900 -22.395 2.929 796 HG23 VAL 89 HG23 VAL 89 -18.576 -22.814 4.521 797 H SER 90 H SER 90 -15.927 -23.961 4.208 798 HA SER 90 HA SER 90 -16.619 -25.017 6.896 799 HB2 SER 90 HB2 SER 90 -17.056 -27.097 5.654 800 HB3 SER 90 HB3 SER 90 -17.965 -25.724 4.998 801 HG SER 90 HG SER 90 -16.953 -26.984 3.346 802 H VAL 91 H VAL 91 -13.700 -24.424 5.258 803 HA VAL 91 HA VAL 91 -12.557 -27.036 5.778 804 HB VAL 91 HB VAL 91 -12.178 -25.600 3.699 805 HG11 VAL 91 HG11 VAL 91 -11.162 -23.655 4.893 806 HG12 VAL 91 HG12 VAL 91 -9.768 -24.679 5.312 807 HG13 VAL 91 HG13 VAL 91 -10.138 -24.337 3.614 808 HG21 VAL 91 HG21 VAL 91 -10.084 -26.788 3.267 809 HG22 VAL 91 HG22 VAL 91 -9.922 -27.186 4.986 810 HG23 VAL 91 HG23 VAL 91 -11.271 -27.846 4.036 811 H SER 92 H SER 92 -11.043 -27.770 7.124 812 HA SER 92 HA SER 92 -10.764 -26.353 9.644 813 HB2 SER 92 HB2 SER 92 -9.681 -28.453 10.365 814 HB3 SER 92 HB3 SER 92 -11.241 -28.730 9.575 815 HG SER 92 HG SER 92 -9.592 -30.168 8.811 816 H THR 93 H THR 93 -8.744 -26.435 6.834 817 HA THR 93 HA THR 93 -6.247 -26.668 7.710 818 HB THR 93 HB THR 93 -6.739 -24.489 5.724 819 HG1 THR 93 HG1 THR 93 -7.133 -26.163 4.198 820 HG21 THR 93 HG21 THR 93 -4.402 -25.175 6.134 821 HG22 THR 93 HG22 THR 93 -4.825 -26.865 5.766 822 HG23 THR 93 HG23 THR 93 -4.927 -25.615 4.506 823 HA PRO 94 HA PRO 94 -5.195 -23.104 10.291 824 HB2 PRO 94 HB2 PRO 94 -2.498 -23.446 10.515 825 HB3 PRO 94 HB3 PRO 94 -3.680 -24.439 11.416 826 HG2 PRO 94 HG2 PRO 94 -2.292 -25.111 8.803 827 HG3 PRO 94 HG3 PRO 94 -2.442 -26.136 10.267 828 HD2 PRO 94 HD2 PRO 94 -4.113 -26.422 8.161 829 HD3 PRO 94 HD3 PRO 94 -4.726 -26.579 9.837 830 H ILE 95 H ILE 95 -4.584 -21.022 9.781 831 HA ILE 95 HA ILE 95 -4.365 -20.384 7.039 832 HB ILE 95 HB ILE 95 -5.467 -18.979 8.668 833 HG12 ILE 95 HG12 ILE 95 -3.294 -17.154 7.613 834 HG13 ILE 95 HG13 ILE 95 -4.216 -18.105 6.443 835 HG21 ILE 95 HG21 ILE 95 -4.165 -17.451 10.147 836 HG22 ILE 95 HG22 ILE 95 -3.901 -19.139 10.576 837 HG23 ILE 95 HG23 ILE 95 -2.665 -18.257 9.656 838 HD11 ILE 95 HD11 ILE 95 -5.192 -15.887 6.776 839 HD12 ILE 95 HD12 ILE 95 -6.310 -17.200 7.214 840 HD13 ILE 95 HD13 ILE 95 -5.484 -16.268 8.480 841 H SER 96 H SER 96 -1.728 -21.216 9.145 842 HA SER 96 HA SER 96 0.463 -19.971 7.863 843 HB2 SER 96 HB2 SER 96 1.710 -22.009 8.612 844 HB3 SER 96 HB3 SER 96 0.710 -21.274 9.879 845 HG SER 96 HG SER 96 0.498 -23.586 9.762 846 H GLU 97 H GLU 97 -1.092 -23.093 6.999 847 HA GLU 97 HA GLU 97 0.478 -23.517 4.603 848 HB2 GLU 97 HB2 GLU 97 -2.254 -24.600 5.399 849 HB3 GLU 97 HB3 GLU 97 -1.275 -25.226 4.081 850 HG2 GLU 97 HG2 GLU 97 -0.507 -25.256 7.031 851 HG3 GLU 97 HG3 GLU 97 -1.177 -26.609 6.132 852 H VAL 98 H VAL 98 -2.710 -22.039 5.156 853 HA VAL 98 HA VAL 98 -3.297 -21.539 2.386 854 HB VAL 98 HB VAL 98 -4.361 -19.942 4.732 855 HG11 VAL 98 HG11 VAL 98 -4.893 -19.009 2.496 856 HG12 VAL 98 HG12 VAL 98 -5.533 -20.589 1.993 857 HG13 VAL 98 HG13 VAL 98 -6.331 -19.664 3.287 858 HG21 VAL 98 HG21 VAL 98 -6.267 -21.580 4.664 859 HG22 VAL 98 HG22 VAL 98 -5.314 -22.607 3.583 860 HG23 VAL 98 HG23 VAL 98 -4.772 -22.299 5.250 861 H TYR 99 H TYR 99 -1.496 -19.622 4.790 862 HA TYR 99 HA TYR 99 -1.009 -17.375 3.133 863 HB2 TYR 99 HB2 TYR 99 -0.511 -16.960 5.300 864 HB3 TYR 99 HB3 TYR 99 0.268 -18.495 5.565 865 HD1 TYR 99 HD1 TYR 99 0.783 -15.201 3.821 866 HD2 TYR 99 HD2 TYR 99 2.589 -18.738 5.517 867 HE1 TYR 99 HE1 TYR 99 3.049 -14.211 3.515 868 HE2 TYR 99 HE2 TYR 99 4.841 -17.746 5.201 869 HH TYR 99 HH TYR 99 6.044 -15.895 4.512 870 H GLU 100 H GLU 100 1.132 -20.228 3.504 871 HA GLU 100 HA GLU 100 2.915 -19.378 1.441 872 HB2 GLU 100 HB2 GLU 100 2.242 -22.181 2.414 873 HB3 GLU 100 HB3 GLU 100 3.601 -21.800 1.363 874 HG2 GLU 100 HG2 GLU 100 3.250 -20.743 4.196 875 HG3 GLU 100 HG3 GLU 100 4.213 -22.136 3.738 876 H SER 101 H SER 101 -0.159 -21.082 1.214 877 HA SER 101 HA SER 101 0.167 -21.780 -1.611 878 HB2 SER 101 HB2 SER 101 -2.264 -21.864 0.220 879 HB3 SER 101 HB3 SER 101 -2.183 -22.524 -1.415 880 HG SER 101 HG SER 101 -0.763 -23.352 0.899 881 H GLU 102 H GLU 102 -1.501 -19.124 0.119 882 HA GLU 102 HA GLU 102 -2.540 -18.114 -2.497 883 HB2 GLU 102 HB2 GLU 102 -3.883 -17.869 0.203 884 HB3 GLU 102 HB3 GLU 102 -4.550 -17.442 -1.359 885 HG2 GLU 102 HG2 GLU 102 -3.947 -20.247 -0.349 886 HG3 GLU 102 HG3 GLU 102 -5.520 -19.510 -0.542 887 H LYS 103 H LYS 103 -0.174 -17.155 -0.426 888 HA LYS 103 HA LYS 103 -0.681 -14.327 -0.202 889 HB2 LYS 103 HB2 LYS 103 1.724 -14.079 0.028 890 HB3 LYS 103 HB3 LYS 103 1.116 -15.390 1.031 891 HG2 LYS 103 HG2 LYS 103 1.883 -16.995 -0.865 892 HG3 LYS 103 HG3 LYS 103 2.708 -15.587 -1.556 893 HD2 LYS 103 HD2 LYS 103 3.975 -15.344 0.611 894 HD3 LYS 103 HD3 LYS 103 3.197 -16.836 1.186 895 HE2 LYS 103 HE2 LYS 103 4.121 -18.030 -0.834 896 HE3 LYS 103 HE3 LYS 103 4.946 -16.537 -1.297 897 HZ1 LYS 103 HZ1 LYS 103 5.477 -18.202 1.119 898 HZ2 LYS 103 HZ2 LYS 103 6.488 -17.916 -0.118 899 HZ3 LYS 103 HZ3 LYS 103 6.133 -16.700 0.912 900 H ASP 104 H ASP 104 -0.591 -12.667 -1.649 901 HA ASP 104 HA ASP 104 -0.771 -13.471 -4.421 902 HB2 ASP 104 HB2 ASP 104 -2.372 -11.945 -3.638 903 HB3 ASP 104 HB3 ASP 104 -1.138 -10.814 -3.082 904 H GLU 105 H GLU 105 1.340 -10.943 -2.991 905 HA GLU 105 HA GLU 105 3.426 -11.696 -4.994 906 HB2 GLU 105 HB2 GLU 105 2.678 -8.904 -4.136 907 HB3 GLU 105 HB3 GLU 105 4.181 -9.293 -4.956 908 HG2 GLU 105 HG2 GLU 105 1.397 -9.825 -6.077 909 HG3 GLU 105 HG3 GLU 105 2.391 -8.421 -6.446 910 H ASP 106 H ASP 106 3.920 -9.330 -2.395 911 HA ASP 106 HA ASP 106 6.363 -10.754 -1.757 912 HB2 ASP 106 HB2 ASP 106 6.133 -8.280 -1.977 913 HB3 ASP 106 HB3 ASP 106 5.149 -8.260 -0.513 914 H GLY 107 H GLY 107 3.232 -11.020 -0.449 915 HA2 GLY 107 HA2 GLY 107 3.607 -13.022 1.338 916 HA3 GLY 107 HA3 GLY 107 4.026 -11.632 2.340 917 H PHE 108 H PHE 108 1.856 -9.963 0.895 918 HA PHE 108 HA PHE 108 -0.211 -10.478 2.757 919 HB2 PHE 108 HB2 PHE 108 -1.530 -8.800 1.351 920 HB3 PHE 108 HB3 PHE 108 -0.105 -8.307 2.244 921 HD1 PHE 108 HD1 PHE 108 1.809 -7.344 1.150 922 HD2 PHE 108 HD2 PHE 108 -1.294 -9.233 -1.165 923 HE1 PHE 108 HE1 PHE 108 2.854 -6.497 -0.937 924 HE2 PHE 108 HE2 PHE 108 -0.283 -8.324 -3.250 925 HZ PHE 108 HZ PHE 108 1.781 -6.956 -3.133 926 H LEU 109 H LEU 109 -1.918 -11.686 2.939 927 HA LEU 109 HA LEU 109 -2.549 -13.564 0.746 928 HB2 LEU 109 HB2 LEU 109 -2.050 -14.025 3.266 929 HB3 LEU 109 HB3 LEU 109 -3.711 -13.518 3.545 930 HG LEU 109 HG LEU 109 -2.742 -15.868 1.857 931 HD11 LEU 109 HD11 LEU 109 -4.314 -15.735 4.472 932 HD12 LEU 109 HD12 LEU 109 -3.785 -17.213 3.630 933 HD13 LEU 109 HD13 LEU 109 -2.589 -16.116 4.333 934 HD21 LEU 109 HD21 LEU 109 -5.182 -16.530 1.852 935 HD22 LEU 109 HD22 LEU 109 -5.574 -14.876 2.388 936 HD23 LEU 109 HD23 LEU 109 -4.797 -15.171 0.808 937 H TYR 110 H TYR 110 -4.186 -13.124 -0.686 938 HA TYR 110 HA TYR 110 -6.239 -11.170 0.012 939 HB2 TYR 110 HB2 TYR 110 -5.399 -12.395 -2.539 940 HB3 TYR 110 HB3 TYR 110 -7.056 -11.868 -2.404 941 HD1 TYR 110 HD1 TYR 110 -7.677 -9.623 -2.621 942 HD2 TYR 110 HD2 TYR 110 -3.532 -10.628 -1.960 943 HE1 TYR 110 HE1 TYR 110 -7.033 -7.278 -3.125 944 HE2 TYR 110 HE2 TYR 110 -2.890 -8.277 -2.502 945 HH TYR 110 HH TYR 110 -5.131 -5.957 -3.816 946 H MET 111 H MET 111 -8.155 -11.371 0.804 947 HA MET 111 HA MET 111 -9.707 -13.862 0.210 948 HB2 MET 111 HB2 MET 111 -9.884 -12.185 2.749 949 HB3 MET 111 HB3 MET 111 -10.782 -13.662 2.352 950 HG2 MET 111 HG2 MET 111 -8.493 -14.815 2.156 951 HG3 MET 111 HG3 MET 111 -7.800 -13.373 2.893 952 HE1 MET 111 HE1 MET 111 -7.425 -16.358 3.789 953 HE2 MET 111 HE2 MET 111 -6.640 -15.019 4.663 954 HE3 MET 111 HE3 MET 111 -7.560 -16.248 5.554 955 H VAL 112 H VAL 112 -11.247 -13.417 -1.223 956 HA VAL 112 HA VAL 112 -12.426 -10.691 -1.361 957 HB VAL 112 HB VAL 112 -12.815 -13.018 -3.260 958 HG11 VAL 112 HG11 VAL 112 -14.663 -11.451 -3.455 959 HG12 VAL 112 HG12 VAL 112 -13.540 -10.065 -3.476 960 HG13 VAL 112 HG13 VAL 112 -13.584 -11.209 -4.830 961 HG21 VAL 112 HG21 VAL 112 -11.319 -11.755 -4.793 962 HG22 VAL 112 HG22 VAL 112 -10.971 -10.605 -3.485 963 HG23 VAL 112 HG23 VAL 112 -10.474 -12.309 -3.353 964 H TYR 113 H TYR 113 -14.896 -10.495 -1.218 965 HA TYR 113 HA TYR 113 -16.194 -13.055 -0.415 966 HB2 TYR 113 HB2 TYR 113 -17.380 -12.177 1.418 967 HB3 TYR 113 HB3 TYR 113 -15.670 -11.951 1.698 968 HD1 TYR 113 HD1 TYR 113 -18.900 -10.305 1.150 969 HD2 TYR 113 HD2 TYR 113 -14.680 -9.665 1.742 970 HE1 TYR 113 HE1 TYR 113 -19.353 -7.945 1.777 971 HE2 TYR 113 HE2 TYR 113 -15.140 -7.301 2.404 972 HH TYR 113 HH TYR 113 -16.785 -5.733 2.902 973 H ALA 114 H ALA 114 -18.382 -13.253 -0.748 974 HA ALA 114 HA ALA 114 -19.880 -11.217 -2.242 975 HB1 ALA 114 HB1 ALA 114 -18.320 -12.218 -3.944 976 HB2 ALA 114 HB2 ALA 114 -18.988 -13.822 -3.588 977 HB3 ALA 114 HB3 ALA 114 -20.012 -12.554 -4.313 978 H SER 115 H SER 115 -22.059 -12.246 -3.016 979 HA SER 115 HA SER 115 -23.218 -13.866 -0.880 980 HB2 SER 115 HB2 SER 115 -25.293 -13.602 -2.164 981 HB3 SER 115 HB3 SER 115 -24.474 -12.048 -1.908 982 HG SER 115 HG SER 115 -25.207 -12.348 -4.069 983 H GLN 116 H GLN 116 -21.605 -14.659 -3.825 984 HA GLN 116 HA GLN 116 -22.901 -17.346 -4.026 985 HB2 GLN 116 HB2 GLN 116 -20.933 -16.100 -5.964 986 HB3 GLN 116 HB3 GLN 116 -21.968 -17.497 -6.207 987 HG2 GLN 116 HG2 GLN 116 -23.396 -16.134 -7.260 988 HG3 GLN 116 HG3 GLN 116 -23.832 -15.467 -5.697 989 HE21 GLN 116 HE21 GLN 116 -22.326 -12.319 -6.512 990 HE22 GLN 116 HE22 GLN 116 -23.344 -13.203 -5.379 991 H GLU 117 H GLU 117 -21.636 -19.266 -4.017 992 HA GLU 117 HA GLU 117 -19.283 -19.327 -2.397 993 HB2 GLU 117 HB2 GLU 117 -19.275 -21.667 -2.789 994 HB3 GLU 117 HB3 GLU 117 -20.931 -21.162 -2.537 995 HG2 GLU 117 HG2 GLU 117 -19.679 -21.734 -5.264 996 HG3 GLU 117 HG3 GLU 117 -20.539 -22.912 -4.297 997 H THR 118 H THR 118 -19.614 -18.760 -5.757 998 HA THR 118 HA THR 118 -16.765 -18.141 -6.066 999 HB THR 118 HB THR 118 -17.021 -19.261 -8.485 1000 HG1 THR 118 HG1 THR 118 -19.047 -20.217 -8.203 1001 HG21 THR 118 HG21 THR 118 -15.226 -19.802 -6.883 1002 HG22 THR 118 HG22 THR 118 -16.289 -21.011 -6.119 1003 HG23 THR 118 HG23 THR 118 -15.772 -21.211 -7.811 1004 H PHE 119 H PHE 119 -16.819 -16.222 -7.253 1005 HA PHE 119 HA PHE 119 -19.338 -15.218 -8.214 1006 HB2 PHE 119 HB2 PHE 119 -17.886 -13.328 -9.150 1007 HB3 PHE 119 HB3 PHE 119 -18.208 -13.495 -7.438 1008 HD1 PHE 119 HD1 PHE 119 -15.623 -14.256 -10.050 1009 HD2 PHE 119 HD2 PHE 119 -16.453 -13.628 -5.874 1010 HE1 PHE 119 HE1 PHE 119 -13.188 -14.222 -9.575 1011 HE2 PHE 119 HE2 PHE 119 -14.013 -13.619 -5.390 1012 HZ PHE 119 HZ PHE 119 -12.373 -13.900 -7.246 1013 H GLY 120 H GLY 120 -20.075 -14.617 -10.218 1014 HA2 GLY 120 HA2 GLY 120 -18.795 -15.353 -12.702 1015 HA3 GLY 120 HA3 GLY 120 -19.959 -16.584 -12.212 1016 H1 ASP 10 H1 ASP 10 -6.312 -4.661 21.138 1017 H2 ASP 10 H2 ASP 10 -7.533 -5.310 22.028 1018 H3 ASP 10 H3 ASP 10 -7.344 -5.733 20.452 1019 HA ASP 10 HA ASP 10 -9.190 -4.225 20.708 1020 HB2 ASP 10 HB2 ASP 10 -7.127 -2.365 21.935 1021 HB3 ASP 10 HB3 ASP 10 -8.724 -1.851 21.398 1022 H TYR 11 H TYR 11 -9.640 -2.250 19.355 1023 HA TYR 11 HA TYR 11 -9.812 -1.404 17.408 1024 HB2 TYR 11 HB2 TYR 11 -7.797 -0.217 16.383 1025 HB3 TYR 11 HB3 TYR 11 -8.542 0.277 17.879 1026 HD1 TYR 11 HD1 TYR 11 -7.456 -0.031 20.050 1027 HD2 TYR 11 HD2 TYR 11 -5.454 -1.003 16.337 1028 HE1 TYR 11 HE1 TYR 11 -5.269 -0.043 21.238 1029 HE2 TYR 11 HE2 TYR 11 -3.273 -0.960 17.548 1030 HH TYR 11 HH TYR 11 -2.984 -0.295 21.040 1031 H GLU 12 H GLU 12 -9.741 -1.140 15.183 1032 HA GLU 12 HA GLU 12 -9.143 -3.751 13.876 1033 HB2 GLU 12 HB2 GLU 12 -11.548 -3.146 14.756 1034 HB3 GLU 12 HB3 GLU 12 -11.621 -2.178 13.268 1035 HG2 GLU 12 HG2 GLU 12 -11.020 -4.364 12.035 1036 HG3 GLU 12 HG3 GLU 12 -11.181 -5.178 13.597 1037 H SER 13 H SER 13 -8.026 -0.796 13.688 1038 HA SER 13 HA SER 13 -6.646 -1.199 11.292 1039 HB2 SER 13 HB2 SER 13 -8.819 -0.574 10.133 1040 HB3 SER 13 HB3 SER 13 -8.748 0.986 10.976 1041 HG SER 13 HG SER 13 -6.901 -0.069 9.057 1042 H ASP 14 H ASP 14 -4.807 -0.107 11.603 1043 HA ASP 14 HA ASP 14 -4.691 2.703 12.279 1044 HB2 ASP 14 HB2 ASP 14 -4.926 1.386 14.564 1045 HB3 ASP 14 HB3 ASP 14 -3.307 0.808 14.225 1046 H ASP 15 H ASP 15 -2.003 2.834 12.896 1047 HA ASP 15 HA ASP 15 -0.417 1.005 11.234 1048 HB2 ASP 15 HB2 ASP 15 -0.426 3.995 10.815 1049 HB3 ASP 15 HB3 ASP 15 0.954 2.993 10.397 1050 H ASP 16 H ASP 16 1.709 0.734 11.735 1051 HA ASP 16 HA ASP 16 3.293 0.175 13.098 1052 HB2 ASP 16 HB2 ASP 16 4.644 1.969 14.228 1053 HB3 ASP 16 HB3 ASP 16 4.508 1.883 12.488 1054 H SER 17 H SER 17 3.718 -0.987 14.727 1055 HA SER 17 HA SER 17 3.198 -2.243 16.570 1056 HB2 SER 17 HB2 SER 17 3.586 -1.167 18.747 1057 HB3 SER 17 HB3 SER 17 4.839 -0.879 17.548 1058 HG SER 17 HG SER 17 2.768 0.968 18.203 1059 H TYR 18 H TYR 18 1.056 -2.579 15.552 1060 HA TYR 18 HA TYR 18 -1.200 -1.713 17.304 1061 HB2 TYR 18 HB2 TYR 18 -2.356 -0.736 15.477 1062 HB3 TYR 18 HB3 TYR 18 -0.756 -0.050 15.422 1063 HD1 TYR 18 HD1 TYR 18 0.960 -1.233 13.745 1064 HD2 TYR 18 HD2 TYR 18 -3.331 -1.514 13.506 1065 HE1 TYR 18 HE1 TYR 18 1.161 -2.012 11.378 1066 HE2 TYR 18 HE2 TYR 18 -3.105 -2.149 11.087 1067 HH TYR 18 HH TYR 18 -0.202 -3.334 9.723 1068 H GLU 19 H GLU 19 -3.310 -2.592 15.999 1069 HA GLU 19 HA GLU 19 -3.023 -5.371 15.062 1070 HB2 GLU 19 HB2 GLU 19 -3.277 -5.556 17.483 1071 HB3 GLU 19 HB3 GLU 19 -4.664 -4.477 17.459 1072 HG2 GLU 19 HG2 GLU 19 -5.348 -6.801 17.766 1073 HG3 GLU 19 HG3 GLU 19 -6.009 -6.160 16.276 1074 H VAL 20 H VAL 20 -4.975 -6.154 14.037 1075 HA VAL 20 HA VAL 20 -6.907 -4.110 13.084 1076 HB VAL 20 HB VAL 20 -5.725 -6.115 11.161 1077 HG11 VAL 20 HG11 VAL 20 -7.895 -5.041 10.528 1078 HG12 VAL 20 HG12 VAL 20 -7.109 -3.455 10.669 1079 HG13 VAL 20 HG13 VAL 20 -6.569 -4.605 9.447 1080 HG21 VAL 20 HG21 VAL 20 -3.832 -4.678 11.828 1081 HG22 VAL 20 HG22 VAL 20 -4.372 -4.237 10.205 1082 HG23 VAL 20 HG23 VAL 20 -4.860 -3.250 11.611 1083 H LEU 21 H LEU 21 -6.279 -7.487 13.865 1084 HA LEU 21 HA LEU 21 -9.158 -8.219 13.422 1085 HB2 LEU 21 HB2 LEU 21 -7.432 -9.719 12.537 1086 HB3 LEU 21 HB3 LEU 21 -6.674 -9.831 14.119 1087 HG LEU 21 HG LEU 21 -9.293 -10.650 14.648 1088 HD11 LEU 21 HD11 LEU 21 -8.438 -11.720 11.913 1089 HD12 LEU 21 HD12 LEU 21 -9.789 -12.332 12.879 1090 HD13 LEU 21 HD13 LEU 21 -9.843 -10.678 12.224 1091 HD21 LEU 21 HD21 LEU 21 -6.926 -12.371 13.801 1092 HD22 LEU 21 HD22 LEU 21 -7.246 -11.769 15.442 1093 HD23 LEU 21 HD23 LEU 21 -8.349 -12.942 14.693 1094 H ASP 22 H ASP 22 -10.074 -6.980 15.034 1095 HA ASP 22 HA ASP 22 -8.901 -6.291 17.408 1096 HB2 ASP 22 HB2 ASP 22 -11.113 -5.548 18.180 1097 HB3 ASP 22 HB3 ASP 22 -10.801 -5.104 16.501 1098 H LEU 23 H LEU 23 -10.139 -9.392 16.830 1099 HA LEU 23 HA LEU 23 -10.645 -10.455 19.414 1100 HB2 LEU 23 HB2 LEU 23 -11.109 -11.543 17.227 1101 HB3 LEU 23 HB3 LEU 23 -9.380 -11.641 16.904 1102 HG LEU 23 HG LEU 23 -9.147 -13.226 18.844 1103 HD11 LEU 23 HD11 LEU 23 -11.194 -14.340 19.673 1104 HD12 LEU 23 HD12 LEU 23 -11.177 -12.627 20.114 1105 HD13 LEU 23 HD13 LEU 23 -12.198 -13.189 18.768 1106 HD21 LEU 23 HD21 LEU 23 -10.120 -15.156 17.663 1107 HD22 LEU 23 HD22 LEU 23 -11.070 -14.060 16.638 1108 HD23 LEU 23 HD23 LEU 23 -9.288 -14.073 16.555 1109 H THR 24 H THR 24 -7.636 -9.469 17.925 1110 HA THR 24 HA THR 24 -5.563 -9.285 18.525 1111 HB THR 24 HB THR 24 -6.176 -9.353 21.440 1112 HG1 THR 24 HG1 THR 24 -7.828 -8.171 20.490 1113 HG21 THR 24 HG21 THR 24 -4.625 -7.445 21.474 1114 HG22 THR 24 HG22 THR 24 -3.848 -8.883 20.796 1115 HG23 THR 24 HG23 THR 24 -4.398 -7.581 19.717 1116 H GLU 25 H GLU 25 -6.668 -12.008 20.546 1117 HA GLU 25 HA GLU 25 -5.574 -13.856 21.287 1118 HB2 GLU 25 HB2 GLU 25 -4.514 -13.715 18.455 1119 HB3 GLU 25 HB3 GLU 25 -4.303 -15.128 19.473 1120 HG2 GLU 25 HG2 GLU 25 -6.988 -13.939 18.682 1121 HG3 GLU 25 HG3 GLU 25 -6.217 -15.328 17.932 1122 H TYR 26 H TYR 26 -4.316 -11.529 22.188 1123 HA TYR 26 HA TYR 26 -1.751 -12.623 23.008 1124 HB2 TYR 26 HB2 TYR 26 -0.854 -11.559 21.195 1125 HB3 TYR 26 HB3 TYR 26 -1.905 -10.165 21.351 1126 HD1 TYR 26 HD1 TYR 26 -1.351 -8.272 22.740 1127 HD2 TYR 26 HD2 TYR 26 1.104 -11.815 22.740 1128 HE1 TYR 26 HE1 TYR 26 0.461 -7.019 23.923 1129 HE2 TYR 26 HE2 TYR 26 2.912 -10.571 23.929 1130 HH TYR 26 HH TYR 26 3.562 -8.570 24.842 Start of MODEL 20 1 H1 MET 1 H1 MET 1 -6.600 2.613 7.056 2 H2 MET 1 H2 MET 1 -7.638 1.587 7.751 3 H3 MET 1 H3 MET 1 -7.481 1.573 6.120 4 HA MET 1 HA MET 1 -8.529 3.878 7.676 5 HB2 MET 1 HB2 MET 1 -7.453 4.549 5.568 6 HB3 MET 1 HB3 MET 1 -8.480 3.438 4.650 7 HG2 MET 1 HG2 MET 1 -9.318 5.703 4.479 8 HG3 MET 1 HG3 MET 1 -10.486 4.732 5.366 9 HE1 MET 1 HE1 MET 1 -10.639 7.886 5.288 10 HE2 MET 1 HE2 MET 1 -11.758 6.879 6.242 11 HE3 MET 1 HE3 MET 1 -10.943 8.267 6.997 12 HA PRO 2 HA PRO 2 -11.907 0.827 7.621 13 HB2 PRO 2 HB2 PRO 2 -12.933 1.223 10.094 14 HB3 PRO 2 HB3 PRO 2 -11.390 0.372 9.814 15 HG2 PRO 2 HG2 PRO 2 -11.825 3.209 10.740 16 HG3 PRO 2 HG3 PRO 2 -10.602 2.016 11.281 17 HD2 PRO 2 HD2 PRO 2 -10.233 4.062 9.358 18 HD3 PRO 2 HD3 PRO 2 -9.168 2.647 9.582 19 H SER 3 H SER 3 -12.964 1.883 5.905 20 HA SER 3 HA SER 3 -15.408 3.327 6.653 21 HB2 SER 3 HB2 SER 3 -15.053 5.271 5.328 22 HB3 SER 3 HB3 SER 3 -13.635 5.120 6.364 23 HG SER 3 HG SER 3 -13.044 5.567 4.191 24 H GLU 4 H GLU 4 -16.602 3.941 4.430 25 HA GLU 4 HA GLU 4 -17.132 1.503 3.014 26 HB2 GLU 4 HB2 GLU 4 -18.832 3.080 3.410 27 HB3 GLU 4 HB3 GLU 4 -17.957 4.399 2.664 28 HG2 GLU 4 HG2 GLU 4 -18.803 1.968 1.052 29 HG3 GLU 4 HG3 GLU 4 -19.961 3.225 1.447 30 H LYS 5 H LYS 5 -14.724 3.957 2.416 31 HA LYS 5 HA LYS 5 -14.296 3.305 -0.419 32 HB2 LYS 5 HB2 LYS 5 -12.522 4.801 1.559 33 HB3 LYS 5 HB3 LYS 5 -12.270 4.707 -0.184 34 HG2 LYS 5 HG2 LYS 5 -14.653 6.021 1.194 35 HG3 LYS 5 HG3 LYS 5 -13.265 6.858 0.509 36 HD2 LYS 5 HD2 LYS 5 -13.813 6.011 -1.749 37 HD3 LYS 5 HD3 LYS 5 -15.221 5.158 -1.110 38 HE2 LYS 5 HE2 LYS 5 -14.798 8.185 -1.071 39 HE3 LYS 5 HE3 LYS 5 -15.806 7.289 -2.208 40 HZ1 LYS 5 HZ1 LYS 5 -16.287 7.581 0.705 41 HZ2 LYS 5 HZ2 LYS 5 -17.252 8.076 -0.515 42 HZ3 LYS 5 HZ3 LYS 5 -17.078 6.467 -0.200 43 H THR 6 H THR 6 -12.665 2.070 -1.316 44 HA THR 6 HA THR 6 -11.709 -0.143 0.261 45 HB THR 6 HB THR 6 -10.930 -1.185 -1.546 46 HG1 THR 6 HG1 THR 6 -10.216 -0.060 -3.437 47 HG21 THR 6 HG21 THR 6 -12.392 -0.931 -3.441 48 HG22 THR 6 HG22 THR 6 -13.350 -0.605 -1.990 49 HG23 THR 6 HG23 THR 6 -12.784 0.742 -3.005 50 H PHE 7 H PHE 7 -9.414 -0.877 0.438 51 HA PHE 7 HA PHE 7 -7.937 1.136 1.886 52 HB2 PHE 7 HB2 PHE 7 -6.288 -0.585 2.226 53 HB3 PHE 7 HB3 PHE 7 -7.870 -1.316 2.384 54 HD1 PHE 7 HD1 PHE 7 -8.630 -3.052 0.790 55 HD2 PHE 7 HD2 PHE 7 -4.847 -1.035 0.268 56 HE1 PHE 7 HE1 PHE 7 -8.002 -4.665 -0.986 57 HE2 PHE 7 HE2 PHE 7 -4.204 -2.702 -1.458 58 HZ PHE 7 HZ PHE 7 -5.793 -4.500 -2.104 59 H LYS 8 H LYS 8 -8.077 0.554 -1.552 60 HA LYS 8 HA LYS 8 -5.383 1.192 -2.297 61 HB2 LYS 8 HB2 LYS 8 -7.058 0.184 -3.797 62 HB3 LYS 8 HB3 LYS 8 -8.035 1.650 -3.732 63 HG2 LYS 8 HG2 LYS 8 -6.871 1.521 -5.830 64 HG3 LYS 8 HG3 LYS 8 -6.301 2.914 -4.927 65 HD2 LYS 8 HD2 LYS 8 -4.275 1.574 -4.226 66 HD3 LYS 8 HD3 LYS 8 -4.845 0.230 -5.210 67 HE2 LYS 8 HE2 LYS 8 -4.156 3.040 -6.218 68 HE3 LYS 8 HE3 LYS 8 -3.064 1.659 -6.272 69 HZ1 LYS 8 HZ1 LYS 8 -4.675 0.526 -7.747 70 HZ2 LYS 8 HZ2 LYS 8 -5.647 1.845 -7.751 71 HZ3 LYS 8 HZ3 LYS 8 -4.157 1.924 -8.401 72 H GLN 9 H GLN 9 -7.983 3.290 -1.231 73 HA GLN 9 HA GLN 9 -6.825 5.825 -1.901 74 HB2 GLN 9 HB2 GLN 9 -9.172 5.384 -1.213 75 HB3 GLN 9 HB3 GLN 9 -8.627 5.010 0.424 76 HG2 GLN 9 HG2 GLN 9 -7.840 7.332 0.717 77 HG3 GLN 9 HG3 GLN 9 -8.221 7.692 -0.978 78 HE21 GLN 9 HE21 GLN 9 -11.308 7.404 1.742 79 HE22 GLN 9 HE22 GLN 9 -9.746 6.716 2.151 80 H ARG 10 H ARG 10 -6.098 3.522 0.667 81 HA ARG 10 HA ARG 10 -4.430 5.465 2.192 82 HB2 ARG 10 HB2 ARG 10 -6.323 4.154 3.245 83 HB3 ARG 10 HB3 ARG 10 -5.438 2.674 2.921 84 HG2 ARG 10 HG2 ARG 10 -5.191 3.314 5.232 85 HG3 ARG 10 HG3 ARG 10 -3.615 3.410 4.462 86 HD2 ARG 10 HD2 ARG 10 -3.616 5.775 4.476 87 HD3 ARG 10 HD3 ARG 10 -5.377 5.876 4.658 88 HE ARG 10 HE ARG 10 -4.568 4.608 6.995 89 HH11 ARG 10 HH11 ARG 10 -4.506 5.741 8.901 90 HH12 ARG 10 HH12 ARG 10 -3.909 7.387 8.927 91 HH21 ARG 10 HH21 ARG 10 -3.668 7.685 5.518 92 HH22 ARG 10 HH22 ARG 10 -3.491 8.465 7.063 93 H ARG 11 H ARG 11 -4.058 2.468 0.324 94 HA ARG 11 HA ARG 11 -1.099 2.633 0.746 95 HB2 ARG 11 HB2 ARG 11 -2.855 0.142 0.903 96 HB3 ARG 11 HB3 ARG 11 -1.102 0.090 0.793 97 HG2 ARG 11 HG2 ARG 11 -2.650 1.334 3.091 98 HG3 ARG 11 HG3 ARG 11 -1.922 -0.265 3.081 99 HD2 ARG 11 HD2 ARG 11 0.094 0.538 3.669 100 HD3 ARG 11 HD3 ARG 11 0.115 1.635 2.309 101 HE ARG 11 HE ARG 11 -0.920 3.353 3.590 102 HH11 ARG 11 HH11 ARG 11 -0.949 4.479 5.575 103 HH12 ARG 11 HH12 ARG 11 -0.611 3.553 7.045 104 HH21 ARG 11 HH21 ARG 11 0.045 0.602 5.691 105 HH22 ARG 11 HH22 ARG 11 -0.149 1.658 7.088 106 H THR 12 H THR 12 0.242 1.963 -0.752 107 HA THR 12 HA THR 12 -0.736 1.061 -3.414 108 HB THR 12 HB THR 12 1.002 2.162 -4.512 109 HG1 THR 12 HG1 THR 12 2.716 3.133 -3.405 110 HG21 THR 12 HG21 THR 12 0.808 4.506 -3.974 111 HG22 THR 12 HG22 THR 12 -0.773 3.749 -3.727 112 HG23 THR 12 HG23 THR 12 0.250 4.154 -2.329 113 H PHE 13 H PHE 13 1.005 -0.258 -4.666 114 HA PHE 13 HA PHE 13 1.504 -2.630 -3.294 115 HB2 PHE 13 HB2 PHE 13 1.342 -2.754 -5.587 116 HB3 PHE 13 HB3 PHE 13 2.543 -1.506 -5.857 117 HD1 PHE 13 HD1 PHE 13 5.000 -1.977 -5.575 118 HD2 PHE 13 HD2 PHE 13 2.013 -5.083 -5.473 119 HE1 PHE 13 HE1 PHE 13 6.757 -3.679 -5.999 120 HE2 PHE 13 HE2 PHE 13 3.767 -6.780 -5.949 121 HZ PHE 13 HZ PHE 13 6.135 -6.083 -6.198 122 H GLU 14 H GLU 14 3.996 -0.119 -3.811 123 HA GLU 14 HA GLU 14 6.043 -1.563 -2.366 124 HB2 GLU 14 HB2 GLU 14 5.754 1.415 -2.931 125 HB3 GLU 14 HB3 GLU 14 7.197 0.621 -2.277 126 HG2 GLU 14 HG2 GLU 14 7.270 -0.823 -4.339 127 HG3 GLU 14 HG3 GLU 14 5.955 0.143 -5.015 128 H GLN 15 H GLN 15 3.573 0.798 -1.319 129 HA GLN 15 HA GLN 15 4.572 1.032 1.393 130 HB2 GLN 15 HB2 GLN 15 1.813 1.529 0.232 131 HB3 GLN 15 HB3 GLN 15 2.330 1.982 1.863 132 HG2 GLN 15 HG2 GLN 15 3.985 3.531 1.013 133 HG3 GLN 15 HG3 GLN 15 3.686 3.037 -0.655 134 HE21 GLN 15 HE21 GLN 15 1.799 6.177 -0.249 135 HE22 GLN 15 HE22 GLN 15 3.486 5.684 -0.307 136 H ARG 16 H ARG 16 2.265 -1.240 -0.177 137 HA ARG 16 HA ARG 16 1.661 -2.640 2.313 138 HB2 ARG 16 HB2 ARG 16 1.380 -3.514 -0.586 139 HB3 ARG 16 HB3 ARG 16 0.923 -4.490 0.814 140 HG2 ARG 16 HG2 ARG 16 -0.519 -2.473 1.563 141 HG3 ARG 16 HG3 ARG 16 -0.290 -1.862 -0.084 142 HD2 ARG 16 HD2 ARG 16 -1.544 -4.521 0.698 143 HD3 ARG 16 HD3 ARG 16 -2.415 -3.088 0.177 144 HE ARG 16 HE ARG 16 -1.660 -3.354 -2.049 145 HH11 ARG 16 HH11 ARG 16 -0.622 -6.084 -0.100 146 HH12 ARG 16 HH12 ARG 16 0.042 -6.931 -1.481 147 HH21 ARG 16 HH21 ARG 16 -0.020 -6.069 -3.426 148 HH22 ARG 16 HH22 ARG 16 -0.840 -4.549 -3.774 149 H VAL 17 H VAL 17 4.206 -3.215 -0.170 150 HA VAL 17 HA VAL 17 5.375 -5.491 1.132 151 HB VAL 17 HB VAL 17 6.688 -3.252 -0.462 152 HG11 VAL 17 HG11 VAL 17 8.442 -4.265 0.911 153 HG12 VAL 17 HG12 VAL 17 7.896 -5.893 0.465 154 HG13 VAL 17 HG13 VAL 17 8.606 -4.816 -0.756 155 HG21 VAL 17 HG21 VAL 17 6.757 -4.911 -2.267 156 HG22 VAL 17 HG22 VAL 17 6.013 -6.128 -1.208 157 HG23 VAL 17 HG23 VAL 17 5.089 -4.706 -1.724 158 H GLU 18 H GLU 18 5.843 -1.954 1.782 159 HA GLU 18 HA GLU 18 7.621 -2.397 3.977 160 HB2 GLU 18 HB2 GLU 18 6.976 -0.166 2.673 161 HB3 GLU 18 HB3 GLU 18 5.740 -0.039 3.934 162 HG2 GLU 18 HG2 GLU 18 7.715 1.210 4.567 163 HG3 GLU 18 HG3 GLU 18 7.447 -0.128 5.674 164 H ASP 19 H ASP 19 4.007 -2.053 3.987 165 HA ASP 19 HA ASP 19 3.691 -2.485 6.760 166 HB2 ASP 19 HB2 ASP 19 1.849 -3.085 4.460 167 HB3 ASP 19 HB3 ASP 19 1.434 -3.498 6.109 168 H VAL 20 H VAL 20 4.210 -4.986 4.290 169 HA VAL 20 HA VAL 20 3.942 -7.219 6.091 170 HB VAL 20 HB VAL 20 5.699 -7.019 3.625 171 HG11 VAL 20 HG11 VAL 20 4.782 -9.441 5.234 172 HG12 VAL 20 HG12 VAL 20 5.576 -9.505 3.645 173 HG13 VAL 20 HG13 VAL 20 6.455 -8.883 5.038 174 HG21 VAL 20 HG21 VAL 20 2.848 -8.019 4.064 175 HG22 VAL 20 HG22 VAL 20 3.398 -6.728 2.982 176 HG23 VAL 20 HG23 VAL 20 3.814 -8.392 2.625 177 H ARG 21 H ARG 21 6.742 -5.077 5.374 178 HA ARG 21 HA ARG 21 8.602 -6.462 7.100 179 HB2 ARG 21 HB2 ARG 21 9.086 -4.627 5.294 180 HB3 ARG 21 HB3 ARG 21 8.690 -3.467 6.562 181 HG2 ARG 21 HG2 ARG 21 10.439 -4.816 8.001 182 HG3 ARG 21 HG3 ARG 21 10.952 -5.478 6.450 183 HD2 ARG 21 HD2 ARG 21 10.999 -2.593 7.403 184 HD3 ARG 21 HD3 ARG 21 12.385 -3.597 6.993 185 HE ARG 21 HE ARG 21 10.774 -1.954 5.250 186 HH11 ARG 21 HH11 ARG 21 10.882 -1.937 3.130 187 HH12 ARG 21 HH12 ARG 21 11.969 -3.011 2.256 188 HH21 ARG 21 HH21 ARG 21 12.876 -4.780 5.090 189 HH22 ARG 21 HH22 ARG 21 13.033 -4.649 3.362 190 H LEU 22 H LEU 22 6.543 -3.550 7.743 191 HA LEU 22 HA LEU 22 7.161 -3.233 10.475 192 HB2 LEU 22 HB2 LEU 22 4.681 -2.608 8.811 193 HB3 LEU 22 HB3 LEU 22 4.672 -2.410 10.554 194 HG LEU 22 HG LEU 22 6.798 -0.997 10.280 195 HD11 LEU 22 HD11 LEU 22 7.309 -1.411 7.917 196 HD12 LEU 22 HD12 LEU 22 5.730 -0.735 7.439 197 HD13 LEU 22 HD13 LEU 22 6.959 0.295 8.193 198 HD21 LEU 22 HD21 LEU 22 4.115 0.011 9.236 199 HD22 LEU 22 HD22 LEU 22 4.594 -0.109 10.947 200 HD23 LEU 22 HD23 LEU 22 5.423 1.027 9.872 201 H ILE 23 H ILE 23 4.488 -5.292 9.110 202 HA ILE 23 HA ILE 23 3.733 -6.128 11.743 203 HB ILE 23 HB ILE 23 2.366 -6.060 9.592 204 HG12 ILE 23 HG12 ILE 23 1.633 -6.757 11.877 205 HG13 ILE 23 HG13 ILE 23 0.711 -7.291 10.506 206 HG21 ILE 23 HG21 ILE 23 1.972 -8.165 8.443 207 HG22 ILE 23 HG22 ILE 23 3.617 -7.575 8.177 208 HG23 ILE 23 HG23 ILE 23 3.336 -8.932 9.285 209 HD11 ILE 23 HD11 ILE 23 2.644 -9.087 12.025 210 HD12 ILE 23 HD12 ILE 23 0.893 -9.030 12.247 211 HD13 ILE 23 HD13 ILE 23 1.555 -9.576 10.704 212 H ARG 24 H ARG 24 5.906 -7.660 9.342 213 HA ARG 24 HA ARG 24 6.497 -10.004 10.878 214 HB2 ARG 24 HB2 ARG 24 7.039 -9.848 8.521 215 HB3 ARG 24 HB3 ARG 24 8.066 -8.444 8.788 216 HG2 ARG 24 HG2 ARG 24 9.396 -10.439 8.350 217 HG3 ARG 24 HG3 ARG 24 9.734 -9.775 9.937 218 HD2 ARG 24 HD2 ARG 24 8.145 -11.571 10.897 219 HD3 ARG 24 HD3 ARG 24 8.062 -12.236 9.273 220 HE ARG 24 HE ARG 24 10.165 -13.133 9.514 221 HH11 ARG 24 HH11 ARG 24 9.833 -10.785 12.146 222 HH12 ARG 24 HH12 ARG 24 11.340 -11.295 12.863 223 HH21 ARG 24 HH21 ARG 24 12.024 -13.730 10.537 224 HH22 ARG 24 HH22 ARG 24 12.529 -12.931 11.994 225 H GLU 25 H GLU 25 7.756 -6.709 11.217 226 HA GLU 25 HA GLU 25 9.740 -7.480 13.213 227 HB2 GLU 25 HB2 GLU 25 8.562 -4.817 12.371 228 HB3 GLU 25 HB3 GLU 25 9.702 -4.953 13.701 229 HG2 GLU 25 HG2 GLU 25 10.273 -5.919 10.862 230 HG3 GLU 25 HG3 GLU 25 10.714 -4.333 11.487 231 H GLN 26 H GLN 26 6.421 -5.989 13.542 232 HA GLN 26 HA GLN 26 6.673 -6.054 16.424 233 HB2 GLN 26 HB2 GLN 26 4.358 -5.404 16.551 234 HB3 GLN 26 HB3 GLN 26 5.283 -4.371 15.470 235 HG2 GLN 26 HG2 GLN 26 4.119 -5.047 13.585 236 HG3 GLN 26 HG3 GLN 26 3.704 -6.630 14.244 237 HE21 GLN 26 HE21 GLN 26 0.429 -5.357 14.695 238 HE22 GLN 26 HE22 GLN 26 1.442 -6.506 13.825 239 H HIS 27 H HIS 27 5.182 -8.393 14.176 240 HA HIS 27 HA HIS 27 4.900 -10.365 16.397 241 HB2 HIS 27 HB2 HIS 27 2.563 -9.458 14.664 242 HB3 HIS 27 HB3 HIS 27 2.553 -10.853 15.737 243 HD1 HIS 27 HD1 HIS 27 3.558 -9.696 18.454 244 HD2 HIS 27 HD2 HIS 27 0.769 -7.963 15.804 245 HE1 HIS 27 HE1 HIS 27 1.957 -8.286 19.887 246 HE2 HIS 27 HE2 HIS 27 0.258 -7.230 18.255 247 HA PRO 28 HA PRO 28 6.578 -12.315 12.563 248 HB2 PRO 28 HB2 PRO 28 7.579 -14.198 14.706 249 HB3 PRO 28 HB3 PRO 28 8.422 -13.614 13.236 250 HG2 PRO 28 HG2 PRO 28 8.999 -12.525 15.637 251 HG3 PRO 28 HG3 PRO 28 8.778 -11.454 14.220 252 HD2 PRO 28 HD2 PRO 28 6.792 -12.086 16.410 253 HD3 PRO 28 HD3 PRO 28 7.217 -10.508 15.676 254 H THR 29 H THR 29 4.678 -13.767 15.182 255 HA THR 29 HA THR 29 3.923 -16.162 13.737 256 HB THR 29 HB THR 29 2.574 -16.722 15.569 257 HG1 THR 29 HG1 THR 29 2.045 -15.182 17.165 258 HG21 THR 29 HG21 THR 29 4.837 -15.117 16.857 259 HG22 THR 29 HG22 THR 29 4.009 -16.554 17.492 260 HG23 THR 29 HG23 THR 29 5.061 -16.699 16.071 261 H LYS 30 H LYS 30 2.864 -13.013 13.196 262 HA LYS 30 HA LYS 30 0.134 -13.918 12.403 263 HB2 LYS 30 HB2 LYS 30 1.147 -11.215 13.299 264 HB3 LYS 30 HB3 LYS 30 -0.397 -11.426 12.449 265 HG2 LYS 30 HG2 LYS 30 -1.291 -12.819 14.154 266 HG3 LYS 30 HG3 LYS 30 0.272 -12.990 14.966 267 HD2 LYS 30 HD2 LYS 30 0.212 -10.670 15.688 268 HD3 LYS 30 HD3 LYS 30 -1.269 -10.359 14.756 269 HE2 LYS 30 HE2 LYS 30 -2.551 -11.887 16.119 270 HE3 LYS 30 HE3 LYS 30 -1.099 -12.512 16.917 271 HZ1 LYS 30 HZ1 LYS 30 -2.410 -10.899 18.232 272 HZ2 LYS 30 HZ2 LYS 30 -0.854 -10.519 18.149 273 HZ3 LYS 30 HZ3 LYS 30 -1.942 -9.664 17.237 274 H ILE 31 H ILE 31 -0.766 -13.499 10.553 275 HA ILE 31 HA ILE 31 1.038 -13.155 8.240 276 HB ILE 31 HB ILE 31 -1.805 -14.215 8.342 277 HG12 ILE 31 HG12 ILE 31 -0.523 -15.635 9.833 278 HG13 ILE 31 HG13 ILE 31 -0.927 -16.486 8.352 279 HG21 ILE 31 HG21 ILE 31 0.398 -14.543 6.265 280 HG22 ILE 31 HG22 ILE 31 -1.205 -15.312 6.221 281 HG23 ILE 31 HG23 ILE 31 -1.067 -13.560 6.088 282 HD11 ILE 31 HD11 ILE 31 1.802 -15.306 9.044 283 HD12 ILE 31 HD12 ILE 31 1.342 -17.013 9.094 284 HD13 ILE 31 HD13 ILE 31 1.410 -16.168 7.537 285 HA PRO 32 HA PRO 32 -1.229 -9.287 7.234 286 HB2 PRO 32 HB2 PRO 32 0.044 -8.648 4.900 287 HB3 PRO 32 HB3 PRO 32 0.808 -8.446 6.501 288 HG2 PRO 32 HG2 PRO 32 1.145 -10.720 4.530 289 HG3 PRO 32 HG3 PRO 32 2.418 -9.848 5.444 290 HD2 PRO 32 HD2 PRO 32 1.387 -12.262 6.226 291 HD3 PRO 32 HD3 PRO 32 1.981 -11.040 7.392 292 H VAL 33 H VAL 33 -3.319 -9.423 6.485 293 HA VAL 33 HA VAL 33 -3.765 -10.686 3.864 294 HB VAL 33 HB VAL 33 -5.307 -12.191 4.374 295 HG11 VAL 33 HG11 VAL 33 -4.747 -13.499 6.351 296 HG12 VAL 33 HG12 VAL 33 -3.259 -12.883 5.618 297 HG13 VAL 33 HG13 VAL 33 -3.901 -12.112 7.077 298 HG21 VAL 33 HG21 VAL 33 -6.966 -10.751 5.467 299 HG22 VAL 33 HG22 VAL 33 -6.775 -12.278 6.320 300 HG23 VAL 33 HG23 VAL 33 -6.007 -10.820 6.975 301 H ILE 34 H ILE 34 -5.602 -10.145 2.658 302 HA ILE 34 HA ILE 34 -6.748 -7.445 3.346 303 HB ILE 34 HB ILE 34 -5.753 -8.596 0.755 304 HG12 ILE 34 HG12 ILE 34 -5.504 -5.736 1.777 305 HG13 ILE 34 HG13 ILE 34 -4.483 -7.004 2.435 306 HG21 ILE 34 HG21 ILE 34 -6.827 -6.742 -0.493 307 HG22 ILE 34 HG22 ILE 34 -8.010 -7.878 0.142 308 HG23 ILE 34 HG23 ILE 34 -7.760 -6.306 0.948 309 HD11 ILE 34 HD11 ILE 34 -3.278 -5.905 0.680 310 HD12 ILE 34 HD12 ILE 34 -3.654 -7.548 0.141 311 HD13 ILE 34 HD13 ILE 34 -4.587 -6.162 -0.481 312 H ILE 35 H ILE 35 -8.950 -7.113 2.978 313 HA ILE 35 HA ILE 35 -10.527 -9.416 2.016 314 HB ILE 35 HB ILE 35 -10.841 -9.605 4.372 315 HG12 ILE 35 HG12 ILE 35 -13.306 -8.257 3.136 316 HG13 ILE 35 HG13 ILE 35 -12.760 -9.896 2.772 317 HG21 ILE 35 HG21 ILE 35 -10.238 -7.309 5.107 318 HG22 ILE 35 HG22 ILE 35 -11.754 -6.687 4.402 319 HG23 ILE 35 HG23 ILE 35 -11.793 -7.791 5.772 320 HD11 ILE 35 HD11 ILE 35 -14.520 -10.066 4.390 321 HD12 ILE 35 HD12 ILE 35 -13.005 -10.504 5.192 322 HD13 ILE 35 HD13 ILE 35 -13.751 -8.902 5.471 323 H GLU 36 H GLU 36 -11.909 -8.840 0.416 324 HA GLU 36 HA GLU 36 -12.929 -6.045 0.356 325 HB2 GLU 36 HB2 GLU 36 -10.704 -6.331 -0.936 326 HB3 GLU 36 HB3 GLU 36 -11.614 -7.340 -2.065 327 HG2 GLU 36 HG2 GLU 36 -13.148 -5.364 -2.459 328 HG3 GLU 36 HG3 GLU 36 -12.150 -4.416 -1.364 329 H ARG 37 H ARG 37 -14.862 -5.768 -0.735 330 HA ARG 37 HA ARG 37 -16.634 -7.995 -1.312 331 HB2 ARG 37 HB2 ARG 37 -16.610 -5.032 -2.065 332 HB3 ARG 37 HB3 ARG 37 -17.722 -6.120 -2.857 333 HG2 ARG 37 HG2 ARG 37 -18.873 -5.020 -1.057 334 HG3 ARG 37 HG3 ARG 37 -18.784 -6.757 -0.796 335 HD2 ARG 37 HD2 ARG 37 -18.486 -5.682 1.276 336 HD3 ARG 37 HD3 ARG 37 -16.927 -6.397 0.834 337 HE ARG 37 HE ARG 37 -16.812 -3.732 -0.058 338 HH11 ARG 37 HH11 ARG 37 -16.029 -1.968 1.186 339 HH12 ARG 37 HH12 ARG 37 -16.091 -2.101 2.931 340 HH21 ARG 37 HH21 ARG 37 -16.634 -3.839 3.929 341 HH22 ARG 37 HH22 ARG 37 -17.269 -5.259 3.112 342 H TYR 38 H TYR 38 -17.155 -9.031 -3.284 343 HA TYR 38 HA TYR 38 -15.195 -9.171 -5.326 344 HB2 TYR 38 HB2 TYR 38 -16.456 -11.043 -5.265 345 HB3 TYR 38 HB3 TYR 38 -17.964 -10.159 -5.087 346 HD1 TYR 38 HD1 TYR 38 -19.471 -10.585 -6.773 347 HD2 TYR 38 HD2 TYR 38 -15.264 -10.360 -7.754 348 HE1 TYR 38 HE1 TYR 38 -20.019 -10.799 -9.178 349 HE2 TYR 38 HE2 TYR 38 -15.837 -10.519 -10.174 350 HH TYR 38 HH TYR 38 -19.210 -10.771 -11.340 351 H LYS 39 H LYS 39 -14.710 -8.172 -7.214 352 HA LYS 39 HA LYS 39 -15.275 -5.447 -7.428 353 HB2 LYS 39 HB2 LYS 39 -14.308 -7.403 -9.555 354 HB3 LYS 39 HB3 LYS 39 -14.332 -5.647 -9.765 355 HG2 LYS 39 HG2 LYS 39 -12.824 -5.345 -7.837 356 HG3 LYS 39 HG3 LYS 39 -12.823 -7.082 -7.531 357 HD2 LYS 39 HD2 LYS 39 -10.784 -6.491 -8.652 358 HD3 LYS 39 HD3 LYS 39 -11.764 -7.487 -9.739 359 HE2 LYS 39 HE2 LYS 39 -12.495 -5.446 -10.956 360 HE3 LYS 39 HE3 LYS 39 -11.582 -4.435 -9.828 361 HZ1 LYS 39 HZ1 LYS 39 -10.322 -4.839 -11.873 362 HZ2 LYS 39 HZ2 LYS 39 -9.533 -5.526 -10.620 363 HZ3 LYS 39 HZ3 LYS 39 -10.383 -6.455 -11.666 364 H GLY 40 H GLY 40 -17.145 -8.035 -8.904 365 HA2 GLY 40 HA2 GLY 40 -18.818 -6.210 -10.506 366 HA3 GLY 40 HA3 GLY 40 -18.948 -7.960 -10.403 367 H GLU 41 H GLU 41 -18.859 -6.647 -7.226 368 HA GLU 41 HA GLU 41 -21.832 -6.600 -7.022 369 HB2 GLU 41 HB2 GLU 41 -21.198 -8.901 -6.770 370 HB3 GLU 41 HB3 GLU 41 -19.913 -8.479 -5.628 371 HG2 GLU 41 HG2 GLU 41 -21.663 -7.660 -4.016 372 HG3 GLU 41 HG3 GLU 41 -22.896 -8.206 -5.154 373 H LYS 42 H LYS 42 -22.637 -5.149 -5.717 374 HA LYS 42 HA LYS 42 -21.239 -4.412 -3.175 375 HB2 LYS 42 HB2 LYS 42 -22.744 -2.533 -5.033 376 HB3 LYS 42 HB3 LYS 42 -22.207 -2.106 -3.414 377 HG2 LYS 42 HG2 LYS 42 -20.321 -2.889 -5.676 378 HG3 LYS 42 HG3 LYS 42 -20.782 -1.245 -5.253 379 HD2 LYS 42 HD2 LYS 42 -19.808 -1.536 -2.979 380 HD3 LYS 42 HD3 LYS 42 -19.329 -3.180 -3.388 381 HE2 LYS 42 HE2 LYS 42 -17.393 -1.707 -3.543 382 HE3 LYS 42 HE3 LYS 42 -17.786 -2.361 -5.126 383 HZ1 LYS 42 HZ1 LYS 42 -18.827 -0.221 -5.694 384 HZ2 LYS 42 HZ2 LYS 42 -18.541 0.381 -4.196 385 HZ3 LYS 42 HZ3 LYS 42 -17.300 0.034 -5.197 386 H GLN 43 H GLN 43 -23.153 -6.481 -3.805 387 HA GLN 43 HA GLN 43 -25.816 -5.706 -2.940 388 HB2 GLN 43 HB2 GLN 43 -25.195 -7.426 -4.680 389 HB3 GLN 43 HB3 GLN 43 -24.633 -8.486 -3.397 390 HG2 GLN 43 HG2 GLN 43 -27.472 -7.420 -3.673 391 HG3 GLN 43 HG3 GLN 43 -26.913 -8.959 -4.324 392 HE21 GLN 43 HE21 GLN 43 -28.593 -9.465 -0.960 393 HE22 GLN 43 HE22 GLN 43 -29.075 -8.493 -2.341 394 H LEU 44 H LEU 44 -23.234 -7.782 -1.500 395 HA LEU 44 HA LEU 44 -24.537 -7.848 1.094 396 HB2 LEU 44 HB2 LEU 44 -21.740 -8.574 0.141 397 HB3 LEU 44 HB3 LEU 44 -22.226 -8.718 1.825 398 HG LEU 44 HG LEU 44 -23.492 -10.240 -0.502 399 HD11 LEU 44 HD11 LEU 44 -22.426 -12.178 0.550 400 HD12 LEU 44 HD12 LEU 44 -21.207 -10.960 0.144 401 HD13 LEU 44 HD13 LEU 44 -21.749 -11.139 1.831 402 HD21 LEU 44 HD21 LEU 44 -24.597 -11.545 1.348 403 HD22 LEU 44 HD22 LEU 44 -24.073 -10.303 2.501 404 HD23 LEU 44 HD23 LEU 44 -25.209 -9.903 1.192 405 HA PRO 45 HA PRO 45 -23.687 -4.087 2.912 406 HB2 PRO 45 HB2 PRO 45 -22.236 -5.496 5.163 407 HB3 PRO 45 HB3 PRO 45 -23.464 -4.185 5.255 408 HG2 PRO 45 HG2 PRO 45 -24.225 -6.748 5.641 409 HG3 PRO 45 HG3 PRO 45 -25.213 -5.684 4.583 410 HD2 PRO 45 HD2 PRO 45 -23.183 -7.777 3.783 411 HD3 PRO 45 HD3 PRO 45 -24.800 -7.424 3.089 412 H VAL 46 H VAL 46 -22.355 -2.496 2.421 413 HA VAL 46 HA VAL 46 -19.585 -3.014 1.776 414 HB VAL 46 HB VAL 46 -21.185 -1.790 0.330 415 HG11 VAL 46 HG11 VAL 46 -21.526 0.572 0.540 416 HG12 VAL 46 HG12 VAL 46 -22.146 -0.214 1.997 417 HG13 VAL 46 HG13 VAL 46 -20.597 0.654 2.040 418 HG21 VAL 46 HG21 VAL 46 -19.509 -0.284 -0.602 419 HG22 VAL 46 HG22 VAL 46 -18.525 -0.430 0.861 420 HG23 VAL 46 HG23 VAL 46 -18.818 -1.852 -0.168 421 H LEU 47 H LEU 47 -19.763 -3.438 4.369 422 HA LEU 47 HA LEU 47 -19.343 -1.153 6.068 423 HB2 LEU 47 HB2 LEU 47 -18.992 -4.144 6.487 424 HB3 LEU 47 HB3 LEU 47 -18.819 -2.986 7.795 425 HG LEU 47 HG LEU 47 -21.371 -3.267 6.157 426 HD11 LEU 47 HD11 LEU 47 -20.683 -4.416 8.890 427 HD12 LEU 47 HD12 LEU 47 -22.268 -4.481 8.078 428 HD13 LEU 47 HD13 LEU 47 -20.879 -5.345 7.374 429 HD21 LEU 47 HD21 LEU 47 -22.400 -2.089 8.088 430 HD22 LEU 47 HD22 LEU 47 -20.790 -1.892 8.818 431 HD23 LEU 47 HD23 LEU 47 -21.194 -1.079 7.289 432 H ASP 48 H ASP 48 -17.597 -1.020 7.642 433 HA ASP 48 HA ASP 48 -15.362 -0.044 6.287 434 HB2 ASP 48 HB2 ASP 48 -14.542 0.525 8.598 435 HB3 ASP 48 HB3 ASP 48 -16.142 1.100 8.143 436 H LYS 49 H LYS 49 -15.562 -3.277 7.107 437 HA LYS 49 HA LYS 49 -12.722 -3.731 7.739 438 HB2 LYS 49 HB2 LYS 49 -14.903 -5.647 6.828 439 HB3 LYS 49 HB3 LYS 49 -13.323 -6.124 7.433 440 HG2 LYS 49 HG2 LYS 49 -15.442 -4.635 9.071 441 HG3 LYS 49 HG3 LYS 49 -15.175 -6.369 9.057 442 HD2 LYS 49 HD2 LYS 49 -13.954 -5.930 10.898 443 HD3 LYS 49 HD3 LYS 49 -12.690 -5.727 9.703 444 HE2 LYS 49 HE2 LYS 49 -12.458 -3.978 11.288 445 HE3 LYS 49 HE3 LYS 49 -13.006 -3.226 9.793 446 HZ1 LYS 49 HZ1 LYS 49 -15.110 -2.791 10.734 447 HZ2 LYS 49 HZ2 LYS 49 -14.958 -3.939 11.923 448 HZ3 LYS 49 HZ3 LYS 49 -14.098 -2.573 12.017 449 H THR 50 H THR 50 -11.267 -3.163 6.264 450 HA THR 50 HA THR 50 -11.457 -4.254 3.481 451 HB THR 50 HB THR 50 -10.359 -2.334 2.633 452 HG1 THR 50 HG1 THR 50 -9.809 -0.626 4.160 453 HG21 THR 50 HG21 THR 50 -12.360 -1.220 4.650 454 HG22 THR 50 HG22 THR 50 -11.888 -0.527 3.094 455 HG23 THR 50 HG23 THR 50 -12.832 -2.023 3.134 456 H LYS 51 H LYS 51 -9.650 -4.604 6.280 457 HA LYS 51 HA LYS 51 -7.347 -5.884 4.931 458 HB2 LYS 51 HB2 LYS 51 -6.945 -3.379 5.116 459 HB3 LYS 51 HB3 LYS 51 -7.056 -3.529 6.865 460 HG2 LYS 51 HG2 LYS 51 -5.031 -4.999 6.840 461 HG3 LYS 51 HG3 LYS 51 -4.977 -4.859 5.065 462 HD2 LYS 51 HD2 LYS 51 -4.776 -2.381 5.280 463 HD3 LYS 51 HD3 LYS 51 -4.789 -2.542 7.051 464 HE2 LYS 51 HE2 LYS 51 -2.675 -3.961 6.837 465 HE3 LYS 51 HE3 LYS 51 -2.667 -3.568 5.111 466 HZ1 LYS 51 HZ1 LYS 51 -2.639 -1.140 5.855 467 HZ2 LYS 51 HZ2 LYS 51 -2.317 -1.643 7.388 468 HZ3 LYS 51 HZ3 LYS 51 -1.261 -1.939 6.159 469 H PHE 52 H PHE 52 -6.240 -7.328 6.434 470 HA PHE 52 HA PHE 52 -7.076 -7.420 9.212 471 HB2 PHE 52 HB2 PHE 52 -7.958 -9.557 7.314 472 HB3 PHE 52 HB3 PHE 52 -7.616 -9.973 8.980 473 HD1 PHE 52 HD1 PHE 52 -8.784 -7.943 10.652 474 HD2 PHE 52 HD2 PHE 52 -10.235 -9.599 6.942 475 HE1 PHE 52 HE1 PHE 52 -11.109 -7.510 11.368 476 HE2 PHE 52 HE2 PHE 52 -12.561 -9.154 7.668 477 HZ PHE 52 HZ PHE 52 -13.004 -8.168 9.895 478 H LEU 53 H LEU 53 -5.983 -8.952 10.608 479 HA LEU 53 HA LEU 53 -3.454 -10.052 9.481 480 HB2 LEU 53 HB2 LEU 53 -3.733 -8.825 12.242 481 HB3 LEU 53 HB3 LEU 53 -2.305 -9.611 11.596 482 HG LEU 53 HG LEU 53 -3.478 -6.982 10.586 483 HD11 LEU 53 HD11 LEU 53 -2.464 -6.790 12.807 484 HD12 LEU 53 HD12 LEU 53 -1.015 -7.637 12.256 485 HD13 LEU 53 HD13 LEU 53 -1.417 -6.033 11.604 486 HD21 LEU 53 HD21 LEU 53 -1.006 -8.561 9.751 487 HD22 LEU 53 HD22 LEU 53 -2.382 -8.068 8.739 488 HD23 LEU 53 HD23 LEU 53 -1.274 -6.846 9.349 489 H VAL 54 H VAL 54 -2.968 -12.139 10.277 490 HA VAL 54 HA VAL 54 -4.991 -13.300 12.146 491 HB VAL 54 HB VAL 54 -4.135 -14.813 9.699 492 HG11 VAL 54 HG11 VAL 54 -6.180 -16.113 10.181 493 HG12 VAL 54 HG12 VAL 54 -5.098 -16.101 11.585 494 HG13 VAL 54 HG13 VAL 54 -6.533 -15.056 11.569 495 HG21 VAL 54 HG21 VAL 54 -5.286 -12.839 8.821 496 HG22 VAL 54 HG22 VAL 54 -6.302 -14.264 8.666 497 HG23 VAL 54 HG23 VAL 54 -6.625 -13.088 9.960 498 HA PRO 55 HA PRO 55 -1.185 -15.104 13.842 499 HB2 PRO 55 HB2 PRO 55 -2.177 -16.400 16.017 500 HB3 PRO 55 HB3 PRO 55 -2.042 -14.617 15.957 501 HG2 PRO 55 HG2 PRO 55 -4.480 -16.309 15.392 502 HG3 PRO 55 HG3 PRO 55 -4.367 -14.862 16.439 503 HD2 PRO 55 HD2 PRO 55 -5.265 -14.750 13.855 504 HD3 PRO 55 HD3 PRO 55 -4.331 -13.409 14.587 505 H ASP 56 H ASP 56 -0.179 -17.054 13.495 506 HA ASP 56 HA ASP 56 -1.169 -18.797 11.625 507 HB2 ASP 56 HB2 ASP 56 0.685 -20.348 12.273 508 HB3 ASP 56 HB3 ASP 56 1.097 -18.692 11.856 509 H HIS 57 H HIS 57 -1.758 -19.189 15.038 510 HA HIS 57 HA HIS 57 -2.725 -21.900 14.951 511 HB2 HIS 57 HB2 HIS 57 -1.886 -20.703 16.967 512 HB3 HIS 57 HB3 HIS 57 -3.283 -19.633 16.928 513 HD1 HIS 57 HD1 HIS 57 -2.777 -23.518 17.100 514 HD2 HIS 57 HD2 HIS 57 -5.013 -20.322 18.725 515 HE1 HIS 57 HE1 HIS 57 -4.303 -24.541 18.905 516 HE2 HIS 57 HE2 HIS 57 -5.668 -22.587 19.878 517 H VAL 58 H VAL 58 -4.345 -18.950 13.950 518 HA VAL 58 HA VAL 58 -7.093 -19.887 14.460 519 HB VAL 58 HB VAL 58 -5.838 -17.552 13.052 520 HG11 VAL 58 HG11 VAL 58 -8.769 -18.322 12.783 521 HG12 VAL 58 HG12 VAL 58 -8.124 -16.704 12.471 522 HG13 VAL 58 HG13 VAL 58 -7.606 -18.062 11.464 523 HG21 VAL 58 HG21 VAL 58 -6.332 -17.605 15.536 524 HG22 VAL 58 HG22 VAL 58 -7.151 -16.296 14.660 525 HG23 VAL 58 HG23 VAL 58 -8.050 -17.747 15.141 526 H ASN 59 H ASN 59 -8.340 -21.102 13.142 527 HA ASN 59 HA ASN 59 -7.272 -22.194 10.614 528 HB2 ASN 59 HB2 ASN 59 -9.880 -22.712 12.109 529 HB3 ASN 59 HB3 ASN 59 -9.305 -23.620 10.715 530 HD21 ASN 59 HD21 ASN 59 -8.422 -25.336 13.999 531 HD22 ASN 59 HD22 ASN 59 -9.916 -24.587 13.458 532 H MET 60 H MET 60 -8.564 -22.139 8.570 533 HA MET 60 HA MET 60 -9.614 -19.516 7.992 534 HB2 MET 60 HB2 MET 60 -9.660 -22.152 6.528 535 HB3 MET 60 HB3 MET 60 -10.747 -20.879 5.995 536 HG2 MET 60 HG2 MET 60 -7.735 -20.747 6.139 537 HG3 MET 60 HG3 MET 60 -8.752 -20.783 4.693 538 HE1 MET 60 HE1 MET 60 -10.399 -17.087 4.960 539 HE2 MET 60 HE2 MET 60 -10.405 -18.587 4.019 540 HE3 MET 60 HE3 MET 60 -11.067 -18.565 5.673 541 H SER 61 H SER 61 -11.384 -22.524 8.868 542 HA SER 61 HA SER 61 -14.014 -21.494 8.733 543 HB2 SER 61 HB2 SER 61 -14.508 -23.245 10.442 544 HB3 SER 61 HB3 SER 61 -13.553 -23.839 9.071 545 HG SER 61 HG SER 61 -12.789 -24.469 11.245 546 H GLU 62 H GLU 62 -11.699 -21.284 11.458 547 HA GLU 62 HA GLU 62 -13.397 -19.779 13.213 548 HB2 GLU 62 HB2 GLU 62 -11.526 -20.893 14.157 549 HB3 GLU 62 HB3 GLU 62 -10.412 -20.143 13.032 550 HG2 GLU 62 HG2 GLU 62 -10.092 -19.205 15.203 551 HG3 GLU 62 HG3 GLU 62 -10.666 -17.961 14.109 552 H LEU 63 H LEU 63 -10.848 -18.614 10.944 553 HA LEU 63 HA LEU 63 -11.223 -15.829 11.335 554 HB2 LEU 63 HB2 LEU 63 -9.329 -16.868 10.106 555 HB3 LEU 63 HB3 LEU 63 -10.430 -17.373 8.826 556 HG LEU 63 HG LEU 63 -10.916 -14.950 8.332 557 HD11 LEU 63 HD11 LEU 63 -10.348 -13.910 10.467 558 HD12 LEU 63 HD12 LEU 63 -8.671 -14.500 10.348 559 HD13 LEU 63 HD13 LEU 63 -9.277 -13.273 9.214 560 HD21 LEU 63 HD21 LEU 63 -8.017 -15.852 8.180 561 HD22 LEU 63 HD22 LEU 63 -9.305 -16.134 6.993 562 HD23 LEU 63 HD23 LEU 63 -8.719 -14.493 7.261 563 H ILE 64 H ILE 64 -12.901 -18.045 9.103 564 HA ILE 64 HA ILE 64 -14.627 -16.141 7.867 565 HB ILE 64 HB ILE 64 -14.716 -19.129 8.287 566 HG12 ILE 64 HG12 ILE 64 -14.617 -17.534 5.717 567 HG13 ILE 64 HG13 ILE 64 -13.164 -17.913 6.632 568 HG21 ILE 64 HG21 ILE 64 -17.095 -18.530 8.283 569 HG22 ILE 64 HG22 ILE 64 -16.866 -17.533 6.826 570 HG23 ILE 64 HG23 ILE 64 -16.665 -19.302 6.773 571 HD11 ILE 64 HD11 ILE 64 -13.346 -19.531 4.909 572 HD12 ILE 64 HD12 ILE 64 -13.782 -20.378 6.405 573 HD13 ILE 64 HD13 ILE 64 -15.047 -19.845 5.264 574 H LYS 65 H LYS 65 -15.328 -18.174 10.834 575 HA LYS 65 HA LYS 65 -17.871 -16.807 11.048 576 HB2 LYS 65 HB2 LYS 65 -18.324 -17.991 13.027 577 HB3 LYS 65 HB3 LYS 65 -17.678 -19.055 11.786 578 HG2 LYS 65 HG2 LYS 65 -15.522 -19.171 12.973 579 HG3 LYS 65 HG3 LYS 65 -16.130 -18.054 14.217 580 HD2 LYS 65 HD2 LYS 65 -17.928 -19.639 14.800 581 HD3 LYS 65 HD3 LYS 65 -17.459 -20.701 13.482 582 HE2 LYS 65 HE2 LYS 65 -16.751 -21.661 15.545 583 HE3 LYS 65 HE3 LYS 65 -15.333 -21.229 14.588 584 HZ1 LYS 65 HZ1 LYS 65 -14.855 -19.441 16.026 585 HZ2 LYS 65 HZ2 LYS 65 -16.354 -19.449 16.747 586 HZ3 LYS 65 HZ3 LYS 65 -15.270 -20.640 17.034 587 H ILE 66 H ILE 66 -14.739 -15.990 12.610 588 HA ILE 66 HA ILE 66 -15.996 -13.930 14.226 589 HB ILE 66 HB ILE 66 -13.822 -14.655 14.827 590 HG12 ILE 66 HG12 ILE 66 -14.666 -12.207 15.183 591 HG13 ILE 66 HG13 ILE 66 -13.049 -12.696 15.637 592 HG21 ILE 66 HG21 ILE 66 -12.714 -13.432 12.263 593 HG22 ILE 66 HG22 ILE 66 -11.756 -14.003 13.647 594 HG23 ILE 66 HG23 ILE 66 -12.737 -15.133 12.732 595 HD11 ILE 66 HD11 ILE 66 -13.175 -10.430 14.578 596 HD12 ILE 66 HD12 ILE 66 -12.038 -11.526 13.806 597 HD13 ILE 66 HD13 ILE 66 -13.604 -11.200 13.039 598 H ILE 67 H ILE 67 -14.683 -13.854 10.872 599 HA ILE 67 HA ILE 67 -15.325 -11.075 10.463 600 HB ILE 67 HB ILE 67 -14.807 -13.392 8.568 601 HG12 ILE 67 HG12 ILE 67 -13.241 -10.877 9.334 602 HG13 ILE 67 HG13 ILE 67 -12.959 -12.457 10.023 603 HG21 ILE 67 HG21 ILE 67 -16.285 -11.850 7.334 604 HG22 ILE 67 HG22 ILE 67 -15.276 -10.463 7.826 605 HG23 ILE 67 HG23 ILE 67 -14.654 -11.712 6.723 606 HD11 ILE 67 HD11 ILE 67 -12.390 -13.334 7.740 607 HD12 ILE 67 HD12 ILE 67 -12.448 -11.663 7.145 608 HD13 ILE 67 HD13 ILE 67 -11.275 -12.108 8.391 609 H ARG 68 H ARG 68 -17.258 -14.023 9.789 610 HA ARG 68 HA ARG 68 -19.563 -12.697 8.766 611 HB2 ARG 68 HB2 ARG 68 -18.887 -15.188 8.791 612 HB3 ARG 68 HB3 ARG 68 -19.607 -15.281 10.388 613 HG2 ARG 68 HG2 ARG 68 -21.031 -14.466 7.809 614 HG3 ARG 68 HG3 ARG 68 -20.985 -16.099 8.453 615 HD2 ARG 68 HD2 ARG 68 -22.441 -13.726 9.637 616 HD3 ARG 68 HD3 ARG 68 -23.124 -15.172 8.924 617 HE ARG 68 HE ARG 68 -21.932 -16.432 10.838 618 HH11 ARG 68 HH11 ARG 68 -23.501 -13.289 11.275 619 HH12 ARG 68 HH12 ARG 68 -23.821 -13.617 12.954 620 HH21 ARG 68 HH21 ARG 68 -22.340 -16.720 12.991 621 HH22 ARG 68 HH22 ARG 68 -23.173 -15.499 13.899 622 H ARG 69 H ARG 69 -18.599 -13.209 12.162 623 HA ARG 69 HA ARG 69 -21.056 -11.947 13.169 624 HB2 ARG 69 HB2 ARG 69 -19.940 -13.673 14.496 625 HB3 ARG 69 HB3 ARG 69 -18.447 -12.736 14.535 626 HG2 ARG 69 HG2 ARG 69 -19.609 -12.551 16.671 627 HG3 ARG 69 HG3 ARG 69 -19.541 -10.979 15.891 628 HD2 ARG 69 HD2 ARG 69 -21.940 -11.393 15.068 629 HD3 ARG 69 HD3 ARG 69 -21.935 -12.850 16.055 630 HE ARG 69 HE ARG 69 -22.077 -11.567 17.993 631 HH11 ARG 69 HH11 ARG 69 -21.454 -9.310 15.340 632 HH12 ARG 69 HH12 ARG 69 -21.988 -7.952 16.291 633 HH21 ARG 69 HH21 ARG 69 -22.660 -9.774 19.129 634 HH22 ARG 69 HH22 ARG 69 -22.605 -8.200 18.393 635 H ARG 70 H ARG 70 -17.726 -10.746 12.568 636 HA ARG 70 HA ARG 70 -18.197 -8.203 13.840 637 HB2 ARG 70 HB2 ARG 70 -15.952 -9.245 13.443 638 HB3 ARG 70 HB3 ARG 70 -16.131 -8.959 11.715 639 HG2 ARG 70 HG2 ARG 70 -14.680 -7.321 12.762 640 HG3 ARG 70 HG3 ARG 70 -16.089 -6.528 12.068 641 HD2 ARG 70 HD2 ARG 70 -15.945 -7.275 15.012 642 HD3 ARG 70 HD3 ARG 70 -15.214 -5.782 14.405 643 HE ARG 70 HE ARG 70 -17.848 -5.743 13.428 644 HH11 ARG 70 HH11 ARG 70 -16.372 -5.667 16.613 645 HH12 ARG 70 HH12 ARG 70 -17.718 -4.821 17.315 646 HH21 ARG 70 HH21 ARG 70 -19.533 -4.692 14.382 647 HH22 ARG 70 HH22 ARG 70 -19.458 -4.255 16.064 648 H LEU 71 H LEU 71 -18.577 -9.332 10.525 649 HA LEU 71 HA LEU 71 -19.717 -6.787 9.523 650 HB2 LEU 71 HB2 LEU 71 -19.600 -9.613 8.369 651 HB3 LEU 71 HB3 LEU 71 -20.236 -8.212 7.509 652 HG LEU 71 HG LEU 71 -17.334 -8.470 8.425 653 HD11 LEU 71 HD11 LEU 71 -17.919 -10.180 6.735 654 HD12 LEU 71 HD12 LEU 71 -18.583 -8.915 5.678 655 HD13 LEU 71 HD13 LEU 71 -16.848 -8.943 6.058 656 HD21 LEU 71 HD21 LEU 71 -16.975 -6.650 6.766 657 HD22 LEU 71 HD22 LEU 71 -18.723 -6.550 6.490 658 HD23 LEU 71 HD23 LEU 71 -18.035 -6.120 8.085 659 H GLN 72 H GLN 72 -22.038 -6.570 9.081 660 HA GLN 72 HA GLN 72 -23.744 -8.045 10.906 661 HB2 GLN 72 HB2 GLN 72 -24.351 -5.804 8.967 662 HB3 GLN 72 HB3 GLN 72 -25.521 -6.531 10.084 663 HG2 GLN 72 HG2 GLN 72 -24.058 -5.945 12.015 664 HG3 GLN 72 HG3 GLN 72 -22.933 -5.137 10.932 665 HE21 GLN 72 HE21 GLN 72 -25.090 -2.474 12.328 666 HE22 GLN 72 HE22 GLN 72 -23.885 -3.602 12.942 667 H LEU 73 H LEU 73 -22.798 -9.968 9.410 668 HA LEU 73 HA LEU 73 -24.722 -10.672 7.239 669 HB2 LEU 73 HB2 LEU 73 -22.111 -11.916 8.173 670 HB3 LEU 73 HB3 LEU 73 -23.119 -12.602 6.899 671 HG LEU 73 HG LEU 73 -21.885 -9.810 6.751 672 HD11 LEU 73 HD11 LEU 73 -20.103 -11.470 6.877 673 HD12 LEU 73 HD12 LEU 73 -20.910 -12.473 5.660 674 HD13 LEU 73 HD13 LEU 73 -20.241 -10.888 5.213 675 HD21 LEU 73 HD21 LEU 73 -23.816 -10.137 5.237 676 HD22 LEU 73 HD22 LEU 73 -22.301 -10.069 4.327 677 HD23 LEU 73 HD23 LEU 73 -23.082 -11.641 4.619 678 H ASN 74 H ASN 74 -25.908 -12.574 7.274 679 HA ASN 74 HA ASN 74 -26.221 -14.071 9.825 680 HB2 ASN 74 HB2 ASN 74 -27.765 -12.134 9.909 681 HB3 ASN 74 HB3 ASN 74 -28.421 -12.560 8.326 682 HD21 ASN 74 HD21 ASN 74 -29.943 -14.340 11.605 683 HD22 ASN 74 HD22 ASN 74 -28.727 -13.080 11.730 684 H ALA 75 H ALA 75 -27.195 -16.174 9.527 685 HA ALA 75 HA ALA 75 -26.356 -17.537 7.218 686 HB1 ALA 75 HB1 ALA 75 -28.400 -18.348 9.332 687 HB2 ALA 75 HB2 ALA 75 -27.538 -19.448 8.237 688 HB3 ALA 75 HB3 ALA 75 -26.633 -18.536 9.451 689 H ASN 76 H ASN 76 -29.414 -15.865 7.663 690 HA ASN 76 HA ASN 76 -30.870 -17.185 5.521 691 HB2 ASN 76 HB2 ASN 76 -31.184 -14.492 6.915 692 HB3 ASN 76 HB3 ASN 76 -32.273 -15.079 5.664 693 HD21 ASN 76 HD21 ASN 76 -32.705 -16.528 9.416 694 HD22 ASN 76 HD22 ASN 76 -31.389 -15.419 9.026 695 H GLN 77 H GLN 77 -28.289 -14.825 5.469 696 HA GLN 77 HA GLN 77 -28.930 -13.873 2.737 697 HB2 GLN 77 HB2 GLN 77 -26.473 -13.276 4.439 698 HB3 GLN 77 HB3 GLN 77 -27.004 -12.440 2.988 699 HG2 GLN 77 HG2 GLN 77 -28.268 -12.372 5.755 700 HG3 GLN 77 HG3 GLN 77 -27.519 -11.048 4.868 701 HE21 GLN 77 HE21 GLN 77 -30.456 -10.665 2.684 702 HE22 GLN 77 HE22 GLN 77 -28.707 -10.527 2.639 703 H ALA 78 H ALA 78 -27.729 -14.417 0.894 704 HA ALA 78 HA ALA 78 -26.111 -16.847 0.910 705 HB1 ALA 78 HB1 ALA 78 -25.825 -16.345 -1.482 706 HB2 ALA 78 HB2 ALA 78 -27.533 -16.265 -0.999 707 HB3 ALA 78 HB3 ALA 78 -26.609 -14.768 -1.255 708 H PHE 79 H PHE 79 -24.009 -16.915 1.528 709 HA PHE 79 HA PHE 79 -22.181 -14.741 0.918 710 HB2 PHE 79 HB2 PHE 79 -22.811 -13.714 2.837 711 HB3 PHE 79 HB3 PHE 79 -23.123 -15.213 3.687 712 HD1 PHE 79 HD1 PHE 79 -21.457 -16.310 5.021 713 HD2 PHE 79 HD2 PHE 79 -20.378 -12.956 2.534 714 HE1 PHE 79 HE1 PHE 79 -19.264 -16.167 6.168 715 HE2 PHE 79 HE2 PHE 79 -18.203 -12.786 3.728 716 HZ PHE 79 HZ PHE 79 -17.638 -14.395 5.532 717 H PHE 80 H PHE 80 -20.162 -15.208 0.531 718 HA PHE 80 HA PHE 80 -18.928 -17.621 1.758 719 HB2 PHE 80 HB2 PHE 80 -18.762 -16.941 -1.209 720 HB3 PHE 80 HB3 PHE 80 -17.960 -18.275 -0.397 721 HD1 PHE 80 HD1 PHE 80 -21.106 -17.049 -1.839 722 HD2 PHE 80 HD2 PHE 80 -19.253 -20.277 0.343 723 HE1 PHE 80 HE1 PHE 80 -23.042 -18.512 -2.357 724 HE2 PHE 80 HE2 PHE 80 -21.195 -21.737 -0.178 725 HZ PHE 80 HZ PHE 80 -23.091 -20.857 -1.523 726 H LEU 81 H LEU 81 -16.952 -17.125 2.555 727 HA LEU 81 HA LEU 81 -15.478 -14.732 1.532 728 HB2 LEU 81 HB2 LEU 81 -15.795 -14.580 3.888 729 HB3 LEU 81 HB3 LEU 81 -15.327 -16.256 4.131 730 HG LEU 81 HG LEU 81 -12.984 -15.729 3.547 731 HD11 LEU 81 HD11 LEU 81 -13.982 -12.830 3.404 732 HD12 LEU 81 HD12 LEU 81 -12.285 -13.323 3.412 733 HD13 LEU 81 HD13 LEU 81 -13.307 -13.751 2.038 734 HD21 LEU 81 HD21 LEU 81 -12.411 -14.350 5.491 735 HD22 LEU 81 HD22 LEU 81 -14.125 -13.879 5.665 736 HD23 LEU 81 HD23 LEU 81 -13.614 -15.564 5.891 737 H LEU 82 H LEU 82 -13.751 -15.015 0.329 738 HA LEU 82 HA LEU 82 -12.857 -17.770 -0.374 739 HB2 LEU 82 HB2 LEU 82 -12.885 -15.386 -2.220 740 HB3 LEU 82 HB3 LEU 82 -12.917 -17.093 -2.638 741 HG LEU 82 HG LEU 82 -15.290 -15.567 -1.442 742 HD11 LEU 82 HD11 LEU 82 -14.604 -14.669 -3.649 743 HD12 LEU 82 HD12 LEU 82 -14.808 -16.301 -4.346 744 HD13 LEU 82 HD13 LEU 82 -16.193 -15.432 -3.644 745 HD21 LEU 82 HD21 LEU 82 -15.085 -18.276 -2.819 746 HD22 LEU 82 HD22 LEU 82 -15.444 -17.994 -1.098 747 HD23 LEU 82 HD23 LEU 82 -16.592 -17.474 -2.338 748 H VAL 83 H VAL 83 -10.660 -18.076 -0.910 749 HA VAL 83 HA VAL 83 -8.812 -15.770 -0.403 750 HB VAL 83 HB VAL 83 -8.540 -17.708 1.128 751 HG11 VAL 83 HG11 VAL 83 -7.303 -19.097 -1.284 752 HG12 VAL 83 HG12 VAL 83 -7.360 -19.688 0.388 753 HG13 VAL 83 HG13 VAL 83 -8.856 -19.542 -0.557 754 HG21 VAL 83 HG21 VAL 83 -6.100 -17.689 1.014 755 HG22 VAL 83 HG22 VAL 83 -6.155 -16.969 -0.612 756 HG23 VAL 83 HG23 VAL 83 -6.764 -16.064 0.790 757 H ASN 84 H ASN 84 -7.823 -14.896 -2.153 758 HA ASN 84 HA ASN 84 -7.709 -14.408 -4.402 759 HB2 ASN 84 HB2 ASN 84 -6.534 -17.210 -4.379 760 HB3 ASN 84 HB3 ASN 84 -6.389 -16.097 -5.737 761 HD21 ASN 84 HD21 ASN 84 -3.440 -15.891 -3.315 762 HD22 ASN 84 HD22 ASN 84 -4.336 -17.292 -3.909 763 H GLY 85 H GLY 85 -10.332 -15.236 -3.692 764 HA2 GLY 85 HA2 GLY 85 -12.334 -15.545 -4.785 765 HA3 GLY 85 HA3 GLY 85 -11.484 -15.897 -6.286 766 H HIS 86 H HIS 86 -10.219 -18.050 -4.026 767 HA HIS 86 HA HIS 86 -11.957 -20.298 -4.871 768 HB2 HIS 86 HB2 HIS 86 -9.467 -20.323 -3.111 769 HB3 HIS 86 HB3 HIS 86 -10.196 -21.690 -3.955 770 HD1 HIS 86 HD1 HIS 86 -7.108 -20.403 -4.327 771 HD2 HIS 86 HD2 HIS 86 -10.511 -20.110 -6.859 772 HE1 HIS 86 HE1 HIS 86 -6.230 -19.854 -6.676 773 HE2 HIS 86 HE2 HIS 86 -8.292 -19.688 -8.220 774 H SER 87 H SER 87 -13.472 -21.264 -3.574 775 HA SER 87 HA SER 87 -14.362 -20.020 -1.182 776 HB2 SER 87 HB2 SER 87 -15.018 -22.752 -2.339 777 HB3 SER 87 HB3 SER 87 -15.897 -21.968 -1.008 778 HG SER 87 HG SER 87 -16.864 -21.563 -3.059 779 H MET 88 H MET 88 -14.016 -20.312 0.943 780 HA MET 88 HA MET 88 -12.150 -22.500 1.806 781 HB2 MET 88 HB2 MET 88 -12.405 -19.617 2.682 782 HB3 MET 88 HB3 MET 88 -11.424 -20.799 3.552 783 HG2 MET 88 HG2 MET 88 -10.969 -20.280 0.597 784 HG3 MET 88 HG3 MET 88 -10.284 -19.260 1.850 785 HE1 MET 88 HE1 MET 88 -9.369 -21.812 -0.517 786 HE2 MET 88 HE2 MET 88 -8.532 -23.118 0.343 787 HE3 MET 88 HE3 MET 88 -10.301 -23.007 0.414 788 H VAL 89 H VAL 89 -15.378 -21.985 2.104 789 HA VAL 89 HA VAL 89 -15.741 -21.867 4.924 790 HB VAL 89 HB VAL 89 -18.017 -22.124 4.639 791 HG11 VAL 89 HG11 VAL 89 -18.604 -20.556 2.918 792 HG12 VAL 89 HG12 VAL 89 -17.034 -20.065 3.578 793 HG13 VAL 89 HG13 VAL 89 -17.128 -20.884 1.998 794 HG21 VAL 89 HG21 VAL 89 -17.518 -23.409 1.927 795 HG22 VAL 89 HG22 VAL 89 -18.178 -24.199 3.377 796 HG23 VAL 89 HG23 VAL 89 -19.102 -22.936 2.566 797 H SER 90 H SER 90 -15.056 -24.692 3.033 798 HA SER 90 HA SER 90 -15.727 -26.558 5.212 799 HB2 SER 90 HB2 SER 90 -14.921 -28.250 3.607 800 HB3 SER 90 HB3 SER 90 -16.170 -27.197 2.917 801 HG SER 90 HG SER 90 -14.360 -27.495 1.486 802 H VAL 91 H VAL 91 -13.097 -24.498 4.722 803 HA VAL 91 HA VAL 91 -10.967 -26.456 5.179 804 HB VAL 91 HB VAL 91 -10.799 -23.455 4.806 805 HG11 VAL 91 HG11 VAL 91 -8.643 -25.594 4.623 806 HG12 VAL 91 HG12 VAL 91 -8.443 -23.877 4.238 807 HG13 VAL 91 HG13 VAL 91 -8.758 -24.364 5.905 808 HG21 VAL 91 HG21 VAL 91 -11.730 -24.589 2.809 809 HG22 VAL 91 HG22 VAL 91 -10.058 -24.094 2.515 810 HG23 VAL 91 HG23 VAL 91 -10.428 -25.791 2.872 811 H SER 92 H SER 92 -11.092 -27.307 7.154 812 HA SER 92 HA SER 92 -11.011 -25.756 9.618 813 HB2 SER 92 HB2 SER 92 -10.600 -27.963 10.651 814 HB3 SER 92 HB3 SER 92 -11.993 -27.984 9.557 815 HG SER 92 HG SER 92 -10.590 -29.801 9.230 816 H THR 93 H THR 93 -8.625 -26.465 7.253 817 HA THR 93 HA THR 93 -6.320 -26.823 8.676 818 HB THR 93 HB THR 93 -6.359 -25.100 6.218 819 HG1 THR 93 HG1 THR 93 -6.478 -27.109 5.065 820 HG21 THR 93 HG21 THR 93 -4.125 -25.599 7.120 821 HG22 THR 93 HG22 THR 93 -4.490 -27.346 7.078 822 HG23 THR 93 HG23 THR 93 -4.382 -26.407 5.574 823 HA PRO 94 HA PRO 94 -5.282 -22.932 10.758 824 HB2 PRO 94 HB2 PRO 94 -2.538 -23.203 10.892 825 HB3 PRO 94 HB3 PRO 94 -3.690 -23.996 12.010 826 HG2 PRO 94 HG2 PRO 94 -2.422 -25.160 9.507 827 HG3 PRO 94 HG3 PRO 94 -2.517 -25.887 11.146 828 HD2 PRO 94 HD2 PRO 94 -4.290 -26.592 9.275 829 HD3 PRO 94 HD3 PRO 94 -4.863 -26.265 10.928 830 H ILE 95 H ILE 95 -4.550 -20.900 10.160 831 HA ILE 95 HA ILE 95 -4.676 -20.330 7.421 832 HB ILE 95 HB ILE 95 -5.333 -18.803 9.226 833 HG12 ILE 95 HG12 ILE 95 -4.460 -16.664 8.362 834 HG13 ILE 95 HG13 ILE 95 -3.250 -17.507 7.402 835 HG21 ILE 95 HG21 ILE 95 -3.432 -19.138 10.793 836 HG22 ILE 95 HG22 ILE 95 -2.332 -18.326 9.645 837 HG23 ILE 95 HG23 ILE 95 -3.641 -17.436 10.424 838 HD11 ILE 95 HD11 ILE 95 -5.287 -16.784 6.126 839 HD12 ILE 95 HD12 ILE 95 -5.034 -18.538 6.047 840 HD13 ILE 95 HD13 ILE 95 -6.272 -17.857 7.130 841 H SER 96 H SER 96 -1.748 -21.083 9.240 842 HA SER 96 HA SER 96 0.186 -19.762 7.628 843 HB2 SER 96 HB2 SER 96 1.734 -21.493 8.577 844 HB3 SER 96 HB3 SER 96 0.759 -20.629 9.778 845 HG SER 96 HG SER 96 0.804 -22.955 10.089 846 H GLU 97 H GLU 97 -1.188 -23.053 7.258 847 HA GLU 97 HA GLU 97 0.415 -23.738 4.936 848 HB2 GLU 97 HB2 GLU 97 -2.256 -24.839 5.887 849 HB3 GLU 97 HB3 GLU 97 -1.232 -25.596 4.675 850 HG2 GLU 97 HG2 GLU 97 -0.528 -25.172 7.616 851 HG3 GLU 97 HG3 GLU 97 -1.088 -26.669 6.895 852 H VAL 98 H VAL 98 -2.873 -22.428 5.323 853 HA VAL 98 HA VAL 98 -3.550 -22.270 2.530 854 HB VAL 98 HB VAL 98 -4.547 -20.493 4.781 855 HG11 VAL 98 HG11 VAL 98 -5.181 -19.684 2.527 856 HG12 VAL 98 HG12 VAL 98 -5.848 -21.286 2.143 857 HG13 VAL 98 HG13 VAL 98 -6.580 -20.283 3.413 858 HG21 VAL 98 HG21 VAL 98 -5.549 -23.221 3.874 859 HG22 VAL 98 HG22 VAL 98 -4.912 -22.798 5.482 860 HG23 VAL 98 HG23 VAL 98 -6.446 -22.124 4.941 861 H TYR 99 H TYR 99 -1.994 -19.963 4.748 862 HA TYR 99 HA TYR 99 -1.560 -17.856 2.969 863 HB2 TYR 99 HB2 TYR 99 -1.242 -17.333 5.175 864 HB3 TYR 99 HB3 TYR 99 -0.245 -18.725 5.484 865 HD1 TYR 99 HD1 TYR 99 -0.140 -15.582 3.411 866 HD2 TYR 99 HD2 TYR 99 2.055 -18.486 5.729 867 HE1 TYR 99 HE1 TYR 99 1.907 -14.171 3.247 868 HE2 TYR 99 HE2 TYR 99 4.097 -17.086 5.544 869 HH TYR 99 HH TYR 99 4.998 -15.098 4.807 870 H GLU 100 H GLU 100 0.950 -20.366 3.663 871 HA GLU 100 HA GLU 100 2.651 -19.382 1.637 872 HB2 GLU 100 HB2 GLU 100 3.360 -20.813 3.495 873 HB3 GLU 100 HB3 GLU 100 2.383 -22.140 2.882 874 HG2 GLU 100 HG2 GLU 100 4.690 -22.547 2.407 875 HG3 GLU 100 HG3 GLU 100 3.813 -22.337 0.902 876 H SER 101 H SER 101 -0.124 -21.520 1.325 877 HA SER 101 HA SER 101 0.416 -22.363 -1.408 878 HB2 SER 101 HB2 SER 101 -2.177 -22.307 0.191 879 HB3 SER 101 HB3 SER 101 -1.943 -23.098 -1.376 880 HG SER 101 HG SER 101 -0.784 -23.757 1.125 881 H GLU 102 H GLU 102 -1.163 -19.505 -0.044 882 HA GLU 102 HA GLU 102 -2.083 -18.643 -2.774 883 HB2 GLU 102 HB2 GLU 102 -3.422 -18.432 -0.080 884 HB3 GLU 102 HB3 GLU 102 -4.037 -17.631 -1.505 885 HG2 GLU 102 HG2 GLU 102 -3.697 -20.659 -1.317 886 HG3 GLU 102 HG3 GLU 102 -5.127 -19.810 -0.786 887 H LYS 103 H LYS 103 0.106 -17.749 -0.486 888 HA LYS 103 HA LYS 103 0.020 -14.961 -0.247 889 HB2 LYS 103 HB2 LYS 103 1.559 -16.415 0.940 890 HB3 LYS 103 HB3 LYS 103 2.311 -16.929 -0.568 891 HG2 LYS 103 HG2 LYS 103 3.204 -14.583 -0.858 892 HG3 LYS 103 HG3 LYS 103 2.468 -14.172 0.705 893 HD2 LYS 103 HD2 LYS 103 4.734 -14.687 1.212 894 HD3 LYS 103 HD3 LYS 103 3.830 -16.129 1.692 895 HE2 LYS 103 HE2 LYS 103 4.403 -17.066 -0.662 896 HE3 LYS 103 HE3 LYS 103 5.511 -15.703 -0.817 897 HZ1 LYS 103 HZ1 LYS 103 6.581 -16.563 1.299 898 HZ2 LYS 103 HZ2 LYS 103 5.633 -17.918 1.183 899 HZ3 LYS 103 HZ3 LYS 103 6.718 -17.580 0.023 900 H ASP 104 H ASP 104 0.254 -13.266 -1.567 901 HA ASP 104 HA ASP 104 0.906 -13.661 -4.429 902 HB2 ASP 104 HB2 ASP 104 -1.116 -12.438 -3.618 903 HB3 ASP 104 HB3 ASP 104 -0.058 -11.207 -2.910 904 H GLU 105 H GLU 105 2.279 -11.854 -5.423 905 HA GLU 105 HA GLU 105 4.931 -12.337 -4.684 906 HB2 GLU 105 HB2 GLU 105 3.799 -10.050 -6.352 907 HB3 GLU 105 HB3 GLU 105 5.496 -10.502 -6.323 908 HG2 GLU 105 HG2 GLU 105 3.223 -12.316 -7.244 909 HG3 GLU 105 HG3 GLU 105 4.266 -11.369 -8.297 910 H ASP 106 H ASP 106 2.998 -9.531 -3.690 911 HA ASP 106 HA ASP 106 5.285 -8.181 -2.453 912 HB2 ASP 106 HB2 ASP 106 3.529 -6.577 -1.615 913 HB3 ASP 106 HB3 ASP 106 3.754 -6.710 -3.349 914 H GLY 107 H GLY 107 3.616 -10.830 -1.436 915 HA2 GLY 107 HA2 GLY 107 4.109 -11.976 0.551 916 HA3 GLY 107 HA3 GLY 107 4.478 -10.465 1.370 917 H PHE 108 H PHE 108 1.625 -9.600 0.049 918 HA PHE 108 HA PHE 108 0.050 -10.368 2.367 919 HB2 PHE 108 HB2 PHE 108 -0.482 -8.606 0.043 920 HB3 PHE 108 HB3 PHE 108 -1.843 -9.294 0.868 921 HD1 PHE 108 HD1 PHE 108 1.258 -7.259 1.550 922 HD2 PHE 108 HD2 PHE 108 -2.677 -8.439 2.850 923 HE1 PHE 108 HE1 PHE 108 1.299 -5.514 3.325 924 HE2 PHE 108 HE2 PHE 108 -2.640 -6.681 4.604 925 HZ PHE 108 HZ PHE 108 -0.632 -5.213 4.836 926 H LEU 109 H LEU 109 -1.792 -11.481 2.590 927 HA LEU 109 HA LEU 109 -2.400 -13.553 0.531 928 HB2 LEU 109 HB2 LEU 109 -1.856 -14.273 2.834 929 HB3 LEU 109 HB3 LEU 109 -3.158 -13.272 3.452 930 HG LEU 109 HG LEU 109 -4.833 -14.666 2.235 931 HD11 LEU 109 HD11 LEU 109 -3.967 -16.925 1.442 932 HD12 LEU 109 HD12 LEU 109 -3.562 -15.563 0.387 933 HD13 LEU 109 HD13 LEU 109 -2.331 -16.247 1.478 934 HD21 LEU 109 HD21 LEU 109 -4.603 -16.649 3.685 935 HD22 LEU 109 HD22 LEU 109 -2.920 -16.208 4.040 936 HD23 LEU 109 HD23 LEU 109 -4.244 -15.157 4.581 937 H TYR 110 H TYR 110 -3.874 -12.764 -0.948 938 HA TYR 110 HA TYR 110 -5.900 -10.852 -0.145 939 HB2 TYR 110 HB2 TYR 110 -5.128 -12.023 -2.750 940 HB3 TYR 110 HB3 TYR 110 -6.729 -11.348 -2.574 941 HD1 TYR 110 HD1 TYR 110 -7.126 -9.003 -2.471 942 HD2 TYR 110 HD2 TYR 110 -3.087 -10.544 -2.433 943 HE1 TYR 110 HE1 TYR 110 -6.250 -6.745 -3.034 944 HE2 TYR 110 HE2 TYR 110 -2.222 -8.285 -2.999 945 HH TYR 110 HH TYR 110 -2.833 -6.160 -3.792 946 H MET 111 H MET 111 -7.898 -11.054 0.565 947 HA MET 111 HA MET 111 -9.364 -13.520 -0.182 948 HB2 MET 111 HB2 MET 111 -9.778 -12.045 2.451 949 HB3 MET 111 HB3 MET 111 -10.568 -13.514 1.889 950 HG2 MET 111 HG2 MET 111 -8.326 -14.653 1.858 951 HG3 MET 111 HG3 MET 111 -7.648 -13.215 2.647 952 HE1 MET 111 HE1 MET 111 -6.629 -14.666 4.477 953 HE2 MET 111 HE2 MET 111 -7.512 -15.867 5.439 954 HE3 MET 111 HE3 MET 111 -7.286 -16.134 3.700 955 H VAL 112 H VAL 112 -11.499 -13.324 -0.739 956 HA VAL 112 HA VAL 112 -12.608 -10.571 -1.100 957 HB VAL 112 HB VAL 112 -12.575 -12.801 -3.164 958 HG11 VAL 112 HG11 VAL 112 -13.924 -10.078 -3.306 959 HG12 VAL 112 HG12 VAL 112 -13.741 -11.212 -4.661 960 HG13 VAL 112 HG13 VAL 112 -14.742 -11.665 -3.290 961 HG21 VAL 112 HG21 VAL 112 -11.373 -11.149 -4.574 962 HG22 VAL 112 HG22 VAL 112 -11.349 -10.011 -3.211 963 HG23 VAL 112 HG23 VAL 112 -10.457 -11.545 -3.112 964 H TYR 113 H TYR 113 -14.945 -10.492 -0.726 965 HA TYR 113 HA TYR 113 -16.197 -13.182 -0.340 966 HB2 TYR 113 HB2 TYR 113 -17.344 -12.629 1.605 967 HB3 TYR 113 HB3 TYR 113 -15.676 -12.207 1.908 968 HD1 TYR 113 HD1 TYR 113 -14.989 -9.752 1.916 969 HD2 TYR 113 HD2 TYR 113 -19.102 -11.027 1.746 970 HE1 TYR 113 HE1 TYR 113 -15.714 -7.584 2.928 971 HE2 TYR 113 HE2 TYR 113 -19.827 -8.843 2.670 972 HH TYR 113 HH TYR 113 -19.152 -6.807 3.555 973 H ALA 114 H ALA 114 -18.394 -13.305 -0.696 974 HA ALA 114 HA ALA 114 -19.772 -11.167 -2.199 975 HB1 ALA 114 HB1 ALA 114 -18.589 -13.670 -3.486 976 HB2 ALA 114 HB2 ALA 114 -19.598 -12.466 -4.317 977 HB3 ALA 114 HB3 ALA 114 -17.992 -12.025 -3.726 978 H SER 115 H SER 115 -21.789 -11.908 -3.144 979 HA SER 115 HA SER 115 -23.388 -13.752 -1.628 980 HB2 SER 115 HB2 SER 115 -24.310 -11.825 -2.807 981 HB3 SER 115 HB3 SER 115 -23.749 -12.467 -4.360 982 HG SER 115 HG SER 115 -25.987 -12.920 -3.966 983 H GLN 116 H GLN 116 -21.436 -14.099 -4.536 984 HA GLN 116 HA GLN 116 -21.737 -17.043 -4.537 985 HB2 GLN 116 HB2 GLN 116 -22.141 -17.123 -6.877 986 HB3 GLN 116 HB3 GLN 116 -23.365 -16.081 -6.166 987 HG2 GLN 116 HG2 GLN 116 -20.939 -15.177 -7.775 988 HG3 GLN 116 HG3 GLN 116 -22.598 -15.248 -8.336 989 HE21 GLN 116 HE21 GLN 116 -21.412 -12.114 -5.942 990 HE22 GLN 116 HE22 GLN 116 -20.331 -13.483 -6.294 991 H GLU 117 H GLU 117 -19.885 -18.172 -5.328 992 HA GLU 117 HA GLU 117 -17.405 -16.697 -5.047 993 HB2 GLU 117 HB2 GLU 117 -16.338 -18.759 -5.023 994 HB3 GLU 117 HB3 GLU 117 -17.843 -19.027 -4.165 995 HG2 GLU 117 HG2 GLU 117 -17.225 -19.853 -7.044 996 HG3 GLU 117 HG3 GLU 117 -17.131 -20.889 -5.642 997 H THR 118 H THR 118 -19.342 -17.377 -7.823 998 HA THR 118 HA THR 118 -17.241 -17.643 -9.820 999 HB THR 118 HB THR 118 -19.332 -16.786 -11.270 1000 HG1 THR 118 HG1 THR 118 -21.291 -17.330 -10.281 1001 HG21 THR 118 HG21 THR 118 -19.289 -19.494 -9.876 1002 HG22 THR 118 HG22 THR 118 -20.180 -19.097 -11.367 1003 HG23 THR 118 HG23 THR 118 -18.408 -19.054 -11.359 1004 H PHE 119 H PHE 119 -16.568 -16.081 -11.269 1005 HA PHE 119 HA PHE 119 -17.321 -13.281 -10.889 1006 HB2 PHE 119 HB2 PHE 119 -14.869 -12.611 -11.067 1007 HB3 PHE 119 HB3 PHE 119 -15.537 -13.140 -9.529 1008 HD1 PHE 119 HD1 PHE 119 -13.354 -14.202 -12.357 1009 HD2 PHE 119 HD2 PHE 119 -14.740 -15.088 -8.375 1010 HE1 PHE 119 HE1 PHE 119 -11.582 -15.927 -12.118 1011 HE2 PHE 119 HE2 PHE 119 -12.989 -16.822 -8.145 1012 HZ PHE 119 HZ PHE 119 -11.397 -17.240 -10.019 1013 H GLY 120 H GLY 120 -17.198 -11.872 -12.546 1014 HA2 GLY 120 HA2 GLY 120 -16.894 -13.083 -15.279 1015 HA3 GLY 120 HA3 GLY 120 -17.966 -11.758 -14.854 1016 H1 ASP 10 H1 ASP 10 -10.051 -1.876 21.079 1017 H2 ASP 10 H2 ASP 10 -10.014 -2.737 19.675 1018 H3 ASP 10 H3 ASP 10 -8.837 -2.944 20.791 1019 HA ASP 10 HA ASP 10 -9.348 -0.436 19.350 1020 HB2 ASP 10 HB2 ASP 10 -7.153 -1.118 21.322 1021 HB3 ASP 10 HB3 ASP 10 -7.081 0.262 20.226 1022 H TYR 11 H TYR 11 -7.581 0.320 17.881 1023 HA TYR 11 HA TYR 11 -6.573 0.018 15.947 1024 HB2 TYR 11 HB2 TYR 11 -4.970 -1.698 17.733 1025 HB3 TYR 11 HB3 TYR 11 -4.571 -1.649 16.035 1026 HD1 TYR 11 HD1 TYR 11 -3.913 0.391 14.861 1027 HD2 TYR 11 HD2 TYR 11 -4.585 0.317 19.135 1028 HE1 TYR 11 HE1 TYR 11 -2.694 2.553 15.100 1029 HE2 TYR 11 HE2 TYR 11 -3.367 2.477 19.365 1030 HH TYR 11 HH TYR 11 -2.249 4.166 18.281 1031 H GLU 12 H GLU 12 -8.935 -1.001 15.572 1032 HA GLU 12 HA GLU 12 -8.684 -3.376 13.864 1033 HB2 GLU 12 HB2 GLU 12 -11.043 -2.993 13.354 1034 HB3 GLU 12 HB3 GLU 12 -10.762 -2.993 15.096 1035 HG2 GLU 12 HG2 GLU 12 -10.981 -0.630 15.278 1036 HG3 GLU 12 HG3 GLU 12 -10.797 -0.385 13.541 1037 H SER 13 H SER 13 -7.085 -0.849 13.221 1038 HA SER 13 HA SER 13 -7.099 -1.515 10.418 1039 HB2 SER 13 HB2 SER 13 -9.049 0.259 10.824 1040 HB3 SER 13 HB3 SER 13 -7.698 1.403 10.870 1041 HG SER 13 HG SER 13 -8.493 -0.402 8.794 1042 H ASP 14 H ASP 14 -5.796 -0.109 9.219 1043 HA ASP 14 HA ASP 14 -3.941 0.955 8.543 1044 HB2 ASP 14 HB2 ASP 14 -4.244 2.427 11.112 1045 HB3 ASP 14 HB3 ASP 14 -2.940 2.775 9.995 1046 H ASP 15 H ASP 15 -2.061 1.306 11.387 1047 HA ASP 15 HA ASP 15 -0.286 -0.905 10.859 1048 HB2 ASP 15 HB2 ASP 15 1.617 0.517 10.027 1049 HB3 ASP 15 HB3 ASP 15 0.322 0.222 8.892 1050 H ASP 16 H ASP 16 1.761 -0.794 12.014 1051 HA ASP 16 HA ASP 16 3.027 -0.641 13.804 1052 HB2 ASP 16 HB2 ASP 16 3.859 1.272 12.925 1053 HB3 ASP 16 HB3 ASP 16 2.436 2.224 13.329 1054 H SER 17 H SER 17 2.781 -1.708 15.604 1055 HA SER 17 HA SER 17 1.942 -2.466 17.565 1056 HB2 SER 17 HB2 SER 17 1.559 0.481 18.212 1057 HB3 SER 17 HB3 SER 17 1.516 -0.859 19.365 1058 HG SER 17 HG SER 17 3.724 -0.066 17.744 1059 H TYR 18 H TYR 18 0.295 -3.053 15.766 1060 HA TYR 18 HA TYR 18 -2.475 -2.288 16.581 1061 HB2 TYR 18 HB2 TYR 18 -2.996 -1.595 14.392 1062 HB3 TYR 18 HB3 TYR 18 -1.452 -0.836 14.668 1063 HD1 TYR 18 HD1 TYR 18 0.601 -2.762 13.879 1064 HD2 TYR 18 HD2 TYR 18 -3.321 -2.091 12.257 1065 HE1 TYR 18 HE1 TYR 18 1.321 -3.824 11.750 1066 HE2 TYR 18 HE2 TYR 18 -2.601 -3.141 10.105 1067 HH TYR 18 HH TYR 18 -0.899 -4.215 8.974 1068 H GLU 19 H GLU 19 -4.109 -3.765 15.642 1069 HA GLU 19 HA GLU 19 -3.051 -6.558 15.240 1070 HB2 GLU 19 HB2 GLU 19 -5.399 -5.669 16.954 1071 HB3 GLU 19 HB3 GLU 19 -4.841 -7.321 16.737 1072 HG2 GLU 19 HG2 GLU 19 -3.333 -5.059 18.111 1073 HG3 GLU 19 HG3 GLU 19 -4.124 -6.425 18.881 1074 H VAL 20 H VAL 20 -5.624 -4.305 14.314 1075 HA VAL 20 HA VAL 20 -7.185 -4.315 12.814 1076 HB VAL 20 HB VAL 20 -5.918 -6.410 11.125 1077 HG11 VAL 20 HG11 VAL 20 -7.388 -3.790 10.573 1078 HG12 VAL 20 HG12 VAL 20 -6.716 -4.862 9.345 1079 HG13 VAL 20 HG13 VAL 20 -8.065 -5.410 10.364 1080 HG21 VAL 20 HG21 VAL 20 -5.044 -3.514 11.430 1081 HG22 VAL 20 HG22 VAL 20 -4.067 -4.943 11.838 1082 HG23 VAL 20 HG23 VAL 20 -4.510 -4.633 10.154 1083 H LEU 21 H LEU 21 -6.653 -7.830 13.126 1084 HA LEU 21 HA LEU 21 -9.586 -8.422 13.138 1085 HB2 LEU 21 HB2 LEU 21 -7.805 -9.831 11.945 1086 HB3 LEU 21 HB3 LEU 21 -7.175 -10.225 13.536 1087 HG LEU 21 HG LEU 21 -9.611 -11.099 14.031 1088 HD11 LEU 21 HD11 LEU 21 -10.713 -10.188 12.022 1089 HD12 LEU 21 HD12 LEU 21 -9.571 -11.051 10.967 1090 HD13 LEU 21 HD13 LEU 21 -10.730 -11.954 11.951 1091 HD21 LEU 21 HD21 LEU 21 -7.814 -12.528 12.028 1092 HD22 LEU 21 HD22 LEU 21 -7.627 -12.553 13.798 1093 HD23 LEU 21 HD23 LEU 21 -9.056 -13.293 13.053 1094 H ASP 22 H ASP 22 -9.478 -6.708 14.937 1095 HA ASP 22 HA ASP 22 -8.132 -6.923 17.294 1096 HB2 ASP 22 HB2 ASP 22 -9.209 -4.929 16.658 1097 HB3 ASP 22 HB3 ASP 22 -10.793 -5.682 16.681 1098 H LEU 23 H LEU 23 -7.843 -8.593 18.510 1099 HA LEU 23 HA LEU 23 -10.009 -10.010 19.937 1100 HB2 LEU 23 HB2 LEU 23 -7.945 -11.242 18.050 1101 HB3 LEU 23 HB3 LEU 23 -8.750 -12.184 19.293 1102 HG LEU 23 HG LEU 23 -10.237 -10.809 17.023 1103 HD11 LEU 23 HD11 LEU 23 -9.413 -13.734 17.370 1104 HD12 LEU 23 HD12 LEU 23 -10.420 -13.073 16.063 1105 HD13 LEU 23 HD13 LEU 23 -8.723 -12.594 16.202 1106 HD21 LEU 23 HD21 LEU 23 -11.653 -11.207 18.999 1107 HD22 LEU 23 HD22 LEU 23 -12.070 -12.334 17.711 1108 HD23 LEU 23 HD23 LEU 23 -11.094 -12.898 19.082 1109 H THR 24 H THR 24 -9.207 -11.219 21.772 1110 HA THR 24 HA THR 24 -6.979 -10.093 23.098 1111 HB THR 24 HB THR 24 -8.004 -12.663 24.151 1112 HG1 THR 24 HG1 THR 24 -9.922 -11.710 24.810 1113 HG21 THR 24 HG21 THR 24 -8.091 -11.366 26.244 1114 HG22 THR 24 HG22 THR 24 -6.499 -11.200 25.497 1115 HG23 THR 24 HG23 THR 24 -7.674 -9.875 25.367 1116 H GLU 25 H GLU 25 -6.717 -12.303 20.684 1117 HA GLU 25 HA GLU 25 -4.408 -13.821 21.648 1118 HB2 GLU 25 HB2 GLU 25 -5.574 -13.472 18.856 1119 HB3 GLU 25 HB3 GLU 25 -4.293 -14.600 19.282 1120 HG2 GLU 25 HG2 GLU 25 -7.161 -14.654 20.316 1121 HG3 GLU 25 HG3 GLU 25 -6.481 -15.689 19.074 1122 H TYR 26 H TYR 26 -3.470 -11.684 22.408 1123 HA TYR 26 HA TYR 26 -2.296 -9.880 20.566 1124 HB2 TYR 26 HB2 TYR 26 -1.861 -10.304 23.498 1125 HB3 TYR 26 HB3 TYR 26 -0.949 -9.129 22.568 1126 HD1 TYR 26 HD1 TYR 26 -4.049 -9.723 24.296 1127 HD2 TYR 26 HD2 TYR 26 -2.205 -7.349 21.204 1128 HE1 TYR 26 HE1 TYR 26 -5.877 -8.035 24.498 1129 HE2 TYR 26 HE2 TYR 26 -4.029 -5.665 21.401 1130 HH TYR 26 HH TYR 26 -5.969 -5.057 22.502
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