NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
480583 | 2p0p | 7381 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 10.565 -5.021 -0.766 2 H2 MET 1 H2 MET 1 9.516 -3.807 -1.098 3 H3 MET 1 H3 MET 1 9.561 -4.441 0.402 4 HA MET 1 HA MET 1 8.710 -5.800 -2.049 5 HB2 MET 1 HB2 MET 1 8.156 -7.745 -0.785 6 HB3 MET 1 HB3 MET 1 9.836 -7.353 -0.462 7 HG2 MET 1 HG2 MET 1 9.195 -6.384 1.732 8 HG3 MET 1 HG3 MET 1 7.496 -6.715 1.375 9 HE1 MET 1 HE1 MET 1 8.174 -9.208 4.269 10 HE2 MET 1 HE2 MET 1 8.818 -7.562 4.080 11 HE3 MET 1 HE3 MET 1 7.129 -7.909 3.651 12 H ALA 2 H ALA 2 6.313 -6.648 -1.701 13 HA ALA 2 HA ALA 2 4.666 -4.357 -1.537 14 HB1 ALA 2 HB1 ALA 2 3.900 -7.312 -1.378 15 HB2 ALA 2 HB2 ALA 2 2.801 -5.964 -1.740 16 HB3 ALA 2 HB3 ALA 2 4.110 -6.357 -2.865 17 H SER 3 H SER 3 5.358 -6.877 0.890 18 HA SER 3 HA SER 3 4.861 -7.179 3.037 19 HB2 SER 3 HB2 SER 3 4.754 -4.152 3.192 20 HB3 SER 3 HB3 SER 3 5.076 -5.282 4.519 21 HG SER 3 HG SER 3 6.989 -4.382 3.601 22 H VAL 4 H VAL 4 2.393 -6.429 1.097 23 HA VAL 4 HA VAL 4 0.218 -5.854 2.792 24 HB VAL 4 HB VAL 4 0.223 -5.864 0.323 25 HG11 VAL 4 HG11 VAL 4 1.510 -7.972 -0.081 26 HG12 VAL 4 HG12 VAL 4 0.096 -8.903 0.468 27 HG13 VAL 4 HG13 VAL 4 -0.001 -7.896 -0.979 28 HG21 VAL 4 HG21 VAL 4 -1.918 -5.921 1.536 29 HG22 VAL 4 HG22 VAL 4 -2.011 -6.731 -0.036 30 HG23 VAL 4 HG23 VAL 4 -1.919 -7.695 1.456 31 H GLU 5 H GLU 5 2.150 -8.755 2.376 32 HA GLU 5 HA GLU 5 1.126 -9.870 4.837 33 HB2 GLU 5 HB2 GLU 5 -0.166 -11.151 3.200 34 HB3 GLU 5 HB3 GLU 5 1.250 -11.366 2.174 35 HG2 GLU 5 HG2 GLU 5 0.791 -13.413 3.411 36 HG3 GLU 5 HG3 GLU 5 2.341 -12.731 3.897 37 H ARG 6 H ARG 6 2.910 -10.877 5.856 38 HA ARG 6 HA ARG 6 5.586 -10.609 4.621 39 HB2 ARG 6 HB2 ARG 6 6.300 -9.026 6.331 40 HB3 ARG 6 HB3 ARG 6 4.888 -8.404 5.469 41 HG2 ARG 6 HG2 ARG 6 3.448 -9.277 7.417 42 HG3 ARG 6 HG3 ARG 6 4.955 -9.629 8.260 43 HD2 ARG 6 HD2 ARG 6 4.128 -7.497 9.016 44 HD3 ARG 6 HD3 ARG 6 5.592 -7.207 8.059 45 HE ARG 6 HE ARG 6 3.424 -7.000 6.279 46 HH11 ARG 6 HH11 ARG 6 4.509 -5.274 9.190 47 HH12 ARG 6 HH12 ARG 6 3.786 -3.776 8.733 48 HH21 ARG 6 HH21 ARG 6 2.511 -5.055 5.658 49 HH22 ARG 6 HH22 ARG 6 2.593 -3.644 6.671 50 H ASP 7 H ASP 7 3.504 -12.508 6.451 51 HA ASP 7 HA ASP 7 5.819 -13.904 7.689 52 HB2 ASP 7 HB2 ASP 7 4.677 -12.734 9.510 53 HB3 ASP 7 HB3 ASP 7 3.127 -13.407 8.998 54 H GLU 8 H GLU 8 5.761 -16.083 7.388 55 HA GLU 8 HA GLU 8 4.265 -16.854 5.100 56 HB2 GLU 8 HB2 GLU 8 6.130 -18.462 6.898 57 HB3 GLU 8 HB3 GLU 8 5.531 -18.989 5.317 58 HG2 GLU 8 HG2 GLU 8 6.614 -17.027 4.246 59 HG3 GLU 8 HG3 GLU 8 7.277 -16.543 5.807 60 H THR 9 H THR 9 3.232 -17.068 8.402 61 HA THR 9 HA THR 9 2.129 -19.637 8.585 62 HB THR 9 HB THR 9 0.965 -17.039 9.620 63 HG1 THR 9 HG1 THR 9 2.986 -17.118 10.307 64 HG21 THR 9 HG21 THR 9 0.136 -18.473 11.485 65 HG22 THR 9 HG22 THR 9 -0.594 -18.905 9.934 66 HG23 THR 9 HG23 THR 9 0.705 -19.914 10.607 67 H ARG 10 H ARG 10 0.570 -16.748 7.031 68 HA ARG 10 HA ARG 10 -1.819 -18.228 6.433 69 HB2 ARG 10 HB2 ARG 10 -0.649 -15.633 5.397 70 HB3 ARG 10 HB3 ARG 10 -2.014 -16.375 4.575 71 HG2 ARG 10 HG2 ARG 10 -2.879 -14.765 6.129 72 HG3 ARG 10 HG3 ARG 10 -3.355 -16.383 6.620 73 HD2 ARG 10 HD2 ARG 10 -2.789 -15.082 8.568 74 HD3 ARG 10 HD3 ARG 10 -1.582 -16.360 8.384 75 HE ARG 10 HE ARG 10 -0.724 -13.991 7.016 76 HH11 ARG 10 HH11 ARG 10 -1.242 -15.008 10.388 77 HH12 ARG 10 HH12 ARG 10 -0.123 -13.868 11.033 78 HH21 ARG 10 HH21 ARG 10 0.808 -12.588 7.822 79 HH22 ARG 10 HH22 ARG 10 1.023 -12.394 9.538 80 H GLU 11 H GLU 11 1.285 -17.978 4.693 81 HA GLU 11 HA GLU 11 0.235 -19.186 2.274 82 HB2 GLU 11 HB2 GLU 11 3.092 -18.840 3.268 83 HB3 GLU 11 HB3 GLU 11 2.632 -19.535 1.709 84 HG2 GLU 11 HG2 GLU 11 1.374 -17.403 1.192 85 HG3 GLU 11 HG3 GLU 11 2.048 -16.702 2.665 86 H HIS 12 H HIS 12 1.905 -20.419 5.252 87 HA HIS 12 HA HIS 12 1.959 -23.157 4.360 88 HB2 HIS 12 HB2 HIS 12 1.816 -21.996 7.175 89 HB3 HIS 12 HB3 HIS 12 2.104 -23.689 6.796 90 HD1 HIS 12 HD1 HIS 12 4.471 -23.978 5.068 91 HD2 HIS 12 HD2 HIS 12 3.965 -20.698 7.650 92 HE1 HIS 12 HE1 HIS 12 6.797 -23.027 5.468 93 H ARG 13 H ARG 13 -0.526 -21.194 6.098 94 HA ARG 13 HA ARG 13 -2.194 -23.491 6.642 95 HB2 ARG 13 HB2 ARG 13 -2.853 -20.505 6.521 96 HB3 ARG 13 HB3 ARG 13 -4.013 -21.748 6.955 97 HG2 ARG 13 HG2 ARG 13 -1.588 -20.863 8.539 98 HG3 ARG 13 HG3 ARG 13 -3.279 -20.827 8.996 99 HD2 ARG 13 HD2 ARG 13 -1.438 -23.218 8.758 100 HD3 ARG 13 HD3 ARG 13 -2.179 -22.576 10.224 101 HE ARG 13 HE ARG 13 -4.399 -23.182 8.850 102 HH11 ARG 13 HH11 ARG 13 -1.503 -25.163 9.389 103 HH12 ARG 13 HH12 ARG 13 -2.297 -26.655 9.059 104 HH21 ARG 13 HH21 ARG 13 -5.459 -25.130 8.416 105 HH22 ARG 13 HH22 ARG 13 -4.627 -26.649 8.582 106 H ILE 14 H ILE 14 -2.366 -20.989 4.034 107 HA ILE 14 HA ILE 14 -4.629 -22.185 2.900 108 HB ILE 14 HB ILE 14 -3.687 -19.873 2.558 109 HG12 ILE 14 HG12 ILE 14 -4.662 -21.402 0.109 110 HG13 ILE 14 HG13 ILE 14 -5.660 -20.826 1.441 111 HG21 ILE 14 HG21 ILE 14 -2.116 -21.076 0.246 112 HG22 ILE 14 HG22 ILE 14 -2.223 -19.367 0.719 113 HG23 ILE 14 HG23 ILE 14 -1.421 -20.517 1.776 114 HD11 ILE 14 HD11 ILE 14 -4.148 -19.106 -0.551 115 HD12 ILE 14 HD12 ILE 14 -5.902 -19.309 -0.396 116 HD13 ILE 14 HD13 ILE 14 -4.997 -18.476 0.885 117 H GLU 15 H GLU 15 -1.152 -22.833 2.315 118 HA GLU 15 HA GLU 15 -1.371 -24.698 0.198 119 HB2 GLU 15 HB2 GLU 15 0.713 -23.684 0.979 120 HB3 GLU 15 HB3 GLU 15 0.545 -24.467 2.546 121 HG2 GLU 15 HG2 GLU 15 2.185 -25.651 1.278 122 HG3 GLU 15 HG3 GLU 15 0.773 -26.677 1.503 123 H THR 16 H THR 16 -1.883 -25.121 3.733 124 HA THR 16 HA THR 16 -2.171 -28.045 3.303 125 HB THR 16 HB THR 16 -1.820 -28.186 5.756 126 HG1 THR 16 HG1 THR 16 -1.053 -25.464 5.582 127 HG21 THR 16 HG21 THR 16 0.066 -28.462 4.191 128 HG22 THR 16 HG22 THR 16 0.401 -26.720 4.265 129 HG23 THR 16 HG23 THR 16 0.576 -27.726 5.719 130 H GLU 17 H GLU 17 -4.268 -25.522 3.251 131 HA GLU 17 HA GLU 17 -6.423 -27.155 4.496 132 HB2 GLU 17 HB2 GLU 17 -5.446 -25.193 5.792 133 HB3 GLU 17 HB3 GLU 17 -6.150 -24.127 4.560 134 HG2 GLU 17 HG2 GLU 17 -8.377 -24.991 5.091 135 HG3 GLU 17 HG3 GLU 17 -7.671 -26.158 6.223 136 H ILE 18 H ILE 18 -5.579 -24.967 1.771 137 HA ILE 18 HA ILE 18 -8.371 -25.306 0.765 138 HB ILE 18 HB ILE 18 -6.427 -23.000 0.509 139 HG12 ILE 18 HG12 ILE 18 -8.927 -23.542 2.148 140 HG13 ILE 18 HG13 ILE 18 -7.340 -23.013 2.698 141 HG21 ILE 18 HG21 ILE 18 -9.250 -23.186 -0.616 142 HG22 ILE 18 HG22 ILE 18 -8.171 -21.766 -0.673 143 HG23 ILE 18 HG23 ILE 18 -7.759 -23.196 -1.580 144 HD11 ILE 18 HD11 ILE 18 -9.474 -21.352 1.329 145 HD12 ILE 18 HD12 ILE 18 -8.849 -21.198 2.975 146 HD13 ILE 18 HD13 ILE 18 -7.820 -20.763 1.600 147 H ILE 19 H ILE 19 -4.939 -25.515 -0.251 148 HA ILE 19 HA ILE 19 -5.949 -26.722 -2.792 149 HB ILE 19 HB ILE 19 -3.962 -25.847 -3.913 150 HG12 ILE 19 HG12 ILE 19 -2.715 -25.271 -1.703 151 HG13 ILE 19 HG13 ILE 19 -2.484 -24.324 -3.164 152 HG21 ILE 19 HG21 ILE 19 -4.899 -23.618 -4.345 153 HG22 ILE 19 HG22 ILE 19 -6.135 -24.879 -4.289 154 HG23 ILE 19 HG23 ILE 19 -5.944 -23.772 -2.923 155 HD11 ILE 19 HD11 ILE 19 -2.674 -22.958 -1.089 156 HD12 ILE 19 HD12 ILE 19 -3.812 -22.505 -2.364 157 HD13 ILE 19 HD13 ILE 19 -4.382 -23.443 -0.980 158 H VAL 20 H VAL 20 -5.350 -28.090 -0.293 159 HA VAL 20 HA VAL 20 -2.921 -29.510 -0.383 160 HB VAL 20 HB VAL 20 -4.267 -31.329 0.787 161 HG11 VAL 20 HG11 VAL 20 -4.400 -28.495 1.867 162 HG12 VAL 20 HG12 VAL 20 -4.523 -29.986 2.834 163 HG13 VAL 20 HG13 VAL 20 -3.020 -29.613 1.974 164 HG21 VAL 20 HG21 VAL 20 -6.534 -30.859 -0.135 165 HG22 VAL 20 HG22 VAL 20 -6.493 -30.808 1.626 166 HG23 VAL 20 HG23 VAL 20 -6.551 -29.294 0.714 167 H ASP 21 H ASP 21 -5.861 -29.960 -2.298 168 HA ASP 21 HA ASP 21 -4.995 -32.591 -3.272 169 HB2 ASP 21 HB2 ASP 21 -7.298 -32.121 -2.419 170 HB3 ASP 21 HB3 ASP 21 -7.547 -31.019 -3.773 171 H ALA 22 H ALA 22 -3.960 -29.689 -4.193 172 HA ALA 22 HA ALA 22 -4.185 -30.135 -7.136 173 HB1 ALA 22 HB1 ALA 22 -4.448 -27.622 -7.253 174 HB2 ALA 22 HB2 ALA 22 -5.840 -28.457 -6.537 175 HB3 ALA 22 HB3 ALA 22 -4.676 -27.607 -5.498 176 H GLU 23 H GLU 23 -2.298 -29.739 -8.239 177 HA GLU 23 HA GLU 23 0.080 -28.826 -6.661 178 HB2 GLU 23 HB2 GLU 23 -0.214 -31.290 -8.429 179 HB3 GLU 23 HB3 GLU 23 1.303 -30.711 -7.732 180 HG2 GLU 23 HG2 GLU 23 0.331 -30.976 -5.441 181 HG3 GLU 23 HG3 GLU 23 -1.116 -31.688 -6.161 182 H ASP 24 H ASP 24 -1.791 -28.087 -9.301 183 HA ASP 24 HA ASP 24 0.486 -26.765 -10.693 184 HB2 ASP 24 HB2 ASP 24 -0.104 -28.751 -12.012 185 HB3 ASP 24 HB3 ASP 24 -1.813 -28.311 -11.963 186 H LYS 25 H LYS 25 -0.128 -24.755 -11.677 187 HA LYS 25 HA LYS 25 -1.795 -23.183 -10.109 188 HB2 LYS 25 HB2 LYS 25 -1.478 -21.433 -11.759 189 HB3 LYS 25 HB3 LYS 25 0.030 -22.319 -11.516 190 HG2 LYS 25 HG2 LYS 25 -0.478 -23.650 -13.606 191 HG3 LYS 25 HG3 LYS 25 -1.912 -22.636 -13.853 192 HD2 LYS 25 HD2 LYS 25 -0.480 -20.632 -14.031 193 HD3 LYS 25 HD3 LYS 25 0.966 -21.653 -13.803 194 HE2 LYS 25 HE2 LYS 25 0.304 -23.012 -15.779 195 HE3 LYS 25 HE3 LYS 25 -1.125 -22.006 -16.003 196 HZ1 LYS 25 HZ1 LYS 25 0.351 -20.116 -16.429 197 HZ2 LYS 25 HZ2 LYS 25 1.677 -21.050 -16.220 198 HZ3 LYS 25 HZ3 LYS 25 0.672 -21.325 -17.471 199 H GLU 26 H GLU 26 -2.761 -25.013 -13.071 200 HA GLU 26 HA GLU 26 -5.264 -23.603 -13.377 201 HB2 GLU 26 HB2 GLU 26 -4.315 -26.372 -14.259 202 HB3 GLU 26 HB3 GLU 26 -5.879 -25.692 -14.688 203 HG2 GLU 26 HG2 GLU 26 -4.722 -23.732 -15.744 204 HG3 GLU 26 HG3 GLU 26 -3.168 -24.490 -15.409 205 H GLU 27 H GLU 27 -4.260 -26.562 -11.628 206 HA GLU 27 HA GLU 27 -6.897 -27.295 -10.723 207 HB2 GLU 27 HB2 GLU 27 -4.182 -27.919 -9.489 208 HB3 GLU 27 HB3 GLU 27 -5.699 -28.777 -9.192 209 HG2 GLU 27 HG2 GLU 27 -5.727 -29.489 -11.579 210 HG3 GLU 27 HG3 GLU 27 -4.168 -28.690 -11.826 211 H ARG 28 H ARG 28 -4.206 -25.344 -9.379 212 HA ARG 28 HA ARG 28 -5.526 -24.913 -6.846 213 HB2 ARG 28 HB2 ARG 28 -3.163 -23.487 -8.164 214 HB3 ARG 28 HB3 ARG 28 -3.746 -23.195 -6.510 215 HG2 ARG 28 HG2 ARG 28 -3.514 -25.633 -6.041 216 HG3 ARG 28 HG3 ARG 28 -2.720 -25.861 -7.591 217 HD2 ARG 28 HD2 ARG 28 -0.816 -24.573 -6.904 218 HD3 ARG 28 HD3 ARG 28 -1.686 -23.961 -5.477 219 HE ARG 28 HE ARG 28 -1.505 -26.878 -5.620 220 HH11 ARG 28 HH11 ARG 28 0.183 -24.019 -4.358 221 HH12 ARG 28 HH12 ARG 28 0.695 -24.847 -2.901 222 HH21 ARG 28 HH21 ARG 28 -0.912 -27.880 -3.772 223 HH22 ARG 28 HH22 ARG 28 0.131 -27.103 -2.590 224 H ALA 29 H ALA 29 -5.712 -23.219 -9.941 225 HA ALA 29 HA ALA 29 -7.071 -20.887 -8.920 226 HB1 ALA 29 HB1 ALA 29 -6.154 -20.991 -11.235 227 HB2 ALA 29 HB2 ALA 29 -7.358 -22.232 -11.651 228 HB3 ALA 29 HB3 ALA 29 -7.881 -20.602 -11.215 229 H MET 30 H MET 30 -8.150 -24.186 -9.978 230 HA MET 30 HA MET 30 -10.928 -23.634 -9.454 231 HB2 MET 30 HB2 MET 30 -9.476 -26.290 -9.635 232 HB3 MET 30 HB3 MET 30 -11.226 -26.066 -9.604 233 HG2 MET 30 HG2 MET 30 -9.342 -24.992 -11.742 234 HG3 MET 30 HG3 MET 30 -10.364 -26.410 -11.869 235 HE1 MET 30 HE1 MET 30 -9.951 -22.710 -12.337 236 HE2 MET 30 HE2 MET 30 -11.575 -22.070 -12.654 237 HE3 MET 30 HE3 MET 30 -11.053 -22.333 -10.996 238 H GLY 31 H GLY 31 -8.321 -24.952 -7.370 239 HA2 GLY 31 HA2 GLY 31 -9.937 -25.578 -5.131 240 HA3 GLY 31 HA3 GLY 31 -8.246 -25.056 -5.063 241 H TRP 32 H TRP 32 -8.226 -22.473 -5.889 242 HA TRP 32 HA TRP 32 -9.280 -20.903 -3.833 243 HB2 TRP 32 HB2 TRP 32 -8.178 -20.376 -6.580 244 HB3 TRP 32 HB3 TRP 32 -9.104 -19.099 -5.831 245 HD1 TRP 32 HD1 TRP 32 -5.757 -20.830 -5.522 246 HE1 TRP 32 HE1 TRP 32 -4.255 -19.460 -3.969 247 HE3 TRP 32 HE3 TRP 32 -9.257 -17.574 -3.691 248 HZ2 TRP 32 HZ2 TRP 32 -4.541 -17.230 -2.137 249 HZ3 TRP 32 HZ3 TRP 32 -8.620 -15.868 -2.009 250 HH2 TRP 32 HH2 TRP 32 -6.265 -15.672 -1.244 251 H TYR 33 H TYR 33 -10.581 -21.409 -7.163 252 HA TYR 33 HA TYR 33 -12.760 -19.665 -6.999 253 HB2 TYR 33 HB2 TYR 33 -11.948 -20.643 -9.087 254 HB3 TYR 33 HB3 TYR 33 -12.386 -22.260 -8.548 255 HD1 TYR 33 HD1 TYR 33 -14.806 -22.924 -8.302 256 HD2 TYR 33 HD2 TYR 33 -13.597 -19.168 -10.035 257 HE1 TYR 33 HE1 TYR 33 -17.087 -22.588 -9.120 258 HE2 TYR 33 HE2 TYR 33 -15.831 -18.908 -11.034 259 HH TYR 33 HH TYR 33 -17.916 -19.794 -11.295 260 H TYR 34 H TYR 34 -12.658 -23.189 -6.295 261 HA TYR 34 HA TYR 34 -15.364 -23.596 -5.798 262 HB2 TYR 34 HB2 TYR 34 -13.933 -25.452 -6.136 263 HB3 TYR 34 HB3 TYR 34 -12.796 -24.925 -4.903 264 HD1 TYR 34 HD2 TYR 34 -16.291 -26.211 -5.330 265 HD2 TYR 34 HD1 TYR 34 -12.918 -25.675 -2.707 266 HE1 TYR 34 HE2 TYR 34 -17.420 -27.607 -3.619 267 HE2 TYR 34 HE1 TYR 34 -14.030 -27.070 -0.975 268 HH TYR 34 HH TYR 34 -17.282 -28.533 -1.481 269 H TYR 35 H TYR 35 -12.753 -22.907 -3.320 270 HA TYR 35 HA TYR 35 -14.771 -22.875 -1.265 271 HB2 TYR 35 HB2 TYR 35 -13.136 -22.748 0.231 272 HB3 TYR 35 HB3 TYR 35 -12.124 -23.244 -1.107 273 HD1 TYR 35 HD1 TYR 35 -10.608 -21.592 -2.184 274 HD2 TYR 35 HD2 TYR 35 -13.080 -20.488 1.168 275 HE1 TYR 35 HE1 TYR 35 -9.264 -19.536 -1.885 276 HE2 TYR 35 HE2 TYR 35 -11.758 -18.429 1.483 277 HH TYR 35 HH TYR 35 -9.965 -17.160 0.744 278 H LEU 36 H LEU 36 -13.249 -20.314 -3.265 279 HA LEU 36 HA LEU 36 -14.196 -18.122 -1.755 280 HB2 LEU 36 HB2 LEU 36 -12.459 -17.882 -3.431 281 HB3 LEU 36 HB3 LEU 36 -13.562 -18.390 -4.716 282 HG LEU 36 HG LEU 36 -14.903 -16.362 -4.453 283 HD11 LEU 36 HD11 LEU 36 -12.938 -15.592 -2.247 284 HD12 LEU 36 HD12 LEU 36 -14.117 -14.494 -2.994 285 HD13 LEU 36 HD13 LEU 36 -14.687 -15.877 -2.059 286 HD21 LEU 36 HD21 LEU 36 -12.889 -16.397 -5.918 287 HD22 LEU 36 HD22 LEU 36 -13.274 -14.787 -5.310 288 HD23 LEU 36 HD23 LEU 36 -11.929 -15.705 -4.595 289 H ASP 37 H ASP 37 -15.665 -19.683 -4.705 290 HA ASP 37 HA ASP 37 -17.990 -18.055 -4.724 291 HB2 ASP 37 HB2 ASP 37 -17.301 -19.474 -6.625 292 HB3 ASP 37 HB3 ASP 37 -17.639 -20.923 -5.675 293 H ASP 38 H ASP 38 -17.325 -21.167 -3.065 294 HA ASP 38 HA ASP 38 -19.910 -21.492 -1.910 295 HB2 ASP 38 HB2 ASP 38 -18.241 -23.281 -2.026 296 HB3 ASP 38 HB3 ASP 38 -17.186 -22.402 -0.916 297 H THR 39 H THR 39 -17.319 -19.276 -1.031 298 HA THR 39 HA THR 39 -18.401 -18.853 1.691 299 HB THR 39 HB THR 39 -15.939 -17.727 0.293 300 HG1 THR 39 HG1 THR 39 -15.685 -19.853 0.632 301 HG21 THR 39 HG21 THR 39 -16.936 -17.485 3.160 302 HG22 THR 39 HG22 THR 39 -15.239 -17.217 2.696 303 HG23 THR 39 HG23 THR 39 -16.516 -16.186 2.036 304 H LEU 40 H LEU 40 -18.201 -17.210 -1.477 305 HA LEU 40 HA LEU 40 -18.915 -14.596 -0.645 306 HB2 LEU 40 HB2 LEU 40 -19.548 -16.082 -3.214 307 HB3 LEU 40 HB3 LEU 40 -19.894 -14.373 -2.964 308 HG LEU 40 HG LEU 40 -17.128 -15.611 -2.943 309 HD11 LEU 40 HD11 LEU 40 -16.826 -14.575 -5.122 310 HD12 LEU 40 HD12 LEU 40 -18.253 -15.623 -5.166 311 HD13 LEU 40 HD13 LEU 40 -18.454 -13.866 -5.050 312 HD21 LEU 40 HD21 LEU 40 -17.962 -12.740 -2.677 313 HD22 LEU 40 HD22 LEU 40 -16.939 -13.730 -1.579 314 HD23 LEU 40 HD23 LEU 40 -16.332 -13.253 -3.161 315 H GLU 41 H GLU 41 -20.761 -13.979 0.445 316 HA GLU 41 HA GLU 41 -23.205 -15.572 0.393 317 HB2 GLU 41 HB2 GLU 41 -22.419 -12.943 1.712 318 HB3 GLU 41 HB3 GLU 41 -24.026 -13.657 1.878 319 HG2 GLU 41 HG2 GLU 41 -21.522 -15.225 2.554 320 HG3 GLU 41 HG3 GLU 41 -22.310 -14.164 3.722 321 H PHE 42 H PHE 42 -22.727 -15.128 -2.094 322 HA PHE 42 HA PHE 42 -23.575 -12.649 -3.209 323 HB2 PHE 42 HB2 PHE 42 -23.402 -13.728 -5.349 324 HB3 PHE 42 HB3 PHE 42 -22.066 -14.226 -4.350 325 HD1 PHE 42 HD1 PHE 42 -25.362 -15.320 -5.756 326 HD2 PHE 42 HD2 PHE 42 -21.655 -16.577 -3.933 327 HE1 PHE 42 HE1 PHE 42 -25.907 -17.683 -6.259 328 HE2 PHE 42 HE2 PHE 42 -22.206 -18.928 -4.440 329 HZ PHE 42 HZ PHE 42 -24.335 -19.497 -5.599 330 HA PRO 43 HA PRO 43 -24.670 -11.954 -5.272 331 HB2 PRO 43 HB2 PRO 43 -26.657 -10.168 -5.759 332 HB3 PRO 43 HB3 PRO 43 -26.562 -11.754 -6.584 333 HG2 PRO 43 HG2 PRO 43 -28.235 -11.019 -4.163 334 HG3 PRO 43 HG3 PRO 43 -28.753 -11.880 -5.648 335 HD2 PRO 43 HD2 PRO 43 -28.053 -13.202 -3.352 336 HD3 PRO 43 HD3 PRO 43 -27.699 -13.876 -4.969 337 H PHE 44 H PHE 44 -23.907 -9.801 -4.920 338 HA PHE 44 HA PHE 44 -24.603 -8.379 -2.435 339 HB2 PHE 44 HB2 PHE 44 -22.400 -8.328 -1.566 340 HB3 PHE 44 HB3 PHE 44 -22.895 -9.997 -1.712 341 HD1 PHE 44 HD1 PHE 44 -21.956 -11.384 -3.715 342 HD2 PHE 44 HD2 PHE 44 -20.317 -7.610 -2.437 343 HE1 PHE 44 HE1 PHE 44 -19.798 -11.964 -4.772 344 HE2 PHE 44 HE2 PHE 44 -18.178 -8.169 -3.546 345 HZ PHE 44 HZ PHE 44 -17.898 -10.360 -4.691 346 H MET 45 H MET 45 -22.558 -6.429 -2.561 347 HA MET 45 HA MET 45 -22.582 -5.545 -5.385 348 HB2 MET 45 HB2 MET 45 -23.415 -3.433 -4.967 349 HB3 MET 45 HB3 MET 45 -24.529 -4.511 -4.151 350 HG2 MET 45 HG2 MET 45 -23.921 -3.786 -2.039 351 HG3 MET 45 HG3 MET 45 -22.287 -3.350 -2.505 352 HE1 MET 45 HE1 MET 45 -22.608 -1.358 -5.061 353 HE2 MET 45 HE2 MET 45 -22.535 0.137 -4.110 354 HE3 MET 45 HE3 MET 45 -21.499 -1.235 -3.688 355 H GLY 46 H GLY 46 -21.171 -3.733 -5.814 356 HA2 GLY 46 HA2 GLY 46 -18.994 -3.178 -3.920 357 HA3 GLY 46 HA3 GLY 46 -18.544 -4.233 -5.274 358 H LYS 47 H LYS 47 -17.157 -2.158 -5.224 359 HA LYS 47 HA LYS 47 -18.231 -0.435 -7.420 360 HB2 LYS 47 HB2 LYS 47 -17.544 0.690 -5.167 361 HB3 LYS 47 HB3 LYS 47 -15.898 0.242 -5.583 362 HG2 LYS 47 HG2 LYS 47 -16.066 2.432 -6.399 363 HG3 LYS 47 HG3 LYS 47 -16.364 1.467 -7.846 364 HD2 LYS 47 HD2 LYS 47 -18.035 3.140 -7.898 365 HD3 LYS 47 HD3 LYS 47 -18.869 1.701 -7.314 366 HE2 LYS 47 HE2 LYS 47 -18.826 2.495 -5.029 367 HE3 LYS 47 HE3 LYS 47 -17.749 3.833 -5.453 368 HZ1 LYS 47 HZ1 LYS 47 -20.120 4.472 -5.242 369 HZ2 LYS 47 HZ2 LYS 47 -19.502 4.843 -6.702 370 HZ3 LYS 47 HZ3 LYS 47 -20.494 3.559 -6.555 371 H TRP 48 H TRP 48 -17.355 -0.953 -9.328 372 HA TRP 48 HA TRP 48 -14.924 -2.614 -9.530 373 HB2 TRP 48 HB2 TRP 48 -16.907 -2.868 -11.053 374 HB3 TRP 48 HB3 TRP 48 -16.593 -1.265 -11.683 375 HD1 TRP 48 HD1 TRP 48 -13.233 -2.421 -11.531 376 HE1 TRP 48 HE1 TRP 48 -12.428 -3.612 -13.593 377 HE3 TRP 48 HE3 TRP 48 -17.777 -3.277 -13.747 378 HZ2 TRP 48 HZ2 TRP 48 -13.599 -4.915 -15.912 379 HZ3 TRP 48 HZ3 TRP 48 -17.885 -4.510 -15.898 380 HH2 TRP 48 HH2 TRP 48 -15.797 -5.348 -16.969 381 H LYS 49 H LYS 49 -13.125 -1.559 -8.975 382 HA LYS 49 HA LYS 49 -12.800 1.330 -9.237 383 HB2 LYS 49 HB2 LYS 49 -10.804 -0.798 -8.325 384 HB3 LYS 49 HB3 LYS 49 -10.749 0.921 -7.956 385 HG2 LYS 49 HG2 LYS 49 -12.836 -1.065 -6.932 386 HG3 LYS 49 HG3 LYS 49 -11.408 -0.580 -6.058 387 HD2 LYS 49 HD2 LYS 49 -13.535 1.435 -6.909 388 HD3 LYS 49 HD3 LYS 49 -13.584 0.516 -5.402 389 HE2 LYS 49 HE2 LYS 49 -11.160 1.371 -5.011 390 HE3 LYS 49 HE3 LYS 49 -11.541 2.592 -6.238 391 HZ1 LYS 49 HZ1 LYS 49 -13.105 2.108 -3.758 392 HZ2 LYS 49 HZ2 LYS 49 -11.999 3.306 -3.941 393 HZ3 LYS 49 HZ3 LYS 49 -13.355 3.345 -4.852 394 H LYS 50 H LYS 50 -13.160 0.618 -11.737 395 HA LYS 50 HA LYS 50 -11.259 -0.974 -13.110 396 HB2 LYS 50 HB2 LYS 50 -13.519 -0.494 -13.922 397 HB3 LYS 50 HB3 LYS 50 -13.123 1.216 -14.135 398 HG2 LYS 50 HG2 LYS 50 -11.494 0.705 -15.862 399 HG3 LYS 50 HG3 LYS 50 -11.652 -1.034 -15.578 400 HD2 LYS 50 HD2 LYS 50 -13.884 0.787 -16.596 401 HD3 LYS 50 HD3 LYS 50 -12.838 -0.207 -17.622 402 HE2 LYS 50 HE2 LYS 50 -13.624 -2.253 -16.419 403 HE3 LYS 50 HE3 LYS 50 -14.732 -1.259 -15.469 404 HZ1 LYS 50 HZ1 LYS 50 -15.857 -2.259 -17.336 405 HZ2 LYS 50 HZ2 LYS 50 -15.837 -0.640 -17.554 406 HZ3 LYS 50 HZ3 LYS 50 -14.826 -1.597 -18.412 407 H LYS 51 H LYS 51 -9.142 -0.578 -13.502 408 HA LYS 51 HA LYS 51 -8.166 2.213 -13.473 409 HB2 LYS 51 HB2 LYS 51 -7.072 0.218 -12.260 410 HB3 LYS 51 HB3 LYS 51 -6.484 -0.289 -13.850 411 HG2 LYS 51 HG2 LYS 51 -5.275 1.845 -14.102 412 HG3 LYS 51 HG3 LYS 51 -5.997 2.461 -12.602 413 HD2 LYS 51 HD2 LYS 51 -4.822 0.687 -11.322 414 HD3 LYS 51 HD3 LYS 51 -4.098 0.086 -12.833 415 HE2 LYS 51 HE2 LYS 51 -3.037 2.308 -13.198 416 HE3 LYS 51 HE3 LYS 51 -3.757 2.904 -11.701 417 HZ1 LYS 51 HZ1 LYS 51 -2.449 1.251 -10.490 418 HZ2 LYS 51 HZ2 LYS 51 -1.782 0.699 -11.878 419 HZ3 LYS 51 HZ3 LYS 51 -1.470 2.213 -11.366 420 H SER 52 H SER 52 -9.214 -0.050 -15.821 421 HA SER 52 HA SER 52 -7.446 0.245 -17.883 422 HB2 SER 52 HB2 SER 52 -10.414 -0.270 -18.212 423 HB3 SER 52 HB3 SER 52 -9.064 -0.990 -19.106 424 HG SER 52 HG SER 52 -9.853 -2.448 -17.570 425 H ARG 53 H ARG 53 -8.664 3.010 -16.901 426 HA ARG 53 HA ARG 53 -9.970 4.184 -19.200 427 HB2 ARG 53 HB2 ARG 53 -9.971 5.007 -16.776 428 HB3 ARG 53 HB3 ARG 53 -8.297 5.526 -17.025 429 HG2 ARG 53 HG2 ARG 53 -9.030 7.081 -18.789 430 HG3 ARG 53 HG3 ARG 53 -10.711 6.538 -18.605 431 HD2 ARG 53 HD2 ARG 53 -10.830 7.448 -16.365 432 HD3 ARG 53 HD3 ARG 53 -9.086 7.617 -16.289 433 HE ARG 53 HE ARG 53 -9.087 9.486 -17.585 434 HH11 ARG 53 HH12 ARG 53 -12.462 8.273 -17.343 435 HH12 ARG 53 HH11 ARG 53 -13.148 9.759 -17.902 436 HH21 ARG 53 HH22 ARG 53 -10.053 11.442 -18.304 437 HH22 ARG 53 HH21 ARG 53 -11.761 11.582 -18.469 438 H LYS 54 H LYS 54 -8.934 5.630 -20.768 439 HA LYS 54 HA LYS 54 -6.499 4.814 -21.879 440 HB2 LYS 54 HB2 LYS 54 -8.265 6.163 -23.000 441 HB3 LYS 54 HB3 LYS 54 -7.802 7.571 -22.032 442 HG2 LYS 54 HG2 LYS 54 -5.558 7.566 -23.075 443 HG3 LYS 54 HG3 LYS 54 -5.973 6.095 -23.979 444 HD2 LYS 54 HD2 LYS 54 -7.777 7.340 -25.164 445 HD3 LYS 54 HD3 LYS 54 -7.410 8.778 -24.207 446 HE2 LYS 54 HE2 LYS 54 -6.397 9.072 -26.353 447 HE3 LYS 54 HE3 LYS 54 -5.110 8.836 -25.170 448 HZ1 LYS 54 HZ1 LYS 54 -4.916 6.539 -25.946 449 HZ2 LYS 54 HZ2 LYS 54 -6.134 6.753 -27.019 450 HZ3 LYS 54 HZ3 LYS 54 -4.737 7.567 -27.194 451 H THR 55 H THR 55 -7.055 7.326 -19.359 452 HA THR 55 HA THR 55 -4.290 8.180 -19.339 453 HB THR 55 HB THR 55 -5.200 9.563 -17.408 454 HG1 THR 55 HG1 THR 55 -6.930 8.813 -16.573 455 HG21 THR 55 HG21 THR 55 -6.937 9.657 -19.918 456 HG22 THR 55 HG22 THR 55 -6.642 10.970 -18.762 457 HG23 THR 55 HG23 THR 55 -5.315 10.379 -19.780 458 H SER 56 H SER 56 -5.570 5.313 -18.260 459 HA SER 56 HA SER 56 -5.250 3.826 -16.680 460 HB2 SER 56 HB2 SER 56 -2.584 5.155 -16.115 461 HB3 SER 56 HB3 SER 56 -3.048 3.480 -15.788 462 HG SER 56 HG SER 56 -1.831 3.706 -17.727 463 H THR 57 H THR 57 -6.279 6.712 -15.840 464 HA THR 57 HA THR 57 -5.892 6.730 -12.975 465 HB THR 57 HB THR 57 -8.273 7.927 -14.386 466 HG1 THR 57 HG1 THR 57 -5.641 8.974 -14.519 467 HG21 THR 57 HG21 THR 57 -7.841 9.836 -12.882 468 HG22 THR 57 HG22 THR 57 -8.095 8.333 -11.986 469 HG23 THR 57 HG23 THR 57 -6.448 8.974 -12.187 470 H ILE 58 H ILE 58 -7.340 5.983 -11.395 471 HA ILE 58 HA ILE 58 -8.996 3.695 -11.967 472 HB ILE 58 HB ILE 58 -8.709 5.559 -9.594 473 HG12 ILE 58 HG12 ILE 58 -6.692 4.182 -10.126 474 HG13 ILE 58 HG13 ILE 58 -7.372 3.890 -8.537 475 HG21 ILE 58 HG21 ILE 58 -10.909 4.612 -9.354 476 HG22 ILE 58 HG22 ILE 58 -10.329 2.986 -9.758 477 HG23 ILE 58 HG23 ILE 58 -9.843 3.764 -8.233 478 HD11 ILE 58 HD11 ILE 58 -7.870 2.078 -10.934 479 HD12 ILE 58 HD12 ILE 58 -6.611 1.825 -9.711 480 HD13 ILE 58 HD13 ILE 58 -8.315 1.765 -9.241 481 H GLU 59 H GLU 59 -11.157 3.587 -12.261 482 HA GLU 59 HA GLU 59 -12.869 6.005 -12.103 483 HB2 GLU 59 HB2 GLU 59 -13.041 3.738 -14.152 484 HB3 GLU 59 HB3 GLU 59 -14.207 5.053 -13.949 485 HG2 GLU 59 HG2 GLU 59 -12.353 6.687 -14.474 486 HG3 GLU 59 HG3 GLU 59 -11.321 5.314 -14.882 487 H GLU 60 H GLU 60 -15.038 5.386 -11.353 488 HA GLU 60 HA GLU 60 -15.012 2.847 -9.772 489 HB2 GLU 60 HB2 GLU 60 -15.711 5.685 -8.913 490 HB3 GLU 60 HB3 GLU 60 -16.049 4.237 -7.968 491 HG2 GLU 60 HG2 GLU 60 -13.582 3.691 -8.022 492 HG3 GLU 60 HG3 GLU 60 -13.303 5.262 -8.781 493 H LYS 61 H LYS 61 -16.521 1.634 -10.765 494 HA LYS 61 HA LYS 61 -19.143 2.895 -11.509 495 HB2 LYS 61 HB2 LYS 61 -17.908 1.916 -13.382 496 HB3 LYS 61 HB3 LYS 61 -17.741 0.384 -12.508 497 HG2 LYS 61 HG2 LYS 61 -20.129 -0.005 -12.564 498 HG3 LYS 61 HG3 LYS 61 -20.425 1.570 -13.296 499 HD2 LYS 61 HD2 LYS 61 -18.627 -0.518 -14.611 500 HD3 LYS 61 HD3 LYS 61 -20.364 -0.590 -14.805 501 HE2 LYS 61 HE2 LYS 61 -18.611 1.779 -15.594 502 HE3 LYS 61 HE3 LYS 61 -19.241 0.550 -16.695 503 HZ1 LYS 61 HZ1 LYS 61 -20.623 2.522 -16.728 504 HZ2 LYS 61 HZ2 LYS 61 -21.501 1.271 -16.123 505 HZ3 LYS 61 HZ3 LYS 61 -20.918 2.409 -15.119 506 H THR 62 H THR 62 -20.761 2.471 -10.036 507 HA THR 62 HA THR 62 -20.475 0.460 -8.012 508 HB THR 62 HB THR 62 -23.056 1.814 -8.880 509 HG1 THR 62 HG1 THR 62 -22.390 3.640 -8.010 510 HG21 THR 62 HG21 THR 62 -21.920 1.084 -6.139 511 HG22 THR 62 HG22 THR 62 -23.527 1.779 -6.462 512 HG23 THR 62 HG23 THR 62 -23.143 0.140 -7.013 513 H VAL 63 H VAL 63 -21.048 -1.641 -8.045 514 HA VAL 63 HA VAL 63 -22.736 -2.648 -10.292 515 HB VAL 63 HB VAL 63 -21.120 -4.542 -10.517 516 HG11 VAL 63 HG11 VAL 63 -21.157 -2.625 -12.123 517 HG12 VAL 63 HG12 VAL 63 -19.839 -1.867 -11.203 518 HG13 VAL 63 HG13 VAL 63 -19.584 -3.427 -11.998 519 HG21 VAL 63 HG21 VAL 63 -18.800 -4.323 -9.798 520 HG22 VAL 63 HG22 VAL 63 -19.150 -2.786 -8.988 521 HG23 VAL 63 HG23 VAL 63 -19.859 -4.299 -8.383 522 H GLU 64 H GLU 64 -23.853 -4.552 -9.930 523 HA GLU 64 HA GLU 64 -24.037 -5.478 -7.088 524 HB2 GLU 64 HB2 GLU 64 -26.189 -4.844 -8.139 525 HB3 GLU 64 HB3 GLU 64 -25.875 -5.948 -9.482 526 HG2 GLU 64 HG2 GLU 64 -25.886 -7.865 -7.895 527 HG3 GLU 64 HG3 GLU 64 -26.149 -6.747 -6.553 528 H VAL 65 H VAL 65 -23.004 -7.410 -6.727 529 HA VAL 65 HA VAL 65 -21.677 -8.723 -9.035 530 HB VAL 65 HB VAL 65 -21.033 -9.034 -6.080 531 HG11 VAL 65 HG11 VAL 65 -19.476 -9.565 -8.656 532 HG12 VAL 65 HG12 VAL 65 -18.833 -9.787 -7.018 533 HG13 VAL 65 HG13 VAL 65 -20.168 -10.801 -7.581 534 HG21 VAL 65 HG21 VAL 65 -19.139 -7.469 -6.443 535 HG22 VAL 65 HG22 VAL 65 -19.781 -7.063 -8.047 536 HG23 VAL 65 HG23 VAL 65 -20.693 -6.655 -6.580 537 H LEU 66 H LEU 66 -22.724 -10.431 -9.793 538 HA LEU 66 HA LEU 66 -25.057 -11.465 -8.415 539 HB2 LEU 66 HB2 LEU 66 -23.673 -12.106 -11.048 540 HB3 LEU 66 HB3 LEU 66 -25.000 -13.082 -10.439 541 HG LEU 66 HG LEU 66 -26.495 -11.112 -10.404 542 HD11 LEU 66 HD11 LEU 66 -24.954 -9.232 -10.238 543 HD12 LEU 66 HD12 LEU 66 -24.170 -9.685 -11.772 544 HD13 LEU 66 HD13 LEU 66 -25.849 -9.102 -11.744 545 HD21 LEU 66 HD21 LEU 66 -26.761 -11.012 -12.874 546 HD22 LEU 66 HD22 LEU 66 -25.150 -11.744 -13.065 547 HD23 LEU 66 HD23 LEU 66 -26.465 -12.661 -12.306 548 H GLY 67 H GLY 67 -21.713 -12.576 -8.879 549 HA2 GLY 67 HA2 GLY 67 -21.370 -14.416 -6.935 550 HA3 GLY 67 HA3 GLY 67 -22.231 -15.330 -8.198 551 H MET 68 H MET 68 -19.876 -16.321 -7.983 552 HA MET 68 HA MET 68 -17.792 -15.020 -9.533 553 HB2 MET 68 HB2 MET 68 -18.191 -17.951 -8.830 554 HB3 MET 68 HB3 MET 68 -16.834 -17.282 -9.730 555 HG2 MET 68 HG2 MET 68 -16.717 -15.605 -7.635 556 HG3 MET 68 HG3 MET 68 -17.521 -16.953 -6.836 557 HE1 MET 68 HE1 MET 68 -13.270 -16.934 -8.651 558 HE2 MET 68 HE2 MET 68 -14.699 -16.824 -9.682 559 HE3 MET 68 HE3 MET 68 -14.349 -15.526 -8.521 560 H ALA 69 H ALA 69 -17.136 -15.519 -11.625 561 HA ALA 69 HA ALA 69 -19.229 -15.899 -13.606 562 HB1 ALA 69 HB1 ALA 69 -16.198 -15.912 -13.896 563 HB2 ALA 69 HB2 ALA 69 -17.374 -15.561 -15.169 564 HB3 ALA 69 HB3 ALA 69 -17.175 -14.424 -13.838 565 HA PRO 70 HA PRO 70 -18.874 -20.322 -14.364 566 HB2 PRO 70 HB2 PRO 70 -17.588 -19.660 -17.027 567 HB3 PRO 70 HB3 PRO 70 -18.848 -20.883 -16.660 568 HG2 PRO 70 HG2 PRO 70 -19.563 -18.510 -17.740 569 HG3 PRO 70 HG3 PRO 70 -20.514 -19.177 -16.372 570 HD2 PRO 70 HD2 PRO 70 -18.360 -17.064 -16.316 571 HD3 PRO 70 HD3 PRO 70 -19.944 -17.067 -15.479 572 H ASP 71 H ASP 71 -17.376 -21.824 -13.774 573 HA ASP 71 HA ASP 71 -14.835 -21.086 -12.874 574 HB2 ASP 71 HB2 ASP 71 -14.485 -23.337 -12.334 575 HB3 ASP 71 HB3 ASP 71 -16.214 -23.089 -12.154 576 H ASP 72 H ASP 72 -15.835 -22.266 -16.052 577 HA ASP 72 HA ASP 72 -13.347 -23.051 -17.113 578 HB2 ASP 72 HB2 ASP 72 -15.501 -23.521 -18.178 579 HB3 ASP 72 HB3 ASP 72 -15.766 -21.798 -18.465 580 H GLU 73 H GLU 73 -14.623 -19.775 -16.574 581 HA GLU 73 HA GLU 73 -12.487 -18.559 -18.236 582 HB2 GLU 73 HB2 GLU 73 -14.696 -17.331 -16.522 583 HB3 GLU 73 HB3 GLU 73 -13.483 -16.420 -17.433 584 HG2 GLU 73 HG2 GLU 73 -14.260 -17.597 -19.534 585 HG3 GLU 73 HG3 GLU 73 -15.574 -18.311 -18.596 586 H CYS 74 H CYS 74 -13.125 -19.518 -14.943 587 HA CYS 74 HA CYS 74 -11.280 -17.577 -13.793 588 HB2 CYS 74 HB2 CYS 74 -12.968 -19.734 -12.468 589 HB3 CYS 74 HB3 CYS 74 -12.076 -18.435 -11.651 590 HG CYS 74 HG CYS 74 -14.618 -18.251 -13.774 591 H LEU 75 H LEU 75 -10.259 -19.811 -15.509 592 HA LEU 75 HA LEU 75 -8.719 -21.592 -13.800 593 HB2 LEU 75 HB2 LEU 75 -9.021 -21.061 -16.747 594 HB3 LEU 75 HB3 LEU 75 -7.446 -21.614 -16.255 595 HG LEU 75 HG LEU 75 -8.755 -23.466 -16.989 596 HD11 LEU 75 HD11 LEU 75 -8.469 -23.735 -13.966 597 HD12 LEU 75 HD12 LEU 75 -8.377 -25.003 -15.196 598 HD13 LEU 75 HD13 LEU 75 -7.117 -23.760 -15.115 599 HD21 LEU 75 HD21 LEU 75 -10.721 -22.887 -14.751 600 HD22 LEU 75 HD22 LEU 75 -11.010 -22.656 -16.480 601 HD23 LEU 75 HD23 LEU 75 -10.747 -24.285 -15.840 602 H LYS 76 H LYS 76 -8.460 -18.310 -14.442 603 HA LYS 76 HA LYS 76 -5.528 -18.260 -13.940 604 HB2 LYS 76 HB2 LYS 76 -5.336 -16.530 -15.695 605 HB3 LYS 76 HB3 LYS 76 -5.883 -18.083 -16.325 606 HG2 LYS 76 HG2 LYS 76 -8.269 -17.184 -16.256 607 HG3 LYS 76 HG3 LYS 76 -7.593 -15.601 -15.836 608 HD2 LYS 76 HD2 LYS 76 -6.335 -15.559 -17.942 609 HD3 LYS 76 HD3 LYS 76 -6.906 -17.178 -18.363 610 HE2 LYS 76 HE2 LYS 76 -8.697 -14.739 -17.942 611 HE3 LYS 76 HE3 LYS 76 -8.129 -15.306 -19.510 612 HZ1 LYS 76 HZ1 LYS 76 -9.319 -17.386 -19.136 613 HZ2 LYS 76 HZ2 LYS 76 -9.906 -16.860 -17.692 614 HZ3 LYS 76 HZ3 LYS 76 -10.332 -16.115 -19.083 615 H ASP 77 H ASP 77 -8.702 -16.661 -13.493 616 HA ASP 77 HA ASP 77 -7.540 -14.977 -11.372 617 HB2 ASP 77 HB2 ASP 77 -7.206 -13.603 -13.400 618 HB3 ASP 77 HB3 ASP 77 -8.886 -13.840 -13.863 619 H MET 78 H MET 78 -9.245 -14.277 -9.933 620 HA MET 78 HA MET 78 -11.629 -15.959 -10.020 621 HB2 MET 78 HB2 MET 78 -10.731 -13.785 -8.086 622 HB3 MET 78 HB3 MET 78 -12.133 -14.824 -7.858 623 HG2 MET 78 HG2 MET 78 -9.230 -15.737 -7.996 624 HG3 MET 78 HG3 MET 78 -10.209 -15.564 -6.554 625 HE1 MET 78 HE1 MET 78 -9.969 -19.216 -9.278 626 HE2 MET 78 HE2 MET 78 -10.088 -17.626 -10.048 627 HE3 MET 78 HE3 MET 78 -8.735 -17.982 -8.948 628 H TYR 79 H TYR 79 -12.627 -15.198 -12.020 629 HA TYR 79 HA TYR 79 -13.479 -12.419 -12.221 630 HB2 TYR 79 HB2 TYR 79 -14.181 -14.916 -13.798 631 HB3 TYR 79 HB3 TYR 79 -14.836 -13.331 -14.146 632 HD1 TYR 79 HD2 TYR 79 -13.338 -11.463 -14.905 633 HD2 TYR 79 HD1 TYR 79 -11.971 -15.534 -14.529 634 HE1 TYR 79 HE2 TYR 79 -11.436 -10.952 -16.400 635 HE2 TYR 79 HE1 TYR 79 -10.046 -15.029 -15.986 636 HH TYR 79 HH TYR 79 -9.503 -11.777 -17.425 637 H VAL 80 H VAL 80 -15.618 -11.642 -12.099 638 HA VAL 80 HA VAL 80 -17.689 -13.391 -10.864 639 HB VAL 80 HB VAL 80 -18.323 -11.366 -9.515 640 HG11 VAL 80 HG11 VAL 80 -16.664 -11.751 -7.728 641 HG12 VAL 80 HG12 VAL 80 -17.250 -13.252 -8.431 642 HG13 VAL 80 HG13 VAL 80 -15.637 -12.647 -8.870 643 HG21 VAL 80 HG21 VAL 80 -16.968 -9.647 -10.739 644 HG22 VAL 80 HG22 VAL 80 -16.679 -9.652 -8.995 645 HG23 VAL 80 HG23 VAL 80 -15.490 -10.383 -10.088 646 H GLU 81 H GLU 81 -19.838 -12.851 -11.404 647 HA GLU 81 HA GLU 81 -20.123 -11.295 -13.932 648 HB2 GLU 81 HB2 GLU 81 -21.955 -13.159 -12.375 649 HB3 GLU 81 HB3 GLU 81 -22.564 -12.064 -13.629 650 HG2 GLU 81 HG2 GLU 81 -21.008 -13.049 -15.278 651 HG3 GLU 81 HG3 GLU 81 -20.409 -14.165 -14.056 652 H VAL 82 H VAL 82 -21.239 -9.371 -13.997 653 HA VAL 82 HA VAL 82 -22.110 -8.198 -11.435 654 HB VAL 82 HB VAL 82 -20.786 -6.141 -12.035 655 HG11 VAL 82 HG11 VAL 82 -20.091 -7.700 -10.252 656 HG12 VAL 82 HG12 VAL 82 -19.091 -8.591 -11.418 657 HG13 VAL 82 HG13 VAL 82 -18.723 -6.899 -11.031 658 HG21 VAL 82 HG21 VAL 82 -20.251 -6.681 -14.413 659 HG22 VAL 82 HG22 VAL 82 -18.834 -6.275 -13.449 660 HG23 VAL 82 HG23 VAL 82 -19.166 -7.973 -13.853 661 H ALA 83 H ALA 83 -23.637 -6.621 -11.618 662 HA ALA 83 HA ALA 83 -24.635 -5.983 -14.372 663 HB1 ALA 83 HB1 ALA 83 -26.176 -6.042 -11.749 664 HB2 ALA 83 HB2 ALA 83 -26.819 -5.570 -13.340 665 HB3 ALA 83 HB3 ALA 83 -26.291 -7.238 -13.059 666 H ASP 84 H ASP 84 -24.745 -3.848 -14.896 667 HA ASP 84 HA ASP 84 -23.097 -2.048 -13.298 668 HB2 ASP 84 HB2 ASP 84 -22.791 -2.256 -15.712 669 HB3 ASP 84 HB3 ASP 84 -24.452 -1.706 -15.985 670 H ILE 85 H ILE 85 -24.873 -2.233 -11.559 671 HA ILE 85 HA ILE 85 -27.268 -0.727 -11.813 672 HB ILE 85 HB ILE 85 -27.333 -0.672 -9.390 673 HG12 ILE 85 HG12 ILE 85 -24.553 -1.868 -9.386 674 HG13 ILE 85 HG13 ILE 85 -24.927 -0.206 -8.940 675 HG21 ILE 85 HG21 ILE 85 -26.334 -3.394 -10.332 676 HG22 ILE 85 HG22 ILE 85 -27.520 -3.046 -9.055 677 HG23 ILE 85 HG23 ILE 85 -27.928 -2.723 -10.736 678 HD11 ILE 85 HD11 ILE 85 -26.326 -1.005 -7.063 679 HD12 ILE 85 HD12 ILE 85 -25.912 -2.686 -7.469 680 HD13 ILE 85 HD13 ILE 85 -24.650 -1.579 -6.940 681 H GLY 86 H GLY 86 -24.009 0.424 -11.696 682 HA2 GLY 86 HA2 GLY 86 -24.671 3.143 -10.839 683 HA3 GLY 86 HA3 GLY 86 -23.115 2.513 -11.401 684 H GLY 87 H GLY 87 -25.132 1.419 -13.769 685 HA2 GLY 87 HA2 GLY 87 -25.328 3.922 -15.348 686 HA3 GLY 87 HA3 GLY 87 -24.183 2.678 -15.864 687 H LYS 88 H LYS 88 -24.950 0.769 -16.819 688 HA LYS 88 HA LYS 88 -27.311 1.123 -18.334 689 HB2 LYS 88 HB2 LYS 88 -25.859 -1.507 -17.805 690 HB3 LYS 88 HB3 LYS 88 -26.975 -1.189 -19.122 691 HG2 LYS 88 HG2 LYS 88 -24.254 0.128 -18.736 692 HG3 LYS 88 HG3 LYS 88 -24.659 -1.142 -19.881 693 HD2 LYS 88 HD2 LYS 88 -26.273 0.405 -21.009 694 HD3 LYS 88 HD3 LYS 88 -25.763 1.701 -19.901 695 HE2 LYS 88 HE2 LYS 88 -23.425 1.465 -20.696 696 HE3 LYS 88 HE3 LYS 88 -23.925 0.178 -21.801 697 HZ1 LYS 88 HZ1 LYS 88 -25.320 1.797 -22.951 698 HZ2 LYS 88 HZ2 LYS 88 -24.858 2.989 -21.930 699 HZ3 LYS 88 HZ3 LYS 88 -23.773 2.302 -22.930 700 H ASP 89 H ASP 89 -26.873 -0.596 -15.325 701 HA ASP 89 HA ASP 89 -28.100 -1.589 -13.826 702 HB2 ASP 89 HB2 ASP 89 -29.084 0.616 -13.692 703 HB3 ASP 89 HB3 ASP 89 -30.274 0.206 -14.928 704 H ASP 90 H ASP 90 -29.531 -1.952 -17.001 705 HA ASP 90 HA ASP 90 -31.189 -4.235 -16.111 706 HB2 ASP 90 HB2 ASP 90 -32.158 -2.229 -17.256 707 HB3 ASP 90 HB3 ASP 90 -31.161 -2.599 -18.666 708 H ASP 91 H ASP 91 -28.115 -4.055 -17.042 709 HA ASP 91 HA ASP 91 -28.224 -6.582 -18.577 710 HB2 ASP 91 HB2 ASP 91 -27.965 -4.575 -20.158 711 HB3 ASP 91 HB3 ASP 91 -26.366 -4.356 -19.430 712 H VAL 92 H VAL 92 -26.050 -7.585 -18.722 713 HA VAL 92 HA VAL 92 -24.578 -7.295 -16.152 714 HB VAL 92 HB VAL 92 -25.592 -9.885 -17.387 715 HG11 VAL 92 HG11 VAL 92 -25.035 -10.944 -15.277 716 HG12 VAL 92 HG12 VAL 92 -23.594 -10.167 -15.914 717 HG13 VAL 92 HG13 VAL 92 -24.496 -9.400 -14.586 718 HG21 VAL 92 HG21 VAL 92 -27.575 -8.714 -16.615 719 HG22 VAL 92 HG22 VAL 92 -27.202 -9.990 -15.463 720 HG23 VAL 92 HG23 VAL 92 -26.789 -8.306 -15.075 721 H TYR 93 H TYR 93 -22.468 -7.974 -16.193 722 HA TYR 93 HA TYR 93 -21.113 -8.729 -18.718 723 HB2 TYR 93 HB2 TYR 93 -20.378 -6.395 -16.886 724 HB3 TYR 93 HB3 TYR 93 -19.453 -6.934 -18.276 725 HD1 TYR 93 HD2 TYR 93 -20.204 -6.498 -20.580 726 HD2 TYR 93 HD1 TYR 93 -22.452 -5.085 -17.175 727 HE1 TYR 93 HE2 TYR 93 -21.481 -4.976 -22.058 728 HE2 TYR 93 HE1 TYR 93 -23.751 -3.582 -18.643 729 HH TYR 93 HH TYR 93 -24.100 -2.847 -20.844 730 H THR 94 H THR 94 -18.543 -8.760 -17.790 731 HA THR 94 HA THR 94 -18.548 -10.253 -15.218 732 HB THR 94 HB THR 94 -16.925 -10.920 -17.706 733 HG1 THR 94 HG1 THR 94 -19.084 -11.517 -17.921 734 HG21 THR 94 HG21 THR 94 -16.328 -12.994 -16.457 735 HG22 THR 94 HG22 THR 94 -15.697 -11.539 -15.679 736 HG23 THR 94 HG23 THR 94 -17.135 -12.341 -15.014 737 H ALA 95 H ALA 95 -16.742 -9.843 -13.929 738 HA ALA 95 HA ALA 95 -14.788 -7.801 -14.817 739 HB1 ALA 95 HB1 ALA 95 -16.469 -7.653 -12.272 740 HB2 ALA 95 HB2 ALA 95 -15.094 -6.593 -12.649 741 HB3 ALA 95 HB3 ALA 95 -16.549 -6.537 -13.654 742 H LYS 96 H LYS 96 -12.908 -7.753 -13.453 743 HA LYS 96 HA LYS 96 -12.123 -10.395 -12.398 744 HB2 LYS 96 HB2 LYS 96 -10.638 -7.726 -12.272 745 HB3 LYS 96 HB3 LYS 96 -10.013 -9.302 -11.864 746 HG2 LYS 96 HG2 LYS 96 -9.057 -8.694 -13.920 747 HG3 LYS 96 HG3 LYS 96 -10.169 -10.012 -14.227 748 HD2 LYS 96 HD2 LYS 96 -10.140 -8.250 -15.999 749 HD3 LYS 96 HD3 LYS 96 -11.723 -8.570 -15.340 750 HE2 LYS 96 HE2 LYS 96 -11.601 -6.221 -15.605 751 HE3 LYS 96 HE3 LYS 96 -11.476 -6.505 -13.871 752 HZ1 LYS 96 HZ1 LYS 96 -9.293 -5.763 -15.721 753 HZ2 LYS 96 HZ2 LYS 96 -9.899 -4.893 -14.464 754 HZ3 LYS 96 HZ3 LYS 96 -9.006 -6.241 -14.183 755 H LEU 97 H LEU 97 -12.445 -10.918 -10.163 756 HA LEU 97 HA LEU 97 -13.613 -9.019 -8.354 757 HB2 LEU 97 HB2 LEU 97 -13.681 -11.491 -8.032 758 HB3 LEU 97 HB3 LEU 97 -11.928 -11.490 -7.779 759 HG LEU 97 HG LEU 97 -12.219 -10.098 -5.742 760 HD11 LEU 97 HD11 LEU 97 -14.561 -9.870 -4.806 761 HD12 LEU 97 HD12 LEU 97 -14.285 -8.889 -6.237 762 HD13 LEU 97 HD13 LEU 97 -15.198 -10.409 -6.365 763 HD21 LEU 97 HD21 LEU 97 -13.962 -12.585 -5.719 764 HD22 LEU 97 HD22 LEU 97 -12.182 -12.600 -5.717 765 HD23 LEU 97 HD23 LEU 97 -13.045 -11.888 -4.362 766 H SER 98 H SER 98 -10.314 -9.896 -9.242 767 HA SER 98 HA SER 98 -8.701 -8.528 -7.509 768 HB2 SER 98 HB2 SER 98 -8.314 -8.740 -10.513 769 HB3 SER 98 HB3 SER 98 -7.080 -8.810 -9.248 770 HG SER 98 HG SER 98 -7.985 -10.892 -10.276 771 H ASP 99 H ASP 99 -11.004 -7.050 -9.628 772 HA ASP 99 HA ASP 99 -9.624 -4.427 -9.509 773 HB2 ASP 99 HB2 ASP 99 -9.724 -5.707 -11.723 774 HB3 ASP 99 HB3 ASP 99 -11.470 -5.460 -11.689 775 H ILE 100 H ILE 100 -11.783 -5.937 -7.876 776 HA ILE 100 HA ILE 100 -13.798 -3.740 -7.804 777 HB ILE 100 HB ILE 100 -14.076 -6.687 -8.020 778 HG12 ILE 100 HG12 ILE 100 -15.964 -4.378 -8.625 779 HG13 ILE 100 HG13 ILE 100 -14.711 -4.966 -9.740 780 HG21 ILE 100 HG21 ILE 100 -14.942 -6.454 -5.705 781 HG22 ILE 100 HG22 ILE 100 -16.119 -5.250 -6.288 782 HG23 ILE 100 HG23 ILE 100 -16.176 -6.931 -6.851 783 HD11 ILE 100 HD11 ILE 100 -15.864 -7.205 -9.732 784 HD12 ILE 100 HD12 ILE 100 -17.194 -6.443 -8.812 785 HD13 ILE 100 HD13 ILE 100 -16.794 -5.861 -10.433 786 H GLU 101 H GLU 101 -14.703 -3.266 -5.886 787 HA GLU 101 HA GLU 101 -13.301 -4.073 -3.378 788 HB2 GLU 101 HB2 GLU 101 -12.670 -1.799 -4.031 789 HB3 GLU 101 HB3 GLU 101 -14.371 -1.356 -4.263 790 HG2 GLU 101 HG2 GLU 101 -14.826 -1.561 -1.892 791 HG3 GLU 101 HG3 GLU 101 -13.247 -2.293 -1.601 792 H ALA 102 H ALA 102 -14.728 -5.146 -2.091 793 HA ALA 102 HA ALA 102 -17.544 -5.315 -2.873 794 HB1 ALA 102 HB1 ALA 102 -16.111 -6.494 -0.448 795 HB2 ALA 102 HB2 ALA 102 -17.701 -6.960 -1.096 796 HB3 ALA 102 HB3 ALA 102 -16.234 -7.263 -2.046 797 H ILE 103 H ILE 103 -19.258 -4.419 -1.836 798 HA ILE 103 HA ILE 103 -18.787 -2.640 0.521 799 HB ILE 103 HB ILE 103 -20.259 -2.161 -2.080 800 HG12 ILE 103 HG12 ILE 103 -18.115 -0.516 -0.655 801 HG13 ILE 103 HG13 ILE 103 -17.782 -1.670 -1.945 802 HG21 ILE 103 HG21 ILE 103 -21.759 -1.373 -0.282 803 HG22 ILE 103 HG22 ILE 103 -20.431 -0.422 0.423 804 HG23 ILE 103 HG23 ILE 103 -21.107 -0.021 -1.171 805 HD11 ILE 103 HD11 ILE 103 -19.402 0.867 -2.238 806 HD12 ILE 103 HD12 ILE 103 -17.802 0.498 -2.894 807 HD13 ILE 103 HD13 ILE 103 -19.224 -0.395 -3.488 808 H ASP 104 H ASP 104 -20.253 -2.757 2.110 809 HA ASP 104 HA ASP 104 -21.923 -3.461 3.404 810 HB2 ASP 104 HB2 ASP 104 -23.025 -1.814 1.934 811 HB3 ASP 104 HB3 ASP 104 -23.582 -3.121 0.889 812 H VAL 105 H VAL 105 -20.404 -5.621 2.368 813 HA VAL 105 HA VAL 105 -22.439 -7.779 2.165 814 HB VAL 105 HB VAL 105 -20.711 -7.378 0.340 815 HG11 VAL 105 HG11 VAL 105 -18.522 -8.401 0.559 816 HG12 VAL 105 HG12 VAL 105 -18.693 -7.057 1.698 817 HG13 VAL 105 HG13 VAL 105 -18.812 -8.732 2.272 818 HG21 VAL 105 HG21 VAL 105 -20.597 -9.660 -0.218 819 HG22 VAL 105 HG22 VAL 105 -20.851 -10.178 1.460 820 HG23 VAL 105 HG23 VAL 105 -22.149 -9.372 0.576 821 H ASP 106 H ASP 106 -21.648 -9.934 3.166 822 HA ASP 106 HA ASP 106 -21.453 -9.583 6.008 823 HB2 ASP 106 HB2 ASP 106 -22.612 -11.489 4.937 824 HB3 ASP 106 HB3 ASP 106 -21.061 -12.046 4.279 825 H ASP 107 H ASP 107 -19.785 -10.336 7.366 826 HA ASP 107 HA ASP 107 -17.210 -9.330 6.783 827 HB2 ASP 107 HB2 ASP 107 -18.090 -9.549 9.053 828 HB3 ASP 107 HB3 ASP 107 -18.130 -11.308 8.900 829 H ASP 108 H ASP 108 -18.428 -12.749 6.563 830 HA ASP 108 HA ASP 108 -15.726 -13.726 6.178 831 HB2 ASP 108 HB2 ASP 108 -17.807 -15.011 7.065 832 HB3 ASP 108 HB3 ASP 108 -18.227 -15.222 5.355 833 H THR 109 H THR 109 -18.206 -12.421 4.095 834 HA THR 109 HA THR 109 -17.110 -13.449 1.562 835 HB THR 109 HB THR 109 -19.090 -11.199 2.182 836 HG1 THR 109 HG1 THR 109 -19.636 -13.458 2.721 837 HG21 THR 109 HG21 THR 109 -18.164 -12.486 -0.373 838 HG22 THR 109 HG22 THR 109 -19.773 -11.772 -0.258 839 HG23 THR 109 HG23 THR 109 -18.324 -10.769 -0.009 840 H GLN 110 H GLN 110 -17.144 -10.314 3.398 841 HA GLN 110 HA GLN 110 -15.464 -8.940 1.624 842 HB2 GLN 110 HB2 GLN 110 -16.889 -8.184 3.736 843 HB3 GLN 110 HB3 GLN 110 -15.377 -8.401 4.608 844 HG2 GLN 110 HG2 GLN 110 -15.868 -6.598 2.188 845 HG3 GLN 110 HG3 GLN 110 -15.757 -6.066 3.858 846 HE21 GLN 110 HE22 GLN 110 -13.959 -6.525 0.988 847 HE22 GLN 110 HE21 GLN 110 -12.360 -6.449 1.679 848 H GLU 111 H GLU 111 -14.597 -10.911 4.538 849 HA GLU 111 HA GLU 111 -11.802 -10.474 4.348 850 HB2 GLU 111 HB2 GLU 111 -13.485 -12.693 5.567 851 HB3 GLU 111 HB3 GLU 111 -11.729 -12.680 5.688 852 HG2 GLU 111 HG2 GLU 111 -13.461 -10.357 6.653 853 HG3 GLU 111 HG3 GLU 111 -12.973 -11.707 7.669 854 H ALA 112 H ALA 112 -13.871 -12.975 2.747 855 HA ALA 112 HA ALA 112 -11.650 -14.497 1.739 856 HB1 ALA 112 HB1 ALA 112 -14.465 -14.198 0.595 857 HB2 ALA 112 HB2 ALA 112 -13.286 -15.463 0.189 858 HB3 ALA 112 HB3 ALA 112 -13.951 -15.377 1.826 859 H ILE 113 H ILE 113 -13.543 -11.760 0.409 860 HA ILE 113 HA ILE 113 -12.203 -11.655 -2.120 861 HB ILE 113 HB ILE 113 -13.800 -9.623 -0.505 862 HG12 ILE 113 HG12 ILE 113 -14.602 -11.256 -2.960 863 HG13 ILE 113 HG13 ILE 113 -14.936 -11.764 -1.326 864 HG21 ILE 113 HG21 ILE 113 -14.027 -8.350 -2.676 865 HG22 ILE 113 HG22 ILE 113 -12.406 -8.324 -2.000 866 HG23 ILE 113 HG23 ILE 113 -12.764 -9.397 -3.361 867 HD11 ILE 113 HD11 ILE 113 -16.909 -10.763 -2.112 868 HD12 ILE 113 HD12 ILE 113 -16.202 -9.602 -0.972 869 HD13 ILE 113 HD13 ILE 113 -16.059 -9.346 -2.736 870 H ALA 114 H ALA 114 -11.692 -9.880 0.981 871 HA ALA 114 HA ALA 114 -9.509 -8.300 0.134 872 HB1 ALA 114 HB1 ALA 114 -10.746 -7.948 2.255 873 HB2 ALA 114 HB2 ALA 114 -10.077 -9.466 2.897 874 HB3 ALA 114 HB3 ALA 114 -9.002 -8.104 2.530 875 H ASP 115 H ASP 115 -9.598 -11.636 1.495 876 HA ASP 115 HA ASP 115 -6.765 -11.892 1.645 877 HB2 ASP 115 HB2 ASP 115 -8.354 -13.303 2.908 878 HB3 ASP 115 HB3 ASP 115 -8.842 -14.093 1.401 879 H TRP 116 H TRP 116 -9.063 -12.650 -1.032 880 HA TRP 116 HA TRP 116 -7.098 -13.832 -2.772 881 HB2 TRP 116 HB2 TRP 116 -9.388 -14.082 -3.395 882 HB3 TRP 116 HB3 TRP 116 -9.700 -12.359 -3.264 883 HD1 TRP 116 HD1 TRP 116 -9.666 -11.030 -5.407 884 HE1 TRP 116 HE1 TRP 116 -8.708 -11.281 -7.780 885 HE3 TRP 116 HE3 TRP 116 -7.183 -15.483 -4.854 886 HZ2 TRP 116 HZ2 TRP 116 -7.106 -13.147 -9.242 887 HZ3 TRP 116 HZ3 TRP 116 -5.930 -16.458 -6.746 888 HH2 TRP 116 HH2 TRP 116 -5.880 -15.305 -8.950 889 H LEU 117 H LEU 117 -8.156 -10.424 -2.267 890 HA LEU 117 HA LEU 117 -6.469 -9.318 -4.282 891 HB2 LEU 117 HB2 LEU 117 -7.657 -8.143 -1.737 892 HB3 LEU 117 HB3 LEU 117 -6.766 -7.178 -2.901 893 HG LEU 117 HG LEU 117 -9.185 -8.820 -3.757 894 HD11 LEU 117 HD11 LEU 117 -9.939 -7.378 -1.937 895 HD12 LEU 117 HD12 LEU 117 -9.179 -5.963 -2.701 896 HD13 LEU 117 HD13 LEU 117 -10.550 -6.782 -3.486 897 HD21 LEU 117 HD21 LEU 117 -7.895 -6.309 -4.910 898 HD22 LEU 117 HD22 LEU 117 -7.704 -7.953 -5.548 899 HD23 LEU 117 HD23 LEU 117 -9.297 -7.175 -5.572 900 H TYR 118 H TYR 118 -5.933 -9.796 -0.749 901 HA TYR 118 HA TYR 118 -3.323 -8.682 -0.680 902 HB2 TYR 118 HB2 TYR 118 -4.509 -10.889 1.045 903 HB3 TYR 118 HB3 TYR 118 -3.060 -9.971 1.416 904 HD1 TYR 118 HD2 TYR 118 -4.547 -7.206 0.406 905 HD2 TYR 118 HD1 TYR 118 -5.376 -10.344 3.260 906 HE1 TYR 118 HE2 TYR 118 -5.882 -5.632 1.738 907 HE2 TYR 118 HE1 TYR 118 -6.724 -8.764 4.602 908 HH TYR 118 HH TYR 118 -7.186 -5.326 3.647 909 H TRP 119 H TRP 119 -4.391 -12.105 -1.240 910 HA TRP 119 HA TRP 119 -1.793 -13.226 -1.415 911 HB2 TRP 119 HB2 TRP 119 -3.660 -14.693 -1.268 912 HB3 TRP 119 HB3 TRP 119 -4.491 -13.923 -2.613 913 HD1 TRP 119 HD1 TRP 119 -4.035 -14.732 -5.000 914 HE1 TRP 119 HE1 TRP 119 -2.655 -16.617 -6.080 915 HE3 TRP 119 HE3 TRP 119 -1.332 -16.165 -0.894 916 HZ2 TRP 119 HZ2 TRP 119 -0.723 -18.584 -5.203 917 HZ3 TRP 119 HZ3 TRP 119 0.282 -18.043 -1.049 918 HH2 TRP 119 HH2 TRP 119 0.590 -19.258 -3.196 919 H LEU 120 H LEU 120 -3.907 -11.763 -3.952 920 HA LEU 120 HA LEU 120 -2.192 -12.435 -6.082 921 HB2 LEU 120 HB2 LEU 120 -4.620 -11.764 -6.230 922 HB3 LEU 120 HB3 LEU 120 -4.151 -10.101 -5.868 923 HG LEU 120 HG LEU 120 -2.749 -10.084 -7.963 924 HD11 LEU 120 HD11 LEU 120 -2.317 -12.493 -8.224 925 HD12 LEU 120 HD12 LEU 120 -4.051 -12.815 -8.417 926 HD13 LEU 120 HD13 LEU 120 -3.163 -11.886 -9.647 927 HD21 LEU 120 HD21 LEU 120 -5.684 -10.814 -8.332 928 HD22 LEU 120 HD22 LEU 120 -5.046 -9.201 -7.945 929 HD23 LEU 120 HD23 LEU 120 -4.668 -9.948 -9.506 930 H ALA 121 H ALA 121 -2.426 -9.498 -4.065 931 HA ALA 121 HA ALA 121 -0.366 -8.005 -5.374 932 HB1 ALA 121 HB1 ALA 121 -2.074 -6.957 -4.005 933 HB2 ALA 121 HB2 ALA 121 -1.605 -7.913 -2.592 934 HB3 ALA 121 HB3 ALA 121 -0.495 -6.670 -3.237 935 H ARG 122 H ARG 122 -0.306 -10.324 -2.612 936 HA ARG 122 HA ARG 122 2.438 -9.919 -1.932 937 HB2 ARG 122 HB2 ARG 122 0.726 -10.979 -0.466 938 HB3 ARG 122 HB3 ARG 122 0.619 -12.345 -1.564 939 HG2 ARG 122 HG2 ARG 122 1.868 -12.903 0.417 940 HG3 ARG 122 HG3 ARG 122 2.902 -13.046 -0.990 941 HD2 ARG 122 HD2 ARG 122 2.894 -10.485 0.652 942 HD3 ARG 122 HD3 ARG 122 3.763 -11.919 1.224 943 HE ARG 122 HE ARG 122 4.443 -11.368 -1.503 944 HH11 ARG 122 HH11 ARG 122 5.078 -10.152 1.789 945 HH12 ARG 122 HH12 ARG 122 6.750 -9.812 1.475 946 HH21 ARG 122 HH21 ARG 122 6.612 -10.823 -1.932 947 HH22 ARG 122 HH22 ARG 122 7.633 -10.183 -0.703 948 H GLY 123 H GLY 123 0.923 -11.718 -4.546 949 HA2 GLY 123 HA2 GLY 123 2.929 -11.896 -6.246 950 HA3 GLY 123 HA3 GLY 123 3.379 -13.242 -5.186 951 H TYR 124 H TYR 124 1.909 -12.654 -8.024 952 HA TYR 124 HA TYR 124 -0.357 -14.469 -7.882 953 HB2 TYR 124 HB2 TYR 124 -0.297 -12.549 -9.412 954 HB3 TYR 124 HB3 TYR 124 1.151 -13.169 -10.181 955 HD1 TYR 124 HD2 TYR 124 -2.254 -14.611 -9.288 956 HD2 TYR 124 HD1 TYR 124 0.763 -14.002 -12.320 957 HE1 TYR 124 HE2 TYR 124 -3.710 -15.704 -10.938 958 HE2 TYR 124 HE1 TYR 124 -0.675 -15.141 -13.978 959 HH TYR 124 HH TYR 124 -4.013 -16.184 -13.190 960 H LYS 125 H LYS 125 1.075 -16.156 -6.746 961 HA LYS 125 HA LYS 125 3.040 -17.596 -8.350 962 HB2 LYS 125 HB2 LYS 125 1.557 -18.332 -5.783 963 HB3 LYS 125 HB3 LYS 125 2.853 -19.280 -6.514 964 HG2 LYS 125 HG2 LYS 125 4.426 -17.394 -6.237 965 HG3 LYS 125 HG3 LYS 125 3.144 -16.410 -5.507 966 HD2 LYS 125 HD2 LYS 125 2.934 -18.005 -3.641 967 HD3 LYS 125 HD3 LYS 125 4.177 -19.045 -4.376 968 HE2 LYS 125 HE2 LYS 125 5.810 -17.171 -4.233 969 HE3 LYS 125 HE3 LYS 125 4.580 -16.154 -3.471 970 HZ1 LYS 125 HZ1 LYS 125 4.555 -17.639 -1.578 971 HZ2 LYS 125 HZ2 LYS 125 5.597 -18.683 -2.310 972 HZ3 LYS 125 HZ3 LYS 125 6.093 -17.194 -1.875 973 H PHE 126 H PHE 126 -0.426 -17.826 -7.578 974 HA PHE 126 HA PHE 126 -1.103 -19.132 -9.981 975 HB2 PHE 126 HB2 PHE 126 -2.280 -21.070 -8.845 976 HB3 PHE 126 HB3 PHE 126 -0.546 -21.213 -8.993 977 HD1 PHE 126 HD1 PHE 126 -3.321 -20.623 -6.584 978 HD2 PHE 126 HD2 PHE 126 0.902 -21.353 -7.059 979 HE1 PHE 126 HE1 PHE 126 -3.137 -21.197 -4.172 980 HE2 PHE 126 HE2 PHE 126 1.094 -21.845 -4.637 981 HZ PHE 126 HZ PHE 126 -0.937 -21.788 -3.188 Start of MODEL 2 1 H1 MET 1 H1 MET 1 4.601 -6.080 -4.195 2 H2 MET 1 H2 MET 1 3.001 -6.339 -3.996 3 H3 MET 1 H3 MET 1 3.585 -4.804 -4.077 4 HA MET 1 HA MET 1 4.845 -5.135 -2.039 5 HB2 MET 1 HB2 MET 1 2.637 -4.041 -1.937 6 HB3 MET 1 HB3 MET 1 1.845 -5.609 -1.753 7 HG2 MET 1 HG2 MET 1 3.085 -5.956 0.388 8 HG3 MET 1 HG3 MET 1 3.848 -4.374 0.187 9 HE1 MET 1 HE1 MET 1 1.371 -3.944 3.233 10 HE2 MET 1 HE2 MET 1 2.230 -5.435 2.795 11 HE3 MET 1 HE3 MET 1 3.063 -3.864 2.696 12 H ALA 2 H ALA 2 6.228 -7.006 -1.958 13 HA ALA 2 HA ALA 2 5.121 -9.658 -1.632 14 HB1 ALA 2 HB1 ALA 2 7.449 -10.300 -1.167 15 HB2 ALA 2 HB2 ALA 2 7.360 -9.260 -2.600 16 HB3 ALA 2 HB3 ALA 2 7.918 -8.593 -1.045 17 H SER 3 H SER 3 5.816 -7.029 0.600 18 HA SER 3 HA SER 3 6.555 -8.281 2.860 19 HB2 SER 3 HB2 SER 3 4.647 -5.934 2.887 20 HB3 SER 3 HB3 SER 3 6.023 -6.260 3.956 21 HG SER 3 HG SER 3 6.549 -4.678 2.399 22 H VAL 4 H VAL 4 3.269 -8.498 1.583 23 HA VAL 4 HA VAL 4 1.921 -8.963 4.060 24 HB VAL 4 HB VAL 4 0.160 -9.977 2.652 25 HG11 VAL 4 HG11 VAL 4 -0.407 -7.980 1.386 26 HG12 VAL 4 HG12 VAL 4 0.315 -7.508 2.930 27 HG13 VAL 4 HG13 VAL 4 1.268 -7.408 1.433 28 HG21 VAL 4 HG21 VAL 4 1.572 -11.114 0.963 29 HG22 VAL 4 HG22 VAL 4 0.379 -10.049 0.215 30 HG23 VAL 4 HG23 VAL 4 2.069 -9.535 0.307 31 H GLU 5 H GLU 5 4.171 -10.947 2.303 32 HA GLU 5 HA GLU 5 3.444 -13.539 3.152 33 HB2 GLU 5 HB2 GLU 5 5.103 -12.839 1.430 34 HB3 GLU 5 HB3 GLU 5 6.207 -12.337 2.715 35 HG2 GLU 5 HG2 GLU 5 6.525 -14.591 3.447 36 HG3 GLU 5 HG3 GLU 5 5.125 -15.171 2.534 37 H ARG 6 H ARG 6 4.636 -10.855 5.047 38 HA ARG 6 HA ARG 6 5.873 -12.190 7.205 39 HB2 ARG 6 HB2 ARG 6 5.392 -10.217 8.488 40 HB3 ARG 6 HB3 ARG 6 5.783 -9.725 6.841 41 HG2 ARG 6 HG2 ARG 6 3.211 -9.641 6.439 42 HG3 ARG 6 HG3 ARG 6 3.049 -9.790 8.195 43 HD2 ARG 6 HD2 ARG 6 4.382 -7.740 8.510 44 HD3 ARG 6 HD3 ARG 6 4.639 -7.630 6.755 45 HE ARG 6 HE ARG 6 1.833 -7.727 7.486 46 HH11 ARG 6 HH11 ARG 6 4.599 -5.524 7.184 47 HH12 ARG 6 HH12 ARG 6 3.638 -4.121 6.900 48 HH21 ARG 6 HH21 ARG 6 0.544 -5.858 7.109 49 HH22 ARG 6 HH22 ARG 6 1.278 -4.320 6.869 50 H ASP 7 H ASP 7 2.490 -12.216 6.231 51 HA ASP 7 HA ASP 7 1.553 -13.169 8.820 52 HB2 ASP 7 HB2 ASP 7 0.157 -11.770 7.304 53 HB3 ASP 7 HB3 ASP 7 0.057 -13.127 6.181 54 H GLU 8 H GLU 8 3.341 -14.801 8.788 55 HA GLU 8 HA GLU 8 3.296 -17.030 7.051 56 HB2 GLU 8 HB2 GLU 8 4.682 -18.152 8.694 57 HB3 GLU 8 HB3 GLU 8 5.219 -16.492 8.427 58 HG2 GLU 8 HG2 GLU 8 4.094 -15.796 10.547 59 HG3 GLU 8 HG3 GLU 8 3.580 -17.463 10.814 60 H THR 9 H THR 9 1.210 -16.302 9.834 61 HA THR 9 HA THR 9 0.161 -18.935 10.236 62 HB THR 9 HB THR 9 -1.292 -16.300 10.560 63 HG1 THR 9 HG1 THR 9 0.647 -17.486 12.258 64 HG21 THR 9 HG21 THR 9 -2.659 -18.286 10.962 65 HG22 THR 9 HG22 THR 9 -1.448 -18.923 12.097 66 HG23 THR 9 HG23 THR 9 -2.347 -17.434 12.482 67 H ARG 10 H ARG 10 -0.893 -16.202 8.078 68 HA ARG 10 HA ARG 10 -3.019 -17.711 6.953 69 HB2 ARG 10 HB2 ARG 10 -2.886 -15.263 6.789 70 HB3 ARG 10 HB3 ARG 10 -1.434 -15.378 5.787 71 HG2 ARG 10 HG2 ARG 10 -3.415 -14.875 4.461 72 HG3 ARG 10 HG3 ARG 10 -2.718 -16.426 3.984 73 HD2 ARG 10 HD2 ARG 10 -4.439 -17.622 5.292 74 HD3 ARG 10 HD3 ARG 10 -5.123 -16.074 5.833 75 HE ARG 10 HE ARG 10 -5.248 -15.790 3.151 76 HH11 ARG 10 HH11 ARG 10 -6.450 -18.284 5.381 77 HH12 ARG 10 HH12 ARG 10 -7.727 -18.797 4.350 78 HH21 ARG 10 HH21 ARG 10 -6.847 -16.525 1.739 79 HH22 ARG 10 HH22 ARG 10 -7.941 -17.806 2.172 80 H GLU 11 H GLU 11 0.433 -17.377 5.957 81 HA GLU 11 HA GLU 11 0.240 -18.912 3.579 82 HB2 GLU 11 HB2 GLU 11 2.508 -18.671 5.606 83 HB3 GLU 11 HB3 GLU 11 2.672 -19.501 4.067 84 HG2 GLU 11 HG2 GLU 11 1.885 -16.567 4.307 85 HG3 GLU 11 HG3 GLU 11 3.539 -17.140 4.121 86 H HIS 12 H HIS 12 0.906 -19.994 6.931 87 HA HIS 12 HA HIS 12 0.965 -22.768 6.411 88 HB2 HIS 12 HB2 HIS 12 1.823 -22.093 8.470 89 HB3 HIS 12 HB3 HIS 12 0.489 -20.999 8.800 90 HD1 HIS 12 HD1 HIS 12 0.669 -24.899 8.492 91 HD2 HIS 12 HD2 HIS 12 -1.028 -21.704 10.643 92 HE1 HIS 12 HE1 HIS 12 -0.806 -25.955 10.276 93 H ARG 13 H ARG 13 -1.898 -20.662 7.268 94 HA ARG 13 HA ARG 13 -3.609 -22.995 7.409 95 HB2 ARG 13 HB2 ARG 13 -4.320 -20.032 7.173 96 HB3 ARG 13 HB3 ARG 13 -5.480 -21.332 7.410 97 HG2 ARG 13 HG2 ARG 13 -3.427 -20.299 9.374 98 HG3 ARG 13 HG3 ARG 13 -5.171 -20.396 9.547 99 HD2 ARG 13 HD2 ARG 13 -3.182 -22.682 9.547 100 HD3 ARG 13 HD3 ARG 13 -4.055 -22.057 10.949 101 HE ARG 13 HE ARG 13 -6.069 -22.847 9.252 102 HH11 ARG 13 HH11 ARG 13 -3.185 -24.490 10.548 103 HH12 ARG 13 HH12 ARG 13 -3.921 -26.055 10.545 104 HH21 ARG 13 HH21 ARG 13 -7.000 -24.903 9.166 105 HH22 ARG 13 HH22 ARG 13 -6.144 -26.306 9.743 106 H ILE 14 H ILE 14 -3.029 -20.580 4.781 107 HA ILE 14 HA ILE 14 -5.089 -21.674 3.181 108 HB ILE 14 HB ILE 14 -3.904 -19.426 2.975 109 HG12 ILE 14 HG12 ILE 14 -4.631 -21.114 0.562 110 HG13 ILE 14 HG13 ILE 14 -5.680 -20.094 1.532 111 HG21 ILE 14 HG21 ILE 14 -1.975 -20.908 1.148 112 HG22 ILE 14 HG22 ILE 14 -2.056 -19.160 1.453 113 HG23 ILE 14 HG23 ILE 14 -1.581 -20.243 2.747 114 HD11 ILE 14 HD11 ILE 14 -4.347 -18.079 0.700 115 HD12 ILE 14 HD12 ILE 14 -3.569 -19.188 -0.462 116 HD13 ILE 14 HD13 ILE 14 -5.318 -18.960 -0.487 117 H GLU 15 H GLU 15 -1.605 -22.470 3.461 118 HA GLU 15 HA GLU 15 -1.507 -24.464 1.464 119 HB2 GLU 15 HB2 GLU 15 0.449 -23.398 2.427 120 HB3 GLU 15 HB3 GLU 15 0.083 -24.046 4.032 121 HG2 GLU 15 HG2 GLU 15 0.511 -26.313 3.290 122 HG3 GLU 15 HG3 GLU 15 0.692 -25.781 1.611 123 H THR 16 H THR 16 -2.469 -24.716 4.939 124 HA THR 16 HA THR 16 -2.616 -27.642 4.644 125 HB THR 16 HB THR 16 -2.987 -27.583 7.113 126 HG1 THR 16 HG1 THR 16 -2.240 -24.862 6.910 127 HG21 THR 16 HG21 THR 16 -0.676 -27.013 7.674 128 HG22 THR 16 HG22 THR 16 -0.747 -27.916 6.154 129 HG23 THR 16 HG23 THR 16 -0.476 -26.163 6.123 130 H GLU 17 H GLU 17 -4.877 -25.092 4.303 131 HA GLU 17 HA GLU 17 -7.112 -26.965 4.914 132 HB2 GLU 17 HB2 GLU 17 -6.457 -25.036 6.509 133 HB3 GLU 17 HB3 GLU 17 -7.099 -23.951 5.264 134 HG2 GLU 17 HG2 GLU 17 -9.274 -25.148 5.397 135 HG3 GLU 17 HG3 GLU 17 -8.599 -26.188 6.661 136 H ILE 18 H ILE 18 -5.921 -24.511 2.567 137 HA ILE 18 HA ILE 18 -8.555 -24.672 1.189 138 HB ILE 18 HB ILE 18 -6.471 -22.508 1.452 139 HG12 ILE 18 HG12 ILE 18 -9.466 -22.555 2.068 140 HG13 ILE 18 HG13 ILE 18 -8.237 -22.936 3.265 141 HG21 ILE 18 HG21 ILE 18 -7.856 -21.080 -0.017 142 HG22 ILE 18 HG22 ILE 18 -7.217 -22.444 -0.899 143 HG23 ILE 18 HG23 ILE 18 -8.908 -22.475 -0.369 144 HD11 ILE 18 HD11 ILE 18 -7.286 -20.692 3.094 145 HD12 ILE 18 HD12 ILE 18 -8.536 -20.236 1.908 146 HD13 ILE 18 HD13 ILE 18 -8.998 -20.670 3.558 147 H ILE 19 H ILE 19 -5.019 -24.963 0.506 148 HA ILE 19 HA ILE 19 -5.876 -26.343 -2.002 149 HB ILE 19 HB ILE 19 -3.916 -25.584 -3.164 150 HG12 ILE 19 HG12 ILE 19 -2.569 -25.055 -0.992 151 HG13 ILE 19 HG13 ILE 19 -2.282 -24.176 -2.484 152 HG21 ILE 19 HG21 ILE 19 -4.647 -23.310 -3.664 153 HG22 ILE 19 HG22 ILE 19 -6.008 -24.430 -3.510 154 HG23 ILE 19 HG23 ILE 19 -5.650 -23.286 -2.210 155 HD11 ILE 19 HD11 ILE 19 -2.361 -22.784 -0.367 156 HD12 ILE 19 HD12 ILE 19 -3.389 -22.219 -1.701 157 HD13 ILE 19 HD13 ILE 19 -4.110 -23.084 -0.338 158 H VAL 20 H VAL 20 -5.187 -27.278 0.815 159 HA VAL 20 HA VAL 20 -2.749 -28.631 0.814 160 HB VAL 20 HB VAL 20 -4.352 -28.194 2.657 161 HG11 VAL 20 HG11 VAL 20 -5.824 -30.706 1.841 162 HG12 VAL 20 HG12 VAL 20 -6.083 -29.731 3.296 163 HG13 VAL 20 HG13 VAL 20 -6.450 -29.043 1.713 164 HG21 VAL 20 HG21 VAL 20 -3.344 -31.059 2.534 165 HG22 VAL 20 HG22 VAL 20 -2.378 -29.634 2.975 166 HG23 VAL 20 HG23 VAL 20 -3.728 -30.140 4.005 167 H ASP 21 H ASP 21 -5.833 -29.593 -0.580 168 HA ASP 21 HA ASP 21 -5.043 -32.287 -1.281 169 HB2 ASP 21 HB2 ASP 21 -7.368 -31.605 -0.811 170 HB3 ASP 21 HB3 ASP 21 -7.354 -30.547 -2.224 171 H ALA 22 H ALA 22 -4.370 -29.229 -2.776 172 HA ALA 22 HA ALA 22 -4.653 -30.100 -5.540 173 HB1 ALA 22 HB1 ALA 22 -3.283 -27.641 -4.361 174 HB2 ALA 22 HB2 ALA 22 -3.670 -27.899 -6.062 175 HB3 ALA 22 HB3 ALA 22 -4.987 -27.731 -4.880 176 H GLU 23 H GLU 23 -3.082 -30.697 -6.954 177 HA GLU 23 HA GLU 23 -0.216 -30.632 -6.137 178 HB2 GLU 23 HB2 GLU 23 -1.697 -32.798 -7.689 179 HB3 GLU 23 HB3 GLU 23 0.050 -32.708 -7.540 180 HG2 GLU 23 HG2 GLU 23 -1.923 -33.123 -5.255 181 HG3 GLU 23 HG3 GLU 23 -0.920 -34.355 -6.005 182 H ASP 24 H ASP 24 -2.718 -29.973 -8.546 183 HA ASP 24 HA ASP 24 -0.640 -28.871 -10.396 184 HB2 ASP 24 HB2 ASP 24 -1.965 -30.744 -11.314 185 HB3 ASP 24 HB3 ASP 24 -3.459 -29.873 -10.952 186 H LYS 25 H LYS 25 -0.962 -26.786 -11.237 187 HA LYS 25 HA LYS 25 -2.053 -24.909 -9.544 188 HB2 LYS 25 HB2 LYS 25 -1.505 -23.239 -11.042 189 HB3 LYS 25 HB3 LYS 25 -0.309 -24.486 -11.303 190 HG2 LYS 25 HG2 LYS 25 -2.751 -24.016 -13.079 191 HG3 LYS 25 HG3 LYS 25 -1.167 -23.332 -13.383 192 HD2 LYS 25 HD2 LYS 25 -0.208 -25.370 -14.020 193 HD3 LYS 25 HD3 LYS 25 -1.377 -26.320 -13.121 194 HE2 LYS 25 HE2 LYS 25 -3.084 -25.133 -14.834 195 HE3 LYS 25 HE3 LYS 25 -1.646 -25.129 -15.855 196 HZ1 LYS 25 HZ1 LYS 25 -1.581 -27.493 -15.732 197 HZ2 LYS 25 HZ2 LYS 25 -2.598 -27.554 -14.439 198 HZ3 LYS 25 HZ3 LYS 25 -3.199 -27.155 -15.894 199 H GLU 26 H GLU 26 -3.890 -26.690 -12.011 200 HA GLU 26 HA GLU 26 -6.102 -24.790 -12.071 201 HB2 GLU 26 HB2 GLU 26 -5.827 -27.741 -12.770 202 HB3 GLU 26 HB3 GLU 26 -7.365 -26.881 -12.883 203 HG2 GLU 26 HG2 GLU 26 -6.544 -25.354 -14.530 204 HG3 GLU 26 HG3 GLU 26 -4.876 -25.825 -14.250 205 H GLU 27 H GLU 27 -5.257 -27.644 -10.078 206 HA GLU 27 HA GLU 27 -7.731 -27.709 -8.603 207 HB2 GLU 27 HB2 GLU 27 -4.976 -28.719 -7.813 208 HB3 GLU 27 HB3 GLU 27 -6.506 -29.185 -7.073 209 HG2 GLU 27 HG2 GLU 27 -7.242 -30.232 -9.174 210 HG3 GLU 27 HG3 GLU 27 -5.751 -29.730 -9.983 211 H ARG 28 H ARG 28 -4.565 -26.107 -8.133 212 HA ARG 28 HA ARG 28 -5.093 -24.888 -5.617 213 HB2 ARG 28 HB2 ARG 28 -2.906 -24.808 -6.401 214 HB3 ARG 28 HB3 ARG 28 -3.347 -24.239 -7.980 215 HG2 ARG 28 HG2 ARG 28 -3.384 -22.523 -5.469 216 HG3 ARG 28 HG3 ARG 28 -2.066 -22.650 -6.616 217 HD2 ARG 28 HD2 ARG 28 -4.713 -21.265 -7.012 218 HD3 ARG 28 HD3 ARG 28 -3.080 -20.631 -7.142 219 HE ARG 28 HE ARG 28 -3.859 -22.748 -9.060 220 HH11 ARG 28 HH21 ARG 28 -3.406 -19.232 -8.687 221 HH12 ARG 28 HH22 ARG 28 -3.476 -18.970 -10.409 222 HH21 ARG 28 HH11 ARG 28 -4.124 -22.316 -11.210 223 HH22 ARG 28 HH12 ARG 28 -3.916 -20.709 -11.843 224 H ALA 29 H ALA 29 -6.099 -23.868 -8.913 225 HA ALA 29 HA ALA 29 -7.154 -21.341 -7.976 226 HB1 ALA 29 HB1 ALA 29 -6.511 -21.794 -10.354 227 HB2 ALA 29 HB2 ALA 29 -7.901 -22.895 -10.490 228 HB3 ALA 29 HB3 ALA 29 -8.153 -21.167 -10.164 229 H MET 30 H MET 30 -8.520 -24.630 -8.521 230 HA MET 30 HA MET 30 -11.199 -23.905 -7.833 231 HB2 MET 30 HB2 MET 30 -9.803 -26.589 -7.663 232 HB3 MET 30 HB3 MET 30 -11.540 -26.322 -7.494 233 HG2 MET 30 HG2 MET 30 -9.906 -25.679 -9.977 234 HG3 MET 30 HG3 MET 30 -10.911 -27.092 -9.733 235 HE1 MET 30 HE1 MET 30 -12.191 -22.984 -11.215 236 HE2 MET 30 HE2 MET 30 -11.800 -22.888 -9.502 237 HE3 MET 30 HE3 MET 30 -10.578 -23.466 -10.654 238 H GLY 31 H GLY 31 -8.469 -25.019 -5.752 239 HA2 GLY 31 HA2 GLY 31 -9.914 -25.205 -3.341 240 HA3 GLY 31 HA3 GLY 31 -8.207 -24.759 -3.490 241 H TRP 32 H TRP 32 -8.136 -22.341 -4.657 242 HA TRP 32 HA TRP 32 -8.993 -20.437 -2.780 243 HB2 TRP 32 HB2 TRP 32 -8.105 -20.318 -5.660 244 HB3 TRP 32 HB3 TRP 32 -8.788 -18.892 -4.912 245 HD1 TRP 32 HD1 TRP 32 -5.655 -21.057 -4.763 246 HE1 TRP 32 HE1 TRP 32 -3.793 -19.731 -3.628 247 HE3 TRP 32 HE3 TRP 32 -8.445 -17.141 -3.016 248 HZ2 TRP 32 HZ2 TRP 32 -3.541 -17.226 -2.152 249 HZ3 TRP 32 HZ3 TRP 32 -7.389 -15.360 -1.660 250 HH2 TRP 32 HH2 TRP 32 -4.952 -15.384 -1.231 251 H TYR 33 H TYR 33 -10.550 -21.372 -5.912 252 HA TYR 33 HA TYR 33 -12.712 -19.601 -5.783 253 HB2 TYR 33 HB2 TYR 33 -12.163 -20.847 -7.792 254 HB3 TYR 33 HB3 TYR 33 -12.479 -22.376 -6.990 255 HD1 TYR 33 HD2 TYR 33 -14.807 -23.058 -6.360 256 HD2 TYR 33 HD1 TYR 33 -13.983 -19.581 -8.764 257 HE1 TYR 33 HE2 TYR 33 -17.183 -22.959 -7.006 258 HE2 TYR 33 HE1 TYR 33 -16.306 -19.595 -9.587 259 HH TYR 33 HH TYR 33 -18.777 -21.913 -8.365 260 H TYR 34 H TYR 34 -12.471 -22.941 -4.370 261 HA TYR 34 HA TYR 34 -15.239 -23.095 -3.769 262 HB2 TYR 34 HB2 TYR 34 -12.870 -24.523 -2.493 263 HB3 TYR 34 HB3 TYR 34 -14.550 -24.915 -2.171 264 HD1 TYR 34 HD2 TYR 34 -15.791 -24.887 -4.902 265 HD2 TYR 34 HD1 TYR 34 -12.031 -26.478 -3.494 266 HE1 TYR 34 HE2 TYR 34 -15.795 -26.514 -6.751 267 HE2 TYR 34 HE1 TYR 34 -12.045 -28.136 -5.329 268 HH TYR 34 HH TYR 34 -14.675 -28.284 -7.778 269 H TYR 35 H TYR 35 -12.437 -22.188 -1.609 270 HA TYR 35 HA TYR 35 -14.274 -21.771 0.572 271 HB2 TYR 35 HB2 TYR 35 -12.520 -21.361 1.885 272 HB3 TYR 35 HB3 TYR 35 -11.627 -22.132 0.590 273 HD1 TYR 35 HD1 TYR 35 -10.299 -20.722 -0.992 274 HD2 TYR 35 HD2 TYR 35 -12.335 -18.986 2.380 275 HE1 TYR 35 HE1 TYR 35 -9.006 -18.640 -1.300 276 HE2 TYR 35 HE2 TYR 35 -11.084 -16.877 2.067 277 HH TYR 35 HH TYR 35 -9.529 -15.730 0.765 278 H LEU 36 H LEU 36 -12.906 -19.593 -1.956 279 HA LEU 36 HA LEU 36 -13.825 -17.194 -0.771 280 HB2 LEU 36 HB2 LEU 36 -12.167 -17.241 -2.575 281 HB3 LEU 36 HB3 LEU 36 -13.366 -17.896 -3.697 282 HG LEU 36 HG LEU 36 -14.690 -15.811 -3.535 283 HD11 LEU 36 HD11 LEU 36 -12.415 -14.802 -1.762 284 HD12 LEU 36 HD12 LEU 36 -13.693 -13.789 -2.466 285 HD13 LEU 36 HD13 LEU 36 -14.115 -15.020 -1.277 286 HD21 LEU 36 HD21 LEU 36 -13.149 -14.382 -4.778 287 HD22 LEU 36 HD22 LEU 36 -11.757 -15.325 -4.193 288 HD23 LEU 36 HD23 LEU 36 -12.965 -16.067 -5.266 289 H ASP 37 H ASP 37 -15.385 -19.311 -3.263 290 HA ASP 37 HA ASP 37 -17.755 -17.794 -3.571 291 HB2 ASP 37 HB2 ASP 37 -17.089 -19.608 -5.099 292 HB3 ASP 37 HB3 ASP 37 -17.299 -20.795 -3.812 293 H ASP 38 H ASP 38 -16.961 -20.470 -1.309 294 HA ASP 38 HA ASP 38 -19.487 -20.557 0.003 295 HB2 ASP 38 HB2 ASP 38 -17.813 -22.341 0.146 296 HB3 ASP 38 HB3 ASP 38 -16.713 -21.272 1.020 297 H THR 39 H THR 39 -16.852 -18.237 0.348 298 HA THR 39 HA THR 39 -17.774 -17.384 3.026 299 HB THR 39 HB THR 39 -15.401 -16.510 1.328 300 HG1 THR 39 HG1 THR 39 -15.114 -18.552 1.975 301 HG21 THR 39 HG21 THR 39 -15.867 -14.712 2.840 302 HG22 THR 39 HG22 THR 39 -16.241 -15.817 4.171 303 HG23 THR 39 HG23 THR 39 -14.568 -15.649 3.592 304 H LEU 40 H LEU 40 -17.648 -16.188 -0.353 305 HA LEU 40 HA LEU 40 -18.276 -13.473 0.186 306 HB2 LEU 40 HB2 LEU 40 -18.842 -15.262 -2.212 307 HB3 LEU 40 HB3 LEU 40 -19.261 -13.554 -2.193 308 HG LEU 40 HG LEU 40 -16.420 -14.596 -1.894 309 HD11 LEU 40 HD11 LEU 40 -16.131 -13.859 -4.233 310 HD12 LEU 40 HD12 LEU 40 -17.350 -15.130 -4.106 311 HD13 LEU 40 HD13 LEU 40 -17.854 -13.440 -4.321 312 HD21 LEU 40 HD21 LEU 40 -15.813 -12.248 -2.516 313 HD22 LEU 40 HD22 LEU 40 -17.499 -11.790 -2.201 314 HD23 LEU 40 HD23 LEU 40 -16.470 -12.463 -0.901 315 H GLU 41 H GLU 41 -19.986 -12.609 1.071 316 HA GLU 41 HA GLU 41 -22.548 -13.892 1.323 317 HB2 GLU 41 HB2 GLU 41 -21.397 -12.439 3.015 318 HB3 GLU 41 HB3 GLU 41 -21.554 -11.065 1.920 319 HG2 GLU 41 HG2 GLU 41 -23.214 -10.926 3.601 320 HG3 GLU 41 HG3 GLU 41 -24.029 -11.284 2.085 321 H PHE 42 H PHE 42 -22.124 -14.031 -1.268 322 HA PHE 42 HA PHE 42 -22.879 -11.693 -2.776 323 HB2 PHE 42 HB2 PHE 42 -22.751 -13.062 -4.725 324 HB3 PHE 42 HB3 PHE 42 -21.404 -13.454 -3.689 325 HD1 PHE 42 HD2 PHE 42 -24.691 -14.640 -4.989 326 HD2 PHE 42 HD1 PHE 42 -21.114 -15.722 -2.829 327 HE1 PHE 42 HE2 PHE 42 -25.306 -17.035 -5.161 328 HE2 PHE 42 HE1 PHE 42 -21.735 -18.109 -3.003 329 HZ PHE 42 HZ PHE 42 -23.833 -18.777 -4.164 330 HA PRO 43 HA PRO 43 -24.042 -11.261 -4.853 331 HB2 PRO 43 HB2 PRO 43 -26.037 -9.513 -5.455 332 HB3 PRO 43 HB3 PRO 43 -25.987 -11.181 -6.104 333 HG2 PRO 43 HG2 PRO 43 -27.560 -10.170 -3.719 334 HG3 PRO 43 HG3 PRO 43 -28.136 -11.187 -5.078 335 HD2 PRO 43 HD2 PRO 43 -27.357 -12.252 -2.678 336 HD3 PRO 43 HD3 PRO 43 -27.061 -13.102 -4.222 337 H PHE 44 H PHE 44 -23.180 -9.124 -4.715 338 HA PHE 44 HA PHE 44 -23.775 -7.487 -2.341 339 HB2 PHE 44 HB2 PHE 44 -21.511 -7.351 -1.616 340 HB3 PHE 44 HB3 PHE 44 -22.021 -9.018 -1.561 341 HD1 PHE 44 HD1 PHE 44 -21.125 -10.671 -3.294 342 HD2 PHE 44 HD2 PHE 44 -19.570 -6.682 -2.874 343 HE1 PHE 44 HE1 PHE 44 -19.037 -11.367 -4.419 344 HE2 PHE 44 HE2 PHE 44 -17.483 -7.374 -4.005 345 HZ PHE 44 HZ PHE 44 -17.196 -9.728 -4.758 346 H MET 45 H MET 45 -21.830 -5.507 -2.722 347 HA MET 45 HA MET 45 -22.058 -4.839 -5.601 348 HB2 MET 45 HB2 MET 45 -22.964 -2.753 -5.294 349 HB3 MET 45 HB3 MET 45 -23.952 -3.781 -4.285 350 HG2 MET 45 HG2 MET 45 -23.230 -2.800 -2.329 351 HG3 MET 45 HG3 MET 45 -21.631 -2.424 -2.943 352 HE1 MET 45 HE1 MET 45 -22.165 -0.709 -5.696 353 HE2 MET 45 HE2 MET 45 -22.015 0.874 -4.911 354 HE3 MET 45 HE3 MET 45 -20.944 -0.454 -4.440 355 H GLY 46 H GLY 46 -20.750 -2.944 -6.216 356 HA2 GLY 46 HA2 GLY 46 -18.426 -2.322 -4.553 357 HA3 GLY 46 HA3 GLY 46 -18.079 -3.487 -5.845 358 H LYS 47 H LYS 47 -16.669 -1.478 -6.055 359 HA LYS 47 HA LYS 47 -17.831 0.081 -8.323 360 HB2 LYS 47 HB2 LYS 47 -17.011 1.371 -6.194 361 HB3 LYS 47 HB3 LYS 47 -15.395 0.888 -6.681 362 HG2 LYS 47 HG2 LYS 47 -15.623 3.011 -7.645 363 HG3 LYS 47 HG3 LYS 47 -15.998 1.935 -8.994 364 HD2 LYS 47 HD2 LYS 47 -17.670 3.615 -9.066 365 HD3 LYS 47 HD3 LYS 47 -18.468 2.212 -8.364 366 HE2 LYS 47 HE2 LYS 47 -18.325 3.144 -6.134 367 HE3 LYS 47 HE3 LYS 47 -17.277 4.457 -6.690 368 HZ1 LYS 47 HZ1 LYS 47 -19.642 5.098 -6.411 369 HZ2 LYS 47 HZ2 LYS 47 -19.089 5.381 -7.916 370 HZ3 LYS 47 HZ3 LYS 47 -20.065 4.104 -7.649 371 H TRP 48 H TRP 48 -17.069 -0.695 -10.221 372 HA TRP 48 HA TRP 48 -14.622 -2.353 -10.318 373 HB2 TRP 48 HB2 TRP 48 -16.645 -2.852 -11.726 374 HB3 TRP 48 HB3 TRP 48 -16.378 -1.349 -12.587 375 HD1 TRP 48 HD1 TRP 48 -12.990 -2.332 -12.365 376 HE1 TRP 48 HE1 TRP 48 -12.164 -3.792 -14.225 377 HE3 TRP 48 HE3 TRP 48 -17.521 -3.834 -14.268 378 HZ2 TRP 48 HZ2 TRP 48 -13.269 -5.528 -16.245 379 HZ3 TRP 48 HZ3 TRP 48 -17.560 -5.448 -16.158 380 HH2 TRP 48 HH2 TRP 48 -15.452 -6.294 -17.146 381 H LYS 49 H LYS 49 -12.817 -1.225 -10.014 382 HA LYS 49 HA LYS 49 -12.526 1.602 -10.648 383 HB2 LYS 49 HB2 LYS 49 -10.432 -0.403 -9.690 384 HB3 LYS 49 HB3 LYS 49 -10.386 1.346 -9.503 385 HG2 LYS 49 HG2 LYS 49 -12.331 -0.561 -8.113 386 HG3 LYS 49 HG3 LYS 49 -10.859 0.051 -7.411 387 HD2 LYS 49 HD2 LYS 49 -13.095 1.925 -8.307 388 HD3 LYS 49 HD3 LYS 49 -13.037 1.150 -6.721 389 HE2 LYS 49 HE2 LYS 49 -10.622 2.078 -6.543 390 HE3 LYS 49 HE3 LYS 49 -11.082 3.164 -7.866 391 HZ1 LYS 49 HZ1 LYS 49 -12.533 2.922 -5.283 392 HZ2 LYS 49 HZ2 LYS 49 -11.429 4.088 -5.618 393 HZ3 LYS 49 HZ3 LYS 49 -12.816 4.057 -6.477 394 H LYS 50 H LYS 50 -13.107 0.669 -13.013 395 HA LYS 50 HA LYS 50 -11.275 -1.058 -14.371 396 HB2 LYS 50 HB2 LYS 50 -13.632 -0.799 -14.982 397 HB3 LYS 50 HB3 LYS 50 -13.372 0.887 -15.441 398 HG2 LYS 50 HG2 LYS 50 -11.943 0.265 -17.282 399 HG3 LYS 50 HG3 LYS 50 -11.887 -1.426 -16.766 400 HD2 LYS 50 HD2 LYS 50 -14.398 0.031 -17.717 401 HD3 LYS 50 HD3 LYS 50 -13.364 -0.989 -18.732 402 HE2 LYS 50 HE2 LYS 50 -13.777 -2.912 -17.171 403 HE3 LYS 50 HE3 LYS 50 -14.909 -1.906 -16.263 404 HZ1 LYS 50 HZ1 LYS 50 -16.060 -3.291 -17.847 405 HZ2 LYS 50 HZ2 LYS 50 -16.251 -1.731 -18.296 406 HZ3 LYS 50 HZ3 LYS 50 -15.208 -2.696 -19.104 407 H LYS 51 H LYS 51 -9.238 -0.622 -15.087 408 HA LYS 51 HA LYS 51 -8.314 2.138 -15.496 409 HB2 LYS 51 HB2 LYS 51 -7.096 -0.592 -16.115 410 HB3 LYS 51 HB3 LYS 51 -6.319 0.942 -16.538 411 HG2 LYS 51 HG2 LYS 51 -6.289 1.634 -14.172 412 HG3 LYS 51 HG3 LYS 51 -7.106 0.128 -13.706 413 HD2 LYS 51 HD2 LYS 51 -5.191 -1.192 -14.544 414 HD3 LYS 51 HD3 LYS 51 -4.360 0.306 -15.020 415 HE2 LYS 51 HE2 LYS 51 -4.394 1.078 -12.660 416 HE3 LYS 51 HE3 LYS 51 -5.233 -0.403 -12.181 417 HZ1 LYS 51 HZ1 LYS 51 -2.864 -0.559 -11.768 418 HZ2 LYS 51 HZ2 LYS 51 -3.281 -1.661 -12.890 419 HZ3 LYS 51 HZ3 LYS 51 -2.503 -0.292 -13.332 420 H SER 52 H SER 52 -8.285 3.222 -17.466 421 HA SER 52 HA SER 52 -9.283 1.870 -19.909 422 HB2 SER 52 HB2 SER 52 -11.172 2.718 -18.427 423 HB3 SER 52 HB3 SER 52 -10.488 4.341 -18.584 424 HG SER 52 HG SER 52 -11.637 2.677 -20.582 425 H ARG 53 H ARG 53 -9.171 3.398 -21.761 426 HA ARG 53 HA ARG 53 -7.951 4.571 -23.244 427 HB2 ARG 53 HB2 ARG 53 -7.255 6.386 -20.894 428 HB3 ARG 53 HB3 ARG 53 -6.861 6.718 -22.562 429 HG2 ARG 53 HG2 ARG 53 -8.727 8.023 -21.945 430 HG3 ARG 53 HG3 ARG 53 -9.252 6.847 -23.154 431 HD2 ARG 53 HD2 ARG 53 -10.472 5.591 -21.575 432 HD3 ARG 53 HD3 ARG 53 -9.592 6.283 -20.196 433 HE ARG 53 HE ARG 53 -10.853 8.455 -21.294 434 HH11 ARG 53 HH11 ARG 53 -12.041 5.256 -20.204 435 HH12 ARG 53 HH12 ARG 53 -13.381 5.976 -19.324 436 HH21 ARG 53 HH21 ARG 53 -12.759 9.278 -20.145 437 HH22 ARG 53 HH22 ARG 53 -13.755 8.130 -19.283 438 H LYS 54 H LYS 54 -5.642 5.338 -23.831 439 HA LYS 54 HA LYS 54 -3.773 3.231 -23.278 440 HB2 LYS 54 HB2 LYS 54 -3.264 6.038 -24.372 441 HB3 LYS 54 HB3 LYS 54 -2.135 4.697 -24.448 442 HG2 LYS 54 HG2 LYS 54 -4.822 4.900 -25.872 443 HG3 LYS 54 HG3 LYS 54 -3.230 5.026 -26.601 444 HD2 LYS 54 HD2 LYS 54 -4.432 2.516 -25.353 445 HD3 LYS 54 HD3 LYS 54 -4.258 2.863 -27.074 446 HE2 LYS 54 HE2 LYS 54 -1.781 2.956 -26.810 447 HE3 LYS 54 HE3 LYS 54 -1.952 2.556 -25.097 448 HZ1 LYS 54 HZ1 LYS 54 -2.944 0.439 -25.761 449 HZ2 LYS 54 HZ2 LYS 54 -2.779 0.812 -27.345 450 HZ3 LYS 54 HZ3 LYS 54 -1.461 0.600 -26.414 451 H THR 55 H THR 55 -4.456 6.287 -21.626 452 HA THR 55 HA THR 55 -2.042 6.393 -20.089 453 HB THR 55 HB THR 55 -3.632 8.032 -18.778 454 HG1 THR 55 HG1 THR 55 -5.602 7.798 -19.397 455 HG21 THR 55 HG21 THR 55 -3.042 8.490 -21.743 456 HG22 THR 55 HG22 THR 55 -3.394 9.745 -20.533 457 HG23 THR 55 HG23 THR 55 -1.916 8.780 -20.399 458 H SER 56 H SER 56 -4.673 4.190 -19.890 459 HA SER 56 HA SER 56 -5.526 2.874 -18.323 460 HB2 SER 56 HB2 SER 56 -2.847 3.152 -16.917 461 HB3 SER 56 HB3 SER 56 -4.023 1.846 -16.723 462 HG SER 56 HG SER 56 -2.317 1.319 -18.183 463 H THR 57 H THR 57 -6.182 5.626 -18.084 464 HA THR 57 HA THR 57 -6.169 6.659 -15.439 465 HB THR 57 HB THR 57 -8.318 6.991 -17.561 466 HG1 THR 57 HG1 THR 57 -7.000 8.713 -18.326 467 HG21 THR 57 HG21 THR 57 -8.775 8.082 -15.387 468 HG22 THR 57 HG22 THR 57 -7.201 8.904 -15.457 469 HG23 THR 57 HG23 THR 57 -8.472 9.287 -16.642 470 H ILE 58 H ILE 58 -7.413 6.052 -13.661 471 HA ILE 58 HA ILE 58 -9.098 3.708 -13.806 472 HB ILE 58 HB ILE 58 -8.569 5.792 -11.670 473 HG12 ILE 58 HG12 ILE 58 -6.685 4.207 -12.323 474 HG13 ILE 58 HG13 ILE 58 -7.138 4.227 -10.625 475 HG21 ILE 58 HG21 ILE 58 -10.290 3.295 -11.429 476 HG22 ILE 58 HG22 ILE 58 -9.631 4.198 -10.042 477 HG23 ILE 58 HG23 ILE 58 -10.764 4.979 -11.145 478 HD11 ILE 58 HD11 ILE 58 -8.276 2.093 -10.828 479 HD12 ILE 58 HD12 ILE 58 -8.079 2.110 -12.597 480 HD13 ILE 58 HD13 ILE 58 -6.663 1.955 -11.536 481 H GLU 59 H GLU 59 -11.210 3.559 -14.043 482 HA GLU 59 HA GLU 59 -12.998 5.936 -14.005 483 HB2 GLU 59 HB2 GLU 59 -13.038 3.426 -15.750 484 HB3 GLU 59 HB3 GLU 59 -14.453 4.440 -15.526 485 HG2 GLU 59 HG2 GLU 59 -11.853 5.626 -16.571 486 HG3 GLU 59 HG3 GLU 59 -12.974 4.761 -17.613 487 H GLU 60 H GLU 60 -15.044 5.394 -12.959 488 HA GLU 60 HA GLU 60 -14.804 3.079 -11.080 489 HB2 GLU 60 HB2 GLU 60 -15.481 5.995 -10.494 490 HB3 GLU 60 HB3 GLU 60 -15.663 4.665 -9.352 491 HG2 GLU 60 HG2 GLU 60 -13.191 4.168 -9.647 492 HG3 GLU 60 HG3 GLU 60 -13.065 5.664 -10.581 493 H LYS 61 H LYS 61 -16.283 1.794 -12.072 494 HA LYS 61 HA LYS 61 -18.978 2.906 -12.742 495 HB2 LYS 61 HB2 LYS 61 -17.825 1.685 -14.515 496 HB3 LYS 61 HB3 LYS 61 -17.568 0.300 -13.447 497 HG2 LYS 61 HG2 LYS 61 -19.974 -0.110 -13.314 498 HG3 LYS 61 HG3 LYS 61 -20.313 1.317 -14.285 499 HD2 LYS 61 HD2 LYS 61 -18.549 -0.963 -15.295 500 HD3 LYS 61 HD3 LYS 61 -20.291 -1.055 -15.421 501 HE2 LYS 61 HE2 LYS 61 -18.550 1.126 -16.655 502 HE3 LYS 61 HE3 LYS 61 -19.241 -0.258 -17.509 503 HZ1 LYS 61 HZ1 LYS 61 -20.593 1.711 -17.821 504 HZ2 LYS 61 HZ2 LYS 61 -21.466 0.597 -16.988 505 HZ3 LYS 61 HZ3 LYS 61 -20.828 1.875 -16.209 506 H THR 62 H THR 62 -20.512 2.689 -11.114 507 HA THR 62 HA THR 62 -20.106 0.923 -8.879 508 HB THR 62 HB THR 62 -22.711 2.222 -9.768 509 HG1 THR 62 HG1 THR 62 -21.974 4.095 -9.096 510 HG21 THR 62 HG21 THR 62 -22.809 0.711 -7.781 511 HG22 THR 62 HG22 THR 62 -21.510 1.651 -7.015 512 HG23 THR 62 HG23 THR 62 -23.094 2.399 -7.329 513 H VAL 63 H VAL 63 -20.772 -1.148 -8.593 514 HA VAL 63 HA VAL 63 -22.479 -2.416 -10.691 515 HB VAL 63 HB VAL 63 -20.878 -4.260 -10.730 516 HG11 VAL 63 HG11 VAL 63 -19.366 -3.362 -12.375 517 HG12 VAL 63 HG12 VAL 63 -20.936 -2.565 -12.549 518 HG13 VAL 63 HG13 VAL 63 -19.590 -1.719 -11.755 519 HG21 VAL 63 HG21 VAL 63 -18.533 -4.015 -10.105 520 HG22 VAL 63 HG22 VAL 63 -18.843 -2.391 -9.462 521 HG23 VAL 63 HG23 VAL 63 -19.555 -3.819 -8.677 522 H GLU 64 H GLU 64 -23.370 -4.432 -10.143 523 HA GLU 64 HA GLU 64 -23.439 -5.097 -7.230 524 HB2 GLU 64 HB2 GLU 64 -25.630 -4.465 -8.226 525 HB3 GLU 64 HB3 GLU 64 -25.478 -5.791 -9.384 526 HG2 GLU 64 HG2 GLU 64 -25.430 -7.411 -7.496 527 HG3 GLU 64 HG3 GLU 64 -25.483 -6.074 -6.346 528 H VAL 65 H VAL 65 -22.206 -6.865 -6.804 529 HA VAL 65 HA VAL 65 -21.122 -8.452 -9.054 530 HB VAL 65 HB VAL 65 -20.315 -8.482 -6.115 531 HG11 VAL 65 HG11 VAL 65 -18.228 -9.490 -7.085 532 HG12 VAL 65 HG12 VAL 65 -19.656 -10.478 -7.421 533 HG13 VAL 65 HG13 VAL 65 -18.979 -9.436 -8.692 534 HG21 VAL 65 HG21 VAL 65 -18.351 -7.103 -6.840 535 HG22 VAL 65 HG22 VAL 65 -19.136 -6.858 -8.417 536 HG23 VAL 65 HG23 VAL 65 -19.869 -6.215 -6.930 537 H LEU 66 H LEU 66 -22.314 -10.179 -9.568 538 HA LEU 66 HA LEU 66 -24.581 -10.887 -7.912 539 HB2 LEU 66 HB2 LEU 66 -23.598 -12.178 -10.481 540 HB3 LEU 66 HB3 LEU 66 -25.190 -12.357 -9.754 541 HG LEU 66 HG LEU 66 -24.025 -9.836 -11.013 542 HD11 LEU 66 HD11 LEU 66 -24.787 -11.595 -12.570 543 HD12 LEU 66 HD12 LEU 66 -26.386 -11.593 -11.800 544 HD13 LEU 66 HD13 LEU 66 -25.809 -10.148 -12.659 545 HD21 LEU 66 HD21 LEU 66 -26.722 -10.211 -9.635 546 HD22 LEU 66 HD22 LEU 66 -25.409 -9.120 -9.134 547 HD23 LEU 66 HD23 LEU 66 -26.268 -8.816 -10.640 548 H GLY 67 H GLY 67 -21.403 -12.366 -8.579 549 HA2 GLY 67 HA2 GLY 67 -21.160 -14.055 -6.462 550 HA3 GLY 67 HA3 GLY 67 -22.123 -14.987 -7.632 551 H MET 68 H MET 68 -19.883 -16.156 -7.330 552 HA MET 68 HA MET 68 -17.634 -15.219 -8.897 553 HB2 MET 68 HB2 MET 68 -18.458 -18.022 -8.022 554 HB3 MET 68 HB3 MET 68 -16.952 -17.625 -8.843 555 HG2 MET 68 HG2 MET 68 -17.802 -16.563 -6.129 556 HG3 MET 68 HG3 MET 68 -16.647 -17.857 -6.416 557 HE1 MET 68 HE1 MET 68 -14.235 -17.582 -7.352 558 HE2 MET 68 HE2 MET 68 -14.857 -16.831 -8.844 559 HE3 MET 68 HE3 MET 68 -13.559 -16.048 -7.935 560 H ALA 69 H ALA 69 -16.983 -15.872 -10.950 561 HA ALA 69 HA ALA 69 -19.028 -16.351 -12.967 562 HB1 ALA 69 HB1 ALA 69 -16.959 -14.951 -13.269 563 HB2 ALA 69 HB2 ALA 69 -15.993 -16.443 -13.126 564 HB3 ALA 69 HB3 ALA 69 -17.104 -16.217 -14.484 565 HA PRO 70 HA PRO 70 -18.823 -20.833 -13.389 566 HB2 PRO 70 HB2 PRO 70 -17.441 -20.416 -16.043 567 HB3 PRO 70 HB3 PRO 70 -18.764 -21.552 -15.628 568 HG2 PRO 70 HG2 PRO 70 -19.344 -19.235 -16.893 569 HG3 PRO 70 HG3 PRO 70 -20.360 -19.763 -15.510 570 HD2 PRO 70 HD2 PRO 70 -18.124 -17.740 -15.546 571 HD3 PRO 70 HD3 PRO 70 -19.724 -17.623 -14.750 572 H ASP 71 H ASP 71 -17.418 -22.549 -13.021 573 HA ASP 71 HA ASP 71 -14.937 -21.957 -11.857 574 HB2 ASP 71 HB2 ASP 71 -14.687 -24.232 -11.471 575 HB3 ASP 71 HB3 ASP 71 -16.425 -23.991 -11.456 576 H ASP 72 H ASP 72 -15.728 -22.736 -15.206 577 HA ASP 72 HA ASP 72 -13.063 -23.433 -16.066 578 HB2 ASP 72 HB2 ASP 72 -15.069 -24.048 -17.341 579 HB3 ASP 72 HB3 ASP 72 -15.441 -22.343 -17.621 580 H GLU 73 H GLU 73 -14.792 -20.347 -15.691 581 HA GLU 73 HA GLU 73 -12.729 -18.722 -16.975 582 HB2 GLU 73 HB2 GLU 73 -14.834 -17.929 -14.909 583 HB3 GLU 73 HB3 GLU 73 -13.826 -16.839 -15.836 584 HG2 GLU 73 HG2 GLU 73 -15.999 -18.669 -16.918 585 HG3 GLU 73 HG3 GLU 73 -16.073 -16.920 -16.757 586 H CYS 74 H CYS 74 -13.670 -19.748 -13.685 587 HA CYS 74 HA CYS 74 -11.599 -18.286 -12.434 588 HB2 CYS 74 HB2 CYS 74 -13.395 -20.442 -11.282 589 HB3 CYS 74 HB3 CYS 74 -12.418 -19.277 -10.369 590 HG CYS 74 HG CYS 74 -14.986 -18.808 -12.393 591 H LEU 75 H LEU 75 -10.770 -20.645 -14.294 592 HA LEU 75 HA LEU 75 -9.101 -22.306 -12.543 593 HB2 LEU 75 HB2 LEU 75 -9.139 -21.875 -15.562 594 HB3 LEU 75 HB3 LEU 75 -8.021 -22.962 -14.755 595 HG LEU 75 HG LEU 75 -11.040 -23.270 -14.747 596 HD11 LEU 75 HD11 LEU 75 -10.037 -23.682 -16.947 597 HD12 LEU 75 HD12 LEU 75 -8.877 -24.819 -16.223 598 HD13 LEU 75 HD13 LEU 75 -10.616 -25.187 -16.222 599 HD21 LEU 75 HD21 LEU 75 -10.105 -24.250 -12.701 600 HD22 LEU 75 HD22 LEU 75 -10.559 -25.537 -13.808 601 HD23 LEU 75 HD23 LEU 75 -8.848 -25.085 -13.634 602 H LYS 76 H LYS 76 -8.861 -19.076 -13.668 603 HA LYS 76 HA LYS 76 -5.904 -19.079 -13.267 604 HB2 LYS 76 HB2 LYS 76 -5.583 -17.896 -15.339 605 HB3 LYS 76 HB3 LYS 76 -6.434 -19.407 -15.635 606 HG2 LYS 76 HG2 LYS 76 -8.603 -17.797 -15.476 607 HG3 LYS 76 HG3 LYS 76 -7.410 -16.558 -15.844 608 HD2 LYS 76 HD2 LYS 76 -8.270 -17.206 -17.958 609 HD3 LYS 76 HD3 LYS 76 -6.709 -18.010 -17.844 610 HE2 LYS 76 HE2 LYS 76 -8.178 -19.659 -18.705 611 HE3 LYS 76 HE3 LYS 76 -7.961 -20.093 -17.011 612 HZ1 LYS 76 HZ1 LYS 76 -10.128 -18.928 -16.588 613 HZ2 LYS 76 HZ2 LYS 76 -10.294 -18.713 -18.208 614 HZ3 LYS 76 HZ3 LYS 76 -10.295 -20.219 -17.576 615 H ASP 77 H ASP 77 -8.926 -17.346 -12.869 616 HA ASP 77 HA ASP 77 -7.543 -15.354 -11.214 617 HB2 ASP 77 HB2 ASP 77 -7.519 -14.415 -13.582 618 HB3 ASP 77 HB3 ASP 77 -9.272 -14.502 -13.574 619 H MET 78 H MET 78 -9.198 -14.331 -9.763 620 HA MET 78 HA MET 78 -11.597 -16.013 -9.442 621 HB2 MET 78 HB2 MET 78 -10.498 -13.672 -7.845 622 HB3 MET 78 HB3 MET 78 -12.003 -14.505 -7.471 623 HG2 MET 78 HG2 MET 78 -9.243 -15.777 -7.523 624 HG3 MET 78 HG3 MET 78 -10.137 -15.283 -6.098 625 HE1 MET 78 HE1 MET 78 -8.969 -18.184 -8.013 626 HE2 MET 78 HE2 MET 78 -10.332 -19.298 -8.231 627 HE3 MET 78 HE3 MET 78 -10.220 -17.834 -9.228 628 H TYR 79 H TYR 79 -12.531 -15.537 -11.496 629 HA TYR 79 HA TYR 79 -13.350 -12.815 -12.142 630 HB2 TYR 79 HB2 TYR 79 -13.933 -15.569 -13.286 631 HB3 TYR 79 HB3 TYR 79 -14.737 -14.120 -13.868 632 HD1 TYR 79 HD1 TYR 79 -13.308 -12.176 -14.752 633 HD2 TYR 79 HD2 TYR 79 -11.799 -16.180 -14.187 634 HE1 TYR 79 HE1 TYR 79 -11.535 -11.737 -16.423 635 HE2 TYR 79 HE2 TYR 79 -10.065 -15.774 -15.895 636 HH TYR 79 HH TYR 79 -9.124 -14.227 -17.380 637 H VAL 80 H VAL 80 -15.461 -11.998 -11.973 638 HA VAL 80 HA VAL 80 -17.479 -13.612 -10.482 639 HB VAL 80 HB VAL 80 -18.061 -11.472 -9.319 640 HG11 VAL 80 HG11 VAL 80 -16.340 -11.682 -7.583 641 HG12 VAL 80 HG12 VAL 80 -16.879 -13.259 -8.155 642 HG13 VAL 80 HG13 VAL 80 -15.312 -12.618 -8.690 643 HG21 VAL 80 HG21 VAL 80 -16.397 -9.704 -9.052 644 HG22 VAL 80 HG22 VAL 80 -15.283 -10.517 -10.163 645 HG23 VAL 80 HG23 VAL 80 -16.820 -9.853 -10.761 646 H GLU 81 H GLU 81 -19.621 -13.200 -11.020 647 HA GLU 81 HA GLU 81 -20.120 -11.920 -13.655 648 HB2 GLU 81 HB2 GLU 81 -21.950 -13.312 -11.643 649 HB3 GLU 81 HB3 GLU 81 -22.491 -12.560 -13.154 650 HG2 GLU 81 HG2 GLU 81 -20.909 -14.101 -14.394 651 HG3 GLU 81 HG3 GLU 81 -20.616 -14.929 -12.863 652 H VAL 82 H VAL 82 -21.189 -9.929 -13.838 653 HA VAL 82 HA VAL 82 -21.739 -8.447 -11.345 654 HB VAL 82 HB VAL 82 -19.313 -8.351 -11.788 655 HG11 VAL 82 HG11 VAL 82 -18.429 -7.111 -13.745 656 HG12 VAL 82 HG12 VAL 82 -19.172 -8.647 -14.196 657 HG13 VAL 82 HG13 VAL 82 -20.025 -7.111 -14.482 658 HG21 VAL 82 HG21 VAL 82 -20.640 -5.713 -12.382 659 HG22 VAL 82 HG22 VAL 82 -20.444 -6.455 -10.766 660 HG23 VAL 82 HG23 VAL 82 -19.017 -5.973 -11.702 661 H ALA 83 H ALA 83 -23.235 -6.825 -11.619 662 HA ALA 83 HA ALA 83 -24.318 -6.390 -14.375 663 HB1 ALA 83 HB1 ALA 83 -25.900 -7.616 -12.965 664 HB2 ALA 83 HB2 ALA 83 -25.785 -6.354 -11.710 665 HB3 ALA 83 HB3 ALA 83 -26.486 -5.976 -13.300 666 H ASP 84 H ASP 84 -24.601 -4.331 -15.040 667 HA ASP 84 HA ASP 84 -22.930 -2.352 -13.682 668 HB2 ASP 84 HB2 ASP 84 -22.647 -2.828 -16.055 669 HB3 ASP 84 HB3 ASP 84 -24.329 -2.371 -16.365 670 H ILE 85 H ILE 85 -24.658 -2.351 -11.896 671 HA ILE 85 HA ILE 85 -27.092 -0.941 -12.273 672 HB ILE 85 HB ILE 85 -27.114 -0.562 -9.887 673 HG12 ILE 85 HG12 ILE 85 -24.279 -1.624 -9.788 674 HG13 ILE 85 HG13 ILE 85 -24.722 0.065 -9.562 675 HG21 ILE 85 HG21 ILE 85 -27.174 -2.874 -9.211 676 HG22 ILE 85 HG22 ILE 85 -27.645 -2.804 -10.906 677 HG23 ILE 85 HG23 ILE 85 -26.010 -3.345 -10.469 678 HD11 ILE 85 HD11 ILE 85 -24.342 -0.986 -7.402 679 HD12 ILE 85 HD12 ILE 85 -26.054 -0.543 -7.560 680 HD13 ILE 85 HD13 ILE 85 -25.537 -2.235 -7.739 681 H GLY 86 H GLY 86 -23.860 0.297 -12.397 682 HA2 GLY 86 HA2 GLY 86 -24.571 3.083 -11.870 683 HA3 GLY 86 HA3 GLY 86 -23.014 2.421 -12.393 684 H GLY 87 H GLY 87 -25.034 0.995 -14.560 685 HA2 GLY 87 HA2 GLY 87 -25.328 3.289 -16.425 686 HA3 GLY 87 HA3 GLY 87 -24.184 1.999 -16.817 687 H LYS 88 H LYS 88 -24.965 -0.053 -17.448 688 HA LYS 88 HA LYS 88 -27.358 0.072 -18.947 689 HB2 LYS 88 HB2 LYS 88 -25.936 -2.470 -18.037 690 HB3 LYS 88 HB3 LYS 88 -27.056 -2.321 -19.389 691 HG2 LYS 88 HG2 LYS 88 -24.319 -1.032 -19.229 692 HG3 LYS 88 HG3 LYS 88 -24.759 -2.487 -20.122 693 HD2 LYS 88 HD2 LYS 88 -26.346 -1.145 -21.525 694 HD3 LYS 88 HD3 LYS 88 -25.881 0.307 -20.619 695 HE2 LYS 88 HE2 LYS 88 -24.566 0.376 -22.561 696 HE3 LYS 88 HE3 LYS 88 -23.501 -0.128 -21.235 697 HZ1 LYS 88 HZ1 LYS 88 -23.712 -2.418 -22.040 698 HZ2 LYS 88 HZ2 LYS 88 -24.687 -1.932 -23.268 699 HZ3 LYS 88 HZ3 LYS 88 -23.133 -1.450 -23.223 700 H ASP 89 H ASP 89 -26.849 -1.193 -15.726 701 HA ASP 89 HA ASP 89 -28.037 -1.964 -14.075 702 HB2 ASP 89 HB2 ASP 89 -29.013 0.257 -14.222 703 HB3 ASP 89 HB3 ASP 89 -30.253 -0.331 -15.334 704 H ASP 90 H ASP 90 -29.505 -2.736 -17.134 705 HA ASP 90 HA ASP 90 -31.040 -4.995 -15.960 706 HB2 ASP 90 HB2 ASP 90 -32.213 -3.098 -17.107 707 HB3 ASP 90 HB3 ASP 90 -31.313 -3.491 -18.576 708 H ASP 91 H ASP 91 -28.079 -4.728 -17.046 709 HA ASP 91 HA ASP 91 -28.132 -7.298 -18.500 710 HB2 ASP 91 HB2 ASP 91 -27.941 -5.328 -20.149 711 HB3 ASP 91 HB3 ASP 91 -26.331 -5.072 -19.455 712 H VAL 92 H VAL 92 -25.967 -8.267 -18.603 713 HA VAL 92 HA VAL 92 -24.395 -7.776 -16.131 714 HB VAL 92 HB VAL 92 -26.170 -9.327 -15.638 715 HG11 VAL 92 HG11 VAL 92 -26.470 -11.493 -16.769 716 HG12 VAL 92 HG12 VAL 92 -26.785 -10.150 -17.862 717 HG13 VAL 92 HG13 VAL 92 -25.252 -11.044 -17.978 718 HG21 VAL 92 HG21 VAL 92 -24.972 -11.335 -14.928 719 HG22 VAL 92 HG22 VAL 92 -23.585 -10.901 -15.934 720 HG23 VAL 92 HG23 VAL 92 -24.059 -9.870 -14.562 721 H TYR 93 H TYR 93 -22.324 -8.545 -16.133 722 HA TYR 93 HA TYR 93 -21.052 -9.555 -18.611 723 HB2 TYR 93 HB2 TYR 93 -20.152 -7.144 -16.964 724 HB3 TYR 93 HB3 TYR 93 -19.302 -7.820 -18.344 725 HD1 TYR 93 HD1 TYR 93 -20.320 -7.708 -20.648 726 HD2 TYR 93 HD2 TYR 93 -21.969 -5.570 -17.279 727 HE1 TYR 93 HE1 TYR 93 -21.587 -6.261 -22.197 728 HE2 TYR 93 HE2 TYR 93 -23.256 -4.127 -18.818 729 HH TYR 93 HH TYR 93 -23.101 -4.564 -22.402 730 H THR 94 H THR 94 -18.466 -9.587 -17.715 731 HA THR 94 HA THR 94 -18.452 -10.894 -15.051 732 HB THR 94 HB THR 94 -16.825 -11.766 -17.473 733 HG1 THR 94 HG1 THR 94 -19.001 -12.297 -17.733 734 HG21 THR 94 HG21 THR 94 -15.729 -12.301 -15.325 735 HG22 THR 94 HG22 THR 94 -17.221 -13.078 -14.749 736 HG23 THR 94 HG23 THR 94 -16.317 -13.769 -16.114 737 H ALA 95 H ALA 95 -16.593 -10.339 -13.814 738 HA ALA 95 HA ALA 95 -14.663 -8.410 -14.984 739 HB1 ALA 95 HB1 ALA 95 -14.831 -7.054 -12.869 740 HB2 ALA 95 HB2 ALA 95 -16.279 -6.990 -13.867 741 HB3 ALA 95 HB3 ALA 95 -16.255 -8.012 -12.409 742 H LYS 96 H LYS 96 -12.758 -8.187 -13.713 743 HA LYS 96 HA LYS 96 -11.850 -10.705 -12.454 744 HB2 LYS 96 HB2 LYS 96 -10.377 -8.059 -12.793 745 HB3 LYS 96 HB3 LYS 96 -9.668 -9.617 -12.453 746 HG2 LYS 96 HG2 LYS 96 -9.664 -10.294 -14.627 747 HG3 LYS 96 HG3 LYS 96 -11.189 -9.533 -15.038 748 HD2 LYS 96 HD2 LYS 96 -8.564 -8.049 -14.678 749 HD3 LYS 96 HD3 LYS 96 -9.266 -8.526 -16.231 750 HE2 LYS 96 HE2 LYS 96 -11.232 -7.070 -15.859 751 HE3 LYS 96 HE3 LYS 96 -10.668 -6.685 -14.238 752 HZ1 LYS 96 HZ1 LYS 96 -9.963 -4.896 -15.429 753 HZ2 LYS 96 HZ2 LYS 96 -8.605 -5.784 -15.421 754 HZ3 LYS 96 HZ3 LYS 96 -9.526 -5.760 -16.773 755 H LEU 97 H LEU 97 -12.056 -10.926 -10.175 756 HA LEU 97 HA LEU 97 -13.254 -8.877 -8.630 757 HB2 LEU 97 HB2 LEU 97 -13.322 -11.257 -8.063 758 HB3 LEU 97 HB3 LEU 97 -11.577 -11.268 -7.789 759 HG LEU 97 HG LEU 97 -11.871 -9.764 -5.839 760 HD11 LEU 97 HD11 LEU 97 -13.908 -8.535 -6.459 761 HD12 LEU 97 HD12 LEU 97 -14.856 -10.039 -6.447 762 HD13 LEU 97 HD13 LEU 97 -14.182 -9.386 -4.942 763 HD21 LEU 97 HD21 LEU 97 -11.894 -12.244 -5.643 764 HD22 LEU 97 HD22 LEU 97 -12.843 -11.460 -4.384 765 HD23 LEU 97 HD23 LEU 97 -13.668 -12.222 -5.764 766 H SER 98 H SER 98 -9.844 -9.425 -9.442 767 HA SER 98 HA SER 98 -8.603 -7.855 -7.413 768 HB2 SER 98 HB2 SER 98 -6.820 -7.752 -9.334 769 HB3 SER 98 HB3 SER 98 -7.203 -9.297 -8.561 770 HG SER 98 HG SER 98 -7.197 -9.408 -10.875 771 H ASP 99 H ASP 99 -10.528 -6.935 -10.207 772 HA ASP 99 HA ASP 99 -9.316 -4.241 -10.269 773 HB2 ASP 99 HB2 ASP 99 -9.514 -5.809 -12.317 774 HB3 ASP 99 HB3 ASP 99 -11.239 -5.446 -12.282 775 H ILE 100 H ILE 100 -11.475 -5.560 -8.464 776 HA ILE 100 HA ILE 100 -13.460 -3.342 -8.576 777 HB ILE 100 HB ILE 100 -13.759 -6.295 -8.382 778 HG12 ILE 100 HG12 ILE 100 -15.645 -4.071 -9.259 779 HG13 ILE 100 HG13 ILE 100 -14.437 -4.832 -10.315 780 HG21 ILE 100 HG21 ILE 100 -15.720 -4.595 -6.802 781 HG22 ILE 100 HG22 ILE 100 -15.823 -6.338 -7.121 782 HG23 ILE 100 HG23 ILE 100 -14.539 -5.731 -6.101 783 HD11 ILE 100 HD11 ILE 100 -16.887 -6.122 -9.083 784 HD12 ILE 100 HD12 ILE 100 -16.561 -5.810 -10.793 785 HD13 ILE 100 HD13 ILE 100 -15.605 -7.035 -9.926 786 H GLU 101 H GLU 101 -14.233 -2.604 -6.704 787 HA GLU 101 HA GLU 101 -12.716 -3.121 -4.186 788 HB2 GLU 101 HB2 GLU 101 -12.154 -0.928 -5.077 789 HB3 GLU 101 HB3 GLU 101 -13.866 -0.537 -5.327 790 HG2 GLU 101 HG2 GLU 101 -14.289 -0.467 -2.952 791 HG3 GLU 101 HG3 GLU 101 -12.713 -1.174 -2.592 792 H ALA 102 H ALA 102 -14.053 -4.111 -2.751 793 HA ALA 102 HA ALA 102 -16.880 -4.427 -3.383 794 HB1 ALA 102 HB1 ALA 102 -16.885 -5.891 -1.439 795 HB2 ALA 102 HB2 ALA 102 -15.467 -6.240 -2.445 796 HB3 ALA 102 HB3 ALA 102 -15.280 -5.315 -0.936 797 H ILE 103 H ILE 103 -18.574 -3.473 -2.395 798 HA ILE 103 HA ILE 103 -18.129 -1.515 -0.187 799 HB ILE 103 HB ILE 103 -19.650 -1.251 -2.794 800 HG12 ILE 103 HG12 ILE 103 -17.516 0.551 -1.563 801 HG13 ILE 103 HG13 ILE 103 -17.180 -0.698 -2.758 802 HG21 ILE 103 HG21 ILE 103 -20.523 0.925 -2.027 803 HG22 ILE 103 HG22 ILE 103 -21.111 -0.364 -1.002 804 HG23 ILE 103 HG23 ILE 103 -19.781 0.673 -0.430 805 HD11 ILE 103 HD11 ILE 103 -18.679 0.408 -4.376 806 HD12 ILE 103 HD12 ILE 103 -18.870 1.768 -3.237 807 HD13 ILE 103 HD13 ILE 103 -17.273 1.382 -3.889 808 H ASP 104 H ASP 104 -19.692 -1.515 1.387 809 HA ASP 104 HA ASP 104 -21.296 -2.255 2.734 810 HB2 ASP 104 HB2 ASP 104 -22.628 -1.093 0.994 811 HB3 ASP 104 HB3 ASP 104 -22.930 -2.643 0.210 812 H VAL 105 H VAL 105 -19.413 -4.314 1.692 813 HA VAL 105 HA VAL 105 -20.908 -6.827 1.773 814 HB VAL 105 HB VAL 105 -18.490 -7.750 1.907 815 HG11 VAL 105 HG11 VAL 105 -19.430 -6.199 -0.517 816 HG12 VAL 105 HG12 VAL 105 -18.231 -7.521 -0.507 817 HG13 VAL 105 HG13 VAL 105 -19.898 -7.851 -0.027 818 HG21 VAL 105 HG21 VAL 105 -16.680 -6.405 1.191 819 HG22 VAL 105 HG22 VAL 105 -17.705 -4.976 0.938 820 HG23 VAL 105 HG23 VAL 105 -17.404 -5.588 2.585 821 H ASP 106 H ASP 106 -20.223 -8.526 3.268 822 HA ASP 106 HA ASP 106 -20.328 -7.697 6.087 823 HB2 ASP 106 HB2 ASP 106 -21.441 -9.778 5.330 824 HB3 ASP 106 HB3 ASP 106 -19.877 -10.410 4.788 825 H ASP 107 H ASP 107 -18.579 -8.314 7.575 826 HA ASP 107 HA ASP 107 -15.991 -7.395 6.789 827 HB2 ASP 107 HB2 ASP 107 -16.792 -7.316 9.099 828 HB3 ASP 107 HB3 ASP 107 -16.882 -9.079 9.159 829 H ASP 108 H ASP 108 -17.261 -10.794 7.098 830 HA ASP 108 HA ASP 108 -14.597 -11.857 6.659 831 HB2 ASP 108 HB2 ASP 108 -16.577 -12.972 7.881 832 HB3 ASP 108 HB3 ASP 108 -17.196 -13.368 6.270 833 H THR 109 H THR 109 -17.209 -10.803 4.615 834 HA THR 109 HA THR 109 -16.355 -12.162 2.167 835 HB THR 109 HB THR 109 -18.274 -9.888 2.817 836 HG1 THR 109 HG1 THR 109 -18.699 -12.135 3.422 837 HG21 THR 109 HG21 THR 109 -17.548 -9.631 0.444 838 HG22 THR 109 HG22 THR 109 -18.033 -11.309 0.149 839 HG23 THR 109 HG23 THR 109 -19.251 -10.119 0.620 840 H GLN 110 H GLN 110 -16.093 -8.803 3.567 841 HA GLN 110 HA GLN 110 -14.458 -7.765 1.532 842 HB2 GLN 110 HB2 GLN 110 -15.656 -6.657 3.615 843 HB3 GLN 110 HB3 GLN 110 -14.138 -6.946 4.442 844 HG2 GLN 110 HG2 GLN 110 -14.498 -5.366 1.847 845 HG3 GLN 110 HG3 GLN 110 -14.353 -4.660 3.448 846 HE21 GLN 110 HE22 GLN 110 -12.574 -5.482 0.674 847 HE22 GLN 110 HE21 GLN 110 -10.984 -5.486 1.386 848 H GLU 111 H GLU 111 -13.534 -9.433 4.608 849 HA GLU 111 HA GLU 111 -10.746 -9.190 4.248 850 HB2 GLU 111 HB2 GLU 111 -12.479 -11.172 5.765 851 HB3 GLU 111 HB3 GLU 111 -10.721 -11.229 5.833 852 HG2 GLU 111 HG2 GLU 111 -12.289 -8.705 6.555 853 HG3 GLU 111 HG3 GLU 111 -11.909 -9.970 7.714 854 H ALA 112 H ALA 112 -13.008 -11.700 2.967 855 HA ALA 112 HA ALA 112 -10.907 -13.425 2.026 856 HB1 ALA 112 HB1 ALA 112 -13.257 -14.155 2.318 857 HB2 ALA 112 HB2 ALA 112 -13.755 -13.098 0.973 858 HB3 ALA 112 HB3 ALA 112 -12.658 -14.467 0.682 859 H ILE 113 H ILE 113 -12.752 -10.737 0.514 860 HA ILE 113 HA ILE 113 -11.509 -10.924 -2.060 861 HB ILE 113 HB ILE 113 -12.868 -8.615 -0.606 862 HG12 ILE 113 HG12 ILE 113 -13.969 -10.444 -2.790 863 HG13 ILE 113 HG13 ILE 113 -14.226 -10.742 -1.090 864 HG21 ILE 113 HG21 ILE 113 -13.148 -7.581 -2.863 865 HG22 ILE 113 HG22 ILE 113 -11.458 -7.698 -2.398 866 HG23 ILE 113 HG23 ILE 113 -12.129 -8.861 -3.556 867 HD11 ILE 113 HD11 ILE 113 -15.260 -8.403 -2.693 868 HD12 ILE 113 HD12 ILE 113 -16.172 -9.674 -1.864 869 HD13 ILE 113 HD13 ILE 113 -15.302 -8.457 -0.908 870 H ALA 114 H ALA 114 -10.716 -9.043 0.905 871 HA ALA 114 HA ALA 114 -8.488 -7.643 -0.135 872 HB1 ALA 114 HB1 ALA 114 -8.966 -8.605 2.718 873 HB2 ALA 114 HB2 ALA 114 -7.860 -7.319 2.205 874 HB3 ALA 114 HB3 ALA 114 -9.610 -7.103 2.017 875 H ASP 115 H ASP 115 -8.717 -10.914 1.368 876 HA ASP 115 HA ASP 115 -5.885 -11.349 1.407 877 HB2 ASP 115 HB2 ASP 115 -7.472 -12.613 2.794 878 HB3 ASP 115 HB3 ASP 115 -8.153 -13.367 1.346 879 H TRP 116 H TRP 116 -8.412 -12.159 -1.021 880 HA TRP 116 HA TRP 116 -6.708 -13.419 -2.930 881 HB2 TRP 116 HB2 TRP 116 -8.925 -13.684 -3.461 882 HB3 TRP 116 HB3 TRP 116 -9.383 -12.084 -2.909 883 HD1 TRP 116 HD1 TRP 116 -9.636 -10.213 -4.595 884 HE1 TRP 116 HE1 TRP 116 -9.297 -9.935 -7.113 885 HE3 TRP 116 HE3 TRP 116 -7.404 -14.680 -5.629 886 HZ2 TRP 116 HZ2 TRP 116 -8.137 -11.431 -9.312 887 HZ3 TRP 116 HZ3 TRP 116 -6.562 -15.177 -7.917 888 HH2 TRP 116 HH2 TRP 116 -6.911 -13.545 -9.753 889 H LEU 117 H LEU 117 -7.521 -9.937 -2.423 890 HA LEU 117 HA LEU 117 -5.920 -8.970 -4.573 891 HB2 LEU 117 HB2 LEU 117 -6.862 -7.721 -1.966 892 HB3 LEU 117 HB3 LEU 117 -5.872 -6.829 -3.101 893 HG LEU 117 HG LEU 117 -8.468 -8.140 -3.996 894 HD11 LEU 117 HD11 LEU 117 -9.046 -6.697 -2.112 895 HD12 LEU 117 HD12 LEU 117 -8.121 -5.351 -2.816 896 HD13 LEU 117 HD13 LEU 117 -9.583 -5.964 -3.627 897 HD21 LEU 117 HD21 LEU 117 -6.938 -7.376 -5.781 898 HD22 LEU 117 HD22 LEU 117 -8.385 -6.352 -5.712 899 HD23 LEU 117 HD23 LEU 117 -6.854 -5.767 -5.039 900 H TYR 118 H TYR 118 -5.093 -9.525 -1.077 901 HA TYR 118 HA TYR 118 -2.467 -8.498 -1.240 902 HB2 TYR 118 HB2 TYR 118 -3.552 -10.669 0.589 903 HB3 TYR 118 HB3 TYR 118 -2.034 -9.827 0.816 904 HD1 TYR 118 HD2 TYR 118 -3.213 -6.949 0.068 905 HD2 TYR 118 HD1 TYR 118 -4.387 -10.111 2.771 906 HE1 TYR 118 HE2 TYR 118 -4.342 -5.300 1.498 907 HE2 TYR 118 HE1 TYR 118 -5.528 -8.456 4.209 908 HH TYR 118 HH TYR 118 -5.589 -4.943 3.435 909 H TRP 119 H TRP 119 -3.634 -11.867 -1.836 910 HA TRP 119 HA TRP 119 -1.147 -13.117 -2.358 911 HB2 TRP 119 HB2 TRP 119 -3.096 -14.452 -2.253 912 HB3 TRP 119 HB3 TRP 119 -4.021 -13.413 -3.311 913 HD1 TRP 119 HD1 TRP 119 -0.725 -14.277 -4.688 914 HE1 TRP 119 HE1 TRP 119 -0.812 -16.114 -6.442 915 HE3 TRP 119 HE3 TRP 119 -5.673 -15.245 -4.447 916 HZ2 TRP 119 HZ2 TRP 119 -2.783 -18.075 -7.302 917 HZ3 TRP 119 HZ3 TRP 119 -6.699 -16.972 -5.912 918 HH2 TRP 119 HH2 TRP 119 -5.274 -18.436 -7.305 919 H LEU 120 H LEU 120 -3.409 -11.663 -4.660 920 HA LEU 120 HA LEU 120 -1.632 -11.976 -6.773 921 HB2 LEU 120 HB2 LEU 120 -4.225 -11.474 -6.729 922 HB3 LEU 120 HB3 LEU 120 -3.734 -9.780 -6.777 923 HG LEU 120 HG LEU 120 -2.368 -10.367 -8.881 924 HD11 LEU 120 HD11 LEU 120 -2.191 -12.831 -8.535 925 HD12 LEU 120 HD12 LEU 120 -3.951 -12.973 -8.643 926 HD13 LEU 120 HD13 LEU 120 -3.006 -12.466 -10.062 927 HD21 LEU 120 HD21 LEU 120 -4.542 -9.256 -8.995 928 HD22 LEU 120 HD22 LEU 120 -4.359 -10.395 -10.340 929 HD23 LEU 120 HD23 LEU 120 -5.377 -10.828 -8.945 930 H ALA 121 H ALA 121 -1.965 -9.260 -4.578 931 HA ALA 121 HA ALA 121 -0.251 -7.455 -5.940 932 HB1 ALA 121 HB1 ALA 121 -1.020 -7.778 -3.000 933 HB2 ALA 121 HB2 ALA 121 -0.257 -6.317 -3.686 934 HB3 ALA 121 HB3 ALA 121 -1.889 -6.813 -4.204 935 H ARG 122 H ARG 122 0.437 -10.111 -3.648 936 HA ARG 122 HA ARG 122 3.296 -9.522 -3.384 937 HB2 ARG 122 HB2 ARG 122 2.218 -10.757 -1.719 938 HB3 ARG 122 HB3 ARG 122 1.597 -11.963 -2.846 939 HG2 ARG 122 HG2 ARG 122 3.662 -13.005 -3.139 940 HG3 ARG 122 HG3 ARG 122 4.585 -11.565 -2.677 941 HD2 ARG 122 HD2 ARG 122 4.676 -13.261 -0.922 942 HD3 ARG 122 HD3 ARG 122 3.908 -11.753 -0.395 943 HE ARG 122 HE ARG 122 1.708 -12.858 -0.751 944 HH11 ARG 122 HH11 ARG 122 4.518 -14.989 -0.007 945 HH12 ARG 122 HH12 ARG 122 3.490 -16.234 0.640 946 HH21 ARG 122 HH21 ARG 122 0.446 -14.527 0.132 947 HH22 ARG 122 HH22 ARG 122 1.201 -15.947 0.780 948 H GLY 123 H GLY 123 1.136 -11.292 -5.560 949 HA2 GLY 123 HA2 GLY 123 2.183 -11.079 -7.923 950 HA3 GLY 123 HA3 GLY 123 3.366 -12.232 -7.292 951 H TYR 124 H TYR 124 1.874 -12.793 -9.440 952 HA TYR 124 HA TYR 124 -0.172 -14.798 -8.672 953 HB2 TYR 124 HB2 TYR 124 -0.515 -13.279 -10.651 954 HB3 TYR 124 HB3 TYR 124 0.851 -14.058 -11.440 955 HD1 TYR 124 HD2 TYR 124 -2.312 -15.063 -9.600 956 HD2 TYR 124 HD1 TYR 124 0.245 -15.723 -13.022 957 HE1 TYR 124 HE2 TYR 124 -3.782 -16.894 -10.336 958 HE2 TYR 124 HE1 TYR 124 -1.184 -17.617 -13.721 959 HH TYR 124 HH TYR 124 -3.041 -18.906 -13.229 960 H LYS 125 H LYS 125 0.772 -16.590 -10.904 961 HA LYS 125 HA LYS 125 1.840 -18.602 -10.979 962 HB2 LYS 125 HB2 LYS 125 4.253 -16.848 -10.385 963 HB3 LYS 125 HB3 LYS 125 4.295 -18.453 -11.102 964 HG2 LYS 125 HG2 LYS 125 3.007 -15.992 -12.367 965 HG3 LYS 125 HG3 LYS 125 4.593 -16.657 -12.753 966 HD2 LYS 125 HD2 LYS 125 3.509 -18.795 -13.476 967 HD3 LYS 125 HD3 LYS 125 1.916 -18.052 -13.202 968 HE2 LYS 125 HE2 LYS 125 2.457 -16.269 -14.835 969 HE3 LYS 125 HE3 LYS 125 4.060 -16.968 -15.084 970 HZ1 LYS 125 HZ1 LYS 125 2.530 -17.639 -16.817 971 HZ2 LYS 125 HZ2 LYS 125 2.994 -18.952 -15.977 972 HZ3 LYS 125 HZ3 LYS 125 1.505 -18.315 -15.749 973 H PHE 126 H PHE 126 0.510 -18.794 -8.884 974 HA PHE 126 HA PHE 126 1.612 -18.981 -6.330 975 HB2 PHE 126 HB2 PHE 126 -0.819 -19.230 -7.099 976 HB3 PHE 126 HB3 PHE 126 -0.449 -20.907 -7.475 977 HD1 PHE 126 HD2 PHE 126 0.372 -22.425 -5.533 978 HD2 PHE 126 HD1 PHE 126 -1.314 -18.506 -4.882 979 HE1 PHE 126 HE2 PHE 126 0.002 -22.972 -3.142 980 HE2 PHE 126 HE1 PHE 126 -1.668 -19.055 -2.494 981 HZ PHE 126 HZ PHE 126 -0.994 -21.279 -1.615 Start of MODEL 3 1 H1 MET 1 H1 MET 1 8.118 -4.514 -4.684 2 H2 MET 1 H2 MET 1 7.936 -3.079 -3.925 3 H3 MET 1 H3 MET 1 9.316 -3.947 -3.721 4 HA MET 1 HA MET 1 8.117 -5.704 -2.625 5 HB2 MET 1 HB2 MET 1 9.093 -3.737 -1.321 6 HB3 MET 1 HB3 MET 1 7.464 -3.045 -1.282 7 HG2 MET 1 HG2 MET 1 6.670 -5.153 -0.176 8 HG3 MET 1 HG3 MET 1 8.330 -5.750 -0.184 9 HE1 MET 1 HE1 MET 1 6.487 -5.769 2.326 10 HE2 MET 1 HE2 MET 1 8.175 -6.321 2.351 11 HE3 MET 1 HE3 MET 1 7.596 -5.184 3.588 12 H ALA 2 H ALA 2 6.199 -6.792 -2.415 13 HA ALA 2 HA ALA 2 3.820 -5.768 -3.772 14 HB1 ALA 2 HB1 ALA 2 2.907 -7.964 -3.245 15 HB2 ALA 2 HB2 ALA 2 4.539 -8.144 -3.902 16 HB3 ALA 2 HB3 ALA 2 4.262 -8.314 -2.153 17 H SER 3 H SER 3 5.031 -5.861 -0.512 18 HA SER 3 HA SER 3 4.408 -4.901 1.391 19 HB2 SER 3 HB2 SER 3 1.869 -3.859 0.093 20 HB3 SER 3 HB3 SER 3 2.581 -3.355 1.630 21 HG SER 3 HG SER 3 3.103 -1.930 -0.092 22 H VAL 4 H VAL 4 3.666 -7.602 0.333 23 HA VAL 4 HA VAL 4 1.884 -8.384 2.562 24 HB VAL 4 HB VAL 4 0.592 -9.897 1.047 25 HG11 VAL 4 HG11 VAL 4 -0.371 -7.733 1.773 26 HG12 VAL 4 HG12 VAL 4 0.255 -6.970 0.293 27 HG13 VAL 4 HG13 VAL 4 -0.954 -8.257 0.186 28 HG21 VAL 4 HG21 VAL 4 2.232 -9.900 -0.872 29 HG22 VAL 4 HG22 VAL 4 0.557 -9.582 -1.332 30 HG23 VAL 4 HG23 VAL 4 1.707 -8.243 -1.251 31 H GLU 5 H GLU 5 4.799 -8.825 0.972 32 HA GLU 5 HA GLU 5 4.986 -11.733 1.288 33 HB2 GLU 5 HB2 GLU 5 7.238 -11.464 0.461 34 HB3 GLU 5 HB3 GLU 5 6.089 -10.703 -0.613 35 HG2 GLU 5 HG2 GLU 5 7.513 -8.997 1.456 36 HG3 GLU 5 HG3 GLU 5 8.384 -9.550 0.033 37 H ARG 6 H ARG 6 7.463 -12.110 2.334 38 HA ARG 6 HA ARG 6 8.375 -12.671 4.280 39 HB2 ARG 6 HB2 ARG 6 9.148 -10.347 3.535 40 HB3 ARG 6 HB3 ARG 6 8.236 -9.705 4.903 41 HG2 ARG 6 HG2 ARG 6 9.648 -10.902 6.480 42 HG3 ARG 6 HG3 ARG 6 10.352 -11.896 5.184 43 HD2 ARG 6 HD2 ARG 6 11.324 -9.917 4.139 44 HD3 ARG 6 HD3 ARG 6 10.648 -8.871 5.389 45 HE ARG 6 HE ARG 6 12.974 -10.646 5.565 46 HH11 ARG 6 HH11 ARG 6 10.636 -8.766 7.469 47 HH12 ARG 6 HH12 ARG 6 11.629 -8.691 8.876 48 HH21 ARG 6 HH21 ARG 6 14.294 -10.547 7.439 49 HH22 ARG 6 HH22 ARG 6 13.756 -9.726 8.854 50 H ASP 7 H ASP 7 5.688 -13.207 4.438 51 HA ASP 7 HA ASP 7 5.488 -13.433 7.343 52 HB2 ASP 7 HB2 ASP 7 4.077 -11.478 7.052 53 HB3 ASP 7 HB3 ASP 7 3.219 -12.239 5.706 54 H GLU 8 H GLU 8 5.844 -15.596 7.186 55 HA GLU 8 HA GLU 8 4.951 -17.251 5.052 56 HB2 GLU 8 HB2 GLU 8 5.753 -19.098 6.410 57 HB3 GLU 8 HB3 GLU 8 6.904 -17.764 6.378 58 HG2 GLU 8 HG2 GLU 8 6.106 -17.041 8.644 59 HG3 GLU 8 HG3 GLU 8 4.984 -18.402 8.666 60 H THR 9 H THR 9 3.177 -16.075 7.842 61 HA THR 9 HA THR 9 1.465 -18.239 8.335 62 HB THR 9 HB THR 9 0.564 -15.352 8.367 63 HG1 THR 9 HG1 THR 9 2.414 -15.125 9.301 64 HG21 THR 9 HG21 THR 9 0.040 -17.711 10.231 65 HG22 THR 9 HG22 THR 9 -0.562 -16.053 10.470 66 HG23 THR 9 HG23 THR 9 -1.109 -16.996 9.079 67 H ARG 10 H ARG 10 1.287 -15.774 5.747 68 HA ARG 10 HA ARG 10 -1.304 -16.484 4.813 69 HB2 ARG 10 HB2 ARG 10 0.945 -15.468 3.027 70 HB3 ARG 10 HB3 ARG 10 -0.789 -15.267 2.800 71 HG2 ARG 10 HG2 ARG 10 0.951 -13.961 4.925 72 HG3 ARG 10 HG3 ARG 10 0.261 -13.169 3.520 73 HD2 ARG 10 HD2 ARG 10 -1.835 -12.977 4.445 74 HD3 ARG 10 HD3 ARG 10 -1.700 -14.466 5.393 75 HE ARG 10 HE ARG 10 0.199 -12.812 6.516 76 HH11 ARG 10 HH11 ARG 10 -3.335 -12.559 6.137 77 HH12 ARG 10 HH12 ARG 10 -3.532 -11.698 7.619 78 HH21 ARG 10 HH21 ARG 10 -0.021 -11.804 8.335 79 HH22 ARG 10 HH22 ARG 10 -1.553 -11.207 8.948 80 H GLU 11 H GLU 11 1.925 -17.750 3.919 81 HA GLU 11 HA GLU 11 0.907 -19.507 1.868 82 HB2 GLU 11 HB2 GLU 11 3.551 -19.293 3.347 83 HB3 GLU 11 HB3 GLU 11 3.210 -20.611 2.212 84 HG2 GLU 11 HG2 GLU 11 2.707 -19.008 0.425 85 HG3 GLU 11 HG3 GLU 11 2.978 -17.660 1.532 86 H HIS 12 H HIS 12 1.569 -19.854 5.383 87 HA HIS 12 HA HIS 12 1.155 -22.711 5.425 88 HB2 HIS 12 HB2 HIS 12 0.937 -20.551 7.564 89 HB3 HIS 12 HB3 HIS 12 0.619 -22.252 7.884 90 HD1 HIS 12 HD1 HIS 12 2.707 -22.795 9.386 91 HD2 HIS 12 HD2 HIS 12 3.588 -21.003 5.684 92 HE1 HIS 12 HE1 HIS 12 5.233 -22.926 9.113 93 H ARG 13 H ARG 13 -1.065 -19.930 6.075 94 HA ARG 13 HA ARG 13 -3.268 -21.716 6.639 95 HB2 ARG 13 HB2 ARG 13 -3.296 -18.739 5.957 96 HB3 ARG 13 HB3 ARG 13 -4.685 -19.675 6.495 97 HG2 ARG 13 HG2 ARG 13 -2.278 -18.835 8.103 98 HG3 ARG 13 HG3 ARG 13 -3.989 -18.570 8.409 99 HD2 ARG 13 HD2 ARG 13 -4.083 -21.191 8.688 100 HD3 ARG 13 HD3 ARG 13 -2.329 -21.072 8.806 101 HE ARG 13 HE ARG 13 -2.493 -19.993 10.850 102 HH11 ARG 13 HH11 ARG 13 -5.785 -20.563 9.533 103 HH12 ARG 13 HH12 ARG 13 -6.563 -20.107 11.009 104 HH21 ARG 13 HH21 ARG 13 -3.574 -19.443 12.794 105 HH22 ARG 13 HH22 ARG 13 -5.292 -19.494 12.895 106 H ILE 14 H ILE 14 -2.439 -19.908 3.622 107 HA ILE 14 HA ILE 14 -4.772 -20.718 2.291 108 HB ILE 14 HB ILE 14 -3.197 -18.995 1.446 109 HG12 ILE 14 HG12 ILE 14 -4.155 -21.213 -0.386 110 HG13 ILE 14 HG13 ILE 14 -4.963 -19.712 0.030 111 HG21 ILE 14 HG21 ILE 14 -1.101 -20.389 1.741 112 HG22 ILE 14 HG22 ILE 14 -1.522 -21.229 0.242 113 HG23 ILE 14 HG23 ILE 14 -1.211 -19.478 0.245 114 HD11 ILE 14 HD11 ILE 14 -3.197 -18.438 -1.184 115 HD12 ILE 14 HD12 ILE 14 -2.475 -19.984 -1.707 116 HD13 ILE 14 HD13 ILE 14 -4.098 -19.563 -2.220 117 H GLU 15 H GLU 15 -1.576 -22.374 2.513 118 HA GLU 15 HA GLU 15 -2.193 -24.578 0.888 119 HB2 GLU 15 HB2 GLU 15 0.061 -23.877 1.579 120 HB3 GLU 15 HB3 GLU 15 -0.300 -24.313 3.251 121 HG2 GLU 15 HG2 GLU 15 1.045 -26.040 2.219 122 HG3 GLU 15 HG3 GLU 15 -0.548 -26.666 2.628 123 H THR 16 H THR 16 -2.697 -24.114 4.431 124 HA THR 16 HA THR 16 -3.521 -26.934 4.647 125 HB THR 16 HB THR 16 -3.661 -26.386 7.090 126 HG1 THR 16 HG1 THR 16 -2.385 -23.967 6.354 127 HG21 THR 16 HG21 THR 16 -1.231 -26.238 7.413 128 HG22 THR 16 HG22 THR 16 -1.633 -27.364 6.108 129 HG23 THR 16 HG23 THR 16 -1.010 -25.749 5.718 130 H GLU 17 H GLU 17 -5.245 -24.032 3.970 131 HA GLU 17 HA GLU 17 -7.755 -25.296 5.023 132 HB2 GLU 17 HB2 GLU 17 -7.122 -22.324 4.969 133 HB3 GLU 17 HB3 GLU 17 -8.536 -23.124 5.649 134 HG2 GLU 17 HG2 GLU 17 -6.946 -24.348 7.235 135 HG3 GLU 17 HG3 GLU 17 -5.669 -23.276 6.655 136 H ILE 18 H ILE 18 -6.421 -23.143 2.439 137 HA ILE 18 HA ILE 18 -9.110 -23.007 1.241 138 HB ILE 18 HB ILE 18 -6.493 -21.586 0.634 139 HG12 ILE 18 HG12 ILE 18 -9.123 -20.632 1.875 140 HG13 ILE 18 HG13 ILE 18 -7.664 -20.999 2.787 141 HG21 ILE 18 HG21 ILE 18 -9.228 -21.185 -0.634 142 HG22 ILE 18 HG22 ILE 18 -7.821 -20.123 -0.888 143 HG23 ILE 18 HG23 ILE 18 -7.800 -21.774 -1.466 144 HD11 ILE 18 HD11 ILE 18 -6.461 -19.158 1.663 145 HD12 ILE 18 HD12 ILE 18 -7.956 -18.719 0.801 146 HD13 ILE 18 HD13 ILE 18 -7.886 -18.621 2.563 147 H ILE 19 H ILE 19 -5.931 -24.447 0.555 148 HA ILE 19 HA ILE 19 -7.085 -25.755 -1.874 149 HB ILE 19 HB ILE 19 -4.951 -25.393 -2.965 150 HG12 ILE 19 HG12 ILE 19 -4.118 -24.242 -0.315 151 HG13 ILE 19 HG13 ILE 19 -3.354 -25.509 -1.232 152 HG21 ILE 19 HG21 ILE 19 -5.202 -23.089 -3.472 153 HG22 ILE 19 HG22 ILE 19 -6.814 -23.663 -3.044 154 HG23 ILE 19 HG23 ILE 19 -5.860 -22.718 -1.875 155 HD11 ILE 19 HD11 ILE 19 -2.595 -23.832 -2.878 156 HD12 ILE 19 HD12 ILE 19 -3.372 -22.549 -1.933 157 HD13 ILE 19 HD13 ILE 19 -2.036 -23.465 -1.228 158 H VAL 20 H VAL 20 -6.403 -26.648 1.096 159 HA VAL 20 HA VAL 20 -4.290 -28.448 1.017 160 HB VAL 20 HB VAL 20 -5.590 -27.517 2.940 161 HG11 VAL 20 HG11 VAL 20 -7.454 -28.669 3.920 162 HG12 VAL 20 HG12 VAL 20 -7.884 -28.108 2.302 163 HG13 VAL 20 HG13 VAL 20 -7.510 -29.827 2.581 164 HG21 VAL 20 HG21 VAL 20 -5.121 -29.372 4.456 165 HG22 VAL 20 HG22 VAL 20 -5.049 -30.503 3.086 166 HG23 VAL 20 HG23 VAL 20 -3.835 -29.213 3.248 167 H ASP 21 H ASP 21 -7.597 -28.890 -0.020 168 HA ASP 21 HA ASP 21 -7.431 -31.760 -0.434 169 HB2 ASP 21 HB2 ASP 21 -9.479 -30.513 0.269 170 HB3 ASP 21 HB3 ASP 21 -9.528 -29.740 -1.316 171 H ALA 22 H ALA 22 -5.913 -29.413 -2.201 172 HA ALA 22 HA ALA 22 -6.450 -30.666 -4.857 173 HB1 ALA 22 HB1 ALA 22 -6.395 -27.722 -4.050 174 HB2 ALA 22 HB2 ALA 22 -6.291 -28.293 -5.727 175 HB3 ALA 22 HB3 ALA 22 -7.744 -28.625 -4.763 176 H GLU 23 H GLU 23 -4.691 -30.581 -6.325 177 HA GLU 23 HA GLU 23 -2.017 -30.007 -5.111 178 HB2 GLU 23 HB2 GLU 23 -2.963 -32.520 -6.545 179 HB3 GLU 23 HB3 GLU 23 -1.293 -32.186 -6.071 180 HG2 GLU 23 HG2 GLU 23 -2.022 -32.036 -3.681 181 HG3 GLU 23 HG3 GLU 23 -3.650 -32.517 -4.171 182 H ASP 24 H ASP 24 -4.005 -29.294 -7.755 183 HA ASP 24 HA ASP 24 -1.661 -28.626 -9.478 184 HB2 ASP 24 HB2 ASP 24 -2.744 -30.634 -10.402 185 HB3 ASP 24 HB3 ASP 24 -4.330 -29.862 -10.285 186 H LYS 25 H LYS 25 -1.975 -26.673 -10.683 187 HA LYS 25 HA LYS 25 -3.189 -24.598 -9.349 188 HB2 LYS 25 HB2 LYS 25 -2.803 -23.257 -11.347 189 HB3 LYS 25 HB3 LYS 25 -1.439 -24.332 -11.039 190 HG2 LYS 25 HG2 LYS 25 -2.364 -25.906 -12.790 191 HG3 LYS 25 HG3 LYS 25 -3.639 -24.718 -13.122 192 HD2 LYS 25 HD2 LYS 25 -1.935 -23.054 -13.774 193 HD3 LYS 25 HD3 LYS 25 -0.653 -24.256 -13.467 194 HE2 LYS 25 HE2 LYS 25 -1.712 -25.792 -15.110 195 HE3 LYS 25 HE3 LYS 25 -2.984 -24.608 -15.409 196 HZ1 LYS 25 HZ1 LYS 25 -1.284 -23.098 -16.278 197 HZ2 LYS 25 HZ2 LYS 25 -0.104 -24.195 -15.997 198 HZ3 LYS 25 HZ3 LYS 25 -1.260 -24.502 -17.101 199 H GLU 26 H GLU 26 -4.812 -26.637 -11.857 200 HA GLU 26 HA GLU 26 -7.058 -24.811 -12.120 201 HB2 GLU 26 HB2 GLU 26 -6.638 -27.754 -12.805 202 HB3 GLU 26 HB3 GLU 26 -8.152 -26.906 -13.100 203 HG2 GLU 26 HG2 GLU 26 -7.059 -25.301 -14.572 204 HG3 GLU 26 HG3 GLU 26 -5.475 -25.997 -14.228 205 H GLU 27 H GLU 27 -6.340 -27.690 -10.140 206 HA GLU 27 HA GLU 27 -8.965 -27.852 -8.930 207 HB2 GLU 27 HB2 GLU 27 -6.277 -28.996 -8.048 208 HB3 GLU 27 HB3 GLU 27 -7.852 -29.464 -7.411 209 HG2 GLU 27 HG2 GLU 27 -6.924 -29.831 -10.296 210 HG3 GLU 27 HG3 GLU 27 -6.930 -31.076 -9.057 211 H ARG 28 H ARG 28 -5.867 -26.261 -8.130 212 HA ARG 28 HA ARG 28 -6.734 -25.430 -5.490 213 HB2 ARG 28 HB2 ARG 28 -4.400 -24.546 -7.259 214 HB3 ARG 28 HB3 ARG 28 -4.686 -23.971 -5.607 215 HG2 ARG 28 HG2 ARG 28 -4.778 -26.376 -4.863 216 HG3 ARG 28 HG3 ARG 28 -4.222 -26.878 -6.436 217 HD2 ARG 28 HD2 ARG 28 -2.058 -25.987 -6.092 218 HD3 ARG 28 HD3 ARG 28 -2.619 -24.940 -4.772 219 HE ARG 28 HE ARG 28 -3.043 -27.800 -4.317 220 HH11 ARG 28 HH11 ARG 28 -0.623 -25.242 -3.733 221 HH12 ARG 28 HH12 ARG 28 -0.319 -25.801 -2.103 222 HH21 ARG 28 HH21 ARG 28 -2.565 -28.519 -2.327 223 HH22 ARG 28 HH22 ARG 28 -1.335 -27.753 -1.330 224 H ALA 29 H ALA 29 -7.064 -24.004 -8.735 225 HA ALA 29 HA ALA 29 -8.084 -21.478 -7.774 226 HB1 ALA 29 HB1 ALA 29 -8.950 -21.211 -10.026 227 HB2 ALA 29 HB2 ALA 29 -7.302 -21.853 -10.122 228 HB3 ALA 29 HB3 ALA 29 -8.696 -22.927 -10.388 229 H MET 30 H MET 30 -9.539 -24.727 -8.461 230 HA MET 30 HA MET 30 -12.213 -23.877 -7.826 231 HB2 MET 30 HB2 MET 30 -10.958 -26.642 -7.784 232 HB3 MET 30 HB3 MET 30 -12.664 -26.309 -7.506 233 HG2 MET 30 HG2 MET 30 -11.163 -25.543 -10.026 234 HG3 MET 30 HG3 MET 30 -12.139 -26.994 -9.823 235 HE1 MET 30 HE1 MET 30 -12.333 -23.535 -11.456 236 HE2 MET 30 HE2 MET 30 -13.663 -22.729 -10.614 237 HE3 MET 30 HE3 MET 30 -12.146 -23.076 -9.759 238 H GLY 31 H GLY 31 -9.569 -25.167 -5.767 239 HA2 GLY 31 HA2 GLY 31 -10.939 -25.347 -3.331 240 HA3 GLY 31 HA3 GLY 31 -9.249 -24.835 -3.502 241 H TRP 32 H TRP 32 -9.229 -22.432 -4.613 242 HA TRP 32 HA TRP 32 -10.133 -20.524 -2.818 243 HB2 TRP 32 HB2 TRP 32 -9.333 -20.446 -5.725 244 HB3 TRP 32 HB3 TRP 32 -10.107 -19.039 -5.028 245 HD1 TRP 32 HD1 TRP 32 -6.806 -20.791 -5.131 246 HE1 TRP 32 HE1 TRP 32 -5.058 -19.362 -3.929 247 HE3 TRP 32 HE3 TRP 32 -9.924 -17.393 -2.903 248 HZ2 TRP 32 HZ2 TRP 32 -5.030 -17.157 -2.042 249 HZ3 TRP 32 HZ3 TRP 32 -9.007 -15.660 -1.385 250 HH2 TRP 32 HH2 TRP 32 -6.566 -15.539 -0.944 251 H TYR 33 H TYR 33 -11.682 -21.494 -5.951 252 HA TYR 33 HA TYR 33 -13.848 -19.761 -5.848 253 HB2 TYR 33 HB2 TYR 33 -13.217 -21.121 -7.815 254 HB3 TYR 33 HB3 TYR 33 -13.756 -22.577 -6.994 255 HD1 TYR 33 HD2 TYR 33 -16.227 -22.843 -6.369 256 HD2 TYR 33 HD1 TYR 33 -14.779 -19.797 -9.054 257 HE1 TYR 33 HE2 TYR 33 -18.523 -22.480 -7.169 258 HE2 TYR 33 HE1 TYR 33 -17.049 -19.559 -10.000 259 HH TYR 33 HH TYR 33 -19.884 -21.350 -8.701 260 H TYR 34 H TYR 34 -13.667 -23.113 -4.457 261 HA TYR 34 HA TYR 34 -16.423 -23.243 -3.842 262 HB2 TYR 34 HB2 TYR 34 -14.073 -24.660 -2.522 263 HB3 TYR 34 HB3 TYR 34 -15.759 -25.074 -2.273 264 HD1 TYR 34 HD1 TYR 34 -16.839 -24.986 -5.108 265 HD2 TYR 34 HD2 TYR 34 -13.200 -26.632 -3.462 266 HE1 TYR 34 HE1 TYR 34 -16.743 -26.617 -6.955 267 HE2 TYR 34 HE2 TYR 34 -13.116 -28.289 -5.290 268 HH TYR 34 HH TYR 34 -14.146 -29.090 -7.226 269 H TYR 35 H TYR 35 -13.623 -22.382 -1.647 270 HA TYR 35 HA TYR 35 -15.537 -21.930 0.479 271 HB2 TYR 35 HB2 TYR 35 -13.830 -21.727 1.873 272 HB3 TYR 35 HB3 TYR 35 -12.907 -22.452 0.572 273 HD1 TYR 35 HD1 TYR 35 -11.564 -20.923 -0.960 274 HD2 TYR 35 HD2 TYR 35 -13.441 -19.492 2.645 275 HE1 TYR 35 HE1 TYR 35 -10.163 -18.897 -1.052 276 HE2 TYR 35 HE2 TYR 35 -12.056 -17.448 2.571 277 HH TYR 35 HH TYR 35 -10.415 -16.278 1.434 278 H LEU 36 H LEU 36 -13.990 -19.793 -1.954 279 HA LEU 36 HA LEU 36 -14.772 -17.340 -0.770 280 HB2 LEU 36 HB2 LEU 36 -13.091 -17.489 -2.541 281 HB3 LEU 36 HB3 LEU 36 -14.297 -18.110 -3.677 282 HG LEU 36 HG LEU 36 -15.508 -15.967 -3.617 283 HD11 LEU 36 HD11 LEU 36 -13.247 -15.021 -1.793 284 HD12 LEU 36 HD12 LEU 36 -14.449 -13.968 -2.567 285 HD13 LEU 36 HD13 LEU 36 -14.969 -15.144 -1.359 286 HD21 LEU 36 HD21 LEU 36 -12.533 -15.634 -4.186 287 HD22 LEU 36 HD22 LEU 36 -13.720 -16.388 -5.271 288 HD23 LEU 36 HD23 LEU 36 -13.868 -14.677 -4.869 289 H ASP 37 H ASP 37 -16.393 -19.342 -3.324 290 HA ASP 37 HA ASP 37 -18.656 -17.675 -3.653 291 HB2 ASP 37 HB2 ASP 37 -18.032 -19.473 -5.214 292 HB3 ASP 37 HB3 ASP 37 -18.383 -20.689 -3.981 293 H ASP 38 H ASP 38 -18.052 -20.397 -1.393 294 HA ASP 38 HA ASP 38 -20.630 -20.383 -0.162 295 HB2 ASP 38 HB2 ASP 38 -19.057 -22.249 0.026 296 HB3 ASP 38 HB3 ASP 38 -17.921 -21.235 0.920 297 H THR 39 H THR 39 -17.883 -18.203 0.254 298 HA THR 39 HA THR 39 -18.839 -17.249 2.882 299 HB THR 39 HB THR 39 -16.445 -16.437 1.179 300 HG1 THR 39 HG1 THR 39 -16.195 -18.479 1.898 301 HG21 THR 39 HG21 THR 39 -16.901 -14.588 2.614 302 HG22 THR 39 HG22 THR 39 -17.322 -15.628 3.980 303 HG23 THR 39 HG23 THR 39 -15.635 -15.512 3.434 304 H LEU 40 H LEU 40 -18.593 -16.129 -0.526 305 HA LEU 40 HA LEU 40 -19.194 -13.412 -0.042 306 HB2 LEU 40 HB2 LEU 40 -19.675 -15.167 -2.476 307 HB3 LEU 40 HB3 LEU 40 -19.995 -13.434 -2.468 308 HG LEU 40 HG LEU 40 -17.268 -14.682 -1.991 309 HD11 LEU 40 HD11 LEU 40 -18.409 -13.297 -4.450 310 HD12 LEU 40 HD12 LEU 40 -16.736 -13.860 -4.256 311 HD13 LEU 40 HD13 LEU 40 -18.058 -15.030 -4.292 312 HD21 LEU 40 HD21 LEU 40 -16.437 -12.353 -2.441 313 HD22 LEU 40 HD22 LEU 40 -18.102 -11.788 -2.184 314 HD23 LEU 40 HD23 LEU 40 -17.196 -12.621 -0.882 315 H GLU 41 H GLU 41 -21.016 -12.369 0.476 316 HA GLU 41 HA GLU 41 -23.510 -13.742 0.940 317 HB2 GLU 41 HB2 GLU 41 -24.177 -11.618 1.897 318 HB3 GLU 41 HB3 GLU 41 -22.516 -11.955 2.368 319 HG2 GLU 41 HG2 GLU 41 -21.793 -10.453 0.388 320 HG3 GLU 41 HG3 GLU 41 -23.477 -9.957 0.263 321 H PHE 42 H PHE 42 -22.556 -13.507 -1.927 322 HA PHE 42 HA PHE 42 -23.499 -11.453 -3.373 323 HB2 PHE 42 HB2 PHE 42 -23.281 -12.784 -5.325 324 HB3 PHE 42 HB3 PHE 42 -22.011 -13.195 -4.199 325 HD1 PHE 42 HD2 PHE 42 -25.136 -14.374 -5.830 326 HD2 PHE 42 HD1 PHE 42 -21.889 -15.457 -3.204 327 HE1 PHE 42 HE2 PHE 42 -25.758 -16.761 -6.040 328 HE2 PHE 42 HE1 PHE 42 -22.524 -17.838 -3.407 329 HZ PHE 42 HZ PHE 42 -24.458 -18.502 -4.823 330 HA PRO 43 HA PRO 43 -24.512 -10.731 -5.477 331 HB2 PRO 43 HB2 PRO 43 -26.958 -9.008 -5.130 332 HB3 PRO 43 HB3 PRO 43 -25.997 -9.316 -6.606 333 HG2 PRO 43 HG2 PRO 43 -28.383 -10.555 -6.235 334 HG3 PRO 43 HG3 PRO 43 -26.986 -11.478 -6.882 335 HD2 PRO 43 HD2 PRO 43 -28.009 -11.382 -4.026 336 HD3 PRO 43 HD3 PRO 43 -27.544 -12.804 -5.009 337 H PHE 44 H PHE 44 -23.442 -8.729 -5.051 338 HA PHE 44 HA PHE 44 -24.075 -7.163 -2.650 339 HB2 PHE 44 HB2 PHE 44 -21.900 -7.228 -1.704 340 HB3 PHE 44 HB3 PHE 44 -22.496 -8.865 -1.796 341 HD1 PHE 44 HD1 PHE 44 -21.545 -10.456 -3.553 342 HD2 PHE 44 HD2 PHE 44 -19.826 -6.588 -2.742 343 HE1 PHE 44 HE1 PHE 44 -19.419 -11.181 -4.595 344 HE2 PHE 44 HE2 PHE 44 -17.710 -7.309 -3.804 345 HZ PHE 44 HZ PHE 44 -17.490 -9.615 -4.713 346 H MET 45 H MET 45 -21.953 -5.313 -2.823 347 HA MET 45 HA MET 45 -21.923 -4.572 -5.699 348 HB2 MET 45 HB2 MET 45 -22.696 -2.435 -5.398 349 HB3 MET 45 HB3 MET 45 -23.820 -3.406 -4.480 350 HG2 MET 45 HG2 MET 45 -23.141 -2.532 -2.450 351 HG3 MET 45 HG3 MET 45 -21.493 -2.231 -2.971 352 HE1 MET 45 HE1 MET 45 -21.600 1.130 -4.875 353 HE2 MET 45 HE2 MET 45 -20.626 -0.266 -4.390 354 HE3 MET 45 HE3 MET 45 -21.799 -0.423 -5.707 355 H GLY 46 H GLY 46 -20.455 -2.803 -6.222 356 HA2 GLY 46 HA2 GLY 46 -18.211 -2.290 -4.410 357 HA3 GLY 46 HA3 GLY 46 -17.846 -3.466 -5.685 358 H LYS 47 H LYS 47 -16.307 -1.513 -5.813 359 HA LYS 47 HA LYS 47 -17.295 0.125 -8.111 360 HB2 LYS 47 HB2 LYS 47 -16.443 1.365 -5.976 361 HB3 LYS 47 HB3 LYS 47 -14.851 0.753 -6.403 362 HG2 LYS 47 HG2 LYS 47 -14.881 2.877 -7.401 363 HG3 LYS 47 HG3 LYS 47 -15.305 1.818 -8.748 364 HD2 LYS 47 HD2 LYS 47 -16.820 3.620 -8.895 365 HD3 LYS 47 HD3 LYS 47 -17.757 2.304 -8.183 366 HE2 LYS 47 HE2 LYS 47 -17.574 3.274 -5.966 367 HE3 LYS 47 HE3 LYS 47 -16.419 4.488 -6.538 368 HZ1 LYS 47 HZ1 LYS 47 -18.729 5.317 -6.314 369 HZ2 LYS 47 HZ2 LYS 47 -18.137 5.515 -7.819 370 HZ3 LYS 47 HZ3 LYS 47 -19.213 4.326 -7.531 371 H TRP 48 H TRP 48 -16.534 -0.649 -9.993 372 HA TRP 48 HA TRP 48 -14.227 -2.490 -10.085 373 HB2 TRP 48 HB2 TRP 48 -16.259 -2.802 -11.517 374 HB3 TRP 48 HB3 TRP 48 -15.899 -1.290 -12.324 375 HD1 TRP 48 HD1 TRP 48 -12.600 -2.655 -12.081 376 HE1 TRP 48 HE1 TRP 48 -11.897 -4.069 -14.034 377 HE3 TRP 48 HE3 TRP 48 -17.219 -3.421 -14.172 378 HZ2 TRP 48 HZ2 TRP 48 -13.170 -5.444 -16.253 379 HZ3 TRP 48 HZ3 TRP 48 -17.428 -4.818 -16.213 380 HH2 TRP 48 HH2 TRP 48 -15.405 -5.844 -17.244 381 H LYS 49 H LYS 49 -12.345 -1.511 -9.723 382 HA LYS 49 HA LYS 49 -11.767 1.271 -10.451 383 HB2 LYS 49 HB2 LYS 49 -10.062 -0.989 -9.265 384 HB3 LYS 49 HB3 LYS 49 -9.550 0.689 -9.418 385 HG2 LYS 49 HG2 LYS 49 -11.817 -0.320 -7.649 386 HG3 LYS 49 HG3 LYS 49 -10.198 0.171 -7.138 387 HD2 LYS 49 HD2 LYS 49 -10.654 2.482 -8.077 388 HD3 LYS 49 HD3 LYS 49 -12.302 1.939 -8.451 389 HE2 LYS 49 HE2 LYS 49 -12.333 3.195 -6.414 390 HE3 LYS 49 HE3 LYS 49 -12.740 1.499 -6.094 391 HZ1 LYS 49 HZ1 LYS 49 -10.286 2.943 -5.365 392 HZ2 LYS 49 HZ2 LYS 49 -11.317 2.063 -4.417 393 HZ3 LYS 49 HZ3 LYS 49 -10.299 1.301 -5.435 394 H LYS 50 H LYS 50 -12.429 0.443 -12.786 395 HA LYS 50 HA LYS 50 -10.746 -1.438 -14.143 396 HB2 LYS 50 HB2 LYS 50 -13.017 -0.894 -14.879 397 HB3 LYS 50 HB3 LYS 50 -12.548 0.775 -15.235 398 HG2 LYS 50 HG2 LYS 50 -11.050 0.074 -17.005 399 HG3 LYS 50 HG3 LYS 50 -11.219 -1.629 -16.568 400 HD2 LYS 50 HD2 LYS 50 -13.472 0.142 -17.629 401 HD3 LYS 50 HD3 LYS 50 -12.489 -0.957 -18.610 402 HE2 LYS 50 HE2 LYS 50 -13.248 -2.874 -17.180 403 HE3 LYS 50 HE3 LYS 50 -14.312 -1.774 -16.299 404 HZ1 LYS 50 HZ1 LYS 50 -15.510 -2.931 -18.023 405 HZ2 LYS 50 HZ2 LYS 50 -15.471 -1.345 -18.408 406 HZ3 LYS 50 HZ3 LYS 50 -14.501 -2.404 -19.189 407 H LYS 51 H LYS 51 -8.647 -1.191 -14.609 408 HA LYS 51 HA LYS 51 -7.320 1.393 -14.669 409 HB2 LYS 51 HB2 LYS 51 -6.515 -1.390 -15.617 410 HB3 LYS 51 HB3 LYS 51 -5.480 0.039 -15.801 411 HG2 LYS 51 HG2 LYS 51 -5.532 0.413 -13.348 412 HG3 LYS 51 HG3 LYS 51 -6.532 -1.039 -13.146 413 HD2 LYS 51 HD2 LYS 51 -4.716 -2.425 -14.117 414 HD3 LYS 51 HD3 LYS 51 -3.716 -0.968 -14.321 415 HE2 LYS 51 HE2 LYS 51 -3.803 -0.572 -11.866 416 HE3 LYS 51 HE3 LYS 51 -4.794 -2.023 -11.665 417 HZ1 LYS 51 HZ1 LYS 51 -2.928 -3.332 -12.504 418 HZ2 LYS 51 HZ2 LYS 51 -2.012 -1.989 -12.688 419 HZ3 LYS 51 HZ3 LYS 51 -2.470 -2.468 -11.202 420 H SER 52 H SER 52 -7.225 2.789 -16.366 421 HA SER 52 HA SER 52 -8.767 2.457 -18.740 422 HB2 SER 52 HB2 SER 52 -6.428 4.287 -18.105 423 HB3 SER 52 HB3 SER 52 -7.634 4.557 -19.379 424 HG SER 52 HG SER 52 -9.195 4.836 -17.810 425 H ARG 53 H ARG 53 -7.980 2.150 -20.905 426 HA ARG 53 HA ARG 53 -6.644 -0.181 -21.262 427 HB2 ARG 53 HB2 ARG 53 -6.556 1.920 -23.464 428 HB3 ARG 53 HB3 ARG 53 -6.565 0.171 -23.600 429 HG2 ARG 53 HG2 ARG 53 -8.756 0.624 -24.145 430 HG3 ARG 53 HG3 ARG 53 -8.916 0.349 -22.408 431 HD2 ARG 53 HD2 ARG 53 -8.364 3.037 -22.437 432 HD3 ARG 53 HD3 ARG 53 -9.116 2.887 -24.019 433 HE ARG 53 HE ARG 53 -11.026 1.708 -22.757 434 HH11 ARG 53 HH11 ARG 53 -9.266 4.540 -21.501 435 HH12 ARG 53 HH12 ARG 53 -10.274 4.663 -20.076 436 HH21 ARG 53 HH21 ARG 53 -12.526 2.156 -21.030 437 HH22 ARG 53 HH22 ARG 53 -12.223 3.486 -19.944 438 H LYS 54 H LYS 54 -4.671 -0.793 -20.764 439 HA LYS 54 HA LYS 54 -2.450 -0.808 -20.336 440 HB2 LYS 54 HB2 LYS 54 -2.419 0.293 -23.176 441 HB3 LYS 54 HB3 LYS 54 -1.067 -0.500 -22.358 442 HG2 LYS 54 HG2 LYS 54 -2.398 -2.590 -22.152 443 HG3 LYS 54 HG3 LYS 54 -3.751 -1.809 -22.972 444 HD2 LYS 54 HD2 LYS 54 -2.584 -3.183 -24.573 445 HD3 LYS 54 HD3 LYS 54 -2.399 -1.488 -24.998 446 HE2 LYS 54 HE2 LYS 54 -0.301 -2.590 -25.372 447 HE3 LYS 54 HE3 LYS 54 -0.104 -1.489 -24.012 448 HZ1 LYS 54 HZ1 LYS 54 0.914 -3.643 -23.598 449 HZ2 LYS 54 HZ2 LYS 54 -0.290 -3.416 -22.527 450 HZ3 LYS 54 HZ3 LYS 54 -0.498 -4.423 -23.801 451 H THR 55 H THR 55 -3.526 1.495 -19.076 452 HA THR 55 HA THR 55 -1.088 3.102 -19.005 453 HB THR 55 HB THR 55 -2.675 4.074 -20.786 454 HG1 THR 55 HG1 THR 55 -1.085 5.354 -20.017 455 HG21 THR 55 HG21 THR 55 -4.462 5.528 -20.054 456 HG22 THR 55 HG22 THR 55 -4.799 3.843 -19.644 457 HG23 THR 55 HG23 THR 55 -4.271 4.981 -18.376 458 H SER 56 H SER 56 -1.134 4.608 -17.097 459 HA SER 56 HA SER 56 -1.699 3.014 -14.829 460 HB2 SER 56 HB2 SER 56 -0.933 5.958 -14.895 461 HB3 SER 56 HB3 SER 56 -0.592 4.779 -13.615 462 HG SER 56 HG SER 56 1.221 5.143 -14.975 463 H THR 57 H THR 57 -3.603 5.558 -16.347 464 HA THR 57 HA THR 57 -5.020 6.565 -14.183 465 HB THR 57 HB THR 57 -6.083 6.160 -16.994 466 HG1 THR 57 HG1 THR 57 -4.880 7.939 -17.590 467 HG21 THR 57 HG21 THR 57 -6.430 8.421 -14.971 468 HG22 THR 57 HG22 THR 57 -7.008 8.461 -16.653 469 HG23 THR 57 HG23 THR 57 -7.683 7.284 -15.528 470 H ILE 58 H ILE 58 -7.170 6.150 -13.401 471 HA ILE 58 HA ILE 58 -8.300 3.448 -13.924 472 HB ILE 58 HB ILE 58 -7.902 4.909 -11.294 473 HG12 ILE 58 HG12 ILE 58 -7.076 2.189 -12.393 474 HG13 ILE 58 HG13 ILE 58 -6.032 3.561 -12.010 475 HG21 ILE 58 HG21 ILE 58 -10.230 4.117 -11.273 476 HG22 ILE 58 HG22 ILE 58 -9.694 2.497 -11.760 477 HG23 ILE 58 HG23 ILE 58 -9.268 3.177 -10.169 478 HD11 ILE 58 HD11 ILE 58 -7.511 1.769 -10.048 479 HD12 ILE 58 HD12 ILE 58 -5.766 1.932 -10.279 480 HD13 ILE 58 HD13 ILE 58 -6.697 3.279 -9.575 481 H GLU 59 H GLU 59 -10.453 3.330 -14.024 482 HA GLU 59 HA GLU 59 -12.117 5.798 -13.907 483 HB2 GLU 59 HB2 GLU 59 -12.124 3.411 -15.800 484 HB3 GLU 59 HB3 GLU 59 -13.585 4.373 -15.528 485 HG2 GLU 59 HG2 GLU 59 -12.736 6.279 -16.547 486 HG3 GLU 59 HG3 GLU 59 -11.061 5.877 -16.191 487 H GLU 60 H GLU 60 -13.980 5.485 -12.644 488 HA GLU 60 HA GLU 60 -13.899 3.044 -10.920 489 HB2 GLU 60 HB2 GLU 60 -14.507 5.951 -10.219 490 HB3 GLU 60 HB3 GLU 60 -14.649 4.579 -9.116 491 HG2 GLU 60 HG2 GLU 60 -12.209 4.111 -9.433 492 HG3 GLU 60 HG3 GLU 60 -12.082 5.551 -10.441 493 H LYS 61 H LYS 61 -15.509 1.812 -11.745 494 HA LYS 61 HA LYS 61 -18.089 3.131 -12.507 495 HB2 LYS 61 HB2 LYS 61 -16.953 1.917 -14.275 496 HB3 LYS 61 HB3 LYS 61 -16.811 0.476 -13.265 497 HG2 LYS 61 HG2 LYS 61 -19.227 0.167 -13.247 498 HG3 LYS 61 HG3 LYS 61 -19.479 1.676 -14.112 499 HD2 LYS 61 HD2 LYS 61 -17.809 -0.626 -15.236 500 HD3 LYS 61 HD3 LYS 61 -19.544 -0.555 -15.459 501 HE2 LYS 61 HE2 LYS 61 -17.559 1.569 -16.394 502 HE3 LYS 61 HE3 LYS 61 -18.309 0.336 -17.412 503 HZ1 LYS 61 HZ1 LYS 61 -20.478 1.313 -16.912 504 HZ2 LYS 61 HZ2 LYS 61 -19.794 2.462 -15.984 505 HZ3 LYS 61 HZ3 LYS 61 -19.480 2.435 -17.592 506 H THR 62 H THR 62 -19.690 2.982 -10.969 507 HA THR 62 HA THR 62 -19.495 1.159 -8.751 508 HB THR 62 HB THR 62 -21.962 2.661 -9.715 509 HG1 THR 62 HG1 THR 62 -21.125 4.465 -8.965 510 HG21 THR 62 HG21 THR 62 -22.430 2.829 -7.293 511 HG22 THR 62 HG22 THR 62 -22.238 1.130 -7.756 512 HG23 THR 62 HG23 THR 62 -20.913 1.975 -6.927 513 H VAL 63 H VAL 63 -20.258 -0.881 -8.574 514 HA VAL 63 HA VAL 63 -21.971 -1.980 -10.760 515 HB VAL 63 HB VAL 63 -20.499 -3.922 -10.802 516 HG11 VAL 63 HG11 VAL 63 -18.860 -3.059 -12.341 517 HG12 VAL 63 HG12 VAL 63 -20.373 -2.165 -12.553 518 HG13 VAL 63 HG13 VAL 63 -19.016 -1.429 -11.669 519 HG21 VAL 63 HG21 VAL 63 -18.173 -3.855 -10.074 520 HG22 VAL 63 HG22 VAL 63 -18.403 -2.237 -9.382 521 HG23 VAL 63 HG23 VAL 63 -19.238 -3.642 -8.681 522 H GLU 64 H GLU 64 -23.012 -3.935 -10.314 523 HA GLU 64 HA GLU 64 -23.248 -4.686 -7.426 524 HB2 GLU 64 HB2 GLU 64 -25.384 -3.976 -8.467 525 HB3 GLU 64 HB3 GLU 64 -25.185 -5.204 -9.722 526 HG2 GLU 64 HG2 GLU 64 -25.253 -6.975 -7.967 527 HG3 GLU 64 HG3 GLU 64 -25.402 -5.728 -6.727 528 H VAL 65 H VAL 65 -22.278 -6.621 -6.988 529 HA VAL 65 HA VAL 65 -21.123 -8.178 -9.242 530 HB VAL 65 HB VAL 65 -20.482 -8.335 -6.266 531 HG11 VAL 65 HG11 VAL 65 -18.415 -9.454 -7.128 532 HG12 VAL 65 HG12 VAL 65 -19.874 -10.338 -7.596 533 HG13 VAL 65 HG13 VAL 65 -19.045 -9.304 -8.782 534 HG21 VAL 65 HG21 VAL 65 -19.859 -6.083 -6.995 535 HG22 VAL 65 HG22 VAL 65 -18.404 -7.062 -6.846 536 HG23 VAL 65 HG23 VAL 65 -19.084 -6.734 -8.457 537 H LEU 66 H LEU 66 -22.450 -9.762 -9.897 538 HA LEU 66 HA LEU 66 -24.807 -10.420 -8.337 539 HB2 LEU 66 HB2 LEU 66 -23.766 -11.119 -11.091 540 HB3 LEU 66 HB3 LEU 66 -25.043 -12.094 -10.374 541 HG LEU 66 HG LEU 66 -26.460 -10.098 -10.058 542 HD11 LEU 66 HD11 LEU 66 -24.789 -8.299 -9.958 543 HD12 LEU 66 HD12 LEU 66 -24.296 -8.628 -11.634 544 HD13 LEU 66 HD13 LEU 66 -25.923 -8.005 -11.265 545 HD21 LEU 66 HD21 LEU 66 -25.468 -10.553 -12.902 546 HD22 LEU 66 HD22 LEU 66 -26.696 -11.513 -12.054 547 HD23 LEU 66 HD23 LEU 66 -27.025 -9.821 -12.454 548 H GLY 67 H GLY 67 -21.690 -12.039 -8.948 549 HA2 GLY 67 HA2 GLY 67 -21.620 -13.783 -6.870 550 HA3 GLY 67 HA3 GLY 67 -22.585 -14.641 -8.094 551 H MET 68 H MET 68 -20.420 -15.928 -7.721 552 HA MET 68 HA MET 68 -18.089 -15.119 -9.251 553 HB2 MET 68 HB2 MET 68 -19.097 -17.885 -8.454 554 HB3 MET 68 HB3 MET 68 -17.537 -17.537 -9.196 555 HG2 MET 68 HG2 MET 68 -18.464 -16.549 -6.478 556 HG3 MET 68 HG3 MET 68 -17.346 -17.873 -6.773 557 HE1 MET 68 HE1 MET 68 -14.131 -16.091 -8.077 558 HE2 MET 68 HE2 MET 68 -14.871 -17.632 -7.596 559 HE3 MET 68 HE3 MET 68 -15.409 -16.799 -9.076 560 H ALA 69 H ALA 69 -17.483 -15.821 -11.333 561 HA ALA 69 HA ALA 69 -19.624 -16.181 -13.295 562 HB1 ALA 69 HB1 ALA 69 -17.904 -15.890 -14.887 563 HB2 ALA 69 HB2 ALA 69 -17.359 -14.904 -13.540 564 HB3 ALA 69 HB3 ALA 69 -16.669 -16.536 -13.793 565 HA PRO 70 HA PRO 70 -19.715 -20.611 -13.785 566 HB2 PRO 70 HB2 PRO 70 -18.074 -20.412 -16.319 567 HB3 PRO 70 HB3 PRO 70 -19.538 -21.398 -16.000 568 HG2 PRO 70 HG2 PRO 70 -19.773 -19.067 -17.340 569 HG3 PRO 70 HG3 PRO 70 -20.939 -19.444 -16.027 570 HD2 PRO 70 HD2 PRO 70 -18.481 -17.693 -15.924 571 HD3 PRO 70 HD3 PRO 70 -20.117 -17.361 -15.269 572 H ASP 71 H ASP 71 -18.626 -22.347 -13.036 573 HA ASP 71 HA ASP 71 -16.193 -22.209 -11.752 574 HB2 ASP 71 HB2 ASP 71 -17.480 -24.669 -13.022 575 HB3 ASP 71 HB3 ASP 71 -16.209 -24.697 -11.810 576 H ASP 72 H ASP 72 -16.886 -23.196 -15.091 577 HA ASP 72 HA ASP 72 -14.346 -24.309 -15.741 578 HB2 ASP 72 HB2 ASP 72 -16.371 -24.770 -17.028 579 HB3 ASP 72 HB3 ASP 72 -16.504 -23.072 -17.492 580 H GLU 73 H GLU 73 -15.559 -20.941 -15.870 581 HA GLU 73 HA GLU 73 -13.169 -19.989 -17.288 582 HB2 GLU 73 HB2 GLU 73 -15.457 -18.569 -15.847 583 HB3 GLU 73 HB3 GLU 73 -14.074 -17.709 -16.511 584 HG2 GLU 73 HG2 GLU 73 -16.002 -19.439 -18.110 585 HG3 GLU 73 HG3 GLU 73 -16.023 -17.681 -18.021 586 H CYS 74 H CYS 74 -14.363 -20.355 -13.971 587 HA CYS 74 HA CYS 74 -12.226 -18.828 -12.833 588 HB2 CYS 74 HB2 CYS 74 -14.282 -20.630 -11.507 589 HB3 CYS 74 HB3 CYS 74 -13.195 -19.493 -10.680 590 HG CYS 74 HG CYS 74 -15.611 -18.950 -12.858 591 H LEU 75 H LEU 75 -11.642 -21.496 -14.342 592 HA LEU 75 HA LEU 75 -10.215 -23.121 -12.368 593 HB2 LEU 75 HB2 LEU 75 -10.250 -23.051 -15.417 594 HB3 LEU 75 HB3 LEU 75 -9.238 -24.164 -14.509 595 HG LEU 75 HG LEU 75 -12.266 -24.109 -14.273 596 HD11 LEU 75 HD11 LEU 75 -10.470 -25.973 -15.881 597 HD12 LEU 75 HD12 LEU 75 -12.230 -26.134 -15.675 598 HD13 LEU 75 HD13 LEU 75 -11.565 -24.749 -16.551 599 HD21 LEU 75 HD21 LEU 75 -12.022 -26.280 -13.191 600 HD22 LEU 75 HD22 LEU 75 -10.264 -26.249 -13.428 601 HD23 LEU 75 HD23 LEU 75 -11.031 -25.119 -12.307 602 H LYS 76 H LYS 76 -9.611 -20.089 -13.670 603 HA LYS 76 HA LYS 76 -6.664 -20.348 -13.350 604 HB2 LYS 76 HB2 LYS 76 -6.541 -18.869 -15.458 605 HB3 LYS 76 HB3 LYS 76 -6.874 -20.589 -15.663 606 HG2 LYS 76 HG2 LYS 76 -9.220 -20.198 -16.053 607 HG3 LYS 76 HG3 LYS 76 -9.068 -18.489 -15.600 608 HD2 LYS 76 HD2 LYS 76 -7.864 -17.972 -17.607 609 HD3 LYS 76 HD3 LYS 76 -7.586 -19.681 -17.967 610 HE2 LYS 76 HE2 LYS 76 -9.343 -18.716 -19.416 611 HE3 LYS 76 HE3 LYS 76 -9.926 -20.068 -18.443 612 HZ1 LYS 76 HZ1 LYS 76 -11.504 -18.224 -18.475 613 HZ2 LYS 76 HZ2 LYS 76 -10.979 -18.502 -16.955 614 HZ3 LYS 76 HZ3 LYS 76 -10.396 -17.211 -17.811 615 H ASP 77 H ASP 77 -9.551 -18.344 -12.909 616 HA ASP 77 HA ASP 77 -7.998 -16.455 -11.325 617 HB2 ASP 77 HB2 ASP 77 -7.643 -15.501 -13.574 618 HB3 ASP 77 HB3 ASP 77 -9.365 -15.566 -13.892 619 H MET 78 H MET 78 -9.551 -14.955 -10.180 620 HA MET 78 HA MET 78 -12.128 -16.347 -9.674 621 HB2 MET 78 HB2 MET 78 -10.683 -14.131 -8.183 622 HB3 MET 78 HB3 MET 78 -12.292 -14.716 -7.766 623 HG2 MET 78 HG2 MET 78 -9.749 -16.387 -7.766 624 HG3 MET 78 HG3 MET 78 -10.566 -15.721 -6.362 625 HE1 MET 78 HE1 MET 78 -9.860 -18.867 -8.120 626 HE2 MET 78 HE2 MET 78 -11.403 -19.699 -8.401 627 HE3 MET 78 HE3 MET 78 -10.967 -18.298 -9.390 628 H TYR 79 H TYR 79 -13.054 -15.834 -11.718 629 HA TYR 79 HA TYR 79 -13.621 -13.046 -12.413 630 HB2 TYR 79 HB2 TYR 79 -14.713 -15.692 -13.417 631 HB3 TYR 79 HB3 TYR 79 -15.129 -14.125 -14.094 632 HD1 TYR 79 HD1 TYR 79 -12.572 -16.737 -13.815 633 HD2 TYR 79 HD2 TYR 79 -13.534 -12.897 -15.527 634 HE1 TYR 79 HE1 TYR 79 -10.710 -16.979 -15.396 635 HE2 TYR 79 HE2 TYR 79 -11.725 -13.174 -17.188 636 HH TYR 79 HH TYR 79 -9.987 -14.573 -17.957 637 H VAL 80 H VAL 80 -15.619 -12.012 -12.133 638 HA VAL 80 HA VAL 80 -17.812 -13.484 -10.750 639 HB VAL 80 HB VAL 80 -18.262 -11.328 -9.557 640 HG11 VAL 80 HG11 VAL 80 -16.616 -11.708 -7.772 641 HG12 VAL 80 HG12 VAL 80 -17.272 -13.222 -8.392 642 HG13 VAL 80 HG13 VAL 80 -15.640 -12.712 -8.868 643 HG21 VAL 80 HG21 VAL 80 -16.848 -9.785 -10.923 644 HG22 VAL 80 HG22 VAL 80 -16.476 -9.703 -9.197 645 HG23 VAL 80 HG23 VAL 80 -15.391 -10.580 -10.287 646 H GLU 81 H GLU 81 -19.889 -12.877 -11.324 647 HA GLU 81 HA GLU 81 -20.226 -11.525 -13.944 648 HB2 GLU 81 HB2 GLU 81 -22.217 -12.743 -11.969 649 HB3 GLU 81 HB3 GLU 81 -22.647 -11.964 -13.502 650 HG2 GLU 81 HG2 GLU 81 -21.180 -13.652 -14.686 651 HG3 GLU 81 HG3 GLU 81 -20.987 -14.486 -13.142 652 H VAL 82 H VAL 82 -21.064 -9.423 -14.111 653 HA VAL 82 HA VAL 82 -21.532 -7.942 -11.604 654 HB VAL 82 HB VAL 82 -19.099 -8.053 -12.021 655 HG11 VAL 82 HG11 VAL 82 -18.992 -8.288 -14.451 656 HG12 VAL 82 HG12 VAL 82 -19.653 -6.652 -14.671 657 HG13 VAL 82 HG13 VAL 82 -18.074 -6.874 -13.928 658 HG21 VAL 82 HG21 VAL 82 -20.200 -5.294 -12.535 659 HG22 VAL 82 HG22 VAL 82 -20.048 -6.101 -10.945 660 HG23 VAL 82 HG23 VAL 82 -18.597 -5.703 -11.882 661 H ALA 83 H ALA 83 -22.907 -6.209 -11.879 662 HA ALA 83 HA ALA 83 -23.911 -5.667 -14.649 663 HB1 ALA 83 HB1 ALA 83 -25.351 -5.396 -11.983 664 HB2 ALA 83 HB2 ALA 83 -26.011 -4.988 -13.579 665 HB3 ALA 83 HB3 ALA 83 -25.616 -6.673 -13.192 666 H ASP 84 H ASP 84 -23.815 -3.613 -15.366 667 HA ASP 84 HA ASP 84 -22.181 -1.678 -13.908 668 HB2 ASP 84 HB2 ASP 84 -21.855 -2.145 -16.307 669 HB3 ASP 84 HB3 ASP 84 -23.512 -1.624 -16.632 670 H ILE 85 H ILE 85 -23.968 -1.686 -12.183 671 HA ILE 85 HA ILE 85 -26.425 -0.332 -12.647 672 HB ILE 85 HB ILE 85 -26.587 -0.036 -10.261 673 HG12 ILE 85 HG12 ILE 85 -23.706 -0.965 -10.074 674 HG13 ILE 85 HG13 ILE 85 -24.258 0.679 -9.780 675 HG21 ILE 85 HG21 ILE 85 -25.350 -2.763 -10.831 676 HG22 ILE 85 HG22 ILE 85 -26.618 -2.354 -9.655 677 HG23 ILE 85 HG23 ILE 85 -26.967 -2.272 -11.378 678 HD11 ILE 85 HD11 ILE 85 -23.912 -0.445 -7.658 679 HD12 ILE 85 HD12 ILE 85 -25.646 -0.133 -7.876 680 HD13 ILE 85 HD13 ILE 85 -24.982 -1.766 -8.116 681 H GLY 86 H GLY 86 -23.316 0.974 -12.842 682 HA2 GLY 86 HA2 GLY 86 -24.152 3.745 -12.199 683 HA3 GLY 86 HA3 GLY 86 -22.515 3.154 -12.509 684 H GLY 87 H GLY 87 -24.138 1.673 -14.958 685 HA2 GLY 87 HA2 GLY 87 -24.171 4.007 -16.809 686 HA3 GLY 87 HA3 GLY 87 -22.898 2.788 -16.942 687 H LYS 88 H LYS 88 -25.426 0.863 -16.156 688 HA LYS 88 HA LYS 88 -26.872 0.969 -18.744 689 HB2 LYS 88 HB2 LYS 88 -25.867 -1.695 -17.640 690 HB3 LYS 88 HB3 LYS 88 -26.722 -1.412 -19.151 691 HG2 LYS 88 HG2 LYS 88 -23.921 -0.514 -18.532 692 HG3 LYS 88 HG3 LYS 88 -24.338 -1.990 -19.377 693 HD2 LYS 88 HD2 LYS 88 -25.133 -0.870 -21.284 694 HD3 LYS 88 HD3 LYS 88 -25.270 0.689 -20.473 695 HE2 LYS 88 HE2 LYS 88 -22.677 -0.821 -20.961 696 HE3 LYS 88 HE3 LYS 88 -23.275 0.513 -21.965 697 HZ1 LYS 88 HZ1 LYS 88 -23.196 1.890 -19.900 698 HZ2 LYS 88 HZ2 LYS 88 -22.400 0.682 -19.126 699 HZ3 LYS 88 HZ3 LYS 88 -21.715 1.407 -20.431 700 H ASP 89 H ASP 89 -26.451 -0.514 -15.557 701 HA ASP 89 HA ASP 89 -27.679 -1.363 -13.982 702 HB2 ASP 89 HB2 ASP 89 -28.647 0.863 -13.814 703 HB3 ASP 89 HB3 ASP 89 -29.882 0.447 -15.004 704 H ASP 90 H ASP 90 -29.127 -1.651 -17.147 705 HA ASP 90 HA ASP 90 -30.799 -3.940 -16.334 706 HB2 ASP 90 HB2 ASP 90 -31.704 -1.923 -17.507 707 HB3 ASP 90 HB3 ASP 90 -30.664 -2.300 -18.882 708 H ASP 91 H ASP 91 -27.670 -3.785 -17.215 709 HA ASP 91 HA ASP 91 -27.802 -6.324 -18.728 710 HB2 ASP 91 HB2 ASP 91 -27.486 -4.333 -20.326 711 HB3 ASP 91 HB3 ASP 91 -25.886 -4.158 -19.584 712 H VAL 92 H VAL 92 -25.704 -7.408 -18.821 713 HA VAL 92 HA VAL 92 -24.133 -7.064 -16.314 714 HB VAL 92 HB VAL 92 -25.397 -9.642 -17.332 715 HG11 VAL 92 HG11 VAL 92 -23.372 -10.033 -15.946 716 HG12 VAL 92 HG12 VAL 92 -24.099 -9.076 -14.634 717 HG13 VAL 92 HG13 VAL 92 -24.833 -10.605 -15.163 718 HG21 VAL 92 HG21 VAL 92 -26.909 -9.505 -15.332 719 HG22 VAL 92 HG22 VAL 92 -26.348 -7.840 -15.071 720 HG23 VAL 92 HG23 VAL 92 -27.241 -8.275 -16.544 721 H TYR 93 H TYR 93 -22.095 -8.003 -16.357 722 HA TYR 93 HA TYR 93 -20.915 -9.031 -18.870 723 HB2 TYR 93 HB2 TYR 93 -19.751 -6.785 -17.164 724 HB3 TYR 93 HB3 TYR 93 -19.063 -7.445 -18.637 725 HD1 TYR 93 HD2 TYR 93 -20.184 -7.024 -20.863 726 HD2 TYR 93 HD1 TYR 93 -21.415 -5.041 -17.231 727 HE1 TYR 93 HE2 TYR 93 -21.340 -5.298 -22.206 728 HE2 TYR 93 HE1 TYR 93 -22.572 -3.308 -18.566 729 HH TYR 93 HH TYR 93 -22.610 -3.357 -22.166 730 H THR 94 H THR 94 -18.319 -9.257 -17.946 731 HA THR 94 HA THR 94 -18.438 -10.602 -15.301 732 HB THR 94 HB THR 94 -16.821 -11.545 -17.700 733 HG1 THR 94 HG1 THR 94 -19.023 -11.924 -18.016 734 HG21 THR 94 HG21 THR 94 -15.823 -12.177 -15.520 735 HG22 THR 94 HG22 THR 94 -17.372 -12.884 -15.013 736 HG23 THR 94 HG23 THR 94 -16.460 -13.589 -16.368 737 H ALA 95 H ALA 95 -16.568 -10.239 -14.036 738 HA ALA 95 HA ALA 95 -14.417 -8.529 -15.139 739 HB1 ALA 95 HB1 ALA 95 -15.894 -6.897 -14.107 740 HB2 ALA 95 HB2 ALA 95 -16.026 -7.879 -12.624 741 HB3 ALA 95 HB3 ALA 95 -14.490 -7.104 -13.064 742 H LYS 96 H LYS 96 -12.566 -8.468 -13.712 743 HA LYS 96 HA LYS 96 -12.038 -11.051 -12.365 744 HB2 LYS 96 HB2 LYS 96 -9.767 -9.769 -11.980 745 HB3 LYS 96 HB3 LYS 96 -10.114 -10.542 -13.510 746 HG2 LYS 96 HG2 LYS 96 -10.836 -7.636 -13.252 747 HG3 LYS 96 HG3 LYS 96 -9.127 -8.071 -13.361 748 HD2 LYS 96 HD2 LYS 96 -9.341 -9.002 -15.507 749 HD3 LYS 96 HD3 LYS 96 -11.083 -9.167 -15.389 750 HE2 LYS 96 HE2 LYS 96 -10.468 -7.399 -16.943 751 HE3 LYS 96 HE3 LYS 96 -11.427 -6.768 -15.609 752 HZ1 LYS 96 HZ1 LYS 96 -9.594 -5.624 -14.767 753 HZ2 LYS 96 HZ2 LYS 96 -8.481 -6.571 -15.559 754 HZ3 LYS 96 HZ3 LYS 96 -9.385 -5.484 -16.362 755 H LEU 97 H LEU 97 -12.361 -11.259 -10.184 756 HA LEU 97 HA LEU 97 -13.399 -9.169 -8.573 757 HB2 LEU 97 HB2 LEU 97 -13.613 -11.588 -8.083 758 HB3 LEU 97 HB3 LEU 97 -11.875 -11.689 -7.790 759 HG LEU 97 HG LEU 97 -12.091 -10.203 -5.824 760 HD11 LEU 97 HD11 LEU 97 -14.388 -9.678 -4.942 761 HD12 LEU 97 HD12 LEU 97 -14.017 -8.811 -6.428 762 HD13 LEU 97 HD13 LEU 97 -15.079 -10.237 -6.476 763 HD21 LEU 97 HD21 LEU 97 -13.236 -11.810 -4.386 764 HD22 LEU 97 HD22 LEU 97 -14.065 -12.517 -5.792 765 HD23 LEU 97 HD23 LEU 97 -12.300 -12.663 -5.615 766 H SER 98 H SER 98 -10.079 -10.168 -9.288 767 HA SER 98 HA SER 98 -8.545 -8.761 -7.500 768 HB2 SER 98 HB2 SER 98 -7.980 -9.050 -10.462 769 HB3 SER 98 HB3 SER 98 -6.823 -9.073 -9.120 770 HG SER 98 HG SER 98 -7.452 -11.180 -10.026 771 H ASP 99 H ASP 99 -10.633 -7.353 -9.945 772 HA ASP 99 HA ASP 99 -9.119 -4.802 -9.915 773 HB2 ASP 99 HB2 ASP 99 -9.405 -6.263 -11.996 774 HB3 ASP 99 HB3 ASP 99 -11.110 -5.784 -11.973 775 H ILE 100 H ILE 100 -11.392 -5.968 -8.157 776 HA ILE 100 HA ILE 100 -13.186 -3.585 -8.252 777 HB ILE 100 HB ILE 100 -13.734 -6.510 -8.108 778 HG12 ILE 100 HG12 ILE 100 -15.378 -4.130 -9.063 779 HG13 ILE 100 HG13 ILE 100 -14.190 -4.988 -10.068 780 HG21 ILE 100 HG21 ILE 100 -14.576 -5.880 -5.867 781 HG22 ILE 100 HG22 ILE 100 -15.610 -4.638 -6.619 782 HG23 ILE 100 HG23 ILE 100 -15.858 -6.364 -6.951 783 HD11 ILE 100 HD11 ILE 100 -15.561 -7.086 -9.734 784 HD12 ILE 100 HD12 ILE 100 -16.798 -6.055 -8.960 785 HD13 ILE 100 HD13 ILE 100 -16.357 -5.786 -10.653 786 H GLU 101 H GLU 101 -13.952 -2.819 -6.384 787 HA GLU 101 HA GLU 101 -12.618 -3.597 -3.829 788 HB2 GLU 101 HB2 GLU 101 -11.815 -1.404 -4.548 789 HB3 GLU 101 HB3 GLU 101 -13.477 -0.832 -4.802 790 HG2 GLU 101 HG2 GLU 101 -13.960 -0.871 -2.453 791 HG3 GLU 101 HG3 GLU 101 -12.541 -1.860 -2.100 792 H ALA 102 H ALA 102 -14.102 -4.455 -2.462 793 HA ALA 102 HA ALA 102 -16.924 -4.493 -3.226 794 HB1 ALA 102 HB1 ALA 102 -17.176 -5.970 -1.302 795 HB2 ALA 102 HB2 ALA 102 -15.765 -6.460 -2.258 796 HB3 ALA 102 HB3 ALA 102 -15.538 -5.577 -0.730 797 H ILE 103 H ILE 103 -18.553 -3.391 -2.283 798 HA ILE 103 HA ILE 103 -17.974 -1.465 -0.075 799 HB ILE 103 HB ILE 103 -19.416 -1.120 -2.714 800 HG12 ILE 103 HG12 ILE 103 -17.189 0.520 -1.415 801 HG13 ILE 103 HG13 ILE 103 -16.916 -0.751 -2.604 802 HG21 ILE 103 HG21 ILE 103 -20.147 1.124 -1.995 803 HG22 ILE 103 HG22 ILE 103 -20.875 -0.121 -1.008 804 HG23 ILE 103 HG23 ILE 103 -19.503 0.818 -0.365 805 HD11 ILE 103 HD11 ILE 103 -18.386 1.849 -3.118 806 HD12 ILE 103 HD12 ILE 103 -16.807 1.337 -3.724 807 HD13 ILE 103 HD13 ILE 103 -18.274 0.484 -4.262 808 H ASP 104 H ASP 104 -19.546 -1.256 1.463 809 HA ASP 104 HA ASP 104 -21.246 -1.773 2.797 810 HB2 ASP 104 HB2 ASP 104 -22.421 -0.552 0.991 811 HB3 ASP 104 HB3 ASP 104 -22.855 -2.090 0.247 812 H VAL 105 H VAL 105 -19.536 -4.015 2.002 813 HA VAL 105 HA VAL 105 -21.324 -6.363 2.199 814 HB VAL 105 HB VAL 105 -19.096 -7.584 2.102 815 HG11 VAL 105 HG11 VAL 105 -20.635 -7.482 0.284 816 HG12 VAL 105 HG12 VAL 105 -19.966 -5.923 -0.270 817 HG13 VAL 105 HG13 VAL 105 -18.972 -7.403 -0.322 818 HG21 VAL 105 HG21 VAL 105 -17.150 -6.540 1.259 819 HG22 VAL 105 HG22 VAL 105 -17.959 -4.967 1.072 820 HG23 VAL 105 HG23 VAL 105 -17.646 -5.636 2.695 821 H ASP 106 H ASP 106 -20.707 -8.046 3.673 822 HA ASP 106 HA ASP 106 -20.463 -7.180 6.466 823 HB2 ASP 106 HB2 ASP 106 -21.896 -9.101 5.805 824 HB3 ASP 106 HB3 ASP 106 -20.466 -9.940 5.181 825 H ASP 107 H ASP 107 -18.761 -8.014 7.837 826 HA ASP 107 HA ASP 107 -16.126 -7.463 6.978 827 HB2 ASP 107 HB2 ASP 107 -16.839 -7.355 9.312 828 HB3 ASP 107 HB3 ASP 107 -17.153 -9.092 9.330 829 H ASP 108 H ASP 108 -17.841 -10.672 7.185 830 HA ASP 108 HA ASP 108 -15.367 -12.094 6.764 831 HB2 ASP 108 HB2 ASP 108 -17.550 -12.969 7.826 832 HB3 ASP 108 HB3 ASP 108 -18.130 -13.192 6.165 833 H THR 109 H THR 109 -17.933 -10.883 4.616 834 HA THR 109 HA THR 109 -17.019 -12.092 2.174 835 HB THR 109 HB THR 109 -18.485 -9.478 2.669 836 HG1 THR 109 HG1 THR 109 -20.297 -10.509 2.717 837 HG21 THR 109 HG21 THR 109 -18.589 -11.327 0.257 838 HG22 THR 109 HG22 THR 109 -19.490 -9.816 0.456 839 HG23 THR 109 HG23 THR 109 -17.731 -9.775 0.311 840 H GLN 110 H GLN 110 -16.482 -8.835 3.716 841 HA GLN 110 HA GLN 110 -14.788 -7.868 1.699 842 HB2 GLN 110 HB2 GLN 110 -15.938 -6.724 3.807 843 HB3 GLN 110 HB3 GLN 110 -14.400 -7.044 4.592 844 HG2 GLN 110 HG2 GLN 110 -14.830 -5.472 2.002 845 HG3 GLN 110 HG3 GLN 110 -14.580 -4.764 3.589 846 HE21 GLN 110 HE22 GLN 110 -12.973 -5.637 0.730 847 HE22 GLN 110 HE21 GLN 110 -11.348 -5.681 1.357 848 H GLU 111 H GLU 111 -13.952 -9.638 4.746 849 HA GLU 111 HA GLU 111 -11.149 -9.532 4.378 850 HB2 GLU 111 HB2 GLU 111 -12.987 -11.432 5.876 851 HB3 GLU 111 HB3 GLU 111 -11.239 -11.636 5.890 852 HG2 GLU 111 HG2 GLU 111 -12.592 -9.036 6.743 853 HG3 GLU 111 HG3 GLU 111 -12.220 -10.356 7.847 854 H ALA 112 H ALA 112 -13.562 -11.862 3.042 855 HA ALA 112 HA ALA 112 -11.586 -13.720 2.090 856 HB1 ALA 112 HB1 ALA 112 -13.995 -14.271 2.302 857 HB2 ALA 112 HB2 ALA 112 -14.376 -13.143 0.978 858 HB3 ALA 112 HB3 ALA 112 -13.382 -14.582 0.670 859 H ILE 113 H ILE 113 -13.186 -10.873 0.621 860 HA ILE 113 HA ILE 113 -11.902 -11.134 -1.937 861 HB ILE 113 HB ILE 113 -13.274 -8.795 -0.547 862 HG12 ILE 113 HG12 ILE 113 -14.314 -10.681 -2.719 863 HG13 ILE 113 HG13 ILE 113 -14.641 -10.909 -1.014 864 HG21 ILE 113 HG21 ILE 113 -11.809 -7.916 -2.316 865 HG22 ILE 113 HG22 ILE 113 -12.460 -9.087 -3.477 866 HG23 ILE 113 HG23 ILE 113 -13.485 -7.789 -2.826 867 HD11 ILE 113 HD11 ILE 113 -15.706 -8.633 -0.947 868 HD12 ILE 113 HD12 ILE 113 -15.596 -8.626 -2.736 869 HD13 ILE 113 HD13 ILE 113 -16.548 -9.859 -1.908 870 H ALA 114 H ALA 114 -11.141 -9.222 1.027 871 HA ALA 114 HA ALA 114 -8.857 -7.888 0.018 872 HB1 ALA 114 HB1 ALA 114 -9.981 -7.303 2.151 873 HB2 ALA 114 HB2 ALA 114 -9.424 -8.836 2.862 874 HB3 ALA 114 HB3 ALA 114 -8.247 -7.600 2.378 875 H ASP 115 H ASP 115 -9.200 -11.127 1.573 876 HA ASP 115 HA ASP 115 -6.378 -11.616 1.616 877 HB2 ASP 115 HB2 ASP 115 -8.022 -12.794 3.061 878 HB3 ASP 115 HB3 ASP 115 -8.626 -13.656 1.637 879 H TRP 116 H TRP 116 -8.917 -12.319 -0.835 880 HA TRP 116 HA TRP 116 -7.210 -13.751 -2.640 881 HB2 TRP 116 HB2 TRP 116 -9.578 -13.768 -3.038 882 HB3 TRP 116 HB3 TRP 116 -9.660 -12.012 -3.090 883 HD1 TRP 116 HD1 TRP 116 -9.491 -10.911 -5.388 884 HE1 TRP 116 HE1 TRP 116 -8.671 -11.569 -7.734 885 HE3 TRP 116 HE3 TRP 116 -7.748 -15.613 -4.367 886 HZ2 TRP 116 HZ2 TRP 116 -7.499 -13.865 -9.008 887 HZ3 TRP 116 HZ3 TRP 116 -6.772 -17.010 -6.161 888 HH2 TRP 116 HH2 TRP 116 -6.630 -16.143 -8.484 889 H LEU 117 H LEU 117 -7.880 -10.220 -2.249 890 HA LEU 117 HA LEU 117 -6.209 -9.403 -4.409 891 HB2 LEU 117 HB2 LEU 117 -7.127 -7.984 -1.880 892 HB3 LEU 117 HB3 LEU 117 -6.189 -7.179 -3.125 893 HG LEU 117 HG LEU 117 -8.805 -8.579 -3.809 894 HD11 LEU 117 HD11 LEU 117 -9.928 -6.391 -3.583 895 HD12 LEU 117 HD12 LEU 117 -9.327 -6.991 -2.032 896 HD13 LEU 117 HD13 LEU 117 -8.445 -5.700 -2.881 897 HD21 LEU 117 HD21 LEU 117 -7.308 -6.276 -5.128 898 HD22 LEU 117 HD22 LEU 117 -7.319 -7.957 -5.694 899 HD23 LEU 117 HD23 LEU 117 -8.820 -7.017 -5.693 900 H TYR 118 H TYR 118 -5.468 -9.872 -0.905 901 HA TYR 118 HA TYR 118 -2.745 -9.064 -1.096 902 HB2 TYR 118 HB2 TYR 118 -3.961 -11.147 0.757 903 HB3 TYR 118 HB3 TYR 118 -2.409 -10.358 0.971 904 HD1 TYR 118 HD2 TYR 118 -3.544 -7.452 0.180 905 HD2 TYR 118 HD1 TYR 118 -4.736 -10.545 2.954 906 HE1 TYR 118 HE2 TYR 118 -4.633 -5.758 1.598 907 HE2 TYR 118 HE1 TYR 118 -5.832 -8.851 4.376 908 HH TYR 118 HH TYR 118 -6.329 -6.587 4.659 909 H TRP 119 H TRP 119 -4.254 -12.336 -1.494 910 HA TRP 119 HA TRP 119 -1.846 -13.735 -2.007 911 HB2 TRP 119 HB2 TRP 119 -3.743 -15.035 -1.604 912 HB3 TRP 119 HB3 TRP 119 -4.746 -14.130 -2.730 913 HD1 TRP 119 HD1 TRP 119 -4.960 -14.940 -5.121 914 HE1 TRP 119 HE1 TRP 119 -3.993 -16.829 -6.536 915 HE3 TRP 119 HE3 TRP 119 -1.288 -16.494 -1.912 916 HZ2 TRP 119 HZ2 TRP 119 -2.025 -18.946 -6.180 917 HZ3 TRP 119 HZ3 TRP 119 0.144 -18.433 -2.493 918 HH2 TRP 119 HH2 TRP 119 -0.236 -19.685 -4.603 919 H LEU 120 H LEU 120 -3.928 -11.805 -4.187 920 HA LEU 120 HA LEU 120 -2.819 -12.684 -6.610 921 HB2 LEU 120 HB2 LEU 120 -4.928 -11.214 -6.072 922 HB3 LEU 120 HB3 LEU 120 -3.838 -9.847 -6.070 923 HG LEU 120 HG LEU 120 -4.981 -9.944 -8.132 924 HD11 LEU 120 HD11 LEU 120 -2.593 -9.288 -8.296 925 HD12 LEU 120 HD12 LEU 120 -2.197 -10.947 -8.797 926 HD13 LEU 120 HD13 LEU 120 -3.265 -9.953 -9.792 927 HD21 LEU 120 HD21 LEU 120 -5.714 -12.214 -8.158 928 HD22 LEU 120 HD22 LEU 120 -4.865 -11.896 -9.676 929 HD23 LEU 120 HD23 LEU 120 -4.076 -12.833 -8.389 930 H ALA 121 H ALA 121 -2.052 -9.879 -4.502 931 HA ALA 121 HA ALA 121 0.242 -8.984 -5.957 932 HB1 ALA 121 HB1 ALA 121 -0.674 -8.607 -3.068 933 HB2 ALA 121 HB2 ALA 121 0.622 -7.665 -3.851 934 HB3 ALA 121 HB3 ALA 121 -1.050 -7.554 -4.440 935 H ARG 122 H ARG 122 -0.140 -11.293 -3.248 936 HA ARG 122 HA ARG 122 2.605 -11.548 -2.615 937 HB2 ARG 122 HB2 ARG 122 0.700 -12.260 -1.172 938 HB3 ARG 122 HB3 ARG 122 0.312 -13.536 -2.322 939 HG2 ARG 122 HG2 ARG 122 1.370 -14.466 -0.390 940 HG3 ARG 122 HG3 ARG 122 2.410 -14.705 -1.788 941 HD2 ARG 122 HD2 ARG 122 3.863 -12.854 -1.049 942 HD3 ARG 122 HD3 ARG 122 2.755 -12.495 0.278 943 HE ARG 122 HE ARG 122 4.419 -14.964 -0.030 944 HH11 ARG 122 HH11 ARG 122 2.802 -12.683 2.245 945 HH12 ARG 122 HH12 ARG 122 3.108 -13.732 3.602 946 HH21 ARG 122 HH21 ARG 122 4.871 -16.194 1.871 947 HH22 ARG 122 HH22 ARG 122 4.306 -15.586 3.414 948 H GLY 123 H GLY 123 0.779 -12.962 -5.336 949 HA2 GLY 123 HA2 GLY 123 3.088 -13.754 -6.671 950 HA3 GLY 123 HA3 GLY 123 2.622 -15.164 -5.721 951 H TYR 124 H TYR 124 -0.388 -14.285 -6.265 952 HA TYR 124 HA TYR 124 -1.949 -15.295 -7.595 953 HB2 TYR 124 HB2 TYR 124 -1.634 -13.064 -8.462 954 HB3 TYR 124 HB3 TYR 124 -0.364 -13.603 -9.541 955 HD1 TYR 124 HD2 TYR 124 -3.563 -15.537 -9.112 956 HD2 TYR 124 HD1 TYR 124 -1.393 -12.651 -11.488 957 HE1 TYR 124 HE2 TYR 124 -5.157 -15.858 -10.937 958 HE2 TYR 124 HE1 TYR 124 -3.025 -12.933 -13.318 959 HH TYR 124 HH TYR 124 -4.925 -14.039 -14.053 960 H LYS 125 H LYS 125 -0.397 -17.344 -7.129 961 HA LYS 125 HA LYS 125 0.802 -18.535 -9.499 962 HB2 LYS 125 HB2 LYS 125 -0.115 -19.982 -6.984 963 HB3 LYS 125 HB3 LYS 125 0.992 -20.586 -8.199 964 HG2 LYS 125 HG2 LYS 125 1.521 -18.255 -6.303 965 HG3 LYS 125 HG3 LYS 125 2.186 -19.884 -6.200 966 HD2 LYS 125 HD2 LYS 125 3.329 -19.519 -8.425 967 HD3 LYS 125 HD3 LYS 125 2.710 -17.865 -8.426 968 HE2 LYS 125 HE2 LYS 125 4.953 -17.742 -7.663 969 HE3 LYS 125 HE3 LYS 125 3.911 -17.424 -6.276 970 HZ1 LYS 125 HZ1 LYS 125 5.256 -20.006 -6.854 971 HZ2 LYS 125 HZ2 LYS 125 5.724 -18.929 -5.729 972 HZ3 LYS 125 HZ3 LYS 125 4.310 -19.716 -5.549 973 H PHE 126 H PHE 126 -2.457 -18.417 -8.261 974 HA PHE 126 HA PHE 126 -3.676 -19.487 -10.572 975 HB2 PHE 126 HB2 PHE 126 -4.976 -21.241 -9.099 976 HB3 PHE 126 HB3 PHE 126 -3.460 -21.672 -9.846 977 HD1 PHE 126 HD2 PHE 126 -4.892 -20.488 -6.582 978 HD2 PHE 126 HD1 PHE 126 -1.650 -22.503 -8.586 979 HE1 PHE 126 HE2 PHE 126 -3.880 -21.079 -4.380 980 HE2 PHE 126 HE1 PHE 126 -0.639 -23.066 -6.395 981 HZ PHE 126 HZ PHE 126 -1.730 -22.312 -4.293 Start of MODEL 4 1 H1 MET 1 H1 MET 1 1.904 -3.482 -0.389 2 H2 MET 1 H2 MET 1 2.292 -2.329 -1.499 3 H3 MET 1 H3 MET 1 1.613 -3.743 -1.972 4 HA MET 1 HA MET 1 3.937 -3.792 -2.491 5 HB2 MET 1 HB2 MET 1 4.286 -3.371 0.517 6 HB3 MET 1 HB3 MET 1 5.562 -3.913 -0.574 7 HG2 MET 1 HG2 MET 1 5.274 -1.828 -1.919 8 HG3 MET 1 HG3 MET 1 4.141 -1.229 -0.706 9 HE1 MET 1 HE1 MET 1 4.779 -0.457 1.710 10 HE2 MET 1 HE2 MET 1 5.446 -2.058 2.113 11 HE3 MET 1 HE3 MET 1 6.404 -0.595 2.415 12 H ALA 2 H ALA 2 4.967 -5.860 -2.560 13 HA ALA 2 HA ALA 2 3.270 -8.044 -2.021 14 HB1 ALA 2 HB1 ALA 2 6.266 -8.049 -2.594 15 HB2 ALA 2 HB2 ALA 2 5.161 -9.429 -2.769 16 HB3 ALA 2 HB3 ALA 2 4.968 -8.014 -3.816 17 H SER 3 H SER 3 5.487 -6.506 0.181 18 HA SER 3 HA SER 3 5.879 -8.687 1.935 19 HB2 SER 3 HB2 SER 3 5.859 -5.691 2.449 20 HB3 SER 3 HB3 SER 3 6.513 -6.914 3.558 21 HG SER 3 HG SER 3 7.972 -5.807 1.921 22 H VAL 4 H VAL 4 2.897 -7.208 1.233 23 HA VAL 4 HA VAL 4 1.611 -6.917 3.624 24 HB VAL 4 HB VAL 4 0.682 -6.265 1.541 25 HG11 VAL 4 HG11 VAL 4 -0.328 -7.688 -0.094 26 HG12 VAL 4 HG12 VAL 4 1.362 -8.172 0.069 27 HG13 VAL 4 HG13 VAL 4 0.080 -9.154 0.806 28 HG21 VAL 4 HG21 VAL 4 -1.163 -8.290 2.859 29 HG22 VAL 4 HG22 VAL 4 -0.842 -6.641 3.441 30 HG23 VAL 4 HG23 VAL 4 -1.639 -6.887 1.880 31 H GLU 5 H GLU 5 1.876 -8.158 5.258 32 HA GLU 5 HA GLU 5 1.866 -9.869 6.711 33 HB2 GLU 5 HB2 GLU 5 -0.261 -11.021 4.883 34 HB3 GLU 5 HB3 GLU 5 0.056 -11.515 6.557 35 HG2 GLU 5 HG2 GLU 5 -0.510 -9.173 7.271 36 HG3 GLU 5 HG3 GLU 5 -1.047 -8.853 5.614 37 H ARG 6 H ARG 6 3.840 -10.127 4.429 38 HA ARG 6 HA ARG 6 3.815 -12.845 3.578 39 HB2 ARG 6 HB2 ARG 6 5.880 -12.455 2.507 40 HB3 ARG 6 HB3 ARG 6 4.904 -11.004 2.329 41 HG2 ARG 6 HG2 ARG 6 6.260 -9.816 3.960 42 HG3 ARG 6 HG3 ARG 6 7.132 -11.278 4.414 43 HD2 ARG 6 HD2 ARG 6 8.314 -11.404 2.375 44 HD3 ARG 6 HD3 ARG 6 7.152 -10.402 1.520 45 HE ARG 6 HE ARG 6 8.165 -8.481 2.216 46 HH11 ARG 6 HH11 ARG 6 9.608 -11.170 4.052 47 HH12 ARG 6 HH12 ARG 6 10.871 -10.204 4.719 48 HH21 ARG 6 HH21 ARG 6 9.807 -7.226 3.088 49 HH22 ARG 6 HH22 ARG 6 10.994 -7.896 4.147 50 H ASP 7 H ASP 7 4.036 -12.381 6.649 51 HA ASP 7 HA ASP 7 6.485 -13.649 7.526 52 HB2 ASP 7 HB2 ASP 7 5.037 -12.347 9.057 53 HB3 ASP 7 HB3 ASP 7 3.730 -13.513 8.824 54 H GLU 8 H GLU 8 6.837 -15.860 7.916 55 HA GLU 8 HA GLU 8 5.837 -17.623 6.011 56 HB2 GLU 8 HB2 GLU 8 7.199 -18.210 8.671 57 HB3 GLU 8 HB3 GLU 8 6.938 -19.399 7.387 58 HG2 GLU 8 HG2 GLU 8 8.257 -17.981 5.814 59 HG3 GLU 8 HG3 GLU 8 8.592 -16.851 7.128 60 H THR 9 H THR 9 4.380 -16.888 9.187 61 HA THR 9 HA THR 9 2.858 -19.298 9.358 62 HB THR 9 HB THR 9 3.312 -17.463 11.132 63 HG1 THR 9 HG1 THR 9 2.179 -19.237 11.642 64 HG21 THR 9 HG21 THR 9 2.181 -15.559 9.933 65 HG22 THR 9 HG22 THR 9 0.631 -16.404 10.134 66 HG23 THR 9 HG23 THR 9 1.550 -15.876 11.556 67 H ARG 10 H ARG 10 2.237 -16.243 7.545 68 HA ARG 10 HA ARG 10 -0.440 -16.996 6.788 69 HB2 ARG 10 HB2 ARG 10 0.319 -14.658 6.635 70 HB3 ARG 10 HB3 ARG 10 1.542 -15.109 5.432 71 HG2 ARG 10 HG2 ARG 10 -0.187 -15.768 3.835 72 HG3 ARG 10 HG3 ARG 10 -1.460 -15.495 5.039 73 HD2 ARG 10 HD2 ARG 10 -0.998 -13.115 5.056 74 HD3 ARG 10 HD3 ARG 10 0.411 -13.331 4.001 75 HE ARG 10 HE ARG 10 -0.953 -13.784 2.166 76 HH11 ARG 10 HH11 ARG 10 -3.001 -12.599 4.898 77 HH12 ARG 10 HH12 ARG 10 -4.466 -13.104 4.054 78 HH21 ARG 10 HH21 ARG 10 -3.022 -13.986 1.062 79 HH22 ARG 10 HH22 ARG 10 -4.476 -13.660 1.979 80 H GLU 11 H GLU 11 2.777 -17.378 5.258 81 HA GLU 11 HA GLU 11 1.862 -18.540 2.851 82 HB2 GLU 11 HB2 GLU 11 4.486 -19.149 4.270 83 HB3 GLU 11 HB3 GLU 11 4.156 -19.293 2.548 84 HG2 GLU 11 HG2 GLU 11 4.262 -16.688 4.145 85 HG3 GLU 11 HG3 GLU 11 5.531 -17.321 3.121 86 H HIS 12 H HIS 12 2.801 -20.045 5.965 87 HA HIS 12 HA HIS 12 2.332 -22.762 5.271 88 HB2 HIS 12 HB2 HIS 12 3.571 -22.386 7.222 89 HB3 HIS 12 HB3 HIS 12 2.491 -21.125 7.798 90 HD1 HIS 12 HD1 HIS 12 2.052 -24.983 7.285 91 HD2 HIS 12 HD2 HIS 12 1.055 -21.731 9.769 92 HE1 HIS 12 HE1 HIS 12 0.650 -25.939 9.183 93 H ARG 13 H ARG 13 0.125 -20.337 6.864 94 HA ARG 13 HA ARG 13 -2.009 -22.208 7.169 95 HB2 ARG 13 HB2 ARG 13 -1.977 -19.169 6.990 96 HB3 ARG 13 HB3 ARG 13 -3.421 -20.092 7.414 97 HG2 ARG 13 HG2 ARG 13 -2.499 -20.870 9.469 98 HG3 ARG 13 HG3 ARG 13 -0.856 -20.438 9.006 99 HD2 ARG 13 HD2 ARG 13 -1.710 -17.991 8.887 100 HD3 ARG 13 HD3 ARG 13 -3.125 -18.570 9.770 101 HE ARG 13 HE ARG 13 -0.258 -18.723 10.675 102 HH11 ARG 13 HH11 ARG 13 -3.679 -18.374 11.618 103 HH12 ARG 13 HH12 ARG 13 -3.305 -18.022 13.264 104 HH21 ARG 13 HH21 ARG 13 0.217 -18.247 12.737 105 HH22 ARG 13 HH22 ARG 13 -1.004 -17.968 13.948 106 H ILE 14 H ILE 14 -1.467 -19.756 4.577 107 HA ILE 14 HA ILE 14 -3.833 -20.306 3.263 108 HB ILE 14 HB ILE 14 -2.006 -18.414 3.062 109 HG12 ILE 14 HG12 ILE 14 -3.753 -19.097 0.692 110 HG13 ILE 14 HG13 ILE 14 -4.312 -18.394 2.223 111 HG21 ILE 14 HG21 ILE 14 -0.707 -18.383 1.029 112 HG22 ILE 14 HG22 ILE 14 -0.274 -19.813 1.949 113 HG23 ILE 14 HG23 ILE 14 -1.343 -19.965 0.534 114 HD11 ILE 14 HD11 ILE 14 -4.031 -16.549 0.791 115 HD12 ILE 14 HD12 ILE 14 -2.637 -16.507 1.871 116 HD13 ILE 14 HD13 ILE 14 -2.456 -17.110 0.205 117 H GLU 15 H GLU 15 -0.633 -21.851 2.868 118 HA GLU 15 HA GLU 15 -1.289 -23.667 0.779 119 HB2 GLU 15 HB2 GLU 15 0.991 -23.207 1.449 120 HB3 GLU 15 HB3 GLU 15 0.687 -23.799 3.077 121 HG2 GLU 15 HG2 GLU 15 1.921 -25.451 1.819 122 HG3 GLU 15 HG3 GLU 15 0.330 -26.063 2.260 123 H THR 16 H THR 16 -1.496 -24.005 4.387 124 HA THR 16 HA THR 16 -2.613 -26.681 4.015 125 HB THR 16 HB THR 16 -2.350 -26.798 6.495 126 HG1 THR 16 HG1 THR 16 -1.064 -24.283 6.230 127 HG21 THR 16 HG21 THR 16 0.084 -26.853 6.503 128 HG22 THR 16 HG22 THR 16 -0.533 -27.509 4.980 129 HG23 THR 16 HG23 THR 16 0.156 -25.874 5.020 130 H GLU 17 H GLU 17 -4.215 -23.888 3.709 131 HA GLU 17 HA GLU 17 -6.670 -25.192 4.803 132 HB2 GLU 17 HB2 GLU 17 -5.858 -23.309 6.199 133 HB3 GLU 17 HB3 GLU 17 -5.986 -22.222 4.797 134 HG2 GLU 17 HG2 GLU 17 -8.363 -22.606 4.644 135 HG3 GLU 17 HG3 GLU 17 -8.286 -23.874 5.873 136 H ILE 18 H ILE 18 -5.455 -22.858 2.261 137 HA ILE 18 HA ILE 18 -8.157 -22.811 1.141 138 HB ILE 18 HB ILE 18 -5.646 -21.588 -0.052 139 HG12 ILE 18 HG12 ILE 18 -5.625 -20.770 2.196 140 HG13 ILE 18 HG13 ILE 18 -6.122 -19.493 1.109 141 HG21 ILE 18 HG21 ILE 18 -8.596 -20.901 -0.251 142 HG22 ILE 18 HG22 ILE 18 -7.292 -19.862 -0.866 143 HG23 ILE 18 HG23 ILE 18 -7.537 -21.468 -1.552 144 HD11 ILE 18 HD11 ILE 18 -7.324 -19.474 3.240 145 HD12 ILE 18 HD12 ILE 18 -8.442 -19.697 1.872 146 HD13 ILE 18 HD13 ILE 18 -7.994 -21.079 2.905 147 H ILE 19 H ILE 19 -5.118 -24.437 0.424 148 HA ILE 19 HA ILE 19 -6.266 -25.600 -2.069 149 HB ILE 19 HB ILE 19 -4.012 -25.178 -3.079 150 HG12 ILE 19 HG12 ILE 19 -3.480 -23.787 -0.430 151 HG13 ILE 19 HG13 ILE 19 -2.507 -24.964 -1.286 152 HG21 ILE 19 HG21 ILE 19 -5.403 -22.617 -2.217 153 HG22 ILE 19 HG22 ILE 19 -4.496 -22.921 -3.703 154 HG23 ILE 19 HG23 ILE 19 -6.036 -23.731 -3.440 155 HD11 ILE 19 HD11 ILE 19 -2.081 -23.157 -3.031 156 HD12 ILE 19 HD12 ILE 19 -2.943 -22.029 -1.949 157 HD13 ILE 19 HD13 ILE 19 -1.455 -22.807 -1.404 158 H VAL 20 H VAL 20 -5.828 -26.772 0.732 159 HA VAL 20 HA VAL 20 -3.752 -28.674 0.651 160 HB VAL 20 HB VAL 20 -5.287 -30.020 2.178 161 HG11 VAL 20 HG11 VAL 20 -5.004 -28.416 4.020 162 HG12 VAL 20 HG12 VAL 20 -3.574 -28.485 2.976 163 HG13 VAL 20 HG13 VAL 20 -4.706 -27.121 2.830 164 HG21 VAL 20 HG21 VAL 20 -7.508 -29.180 1.418 165 HG22 VAL 20 HG22 VAL 20 -7.240 -28.925 3.141 166 HG23 VAL 20 HG23 VAL 20 -7.099 -27.558 2.028 167 H ASP 21 H ASP 21 -6.932 -28.733 -0.906 168 HA ASP 21 HA ASP 21 -6.889 -31.586 -1.408 169 HB2 ASP 21 HB2 ASP 21 -8.915 -30.237 -0.843 170 HB3 ASP 21 HB3 ASP 21 -8.773 -29.411 -2.395 171 H ALA 22 H ALA 22 -5.093 -29.267 -2.926 172 HA ALA 22 HA ALA 22 -5.335 -30.473 -5.639 173 HB1 ALA 22 HB1 ALA 22 -5.625 -27.548 -4.834 174 HB2 ALA 22 HB2 ALA 22 -5.286 -28.085 -6.492 175 HB3 ALA 22 HB3 ALA 22 -6.802 -28.558 -5.695 176 H GLU 23 H GLU 23 -3.486 -30.155 -6.947 177 HA GLU 23 HA GLU 23 -1.015 -29.179 -5.605 178 HB2 GLU 23 HB2 GLU 23 0.123 -31.240 -6.167 179 HB3 GLU 23 HB3 GLU 23 -1.281 -31.570 -5.156 180 HG2 GLU 23 HG2 GLU 23 -2.573 -32.271 -7.170 181 HG3 GLU 23 HG3 GLU 23 -1.171 -31.940 -8.187 182 H ASP 24 H ASP 24 -2.934 -28.791 -8.283 183 HA ASP 24 HA ASP 24 -0.641 -28.008 -10.027 184 HB2 ASP 24 HB2 ASP 24 -1.716 -30.030 -10.938 185 HB3 ASP 24 HB3 ASP 24 -3.309 -29.282 -10.786 186 H LYS 25 H LYS 25 -0.967 -25.988 -11.066 187 HA LYS 25 HA LYS 25 -2.320 -24.064 -9.657 188 HB2 LYS 25 HB2 LYS 25 -1.827 -22.523 -11.335 189 HB3 LYS 25 HB3 LYS 25 -0.480 -23.641 -11.284 190 HG2 LYS 25 HG2 LYS 25 -2.719 -23.667 -13.360 191 HG3 LYS 25 HG3 LYS 25 -1.198 -22.826 -13.566 192 HD2 LYS 25 HD2 LYS 25 0.069 -24.800 -13.782 193 HD3 LYS 25 HD3 LYS 25 -1.169 -25.797 -13.032 194 HE2 LYS 25 HE2 LYS 25 -2.524 -24.688 -15.190 195 HE3 LYS 25 HE3 LYS 25 -0.916 -24.962 -15.856 196 HZ1 LYS 25 HZ1 LYS 25 -1.143 -27.255 -15.470 197 HZ2 LYS 25 HZ2 LYS 25 -2.319 -27.079 -14.340 198 HZ3 LYS 25 HZ3 LYS 25 -2.686 -26.823 -15.909 199 H GLU 26 H GLU 26 -3.815 -26.028 -12.270 200 HA GLU 26 HA GLU 26 -6.091 -24.191 -12.529 201 HB2 GLU 26 HB2 GLU 26 -5.560 -27.048 -13.456 202 HB3 GLU 26 HB3 GLU 26 -7.102 -26.226 -13.714 203 HG2 GLU 26 HG2 GLU 26 -6.083 -24.501 -15.053 204 HG3 GLU 26 HG3 GLU 26 -4.462 -25.056 -14.652 205 H GLU 27 H GLU 27 -5.348 -27.241 -10.808 206 HA GLU 27 HA GLU 27 -7.973 -27.561 -9.655 207 HB2 GLU 27 HB2 GLU 27 -5.258 -28.650 -8.794 208 HB3 GLU 27 HB3 GLU 27 -6.822 -29.205 -8.194 209 HG2 GLU 27 HG2 GLU 27 -5.854 -29.402 -11.081 210 HG3 GLU 27 HG3 GLU 27 -5.849 -30.704 -9.903 211 H ARG 28 H ARG 28 -4.985 -25.866 -8.659 212 HA ARG 28 HA ARG 28 -6.035 -25.186 -6.038 213 HB2 ARG 28 HB2 ARG 28 -3.642 -24.156 -7.638 214 HB3 ARG 28 HB3 ARG 28 -4.077 -23.575 -6.018 215 HG2 ARG 28 HG2 ARG 28 -4.093 -25.942 -5.216 216 HG3 ARG 28 HG3 ARG 28 -3.440 -26.471 -6.764 217 HD2 ARG 28 HD2 ARG 28 -1.344 -25.405 -6.343 218 HD3 ARG 28 HD3 ARG 28 -2.039 -24.442 -5.016 219 HE ARG 28 HE ARG 28 -2.289 -27.320 -4.630 220 HH11 ARG 28 HH11 ARG 28 -0.011 -24.657 -4.003 221 HH12 ARG 28 HH12 ARG 28 0.280 -25.172 -2.360 222 HH21 ARG 28 HH21 ARG 28 -1.847 -27.994 -2.604 223 HH22 ARG 28 HH22 ARG 28 -0.634 -27.190 -1.614 224 H ALA 29 H ALA 29 -6.276 -23.657 -9.239 225 HA ALA 29 HA ALA 29 -7.414 -21.197 -8.229 226 HB1 ALA 29 HB1 ALA 29 -7.942 -22.559 -10.907 227 HB2 ALA 29 HB2 ALA 29 -8.234 -20.868 -10.484 228 HB3 ALA 29 HB3 ALA 29 -6.573 -21.471 -10.575 229 H MET 30 H MET 30 -8.720 -24.470 -9.050 230 HA MET 30 HA MET 30 -11.427 -23.769 -8.390 231 HB2 MET 30 HB2 MET 30 -10.106 -26.494 -8.378 232 HB3 MET 30 HB3 MET 30 -11.828 -26.183 -8.223 233 HG2 MET 30 HG2 MET 30 -10.168 -25.352 -10.629 234 HG3 MET 30 HG3 MET 30 -11.072 -26.848 -10.494 235 HE1 MET 30 HE1 MET 30 -12.208 -22.773 -9.966 236 HE2 MET 30 HE2 MET 30 -11.021 -23.166 -11.230 237 HE3 MET 30 HE3 MET 30 -12.693 -22.749 -11.655 238 H GLY 31 H GLY 31 -8.740 -25.036 -6.339 239 HA2 GLY 31 HA2 GLY 31 -10.160 -25.323 -3.938 240 HA3 GLY 31 HA3 GLY 31 -8.477 -24.781 -4.058 241 H TRP 32 H TRP 32 -8.486 -22.348 -5.109 242 HA TRP 32 HA TRP 32 -9.443 -20.543 -3.211 243 HB2 TRP 32 HB2 TRP 32 -8.548 -20.267 -6.090 244 HB3 TRP 32 HB3 TRP 32 -9.227 -18.892 -5.237 245 HD1 TRP 32 HD1 TRP 32 -6.039 -20.916 -5.425 246 HE1 TRP 32 HE1 TRP 32 -4.253 -19.853 -3.954 247 HE3 TRP 32 HE3 TRP 32 -8.919 -17.384 -3.120 248 HZ2 TRP 32 HZ2 TRP 32 -4.172 -17.946 -1.735 249 HZ3 TRP 32 HZ3 TRP 32 -7.969 -15.960 -1.332 250 HH2 TRP 32 HH2 TRP 32 -5.628 -16.241 -0.621 251 H TYR 33 H TYR 33 -10.956 -21.448 -6.383 252 HA TYR 33 HA TYR 33 -13.187 -19.750 -6.190 253 HB2 TYR 33 HB2 TYR 33 -12.566 -20.961 -8.234 254 HB3 TYR 33 HB3 TYR 33 -12.937 -22.496 -7.469 255 HD1 TYR 33 HD2 TYR 33 -15.294 -23.130 -6.897 256 HD2 TYR 33 HD1 TYR 33 -14.335 -19.610 -9.190 257 HE1 TYR 33 HE2 TYR 33 -17.648 -22.969 -7.610 258 HE2 TYR 33 HE1 TYR 33 -16.640 -19.541 -10.056 259 HH TYR 33 HH TYR 33 -19.184 -21.851 -8.976 260 H TYR 34 H TYR 34 -12.823 -23.140 -4.951 261 HA TYR 34 HA TYR 34 -15.546 -23.448 -4.331 262 HB2 TYR 34 HB2 TYR 34 -13.123 -24.791 -3.070 263 HB3 TYR 34 HB3 TYR 34 -14.783 -25.291 -2.802 264 HD1 TYR 34 HD2 TYR 34 -15.958 -25.198 -5.574 265 HD2 TYR 34 HD1 TYR 34 -12.166 -26.667 -4.120 266 HE1 TYR 34 HE2 TYR 34 -15.835 -26.749 -7.482 267 HE2 TYR 34 HE1 TYR 34 -12.047 -28.245 -6.020 268 HH TYR 34 HH TYR 34 -14.605 -28.425 -8.542 269 H TYR 35 H TYR 35 -12.839 -22.486 -2.048 270 HA TYR 35 HA TYR 35 -14.807 -22.245 0.063 271 HB2 TYR 35 HB2 TYR 35 -13.145 -21.779 1.489 272 HB3 TYR 35 HB3 TYR 35 -12.163 -22.509 0.230 273 HD1 TYR 35 HD1 TYR 35 -10.931 -20.988 -1.387 274 HD2 TYR 35 HD2 TYR 35 -12.974 -19.452 2.087 275 HE1 TYR 35 HE1 TYR 35 -9.869 -18.806 -1.738 276 HE2 TYR 35 HE2 TYR 35 -11.906 -17.248 1.755 277 HH TYR 35 HH TYR 35 -10.524 -15.963 0.395 278 H LEU 36 H LEU 36 -13.423 -19.927 -2.310 279 HA LEU 36 HA LEU 36 -14.399 -17.589 -1.057 280 HB2 LEU 36 HB2 LEU 36 -12.660 -17.570 -2.775 281 HB3 LEU 36 HB3 LEU 36 -13.799 -18.195 -3.976 282 HG LEU 36 HG LEU 36 -15.119 -16.115 -3.845 283 HD11 LEU 36 HD11 LEU 36 -12.941 -15.155 -1.926 284 HD12 LEU 36 HD12 LEU 36 -14.174 -14.121 -2.680 285 HD13 LEU 36 HD13 LEU 36 -14.665 -15.377 -1.540 286 HD21 LEU 36 HD21 LEU 36 -12.151 -15.613 -4.320 287 HD22 LEU 36 HD22 LEU 36 -13.265 -16.399 -5.463 288 HD23 LEU 36 HD23 LEU 36 -13.521 -14.714 -5.016 289 H ASP 37 H ASP 37 -15.835 -19.602 -3.695 290 HA ASP 37 HA ASP 37 -18.193 -18.072 -4.065 291 HB2 ASP 37 HB2 ASP 37 -17.423 -19.803 -5.638 292 HB3 ASP 37 HB3 ASP 37 -17.695 -21.054 -4.423 293 H ASP 38 H ASP 38 -17.441 -20.761 -1.817 294 HA ASP 38 HA ASP 38 -20.059 -20.940 -0.663 295 HB2 ASP 38 HB2 ASP 38 -18.391 -22.729 -0.507 296 HB3 ASP 38 HB3 ASP 38 -17.336 -21.695 0.457 297 H THR 39 H THR 39 -17.446 -18.627 -0.128 298 HA THR 39 HA THR 39 -18.506 -17.870 2.530 299 HB THR 39 HB THR 39 -16.022 -16.943 1.033 300 HG1 THR 39 HG1 THR 39 -15.811 -19.049 1.549 301 HG21 THR 39 HG21 THR 39 -16.588 -15.261 2.657 302 HG22 THR 39 HG22 THR 39 -17.015 -16.467 3.875 303 HG23 THR 39 HG23 THR 39 -15.317 -16.251 3.390 304 H LEU 40 H LEU 40 -18.188 -16.532 -0.779 305 HA LEU 40 HA LEU 40 -18.972 -13.851 -0.155 306 HB2 LEU 40 HB2 LEU 40 -19.293 -15.533 -2.671 307 HB3 LEU 40 HB3 LEU 40 -19.734 -13.831 -2.589 308 HG LEU 40 HG LEU 40 -16.919 -14.880 -2.133 309 HD11 LEU 40 HD11 LEU 40 -16.449 -14.031 -4.405 310 HD12 LEU 40 HD12 LEU 40 -17.676 -15.301 -4.438 311 HD13 LEU 40 HD13 LEU 40 -18.160 -13.600 -4.605 312 HD21 LEU 40 HD21 LEU 40 -17.080 -12.785 -1.046 313 HD22 LEU 40 HD22 LEU 40 -16.257 -12.518 -2.577 314 HD23 LEU 40 HD23 LEU 40 -17.965 -12.059 -2.421 315 H GLU 41 H GLU 41 -20.917 -13.287 0.788 316 HA GLU 41 HA GLU 41 -23.281 -15.003 0.461 317 HB2 GLU 41 HB2 GLU 41 -22.892 -12.407 2.009 318 HB3 GLU 41 HB3 GLU 41 -24.364 -13.398 1.972 319 HG2 GLU 41 HG2 GLU 41 -22.807 -15.357 2.723 320 HG3 GLU 41 HG3 GLU 41 -21.678 -14.086 3.192 321 H PHE 42 H PHE 42 -22.635 -14.440 -1.962 322 HA PHE 42 HA PHE 42 -23.439 -11.956 -3.068 323 HB2 PHE 42 HB2 PHE 42 -23.188 -13.064 -5.222 324 HB3 PHE 42 HB3 PHE 42 -21.881 -13.511 -4.161 325 HD1 PHE 42 HD1 PHE 42 -25.084 -14.699 -5.689 326 HD2 PHE 42 HD2 PHE 42 -21.470 -15.836 -3.622 327 HE1 PHE 42 HE1 PHE 42 -25.561 -17.084 -6.156 328 HE2 PHE 42 HE2 PHE 42 -21.957 -18.214 -4.085 329 HZ PHE 42 HZ PHE 42 -24.002 -18.851 -5.352 330 HA PRO 43 HA PRO 43 -24.456 -11.372 -5.335 331 HB2 PRO 43 HB2 PRO 43 -26.386 -9.552 -5.910 332 HB3 PRO 43 HB3 PRO 43 -26.327 -11.174 -6.665 333 HG2 PRO 43 HG2 PRO 43 -27.992 -10.297 -4.286 334 HG3 PRO 43 HG3 PRO 43 -28.528 -11.195 -5.743 335 HD2 PRO 43 HD2 PRO 43 -27.891 -12.464 -3.409 336 HD3 PRO 43 HD3 PRO 43 -27.513 -13.191 -4.998 337 H PHE 44 H PHE 44 -23.665 -9.209 -5.129 338 HA PHE 44 HA PHE 44 -24.342 -7.639 -2.735 339 HB2 PHE 44 HB2 PHE 44 -22.088 -7.490 -1.938 340 HB3 PHE 44 HB3 PHE 44 -22.631 -9.145 -1.879 341 HD1 PHE 44 HD1 PHE 44 -21.717 -10.838 -3.559 342 HD2 PHE 44 HD2 PHE 44 -20.071 -6.889 -3.112 343 HE1 PHE 44 HE1 PHE 44 -19.594 -11.612 -4.566 344 HE2 PHE 44 HE2 PHE 44 -17.955 -7.654 -4.136 345 HZ PHE 44 HZ PHE 44 -17.698 -10.025 -4.845 346 H MET 45 H MET 45 -22.356 -5.672 -2.989 347 HA MET 45 HA MET 45 -22.438 -4.916 -5.853 348 HB2 MET 45 HB2 MET 45 -23.349 -2.831 -5.533 349 HB3 MET 45 HB3 MET 45 -24.392 -3.883 -4.607 350 HG2 MET 45 HG2 MET 45 -23.785 -2.956 -2.594 351 HG3 MET 45 HG3 MET 45 -22.144 -2.595 -3.095 352 HE1 MET 45 HE1 MET 45 -22.343 0.766 -4.982 353 HE2 MET 45 HE2 MET 45 -21.327 -0.594 -4.487 354 HE3 MET 45 HE3 MET 45 -22.470 -0.789 -5.825 355 H GLY 46 H GLY 46 -21.083 -2.960 -6.308 356 HA2 GLY 46 HA2 GLY 46 -18.829 -2.495 -4.503 357 HA3 GLY 46 HA3 GLY 46 -18.448 -3.595 -5.838 358 H LYS 47 H LYS 47 -16.963 -1.640 -5.849 359 HA LYS 47 HA LYS 47 -17.916 0.082 -8.090 360 HB2 LYS 47 HB2 LYS 47 -17.220 1.248 -5.843 361 HB3 LYS 47 HB3 LYS 47 -15.584 0.752 -6.247 362 HG2 LYS 47 HG2 LYS 47 -15.697 2.915 -7.126 363 HG3 LYS 47 HG3 LYS 47 -16.015 1.911 -8.543 364 HD2 LYS 47 HD2 LYS 47 -17.628 3.633 -8.648 365 HD3 LYS 47 HD3 LYS 47 -18.514 2.233 -8.042 366 HE2 LYS 47 HE2 LYS 47 -18.445 3.097 -5.770 367 HE3 LYS 47 HE3 LYS 47 -17.347 4.401 -6.251 368 HZ1 LYS 47 HZ1 LYS 47 -19.082 5.394 -7.526 369 HZ2 LYS 47 HZ2 LYS 47 -20.091 4.130 -7.348 370 HZ3 LYS 47 HZ3 LYS 47 -19.716 5.078 -6.059 371 H TRP 48 H TRP 48 -17.041 -0.643 -9.959 372 HA TRP 48 HA TRP 48 -14.621 -2.343 -9.937 373 HB2 TRP 48 HB2 TRP 48 -16.544 -2.744 -11.513 374 HB3 TRP 48 HB3 TRP 48 -16.169 -1.222 -12.302 375 HD1 TRP 48 HD1 TRP 48 -12.845 -2.324 -11.792 376 HE1 TRP 48 HE1 TRP 48 -11.879 -3.735 -13.615 377 HE3 TRP 48 HE3 TRP 48 -17.211 -3.599 -14.176 378 HZ2 TRP 48 HZ2 TRP 48 -12.841 -5.344 -15.821 379 HZ3 TRP 48 HZ3 TRP 48 -17.123 -5.115 -16.146 380 HH2 TRP 48 HH2 TRP 48 -14.947 -5.991 -16.963 381 H LYS 49 H LYS 49 -12.811 -1.269 -9.474 382 HA LYS 49 HA LYS 49 -12.368 1.555 -10.115 383 HB2 LYS 49 HB2 LYS 49 -10.464 -0.592 -9.049 384 HB3 LYS 49 HB3 LYS 49 -10.182 1.145 -9.036 385 HG2 LYS 49 HG2 LYS 49 -12.229 -0.385 -7.376 386 HG3 LYS 49 HG3 LYS 49 -10.694 0.285 -6.846 387 HD2 LYS 49 HD2 LYS 49 -11.870 2.565 -7.808 388 HD3 LYS 49 HD3 LYS 49 -13.310 1.636 -7.328 389 HE2 LYS 49 HE2 LYS 49 -11.997 1.202 -5.101 390 HE3 LYS 49 HE3 LYS 49 -10.899 2.470 -5.658 391 HZ1 LYS 49 HZ1 LYS 49 -13.677 2.681 -4.776 392 HZ2 LYS 49 HZ2 LYS 49 -12.398 3.569 -4.339 393 HZ3 LYS 49 HZ3 LYS 49 -13.064 3.862 -5.806 394 H LYS 50 H LYS 50 -12.889 0.824 -12.504 395 HA LYS 50 HA LYS 50 -11.119 -1.025 -13.838 396 HB2 LYS 50 HB2 LYS 50 -13.440 -0.677 -14.530 397 HB3 LYS 50 HB3 LYS 50 -13.120 1.016 -14.918 398 HG2 LYS 50 HG2 LYS 50 -11.652 0.419 -16.738 399 HG3 LYS 50 HG3 LYS 50 -11.666 -1.291 -16.286 400 HD2 LYS 50 HD2 LYS 50 -14.103 0.275 -17.250 401 HD3 LYS 50 HD3 LYS 50 -13.057 -0.717 -18.281 402 HE2 LYS 50 HE2 LYS 50 -13.553 -2.698 -16.800 403 HE3 LYS 50 HE3 LYS 50 -14.723 -1.709 -15.922 404 HZ1 LYS 50 HZ1 LYS 50 -15.797 -3.023 -17.618 405 HZ2 LYS 50 HZ2 LYS 50 -15.941 -1.447 -18.028 406 HZ3 LYS 50 HZ3 LYS 50 -14.864 -2.402 -18.802 407 H LYS 51 H LYS 51 -9.225 -0.640 -14.997 408 HA LYS 51 HA LYS 51 -7.997 2.015 -14.632 409 HB2 LYS 51 HB2 LYS 51 -7.011 -0.650 -15.703 410 HB3 LYS 51 HB3 LYS 51 -6.107 0.829 -16.000 411 HG2 LYS 51 HG2 LYS 51 -5.268 -0.411 -14.026 412 HG3 LYS 51 HG3 LYS 51 -5.761 1.247 -13.656 413 HD2 LYS 51 HD2 LYS 51 -7.843 0.488 -12.691 414 HD3 LYS 51 HD3 LYS 51 -7.531 -1.190 -13.193 415 HE2 LYS 51 HE2 LYS 51 -5.635 -1.276 -11.605 416 HE3 LYS 51 HE3 LYS 51 -5.945 0.411 -11.145 417 HZ1 LYS 51 HZ1 LYS 51 -7.050 -1.075 -9.598 418 HZ2 LYS 51 HZ2 LYS 51 -8.224 -0.337 -10.514 419 HZ3 LYS 51 HZ3 LYS 51 -7.821 -1.866 -10.827 420 H SER 52 H SER 52 -7.222 3.320 -16.344 421 HA SER 52 HA SER 52 -8.983 3.513 -18.603 422 HB2 SER 52 HB2 SER 52 -7.708 5.491 -19.096 423 HB3 SER 52 HB3 SER 52 -8.061 5.416 -17.370 424 HG SER 52 HG SER 52 -5.712 5.380 -18.710 425 H ARG 53 H ARG 53 -7.377 4.147 -20.745 426 HA ARG 53 HA ARG 53 -6.833 1.434 -21.722 427 HB2 ARG 53 HB2 ARG 53 -6.997 4.149 -23.108 428 HB3 ARG 53 HB3 ARG 53 -6.647 2.631 -23.922 429 HG2 ARG 53 HG2 ARG 53 -8.901 3.135 -24.316 430 HG3 ARG 53 HG3 ARG 53 -8.859 1.722 -23.278 431 HD2 ARG 53 HD2 ARG 53 -9.186 4.459 -22.016 432 HD3 ARG 53 HD3 ARG 53 -10.541 3.766 -22.923 433 HE ARG 53 HE ARG 53 -9.513 1.844 -21.063 434 HH11 ARG 53 HH11 ARG 53 -11.681 4.642 -21.349 435 HH12 ARG 53 HH12 ARG 53 -12.502 4.348 -19.845 436 HH21 ARG 53 HH21 ARG 53 -10.576 1.519 -18.966 437 HH22 ARG 53 HH22 ARG 53 -11.994 2.470 -18.620 438 H LYS 54 H LYS 54 -4.976 1.495 -20.067 439 HA LYS 54 HA LYS 54 -2.819 1.656 -19.471 440 HB2 LYS 54 HB2 LYS 54 -2.700 0.234 -21.590 441 HB3 LYS 54 HB3 LYS 54 -2.074 1.666 -22.415 442 HG2 LYS 54 HG2 LYS 54 -0.186 1.742 -20.762 443 HG3 LYS 54 HG3 LYS 54 -0.853 0.310 -19.960 444 HD2 LYS 54 HD2 LYS 54 -0.595 -0.982 -22.066 445 HD3 LYS 54 HD3 LYS 54 0.107 0.429 -22.862 446 HE2 LYS 54 HE2 LYS 54 1.257 -0.960 -20.393 447 HE3 LYS 54 HE3 LYS 54 1.776 -1.270 -22.050 448 HZ1 LYS 54 HZ1 LYS 54 2.488 1.043 -22.204 449 HZ2 LYS 54 HZ2 LYS 54 2.033 1.331 -20.657 450 HZ3 LYS 54 HZ3 LYS 54 3.242 0.290 -20.975 451 H THR 55 H THR 55 -4.159 3.950 -19.289 452 HA THR 55 HA THR 55 -2.187 6.073 -19.942 453 HB THR 55 HB THR 55 -4.459 7.477 -20.024 454 HG1 THR 55 HG1 THR 55 -6.106 6.273 -20.909 455 HG21 THR 55 HG21 THR 55 -4.564 7.111 -22.451 456 HG22 THR 55 HG22 THR 55 -2.885 7.238 -21.905 457 HG23 THR 55 HG23 THR 55 -3.571 5.647 -22.290 458 H SER 56 H SER 56 -2.558 4.332 -17.547 459 HA SER 56 HA SER 56 -2.538 4.436 -15.303 460 HB2 SER 56 HB2 SER 56 -1.069 7.015 -15.919 461 HB3 SER 56 HB3 SER 56 -0.827 5.936 -14.530 462 HG SER 56 HG SER 56 0.722 5.599 -16.194 463 H THR 57 H THR 57 -5.077 5.372 -16.088 464 HA THR 57 HA THR 57 -5.718 7.206 -13.843 465 HB THR 57 HB THR 57 -6.946 7.249 -16.625 466 HG1 THR 57 HG1 THR 57 -4.854 8.066 -16.664 467 HG21 THR 57 HG21 THR 57 -7.885 9.456 -15.871 468 HG22 THR 57 HG22 THR 57 -8.562 8.074 -15.016 469 HG23 THR 57 HG23 THR 57 -7.331 9.085 -14.222 470 H ILE 58 H ILE 58 -8.048 6.835 -13.157 471 HA ILE 58 HA ILE 58 -8.961 4.057 -13.683 472 HB ILE 58 HB ILE 58 -8.510 5.411 -11.007 473 HG12 ILE 58 HG12 ILE 58 -7.392 2.943 -12.402 474 HG13 ILE 58 HG13 ILE 58 -6.523 4.394 -11.903 475 HG21 ILE 58 HG21 ILE 58 -9.542 3.445 -9.928 476 HG22 ILE 58 HG22 ILE 58 -10.706 4.295 -10.914 477 HG23 ILE 58 HG23 ILE 58 -9.975 2.798 -11.532 478 HD11 ILE 58 HD11 ILE 58 -5.933 2.631 -10.413 479 HD12 ILE 58 HD12 ILE 58 -6.966 3.757 -9.503 480 HD13 ILE 58 HD13 ILE 58 -7.625 2.211 -10.109 481 H GLU 59 H GLU 59 -11.062 3.745 -13.718 482 HA GLU 59 HA GLU 59 -12.958 6.039 -13.581 483 HB2 GLU 59 HB2 GLU 59 -13.102 3.377 -15.069 484 HB3 GLU 59 HB3 GLU 59 -14.383 4.594 -15.034 485 HG2 GLU 59 HG2 GLU 59 -12.967 6.189 -16.235 486 HG3 GLU 59 HG3 GLU 59 -11.607 5.060 -16.221 487 H GLU 60 H GLU 60 -14.898 5.507 -12.373 488 HA GLU 60 HA GLU 60 -14.635 3.155 -10.545 489 HB2 GLU 60 HB2 GLU 60 -15.334 6.041 -9.854 490 HB3 GLU 60 HB3 GLU 60 -15.488 4.661 -8.762 491 HG2 GLU 60 HG2 GLU 60 -13.013 4.204 -9.131 492 HG3 GLU 60 HG3 GLU 60 -12.916 5.744 -9.988 493 H LYS 61 H LYS 61 -16.079 1.910 -11.650 494 HA LYS 61 HA LYS 61 -18.709 3.093 -12.436 495 HB2 LYS 61 HB2 LYS 61 -17.445 1.924 -14.166 496 HB3 LYS 61 HB3 LYS 61 -17.313 0.484 -13.152 497 HG2 LYS 61 HG2 LYS 61 -19.745 0.155 -13.229 498 HG3 LYS 61 HG3 LYS 61 -19.953 1.628 -14.169 499 HD2 LYS 61 HD2 LYS 61 -18.201 -0.700 -15.090 500 HD3 LYS 61 HD3 LYS 61 -19.919 -0.659 -15.420 501 HE2 LYS 61 HE2 LYS 61 -17.923 1.472 -16.318 502 HE3 LYS 61 HE3 LYS 61 -18.537 0.155 -17.322 503 HZ1 LYS 61 HZ1 LYS 61 -19.773 2.168 -17.731 504 HZ2 LYS 61 HZ2 LYS 61 -20.774 1.053 -17.059 505 HZ3 LYS 61 HZ3 LYS 61 -20.212 2.299 -16.160 506 H THR 62 H THR 62 -20.347 2.862 -10.924 507 HA THR 62 HA THR 62 -20.138 0.986 -8.751 508 HB THR 62 HB THR 62 -22.641 2.419 -9.722 509 HG1 THR 62 HG1 THR 62 -21.870 4.235 -8.965 510 HG21 THR 62 HG21 THR 62 -23.161 2.488 -7.308 511 HG22 THR 62 HG22 THR 62 -22.875 0.814 -7.811 512 HG23 THR 62 HG23 THR 62 -21.609 1.700 -6.936 513 H VAL 63 H VAL 63 -20.865 -1.067 -8.623 514 HA VAL 63 HA VAL 63 -22.472 -2.202 -10.874 515 HB VAL 63 HB VAL 63 -20.915 -4.083 -10.896 516 HG11 VAL 63 HG11 VAL 63 -19.517 -1.521 -11.702 517 HG12 VAL 63 HG12 VAL 63 -19.268 -3.136 -12.382 518 HG13 VAL 63 HG13 VAL 63 -20.812 -2.308 -12.630 519 HG21 VAL 63 HG21 VAL 63 -18.613 -3.919 -10.097 520 HG22 VAL 63 HG22 VAL 63 -18.934 -2.320 -9.402 521 HG23 VAL 63 HG23 VAL 63 -19.728 -3.765 -8.735 522 H GLU 64 H GLU 64 -23.390 -4.262 -10.457 523 HA GLU 64 HA GLU 64 -23.679 -5.001 -7.570 524 HB2 GLU 64 HB2 GLU 64 -25.809 -4.367 -8.661 525 HB3 GLU 64 HB3 GLU 64 -25.541 -5.593 -9.905 526 HG2 GLU 64 HG2 GLU 64 -25.579 -7.359 -8.141 527 HG3 GLU 64 HG3 GLU 64 -25.817 -6.110 -6.915 528 H VAL 65 H VAL 65 -22.670 -6.916 -7.084 529 HA VAL 65 HA VAL 65 -21.389 -8.416 -9.310 530 HB VAL 65 HB VAL 65 -20.757 -8.543 -6.336 531 HG11 VAL 65 HG11 VAL 65 -19.265 -9.402 -8.861 532 HG12 VAL 65 HG12 VAL 65 -18.613 -9.506 -7.214 533 HG13 VAL 65 HG13 VAL 65 -20.012 -10.489 -7.668 534 HG21 VAL 65 HG21 VAL 65 -20.279 -6.245 -7.048 535 HG22 VAL 65 HG22 VAL 65 -18.765 -7.130 -6.891 536 HG23 VAL 65 HG23 VAL 65 -19.449 -6.836 -8.506 537 H LEU 66 H LEU 66 -22.504 -10.133 -9.959 538 HA LEU 66 HA LEU 66 -24.893 -10.926 -8.500 539 HB2 LEU 66 HB2 LEU 66 -23.663 -11.572 -11.186 540 HB3 LEU 66 HB3 LEU 66 -24.910 -12.626 -10.531 541 HG LEU 66 HG LEU 66 -26.494 -10.773 -10.361 542 HD11 LEU 66 HD11 LEU 66 -25.016 -8.835 -10.053 543 HD12 LEU 66 HD12 LEU 66 -24.332 -9.068 -11.677 544 HD13 LEU 66 HD13 LEU 66 -26.037 -8.604 -11.462 545 HD21 LEU 66 HD21 LEU 66 -26.394 -12.140 -12.412 546 HD22 LEU 66 HD22 LEU 66 -26.859 -10.474 -12.787 547 HD23 LEU 66 HD23 LEU 66 -25.201 -11.026 -13.111 548 H GLY 67 H GLY 67 -21.638 -12.310 -8.964 549 HA2 GLY 67 HA2 GLY 67 -21.498 -14.063 -6.909 550 HA3 GLY 67 HA3 GLY 67 -22.380 -14.979 -8.154 551 H MET 68 H MET 68 -20.156 -16.137 -7.783 552 HA MET 68 HA MET 68 -17.841 -15.150 -9.223 553 HB2 MET 68 HB2 MET 68 -18.712 -17.983 -8.508 554 HB3 MET 68 HB3 MET 68 -17.173 -17.555 -9.249 555 HG2 MET 68 HG2 MET 68 -18.124 -16.617 -6.524 556 HG3 MET 68 HG3 MET 68 -16.970 -17.910 -6.823 557 HE1 MET 68 HE1 MET 68 -14.507 -17.609 -7.645 558 HE2 MET 68 HE2 MET 68 -15.062 -16.789 -9.127 559 HE3 MET 68 HE3 MET 68 -13.805 -16.049 -8.126 560 H ALA 69 H ALA 69 -17.122 -15.751 -11.285 561 HA ALA 69 HA ALA 69 -19.101 -16.082 -13.389 562 HB1 ALA 69 HB1 ALA 69 -17.126 -16.023 -14.833 563 HB2 ALA 69 HB2 ALA 69 -16.936 -14.805 -13.574 564 HB3 ALA 69 HB3 ALA 69 -16.078 -16.366 -13.451 565 HA PRO 70 HA PRO 70 -19.144 -20.553 -13.887 566 HB2 PRO 70 HB2 PRO 70 -17.680 -20.180 -16.506 567 HB3 PRO 70 HB3 PRO 70 -19.084 -21.233 -16.142 568 HG2 PRO 70 HG2 PRO 70 -19.474 -18.862 -17.382 569 HG3 PRO 70 HG3 PRO 70 -20.561 -19.345 -16.037 570 HD2 PRO 70 HD2 PRO 70 -18.196 -17.474 -15.971 571 HD3 PRO 70 HD3 PRO 70 -19.809 -17.264 -15.222 572 H ASP 71 H ASP 71 -17.826 -22.327 -13.448 573 HA ASP 71 HA ASP 71 -15.304 -21.858 -12.309 574 HB2 ASP 71 HB2 ASP 71 -15.150 -24.143 -11.915 575 HB3 ASP 71 HB3 ASP 71 -16.873 -23.809 -11.854 576 H ASP 72 H ASP 72 -16.175 -22.640 -15.640 577 HA ASP 72 HA ASP 72 -13.598 -23.494 -16.544 578 HB2 ASP 72 HB2 ASP 72 -15.671 -23.895 -17.802 579 HB3 ASP 72 HB3 ASP 72 -15.878 -22.158 -18.051 580 H GLU 73 H GLU 73 -15.016 -20.257 -16.066 581 HA GLU 73 HA GLU 73 -12.796 -18.843 -17.382 582 HB2 GLU 73 HB2 GLU 73 -14.901 -17.833 -15.406 583 HB3 GLU 73 HB3 GLU 73 -13.792 -16.843 -16.334 584 HG2 GLU 73 HG2 GLU 73 -16.064 -18.546 -17.427 585 HG3 GLU 73 HG3 GLU 73 -16.024 -16.794 -17.303 586 H CYS 74 H CYS 74 -13.849 -19.840 -14.126 587 HA CYS 74 HA CYS 74 -11.797 -18.384 -12.796 588 HB2 CYS 74 HB2 CYS 74 -13.659 -20.532 -11.736 589 HB3 CYS 74 HB3 CYS 74 -12.656 -19.443 -10.764 590 HG CYS 74 HG CYS 74 -15.150 -18.777 -12.832 591 H LEU 75 H LEU 75 -11.007 -20.730 -14.701 592 HA LEU 75 HA LEU 75 -9.395 -22.472 -12.989 593 HB2 LEU 75 HB2 LEU 75 -9.444 -21.999 -16.002 594 HB3 LEU 75 HB3 LEU 75 -8.380 -23.156 -15.212 595 HG LEU 75 HG LEU 75 -11.415 -23.289 -15.188 596 HD11 LEU 75 HD11 LEU 75 -11.120 -25.226 -16.664 597 HD12 LEU 75 HD12 LEU 75 -10.443 -23.762 -17.391 598 HD13 LEU 75 HD13 LEU 75 -9.359 -24.973 -16.668 599 HD21 LEU 75 HD21 LEU 75 -9.338 -25.237 -14.081 600 HD22 LEU 75 HD22 LEU 75 -10.532 -24.320 -13.142 601 HD23 LEU 75 HD23 LEU 75 -11.078 -25.573 -14.244 602 H LYS 76 H LYS 76 -9.052 -19.240 -14.170 603 HA LYS 76 HA LYS 76 -6.122 -19.353 -13.621 604 HB2 LYS 76 HB2 LYS 76 -5.724 -17.897 -15.509 605 HB3 LYS 76 HB3 LYS 76 -6.481 -19.408 -16.017 606 HG2 LYS 76 HG2 LYS 76 -8.680 -18.227 -16.195 607 HG3 LYS 76 HG3 LYS 76 -7.886 -16.711 -15.722 608 HD2 LYS 76 HD2 LYS 76 -6.420 -16.856 -17.713 609 HD3 LYS 76 HD3 LYS 76 -7.206 -18.382 -18.182 610 HE2 LYS 76 HE2 LYS 76 -9.392 -17.200 -18.333 611 HE3 LYS 76 HE3 LYS 76 -8.602 -15.685 -17.876 612 HZ1 LYS 76 HZ1 LYS 76 -8.017 -17.232 -20.335 613 HZ2 LYS 76 HZ2 LYS 76 -8.874 -15.849 -20.264 614 HZ3 LYS 76 HZ3 LYS 76 -7.285 -15.833 -19.908 615 H ASP 77 H ASP 77 -9.116 -17.500 -13.203 616 HA ASP 77 HA ASP 77 -7.724 -15.816 -11.240 617 HB2 ASP 77 HB2 ASP 77 -7.338 -14.539 -13.318 618 HB3 ASP 77 HB3 ASP 77 -9.048 -14.643 -13.722 619 H MET 78 H MET 78 -9.291 -14.828 -9.793 620 HA MET 78 HA MET 78 -11.848 -16.215 -9.666 621 HB2 MET 78 HB2 MET 78 -10.323 -14.269 -7.925 622 HB3 MET 78 HB3 MET 78 -12.024 -14.591 -7.619 623 HG2 MET 78 HG2 MET 78 -10.477 -15.961 -6.272 624 HG3 MET 78 HG3 MET 78 -11.680 -16.874 -7.165 625 HE1 MET 78 HE1 MET 78 -10.885 -18.147 -9.685 626 HE2 MET 78 HE2 MET 78 -9.733 -19.393 -9.183 627 HE3 MET 78 HE3 MET 78 -11.161 -19.066 -8.184 628 H TYR 79 H TYR 79 -12.676 -15.527 -11.690 629 HA TYR 79 HA TYR 79 -13.384 -12.736 -12.139 630 HB2 TYR 79 HB2 TYR 79 -14.119 -15.370 -13.465 631 HB3 TYR 79 HB3 TYR 79 -14.753 -13.821 -13.993 632 HD1 TYR 79 HD2 TYR 79 -13.067 -11.994 -14.729 633 HD2 TYR 79 HD1 TYR 79 -12.081 -16.176 -14.344 634 HE1 TYR 79 HE2 TYR 79 -11.195 -11.692 -16.317 635 HE2 TYR 79 HE1 TYR 79 -10.228 -15.897 -15.945 636 HH TYR 79 HH TYR 79 -9.434 -12.725 -17.452 637 H VAL 80 H VAL 80 -15.495 -11.872 -12.017 638 HA VAL 80 HA VAL 80 -17.620 -13.513 -10.720 639 HB VAL 80 HB VAL 80 -18.252 -11.404 -9.524 640 HG11 VAL 80 HG11 VAL 80 -16.616 -11.677 -7.706 641 HG12 VAL 80 HG12 VAL 80 -17.159 -13.229 -8.341 642 HG13 VAL 80 HG13 VAL 80 -15.556 -12.610 -8.786 643 HG21 VAL 80 HG21 VAL 80 -15.426 -10.447 -10.177 644 HG22 VAL 80 HG22 VAL 80 -16.921 -9.757 -10.849 645 HG23 VAL 80 HG23 VAL 80 -16.602 -9.658 -9.114 646 H GLU 81 H GLU 81 -19.731 -13.030 -11.334 647 HA GLU 81 HA GLU 81 -20.084 -11.702 -13.965 648 HB2 GLU 81 HB2 GLU 81 -22.048 -13.043 -12.043 649 HB3 GLU 81 HB3 GLU 81 -22.485 -12.286 -13.585 650 HG2 GLU 81 HG2 GLU 81 -20.876 -13.891 -14.722 651 HG3 GLU 81 HG3 GLU 81 -20.718 -14.717 -13.168 652 H VAL 82 H VAL 82 -21.042 -9.661 -14.158 653 HA VAL 82 HA VAL 82 -21.701 -8.220 -11.665 654 HB VAL 82 HB VAL 82 -19.256 -8.163 -11.979 655 HG11 VAL 82 HG11 VAL 82 -19.013 -8.412 -14.389 656 HG12 VAL 82 HG12 VAL 82 -19.793 -6.837 -14.672 657 HG13 VAL 82 HG13 VAL 82 -18.237 -6.920 -13.858 658 HG21 VAL 82 HG21 VAL 82 -20.511 -5.486 -12.577 659 HG22 VAL 82 HG22 VAL 82 -20.384 -6.263 -10.971 660 HG23 VAL 82 HG23 VAL 82 -18.918 -5.782 -11.844 661 H ALA 83 H ALA 83 -23.201 -6.617 -11.977 662 HA ALA 83 HA ALA 83 -24.161 -6.143 -14.770 663 HB1 ALA 83 HB1 ALA 83 -25.665 -5.952 -12.132 664 HB2 ALA 83 HB2 ALA 83 -26.316 -5.563 -13.737 665 HB3 ALA 83 HB3 ALA 83 -25.845 -7.229 -13.356 666 H ASP 84 H ASP 84 -24.108 -4.087 -15.510 667 HA ASP 84 HA ASP 84 -22.646 -2.093 -13.945 668 HB2 ASP 84 HB2 ASP 84 -22.095 -2.502 -16.285 669 HB3 ASP 84 HB3 ASP 84 -23.740 -2.055 -16.770 670 H ILE 85 H ILE 85 -24.411 -2.029 -12.317 671 HA ILE 85 HA ILE 85 -26.906 -0.778 -12.916 672 HB ILE 85 HB ILE 85 -27.173 -0.438 -10.558 673 HG12 ILE 85 HG12 ILE 85 -24.256 -1.202 -10.220 674 HG13 ILE 85 HG13 ILE 85 -24.928 0.405 -9.972 675 HG21 ILE 85 HG21 ILE 85 -27.405 -2.723 -11.610 676 HG22 ILE 85 HG22 ILE 85 -25.793 -3.122 -10.981 677 HG23 ILE 85 HG23 ILE 85 -27.125 -2.735 -9.873 678 HD11 ILE 85 HD11 ILE 85 -24.616 -0.660 -7.821 679 HD12 ILE 85 HD12 ILE 85 -26.357 -0.506 -8.128 680 HD13 ILE 85 HD13 ILE 85 -25.538 -2.077 -8.315 681 H GLY 86 H GLY 86 -23.892 0.602 -13.317 682 HA2 GLY 86 HA2 GLY 86 -24.758 3.366 -12.666 683 HA3 GLY 86 HA3 GLY 86 -23.132 2.806 -13.077 684 H GLY 87 H GLY 87 -24.581 1.151 -15.383 685 HA2 GLY 87 HA2 GLY 87 -24.966 3.424 -17.295 686 HA3 GLY 87 HA3 GLY 87 -23.636 2.280 -17.476 687 H LYS 88 H LYS 88 -25.862 0.147 -16.506 688 HA LYS 88 HA LYS 88 -27.423 0.027 -19.048 689 HB2 LYS 88 HB2 LYS 88 -25.931 -2.333 -17.814 690 HB3 LYS 88 HB3 LYS 88 -27.042 -2.414 -19.169 691 HG2 LYS 88 HG2 LYS 88 -24.385 -0.930 -19.183 692 HG3 LYS 88 HG3 LYS 88 -24.635 -2.560 -19.782 693 HD2 LYS 88 HD2 LYS 88 -26.111 -0.150 -20.899 694 HD3 LYS 88 HD3 LYS 88 -24.571 -0.692 -21.528 695 HE2 LYS 88 HE2 LYS 88 -27.049 -2.480 -21.423 696 HE3 LYS 88 HE3 LYS 88 -26.651 -1.426 -22.776 697 HZ1 LYS 88 HZ1 LYS 88 -25.799 -3.489 -23.338 698 HZ2 LYS 88 HZ2 LYS 88 -24.474 -2.658 -22.895 699 HZ3 LYS 88 HZ3 LYS 88 -25.118 -3.808 -21.907 700 H ASP 89 H ASP 89 -26.906 -1.229 -15.768 701 HA ASP 89 HA ASP 89 -28.124 -2.017 -14.140 702 HB2 ASP 89 HB2 ASP 89 -29.188 0.172 -14.210 703 HB3 ASP 89 HB3 ASP 89 -30.384 -0.418 -15.367 704 H ASP 90 H ASP 90 -29.490 -2.687 -17.275 705 HA ASP 90 HA ASP 90 -30.895 -5.102 -16.260 706 HB2 ASP 90 HB2 ASP 90 -32.158 -3.241 -17.367 707 HB3 ASP 90 HB3 ASP 90 -31.185 -3.503 -18.818 708 H ASP 91 H ASP 91 -27.916 -4.573 -17.266 709 HA ASP 91 HA ASP 91 -27.758 -7.029 -18.937 710 HB2 ASP 91 HB2 ASP 91 -27.607 -4.931 -20.369 711 HB3 ASP 91 HB3 ASP 91 -26.117 -4.567 -19.468 712 H VAL 92 H VAL 92 -25.612 -7.911 -18.985 713 HA VAL 92 HA VAL 92 -24.119 -7.547 -16.435 714 HB VAL 92 HB VAL 92 -25.155 -10.169 -17.589 715 HG11 VAL 92 HG11 VAL 92 -23.107 -10.499 -16.244 716 HG12 VAL 92 HG12 VAL 92 -23.861 -9.636 -14.882 717 HG13 VAL 92 HG13 VAL 92 -24.515 -11.185 -15.451 718 HG21 VAL 92 HG21 VAL 92 -27.087 -8.970 -16.719 719 HG22 VAL 92 HG22 VAL 92 -26.664 -10.249 -15.591 720 HG23 VAL 92 HG23 VAL 92 -26.214 -8.571 -15.223 721 H TYR 93 H TYR 93 -22.010 -8.193 -16.457 722 HA TYR 93 HA TYR 93 -20.669 -9.133 -18.926 723 HB2 TYR 93 HB2 TYR 93 -19.717 -6.851 -17.140 724 HB3 TYR 93 HB3 TYR 93 -18.928 -7.446 -18.588 725 HD1 TYR 93 HD1 TYR 93 -19.920 -7.007 -20.857 726 HD2 TYR 93 HD2 TYR 93 -21.499 -5.224 -17.256 727 HE1 TYR 93 HE1 TYR 93 -21.007 -5.240 -22.212 728 HE2 TYR 93 HE2 TYR 93 -22.601 -3.469 -18.598 729 HH TYR 93 HH TYR 93 -22.760 -2.492 -20.723 730 H THR 94 H THR 94 -18.102 -9.194 -17.881 731 HA THR 94 HA THR 94 -18.253 -10.612 -15.277 732 HB THR 94 HB THR 94 -16.468 -11.375 -17.621 733 HG1 THR 94 HG1 THR 94 -18.620 -11.901 -18.044 734 HG21 THR 94 HG21 THR 94 -15.509 -11.995 -15.433 735 HG22 THR 94 HG22 THR 94 -17.029 -12.792 -14.978 736 HG23 THR 94 HG23 THR 94 -16.043 -13.433 -16.311 737 H ALA 95 H ALA 95 -16.489 -10.141 -13.908 738 HA ALA 95 HA ALA 95 -14.440 -8.205 -14.845 739 HB1 ALA 95 HB1 ALA 95 -14.714 -6.936 -12.684 740 HB2 ALA 95 HB2 ALA 95 -16.083 -6.775 -13.776 741 HB3 ALA 95 HB3 ALA 95 -16.196 -7.862 -12.370 742 H LYS 96 H LYS 96 -12.617 -8.105 -13.392 743 HA LYS 96 HA LYS 96 -11.937 -10.703 -12.175 744 HB2 LYS 96 HB2 LYS 96 -10.244 -8.179 -11.995 745 HB3 LYS 96 HB3 LYS 96 -9.758 -9.860 -11.911 746 HG2 LYS 96 HG2 LYS 96 -9.024 -9.421 -14.024 747 HG3 LYS 96 HG3 LYS 96 -10.670 -9.899 -14.439 748 HD2 LYS 96 HD2 LYS 96 -11.215 -7.323 -14.200 749 HD3 LYS 96 HD3 LYS 96 -9.479 -7.091 -14.233 750 HE2 LYS 96 HE2 LYS 96 -11.127 -8.500 -16.393 751 HE3 LYS 96 HE3 LYS 96 -10.650 -6.807 -16.443 752 HZ1 LYS 96 HZ1 LYS 96 -8.325 -7.511 -16.473 753 HZ2 LYS 96 HZ2 LYS 96 -8.754 -9.090 -16.445 754 HZ3 LYS 96 HZ3 LYS 96 -9.134 -8.160 -17.725 755 H LEU 97 H LEU 97 -12.327 -11.082 -9.944 756 HA LEU 97 HA LEU 97 -13.495 -9.083 -8.270 757 HB2 LEU 97 HB2 LEU 97 -13.607 -11.528 -7.836 758 HB3 LEU 97 HB3 LEU 97 -11.867 -11.550 -7.525 759 HG LEU 97 HG LEU 97 -12.181 -10.077 -5.558 760 HD11 LEU 97 HD11 LEU 97 -14.172 -8.791 -6.185 761 HD12 LEU 97 HD12 LEU 97 -15.153 -10.273 -6.262 762 HD13 LEU 97 HD13 LEU 97 -14.527 -9.681 -4.715 763 HD21 LEU 97 HD21 LEU 97 -13.200 -11.755 -4.131 764 HD22 LEU 97 HD22 LEU 97 -14.037 -12.485 -5.520 765 HD23 LEU 97 HD23 LEU 97 -12.263 -12.559 -5.387 766 H SER 98 H SER 98 -10.166 -10.020 -8.971 767 HA SER 98 HA SER 98 -8.578 -8.594 -7.274 768 HB2 SER 98 HB2 SER 98 -8.262 -8.902 -10.285 769 HB3 SER 98 HB3 SER 98 -6.970 -8.818 -9.084 770 HG SER 98 HG SER 98 -7.656 -10.995 -9.870 771 H ASP 99 H ASP 99 -10.800 -7.148 -9.593 772 HA ASP 99 HA ASP 99 -9.331 -4.575 -9.458 773 HB2 ASP 99 HB2 ASP 99 -9.316 -5.921 -11.657 774 HB3 ASP 99 HB3 ASP 99 -11.031 -5.522 -11.787 775 H ILE 100 H ILE 100 -11.716 -5.869 -7.978 776 HA ILE 100 HA ILE 100 -13.559 -3.529 -8.186 777 HB ILE 100 HB ILE 100 -14.028 -6.458 -8.101 778 HG12 ILE 100 HG12 ILE 100 -15.723 -4.108 -9.039 779 HG13 ILE 100 HG13 ILE 100 -14.479 -4.900 -10.028 780 HG21 ILE 100 HG21 ILE 100 -16.017 -4.704 -6.619 781 HG22 ILE 100 HG22 ILE 100 -16.181 -6.429 -7.001 782 HG23 ILE 100 HG23 ILE 100 -14.952 -5.919 -5.866 783 HD11 ILE 100 HD11 ILE 100 -15.789 -7.047 -9.807 784 HD12 ILE 100 HD12 ILE 100 -17.083 -6.092 -9.031 785 HD13 ILE 100 HD13 ILE 100 -16.609 -5.743 -10.699 786 H GLU 101 H GLU 101 -14.437 -2.755 -6.397 787 HA GLU 101 HA GLU 101 -13.173 -3.337 -3.751 788 HB2 GLU 101 HB2 GLU 101 -12.638 -1.081 -4.467 789 HB3 GLU 101 HB3 GLU 101 -14.301 -0.786 -4.985 790 HG2 GLU 101 HG2 GLU 101 -15.082 -0.929 -2.636 791 HG3 GLU 101 HG3 GLU 101 -13.438 -1.286 -2.109 792 H ALA 102 H ALA 102 -14.639 -4.375 -2.424 793 HA ALA 102 HA ALA 102 -17.412 -4.683 -3.313 794 HB1 ALA 102 HB1 ALA 102 -17.573 -6.205 -1.428 795 HB2 ALA 102 HB2 ALA 102 -16.094 -6.543 -2.343 796 HB3 ALA 102 HB3 ALA 102 -15.999 -5.673 -0.793 797 H ILE 103 H ILE 103 -19.157 -3.719 -2.415 798 HA ILE 103 HA ILE 103 -18.835 -1.871 -0.092 799 HB ILE 103 HB ILE 103 -20.163 -1.470 -2.785 800 HG12 ILE 103 HG12 ILE 103 -18.110 0.246 -1.318 801 HG13 ILE 103 HG13 ILE 103 -17.703 -0.950 -2.547 802 HG21 ILE 103 HG21 ILE 103 -20.463 0.340 -0.345 803 HG22 ILE 103 HG22 ILE 103 -21.077 0.679 -1.979 804 HG23 ILE 103 HG23 ILE 103 -21.751 -0.652 -1.069 805 HD11 ILE 103 HD11 ILE 103 -19.071 0.252 -4.211 806 HD12 ILE 103 HD12 ILE 103 -19.333 1.557 -3.024 807 HD13 ILE 103 HD13 ILE 103 -17.697 1.186 -3.578 808 H ASP 104 H ASP 104 -20.507 -1.906 1.372 809 HA ASP 104 HA ASP 104 -22.220 -2.660 2.562 810 HB2 ASP 104 HB2 ASP 104 -23.417 -1.448 0.756 811 HB3 ASP 104 HB3 ASP 104 -23.667 -2.979 -0.082 812 H VAL 105 H VAL 105 -20.276 -4.706 1.550 813 HA VAL 105 HA VAL 105 -21.775 -7.207 1.464 814 HB VAL 105 HB VAL 105 -19.368 -8.140 1.751 815 HG11 VAL 105 HG11 VAL 105 -20.126 -6.521 -0.692 816 HG12 VAL 105 HG12 VAL 105 -18.942 -7.855 -0.627 817 HG13 VAL 105 HG13 VAL 105 -20.642 -8.180 -0.278 818 HG21 VAL 105 HG21 VAL 105 -17.519 -6.776 1.196 819 HG22 VAL 105 HG22 VAL 105 -18.525 -5.340 0.911 820 HG23 VAL 105 HG23 VAL 105 -18.337 -5.994 2.559 821 H ASP 106 H ASP 106 -21.243 -8.956 2.938 822 HA ASP 106 HA ASP 106 -21.527 -8.242 5.775 823 HB2 ASP 106 HB2 ASP 106 -22.623 -10.253 4.865 824 HB3 ASP 106 HB3 ASP 106 -21.045 -10.896 4.369 825 H ASP 107 H ASP 107 -19.905 -8.968 7.349 826 HA ASP 107 HA ASP 107 -17.265 -8.048 6.804 827 HB2 ASP 107 HB2 ASP 107 -18.231 -8.087 9.050 828 HB3 ASP 107 HB3 ASP 107 -18.336 -9.849 9.008 829 H ASP 108 H ASP 108 -18.579 -11.447 6.812 830 HA ASP 108 HA ASP 108 -15.892 -12.506 6.530 831 HB2 ASP 108 HB2 ASP 108 -18.016 -13.671 7.492 832 HB3 ASP 108 HB3 ASP 108 -18.412 -14.014 5.798 833 H THR 109 H THR 109 -18.369 -11.364 4.345 834 HA THR 109 HA THR 109 -17.302 -12.573 1.908 835 HB THR 109 HB THR 109 -19.251 -10.302 2.478 836 HG1 THR 109 HG1 THR 109 -19.797 -12.550 2.976 837 HG21 THR 109 HG21 THR 109 -19.986 -10.429 0.176 838 HG22 THR 109 HG22 THR 109 -18.259 -10.017 0.196 839 HG23 THR 109 HG23 THR 109 -18.787 -11.666 -0.190 840 H GLN 110 H GLN 110 -17.160 -9.290 3.501 841 HA GLN 110 HA GLN 110 -15.389 -8.137 1.660 842 HB2 GLN 110 HB2 GLN 110 -16.748 -7.166 3.723 843 HB3 GLN 110 HB3 GLN 110 -15.276 -7.471 4.623 844 HG2 GLN 110 HG2 GLN 110 -15.534 -5.746 2.112 845 HG3 GLN 110 HG3 GLN 110 -15.470 -5.142 3.758 846 HE21 GLN 110 HE22 GLN 110 -13.575 -5.719 1.016 847 HE22 GLN 110 HE21 GLN 110 -12.012 -5.731 1.786 848 H GLU 111 H GLU 111 -14.662 -9.948 4.706 849 HA GLU 111 HA GLU 111 -11.859 -9.645 4.569 850 HB2 GLU 111 HB2 GLU 111 -13.665 -11.726 5.850 851 HB3 GLU 111 HB3 GLU 111 -11.916 -11.776 6.035 852 HG2 GLU 111 HG2 GLU 111 -13.556 -9.310 6.787 853 HG3 GLU 111 HG3 GLU 111 -13.232 -10.633 7.899 854 H ALA 112 H ALA 112 -13.976 -12.115 3.013 855 HA ALA 112 HA ALA 112 -11.790 -13.775 2.144 856 HB1 ALA 112 HB1 ALA 112 -13.420 -14.744 0.590 857 HB2 ALA 112 HB2 ALA 112 -14.134 -14.553 2.199 858 HB3 ALA 112 HB3 ALA 112 -14.556 -13.413 0.899 859 H ILE 113 H ILE 113 -13.509 -11.001 0.658 860 HA ILE 113 HA ILE 113 -12.102 -11.091 -1.840 861 HB ILE 113 HB ILE 113 -13.606 -8.856 -0.410 862 HG12 ILE 113 HG12 ILE 113 -14.496 -10.679 -2.692 863 HG13 ILE 113 HG13 ILE 113 -14.881 -10.985 -1.023 864 HG21 ILE 113 HG21 ILE 113 -12.105 -7.845 -2.064 865 HG22 ILE 113 HG22 ILE 113 -12.644 -8.992 -3.303 866 HG23 ILE 113 HG23 ILE 113 -13.756 -7.765 -2.657 867 HD11 ILE 113 HD11 ILE 113 -16.016 -8.725 -0.922 868 HD12 ILE 113 HD12 ILE 113 -15.848 -8.679 -2.703 869 HD13 ILE 113 HD13 ILE 113 -16.786 -9.965 -1.932 870 H ALA 114 H ALA 114 -11.567 -9.218 1.204 871 HA ALA 114 HA ALA 114 -9.278 -7.793 0.341 872 HB1 ALA 114 HB1 ALA 114 -9.971 -8.813 3.133 873 HB2 ALA 114 HB2 ALA 114 -8.805 -7.535 2.741 874 HB3 ALA 114 HB3 ALA 114 -10.531 -7.284 2.418 875 H ASP 115 H ASP 115 -9.598 -11.058 1.830 876 HA ASP 115 HA ASP 115 -6.787 -11.471 2.064 877 HB2 ASP 115 HB2 ASP 115 -8.468 -12.725 3.367 878 HB3 ASP 115 HB3 ASP 115 -9.006 -13.542 1.887 879 H TRP 116 H TRP 116 -9.104 -12.261 -0.564 880 HA TRP 116 HA TRP 116 -7.256 -13.639 -2.262 881 HB2 TRP 116 HB2 TRP 116 -9.567 -13.730 -2.840 882 HB3 TRP 116 HB3 TRP 116 -9.746 -11.982 -2.786 883 HD1 TRP 116 HD1 TRP 116 -9.524 -10.708 -4.994 884 HE1 TRP 116 HE1 TRP 116 -8.642 -11.200 -7.366 885 HE3 TRP 116 HE3 TRP 116 -7.693 -15.416 -4.237 886 HZ2 TRP 116 HZ2 TRP 116 -7.315 -13.342 -8.735 887 HZ3 TRP 116 HZ3 TRP 116 -6.635 -16.673 -6.088 888 HH2 TRP 116 HH2 TRP 116 -6.422 -15.637 -8.343 889 H LEU 117 H LEU 117 -8.050 -10.132 -1.911 890 HA LEU 117 HA LEU 117 -6.302 -9.263 -3.983 891 HB2 LEU 117 HB2 LEU 117 -7.400 -7.867 -1.514 892 HB3 LEU 117 HB3 LEU 117 -6.431 -7.035 -2.717 893 HG LEU 117 HG LEU 117 -8.960 -8.537 -3.507 894 HD11 LEU 117 HD11 LEU 117 -9.606 -6.928 -1.786 895 HD12 LEU 117 HD12 LEU 117 -8.734 -5.628 -2.632 896 HD13 LEU 117 HD13 LEU 117 -10.163 -6.387 -3.375 897 HD21 LEU 117 HD21 LEU 117 -7.461 -6.224 -4.806 898 HD22 LEU 117 HD22 LEU 117 -7.424 -7.914 -5.343 899 HD23 LEU 117 HD23 LEU 117 -8.937 -6.998 -5.418 900 H TYR 118 H TYR 118 -5.726 -9.706 -0.427 901 HA TYR 118 HA TYR 118 -3.029 -8.777 -0.456 902 HB2 TYR 118 HB2 TYR 118 -4.264 -10.918 1.314 903 HB3 TYR 118 HB3 TYR 118 -2.763 -10.065 1.624 904 HD1 TYR 118 HD1 TYR 118 -4.072 -7.221 0.729 905 HD2 TYR 118 HD2 TYR 118 -5.102 -10.363 3.511 906 HE1 TYR 118 HE1 TYR 118 -5.307 -5.594 2.105 907 HE2 TYR 118 HE2 TYR 118 -6.347 -8.738 4.890 908 HH TYR 118 HH TYR 118 -7.002 -6.512 5.141 909 H TRP 119 H TRP 119 -4.381 -12.088 -0.956 910 HA TRP 119 HA TRP 119 -1.860 -13.390 -1.326 911 HB2 TRP 119 HB2 TRP 119 -3.584 -14.883 -1.014 912 HB3 TRP 119 HB3 TRP 119 -4.739 -13.941 -1.940 913 HD1 TRP 119 HD1 TRP 119 -5.130 -14.455 -4.369 914 HE1 TRP 119 HE1 TRP 119 -4.319 -16.184 -6.029 915 HE3 TRP 119 HE3 TRP 119 -1.233 -16.374 -1.655 916 HZ2 TRP 119 HZ2 TRP 119 -2.227 -18.222 -6.167 917 HZ3 TRP 119 HZ3 TRP 119 0.150 -18.211 -2.579 918 HH2 TRP 119 HH2 TRP 119 -0.343 -19.145 -4.830 919 H LEU 120 H LEU 120 -3.991 -11.637 -3.649 920 HA LEU 120 HA LEU 120 -2.525 -12.346 -5.957 921 HB2 LEU 120 HB2 LEU 120 -4.828 -11.192 -5.786 922 HB3 LEU 120 HB3 LEU 120 -3.951 -9.702 -5.459 923 HG LEU 120 HG LEU 120 -2.657 -10.322 -7.716 924 HD11 LEU 120 HD11 LEU 120 -3.839 -12.567 -7.908 925 HD12 LEU 120 HD12 LEU 120 -5.353 -11.687 -8.146 926 HD13 LEU 120 HD13 LEU 120 -4.034 -11.520 -9.323 927 HD21 LEU 120 HD21 LEU 120 -4.411 -9.047 -8.971 928 HD22 LEU 120 HD22 LEU 120 -5.480 -9.211 -7.551 929 HD23 LEU 120 HD23 LEU 120 -3.963 -8.301 -7.428 930 H ALA 121 H ALA 121 -2.291 -9.563 -3.723 931 HA ALA 121 HA ALA 121 -0.132 -8.225 -4.978 932 HB1 ALA 121 HB1 ALA 121 -0.035 -7.014 -2.786 933 HB2 ALA 121 HB2 ALA 121 -1.679 -7.128 -3.455 934 HB3 ALA 121 HB3 ALA 121 -1.194 -8.197 -2.128 935 H ARG 122 H ARG 122 -0.130 -10.846 -2.514 936 HA ARG 122 HA ARG 122 2.612 -10.777 -1.814 937 HB2 ARG 122 HB2 ARG 122 0.591 -13.024 -2.057 938 HB3 ARG 122 HB3 ARG 122 2.238 -13.399 -1.678 939 HG2 ARG 122 HG2 ARG 122 0.543 -11.508 0.002 940 HG3 ARG 122 HG3 ARG 122 0.637 -13.245 0.261 941 HD2 ARG 122 HD2 ARG 122 2.883 -11.237 0.573 942 HD3 ARG 122 HD3 ARG 122 2.082 -12.164 1.829 943 HE ARG 122 HE ARG 122 3.113 -14.180 1.124 944 HH11 ARG 122 HH11 ARG 122 4.605 -11.232 -0.269 945 HH12 ARG 122 HH12 ARG 122 5.927 -12.100 -0.967 946 HH21 ARG 122 HH21 ARG 122 4.858 -15.288 0.207 947 HH22 ARG 122 HH22 ARG 122 6.137 -14.429 -0.598 948 H GLY 123 H GLY 123 1.250 -11.527 -4.956 949 HA2 GLY 123 HA2 GLY 123 2.870 -11.535 -6.783 950 HA3 GLY 123 HA3 GLY 123 3.896 -12.630 -5.844 951 H TYR 124 H TYR 124 0.665 -12.322 -7.382 952 HA TYR 124 HA TYR 124 -0.247 -14.917 -6.958 953 HB2 TYR 124 HB2 TYR 124 -1.569 -12.989 -7.820 954 HB3 TYR 124 HB3 TYR 124 -0.728 -13.100 -9.356 955 HD1 TYR 124 HD2 TYR 124 -2.241 -15.751 -7.137 956 HD2 TYR 124 HD1 TYR 124 -2.330 -13.770 -10.963 957 HE1 TYR 124 HE2 TYR 124 -3.966 -17.357 -7.921 958 HE2 TYR 124 HE1 TYR 124 -4.071 -15.345 -11.742 959 HH TYR 124 HH TYR 124 -5.376 -17.175 -11.211 960 H LYS 125 H LYS 125 -0.055 -16.859 -8.011 961 HA LYS 125 HA LYS 125 1.936 -17.088 -10.215 962 HB2 LYS 125 HB2 LYS 125 3.103 -18.803 -8.972 963 HB3 LYS 125 HB3 LYS 125 3.039 -17.318 -8.026 964 HG2 LYS 125 HG2 LYS 125 1.103 -18.263 -6.723 965 HG3 LYS 125 HG3 LYS 125 1.264 -19.777 -7.618 966 HD2 LYS 125 HD2 LYS 125 3.399 -18.529 -5.840 967 HD3 LYS 125 HD3 LYS 125 2.303 -19.840 -5.376 968 HE2 LYS 125 HE2 LYS 125 3.238 -21.269 -7.188 969 HE3 LYS 125 HE3 LYS 125 4.358 -19.974 -7.631 970 HZ1 LYS 125 HZ1 LYS 125 5.413 -21.597 -6.199 971 HZ2 LYS 125 HZ2 LYS 125 5.353 -20.165 -5.428 972 HZ3 LYS 125 HZ3 LYS 125 4.321 -21.364 -5.015 973 H PHE 126 H PHE 126 -1.206 -17.936 -9.379 974 HA PHE 126 HA PHE 126 -1.030 -20.537 -10.810 975 HB2 PHE 126 HB2 PHE 126 -3.345 -19.405 -9.215 976 HB3 PHE 126 HB3 PHE 126 -3.299 -20.969 -10.005 977 HD1 PHE 126 HD1 PHE 126 -0.432 -21.815 -9.183 978 HD2 PHE 126 HD2 PHE 126 -3.741 -20.152 -6.946 979 HE1 PHE 126 HE1 PHE 126 0.482 -22.777 -7.107 980 HE2 PHE 126 HE2 PHE 126 -2.805 -21.132 -4.875 981 HZ PHE 126 HZ PHE 126 -0.675 -22.399 -4.937 Start of MODEL 5 1 H1 MET 1 H1 MET 1 3.343 -6.158 -4.818 2 H2 MET 1 H2 MET 1 2.599 -5.277 -3.658 3 H3 MET 1 H3 MET 1 3.647 -4.553 -4.695 4 HA MET 1 HA MET 1 5.478 -5.821 -3.821 5 HB2 MET 1 HB2 MET 1 4.878 -3.579 -2.843 6 HB3 MET 1 HB3 MET 1 3.960 -4.406 -1.580 7 HG2 MET 1 HG2 MET 1 6.040 -5.531 -0.823 8 HG3 MET 1 HG3 MET 1 6.936 -4.755 -2.136 9 HE1 MET 1 HE1 MET 1 8.463 -2.852 0.870 10 HE2 MET 1 HE2 MET 1 8.057 -4.577 0.773 11 HE3 MET 1 HE3 MET 1 8.771 -3.753 -0.631 12 H ALA 2 H ALA 2 5.995 -7.859 -3.132 13 HA ALA 2 HA ALA 2 3.970 -9.676 -2.340 14 HB1 ALA 2 HB1 ALA 2 6.999 -9.943 -2.144 15 HB2 ALA 2 HB2 ALA 2 5.823 -11.271 -2.069 16 HB3 ALA 2 HB3 ALA 2 5.999 -10.339 -3.566 17 H SER 3 H SER 3 6.080 -7.660 -0.394 18 HA SER 3 HA SER 3 6.234 -9.154 1.930 19 HB2 SER 3 HB2 SER 3 6.421 -6.133 1.686 20 HB3 SER 3 HB3 SER 3 7.332 -7.192 2.777 21 HG SER 3 HG SER 3 8.473 -7.982 1.021 22 H VAL 4 H VAL 4 3.316 -8.892 1.236 23 HA VAL 4 HA VAL 4 2.072 -7.132 3.145 24 HB VAL 4 HB VAL 4 0.028 -8.471 2.695 25 HG11 VAL 4 HG11 VAL 4 1.525 -7.628 0.176 26 HG12 VAL 4 HG12 VAL 4 -0.232 -7.782 0.371 27 HG13 VAL 4 HG13 VAL 4 0.650 -6.543 1.276 28 HG21 VAL 4 HG21 VAL 4 1.116 -10.694 2.267 29 HG22 VAL 4 HG22 VAL 4 -0.030 -10.201 1.010 30 HG23 VAL 4 HG23 VAL 4 1.707 -10.060 0.709 31 H GLU 5 H GLU 5 3.774 -10.115 3.583 32 HA GLU 5 HA GLU 5 3.248 -9.989 6.446 33 HB2 GLU 5 HB2 GLU 5 1.527 -11.586 5.880 34 HB3 GLU 5 HB3 GLU 5 2.570 -12.387 4.705 35 HG2 GLU 5 HG2 GLU 5 4.002 -13.267 6.490 36 HG3 GLU 5 HG3 GLU 5 3.041 -12.414 7.706 37 H ARG 6 H ARG 6 5.051 -10.781 7.574 38 HA ARG 6 HA ARG 6 7.173 -12.211 6.064 39 HB2 ARG 6 HB2 ARG 6 8.895 -10.990 7.195 40 HB3 ARG 6 HB3 ARG 6 7.820 -9.857 6.378 41 HG2 ARG 6 HG2 ARG 6 6.700 -9.344 8.539 42 HG3 ARG 6 HG3 ARG 6 7.787 -10.457 9.379 43 HD2 ARG 6 HD2 ARG 6 8.656 -8.000 7.802 44 HD3 ARG 6 HD3 ARG 6 8.454 -8.057 9.561 45 HE ARG 6 HE ARG 6 10.188 -10.130 9.047 46 HH11 ARG 6 HH11 ARG 6 10.243 -6.642 8.395 47 HH12 ARG 6 HH12 ARG 6 11.962 -6.514 8.436 48 HH21 ARG 6 HH21 ARG 6 12.482 -9.968 9.092 49 HH22 ARG 6 HH22 ARG 6 13.259 -8.451 8.849 50 H ASP 7 H ASP 7 4.933 -12.375 8.528 51 HA ASP 7 HA ASP 7 6.445 -13.924 10.478 52 HB2 ASP 7 HB2 ASP 7 4.657 -12.386 11.131 53 HB3 ASP 7 HB3 ASP 7 3.504 -13.255 10.121 54 H GLU 8 H GLU 8 4.844 -14.627 7.521 55 HA GLU 8 HA GLU 8 4.352 -16.450 6.334 56 HB2 GLU 8 HB2 GLU 8 6.260 -17.870 8.222 57 HB3 GLU 8 HB3 GLU 8 5.728 -18.440 6.643 58 HG2 GLU 8 HG2 GLU 8 6.775 -16.501 5.544 59 HG3 GLU 8 HG3 GLU 8 7.315 -15.881 7.104 60 H THR 9 H THR 9 3.127 -16.461 9.557 61 HA THR 9 HA THR 9 1.930 -19.035 9.628 62 HB THR 9 HB THR 9 0.811 -16.450 10.714 63 HG1 THR 9 HG1 THR 9 2.548 -16.409 11.821 64 HG21 THR 9 HG21 THR 9 -0.755 -18.326 10.897 65 HG22 THR 9 HG22 THR 9 0.516 -19.343 11.613 66 HG23 THR 9 HG23 THR 9 -0.103 -17.922 12.491 67 H ARG 10 H ARG 10 0.676 -16.028 8.004 68 HA ARG 10 HA ARG 10 -1.730 -17.456 7.177 69 HB2 ARG 10 HB2 ARG 10 -0.535 -14.786 6.397 70 HB3 ARG 10 HB3 ARG 10 -1.759 -15.524 5.396 71 HG2 ARG 10 HG2 ARG 10 -2.693 -13.893 6.986 72 HG3 ARG 10 HG3 ARG 10 -3.409 -15.494 7.097 73 HD2 ARG 10 HD2 ARG 10 -3.086 -14.391 9.299 74 HD3 ARG 10 HD3 ARG 10 -2.275 -15.961 9.171 75 HE ARG 10 HE ARG 10 -0.346 -14.131 8.406 76 HH11 ARG 10 HH11 ARG 10 -2.178 -14.660 11.426 77 HH12 ARG 10 HH12 ARG 10 -0.814 -14.316 12.426 78 HH21 ARG 10 HH21 ARG 10 1.322 -13.816 9.609 79 HH22 ARG 10 HH22 ARG 10 1.367 -14.015 11.332 80 H GLU 11 H GLU 11 1.498 -16.883 5.722 81 HA GLU 11 HA GLU 11 1.068 -18.101 3.247 82 HB2 GLU 11 HB2 GLU 11 3.241 -17.116 4.592 83 HB3 GLU 11 HB3 GLU 11 3.612 -18.831 4.681 84 HG2 GLU 11 HG2 GLU 11 3.359 -18.988 2.215 85 HG3 GLU 11 HG3 GLU 11 3.008 -17.251 2.171 86 H HIS 12 H HIS 12 1.976 -19.680 6.328 87 HA HIS 12 HA HIS 12 1.871 -22.373 5.425 88 HB2 HIS 12 HB2 HIS 12 3.025 -22.068 7.411 89 HB3 HIS 12 HB3 HIS 12 1.869 -20.916 8.052 90 HD1 HIS 12 HD1 HIS 12 1.580 -24.742 7.265 91 HD2 HIS 12 HD2 HIS 12 0.571 -21.740 10.039 92 HE1 HIS 12 HE1 HIS 12 0.268 -25.896 9.113 93 H ARG 13 H ARG 13 -0.671 -20.341 7.069 94 HA ARG 13 HA ARG 13 -2.553 -22.491 7.103 95 HB2 ARG 13 HB2 ARG 13 -3.033 -19.473 7.172 96 HB3 ARG 13 HB3 ARG 13 -4.267 -20.690 7.449 97 HG2 ARG 13 HG2 ARG 13 -1.925 -19.992 9.241 98 HG3 ARG 13 HG3 ARG 13 -3.644 -19.971 9.597 99 HD2 ARG 13 HD2 ARG 13 -1.819 -22.352 9.250 100 HD3 ARG 13 HD3 ARG 13 -2.625 -21.840 10.736 101 HE ARG 13 HE ARG 13 -4.696 -22.367 8.931 102 HH11 ARG 13 HH11 ARG 13 -1.919 -24.309 10.061 103 HH12 ARG 13 HH12 ARG 13 -2.772 -25.806 9.910 104 HH21 ARG 13 HH21 ARG 13 -5.691 -24.223 8.589 105 HH22 ARG 13 HH22 ARG 13 -5.018 -25.788 9.016 106 H ILE 14 H ILE 14 -2.218 -19.825 4.697 107 HA ILE 14 HA ILE 14 -4.463 -20.555 3.277 108 HB ILE 14 HB ILE 14 -2.879 -18.472 3.166 109 HG12 ILE 14 HG12 ILE 14 -4.446 -19.386 0.750 110 HG13 ILE 14 HG13 ILE 14 -5.080 -18.616 2.220 111 HG21 ILE 14 HG21 ILE 14 -1.914 -19.893 0.664 112 HG22 ILE 14 HG22 ILE 14 -1.464 -18.269 1.234 113 HG23 ILE 14 HG23 ILE 14 -0.943 -19.676 2.141 114 HD11 ILE 14 HD11 ILE 14 -4.914 -16.891 0.617 115 HD12 ILE 14 HD12 ILE 14 -3.585 -16.627 1.750 116 HD13 ILE 14 HD13 ILE 14 -3.267 -17.343 0.148 117 H GLU 15 H GLU 15 -1.106 -21.736 2.937 118 HA GLU 15 HA GLU 15 -1.498 -23.523 0.759 119 HB2 GLU 15 HB2 GLU 15 0.681 -22.768 1.491 120 HB3 GLU 15 HB3 GLU 15 0.444 -23.471 3.087 121 HG2 GLU 15 HG2 GLU 15 1.929 -24.859 1.768 122 HG3 GLU 15 HG3 GLU 15 0.450 -25.718 2.184 123 H THR 16 H THR 16 -2.059 -23.953 4.317 124 HA THR 16 HA THR 16 -2.425 -26.839 3.827 125 HB THR 16 HB THR 16 -2.402 -26.958 6.332 126 HG1 THR 16 HG1 THR 16 -1.418 -24.311 6.161 127 HG21 THR 16 HG21 THR 16 -0.409 -27.416 4.961 128 HG22 THR 16 HG22 THR 16 0.036 -25.699 5.001 129 HG23 THR 16 HG23 THR 16 0.015 -26.658 6.501 130 H GLU 17 H GLU 17 -4.608 -24.210 3.877 131 HA GLU 17 HA GLU 17 -6.732 -26.261 4.280 132 HB2 GLU 17 HB2 GLU 17 -7.986 -25.008 5.769 133 HB3 GLU 17 HB3 GLU 17 -6.335 -24.946 6.362 134 HG2 GLU 17 HG2 GLU 17 -6.188 -22.624 5.211 135 HG3 GLU 17 HG3 GLU 17 -7.921 -22.756 4.975 136 H ILE 18 H ILE 18 -5.787 -23.415 2.355 137 HA ILE 18 HA ILE 18 -8.493 -23.354 1.174 138 HB ILE 18 HB ILE 18 -6.045 -21.862 0.190 139 HG12 ILE 18 HG12 ILE 18 -6.241 -21.260 2.516 140 HG13 ILE 18 HG13 ILE 18 -6.708 -19.926 1.471 141 HG21 ILE 18 HG21 ILE 18 -7.761 -20.249 -0.647 142 HG22 ILE 18 HG22 ILE 18 -7.916 -21.847 -1.380 143 HG23 ILE 18 HG23 ILE 18 -9.032 -21.366 -0.097 144 HD11 ILE 18 HD11 ILE 18 -8.652 -21.698 2.977 145 HD12 ILE 18 HD12 ILE 18 -8.052 -20.108 3.496 146 HD13 ILE 18 HD13 ILE 18 -9.044 -20.238 2.026 147 H ILE 19 H ILE 19 -5.174 -24.313 0.267 148 HA ILE 19 HA ILE 19 -6.217 -25.607 -2.210 149 HB ILE 19 HB ILE 19 -4.081 -24.845 -3.233 150 HG12 ILE 19 HG12 ILE 19 -3.675 -23.413 -0.579 151 HG13 ILE 19 HG13 ILE 19 -2.634 -24.615 -1.331 152 HG21 ILE 19 HG21 ILE 19 -6.267 -23.616 -3.443 153 HG22 ILE 19 HG22 ILE 19 -5.713 -22.514 -2.165 154 HG23 ILE 19 HG23 ILE 19 -4.835 -22.624 -3.698 155 HD11 ILE 19 HD11 ILE 19 -3.132 -21.749 -2.210 156 HD12 ILE 19 HD12 ILE 19 -1.635 -22.452 -1.580 157 HD13 ILE 19 HD13 ILE 19 -2.228 -22.935 -3.185 158 H VAL 20 H VAL 20 -5.209 -26.613 0.671 159 HA VAL 20 HA VAL 20 -2.948 -28.191 0.235 160 HB VAL 20 HB VAL 20 -4.129 -27.551 2.346 161 HG11 VAL 20 HG11 VAL 20 -5.873 -29.990 1.936 162 HG12 VAL 20 HG12 VAL 20 -5.787 -28.966 3.375 163 HG13 VAL 20 HG13 VAL 20 -6.418 -28.297 1.867 164 HG21 VAL 20 HG21 VAL 20 -3.320 -30.472 2.162 165 HG22 VAL 20 HG22 VAL 20 -2.214 -29.091 2.342 166 HG23 VAL 20 HG23 VAL 20 -3.361 -29.478 3.635 167 H ASP 21 H ASP 21 -6.300 -28.814 -0.535 168 HA ASP 21 HA ASP 21 -6.072 -31.615 -1.141 169 HB2 ASP 21 HB2 ASP 21 -8.141 -30.439 -0.402 170 HB3 ASP 21 HB3 ASP 21 -8.187 -29.579 -1.942 171 H ALA 22 H ALA 22 -4.714 -29.084 -2.853 172 HA ALA 22 HA ALA 22 -5.085 -30.347 -5.530 173 HB1 ALA 22 HB1 ALA 22 -5.185 -27.946 -6.357 174 HB2 ALA 22 HB2 ALA 22 -6.615 -28.494 -5.461 175 HB3 ALA 22 HB3 ALA 22 -5.425 -27.445 -4.671 176 H GLU 23 H GLU 23 -3.323 -29.963 -6.970 177 HA GLU 23 HA GLU 23 -0.775 -29.097 -5.683 178 HB2 GLU 23 HB2 GLU 23 0.271 -31.150 -6.411 179 HB3 GLU 23 HB3 GLU 23 -1.114 -31.503 -5.383 180 HG2 GLU 23 HG2 GLU 23 -2.485 -32.029 -7.396 181 HG3 GLU 23 HG3 GLU 23 -1.107 -31.665 -8.433 182 H ASP 24 H ASP 24 -2.764 -28.580 -8.336 183 HA ASP 24 HA ASP 24 -0.485 -27.622 -10.001 184 HB2 ASP 24 HB2 ASP 24 -1.369 -29.688 -11.008 185 HB3 ASP 24 HB3 ASP 24 -3.020 -29.067 -10.885 186 H LYS 25 H LYS 25 -0.971 -25.663 -11.120 187 HA LYS 25 HA LYS 25 -2.433 -23.807 -9.696 188 HB2 LYS 25 HB2 LYS 25 -2.240 -22.348 -11.700 189 HB3 LYS 25 HB3 LYS 25 -0.723 -23.079 -11.191 190 HG2 LYS 25 HG2 LYS 25 -0.722 -24.647 -13.001 191 HG3 LYS 25 HG3 LYS 25 -2.390 -24.283 -13.444 192 HD2 LYS 25 HD2 LYS 25 -0.125 -22.259 -13.624 193 HD3 LYS 25 HD3 LYS 25 -0.657 -23.299 -14.958 194 HE2 LYS 25 HE2 LYS 25 -2.973 -22.381 -14.731 195 HE3 LYS 25 HE3 LYS 25 -2.396 -21.268 -13.485 196 HZ1 LYS 25 HZ1 LYS 25 -0.911 -20.282 -15.138 197 HZ2 LYS 25 HZ2 LYS 25 -1.452 -21.303 -16.296 198 HZ3 LYS 25 HZ3 LYS 25 -2.456 -20.197 -15.647 199 H GLU 26 H GLU 26 -3.772 -25.846 -12.355 200 HA GLU 26 HA GLU 26 -6.169 -24.212 -12.588 201 HB2 GLU 26 HB2 GLU 26 -5.497 -27.072 -13.410 202 HB3 GLU 26 HB3 GLU 26 -7.064 -26.321 -13.700 203 HG2 GLU 26 HG2 GLU 26 -6.016 -24.529 -15.023 204 HG3 GLU 26 HG3 GLU 26 -4.417 -25.213 -14.729 205 H GLU 27 H GLU 27 -5.245 -27.135 -10.750 206 HA GLU 27 HA GLU 27 -7.848 -27.596 -9.593 207 HB2 GLU 27 HB2 GLU 27 -5.076 -28.472 -8.679 208 HB3 GLU 27 HB3 GLU 27 -6.607 -29.125 -8.098 209 HG2 GLU 27 HG2 GLU 27 -5.571 -29.296 -10.964 210 HG3 GLU 27 HG3 GLU 27 -5.494 -30.579 -9.766 211 H ARG 28 H ARG 28 -4.958 -25.721 -8.631 212 HA ARG 28 HA ARG 28 -6.048 -25.060 -6.019 213 HB2 ARG 28 HB2 ARG 28 -3.704 -23.925 -7.617 214 HB3 ARG 28 HB3 ARG 28 -4.151 -23.412 -5.976 215 HG2 ARG 28 HG2 ARG 28 -4.042 -25.790 -5.237 216 HG3 ARG 28 HG3 ARG 28 -3.394 -26.258 -6.803 217 HD2 ARG 28 HD2 ARG 28 -1.338 -25.135 -6.405 218 HD3 ARG 28 HD3 ARG 28 -2.044 -24.184 -5.078 219 HE ARG 28 HE ARG 28 -2.136 -27.082 -4.679 220 HH11 ARG 28 HH11 ARG 28 -0.092 -24.240 -4.030 221 HH12 ARG 28 HH12 ARG 28 0.243 -24.739 -2.391 222 HH21 ARG 28 HH21 ARG 28 -1.613 -27.743 -2.665 223 HH22 ARG 28 HH22 ARG 28 -0.459 -26.847 -1.673 224 H ALA 29 H ALA 29 -6.274 -23.543 -9.238 225 HA ALA 29 HA ALA 29 -7.558 -21.150 -8.287 226 HB1 ALA 29 HB1 ALA 29 -8.320 -20.848 -10.545 227 HB2 ALA 29 HB2 ALA 29 -6.662 -21.454 -10.629 228 HB3 ALA 29 HB3 ALA 29 -8.029 -22.547 -10.955 229 H MET 30 H MET 30 -8.769 -24.457 -9.195 230 HA MET 30 HA MET 30 -11.505 -23.889 -8.644 231 HB2 MET 30 HB2 MET 30 -10.053 -26.537 -8.321 232 HB3 MET 30 HB3 MET 30 -11.788 -26.309 -8.286 233 HG2 MET 30 HG2 MET 30 -10.055 -25.676 -10.695 234 HG3 MET 30 HG3 MET 30 -10.884 -27.192 -10.411 235 HE1 MET 30 HE1 MET 30 -12.330 -23.161 -10.468 236 HE2 MET 30 HE2 MET 30 -10.915 -23.655 -11.424 237 HE3 MET 30 HE3 MET 30 -12.482 -23.401 -12.218 238 H GLY 31 H GLY 31 -8.878 -24.968 -6.394 239 HA2 GLY 31 HA2 GLY 31 -10.436 -25.293 -4.089 240 HA3 GLY 31 HA3 GLY 31 -8.751 -24.745 -4.108 241 H TRP 32 H TRP 32 -8.730 -22.285 -5.139 242 HA TRP 32 HA TRP 32 -9.775 -20.514 -3.242 243 HB2 TRP 32 HB2 TRP 32 -8.741 -20.226 -6.067 244 HB3 TRP 32 HB3 TRP 32 -9.515 -18.862 -5.283 245 HD1 TRP 32 HD1 TRP 32 -6.297 -20.869 -5.135 246 HE1 TRP 32 HE1 TRP 32 -4.613 -19.632 -3.664 247 HE3 TRP 32 HE3 TRP 32 -9.407 -17.310 -3.190 248 HZ2 TRP 32 HZ2 TRP 32 -4.625 -17.389 -1.830 249 HZ3 TRP 32 HZ3 TRP 32 -8.551 -15.643 -1.571 250 HH2 TRP 32 HH2 TRP 32 -6.170 -15.659 -0.896 251 H TYR 33 H TYR 33 -11.096 -21.320 -6.516 252 HA TYR 33 HA TYR 33 -13.332 -19.645 -6.412 253 HB2 TYR 33 HB2 TYR 33 -12.627 -20.728 -8.458 254 HB3 TYR 33 HB3 TYR 33 -12.914 -22.323 -7.785 255 HD1 TYR 33 HD2 TYR 33 -15.238 -23.152 -7.358 256 HD2 TYR 33 HD1 TYR 33 -14.479 -19.399 -9.334 257 HE1 TYR 33 HE2 TYR 33 -17.591 -23.070 -8.085 258 HE2 TYR 33 HE1 TYR 33 -16.729 -19.472 -10.341 259 HH TYR 33 HH TYR 33 -19.155 -21.986 -9.455 260 H TYR 34 H TYR 34 -13.042 -23.064 -5.204 261 HA TYR 34 HA TYR 34 -15.815 -23.382 -4.767 262 HB2 TYR 34 HB2 TYR 34 -13.458 -24.704 -3.363 263 HB3 TYR 34 HB3 TYR 34 -15.128 -25.201 -3.169 264 HD1 TYR 34 HD1 TYR 34 -16.142 -25.134 -6.022 265 HD2 TYR 34 HD2 TYR 34 -12.473 -26.627 -4.300 266 HE1 TYR 34 HE1 TYR 34 -15.931 -26.746 -7.876 267 HE2 TYR 34 HE2 TYR 34 -12.271 -28.264 -6.136 268 HH TYR 34 HH TYR 34 -13.218 -29.096 -8.102 269 H TYR 35 H TYR 35 -13.216 -22.359 -2.401 270 HA TYR 35 HA TYR 35 -15.289 -22.078 -0.395 271 HB2 TYR 35 HB2 TYR 35 -13.712 -21.745 1.120 272 HB3 TYR 35 HB3 TYR 35 -12.677 -22.462 -0.097 273 HD1 TYR 35 HD1 TYR 35 -11.160 -20.993 -1.445 274 HD2 TYR 35 HD2 TYR 35 -13.579 -19.415 1.756 275 HE1 TYR 35 HE1 TYR 35 -9.819 -18.927 -1.466 276 HE2 TYR 35 HE2 TYR 35 -12.261 -17.325 1.741 277 HH TYR 35 HH TYR 35 -10.510 -16.165 0.771 278 H LEU 36 H LEU 36 -13.758 -19.777 -2.717 279 HA LEU 36 HA LEU 36 -14.857 -17.429 -1.534 280 HB2 LEU 36 HB2 LEU 36 -13.898 -18.146 -4.316 281 HB3 LEU 36 HB3 LEU 36 -14.782 -16.653 -4.085 282 HG LEU 36 HG LEU 36 -12.337 -17.304 -2.411 283 HD11 LEU 36 HD11 LEU 36 -12.510 -15.749 -5.031 284 HD12 LEU 36 HD12 LEU 36 -11.095 -15.789 -3.956 285 HD13 LEU 36 HD13 LEU 36 -11.646 -17.275 -4.751 286 HD21 LEU 36 HD21 LEU 36 -13.927 -15.511 -1.583 287 HD22 LEU 36 HD22 LEU 36 -12.308 -14.903 -1.968 288 HD23 LEU 36 HD23 LEU 36 -13.658 -14.632 -3.091 289 H ASP 37 H ASP 37 -16.154 -19.499 -4.228 290 HA ASP 37 HA ASP 37 -18.531 -18.037 -4.586 291 HB2 ASP 37 HB2 ASP 37 -17.749 -19.714 -6.181 292 HB3 ASP 37 HB3 ASP 37 -17.980 -20.999 -4.989 293 H ASP 38 H ASP 38 -17.766 -20.651 -2.299 294 HA ASP 38 HA ASP 38 -20.417 -20.903 -1.201 295 HB2 ASP 38 HB2 ASP 38 -18.711 -22.648 -0.984 296 HB3 ASP 38 HB3 ASP 38 -17.701 -21.573 -0.014 297 H THR 39 H THR 39 -17.862 -18.533 -0.626 298 HA THR 39 HA THR 39 -18.998 -17.772 2.008 299 HB THR 39 HB THR 39 -16.432 -16.963 0.585 300 HG1 THR 39 HG1 THR 39 -16.268 -19.010 1.168 301 HG21 THR 39 HG21 THR 39 -17.517 -16.265 3.341 302 HG22 THR 39 HG22 THR 39 -15.781 -16.213 2.948 303 HG23 THR 39 HG23 THR 39 -16.924 -15.184 2.072 304 H LEU 40 H LEU 40 -18.497 -16.455 -1.267 305 HA LEU 40 HA LEU 40 -18.836 -13.788 -0.619 306 HB2 LEU 40 HB2 LEU 40 -19.093 -15.343 -3.194 307 HB3 LEU 40 HB3 LEU 40 -19.278 -13.599 -3.198 308 HG LEU 40 HG LEU 40 -16.757 -14.970 -2.182 309 HD11 LEU 40 HD11 LEU 40 -15.741 -14.364 -4.317 310 HD12 LEU 40 HD12 LEU 40 -17.137 -15.406 -4.607 311 HD13 LEU 40 HD13 LEU 40 -17.262 -13.646 -4.874 312 HD21 LEU 40 HD21 LEU 40 -15.755 -12.741 -2.584 313 HD22 LEU 40 HD22 LEU 40 -17.399 -12.086 -2.768 314 HD23 LEU 40 HD23 LEU 40 -16.867 -12.817 -1.228 315 H GLU 41 H GLU 41 -21.150 -15.652 -0.001 316 HA GLU 41 HA GLU 41 -23.457 -15.965 -0.597 317 HB2 GLU 41 HB2 GLU 41 -24.584 -14.715 1.202 318 HB3 GLU 41 HB3 GLU 41 -23.173 -15.646 1.676 319 HG2 GLU 41 HG2 GLU 41 -21.820 -13.693 1.922 320 HG3 GLU 41 HG3 GLU 41 -23.040 -12.644 1.198 321 H PHE 42 H PHE 42 -23.104 -15.140 -2.839 322 HA PHE 42 HA PHE 42 -23.731 -12.631 -3.734 323 HB2 PHE 42 HB2 PHE 42 -24.340 -15.325 -5.015 324 HB3 PHE 42 HB3 PHE 42 -24.406 -13.804 -5.876 325 HD1 PHE 42 HD1 PHE 42 -22.286 -12.322 -5.955 326 HD2 PHE 42 HD2 PHE 42 -22.262 -16.510 -4.886 327 HE1 PHE 42 HE1 PHE 42 -19.895 -12.493 -6.602 328 HE2 PHE 42 HE2 PHE 42 -19.890 -16.655 -5.539 329 HZ PHE 42 HZ PHE 42 -18.702 -14.641 -6.404 330 HA PRO 43 HA PRO 43 -24.733 -11.606 -5.551 331 HB2 PRO 43 HB2 PRO 43 -26.335 -9.474 -6.018 332 HB3 PRO 43 HB3 PRO 43 -26.592 -11.050 -6.826 333 HG2 PRO 43 HG2 PRO 43 -28.005 -9.969 -4.365 334 HG3 PRO 43 HG3 PRO 43 -28.738 -10.705 -5.826 335 HD2 PRO 43 HD2 PRO 43 -28.248 -12.133 -3.529 336 HD3 PRO 43 HD3 PRO 43 -28.128 -12.874 -5.151 337 H PHE 44 H PHE 44 -23.710 -9.486 -5.255 338 HA PHE 44 HA PHE 44 -24.338 -7.950 -2.854 339 HB2 PHE 44 HB2 PHE 44 -22.220 -7.922 -1.872 340 HB3 PHE 44 HB3 PHE 44 -22.672 -9.602 -2.011 341 HD1 PHE 44 HD1 PHE 44 -21.491 -11.078 -3.753 342 HD2 PHE 44 HD2 PHE 44 -20.197 -7.076 -2.783 343 HE1 PHE 44 HE1 PHE 44 -19.227 -11.573 -4.632 344 HE2 PHE 44 HE2 PHE 44 -17.983 -7.548 -3.779 345 HZ PHE 44 HZ PHE 44 -17.488 -9.807 -4.700 346 H MET 45 H MET 45 -22.300 -6.031 -3.026 347 HA MET 45 HA MET 45 -22.153 -5.348 -5.896 348 HB2 MET 45 HB2 MET 45 -23.077 -3.225 -5.694 349 HB3 MET 45 HB3 MET 45 -24.214 -4.281 -4.880 350 HG2 MET 45 HG2 MET 45 -23.779 -3.392 -2.790 351 HG3 MET 45 HG3 MET 45 -22.129 -2.930 -3.170 352 HE1 MET 45 HE1 MET 45 -22.296 -1.136 -5.858 353 HE2 MET 45 HE2 MET 45 -22.361 0.428 -5.020 354 HE3 MET 45 HE3 MET 45 -21.317 -0.864 -4.408 355 H GLY 46 H GLY 46 -20.765 -3.520 -6.381 356 HA2 GLY 46 HA2 GLY 46 -18.755 -2.733 -4.403 357 HA3 GLY 46 HA3 GLY 46 -18.178 -3.888 -5.619 358 H LYS 47 H LYS 47 -16.854 -1.796 -5.692 359 HA LYS 47 HA LYS 47 -17.838 -0.254 -8.055 360 HB2 LYS 47 HB2 LYS 47 -17.186 1.026 -5.875 361 HB3 LYS 47 HB3 LYS 47 -15.538 0.528 -6.217 362 HG2 LYS 47 HG2 LYS 47 -15.659 2.656 -7.189 363 HG3 LYS 47 HG3 LYS 47 -15.924 1.590 -8.570 364 HD2 LYS 47 HD2 LYS 47 -17.560 3.291 -8.783 365 HD3 LYS 47 HD3 LYS 47 -18.434 1.890 -8.167 366 HE2 LYS 47 HE2 LYS 47 -18.479 2.805 -5.922 367 HE3 LYS 47 HE3 LYS 47 -17.386 4.119 -6.378 368 HZ1 LYS 47 HZ1 LYS 47 -19.759 4.769 -6.301 369 HZ2 LYS 47 HZ2 LYS 47 -19.090 5.046 -7.759 370 HZ3 LYS 47 HZ3 LYS 47 -20.088 3.772 -7.563 371 H TRP 48 H TRP 48 -16.925 -0.940 -9.899 372 HA TRP 48 HA TRP 48 -14.522 -2.645 -9.907 373 HB2 TRP 48 HB2 TRP 48 -16.464 -2.975 -11.470 374 HB3 TRP 48 HB3 TRP 48 -16.099 -1.427 -12.207 375 HD1 TRP 48 HD1 TRP 48 -12.771 -2.652 -11.819 376 HE1 TRP 48 HE1 TRP 48 -11.912 -4.014 -13.750 377 HE3 TRP 48 HE3 TRP 48 -17.238 -3.551 -14.172 378 HZ2 TRP 48 HZ2 TRP 48 -13.020 -5.434 -16.035 379 HZ3 TRP 48 HZ3 TRP 48 -17.291 -4.942 -16.227 380 HH2 TRP 48 HH2 TRP 48 -15.182 -5.896 -17.148 381 H LYS 49 H LYS 49 -12.707 -1.604 -9.437 382 HA LYS 49 HA LYS 49 -12.318 1.264 -9.909 383 HB2 LYS 49 HB2 LYS 49 -10.393 -0.822 -8.775 384 HB3 LYS 49 HB3 LYS 49 -10.294 0.924 -8.570 385 HG2 LYS 49 HG2 LYS 49 -12.459 -0.899 -7.415 386 HG3 LYS 49 HG3 LYS 49 -11.044 -0.363 -6.550 387 HD2 LYS 49 HD2 LYS 49 -13.100 1.602 -7.656 388 HD3 LYS 49 HD3 LYS 49 -13.214 0.833 -6.070 389 HE2 LYS 49 HE2 LYS 49 -10.775 1.671 -5.699 390 HE3 LYS 49 HE3 LYS 49 -11.108 2.785 -7.036 391 HZ1 LYS 49 HZ1 LYS 49 -12.922 3.702 -5.761 392 HZ2 LYS 49 HZ2 LYS 49 -12.743 2.552 -4.564 393 HZ3 LYS 49 HZ3 LYS 49 -11.594 3.697 -4.812 394 H LYS 50 H LYS 50 -12.665 0.558 -12.311 395 HA LYS 50 HA LYS 50 -10.783 -1.174 -13.645 396 HB2 LYS 50 HB2 LYS 50 -13.142 -0.737 -14.344 397 HB3 LYS 50 HB3 LYS 50 -12.714 0.929 -14.748 398 HG2 LYS 50 HG2 LYS 50 -11.213 0.180 -16.513 399 HG3 LYS 50 HG3 LYS 50 -11.427 -1.513 -16.054 400 HD2 LYS 50 HD2 LYS 50 -13.645 0.308 -17.098 401 HD3 LYS 50 HD3 LYS 50 -12.686 -0.800 -18.093 402 HE2 LYS 50 HE2 LYS 50 -13.449 -2.706 -16.640 403 HE3 LYS 50 HE3 LYS 50 -14.516 -1.591 -15.780 404 HZ1 LYS 50 HZ1 LYS 50 -15.654 -1.186 -17.906 405 HZ2 LYS 50 HZ2 LYS 50 -14.674 -2.249 -18.667 406 HZ3 LYS 50 HZ3 LYS 50 -15.695 -2.772 -17.509 407 H LYS 51 H LYS 51 -9.224 -0.542 -15.312 408 HA LYS 51 HA LYS 51 -7.974 2.143 -14.824 409 HB2 LYS 51 HB2 LYS 51 -6.736 -0.519 -15.656 410 HB3 LYS 51 HB3 LYS 51 -5.921 1.037 -15.791 411 HG2 LYS 51 HG2 LYS 51 -5.088 -0.018 -13.833 412 HG3 LYS 51 HG3 LYS 51 -6.107 1.327 -13.295 413 HD2 LYS 51 HD2 LYS 51 -7.899 -0.187 -12.740 414 HD3 LYS 51 HD3 LYS 51 -7.076 -1.573 -13.466 415 HE2 LYS 51 HE2 LYS 51 -5.524 -1.699 -11.687 416 HE3 LYS 51 HE3 LYS 51 -5.842 -0.039 -11.167 417 HZ1 LYS 51 HZ1 LYS 51 -6.956 -1.630 -9.706 418 HZ2 LYS 51 HZ2 LYS 51 -8.096 -0.754 -10.536 419 HZ3 LYS 51 HZ3 LYS 51 -7.800 -2.264 -10.981 420 H SER 52 H SER 52 -8.196 3.458 -16.611 421 HA SER 52 HA SER 52 -8.854 2.263 -19.262 422 HB2 SER 52 HB2 SER 52 -10.460 4.380 -17.772 423 HB3 SER 52 HB3 SER 52 -10.823 3.727 -19.379 424 HG SER 52 HG SER 52 -12.086 2.741 -17.784 425 H ARG 53 H ARG 53 -9.184 4.193 -20.844 426 HA ARG 53 HA ARG 53 -8.254 5.764 -22.123 427 HB2 ARG 53 HB2 ARG 53 -6.888 7.089 -19.779 428 HB3 ARG 53 HB3 ARG 53 -7.346 7.780 -21.315 429 HG2 ARG 53 HG2 ARG 53 -8.889 8.746 -19.992 430 HG3 ARG 53 HG3 ARG 53 -9.829 7.338 -20.493 431 HD2 ARG 53 HD2 ARG 53 -9.526 6.275 -18.370 432 HD3 ARG 53 HD3 ARG 53 -8.133 7.274 -17.968 433 HE ARG 53 HE ARG 53 -10.942 7.839 -17.505 434 HH11 ARG 53 HH11 ARG 53 -7.708 9.358 -17.653 435 HH12 ARG 53 HH12 ARG 53 -8.270 10.845 -16.987 436 HH21 ARG 53 HH22 ARG 53 -11.555 9.551 -16.428 437 HH22 ARG 53 HH21 ARG 53 -10.547 10.965 -16.178 438 H LYS 54 H LYS 54 -6.038 6.693 -22.850 439 HA LYS 54 HA LYS 54 -4.075 4.602 -22.990 440 HB2 LYS 54 HB2 LYS 54 -3.840 7.598 -23.540 441 HB3 LYS 54 HB3 LYS 54 -2.593 6.401 -23.912 442 HG2 LYS 54 HG2 LYS 54 -4.169 5.197 -25.403 443 HG3 LYS 54 HG3 LYS 54 -5.411 6.423 -25.083 444 HD2 LYS 54 HD2 LYS 54 -3.905 8.181 -25.990 445 HD3 LYS 54 HD3 LYS 54 -2.689 6.957 -26.369 446 HE2 LYS 54 HE2 LYS 54 -5.529 7.037 -27.499 447 HE3 LYS 54 HE3 LYS 54 -4.104 7.677 -28.318 448 HZ1 LYS 54 HZ1 LYS 54 -4.619 5.476 -29.106 449 HZ2 LYS 54 HZ2 LYS 54 -3.180 5.434 -28.349 450 HZ3 LYS 54 HZ3 LYS 54 -4.514 4.829 -27.617 451 H THR 55 H THR 55 -4.553 7.312 -20.713 452 HA THR 55 HA THR 55 -1.987 7.116 -19.472 453 HB THR 55 HB THR 55 -3.317 8.553 -17.731 454 HG1 THR 55 HG1 THR 55 -5.384 8.437 -18.111 455 HG21 THR 55 HG21 THR 55 -3.256 10.514 -19.215 456 HG22 THR 55 HG22 THR 55 -1.814 9.513 -19.445 457 HG23 THR 55 HG23 THR 55 -3.127 9.462 -20.643 458 H SER 56 H SER 56 -4.607 4.913 -19.319 459 HA SER 56 HA SER 56 -5.273 3.334 -17.905 460 HB2 SER 56 HB2 SER 56 -2.445 3.394 -16.802 461 HB3 SER 56 HB3 SER 56 -3.609 2.065 -16.695 462 HG SER 56 HG SER 56 -2.512 3.164 -19.085 463 H THR 57 H THR 57 -5.851 6.033 -17.110 464 HA THR 57 HA THR 57 -5.452 6.479 -14.307 465 HB THR 57 HB THR 57 -7.846 7.410 -15.891 466 HG1 THR 57 HG1 THR 57 -5.284 8.593 -16.075 467 HG21 THR 57 HG21 THR 57 -7.762 8.165 -13.586 468 HG22 THR 57 HG22 THR 57 -6.107 8.780 -13.807 469 HG23 THR 57 HG23 THR 57 -7.469 9.532 -14.667 470 H ILE 58 H ILE 58 -6.813 5.887 -12.555 471 HA ILE 58 HA ILE 58 -8.552 3.642 -12.860 472 HB ILE 58 HB ILE 58 -8.050 5.645 -10.663 473 HG12 ILE 58 HG12 ILE 58 -6.363 3.794 -11.364 474 HG13 ILE 58 HG13 ILE 58 -6.748 3.994 -9.653 475 HG21 ILE 58 HG21 ILE 58 -10.037 3.341 -10.545 476 HG22 ILE 58 HG22 ILE 58 -9.354 4.157 -9.115 477 HG23 ILE 58 HG23 ILE 58 -10.342 5.064 -10.261 478 HD11 ILE 58 HD11 ILE 58 -6.588 1.649 -10.340 479 HD12 ILE 58 HD12 ILE 58 -8.202 2.011 -9.729 480 HD13 ILE 58 HD13 ILE 58 -7.931 1.874 -11.485 481 H GLU 59 H GLU 59 -10.692 3.513 -13.141 482 HA GLU 59 HA GLU 59 -12.439 5.896 -13.115 483 HB2 GLU 59 HB2 GLU 59 -12.268 3.600 -15.122 484 HB3 GLU 59 HB3 GLU 59 -13.766 4.485 -14.879 485 HG2 GLU 59 HG2 GLU 59 -11.130 5.758 -15.738 486 HG3 GLU 59 HG3 GLU 59 -12.432 5.281 -16.821 487 H GLU 60 H GLU 60 -14.591 5.272 -12.352 488 HA GLU 60 HA GLU 60 -14.502 2.850 -10.592 489 HB2 GLU 60 HB2 GLU 60 -15.260 5.721 -9.906 490 HB3 GLU 60 HB3 GLU 60 -15.504 4.325 -8.859 491 HG2 GLU 60 HG2 GLU 60 -13.014 3.889 -8.954 492 HG3 GLU 60 HG3 GLU 60 -12.827 5.416 -9.826 493 H LYS 61 H LYS 61 -16.001 1.562 -11.529 494 HA LYS 61 HA LYS 61 -18.608 2.777 -12.395 495 HB2 LYS 61 HB2 LYS 61 -17.340 1.702 -14.183 496 HB3 LYS 61 HB3 LYS 61 -17.182 0.219 -13.230 497 HG2 LYS 61 HG2 LYS 61 -19.572 -0.177 -13.307 498 HG3 LYS 61 HG3 LYS 61 -19.861 1.363 -14.106 499 HD2 LYS 61 HD2 LYS 61 -18.054 -0.775 -15.321 500 HD3 LYS 61 HD3 LYS 61 -19.791 -0.859 -15.518 501 HE2 LYS 61 HE2 LYS 61 -18.041 1.478 -16.403 502 HE3 LYS 61 HE3 LYS 61 -18.668 0.202 -17.453 503 HZ1 LYS 61 HZ1 LYS 61 -20.049 2.174 -17.569 504 HZ2 LYS 61 HZ2 LYS 61 -20.928 0.945 -16.922 505 HZ3 LYS 61 HZ3 LYS 61 -20.354 2.120 -15.958 506 H THR 62 H THR 62 -20.269 2.436 -10.946 507 HA THR 62 HA THR 62 -20.027 0.551 -8.797 508 HB THR 62 HB THR 62 -22.590 1.843 -9.807 509 HG1 THR 62 HG1 THR 62 -21.948 3.727 -9.049 510 HG21 THR 62 HG21 THR 62 -23.110 1.974 -7.405 511 HG22 THR 62 HG22 THR 62 -22.712 0.302 -7.834 512 HG23 THR 62 HG23 THR 62 -21.508 1.309 -7.002 513 H VAL 63 H VAL 63 -20.632 -1.575 -8.721 514 HA VAL 63 HA VAL 63 -22.268 -2.673 -10.954 515 HB VAL 63 HB VAL 63 -20.670 -4.550 -11.140 516 HG11 VAL 63 HG11 VAL 63 -19.063 -3.473 -12.574 517 HG12 VAL 63 HG12 VAL 63 -20.622 -2.654 -12.755 518 HG13 VAL 63 HG13 VAL 63 -19.324 -1.907 -11.798 519 HG21 VAL 63 HG21 VAL 63 -18.353 -4.358 -10.369 520 HG22 VAL 63 HG22 VAL 63 -18.717 -2.830 -9.545 521 HG23 VAL 63 HG23 VAL 63 -19.449 -4.350 -8.984 522 H GLU 64 H GLU 64 -23.403 -4.534 -10.520 523 HA GLU 64 HA GLU 64 -23.579 -5.386 -7.657 524 HB2 GLU 64 HB2 GLU 64 -25.714 -4.692 -8.753 525 HB3 GLU 64 HB3 GLU 64 -25.472 -5.930 -9.990 526 HG2 GLU 64 HG2 GLU 64 -25.541 -7.686 -8.223 527 HG3 GLU 64 HG3 GLU 64 -25.722 -6.435 -6.992 528 H VAL 65 H VAL 65 -22.745 -7.412 -7.232 529 HA VAL 65 HA VAL 65 -21.410 -8.833 -9.471 530 HB VAL 65 HB VAL 65 -20.965 -9.221 -6.492 531 HG11 VAL 65 HG11 VAL 65 -20.145 -10.949 -8.163 532 HG12 VAL 65 HG12 VAL 65 -19.171 -9.684 -8.920 533 HG13 VAL 65 HG13 VAL 65 -18.835 -10.174 -7.246 534 HG21 VAL 65 HG21 VAL 65 -20.443 -6.865 -6.860 535 HG22 VAL 65 HG22 VAL 65 -18.936 -7.767 -6.743 536 HG23 VAL 65 HG23 VAL 65 -19.531 -7.254 -8.336 537 H LEU 66 H LEU 66 -22.503 -10.504 -10.259 538 HA LEU 66 HA LEU 66 -24.961 -11.379 -8.942 539 HB2 LEU 66 HB2 LEU 66 -23.681 -11.718 -11.670 540 HB3 LEU 66 HB3 LEU 66 -24.981 -12.793 -11.182 541 HG LEU 66 HG LEU 66 -26.532 -10.965 -10.876 542 HD11 LEU 66 HD11 LEU 66 -25.074 -9.125 -10.168 543 HD12 LEU 66 HD12 LEU 66 -24.282 -9.106 -11.760 544 HD13 LEU 66 HD13 LEU 66 -25.997 -8.657 -11.586 545 HD21 LEU 66 HD21 LEU 66 -26.737 -10.287 -13.244 546 HD22 LEU 66 HD22 LEU 66 -25.061 -10.790 -13.546 547 HD23 LEU 66 HD23 LEU 66 -26.292 -11.994 -13.112 548 H GLY 67 H GLY 67 -21.748 -12.807 -9.624 549 HA2 GLY 67 HA2 GLY 67 -21.931 -15.025 -7.909 550 HA3 GLY 67 HA3 GLY 67 -22.535 -15.504 -9.501 551 H MET 68 H MET 68 -20.204 -16.647 -8.596 552 HA MET 68 HA MET 68 -17.915 -15.298 -9.833 553 HB2 MET 68 HB2 MET 68 -18.202 -18.178 -8.933 554 HB3 MET 68 HB3 MET 68 -16.738 -17.395 -9.572 555 HG2 MET 68 HG2 MET 68 -17.195 -15.641 -7.652 556 HG3 MET 68 HG3 MET 68 -18.108 -16.973 -6.941 557 HE1 MET 68 HE1 MET 68 -14.620 -16.616 -8.930 558 HE2 MET 68 HE2 MET 68 -14.766 -15.323 -7.717 559 HE3 MET 68 HE3 MET 68 -13.556 -16.602 -7.507 560 H ALA 69 H ALA 69 -16.877 -16.005 -11.752 561 HA ALA 69 HA ALA 69 -18.688 -16.225 -13.943 562 HB1 ALA 69 HB1 ALA 69 -16.566 -16.165 -15.262 563 HB2 ALA 69 HB2 ALA 69 -16.585 -14.960 -13.975 564 HB3 ALA 69 HB3 ALA 69 -15.661 -16.478 -13.774 565 HA PRO 70 HA PRO 70 -18.875 -20.559 -15.113 566 HB2 PRO 70 HB2 PRO 70 -17.402 -19.707 -17.609 567 HB3 PRO 70 HB3 PRO 70 -18.800 -20.821 -17.452 568 HG2 PRO 70 HG2 PRO 70 -19.222 -18.266 -18.201 569 HG3 PRO 70 HG3 PRO 70 -20.281 -18.997 -16.947 570 HD2 PRO 70 HD2 PRO 70 -17.920 -17.155 -16.587 571 HD3 PRO 70 HD3 PRO 70 -19.511 -17.117 -15.767 572 H ASP 71 H ASP 71 -17.729 -22.442 -15.422 573 HA ASP 71 HA ASP 71 -15.349 -22.956 -14.130 574 HB2 ASP 71 HB2 ASP 71 -16.925 -24.672 -14.773 575 HB3 ASP 71 HB3 ASP 71 -16.644 -24.350 -16.487 576 H ASP 72 H ASP 72 -15.819 -21.944 -17.487 577 HA ASP 72 HA ASP 72 -13.218 -22.595 -18.472 578 HB2 ASP 72 HB2 ASP 72 -15.181 -22.162 -19.906 579 HB3 ASP 72 HB3 ASP 72 -15.186 -20.469 -19.401 580 H GLU 73 H GLU 73 -14.296 -19.940 -16.467 581 HA GLU 73 HA GLU 73 -11.908 -18.293 -17.138 582 HB2 GLU 73 HB2 GLU 73 -14.509 -17.641 -15.721 583 HB3 GLU 73 HB3 GLU 73 -13.181 -16.509 -15.932 584 HG2 GLU 73 HG2 GLU 73 -14.647 -17.812 -18.266 585 HG3 GLU 73 HG3 GLU 73 -15.105 -16.281 -17.542 586 H CYS 74 H CYS 74 -13.708 -19.712 -14.338 587 HA CYS 74 HA CYS 74 -11.766 -18.705 -12.486 588 HB2 CYS 74 HB2 CYS 74 -12.938 -20.067 -10.820 589 HB3 CYS 74 HB3 CYS 74 -14.013 -18.999 -11.746 590 HG CYS 74 HG CYS 74 -15.207 -21.253 -11.218 591 H LEU 75 H LEU 75 -11.294 -21.082 -14.653 592 HA LEU 75 HA LEU 75 -9.667 -22.897 -13.047 593 HB2 LEU 75 HB2 LEU 75 -10.231 -22.517 -15.992 594 HB3 LEU 75 HB3 LEU 75 -8.820 -23.451 -15.520 595 HG LEU 75 HG LEU 75 -11.586 -24.099 -14.436 596 HD11 LEU 75 HD11 LEU 75 -10.166 -25.303 -16.860 597 HD12 LEU 75 HD12 LEU 75 -11.697 -25.869 -16.148 598 HD13 LEU 75 HD13 LEU 75 -11.617 -24.278 -16.905 599 HD21 LEU 75 HD21 LEU 75 -9.056 -25.780 -14.659 600 HD22 LEU 75 HD22 LEU 75 -9.653 -25.045 -13.159 601 HD23 LEU 75 HD23 LEU 75 -10.606 -26.292 -13.962 602 H LYS 76 H LYS 76 -9.175 -19.670 -14.157 603 HA LYS 76 HA LYS 76 -6.305 -20.035 -13.471 604 HB2 LYS 76 HB2 LYS 76 -5.571 -18.575 -15.220 605 HB3 LYS 76 HB3 LYS 76 -6.336 -20.000 -15.897 606 HG2 LYS 76 HG2 LYS 76 -8.001 -17.487 -15.587 607 HG3 LYS 76 HG3 LYS 76 -6.744 -17.515 -16.813 608 HD2 LYS 76 HD2 LYS 76 -7.726 -19.435 -17.920 609 HD3 LYS 76 HD3 LYS 76 -8.967 -19.594 -16.654 610 HE2 LYS 76 HE2 LYS 76 -9.881 -17.409 -17.179 611 HE3 LYS 76 HE3 LYS 76 -8.575 -17.063 -18.317 612 HZ1 LYS 76 HZ1 LYS 76 -9.444 -18.648 -19.824 613 HZ2 LYS 76 HZ2 LYS 76 -10.495 -19.283 -18.722 614 HZ3 LYS 76 HZ3 LYS 76 -10.744 -17.777 -19.282 615 H ASP 77 H ASP 77 -9.153 -17.936 -13.323 616 HA ASP 77 HA ASP 77 -7.732 -16.254 -11.369 617 HB2 ASP 77 HB2 ASP 77 -7.065 -15.267 -13.536 618 HB3 ASP 77 HB3 ASP 77 -8.757 -15.160 -14.008 619 H MET 78 H MET 78 -9.203 -14.855 -10.214 620 HA MET 78 HA MET 78 -11.776 -16.238 -9.867 621 HB2 MET 78 HB2 MET 78 -10.392 -14.087 -8.225 622 HB3 MET 78 HB3 MET 78 -11.929 -14.844 -7.807 623 HG2 MET 78 HG2 MET 78 -9.245 -16.259 -8.063 624 HG3 MET 78 HG3 MET 78 -10.090 -15.859 -6.579 625 HE1 MET 78 HE1 MET 78 -10.354 -18.102 -9.916 626 HE2 MET 78 HE2 MET 78 -9.114 -18.648 -8.762 627 HE3 MET 78 HE3 MET 78 -10.556 -19.638 -9.069 628 H TYR 79 H TYR 79 -12.591 -15.569 -11.922 629 HA TYR 79 HA TYR 79 -13.340 -12.746 -12.296 630 HB2 TYR 79 HB2 TYR 79 -13.729 -15.319 -13.850 631 HB3 TYR 79 HB3 TYR 79 -14.589 -13.848 -14.273 632 HD1 TYR 79 HD1 TYR 79 -13.358 -11.781 -14.941 633 HD2 TYR 79 HD2 TYR 79 -11.416 -15.621 -14.567 634 HE1 TYR 79 HE1 TYR 79 -11.559 -11.008 -16.451 635 HE2 TYR 79 HE2 TYR 79 -9.644 -14.872 -16.120 636 HH TYR 79 HH TYR 79 -8.813 -13.119 -17.417 637 H VAL 80 H VAL 80 -15.483 -11.989 -12.286 638 HA VAL 80 HA VAL 80 -17.617 -13.735 -11.178 639 HB VAL 80 HB VAL 80 -18.336 -11.699 -9.873 640 HG11 VAL 80 HG11 VAL 80 -17.330 -13.563 -8.705 641 HG12 VAL 80 HG12 VAL 80 -15.691 -12.964 -9.053 642 HG13 VAL 80 HG13 VAL 80 -16.782 -12.055 -7.985 643 HG21 VAL 80 HG21 VAL 80 -16.931 -9.976 -11.015 644 HG22 VAL 80 HG22 VAL 80 -16.719 -9.981 -9.261 645 HG23 VAL 80 HG23 VAL 80 -15.479 -10.706 -10.294 646 H GLU 81 H GLU 81 -19.716 -13.188 -11.837 647 HA GLU 81 HA GLU 81 -19.946 -11.665 -14.369 648 HB2 GLU 81 HB2 GLU 81 -21.971 -13.207 -12.675 649 HB3 GLU 81 HB3 GLU 81 -22.341 -12.349 -14.180 650 HG2 GLU 81 HG2 GLU 81 -20.660 -13.802 -15.364 651 HG3 GLU 81 HG3 GLU 81 -20.455 -14.725 -13.874 652 H VAL 82 H VAL 82 -20.956 -9.655 -14.448 653 HA VAL 82 HA VAL 82 -21.701 -8.390 -11.890 654 HB VAL 82 HB VAL 82 -19.156 -8.213 -13.225 655 HG11 VAL 82 HG11 VAL 82 -19.963 -6.454 -14.658 656 HG12 VAL 82 HG12 VAL 82 -20.525 -5.520 -13.252 657 HG13 VAL 82 HG13 VAL 82 -18.790 -5.837 -13.486 658 HG21 VAL 82 HG21 VAL 82 -18.547 -6.853 -11.282 659 HG22 VAL 82 HG22 VAL 82 -20.262 -6.757 -10.818 660 HG23 VAL 82 HG23 VAL 82 -19.431 -8.323 -10.850 661 H ALA 83 H ALA 83 -23.161 -6.751 -12.128 662 HA ALA 83 HA ALA 83 -24.136 -6.164 -14.899 663 HB1 ALA 83 HB1 ALA 83 -25.709 -6.113 -12.299 664 HB2 ALA 83 HB2 ALA 83 -26.320 -5.708 -13.920 665 HB3 ALA 83 HB3 ALA 83 -25.812 -7.367 -13.559 666 H ASP 84 H ASP 84 -24.201 -4.065 -15.514 667 HA ASP 84 HA ASP 84 -22.565 -2.222 -13.955 668 HB2 ASP 84 HB2 ASP 84 -22.188 -2.554 -16.337 669 HB3 ASP 84 HB3 ASP 84 -23.844 -2.038 -16.692 670 H ILE 85 H ILE 85 -24.367 -2.288 -12.253 671 HA ILE 85 HA ILE 85 -26.739 -0.762 -12.628 672 HB ILE 85 HB ILE 85 -26.831 -0.573 -10.207 673 HG12 ILE 85 HG12 ILE 85 -24.101 -1.876 -10.104 674 HG13 ILE 85 HG13 ILE 85 -24.400 -0.173 -9.771 675 HG21 ILE 85 HG21 ILE 85 -27.087 -2.930 -9.760 676 HG22 ILE 85 HG22 ILE 85 -27.485 -2.665 -11.454 677 HG23 ILE 85 HG23 ILE 85 -25.913 -3.367 -11.019 678 HD11 ILE 85 HD11 ILE 85 -25.527 -2.499 -8.157 679 HD12 ILE 85 HD12 ILE 85 -24.202 -1.439 -7.687 680 HD13 ILE 85 HD13 ILE 85 -25.840 -0.775 -7.858 681 H GLY 86 H GLY 86 -23.467 0.340 -12.557 682 HA2 GLY 86 HA2 GLY 86 -24.096 3.112 -11.854 683 HA3 GLY 86 HA3 GLY 86 -22.544 2.428 -12.364 684 H GLY 87 H GLY 87 -24.548 1.229 -14.691 685 HA2 GLY 87 HA2 GLY 87 -24.683 3.649 -16.406 686 HA3 GLY 87 HA3 GLY 87 -23.571 2.347 -16.845 687 H LYS 88 H LYS 88 -24.408 0.359 -17.628 688 HA LYS 88 HA LYS 88 -26.732 0.653 -19.209 689 HB2 LYS 88 HB2 LYS 88 -25.458 -1.979 -18.335 690 HB3 LYS 88 HB3 LYS 88 -26.550 -1.760 -19.690 691 HG2 LYS 88 HG2 LYS 88 -23.737 -0.619 -19.462 692 HG3 LYS 88 HG3 LYS 88 -24.267 -1.980 -20.448 693 HD2 LYS 88 HD2 LYS 88 -25.750 -0.444 -21.751 694 HD3 LYS 88 HD3 LYS 88 -25.114 0.927 -20.808 695 HE2 LYS 88 HE2 LYS 88 -22.816 0.387 -21.567 696 HE3 LYS 88 HE3 LYS 88 -23.438 -0.980 -22.498 697 HZ1 LYS 88 HZ1 LYS 88 -23.109 0.960 -23.891 698 HZ2 LYS 88 HZ2 LYS 88 -24.695 0.597 -23.851 699 HZ3 LYS 88 HZ3 LYS 88 -24.120 1.863 -22.990 700 H ASP 89 H ASP 89 -26.409 -0.776 -16.029 701 HA ASP 89 HA ASP 89 -27.692 -1.605 -14.477 702 HB2 ASP 89 HB2 ASP 89 -28.651 0.631 -14.544 703 HB3 ASP 89 HB3 ASP 89 -29.842 0.111 -15.740 704 H ASP 90 H ASP 90 -29.002 -2.173 -17.653 705 HA ASP 90 HA ASP 90 -30.589 -4.499 -16.704 706 HB2 ASP 90 HB2 ASP 90 -31.696 -2.548 -17.823 707 HB3 ASP 90 HB3 ASP 90 -30.704 -2.861 -19.252 708 H ASP 91 H ASP 91 -27.558 -4.155 -17.623 709 HA ASP 91 HA ASP 91 -27.529 -6.643 -19.235 710 HB2 ASP 91 HB2 ASP 91 -27.242 -4.588 -20.736 711 HB3 ASP 91 HB3 ASP 91 -25.696 -4.341 -19.902 712 H VAL 92 H VAL 92 -25.398 -7.627 -19.290 713 HA VAL 92 HA VAL 92 -23.990 -7.389 -16.682 714 HB VAL 92 HB VAL 92 -25.055 -9.901 -18.047 715 HG11 VAL 92 HG11 VAL 92 -23.012 -10.394 -16.732 716 HG12 VAL 92 HG12 VAL 92 -23.774 -9.668 -15.299 717 HG13 VAL 92 HG13 VAL 92 -24.450 -11.130 -16.035 718 HG21 VAL 92 HG21 VAL 92 -26.059 -8.464 -15.561 719 HG22 VAL 92 HG22 VAL 92 -26.938 -8.692 -17.087 720 HG23 VAL 92 HG23 VAL 92 -26.578 -10.084 -16.073 721 H TYR 93 H TYR 93 -21.858 -7.962 -16.679 722 HA TYR 93 HA TYR 93 -20.455 -8.808 -19.151 723 HB2 TYR 93 HB2 TYR 93 -19.615 -6.593 -17.221 724 HB3 TYR 93 HB3 TYR 93 -18.682 -7.168 -18.591 725 HD1 TYR 93 HD1 TYR 93 -19.364 -6.666 -20.923 726 HD2 TYR 93 HD2 TYR 93 -21.479 -5.033 -17.532 727 HE1 TYR 93 HE1 TYR 93 -20.391 -4.965 -22.393 728 HE2 TYR 93 HE2 TYR 93 -22.528 -3.338 -18.996 729 HH TYR 93 HH TYR 93 -21.808 -3.142 -22.526 730 H THR 94 H THR 94 -17.946 -9.060 -18.098 731 HA THR 94 HA THR 94 -18.197 -10.548 -15.539 732 HB THR 94 HB THR 94 -16.371 -11.348 -17.833 733 HG1 THR 94 HG1 THR 94 -18.528 -11.683 -18.425 734 HG21 THR 94 HG21 THR 94 -17.265 -12.895 -15.358 735 HG22 THR 94 HG22 THR 94 -16.130 -13.453 -16.607 736 HG23 THR 94 HG23 THR 94 -15.685 -12.107 -15.549 737 H ALA 95 H ALA 95 -16.483 -10.153 -14.124 738 HA ALA 95 HA ALA 95 -14.419 -8.166 -14.916 739 HB1 ALA 95 HB1 ALA 95 -14.871 -6.906 -12.835 740 HB2 ALA 95 HB2 ALA 95 -16.315 -6.931 -13.864 741 HB3 ALA 95 HB3 ALA 95 -16.216 -8.000 -12.448 742 H LYS 96 H LYS 96 -12.556 -8.241 -13.525 743 HA LYS 96 HA LYS 96 -12.090 -10.873 -12.255 744 HB2 LYS 96 HB2 LYS 96 -9.828 -9.633 -11.721 745 HB3 LYS 96 HB3 LYS 96 -10.122 -10.371 -13.278 746 HG2 LYS 96 HG2 LYS 96 -10.829 -7.463 -13.006 747 HG3 LYS 96 HG3 LYS 96 -9.117 -7.902 -13.013 748 HD2 LYS 96 HD2 LYS 96 -9.212 -8.823 -15.183 749 HD3 LYS 96 HD3 LYS 96 -10.965 -8.933 -15.175 750 HE2 LYS 96 HE2 LYS 96 -10.157 -7.160 -16.660 751 HE3 LYS 96 HE3 LYS 96 -11.233 -6.544 -15.410 752 HZ1 LYS 96 HZ1 LYS 96 -9.124 -5.263 -15.933 753 HZ2 LYS 96 HZ2 LYS 96 -9.484 -5.442 -14.369 754 HZ3 LYS 96 HZ3 LYS 96 -8.304 -6.378 -15.077 755 H LEU 97 H LEU 97 -12.391 -11.191 -10.080 756 HA LEU 97 HA LEU 97 -13.570 -9.213 -8.421 757 HB2 LEU 97 HB2 LEU 97 -13.709 -11.678 -8.087 758 HB3 LEU 97 HB3 LEU 97 -11.991 -11.715 -7.681 759 HG LEU 97 HG LEU 97 -12.417 -10.348 -5.662 760 HD11 LEU 97 HD11 LEU 97 -15.347 -10.511 -6.522 761 HD12 LEU 97 HD12 LEU 97 -14.789 -9.981 -4.924 762 HD13 LEU 97 HD13 LEU 97 -14.372 -9.033 -6.344 763 HD21 LEU 97 HD21 LEU 97 -13.590 -12.097 -4.395 764 HD22 LEU 97 HD22 LEU 97 -14.231 -12.787 -5.901 765 HD23 LEU 97 HD23 LEU 97 -12.485 -12.815 -5.569 766 H SER 98 H SER 98 -10.208 -10.117 -9.023 767 HA SER 98 HA SER 98 -8.704 -8.736 -7.213 768 HB2 SER 98 HB2 SER 98 -8.180 -8.804 -10.201 769 HB3 SER 98 HB3 SER 98 -7.013 -8.961 -8.884 770 HG SER 98 HG SER 98 -7.630 -10.969 -9.966 771 H ASP 99 H ASP 99 -10.819 -7.288 -9.626 772 HA ASP 99 HA ASP 99 -9.371 -4.703 -9.484 773 HB2 ASP 99 HB2 ASP 99 -9.548 -6.151 -11.597 774 HB3 ASP 99 HB3 ASP 99 -11.256 -5.681 -11.643 775 H ILE 100 H ILE 100 -11.669 -5.987 -7.854 776 HA ILE 100 HA ILE 100 -13.559 -3.686 -7.988 777 HB ILE 100 HB ILE 100 -13.966 -6.641 -7.776 778 HG12 ILE 100 HG12 ILE 100 -15.617 -4.365 -8.957 779 HG13 ILE 100 HG13 ILE 100 -14.352 -5.247 -9.837 780 HG21 ILE 100 HG21 ILE 100 -14.975 -5.944 -5.627 781 HG22 ILE 100 HG22 ILE 100 -15.991 -4.765 -6.497 782 HG23 ILE 100 HG23 ILE 100 -16.175 -6.511 -6.763 783 HD11 ILE 100 HD11 ILE 100 -15.696 -7.358 -9.452 784 HD12 ILE 100 HD12 ILE 100 -17.004 -6.308 -8.834 785 HD13 ILE 100 HD13 ILE 100 -16.444 -6.136 -10.506 786 H GLU 101 H GLU 101 -14.401 -2.936 -6.173 787 HA GLU 101 HA GLU 101 -13.075 -3.522 -3.561 788 HB2 GLU 101 HB2 GLU 101 -12.410 -1.328 -4.388 789 HB3 GLU 101 HB3 GLU 101 -14.091 -0.905 -4.756 790 HG2 GLU 101 HG2 GLU 101 -14.680 -0.846 -2.413 791 HG3 GLU 101 HG3 GLU 101 -13.138 -1.570 -1.951 792 H ALA 102 H ALA 102 -14.551 -4.468 -2.213 793 HA ALA 102 HA ALA 102 -17.319 -4.736 -3.131 794 HB1 ALA 102 HB1 ALA 102 -16.008 -6.611 -2.140 795 HB2 ALA 102 HB2 ALA 102 -16.004 -5.763 -0.577 796 HB3 ALA 102 HB3 ALA 102 -17.539 -6.299 -1.298 797 H ILE 103 H ILE 103 -19.090 -3.802 -2.240 798 HA ILE 103 HA ILE 103 -18.721 -1.819 -0.027 799 HB ILE 103 HB ILE 103 -20.099 -1.628 -2.713 800 HG12 ILE 103 HG12 ILE 103 -18.022 0.160 -1.361 801 HG13 ILE 103 HG13 ILE 103 -17.645 -1.088 -2.548 802 HG21 ILE 103 HG21 ILE 103 -20.405 0.338 -0.403 803 HG22 ILE 103 HG22 ILE 103 -21.011 0.576 -2.058 804 HG23 ILE 103 HG23 ILE 103 -21.686 -0.700 -1.078 805 HD11 ILE 103 HD11 ILE 103 -19.050 0.070 -4.226 806 HD12 ILE 103 HD12 ILE 103 -19.258 1.418 -3.075 807 HD13 ILE 103 HD13 ILE 103 -17.643 1.005 -3.657 808 H ASP 104 H ASP 104 -20.227 -1.756 1.509 809 HA ASP 104 HA ASP 104 -21.927 -2.339 2.834 810 HB2 ASP 104 HB2 ASP 104 -23.015 -0.861 1.189 811 HB3 ASP 104 HB3 ASP 104 -23.522 -2.270 0.256 812 H VAL 105 H VAL 105 -20.359 -4.544 2.146 813 HA VAL 105 HA VAL 105 -22.343 -6.757 2.033 814 HB VAL 105 HB VAL 105 -20.572 -6.389 0.194 815 HG11 VAL 105 HG11 VAL 105 -18.422 -7.495 0.492 816 HG12 VAL 105 HG12 VAL 105 -18.566 -6.096 1.570 817 HG13 VAL 105 HG13 VAL 105 -18.757 -7.741 2.209 818 HG21 VAL 105 HG21 VAL 105 -20.478 -8.726 -0.257 819 HG22 VAL 105 HG22 VAL 105 -20.872 -9.126 1.431 820 HG23 VAL 105 HG23 VAL 105 -22.064 -8.318 0.409 821 H ASP 106 H ASP 106 -21.631 -8.796 3.208 822 HA ASP 106 HA ASP 106 -21.390 -8.196 6.007 823 HB2 ASP 106 HB2 ASP 106 -22.680 -10.113 5.134 824 HB3 ASP 106 HB3 ASP 106 -21.182 -10.837 4.525 825 H ASP 107 H ASP 107 -19.764 -8.977 7.429 826 HA ASP 107 HA ASP 107 -17.135 -8.187 6.779 827 HB2 ASP 107 HB2 ASP 107 -18.014 -8.212 9.060 828 HB3 ASP 107 HB3 ASP 107 -18.174 -9.970 9.012 829 H ASP 108 H ASP 108 -18.579 -11.532 6.766 830 HA ASP 108 HA ASP 108 -15.957 -12.716 6.455 831 HB2 ASP 108 HB2 ASP 108 -18.112 -13.844 7.349 832 HB3 ASP 108 HB3 ASP 108 -18.553 -14.052 5.641 833 H THR 109 H THR 109 -18.490 -11.589 4.244 834 HA THR 109 HA THR 109 -17.441 -12.666 1.811 835 HB THR 109 HB THR 109 -19.073 -10.121 2.253 836 HG1 THR 109 HG1 THR 109 -20.850 -11.495 2.105 837 HG21 THR 109 HG21 THR 109 -18.502 -11.895 -0.105 838 HG22 THR 109 HG22 THR 109 -20.056 -11.074 -0.014 839 HG23 THR 109 HG23 THR 109 -18.534 -10.143 -0.019 840 H GLN 110 H GLN 110 -17.188 -9.411 3.408 841 HA GLN 110 HA GLN 110 -15.425 -8.287 1.546 842 HB2 GLN 110 HB2 GLN 110 -16.806 -7.284 3.580 843 HB3 GLN 110 HB3 GLN 110 -15.318 -7.532 4.484 844 HG2 GLN 110 HG2 GLN 110 -15.676 -5.882 1.937 845 HG3 GLN 110 HG3 GLN 110 -15.547 -5.239 3.565 846 HE21 GLN 110 HE22 GLN 110 -13.761 -5.980 0.761 847 HE22 GLN 110 HE21 GLN 110 -12.164 -5.956 1.461 848 H GLU 111 H GLU 111 -14.668 -10.075 4.612 849 HA GLU 111 HA GLU 111 -11.861 -9.755 4.430 850 HB2 GLU 111 HB2 GLU 111 -13.640 -11.817 5.777 851 HB3 GLU 111 HB3 GLU 111 -11.887 -11.900 5.891 852 HG2 GLU 111 HG2 GLU 111 -13.463 -9.421 6.714 853 HG3 GLU 111 HG3 GLU 111 -13.061 -10.736 7.813 854 H ALA 112 H ALA 112 -13.997 -12.260 2.934 855 HA ALA 112 HA ALA 112 -11.820 -13.900 2.043 856 HB1 ALA 112 HB1 ALA 112 -14.197 -14.639 2.115 857 HB2 ALA 112 HB2 ALA 112 -14.565 -13.549 0.755 858 HB3 ALA 112 HB3 ALA 112 -13.442 -14.910 0.539 859 H ILE 113 H ILE 113 -13.493 -11.088 0.590 860 HA ILE 113 HA ILE 113 -12.089 -11.197 -1.919 861 HB ILE 113 HB ILE 113 -13.565 -8.930 -0.509 862 HG12 ILE 113 HG12 ILE 113 -14.489 -10.736 -2.787 863 HG13 ILE 113 HG13 ILE 113 -14.855 -11.069 -1.112 864 HG21 ILE 113 HG21 ILE 113 -12.046 -7.991 -2.215 865 HG22 ILE 113 HG22 ILE 113 -12.669 -9.131 -3.423 866 HG23 ILE 113 HG23 ILE 113 -13.714 -7.860 -2.755 867 HD11 ILE 113 HD11 ILE 113 -15.973 -8.808 -0.955 868 HD12 ILE 113 HD12 ILE 113 -15.841 -8.736 -2.738 869 HD13 ILE 113 HD13 ILE 113 -16.767 -10.029 -1.960 870 H ALA 114 H ALA 114 -11.563 -9.361 1.148 871 HA ALA 114 HA ALA 114 -9.255 -7.943 0.320 872 HB1 ALA 114 HB1 ALA 114 -8.796 -7.714 2.719 873 HB2 ALA 114 HB2 ALA 114 -10.523 -7.461 2.400 874 HB3 ALA 114 HB3 ALA 114 -9.959 -8.998 3.095 875 H ASP 115 H ASP 115 -9.622 -11.236 1.716 876 HA ASP 115 HA ASP 115 -6.814 -11.725 1.944 877 HB2 ASP 115 HB2 ASP 115 -8.538 -12.973 3.199 878 HB3 ASP 115 HB3 ASP 115 -9.087 -13.724 1.695 879 H TRP 116 H TRP 116 -9.168 -12.423 -0.711 880 HA TRP 116 HA TRP 116 -7.302 -13.697 -2.457 881 HB2 TRP 116 HB2 TRP 116 -9.626 -13.784 -3.005 882 HB3 TRP 116 HB3 TRP 116 -9.794 -12.035 -2.944 883 HD1 TRP 116 HD1 TRP 116 -9.706 -10.821 -5.170 884 HE1 TRP 116 HE1 TRP 116 -8.774 -11.270 -7.531 885 HE3 TRP 116 HE3 TRP 116 -7.518 -15.380 -4.365 886 HZ2 TRP 116 HZ2 TRP 116 -7.300 -13.320 -8.874 887 HZ3 TRP 116 HZ3 TRP 116 -6.373 -16.567 -6.208 888 HH2 TRP 116 HH2 TRP 116 -6.242 -15.543 -8.464 889 H LEU 117 H LEU 117 -8.084 -10.203 -1.970 890 HA LEU 117 HA LEU 117 -6.327 -9.277 -4.016 891 HB2 LEU 117 HB2 LEU 117 -7.417 -7.954 -1.503 892 HB3 LEU 117 HB3 LEU 117 -6.445 -7.090 -2.681 893 HG LEU 117 HG LEU 117 -8.994 -8.545 -3.503 894 HD11 LEU 117 HD11 LEU 117 -10.164 -6.379 -3.314 895 HD12 LEU 117 HD12 LEU 117 -9.612 -6.971 -1.742 896 HD13 LEU 117 HD13 LEU 117 -8.722 -5.662 -2.555 897 HD21 LEU 117 HD21 LEU 117 -7.466 -7.902 -5.334 898 HD22 LEU 117 HD22 LEU 117 -8.960 -6.957 -5.372 899 HD23 LEU 117 HD23 LEU 117 -7.466 -6.225 -4.754 900 H TYR 118 H TYR 118 -5.767 -9.827 -0.480 901 HA TYR 118 HA TYR 118 -3.064 -8.916 -0.494 902 HB2 TYR 118 HB2 TYR 118 -4.329 -11.048 1.264 903 HB3 TYR 118 HB3 TYR 118 -2.814 -10.219 1.578 904 HD1 TYR 118 HD2 TYR 118 -3.861 -7.332 0.796 905 HD2 TYR 118 HD1 TYR 118 -5.357 -10.483 3.348 906 HE1 TYR 118 HE2 TYR 118 -5.074 -5.663 2.135 907 HE2 TYR 118 HE1 TYR 118 -6.581 -8.809 4.696 908 HH TYR 118 HH TYR 118 -6.485 -5.290 3.953 909 H TRP 119 H TRP 119 -4.450 -12.200 -1.116 910 HA TRP 119 HA TRP 119 -1.944 -13.505 -1.516 911 HB2 TRP 119 HB2 TRP 119 -3.788 -14.917 -1.310 912 HB3 TRP 119 HB3 TRP 119 -4.784 -13.976 -2.410 913 HD1 TRP 119 HD1 TRP 119 -4.794 -14.546 -4.898 914 HE1 TRP 119 HE1 TRP 119 -3.768 -16.369 -6.366 915 HE3 TRP 119 HE3 TRP 119 -1.453 -16.457 -1.521 916 HZ2 TRP 119 HZ2 TRP 119 -1.677 -18.370 -6.111 917 HZ3 TRP 119 HZ3 TRP 119 0.060 -18.312 -2.170 918 HH2 TRP 119 HH2 TRP 119 -0.043 -19.272 -4.462 919 H LEU 120 H LEU 120 -4.017 -11.592 -3.758 920 HA LEU 120 HA LEU 120 -2.619 -12.248 -6.111 921 HB2 LEU 120 HB2 LEU 120 -4.875 -10.947 -5.762 922 HB3 LEU 120 HB3 LEU 120 -3.864 -9.526 -5.542 923 HG LEU 120 HG LEU 120 -2.785 -10.411 -7.870 924 HD11 LEU 120 HD11 LEU 120 -5.699 -11.305 -8.034 925 HD12 LEU 120 HD12 LEU 120 -4.473 -11.404 -9.315 926 HD13 LEU 120 HD13 LEU 120 -4.341 -12.424 -7.869 927 HD21 LEU 120 HD21 LEU 120 -3.670 -8.189 -7.581 928 HD22 LEU 120 HD22 LEU 120 -4.397 -8.883 -9.039 929 HD23 LEU 120 HD23 LEU 120 -5.334 -8.793 -7.523 930 H ALA 121 H ALA 121 -2.208 -9.598 -3.740 931 HA ALA 121 HA ALA 121 0.056 -8.338 -4.927 932 HB1 ALA 121 HB1 ALA 121 -1.428 -7.264 -3.281 933 HB2 ALA 121 HB2 ALA 121 -0.941 -8.435 -2.043 934 HB3 ALA 121 HB3 ALA 121 0.247 -7.277 -2.681 935 H ARG 122 H ARG 122 -0.226 -10.953 -2.479 936 HA ARG 122 HA ARG 122 2.485 -11.212 -1.781 937 HB2 ARG 122 HB2 ARG 122 0.488 -12.306 -0.689 938 HB3 ARG 122 HB3 ARG 122 0.406 -13.428 -2.041 939 HG2 ARG 122 HG2 ARG 122 1.412 -14.479 -0.142 940 HG3 ARG 122 HG3 ARG 122 2.597 -14.377 -1.439 941 HD2 ARG 122 HD2 ARG 122 3.858 -12.718 -0.349 942 HD3 ARG 122 HD3 ARG 122 2.509 -12.184 0.648 943 HE ARG 122 HE ARG 122 4.393 -14.299 1.228 944 HH11 ARG 122 HH11 ARG 122 1.059 -13.219 1.934 945 HH12 ARG 122 HH12 ARG 122 1.070 -13.889 3.530 946 HH21 ARG 122 HH21 ARG 122 4.303 -15.261 3.290 947 HH22 ARG 122 HH22 ARG 122 2.946 -14.939 4.360 948 H GLY 123 H GLY 123 0.807 -12.273 -4.717 949 HA2 GLY 123 HA2 GLY 123 2.620 -12.399 -6.564 950 HA3 GLY 123 HA3 GLY 123 3.187 -13.805 -5.643 951 H TYR 124 H TYR 124 0.528 -12.515 -7.654 952 HA TYR 124 HA TYR 124 -1.268 -14.719 -7.413 953 HB2 TYR 124 HB2 TYR 124 -2.109 -12.725 -8.353 954 HB3 TYR 124 HB3 TYR 124 -0.748 -12.536 -9.443 955 HD1 TYR 124 HD2 TYR 124 -3.686 -14.837 -8.807 956 HD2 TYR 124 HD1 TYR 124 -0.871 -13.244 -11.670 957 HE1 TYR 124 HE2 TYR 124 -4.845 -16.055 -10.620 958 HE2 TYR 124 HE1 TYR 124 -2.034 -14.448 -13.489 959 HH TYR 124 HH TYR 124 -4.852 -16.596 -12.892 960 H LYS 125 H LYS 125 -1.162 -16.669 -8.243 961 HA LYS 125 HA LYS 125 0.200 -17.185 -10.801 962 HB2 LYS 125 HB2 LYS 125 1.199 -19.302 -9.915 963 HB3 LYS 125 HB3 LYS 125 1.933 -17.817 -9.314 964 HG2 LYS 125 HG2 LYS 125 0.772 -18.041 -7.161 965 HG3 LYS 125 HG3 LYS 125 -0.141 -19.419 -7.766 966 HD2 LYS 125 HD2 LYS 125 1.623 -20.217 -6.338 967 HD3 LYS 125 HD3 LYS 125 1.986 -20.706 -8.001 968 HE2 LYS 125 HE2 LYS 125 3.569 -18.796 -8.214 969 HE3 LYS 125 HE3 LYS 125 3.169 -18.275 -6.572 970 HZ1 LYS 125 HZ1 LYS 125 4.105 -20.360 -5.754 971 HZ2 LYS 125 HZ2 LYS 125 4.467 -20.847 -7.274 972 HZ3 LYS 125 HZ3 LYS 125 5.214 -19.552 -6.629 973 H PHE 126 H PHE 126 -2.427 -17.821 -8.593 974 HA PHE 126 HA PHE 126 -4.051 -18.858 -10.623 975 HB2 PHE 126 HB2 PHE 126 -4.788 -20.838 -9.150 976 HB3 PHE 126 HB3 PHE 126 -3.351 -21.042 -10.119 977 HD1 PHE 126 HD1 PHE 126 -4.420 -20.137 -6.623 978 HD2 PHE 126 HD2 PHE 126 -1.341 -21.793 -9.143 979 HE1 PHE 126 HE1 PHE 126 -3.095 -20.767 -4.614 980 HE2 PHE 126 HE2 PHE 126 -0.043 -22.448 -7.139 981 HZ PHE 126 HZ PHE 126 -0.898 -21.889 -4.870 Start of MODEL 6 1 H1 MET 1 H1 MET 1 4.445 -6.751 -8.177 2 H2 MET 1 H2 MET 1 3.486 -5.581 -7.545 3 H3 MET 1 H3 MET 1 5.109 -5.411 -7.496 4 HA MET 1 HA MET 1 3.544 -7.438 -6.067 5 HB2 MET 1 HB2 MET 1 5.731 -8.339 -6.706 6 HB3 MET 1 HB3 MET 1 6.552 -6.925 -6.031 7 HG2 MET 1 HG2 MET 1 5.772 -7.528 -3.770 8 HG3 MET 1 HG3 MET 1 4.887 -8.909 -4.427 9 HE1 MET 1 HE1 MET 1 6.108 -10.227 -2.411 10 HE2 MET 1 HE2 MET 1 7.873 -10.357 -2.255 11 HE3 MET 1 HE3 MET 1 7.070 -8.796 -1.979 12 H ALA 2 H ALA 2 3.013 -6.985 -3.953 13 HA ALA 2 HA ALA 2 4.226 -4.661 -2.585 14 HB1 ALA 2 HB1 ALA 2 2.061 -3.823 -3.486 15 HB2 ALA 2 HB2 ALA 2 1.223 -5.204 -2.734 16 HB3 ALA 2 HB3 ALA 2 2.015 -3.985 -1.717 17 H SER 3 H SER 3 4.914 -5.387 -0.617 18 HA SER 3 HA SER 3 4.491 -8.072 0.248 19 HB2 SER 3 HB2 SER 3 5.474 -5.670 1.843 20 HB3 SER 3 HB3 SER 3 5.767 -7.384 2.200 21 HG SER 3 HG SER 3 7.536 -6.378 1.121 22 H VAL 4 H VAL 4 3.225 -8.870 1.966 23 HA VAL 4 HA VAL 4 1.353 -7.226 3.430 24 HB VAL 4 HB VAL 4 -0.568 -8.708 2.789 25 HG11 VAL 4 HG11 VAL 4 -1.212 -7.580 0.762 26 HG12 VAL 4 HG12 VAL 4 -0.334 -6.436 1.788 27 HG13 VAL 4 HG13 VAL 4 0.467 -7.170 0.378 28 HG21 VAL 4 HG21 VAL 4 1.168 -9.569 0.439 29 HG22 VAL 4 HG22 VAL 4 0.683 -10.606 1.812 30 HG23 VAL 4 HG23 VAL 4 -0.525 -9.984 0.692 31 H GLU 5 H GLU 5 0.305 -8.722 5.064 32 HA GLU 5 HA GLU 5 2.275 -10.248 6.442 33 HB2 GLU 5 HB2 GLU 5 -0.754 -10.134 6.761 34 HB3 GLU 5 HB3 GLU 5 0.347 -10.965 7.871 35 HG2 GLU 5 HG2 GLU 5 1.538 -8.818 8.293 36 HG3 GLU 5 HG3 GLU 5 0.394 -7.981 7.241 37 H ARG 6 H ARG 6 3.029 -12.232 6.105 38 HA ARG 6 HA ARG 6 1.295 -14.457 5.494 39 HB2 ARG 6 HB2 ARG 6 2.180 -13.757 3.261 40 HB3 ARG 6 HB3 ARG 6 3.798 -13.621 3.959 41 HG2 ARG 6 HG2 ARG 6 3.579 -16.166 4.469 42 HG3 ARG 6 HG3 ARG 6 2.223 -16.141 3.334 43 HD2 ARG 6 HD2 ARG 6 3.682 -15.371 1.560 44 HD3 ARG 6 HD3 ARG 6 4.971 -14.987 2.709 45 HE ARG 6 HE ARG 6 4.290 -17.635 1.604 46 HH11 ARG 6 HH11 ARG 6 6.103 -15.968 4.213 47 HH12 ARG 6 HH12 ARG 6 6.983 -17.412 4.639 48 HH21 ARG 6 HH21 ARG 6 5.456 -19.375 2.126 49 HH22 ARG 6 HH22 ARG 6 6.571 -19.416 3.504 50 H ASP 7 H ASP 7 2.316 -16.267 6.472 51 HA ASP 7 HA ASP 7 4.965 -16.080 7.707 52 HB2 ASP 7 HB2 ASP 7 3.422 -15.401 9.538 53 HB3 ASP 7 HB3 ASP 7 2.446 -16.845 9.256 54 H GLU 8 H GLU 8 5.674 -18.434 8.190 55 HA GLU 8 HA GLU 8 4.929 -20.152 6.039 56 HB2 GLU 8 HB2 GLU 8 6.202 -21.017 8.660 57 HB3 GLU 8 HB3 GLU 8 6.267 -21.842 7.104 58 HG2 GLU 8 HG2 GLU 8 7.661 -19.293 7.955 59 HG3 GLU 8 HG3 GLU 8 8.389 -20.804 7.424 60 H THR 9 H THR 9 3.554 -19.737 9.299 61 HA THR 9 HA THR 9 1.890 -22.055 9.333 62 HB THR 9 HB THR 9 1.212 -19.329 10.459 63 HG1 THR 9 HG1 THR 9 3.223 -19.630 11.125 64 HG21 THR 9 HG21 THR 9 0.671 -22.163 11.456 65 HG22 THR 9 HG22 THR 9 0.192 -20.657 12.279 66 HG23 THR 9 HG23 THR 9 -0.513 -21.069 10.709 67 H ARG 10 H ARG 10 1.414 -18.808 7.777 68 HA ARG 10 HA ARG 10 -1.285 -19.450 6.953 69 HB2 ARG 10 HB2 ARG 10 -0.439 -17.078 7.184 70 HB3 ARG 10 HB3 ARG 10 0.668 -17.368 5.842 71 HG2 ARG 10 HG2 ARG 10 -1.213 -16.199 4.964 72 HG3 ARG 10 HG3 ARG 10 -1.290 -17.847 4.360 73 HD2 ARG 10 HD2 ARG 10 -2.881 -18.214 6.481 74 HD3 ARG 10 HD3 ARG 10 -3.053 -16.470 6.409 75 HE ARG 10 HE ARG 10 -4.096 -18.512 4.610 76 HH11 ARG 10 HH11 ARG 10 -3.406 -15.022 4.833 77 HH12 ARG 10 HH12 ARG 10 -4.580 -14.592 3.618 78 HH21 ARG 10 HH21 ARG 10 -5.625 -17.899 2.997 79 HH22 ARG 10 HH22 ARG 10 -5.811 -16.228 2.563 80 H GLU 11 H GLU 11 1.961 -19.704 5.431 81 HA GLU 11 HA GLU 11 1.077 -20.567 2.894 82 HB2 GLU 11 HB2 GLU 11 3.410 -19.847 3.678 83 HB3 GLU 11 HB3 GLU 11 3.595 -21.458 4.362 84 HG2 GLU 11 HG2 GLU 11 4.649 -21.572 2.280 85 HG3 GLU 11 HG3 GLU 11 3.109 -22.387 2.024 86 H HIS 12 H HIS 12 1.919 -22.455 5.808 87 HA HIS 12 HA HIS 12 1.308 -25.051 4.837 88 HB2 HIS 12 HB2 HIS 12 2.531 -24.967 6.835 89 HB3 HIS 12 HB3 HIS 12 1.512 -23.717 7.536 90 HD1 HIS 12 HD1 HIS 12 0.890 -27.471 6.610 91 HD2 HIS 12 HD2 HIS 12 -0.012 -24.441 9.389 92 HE1 HIS 12 HE1 HIS 12 -0.613 -28.540 8.365 93 H ARG 13 H ARG 13 -0.793 -22.728 6.689 94 HA ARG 13 HA ARG 13 -3.028 -24.473 6.677 95 HB2 ARG 13 HB2 ARG 13 -2.768 -21.462 7.025 96 HB3 ARG 13 HB3 ARG 13 -4.318 -22.302 7.159 97 HG2 ARG 13 HG2 ARG 13 -3.510 -23.696 8.980 98 HG3 ARG 13 HG3 ARG 13 -1.875 -23.027 8.845 99 HD2 ARG 13 HD2 ARG 13 -2.685 -20.802 9.448 100 HD3 ARG 13 HD3 ARG 13 -4.359 -21.401 9.524 101 HE ARG 13 HE ARG 13 -2.893 -23.027 11.248 102 HH11 ARG 13 HH11 ARG 13 -3.714 -19.577 11.062 103 HH12 ARG 13 HH12 ARG 13 -3.614 -19.314 12.762 104 HH21 ARG 13 HH21 ARG 13 -2.761 -22.679 13.519 105 HH22 ARG 13 HH22 ARG 13 -3.068 -21.124 14.188 106 H ILE 14 H ILE 14 -2.308 -21.764 4.344 107 HA ILE 14 HA ILE 14 -4.741 -22.168 2.964 108 HB ILE 14 HB ILE 14 -3.283 -20.150 2.810 109 HG12 ILE 14 HG12 ILE 14 -4.184 -21.407 0.177 110 HG13 ILE 14 HG13 ILE 14 -5.210 -20.568 1.336 111 HG21 ILE 14 HG21 ILE 14 -1.676 -21.656 0.705 112 HG22 ILE 14 HG22 ILE 14 -1.462 -19.979 1.249 113 HG23 ILE 14 HG23 ILE 14 -1.110 -21.299 2.348 114 HD11 ILE 14 HD11 ILE 14 -3.012 -19.325 -0.353 115 HD12 ILE 14 HD12 ILE 14 -4.758 -19.063 -0.448 116 HD13 ILE 14 HD13 ILE 14 -3.860 -18.476 0.966 117 H GLU 15 H GLU 15 -1.505 -23.650 2.509 118 HA GLU 15 HA GLU 15 -2.131 -25.193 0.256 119 HB2 GLU 15 HB2 GLU 15 0.114 -24.775 0.959 120 HB3 GLU 15 HB3 GLU 15 -0.108 -25.714 2.448 121 HG2 GLU 15 HG2 GLU 15 -0.226 -27.763 1.288 122 HG3 GLU 15 HG3 GLU 15 -0.647 -26.989 -0.244 123 H THR 16 H THR 16 -2.507 -26.029 3.764 124 HA THR 16 HA THR 16 -3.384 -28.701 2.974 125 HB THR 16 HB THR 16 -3.418 -29.066 5.459 126 HG1 THR 16 HG1 THR 16 -2.149 -26.529 5.548 127 HG21 THR 16 HG21 THR 16 -0.809 -27.988 4.297 128 HG22 THR 16 HG22 THR 16 -0.985 -29.089 5.685 129 HG23 THR 16 HG23 THR 16 -1.458 -29.624 4.068 130 H GLU 17 H GLU 17 -5.080 -25.744 3.657 131 HA GLU 17 HA GLU 17 -7.547 -27.318 4.276 132 HB2 GLU 17 HB2 GLU 17 -6.899 -24.489 5.149 133 HB3 GLU 17 HB3 GLU 17 -8.269 -25.491 5.625 134 HG2 GLU 17 HG2 GLU 17 -6.571 -27.153 6.581 135 HG3 GLU 17 HG3 GLU 17 -5.346 -25.904 6.355 136 H ILE 18 H ILE 18 -6.310 -24.616 2.248 137 HA ILE 18 HA ILE 18 -9.058 -24.232 1.204 138 HB ILE 18 HB ILE 18 -6.559 -22.521 1.235 139 HG12 ILE 18 HG12 ILE 18 -9.365 -22.158 2.400 140 HG13 ILE 18 HG13 ILE 18 -7.965 -22.702 3.318 141 HG21 ILE 18 HG21 ILE 18 -7.901 -20.758 0.080 142 HG22 ILE 18 HG22 ILE 18 -7.615 -22.145 -0.950 143 HG23 ILE 18 HG23 ILE 18 -9.192 -21.960 -0.171 144 HD11 ILE 18 HD11 ILE 18 -6.842 -20.530 2.926 145 HD12 ILE 18 HD12 ILE 18 -8.307 -19.941 2.095 146 HD13 ILE 18 HD13 ILE 18 -8.373 -20.389 3.801 147 H ILE 19 H ILE 19 -5.811 -25.238 0.186 148 HA ILE 19 HA ILE 19 -6.994 -26.111 -2.411 149 HB ILE 19 HB ILE 19 -4.977 -25.540 -3.541 150 HG12 ILE 19 HG12 ILE 19 -3.894 -25.147 -0.812 151 HG13 ILE 19 HG13 ILE 19 -3.130 -25.841 -2.227 152 HG21 ILE 19 HG21 ILE 19 -5.138 -23.152 -3.579 153 HG22 ILE 19 HG22 ILE 19 -6.740 -23.785 -3.225 154 HG23 ILE 19 HG23 ILE 19 -5.756 -23.099 -1.919 155 HD11 ILE 19 HD11 ILE 19 -1.936 -23.859 -1.603 156 HD12 ILE 19 HD12 ILE 19 -2.804 -23.495 -3.108 157 HD13 ILE 19 HD13 ILE 19 -3.414 -22.895 -1.542 158 H VAL 20 H VAL 20 -7.048 -27.508 -0.083 159 HA VAL 20 HA VAL 20 -5.560 -28.949 1.220 160 HB VAL 20 HB VAL 20 -7.095 -30.854 1.226 161 HG11 VAL 20 HG11 VAL 20 -9.096 -29.636 1.823 162 HG12 VAL 20 HG12 VAL 20 -7.691 -28.707 2.340 163 HG13 VAL 20 HG13 VAL 20 -8.596 -28.216 0.891 164 HG21 VAL 20 HG21 VAL 20 -7.603 -31.202 -1.147 165 HG22 VAL 20 HG22 VAL 20 -9.087 -30.867 -0.268 166 HG23 VAL 20 HG23 VAL 20 -8.356 -29.593 -1.260 167 H ASP 21 H ASP 21 -5.781 -30.208 -2.152 168 HA ASP 21 HA ASP 21 -3.300 -31.771 -1.655 169 HB2 ASP 21 HB2 ASP 21 -5.307 -33.204 -1.230 170 HB3 ASP 21 HB3 ASP 21 -5.855 -32.885 -2.875 171 H ALA 22 H ALA 22 -4.476 -29.336 -3.331 172 HA ALA 22 HA ALA 22 -4.219 -30.138 -6.121 173 HB1 ALA 22 HB1 ALA 22 -4.479 -27.472 -4.669 174 HB2 ALA 22 HB2 ALA 22 -4.450 -27.640 -6.424 175 HB3 ALA 22 HB3 ALA 22 -5.776 -28.366 -5.491 176 H GLU 23 H GLU 23 -2.486 -29.746 -7.468 177 HA GLU 23 HA GLU 23 0.001 -28.580 -6.307 178 HB2 GLU 23 HB2 GLU 23 1.304 -30.425 -7.165 179 HB3 GLU 23 HB3 GLU 23 0.094 -31.006 -6.026 180 HG2 GLU 23 HG2 GLU 23 -1.328 -31.793 -7.887 181 HG3 GLU 23 HG3 GLU 23 -0.186 -31.141 -9.064 182 H ASP 24 H ASP 24 -2.253 -28.435 -8.808 183 HA ASP 24 HA ASP 24 -0.265 -27.066 -10.582 184 HB2 ASP 24 HB2 ASP 24 -1.159 -29.089 -11.648 185 HB3 ASP 24 HB3 ASP 24 -2.811 -28.550 -11.327 186 H LYS 25 H LYS 25 -0.890 -25.060 -11.412 187 HA LYS 25 HA LYS 25 -2.279 -23.392 -9.714 188 HB2 LYS 25 HB2 LYS 25 -2.123 -21.692 -11.443 189 HB3 LYS 25 HB3 LYS 25 -0.638 -22.647 -11.399 190 HG2 LYS 25 HG2 LYS 25 -1.553 -24.006 -13.347 191 HG3 LYS 25 HG3 LYS 25 -2.917 -22.875 -13.420 192 HD2 LYS 25 HD2 LYS 25 -1.366 -21.010 -13.873 193 HD3 LYS 25 HD3 LYS 25 0.012 -22.141 -13.794 194 HE2 LYS 25 HE2 LYS 25 -1.038 -23.506 -15.604 195 HE3 LYS 25 HE3 LYS 25 -2.366 -22.351 -15.702 196 HZ1 LYS 25 HZ1 LYS 25 -0.700 -21.927 -17.402 197 HZ2 LYS 25 HZ2 LYS 25 -0.749 -20.657 -16.384 198 HZ3 LYS 25 HZ3 LYS 25 0.478 -21.735 -16.295 199 H GLU 26 H GLU 26 -3.736 -25.239 -12.451 200 HA GLU 26 HA GLU 26 -6.179 -23.694 -12.441 201 HB2 GLU 26 HB2 GLU 26 -5.549 -26.527 -13.385 202 HB3 GLU 26 HB3 GLU 26 -7.101 -25.722 -13.616 203 HG2 GLU 26 HG2 GLU 26 -6.061 -23.957 -14.954 204 HG3 GLU 26 HG3 GLU 26 -4.457 -24.629 -14.667 205 H GLU 27 H GLU 27 -5.067 -26.641 -10.748 206 HA GLU 27 HA GLU 27 -7.580 -27.278 -9.498 207 HB2 GLU 27 HB2 GLU 27 -4.743 -27.865 -8.578 208 HB3 GLU 27 HB3 GLU 27 -6.206 -28.688 -8.029 209 HG2 GLU 27 HG2 GLU 27 -6.524 -29.630 -10.281 210 HG3 GLU 27 HG3 GLU 27 -5.080 -28.786 -10.860 211 H ARG 28 H ARG 28 -4.686 -25.374 -8.518 212 HA ARG 28 HA ARG 28 -5.729 -24.782 -5.891 213 HB2 ARG 28 HB2 ARG 28 -3.510 -23.466 -7.528 214 HB3 ARG 28 HB3 ARG 28 -3.903 -23.071 -5.839 215 HG2 ARG 28 HG2 ARG 28 -3.580 -25.458 -5.236 216 HG3 ARG 28 HG3 ARG 28 -3.018 -25.801 -6.873 217 HD2 ARG 28 HD2 ARG 28 -1.040 -24.483 -6.549 218 HD3 ARG 28 HD3 ARG 28 -1.687 -23.779 -5.053 219 HE ARG 28 HE ARG 28 -1.472 -26.715 -5.091 220 HH11 ARG 28 HH11 ARG 28 0.161 -23.730 -4.063 221 HH12 ARG 28 HH12 ARG 28 1.032 -24.524 -2.789 222 HH21 ARG 28 HH21 ARG 28 -0.394 -27.705 -3.452 223 HH22 ARG 28 HH22 ARG 28 0.726 -26.823 -2.420 224 H ALA 29 H ALA 29 -6.123 -23.180 -9.035 225 HA ALA 29 HA ALA 29 -7.328 -20.778 -7.965 226 HB1 ALA 29 HB1 ALA 29 -8.165 -20.450 -10.238 227 HB2 ALA 29 HB2 ALA 29 -6.458 -20.918 -10.293 228 HB3 ALA 29 HB3 ALA 29 -7.723 -22.108 -10.684 229 H MET 30 H MET 30 -8.553 -24.049 -8.930 230 HA MET 30 HA MET 30 -11.299 -23.376 -8.395 231 HB2 MET 30 HB2 MET 30 -9.855 -26.046 -8.559 232 HB3 MET 30 HB3 MET 30 -11.598 -25.872 -8.328 233 HG2 MET 30 HG2 MET 30 -10.052 -24.715 -10.671 234 HG3 MET 30 HG3 MET 30 -10.947 -26.231 -10.688 235 HE1 MET 30 HE1 MET 30 -11.123 -22.360 -10.220 236 HE2 MET 30 HE2 MET 30 -11.408 -22.554 -11.955 237 HE3 MET 30 HE3 MET 30 -12.710 -21.971 -10.915 238 H GLY 31 H GLY 31 -8.716 -24.730 -6.302 239 HA2 GLY 31 HA2 GLY 31 -10.280 -25.161 -3.993 240 HA3 GLY 31 HA3 GLY 31 -8.587 -24.652 -3.993 241 H TRP 32 H TRP 32 -8.558 -22.126 -4.967 242 HA TRP 32 HA TRP 32 -9.636 -20.379 -3.055 243 HB2 TRP 32 HB2 TRP 32 -8.610 -20.039 -5.869 244 HB3 TRP 32 HB3 TRP 32 -9.446 -18.710 -5.098 245 HD1 TRP 32 HD1 TRP 32 -6.143 -20.549 -5.006 246 HE1 TRP 32 HE1 TRP 32 -4.473 -19.219 -3.610 247 HE3 TRP 32 HE3 TRP 32 -9.361 -17.129 -2.962 248 HZ2 TRP 32 HZ2 TRP 32 -4.518 -16.935 -1.824 249 HZ3 TRP 32 HZ3 TRP 32 -8.514 -15.396 -1.405 250 HH2 TRP 32 HH2 TRP 32 -6.098 -15.275 -0.849 251 H TYR 33 H TYR 33 -10.981 -21.179 -6.330 252 HA TYR 33 HA TYR 33 -13.204 -19.507 -6.203 253 HB2 TYR 33 HB2 TYR 33 -12.411 -20.747 -8.215 254 HB3 TYR 33 HB3 TYR 33 -13.031 -22.242 -7.531 255 HD1 TYR 33 HD1 TYR 33 -15.560 -22.474 -7.094 256 HD2 TYR 33 HD2 TYR 33 -13.844 -19.266 -9.400 257 HE1 TYR 33 HE1 TYR 33 -17.782 -21.982 -8.035 258 HE2 TYR 33 HE2 TYR 33 -16.029 -18.873 -10.485 259 HH TYR 33 HH TYR 33 -18.219 -19.513 -10.651 260 H TYR 34 H TYR 34 -12.974 -22.945 -5.060 261 HA TYR 34 HA TYR 34 -15.745 -23.194 -4.557 262 HB2 TYR 34 HB2 TYR 34 -13.414 -24.651 -3.248 263 HB3 TYR 34 HB3 TYR 34 -15.098 -25.136 -3.140 264 HD1 TYR 34 HD1 TYR 34 -15.973 -24.781 -6.052 265 HD2 TYR 34 HD2 TYR 34 -12.450 -26.540 -4.275 266 HE1 TYR 34 HE1 TYR 34 -15.698 -26.225 -8.031 267 HE2 TYR 34 HE2 TYR 34 -12.185 -28.009 -6.242 268 HH TYR 34 HH TYR 34 -13.040 -28.630 -8.324 269 H TYR 35 H TYR 35 -13.049 -22.413 -2.217 270 HA TYR 35 HA TYR 35 -15.003 -22.161 -0.106 271 HB2 TYR 35 HB2 TYR 35 -13.324 -21.953 1.318 272 HB3 TYR 35 HB3 TYR 35 -12.348 -22.548 -0.005 273 HD1 TYR 35 HD1 TYR 35 -10.978 -20.912 -1.349 274 HD2 TYR 35 HD2 TYR 35 -13.115 -19.705 2.190 275 HE1 TYR 35 HE1 TYR 35 -9.574 -18.882 -1.207 276 HE2 TYR 35 HE2 TYR 35 -11.744 -17.658 2.337 277 HH TYR 35 HH TYR 35 -10.002 -16.434 1.411 278 H LEU 36 H LEU 36 -13.542 -19.836 -2.408 279 HA LEU 36 HA LEU 36 -14.452 -17.478 -1.132 280 HB2 LEU 36 HB2 LEU 36 -12.781 -17.448 -2.903 281 HB3 LEU 36 HB3 LEU 36 -13.939 -18.120 -4.059 282 HG LEU 36 HG LEU 36 -15.302 -16.065 -3.936 283 HD11 LEU 36 HD11 LEU 36 -14.811 -15.262 -1.663 284 HD12 LEU 36 HD12 LEU 36 -13.096 -15.036 -2.086 285 HD13 LEU 36 HD13 LEU 36 -14.347 -14.029 -2.840 286 HD21 LEU 36 HD21 LEU 36 -13.781 -14.671 -5.184 287 HD22 LEU 36 HD22 LEU 36 -12.363 -15.501 -4.497 288 HD23 LEU 36 HD23 LEU 36 -13.473 -16.355 -5.592 289 H ASP 37 H ASP 37 -15.992 -19.413 -3.800 290 HA ASP 37 HA ASP 37 -18.339 -17.835 -4.015 291 HB2 ASP 37 HB2 ASP 37 -17.667 -19.521 -5.684 292 HB3 ASP 37 HB3 ASP 37 -17.914 -20.811 -4.507 293 H ASP 38 H ASP 38 -17.632 -20.700 -1.976 294 HA ASP 38 HA ASP 38 -20.166 -20.851 -0.694 295 HB2 ASP 38 HB2 ASP 38 -18.502 -22.645 -0.628 296 HB3 ASP 38 HB3 ASP 38 -17.409 -21.631 0.316 297 H THR 39 H THR 39 -17.505 -18.588 -0.146 298 HA THR 39 HA THR 39 -18.483 -17.837 2.536 299 HB THR 39 HB THR 39 -16.116 -16.880 0.869 300 HG1 THR 39 HG1 THR 39 -15.797 -18.917 1.508 301 HG21 THR 39 HG21 THR 39 -16.972 -16.201 3.708 302 HG22 THR 39 HG22 THR 39 -15.304 -16.002 3.122 303 HG23 THR 39 HG23 THR 39 -16.621 -15.092 2.373 304 H LEU 40 H LEU 40 -18.334 -16.512 -0.794 305 HA LEU 40 HA LEU 40 -18.897 -13.828 -0.192 306 HB2 LEU 40 HB2 LEU 40 -19.585 -15.498 -2.630 307 HB3 LEU 40 HB3 LEU 40 -19.920 -13.771 -2.537 308 HG LEU 40 HG LEU 40 -17.162 -15.019 -2.414 309 HD11 LEU 40 HD11 LEU 40 -18.249 -15.207 -4.613 310 HD12 LEU 40 HD12 LEU 40 -18.542 -13.457 -4.628 311 HD13 LEU 40 HD13 LEU 40 -16.882 -14.089 -4.663 312 HD21 LEU 40 HD21 LEU 40 -16.931 -13.034 -1.206 313 HD22 LEU 40 HD22 LEU 40 -16.374 -12.666 -2.832 314 HD23 LEU 40 HD23 LEU 40 -17.990 -12.126 -2.339 315 H GLU 41 H GLU 41 -20.549 -12.937 0.794 316 HA GLU 41 HA GLU 41 -23.179 -14.084 0.999 317 HB2 GLU 41 HB2 GLU 41 -21.951 -12.781 2.750 318 HB3 GLU 41 HB3 GLU 41 -22.023 -11.350 1.720 319 HG2 GLU 41 HG2 GLU 41 -23.663 -11.189 3.414 320 HG3 GLU 41 HG3 GLU 41 -24.498 -11.412 1.884 321 H PHE 42 H PHE 42 -22.774 -14.119 -1.603 322 HA PHE 42 HA PHE 42 -23.457 -11.668 -2.970 323 HB2 PHE 42 HB2 PHE 42 -23.382 -12.919 -5.000 324 HB3 PHE 42 HB3 PHE 42 -22.029 -13.390 -4.005 325 HD1 PHE 42 HD2 PHE 42 -25.372 -14.448 -5.289 326 HD2 PHE 42 HD1 PHE 42 -21.725 -15.722 -3.357 327 HE1 PHE 42 HE2 PHE 42 -26.021 -16.818 -5.608 328 HE2 PHE 42 HE1 PHE 42 -22.381 -18.080 -3.679 329 HZ PHE 42 HZ PHE 42 -24.532 -18.642 -4.799 330 HA PRO 43 HA PRO 43 -24.599 -11.053 -4.972 331 HB2 PRO 43 HB2 PRO 43 -26.551 -9.232 -5.485 332 HB3 PRO 43 HB3 PRO 43 -26.532 -10.860 -6.228 333 HG2 PRO 43 HG2 PRO 43 -28.100 -9.949 -3.798 334 HG3 PRO 43 HG3 PRO 43 -28.689 -10.876 -5.215 335 HD2 PRO 43 HD2 PRO 43 -27.945 -12.085 -2.869 336 HD3 PRO 43 HD3 PRO 43 -27.672 -12.860 -4.456 337 H PHE 44 H PHE 44 -23.677 -8.973 -4.704 338 HA PHE 44 HA PHE 44 -24.271 -7.378 -2.302 339 HB2 PHE 44 HB2 PHE 44 -22.064 -7.397 -1.453 340 HB3 PHE 44 HB3 PHE 44 -22.640 -9.043 -1.510 341 HD1 PHE 44 HD1 PHE 44 -21.756 -10.599 -3.391 342 HD2 PHE 44 HD2 PHE 44 -19.975 -6.807 -2.409 343 HE1 PHE 44 HE1 PHE 44 -19.638 -11.330 -4.436 344 HE2 PHE 44 HE2 PHE 44 -17.882 -7.508 -3.528 345 HZ PHE 44 HZ PHE 44 -17.696 -9.780 -4.522 346 H MET 45 H MET 45 -22.129 -5.551 -2.569 347 HA MET 45 HA MET 45 -22.208 -4.804 -5.436 348 HB2 MET 45 HB2 MET 45 -22.891 -2.631 -5.095 349 HB3 MET 45 HB3 MET 45 -24.032 -3.593 -4.178 350 HG2 MET 45 HG2 MET 45 -23.287 -2.803 -2.134 351 HG3 MET 45 HG3 MET 45 -21.650 -2.502 -2.690 352 HE1 MET 45 HE1 MET 45 -21.731 0.908 -4.456 353 HE2 MET 45 HE2 MET 45 -20.774 -0.511 -4.006 354 HE3 MET 45 HE3 MET 45 -21.945 -0.623 -5.327 355 H GLY 46 H GLY 46 -20.717 -3.098 -6.012 356 HA2 GLY 46 HA2 GLY 46 -18.416 -2.615 -4.255 357 HA3 GLY 46 HA3 GLY 46 -18.107 -3.764 -5.572 358 H LYS 47 H LYS 47 -16.585 -1.802 -5.699 359 HA LYS 47 HA LYS 47 -17.650 -0.106 -7.921 360 HB2 LYS 47 HB2 LYS 47 -16.851 1.054 -5.713 361 HB3 LYS 47 HB3 LYS 47 -15.235 0.553 -6.186 362 HG2 LYS 47 HG2 LYS 47 -15.390 2.723 -7.040 363 HG3 LYS 47 HG3 LYS 47 -15.761 1.734 -8.453 364 HD2 LYS 47 HD2 LYS 47 -17.409 3.434 -8.488 365 HD3 LYS 47 HD3 LYS 47 -18.245 2.036 -7.830 366 HE2 LYS 47 HE2 LYS 47 -18.117 2.893 -5.580 367 HE3 LYS 47 HE3 LYS 47 -17.005 4.179 -6.066 368 HZ1 LYS 47 HZ1 LYS 47 -19.349 4.907 -5.810 369 HZ2 LYS 47 HZ2 LYS 47 -18.749 5.228 -7.289 370 HZ3 LYS 47 HZ3 LYS 47 -19.783 3.985 -7.098 371 H TRP 48 H TRP 48 -16.876 -0.762 -9.834 372 HA TRP 48 HA TRP 48 -14.472 -2.478 -9.993 373 HB2 TRP 48 HB2 TRP 48 -16.470 -2.802 -11.499 374 HB3 TRP 48 HB3 TRP 48 -16.107 -1.255 -12.242 375 HD1 TRP 48 HD1 TRP 48 -12.768 -2.350 -11.969 376 HE1 TRP 48 HE1 TRP 48 -11.918 -3.771 -13.842 377 HE3 TRP 48 HE3 TRP 48 -17.265 -3.605 -14.113 378 HZ2 TRP 48 HZ2 TRP 48 -12.999 -5.375 -15.985 379 HZ3 TRP 48 HZ3 TRP 48 -17.286 -5.125 -16.080 380 HH2 TRP 48 HH2 TRP 48 -15.171 -6.025 -17.004 381 H LYS 49 H LYS 49 -12.640 -1.453 -9.610 382 HA LYS 49 HA LYS 49 -12.248 1.406 -10.022 383 HB2 LYS 49 HB2 LYS 49 -10.226 -0.728 -9.216 384 HB3 LYS 49 HB3 LYS 49 -10.113 1.008 -8.932 385 HG2 LYS 49 HG2 LYS 49 -12.142 -0.898 -7.664 386 HG3 LYS 49 HG3 LYS 49 -10.662 -0.371 -6.909 387 HD2 LYS 49 HD2 LYS 49 -12.854 1.594 -7.719 388 HD3 LYS 49 HD3 LYS 49 -12.811 0.736 -6.177 389 HE2 LYS 49 HE2 LYS 49 -10.367 1.626 -5.977 390 HE3 LYS 49 HE3 LYS 49 -10.854 2.805 -7.208 391 HZ1 LYS 49 HZ1 LYS 49 -12.253 2.375 -4.619 392 HZ2 LYS 49 HZ2 LYS 49 -11.155 3.563 -4.891 393 HZ3 LYS 49 HZ3 LYS 49 -12.563 3.591 -5.716 394 H LYS 50 H LYS 50 -12.868 0.998 -12.356 395 HA LYS 50 HA LYS 50 -11.467 -0.672 -14.173 396 HB2 LYS 50 HB2 LYS 50 -13.740 0.412 -14.452 397 HB3 LYS 50 HB3 LYS 50 -12.954 1.972 -14.566 398 HG2 LYS 50 HG2 LYS 50 -13.492 1.409 -16.767 399 HG3 LYS 50 HG3 LYS 50 -11.761 1.164 -16.653 400 HD2 LYS 50 HD2 LYS 50 -12.784 -0.594 -17.955 401 HD3 LYS 50 HD3 LYS 50 -12.142 -1.307 -16.466 402 HE2 LYS 50 HE2 LYS 50 -14.344 -1.490 -15.502 403 HE3 LYS 50 HE3 LYS 50 -15.049 -0.431 -16.734 404 HZ1 LYS 50 HZ1 LYS 50 -14.680 -2.147 -18.377 405 HZ2 LYS 50 HZ2 LYS 50 -13.953 -3.127 -17.282 406 HZ3 LYS 50 HZ3 LYS 50 -15.535 -2.773 -17.134 407 H LYS 51 H LYS 51 -9.496 -0.326 -15.327 408 HA LYS 51 HA LYS 51 -8.145 2.318 -14.889 409 HB2 LYS 51 HB2 LYS 51 -7.251 0.219 -13.751 410 HB3 LYS 51 HB3 LYS 51 -6.796 -0.362 -15.356 411 HG2 LYS 51 HG2 LYS 51 -5.294 1.562 -15.657 412 HG3 LYS 51 HG3 LYS 51 -5.888 2.290 -14.148 413 HD2 LYS 51 HD2 LYS 51 -4.930 0.438 -12.846 414 HD3 LYS 51 HD3 LYS 51 -4.482 -0.407 -14.328 415 HE2 LYS 51 HE2 LYS 51 -2.517 0.636 -13.364 416 HE3 LYS 51 HE3 LYS 51 -2.890 1.362 -14.927 417 HZ1 LYS 51 HZ1 LYS 51 -3.810 3.273 -13.785 418 HZ2 LYS 51 HZ2 LYS 51 -3.576 2.574 -12.306 419 HZ3 LYS 51 HZ3 LYS 51 -2.303 2.999 -13.226 420 H SER 52 H SER 52 -9.579 0.384 -17.280 421 HA SER 52 HA SER 52 -7.830 0.484 -19.401 422 HB2 SER 52 HB2 SER 52 -10.854 0.371 -19.605 423 HB3 SER 52 HB3 SER 52 -9.648 -0.491 -20.578 424 HG SER 52 HG SER 52 -10.515 -1.905 -19.072 425 H ARG 53 H ARG 53 -8.396 3.350 -18.331 426 HA ARG 53 HA ARG 53 -10.089 4.611 -20.295 427 HB2 ARG 53 HB2 ARG 53 -9.499 5.207 -17.752 428 HB3 ARG 53 HB3 ARG 53 -8.234 6.183 -18.506 429 HG2 ARG 53 HG2 ARG 53 -10.145 7.215 -19.957 430 HG3 ARG 53 HG3 ARG 53 -11.256 6.306 -18.931 431 HD2 ARG 53 HD2 ARG 53 -11.183 8.457 -17.996 432 HD3 ARG 53 HD3 ARG 53 -10.157 7.467 -16.937 433 HE ARG 53 HE ARG 53 -8.428 8.553 -18.825 434 HH11 ARG 53 HH11 ARG 53 -10.533 9.722 -16.196 435 HH12 ARG 53 HH12 ARG 53 -9.726 11.254 -16.062 436 HH21 ARG 53 HH22 ARG 53 -7.285 10.465 -18.538 437 HH22 ARG 53 HH21 ARG 53 -7.786 11.675 -17.407 438 H LYS 54 H LYS 54 -7.311 3.370 -21.113 439 HA LYS 54 HA LYS 54 -5.604 3.668 -22.499 440 HB2 LYS 54 HB2 LYS 54 -7.042 6.121 -23.568 441 HB3 LYS 54 HB3 LYS 54 -5.664 5.303 -24.298 442 HG2 LYS 54 HG2 LYS 54 -7.005 3.224 -24.551 443 HG3 LYS 54 HG3 LYS 54 -8.390 4.022 -23.798 444 HD2 LYS 54 HD2 LYS 54 -8.717 4.019 -26.172 445 HD3 LYS 54 HD3 LYS 54 -8.446 5.685 -25.642 446 HE2 LYS 54 HE2 LYS 54 -6.081 5.541 -26.405 447 HE3 LYS 54 HE3 LYS 54 -6.333 3.857 -26.884 448 HZ1 LYS 54 HZ1 LYS 54 -7.722 6.191 -28.071 449 HZ2 LYS 54 HZ2 LYS 54 -6.511 5.354 -28.766 450 HZ3 LYS 54 HZ3 LYS 54 -7.950 4.635 -28.517 451 H THR 55 H THR 55 -6.372 6.713 -20.722 452 HA THR 55 HA THR 55 -3.570 7.476 -20.603 453 HB THR 55 HB THR 55 -4.499 9.117 -18.916 454 HG1 THR 55 HG1 THR 55 -6.277 8.433 -18.064 455 HG21 THR 55 HG21 THR 55 -4.416 9.646 -21.356 456 HG22 THR 55 HG22 THR 55 -6.066 9.007 -21.534 457 HG23 THR 55 HG23 THR 55 -5.764 10.433 -20.522 458 H SER 56 H SER 56 -5.132 4.855 -19.296 459 HA SER 56 HA SER 56 -4.884 3.446 -17.612 460 HB2 SER 56 HB2 SER 56 -2.196 4.734 -17.059 461 HB3 SER 56 HB3 SER 56 -2.729 3.109 -16.609 462 HG SER 56 HG SER 56 -1.445 3.134 -18.521 463 H THR 57 H THR 57 -5.815 6.425 -17.074 464 HA THR 57 HA THR 57 -5.516 6.804 -14.255 465 HB THR 57 HB THR 57 -7.835 7.720 -15.973 466 HG1 THR 57 HG1 THR 57 -5.237 8.856 -15.927 467 HG21 THR 57 HG21 THR 57 -7.620 9.809 -14.647 468 HG22 THR 57 HG22 THR 57 -7.953 8.405 -13.627 469 HG23 THR 57 HG23 THR 57 -6.307 9.068 -13.706 470 H ILE 58 H ILE 58 -6.802 6.054 -12.571 471 HA ILE 58 HA ILE 58 -8.611 3.851 -13.042 472 HB ILE 58 HB ILE 58 -7.889 5.528 -10.633 473 HG12 ILE 58 HG12 ILE 58 -6.193 3.901 -11.549 474 HG13 ILE 58 HG13 ILE 58 -6.648 3.649 -9.871 475 HG21 ILE 58 HG21 ILE 58 -9.090 3.821 -9.226 476 HG22 ILE 58 HG22 ILE 58 -10.156 4.869 -10.163 477 HG23 ILE 58 HG23 ILE 58 -9.862 3.208 -10.709 478 HD11 ILE 58 HD11 ILE 58 -6.396 1.539 -11.146 479 HD12 ILE 58 HD12 ILE 58 -8.020 1.716 -10.475 480 HD13 ILE 58 HD13 ILE 58 -7.735 2.016 -12.205 481 H GLU 59 H GLU 59 -10.781 3.852 -12.990 482 HA GLU 59 HA GLU 59 -12.352 6.313 -12.609 483 HB2 GLU 59 HB2 GLU 59 -12.619 4.323 -14.914 484 HB3 GLU 59 HB3 GLU 59 -13.900 5.434 -14.447 485 HG2 GLU 59 HG2 GLU 59 -11.121 6.212 -15.410 486 HG3 GLU 59 HG3 GLU 59 -12.591 6.255 -16.371 487 H GLU 60 H GLU 60 -14.618 5.611 -11.995 488 HA GLU 60 HA GLU 60 -14.470 3.077 -10.397 489 HB2 GLU 60 HB2 GLU 60 -15.227 5.905 -9.536 490 HB3 GLU 60 HB3 GLU 60 -15.429 4.461 -8.555 491 HG2 GLU 60 HG2 GLU 60 -12.930 4.047 -8.780 492 HG3 GLU 60 HG3 GLU 60 -12.794 5.641 -9.530 493 H LYS 61 H LYS 61 -15.975 1.837 -11.414 494 HA LYS 61 HA LYS 61 -18.613 3.045 -12.158 495 HB2 LYS 61 HB2 LYS 61 -17.392 1.884 -13.954 496 HB3 LYS 61 HB3 LYS 61 -17.272 0.428 -12.951 497 HG2 LYS 61 HG2 LYS 61 -19.684 0.137 -12.959 498 HG3 LYS 61 HG3 LYS 61 -19.910 1.635 -13.856 499 HD2 LYS 61 HD2 LYS 61 -18.206 -0.660 -14.933 500 HD3 LYS 61 HD3 LYS 61 -19.946 -0.675 -15.122 501 HE2 LYS 61 HE2 LYS 61 -18.093 1.513 -16.167 502 HE3 LYS 61 HE3 LYS 61 -18.777 0.198 -17.124 503 HZ1 LYS 61 HZ1 LYS 61 -20.360 2.303 -15.774 504 HZ2 LYS 61 HZ2 LYS 61 -20.089 2.193 -17.386 505 HZ3 LYS 61 HZ3 LYS 61 -21.013 1.075 -16.613 506 H THR 62 H THR 62 -20.152 2.802 -10.549 507 HA THR 62 HA THR 62 -19.897 0.865 -8.452 508 HB THR 62 HB THR 62 -22.449 2.272 -9.317 509 HG1 THR 62 HG1 THR 62 -21.694 4.113 -8.554 510 HG21 THR 62 HG21 THR 62 -22.531 0.691 -7.366 511 HG22 THR 62 HG22 THR 62 -21.258 1.644 -6.576 512 HG23 THR 62 HG23 THR 62 -22.854 2.367 -6.891 513 H VAL 63 H VAL 63 -20.577 -1.203 -8.349 514 HA VAL 63 HA VAL 63 -22.361 -2.247 -10.504 515 HB VAL 63 HB VAL 63 -20.851 -4.233 -10.655 516 HG11 VAL 63 HG11 VAL 63 -20.832 -2.410 -12.373 517 HG12 VAL 63 HG12 VAL 63 -19.450 -1.674 -11.533 518 HG13 VAL 63 HG13 VAL 63 -19.301 -3.288 -12.245 519 HG21 VAL 63 HG21 VAL 63 -18.499 -4.086 -10.014 520 HG22 VAL 63 HG22 VAL 63 -18.753 -2.493 -9.283 521 HG23 VAL 63 HG23 VAL 63 -19.516 -3.935 -8.576 522 H GLU 64 H GLU 64 -23.578 -4.050 -9.995 523 HA GLU 64 HA GLU 64 -23.713 -4.789 -7.101 524 HB2 GLU 64 HB2 GLU 64 -25.830 -4.029 -8.202 525 HB3 GLU 64 HB3 GLU 64 -25.700 -5.371 -9.342 526 HG2 GLU 64 HG2 GLU 64 -25.821 -6.978 -7.455 527 HG3 GLU 64 HG3 GLU 64 -25.831 -5.640 -6.306 528 H VAL 65 H VAL 65 -22.601 -6.641 -6.662 529 HA VAL 65 HA VAL 65 -21.461 -8.192 -8.899 530 HB VAL 65 HB VAL 65 -20.827 -8.402 -5.926 531 HG11 VAL 65 HG11 VAL 65 -19.345 -9.186 -8.478 532 HG12 VAL 65 HG12 VAL 65 -18.706 -9.387 -6.837 533 HG13 VAL 65 HG13 VAL 65 -20.127 -10.311 -7.343 534 HG21 VAL 65 HG21 VAL 65 -20.290 -6.088 -6.564 535 HG22 VAL 65 HG22 VAL 65 -18.809 -7.022 -6.384 536 HG23 VAL 65 HG23 VAL 65 -19.428 -6.658 -8.008 537 H LEU 66 H LEU 66 -22.706 -9.801 -9.574 538 HA LEU 66 HA LEU 66 -25.065 -10.535 -8.041 539 HB2 LEU 66 HB2 LEU 66 -24.042 -11.655 -10.677 540 HB3 LEU 66 HB3 LEU 66 -25.664 -11.831 -10.018 541 HG LEU 66 HG LEU 66 -24.368 -9.256 -11.019 542 HD11 LEU 66 HD11 LEU 66 -26.101 -9.367 -12.750 543 HD12 LEU 66 HD12 LEU 66 -25.104 -10.832 -12.762 544 HD13 LEU 66 HD13 LEU 66 -26.732 -10.875 -12.054 545 HD21 LEU 66 HD21 LEU 66 -25.815 -8.664 -9.139 546 HD22 LEU 66 HD22 LEU 66 -26.588 -8.194 -10.649 547 HD23 LEU 66 HD23 LEU 66 -27.137 -9.656 -9.798 548 H GLY 67 H GLY 67 -21.922 -12.053 -8.741 549 HA2 GLY 67 HA2 GLY 67 -21.782 -13.902 -6.750 550 HA3 GLY 67 HA3 GLY 67 -22.713 -14.722 -8.025 551 H MET 68 H MET 68 -20.463 -15.921 -7.686 552 HA MET 68 HA MET 68 -18.176 -14.903 -9.145 553 HB2 MET 68 HB2 MET 68 -19.045 -17.733 -8.403 554 HB3 MET 68 HB3 MET 68 -17.548 -17.364 -9.249 555 HG2 MET 68 HG2 MET 68 -18.300 -16.377 -6.486 556 HG3 MET 68 HG3 MET 68 -17.182 -17.686 -6.846 557 HE1 MET 68 HE1 MET 68 -15.403 -16.664 -9.246 558 HE2 MET 68 HE2 MET 68 -14.077 -15.905 -8.356 559 HE3 MET 68 HE3 MET 68 -14.764 -17.433 -7.770 560 H ALA 69 H ALA 69 -17.456 -15.440 -11.181 561 HA ALA 69 HA ALA 69 -19.429 -15.825 -13.293 562 HB1 ALA 69 HB1 ALA 69 -17.425 -15.674 -14.730 563 HB2 ALA 69 HB2 ALA 69 -17.359 -14.414 -13.495 564 HB3 ALA 69 HB3 ALA 69 -16.382 -15.892 -13.318 565 HA PRO 70 HA PRO 70 -19.148 -20.304 -13.788 566 HB2 PRO 70 HB2 PRO 70 -17.761 -19.768 -16.429 567 HB3 PRO 70 HB3 PRO 70 -19.043 -20.965 -16.056 568 HG2 PRO 70 HG2 PRO 70 -19.699 -18.633 -17.255 569 HG3 PRO 70 HG3 PRO 70 -20.704 -19.239 -15.897 570 HD2 PRO 70 HD2 PRO 70 -18.552 -17.124 -15.850 571 HD3 PRO 70 HD3 PRO 70 -20.156 -17.109 -15.057 572 H ASP 71 H ASP 71 -17.703 -21.833 -13.128 573 HA ASP 71 HA ASP 71 -15.192 -21.111 -12.126 574 HB2 ASP 71 HB2 ASP 71 -14.889 -23.371 -11.562 575 HB3 ASP 71 HB3 ASP 71 -16.611 -23.066 -11.397 576 H ASP 72 H ASP 72 -16.061 -22.349 -15.318 577 HA ASP 72 HA ASP 72 -13.522 -23.211 -16.219 578 HB2 ASP 72 HB2 ASP 72 -15.610 -23.704 -17.394 579 HB3 ASP 72 HB3 ASP 72 -15.864 -21.988 -17.729 580 H GLU 73 H GLU 73 -14.863 -19.922 -15.913 581 HA GLU 73 HA GLU 73 -12.664 -18.740 -17.493 582 HB2 GLU 73 HB2 GLU 73 -14.937 -17.476 -15.893 583 HB3 GLU 73 HB3 GLU 73 -13.709 -16.589 -16.804 584 HG2 GLU 73 HG2 GLU 73 -14.418 -17.880 -18.874 585 HG3 GLU 73 HG3 GLU 73 -15.769 -18.525 -17.941 586 H CYS 74 H CYS 74 -13.227 -19.798 -14.251 587 HA CYS 74 HA CYS 74 -11.433 -17.765 -13.098 588 HB2 CYS 74 HB2 CYS 74 -13.284 -19.757 -11.751 589 HB3 CYS 74 HB3 CYS 74 -12.339 -18.483 -10.954 590 HG CYS 74 HG CYS 74 -14.788 -18.242 -13.171 591 H LEU 75 H LEU 75 -10.519 -20.209 -14.677 592 HA LEU 75 HA LEU 75 -9.248 -21.979 -12.749 593 HB2 LEU 75 HB2 LEU 75 -9.038 -21.672 -15.772 594 HB3 LEU 75 HB3 LEU 75 -8.139 -22.890 -14.878 595 HG LEU 75 HG LEU 75 -11.171 -22.722 -14.822 596 HD11 LEU 75 HD11 LEU 75 -10.389 -23.176 -17.111 597 HD12 LEU 75 HD12 LEU 75 -9.374 -24.506 -16.517 598 HD13 LEU 75 HD13 LEU 75 -11.147 -24.608 -16.402 599 HD21 LEU 75 HD21 LEU 75 -9.329 -25.047 -14.101 600 HD22 LEU 75 HD22 LEU 75 -10.050 -23.967 -12.905 601 HD23 LEU 75 HD23 LEU 75 -11.097 -24.963 -13.909 602 H LYS 76 H LYS 76 -8.481 -18.856 -13.515 603 HA LYS 76 HA LYS 76 -5.682 -19.248 -12.670 604 HB2 LYS 76 HB2 LYS 76 -4.798 -17.825 -14.438 605 HB3 LYS 76 HB3 LYS 76 -5.519 -19.295 -15.093 606 HG2 LYS 76 HG2 LYS 76 -7.567 -18.010 -15.719 607 HG3 LYS 76 HG3 LYS 76 -6.830 -16.530 -15.097 608 HD2 LYS 76 HD2 LYS 76 -5.716 -18.220 -17.376 609 HD3 LYS 76 HD3 LYS 76 -6.700 -16.760 -17.566 610 HE2 LYS 76 HE2 LYS 76 -4.978 -15.444 -16.327 611 HE3 LYS 76 HE3 LYS 76 -3.972 -16.893 -16.203 612 HZ1 LYS 76 HZ1 LYS 76 -3.299 -15.510 -18.059 613 HZ2 LYS 76 HZ2 LYS 76 -3.849 -16.932 -18.630 614 HZ3 LYS 76 HZ3 LYS 76 -4.774 -15.589 -18.741 615 H ASP 77 H ASP 77 -8.536 -17.176 -12.905 616 HA ASP 77 HA ASP 77 -7.392 -15.273 -10.959 617 HB2 ASP 77 HB2 ASP 77 -6.668 -14.384 -13.141 618 HB3 ASP 77 HB3 ASP 77 -8.295 -14.570 -13.790 619 H MET 78 H MET 78 -9.150 -14.533 -9.631 620 HA MET 78 HA MET 78 -11.670 -15.902 -10.026 621 HB2 MET 78 HB2 MET 78 -10.798 -13.727 -8.080 622 HB3 MET 78 HB3 MET 78 -12.365 -14.524 -8.026 623 HG2 MET 78 HG2 MET 78 -9.662 -15.882 -7.682 624 HG3 MET 78 HG3 MET 78 -10.807 -15.488 -6.414 625 HE1 MET 78 HE1 MET 78 -10.642 -19.276 -8.893 626 HE2 MET 78 HE2 MET 78 -10.161 -17.731 -9.617 627 HE3 MET 78 HE3 MET 78 -9.339 -18.324 -8.154 628 H TYR 79 H TYR 79 -13.452 -15.242 -11.116 629 HA TYR 79 HA TYR 79 -13.715 -12.376 -11.916 630 HB2 TYR 79 HB2 TYR 79 -14.322 -14.929 -13.447 631 HB3 TYR 79 HB3 TYR 79 -15.036 -13.389 -13.861 632 HD1 TYR 79 HD1 TYR 79 -13.716 -11.557 -14.826 633 HD2 TYR 79 HD2 TYR 79 -12.000 -15.428 -14.017 634 HE1 TYR 79 HE1 TYR 79 -11.864 -11.052 -16.382 635 HE2 TYR 79 HE2 TYR 79 -10.132 -14.933 -15.548 636 HH TYR 79 HH TYR 79 -9.187 -13.372 -17.015 637 H VAL 80 H VAL 80 -15.848 -11.564 -11.935 638 HA VAL 80 HA VAL 80 -17.958 -13.220 -10.628 639 HB VAL 80 HB VAL 80 -18.534 -11.092 -9.385 640 HG11 VAL 80 HG11 VAL 80 -16.964 -11.524 -7.540 641 HG12 VAL 80 HG12 VAL 80 -17.610 -13.008 -8.226 642 HG13 VAL 80 HG13 VAL 80 -15.954 -12.511 -8.623 643 HG21 VAL 80 HG21 VAL 80 -16.784 -9.466 -8.888 644 HG22 VAL 80 HG22 VAL 80 -15.632 -10.305 -9.940 645 HG23 VAL 80 HG23 VAL 80 -17.056 -9.503 -10.634 646 H GLU 81 H GLU 81 -20.069 -12.674 -11.181 647 HA GLU 81 HA GLU 81 -20.409 -11.215 -13.748 648 HB2 GLU 81 HB2 GLU 81 -22.364 -12.686 -11.923 649 HB3 GLU 81 HB3 GLU 81 -22.814 -11.826 -13.407 650 HG2 GLU 81 HG2 GLU 81 -21.214 -13.312 -14.675 651 HG3 GLU 81 HG3 GLU 81 -20.974 -14.240 -13.194 652 H VAL 82 H VAL 82 -21.373 -9.187 -13.862 653 HA VAL 82 HA VAL 82 -22.080 -7.836 -11.328 654 HB VAL 82 HB VAL 82 -20.698 -5.878 -12.139 655 HG11 VAL 82 HG11 VAL 82 -19.139 -8.356 -11.316 656 HG12 VAL 82 HG12 VAL 82 -18.618 -6.668 -11.152 657 HG13 VAL 82 HG13 VAL 82 -20.009 -7.246 -10.234 658 HG21 VAL 82 HG21 VAL 82 -19.180 -7.917 -13.808 659 HG22 VAL 82 HG22 VAL 82 -20.259 -6.672 -14.474 660 HG23 VAL 82 HG23 VAL 82 -18.819 -6.189 -13.590 661 H ALA 83 H ALA 83 -23.586 -6.268 -11.535 662 HA ALA 83 HA ALA 83 -24.636 -5.708 -14.287 663 HB1 ALA 83 HB1 ALA 83 -26.094 -5.612 -11.624 664 HB2 ALA 83 HB2 ALA 83 -26.767 -5.166 -13.212 665 HB3 ALA 83 HB3 ALA 83 -26.288 -6.845 -12.897 666 H ASP 84 H ASP 84 -24.687 -3.601 -14.938 667 HA ASP 84 HA ASP 84 -22.827 -1.860 -13.528 668 HB2 ASP 84 HB2 ASP 84 -22.661 -2.271 -15.935 669 HB3 ASP 84 HB3 ASP 84 -24.269 -1.570 -16.179 670 H ILE 85 H ILE 85 -24.567 -1.791 -11.725 671 HA ILE 85 HA ILE 85 -26.817 -0.086 -11.992 672 HB ILE 85 HB ILE 85 -26.771 0.119 -9.566 673 HG12 ILE 85 HG12 ILE 85 -24.166 -1.417 -9.589 674 HG13 ILE 85 HG13 ILE 85 -24.288 0.310 -9.268 675 HG21 ILE 85 HG21 ILE 85 -27.659 -1.909 -10.771 676 HG22 ILE 85 HG22 ILE 85 -26.129 -2.739 -10.420 677 HG23 ILE 85 HG23 ILE 85 -27.195 -2.211 -9.100 678 HD11 ILE 85 HD11 ILE 85 -25.563 -1.869 -7.560 679 HD12 ILE 85 HD12 ILE 85 -24.103 -0.962 -7.178 680 HD13 ILE 85 HD13 ILE 85 -25.663 -0.118 -7.274 681 H GLY 86 H GLY 86 -23.461 0.789 -12.009 682 HA2 GLY 86 HA2 GLY 86 -23.900 3.599 -11.309 683 HA3 GLY 86 HA3 GLY 86 -22.399 2.813 -11.821 684 H GLY 87 H GLY 87 -24.529 1.761 -14.120 685 HA2 GLY 87 HA2 GLY 87 -24.461 4.172 -15.854 686 HA3 GLY 87 HA3 GLY 87 -23.513 2.751 -16.310 687 H LYS 88 H LYS 88 -24.569 0.914 -17.128 688 HA LYS 88 HA LYS 88 -26.949 1.489 -18.552 689 HB2 LYS 88 HB2 LYS 88 -25.813 -1.273 -17.928 690 HB3 LYS 88 HB3 LYS 88 -26.960 -0.889 -19.201 691 HG2 LYS 88 HG2 LYS 88 -24.064 0.032 -19.050 692 HG3 LYS 88 HG3 LYS 88 -24.751 -1.185 -20.122 693 HD2 LYS 88 HD2 LYS 88 -26.174 0.575 -21.190 694 HD3 LYS 88 HD3 LYS 88 -25.381 1.798 -20.169 695 HE2 LYS 88 HE2 LYS 88 -23.177 1.160 -21.116 696 HE3 LYS 88 HE3 LYS 88 -23.964 -0.042 -22.146 697 HZ1 LYS 88 HZ1 LYS 88 -23.552 2.007 -23.342 698 HZ2 LYS 88 HZ2 LYS 88 -25.159 1.768 -23.236 699 HZ3 LYS 88 HZ3 LYS 88 -24.429 2.882 -22.285 700 H ASP 89 H ASP 89 -26.572 -0.067 -15.446 701 HA ASP 89 HA ASP 89 -27.847 -0.829 -13.849 702 HB2 ASP 89 HB2 ASP 89 -28.677 1.457 -13.872 703 HB3 ASP 89 HB3 ASP 89 -29.936 1.016 -15.029 704 H ASP 90 H ASP 90 -29.294 -1.300 -16.979 705 HA ASP 90 HA ASP 90 -31.018 -3.504 -15.988 706 HB2 ASP 90 HB2 ASP 90 -31.987 -1.479 -17.107 707 HB3 ASP 90 HB3 ASP 90 -31.047 -1.883 -18.548 708 H ASP 91 H ASP 91 -27.985 -3.415 -16.954 709 HA ASP 91 HA ASP 91 -28.176 -5.903 -18.538 710 HB2 ASP 91 HB2 ASP 91 -27.795 -3.872 -20.070 711 HB3 ASP 91 HB3 ASP 91 -26.196 -3.761 -19.313 712 H VAL 92 H VAL 92 -26.111 -7.027 -18.639 713 HA VAL 92 HA VAL 92 -24.563 -6.811 -16.120 714 HB VAL 92 HB VAL 92 -26.473 -8.230 -15.752 715 HG11 VAL 92 HG11 VAL 92 -27.101 -8.869 -18.031 716 HG12 VAL 92 HG12 VAL 92 -25.647 -9.885 -18.170 717 HG13 VAL 92 HG13 VAL 92 -26.929 -10.294 -17.013 718 HG21 VAL 92 HG21 VAL 92 -24.454 -9.014 -14.662 719 HG22 VAL 92 HG22 VAL 92 -25.467 -10.375 -15.140 720 HG23 VAL 92 HG23 VAL 92 -24.018 -9.994 -16.082 721 H TYR 93 H TYR 93 -22.556 -7.705 -16.125 722 HA TYR 93 HA TYR 93 -21.285 -8.670 -18.626 723 HB2 TYR 93 HB2 TYR 93 -20.311 -6.377 -16.855 724 HB3 TYR 93 HB3 TYR 93 -19.447 -7.045 -18.226 725 HD1 TYR 93 HD2 TYR 93 -20.141 -6.597 -20.541 726 HD2 TYR 93 HD1 TYR 93 -22.221 -4.855 -17.182 727 HE1 TYR 93 HE2 TYR 93 -21.209 -4.956 -22.058 728 HE2 TYR 93 HE1 TYR 93 -23.315 -3.234 -18.686 729 HH TYR 93 HH TYR 93 -23.520 -2.475 -20.896 730 H THR 94 H THR 94 -18.727 -8.881 -17.699 731 HA THR 94 HA THR 94 -18.807 -10.233 -15.060 732 HB THR 94 HB THR 94 -17.261 -11.153 -17.519 733 HG1 THR 94 HG1 THR 94 -19.458 -11.628 -17.666 734 HG21 THR 94 HG21 THR 94 -16.751 -13.171 -16.162 735 HG22 THR 94 HG22 THR 94 -16.049 -11.713 -15.456 736 HG23 THR 94 HG23 THR 94 -17.522 -12.411 -14.752 737 H ALA 95 H ALA 95 -16.947 -9.849 -13.835 738 HA ALA 95 HA ALA 95 -14.949 -7.911 -14.886 739 HB1 ALA 95 HB1 ALA 95 -15.071 -6.641 -12.769 740 HB2 ALA 95 HB2 ALA 95 -16.628 -6.610 -13.608 741 HB3 ALA 95 HB3 ALA 95 -16.404 -7.686 -12.215 742 H LYS 96 H LYS 96 -12.980 -7.920 -13.719 743 HA LYS 96 HA LYS 96 -12.172 -10.530 -12.634 744 HB2 LYS 96 HB2 LYS 96 -10.741 -7.843 -12.680 745 HB3 LYS 96 HB3 LYS 96 -10.000 -9.392 -12.337 746 HG2 LYS 96 HG2 LYS 96 -9.997 -10.073 -14.566 747 HG3 LYS 96 HG3 LYS 96 -11.328 -9.028 -15.043 748 HD2 LYS 96 HD2 LYS 96 -8.580 -7.990 -14.275 749 HD3 LYS 96 HD3 LYS 96 -9.097 -8.322 -15.938 750 HE2 LYS 96 HE2 LYS 96 -10.903 -6.660 -15.789 751 HE3 LYS 96 HE3 LYS 96 -10.575 -6.404 -14.082 752 HZ1 LYS 96 HZ1 LYS 96 -8.962 -5.500 -16.353 753 HZ2 LYS 96 HZ2 LYS 96 -9.506 -4.663 -15.032 754 HZ3 LYS 96 HZ3 LYS 96 -8.258 -5.695 -14.889 755 H LEU 97 H LEU 97 -12.466 -10.984 -10.425 756 HA LEU 97 HA LEU 97 -13.599 -9.032 -8.616 757 HB2 LEU 97 HB2 LEU 97 -13.811 -11.497 -8.313 758 HB3 LEU 97 HB3 LEU 97 -12.066 -11.609 -8.059 759 HG LEU 97 HG LEU 97 -12.242 -10.241 -6.007 760 HD11 LEU 97 HD11 LEU 97 -14.550 -9.786 -5.062 761 HD12 LEU 97 HD12 LEU 97 -14.156 -8.802 -6.465 762 HD13 LEU 97 HD13 LEU 97 -15.233 -10.206 -6.640 763 HD21 LEU 97 HD21 LEU 97 -14.221 -12.549 -6.066 764 HD22 LEU 97 HD22 LEU 97 -12.451 -12.706 -5.944 765 HD23 LEU 97 HD23 LEU 97 -13.351 -11.931 -4.644 766 H SER 98 H SER 98 -10.361 -10.152 -9.443 767 HA SER 98 HA SER 98 -8.658 -8.828 -7.792 768 HB2 SER 98 HB2 SER 98 -8.300 -9.190 -10.784 769 HB3 SER 98 HB3 SER 98 -7.080 -9.342 -9.510 770 HG SER 98 HG SER 98 -7.988 -11.387 -10.371 771 H ASP 99 H ASP 99 -10.857 -7.230 -9.964 772 HA ASP 99 HA ASP 99 -9.263 -4.731 -9.816 773 HB2 ASP 99 HB2 ASP 99 -9.408 -5.991 -12.058 774 HB3 ASP 99 HB3 ASP 99 -11.114 -5.537 -12.079 775 H ILE 100 H ILE 100 -11.579 -6.008 -8.239 776 HA ILE 100 HA ILE 100 -13.395 -3.645 -8.263 777 HB ILE 100 HB ILE 100 -13.908 -6.565 -8.294 778 HG12 ILE 100 HG12 ILE 100 -15.623 -4.145 -8.976 779 HG13 ILE 100 HG13 ILE 100 -14.468 -4.906 -10.090 780 HG21 ILE 100 HG21 ILE 100 -14.668 -6.152 -5.972 781 HG22 ILE 100 HG22 ILE 100 -15.772 -4.890 -6.577 782 HG23 ILE 100 HG23 ILE 100 -15.977 -6.588 -7.049 783 HD11 ILE 100 HD11 ILE 100 -15.810 -7.035 -9.891 784 HD12 ILE 100 HD12 ILE 100 -17.037 -6.097 -8.994 785 HD13 ILE 100 HD13 ILE 100 -16.640 -5.662 -10.661 786 H GLU 101 H GLU 101 -14.208 -2.979 -6.353 787 HA GLU 101 HA GLU 101 -12.763 -3.721 -3.847 788 HB2 GLU 101 HB2 GLU 101 -12.071 -1.518 -4.655 789 HB3 GLU 101 HB3 GLU 101 -13.760 -1.015 -4.846 790 HG2 GLU 101 HG2 GLU 101 -14.127 -1.065 -2.454 791 HG3 GLU 101 HG3 GLU 101 -12.576 -1.861 -2.179 792 H ALA 102 H ALA 102 -14.181 -4.669 -2.452 793 HA ALA 102 HA ALA 102 -17.025 -4.775 -3.129 794 HB1 ALA 102 HB1 ALA 102 -15.745 -6.729 -2.273 795 HB2 ALA 102 HB2 ALA 102 -15.532 -5.902 -0.714 796 HB3 ALA 102 HB3 ALA 102 -17.161 -6.343 -1.273 797 H ILE 103 H ILE 103 -18.660 -3.748 -2.101 798 HA ILE 103 HA ILE 103 -18.054 -1.905 0.176 799 HB ILE 103 HB ILE 103 -19.528 -1.433 -2.426 800 HG12 ILE 103 HG12 ILE 103 -17.235 0.114 -1.131 801 HG13 ILE 103 HG13 ILE 103 -17.021 -1.118 -2.374 802 HG21 ILE 103 HG21 ILE 103 -20.924 -0.447 -0.647 803 HG22 ILE 103 HG22 ILE 103 -19.512 0.424 -0.003 804 HG23 ILE 103 HG23 ILE 103 -20.185 0.811 -1.601 805 HD11 ILE 103 HD11 ILE 103 -16.915 0.990 -3.432 806 HD12 ILE 103 HD12 ILE 103 -18.425 0.187 -3.935 807 HD13 ILE 103 HD13 ILE 103 -18.455 1.517 -2.745 808 H ASP 104 H ASP 104 -19.583 -1.776 1.740 809 HA ASP 104 HA ASP 104 -21.325 -2.291 3.033 810 HB2 ASP 104 HB2 ASP 104 -22.316 -0.715 1.421 811 HB3 ASP 104 HB3 ASP 104 -22.894 -2.070 0.448 812 H VAL 105 H VAL 105 -19.875 -4.573 2.269 813 HA VAL 105 HA VAL 105 -22.007 -6.657 2.298 814 HB VAL 105 HB VAL 105 -20.402 -6.487 0.322 815 HG11 VAL 105 HG11 VAL 105 -18.416 -7.762 2.216 816 HG12 VAL 105 HG12 VAL 105 -18.246 -7.575 0.464 817 HG13 VAL 105 HG13 VAL 105 -18.277 -6.143 1.501 818 HG21 VAL 105 HG21 VAL 105 -20.409 -8.812 -0.035 819 HG22 VAL 105 HG22 VAL 105 -20.587 -9.164 1.696 820 HG23 VAL 105 HG23 VAL 105 -21.898 -8.377 0.808 821 H ASP 106 H ASP 106 -21.249 -8.737 3.439 822 HA ASP 106 HA ASP 106 -20.831 -8.145 6.207 823 HB2 ASP 106 HB2 ASP 106 -22.101 -10.104 5.408 824 HB3 ASP 106 HB3 ASP 106 -20.619 -10.765 4.690 825 H ASP 107 H ASP 107 -19.111 -8.786 7.519 826 HA ASP 107 HA ASP 107 -16.561 -7.906 6.698 827 HB2 ASP 107 HB2 ASP 107 -17.302 -7.901 9.028 828 HB3 ASP 107 HB3 ASP 107 -17.374 -9.665 9.041 829 H ASP 108 H ASP 108 -17.832 -11.305 6.870 830 HA ASP 108 HA ASP 108 -15.171 -12.359 6.403 831 HB2 ASP 108 HB2 ASP 108 -17.142 -13.524 7.583 832 HB3 ASP 108 HB3 ASP 108 -17.773 -13.851 5.960 833 H THR 109 H THR 109 -17.764 -11.207 4.378 834 HA THR 109 HA THR 109 -16.878 -12.515 1.893 835 HB THR 109 HB THR 109 -18.814 -10.200 2.436 836 HG1 THR 109 HG1 THR 109 -19.302 -12.383 3.247 837 HG21 THR 109 HG21 THR 109 -18.216 -10.035 0.129 838 HG22 THR 109 HG22 THR 109 -18.215 -11.791 -0.050 839 HG23 THR 109 HG23 THR 109 -19.748 -10.949 0.188 840 H GLN 110 H GLN 110 -16.715 -9.227 3.412 841 HA GLN 110 HA GLN 110 -15.130 -8.060 1.404 842 HB2 GLN 110 HB2 GLN 110 -16.400 -7.078 3.520 843 HB3 GLN 110 HB3 GLN 110 -14.850 -7.284 4.327 844 HG2 GLN 110 HG2 GLN 110 -15.421 -5.647 1.812 845 HG3 GLN 110 HG3 GLN 110 -15.182 -5.002 3.427 846 HE21 GLN 110 HE22 GLN 110 -13.598 -5.758 0.497 847 HE22 GLN 110 HE21 GLN 110 -11.953 -5.699 1.075 848 H GLU 111 H GLU 111 -14.133 -9.762 4.442 849 HA GLU 111 HA GLU 111 -11.353 -9.430 4.057 850 HB2 GLU 111 HB2 GLU 111 -13.011 -11.464 5.588 851 HB3 GLU 111 HB3 GLU 111 -11.252 -11.502 5.603 852 HG2 GLU 111 HG2 GLU 111 -12.842 -9.026 6.420 853 HG3 GLU 111 HG3 GLU 111 -12.350 -10.289 7.543 854 H ALA 112 H ALA 112 -13.544 -12.041 2.827 855 HA ALA 112 HA ALA 112 -11.433 -13.712 1.869 856 HB1 ALA 112 HB1 ALA 112 -13.764 -14.480 2.075 857 HB2 ALA 112 HB2 ALA 112 -14.263 -13.372 0.774 858 HB3 ALA 112 HB3 ALA 112 -13.155 -14.717 0.429 859 H ILE 113 H ILE 113 -13.235 -11.017 0.338 860 HA ILE 113 HA ILE 113 -11.943 -11.218 -2.219 861 HB ILE 113 HB ILE 113 -13.425 -8.950 -0.823 862 HG12 ILE 113 HG12 ILE 113 -14.411 -10.846 -3.006 863 HG13 ILE 113 HG13 ILE 113 -14.671 -11.156 -1.308 864 HG21 ILE 113 HG21 ILE 113 -12.570 -9.195 -3.741 865 HG22 ILE 113 HG22 ILE 113 -13.705 -7.976 -3.125 866 HG23 ILE 113 HG23 ILE 113 -12.035 -7.971 -2.578 867 HD11 ILE 113 HD11 ILE 113 -15.836 -8.922 -1.121 868 HD12 ILE 113 HD12 ILE 113 -15.785 -8.851 -2.906 869 HD13 ILE 113 HD13 ILE 113 -16.652 -10.159 -2.089 870 H ALA 114 H ALA 114 -11.333 -9.168 0.694 871 HA ALA 114 HA ALA 114 -9.139 -7.720 -0.343 872 HB1 ALA 114 HB1 ALA 114 -9.658 -8.605 2.530 873 HB2 ALA 114 HB2 ALA 114 -8.579 -7.298 2.008 874 HB3 ALA 114 HB3 ALA 114 -10.328 -7.149 1.760 875 H ASP 115 H ASP 115 -9.266 -10.909 1.316 876 HA ASP 115 HA ASP 115 -6.428 -11.213 1.458 877 HB2 ASP 115 HB2 ASP 115 -8.020 -12.432 2.896 878 HB3 ASP 115 HB3 ASP 115 -8.580 -13.354 1.491 879 H TRP 116 H TRP 116 -8.809 -12.176 -1.061 880 HA TRP 116 HA TRP 116 -6.952 -13.600 -2.729 881 HB2 TRP 116 HB2 TRP 116 -9.275 -13.821 -3.208 882 HB3 TRP 116 HB3 TRP 116 -9.525 -12.085 -3.254 883 HD1 TRP 116 HD1 TRP 116 -9.466 -10.944 -5.514 884 HE1 TRP 116 HE1 TRP 116 -8.732 -11.537 -7.905 885 HE3 TRP 116 HE3 TRP 116 -7.417 -15.556 -4.645 886 HZ2 TRP 116 HZ2 TRP 116 -7.371 -13.678 -9.233 887 HZ3 TRP 116 HZ3 TRP 116 -6.400 -16.850 -6.488 888 HH2 TRP 116 HH2 TRP 116 -6.364 -15.925 -8.795 889 H LEU 117 H LEU 117 -7.876 -10.120 -2.557 890 HA LEU 117 HA LEU 117 -6.192 -9.273 -4.693 891 HB2 LEU 117 HB2 LEU 117 -7.260 -7.814 -2.242 892 HB3 LEU 117 HB3 LEU 117 -6.362 -7.006 -3.513 893 HG LEU 117 HG LEU 117 -8.880 -8.602 -4.141 894 HD11 LEU 117 HD11 LEU 117 -8.699 -5.657 -3.379 895 HD12 LEU 117 HD12 LEU 117 -10.133 -6.477 -4.041 896 HD13 LEU 117 HD13 LEU 117 -9.506 -6.946 -2.457 897 HD21 LEU 117 HD21 LEU 117 -7.424 -7.993 -6.053 898 HD22 LEU 117 HD22 LEU 117 -8.971 -7.127 -6.101 899 HD23 LEU 117 HD23 LEU 117 -7.500 -6.288 -5.570 900 H TYR 118 H TYR 118 -5.584 -9.458 -1.135 901 HA TYR 118 HA TYR 118 -2.931 -8.457 -1.208 902 HB2 TYR 118 HB2 TYR 118 -4.193 -10.473 0.691 903 HB3 TYR 118 HB3 TYR 118 -2.696 -9.619 0.984 904 HD1 TYR 118 HD2 TYR 118 -3.906 -6.824 -0.150 905 HD2 TYR 118 HD1 TYR 118 -5.087 -9.738 2.817 906 HE1 TYR 118 HE2 TYR 118 -5.139 -5.079 1.063 907 HE2 TYR 118 HE1 TYR 118 -6.331 -7.985 4.039 908 HH TYR 118 HH TYR 118 -6.473 -4.573 2.907 909 H TRP 119 H TRP 119 -4.128 -11.866 -1.453 910 HA TRP 119 HA TRP 119 -1.591 -13.099 -1.572 911 HB2 TRP 119 HB2 TRP 119 -3.441 -14.525 -1.283 912 HB3 TRP 119 HB3 TRP 119 -4.343 -13.799 -2.610 913 HD1 TRP 119 HD1 TRP 119 -4.280 -14.933 -4.854 914 HE1 TRP 119 HE1 TRP 119 -2.880 -16.728 -6.025 915 HE3 TRP 119 HE3 TRP 119 -0.777 -15.714 -1.195 916 HZ2 TRP 119 HZ2 TRP 119 -0.532 -18.319 -5.434 917 HZ3 TRP 119 HZ3 TRP 119 1.050 -17.355 -1.545 918 HH2 TRP 119 HH2 TRP 119 1.184 -18.656 -3.661 919 H LEU 120 H LEU 120 -3.637 -11.774 -4.243 920 HA LEU 120 HA LEU 120 -1.911 -12.567 -6.363 921 HB2 LEU 120 HB2 LEU 120 -3.836 -10.214 -6.023 922 HB3 LEU 120 HB3 LEU 120 -2.904 -10.439 -7.491 923 HG LEU 120 HG LEU 120 -4.973 -12.411 -6.436 924 HD11 LEU 120 HD11 LEU 120 -4.944 -10.333 -8.678 925 HD12 LEU 120 HD12 LEU 120 -6.209 -11.554 -8.453 926 HD13 LEU 120 HD13 LEU 120 -5.952 -10.313 -7.213 927 HD21 LEU 120 HD21 LEU 120 -3.265 -13.596 -7.705 928 HD22 LEU 120 HD22 LEU 120 -4.700 -13.427 -8.713 929 HD23 LEU 120 HD23 LEU 120 -3.308 -12.363 -8.994 930 H ALA 121 H ALA 121 -2.115 -9.574 -4.408 931 HA ALA 121 HA ALA 121 -0.202 -8.131 -5.860 932 HB1 ALA 121 HB1 ALA 121 -0.266 -6.607 -3.898 933 HB2 ALA 121 HB2 ALA 121 -1.898 -7.148 -4.350 934 HB3 ALA 121 HB3 ALA 121 -1.085 -7.870 -2.946 935 H ARG 122 H ARG 122 0.171 -10.426 -3.145 936 HA ARG 122 HA ARG 122 2.875 -9.788 -2.534 937 HB2 ARG 122 HB2 ARG 122 1.075 -11.272 -1.305 938 HB3 ARG 122 HB3 ARG 122 1.950 -12.580 -2.125 939 HG2 ARG 122 HG2 ARG 122 4.116 -11.651 -1.202 940 HG3 ARG 122 HG3 ARG 122 3.200 -10.338 -0.437 941 HD2 ARG 122 HD2 ARG 122 1.812 -12.212 0.615 942 HD3 ARG 122 HD3 ARG 122 3.151 -13.286 0.186 943 HE ARG 122 HE ARG 122 2.996 -11.338 2.341 944 HH11 ARG 122 HH11 ARG 122 5.406 -12.943 0.264 945 HH12 ARG 122 HH12 ARG 122 6.725 -12.554 1.302 946 HH21 ARG 122 HH21 ARG 122 4.676 -10.778 3.625 947 HH22 ARG 122 HH22 ARG 122 6.302 -11.304 3.308 948 H GLY 123 H GLY 123 1.604 -11.340 -5.371 949 HA2 GLY 123 HA2 GLY 123 3.415 -11.749 -7.079 950 HA3 GLY 123 HA3 GLY 123 4.180 -12.794 -5.875 951 H TYR 124 H TYR 124 1.219 -12.322 -7.782 952 HA TYR 124 HA TYR 124 -0.179 -14.666 -7.400 953 HB2 TYR 124 HB2 TYR 124 -1.074 -13.045 -8.867 954 HB3 TYR 124 HB3 TYR 124 0.375 -12.988 -9.853 955 HD1 TYR 124 HD1 TYR 124 -2.472 -15.307 -8.957 956 HD2 TYR 124 HD2 TYR 124 0.602 -14.279 -11.810 957 HE1 TYR 124 HE1 TYR 124 -3.371 -16.981 -10.524 958 HE2 TYR 124 HE2 TYR 124 -0.267 -15.987 -13.367 959 HH TYR 124 HH TYR 124 -1.848 -17.657 -13.715 960 H LYS 125 H LYS 125 0.220 -16.770 -7.617 961 HA LYS 125 HA LYS 125 1.982 -17.745 -9.818 962 HB2 LYS 125 HB2 LYS 125 1.702 -18.914 -7.010 963 HB3 LYS 125 HB3 LYS 125 2.569 -19.668 -8.354 964 HG2 LYS 125 HG2 LYS 125 4.114 -17.716 -8.451 965 HG3 LYS 125 HG3 LYS 125 3.270 -17.005 -7.060 966 HD2 LYS 125 HD2 LYS 125 3.863 -18.972 -5.678 967 HD3 LYS 125 HD3 LYS 125 4.723 -19.684 -7.064 968 HE2 LYS 125 HE2 LYS 125 6.226 -17.700 -7.137 969 HE3 LYS 125 HE3 LYS 125 5.375 -17.002 -5.753 970 HZ1 LYS 125 HZ1 LYS 125 7.398 -18.128 -5.075 971 HZ2 LYS 125 HZ2 LYS 125 6.118 -18.897 -4.427 972 HZ3 LYS 125 HZ3 LYS 125 6.903 -19.543 -5.709 973 H PHE 126 H PHE 126 -1.027 -18.017 -7.979 974 HA PHE 126 HA PHE 126 -2.344 -19.537 -9.977 975 HB2 PHE 126 HB2 PHE 126 -3.076 -21.325 -8.387 976 HB3 PHE 126 HB3 PHE 126 -1.404 -21.458 -8.894 977 HD1 PHE 126 HD2 PHE 126 -3.592 -20.477 -6.024 978 HD2 PHE 126 HD1 PHE 126 0.403 -21.441 -7.326 979 HE1 PHE 126 HE2 PHE 126 -2.864 -20.702 -3.654 980 HE2 PHE 126 HE1 PHE 126 1.138 -21.603 -4.964 981 HZ PHE 126 HZ PHE 126 -0.505 -21.248 -3.120 Start of MODEL 7 1 H1 MET 1 H1 MET 1 3.557 -5.138 -5.019 2 H2 MET 1 H2 MET 1 3.300 -6.646 -4.410 3 H3 MET 1 H3 MET 1 2.743 -5.343 -3.604 4 HA MET 1 HA MET 1 5.581 -5.938 -4.057 5 HB2 MET 1 HB2 MET 1 5.027 -3.499 -3.858 6 HB3 MET 1 HB3 MET 1 4.307 -3.806 -2.272 7 HG2 MET 1 HG2 MET 1 6.511 -4.590 -1.436 8 HG3 MET 1 HG3 MET 1 7.211 -4.321 -3.039 9 HE1 MET 1 HE1 MET 1 9.169 -2.886 -2.047 10 HE2 MET 1 HE2 MET 1 8.930 -1.557 -0.892 11 HE3 MET 1 HE3 MET 1 8.524 -3.223 -0.425 12 H ALA 2 H ALA 2 6.556 -7.268 -2.531 13 HA ALA 2 HA ALA 2 5.013 -9.140 -1.259 14 HB1 ALA 2 HB1 ALA 2 7.862 -8.316 -0.547 15 HB2 ALA 2 HB2 ALA 2 7.091 -9.858 -0.124 16 HB3 ALA 2 HB3 ALA 2 7.381 -9.458 -1.827 17 H SER 3 H SER 3 6.248 -6.146 0.209 18 HA SER 3 HA SER 3 5.837 -6.574 2.887 19 HB2 SER 3 HB2 SER 3 5.441 -3.990 1.372 20 HB3 SER 3 HB3 SER 3 5.932 -4.187 3.068 21 HG SER 3 HG SER 3 7.726 -3.843 1.727 22 H VAL 4 H VAL 4 3.262 -6.508 0.599 23 HA VAL 4 HA VAL 4 1.162 -5.551 2.252 24 HB VAL 4 HB VAL 4 1.095 -5.908 -0.183 25 HG11 VAL 4 HG11 VAL 4 0.842 -8.010 -1.225 26 HG12 VAL 4 HG12 VAL 4 2.258 -8.186 -0.185 27 HG13 VAL 4 HG13 VAL 4 0.707 -8.880 0.302 28 HG21 VAL 4 HG21 VAL 4 -0.993 -5.676 1.115 29 HG22 VAL 4 HG22 VAL 4 -1.194 -6.650 -0.347 30 HG23 VAL 4 HG23 VAL 4 -1.104 -7.445 1.239 31 H GLU 5 H GLU 5 3.019 -8.568 2.390 32 HA GLU 5 HA GLU 5 1.467 -9.332 4.820 33 HB2 GLU 5 HB2 GLU 5 2.235 -11.294 2.649 34 HB3 GLU 5 HB3 GLU 5 1.475 -11.690 4.170 35 HG2 GLU 5 HG2 GLU 5 -0.609 -10.688 3.518 36 HG3 GLU 5 HG3 GLU 5 0.093 -9.960 2.080 37 H ARG 6 H ARG 6 4.207 -10.240 2.685 38 HA ARG 6 HA ARG 6 6.219 -11.150 3.086 39 HB2 ARG 6 HB2 ARG 6 6.134 -8.572 3.234 40 HB3 ARG 6 HB3 ARG 6 6.617 -8.766 4.911 41 HG2 ARG 6 HG2 ARG 6 8.708 -9.827 4.203 42 HG3 ARG 6 HG3 ARG 6 8.116 -9.978 2.534 43 HD2 ARG 6 HD2 ARG 6 7.969 -7.503 2.365 44 HD3 ARG 6 HD3 ARG 6 8.668 -7.354 3.988 45 HE ARG 6 HE ARG 6 10.550 -8.837 2.809 46 HH11 ARG 6 HH11 ARG 6 8.929 -5.885 1.580 47 HH12 ARG 6 HH12 ARG 6 10.269 -5.433 0.594 48 HH21 ARG 6 HH21 ARG 6 12.302 -8.192 1.488 49 HH22 ARG 6 HH22 ARG 6 12.217 -6.755 0.546 50 H ASP 7 H ASP 7 4.520 -12.628 4.745 51 HA ASP 7 HA ASP 7 6.523 -13.557 6.666 52 HB2 ASP 7 HB2 ASP 7 5.082 -12.006 8.004 53 HB3 ASP 7 HB3 ASP 7 3.668 -12.968 7.563 54 H GLU 8 H GLU 8 6.617 -15.726 6.474 55 HA GLU 8 HA GLU 8 5.152 -16.957 4.403 56 HB2 GLU 8 HB2 GLU 8 6.487 -18.918 4.867 57 HB3 GLU 8 HB3 GLU 8 7.488 -17.470 4.939 58 HG2 GLU 8 HG2 GLU 8 7.360 -17.518 7.436 59 HG3 GLU 8 HG3 GLU 8 6.374 -18.978 7.353 60 H THR 9 H THR 9 4.137 -16.582 7.678 61 HA THR 9 HA THR 9 2.767 -19.005 8.131 62 HB THR 9 HB THR 9 1.906 -16.210 8.916 63 HG1 THR 9 HG1 THR 9 3.908 -16.360 9.572 64 HG21 THR 9 HG21 THR 9 1.424 -18.929 10.210 65 HG22 THR 9 HG22 THR 9 1.033 -17.360 10.956 66 HG23 THR 9 HG23 THR 9 0.204 -17.859 9.478 67 H ARG 10 H ARG 10 1.919 -16.232 6.050 68 HA ARG 10 HA ARG 10 -0.787 -16.952 5.539 69 HB2 ARG 10 HB2 ARG 10 1.311 -15.414 3.951 70 HB3 ARG 10 HB3 ARG 10 -0.314 -15.656 3.325 71 HG2 ARG 10 HG2 ARG 10 0.214 -14.418 6.067 72 HG3 ARG 10 HG3 ARG 10 0.161 -13.462 4.590 73 HD2 ARG 10 HD2 ARG 10 -2.131 -15.249 5.481 74 HD3 ARG 10 HD3 ARG 10 -2.004 -13.527 5.882 75 HE ARG 10 HE ARG 10 -1.701 -13.397 3.217 76 HH11 ARG 10 HH11 ARG 10 -4.233 -15.116 5.052 77 HH12 ARG 10 HH12 ARG 10 -5.420 -14.857 3.803 78 HH21 ARG 10 HH21 ARG 10 -3.123 -13.170 1.676 79 HH22 ARG 10 HH22 ARG 10 -4.730 -13.938 1.735 80 H GLU 11 H GLU 11 2.138 -17.693 3.570 81 HA GLU 11 HA GLU 11 0.936 -19.447 1.767 82 HB2 GLU 11 HB2 GLU 11 3.752 -19.670 2.947 83 HB3 GLU 11 HB3 GLU 11 3.150 -20.510 1.527 84 HG2 GLU 11 HG2 GLU 11 4.254 -18.805 0.533 85 HG3 GLU 11 HG3 GLU 11 2.628 -18.123 0.598 86 H HIS 12 H HIS 12 2.429 -20.208 4.951 87 HA HIS 12 HA HIS 12 2.038 -23.009 4.838 88 HB2 HIS 12 HB2 HIS 12 3.567 -22.202 6.408 89 HB3 HIS 12 HB3 HIS 12 2.480 -20.947 6.984 90 HD1 HIS 12 HD1 HIS 12 2.212 -24.858 7.116 91 HD2 HIS 12 HD2 HIS 12 1.666 -21.310 9.308 92 HE1 HIS 12 HE1 HIS 12 1.342 -25.566 9.398 93 H ARG 13 H ARG 13 -0.158 -20.469 6.274 94 HA ARG 13 HA ARG 13 -2.038 -22.518 7.102 95 HB2 ARG 13 HB2 ARG 13 -2.459 -19.516 6.805 96 HB3 ARG 13 HB3 ARG 13 -3.623 -20.654 7.475 97 HG2 ARG 13 HG2 ARG 13 -1.018 -19.732 8.663 98 HG3 ARG 13 HG3 ARG 13 -2.626 -19.684 9.362 99 HD2 ARG 13 HD2 ARG 13 -0.869 -22.128 8.943 100 HD3 ARG 13 HD3 ARG 13 -1.191 -21.325 10.481 101 HE ARG 13 HE ARG 13 -3.692 -22.085 9.537 102 HH11 ARG 13 HH11 ARG 13 -0.636 -23.763 10.273 103 HH12 ARG 13 HH12 ARG 13 -1.409 -25.211 10.816 104 HH21 ARG 13 HH21 ARG 13 -4.712 -24.074 10.149 105 HH22 ARG 13 HH22 ARG 13 -3.752 -25.395 10.731 106 H ILE 14 H ILE 14 -2.007 -20.321 4.203 107 HA ILE 14 HA ILE 14 -4.498 -21.298 3.371 108 HB ILE 14 HB ILE 14 -3.384 -19.260 2.484 109 HG12 ILE 14 HG12 ILE 14 -4.506 -21.218 0.430 110 HG13 ILE 14 HG13 ILE 14 -5.443 -20.287 1.601 111 HG21 ILE 14 HG21 ILE 14 -1.942 -21.112 0.538 112 HG22 ILE 14 HG22 ILE 14 -1.916 -19.336 0.559 113 HG23 ILE 14 HG23 ILE 14 -1.180 -20.233 1.875 114 HD11 ILE 14 HD11 ILE 14 -5.601 -19.179 -0.487 115 HD12 ILE 14 HD12 ILE 14 -4.591 -18.170 0.565 116 HD13 ILE 14 HD13 ILE 14 -3.843 -19.159 -0.715 117 H GLU 15 H GLU 15 -1.230 -22.610 2.758 118 HA GLU 15 HA GLU 15 -1.929 -24.775 1.080 119 HB2 GLU 15 HB2 GLU 15 0.329 -24.024 1.369 120 HB3 GLU 15 HB3 GLU 15 0.290 -24.349 3.108 121 HG2 GLU 15 HG2 GLU 15 0.155 -26.728 2.746 122 HG3 GLU 15 HG3 GLU 15 -0.001 -26.507 0.995 123 H THR 16 H THR 16 -2.245 -24.424 4.631 124 HA THR 16 HA THR 16 -2.933 -27.320 4.804 125 HB THR 16 HB THR 16 -2.577 -26.958 7.263 126 HG1 THR 16 HG1 THR 16 -1.292 -24.570 6.448 127 HG21 THR 16 HG21 THR 16 -0.842 -27.958 5.828 128 HG22 THR 16 HG22 THR 16 -0.195 -26.346 5.459 129 HG23 THR 16 HG23 THR 16 -0.134 -26.977 7.120 130 H GLU 17 H GLU 17 -4.659 -24.562 4.268 131 HA GLU 17 HA GLU 17 -6.995 -25.548 5.873 132 HB2 GLU 17 HB2 GLU 17 -6.138 -22.712 5.201 133 HB3 GLU 17 HB3 GLU 17 -7.644 -23.118 5.987 134 HG2 GLU 17 HG2 GLU 17 -4.937 -23.834 7.196 135 HG3 GLU 17 HG3 GLU 17 -5.731 -22.290 7.442 136 H ILE 18 H ILE 18 -6.032 -23.927 2.789 137 HA ILE 18 HA ILE 18 -8.851 -24.284 1.862 138 HB ILE 18 HB ILE 18 -6.793 -22.131 1.308 139 HG12 ILE 18 HG12 ILE 18 -9.467 -22.108 2.789 140 HG13 ILE 18 HG13 ILE 18 -7.874 -21.987 3.530 141 HG21 ILE 18 HG21 ILE 18 -8.133 -22.538 -0.747 142 HG22 ILE 18 HG22 ILE 18 -9.620 -22.326 0.195 143 HG23 ILE 18 HG23 ILE 18 -8.478 -20.978 -0.041 144 HD11 ILE 18 HD11 ILE 18 -9.201 -19.883 1.807 145 HD12 ILE 18 HD12 ILE 18 -8.843 -19.820 3.532 146 HD13 ILE 18 HD13 ILE 18 -7.513 -19.805 2.362 147 H ILE 19 H ILE 19 -5.424 -24.600 0.789 148 HA ILE 19 HA ILE 19 -6.466 -25.854 -1.717 149 HB ILE 19 HB ILE 19 -4.495 -25.031 -2.829 150 HG12 ILE 19 HG12 ILE 19 -3.683 -24.027 -0.091 151 HG13 ILE 19 HG13 ILE 19 -2.809 -25.147 -1.125 152 HG21 ILE 19 HG21 ILE 19 -5.067 -22.691 -2.889 153 HG22 ILE 19 HG22 ILE 19 -6.550 -23.596 -2.604 154 HG23 ILE 19 HG23 ILE 19 -5.755 -22.741 -1.261 155 HD11 ILE 19 HD11 ILE 19 -3.179 -22.163 -1.521 156 HD12 ILE 19 HD12 ILE 19 -1.698 -23.037 -1.114 157 HD13 ILE 19 HD13 ILE 19 -2.425 -23.249 -2.727 158 H VAL 20 H VAL 20 -5.969 -27.184 0.915 159 HA VAL 20 HA VAL 20 -3.555 -28.510 1.034 160 HB VAL 20 HB VAL 20 -6.071 -29.925 1.933 161 HG11 VAL 20 HG11 VAL 20 -3.387 -29.386 3.281 162 HG12 VAL 20 HG12 VAL 20 -4.698 -30.404 3.920 163 HG13 VAL 20 HG13 VAL 20 -3.845 -30.887 2.449 164 HG21 VAL 20 HG21 VAL 20 -6.699 -27.689 2.544 165 HG22 VAL 20 HG22 VAL 20 -6.100 -28.476 3.999 166 HG23 VAL 20 HG23 VAL 20 -5.057 -27.329 3.131 167 H ASP 21 H ASP 21 -6.456 -29.464 -0.806 168 HA ASP 21 HA ASP 21 -5.380 -32.062 -1.564 169 HB2 ASP 21 HB2 ASP 21 -7.790 -31.622 -1.200 170 HB3 ASP 21 HB3 ASP 21 -7.790 -30.491 -2.554 171 H ALA 22 H ALA 22 -4.822 -28.870 -2.732 172 HA ALA 22 HA ALA 22 -4.865 -29.501 -5.575 173 HB1 ALA 22 HB1 ALA 22 -4.040 -27.198 -5.852 174 HB2 ALA 22 HB2 ALA 22 -5.425 -27.224 -4.739 175 HB3 ALA 22 HB3 ALA 22 -3.763 -27.058 -4.116 176 H GLU 23 H GLU 23 -3.111 -29.692 -6.940 177 HA GLU 23 HA GLU 23 -0.354 -29.649 -5.815 178 HB2 GLU 23 HB2 GLU 23 -1.532 -31.747 -7.692 179 HB3 GLU 23 HB3 GLU 23 0.181 -31.590 -7.289 180 HG2 GLU 23 HG2 GLU 23 -0.368 -31.976 -4.880 181 HG3 GLU 23 HG3 GLU 23 -2.051 -32.266 -5.332 182 H ASP 24 H ASP 24 -2.563 -28.451 -8.126 183 HA ASP 24 HA ASP 24 -0.424 -27.469 -9.941 184 HB2 ASP 24 HB2 ASP 24 -1.395 -29.531 -10.890 185 HB3 ASP 24 HB3 ASP 24 -3.027 -28.905 -10.642 186 H LYS 25 H LYS 25 -1.021 -25.485 -11.004 187 HA LYS 25 HA LYS 25 -2.408 -23.654 -9.497 188 HB2 LYS 25 HB2 LYS 25 -2.183 -22.093 -11.209 189 HB3 LYS 25 HB3 LYS 25 -0.750 -23.097 -11.276 190 HG2 LYS 25 HG2 LYS 25 -3.151 -23.366 -13.145 191 HG3 LYS 25 HG3 LYS 25 -1.770 -22.341 -13.481 192 HD2 LYS 25 HD2 LYS 25 -0.286 -24.145 -13.806 193 HD3 LYS 25 HD3 LYS 25 -1.329 -25.275 -12.953 194 HE2 LYS 25 HE2 LYS 25 -3.011 -24.435 -14.958 195 HE3 LYS 25 HE3 LYS 25 -1.458 -24.382 -15.792 196 HZ1 LYS 25 HZ1 LYS 25 -2.839 -26.553 -15.727 197 HZ2 LYS 25 HZ2 LYS 25 -1.204 -26.689 -15.447 198 HZ3 LYS 25 HZ3 LYS 25 -2.286 -26.737 -14.209 199 H GLU 26 H GLU 26 -3.908 -25.851 -11.878 200 HA GLU 26 HA GLU 26 -6.360 -24.293 -12.075 201 HB2 GLU 26 HB2 GLU 26 -5.669 -27.197 -12.706 202 HB3 GLU 26 HB3 GLU 26 -7.245 -26.465 -13.022 203 HG2 GLU 26 HG2 GLU 26 -6.289 -24.866 -14.581 204 HG3 GLU 26 HG3 GLU 26 -4.657 -25.329 -14.141 205 H GLU 27 H GLU 27 -5.170 -27.017 -10.071 206 HA GLU 27 HA GLU 27 -7.687 -27.438 -8.708 207 HB2 GLU 27 HB2 GLU 27 -4.857 -28.221 -7.905 208 HB3 GLU 27 HB3 GLU 27 -6.348 -28.831 -7.187 209 HG2 GLU 27 HG2 GLU 27 -5.432 -29.221 -10.066 210 HG3 GLU 27 HG3 GLU 27 -5.374 -30.429 -8.787 211 H ARG 28 H ARG 28 -4.757 -25.479 -8.108 212 HA ARG 28 HA ARG 28 -5.514 -24.443 -5.553 213 HB2 ARG 28 HB2 ARG 28 -3.285 -24.189 -6.444 214 HB3 ARG 28 HB3 ARG 28 -3.855 -23.287 -7.834 215 HG2 ARG 28 HG2 ARG 28 -4.271 -22.236 -5.022 216 HG3 ARG 28 HG3 ARG 28 -2.729 -22.073 -5.824 217 HD2 ARG 28 HD2 ARG 28 -5.356 -20.898 -6.815 218 HD3 ARG 28 HD3 ARG 28 -4.041 -20.020 -6.050 219 HE ARG 28 HE ARG 28 -2.673 -20.952 -8.097 220 HH11 ARG 28 HH11 ARG 28 -5.946 -19.507 -8.184 221 HH12 ARG 28 HH12 ARG 28 -5.784 -19.061 -9.862 222 HH21 ARG 28 HH21 ARG 28 -2.448 -20.144 -10.122 223 HH22 ARG 28 HH22 ARG 28 -3.787 -19.413 -10.983 224 H ALA 29 H ALA 29 -6.505 -23.510 -8.868 225 HA ALA 29 HA ALA 29 -7.896 -21.128 -7.997 226 HB1 ALA 29 HB1 ALA 29 -8.462 -22.775 -10.488 227 HB2 ALA 29 HB2 ALA 29 -8.831 -21.071 -10.203 228 HB3 ALA 29 HB3 ALA 29 -7.142 -21.589 -10.369 229 H MET 30 H MET 30 -8.837 -24.600 -8.442 230 HA MET 30 HA MET 30 -11.587 -24.227 -7.799 231 HB2 MET 30 HB2 MET 30 -9.870 -26.667 -7.202 232 HB3 MET 30 HB3 MET 30 -11.623 -26.598 -7.224 233 HG2 MET 30 HG2 MET 30 -9.801 -26.223 -9.627 234 HG3 MET 30 HG3 MET 30 -10.727 -27.648 -9.216 235 HE1 MET 30 HE1 MET 30 -12.249 -23.908 -11.394 236 HE2 MET 30 HE2 MET 30 -11.538 -23.640 -9.807 237 HE3 MET 30 HE3 MET 30 -10.560 -24.387 -11.087 238 H GLY 31 H GLY 31 -8.758 -24.823 -5.618 239 HA2 GLY 31 HA2 GLY 31 -10.255 -25.047 -3.227 240 HA3 GLY 31 HA3 GLY 31 -8.569 -24.515 -3.349 241 H TRP 32 H TRP 32 -8.636 -22.125 -4.630 242 HA TRP 32 HA TRP 32 -9.611 -20.244 -2.772 243 HB2 TRP 32 HB2 TRP 32 -8.681 -20.086 -5.640 244 HB3 TRP 32 HB3 TRP 32 -9.435 -18.698 -4.885 245 HD1 TRP 32 HD1 TRP 32 -6.238 -20.764 -4.612 246 HE1 TRP 32 HE1 TRP 32 -4.454 -19.373 -3.407 247 HE3 TRP 32 HE3 TRP 32 -9.205 -16.935 -2.984 248 HZ2 TRP 32 HZ2 TRP 32 -4.337 -16.870 -1.947 249 HZ3 TRP 32 HZ3 TRP 32 -8.265 -15.161 -1.538 250 HH2 TRP 32 HH2 TRP 32 -5.832 -15.093 -1.047 251 H TYR 33 H TYR 33 -11.084 -21.325 -5.902 252 HA TYR 33 HA TYR 33 -13.286 -19.564 -5.846 253 HB2 TYR 33 HB2 TYR 33 -12.750 -20.760 -7.863 254 HB3 TYR 33 HB3 TYR 33 -12.883 -22.321 -7.063 255 HD1 TYR 33 HD1 TYR 33 -14.806 -19.503 -8.493 256 HD2 TYR 33 HD2 TYR 33 -15.048 -23.355 -6.572 257 HE1 TYR 33 HE1 TYR 33 -17.195 -19.656 -9.113 258 HE2 TYR 33 HE2 TYR 33 -17.460 -23.454 -7.051 259 HH TYR 33 HH TYR 33 -19.275 -22.414 -8.104 260 H TYR 34 H TYR 34 -12.962 -22.901 -4.533 261 HA TYR 34 HA TYR 34 -15.638 -23.302 -3.874 262 HB2 TYR 34 HB2 TYR 34 -14.168 -25.151 -3.978 263 HB3 TYR 34 HB3 TYR 34 -12.999 -24.414 -2.894 264 HD1 TYR 34 HD1 TYR 34 -16.470 -25.829 -2.961 265 HD2 TYR 34 HD2 TYR 34 -13.006 -24.826 -0.609 266 HE1 TYR 34 HE1 TYR 34 -17.480 -26.983 -1.002 267 HE2 TYR 34 HE2 TYR 34 -13.995 -25.972 1.364 268 HH TYR 34 HH TYR 34 -15.820 -27.169 2.186 269 H TYR 35 H TYR 35 -12.966 -22.188 -1.632 270 HA TYR 35 HA TYR 35 -14.891 -21.879 0.482 271 HB2 TYR 35 HB2 TYR 35 -13.193 -21.393 1.853 272 HB3 TYR 35 HB3 TYR 35 -12.238 -22.128 0.583 273 HD1 TYR 35 HD1 TYR 35 -10.951 -20.635 -1.000 274 HD2 TYR 35 HD2 TYR 35 -13.060 -19.042 2.402 275 HE1 TYR 35 HE1 TYR 35 -9.717 -18.509 -1.245 276 HE2 TYR 35 HE2 TYR 35 -11.851 -16.901 2.165 277 HH TYR 35 HH TYR 35 -10.291 -15.696 0.939 278 H LEU 36 H LEU 36 -13.547 -19.627 -1.965 279 HA LEU 36 HA LEU 36 -14.500 -17.259 -0.750 280 HB2 LEU 36 HB2 LEU 36 -12.777 -17.277 -2.469 281 HB3 LEU 36 HB3 LEU 36 -13.913 -17.942 -3.652 282 HG LEU 36 HG LEU 36 -15.223 -15.877 -3.632 283 HD11 LEU 36 HD11 LEU 36 -14.363 -13.837 -2.488 284 HD12 LEU 36 HD12 LEU 36 -14.874 -15.066 -1.327 285 HD13 LEU 36 HD13 LEU 36 -13.141 -14.824 -1.658 286 HD21 LEU 36 HD21 LEU 36 -13.624 -14.516 -4.802 287 HD22 LEU 36 HD22 LEU 36 -12.251 -15.285 -3.968 288 HD23 LEU 36 HD23 LEU 36 -13.233 -16.204 -5.123 289 H ASP 37 H ASP 37 -15.986 -19.290 -3.372 290 HA ASP 37 HA ASP 37 -18.356 -17.729 -3.647 291 HB2 ASP 37 HB2 ASP 37 -17.675 -19.377 -5.312 292 HB3 ASP 37 HB3 ASP 37 -17.826 -20.685 -4.132 293 H ASP 38 H ASP 38 -17.547 -20.474 -1.476 294 HA ASP 38 HA ASP 38 -20.127 -20.679 -0.260 295 HB2 ASP 38 HB2 ASP 38 -18.433 -22.439 -0.117 296 HB3 ASP 38 HB3 ASP 38 -17.373 -21.380 0.815 297 H THR 39 H THR 39 -17.558 -18.316 0.208 298 HA THR 39 HA THR 39 -18.576 -17.515 2.867 299 HB THR 39 HB THR 39 -16.186 -16.556 1.237 300 HG1 THR 39 HG1 THR 39 -15.873 -18.608 1.884 301 HG21 THR 39 HG21 THR 39 -17.121 -15.908 4.058 302 HG22 THR 39 HG22 THR 39 -15.437 -15.695 3.533 303 HG23 THR 39 HG23 THR 39 -16.735 -14.783 2.748 304 H LEU 40 H LEU 40 -18.402 -16.292 -0.493 305 HA LEU 40 HA LEU 40 -19.036 -13.584 0.041 306 HB2 LEU 40 HB2 LEU 40 -19.567 -15.350 -2.379 307 HB3 LEU 40 HB3 LEU 40 -19.966 -13.637 -2.359 308 HG LEU 40 HG LEU 40 -17.152 -14.727 -2.009 309 HD11 LEU 40 HD11 LEU 40 -16.783 -13.974 -4.325 310 HD12 LEU 40 HD12 LEU 40 -18.041 -15.210 -4.254 311 HD13 LEU 40 HD13 LEU 40 -18.490 -13.503 -4.455 312 HD21 LEU 40 HD21 LEU 40 -16.478 -12.384 -2.571 313 HD22 LEU 40 HD22 LEU 40 -18.164 -11.896 -2.303 314 HD23 LEU 40 HD23 LEU 40 -17.192 -12.606 -0.981 315 H GLU 41 H GLU 41 -20.744 -12.731 0.948 316 HA GLU 41 HA GLU 41 -23.329 -13.985 1.127 317 HB2 GLU 41 HB2 GLU 41 -22.191 -12.618 2.887 318 HB3 GLU 41 HB3 GLU 41 -22.295 -11.201 1.837 319 HG2 GLU 41 HG2 GLU 41 -23.966 -11.071 3.494 320 HG3 GLU 41 HG3 GLU 41 -24.766 -11.346 1.955 321 H PHE 42 H PHE 42 -22.894 -14.043 -1.454 322 HA PHE 42 HA PHE 42 -23.594 -11.638 -2.881 323 HB2 PHE 42 HB2 PHE 42 -23.472 -12.953 -4.877 324 HB3 PHE 42 HB3 PHE 42 -22.127 -13.361 -3.844 325 HD1 PHE 42 HD2 PHE 42 -25.429 -14.535 -5.139 326 HD2 PHE 42 HD1 PHE 42 -21.778 -15.657 -3.123 327 HE1 PHE 42 HE2 PHE 42 -26.022 -16.928 -5.382 328 HE2 PHE 42 HE1 PHE 42 -22.379 -18.040 -3.368 329 HZ PHE 42 HZ PHE 42 -24.503 -18.689 -4.493 330 HA PRO 43 HA PRO 43 -24.701 -11.162 -5.006 331 HB2 PRO 43 HB2 PRO 43 -26.648 -9.373 -5.636 332 HB3 PRO 43 HB3 PRO 43 -26.610 -11.035 -6.297 333 HG2 PRO 43 HG2 PRO 43 -28.216 -10.010 -3.938 334 HG3 PRO 43 HG3 PRO 43 -28.783 -11.010 -5.314 335 HD2 PRO 43 HD2 PRO 43 -28.075 -12.099 -2.903 336 HD3 PRO 43 HD3 PRO 43 -27.763 -12.949 -4.444 337 H PHE 44 H PHE 44 -23.844 -9.026 -4.897 338 HA PHE 44 HA PHE 44 -24.405 -7.343 -2.546 339 HB2 PHE 44 HB2 PHE 44 -22.159 -7.272 -1.782 340 HB3 PHE 44 HB3 PHE 44 -22.732 -8.915 -1.701 341 HD1 PHE 44 HD1 PHE 44 -21.894 -10.619 -3.451 342 HD2 PHE 44 HD2 PHE 44 -20.116 -6.741 -2.911 343 HE1 PHE 44 HE1 PHE 44 -19.794 -11.445 -4.458 344 HE2 PHE 44 HE2 PHE 44 -18.019 -7.559 -3.930 345 HZ PHE 44 HZ PHE 44 -17.838 -9.924 -4.683 346 H MET 45 H MET 45 -22.322 -5.476 -2.934 347 HA MET 45 HA MET 45 -22.385 -4.889 -5.830 348 HB2 MET 45 HB2 MET 45 -23.190 -2.738 -5.641 349 HB3 MET 45 HB3 MET 45 -24.300 -3.698 -4.686 350 HG2 MET 45 HG2 MET 45 -23.664 -2.732 -2.691 351 HG3 MET 45 HG3 MET 45 -22.022 -2.403 -3.213 352 HE1 MET 45 HE1 MET 45 -22.198 0.878 -5.232 353 HE2 MET 45 HE2 MET 45 -21.188 -0.457 -4.656 354 HE3 MET 45 HE3 MET 45 -22.318 -0.720 -5.992 355 H GLY 46 H GLY 46 -20.936 -3.083 -6.419 356 HA2 GLY 46 HA2 GLY 46 -18.706 -2.492 -4.595 357 HA3 GLY 46 HA3 GLY 46 -18.332 -3.694 -5.842 358 H LYS 47 H LYS 47 -16.811 -1.695 -5.972 359 HA LYS 47 HA LYS 47 -17.806 -0.146 -8.330 360 HB2 LYS 47 HB2 LYS 47 -17.068 1.220 -6.243 361 HB3 LYS 47 HB3 LYS 47 -15.444 0.618 -6.555 362 HG2 LYS 47 HG2 LYS 47 -15.447 2.686 -7.673 363 HG3 LYS 47 HG3 LYS 47 -15.791 1.548 -8.976 364 HD2 LYS 47 HD2 LYS 47 -17.338 3.282 -9.315 365 HD3 LYS 47 HD3 LYS 47 -18.280 2.010 -8.531 366 HE2 LYS 47 HE2 LYS 47 -18.171 3.152 -6.388 367 HE3 LYS 47 HE3 LYS 47 -17.032 4.346 -7.027 368 HZ1 LYS 47 HZ1 LYS 47 -19.800 4.035 -8.059 369 HZ2 LYS 47 HZ2 LYS 47 -19.361 5.135 -6.922 370 HZ3 LYS 47 HZ3 LYS 47 -18.746 5.223 -8.427 371 H TRP 48 H TRP 48 -16.962 -0.955 -10.170 372 HA TRP 48 HA TRP 48 -14.553 -2.673 -10.107 373 HB2 TRP 48 HB2 TRP 48 -16.483 -3.153 -11.647 374 HB3 TRP 48 HB3 TRP 48 -16.152 -1.648 -12.482 375 HD1 TRP 48 HD1 TRP 48 -12.800 -2.737 -11.999 376 HE1 TRP 48 HE1 TRP 48 -11.854 -4.103 -13.864 377 HE3 TRP 48 HE3 TRP 48 -17.195 -4.000 -14.318 378 HZ2 TRP 48 HZ2 TRP 48 -12.862 -5.782 -16.018 379 HZ3 TRP 48 HZ3 TRP 48 -17.136 -5.548 -16.263 380 HH2 TRP 48 HH2 TRP 48 -14.991 -6.449 -17.099 381 H LYS 49 H LYS 49 -12.802 -1.533 -9.607 382 HA LYS 49 HA LYS 49 -12.330 1.251 -10.387 383 HB2 LYS 49 HB2 LYS 49 -10.473 -0.836 -9.139 384 HB3 LYS 49 HB3 LYS 49 -10.233 0.905 -9.137 385 HG2 LYS 49 HG2 LYS 49 -12.451 -0.605 -7.662 386 HG3 LYS 49 HG3 LYS 49 -10.951 -0.070 -6.947 387 HD2 LYS 49 HD2 LYS 49 -13.018 1.831 -8.138 388 HD3 LYS 49 HD3 LYS 49 -12.922 1.356 -6.434 389 HE2 LYS 49 HE2 LYS 49 -10.446 2.118 -6.535 390 HE3 LYS 49 HE3 LYS 49 -10.879 2.933 -8.044 391 HZ1 LYS 49 HZ1 LYS 49 -12.176 3.438 -5.421 392 HZ2 LYS 49 HZ2 LYS 49 -11.021 4.372 -6.083 393 HZ3 LYS 49 HZ3 LYS 49 -12.472 4.268 -6.815 394 H LYS 50 H LYS 50 -12.870 0.254 -12.666 395 HA LYS 50 HA LYS 50 -11.415 -1.740 -13.905 396 HB2 LYS 50 HB2 LYS 50 -13.558 -0.917 -14.677 397 HB3 LYS 50 HB3 LYS 50 -12.837 0.626 -15.167 398 HG2 LYS 50 HG2 LYS 50 -11.485 -0.436 -16.852 399 HG3 LYS 50 HG3 LYS 50 -11.868 -2.050 -16.248 400 HD2 LYS 50 HD2 LYS 50 -13.936 -0.145 -17.450 401 HD3 LYS 50 HD3 LYS 50 -13.039 -1.347 -18.386 402 HE2 LYS 50 HE2 LYS 50 -13.907 -3.129 -16.799 403 HE3 LYS 50 HE3 LYS 50 -14.962 -1.906 -16.085 404 HZ1 LYS 50 HZ1 LYS 50 -15.008 -2.806 -18.914 405 HZ2 LYS 50 HZ2 LYS 50 -16.114 -3.170 -17.776 406 HZ3 LYS 50 HZ3 LYS 50 -15.967 -1.631 -18.311 407 H LYS 51 H LYS 51 -9.327 -1.927 -14.198 408 HA LYS 51 HA LYS 51 -7.614 0.389 -14.864 409 HB2 LYS 51 HB2 LYS 51 -7.148 -2.596 -14.510 410 HB3 LYS 51 HB3 LYS 51 -5.905 -1.554 -15.211 411 HG2 LYS 51 HG2 LYS 51 -5.838 -0.140 -13.246 412 HG3 LYS 51 HG3 LYS 51 -7.167 -1.043 -12.492 413 HD2 LYS 51 HD2 LYS 51 -5.754 -3.099 -12.506 414 HD3 LYS 51 HD3 LYS 51 -4.421 -2.161 -13.218 415 HE2 LYS 51 HE2 LYS 51 -4.434 -0.657 -11.236 416 HE3 LYS 51 HE3 LYS 51 -5.763 -1.592 -10.535 417 HZ1 LYS 51 HZ1 LYS 51 -4.278 -3.511 -10.447 418 HZ2 LYS 51 HZ2 LYS 51 -3.049 -2.646 -11.094 419 HZ3 LYS 51 HZ3 LYS 51 -3.633 -2.263 -9.623 420 H SER 52 H SER 52 -9.520 -1.942 -16.613 421 HA SER 52 HA SER 52 -8.024 -2.372 -18.866 422 HB2 SER 52 HB2 SER 52 -11.036 -2.310 -18.873 423 HB3 SER 52 HB3 SER 52 -9.952 -3.471 -19.644 424 HG SER 52 HG SER 52 -11.105 -4.143 -17.688 425 H ARG 53 H ARG 53 -8.341 0.704 -18.427 426 HA ARG 53 HA ARG 53 -9.842 1.619 -20.762 427 HB2 ARG 53 HB2 ARG 53 -9.087 2.872 -18.464 428 HB3 ARG 53 HB3 ARG 53 -7.740 3.367 -19.494 429 HG2 ARG 53 HG2 ARG 53 -9.415 4.271 -21.156 430 HG3 ARG 53 HG3 ARG 53 -10.707 3.723 -20.084 431 HD2 ARG 53 HD2 ARG 53 -10.555 5.955 -19.563 432 HD3 ARG 53 HD3 ARG 53 -9.599 5.208 -18.270 433 HE ARG 53 HE ARG 53 -7.695 5.815 -20.140 434 HH11 ARG 53 HH11 ARG 53 -10.106 7.684 -18.300 435 HH12 ARG 53 HH12 ARG 53 -9.334 9.208 -18.606 436 HH21 ARG 53 HH21 ARG 53 -6.632 7.765 -20.425 437 HH22 ARG 53 HH22 ARG 53 -7.268 9.255 -19.808 438 H LYS 54 H LYS 54 -8.514 3.034 -22.419 439 HA LYS 54 HA LYS 54 -6.605 1.401 -23.788 440 HB2 LYS 54 HB2 LYS 54 -7.145 4.403 -23.987 441 HB3 LYS 54 HB3 LYS 54 -6.118 3.482 -25.092 442 HG2 LYS 54 HG2 LYS 54 -8.047 2.062 -25.735 443 HG3 LYS 54 HG3 LYS 54 -9.098 2.991 -24.649 444 HD2 LYS 54 HD2 LYS 54 -8.617 5.055 -25.942 445 HD3 LYS 54 HD3 LYS 54 -7.578 4.119 -27.041 446 HE2 LYS 54 HE2 LYS 54 -9.518 2.692 -27.655 447 HE3 LYS 54 HE3 LYS 54 -10.551 3.616 -26.558 448 HZ1 LYS 54 HZ1 LYS 54 -10.151 5.574 -27.935 449 HZ2 LYS 54 HZ2 LYS 54 -9.195 4.720 -28.950 450 HZ3 LYS 54 HZ3 LYS 54 -10.781 4.372 -28.835 451 H THR 55 H THR 55 -6.206 4.247 -21.612 452 HA THR 55 HA THR 55 -3.305 3.845 -21.402 453 HB THR 55 HB THR 55 -3.603 5.827 -19.833 454 HG1 THR 55 HG1 THR 55 -5.520 6.308 -19.271 455 HG21 THR 55 HG21 THR 55 -3.064 6.148 -22.250 456 HG22 THR 55 HG22 THR 55 -4.804 6.225 -22.611 457 HG23 THR 55 HG23 THR 55 -4.050 7.461 -21.583 458 H SER 56 H SER 56 -2.451 3.763 -19.020 459 HA SER 56 HA SER 56 -3.592 1.570 -17.581 460 HB2 SER 56 HB2 SER 56 -1.623 3.663 -16.579 461 HB3 SER 56 HB3 SER 56 -1.810 1.993 -16.013 462 HG SER 56 HG SER 56 -0.035 2.237 -17.446 463 H THR 57 H THR 57 -4.694 4.792 -17.724 464 HA THR 57 HA THR 57 -5.233 5.549 -15.123 465 HB THR 57 HB THR 57 -7.120 6.005 -17.436 466 HG1 THR 57 HG1 THR 57 -4.616 7.291 -17.110 467 HG21 THR 57 HG21 THR 57 -7.193 8.321 -16.564 468 HG22 THR 57 HG22 THR 57 -7.723 7.140 -15.357 469 HG23 THR 57 HG23 THR 57 -6.100 7.854 -15.241 470 H ILE 58 H ILE 58 -6.747 4.991 -13.598 471 HA ILE 58 HA ILE 58 -8.519 2.732 -14.124 472 HB ILE 58 HB ILE 58 -7.684 4.333 -11.712 473 HG12 ILE 58 HG12 ILE 58 -7.757 1.391 -12.528 474 HG13 ILE 58 HG13 ILE 58 -6.340 2.442 -12.509 475 HG21 ILE 58 HG21 ILE 58 -10.128 4.172 -11.390 476 HG22 ILE 58 HG22 ILE 58 -10.043 2.419 -11.661 477 HG23 ILE 58 HG23 ILE 58 -9.263 3.166 -10.248 478 HD11 ILE 58 HD11 ILE 58 -6.215 0.999 -10.621 479 HD12 ILE 58 HD12 ILE 58 -6.610 2.619 -9.999 480 HD13 ILE 58 HD13 ILE 58 -7.873 1.361 -10.129 481 H GLU 59 H GLU 59 -10.720 2.765 -14.001 482 HA GLU 59 HA GLU 59 -12.165 5.358 -14.048 483 HB2 GLU 59 HB2 GLU 59 -12.630 2.919 -15.829 484 HB3 GLU 59 HB3 GLU 59 -13.799 4.217 -15.631 485 HG2 GLU 59 HG2 GLU 59 -10.993 4.493 -16.768 486 HG3 GLU 59 HG3 GLU 59 -12.479 4.439 -17.704 487 H GLU 60 H GLU 60 -14.473 4.949 -13.276 488 HA GLU 60 HA GLU 60 -14.456 2.785 -11.206 489 HB2 GLU 60 HB2 GLU 60 -15.142 5.731 -10.849 490 HB3 GLU 60 HB3 GLU 60 -15.325 4.461 -9.633 491 HG2 GLU 60 HG2 GLU 60 -12.850 4.039 -9.758 492 HG3 GLU 60 HG3 GLU 60 -12.694 5.409 -10.864 493 H LYS 61 H LYS 61 -16.012 1.460 -11.960 494 HA LYS 61 HA LYS 61 -18.606 2.650 -12.886 495 HB2 LYS 61 HB2 LYS 61 -17.355 1.385 -14.574 496 HB3 LYS 61 HB3 LYS 61 -17.250 -0.009 -13.488 497 HG2 LYS 61 HG2 LYS 61 -19.664 -0.317 -13.536 498 HG3 LYS 61 HG3 LYS 61 -19.878 1.135 -14.509 499 HD2 LYS 61 HD2 LYS 61 -18.174 -1.242 -15.402 500 HD3 LYS 61 HD3 LYS 61 -19.895 -1.173 -15.713 501 HE2 LYS 61 HE2 LYS 61 -17.849 0.873 -16.691 502 HE3 LYS 61 HE3 LYS 61 -18.554 -0.429 -17.656 503 HZ1 LYS 61 HZ1 LYS 61 -20.734 0.581 -17.357 504 HZ2 LYS 61 HZ2 LYS 61 -20.101 1.796 -16.470 505 HZ3 LYS 61 HZ3 LYS 61 -19.698 1.651 -18.052 506 H THR 62 H THR 62 -20.195 2.513 -11.334 507 HA THR 62 HA THR 62 -19.969 0.749 -9.082 508 HB THR 62 HB THR 62 -22.498 2.112 -10.083 509 HG1 THR 62 HG1 THR 62 -21.743 3.996 -9.445 510 HG21 THR 62 HG21 THR 62 -22.622 0.675 -8.026 511 HG22 THR 62 HG22 THR 62 -21.356 1.672 -7.281 512 HG23 THR 62 HG23 THR 62 -22.939 2.383 -7.676 513 H VAL 63 H VAL 63 -20.666 -1.311 -8.872 514 HA VAL 63 HA VAL 63 -22.381 -2.493 -11.015 515 HB VAL 63 HB VAL 63 -20.876 -4.484 -10.965 516 HG11 VAL 63 HG11 VAL 63 -19.250 -3.636 -12.535 517 HG12 VAL 63 HG12 VAL 63 -20.782 -2.788 -12.795 518 HG13 VAL 63 HG13 VAL 63 -19.449 -1.979 -11.941 519 HG21 VAL 63 HG21 VAL 63 -18.557 -4.301 -10.229 520 HG22 VAL 63 HG22 VAL 63 -18.834 -2.661 -9.619 521 HG23 VAL 63 HG23 VAL 63 -19.634 -4.050 -8.851 522 H GLU 64 H GLU 64 -23.624 -4.268 -10.445 523 HA GLU 64 HA GLU 64 -23.864 -4.848 -7.514 524 HB2 GLU 64 HB2 GLU 64 -25.984 -4.188 -8.580 525 HB3 GLU 64 HB3 GLU 64 -25.780 -5.436 -9.815 526 HG2 GLU 64 HG2 GLU 64 -25.891 -7.188 -8.064 527 HG3 GLU 64 HG3 GLU 64 -26.006 -5.941 -6.818 528 H VAL 65 H VAL 65 -22.873 -6.748 -6.951 529 HA VAL 65 HA VAL 65 -21.673 -8.380 -9.109 530 HB VAL 65 HB VAL 65 -21.122 -8.548 -6.122 531 HG11 VAL 65 HG11 VAL 65 -20.377 -10.456 -7.504 532 HG12 VAL 65 HG12 VAL 65 -19.579 -9.340 -8.633 533 HG13 VAL 65 HG13 VAL 65 -18.970 -9.520 -6.979 534 HG21 VAL 65 HG21 VAL 65 -20.573 -6.238 -6.722 535 HG22 VAL 65 HG22 VAL 65 -19.090 -7.164 -6.538 536 HG23 VAL 65 HG23 VAL 65 -19.689 -6.781 -8.161 537 H LEU 66 H LEU 66 -22.951 -9.987 -9.787 538 HA LEU 66 HA LEU 66 -25.310 -10.824 -8.363 539 HB2 LEU 66 HB2 LEU 66 -23.832 -12.012 -10.758 540 HB3 LEU 66 HB3 LEU 66 -25.297 -12.698 -10.101 541 HG LEU 66 HG LEU 66 -25.863 -11.497 -12.040 542 HD11 LEU 66 HD11 LEU 66 -26.791 -9.787 -9.697 543 HD12 LEU 66 HD12 LEU 66 -27.593 -10.002 -11.263 544 HD13 LEU 66 HD13 LEU 66 -27.473 -11.369 -10.143 545 HD21 LEU 66 HD21 LEU 66 -23.926 -9.928 -12.064 546 HD22 LEU 66 HD22 LEU 66 -25.479 -9.193 -12.472 547 HD23 LEU 66 HD23 LEU 66 -24.776 -8.918 -10.868 548 H GLY 67 H GLY 67 -21.975 -12.108 -8.611 549 HA2 GLY 67 HA2 GLY 67 -21.760 -13.584 -6.368 550 HA3 GLY 67 HA3 GLY 67 -22.654 -14.670 -7.459 551 H MET 68 H MET 68 -20.478 -15.756 -6.999 552 HA MET 68 HA MET 68 -18.140 -14.921 -8.444 553 HB2 MET 68 HB2 MET 68 -18.464 -16.697 -6.492 554 HB3 MET 68 HB3 MET 68 -18.848 -17.812 -7.811 555 HG2 MET 68 HG2 MET 68 -16.533 -18.033 -7.266 556 HG3 MET 68 HG3 MET 68 -16.624 -17.231 -8.839 557 HE1 MET 68 HE1 MET 68 -13.950 -17.345 -7.340 558 HE2 MET 68 HE2 MET 68 -14.246 -16.461 -8.855 559 HE3 MET 68 HE3 MET 68 -13.408 -15.660 -7.507 560 H ALA 69 H ALA 69 -17.355 -15.633 -10.450 561 HA ALA 69 HA ALA 69 -19.340 -15.877 -12.512 562 HB1 ALA 69 HB1 ALA 69 -16.316 -16.230 -12.570 563 HB2 ALA 69 HB2 ALA 69 -17.333 -15.956 -13.988 564 HB3 ALA 69 HB3 ALA 69 -17.185 -14.687 -12.779 565 HA PRO 70 HA PRO 70 -19.702 -20.278 -13.258 566 HB2 PRO 70 HB2 PRO 70 -18.292 -19.804 -15.891 567 HB3 PRO 70 HB3 PRO 70 -19.736 -20.812 -15.553 568 HG2 PRO 70 HG2 PRO 70 -20.050 -18.343 -16.604 569 HG3 PRO 70 HG3 PRO 70 -21.110 -18.867 -15.253 570 HD2 PRO 70 HD2 PRO 70 -18.658 -17.116 -15.160 571 HD3 PRO 70 HD3 PRO 70 -20.223 -16.896 -14.320 572 H ASP 71 H ASP 71 -18.542 -22.175 -13.095 573 HA ASP 71 HA ASP 71 -16.018 -22.173 -11.894 574 HB2 ASP 71 HB2 ASP 71 -17.701 -23.996 -11.789 575 HB3 ASP 71 HB3 ASP 71 -17.388 -24.376 -13.488 576 H ASP 72 H ASP 72 -16.906 -22.380 -15.305 577 HA ASP 72 HA ASP 72 -14.375 -23.229 -16.346 578 HB2 ASP 72 HB2 ASP 72 -16.499 -23.457 -17.566 579 HB3 ASP 72 HB3 ASP 72 -16.645 -21.699 -17.666 580 H GLU 73 H GLU 73 -15.627 -20.032 -15.422 581 HA GLU 73 HA GLU 73 -13.411 -18.573 -16.721 582 HB2 GLU 73 HB2 GLU 73 -15.417 -17.674 -14.598 583 HB3 GLU 73 HB3 GLU 73 -14.275 -16.644 -15.440 584 HG2 GLU 73 HG2 GLU 73 -16.650 -18.112 -16.650 585 HG3 GLU 73 HG3 GLU 73 -16.509 -16.384 -16.367 586 H CYS 74 H CYS 74 -14.422 -19.788 -13.523 587 HA CYS 74 HA CYS 74 -12.186 -18.641 -12.141 588 HB2 CYS 74 HB2 CYS 74 -14.245 -20.678 -11.217 589 HB3 CYS 74 HB3 CYS 74 -13.137 -19.751 -10.188 590 HG CYS 74 HG CYS 74 -15.623 -18.772 -12.126 591 H LEU 75 H LEU 75 -11.710 -20.855 -14.294 592 HA LEU 75 HA LEU 75 -10.611 -23.088 -12.885 593 HB2 LEU 75 HB2 LEU 75 -11.319 -22.467 -15.552 594 HB3 LEU 75 HB3 LEU 75 -9.589 -22.673 -15.615 595 HG LEU 75 HG LEU 75 -10.647 -24.725 -16.161 596 HD11 LEU 75 HD11 LEU 75 -9.697 -26.312 -14.591 597 HD12 LEU 75 HD12 LEU 75 -8.601 -24.940 -14.800 598 HD13 LEU 75 HD13 LEU 75 -9.583 -25.073 -13.327 599 HD21 LEU 75 HD21 LEU 75 -12.168 -25.968 -14.705 600 HD22 LEU 75 HD22 LEU 75 -12.137 -24.660 -13.509 601 HD23 LEU 75 HD23 LEU 75 -12.833 -24.382 -15.109 602 H LYS 76 H LYS 76 -9.334 -19.929 -13.482 603 HA LYS 76 HA LYS 76 -6.593 -20.837 -12.704 604 HB2 LYS 76 HB2 LYS 76 -7.198 -18.830 -14.920 605 HB3 LYS 76 HB3 LYS 76 -5.616 -19.404 -14.383 606 HG2 LYS 76 HG2 LYS 76 -6.217 -21.701 -15.187 607 HG3 LYS 76 HG3 LYS 76 -7.782 -21.069 -15.732 608 HD2 LYS 76 HD2 LYS 76 -6.232 -21.291 -17.606 609 HD3 LYS 76 HD3 LYS 76 -6.717 -19.605 -17.351 610 HE2 LYS 76 HE2 LYS 76 -4.609 -19.147 -16.172 611 HE3 LYS 76 HE3 LYS 76 -4.126 -20.842 -16.323 612 HZ1 LYS 76 HZ1 LYS 76 -4.077 -20.539 -18.738 613 HZ2 LYS 76 HZ2 LYS 76 -4.526 -18.974 -18.596 614 HZ3 LYS 76 HZ3 LYS 76 -3.084 -19.466 -18.021 615 H ASP 77 H ASP 77 -9.054 -18.337 -12.718 616 HA ASP 77 HA ASP 77 -7.515 -16.611 -10.899 617 HB2 ASP 77 HB2 ASP 77 -6.806 -15.896 -13.143 618 HB3 ASP 77 HB3 ASP 77 -8.488 -15.726 -13.641 619 H MET 78 H MET 78 -8.924 -14.873 -10.018 620 HA MET 78 HA MET 78 -11.553 -16.089 -9.412 621 HB2 MET 78 HB2 MET 78 -10.009 -13.772 -8.180 622 HB3 MET 78 HB3 MET 78 -11.579 -14.332 -7.615 623 HG2 MET 78 HG2 MET 78 -9.002 -15.958 -7.626 624 HG3 MET 78 HG3 MET 78 -9.762 -15.195 -6.243 625 HE1 MET 78 HE1 MET 78 -10.666 -19.348 -7.886 626 HE2 MET 78 HE2 MET 78 -10.469 -18.038 -9.060 627 HE3 MET 78 HE3 MET 78 -9.150 -18.426 -7.931 628 H TYR 79 H TYR 79 -13.321 -15.486 -10.545 629 HA TYR 79 HA TYR 79 -13.529 -12.701 -11.586 630 HB2 TYR 79 HB2 TYR 79 -14.233 -15.371 -12.863 631 HB3 TYR 79 HB3 TYR 79 -14.871 -13.843 -13.431 632 HD1 TYR 79 HD2 TYR 79 -13.316 -12.072 -14.341 633 HD2 TYR 79 HD1 TYR 79 -12.079 -16.132 -13.585 634 HE1 TYR 79 HE2 TYR 79 -11.436 -11.783 -15.922 635 HE2 TYR 79 HE1 TYR 79 -10.229 -15.878 -15.195 636 HH TYR 79 HH TYR 79 -9.131 -14.442 -16.679 637 H VAL 80 H VAL 80 -15.649 -11.842 -11.626 638 HA VAL 80 HA VAL 80 -17.786 -13.393 -10.229 639 HB VAL 80 HB VAL 80 -18.413 -11.173 -9.201 640 HG11 VAL 80 HG11 VAL 80 -15.875 -12.524 -8.221 641 HG12 VAL 80 HG12 VAL 80 -16.905 -11.425 -7.270 642 HG13 VAL 80 HG13 VAL 80 -17.558 -12.956 -7.832 643 HG21 VAL 80 HG21 VAL 80 -16.893 -9.694 -10.529 644 HG22 VAL 80 HG22 VAL 80 -16.711 -9.494 -8.782 645 HG23 VAL 80 HG23 VAL 80 -15.498 -10.412 -9.695 646 H GLU 81 H GLU 81 -19.890 -12.883 -10.869 647 HA GLU 81 HA GLU 81 -20.120 -11.605 -13.558 648 HB2 GLU 81 HB2 GLU 81 -22.002 -13.228 -11.814 649 HB3 GLU 81 HB3 GLU 81 -22.612 -12.215 -13.134 650 HG2 GLU 81 HG2 GLU 81 -21.167 -13.376 -14.751 651 HG3 GLU 81 HG3 GLU 81 -20.532 -14.405 -13.475 652 H VAL 82 H VAL 82 -21.098 -9.626 -13.851 653 HA VAL 82 HA VAL 82 -21.980 -8.119 -11.462 654 HB VAL 82 HB VAL 82 -20.535 -6.219 -12.332 655 HG11 VAL 82 HG11 VAL 82 -18.555 -6.930 -11.131 656 HG12 VAL 82 HG12 VAL 82 -20.008 -7.481 -10.295 657 HG13 VAL 82 HG13 VAL 82 -19.039 -8.633 -11.240 658 HG21 VAL 82 HG21 VAL 82 -19.944 -7.184 -14.567 659 HG22 VAL 82 HG22 VAL 82 -18.551 -6.667 -13.620 660 HG23 VAL 82 HG23 VAL 82 -18.938 -8.396 -13.743 661 H ALA 83 H ALA 83 -23.480 -6.595 -11.850 662 HA ALA 83 HA ALA 83 -24.435 -6.251 -14.666 663 HB1 ALA 83 HB1 ALA 83 -25.879 -5.710 -12.042 664 HB2 ALA 83 HB2 ALA 83 -26.537 -5.475 -13.679 665 HB3 ALA 83 HB3 ALA 83 -26.158 -7.105 -13.100 666 H ASP 84 H ASP 84 -24.303 -4.224 -15.533 667 HA ASP 84 HA ASP 84 -22.606 -2.275 -14.165 668 HB2 ASP 84 HB2 ASP 84 -22.277 -2.845 -16.534 669 HB3 ASP 84 HB3 ASP 84 -23.904 -2.257 -16.910 670 H ILE 85 H ILE 85 -24.403 -2.148 -12.463 671 HA ILE 85 HA ILE 85 -26.790 -0.695 -12.995 672 HB ILE 85 HB ILE 85 -26.941 -0.320 -10.619 673 HG12 ILE 85 HG12 ILE 85 -24.131 -1.422 -10.351 674 HG13 ILE 85 HG13 ILE 85 -24.558 0.275 -10.163 675 HG21 ILE 85 HG21 ILE 85 -25.831 -3.120 -11.080 676 HG22 ILE 85 HG22 ILE 85 -27.105 -2.611 -9.950 677 HG23 ILE 85 HG23 ILE 85 -27.408 -2.577 -11.683 678 HD11 ILE 85 HD11 ILE 85 -24.334 -0.781 -7.974 679 HD12 ILE 85 HD12 ILE 85 -26.017 -0.286 -8.241 680 HD13 ILE 85 HD13 ILE 85 -25.541 -1.992 -8.383 681 H GLY 86 H GLY 86 -23.591 0.442 -13.155 682 HA2 GLY 86 HA2 GLY 86 -24.229 3.256 -12.564 683 HA3 GLY 86 HA3 GLY 86 -22.667 2.559 -13.014 684 H GLY 87 H GLY 87 -24.370 1.145 -15.346 685 HA2 GLY 87 HA2 GLY 87 -24.368 3.510 -17.196 686 HA3 GLY 87 HA3 GLY 87 -23.355 2.084 -17.442 687 H LYS 88 H LYS 88 -25.640 0.234 -16.586 688 HA LYS 88 HA LYS 88 -27.436 0.529 -18.958 689 HB2 LYS 88 HB2 LYS 88 -25.809 -1.953 -18.238 690 HB3 LYS 88 HB3 LYS 88 -27.074 -1.903 -19.452 691 HG2 LYS 88 HG2 LYS 88 -24.489 -0.291 -19.595 692 HG3 LYS 88 HG3 LYS 88 -24.772 -1.841 -20.377 693 HD2 LYS 88 HD2 LYS 88 -26.616 -0.882 -21.712 694 HD3 LYS 88 HD3 LYS 88 -26.360 0.700 -20.947 695 HE2 LYS 88 HE2 LYS 88 -24.031 0.742 -21.807 696 HE3 LYS 88 HE3 LYS 88 -24.286 -0.827 -22.580 697 HZ1 LYS 88 HZ1 LYS 88 -25.995 0.206 -23.962 698 HZ2 LYS 88 HZ2 LYS 88 -25.759 1.658 -23.245 699 HZ3 LYS 88 HZ3 LYS 88 -24.577 0.986 -24.142 700 H ASP 89 H ASP 89 -26.716 -1.117 -15.911 701 HA ASP 89 HA ASP 89 -27.825 -2.097 -14.305 702 HB2 ASP 89 HB2 ASP 89 -28.975 -0.014 -14.032 703 HB3 ASP 89 HB3 ASP 89 -30.143 -0.413 -15.288 704 H ASP 90 H ASP 90 -29.534 -2.411 -17.393 705 HA ASP 90 HA ASP 90 -31.104 -4.676 -16.505 706 HB2 ASP 90 HB2 ASP 90 -31.908 -2.811 -17.959 707 HB3 ASP 90 HB3 ASP 90 -30.803 -3.348 -19.224 708 H ASP 91 H ASP 91 -27.901 -4.666 -17.385 709 HA ASP 91 HA ASP 91 -28.070 -7.372 -18.573 710 HB2 ASP 91 HB2 ASP 91 -27.841 -5.589 -20.401 711 HB3 ASP 91 HB3 ASP 91 -26.232 -5.270 -19.733 712 H VAL 92 H VAL 92 -25.915 -8.407 -18.648 713 HA VAL 92 HA VAL 92 -24.369 -7.820 -16.177 714 HB VAL 92 HB VAL 92 -25.526 -10.509 -17.028 715 HG11 VAL 92 HG11 VAL 92 -24.025 -9.745 -14.493 716 HG12 VAL 92 HG12 VAL 92 -24.824 -11.301 -14.787 717 HG13 VAL 92 HG13 VAL 92 -23.444 -10.833 -15.772 718 HG21 VAL 92 HG21 VAL 92 -26.941 -10.311 -14.966 719 HG22 VAL 92 HG22 VAL 92 -26.398 -8.628 -14.801 720 HG23 VAL 92 HG23 VAL 92 -27.357 -9.134 -16.206 721 H TYR 93 H TYR 93 -22.283 -8.568 -16.152 722 HA TYR 93 HA TYR 93 -20.960 -9.595 -18.594 723 HB2 TYR 93 HB2 TYR 93 -20.126 -7.122 -17.006 724 HB3 TYR 93 HB3 TYR 93 -19.303 -7.786 -18.406 725 HD1 TYR 93 HD2 TYR 93 -20.239 -7.520 -20.691 726 HD2 TYR 93 HD1 TYR 93 -22.139 -5.745 -17.244 727 HE1 TYR 93 HE2 TYR 93 -21.568 -6.055 -22.182 728 HE2 TYR 93 HE1 TYR 93 -23.485 -4.289 -18.725 729 HH TYR 93 HH TYR 93 -23.960 -3.688 -20.931 730 H THR 94 H THR 94 -18.367 -9.556 -17.637 731 HA THR 94 HA THR 94 -18.441 -10.771 -14.927 732 HB THR 94 HB THR 94 -16.783 -11.777 -17.271 733 HG1 THR 94 HG1 THR 94 -18.958 -12.294 -17.538 734 HG21 THR 94 HG21 THR 94 -17.215 -12.921 -14.473 735 HG22 THR 94 HG22 THR 94 -16.340 -13.727 -15.795 736 HG23 THR 94 HG23 THR 94 -15.705 -12.230 -15.103 737 H ALA 95 H ALA 95 -16.621 -10.268 -13.669 738 HA ALA 95 HA ALA 95 -14.599 -8.409 -14.799 739 HB1 ALA 95 HB1 ALA 95 -16.156 -8.032 -12.201 740 HB2 ALA 95 HB2 ALA 95 -14.769 -7.047 -12.718 741 HB3 ALA 95 HB3 ALA 95 -16.276 -7.011 -13.647 742 H LYS 96 H LYS 96 -12.587 -8.516 -13.711 743 HA LYS 96 HA LYS 96 -12.037 -11.043 -12.298 744 HB2 LYS 96 HB2 LYS 96 -9.739 -10.034 -12.053 745 HB3 LYS 96 HB3 LYS 96 -10.240 -10.441 -13.681 746 HG2 LYS 96 HG2 LYS 96 -10.801 -7.625 -12.878 747 HG3 LYS 96 HG3 LYS 96 -9.095 -8.067 -12.924 748 HD2 LYS 96 HD2 LYS 96 -9.180 -8.642 -15.228 749 HD3 LYS 96 HD3 LYS 96 -10.951 -8.571 -15.284 750 HE2 LYS 96 HE2 LYS 96 -10.998 -6.197 -15.038 751 HE3 LYS 96 HE3 LYS 96 -9.316 -6.131 -14.496 752 HZ1 LYS 96 HZ1 LYS 96 -9.538 -5.389 -16.786 753 HZ2 LYS 96 HZ2 LYS 96 -8.608 -6.728 -16.723 754 HZ3 LYS 96 HZ3 LYS 96 -10.150 -6.832 -17.252 755 H LEU 97 H LEU 97 -12.089 -11.247 -10.107 756 HA LEU 97 HA LEU 97 -13.317 -9.187 -8.538 757 HB2 LEU 97 HB2 LEU 97 -13.425 -11.608 -7.998 758 HB3 LEU 97 HB3 LEU 97 -11.687 -11.614 -7.669 759 HG LEU 97 HG LEU 97 -12.009 -10.074 -5.762 760 HD11 LEU 97 HD11 LEU 97 -14.371 -9.618 -4.962 761 HD12 LEU 97 HD12 LEU 97 -13.953 -8.761 -6.439 762 HD13 LEU 97 HD13 LEU 97 -14.969 -10.218 -6.517 763 HD21 LEU 97 HD21 LEU 97 -12.156 -12.539 -5.475 764 HD22 LEU 97 HD22 LEU 97 -13.114 -11.657 -4.285 765 HD23 LEU 97 HD23 LEU 97 -13.924 -12.430 -5.667 766 H SER 98 H SER 98 -9.970 -10.079 -9.206 767 HA SER 98 HA SER 98 -8.417 -8.590 -7.564 768 HB2 SER 98 HB2 SER 98 -8.067 -8.794 -10.570 769 HB3 SER 98 HB3 SER 98 -6.813 -8.807 -9.323 770 HG SER 98 HG SER 98 -7.391 -10.912 -10.226 771 H ASP 99 H ASP 99 -10.637 -7.250 -9.996 772 HA ASP 99 HA ASP 99 -9.260 -4.623 -9.785 773 HB2 ASP 99 HB2 ASP 99 -9.346 -5.970 -11.991 774 HB3 ASP 99 HB3 ASP 99 -11.049 -5.495 -12.061 775 H ILE 100 H ILE 100 -11.554 -5.970 -8.208 776 HA ILE 100 HA ILE 100 -13.476 -3.692 -8.353 777 HB ILE 100 HB ILE 100 -13.857 -6.628 -8.312 778 HG12 ILE 100 HG12 ILE 100 -15.671 -4.306 -9.071 779 HG13 ILE 100 HG13 ILE 100 -14.471 -5.047 -10.153 780 HG21 ILE 100 HG21 ILE 100 -14.672 -6.200 -6.010 781 HG22 ILE 100 HG22 ILE 100 -15.830 -5.013 -6.664 782 HG23 ILE 100 HG23 ILE 100 -15.938 -6.729 -7.097 783 HD11 ILE 100 HD11 ILE 100 -17.013 -6.300 -9.065 784 HD12 ILE 100 HD12 ILE 100 -16.594 -5.909 -10.738 785 HD13 ILE 100 HD13 ILE 100 -15.735 -7.224 -9.903 786 H GLU 101 H GLU 101 -14.362 -2.987 -6.484 787 HA GLU 101 HA GLU 101 -13.070 -3.745 -3.919 788 HB2 GLU 101 HB2 GLU 101 -12.328 -1.483 -4.583 789 HB3 GLU 101 HB3 GLU 101 -14.007 -1.005 -4.890 790 HG2 GLU 101 HG2 GLU 101 -13.237 -0.118 -2.754 791 HG3 GLU 101 HG3 GLU 101 -14.559 -1.247 -2.517 792 H ALA 102 H ALA 102 -14.580 -4.258 -2.345 793 HA ALA 102 HA ALA 102 -17.354 -4.643 -3.293 794 HB1 ALA 102 HB1 ALA 102 -15.994 -5.495 -0.697 795 HB2 ALA 102 HB2 ALA 102 -17.574 -6.030 -1.321 796 HB3 ALA 102 HB3 ALA 102 -16.088 -6.471 -2.179 797 H ILE 103 H ILE 103 -19.067 -3.575 -2.443 798 HA ILE 103 HA ILE 103 -18.665 -1.591 -0.251 799 HB ILE 103 HB ILE 103 -20.031 -1.311 -2.941 800 HG12 ILE 103 HG12 ILE 103 -17.890 0.424 -1.632 801 HG13 ILE 103 HG13 ILE 103 -17.545 -0.863 -2.785 802 HG21 ILE 103 HG21 ILE 103 -21.541 -0.336 -1.233 803 HG22 ILE 103 HG22 ILE 103 -20.196 0.644 -0.602 804 HG23 ILE 103 HG23 ILE 103 -20.843 0.917 -2.235 805 HD11 ILE 103 HD11 ILE 103 -17.498 1.197 -3.958 806 HD12 ILE 103 HD12 ILE 103 -18.909 0.264 -4.500 807 HD13 ILE 103 HD13 ILE 103 -19.112 1.654 -3.401 808 H ASP 104 H ASP 104 -20.293 -1.533 1.249 809 HA ASP 104 HA ASP 104 -21.996 -2.177 2.511 810 HB2 ASP 104 HB2 ASP 104 -23.198 -1.016 0.675 811 HB3 ASP 104 HB3 ASP 104 -23.515 -2.577 -0.081 812 H VAL 105 H VAL 105 -20.143 -4.335 1.550 813 HA VAL 105 HA VAL 105 -21.732 -6.792 1.713 814 HB VAL 105 HB VAL 105 -19.367 -7.806 1.892 815 HG11 VAL 105 HG11 VAL 105 -20.724 -7.881 -0.069 816 HG12 VAL 105 HG12 VAL 105 -20.179 -6.256 -0.575 817 HG13 VAL 105 HG13 VAL 105 -19.034 -7.623 -0.515 818 HG21 VAL 105 HG21 VAL 105 -18.432 -5.084 0.907 819 HG22 VAL 105 HG22 VAL 105 -18.209 -5.678 2.571 820 HG23 VAL 105 HG23 VAL 105 -17.480 -6.553 1.215 821 H ASP 106 H ASP 106 -21.041 -8.455 3.291 822 HA ASP 106 HA ASP 106 -21.073 -7.406 6.048 823 HB2 ASP 106 HB2 ASP 106 -21.981 -9.314 6.635 824 HB3 ASP 106 HB3 ASP 106 -22.163 -9.717 4.932 825 H ASP 107 H ASP 107 -19.423 -8.290 7.576 826 HA ASP 107 HA ASP 107 -16.840 -7.494 6.770 827 HB2 ASP 107 HB2 ASP 107 -17.615 -7.417 9.090 828 HB3 ASP 107 HB3 ASP 107 -17.748 -9.178 9.134 829 H ASP 108 H ASP 108 -18.229 -10.838 6.964 830 HA ASP 108 HA ASP 108 -15.620 -12.039 6.673 831 HB2 ASP 108 HB2 ASP 108 -17.761 -13.073 7.670 832 HB3 ASP 108 HB3 ASP 108 -18.260 -13.373 5.999 833 H THR 109 H THR 109 -18.304 -11.292 4.418 834 HA THR 109 HA THR 109 -17.156 -12.236 2.018 835 HB THR 109 HB THR 109 -19.033 -9.914 2.637 836 HG1 THR 109 HG1 THR 109 -19.886 -11.711 3.374 837 HG21 THR 109 HG21 THR 109 -18.282 -9.752 0.269 838 HG22 THR 109 HG22 THR 109 -18.798 -11.428 0.014 839 HG23 THR 109 HG23 THR 109 -20.000 -10.199 0.428 840 H GLN 110 H GLN 110 -16.917 -8.932 3.562 841 HA GLN 110 HA GLN 110 -15.260 -7.850 1.551 842 HB2 GLN 110 HB2 GLN 110 -16.492 -6.755 3.626 843 HB3 GLN 110 HB3 GLN 110 -14.980 -7.038 4.466 844 HG2 GLN 110 HG2 GLN 110 -15.341 -5.447 1.879 845 HG3 GLN 110 HG3 GLN 110 -15.172 -4.754 3.483 846 HE21 GLN 110 HE22 GLN 110 -13.432 -5.491 0.680 847 HE22 GLN 110 HE21 GLN 110 -11.836 -5.562 1.371 848 H GLU 111 H GLU 111 -14.381 -9.521 4.636 849 HA GLU 111 HA GLU 111 -11.587 -9.247 4.333 850 HB2 GLU 111 HB2 GLU 111 -13.332 -11.239 5.824 851 HB3 GLU 111 HB3 GLU 111 -11.576 -11.302 5.904 852 HG2 GLU 111 HG2 GLU 111 -13.149 -8.786 6.629 853 HG3 GLU 111 HG3 GLU 111 -12.755 -10.052 7.784 854 H ALA 112 H ALA 112 -13.809 -11.770 3.023 855 HA ALA 112 HA ALA 112 -11.706 -13.509 2.140 856 HB1 ALA 112 HB1 ALA 112 -14.510 -13.149 0.982 857 HB2 ALA 112 HB2 ALA 112 -13.430 -14.542 0.752 858 HB3 ALA 112 HB3 ALA 112 -14.082 -14.191 2.360 859 H ILE 113 H ILE 113 -13.411 -10.772 0.578 860 HA ILE 113 HA ILE 113 -12.090 -11.031 -1.969 861 HB ILE 113 HB ILE 113 -13.532 -8.723 -0.594 862 HG12 ILE 113 HG12 ILE 113 -14.485 -10.583 -2.823 863 HG13 ILE 113 HG13 ILE 113 -14.827 -10.869 -1.132 864 HG21 ILE 113 HG21 ILE 113 -12.592 -8.952 -3.487 865 HG22 ILE 113 HG22 ILE 113 -13.707 -7.706 -2.880 866 HG23 ILE 113 HG23 ILE 113 -12.055 -7.767 -2.285 867 HD11 ILE 113 HD11 ILE 113 -16.748 -9.842 -2.013 868 HD12 ILE 113 HD12 ILE 113 -15.945 -8.618 -1.013 869 HD13 ILE 113 HD13 ILE 113 -15.816 -8.559 -2.799 870 H ALA 114 H ALA 114 -11.456 -9.049 0.976 871 HA ALA 114 HA ALA 114 -9.164 -7.701 0.029 872 HB1 ALA 114 HB1 ALA 114 -9.777 -8.603 2.875 873 HB2 ALA 114 HB2 ALA 114 -8.662 -7.316 2.383 874 HB3 ALA 114 HB3 ALA 114 -10.402 -7.124 2.110 875 H ASP 115 H ASP 115 -9.493 -10.919 1.582 876 HA ASP 115 HA ASP 115 -6.761 -11.499 1.896 877 HB2 ASP 115 HB2 ASP 115 -8.743 -12.763 2.815 878 HB3 ASP 115 HB3 ASP 115 -8.941 -13.518 1.232 879 H TRP 116 H TRP 116 -8.909 -12.125 -0.944 880 HA TRP 116 HA TRP 116 -6.862 -13.333 -2.561 881 HB2 TRP 116 HB2 TRP 116 -9.172 -13.608 -3.211 882 HB3 TRP 116 HB3 TRP 116 -9.418 -11.865 -3.294 883 HD1 TRP 116 HD1 TRP 116 -9.350 -10.913 -5.635 884 HE1 TRP 116 HE1 TRP 116 -8.196 -11.435 -7.867 885 HE3 TRP 116 HE3 TRP 116 -6.691 -15.071 -4.243 886 HZ2 TRP 116 HZ2 TRP 116 -6.377 -13.409 -8.908 887 HZ3 TRP 116 HZ3 TRP 116 -5.256 -16.245 -5.868 888 HH2 TRP 116 HH2 TRP 116 -5.088 -15.426 -8.215 889 H LEU 117 H LEU 117 -7.918 -9.915 -2.147 890 HA LEU 117 HA LEU 117 -6.240 -8.898 -4.219 891 HB2 LEU 117 HB2 LEU 117 -7.411 -7.600 -1.728 892 HB3 LEU 117 HB3 LEU 117 -6.529 -6.699 -2.950 893 HG LEU 117 HG LEU 117 -8.987 -8.362 -3.652 894 HD11 LEU 117 HD11 LEU 117 -10.279 -6.259 -3.563 895 HD12 LEU 117 HD12 LEU 117 -9.664 -6.725 -1.972 896 HD13 LEU 117 HD13 LEU 117 -8.867 -5.418 -2.880 897 HD21 LEU 117 HD21 LEU 117 -9.094 -6.892 -5.614 898 HD22 LEU 117 HD22 LEU 117 -7.634 -6.034 -5.077 899 HD23 LEU 117 HD23 LEU 117 -7.544 -7.740 -5.558 900 H TYR 118 H TYR 118 -5.654 -9.279 -0.667 901 HA TYR 118 HA TYR 118 -3.038 -8.150 -0.683 902 HB2 TYR 118 HB2 TYR 118 -4.163 -10.329 1.118 903 HB3 TYR 118 HB3 TYR 118 -2.713 -9.393 1.430 904 HD1 TYR 118 HD2 TYR 118 -3.842 -6.587 0.656 905 HD2 TYR 118 HD1 TYR 118 -5.352 -9.815 3.097 906 HE1 TYR 118 HE2 TYR 118 -5.160 -4.972 1.966 907 HE2 TYR 118 HE1 TYR 118 -6.679 -8.200 4.416 908 HH TYR 118 HH TYR 118 -6.652 -4.666 3.730 909 H TRP 119 H TRP 119 -4.186 -11.542 -1.228 910 HA TRP 119 HA TRP 119 -1.538 -12.647 -1.424 911 HB2 TRP 119 HB2 TRP 119 -3.512 -14.036 -1.014 912 HB3 TRP 119 HB3 TRP 119 -4.231 -13.527 -2.547 913 HD1 TRP 119 HD1 TRP 119 -3.247 -14.468 -4.742 914 HE1 TRP 119 HE1 TRP 119 -1.491 -16.228 -5.381 915 HE3 TRP 119 HE3 TRP 119 -1.403 -15.422 -0.084 916 HZ2 TRP 119 HZ2 TRP 119 0.342 -18.010 -3.959 917 HZ3 TRP 119 HZ3 TRP 119 0.382 -17.108 0.253 918 HH2 TRP 119 HH2 TRP 119 1.264 -18.404 -1.682 919 H LEU 120 H LEU 120 -3.814 -11.361 -3.964 920 HA LEU 120 HA LEU 120 -1.967 -12.085 -5.986 921 HB2 LEU 120 HB2 LEU 120 -4.441 -11.611 -6.285 922 HB3 LEU 120 HB3 LEU 120 -4.058 -9.888 -6.179 923 HG LEU 120 HG LEU 120 -2.553 -10.130 -8.179 924 HD11 LEU 120 HD11 LEU 120 -2.786 -12.233 -9.566 925 HD12 LEU 120 HD12 LEU 120 -1.876 -12.466 -8.077 926 HD13 LEU 120 HD13 LEU 120 -3.559 -13.015 -8.167 927 HD21 LEU 120 HD21 LEU 120 -5.396 -11.124 -8.565 928 HD22 LEU 120 HD22 LEU 120 -4.869 -9.432 -8.435 929 HD23 LEU 120 HD23 LEU 120 -4.361 -10.407 -9.823 930 H ALA 121 H ALA 121 -2.230 -9.186 -3.980 931 HA ALA 121 HA ALA 121 -0.266 -7.614 -5.352 932 HB1 ALA 121 HB1 ALA 121 -1.864 -6.658 -3.779 933 HB2 ALA 121 HB2 ALA 121 -1.241 -7.669 -2.470 934 HB3 ALA 121 HB3 ALA 121 -0.216 -6.386 -3.164 935 H ARG 122 H ARG 122 0.014 -10.234 -2.924 936 HA ARG 122 HA ARG 122 2.895 -9.975 -2.560 937 HB2 ARG 122 HB2 ARG 122 1.159 -11.229 -1.058 938 HB3 ARG 122 HB3 ARG 122 1.157 -12.472 -2.296 939 HG2 ARG 122 HG2 ARG 122 2.610 -13.375 -0.850 940 HG3 ARG 122 HG3 ARG 122 3.746 -12.579 -1.936 941 HD2 ARG 122 HD2 ARG 122 3.930 -10.680 -0.369 942 HD3 ARG 122 HD3 ARG 122 2.698 -11.380 0.661 943 HE ARG 122 HE ARG 122 5.508 -12.089 0.494 944 HH11 ARG 122 HH11 ARG 122 2.299 -13.411 1.497 945 HH12 ARG 122 HH12 ARG 122 3.048 -14.818 2.234 946 HH21 ARG 122 HH21 ARG 122 6.362 -13.947 1.561 947 HH22 ARG 122 HH22 ARG 122 5.282 -15.177 2.130 948 H GLY 123 H GLY 123 0.677 -11.495 -4.811 949 HA2 GLY 123 HA2 GLY 123 1.725 -11.369 -7.134 950 HA3 GLY 123 HA3 GLY 123 2.844 -12.592 -6.525 951 H TYR 124 H TYR 124 1.402 -13.230 -8.600 952 HA TYR 124 HA TYR 124 -1.057 -14.675 -8.189 953 HB2 TYR 124 HB2 TYR 124 -0.029 -14.035 -10.391 954 HB3 TYR 124 HB3 TYR 124 1.216 -15.243 -10.141 955 HD1 TYR 124 HD1 TYR 124 -2.574 -15.035 -10.034 956 HD2 TYR 124 HD2 TYR 124 0.913 -17.187 -11.405 957 HE1 TYR 124 HE1 TYR 124 -4.033 -16.586 -11.304 958 HE2 TYR 124 HE2 TYR 124 -0.531 -18.723 -12.686 959 HH TYR 124 HH TYR 124 -2.700 -19.229 -13.352 960 H LYS 125 H LYS 125 2.331 -15.794 -8.271 961 HA LYS 125 HA LYS 125 3.585 -17.177 -7.069 962 HB2 LYS 125 HB2 LYS 125 1.583 -16.335 -4.969 963 HB3 LYS 125 HB3 LYS 125 2.907 -17.410 -4.560 964 HG2 LYS 125 HG2 LYS 125 3.239 -14.617 -5.711 965 HG3 LYS 125 HG3 LYS 125 3.332 -15.050 -4.002 966 HD2 LYS 125 HD2 LYS 125 5.207 -16.681 -4.666 967 HD3 LYS 125 HD3 LYS 125 5.249 -15.861 -6.226 968 HE2 LYS 125 HE2 LYS 125 5.701 -14.577 -3.487 969 HE3 LYS 125 HE3 LYS 125 6.958 -15.046 -4.629 970 HZ1 LYS 125 HZ1 LYS 125 5.955 -13.415 -6.206 971 HZ2 LYS 125 HZ2 LYS 125 4.991 -12.860 -4.981 972 HZ3 LYS 125 HZ3 LYS 125 6.605 -12.753 -4.871 973 H PHE 126 H PHE 126 0.668 -18.327 -8.053 974 HA PHE 126 HA PHE 126 1.563 -21.101 -7.550 975 HB2 PHE 126 HB2 PHE 126 -1.230 -20.039 -7.012 976 HB3 PHE 126 HB3 PHE 126 -0.837 -21.749 -7.189 977 HD1 PHE 126 HD2 PHE 126 1.515 -22.203 -5.526 978 HD2 PHE 126 HD1 PHE 126 -1.918 -19.682 -4.830 979 HE1 PHE 126 HE2 PHE 126 1.807 -22.466 -3.078 980 HE2 PHE 126 HE1 PHE 126 -1.658 -19.996 -2.393 981 HZ PHE 126 HZ PHE 126 0.225 -21.366 -1.503 Start of MODEL 8 1 H1 MET 1 H1 MET 1 11.840 -10.663 -1.413 2 H2 MET 1 H2 MET 1 10.848 -10.371 -2.683 3 H3 MET 1 H3 MET 1 11.530 -9.120 -1.882 4 HA MET 1 HA MET 1 9.546 -10.992 -0.790 5 HB2 MET 1 HB2 MET 1 11.092 -10.261 0.962 6 HB3 MET 1 HB3 MET 1 10.852 -8.566 0.519 7 HG2 MET 1 HG2 MET 1 8.480 -8.699 1.187 8 HG3 MET 1 HG3 MET 1 8.655 -10.429 1.491 9 HE1 MET 1 HE1 MET 1 10.951 -7.279 2.516 10 HE2 MET 1 HE2 MET 1 9.250 -6.801 2.735 11 HE3 MET 1 HE3 MET 1 10.307 -7.012 4.148 12 H ALA 2 H ALA 2 7.548 -10.579 -1.487 13 HA ALA 2 HA ALA 2 6.830 -8.002 -2.769 14 HB1 ALA 2 HB1 ALA 2 5.156 -10.459 -2.040 15 HB2 ALA 2 HB2 ALA 2 4.621 -9.071 -3.014 16 HB3 ALA 2 HB3 ALA 2 5.881 -10.150 -3.637 17 H SER 3 H SER 3 5.746 -6.365 -1.562 18 HA SER 3 HA SER 3 6.166 -6.302 1.168 19 HB2 SER 3 HB2 SER 3 4.057 -4.680 -0.286 20 HB3 SER 3 HB3 SER 3 5.036 -4.208 1.119 21 HG SER 3 HG SER 3 5.827 -3.310 -0.842 22 H VAL 4 H VAL 4 3.442 -7.749 -0.464 23 HA VAL 4 HA VAL 4 1.607 -7.694 1.763 24 HB VAL 4 HB VAL 4 0.331 -9.320 0.384 25 HG11 VAL 4 HG11 VAL 4 0.034 -6.886 0.096 26 HG12 VAL 4 HG12 VAL 4 1.284 -6.870 -1.165 27 HG13 VAL 4 HG13 VAL 4 -0.223 -7.767 -1.417 28 HG21 VAL 4 HG21 VAL 4 1.023 -9.872 -1.875 29 HG22 VAL 4 HG22 VAL 4 2.550 -9.003 -1.695 30 HG23 VAL 4 HG23 VAL 4 2.241 -10.475 -0.742 31 H GLU 5 H GLU 5 4.509 -9.450 1.375 32 HA GLU 5 HA GLU 5 3.732 -11.849 2.830 33 HB2 GLU 5 HB2 GLU 5 6.436 -10.587 2.215 34 HB3 GLU 5 HB3 GLU 5 6.212 -12.114 3.075 35 HG2 GLU 5 HG2 GLU 5 5.087 -13.100 1.141 36 HG3 GLU 5 HG3 GLU 5 5.234 -11.590 0.241 37 H ARG 6 H ARG 6 2.444 -10.418 4.359 38 HA ARG 6 HA ARG 6 3.537 -8.653 6.213 39 HB2 ARG 6 HB2 ARG 6 1.152 -8.900 6.019 40 HB3 ARG 6 HB3 ARG 6 1.223 -10.624 6.385 41 HG2 ARG 6 HG2 ARG 6 0.309 -9.396 8.269 42 HG3 ARG 6 HG3 ARG 6 1.819 -10.181 8.708 43 HD2 ARG 6 HD2 ARG 6 2.974 -7.904 8.310 44 HD3 ARG 6 HD3 ARG 6 1.366 -7.225 8.094 45 HE ARG 6 HE ARG 6 0.946 -7.403 10.352 46 HH11 ARG 6 HH11 ARG 6 4.036 -9.076 9.660 47 HH12 ARG 6 HH12 ARG 6 4.499 -9.143 11.323 48 HH21 ARG 6 HH21 ARG 6 1.579 -7.550 12.546 49 HH22 ARG 6 HH22 ARG 6 3.071 -8.286 12.989 50 H ASP 7 H ASP 7 3.327 -12.229 6.490 51 HA ASP 7 HA ASP 7 5.641 -12.445 8.157 52 HB2 ASP 7 HB2 ASP 7 4.063 -11.695 9.927 53 HB3 ASP 7 HB3 ASP 7 2.896 -12.914 9.418 54 H GLU 8 H GLU 8 6.149 -14.778 8.340 55 HA GLU 8 HA GLU 8 5.381 -16.146 6.006 56 HB2 GLU 8 HB2 GLU 8 6.801 -17.163 8.505 57 HB3 GLU 8 HB3 GLU 8 6.678 -18.058 6.983 58 HG2 GLU 8 HG2 GLU 8 7.839 -16.203 5.797 59 HG3 GLU 8 HG3 GLU 8 8.036 -15.351 7.330 60 H THR 9 H THR 9 3.721 -16.141 9.120 61 HA THR 9 HA THR 9 2.326 -18.589 9.024 62 HB THR 9 HB THR 9 0.486 -17.064 10.010 63 HG1 THR 9 HG1 THR 9 2.602 -15.214 10.215 64 HG21 THR 9 HG21 THR 9 1.929 -18.375 11.433 65 HG22 THR 9 HG22 THR 9 3.239 -17.189 11.269 66 HG23 THR 9 HG23 THR 9 1.743 -16.754 12.136 67 H ARG 10 H ARG 10 1.843 -15.565 7.204 68 HA ARG 10 HA ARG 10 -0.674 -16.340 6.021 69 HB2 ARG 10 HB2 ARG 10 1.442 -14.308 5.175 70 HB3 ARG 10 HB3 ARG 10 -0.027 -14.592 4.264 71 HG2 ARG 10 HG2 ARG 10 -0.292 -12.648 5.665 72 HG3 ARG 10 HG3 ARG 10 -1.431 -13.912 6.131 73 HD2 ARG 10 HD2 ARG 10 -0.104 -14.461 8.100 74 HD3 ARG 10 HD3 ARG 10 1.171 -13.323 7.608 75 HE ARG 10 HE ARG 10 -1.174 -11.830 7.747 76 HH11 ARG 10 HH11 ARG 10 0.644 -13.853 10.064 77 HH12 ARG 10 HH12 ARG 10 0.191 -12.905 11.433 78 HH21 ARG 10 HH21 ARG 10 -1.796 -10.609 9.597 79 HH22 ARG 10 HH22 ARG 10 -1.226 -11.038 11.162 80 H GLU 11 H GLU 11 2.723 -16.714 4.962 81 HA GLU 11 HA GLU 11 2.180 -17.802 2.383 82 HB2 GLU 11 HB2 GLU 11 4.534 -18.332 4.258 83 HB3 GLU 11 HB3 GLU 11 4.492 -18.721 2.553 84 HG2 GLU 11 HG2 GLU 11 4.193 -15.860 3.581 85 HG3 GLU 11 HG3 GLU 11 5.749 -16.614 3.282 86 H HIS 12 H HIS 12 2.853 -19.376 5.534 87 HA HIS 12 HA HIS 12 2.527 -22.042 4.614 88 HB2 HIS 12 HB2 HIS 12 2.104 -20.901 7.414 89 HB3 HIS 12 HB3 HIS 12 2.210 -22.614 7.026 90 HD1 HIS 12 HD1 HIS 12 4.779 -23.054 5.500 91 HD2 HIS 12 HD2 HIS 12 4.307 -20.081 8.441 92 HE1 HIS 12 HE1 HIS 12 7.118 -22.491 6.323 93 H ARG 13 H ARG 13 0.100 -19.870 6.261 94 HA ARG 13 HA ARG 13 -1.869 -21.962 6.251 95 HB2 ARG 13 HB2 ARG 13 -2.199 -18.944 6.540 96 HB3 ARG 13 HB3 ARG 13 -3.505 -20.108 6.712 97 HG2 ARG 13 HG2 ARG 13 -1.114 -19.746 8.532 98 HG3 ARG 13 HG3 ARG 13 -2.818 -19.575 8.911 99 HD2 ARG 13 HD2 ARG 13 -1.270 -22.134 8.382 100 HD3 ARG 13 HD3 ARG 13 -1.957 -21.596 9.915 101 HE ARG 13 HE ARG 13 -4.160 -21.728 8.281 102 HH11 ARG 13 HH11 ARG 13 -1.648 -24.092 9.131 103 HH12 ARG 13 HH12 ARG 13 -2.677 -25.460 8.935 104 HH21 ARG 13 HH21 ARG 13 -5.507 -23.499 7.992 105 HH22 ARG 13 HH22 ARG 13 -4.942 -25.123 8.280 106 H ILE 14 H ILE 14 -1.309 -19.299 3.853 107 HA ILE 14 HA ILE 14 -3.687 -19.915 2.461 108 HB ILE 14 HB ILE 14 -1.961 -17.913 2.310 109 HG12 ILE 14 HG12 ILE 14 -3.683 -18.781 -0.026 110 HG13 ILE 14 HG13 ILE 14 -4.222 -17.976 1.458 111 HG21 ILE 14 HG21 ILE 14 -1.176 -19.401 -0.223 112 HG22 ILE 14 HG22 ILE 14 -0.625 -17.802 0.311 113 HG23 ILE 14 HG23 ILE 14 -0.127 -19.221 1.210 114 HD11 ILE 14 HD11 ILE 14 -4.047 -16.275 -0.186 115 HD12 ILE 14 HD12 ILE 14 -2.682 -16.046 0.913 116 HD13 ILE 14 HD13 ILE 14 -2.434 -16.793 -0.687 117 H GLU 15 H GLU 15 -0.370 -21.188 2.126 118 HA GLU 15 HA GLU 15 -0.825 -22.927 -0.050 119 HB2 GLU 15 HB2 GLU 15 1.369 -22.202 0.668 120 HB3 GLU 15 HB3 GLU 15 1.174 -22.966 2.250 121 HG2 GLU 15 HG2 GLU 15 1.214 -25.175 1.280 122 HG3 GLU 15 HG3 GLU 15 1.178 -24.515 -0.363 123 H THR 16 H THR 16 -1.265 -23.454 3.500 124 HA THR 16 HA THR 16 -1.812 -26.296 2.978 125 HB THR 16 HB THR 16 -1.792 -26.449 5.475 126 HG1 THR 16 HG1 THR 16 -0.776 -23.810 5.351 127 HG21 THR 16 HG21 THR 16 0.636 -26.164 5.692 128 HG22 THR 16 HG22 THR 16 0.219 -26.930 4.152 129 HG23 THR 16 HG23 THR 16 0.686 -25.218 4.188 130 H GLU 17 H GLU 17 -3.790 -23.563 3.012 131 HA GLU 17 HA GLU 17 -6.095 -25.184 3.976 132 HB2 GLU 17 HB2 GLU 17 -5.112 -23.270 5.372 133 HB3 GLU 17 HB3 GLU 17 -5.787 -22.173 4.150 134 HG2 GLU 17 HG2 GLU 17 -8.029 -23.106 4.579 135 HG3 GLU 17 HG3 GLU 17 -7.331 -24.248 5.741 136 H ILE 18 H ILE 18 -5.011 -22.942 1.371 137 HA ILE 18 HA ILE 18 -7.791 -23.032 0.298 138 HB ILE 18 HB ILE 18 -5.556 -21.041 -0.195 139 HG12 ILE 18 HG12 ILE 18 -8.084 -20.976 1.518 140 HG13 ILE 18 HG13 ILE 18 -6.411 -20.861 2.069 141 HG21 ILE 18 HG21 ILE 18 -7.326 -19.716 -1.355 142 HG22 ILE 18 HG22 ILE 18 -6.985 -21.216 -2.182 143 HG23 ILE 18 HG23 ILE 18 -8.436 -21.100 -1.179 144 HD11 ILE 18 HD11 ILE 18 -7.271 -18.677 2.207 145 HD12 ILE 18 HD12 ILE 18 -6.245 -18.680 0.754 146 HD13 ILE 18 HD13 ILE 18 -8.011 -18.756 0.603 147 H ILE 19 H ILE 19 -4.424 -23.788 -0.623 148 HA ILE 19 HA ILE 19 -5.522 -25.054 -3.093 149 HB ILE 19 HB ILE 19 -3.440 -24.374 -4.230 150 HG12 ILE 19 HG12 ILE 19 -2.241 -23.780 -1.954 151 HG13 ILE 19 HG13 ILE 19 -1.820 -23.040 -3.487 152 HG21 ILE 19 HG21 ILE 19 -5.267 -22.119 -3.335 153 HG22 ILE 19 HG22 ILE 19 -4.236 -22.135 -4.780 154 HG23 ILE 19 HG23 ILE 19 -5.580 -23.280 -4.620 155 HD11 ILE 19 HD11 ILE 19 -1.931 -21.421 -1.598 156 HD12 ILE 19 HD12 ILE 19 -2.981 -20.994 -2.954 157 HD13 ILE 19 HD13 ILE 19 -3.679 -21.707 -1.488 158 H VAL 20 H VAL 20 -4.505 -26.009 -0.266 159 HA VAL 20 HA VAL 20 -2.268 -27.640 -0.683 160 HB VAL 20 HB VAL 20 -3.426 -26.915 1.427 161 HG11 VAL 20 HG11 VAL 20 -5.728 -27.639 0.991 162 HG12 VAL 20 HG12 VAL 20 -5.206 -29.338 1.104 163 HG13 VAL 20 HG13 VAL 20 -5.089 -28.274 2.509 164 HG21 VAL 20 HG21 VAL 20 -2.677 -28.826 2.756 165 HG22 VAL 20 HG22 VAL 20 -2.658 -29.851 1.304 166 HG23 VAL 20 HG23 VAL 20 -1.532 -28.482 1.448 167 H ASP 21 H ASP 21 -5.659 -28.209 -1.367 168 HA ASP 21 HA ASP 21 -5.447 -31.056 -1.769 169 HB2 ASP 21 HB2 ASP 21 -7.440 -29.836 -0.887 170 HB3 ASP 21 HB3 ASP 21 -7.677 -29.109 -2.476 171 H ALA 22 H ALA 22 -4.195 -28.739 -3.735 172 HA ALA 22 HA ALA 22 -4.867 -30.116 -6.292 173 HB1 ALA 22 HB1 ALA 22 -6.425 -28.307 -6.179 174 HB2 ALA 22 HB2 ALA 22 -5.205 -27.188 -5.551 175 HB3 ALA 22 HB3 ALA 22 -5.101 -27.763 -7.227 176 H GLU 23 H GLU 23 -3.339 -29.643 -7.989 177 HA GLU 23 HA GLU 23 -0.643 -28.810 -7.033 178 HB2 GLU 23 HB2 GLU 23 0.288 -30.839 -7.955 179 HB3 GLU 23 HB3 GLU 23 -0.950 -31.222 -6.764 180 HG2 GLU 23 HG2 GLU 23 -2.578 -31.686 -8.591 181 HG3 GLU 23 HG3 GLU 23 -1.349 -31.288 -9.792 182 H ASP 24 H ASP 24 -2.952 -28.169 -9.377 183 HA ASP 24 HA ASP 24 -0.887 -27.131 -11.252 184 HB2 ASP 24 HB2 ASP 24 -1.800 -29.168 -12.279 185 HB3 ASP 24 HB3 ASP 24 -3.452 -28.624 -11.959 186 H LYS 25 H LYS 25 -1.548 -25.207 -12.299 187 HA LYS 25 HA LYS 25 -2.808 -23.268 -10.857 188 HB2 LYS 25 HB2 LYS 25 -2.749 -21.943 -12.879 189 HB3 LYS 25 HB3 LYS 25 -1.345 -23.013 -12.884 190 HG2 LYS 25 HG2 LYS 25 -3.172 -24.565 -14.182 191 HG3 LYS 25 HG3 LYS 25 -3.774 -22.984 -14.639 192 HD2 LYS 25 HD2 LYS 25 -1.640 -22.526 -15.758 193 HD3 LYS 25 HD3 LYS 25 -0.946 -24.047 -15.145 194 HE2 LYS 25 HE2 LYS 25 -3.492 -23.877 -16.814 195 HE3 LYS 25 HE3 LYS 25 -1.903 -24.160 -17.536 196 HZ1 LYS 25 HZ1 LYS 25 -1.837 -26.284 -16.630 197 HZ2 LYS 25 HZ2 LYS 25 -2.900 -25.987 -15.424 198 HZ3 LYS 25 HZ3 LYS 25 -3.460 -26.123 -16.936 199 H GLU 26 H GLU 26 -4.528 -25.506 -13.126 200 HA GLU 26 HA GLU 26 -6.967 -23.928 -13.073 201 HB2 GLU 26 HB2 GLU 26 -6.292 -26.760 -13.993 202 HB3 GLU 26 HB3 GLU 26 -7.888 -26.031 -14.175 203 HG2 GLU 26 HG2 GLU 26 -7.061 -24.323 -15.654 204 HG3 GLU 26 HG3 GLU 26 -5.384 -24.728 -15.310 205 H GLU 27 H GLU 27 -5.797 -26.924 -11.504 206 HA GLU 27 HA GLU 27 -8.186 -27.489 -10.016 207 HB2 GLU 27 HB2 GLU 27 -5.283 -28.263 -9.503 208 HB3 GLU 27 HB3 GLU 27 -6.691 -28.993 -8.730 209 HG2 GLU 27 HG2 GLU 27 -6.047 -29.071 -11.712 210 HG3 GLU 27 HG3 GLU 27 -5.771 -30.373 -10.565 211 H ARG 28 H ARG 28 -5.260 -25.547 -9.367 212 HA ARG 28 HA ARG 28 -5.994 -24.966 -6.621 213 HB2 ARG 28 HB2 ARG 28 -3.944 -23.795 -8.559 214 HB3 ARG 28 HB3 ARG 28 -4.152 -23.210 -6.899 215 HG2 ARG 28 HG2 ARG 28 -3.830 -25.525 -6.054 216 HG3 ARG 28 HG3 ARG 28 -3.488 -26.085 -7.686 217 HD2 ARG 28 HD2 ARG 28 -1.451 -24.852 -7.787 218 HD3 ARG 28 HD3 ARG 28 -1.833 -23.957 -6.293 219 HE ARG 28 HE ARG 28 -1.962 -26.626 -5.564 220 HH11 ARG 28 HH11 ARG 28 0.644 -24.562 -6.885 221 HH12 ARG 28 HH12 ARG 28 1.891 -25.498 -6.124 222 HH21 ARG 28 HH21 ARG 28 -0.393 -27.846 -4.694 223 HH22 ARG 28 HH22 ARG 28 1.291 -27.421 -4.804 224 H ALA 29 H ALA 29 -6.716 -23.412 -9.745 225 HA ALA 29 HA ALA 29 -7.820 -21.020 -8.527 226 HB1 ALA 29 HB1 ALA 29 -8.823 -20.629 -10.700 227 HB2 ALA 29 HB2 ALA 29 -7.138 -21.122 -10.922 228 HB3 ALA 29 HB3 ALA 29 -8.454 -22.285 -11.225 229 H MET 30 H MET 30 -9.054 -24.310 -9.390 230 HA MET 30 HA MET 30 -11.741 -23.757 -8.537 231 HB2 MET 30 HB2 MET 30 -10.217 -26.371 -8.785 232 HB3 MET 30 HB3 MET 30 -11.924 -26.247 -8.367 233 HG2 MET 30 HG2 MET 30 -10.701 -25.136 -10.915 234 HG3 MET 30 HG3 MET 30 -11.512 -26.692 -10.764 235 HE1 MET 30 HE1 MET 30 -11.898 -22.802 -10.372 236 HE2 MET 30 HE2 MET 30 -12.190 -23.133 -12.083 237 HE3 MET 30 HE3 MET 30 -13.514 -22.557 -11.064 238 H GLY 31 H GLY 31 -8.882 -24.986 -6.720 239 HA2 GLY 31 HA2 GLY 31 -10.099 -25.382 -4.224 240 HA3 GLY 31 HA3 GLY 31 -8.451 -24.767 -4.459 241 H TRP 32 H TRP 32 -8.651 -22.315 -5.456 242 HA TRP 32 HA TRP 32 -9.517 -20.590 -3.454 243 HB2 TRP 32 HB2 TRP 32 -8.853 -20.239 -6.374 244 HB3 TRP 32 HB3 TRP 32 -9.580 -18.911 -5.490 245 HD1 TRP 32 HD1 TRP 32 -6.312 -20.835 -5.720 246 HE1 TRP 32 HE1 TRP 32 -4.494 -19.570 -4.460 247 HE3 TRP 32 HE3 TRP 32 -9.240 -17.298 -3.473 248 HZ2 TRP 32 HZ2 TRP 32 -4.361 -17.432 -2.496 249 HZ3 TRP 32 HZ3 TRP 32 -8.240 -15.673 -1.896 250 HH2 TRP 32 HH2 TRP 32 -5.815 -15.708 -1.428 251 H TYR 33 H TYR 33 -11.236 -21.469 -6.528 252 HA TYR 33 HA TYR 33 -13.484 -19.842 -6.157 253 HB2 TYR 33 HB2 TYR 33 -12.969 -20.988 -8.262 254 HB3 TYR 33 HB3 TYR 33 -13.251 -22.553 -7.515 255 HD1 TYR 33 HD2 TYR 33 -15.563 -23.235 -6.776 256 HD2 TYR 33 HD1 TYR 33 -14.819 -19.688 -9.106 257 HE1 TYR 33 HE2 TYR 33 -17.966 -23.094 -7.301 258 HE2 TYR 33 HE1 TYR 33 -17.189 -19.639 -9.791 259 HH TYR 33 HH TYR 33 -19.616 -21.982 -8.533 260 H TYR 34 H TYR 34 -12.981 -23.253 -5.037 261 HA TYR 34 HA TYR 34 -15.636 -23.624 -4.199 262 HB2 TYR 34 HB2 TYR 34 -13.097 -24.930 -3.143 263 HB3 TYR 34 HB3 TYR 34 -14.725 -25.481 -2.789 264 HD1 TYR 34 HD2 TYR 34 -16.066 -25.348 -5.483 265 HD2 TYR 34 HD1 TYR 34 -12.154 -26.748 -4.302 266 HE1 TYR 34 HE2 TYR 34 -16.013 -26.835 -7.445 267 HE2 TYR 34 HE1 TYR 34 -12.107 -28.265 -6.254 268 HH TYR 34 HH TYR 34 -14.801 -28.438 -8.631 269 H TYR 35 H TYR 35 -12.767 -22.633 -2.144 270 HA TYR 35 HA TYR 35 -14.563 -22.423 0.124 271 HB2 TYR 35 HB2 TYR 35 -12.799 -21.996 1.418 272 HB3 TYR 35 HB3 TYR 35 -11.898 -22.657 0.064 273 HD1 TYR 35 HD1 TYR 35 -10.802 -21.069 -1.561 274 HD2 TYR 35 HD2 TYR 35 -12.661 -19.670 2.066 275 HE1 TYR 35 HE1 TYR 35 -9.806 -18.851 -1.919 276 HE2 TYR 35 HE2 TYR 35 -11.668 -17.433 1.728 277 HH TYR 35 HH TYR 35 -10.392 -16.083 0.327 278 H LEU 36 H LEU 36 -13.387 -20.081 -2.342 279 HA LEU 36 HA LEU 36 -14.249 -17.764 -0.981 280 HB2 LEU 36 HB2 LEU 36 -12.676 -17.721 -2.859 281 HB3 LEU 36 HB3 LEU 36 -13.935 -18.296 -3.961 282 HG LEU 36 HG LEU 36 -15.213 -16.207 -3.622 283 HD11 LEU 36 HD11 LEU 36 -14.535 -15.551 -1.353 284 HD12 LEU 36 HD12 LEU 36 -12.846 -15.361 -1.884 285 HD13 LEU 36 HD13 LEU 36 -14.108 -14.267 -2.486 286 HD21 LEU 36 HD21 LEU 36 -13.707 -14.749 -4.864 287 HD22 LEU 36 HD22 LEU 36 -12.303 -15.728 -4.379 288 HD23 LEU 36 HD23 LEU 36 -13.556 -16.410 -5.438 289 H ASP 37 H ASP 37 -15.939 -19.728 -3.521 290 HA ASP 37 HA ASP 37 -18.313 -18.173 -3.620 291 HB2 ASP 37 HB2 ASP 37 -17.731 -19.887 -5.293 292 HB3 ASP 37 HB3 ASP 37 -17.888 -21.155 -4.075 293 H ASP 38 H ASP 38 -17.382 -20.921 -1.513 294 HA ASP 38 HA ASP 38 -19.865 -21.086 -0.098 295 HB2 ASP 38 HB2 ASP 38 -18.205 -22.887 -0.124 296 HB3 ASP 38 HB3 ASP 38 -17.051 -21.870 0.739 297 H THR 39 H THR 39 -17.205 -18.792 0.187 298 HA THR 39 HA THR 39 -17.978 -18.021 2.937 299 HB THR 39 HB THR 39 -15.696 -17.093 1.144 300 HG1 THR 39 HG1 THR 39 -15.407 -19.179 1.693 301 HG21 THR 39 HG21 THR 39 -16.069 -15.358 2.763 302 HG22 THR 39 HG22 THR 39 -16.352 -16.521 4.065 303 HG23 THR 39 HG23 THR 39 -14.723 -16.325 3.378 304 H LEU 40 H LEU 40 -18.023 -16.709 -0.402 305 HA LEU 40 HA LEU 40 -18.524 -14.007 0.250 306 HB2 LEU 40 HB2 LEU 40 -19.333 -15.673 -2.158 307 HB3 LEU 40 HB3 LEU 40 -19.661 -13.947 -2.047 308 HG LEU 40 HG LEU 40 -16.887 -15.177 -2.036 309 HD11 LEU 40 HD11 LEU 40 -18.047 -15.442 -4.191 310 HD12 LEU 40 HD12 LEU 40 -18.403 -13.702 -4.227 311 HD13 LEU 40 HD13 LEU 40 -16.725 -14.277 -4.323 312 HD21 LEU 40 HD21 LEU 40 -17.754 -12.293 -2.000 313 HD22 LEU 40 HD22 LEU 40 -16.645 -13.158 -0.885 314 HD23 LEU 40 HD23 LEU 40 -16.150 -12.828 -2.539 315 H GLU 41 H GLU 41 -20.137 -13.104 1.296 316 HA GLU 41 HA GLU 41 -22.749 -14.275 1.620 317 HB2 GLU 41 HB2 GLU 41 -21.457 -12.964 3.324 318 HB3 GLU 41 HB3 GLU 41 -21.591 -11.532 2.299 319 HG2 GLU 41 HG2 GLU 41 -23.172 -11.383 4.041 320 HG3 GLU 41 HG3 GLU 41 -24.062 -11.653 2.548 321 H PHE 42 H PHE 42 -22.471 -14.318 -0.984 322 HA PHE 42 HA PHE 42 -23.214 -11.876 -2.341 323 HB2 PHE 42 HB2 PHE 42 -23.264 -13.151 -4.355 324 HB3 PHE 42 HB3 PHE 42 -21.859 -13.622 -3.434 325 HD1 PHE 42 HD2 PHE 42 -25.266 -14.669 -4.536 326 HD2 PHE 42 HD1 PHE 42 -21.554 -15.943 -2.734 327 HE1 PHE 42 HE2 PHE 42 -25.951 -17.038 -4.783 328 HE2 PHE 42 HE1 PHE 42 -22.246 -18.301 -2.982 329 HZ PHE 42 HZ PHE 42 -24.446 -18.862 -4.002 330 HA PRO 43 HA PRO 43 -24.469 -11.272 -4.273 331 HB2 PRO 43 HB2 PRO 43 -26.443 -9.450 -4.691 332 HB3 PRO 43 HB3 PRO 43 -26.472 -11.085 -5.419 333 HG2 PRO 43 HG2 PRO 43 -27.895 -10.148 -2.912 334 HG3 PRO 43 HG3 PRO 43 -28.567 -11.084 -4.284 335 HD2 PRO 43 HD2 PRO 43 -27.693 -12.277 -1.975 336 HD3 PRO 43 HD3 PRO 43 -27.514 -13.066 -3.569 337 H PHE 44 H PHE 44 -23.530 -9.187 -4.070 338 HA PHE 44 HA PHE 44 -24.014 -7.574 -1.657 339 HB2 PHE 44 HB2 PHE 44 -21.760 -7.559 -0.928 340 HB3 PHE 44 HB3 PHE 44 -22.322 -9.213 -0.931 341 HD1 PHE 44 HD1 PHE 44 -21.502 -10.804 -2.784 342 HD2 PHE 44 HD2 PHE 44 -19.764 -6.933 -2.066 343 HE1 PHE 44 HE1 PHE 44 -19.448 -11.512 -3.966 344 HE2 PHE 44 HE2 PHE 44 -17.737 -7.617 -3.308 345 HZ PHE 44 HZ PHE 44 -17.559 -9.916 -4.240 346 H MET 45 H MET 45 -21.950 -5.694 -2.036 347 HA MET 45 HA MET 45 -22.154 -5.000 -4.912 348 HB2 MET 45 HB2 MET 45 -22.871 -2.836 -4.570 349 HB3 MET 45 HB3 MET 45 -23.956 -3.813 -3.602 350 HG2 MET 45 HG2 MET 45 -23.147 -2.991 -1.592 351 HG3 MET 45 HG3 MET 45 -21.544 -2.647 -2.218 352 HE1 MET 45 HE1 MET 45 -20.777 -0.615 -3.557 353 HE2 MET 45 HE2 MET 45 -21.977 -0.815 -4.842 354 HE3 MET 45 HE3 MET 45 -21.813 0.746 -4.014 355 H GLY 46 H GLY 46 -20.733 -3.280 -5.580 356 HA2 GLY 46 HA2 GLY 46 -18.391 -2.674 -3.923 357 HA3 GLY 46 HA3 GLY 46 -18.088 -3.849 -5.219 358 H LYS 47 H LYS 47 -16.645 -1.837 -5.458 359 HA LYS 47 HA LYS 47 -17.860 -0.244 -7.676 360 HB2 LYS 47 HB2 LYS 47 -16.918 1.044 -5.619 361 HB3 LYS 47 HB3 LYS 47 -15.336 0.479 -6.135 362 HG2 LYS 47 HG2 LYS 47 -15.496 2.597 -7.144 363 HG3 LYS 47 HG3 LYS 47 -15.964 1.513 -8.457 364 HD2 LYS 47 HD2 LYS 47 -17.563 3.244 -8.530 365 HD3 LYS 47 HD3 LYS 47 -18.396 1.916 -7.720 366 HE2 LYS 47 HE2 LYS 47 -18.076 2.935 -5.542 367 HE3 LYS 47 HE3 LYS 47 -17.019 4.180 -6.223 368 HZ1 LYS 47 HZ1 LYS 47 -18.875 5.113 -7.384 369 HZ2 LYS 47 HZ2 LYS 47 -19.876 3.890 -6.983 370 HZ3 LYS 47 HZ3 LYS 47 -19.332 4.927 -5.832 371 H TRP 48 H TRP 48 -17.198 -0.960 -9.600 372 HA TRP 48 HA TRP 48 -14.895 -2.771 -9.904 373 HB2 TRP 48 HB2 TRP 48 -17.038 -2.972 -11.215 374 HB3 TRP 48 HB3 TRP 48 -16.672 -1.443 -11.988 375 HD1 TRP 48 HD1 TRP 48 -13.403 -2.780 -12.086 376 HE1 TRP 48 HE1 TRP 48 -12.877 -4.179 -14.102 377 HE3 TRP 48 HE3 TRP 48 -18.191 -3.577 -13.735 378 HZ2 TRP 48 HZ2 TRP 48 -14.350 -5.617 -16.162 379 HZ3 TRP 48 HZ3 TRP 48 -18.586 -4.978 -15.743 380 HH2 TRP 48 HH2 TRP 48 -16.664 -6.014 -16.945 381 H LYS 49 H LYS 49 -12.987 -1.786 -9.576 382 HA LYS 49 HA LYS 49 -12.551 1.062 -10.117 383 HB2 LYS 49 HB2 LYS 49 -10.635 -1.095 -9.091 384 HB3 LYS 49 HB3 LYS 49 -10.408 0.643 -8.966 385 HG2 LYS 49 HG2 LYS 49 -12.529 -1.013 -7.524 386 HG3 LYS 49 HG3 LYS 49 -11.021 -0.480 -6.829 387 HD2 LYS 49 HD2 LYS 49 -13.205 1.398 -7.829 388 HD3 LYS 49 HD3 LYS 49 -13.030 0.870 -6.162 389 HE2 LYS 49 HE2 LYS 49 -10.957 2.490 -7.704 390 HE3 LYS 49 HE3 LYS 49 -12.111 3.121 -6.526 391 HZ1 LYS 49 HZ1 LYS 49 -10.072 2.785 -5.408 392 HZ2 LYS 49 HZ2 LYS 49 -11.071 1.601 -4.863 393 HZ3 LYS 49 HZ3 LYS 49 -9.894 1.256 -5.946 394 H LYS 50 H LYS 50 -13.121 0.201 -12.484 395 HA LYS 50 HA LYS 50 -11.479 -1.677 -13.825 396 HB2 LYS 50 HB2 LYS 50 -13.771 -1.010 -14.497 397 HB3 LYS 50 HB3 LYS 50 -13.168 0.575 -15.003 398 HG2 LYS 50 HG2 LYS 50 -11.717 -0.467 -16.682 399 HG3 LYS 50 HG3 LYS 50 -12.175 -2.084 -16.142 400 HD2 LYS 50 HD2 LYS 50 -14.091 -0.024 -17.340 401 HD3 LYS 50 HD3 LYS 50 -13.316 -1.335 -18.243 402 HE2 LYS 50 HE2 LYS 50 -14.390 -3.003 -16.734 403 HE3 LYS 50 HE3 LYS 50 -15.229 -1.697 -15.890 404 HZ1 LYS 50 HZ1 LYS 50 -15.575 -2.387 -18.753 405 HZ2 LYS 50 HZ2 LYS 50 -16.635 -2.711 -17.558 406 HZ3 LYS 50 HZ3 LYS 50 -16.345 -1.163 -17.989 407 H LYS 51 H LYS 51 -9.373 -1.513 -14.347 408 HA LYS 51 HA LYS 51 -8.131 1.143 -14.536 409 HB2 LYS 51 HB2 LYS 51 -7.140 -0.944 -13.400 410 HB3 LYS 51 HB3 LYS 51 -6.760 -1.524 -15.030 411 HG2 LYS 51 HG2 LYS 51 -5.364 0.475 -15.427 412 HG3 LYS 51 HG3 LYS 51 -5.876 1.170 -13.876 413 HD2 LYS 51 HD2 LYS 51 -4.790 -0.705 -12.676 414 HD3 LYS 51 HD3 LYS 51 -4.273 -1.400 -14.231 415 HE2 LYS 51 HE2 LYS 51 -2.992 0.663 -14.731 416 HE3 LYS 51 HE3 LYS 51 -3.526 1.380 -13.206 417 HZ1 LYS 51 HZ1 LYS 51 -2.329 -0.384 -12.037 418 HZ2 LYS 51 HZ2 LYS 51 -1.834 -1.045 -13.448 419 HZ3 LYS 51 HZ3 LYS 51 -1.313 0.434 -13.010 420 H SER 52 H SER 52 -9.497 -1.156 -16.776 421 HA SER 52 HA SER 52 -8.021 -0.646 -19.075 422 HB2 SER 52 HB2 SER 52 -11.016 -1.131 -19.005 423 HB3 SER 52 HB3 SER 52 -9.842 -1.650 -20.225 424 HG SER 52 HG SER 52 -10.389 -3.366 -18.841 425 H ARG 53 H ARG 53 -7.610 1.265 -20.023 426 HA ARG 53 HA ARG 53 -9.719 2.911 -21.031 427 HB2 ARG 53 HB2 ARG 53 -8.757 3.741 -18.506 428 HB3 ARG 53 HB3 ARG 53 -7.781 4.684 -19.624 429 HG2 ARG 53 HG2 ARG 53 -9.880 5.493 -20.737 430 HG3 ARG 53 HG3 ARG 53 -10.820 4.512 -19.606 431 HD2 ARG 53 HD2 ARG 53 -10.888 6.710 -18.777 432 HD3 ARG 53 HD3 ARG 53 -9.790 5.823 -17.705 433 HE ARG 53 HE ARG 53 -8.058 6.939 -19.495 434 HH11 ARG 53 HH11 ARG 53 -10.547 8.287 -17.329 435 HH12 ARG 53 HH12 ARG 53 -9.919 9.902 -17.423 436 HH21 ARG 53 HH21 ARG 53 -7.162 8.990 -19.481 437 HH22 ARG 53 HH22 ARG 53 -7.913 10.311 -18.646 438 H LYS 54 H LYS 54 -8.410 4.829 -22.321 439 HA LYS 54 HA LYS 54 -6.377 3.604 -23.949 440 HB2 LYS 54 HB2 LYS 54 -7.797 5.495 -24.701 441 HB3 LYS 54 HB3 LYS 54 -7.023 6.561 -23.517 442 HG2 LYS 54 HG2 LYS 54 -4.839 6.245 -24.646 443 HG3 LYS 54 HG3 LYS 54 -5.593 5.122 -25.796 444 HD2 LYS 54 HD2 LYS 54 -7.057 6.959 -26.623 445 HD3 LYS 54 HD3 LYS 54 -6.357 8.053 -25.426 446 HE2 LYS 54 HE2 LYS 54 -5.313 8.528 -27.525 447 HE3 LYS 54 HE3 LYS 54 -4.114 7.773 -26.476 448 HZ1 LYS 54 HZ1 LYS 54 -5.605 6.391 -28.638 449 HZ2 LYS 54 HZ2 LYS 54 -4.056 6.880 -28.723 450 HZ3 LYS 54 HZ3 LYS 54 -4.467 5.694 -27.689 451 H THR 55 H THR 55 -6.239 6.000 -21.260 452 HA THR 55 HA THR 55 -3.369 5.646 -20.836 453 HB THR 55 HB THR 55 -3.983 7.225 -18.904 454 HG1 THR 55 HG1 THR 55 -5.985 7.460 -18.533 455 HG21 THR 55 HG21 THR 55 -4.303 9.179 -20.332 456 HG22 THR 55 HG22 THR 55 -3.128 8.082 -21.076 457 HG23 THR 55 HG23 THR 55 -4.793 8.155 -21.698 458 H SER 56 H SER 56 -2.784 5.180 -18.382 459 HA SER 56 HA SER 56 -3.901 2.629 -17.611 460 HB2 SER 56 HB2 SER 56 -1.985 4.442 -16.092 461 HB3 SER 56 HB3 SER 56 -2.182 2.690 -15.911 462 HG SER 56 HG SER 56 -0.361 3.247 -17.197 463 H THR 57 H THR 57 -5.373 5.548 -17.249 464 HA THR 57 HA THR 57 -5.660 5.989 -14.522 465 HB THR 57 HB THR 57 -7.749 6.679 -16.590 466 HG1 THR 57 HG1 THR 57 -5.238 7.967 -16.303 467 HG21 THR 57 HG21 THR 57 -8.152 7.564 -14.339 468 HG22 THR 57 HG22 THR 57 -6.528 8.284 -14.305 469 HG23 THR 57 HG23 THR 57 -7.748 8.875 -15.456 470 H ILE 58 H ILE 58 -6.984 5.214 -12.956 471 HA ILE 58 HA ILE 58 -8.756 2.953 -13.359 472 HB ILE 58 HB ILE 58 -8.253 4.868 -11.060 473 HG12 ILE 58 HG12 ILE 58 -6.347 3.330 -11.686 474 HG13 ILE 58 HG13 ILE 58 -6.922 3.198 -10.036 475 HG21 ILE 58 HG21 ILE 58 -10.015 2.394 -11.068 476 HG22 ILE 58 HG22 ILE 58 -9.402 3.181 -9.594 477 HG23 ILE 58 HG23 ILE 58 -10.477 4.061 -10.681 478 HD11 ILE 58 HD11 ILE 58 -7.745 1.266 -12.238 479 HD12 ILE 58 HD12 ILE 58 -6.383 1.012 -11.131 480 HD13 ILE 58 HD13 ILE 58 -8.030 1.098 -10.492 481 H GLU 59 H GLU 59 -10.945 2.951 -13.480 482 HA GLU 59 HA GLU 59 -12.491 5.481 -13.364 483 HB2 GLU 59 HB2 GLU 59 -12.787 3.138 -15.308 484 HB3 GLU 59 HB3 GLU 59 -14.031 4.351 -15.054 485 HG2 GLU 59 HG2 GLU 59 -11.223 4.868 -16.119 486 HG3 GLU 59 HG3 GLU 59 -12.695 4.798 -17.076 487 H GLU 60 H GLU 60 -14.683 5.036 -12.506 488 HA GLU 60 HA GLU 60 -14.687 2.654 -10.696 489 HB2 GLU 60 HB2 GLU 60 -15.198 5.587 -10.060 490 HB3 GLU 60 HB3 GLU 60 -15.536 4.248 -8.964 491 HG2 GLU 60 HG2 GLU 60 -13.136 3.600 -9.008 492 HG3 GLU 60 HG3 GLU 60 -12.789 4.973 -10.062 493 H LYS 61 H LYS 61 -16.415 1.451 -11.243 494 HA LYS 61 HA LYS 61 -19.012 2.834 -11.878 495 HB2 LYS 61 HB2 LYS 61 -18.052 1.693 -13.815 496 HB3 LYS 61 HB3 LYS 61 -17.826 0.211 -12.872 497 HG2 LYS 61 HG2 LYS 61 -20.216 -0.099 -12.633 498 HG3 LYS 61 HG3 LYS 61 -20.551 1.430 -13.438 499 HD2 LYS 61 HD2 LYS 61 -18.946 -0.784 -14.794 500 HD3 LYS 61 HD3 LYS 61 -20.693 -0.846 -14.778 501 HE2 LYS 61 HE2 LYS 61 -19.038 1.440 -15.936 502 HE3 LYS 61 HE3 LYS 61 -19.793 0.139 -16.864 503 HZ1 LYS 61 HZ1 LYS 61 -21.170 2.112 -16.884 504 HZ2 LYS 61 HZ2 LYS 61 -21.970 0.920 -16.081 505 HZ3 LYS 61 HZ3 LYS 61 -21.271 2.127 -15.247 506 H THR 62 H THR 62 -20.542 2.527 -10.275 507 HA THR 62 HA THR 62 -20.098 0.652 -8.146 508 HB THR 62 HB THR 62 -22.723 2.015 -8.840 509 HG1 THR 62 HG1 THR 62 -21.940 3.882 -8.171 510 HG21 THR 62 HG21 THR 62 -22.639 0.483 -6.856 511 HG22 THR 62 HG22 THR 62 -21.315 1.460 -6.186 512 HG23 THR 62 HG23 THR 62 -22.936 2.167 -6.391 513 H VAL 63 H VAL 63 -20.757 -1.434 -7.966 514 HA VAL 63 HA VAL 63 -22.685 -2.511 -9.971 515 HB VAL 63 HB VAL 63 -21.176 -4.445 -10.292 516 HG11 VAL 63 HG11 VAL 63 -21.247 -2.572 -11.940 517 HG12 VAL 63 HG12 VAL 63 -19.822 -1.859 -11.153 518 HG13 VAL 63 HG13 VAL 63 -19.709 -3.448 -11.919 519 HG21 VAL 63 HG21 VAL 63 -19.004 -2.764 -8.962 520 HG22 VAL 63 HG22 VAL 63 -19.723 -4.240 -8.283 521 HG23 VAL 63 HG23 VAL 63 -18.785 -4.322 -9.779 522 H GLU 64 H GLU 64 -23.822 -4.349 -9.365 523 HA GLU 64 HA GLU 64 -23.704 -5.080 -6.470 524 HB2 GLU 64 HB2 GLU 64 -25.917 -4.357 -7.394 525 HB3 GLU 64 HB3 GLU 64 -25.866 -5.716 -8.522 526 HG2 GLU 64 HG2 GLU 64 -25.793 -7.293 -6.605 527 HG3 GLU 64 HG3 GLU 64 -25.730 -5.932 -5.483 528 H VAL 65 H VAL 65 -22.513 -6.897 -6.123 529 HA VAL 65 HA VAL 65 -21.561 -8.480 -8.424 530 HB VAL 65 HB VAL 65 -20.741 -8.655 -5.492 531 HG11 VAL 65 HG11 VAL 65 -18.713 -9.739 -6.509 532 HG12 VAL 65 HG12 VAL 65 -20.195 -10.637 -6.867 533 HG13 VAL 65 HG13 VAL 65 -19.469 -9.589 -8.106 534 HG21 VAL 65 HG21 VAL 65 -19.457 -7.023 -7.730 535 HG22 VAL 65 HG22 VAL 65 -20.179 -6.385 -6.236 536 HG23 VAL 65 HG23 VAL 65 -18.713 -7.358 -6.152 537 H LEU 66 H LEU 66 -22.889 -10.079 -9.000 538 HA LEU 66 HA LEU 66 -25.139 -10.763 -7.297 539 HB2 LEU 66 HB2 LEU 66 -24.319 -11.932 -9.981 540 HB3 LEU 66 HB3 LEU 66 -25.888 -12.091 -9.202 541 HG LEU 66 HG LEU 66 -24.661 -9.542 -10.340 542 HD11 LEU 66 HD11 LEU 66 -25.551 -11.150 -11.988 543 HD12 LEU 66 HD12 LEU 66 -27.117 -11.151 -11.153 544 HD13 LEU 66 HD13 LEU 66 -26.520 -9.669 -11.927 545 HD21 LEU 66 HD21 LEU 66 -25.942 -8.901 -8.365 546 HD22 LEU 66 HD22 LEU 66 -26.847 -8.464 -9.810 547 HD23 LEU 66 HD23 LEU 66 -27.317 -9.905 -8.882 548 H GLY 67 H GLY 67 -22.073 -12.337 -8.191 549 HA2 GLY 67 HA2 GLY 67 -21.819 -14.163 -6.188 550 HA3 GLY 67 HA3 GLY 67 -22.851 -14.983 -7.384 551 H MET 68 H MET 68 -20.615 -16.225 -7.214 552 HA MET 68 HA MET 68 -18.414 -15.249 -8.828 553 HB2 MET 68 HB2 MET 68 -19.268 -18.074 -8.052 554 HB3 MET 68 HB3 MET 68 -17.798 -17.682 -8.937 555 HG2 MET 68 HG2 MET 68 -18.464 -16.724 -6.136 556 HG3 MET 68 HG3 MET 68 -17.372 -18.041 -6.542 557 HE1 MET 68 HE1 MET 68 -15.675 -16.983 -9.007 558 HE2 MET 68 HE2 MET 68 -14.308 -16.259 -8.152 559 HE3 MET 68 HE3 MET 68 -14.987 -17.795 -7.576 560 H ALA 69 H ALA 69 -17.859 -15.823 -10.933 561 HA ALA 69 HA ALA 69 -19.999 -16.164 -12.883 562 HB1 ALA 69 HB1 ALA 69 -16.970 -16.319 -13.153 563 HB2 ALA 69 HB2 ALA 69 -18.119 -16.049 -14.472 564 HB3 ALA 69 HB3 ALA 69 -17.915 -14.809 -13.237 565 HA PRO 70 HA PRO 70 -19.906 -20.639 -13.412 566 HB2 PRO 70 HB2 PRO 70 -18.626 -20.203 -16.117 567 HB3 PRO 70 HB3 PRO 70 -19.959 -21.315 -15.669 568 HG2 PRO 70 HG2 PRO 70 -20.528 -18.960 -16.870 569 HG3 PRO 70 HG3 PRO 70 -21.504 -19.490 -15.459 570 HD2 PRO 70 HD2 PRO 70 -19.220 -17.521 -15.541 571 HD3 PRO 70 HD3 PRO 70 -20.787 -17.380 -14.685 572 H ASP 71 H ASP 71 -18.494 -22.357 -13.052 573 HA ASP 71 HA ASP 71 -15.935 -21.801 -12.057 574 HB2 ASP 71 HB2 ASP 71 -15.643 -24.097 -11.751 575 HB3 ASP 71 HB3 ASP 71 -17.367 -23.825 -11.532 576 H ASP 72 H ASP 72 -16.953 -22.595 -15.339 577 HA ASP 72 HA ASP 72 -14.404 -23.340 -16.401 578 HB2 ASP 72 HB2 ASP 72 -16.529 -23.834 -17.526 579 HB3 ASP 72 HB3 ASP 72 -16.838 -22.109 -17.749 580 H GLU 73 H GLU 73 -15.928 -20.159 -15.842 581 HA GLU 73 HA GLU 73 -13.863 -18.655 -17.296 582 HB2 GLU 73 HB2 GLU 73 -15.827 -17.743 -15.136 583 HB3 GLU 73 HB3 GLU 73 -14.828 -16.703 -16.132 584 HG2 GLU 73 HG2 GLU 73 -17.132 -18.459 -17.065 585 HG3 GLU 73 HG3 GLU 73 -17.132 -16.708 -16.918 586 H CYS 74 H CYS 74 -14.596 -19.771 -14.000 587 HA CYS 74 HA CYS 74 -12.494 -18.250 -12.808 588 HB2 CYS 74 HB2 CYS 74 -14.229 -20.436 -11.622 589 HB3 CYS 74 HB3 CYS 74 -13.204 -19.299 -10.725 590 HG CYS 74 HG CYS 74 -15.851 -18.747 -12.637 591 H LEU 75 H LEU 75 -11.750 -20.518 -14.795 592 HA LEU 75 HA LEU 75 -10.144 -22.356 -13.183 593 HB2 LEU 75 HB2 LEU 75 -10.344 -21.826 -16.175 594 HB3 LEU 75 HB3 LEU 75 -9.225 -23.000 -15.496 595 HG LEU 75 HG LEU 75 -12.234 -23.144 -15.131 596 HD11 LEU 75 HD11 LEU 75 -12.171 -24.958 -16.784 597 HD12 LEU 75 HD12 LEU 75 -11.613 -23.434 -17.487 598 HD13 LEU 75 HD13 LEU 75 -10.431 -24.682 -17.038 599 HD21 LEU 75 HD21 LEU 75 -11.856 -25.429 -14.363 600 HD22 LEU 75 HD22 LEU 75 -10.103 -25.268 -14.619 601 HD23 LEU 75 HD23 LEU 75 -10.914 -24.348 -13.346 602 H LYS 76 H LYS 76 -9.691 -19.106 -14.075 603 HA LYS 76 HA LYS 76 -6.777 -19.366 -13.561 604 HB2 LYS 76 HB2 LYS 76 -6.242 -17.889 -15.420 605 HB3 LYS 76 HB3 LYS 76 -7.011 -19.377 -15.970 606 HG2 LYS 76 HG2 LYS 76 -9.172 -18.140 -16.261 607 HG3 LYS 76 HG3 LYS 76 -8.391 -16.663 -15.687 608 HD2 LYS 76 HD2 LYS 76 -8.515 -16.579 -18.076 609 HD3 LYS 76 HD3 LYS 76 -6.816 -16.749 -17.608 610 HE2 LYS 76 HE2 LYS 76 -6.922 -19.183 -18.118 611 HE3 LYS 76 HE3 LYS 76 -8.634 -19.027 -18.533 612 HZ1 LYS 76 HZ1 LYS 76 -6.404 -17.707 -19.974 613 HZ2 LYS 76 HZ2 LYS 76 -7.236 -19.004 -20.499 614 HZ3 LYS 76 HZ3 LYS 76 -7.987 -17.567 -20.361 615 H ASP 77 H ASP 77 -9.703 -17.388 -13.293 616 HA ASP 77 HA ASP 77 -8.310 -15.593 -11.410 617 HB2 ASP 77 HB2 ASP 77 -7.977 -14.476 -13.581 618 HB3 ASP 77 HB3 ASP 77 -9.686 -14.652 -13.964 619 H MET 78 H MET 78 -9.905 -14.612 -9.973 620 HA MET 78 HA MET 78 -12.367 -16.179 -9.778 621 HB2 MET 78 HB2 MET 78 -11.186 -13.951 -8.075 622 HB3 MET 78 HB3 MET 78 -12.698 -14.776 -7.712 623 HG2 MET 78 HG2 MET 78 -9.950 -16.075 -7.877 624 HG3 MET 78 HG3 MET 78 -10.841 -15.686 -6.418 625 HE1 MET 78 HE1 MET 78 -9.734 -18.494 -8.553 626 HE2 MET 78 HE2 MET 78 -11.162 -19.480 -8.926 627 HE3 MET 78 HE3 MET 78 -10.935 -17.923 -9.733 628 H TYR 79 H TYR 79 -13.426 -15.588 -11.737 629 HA TYR 79 HA TYR 79 -14.216 -12.808 -12.188 630 HB2 TYR 79 HB2 TYR 79 -14.882 -15.472 -13.483 631 HB3 TYR 79 HB3 TYR 79 -15.731 -13.994 -13.902 632 HD1 TYR 79 HD1 TYR 79 -14.534 -12.055 -14.924 633 HD2 TYR 79 HD2 TYR 79 -12.659 -15.901 -14.371 634 HE1 TYR 79 HE1 TYR 79 -12.858 -11.482 -16.652 635 HE2 TYR 79 HE2 TYR 79 -10.976 -15.340 -16.087 636 HH TYR 79 HH TYR 79 -10.214 -13.727 -17.601 637 H VAL 80 H VAL 80 -16.300 -11.970 -11.889 638 HA VAL 80 HA VAL 80 -18.280 -13.612 -10.379 639 HB VAL 80 HB VAL 80 -18.756 -11.523 -9.088 640 HG11 VAL 80 HG11 VAL 80 -16.000 -12.743 -8.663 641 HG12 VAL 80 HG12 VAL 80 -16.935 -11.823 -7.463 642 HG13 VAL 80 HG13 VAL 80 -17.549 -13.365 -8.056 643 HG21 VAL 80 HG21 VAL 80 -17.054 -9.791 -8.834 644 HG22 VAL 80 HG22 VAL 80 -16.017 -10.566 -10.041 645 HG23 VAL 80 HG23 VAL 80 -17.576 -9.858 -10.521 646 H GLU 81 H GLU 81 -20.449 -13.062 -10.741 647 HA GLU 81 HA GLU 81 -21.025 -11.659 -13.302 648 HB2 GLU 81 HB2 GLU 81 -22.801 -13.090 -11.271 649 HB3 GLU 81 HB3 GLU 81 -23.390 -12.246 -12.716 650 HG2 GLU 81 HG2 GLU 81 -21.929 -13.764 -14.112 651 HG3 GLU 81 HG3 GLU 81 -21.567 -14.676 -12.645 652 H VAL 82 H VAL 82 -22.072 -9.641 -13.342 653 HA VAL 82 HA VAL 82 -22.403 -8.228 -10.775 654 HB VAL 82 HB VAL 82 -20.094 -8.152 -12.526 655 HG11 VAL 82 HG11 VAL 82 -19.755 -5.785 -12.885 656 HG12 VAL 82 HG12 VAL 82 -21.109 -6.413 -13.833 657 HG13 VAL 82 HG13 VAL 82 -21.426 -5.445 -12.374 658 HG21 VAL 82 HG21 VAL 82 -20.784 -6.664 -9.985 659 HG22 VAL 82 HG22 VAL 82 -19.941 -8.219 -10.144 660 HG23 VAL 82 HG23 VAL 82 -19.170 -6.740 -10.731 661 H ALA 83 H ALA 83 -23.857 -6.588 -10.884 662 HA ALA 83 HA ALA 83 -25.166 -6.060 -13.530 663 HB1 ALA 83 HB1 ALA 83 -27.201 -5.532 -12.314 664 HB2 ALA 83 HB2 ALA 83 -26.679 -7.184 -11.941 665 HB3 ALA 83 HB3 ALA 83 -26.404 -5.881 -10.761 666 H ASP 84 H ASP 84 -25.246 -3.968 -14.195 667 HA ASP 84 HA ASP 84 -23.354 -2.159 -12.910 668 HB2 ASP 84 HB2 ASP 84 -23.309 -2.561 -15.315 669 HB3 ASP 84 HB3 ASP 84 -24.966 -1.954 -15.464 670 H ILE 85 H ILE 85 -24.941 -2.111 -10.991 671 HA ILE 85 HA ILE 85 -27.268 -0.484 -11.112 672 HB ILE 85 HB ILE 85 -27.050 -0.237 -8.703 673 HG12 ILE 85 HG12 ILE 85 -24.389 -1.663 -8.907 674 HG13 ILE 85 HG13 ILE 85 -24.571 0.058 -8.577 675 HG21 ILE 85 HG21 ILE 85 -26.365 -3.085 -9.551 676 HG22 ILE 85 HG22 ILE 85 -27.353 -2.568 -8.167 677 HG23 ILE 85 HG23 ILE 85 -27.947 -2.319 -9.805 678 HD11 ILE 85 HD11 ILE 85 -25.587 -2.186 -6.782 679 HD12 ILE 85 HD12 ILE 85 -24.169 -1.181 -6.505 680 HD13 ILE 85 HD13 ILE 85 -25.785 -0.444 -6.488 681 H GLY 86 H GLY 86 -23.959 0.477 -11.433 682 HA2 GLY 86 HA2 GLY 86 -24.393 3.285 -10.730 683 HA3 GLY 86 HA3 GLY 86 -22.937 2.526 -11.393 684 H GLY 87 H GLY 87 -25.243 1.380 -13.452 685 HA2 GLY 87 HA2 GLY 87 -25.465 3.774 -15.195 686 HA3 GLY 87 HA3 GLY 87 -24.477 2.409 -15.730 687 H LYS 88 H LYS 88 -25.483 0.477 -16.395 688 HA LYS 88 HA LYS 88 -27.972 0.884 -17.676 689 HB2 LYS 88 HB2 LYS 88 -26.681 -1.804 -17.028 690 HB3 LYS 88 HB3 LYS 88 -27.905 -1.503 -18.260 691 HG2 LYS 88 HG2 LYS 88 -25.079 -0.408 -18.299 692 HG3 LYS 88 HG3 LYS 88 -25.695 -1.788 -19.207 693 HD2 LYS 88 HD2 LYS 88 -27.309 -0.288 -20.399 694 HD3 LYS 88 HD3 LYS 88 -26.673 1.089 -19.480 695 HE2 LYS 88 HE2 LYS 88 -25.545 1.167 -21.538 696 HE3 LYS 88 HE3 LYS 88 -24.393 0.556 -20.335 697 HZ1 LYS 88 HZ1 LYS 88 -25.858 -1.108 -22.304 698 HZ2 LYS 88 HZ2 LYS 88 -24.285 -0.701 -22.397 699 HZ3 LYS 88 HZ3 LYS 88 -24.794 -1.683 -21.193 700 H ASP 89 H ASP 89 -27.316 -0.571 -14.567 701 HA ASP 89 HA ASP 89 -28.435 -1.325 -12.858 702 HB2 ASP 89 HB2 ASP 89 -29.289 0.948 -12.852 703 HB3 ASP 89 HB3 ASP 89 -30.634 0.479 -13.895 704 H ASP 90 H ASP 90 -30.163 -1.881 -15.835 705 HA ASP 90 HA ASP 90 -31.753 -4.081 -14.632 706 HB2 ASP 90 HB2 ASP 90 -32.860 -2.107 -15.706 707 HB3 ASP 90 HB3 ASP 90 -32.051 -2.529 -17.219 708 H ASP 91 H ASP 91 -28.822 -3.951 -15.913 709 HA ASP 91 HA ASP 91 -29.125 -6.498 -17.395 710 HB2 ASP 91 HB2 ASP 91 -28.946 -4.503 -19.005 711 HB3 ASP 91 HB3 ASP 91 -27.280 -4.342 -18.421 712 H VAL 92 H VAL 92 -27.062 -7.591 -17.694 713 HA VAL 92 HA VAL 92 -25.326 -7.348 -15.289 714 HB VAL 92 HB VAL 92 -26.643 -9.823 -16.487 715 HG11 VAL 92 HG11 VAL 92 -25.002 -9.628 -13.935 716 HG12 VAL 92 HG12 VAL 92 -25.848 -11.063 -14.540 717 HG13 VAL 92 HG13 VAL 92 -24.485 -10.413 -15.442 718 HG21 VAL 92 HG21 VAL 92 -27.912 -9.925 -14.320 719 HG22 VAL 92 HG22 VAL 92 -27.278 -8.314 -13.920 720 HG23 VAL 92 HG23 VAL 92 -28.348 -8.543 -15.318 721 H TYR 93 H TYR 93 -23.231 -7.996 -15.528 722 HA TYR 93 HA TYR 93 -22.184 -8.985 -18.121 723 HB2 TYR 93 HB2 TYR 93 -21.067 -6.683 -16.451 724 HB3 TYR 93 HB3 TYR 93 -20.326 -7.356 -17.894 725 HD1 TYR 93 HD1 TYR 93 -21.402 -7.080 -20.139 726 HD2 TYR 93 HD2 TYR 93 -22.882 -5.063 -16.622 727 HE1 TYR 93 HE1 TYR 93 -22.678 -5.529 -21.576 728 HE2 TYR 93 HE2 TYR 93 -24.177 -3.512 -18.047 729 HH TYR 93 HH TYR 93 -24.145 -3.785 -21.653 730 H THR 94 H THR 94 -19.585 -9.286 -17.458 731 HA THR 94 HA THR 94 -19.476 -10.650 -14.815 732 HB THR 94 HB THR 94 -17.959 -11.498 -17.310 733 HG1 THR 94 HG1 THR 94 -20.176 -11.895 -17.558 734 HG21 THR 94 HG21 THR 94 -18.435 -12.938 -14.661 735 HG22 THR 94 HG22 THR 94 -17.504 -13.556 -16.044 736 HG23 THR 94 HG23 THR 94 -16.915 -12.156 -15.137 737 H ALA 95 H ALA 95 -17.586 -10.218 -13.662 738 HA ALA 95 HA ALA 95 -15.692 -8.211 -14.766 739 HB1 ALA 95 HB1 ALA 95 -15.873 -6.915 -12.666 740 HB2 ALA 95 HB2 ALA 95 -17.443 -6.984 -13.489 741 HB3 ALA 95 HB3 ALA 95 -17.134 -8.022 -12.080 742 H LYS 96 H LYS 96 -13.691 -8.145 -13.574 743 HA LYS 96 HA LYS 96 -12.895 -10.780 -12.476 744 HB2 LYS 96 HB2 LYS 96 -11.264 -8.212 -12.732 745 HB3 LYS 96 HB3 LYS 96 -10.683 -9.792 -12.272 746 HG2 LYS 96 HG2 LYS 96 -9.951 -9.425 -14.466 747 HG3 LYS 96 HG3 LYS 96 -11.185 -10.665 -14.534 748 HD2 LYS 96 HD2 LYS 96 -11.250 -9.043 -16.433 749 HD3 LYS 96 HD3 LYS 96 -12.757 -9.178 -15.564 750 HE2 LYS 96 HE2 LYS 96 -12.471 -6.871 -16.043 751 HE3 LYS 96 HE3 LYS 96 -12.188 -7.048 -14.313 752 HZ1 LYS 96 HZ1 LYS 96 -10.555 -5.627 -15.171 753 HZ2 LYS 96 HZ2 LYS 96 -9.751 -7.028 -14.890 754 HZ3 LYS 96 HZ3 LYS 96 -10.162 -6.622 -16.421 755 H LEU 97 H LEU 97 -12.998 -11.148 -10.211 756 HA LEU 97 HA LEU 97 -13.820 -9.097 -8.386 757 HB2 LEU 97 HB2 LEU 97 -13.995 -11.557 -7.964 758 HB3 LEU 97 HB3 LEU 97 -12.230 -11.643 -7.873 759 HG LEU 97 HG LEU 97 -12.258 -10.160 -5.879 760 HD11 LEU 97 HD11 LEU 97 -14.305 -8.866 -6.237 761 HD12 LEU 97 HD12 LEU 97 -15.296 -10.342 -6.210 762 HD13 LEU 97 HD13 LEU 97 -14.486 -9.772 -4.743 763 HD21 LEU 97 HD21 LEU 97 -13.073 -11.855 -4.352 764 HD22 LEU 97 HD22 LEU 97 -14.105 -12.562 -5.619 765 HD23 LEU 97 HD23 LEU 97 -12.332 -12.652 -5.734 766 H SER 98 H SER 98 -10.695 -10.237 -9.578 767 HA SER 98 HA SER 98 -8.820 -8.886 -8.105 768 HB2 SER 98 HB2 SER 98 -8.857 -9.320 -11.116 769 HB3 SER 98 HB3 SER 98 -7.442 -9.274 -10.064 770 HG SER 98 HG SER 98 -8.449 -11.439 -10.715 771 H ASP 99 H ASP 99 -11.236 -7.389 -10.093 772 HA ASP 99 HA ASP 99 -9.697 -4.861 -10.290 773 HB2 ASP 99 HB2 ASP 99 -10.113 -6.291 -12.377 774 HB3 ASP 99 HB3 ASP 99 -11.825 -5.905 -12.192 775 H ILE 100 H ILE 100 -11.746 -6.100 -8.334 776 HA ILE 100 HA ILE 100 -13.644 -3.801 -8.233 777 HB ILE 100 HB ILE 100 -14.048 -6.744 -8.149 778 HG12 ILE 100 HG12 ILE 100 -15.908 -4.427 -8.799 779 HG13 ILE 100 HG13 ILE 100 -14.786 -5.164 -9.964 780 HG21 ILE 100 HG21 ILE 100 -14.673 -6.264 -5.800 781 HG22 ILE 100 HG22 ILE 100 -15.854 -5.061 -6.379 782 HG23 ILE 100 HG23 ILE 100 -16.032 -6.783 -6.770 783 HD11 ILE 100 HD11 ILE 100 -16.954 -6.052 -10.363 784 HD12 ILE 100 HD12 ILE 100 -15.991 -7.351 -9.621 785 HD13 ILE 100 HD13 ILE 100 -17.199 -6.453 -8.658 786 H GLU 101 H GLU 101 -14.306 -3.130 -6.276 787 HA GLU 101 HA GLU 101 -12.708 -3.858 -3.865 788 HB2 GLU 101 HB2 GLU 101 -12.080 -1.641 -4.769 789 HB3 GLU 101 HB3 GLU 101 -13.777 -1.129 -4.732 790 HG2 GLU 101 HG2 GLU 101 -13.793 -1.505 -2.254 791 HG3 GLU 101 HG3 GLU 101 -12.079 -1.919 -2.327 792 H ALA 102 H ALA 102 -14.060 -4.800 -2.399 793 HA ALA 102 HA ALA 102 -16.939 -4.860 -2.892 794 HB1 ALA 102 HB1 ALA 102 -16.988 -6.398 -1.009 795 HB2 ALA 102 HB2 ALA 102 -15.640 -6.822 -2.082 796 HB3 ALA 102 HB3 ALA 102 -15.323 -5.975 -0.552 797 H ILE 103 H ILE 103 -18.496 -3.820 -1.759 798 HA ILE 103 HA ILE 103 -17.728 -1.934 0.429 799 HB ILE 103 HB ILE 103 -19.415 -1.519 -2.051 800 HG12 ILE 103 HG12 ILE 103 -17.010 0.041 -0.991 801 HG13 ILE 103 HG13 ILE 103 -16.913 -1.209 -2.230 802 HG21 ILE 103 HG21 ILE 103 -19.180 0.390 0.316 803 HG22 ILE 103 HG22 ILE 103 -19.999 0.737 -1.224 804 HG23 ILE 103 HG23 ILE 103 -20.644 -0.497 -0.174 805 HD11 ILE 103 HD11 ILE 103 -18.444 0.088 -3.677 806 HD12 ILE 103 HD12 ILE 103 -18.355 1.433 -2.507 807 HD13 ILE 103 HD13 ILE 103 -16.888 0.881 -3.326 808 H ASP 104 H ASP 104 -19.110 -1.818 2.115 809 HA ASP 104 HA ASP 104 -20.724 -2.343 3.563 810 HB2 ASP 104 HB2 ASP 104 -21.840 -0.756 2.042 811 HB3 ASP 104 HB3 ASP 104 -22.516 -2.105 1.128 812 H VAL 105 H VAL 105 -19.372 -4.645 2.630 813 HA VAL 105 HA VAL 105 -21.515 -6.707 2.790 814 HB VAL 105 HB VAL 105 -19.987 -6.560 0.761 815 HG11 VAL 105 HG11 VAL 105 -17.814 -6.222 1.850 816 HG12 VAL 105 HG12 VAL 105 -17.937 -7.832 2.588 817 HG13 VAL 105 HG13 VAL 105 -17.831 -7.667 0.830 818 HG21 VAL 105 HG21 VAL 105 -20.014 -8.887 0.416 819 HG22 VAL 105 HG22 VAL 105 -20.128 -9.230 2.154 820 HG23 VAL 105 HG23 VAL 105 -21.468 -8.442 1.314 821 H ASP 106 H ASP 106 -20.735 -8.797 3.906 822 HA ASP 106 HA ASP 106 -20.208 -8.222 6.659 823 HB2 ASP 106 HB2 ASP 106 -21.525 -10.166 5.902 824 HB3 ASP 106 HB3 ASP 106 -20.081 -10.833 5.116 825 H ASP 107 H ASP 107 -18.435 -8.908 7.903 826 HA ASP 107 HA ASP 107 -15.917 -8.030 6.973 827 HB2 ASP 107 HB2 ASP 107 -16.558 -8.021 9.333 828 HB3 ASP 107 HB3 ASP 107 -16.646 -9.785 9.348 829 H ASP 108 H ASP 108 -17.198 -11.428 7.206 830 HA ASP 108 HA ASP 108 -14.565 -12.490 6.623 831 HB2 ASP 108 HB2 ASP 108 -16.539 -13.657 7.846 832 HB3 ASP 108 HB3 ASP 108 -17.157 -14.004 6.221 833 H THR 109 H THR 109 -17.223 -11.300 4.714 834 HA THR 109 HA THR 109 -16.454 -12.613 2.197 835 HB THR 109 HB THR 109 -18.361 -10.294 2.811 836 HG1 THR 109 HG1 THR 109 -18.806 -12.465 3.679 837 HG21 THR 109 HG21 THR 109 -19.418 -11.058 0.633 838 HG22 THR 109 HG22 THR 109 -17.875 -10.178 0.467 839 HG23 THR 109 HG23 THR 109 -17.922 -11.938 0.319 840 H GLN 110 H GLN 110 -16.204 -9.316 3.700 841 HA GLN 110 HA GLN 110 -14.704 -8.174 1.602 842 HB2 GLN 110 HB2 GLN 110 -15.869 -7.155 3.759 843 HB3 GLN 110 HB3 GLN 110 -14.289 -7.371 4.501 844 HG2 GLN 110 HG2 GLN 110 -14.941 -5.758 1.988 845 HG3 GLN 110 HG3 GLN 110 -14.634 -5.095 3.585 846 HE21 GLN 110 HE22 GLN 110 -13.166 -5.957 0.610 847 HE22 GLN 110 HE21 GLN 110 -11.501 -5.902 1.126 848 H GLU 111 H GLU 111 -13.609 -9.874 4.605 849 HA GLU 111 HA GLU 111 -10.838 -9.603 4.103 850 HB2 GLU 111 HB2 GLU 111 -12.471 -11.616 5.689 851 HB3 GLU 111 HB3 GLU 111 -10.714 -11.687 5.626 852 HG2 GLU 111 HG2 GLU 111 -12.226 -9.195 6.539 853 HG3 GLU 111 HG3 GLU 111 -11.694 -10.473 7.624 854 H ALA 112 H ALA 112 -13.126 -12.222 3.032 855 HA ALA 112 HA ALA 112 -11.081 -13.862 1.915 856 HB1 ALA 112 HB1 ALA 112 -13.388 -14.650 2.291 857 HB2 ALA 112 HB2 ALA 112 -13.983 -13.555 1.018 858 HB3 ALA 112 HB3 ALA 112 -12.894 -14.897 0.608 859 H ILE 113 H ILE 113 -12.901 -11.105 0.558 860 HA ILE 113 HA ILE 113 -11.845 -11.371 -2.105 861 HB ILE 113 HB ILE 113 -13.189 -9.094 -0.596 862 HG12 ILE 113 HG12 ILE 113 -14.294 -10.927 -2.779 863 HG13 ILE 113 HG13 ILE 113 -14.461 -11.292 -1.085 864 HG21 ILE 113 HG21 ILE 113 -13.580 -8.070 -2.865 865 HG22 ILE 113 HG22 ILE 113 -11.892 -8.063 -2.372 866 HG23 ILE 113 HG23 ILE 113 -12.453 -9.262 -3.549 867 HD11 ILE 113 HD11 ILE 113 -15.668 -8.957 -2.557 868 HD12 ILE 113 HD12 ILE 113 -16.479 -10.287 -1.716 869 HD13 ILE 113 HD13 ILE 113 -15.616 -9.058 -0.773 870 H ALA 114 H ALA 114 -10.901 -9.347 0.746 871 HA ALA 114 HA ALA 114 -8.679 -8.070 -0.487 872 HB1 ALA 114 HB1 ALA 114 -9.086 -8.854 2.434 873 HB2 ALA 114 HB2 ALA 114 -7.924 -7.663 1.820 874 HB3 ALA 114 HB3 ALA 114 -9.665 -7.356 1.669 875 H ASP 115 H ASP 115 -8.998 -11.232 1.130 876 HA ASP 115 HA ASP 115 -6.253 -11.900 1.217 877 HB2 ASP 115 HB2 ASP 115 -8.093 -12.995 2.489 878 HB3 ASP 115 HB3 ASP 115 -8.601 -13.806 1.009 879 H TRP 116 H TRP 116 -8.727 -12.509 -1.313 880 HA TRP 116 HA TRP 116 -6.975 -13.882 -3.145 881 HB2 TRP 116 HB2 TRP 116 -9.323 -14.087 -3.510 882 HB3 TRP 116 HB3 TRP 116 -9.570 -12.348 -3.463 883 HD1 TRP 116 HD1 TRP 116 -9.597 -11.094 -5.671 884 HE1 TRP 116 HE1 TRP 116 -8.985 -11.582 -8.123 885 HE3 TRP 116 HE3 TRP 116 -7.509 -15.737 -5.116 886 HZ2 TRP 116 HZ2 TRP 116 -7.825 -13.712 -9.639 887 HZ3 TRP 116 HZ3 TRP 116 -6.686 -16.988 -7.080 888 HH2 TRP 116 HH2 TRP 116 -6.824 -15.982 -9.358 889 H LEU 117 H LEU 117 -7.849 -10.413 -2.717 890 HA LEU 117 HA LEU 117 -6.441 -9.516 -5.010 891 HB2 LEU 117 HB2 LEU 117 -7.257 -8.141 -2.426 892 HB3 LEU 117 HB3 LEU 117 -6.432 -7.273 -3.712 893 HG LEU 117 HG LEU 117 -9.017 -8.801 -4.232 894 HD11 LEU 117 HD11 LEU 117 -8.694 -5.871 -3.452 895 HD12 LEU 117 HD12 LEU 117 -10.195 -6.643 -4.016 896 HD13 LEU 117 HD13 LEU 117 -9.471 -7.144 -2.483 897 HD21 LEU 117 HD21 LEU 117 -7.684 -8.204 -6.235 898 HD22 LEU 117 HD22 LEU 117 -9.197 -7.291 -6.161 899 HD23 LEU 117 HD23 LEU 117 -7.666 -6.507 -5.720 900 H TYR 118 H TYR 118 -5.309 -9.751 -1.555 901 HA TYR 118 HA TYR 118 -2.721 -8.758 -2.319 902 HB2 TYR 118 HB2 TYR 118 -2.098 -8.827 -0.183 903 HB3 TYR 118 HB3 TYR 118 -3.829 -8.753 0.022 904 HD1 TYR 118 HD1 TYR 118 -0.975 -11.252 -0.137 905 HD2 TYR 118 HD2 TYR 118 -4.775 -10.184 1.607 906 HE1 TYR 118 HE1 TYR 118 -0.810 -13.187 1.387 907 HE2 TYR 118 HE2 TYR 118 -4.601 -12.100 3.159 908 HH TYR 118 HH TYR 118 -3.382 -13.978 3.769 909 H TRP 119 H TRP 119 -4.090 -12.077 -2.129 910 HA TRP 119 HA TRP 119 -1.664 -13.476 -2.600 911 HB2 TRP 119 HB2 TRP 119 -3.474 -14.837 -2.096 912 HB3 TRP 119 HB3 TRP 119 -4.579 -13.971 -3.150 913 HD1 TRP 119 HD1 TRP 119 -4.996 -14.825 -5.485 914 HE1 TRP 119 HE1 TRP 119 -4.093 -16.688 -6.964 915 HE3 TRP 119 HE3 TRP 119 -1.040 -16.282 -2.578 916 HZ2 TRP 119 HZ2 TRP 119 -1.935 -18.602 -6.886 917 HZ3 TRP 119 HZ3 TRP 119 0.448 -18.120 -3.322 918 HH2 TRP 119 HH2 TRP 119 0.022 -19.292 -5.463 919 H LEU 120 H LEU 120 -3.868 -11.761 -4.887 920 HA LEU 120 HA LEU 120 -2.550 -12.755 -7.197 921 HB2 LEU 120 HB2 LEU 120 -4.857 -11.554 -6.973 922 HB3 LEU 120 HB3 LEU 120 -3.932 -10.051 -7.004 923 HG LEU 120 HG LEU 120 -2.910 -10.891 -9.225 924 HD11 LEU 120 HD11 LEU 120 -4.216 -12.600 -10.446 925 HD12 LEU 120 HD12 LEU 120 -3.556 -13.308 -8.970 926 HD13 LEU 120 HD13 LEU 120 -5.260 -12.843 -9.032 927 HD21 LEU 120 HD21 LEU 120 -5.906 -10.420 -9.038 928 HD22 LEU 120 HD22 LEU 120 -4.655 -9.159 -9.129 929 HD23 LEU 120 HD23 LEU 120 -4.929 -10.231 -10.514 930 H ALA 121 H ALA 121 -2.103 -9.809 -5.224 931 HA ALA 121 HA ALA 121 0.063 -8.685 -6.705 932 HB1 ALA 121 HB1 ALA 121 0.408 -7.362 -4.643 933 HB2 ALA 121 HB2 ALA 121 -1.315 -7.440 -5.077 934 HB3 ALA 121 HB3 ALA 121 -0.686 -8.448 -3.758 935 H ARG 122 H ARG 122 -0.054 -11.184 -4.155 936 HA ARG 122 HA ARG 122 2.667 -11.192 -3.461 937 HB2 ARG 122 HB2 ARG 122 0.962 -12.297 -2.102 938 HB3 ARG 122 HB3 ARG 122 0.574 -13.405 -3.404 939 HG2 ARG 122 HG2 ARG 122 1.807 -14.545 -1.691 940 HG3 ARG 122 HG3 ARG 122 2.692 -14.544 -3.209 941 HD2 ARG 122 HD2 ARG 122 4.030 -12.542 -2.277 942 HD3 ARG 122 HD3 ARG 122 3.218 -12.845 -0.740 943 HE ARG 122 HE ARG 122 4.359 -14.851 -0.463 944 HH11 ARG 122 HH11 ARG 122 5.176 -13.519 -3.693 945 HH12 ARG 122 HH12 ARG 122 6.704 -14.323 -3.769 946 HH21 ARG 122 HH21 ARG 122 6.238 -16.033 -0.672 947 HH22 ARG 122 HH22 ARG 122 7.322 -15.835 -2.026 948 H GLY 123 H GLY 123 1.199 -12.476 -6.415 949 HA2 GLY 123 HA2 GLY 123 3.464 -12.635 -7.832 950 HA3 GLY 123 HA3 GLY 123 3.547 -14.174 -6.969 951 H TYR 124 H TYR 124 0.307 -13.909 -7.338 952 HA TYR 124 HA TYR 124 -1.070 -15.290 -8.521 953 HB2 TYR 124 HB2 TYR 124 -1.211 -13.050 -9.496 954 HB3 TYR 124 HB3 TYR 124 0.055 -13.443 -10.645 955 HD1 TYR 124 HD2 TYR 124 -2.826 -15.725 -9.743 956 HD2 TYR 124 HD1 TYR 124 -1.144 -12.995 -12.646 957 HE1 TYR 124 HE2 TYR 124 -4.549 -16.381 -11.344 958 HE2 TYR 124 HE1 TYR 124 -2.888 -13.660 -14.271 959 HH TYR 124 HH TYR 124 -5.460 -16.030 -13.425 960 H LYS 125 H LYS 125 0.718 -16.987 -8.026 961 HA LYS 125 HA LYS 125 1.683 -18.209 -10.594 962 HB2 LYS 125 HB2 LYS 125 3.702 -18.882 -9.464 963 HB3 LYS 125 HB3 LYS 125 3.483 -17.138 -9.379 964 HG2 LYS 125 HG2 LYS 125 2.754 -17.290 -7.035 965 HG3 LYS 125 HG3 LYS 125 2.797 -19.061 -7.108 966 HD2 LYS 125 HD2 LYS 125 5.236 -18.982 -7.567 967 HD3 LYS 125 HD3 LYS 125 5.196 -17.208 -7.438 968 HE2 LYS 125 HE2 LYS 125 4.428 -17.370 -5.102 969 HE3 LYS 125 HE3 LYS 125 4.333 -19.131 -5.228 970 HZ1 LYS 125 HZ1 LYS 125 6.372 -18.439 -4.145 971 HZ2 LYS 125 HZ2 LYS 125 6.733 -19.185 -5.544 972 HZ3 LYS 125 HZ3 LYS 125 6.837 -17.558 -5.439 973 H PHE 126 H PHE 126 -0.365 -18.889 -8.038 974 HA PHE 126 HA PHE 126 -1.083 -20.746 -6.945 975 HB2 PHE 126 HB2 PHE 126 -1.107 -21.764 -9.797 976 HB3 PHE 126 HB3 PHE 126 -1.959 -22.498 -8.450 977 HD1 PHE 126 HD1 PHE 126 -3.492 -20.791 -7.021 978 HD2 PHE 126 HD2 PHE 126 -2.377 -20.293 -11.159 979 HE1 PHE 126 HE1 PHE 126 -5.420 -19.277 -7.360 980 HE2 PHE 126 HE2 PHE 126 -4.355 -18.838 -11.511 981 HZ PHE 126 HZ PHE 126 -5.880 -18.322 -9.616 Start of MODEL 9 1 H1 MET 1 H1 MET 1 7.436 -2.871 0.490 2 H2 MET 1 H2 MET 1 6.978 -3.895 -0.703 3 H3 MET 1 H3 MET 1 5.847 -3.061 0.131 4 HA MET 1 HA MET 1 7.603 -5.142 1.234 5 HB2 MET 1 HB2 MET 1 7.082 -3.373 2.877 6 HB3 MET 1 HB3 MET 1 5.352 -3.598 2.602 7 HG2 MET 1 HG2 MET 1 5.513 -5.913 3.460 8 HG3 MET 1 HG3 MET 1 7.261 -5.721 3.665 9 HE1 MET 1 HE1 MET 1 7.127 -6.548 6.156 10 HE2 MET 1 HE2 MET 1 5.994 -5.894 7.360 11 HE3 MET 1 HE3 MET 1 5.378 -6.794 5.957 12 H ALA 2 H ALA 2 7.030 -6.954 0.057 13 HA ALA 2 HA ALA 2 4.421 -7.342 -1.067 14 HB1 ALA 2 HB1 ALA 2 6.666 -9.347 -0.554 15 HB2 ALA 2 HB2 ALA 2 5.278 -9.580 -1.634 16 HB3 ALA 2 HB3 ALA 2 6.480 -8.335 -2.010 17 H SER 3 H SER 3 5.792 -8.170 2.087 18 HA SER 3 HA SER 3 3.872 -10.152 2.821 19 HB2 SER 3 HB2 SER 3 5.065 -9.541 5.129 20 HB3 SER 3 HB3 SER 3 5.858 -10.471 3.858 21 HG SER 3 HG SER 3 7.219 -8.832 4.597 22 H VAL 4 H VAL 4 2.193 -8.407 1.928 23 HA VAL 4 HA VAL 4 1.402 -6.240 3.597 24 HB VAL 4 HB VAL 4 -0.664 -6.294 2.185 25 HG11 VAL 4 HG11 VAL 4 1.390 -5.096 1.455 26 HG12 VAL 4 HG12 VAL 4 1.910 -6.545 0.570 27 HG13 VAL 4 HG13 VAL 4 0.427 -5.698 0.097 28 HG21 VAL 4 HG21 VAL 4 -0.871 -7.835 0.318 29 HG22 VAL 4 HG22 VAL 4 0.617 -8.684 0.759 30 HG23 VAL 4 HG23 VAL 4 -0.801 -8.766 1.820 31 H GLU 5 H GLU 5 0.779 -9.660 3.908 32 HA GLU 5 HA GLU 5 -1.711 -9.518 5.325 33 HB2 GLU 5 HB2 GLU 5 -1.374 -11.828 5.816 34 HB3 GLU 5 HB3 GLU 5 -0.946 -11.547 4.146 35 HG2 GLU 5 HG2 GLU 5 0.978 -11.966 6.477 36 HG3 GLU 5 HG3 GLU 5 0.546 -13.153 5.257 37 H ARG 6 H ARG 6 -2.091 -9.886 7.596 38 HA ARG 6 HA ARG 6 -0.330 -8.355 9.253 39 HB2 ARG 6 HB2 ARG 6 -1.856 -8.754 11.036 40 HB3 ARG 6 HB3 ARG 6 -2.781 -8.451 9.569 41 HG2 ARG 6 HG2 ARG 6 -3.170 -10.935 9.351 42 HG3 ARG 6 HG3 ARG 6 -2.290 -11.169 10.878 43 HD2 ARG 6 HD2 ARG 6 -3.930 -9.666 12.016 44 HD3 ARG 6 HD3 ARG 6 -4.847 -9.564 10.497 45 HE ARG 6 HE ARG 6 -4.431 -12.302 11.190 46 HH11 ARG 6 HH11 ARG 6 -6.320 -9.497 12.273 47 HH12 ARG 6 HH12 ARG 6 -7.579 -10.437 12.983 48 HH21 ARG 6 HH22 ARG 6 -6.108 -13.560 12.148 49 HH22 ARG 6 HH21 ARG 6 -7.454 -12.797 12.900 50 H ASP 7 H ASP 7 -0.536 -11.853 8.646 51 HA ASP 7 HA ASP 7 1.861 -12.348 10.228 52 HB2 ASP 7 HB2 ASP 7 -0.014 -12.347 11.928 53 HB3 ASP 7 HB3 ASP 7 -0.800 -13.629 11.010 54 H GLU 8 H GLU 8 2.815 -14.304 9.585 55 HA GLU 8 HA GLU 8 2.219 -15.255 6.995 56 HB2 GLU 8 HB2 GLU 8 3.981 -16.914 7.440 57 HB3 GLU 8 HB3 GLU 8 4.477 -15.273 7.799 58 HG2 GLU 8 HG2 GLU 8 3.406 -16.940 10.085 59 HG3 GLU 8 HG3 GLU 8 4.968 -17.366 9.409 60 H THR 9 H THR 9 0.715 -16.209 9.977 61 HA THR 9 HA THR 9 -0.097 -18.839 9.478 62 HB THR 9 HB THR 9 -1.673 -16.521 10.617 63 HG1 THR 9 HG1 THR 9 0.174 -16.775 11.735 64 HG21 THR 9 HG21 THR 9 -2.858 -18.286 11.928 65 HG22 THR 9 HG22 THR 9 -3.178 -18.403 10.194 66 HG23 THR 9 HG23 THR 9 -2.035 -19.532 10.957 67 H ARG 10 H ARG 10 -1.157 -15.844 7.772 68 HA ARG 10 HA ARG 10 -3.379 -17.087 6.428 69 HB2 ARG 10 HB2 ARG 10 -1.554 -14.763 5.656 70 HB3 ARG 10 HB3 ARG 10 -2.925 -15.263 4.674 71 HG2 ARG 10 HG2 ARG 10 -3.161 -14.345 7.573 72 HG3 ARG 10 HG3 ARG 10 -3.392 -13.309 6.160 73 HD2 ARG 10 HD2 ARG 10 -5.253 -14.765 5.383 74 HD3 ARG 10 HD3 ARG 10 -5.052 -15.778 6.805 75 HE ARG 10 HE ARG 10 -5.792 -14.046 8.222 76 HH11 ARG 10 HH11 ARG 10 -6.231 -13.143 4.767 77 HH12 ARG 10 HH12 ARG 10 -7.556 -12.081 5.140 78 HH21 ARG 10 HH21 ARG 10 -7.529 -12.606 8.610 79 HH22 ARG 10 HH22 ARG 10 -8.313 -11.785 7.296 80 H GLU 11 H GLU 11 0.103 -16.866 5.532 81 HA GLU 11 HA GLU 11 -0.308 -18.167 2.974 82 HB2 GLU 11 HB2 GLU 11 2.182 -17.657 4.664 83 HB3 GLU 11 HB3 GLU 11 2.226 -18.378 3.057 84 HG2 GLU 11 HG2 GLU 11 1.055 -15.619 3.619 85 HG3 GLU 11 HG3 GLU 11 2.731 -15.910 3.178 86 H HIS 12 H HIS 12 0.837 -19.221 6.212 87 HA HIS 12 HA HIS 12 1.417 -21.919 5.522 88 HB2 HIS 12 HB2 HIS 12 2.222 -21.197 7.605 89 HB3 HIS 12 HB3 HIS 12 0.719 -20.389 8.029 90 HD1 HIS 12 HD1 HIS 12 1.783 -24.133 7.604 91 HD2 HIS 12 HD2 HIS 12 -0.761 -21.540 9.736 92 HE1 HIS 12 HE1 HIS 12 0.537 -25.580 9.286 93 H ARG 13 H ARG 13 -1.661 -20.441 6.765 94 HA ARG 13 HA ARG 13 -3.068 -22.937 6.736 95 HB2 ARG 13 HB2 ARG 13 -3.974 -20.028 6.755 96 HB3 ARG 13 HB3 ARG 13 -5.107 -21.364 6.637 97 HG2 ARG 13 HG2 ARG 13 -4.111 -22.368 8.739 98 HG3 ARG 13 HG3 ARG 13 -3.104 -20.924 8.901 99 HD2 ARG 13 HD2 ARG 13 -5.064 -20.709 10.312 100 HD3 ARG 13 HD3 ARG 13 -5.157 -19.525 8.994 101 HE ARG 13 HE ARG 13 -6.451 -21.975 8.216 102 HH11 ARG 13 HH21 ARG 13 -7.055 -19.275 10.456 103 HH12 ARG 13 HH22 ARG 13 -8.770 -19.349 10.288 104 HH21 ARG 13 HH11 ARG 13 -8.671 -22.009 7.897 105 HH22 ARG 13 HH12 ARG 13 -9.722 -20.986 8.831 106 H ILE 14 H ILE 14 -3.061 -20.229 4.282 107 HA ILE 14 HA ILE 14 -4.935 -21.492 2.729 108 HB ILE 14 HB ILE 14 -3.990 -19.100 2.566 109 HG12 ILE 14 HG12 ILE 14 -4.935 -20.760 0.225 110 HG13 ILE 14 HG13 ILE 14 -5.866 -19.774 1.381 111 HG21 ILE 14 HG21 ILE 14 -1.657 -19.782 1.938 112 HG22 ILE 14 HG22 ILE 14 -2.294 -20.315 0.364 113 HG23 ILE 14 HG23 ILE 14 -2.390 -18.607 0.855 114 HD11 ILE 14 HD11 ILE 14 -5.836 -18.654 -0.703 115 HD12 ILE 14 HD12 ILE 14 -4.814 -17.729 0.419 116 HD13 ILE 14 HD13 ILE 14 -4.071 -18.760 -0.837 117 H GLU 15 H GLU 15 -1.397 -21.955 2.696 118 HA GLU 15 HA GLU 15 -1.238 -23.699 0.452 119 HB2 GLU 15 HB2 GLU 15 0.676 -22.540 1.451 120 HB3 GLU 15 HB3 GLU 15 0.466 -23.425 2.960 121 HG2 GLU 15 HG2 GLU 15 2.288 -24.382 1.665 122 HG3 GLU 15 HG3 GLU 15 0.975 -25.539 1.850 123 H THR 16 H THR 16 -1.935 -24.317 3.936 124 HA THR 16 HA THR 16 -1.841 -27.214 3.385 125 HB THR 16 HB THR 16 -1.758 -27.416 5.856 126 HG1 THR 16 HG1 THR 16 -1.382 -24.608 5.871 127 HG21 THR 16 HG21 THR 16 0.376 -25.576 4.687 128 HG22 THR 16 HG22 THR 16 0.532 -26.617 6.119 129 HG23 THR 16 HG23 THR 16 0.313 -27.343 4.520 130 H GLU 17 H GLU 17 -4.351 -24.944 3.397 131 HA GLU 17 HA GLU 17 -6.199 -27.242 3.802 132 HB2 GLU 17 HB2 GLU 17 -7.621 -26.143 5.214 133 HB3 GLU 17 HB3 GLU 17 -6.032 -25.687 5.798 134 HG2 GLU 17 HG2 GLU 17 -6.364 -23.490 4.435 135 HG3 GLU 17 HG3 GLU 17 -8.024 -24.018 4.230 136 H ILE 18 H ILE 18 -5.350 -24.698 1.596 137 HA ILE 18 HA ILE 18 -7.989 -25.056 0.228 138 HB ILE 18 HB ILE 18 -5.865 -22.982 -0.353 139 HG12 ILE 18 HG12 ILE 18 -6.481 -22.533 1.900 140 HG13 ILE 18 HG13 ILE 18 -7.181 -21.325 0.821 141 HG21 ILE 18 HG21 ILE 18 -7.457 -23.343 -2.184 142 HG22 ILE 18 HG22 ILE 18 -8.807 -23.033 -1.083 143 HG23 ILE 18 HG23 ILE 18 -7.626 -21.748 -1.471 144 HD11 ILE 18 HD11 ILE 18 -8.591 -21.890 2.677 145 HD12 ILE 18 HD12 ILE 18 -9.368 -22.218 1.110 146 HD13 ILE 18 HD13 ILE 18 -8.734 -23.567 2.088 147 H ILE 19 H ILE 19 -4.445 -24.989 -0.411 148 HA ILE 19 HA ILE 19 -4.963 -26.279 -3.048 149 HB ILE 19 HB ILE 19 -3.019 -24.984 -3.831 150 HG12 ILE 19 HG12 ILE 19 -3.058 -23.790 -1.037 151 HG13 ILE 19 HG13 ILE 19 -1.737 -24.623 -1.843 152 HG21 ILE 19 HG21 ILE 19 -5.136 -23.138 -2.662 153 HG22 ILE 19 HG22 ILE 19 -4.219 -22.939 -4.159 154 HG23 ILE 19 HG23 ILE 19 -5.426 -24.214 -4.044 155 HD11 ILE 19 HD11 ILE 19 -1.247 -22.282 -1.832 156 HD12 ILE 19 HD12 ILE 19 -1.708 -22.682 -3.502 157 HD13 ILE 19 HD13 ILE 19 -2.858 -21.857 -2.426 158 H VAL 20 H VAL 20 -4.161 -27.475 -0.284 159 HA VAL 20 HA VAL 20 -1.617 -28.576 -0.439 160 HB VAL 20 HB VAL 20 -3.496 -30.549 0.607 161 HG11 VAL 20 HG11 VAL 20 -1.189 -30.372 1.309 162 HG12 VAL 20 HG12 VAL 20 -1.440 -28.720 1.891 163 HG13 VAL 20 HG13 VAL 20 -2.244 -30.087 2.702 164 HG21 VAL 20 HG21 VAL 20 -3.945 -27.749 1.680 165 HG22 VAL 20 HG22 VAL 20 -5.149 -28.791 0.877 166 HG23 VAL 20 HG23 VAL 20 -4.488 -29.262 2.439 167 H ASP 21 H ASP 21 -4.583 -29.562 -2.111 168 HA ASP 21 HA ASP 21 -3.477 -32.110 -3.025 169 HB2 ASP 21 HB2 ASP 21 -5.819 -31.804 -2.215 170 HB3 ASP 21 HB3 ASP 21 -6.137 -30.747 -3.591 171 H ALA 22 H ALA 22 -2.844 -29.059 -4.098 172 HA ALA 22 HA ALA 22 -3.031 -29.719 -7.006 173 HB1 ALA 22 HB1 ALA 22 -4.779 -28.134 -6.433 174 HB2 ALA 22 HB2 ALA 22 -3.638 -27.133 -5.511 175 HB3 ALA 22 HB3 ALA 22 -3.483 -27.259 -7.274 176 H GLU 23 H GLU 23 -1.250 -29.249 -8.203 177 HA GLU 23 HA GLU 23 1.115 -28.007 -6.863 178 HB2 GLU 23 HB2 GLU 23 0.913 -30.573 -8.491 179 HB3 GLU 23 HB3 GLU 23 2.438 -29.827 -8.044 180 HG2 GLU 23 HG2 GLU 23 0.358 -30.915 -6.105 181 HG3 GLU 23 HG3 GLU 23 1.854 -31.702 -6.577 182 H ASP 24 H ASP 24 -1.024 -27.583 -9.376 183 HA ASP 24 HA ASP 24 1.026 -26.298 -11.123 184 HB2 ASP 24 HB2 ASP 24 0.179 -28.375 -12.162 185 HB3 ASP 24 HB3 ASP 24 -1.484 -27.829 -11.926 186 H LYS 25 H LYS 25 0.411 -24.281 -11.935 187 HA LYS 25 HA LYS 25 -1.140 -22.698 -10.321 188 HB2 LYS 25 HB2 LYS 25 -0.866 -20.928 -11.844 189 HB3 LYS 25 HB3 LYS 25 0.607 -21.875 -11.910 190 HG2 LYS 25 HG2 LYS 25 -1.649 -22.003 -13.964 191 HG3 LYS 25 HG3 LYS 25 -0.263 -20.943 -14.101 192 HD2 LYS 25 HD2 LYS 25 1.259 -22.695 -14.509 193 HD3 LYS 25 HD3 LYS 25 0.185 -23.918 -13.846 194 HE2 LYS 25 HE2 LYS 25 -1.362 -22.844 -15.874 195 HE3 LYS 25 HE3 LYS 25 0.250 -22.783 -16.581 196 HZ1 LYS 25 HZ1 LYS 25 -0.766 -25.236 -15.273 197 HZ2 LYS 25 HZ2 LYS 25 -1.188 -24.898 -16.810 198 HZ3 LYS 25 HZ3 LYS 25 0.411 -25.115 -16.411 199 H GLU 26 H GLU 26 -2.402 -24.609 -13.068 200 HA GLU 26 HA GLU 26 -4.899 -23.092 -13.204 201 HB2 GLU 26 HB2 GLU 26 -4.019 -25.821 -14.249 202 HB3 GLU 26 HB3 GLU 26 -5.643 -25.172 -14.486 203 HG2 GLU 26 HG2 GLU 26 -4.812 -23.278 -15.740 204 HG3 GLU 26 HG3 GLU 26 -3.146 -23.676 -15.349 205 H GLU 27 H GLU 27 -3.735 -26.087 -11.611 206 HA GLU 27 HA GLU 27 -6.298 -26.822 -10.515 207 HB2 GLU 27 HB2 GLU 27 -3.466 -27.558 -9.643 208 HB3 GLU 27 HB3 GLU 27 -4.940 -28.352 -9.095 209 HG2 GLU 27 HG2 GLU 27 -3.918 -28.280 -11.971 210 HG3 GLU 27 HG3 GLU 27 -3.753 -29.626 -10.853 211 H ARG 28 H ARG 28 -3.528 -24.873 -9.336 212 HA ARG 28 HA ARG 28 -4.725 -24.433 -6.731 213 HB2 ARG 28 HB2 ARG 28 -2.466 -22.982 -8.194 214 HB3 ARG 28 HB3 ARG 28 -2.981 -22.643 -6.528 215 HG2 ARG 28 HG2 ARG 28 -2.668 -25.095 -6.021 216 HG3 ARG 28 HG3 ARG 28 -1.877 -25.290 -7.581 217 HD2 ARG 28 HD2 ARG 28 -0.014 -23.960 -6.913 218 HD3 ARG 28 HD3 ARG 28 -0.913 -23.278 -5.542 219 HE ARG 28 HE ARG 28 -0.533 -26.206 -5.548 220 HH11 ARG 28 HH11 ARG 28 0.767 -23.175 -4.214 221 HH12 ARG 28 HH12 ARG 28 1.058 -23.881 -2.639 222 HH21 ARG 28 HH21 ARG 28 -0.154 -27.066 -3.556 223 HH22 ARG 28 HH22 ARG 28 0.681 -26.153 -2.309 224 H ALA 29 H ALA 29 -5.046 -22.774 -9.853 225 HA ALA 29 HA ALA 29 -6.473 -20.500 -8.788 226 HB1 ALA 29 HB1 ALA 29 -5.530 -20.525 -11.090 227 HB2 ALA 29 HB2 ALA 29 -6.708 -21.778 -11.549 228 HB3 ALA 29 HB3 ALA 29 -7.264 -20.169 -11.070 229 H MET 30 H MET 30 -7.459 -23.816 -9.897 230 HA MET 30 HA MET 30 -10.248 -23.371 -9.389 231 HB2 MET 30 HB2 MET 30 -8.679 -25.967 -9.435 232 HB3 MET 30 HB3 MET 30 -10.433 -25.833 -9.355 233 HG2 MET 30 HG2 MET 30 -8.698 -24.840 -11.639 234 HG3 MET 30 HG3 MET 30 -9.653 -26.307 -11.609 235 HE1 MET 30 HE1 MET 30 -10.868 -22.191 -10.968 236 HE2 MET 30 HE2 MET 30 -9.393 -22.627 -11.865 237 HE3 MET 30 HE3 MET 30 -10.852 -22.124 -12.727 238 H GLY 31 H GLY 31 -7.655 -24.684 -7.252 239 HA2 GLY 31 HA2 GLY 31 -9.220 -25.232 -4.999 240 HA3 GLY 31 HA3 GLY 31 -7.550 -24.642 -4.951 241 H TRP 32 H TRP 32 -7.625 -22.090 -5.826 242 HA TRP 32 HA TRP 32 -8.732 -20.505 -3.816 243 HB2 TRP 32 HB2 TRP 32 -7.668 -20.005 -6.578 244 HB3 TRP 32 HB3 TRP 32 -8.651 -18.749 -5.858 245 HD1 TRP 32 HD1 TRP 32 -5.230 -20.300 -5.561 246 HE1 TRP 32 HE1 TRP 32 -3.799 -18.883 -3.991 247 HE3 TRP 32 HE3 TRP 32 -8.894 -17.317 -3.597 248 HZ2 TRP 32 HZ2 TRP 32 -4.158 -16.590 -2.248 249 HZ3 TRP 32 HZ3 TRP 32 -8.330 -15.591 -1.906 250 HH2 TRP 32 HH2 TRP 32 -5.964 -15.200 -1.251 251 H TYR 33 H TYR 33 -10.042 -21.015 -7.163 252 HA TYR 33 HA TYR 33 -12.320 -19.423 -6.908 253 HB2 TYR 33 HB2 TYR 33 -11.727 -20.173 -9.066 254 HB3 TYR 33 HB3 TYR 33 -11.655 -21.856 -8.571 255 HD1 TYR 33 HD1 TYR 33 -13.975 -19.110 -9.498 256 HD2 TYR 33 HD2 TYR 33 -13.616 -23.256 -8.375 257 HE1 TYR 33 HE1 TYR 33 -16.324 -19.505 -10.180 258 HE2 TYR 33 HE2 TYR 33 -16.004 -23.613 -8.893 259 HH TYR 33 HH TYR 33 -17.963 -22.666 -9.745 260 H TYR 34 H TYR 34 -11.976 -22.926 -6.049 261 HA TYR 34 HA TYR 34 -14.742 -23.347 -5.622 262 HB2 TYR 34 HB2 TYR 34 -12.332 -24.752 -4.393 263 HB3 TYR 34 HB3 TYR 34 -13.989 -25.302 -4.220 264 HD1 TYR 34 HD2 TYR 34 -15.117 -25.051 -6.958 265 HD2 TYR 34 HD1 TYR 34 -11.265 -26.453 -5.608 266 HE1 TYR 34 HE2 TYR 34 -14.915 -26.433 -8.992 267 HE2 TYR 34 HE1 TYR 34 -11.069 -27.870 -7.626 268 HH TYR 34 HH TYR 34 -13.600 -27.951 -10.180 269 H TYR 35 H TYR 35 -12.119 -22.611 -3.190 270 HA TYR 35 HA TYR 35 -14.122 -22.594 -1.112 271 HB2 TYR 35 HB2 TYR 35 -12.474 -22.482 0.358 272 HB3 TYR 35 HB3 TYR 35 -11.472 -22.957 -0.992 273 HD1 TYR 35 HD1 TYR 35 -10.057 -21.217 -2.143 274 HD2 TYR 35 HD2 TYR 35 -12.313 -20.318 1.412 275 HE1 TYR 35 HE1 TYR 35 -8.617 -19.243 -1.747 276 HE2 TYR 35 HE2 TYR 35 -10.907 -18.326 1.816 277 HH TYR 35 HH TYR 35 -9.094 -17.071 1.097 278 H LEU 36 H LEU 36 -12.637 -20.033 -3.139 279 HA LEU 36 HA LEU 36 -13.552 -17.871 -1.551 280 HB2 LEU 36 HB2 LEU 36 -11.790 -17.950 -3.434 281 HB3 LEU 36 HB3 LEU 36 -13.131 -17.722 -4.554 282 HG LEU 36 HG LEU 36 -12.177 -15.886 -2.308 283 HD11 LEU 36 HD11 LEU 36 -12.145 -15.518 -5.333 284 HD12 LEU 36 HD12 LEU 36 -11.507 -14.383 -4.119 285 HD13 LEU 36 HD13 LEU 36 -10.749 -15.963 -4.333 286 HD21 LEU 36 HD21 LEU 36 -14.516 -15.455 -4.205 287 HD22 LEU 36 HD22 LEU 36 -14.550 -15.505 -2.423 288 HD23 LEU 36 HD23 LEU 36 -13.750 -14.172 -3.238 289 H ASP 37 H ASP 37 -15.010 -19.335 -4.575 290 HA ASP 37 HA ASP 37 -17.343 -17.700 -4.523 291 HB2 ASP 37 HB2 ASP 37 -16.605 -19.068 -6.480 292 HB3 ASP 37 HB3 ASP 37 -17.064 -20.525 -5.607 293 H ASP 38 H ASP 38 -16.694 -20.902 -3.015 294 HA ASP 38 HA ASP 38 -19.291 -21.269 -1.908 295 HB2 ASP 38 HB2 ASP 38 -17.619 -23.049 -2.025 296 HB3 ASP 38 HB3 ASP 38 -16.582 -22.185 -0.883 297 H THR 39 H THR 39 -16.712 -19.093 -0.914 298 HA THR 39 HA THR 39 -17.846 -18.692 1.781 299 HB THR 39 HB THR 39 -15.437 -17.447 0.390 300 HG1 THR 39 HG1 THR 39 -15.071 -19.556 0.752 301 HG21 THR 39 HG21 THR 39 -16.111 -15.934 2.130 302 HG22 THR 39 HG22 THR 39 -16.451 -17.259 3.252 303 HG23 THR 39 HG23 THR 39 -14.774 -16.887 2.788 304 H LEU 40 H LEU 40 -17.809 -17.131 -1.430 305 HA LEU 40 HA LEU 40 -18.606 -14.532 -0.646 306 HB2 LEU 40 HB2 LEU 40 -19.307 -16.092 -3.148 307 HB3 LEU 40 HB3 LEU 40 -19.676 -14.385 -2.912 308 HG LEU 40 HG LEU 40 -16.919 -15.611 -3.024 309 HD11 LEU 40 HD11 LEU 40 -18.338 -13.835 -5.042 310 HD12 LEU 40 HD12 LEU 40 -16.720 -14.542 -5.205 311 HD13 LEU 40 HD13 LEU 40 -18.151 -15.589 -5.190 312 HD21 LEU 40 HD21 LEU 40 -16.127 -13.236 -3.247 313 HD22 LEU 40 HD22 LEU 40 -17.733 -12.735 -2.683 314 HD23 LEU 40 HD23 LEU 40 -16.661 -13.735 -1.643 315 H GLU 41 H GLU 41 -20.442 -13.942 0.464 316 HA GLU 41 HA GLU 41 -22.839 -15.604 0.534 317 HB2 GLU 41 HB2 GLU 41 -22.092 -12.892 1.696 318 HB3 GLU 41 HB3 GLU 41 -23.688 -13.618 1.920 319 HG2 GLU 41 HG2 GLU 41 -21.155 -15.123 2.631 320 HG3 GLU 41 HG3 GLU 41 -21.929 -14.010 3.761 321 H PHE 42 H PHE 42 -22.394 -15.285 -1.983 322 HA PHE 42 HA PHE 42 -23.318 -12.892 -3.218 323 HB2 PHE 42 HB2 PHE 42 -23.136 -14.065 -5.306 324 HB3 PHE 42 HB3 PHE 42 -21.771 -14.466 -4.301 325 HD1 PHE 42 HD2 PHE 42 -25.058 -15.743 -5.578 326 HD2 PHE 42 HD1 PHE 42 -21.240 -16.786 -3.847 327 HE1 PHE 42 HE2 PHE 42 -25.524 -18.143 -5.972 328 HE2 PHE 42 HE1 PHE 42 -21.712 -19.170 -4.245 329 HZ PHE 42 HZ PHE 42 -23.857 -19.867 -5.302 330 HA PRO 43 HA PRO 43 -24.442 -12.287 -5.246 331 HB2 PRO 43 HB2 PRO 43 -26.486 -10.585 -5.797 332 HB3 PRO 43 HB3 PRO 43 -26.332 -12.190 -6.574 333 HG2 PRO 43 HG2 PRO 43 -28.044 -11.439 -4.185 334 HG3 PRO 43 HG3 PRO 43 -28.522 -12.367 -5.642 335 HD2 PRO 43 HD2 PRO 43 -27.786 -13.580 -3.294 336 HD3 PRO 43 HD3 PRO 43 -27.411 -14.301 -4.887 337 H PHE 44 H PHE 44 -23.754 -10.095 -4.948 338 HA PHE 44 HA PHE 44 -24.525 -8.610 -2.531 339 HB2 PHE 44 HB2 PHE 44 -22.360 -8.486 -1.589 340 HB3 PHE 44 HB3 PHE 44 -22.785 -10.175 -1.715 341 HD1 PHE 44 HD1 PHE 44 -21.783 -11.516 -3.756 342 HD2 PHE 44 HD2 PHE 44 -20.256 -7.734 -2.361 343 HE1 PHE 44 HE1 PHE 44 -19.607 -12.006 -4.808 344 HE2 PHE 44 HE2 PHE 44 -18.085 -8.218 -3.447 345 HZ PHE 44 HZ PHE 44 -17.740 -10.368 -4.649 346 H MET 45 H MET 45 -22.511 -6.628 -2.693 347 HA MET 45 HA MET 45 -22.520 -5.850 -5.552 348 HB2 MET 45 HB2 MET 45 -23.384 -3.734 -5.209 349 HB3 MET 45 HB3 MET 45 -24.492 -4.808 -4.378 350 HG2 MET 45 HG2 MET 45 -23.917 -4.024 -2.276 351 HG3 MET 45 HG3 MET 45 -22.290 -3.560 -2.740 352 HE1 MET 45 HE1 MET 45 -22.613 -0.120 -4.436 353 HE2 MET 45 HE2 MET 45 -21.545 -1.450 -3.963 354 HE3 MET 45 HE3 MET 45 -22.634 -1.644 -5.345 355 H GLY 46 H GLY 46 -21.150 -4.033 -6.048 356 HA2 GLY 46 HA2 GLY 46 -18.997 -3.352 -4.162 357 HA3 GLY 46 HA3 GLY 46 -18.515 -4.427 -5.487 358 H LYS 47 H LYS 47 -17.189 -2.307 -5.488 359 HA LYS 47 HA LYS 47 -18.308 -0.669 -7.729 360 HB2 LYS 47 HB2 LYS 47 -17.694 0.512 -5.478 361 HB3 LYS 47 HB3 LYS 47 -16.027 0.135 -5.878 362 HG2 LYS 47 HG2 LYS 47 -16.292 2.309 -6.713 363 HG3 LYS 47 HG3 LYS 47 -16.530 1.318 -8.155 364 HD2 LYS 47 HD2 LYS 47 -18.273 2.921 -8.218 365 HD3 LYS 47 HD3 LYS 47 -19.044 1.438 -7.666 366 HE2 LYS 47 HE2 LYS 47 -19.100 2.221 -5.379 367 HE3 LYS 47 HE3 LYS 47 -18.066 3.603 -5.766 368 HZ1 LYS 47 HZ1 LYS 47 -19.819 4.556 -7.053 369 HZ2 LYS 47 HZ2 LYS 47 -20.764 3.233 -6.950 370 HZ3 LYS 47 HZ3 LYS 47 -20.467 4.146 -5.616 371 H TRP 48 H TRP 48 -17.398 -1.205 -9.615 372 HA TRP 48 HA TRP 48 -14.887 -2.756 -9.736 373 HB2 TRP 48 HB2 TRP 48 -16.838 -3.164 -11.275 374 HB3 TRP 48 HB3 TRP 48 -16.577 -1.577 -11.971 375 HD1 TRP 48 HD1 TRP 48 -13.175 -2.555 -11.692 376 HE1 TRP 48 HE1 TRP 48 -12.264 -3.791 -13.673 377 HE3 TRP 48 HE3 TRP 48 -17.613 -3.782 -13.953 378 HZ2 TRP 48 HZ2 TRP 48 -13.300 -5.292 -15.939 379 HZ3 TRP 48 HZ3 TRP 48 -17.596 -5.132 -16.038 380 HH2 TRP 48 HH2 TRP 48 -15.446 -5.905 -17.017 381 H LYS 49 H LYS 49 -13.140 -1.599 -9.236 382 HA LYS 49 HA LYS 49 -12.971 1.300 -9.586 383 HB2 LYS 49 HB2 LYS 49 -10.864 -0.691 -8.607 384 HB3 LYS 49 HB3 LYS 49 -10.897 1.040 -8.290 385 HG2 LYS 49 HG2 LYS 49 -12.890 -1.014 -7.213 386 HG3 LYS 49 HG3 LYS 49 -11.492 -0.436 -6.347 387 HD2 LYS 49 HD2 LYS 49 -13.699 1.456 -7.274 388 HD3 LYS 49 HD3 LYS 49 -13.734 0.568 -5.747 389 HE2 LYS 49 HE2 LYS 49 -11.364 1.534 -5.326 390 HE3 LYS 49 HE3 LYS 49 -11.758 2.704 -6.597 391 HZ1 LYS 49 HZ1 LYS 49 -13.620 3.443 -5.281 392 HZ2 LYS 49 HZ2 LYS 49 -13.375 2.235 -4.149 393 HZ3 LYS 49 HZ3 LYS 49 -12.295 3.458 -4.327 394 H LYS 50 H LYS 50 -13.287 0.564 -12.042 395 HA LYS 50 HA LYS 50 -11.258 -0.937 -13.390 396 HB2 LYS 50 HB2 LYS 50 -13.593 -0.728 -14.146 397 HB3 LYS 50 HB3 LYS 50 -13.367 0.994 -14.462 398 HG2 LYS 50 HG2 LYS 50 -11.726 0.525 -16.202 399 HG3 LYS 50 HG3 LYS 50 -11.746 -1.204 -15.829 400 HD2 LYS 50 HD2 LYS 50 -14.125 0.397 -16.882 401 HD3 LYS 50 HD3 LYS 50 -13.030 -0.579 -17.875 402 HE2 LYS 50 HE2 LYS 50 -13.644 -2.599 -16.520 403 HE3 LYS 50 HE3 LYS 50 -14.820 -1.625 -15.631 404 HZ1 LYS 50 HZ1 LYS 50 -15.868 -2.838 -17.417 405 HZ2 LYS 50 HZ2 LYS 50 -15.975 -1.241 -17.746 406 HZ3 LYS 50 HZ3 LYS 50 -14.894 -2.173 -18.543 407 H LYS 51 H LYS 51 -9.233 -0.330 -13.898 408 HA LYS 51 HA LYS 51 -8.351 2.426 -13.660 409 HB2 LYS 51 HB2 LYS 51 -7.014 0.014 -14.970 410 HB3 LYS 51 HB3 LYS 51 -6.281 1.609 -14.765 411 HG2 LYS 51 HG2 LYS 51 -5.464 0.757 -12.833 412 HG3 LYS 51 HG3 LYS 51 -7.044 1.193 -12.194 413 HD2 LYS 51 HD2 LYS 51 -7.738 -1.266 -12.894 414 HD3 LYS 51 HD3 LYS 51 -6.002 -1.520 -13.068 415 HE2 LYS 51 HE2 LYS 51 -6.339 -2.199 -10.878 416 HE3 LYS 51 HE3 LYS 51 -5.833 -0.521 -10.646 417 HZ1 LYS 51 HZ1 LYS 51 -8.610 -1.571 -10.642 418 HZ2 LYS 51 HZ2 LYS 51 -7.789 -1.018 -9.328 419 HZ3 LYS 51 HZ3 LYS 51 -8.289 0.007 -10.520 420 H SER 52 H SER 52 -8.251 3.990 -15.185 421 HA SER 52 HA SER 52 -10.035 3.878 -17.358 422 HB2 SER 52 HB2 SER 52 -7.791 5.811 -16.668 423 HB3 SER 52 HB3 SER 52 -9.106 6.149 -17.814 424 HG SER 52 HG SER 52 -10.577 6.016 -16.136 425 H ARG 53 H ARG 53 -9.490 4.475 -19.573 426 HA ARG 53 HA ARG 53 -8.269 2.373 -20.892 427 HB2 ARG 53 HB2 ARG 53 -8.709 5.121 -22.147 428 HB3 ARG 53 HB3 ARG 53 -8.657 3.552 -22.933 429 HG2 ARG 53 HG2 ARG 53 -10.924 3.833 -22.880 430 HG3 ARG 53 HG3 ARG 53 -10.726 3.032 -21.320 431 HD2 ARG 53 HD2 ARG 53 -10.532 5.475 -20.357 432 HD3 ARG 53 HD3 ARG 53 -11.146 5.992 -21.924 433 HE ARG 53 HE ARG 53 -12.976 4.122 -21.246 434 HH11 ARG 53 HH11 ARG 53 -11.756 6.964 -19.419 435 HH12 ARG 53 HH12 ARG 53 -13.158 6.964 -18.367 436 HH21 ARG 53 HH21 ARG 53 -14.828 4.315 -19.811 437 HH22 ARG 53 HH22 ARG 53 -14.795 5.572 -18.589 438 H LYS 54 H LYS 54 -6.162 1.876 -20.551 439 HA LYS 54 HA LYS 54 -3.936 2.043 -20.246 440 HB2 LYS 54 HB2 LYS 54 -4.137 3.754 -22.758 441 HB3 LYS 54 HB3 LYS 54 -2.672 2.970 -22.152 442 HG2 LYS 54 HG2 LYS 54 -3.756 0.743 -22.399 443 HG3 LYS 54 HG3 LYS 54 -5.190 1.530 -23.090 444 HD2 LYS 54 HD2 LYS 54 -3.804 2.454 -24.927 445 HD3 LYS 54 HD3 LYS 54 -2.369 1.658 -24.243 446 HE2 LYS 54 HE2 LYS 54 -3.476 -0.553 -24.508 447 HE3 LYS 54 HE3 LYS 54 -4.902 0.239 -25.191 448 HZ1 LYS 54 HZ1 LYS 54 -2.195 0.268 -26.398 449 HZ2 LYS 54 HZ2 LYS 54 -3.456 -0.621 -26.917 450 HZ3 LYS 54 HZ3 LYS 54 -3.513 1.002 -27.030 451 H THR 55 H THR 55 -5.306 3.859 -18.533 452 HA THR 55 HA THR 55 -3.258 5.977 -18.211 453 HB THR 55 HB THR 55 -5.436 7.396 -17.542 454 HG1 THR 55 HG1 THR 55 -6.381 5.916 -19.750 455 HG21 THR 55 HG21 THR 55 -3.749 8.110 -19.189 456 HG22 THR 55 HG22 THR 55 -4.506 7.084 -20.427 457 HG23 THR 55 HG23 THR 55 -5.392 8.466 -19.744 458 H SER 56 H SER 56 -2.942 6.650 -16.075 459 HA SER 56 HA SER 56 -3.299 4.641 -14.124 460 HB2 SER 56 HB2 SER 56 -2.519 7.547 -13.677 461 HB3 SER 56 HB3 SER 56 -2.050 6.137 -12.710 462 HG SER 56 HG SER 56 -0.391 6.801 -14.150 463 H THR 57 H THR 57 -5.393 7.280 -15.002 464 HA THR 57 HA THR 57 -6.763 7.811 -12.626 465 HB THR 57 HB THR 57 -7.907 7.748 -15.436 466 HG1 THR 57 HG1 THR 57 -6.908 9.696 -15.795 467 HG21 THR 57 HG21 THR 57 -9.549 8.492 -13.799 468 HG22 THR 57 HG22 THR 57 -8.373 9.609 -13.062 469 HG23 THR 57 HG23 THR 57 -8.993 9.895 -14.704 470 H ILE 58 H ILE 58 -9.051 7.117 -12.128 471 HA ILE 58 HA ILE 58 -9.643 4.286 -12.834 472 HB ILE 58 HB ILE 58 -9.557 5.582 -10.090 473 HG12 ILE 58 HG12 ILE 58 -8.128 3.234 -11.407 474 HG13 ILE 58 HG13 ILE 58 -7.421 4.751 -10.850 475 HG21 ILE 58 HG21 ILE 58 -10.510 3.471 -9.185 476 HG22 ILE 58 HG22 ILE 58 -11.647 4.307 -10.214 477 HG23 ILE 58 HG23 ILE 58 -10.770 2.906 -10.855 478 HD11 ILE 58 HD11 ILE 58 -8.008 4.083 -8.489 479 HD12 ILE 58 HD12 ILE 58 -8.478 2.485 -9.132 480 HD13 ILE 58 HD13 ILE 58 -6.810 3.049 -9.298 481 H GLU 59 H GLU 59 -11.677 3.803 -13.122 482 HA GLU 59 HA GLU 59 -13.809 5.877 -12.981 483 HB2 GLU 59 HB2 GLU 59 -13.464 3.355 -14.677 484 HB3 GLU 59 HB3 GLU 59 -14.976 4.247 -14.579 485 HG2 GLU 59 HG2 GLU 59 -12.399 5.576 -15.514 486 HG3 GLU 59 HG3 GLU 59 -13.412 4.632 -16.590 487 H GLU 60 H GLU 60 -15.646 5.193 -11.785 488 HA GLU 60 HA GLU 60 -15.276 2.732 -10.123 489 HB2 GLU 60 HB2 GLU 60 -16.159 5.536 -9.315 490 HB3 GLU 60 HB3 GLU 60 -16.314 4.102 -8.298 491 HG2 GLU 60 HG2 GLU 60 -13.821 3.748 -8.518 492 HG3 GLU 60 HG3 GLU 60 -13.729 5.311 -9.340 493 H LYS 61 H LYS 61 -16.636 1.443 -11.298 494 HA LYS 61 HA LYS 61 -19.361 2.467 -11.983 495 HB2 LYS 61 HB2 LYS 61 -18.088 1.461 -13.801 496 HB3 LYS 61 HB3 LYS 61 -17.823 -0.010 -12.857 497 HG2 LYS 61 HG2 LYS 61 -20.199 -0.533 -12.872 498 HG3 LYS 61 HG3 LYS 61 -20.586 0.986 -13.669 499 HD2 LYS 61 HD2 LYS 61 -18.711 -1.091 -14.895 500 HD3 LYS 61 HD3 LYS 61 -20.448 -1.187 -15.106 501 HE2 LYS 61 HE2 LYS 61 -18.722 1.192 -15.941 502 HE3 LYS 61 HE3 LYS 61 -19.294 -0.087 -17.018 503 HZ1 LYS 61 HZ1 LYS 61 -21.576 0.565 -16.493 504 HZ2 LYS 61 HZ2 LYS 61 -21.056 1.772 -15.535 505 HZ3 LYS 61 HZ3 LYS 61 -20.741 1.827 -17.145 506 H THR 62 H THR 62 -20.947 2.053 -10.472 507 HA THR 62 HA THR 62 -20.581 0.121 -8.376 508 HB THR 62 HB THR 62 -23.210 1.355 -9.273 509 HG1 THR 62 HG1 THR 62 -22.600 3.237 -8.499 510 HG21 THR 62 HG21 THR 62 -22.032 0.770 -6.515 511 HG22 THR 62 HG22 THR 62 -23.670 1.379 -6.855 512 HG23 THR 62 HG23 THR 62 -23.212 -0.259 -7.349 513 H VAL 63 H VAL 63 -21.094 -1.993 -8.337 514 HA VAL 63 HA VAL 63 -22.717 -3.132 -10.570 515 HB VAL 63 HB VAL 63 -21.050 -4.946 -10.771 516 HG11 VAL 63 HG11 VAL 63 -21.096 -3.038 -12.370 517 HG12 VAL 63 HG12 VAL 63 -19.828 -2.242 -11.410 518 HG13 VAL 63 HG13 VAL 63 -19.498 -3.785 -12.205 519 HG21 VAL 63 HG21 VAL 63 -19.832 -4.695 -8.612 520 HG22 VAL 63 HG22 VAL 63 -18.742 -4.666 -10.003 521 HG23 VAL 63 HG23 VAL 63 -19.159 -3.152 -9.183 522 H GLU 64 H GLU 64 -23.762 -5.070 -10.164 523 HA GLU 64 HA GLU 64 -23.928 -5.933 -7.300 524 HB2 GLU 64 HB2 GLU 64 -26.104 -5.408 -8.343 525 HB3 GLU 64 HB3 GLU 64 -25.756 -6.520 -9.672 526 HG2 GLU 64 HG2 GLU 64 -25.703 -8.412 -8.061 527 HG3 GLU 64 HG3 GLU 64 -25.985 -7.284 -6.731 528 H VAL 65 H VAL 65 -22.992 -7.903 -6.881 529 HA VAL 65 HA VAL 65 -21.512 -9.191 -9.118 530 HB VAL 65 HB VAL 65 -20.926 -9.290 -6.133 531 HG11 VAL 65 HG11 VAL 65 -19.946 -11.124 -7.480 532 HG12 VAL 65 HG12 VAL 65 -19.303 -9.932 -8.633 533 HG13 VAL 65 HG13 VAL 65 -18.670 -10.004 -6.979 534 HG21 VAL 65 HG21 VAL 65 -19.707 -7.434 -8.228 535 HG22 VAL 65 HG22 VAL 65 -20.680 -6.939 -6.828 536 HG23 VAL 65 HG23 VAL 65 -19.098 -7.669 -6.577 537 H LEU 66 H LEU 66 -22.417 -10.998 -9.813 538 HA LEU 66 HA LEU 66 -24.715 -12.113 -8.424 539 HB2 LEU 66 HB2 LEU 66 -23.323 -12.659 -11.069 540 HB3 LEU 66 HB3 LEU 66 -24.616 -13.689 -10.480 541 HG LEU 66 HG LEU 66 -26.200 -11.826 -10.472 542 HD11 LEU 66 HD11 LEU 66 -24.798 -9.859 -10.124 543 HD12 LEU 66 HD12 LEU 66 -23.923 -10.169 -11.644 544 HD13 LEU 66 HD13 LEU 66 -25.637 -9.701 -11.660 545 HD21 LEU 66 HD21 LEU 66 -26.378 -11.596 -12.933 546 HD22 LEU 66 HD22 LEU 66 -24.704 -12.156 -13.113 547 HD23 LEU 66 HD23 LEU 66 -25.948 -13.250 -12.475 548 H GLY 67 H GLY 67 -21.330 -13.110 -8.926 549 HA2 GLY 67 HA2 GLY 67 -20.904 -14.950 -6.994 550 HA3 GLY 67 HA3 GLY 67 -21.749 -15.885 -8.252 551 H MET 68 H MET 68 -19.186 -16.659 -7.900 552 HA MET 68 HA MET 68 -17.310 -15.193 -9.549 553 HB2 MET 68 HB2 MET 68 -17.232 -18.056 -8.588 554 HB3 MET 68 HB3 MET 68 -15.971 -17.248 -9.527 555 HG2 MET 68 HG2 MET 68 -16.174 -15.381 -7.646 556 HG3 MET 68 HG3 MET 68 -16.858 -16.699 -6.707 557 HE1 MET 68 HE1 MET 68 -13.834 -15.014 -8.295 558 HE2 MET 68 HE2 MET 68 -12.549 -16.237 -8.241 559 HE3 MET 68 HE3 MET 68 -13.896 -16.428 -9.371 560 H ALA 69 H ALA 69 -16.458 -15.792 -11.551 561 HA ALA 69 HA ALA 69 -18.490 -16.209 -13.557 562 HB1 ALA 69 HB1 ALA 69 -16.712 -15.551 -15.059 563 HB2 ALA 69 HB2 ALA 69 -16.484 -14.619 -13.596 564 HB3 ALA 69 HB3 ALA 69 -15.471 -16.054 -13.900 565 HA PRO 70 HA PRO 70 -17.870 -20.514 -14.861 566 HB2 PRO 70 HB2 PRO 70 -16.362 -19.456 -17.256 567 HB3 PRO 70 HB3 PRO 70 -17.567 -20.785 -17.177 568 HG2 PRO 70 HG2 PRO 70 -18.354 -18.351 -18.025 569 HG3 PRO 70 HG3 PRO 70 -19.365 -19.218 -16.819 570 HD2 PRO 70 HD2 PRO 70 -17.328 -17.042 -16.366 571 HD3 PRO 70 HD3 PRO 70 -18.974 -17.182 -15.668 572 H ASP 71 H ASP 71 -16.422 -22.127 -14.609 573 HA ASP 71 HA ASP 71 -14.135 -21.785 -13.108 574 HB2 ASP 71 HB2 ASP 71 -14.804 -24.050 -15.042 575 HB3 ASP 71 HB3 ASP 71 -13.549 -24.115 -13.815 576 H ASP 72 H ASP 72 -14.459 -21.983 -16.646 577 HA ASP 72 HA ASP 72 -11.627 -22.191 -17.228 578 HB2 ASP 72 HB2 ASP 72 -13.355 -22.941 -18.802 579 HB3 ASP 72 HB3 ASP 72 -14.004 -21.304 -18.919 580 H GLU 73 H GLU 73 -13.737 -19.413 -16.554 581 HA GLU 73 HA GLU 73 -11.685 -17.575 -17.536 582 HB2 GLU 73 HB2 GLU 73 -14.408 -17.183 -16.388 583 HB3 GLU 73 HB3 GLU 73 -13.220 -15.904 -16.122 584 HG2 GLU 73 HG2 GLU 73 -13.818 -17.061 -18.874 585 HG3 GLU 73 HG3 GLU 73 -14.636 -15.658 -18.201 586 H CYS 74 H CYS 74 -12.892 -18.897 -14.474 587 HA CYS 74 HA CYS 74 -11.126 -17.343 -12.828 588 HB2 CYS 74 HB2 CYS 74 -12.734 -19.840 -12.192 589 HB3 CYS 74 HB3 CYS 74 -11.941 -18.771 -11.016 590 HG CYS 74 HG CYS 74 -14.419 -18.232 -13.116 591 H LEU 75 H LEU 75 -10.194 -19.513 -14.971 592 HA LEU 75 HA LEU 75 -8.609 -21.377 -13.482 593 HB2 LEU 75 HB2 LEU 75 -9.928 -21.624 -15.692 594 HB3 LEU 75 HB3 LEU 75 -8.624 -20.737 -16.464 595 HG LEU 75 HG LEU 75 -7.087 -22.529 -16.003 596 HD11 LEU 75 HD11 LEU 75 -7.933 -24.700 -14.967 597 HD12 LEU 75 HD12 LEU 75 -7.774 -23.371 -13.819 598 HD13 LEU 75 HD13 LEU 75 -9.380 -23.809 -14.452 599 HD21 LEU 75 HD21 LEU 75 -8.105 -24.286 -17.369 600 HD22 LEU 75 HD22 LEU 75 -9.725 -23.636 -17.028 601 HD23 LEU 75 HD23 LEU 75 -8.563 -22.687 -17.979 602 H LYS 76 H LYS 76 -8.062 -18.157 -14.328 603 HA LYS 76 HA LYS 76 -5.097 -18.483 -14.297 604 HB2 LYS 76 HB2 LYS 76 -4.862 -17.019 -16.180 605 HB3 LYS 76 HB3 LYS 76 -5.975 -18.307 -16.624 606 HG2 LYS 76 HG2 LYS 76 -7.862 -16.575 -15.960 607 HG3 LYS 76 HG3 LYS 76 -6.567 -15.386 -16.020 608 HD2 LYS 76 HD2 LYS 76 -7.624 -15.288 -18.140 609 HD3 LYS 76 HD3 LYS 76 -6.099 -16.134 -18.400 610 HE2 LYS 76 HE2 LYS 76 -7.795 -17.307 -19.645 611 HE3 LYS 76 HE3 LYS 76 -7.349 -18.324 -18.275 612 HZ1 LYS 76 HZ1 LYS 76 -9.690 -18.331 -18.393 613 HZ2 LYS 76 HZ2 LYS 76 -9.373 -17.334 -17.139 614 HZ3 LYS 76 HZ3 LYS 76 -9.825 -16.702 -18.582 615 H ASP 77 H ASP 77 -7.918 -16.539 -13.512 616 HA ASP 77 HA ASP 77 -6.535 -14.883 -11.575 617 HB2 ASP 77 HB2 ASP 77 -6.073 -13.607 -13.636 618 HB3 ASP 77 HB3 ASP 77 -7.759 -13.727 -14.122 619 H MET 78 H MET 78 -8.404 -13.646 -10.393 620 HA MET 78 HA MET 78 -10.703 -15.538 -10.291 621 HB2 MET 78 HB2 MET 78 -9.858 -13.264 -8.467 622 HB3 MET 78 HB3 MET 78 -11.293 -14.253 -8.227 623 HG2 MET 78 HG2 MET 78 -8.425 -15.273 -8.220 624 HG3 MET 78 HG3 MET 78 -9.424 -14.949 -6.814 625 HE1 MET 78 HE1 MET 78 -9.224 -17.279 -10.091 626 HE2 MET 78 HE2 MET 78 -7.965 -17.633 -8.884 627 HE3 MET 78 HE3 MET 78 -9.252 -18.814 -9.205 628 H TYR 79 H TYR 79 -12.669 -15.046 -11.196 629 HA TYR 79 HA TYR 79 -13.252 -12.225 -11.963 630 HB2 TYR 79 HB2 TYR 79 -13.597 -14.805 -13.533 631 HB3 TYR 79 HB3 TYR 79 -14.374 -13.296 -13.965 632 HD1 TYR 79 HD2 TYR 79 -13.071 -11.367 -14.825 633 HD2 TYR 79 HD1 TYR 79 -11.271 -15.207 -14.058 634 HE1 TYR 79 HE2 TYR 79 -11.206 -10.785 -16.337 635 HE2 TYR 79 HE1 TYR 79 -9.405 -14.644 -15.567 636 HH TYR 79 HH TYR 79 -9.194 -11.499 -17.300 637 H VAL 80 H VAL 80 -15.488 -11.711 -12.078 638 HA VAL 80 HA VAL 80 -17.410 -13.661 -10.900 639 HB VAL 80 HB VAL 80 -18.342 -11.655 -9.667 640 HG11 VAL 80 HG11 VAL 80 -15.629 -12.702 -8.780 641 HG12 VAL 80 HG12 VAL 80 -16.788 -11.826 -7.754 642 HG13 VAL 80 HG13 VAL 80 -17.229 -13.386 -8.418 643 HG21 VAL 80 HG21 VAL 80 -16.864 -9.794 -9.087 644 HG22 VAL 80 HG22 VAL 80 -15.569 -10.442 -10.104 645 HG23 VAL 80 HG23 VAL 80 -17.077 -9.854 -10.840 646 H GLU 81 H GLU 81 -19.572 -13.389 -11.516 647 HA GLU 81 HA GLU 81 -20.007 -11.935 -14.069 648 HB2 GLU 81 HB2 GLU 81 -21.748 -13.745 -12.337 649 HB3 GLU 81 HB3 GLU 81 -22.379 -12.801 -13.700 650 HG2 GLU 81 HG2 GLU 81 -20.739 -13.915 -15.212 651 HG3 GLU 81 HG3 GLU 81 -20.191 -14.907 -13.862 652 H VAL 82 H VAL 82 -21.183 -10.024 -14.150 653 HA VAL 82 HA VAL 82 -21.926 -8.768 -11.586 654 HB VAL 82 HB VAL 82 -19.468 -8.428 -13.092 655 HG11 VAL 82 HG11 VAL 82 -21.019 -5.840 -12.965 656 HG12 VAL 82 HG12 VAL 82 -19.293 -6.035 -13.345 657 HG13 VAL 82 HG13 VAL 82 -20.513 -6.723 -14.429 658 HG21 VAL 82 HG21 VAL 82 -20.504 -7.112 -10.577 659 HG22 VAL 82 HG22 VAL 82 -19.552 -8.601 -10.706 660 HG23 VAL 82 HG23 VAL 82 -18.826 -7.052 -11.162 661 H ALA 83 H ALA 83 -23.466 -7.198 -11.783 662 HA ALA 83 HA ALA 83 -24.535 -6.649 -14.527 663 HB1 ALA 83 HB1 ALA 83 -26.718 -6.305 -13.536 664 HB2 ALA 83 HB2 ALA 83 -26.122 -7.923 -13.116 665 HB3 ALA 83 HB3 ALA 83 -26.069 -6.621 -11.908 666 H ASP 84 H ASP 84 -24.832 -4.526 -15.105 667 HA ASP 84 HA ASP 84 -23.105 -2.648 -13.677 668 HB2 ASP 84 HB2 ASP 84 -23.004 -3.089 -16.127 669 HB3 ASP 84 HB3 ASP 84 -24.635 -2.429 -16.295 670 H ILE 85 H ILE 85 -24.872 -2.853 -11.877 671 HA ILE 85 HA ILE 85 -27.314 -1.462 -12.138 672 HB ILE 85 HB ILE 85 -27.391 -1.380 -9.730 673 HG12 ILE 85 HG12 ILE 85 -24.491 -2.257 -9.725 674 HG13 ILE 85 HG13 ILE 85 -25.062 -0.658 -9.262 675 HG21 ILE 85 HG21 ILE 85 -26.090 -4.019 -10.515 676 HG22 ILE 85 HG22 ILE 85 -27.395 -3.728 -9.341 677 HG23 ILE 85 HG23 ILE 85 -27.703 -3.539 -11.064 678 HD11 ILE 85 HD11 ILE 85 -25.729 -3.249 -7.803 679 HD12 ILE 85 HD12 ILE 85 -24.615 -2.001 -7.267 680 HD13 ILE 85 HD13 ILE 85 -26.349 -1.636 -7.384 681 H GLY 86 H GLY 86 -24.150 -0.132 -12.125 682 HA2 GLY 86 HA2 GLY 86 -24.912 2.549 -11.234 683 HA3 GLY 86 HA3 GLY 86 -23.347 2.003 -11.852 684 H GLY 87 H GLY 87 -25.127 0.807 -14.249 685 HA2 GLY 87 HA2 GLY 87 -25.262 3.378 -15.810 686 HA3 GLY 87 HA3 GLY 87 -24.307 1.963 -16.290 687 H LYS 88 H LYS 88 -26.060 -0.118 -15.771 688 HA LYS 88 HA LYS 88 -28.497 0.147 -17.306 689 HB2 LYS 88 HB2 LYS 88 -27.560 -1.476 -19.112 690 HB3 LYS 88 HB3 LYS 88 -27.399 0.269 -19.257 691 HG2 LYS 88 HG2 LYS 88 -25.049 0.126 -18.412 692 HG3 LYS 88 HG3 LYS 88 -25.201 -1.649 -18.395 693 HD2 LYS 88 HD2 LYS 88 -25.404 -1.721 -20.769 694 HD3 LYS 88 HD3 LYS 88 -25.788 -0.001 -20.871 695 HE2 LYS 88 HE2 LYS 88 -23.478 -0.498 -21.646 696 HE3 LYS 88 HE3 LYS 88 -23.550 0.671 -20.324 697 HZ1 LYS 88 HZ1 LYS 88 -22.859 -1.024 -18.788 698 HZ2 LYS 88 HZ2 LYS 88 -22.942 -2.194 -19.964 699 HZ3 LYS 88 HZ3 LYS 88 -21.807 -1.012 -20.044 700 H ASP 89 H ASP 89 -28.881 -0.624 -15.131 701 HA ASP 89 HA ASP 89 -28.029 -2.900 -13.854 702 HB2 ASP 89 HB2 ASP 89 -29.526 -1.405 -12.761 703 HB3 ASP 89 HB3 ASP 89 -30.714 -1.507 -14.053 704 H ASP 90 H ASP 90 -30.188 -2.714 -16.637 705 HA ASP 90 HA ASP 90 -31.361 -5.298 -16.469 706 HB2 ASP 90 HB2 ASP 90 -32.300 -3.379 -17.719 707 HB3 ASP 90 HB3 ASP 90 -30.938 -3.435 -18.840 708 H ASP 91 H ASP 91 -28.098 -4.456 -17.343 709 HA ASP 91 HA ASP 91 -27.856 -6.990 -18.899 710 HB2 ASP 91 HB2 ASP 91 -27.560 -4.626 -20.085 711 HB3 ASP 91 HB3 ASP 91 -25.946 -4.750 -19.373 712 H VAL 92 H VAL 92 -25.831 -8.015 -18.888 713 HA VAL 92 HA VAL 92 -24.395 -7.812 -16.300 714 HB VAL 92 HB VAL 92 -25.559 -10.339 -17.541 715 HG11 VAL 92 HG11 VAL 92 -23.577 -10.725 -16.046 716 HG12 VAL 92 HG12 VAL 92 -24.491 -9.967 -14.720 717 HG13 VAL 92 HG13 VAL 92 -25.070 -11.463 -15.472 718 HG21 VAL 92 HG21 VAL 92 -26.671 -8.684 -15.248 719 HG22 VAL 92 HG22 VAL 92 -27.469 -9.064 -16.787 720 HG23 VAL 92 HG23 VAL 92 -27.175 -10.346 -15.620 721 H TYR 93 H TYR 93 -22.288 -8.557 -16.327 722 HA TYR 93 HA TYR 93 -20.980 -9.353 -18.862 723 HB2 TYR 93 HB2 TYR 93 -20.091 -7.062 -17.051 724 HB3 TYR 93 HB3 TYR 93 -19.351 -7.556 -18.566 725 HD1 TYR 93 HD2 TYR 93 -20.464 -7.072 -20.748 726 HD2 TYR 93 HD1 TYR 93 -22.093 -5.667 -17.004 727 HE1 TYR 93 HE2 TYR 93 -21.922 -5.496 -21.981 728 HE2 TYR 93 HE1 TYR 93 -23.580 -4.111 -18.232 729 HH TYR 93 HH TYR 93 -23.590 -3.880 -21.811 730 H THR 94 H THR 94 -18.392 -9.325 -17.933 731 HA THR 94 HA THR 94 -18.378 -10.765 -15.333 732 HB THR 94 HB THR 94 -16.616 -11.336 -17.751 733 HG1 THR 94 HG1 THR 94 -18.721 -12.127 -17.985 734 HG21 THR 94 HG21 THR 94 -15.398 -11.776 -15.672 735 HG22 THR 94 HG22 THR 94 -16.772 -12.688 -15.018 736 HG23 THR 94 HG23 THR 94 -15.864 -13.308 -16.417 737 H ALA 95 H ALA 95 -16.721 -10.108 -13.974 738 HA ALA 95 HA ALA 95 -14.971 -7.871 -14.863 739 HB1 ALA 95 HB1 ALA 95 -15.424 -6.688 -12.761 740 HB2 ALA 95 HB2 ALA 95 -16.939 -6.920 -13.657 741 HB3 ALA 95 HB3 ALA 95 -16.567 -7.959 -12.266 742 H LYS 96 H LYS 96 -13.056 -7.669 -13.612 743 HA LYS 96 HA LYS 96 -11.927 -10.208 -12.664 744 HB2 LYS 96 HB2 LYS 96 -10.963 -7.327 -12.688 745 HB3 LYS 96 HB3 LYS 96 -9.969 -8.677 -12.160 746 HG2 LYS 96 HG2 LYS 96 -9.668 -9.488 -14.318 747 HG3 LYS 96 HG3 LYS 96 -11.133 -8.744 -14.958 748 HD2 LYS 96 HD2 LYS 96 -8.832 -7.019 -13.974 749 HD3 LYS 96 HD3 LYS 96 -8.826 -7.712 -15.603 750 HE2 LYS 96 HE2 LYS 96 -10.827 -6.598 -16.247 751 HE3 LYS 96 HE3 LYS 96 -11.215 -6.116 -14.593 752 HZ1 LYS 96 HZ1 LYS 96 -10.186 -4.405 -16.171 753 HZ2 LYS 96 HZ2 LYS 96 -9.674 -4.436 -14.633 754 HZ3 LYS 96 HZ3 LYS 96 -8.752 -5.104 -15.843 755 H LEU 97 H LEU 97 -12.151 -10.858 -10.517 756 HA LEU 97 HA LEU 97 -13.493 -9.186 -8.563 757 HB2 LEU 97 HB2 LEU 97 -13.490 -11.683 -8.499 758 HB3 LEU 97 HB3 LEU 97 -11.751 -11.662 -8.189 759 HG LEU 97 HG LEU 97 -12.101 -10.536 -6.032 760 HD11 LEU 97 HD11 LEU 97 -14.467 -10.306 -5.145 761 HD12 LEU 97 HD12 LEU 97 -14.070 -9.166 -6.421 762 HD13 LEU 97 HD13 LEU 97 -15.060 -10.597 -6.787 763 HD21 LEU 97 HD21 LEU 97 -13.928 -12.953 -6.384 764 HD22 LEU 97 HD22 LEU 97 -12.162 -13.003 -6.178 765 HD23 LEU 97 HD23 LEU 97 -13.181 -12.399 -4.871 766 H SER 98 H SER 98 -10.146 -9.992 -9.393 767 HA SER 98 HA SER 98 -8.581 -8.582 -7.670 768 HB2 SER 98 HB2 SER 98 -8.249 -8.819 -10.689 769 HB3 SER 98 HB3 SER 98 -6.977 -8.795 -9.460 770 HG SER 98 HG SER 98 -7.658 -10.977 -10.301 771 H ASP 99 H ASP 99 -10.921 -7.109 -9.812 772 HA ASP 99 HA ASP 99 -9.575 -4.473 -9.558 773 HB2 ASP 99 HB2 ASP 99 -9.653 -5.644 -11.849 774 HB3 ASP 99 HB3 ASP 99 -11.402 -5.358 -11.807 775 H ILE 100 H ILE 100 -11.739 -6.022 -7.989 776 HA ILE 100 HA ILE 100 -13.798 -3.865 -7.968 777 HB ILE 100 HB ILE 100 -13.995 -6.827 -8.054 778 HG12 ILE 100 HG12 ILE 100 -15.907 -4.578 -8.808 779 HG13 ILE 100 HG13 ILE 100 -14.635 -5.212 -9.871 780 HG21 ILE 100 HG21 ILE 100 -14.888 -6.499 -5.766 781 HG22 ILE 100 HG22 ILE 100 -16.079 -5.342 -6.414 782 HG23 ILE 100 HG23 ILE 100 -16.105 -7.051 -6.894 783 HD11 ILE 100 HD11 ILE 100 -17.094 -6.689 -8.876 784 HD12 ILE 100 HD12 ILE 100 -16.721 -6.164 -10.522 785 HD13 ILE 100 HD13 ILE 100 -15.752 -7.455 -9.774 786 H GLU 101 H GLU 101 -14.699 -3.321 -6.089 787 HA GLU 101 HA GLU 101 -13.267 -3.958 -3.549 788 HB2 GLU 101 HB2 GLU 101 -12.742 -1.689 -4.279 789 HB3 GLU 101 HB3 GLU 101 -14.455 -1.336 -4.560 790 HG2 GLU 101 HG2 GLU 101 -14.949 -1.458 -2.192 791 HG3 GLU 101 HG3 GLU 101 -13.344 -2.101 -1.839 792 H ALA 102 H ALA 102 -14.636 -5.052 -2.231 793 HA ALA 102 HA ALA 102 -17.434 -5.415 -3.027 794 HB1 ALA 102 HB1 ALA 102 -17.498 -7.030 -1.218 795 HB2 ALA 102 HB2 ALA 102 -16.010 -7.268 -2.154 796 HB3 ALA 102 HB3 ALA 102 -15.944 -6.457 -0.573 797 H ILE 103 H ILE 103 -19.197 -4.559 -2.038 798 HA ILE 103 HA ILE 103 -18.821 -2.705 0.280 799 HB ILE 103 HB ILE 103 -20.288 -2.343 -2.342 800 HG12 ILE 103 HG12 ILE 103 -18.198 -0.598 -0.955 801 HG13 ILE 103 HG13 ILE 103 -17.828 -1.774 -2.216 802 HG21 ILE 103 HG21 ILE 103 -21.201 -0.203 -1.492 803 HG22 ILE 103 HG22 ILE 103 -21.817 -1.549 -0.569 804 HG23 ILE 103 HG23 ILE 103 -20.518 -0.542 0.113 805 HD11 ILE 103 HD11 ILE 103 -17.910 0.370 -3.215 806 HD12 ILE 103 HD12 ILE 103 -19.301 -0.582 -3.794 807 HD13 ILE 103 HD13 ILE 103 -19.523 0.704 -2.576 808 H ASP 104 H ASP 104 -20.316 -2.805 1.846 809 HA ASP 104 HA ASP 104 -21.978 -3.534 3.138 810 HB2 ASP 104 HB2 ASP 104 -23.153 -2.012 1.598 811 HB3 ASP 104 HB3 ASP 104 -23.607 -3.383 0.586 812 H VAL 105 H VAL 105 -20.313 -5.625 2.282 813 HA VAL 105 HA VAL 105 -22.214 -7.916 2.191 814 HB VAL 105 HB VAL 105 -20.580 -7.461 0.267 815 HG11 VAL 105 HG11 VAL 105 -18.556 -8.698 2.152 816 HG12 VAL 105 HG12 VAL 105 -18.347 -8.391 0.424 817 HG13 VAL 105 HG13 VAL 105 -18.526 -7.032 1.542 818 HG21 VAL 105 HG21 VAL 105 -21.933 -9.495 0.587 819 HG22 VAL 105 HG22 VAL 105 -20.395 -9.760 -0.234 820 HG23 VAL 105 HG23 VAL 105 -20.589 -10.235 1.465 821 H ASP 106 H ASP 106 -21.283 -9.962 3.238 822 HA ASP 106 HA ASP 106 -20.968 -9.457 6.045 823 HB2 ASP 106 HB2 ASP 106 -22.115 -11.449 5.105 824 HB3 ASP 106 HB3 ASP 106 -20.565 -12.000 4.438 825 H ASP 107 H ASP 107 -19.229 -10.080 7.360 826 HA ASP 107 HA ASP 107 -16.671 -9.103 6.648 827 HB2 ASP 107 HB2 ASP 107 -17.482 -9.251 8.953 828 HB3 ASP 107 HB3 ASP 107 -17.517 -11.013 8.857 829 H ASP 108 H ASP 108 -17.897 -12.521 6.552 830 HA ASP 108 HA ASP 108 -15.213 -13.510 6.112 831 HB2 ASP 108 HB2 ASP 108 -17.246 -14.758 7.102 832 HB3 ASP 108 HB3 ASP 108 -17.766 -14.990 5.426 833 H THR 109 H THR 109 -17.793 -12.324 4.044 834 HA THR 109 HA THR 109 -16.713 -13.365 1.510 835 HB THR 109 HB THR 109 -18.730 -11.150 2.140 836 HG1 THR 109 HG1 THR 109 -19.208 -13.433 2.681 837 HG21 THR 109 HG21 THR 109 -19.405 -11.786 -0.314 838 HG22 THR 109 HG22 THR 109 -18.023 -10.693 -0.059 839 HG23 THR 109 HG23 THR 109 -17.749 -12.393 -0.412 840 H GLN 110 H GLN 110 -16.787 -10.193 3.273 841 HA GLN 110 HA GLN 110 -15.176 -8.807 1.458 842 HB2 GLN 110 HB2 GLN 110 -16.568 -8.070 3.602 843 HB3 GLN 110 HB3 GLN 110 -15.027 -8.240 4.434 844 HG2 GLN 110 HG2 GLN 110 -15.655 -6.460 2.033 845 HG3 GLN 110 HG3 GLN 110 -15.468 -5.924 3.695 846 HE21 GLN 110 HE22 GLN 110 -13.822 -6.354 0.737 847 HE22 GLN 110 HE21 GLN 110 -12.187 -6.246 1.336 848 H GLU 111 H GLU 111 -14.187 -10.713 4.380 849 HA GLU 111 HA GLU 111 -11.411 -10.231 4.104 850 HB2 GLU 111 HB2 GLU 111 -13.045 -12.417 5.437 851 HB3 GLU 111 HB3 GLU 111 -11.291 -12.481 5.429 852 HG2 GLU 111 HG2 GLU 111 -12.896 -10.122 6.518 853 HG3 GLU 111 HG3 GLU 111 -12.248 -11.440 7.492 854 H ALA 112 H ALA 112 -13.466 -12.796 2.569 855 HA ALA 112 HA ALA 112 -11.235 -14.287 1.567 856 HB1 ALA 112 HB1 ALA 112 -13.524 -15.193 1.635 857 HB2 ALA 112 HB2 ALA 112 -14.053 -14.007 0.419 858 HB3 ALA 112 HB3 ALA 112 -12.866 -15.256 -0.008 859 H ILE 113 H ILE 113 -13.138 -11.579 0.202 860 HA ILE 113 HA ILE 113 -11.759 -11.505 -2.322 861 HB ILE 113 HB ILE 113 -13.428 -9.441 -0.822 862 HG12 ILE 113 HG12 ILE 113 -14.212 -11.284 -3.132 863 HG13 ILE 113 HG13 ILE 113 -14.535 -11.669 -1.462 864 HG21 ILE 113 HG21 ILE 113 -12.533 -9.453 -3.743 865 HG22 ILE 113 HG22 ILE 113 -13.705 -8.319 -3.039 866 HG23 ILE 113 HG23 ILE 113 -12.036 -8.294 -2.497 867 HD11 ILE 113 HD11 ILE 113 -15.856 -9.554 -1.233 868 HD12 ILE 113 HD12 ILE 113 -15.708 -9.348 -3.002 869 HD13 ILE 113 HD13 ILE 113 -16.529 -10.766 -2.335 870 H ALA 114 H ALA 114 -11.377 -9.658 0.764 871 HA ALA 114 HA ALA 114 -9.248 -8.001 -0.082 872 HB1 ALA 114 HB1 ALA 114 -9.816 -9.126 2.697 873 HB2 ALA 114 HB2 ALA 114 -8.788 -7.731 2.317 874 HB3 ALA 114 HB3 ALA 114 -10.532 -7.650 2.009 875 H ASP 115 H ASP 115 -9.222 -11.298 1.365 876 HA ASP 115 HA ASP 115 -6.383 -11.430 1.591 877 HB2 ASP 115 HB2 ASP 115 -8.032 -12.870 2.821 878 HB3 ASP 115 HB3 ASP 115 -8.284 -13.783 1.328 879 H TRP 116 H TRP 116 -8.612 -12.358 -1.077 880 HA TRP 116 HA TRP 116 -6.586 -13.479 -2.780 881 HB2 TRP 116 HB2 TRP 116 -8.868 -13.847 -3.404 882 HB3 TRP 116 HB3 TRP 116 -9.243 -12.128 -3.347 883 HD1 TRP 116 HD1 TRP 116 -9.196 -10.901 -5.556 884 HE1 TRP 116 HE1 TRP 116 -8.103 -11.198 -7.859 885 HE3 TRP 116 HE3 TRP 116 -6.562 -15.211 -4.686 886 HZ2 TRP 116 HZ2 TRP 116 -6.196 -12.960 -9.100 887 HZ3 TRP 116 HZ3 TRP 116 -5.141 -16.191 -6.458 888 HH2 TRP 116 HH2 TRP 116 -4.928 -15.064 -8.661 889 H LEU 117 H LEU 117 -7.815 -10.101 -2.400 890 HA LEU 117 HA LEU 117 -6.167 -8.999 -4.439 891 HB2 LEU 117 HB2 LEU 117 -7.382 -7.783 -1.927 892 HB3 LEU 117 HB3 LEU 117 -6.532 -6.828 -3.129 893 HG LEU 117 HG LEU 117 -8.898 -8.583 -3.907 894 HD11 LEU 117 HD11 LEU 117 -10.324 -6.577 -3.707 895 HD12 LEU 117 HD12 LEU 117 -9.684 -7.093 -2.141 896 HD13 LEU 117 HD13 LEU 117 -8.972 -5.687 -2.966 897 HD21 LEU 117 HD21 LEU 117 -7.688 -6.093 -5.181 898 HD22 LEU 117 HD22 LEU 117 -7.476 -7.759 -5.755 899 HD23 LEU 117 HD23 LEU 117 -9.082 -7.014 -5.783 900 H TYR 118 H TYR 118 -5.610 -9.440 -0.901 901 HA TYR 118 HA TYR 118 -3.033 -8.256 -0.775 902 HB2 TYR 118 HB2 TYR 118 -4.240 -10.521 0.863 903 HB3 TYR 118 HB3 TYR 118 -2.779 -9.663 1.283 904 HD1 TYR 118 HD2 TYR 118 -4.177 -6.813 0.380 905 HD2 TYR 118 HD1 TYR 118 -5.097 -10.048 3.097 906 HE1 TYR 118 HE2 TYR 118 -5.501 -5.271 1.765 907 HE2 TYR 118 HE1 TYR 118 -6.429 -8.503 4.487 908 HH TYR 118 HH TYR 118 -7.195 -6.315 4.761 909 H TRP 119 H TRP 119 -3.981 -11.708 -1.369 910 HA TRP 119 HA TRP 119 -1.321 -12.705 -1.673 911 HB2 TRP 119 HB2 TRP 119 -3.056 -14.301 -1.491 912 HB3 TRP 119 HB3 TRP 119 -4.030 -13.535 -2.739 913 HD1 TRP 119 HD1 TRP 119 -3.756 -14.281 -5.149 914 HE1 TRP 119 HE1 TRP 119 -2.295 -15.943 -6.440 915 HE3 TRP 119 HE3 TRP 119 -0.421 -15.424 -1.437 916 HZ2 TRP 119 HZ2 TRP 119 -0.006 -17.620 -5.880 917 HZ3 TRP 119 HZ3 TRP 119 1.428 -17.011 -1.865 918 HH2 TRP 119 HH2 TRP 119 1.651 -18.116 -4.085 919 H LEU 120 H LEU 120 -3.557 -11.195 -4.081 920 HA LEU 120 HA LEU 120 -1.854 -11.737 -6.261 921 HB2 LEU 120 HB2 LEU 120 -4.286 -11.212 -6.391 922 HB3 LEU 120 HB3 LEU 120 -3.929 -9.533 -5.969 923 HG LEU 120 HG LEU 120 -2.593 -9.286 -8.052 924 HD11 LEU 120 HD11 LEU 120 -1.796 -11.574 -8.431 925 HD12 LEU 120 HD12 LEU 120 -3.462 -12.162 -8.611 926 HD13 LEU 120 HD13 LEU 120 -2.757 -11.062 -9.816 927 HD21 LEU 120 HD21 LEU 120 -4.993 -8.747 -8.027 928 HD22 LEU 120 HD22 LEU 120 -4.487 -9.355 -9.611 929 HD23 LEU 120 HD23 LEU 120 -5.382 -10.416 -8.501 930 H ALA 121 H ALA 121 -2.015 -9.015 -3.988 931 HA ALA 121 HA ALA 121 -0.018 -7.399 -5.289 932 HB1 ALA 121 HB1 ALA 121 -1.667 -6.526 -3.656 933 HB2 ALA 121 HB2 ALA 121 -0.966 -7.543 -2.387 934 HB3 ALA 121 HB3 ALA 121 -0.005 -6.221 -3.092 935 H ARG 122 H ARG 122 0.115 -9.959 -2.794 936 HA ARG 122 HA ARG 122 2.895 -9.702 -2.179 937 HB2 ARG 122 HB2 ARG 122 1.210 -10.712 -0.762 938 HB3 ARG 122 HB3 ARG 122 1.021 -12.067 -1.879 939 HG2 ARG 122 HG2 ARG 122 3.126 -12.981 -1.354 940 HG3 ARG 122 HG3 ARG 122 3.768 -11.429 -0.787 941 HD2 ARG 122 HD2 ARG 122 3.372 -12.839 1.130 942 HD3 ARG 122 HD3 ARG 122 2.289 -11.442 1.114 943 HE ARG 122 HE ARG 122 1.590 -14.294 0.470 944 HH11 ARG 122 HH11 ARG 122 0.571 -11.294 1.959 945 HH12 ARG 122 HH12 ARG 122 -1.135 -11.551 1.761 946 HH21 ARG 122 HH21 ARG 122 -0.591 -14.921 0.809 947 HH22 ARG 122 HH22 ARG 122 -1.814 -13.747 1.169 948 H GLY 123 H GLY 123 1.222 -11.281 -4.914 949 HA2 GLY 123 HA2 GLY 123 3.463 -11.809 -6.458 950 HA3 GLY 123 HA3 GLY 123 3.197 -13.255 -5.459 951 H TYR 124 H TYR 124 2.899 -13.737 -7.993 952 HA TYR 124 HA TYR 124 0.025 -14.104 -8.416 953 HB2 TYR 124 HB2 TYR 124 0.510 -11.874 -9.379 954 HB3 TYR 124 HB3 TYR 124 1.749 -12.584 -10.404 955 HD1 TYR 124 HD2 TYR 124 -1.614 -14.191 -9.772 956 HD2 TYR 124 HD1 TYR 124 0.805 -11.838 -12.478 957 HE1 TYR 124 HE2 TYR 124 -3.263 -14.544 -11.533 958 HE2 TYR 124 HE1 TYR 124 -0.880 -12.154 -14.252 959 HH TYR 124 HH TYR 124 -2.919 -13.098 -14.833 960 H LYS 125 H LYS 125 1.504 -16.078 -7.690 961 HA LYS 125 HA LYS 125 2.799 -17.516 -9.902 962 HB2 LYS 125 HB2 LYS 125 1.924 -18.469 -7.135 963 HB3 LYS 125 HB3 LYS 125 2.910 -19.381 -8.270 964 HG2 LYS 125 HG2 LYS 125 3.712 -16.783 -6.886 965 HG3 LYS 125 HG3 LYS 125 4.260 -18.410 -6.482 966 HD2 LYS 125 HD2 LYS 125 5.300 -18.603 -8.755 967 HD3 LYS 125 HD3 LYS 125 4.836 -16.916 -9.081 968 HE2 LYS 125 HE2 LYS 125 6.150 -16.171 -7.114 969 HE3 LYS 125 HE3 LYS 125 6.612 -17.845 -6.781 970 HZ1 LYS 125 HZ1 LYS 125 7.336 -16.337 -9.228 971 HZ2 LYS 125 HZ2 LYS 125 8.338 -16.679 -7.991 972 HZ3 LYS 125 HZ3 LYS 125 7.761 -17.886 -8.918 973 H PHE 126 H PHE 126 -0.392 -17.282 -8.403 974 HA PHE 126 HA PHE 126 -1.761 -18.598 -10.511 975 HB2 PHE 126 HB2 PHE 126 -2.869 -20.248 -8.859 976 HB3 PHE 126 HB3 PHE 126 -1.312 -20.663 -9.528 977 HD1 PHE 126 HD1 PHE 126 -2.991 -19.457 -6.426 978 HD2 PHE 126 HD2 PHE 126 0.626 -21.016 -8.178 979 HE1 PHE 126 HE1 PHE 126 -2.037 -19.844 -4.152 980 HE2 PHE 126 HE2 PHE 126 1.589 -21.343 -5.919 981 HZ PHE 126 HZ PHE 126 0.250 -20.751 -3.897 Start of MODEL 10 1 H1 MET 1 H1 MET 1 4.130 -2.853 -3.583 2 H2 MET 1 H2 MET 1 2.524 -2.621 -3.395 3 H3 MET 1 H3 MET 1 3.589 -1.552 -2.748 4 HA MET 1 HA MET 1 4.438 -3.220 -1.254 5 HB2 MET 1 HB2 MET 1 2.571 -1.730 -0.547 6 HB3 MET 1 HB3 MET 1 1.399 -2.940 -1.061 7 HG2 MET 1 HG2 MET 1 3.535 -3.418 1.061 8 HG3 MET 1 HG3 MET 1 1.925 -2.804 1.403 9 HE1 MET 1 HE1 MET 1 1.369 -4.582 3.199 10 HE2 MET 1 HE2 MET 1 1.643 -6.324 2.985 11 HE3 MET 1 HE3 MET 1 3.023 -5.203 3.006 12 H ALA 2 H ALA 2 4.954 -5.352 -1.127 13 HA ALA 2 HA ALA 2 2.921 -7.381 -1.922 14 HB1 ALA 2 HB1 ALA 2 4.565 -7.164 -3.770 15 HB2 ALA 2 HB2 ALA 2 5.892 -7.466 -2.622 16 HB3 ALA 2 HB3 ALA 2 4.695 -8.734 -2.958 17 H SER 3 H SER 3 4.747 -6.118 0.550 18 HA SER 3 HA SER 3 5.976 -8.400 1.669 19 HB2 SER 3 HB2 SER 3 5.345 -5.774 3.046 20 HB3 SER 3 HB3 SER 3 6.729 -6.851 3.312 21 HG SER 3 HG SER 3 7.327 -5.059 2.046 22 H VAL 4 H VAL 4 3.118 -8.959 1.362 23 HA VAL 4 HA VAL 4 1.858 -8.880 3.956 24 HB VAL 4 HB VAL 4 1.145 -10.988 1.928 25 HG11 VAL 4 HG11 VAL 4 -0.108 -10.815 4.068 26 HG12 VAL 4 HG12 VAL 4 -0.552 -9.144 3.661 27 HG13 VAL 4 HG13 VAL 4 -1.130 -10.500 2.668 28 HG21 VAL 4 HG21 VAL 4 -0.296 -9.367 0.705 29 HG22 VAL 4 HG22 VAL 4 0.472 -8.031 1.584 30 HG23 VAL 4 HG23 VAL 4 1.408 -9.039 0.454 31 H GLU 5 H GLU 5 4.464 -10.737 2.681 32 HA GLU 5 HA GLU 5 4.354 -13.102 4.200 33 HB2 GLU 5 HB2 GLU 5 5.954 -12.270 2.308 34 HB3 GLU 5 HB3 GLU 5 6.920 -11.590 3.608 35 HG2 GLU 5 HG2 GLU 5 7.210 -13.831 4.592 36 HG3 GLU 5 HG3 GLU 5 6.065 -14.519 3.437 37 H ARG 6 H ARG 6 4.608 -9.859 5.354 38 HA ARG 6 HA ARG 6 6.009 -10.158 7.778 39 HB2 ARG 6 HB2 ARG 6 4.703 -8.264 8.561 40 HB3 ARG 6 HB3 ARG 6 5.194 -8.021 6.887 41 HG2 ARG 6 HG2 ARG 6 2.858 -8.777 6.174 42 HG3 ARG 6 HG3 ARG 6 2.423 -8.874 7.880 43 HD2 ARG 6 HD2 ARG 6 1.634 -6.785 6.924 44 HD3 ARG 6 HD3 ARG 6 2.869 -6.476 8.159 45 HE ARG 6 HE ARG 6 4.008 -6.673 5.508 46 HH11 ARG 6 HH11 ARG 6 2.094 -4.451 7.511 47 HH12 ARG 6 HH12 ARG 6 2.801 -3.015 6.874 48 HH21 ARG 6 HH21 ARG 6 5.091 -4.724 4.778 49 HH22 ARG 6 HH22 ARG 6 4.491 -3.181 5.241 50 H ASP 7 H ASP 7 2.974 -11.643 6.839 51 HA ASP 7 HA ASP 7 2.792 -12.826 9.562 52 HB2 ASP 7 HB2 ASP 7 0.966 -11.249 9.441 53 HB3 ASP 7 HB3 ASP 7 0.452 -11.899 7.876 54 H GLU 8 H GLU 8 4.225 -14.344 8.559 55 HA GLU 8 HA GLU 8 3.692 -15.889 6.297 56 HB2 GLU 8 HB2 GLU 8 5.104 -16.735 8.862 57 HB3 GLU 8 HB3 GLU 8 5.195 -17.567 7.303 58 HG2 GLU 8 HG2 GLU 8 6.165 -15.495 6.286 59 HG3 GLU 8 HG3 GLU 8 6.201 -14.764 7.900 60 H THR 9 H THR 9 2.028 -16.039 9.398 61 HA THR 9 HA THR 9 1.114 -18.668 9.483 62 HB THR 9 HB THR 9 -0.727 -16.339 10.011 63 HG1 THR 9 HG1 THR 9 0.813 -15.479 11.012 64 HG21 THR 9 HG21 THR 9 -0.163 -18.923 11.528 65 HG22 THR 9 HG22 THR 9 -1.362 -17.685 11.977 66 HG23 THR 9 HG23 THR 9 -1.560 -18.601 10.476 67 H ARG 10 H ARG 10 -0.192 -15.927 7.479 68 HA ARG 10 HA ARG 10 -2.352 -17.546 6.529 69 HB2 ARG 10 HB2 ARG 10 -2.438 -15.072 6.545 70 HB3 ARG 10 HB3 ARG 10 -1.129 -15.002 5.361 71 HG2 ARG 10 HG2 ARG 10 -3.334 -14.621 4.342 72 HG3 ARG 10 HG3 ARG 10 -2.537 -16.042 3.662 73 HD2 ARG 10 HD2 ARG 10 -3.930 -17.512 5.100 74 HD3 ARG 10 HD3 ARG 10 -4.735 -16.087 5.784 75 HE ARG 10 HE ARG 10 -5.269 -15.657 3.225 76 HH11 ARG 10 HH21 ARG 10 -5.593 -18.652 5.123 77 HH12 ARG 10 HH22 ARG 10 -6.806 -19.334 4.111 78 HH21 ARG 10 HH11 ARG 10 -6.773 -16.595 1.820 79 HH22 ARG 10 HH12 ARG 10 -7.499 -18.137 2.149 80 H GLU 11 H GLU 11 0.958 -16.946 5.368 81 HA GLU 11 HA GLU 11 0.636 -18.110 2.775 82 HB2 GLU 11 HB2 GLU 11 3.150 -17.974 4.496 83 HB3 GLU 11 HB3 GLU 11 3.094 -18.230 2.762 84 HG2 GLU 11 HG2 GLU 11 2.138 -15.667 4.131 85 HG3 GLU 11 HG3 GLU 11 3.766 -15.928 3.543 86 H HIS 12 H HIS 12 1.784 -19.457 5.924 87 HA HIS 12 HA HIS 12 2.132 -22.128 4.987 88 HB2 HIS 12 HB2 HIS 12 1.454 -21.088 7.774 89 HB3 HIS 12 HB3 HIS 12 1.937 -22.740 7.406 90 HD1 HIS 12 HD1 HIS 12 4.546 -22.639 5.908 91 HD2 HIS 12 HD2 HIS 12 3.418 -19.789 8.791 92 HE1 HIS 12 HE1 HIS 12 6.702 -21.581 6.743 93 H ARG 13 H ARG 13 -0.710 -20.526 6.589 94 HA ARG 13 HA ARG 13 -2.197 -22.970 6.670 95 HB2 ARG 13 HB2 ARG 13 -3.064 -20.061 6.896 96 HB3 ARG 13 HB3 ARG 13 -4.178 -21.428 7.002 97 HG2 ARG 13 HG2 ARG 13 -2.683 -22.387 8.856 98 HG3 ARG 13 HG3 ARG 13 -1.820 -20.857 8.862 99 HD2 ARG 13 HD2 ARG 13 -3.486 -20.799 10.605 100 HD3 ARG 13 HD3 ARG 13 -3.998 -19.684 9.321 101 HE ARG 13 HE ARG 13 -4.995 -22.422 9.033 102 HH11 ARG 13 HH11 ARG 13 -5.752 -19.381 10.714 103 HH12 ARG 13 HH12 ARG 13 -7.459 -19.629 10.671 104 HH21 ARG 13 HH21 ARG 13 -7.196 -22.679 8.814 105 HH22 ARG 13 HH22 ARG 13 -8.314 -21.613 9.621 106 H ILE 14 H ILE 14 -2.270 -20.318 4.164 107 HA ILE 14 HA ILE 14 -4.427 -21.573 2.813 108 HB ILE 14 HB ILE 14 -3.692 -19.218 2.468 109 HG12 ILE 14 HG12 ILE 14 -4.087 -20.961 -0.001 110 HG13 ILE 14 HG13 ILE 14 -5.341 -20.358 1.081 111 HG21 ILE 14 HG21 ILE 14 -1.625 -20.302 0.510 112 HG22 ILE 14 HG22 ILE 14 -1.975 -18.606 0.903 113 HG23 ILE 14 HG23 ILE 14 -1.239 -19.645 2.112 114 HD11 ILE 14 HD11 ILE 14 -5.368 -19.004 -0.858 115 HD12 ILE 14 HD12 ILE 14 -4.707 -18.010 0.456 116 HD13 ILE 14 HD13 ILE 14 -3.623 -18.698 -0.782 117 H GLU 15 H GLU 15 -0.882 -21.994 2.549 118 HA GLU 15 HA GLU 15 -0.804 -23.792 0.363 119 HB2 GLU 15 HB2 GLU 15 1.138 -22.635 1.252 120 HB3 GLU 15 HB3 GLU 15 0.986 -23.482 2.787 121 HG2 GLU 15 HG2 GLU 15 2.758 -24.472 1.477 122 HG3 GLU 15 HG3 GLU 15 1.450 -25.623 1.723 123 H THR 16 H THR 16 -1.423 -24.405 3.852 124 HA THR 16 HA THR 16 -1.347 -27.305 3.300 125 HB THR 16 HB THR 16 -1.292 -27.462 5.800 126 HG1 THR 16 HG1 THR 16 -0.760 -24.678 5.686 127 HG21 THR 16 HG21 THR 16 0.910 -25.790 4.504 128 HG22 THR 16 HG22 THR 16 1.048 -26.757 5.990 129 HG23 THR 16 HG23 THR 16 0.759 -27.558 4.439 130 H GLU 17 H GLU 17 -3.812 -24.978 3.414 131 HA GLU 17 HA GLU 17 -5.791 -27.054 4.288 132 HB2 GLU 17 HB2 GLU 17 -5.907 -24.053 4.760 133 HB3 GLU 17 HB3 GLU 17 -7.073 -25.263 5.294 134 HG2 GLU 17 HG2 GLU 17 -5.340 -26.330 6.708 135 HG3 GLU 17 HG3 GLU 17 -4.168 -25.117 6.190 136 H ILE 18 H ILE 18 -5.106 -24.558 1.843 137 HA ILE 18 HA ILE 18 -7.854 -24.987 0.727 138 HB ILE 18 HB ILE 18 -6.060 -22.555 0.877 139 HG12 ILE 18 HG12 ILE 18 -8.878 -23.142 1.911 140 HG13 ILE 18 HG13 ILE 18 -7.418 -23.134 2.894 141 HG21 ILE 18 HG21 ILE 18 -8.705 -22.759 -0.618 142 HG22 ILE 18 HG22 ILE 18 -7.720 -21.288 -0.390 143 HG23 ILE 18 HG23 ILE 18 -7.115 -22.588 -1.384 144 HD11 ILE 18 HD11 ILE 18 -8.663 -20.710 1.562 145 HD12 ILE 18 HD12 ILE 18 -8.623 -21.105 3.281 146 HD13 ILE 18 HD13 ILE 18 -7.112 -20.718 2.440 147 H ILE 19 H ILE 19 -4.393 -24.800 -0.093 148 HA ILE 19 HA ILE 19 -5.084 -25.829 -2.815 149 HB ILE 19 HB ILE 19 -3.163 -24.618 -3.665 150 HG12 ILE 19 HG12 ILE 19 -2.719 -23.909 -0.782 151 HG13 ILE 19 HG13 ILE 19 -1.594 -24.571 -1.937 152 HG21 ILE 19 HG21 ILE 19 -4.112 -22.421 -3.674 153 HG22 ILE 19 HG22 ILE 19 -5.451 -23.561 -3.564 154 HG23 ILE 19 HG23 ILE 19 -4.916 -22.678 -2.117 155 HD11 ILE 19 HD11 ILE 19 -0.989 -22.301 -1.407 156 HD12 ILE 19 HD12 ILE 19 -1.576 -22.321 -3.088 157 HD13 ILE 19 HD13 ILE 19 -2.611 -21.711 -1.766 158 H VAL 20 H VAL 20 -4.139 -27.046 -0.012 159 HA VAL 20 HA VAL 20 -1.650 -28.254 -0.447 160 HB VAL 20 HB VAL 20 -2.988 -27.980 1.649 161 HG11 VAL 20 HG11 VAL 20 -4.422 -30.540 0.918 162 HG12 VAL 20 HG12 VAL 20 -4.515 -29.652 2.446 163 HG13 VAL 20 HG13 VAL 20 -5.153 -28.916 0.974 164 HG21 VAL 20 HG21 VAL 20 -0.911 -29.297 1.596 165 HG22 VAL 20 HG22 VAL 20 -2.063 -29.935 2.782 166 HG23 VAL 20 HG23 VAL 20 -1.847 -30.763 1.225 167 H ASP 21 H ASP 21 -4.866 -29.226 -1.434 168 HA ASP 21 HA ASP 21 -4.159 -31.878 -2.352 169 HB2 ASP 21 HB2 ASP 21 -6.383 -31.193 -1.435 170 HB3 ASP 21 HB3 ASP 21 -6.644 -30.198 -2.868 171 H ALA 22 H ALA 22 -3.195 -29.028 -3.676 172 HA ALA 22 HA ALA 22 -3.605 -29.835 -6.519 173 HB1 ALA 22 HB1 ALA 22 -3.983 -27.157 -5.115 174 HB2 ALA 22 HB2 ALA 22 -3.796 -27.315 -6.866 175 HB3 ALA 22 HB3 ALA 22 -5.177 -28.078 -6.050 176 H GLU 23 H GLU 23 -1.838 -29.640 -7.800 177 HA GLU 23 HA GLU 23 0.731 -28.778 -6.523 178 HB2 GLU 23 HB2 GLU 23 -0.025 -31.228 -8.158 179 HB3 GLU 23 HB3 GLU 23 1.648 -30.748 -7.912 180 HG2 GLU 23 HG2 GLU 23 -0.253 -31.319 -5.599 181 HG3 GLU 23 HG3 GLU 23 0.753 -32.539 -6.361 182 H ASP 24 H ASP 24 -1.406 -28.215 -9.124 183 HA ASP 24 HA ASP 24 0.756 -26.838 -10.661 184 HB2 ASP 24 HB2 ASP 24 0.044 -28.840 -11.894 185 HB3 ASP 24 HB3 ASP 24 -1.649 -28.364 -11.736 186 H LYS 25 H LYS 25 0.125 -24.818 -11.554 187 HA LYS 25 HA LYS 25 -1.454 -23.272 -9.873 188 HB2 LYS 25 HB2 LYS 25 -1.247 -21.506 -11.544 189 HB3 LYS 25 HB3 LYS 25 0.280 -22.293 -11.213 190 HG2 LYS 25 HG2 LYS 25 0.365 -23.350 -13.320 191 HG3 LYS 25 HG3 LYS 25 -1.360 -23.133 -13.640 192 HD2 LYS 25 HD2 LYS 25 0.542 -20.785 -13.332 193 HD3 LYS 25 HD3 LYS 25 0.232 -21.563 -14.894 194 HE2 LYS 25 HE2 LYS 25 -2.005 -20.910 -14.981 195 HE3 LYS 25 HE3 LYS 25 -2.144 -20.725 -13.235 196 HZ1 LYS 25 HZ1 LYS 25 -0.568 -18.884 -14.934 197 HZ2 LYS 25 HZ2 LYS 25 -2.087 -18.588 -14.412 198 HZ3 LYS 25 HZ3 LYS 25 -0.879 -18.728 -13.320 199 H GLU 26 H GLU 26 -2.599 -25.040 -12.778 200 HA GLU 26 HA GLU 26 -5.090 -23.581 -12.975 201 HB2 GLU 26 HB2 GLU 26 -4.214 -26.366 -13.877 202 HB3 GLU 26 HB3 GLU 26 -5.801 -25.695 -14.214 203 HG2 GLU 26 HG2 GLU 26 -4.731 -23.748 -15.370 204 HG3 GLU 26 HG3 GLU 26 -3.149 -24.478 -15.110 205 H GLU 27 H GLU 27 -4.005 -26.477 -11.175 206 HA GLU 27 HA GLU 27 -6.610 -27.158 -10.117 207 HB2 GLU 27 HB2 GLU 27 -3.844 -27.784 -9.017 208 HB3 GLU 27 HB3 GLU 27 -5.352 -28.601 -8.600 209 HG2 GLU 27 HG2 GLU 27 -5.520 -29.430 -10.936 210 HG3 GLU 27 HG3 GLU 27 -3.982 -28.644 -11.324 211 H ARG 28 H ARG 28 -3.844 -25.136 -9.036 212 HA ARG 28 HA ARG 28 -5.025 -24.593 -6.452 213 HB2 ARG 28 HB2 ARG 28 -2.793 -23.153 -7.956 214 HB3 ARG 28 HB3 ARG 28 -3.290 -22.828 -6.282 215 HG2 ARG 28 HG2 ARG 28 -2.947 -25.266 -5.778 216 HG3 ARG 28 HG3 ARG 28 -2.187 -25.465 -7.353 217 HD2 ARG 28 HD2 ARG 28 -0.331 -24.088 -6.723 218 HD3 ARG 28 HD3 ARG 28 -1.201 -23.481 -5.294 219 HE ARG 28 HE ARG 28 -0.870 -26.387 -5.350 220 HH11 ARG 28 HH11 ARG 28 0.732 -23.405 -4.244 221 HH12 ARG 28 HH12 ARG 28 1.215 -24.111 -2.723 222 HH21 ARG 28 HH21 ARG 28 -0.189 -27.277 -3.471 223 HH22 ARG 28 HH22 ARG 28 0.810 -26.381 -2.328 224 H ALA 29 H ALA 29 -5.428 -23.057 -9.620 225 HA ALA 29 HA ALA 29 -6.844 -20.745 -8.632 226 HB1 ALA 29 HB1 ALA 29 -6.051 -20.939 -10.997 227 HB2 ALA 29 HB2 ALA 29 -7.255 -22.219 -11.277 228 HB3 ALA 29 HB3 ALA 29 -7.784 -20.583 -10.880 229 H MET 30 H MET 30 -7.809 -24.145 -9.429 230 HA MET 30 HA MET 30 -10.585 -23.698 -8.814 231 HB2 MET 30 HB2 MET 30 -9.020 -26.291 -8.851 232 HB3 MET 30 HB3 MET 30 -10.770 -26.135 -8.733 233 HG2 MET 30 HG2 MET 30 -9.084 -25.168 -11.070 234 HG3 MET 30 HG3 MET 30 -10.020 -26.649 -11.004 235 HE1 MET 30 HE1 MET 30 -10.899 -22.558 -10.446 236 HE2 MET 30 HE2 MET 30 -9.859 -23.007 -11.813 237 HE3 MET 30 HE3 MET 30 -11.532 -22.479 -12.083 238 H GLY 31 H GLY 31 -7.837 -24.799 -6.761 239 HA2 GLY 31 HA2 GLY 31 -9.267 -25.298 -4.398 240 HA3 GLY 31 HA3 GLY 31 -7.628 -24.624 -4.466 241 H TRP 32 H TRP 32 -7.823 -22.150 -5.434 242 HA TRP 32 HA TRP 32 -8.953 -20.481 -3.509 243 HB2 TRP 32 HB2 TRP 32 -8.007 -20.115 -6.342 244 HB3 TRP 32 HB3 TRP 32 -8.962 -18.839 -5.614 245 HD1 TRP 32 HD1 TRP 32 -5.521 -20.382 -5.405 246 HE1 TRP 32 HE1 TRP 32 -4.011 -18.850 -4.024 247 HE3 TRP 32 HE3 TRP 32 -9.093 -17.253 -3.496 248 HZ2 TRP 32 HZ2 TRP 32 -4.322 -16.587 -2.243 249 HZ3 TRP 32 HZ3 TRP 32 -8.460 -15.459 -1.904 250 HH2 TRP 32 HH2 TRP 32 -6.079 -15.099 -1.299 251 H TYR 33 H TYR 33 -10.330 -21.333 -6.755 252 HA TYR 33 HA TYR 33 -12.641 -19.780 -6.565 253 HB2 TYR 33 HB2 TYR 33 -11.970 -20.770 -8.660 254 HB3 TYR 33 HB3 TYR 33 -12.108 -22.397 -8.005 255 HD1 TYR 33 HD1 TYR 33 -14.010 -19.513 -9.301 256 HD2 TYR 33 HD2 TYR 33 -14.275 -23.480 -7.635 257 HE1 TYR 33 HE1 TYR 33 -16.376 -19.641 -9.984 258 HE2 TYR 33 HE2 TYR 33 -16.685 -23.551 -8.159 259 HH TYR 33 HH TYR 33 -18.475 -22.454 -9.188 260 H TYR 34 H TYR 34 -12.194 -23.218 -5.486 261 HA TYR 34 HA TYR 34 -14.937 -23.633 -4.936 262 HB2 TYR 34 HB2 TYR 34 -12.485 -24.951 -3.698 263 HB3 TYR 34 HB3 TYR 34 -14.133 -25.513 -3.481 264 HD1 TYR 34 HD2 TYR 34 -15.306 -25.404 -6.210 265 HD2 TYR 34 HD1 TYR 34 -11.401 -26.672 -4.868 266 HE1 TYR 34 HE2 TYR 34 -15.104 -26.856 -8.190 267 HE2 TYR 34 HE1 TYR 34 -11.206 -28.158 -6.835 268 HH TYR 34 HH TYR 34 -13.776 -28.392 -9.340 269 H TYR 35 H TYR 35 -12.248 -22.673 -2.655 270 HA TYR 35 HA TYR 35 -14.177 -22.564 -0.506 271 HB2 TYR 35 HB2 TYR 35 -12.487 -22.289 0.888 272 HB3 TYR 35 HB3 TYR 35 -11.505 -22.809 -0.462 273 HD1 TYR 35 HD1 TYR 35 -10.159 -21.128 -1.729 274 HD2 TYR 35 HD2 TYR 35 -12.477 -20.005 1.725 275 HE1 TYR 35 HE1 TYR 35 -8.866 -19.027 -1.561 276 HE2 TYR 35 HE2 TYR 35 -11.222 -17.887 1.896 277 HH TYR 35 HH TYR 35 -9.544 -16.567 1.000 278 H LEU 36 H LEU 36 -12.862 -20.104 -2.774 279 HA LEU 36 HA LEU 36 -13.882 -17.851 -1.389 280 HB2 LEU 36 HB2 LEU 36 -12.193 -17.682 -3.148 281 HB3 LEU 36 HB3 LEU 36 -13.338 -18.290 -4.351 282 HG LEU 36 HG LEU 36 -14.739 -16.281 -4.090 283 HD11 LEU 36 HD11 LEU 36 -13.872 -14.315 -2.808 284 HD12 LEU 36 HD12 LEU 36 -14.333 -15.650 -1.752 285 HD13 LEU 36 HD13 LEU 36 -12.614 -15.349 -2.103 286 HD21 LEU 36 HD21 LEU 36 -13.226 -14.723 -5.165 287 HD22 LEU 36 HD22 LEU 36 -11.806 -15.577 -4.517 288 HD23 LEU 36 HD23 LEU 36 -12.859 -16.359 -5.714 289 H ASP 37 H ASP 37 -15.324 -19.747 -4.144 290 HA ASP 37 HA ASP 37 -17.751 -18.291 -4.288 291 HB2 ASP 37 HB2 ASP 37 -17.038 -19.861 -6.031 292 HB3 ASP 37 HB3 ASP 37 -17.165 -21.214 -4.902 293 H ASP 38 H ASP 38 -16.868 -21.153 -2.306 294 HA ASP 38 HA ASP 38 -19.402 -21.464 -1.039 295 HB2 ASP 38 HB2 ASP 38 -17.658 -23.183 -1.024 296 HB3 ASP 38 HB3 ASP 38 -16.613 -22.150 -0.046 297 H THR 39 H THR 39 -16.878 -19.063 -0.466 298 HA THR 39 HA THR 39 -17.886 -18.459 2.248 299 HB THR 39 HB THR 39 -15.508 -17.378 0.684 300 HG1 THR 39 HG1 THR 39 -15.172 -19.459 1.176 301 HG21 THR 39 HG21 THR 39 -14.746 -16.673 3.023 302 HG22 THR 39 HG22 THR 39 -16.062 -15.720 2.324 303 HG23 THR 39 HG23 THR 39 -16.423 -16.937 3.555 304 H LEU 40 H LEU 40 -17.783 -16.993 -1.028 305 HA LEU 40 HA LEU 40 -18.519 -14.359 -0.299 306 HB2 LEU 40 HB2 LEU 40 -19.106 -15.970 -2.804 307 HB3 LEU 40 HB3 LEU 40 -19.510 -14.264 -2.640 308 HG LEU 40 HG LEU 40 -16.699 -15.398 -2.533 309 HD11 LEU 40 HD11 LEU 40 -18.108 -13.850 -4.742 310 HD12 LEU 40 HD12 LEU 40 -16.431 -14.442 -4.769 311 HD13 LEU 40 HD13 LEU 40 -17.773 -15.593 -4.754 312 HD21 LEU 40 HD21 LEU 40 -16.010 -13.013 -2.894 313 HD22 LEU 40 HD22 LEU 40 -17.659 -12.553 -2.424 314 HD23 LEU 40 HD23 LEU 40 -16.585 -13.435 -1.286 315 H GLU 41 H GLU 41 -20.354 -13.717 0.779 316 HA GLU 41 HA GLU 41 -22.804 -15.298 0.771 317 HB2 GLU 41 HB2 GLU 41 -22.011 -12.631 2.009 318 HB3 GLU 41 HB3 GLU 41 -23.615 -13.344 2.205 319 HG2 GLU 41 HG2 GLU 41 -21.107 -14.890 2.913 320 HG3 GLU 41 HG3 GLU 41 -21.879 -13.787 4.052 321 H PHE 42 H PHE 42 -22.321 -14.906 -1.740 322 HA PHE 42 HA PHE 42 -23.222 -12.460 -2.899 323 HB2 PHE 42 HB2 PHE 42 -23.074 -13.579 -5.025 324 HB3 PHE 42 HB3 PHE 42 -21.701 -14.014 -4.043 325 HD1 PHE 42 HD2 PHE 42 -24.987 -15.231 -5.362 326 HD2 PHE 42 HD1 PHE 42 -21.217 -16.345 -3.575 327 HE1 PHE 42 HE2 PHE 42 -25.469 -17.617 -5.815 328 HE2 PHE 42 HE1 PHE 42 -21.707 -18.721 -4.028 329 HZ PHE 42 HZ PHE 42 -23.834 -19.372 -5.145 330 HA PRO 43 HA PRO 43 -24.368 -11.821 -4.970 331 HB2 PRO 43 HB2 PRO 43 -26.390 -10.063 -5.420 332 HB3 PRO 43 HB3 PRO 43 -26.302 -11.657 -6.228 333 HG2 PRO 43 HG2 PRO 43 -27.909 -10.916 -3.766 334 HG3 PRO 43 HG3 PRO 43 -28.461 -11.795 -5.228 335 HD2 PRO 43 HD2 PRO 43 -27.683 -13.093 -2.948 336 HD3 PRO 43 HD3 PRO 43 -27.358 -13.772 -4.569 337 H PHE 44 H PHE 44 -23.598 -9.666 -4.657 338 HA PHE 44 HA PHE 44 -24.265 -8.219 -2.185 339 HB2 PHE 44 HB2 PHE 44 -22.038 -8.124 -1.363 340 HB3 PHE 44 HB3 PHE 44 -22.522 -9.801 -1.466 341 HD1 PHE 44 HD1 PHE 44 -21.554 -11.266 -3.348 342 HD2 PHE 44 HD2 PHE 44 -20.036 -7.351 -2.398 343 HE1 PHE 44 HE1 PHE 44 -19.414 -11.831 -4.453 344 HE2 PHE 44 HE2 PHE 44 -17.923 -7.890 -3.567 345 HZ PHE 44 HZ PHE 44 -17.593 -10.140 -4.575 346 H MET 45 H MET 45 -22.311 -6.207 -2.351 347 HA MET 45 HA MET 45 -22.456 -5.334 -5.182 348 HB2 MET 45 HB2 MET 45 -23.340 -3.263 -4.739 349 HB3 MET 45 HB3 MET 45 -24.365 -4.346 -3.829 350 HG2 MET 45 HG2 MET 45 -23.661 -3.527 -1.788 351 HG3 MET 45 HG3 MET 45 -22.049 -3.121 -2.350 352 HE1 MET 45 HE1 MET 45 -22.351 0.315 -4.056 353 HE2 MET 45 HE2 MET 45 -21.311 -1.064 -3.670 354 HE3 MET 45 HE3 MET 45 -22.509 -1.199 -4.966 355 H GLY 46 H GLY 46 -21.119 -3.465 -5.668 356 HA2 GLY 46 HA2 GLY 46 -18.815 -2.945 -3.924 357 HA3 GLY 46 HA3 GLY 46 -18.460 -4.012 -5.296 358 H LYS 47 H LYS 47 -17.035 -2.004 -5.362 359 HA LYS 47 HA LYS 47 -18.181 -0.279 -7.513 360 HB2 LYS 47 HB2 LYS 47 -17.379 0.860 -5.300 361 HB3 LYS 47 HB3 LYS 47 -15.759 0.392 -5.791 362 HG2 LYS 47 HG2 LYS 47 -15.939 2.571 -6.625 363 HG3 LYS 47 HG3 LYS 47 -16.325 1.592 -8.044 364 HD2 LYS 47 HD2 LYS 47 -17.962 3.299 -8.026 365 HD3 LYS 47 HD3 LYS 47 -18.790 1.869 -7.408 366 HE2 LYS 47 HE2 LYS 47 -18.635 2.666 -5.125 367 HE3 LYS 47 HE3 LYS 47 -17.575 3.999 -5.605 368 HZ1 LYS 47 HZ1 LYS 47 -19.931 4.647 -5.288 369 HZ2 LYS 47 HZ2 LYS 47 -19.381 5.008 -6.778 370 HZ3 LYS 47 HZ3 LYS 47 -20.369 3.727 -6.577 371 H TRP 48 H TRP 48 -17.404 -0.891 -9.458 372 HA TRP 48 HA TRP 48 -14.965 -2.552 -9.664 373 HB2 TRP 48 HB2 TRP 48 -16.973 -2.920 -11.136 374 HB3 TRP 48 HB3 TRP 48 -16.674 -1.359 -11.877 375 HD1 TRP 48 HD1 TRP 48 -13.303 -2.361 -11.682 376 HE1 TRP 48 HE1 TRP 48 -12.448 -3.685 -13.628 377 HE3 TRP 48 HE3 TRP 48 -17.803 -3.742 -13.736 378 HZ2 TRP 48 HZ2 TRP 48 -13.523 -5.276 -15.781 379 HZ3 TRP 48 HZ3 TRP 48 -17.815 -5.196 -15.752 380 HH2 TRP 48 HH2 TRP 48 -15.692 -5.961 -16.774 381 H LYS 49 H LYS 49 -13.152 -1.475 -9.273 382 HA LYS 49 HA LYS 49 -12.818 1.400 -9.695 383 HB2 LYS 49 HB2 LYS 49 -10.765 -0.694 -8.847 384 HB3 LYS 49 HB3 LYS 49 -10.707 1.035 -8.532 385 HG2 LYS 49 HG2 LYS 49 -12.688 -0.952 -7.313 386 HG3 LYS 49 HG3 LYS 49 -11.218 -0.414 -6.550 387 HD2 LYS 49 HD2 LYS 49 -13.421 1.551 -7.322 388 HD3 LYS 49 HD3 LYS 49 -13.393 0.652 -5.801 389 HE2 LYS 49 HE2 LYS 49 -10.966 1.531 -5.526 390 HE3 LYS 49 HE3 LYS 49 -11.400 2.726 -6.761 391 HZ1 LYS 49 HZ1 LYS 49 -12.877 2.293 -4.219 392 HZ2 LYS 49 HZ2 LYS 49 -11.760 3.472 -4.451 393 HZ3 LYS 49 HZ3 LYS 49 -13.140 3.521 -5.322 394 H LYS 50 H LYS 50 -13.373 0.622 -12.141 395 HA LYS 50 HA LYS 50 -11.547 -1.077 -13.540 396 HB2 LYS 50 HB2 LYS 50 -13.916 -0.651 -14.189 397 HB3 LYS 50 HB3 LYS 50 -13.486 0.996 -14.667 398 HG2 LYS 50 HG2 LYS 50 -11.945 0.137 -16.381 399 HG3 LYS 50 HG3 LYS 50 -12.230 -1.526 -15.859 400 HD2 LYS 50 HD2 LYS 50 -14.372 0.321 -17.009 401 HD3 LYS 50 HD3 LYS 50 -13.439 -0.860 -17.944 402 HE2 LYS 50 HE2 LYS 50 -14.280 -2.678 -16.436 403 HE3 LYS 50 HE3 LYS 50 -15.309 -1.501 -15.615 404 HZ1 LYS 50 HZ1 LYS 50 -15.489 -2.246 -18.480 405 HZ2 LYS 50 HZ2 LYS 50 -16.525 -2.700 -17.308 406 HZ3 LYS 50 HZ3 LYS 50 -16.435 -1.130 -17.752 407 H LYS 51 H LYS 51 -9.521 -0.651 -14.269 408 HA LYS 51 HA LYS 51 -8.478 2.053 -14.079 409 HB2 LYS 51 HB2 LYS 51 -7.356 -0.124 -13.338 410 HB3 LYS 51 HB3 LYS 51 -6.983 -0.405 -15.045 411 HG2 LYS 51 HG2 LYS 51 -5.680 1.684 -15.109 412 HG3 LYS 51 HG3 LYS 51 -6.206 2.094 -13.463 413 HD2 LYS 51 HD2 LYS 51 -4.944 0.263 -12.524 414 HD3 LYS 51 HD3 LYS 51 -4.622 -0.416 -14.121 415 HE2 LYS 51 HE2 LYS 51 -2.640 0.708 -13.219 416 HE3 LYS 51 HE3 LYS 51 -3.187 1.441 -14.727 417 HZ1 LYS 51 HZ1 LYS 51 -4.103 3.270 -13.501 418 HZ2 LYS 51 HZ2 LYS 51 -3.776 2.558 -12.044 419 HZ3 LYS 51 HZ3 LYS 51 -2.564 3.061 -13.008 420 H SER 52 H SER 52 -10.468 2.094 -15.975 421 HA SER 52 HA SER 52 -11.068 2.250 -18.171 422 HB2 SER 52 HB2 SER 52 -8.588 4.000 -18.181 423 HB3 SER 52 HB3 SER 52 -10.009 4.129 -19.244 424 HG SER 52 HG SER 52 -9.772 4.618 -16.484 425 H ARG 53 H ARG 53 -8.418 2.888 -20.045 426 HA ARG 53 HA ARG 53 -7.963 0.039 -20.798 427 HB2 ARG 53 HB2 ARG 53 -8.469 2.360 -22.729 428 HB3 ARG 53 HB3 ARG 53 -8.000 0.715 -23.154 429 HG2 ARG 53 HG2 ARG 53 -10.213 0.559 -23.563 430 HG3 ARG 53 HG3 ARG 53 -10.196 0.006 -21.887 431 HD2 ARG 53 HD2 ARG 53 -10.876 2.320 -21.171 432 HD3 ARG 53 HD3 ARG 53 -10.861 2.822 -22.872 433 HE ARG 53 HE ARG 53 -12.536 0.535 -22.545 434 HH11 ARG 53 HH11 ARG 53 -12.509 4.016 -21.837 435 HH12 ARG 53 HH12 ARG 53 -14.225 4.175 -21.847 436 HH21 ARG 53 HH21 ARG 53 -14.825 0.751 -22.576 437 HH22 ARG 53 HH22 ARG 53 -15.567 2.277 -22.284 438 H LYS 54 H LYS 54 -6.174 1.452 -22.984 439 HA LYS 54 HA LYS 54 -3.709 1.548 -21.614 440 HB2 LYS 54 HB2 LYS 54 -4.051 1.364 -24.082 441 HB3 LYS 54 HB3 LYS 54 -4.532 3.068 -24.130 442 HG2 LYS 54 HG2 LYS 54 -2.286 3.741 -23.356 443 HG3 LYS 54 HG3 LYS 54 -1.822 2.035 -23.181 444 HD2 LYS 54 HD2 LYS 54 -2.119 1.711 -25.633 445 HD3 LYS 54 HD3 LYS 54 -2.654 3.387 -25.788 446 HE2 LYS 54 HE2 LYS 54 -0.371 3.297 -26.495 447 HE3 LYS 54 HE3 LYS 54 -0.436 4.174 -24.965 448 HZ1 LYS 54 HZ1 LYS 54 1.386 2.586 -25.033 449 HZ2 LYS 54 HZ2 LYS 54 0.347 2.155 -23.858 450 HZ3 LYS 54 HZ3 LYS 54 0.374 1.336 -25.276 451 H THR 55 H THR 55 -6.264 3.970 -21.795 452 HA THR 55 HA THR 55 -4.990 6.313 -21.000 453 HB THR 55 HB THR 55 -7.378 6.630 -19.940 454 HG1 THR 55 HG1 THR 55 -8.842 5.100 -20.881 455 HG21 THR 55 HG21 THR 55 -6.690 7.513 -22.161 456 HG22 THR 55 HG22 THR 55 -7.085 5.949 -22.907 457 HG23 THR 55 HG23 THR 55 -8.364 6.940 -22.171 458 H SER 56 H SER 56 -5.626 3.408 -19.084 459 HA SER 56 HA SER 56 -5.054 2.750 -17.069 460 HB2 SER 56 HB2 SER 56 -2.863 4.831 -17.367 461 HB3 SER 56 HB3 SER 56 -2.834 3.419 -16.303 462 HG SER 56 HG SER 56 -2.908 3.454 -19.148 463 H THR 57 H THR 57 -6.579 5.661 -17.101 464 HA THR 57 HA THR 57 -6.133 6.421 -14.296 465 HB THR 57 HB THR 57 -8.163 7.343 -16.369 466 HG1 THR 57 HG1 THR 57 -5.899 7.698 -16.858 467 HG21 THR 57 HG21 THR 57 -8.916 7.973 -14.126 468 HG22 THR 57 HG22 THR 57 -7.307 8.608 -13.722 469 HG23 THR 57 HG23 THR 57 -8.308 9.405 -14.960 470 H ILE 58 H ILE 58 -7.558 5.881 -12.573 471 HA ILE 58 HA ILE 58 -9.369 3.654 -13.100 472 HB ILE 58 HB ILE 58 -8.446 5.102 -10.621 473 HG12 ILE 58 HG12 ILE 58 -8.218 2.286 -11.789 474 HG13 ILE 58 HG13 ILE 58 -6.936 3.493 -11.651 475 HG21 ILE 58 HG21 ILE 58 -9.810 3.577 -9.233 476 HG22 ILE 58 HG22 ILE 58 -10.837 4.613 -10.200 477 HG23 ILE 58 HG23 ILE 58 -10.584 2.926 -10.697 478 HD11 ILE 58 HD11 ILE 58 -7.109 3.275 -9.149 479 HD12 ILE 58 HD12 ILE 58 -8.242 1.918 -9.420 480 HD13 ILE 58 HD13 ILE 58 -6.578 1.813 -10.018 481 H GLU 59 H GLU 59 -11.475 3.588 -12.950 482 HA GLU 59 HA GLU 59 -13.088 6.041 -12.586 483 HB2 GLU 59 HB2 GLU 59 -13.461 3.897 -14.733 484 HB3 GLU 59 HB3 GLU 59 -14.681 5.101 -14.285 485 HG2 GLU 59 HG2 GLU 59 -13.063 6.918 -14.869 486 HG3 GLU 59 HG3 GLU 59 -11.939 5.701 -15.467 487 H GLU 60 H GLU 60 -15.191 5.447 -11.681 488 HA GLU 60 HA GLU 60 -15.036 2.920 -10.090 489 HB2 GLU 60 HB2 GLU 60 -15.692 5.762 -9.206 490 HB3 GLU 60 HB3 GLU 60 -15.890 4.318 -8.215 491 HG2 GLU 60 HG2 GLU 60 -13.422 3.846 -8.509 492 HG3 GLU 60 HG3 GLU 60 -13.264 5.406 -9.323 493 H LYS 61 H LYS 61 -16.626 1.700 -10.904 494 HA LYS 61 HA LYS 61 -19.258 2.951 -11.614 495 HB2 LYS 61 HB2 LYS 61 -18.073 1.896 -13.471 496 HB3 LYS 61 HB3 LYS 61 -17.840 0.418 -12.530 497 HG2 LYS 61 HG2 LYS 61 -20.260 0.006 -12.496 498 HG3 LYS 61 HG3 LYS 61 -20.557 1.491 -13.393 499 HD2 LYS 61 HD2 LYS 61 -18.744 -0.741 -14.433 500 HD3 LYS 61 HD3 LYS 61 -20.473 -0.780 -14.690 501 HE2 LYS 61 HE2 LYS 61 -18.627 1.466 -15.627 502 HE3 LYS 61 HE3 LYS 61 -19.215 0.135 -16.630 503 HZ1 LYS 61 HZ1 LYS 61 -20.574 2.078 -16.953 504 HZ2 LYS 61 HZ2 LYS 61 -21.484 0.908 -16.244 505 HZ3 LYS 61 HZ3 LYS 61 -20.940 2.174 -15.360 506 H THR 62 H THR 62 -20.845 2.576 -10.079 507 HA THR 62 HA THR 62 -20.466 0.641 -7.985 508 HB THR 62 HB THR 62 -23.059 2.017 -8.794 509 HG1 THR 62 HG1 THR 62 -22.324 3.831 -7.966 510 HG21 THR 62 HG21 THR 62 -21.874 1.260 -6.080 511 HG22 THR 62 HG22 THR 62 -23.465 2.007 -6.358 512 HG23 THR 62 HG23 THR 62 -23.154 0.357 -6.919 513 H VAL 63 H VAL 63 -21.104 -1.446 -7.900 514 HA VAL 63 HA VAL 63 -22.790 -2.553 -10.109 515 HB VAL 63 HB VAL 63 -21.187 -4.372 -10.276 516 HG11 VAL 63 HG11 VAL 63 -19.655 -3.344 -11.815 517 HG12 VAL 63 HG12 VAL 63 -21.218 -2.525 -11.942 518 HG13 VAL 63 HG13 VAL 63 -19.880 -1.757 -11.062 519 HG21 VAL 63 HG21 VAL 63 -19.171 -2.629 -8.821 520 HG22 VAL 63 HG22 VAL 63 -19.901 -4.116 -8.172 521 HG23 VAL 63 HG23 VAL 63 -18.858 -4.195 -9.595 522 H GLU 64 H GLU 64 -23.681 -4.621 -9.723 523 HA GLU 64 HA GLU 64 -23.785 -5.485 -6.861 524 HB2 GLU 64 HB2 GLU 64 -25.966 -4.777 -7.799 525 HB3 GLU 64 HB3 GLU 64 -25.811 -5.989 -9.076 526 HG2 GLU 64 HG2 GLU 64 -25.778 -7.779 -7.348 527 HG3 GLU 64 HG3 GLU 64 -25.849 -6.554 -6.080 528 H VAL 65 H VAL 65 -22.565 -7.285 -6.546 529 HA VAL 65 HA VAL 65 -21.449 -8.701 -8.891 530 HB VAL 65 HB VAL 65 -20.696 -8.923 -5.945 531 HG11 VAL 65 HG11 VAL 65 -18.597 -9.895 -6.929 532 HG12 VAL 65 HG12 VAL 65 -20.024 -10.854 -7.341 533 HG13 VAL 65 HG13 VAL 65 -19.320 -9.751 -8.545 534 HG21 VAL 65 HG21 VAL 65 -20.217 -6.620 -6.629 535 HG22 VAL 65 HG22 VAL 65 -18.709 -7.525 -6.552 536 HG23 VAL 65 HG23 VAL 65 -19.455 -7.190 -8.131 537 H LEU 66 H LEU 66 -22.548 -10.450 -9.533 538 HA LEU 66 HA LEU 66 -24.865 -11.289 -7.991 539 HB2 LEU 66 HB2 LEU 66 -23.806 -12.341 -10.640 540 HB3 LEU 66 HB3 LEU 66 -25.410 -12.612 -9.966 541 HG LEU 66 HG LEU 66 -24.271 -9.966 -10.965 542 HD11 LEU 66 HD11 LEU 66 -24.961 -11.571 -12.706 543 HD12 LEU 66 HD12 LEU 66 -26.574 -11.687 -11.970 544 HD13 LEU 66 HD13 LEU 66 -26.018 -10.150 -12.666 545 HD21 LEU 66 HD21 LEU 66 -26.542 -9.027 -10.548 546 HD22 LEU 66 HD22 LEU 66 -26.984 -10.516 -9.683 547 HD23 LEU 66 HD23 LEU 66 -25.702 -9.449 -9.061 548 H GLY 67 H GLY 67 -21.642 -12.636 -8.647 549 HA2 GLY 67 HA2 GLY 67 -21.404 -14.485 -6.687 550 HA3 GLY 67 HA3 GLY 67 -22.320 -15.351 -7.944 551 H MET 68 H MET 68 -19.963 -16.423 -7.615 552 HA MET 68 HA MET 68 -17.832 -15.271 -9.219 553 HB2 MET 68 HB2 MET 68 -18.316 -18.151 -8.370 554 HB3 MET 68 HB3 MET 68 -16.922 -17.559 -9.270 555 HG2 MET 68 HG2 MET 68 -16.895 -15.779 -7.209 556 HG3 MET 68 HG3 MET 68 -17.628 -17.166 -6.406 557 HE1 MET 68 HE1 MET 68 -14.819 -16.920 -9.257 558 HE2 MET 68 HE2 MET 68 -14.513 -15.595 -8.113 559 HE3 MET 68 HE3 MET 68 -13.378 -16.957 -8.236 560 H ALA 69 H ALA 69 -17.192 -15.859 -11.291 561 HA ALA 69 HA ALA 69 -19.267 -16.396 -13.261 562 HB1 ALA 69 HB1 ALA 69 -16.229 -16.372 -13.487 563 HB2 ALA 69 HB2 ALA 69 -17.372 -16.218 -14.827 564 HB3 ALA 69 HB3 ALA 69 -17.257 -14.922 -13.633 565 HA PRO 70 HA PRO 70 -18.913 -20.867 -13.629 566 HB2 PRO 70 HB2 PRO 70 -17.658 -20.402 -16.349 567 HB3 PRO 70 HB3 PRO 70 -18.894 -21.612 -15.875 568 HG2 PRO 70 HG2 PRO 70 -19.660 -19.339 -17.122 569 HG3 PRO 70 HG3 PRO 70 -20.584 -19.916 -15.696 570 HD2 PRO 70 HD2 PRO 70 -18.479 -17.758 -15.830 571 HD3 PRO 70 HD3 PRO 70 -20.043 -17.744 -14.959 572 H ASP 71 H ASP 71 -17.397 -22.395 -13.056 573 HA ASP 71 HA ASP 71 -14.843 -21.614 -12.211 574 HB2 ASP 71 HB2 ASP 71 -14.457 -23.836 -11.617 575 HB3 ASP 71 HB3 ASP 71 -16.190 -23.622 -11.427 576 H ASP 72 H ASP 72 -15.918 -22.840 -15.340 577 HA ASP 72 HA ASP 72 -13.449 -23.586 -16.485 578 HB2 ASP 72 HB2 ASP 72 -15.621 -24.098 -17.487 579 HB3 ASP 72 HB3 ASP 72 -15.937 -22.380 -17.750 580 H GLU 73 H GLU 73 -14.824 -20.343 -15.942 581 HA GLU 73 HA GLU 73 -12.711 -19.068 -17.597 582 HB2 GLU 73 HB2 GLU 73 -14.999 -17.889 -15.953 583 HB3 GLU 73 HB3 GLU 73 -13.792 -16.957 -16.849 584 HG2 GLU 73 HG2 GLU 73 -14.487 -18.218 -18.945 585 HG3 GLU 73 HG3 GLU 73 -15.823 -18.904 -18.018 586 H CYS 74 H CYS 74 -13.546 -19.805 -14.235 587 HA CYS 74 HA CYS 74 -11.657 -17.964 -13.110 588 HB2 CYS 74 HB2 CYS 74 -13.138 -20.274 -11.809 589 HB3 CYS 74 HB3 CYS 74 -12.259 -18.986 -10.969 590 HG CYS 74 HG CYS 74 -14.919 -18.792 -12.941 591 H LEU 75 H LEU 75 -10.580 -20.110 -14.974 592 HA LEU 75 HA LEU 75 -8.869 -21.826 -13.380 593 HB2 LEU 75 HB2 LEU 75 -9.477 -21.392 -16.269 594 HB3 LEU 75 HB3 LEU 75 -7.790 -21.706 -15.969 595 HG LEU 75 HG LEU 75 -8.850 -23.747 -16.518 596 HD11 LEU 75 HD11 LEU 75 -8.135 -25.165 -14.740 597 HD12 LEU 75 HD12 LEU 75 -7.063 -23.753 -14.754 598 HD13 LEU 75 HD13 LEU 75 -8.329 -23.901 -13.519 599 HD21 LEU 75 HD21 LEU 75 -10.622 -24.799 -15.198 600 HD22 LEU 75 HD22 LEU 75 -10.718 -23.368 -14.154 601 HD23 LEU 75 HD23 LEU 75 -11.156 -23.247 -15.863 602 H LYS 76 H LYS 76 -8.708 -18.514 -14.261 603 HA LYS 76 HA LYS 76 -5.783 -18.466 -13.697 604 HB2 LYS 76 HB2 LYS 76 -5.434 -16.943 -15.556 605 HB3 LYS 76 HB3 LYS 76 -6.077 -18.490 -16.110 606 HG2 LYS 76 HG2 LYS 76 -8.351 -17.452 -16.311 607 HG3 LYS 76 HG3 LYS 76 -7.664 -15.897 -15.798 608 HD2 LYS 76 HD2 LYS 76 -6.147 -15.920 -17.759 609 HD3 LYS 76 HD3 LYS 76 -6.836 -17.478 -18.272 610 HE2 LYS 76 HE2 LYS 76 -9.081 -16.421 -18.448 611 HE3 LYS 76 HE3 LYS 76 -8.393 -14.874 -17.938 612 HZ1 LYS 76 HZ1 LYS 76 -7.026 -14.894 -19.944 613 HZ2 LYS 76 HZ2 LYS 76 -7.666 -16.322 -20.419 614 HZ3 LYS 76 HZ3 LYS 76 -8.604 -14.993 -20.334 615 H ASP 77 H ASP 77 -8.901 -16.836 -13.336 616 HA ASP 77 HA ASP 77 -7.676 -15.026 -11.365 617 HB2 ASP 77 HB2 ASP 77 -7.522 -13.746 -13.496 618 HB3 ASP 77 HB3 ASP 77 -9.237 -14.014 -13.785 619 H MET 78 H MET 78 -9.408 -14.218 -9.927 620 HA MET 78 HA MET 78 -11.677 -16.076 -9.781 621 HB2 MET 78 HB2 MET 78 -10.761 -13.798 -7.983 622 HB3 MET 78 HB3 MET 78 -12.154 -14.831 -7.667 623 HG2 MET 78 HG2 MET 78 -9.259 -15.751 -7.872 624 HG3 MET 78 HG3 MET 78 -10.183 -15.531 -6.400 625 HE1 MET 78 HE1 MET 78 -8.743 -18.060 -8.665 626 HE2 MET 78 HE2 MET 78 -10.005 -19.261 -9.008 627 HE3 MET 78 HE3 MET 78 -10.058 -17.681 -9.801 628 H TYR 79 H TYR 79 -12.685 -15.468 -11.791 629 HA TYR 79 HA TYR 79 -13.611 -12.755 -12.214 630 HB2 TYR 79 HB2 TYR 79 -14.182 -15.430 -13.539 631 HB3 TYR 79 HB3 TYR 79 -14.969 -13.939 -14.032 632 HD1 TYR 79 HD1 TYR 79 -13.536 -11.965 -14.804 633 HD2 TYR 79 HD2 TYR 79 -12.025 -15.989 -14.420 634 HE1 TYR 79 HE1 TYR 79 -11.724 -11.426 -16.394 635 HE2 TYR 79 HE2 TYR 79 -10.225 -15.473 -16.028 636 HH TYR 79 HH TYR 79 -9.846 -12.223 -17.529 637 H VAL 80 H VAL 80 -15.727 -11.976 -12.018 638 HA VAL 80 HA VAL 80 -17.752 -13.699 -10.670 639 HB VAL 80 HB VAL 80 -18.358 -11.679 -9.353 640 HG11 VAL 80 HG11 VAL 80 -15.539 -12.717 -8.842 641 HG12 VAL 80 HG12 VAL 80 -16.587 -11.897 -7.666 642 HG13 VAL 80 HG13 VAL 80 -17.057 -13.469 -8.307 643 HG21 VAL 80 HG21 VAL 80 -17.231 -9.915 -10.707 644 HG22 VAL 80 HG22 VAL 80 -16.761 -9.859 -9.005 645 HG23 VAL 80 HG23 VAL 80 -15.649 -10.548 -10.198 646 H GLU 81 H GLU 81 -19.902 -13.284 -11.211 647 HA GLU 81 HA GLU 81 -20.373 -11.819 -13.756 648 HB2 GLU 81 HB2 GLU 81 -22.169 -13.478 -11.924 649 HB3 GLU 81 HB3 GLU 81 -22.749 -12.559 -13.325 650 HG2 GLU 81 HG2 GLU 81 -21.182 -13.857 -14.787 651 HG3 GLU 81 HG3 GLU 81 -20.740 -14.838 -13.390 652 H VAL 82 H VAL 82 -21.541 -9.872 -13.787 653 HA VAL 82 HA VAL 82 -22.150 -8.615 -11.185 654 HB VAL 82 HB VAL 82 -19.724 -8.400 -11.559 655 HG11 VAL 82 HG11 VAL 82 -19.516 -8.538 -13.979 656 HG12 VAL 82 HG12 VAL 82 -20.407 -7.011 -14.186 657 HG13 VAL 82 HG13 VAL 82 -18.828 -7.016 -13.409 658 HG21 VAL 82 HG21 VAL 82 -19.498 -6.027 -11.322 659 HG22 VAL 82 HG22 VAL 82 -21.117 -5.767 -12.014 660 HG23 VAL 82 HG23 VAL 82 -20.926 -6.606 -10.447 661 H ALA 83 H ALA 83 -23.672 -7.012 -11.341 662 HA ALA 83 HA ALA 83 -24.756 -6.397 -14.061 663 HB1 ALA 83 HB1 ALA 83 -26.876 -5.931 -12.955 664 HB2 ALA 83 HB2 ALA 83 -26.355 -7.589 -12.611 665 HB3 ALA 83 HB3 ALA 83 -26.170 -6.328 -11.370 666 H ASP 84 H ASP 84 -24.822 -4.288 -14.675 667 HA ASP 84 HA ASP 84 -23.173 -2.428 -13.122 668 HB2 ASP 84 HB2 ASP 84 -22.776 -2.743 -15.507 669 HB3 ASP 84 HB3 ASP 84 -24.431 -2.229 -15.872 670 H ILE 85 H ILE 85 -24.889 -2.432 -11.401 671 HA ILE 85 HA ILE 85 -27.364 -1.085 -11.791 672 HB ILE 85 HB ILE 85 -27.481 -0.842 -9.404 673 HG12 ILE 85 HG12 ILE 85 -24.595 -1.758 -9.254 674 HG13 ILE 85 HG13 ILE 85 -25.140 -0.111 -8.959 675 HG21 ILE 85 HG21 ILE 85 -27.849 -3.065 -10.544 676 HG22 ILE 85 HG22 ILE 85 -26.212 -3.539 -10.047 677 HG23 ILE 85 HG23 ILE 85 -27.457 -3.175 -8.832 678 HD11 ILE 85 HD11 ILE 85 -25.874 -2.550 -7.290 679 HD12 ILE 85 HD12 ILE 85 -24.778 -1.249 -6.841 680 HD13 ILE 85 HD13 ILE 85 -26.508 -0.907 -7.042 681 H GLY 86 H GLY 86 -24.290 0.261 -12.132 682 HA2 GLY 86 HA2 GLY 86 -25.065 2.990 -11.293 683 HA3 GLY 86 HA3 GLY 86 -23.478 2.420 -11.829 684 H GLY 87 H GLY 87 -24.970 1.006 -14.200 685 HA2 GLY 87 HA2 GLY 87 -25.314 3.445 -15.918 686 HA3 GLY 87 HA3 GLY 87 -24.158 2.154 -16.254 687 H LYS 88 H LYS 88 -26.409 0.151 -15.323 688 HA LYS 88 HA LYS 88 -28.181 0.340 -17.724 689 HB2 LYS 88 HB2 LYS 88 -26.550 -2.097 -16.865 690 HB3 LYS 88 HB3 LYS 88 -27.836 -2.141 -18.049 691 HG2 LYS 88 HG2 LYS 88 -25.242 -0.565 -18.330 692 HG3 LYS 88 HG3 LYS 88 -25.570 -2.136 -19.041 693 HD2 LYS 88 HD2 LYS 88 -27.077 0.427 -19.719 694 HD3 LYS 88 HD3 LYS 88 -25.780 -0.300 -20.670 695 HE2 LYS 88 HE2 LYS 88 -27.153 -2.362 -20.963 696 HE3 LYS 88 HE3 LYS 88 -28.471 -1.606 -20.056 697 HZ1 LYS 88 HZ1 LYS 88 -28.591 0.098 -21.783 698 HZ2 LYS 88 HZ2 LYS 88 -27.377 -0.606 -22.622 699 HZ3 LYS 88 HZ3 LYS 88 -28.795 -1.380 -22.434 700 H ASP 89 H ASP 89 -27.453 -1.271 -14.648 701 HA ASP 89 HA ASP 89 -28.555 -2.301 -13.072 702 HB2 ASP 89 HB2 ASP 89 -29.678 -0.181 -12.739 703 HB3 ASP 89 HB3 ASP 89 -30.905 -0.596 -13.937 704 H ASP 90 H ASP 90 -30.111 -2.544 -16.193 705 HA ASP 90 HA ASP 90 -31.520 -5.031 -15.450 706 HB2 ASP 90 HB2 ASP 90 -32.692 -3.038 -16.412 707 HB3 ASP 90 HB3 ASP 90 -31.706 -3.209 -17.867 708 H ASP 91 H ASP 91 -28.491 -4.507 -16.449 709 HA ASP 91 HA ASP 91 -28.457 -6.911 -18.177 710 HB2 ASP 91 HB2 ASP 91 -28.324 -4.779 -19.597 711 HB3 ASP 91 HB3 ASP 91 -26.737 -4.529 -18.844 712 H VAL 92 H VAL 92 -26.322 -7.831 -18.375 713 HA VAL 92 HA VAL 92 -24.746 -7.626 -15.859 714 HB VAL 92 HB VAL 92 -25.880 -10.114 -17.212 715 HG11 VAL 92 HG11 VAL 92 -25.136 -11.361 -15.225 716 HG12 VAL 92 HG12 VAL 92 -23.768 -10.664 -16.080 717 HG13 VAL 92 HG13 VAL 92 -24.355 -9.901 -14.585 718 HG21 VAL 92 HG21 VAL 92 -27.252 -10.353 -15.120 719 HG22 VAL 92 HG22 VAL 92 -26.722 -8.727 -14.635 720 HG23 VAL 92 HG23 VAL 92 -27.706 -8.962 -16.095 721 H TYR 93 H TYR 93 -22.635 -8.245 -15.979 722 HA TYR 93 HA TYR 93 -21.358 -9.037 -18.534 723 HB2 TYR 93 HB2 TYR 93 -20.403 -6.825 -16.660 724 HB3 TYR 93 HB3 TYR 93 -19.614 -7.349 -18.135 725 HD1 TYR 93 HD1 TYR 93 -20.605 -6.838 -20.375 726 HD2 TYR 93 HD2 TYR 93 -22.243 -5.243 -16.713 727 HE1 TYR 93 HE1 TYR 93 -21.783 -5.085 -21.670 728 HE2 TYR 93 HE2 TYR 93 -23.434 -3.500 -17.994 729 HH TYR 93 HH TYR 93 -23.792 -2.553 -20.109 730 H THR 94 H THR 94 -18.778 -9.163 -17.628 731 HA THR 94 HA THR 94 -18.771 -10.652 -15.062 732 HB THR 94 HB THR 94 -17.147 -11.323 -17.546 733 HG1 THR 94 HG1 THR 94 -18.500 -13.024 -17.807 734 HG21 THR 94 HG21 THR 94 -16.538 -13.389 -16.314 735 HG22 THR 94 HG22 THR 94 -15.972 -11.952 -15.461 736 HG23 THR 94 HG23 THR 94 -17.422 -12.804 -14.888 737 H ALA 95 H ALA 95 -16.932 -10.209 -13.797 738 HA ALA 95 HA ALA 95 -15.015 -8.155 -14.764 739 HB1 ALA 95 HB1 ALA 95 -15.202 -6.984 -12.554 740 HB2 ALA 95 HB2 ALA 95 -16.668 -6.869 -13.522 741 HB3 ALA 95 HB3 ALA 95 -16.599 -8.010 -12.159 742 H LYS 96 H LYS 96 -13.116 -8.043 -13.460 743 HA LYS 96 HA LYS 96 -12.215 -10.650 -12.385 744 HB2 LYS 96 HB2 LYS 96 -10.801 -7.951 -12.484 745 HB3 LYS 96 HB3 LYS 96 -10.056 -9.503 -12.192 746 HG2 LYS 96 HG2 LYS 96 -9.971 -10.084 -14.402 747 HG3 LYS 96 HG3 LYS 96 -11.469 -9.282 -14.839 748 HD2 LYS 96 HD2 LYS 96 -8.860 -7.839 -14.257 749 HD3 LYS 96 HD3 LYS 96 -9.471 -8.232 -15.871 750 HE2 LYS 96 HE2 LYS 96 -11.457 -6.797 -15.537 751 HE3 LYS 96 HE3 LYS 96 -10.990 -6.495 -13.869 752 HZ1 LYS 96 HZ1 LYS 96 -8.858 -5.539 -14.901 753 HZ2 LYS 96 HZ2 LYS 96 -9.719 -5.435 -16.287 754 HZ3 LYS 96 HZ3 LYS 96 -10.214 -4.646 -14.918 755 H LEU 97 H LEU 97 -12.475 -11.053 -10.114 756 HA LEU 97 HA LEU 97 -13.536 -9.066 -8.356 757 HB2 LEU 97 HB2 LEU 97 -13.598 -11.516 -7.927 758 HB3 LEU 97 HB3 LEU 97 -11.840 -11.515 -7.723 759 HG LEU 97 HG LEU 97 -12.085 -10.024 -5.740 760 HD11 LEU 97 HD11 LEU 97 -14.409 -9.761 -4.764 761 HD12 LEU 97 HD12 LEU 97 -14.170 -8.848 -6.245 762 HD13 LEU 97 HD13 LEU 97 -15.077 -10.377 -6.282 763 HD21 LEU 97 HD21 LEU 97 -12.874 -11.750 -4.258 764 HD22 LEU 97 HD22 LEU 97 -13.821 -12.510 -5.559 765 HD23 LEU 97 HD23 LEU 97 -12.041 -12.526 -5.597 766 H SER 98 H SER 98 -10.262 -9.951 -9.316 767 HA SER 98 HA SER 98 -8.579 -8.516 -7.720 768 HB2 SER 98 HB2 SER 98 -8.433 -8.819 -10.745 769 HB3 SER 98 HB3 SER 98 -7.076 -8.753 -9.611 770 HG SER 98 HG SER 98 -7.996 -10.927 -10.437 771 H ASP 99 H ASP 99 -10.980 -7.091 -9.822 772 HA ASP 99 HA ASP 99 -9.597 -4.469 -9.736 773 HB2 ASP 99 HB2 ASP 99 -9.750 -5.784 -11.950 774 HB3 ASP 99 HB3 ASP 99 -11.482 -5.458 -11.901 775 H ILE 100 H ILE 100 -11.763 -5.919 -8.070 776 HA ILE 100 HA ILE 100 -13.758 -3.699 -8.028 777 HB ILE 100 HB ILE 100 -14.049 -6.644 -8.139 778 HG12 ILE 100 HG12 ILE 100 -15.985 -4.366 -8.714 779 HG13 ILE 100 HG13 ILE 100 -14.774 -4.964 -9.869 780 HG21 ILE 100 HG21 ILE 100 -14.800 -6.359 -5.792 781 HG22 ILE 100 HG22 ILE 100 -16.019 -5.183 -6.348 782 HG23 ILE 100 HG23 ILE 100 -16.081 -6.879 -6.864 783 HD11 ILE 100 HD11 ILE 100 -17.176 -6.468 -8.785 784 HD12 ILE 100 HD12 ILE 100 -16.885 -5.923 -10.442 785 HD13 ILE 100 HD13 ILE 100 -15.882 -7.223 -9.755 786 H GLU 101 H GLU 101 -14.604 -3.147 -6.094 787 HA GLU 101 HA GLU 101 -13.113 -3.863 -3.609 788 HB2 GLU 101 HB2 GLU 101 -12.504 -1.621 -4.374 789 HB3 GLU 101 HB3 GLU 101 -14.210 -1.177 -4.553 790 HG2 GLU 101 HG2 GLU 101 -14.571 -1.290 -2.161 791 HG3 GLU 101 HG3 GLU 101 -12.985 -2.022 -1.905 792 H ALA 102 H ALA 102 -14.490 -4.883 -2.221 793 HA ALA 102 HA ALA 102 -17.330 -5.073 -2.898 794 HB1 ALA 102 HB1 ALA 102 -15.993 -7.002 -2.090 795 HB2 ALA 102 HB2 ALA 102 -15.799 -6.207 -0.511 796 HB3 ALA 102 HB3 ALA 102 -17.416 -6.683 -1.079 797 H ILE 103 H ILE 103 -19.001 -4.165 -1.828 798 HA ILE 103 HA ILE 103 -18.484 -2.364 0.502 799 HB ILE 103 HB ILE 103 -19.992 -1.908 -2.083 800 HG12 ILE 103 HG12 ILE 103 -17.819 -0.255 -0.713 801 HG13 ILE 103 HG13 ILE 103 -17.518 -1.419 -2.003 802 HG21 ILE 103 HG21 ILE 103 -20.829 0.241 -1.203 803 HG22 ILE 103 HG22 ILE 103 -21.467 -1.094 -0.280 804 HG23 ILE 103 HG23 ILE 103 -20.131 -0.128 0.390 805 HD11 ILE 103 HD11 ILE 103 -17.553 0.726 -2.984 806 HD12 ILE 103 HD12 ILE 103 -19.012 -0.150 -3.510 807 HD13 ILE 103 HD13 ILE 103 -19.121 1.129 -2.269 808 H ASP 104 H ASP 104 -20.000 -2.395 2.084 809 HA ASP 104 HA ASP 104 -21.676 -3.092 3.383 810 HB2 ASP 104 HB2 ASP 104 -22.779 -1.500 1.860 811 HB3 ASP 104 HB3 ASP 104 -23.297 -2.839 0.834 812 H VAL 105 H VAL 105 -20.119 -5.253 2.495 813 HA VAL 105 HA VAL 105 -22.127 -7.451 2.374 814 HB VAL 105 HB VAL 105 -20.468 -7.099 0.477 815 HG11 VAL 105 HG11 VAL 105 -18.254 -8.064 0.659 816 HG12 VAL 105 HG12 VAL 105 -18.413 -6.685 1.756 817 HG13 VAL 105 HG13 VAL 105 -18.480 -8.342 2.392 818 HG21 VAL 105 HG21 VAL 105 -20.521 -9.850 1.718 819 HG22 VAL 105 HG22 VAL 105 -21.854 -9.106 0.831 820 HG23 VAL 105 HG23 VAL 105 -20.315 -9.402 0.015 821 H ASP 106 H ASP 106 -21.278 -9.551 3.428 822 HA ASP 106 HA ASP 106 -21.007 -9.090 6.247 823 HB2 ASP 106 HB2 ASP 106 -22.161 -11.056 5.285 824 HB3 ASP 106 HB3 ASP 106 -20.622 -11.610 4.596 825 H ASP 107 H ASP 107 -19.295 -9.754 7.583 826 HA ASP 107 HA ASP 107 -16.756 -8.728 6.898 827 HB2 ASP 107 HB2 ASP 107 -17.572 -8.883 9.197 828 HB3 ASP 107 HB3 ASP 107 -17.580 -10.647 9.108 829 H ASP 108 H ASP 108 -17.906 -12.177 6.834 830 HA ASP 108 HA ASP 108 -15.194 -13.108 6.413 831 HB2 ASP 108 HB2 ASP 108 -17.208 -14.406 7.411 832 HB3 ASP 108 HB3 ASP 108 -17.689 -14.683 5.728 833 H THR 109 H THR 109 -17.771 -11.958 4.350 834 HA THR 109 HA THR 109 -16.707 -13.048 1.834 835 HB THR 109 HB THR 109 -18.739 -10.832 2.412 836 HG1 THR 109 HG1 THR 109 -19.213 -13.077 3.053 837 HG21 THR 109 HG21 THR 109 -17.868 -12.214 -0.118 838 HG22 THR 109 HG22 THR 109 -19.471 -11.495 0.024 839 HG23 THR 109 HG23 THR 109 -18.017 -10.481 0.180 840 H GLN 110 H GLN 110 -16.766 -9.844 3.548 841 HA GLN 110 HA GLN 110 -15.172 -8.504 1.667 842 HB2 GLN 110 HB2 GLN 110 -16.557 -7.690 3.784 843 HB3 GLN 110 HB3 GLN 110 -15.018 -7.839 4.623 844 HG2 GLN 110 HG2 GLN 110 -15.606 -6.151 2.143 845 HG3 GLN 110 HG3 GLN 110 -15.473 -5.545 3.786 846 HE21 GLN 110 HE22 GLN 110 -13.729 -6.047 0.901 847 HE22 GLN 110 HE21 GLN 110 -12.118 -5.912 1.552 848 H GLU 111 H GLU 111 -14.185 -10.340 4.629 849 HA GLU 111 HA GLU 111 -11.407 -9.854 4.353 850 HB2 GLU 111 HB2 GLU 111 -13.012 -12.066 5.685 851 HB3 GLU 111 HB3 GLU 111 -11.254 -12.021 5.753 852 HG2 GLU 111 HG2 GLU 111 -12.994 -9.696 6.698 853 HG3 GLU 111 HG3 GLU 111 -12.458 -11.008 7.740 854 H ALA 112 H ALA 112 -13.453 -12.473 2.898 855 HA ALA 112 HA ALA 112 -11.219 -13.948 1.865 856 HB1 ALA 112 HB1 ALA 112 -12.862 -15.004 0.376 857 HB2 ALA 112 HB2 ALA 112 -13.495 -14.891 2.026 858 HB3 ALA 112 HB3 ALA 112 -14.064 -13.759 0.775 859 H ILE 113 H ILE 113 -13.187 -11.269 0.528 860 HA ILE 113 HA ILE 113 -11.916 -11.245 -2.045 861 HB ILE 113 HB ILE 113 -13.533 -9.179 -0.496 862 HG12 ILE 113 HG12 ILE 113 -14.350 -10.975 -2.831 863 HG13 ILE 113 HG13 ILE 113 -14.622 -11.405 -1.165 864 HG21 ILE 113 HG21 ILE 113 -13.855 -8.047 -2.732 865 HG22 ILE 113 HG22 ILE 113 -12.213 -7.943 -2.117 866 HG23 ILE 113 HG23 ILE 113 -12.593 -9.107 -3.395 867 HD11 ILE 113 HD11 ILE 113 -16.647 -10.514 -1.937 868 HD12 ILE 113 HD12 ILE 113 -15.947 -9.268 -0.886 869 HD13 ILE 113 HD13 ILE 113 -15.864 -9.107 -2.666 870 H ALA 114 H ALA 114 -11.369 -9.347 0.982 871 HA ALA 114 HA ALA 114 -9.239 -7.755 0.011 872 HB1 ALA 114 HB1 ALA 114 -9.709 -8.832 2.828 873 HB2 ALA 114 HB2 ALA 114 -8.662 -7.471 2.384 874 HB3 ALA 114 HB3 ALA 114 -10.416 -7.345 2.155 875 H ASP 115 H ASP 115 -9.262 -11.044 1.454 876 HA ASP 115 HA ASP 115 -6.417 -11.320 1.544 877 HB2 ASP 115 HB2 ASP 115 -7.931 -12.673 2.909 878 HB3 ASP 115 HB3 ASP 115 -8.582 -13.444 1.456 879 H TRP 116 H TRP 116 -8.832 -12.178 -1.003 880 HA TRP 116 HA TRP 116 -6.971 -13.388 -2.807 881 HB2 TRP 116 HB2 TRP 116 -9.301 -13.618 -3.275 882 HB3 TRP 116 HB3 TRP 116 -9.573 -11.884 -3.210 883 HD1 TRP 116 HD1 TRP 116 -9.609 -10.648 -5.418 884 HE1 TRP 116 HE1 TRP 116 -8.776 -11.053 -7.825 885 HE3 TRP 116 HE3 TRP 116 -7.189 -15.115 -4.749 886 HZ2 TRP 116 HZ2 TRP 116 -7.343 -13.055 -9.270 887 HZ3 TRP 116 HZ3 TRP 116 -6.086 -16.236 -6.658 888 HH2 TRP 116 HH2 TRP 116 -6.146 -15.216 -8.918 889 H LEU 117 H LEU 117 -7.952 -9.950 -2.352 890 HA LEU 117 HA LEU 117 -6.302 -8.946 -4.457 891 HB2 LEU 117 HB2 LEU 117 -7.412 -7.645 -1.939 892 HB3 LEU 117 HB3 LEU 117 -6.565 -6.748 -3.188 893 HG LEU 117 HG LEU 117 -9.021 -8.428 -3.849 894 HD11 LEU 117 HD11 LEU 117 -8.960 -5.511 -2.981 895 HD12 LEU 117 HD12 LEU 117 -10.365 -6.373 -3.653 896 HD13 LEU 117 HD13 LEU 117 -9.691 -6.872 -2.096 897 HD21 LEU 117 HD21 LEU 117 -7.766 -6.017 -5.225 898 HD22 LEU 117 HD22 LEU 117 -7.620 -7.703 -5.757 899 HD23 LEU 117 HD23 LEU 117 -9.203 -6.911 -5.763 900 H TYR 118 H TYR 118 -5.666 -9.424 -0.934 901 HA TYR 118 HA TYR 118 -3.030 -8.345 -0.958 902 HB2 TYR 118 HB2 TYR 118 -4.160 -10.558 0.793 903 HB3 TYR 118 HB3 TYR 118 -2.687 -9.660 1.095 904 HD1 TYR 118 HD1 TYR 118 -4.062 -6.842 0.264 905 HD2 TYR 118 HD2 TYR 118 -5.001 -10.048 3.006 906 HE1 TYR 118 HE1 TYR 118 -5.316 -5.263 1.677 907 HE2 TYR 118 HE2 TYR 118 -6.262 -8.470 4.424 908 HH TYR 118 HH TYR 118 -6.961 -6.263 4.715 909 H TRP 119 H TRP 119 -4.186 -11.732 -1.551 910 HA TRP 119 HA TRP 119 -1.606 -12.863 -1.948 911 HB2 TRP 119 HB2 TRP 119 -3.323 -14.412 -1.741 912 HB3 TRP 119 HB3 TRP 119 -4.410 -13.534 -2.806 913 HD1 TRP 119 HD1 TRP 119 -4.563 -14.209 -5.233 914 HE1 TRP 119 HE1 TRP 119 -3.424 -15.894 -6.777 915 HE3 TRP 119 HE3 TRP 119 -0.729 -15.619 -2.142 916 HZ2 TRP 119 HZ2 TRP 119 -1.100 -17.635 -6.682 917 HZ3 TRP 119 HZ3 TRP 119 0.955 -17.267 -2.916 918 HH2 TRP 119 HH2 TRP 119 0.779 -18.277 -5.182 919 H LEU 120 H LEU 120 -3.820 -11.163 -4.218 920 HA LEU 120 HA LEU 120 -2.416 -11.744 -6.570 921 HB2 LEU 120 HB2 LEU 120 -4.733 -10.600 -6.237 922 HB3 LEU 120 HB3 LEU 120 -3.833 -9.111 -5.975 923 HG LEU 120 HG LEU 120 -2.705 -9.720 -8.311 924 HD11 LEU 120 HD11 LEU 120 -4.171 -10.948 -9.813 925 HD12 LEU 120 HD12 LEU 120 -3.869 -11.977 -8.402 926 HD13 LEU 120 HD13 LEU 120 -5.408 -11.122 -8.551 927 HD21 LEU 120 HD21 LEU 120 -4.537 -8.466 -9.453 928 HD22 LEU 120 HD22 LEU 120 -5.536 -8.648 -7.988 929 HD23 LEU 120 HD23 LEU 120 -4.028 -7.715 -7.933 930 H ALA 121 H ALA 121 -2.095 -9.077 -4.225 931 HA ALA 121 HA ALA 121 0.080 -7.715 -5.504 932 HB1 ALA 121 HB1 ALA 121 0.120 -6.485 -3.349 933 HB2 ALA 121 HB2 ALA 121 -1.541 -6.672 -3.950 934 HB3 ALA 121 HB3 ALA 121 -0.958 -7.703 -2.631 935 H ARG 122 H ARG 122 -0.073 -10.172 -2.897 936 HA ARG 122 HA ARG 122 2.597 -10.181 -2.045 937 HB2 ARG 122 HB2 ARG 122 0.671 -11.362 -0.977 938 HB3 ARG 122 HB3 ARG 122 0.620 -12.485 -2.327 939 HG2 ARG 122 HG2 ARG 122 1.556 -13.564 -0.456 940 HG3 ARG 122 HG3 ARG 122 2.813 -13.422 -1.674 941 HD2 ARG 122 HD2 ARG 122 2.628 -11.236 0.381 942 HD3 ARG 122 HD3 ARG 122 3.132 -12.811 0.973 943 HE ARG 122 HE ARG 122 4.580 -10.953 -0.742 944 HH11 ARG 122 HH11 ARG 122 4.476 -14.335 0.497 945 HH12 ARG 122 HH12 ARG 122 6.221 -14.441 0.518 946 HH21 ARG 122 HH22 ARG 122 6.827 -11.362 -1.058 947 HH22 ARG 122 HH21 ARG 122 7.515 -12.870 -0.571 948 H GLY 123 H GLY 123 1.187 -11.558 -4.993 949 HA2 GLY 123 HA2 GLY 123 3.179 -11.783 -6.689 950 HA3 GLY 123 HA3 GLY 123 3.658 -13.095 -5.594 951 H TYR 124 H TYR 124 1.017 -11.931 -7.751 952 HA TYR 124 HA TYR 124 -0.728 -14.148 -7.526 953 HB2 TYR 124 HB2 TYR 124 -1.527 -12.182 -8.577 954 HB3 TYR 124 HB3 TYR 124 -0.108 -12.024 -9.592 955 HD1 TYR 124 HD2 TYR 124 -3.192 -14.122 -9.110 956 HD2 TYR 124 HD1 TYR 124 0.024 -12.971 -11.755 957 HE1 TYR 124 HE2 TYR 124 -4.308 -15.290 -10.970 958 HE2 TYR 124 HE1 TYR 124 -1.075 -14.169 -13.619 959 HH TYR 124 HH TYR 124 -4.268 -15.764 -13.226 960 H LYS 125 H LYS 125 -0.575 -16.162 -8.281 961 HA LYS 125 HA LYS 125 1.050 -16.752 -10.714 962 HB2 LYS 125 HB2 LYS 125 0.744 -18.497 -8.230 963 HB3 LYS 125 HB3 LYS 125 1.530 -18.987 -9.736 964 HG2 LYS 125 HG2 LYS 125 3.225 -17.195 -9.427 965 HG3 LYS 125 HG3 LYS 125 2.451 -16.742 -7.893 966 HD2 LYS 125 HD2 LYS 125 2.845 -19.030 -7.016 967 HD3 LYS 125 HD3 LYS 125 3.689 -19.466 -8.506 968 HE2 LYS 125 HE2 LYS 125 4.512 -17.221 -6.601 969 HE3 LYS 125 HE3 LYS 125 5.189 -18.850 -6.580 970 HZ1 LYS 125 HZ1 LYS 125 5.414 -16.955 -8.846 971 HZ2 LYS 125 HZ2 LYS 125 6.603 -17.357 -7.809 972 HZ3 LYS 125 HZ3 LYS 125 6.014 -18.479 -8.830 973 H PHE 126 H PHE 126 -1.938 -17.148 -8.896 974 HA PHE 126 HA PHE 126 -3.424 -18.283 -11.035 975 HB2 PHE 126 HB2 PHE 126 -4.183 -20.205 -9.460 976 HB3 PHE 126 HB3 PHE 126 -2.723 -20.410 -10.382 977 HD1 PHE 126 HD2 PHE 126 -3.983 -19.567 -6.958 978 HD2 PHE 126 HD1 PHE 126 -0.615 -20.835 -9.325 979 HE1 PHE 126 HE2 PHE 126 -2.714 -20.127 -4.885 980 HE2 PHE 126 HE1 PHE 126 0.647 -21.365 -7.263 981 HZ PHE 126 HZ PHE 126 -0.401 -20.993 -5.034 Start of MODEL 11 1 H1 MET 1 H1 MET 1 11.064 -6.746 -3.092 2 H2 MET 1 H2 MET 1 10.666 -8.220 -2.511 3 H3 MET 1 H3 MET 1 9.700 -7.495 -3.610 4 HA MET 1 HA MET 1 10.216 -6.550 -0.873 5 HB2 MET 1 HB2 MET 1 8.391 -5.383 -3.011 6 HB3 MET 1 HB3 MET 1 8.250 -5.017 -1.290 7 HG2 MET 1 HG2 MET 1 10.581 -4.188 -1.259 8 HG3 MET 1 HG3 MET 1 10.705 -4.484 -2.998 9 HE1 MET 1 HE1 MET 1 11.536 -2.001 -3.354 10 HE2 MET 1 HE2 MET 1 10.664 -0.572 -2.757 11 HE3 MET 1 HE3 MET 1 11.400 -1.708 -1.604 12 H ALA 2 H ALA 2 7.116 -7.139 -2.628 13 HA ALA 2 HA ALA 2 5.259 -8.197 -1.996 14 HB1 ALA 2 HB1 ALA 2 5.425 -10.563 -1.509 15 HB2 ALA 2 HB2 ALA 2 6.633 -10.130 -2.740 16 HB3 ALA 2 HB3 ALA 2 7.126 -10.386 -1.043 17 H SER 3 H SER 3 6.414 -6.400 -0.035 18 HA SER 3 HA SER 3 6.345 -7.464 2.587 19 HB2 SER 3 HB2 SER 3 6.279 -4.599 1.599 20 HB3 SER 3 HB3 SER 3 6.917 -5.187 3.157 21 HG SER 3 HG SER 3 8.599 -4.819 1.694 22 H VAL 4 H VAL 4 3.866 -8.124 1.541 23 HA VAL 4 HA VAL 4 1.917 -6.462 3.031 24 HB VAL 4 HB VAL 4 0.335 -6.789 1.064 25 HG11 VAL 4 HG11 VAL 4 2.743 -4.991 0.580 26 HG12 VAL 4 HG12 VAL 4 1.124 -4.823 -0.129 27 HG13 VAL 4 HG13 VAL 4 1.349 -4.613 1.614 28 HG21 VAL 4 HG21 VAL 4 1.844 -8.493 -0.116 29 HG22 VAL 4 HG22 VAL 4 1.162 -7.206 -1.128 30 HG23 VAL 4 HG23 VAL 4 2.860 -7.132 -0.610 31 H GLU 5 H GLU 5 3.306 -8.937 3.722 32 HA GLU 5 HA GLU 5 1.481 -11.152 3.582 33 HB2 GLU 5 HB2 GLU 5 2.741 -12.129 5.296 34 HB3 GLU 5 HB3 GLU 5 3.874 -11.349 4.211 35 HG2 GLU 5 HG2 GLU 5 3.000 -10.394 6.972 36 HG3 GLU 5 HG3 GLU 5 4.535 -11.124 6.551 37 H ARG 6 H ARG 6 -0.290 -11.649 5.036 38 HA ARG 6 HA ARG 6 -1.502 -9.251 6.260 39 HB2 ARG 6 HB2 ARG 6 -2.922 -10.881 5.107 40 HB3 ARG 6 HB3 ARG 6 -2.353 -12.184 6.158 41 HG2 ARG 6 HG2 ARG 6 -3.351 -11.057 8.125 42 HG3 ARG 6 HG3 ARG 6 -3.891 -9.717 7.088 43 HD2 ARG 6 HD2 ARG 6 -5.270 -11.349 5.780 44 HD3 ARG 6 HD3 ARG 6 -4.744 -12.630 6.870 45 HE ARG 6 HE ARG 6 -5.885 -11.616 8.698 46 HH11 ARG 6 HH21 ARG 6 -6.773 -10.178 5.559 47 HH12 ARG 6 HH22 ARG 6 -8.262 -9.498 6.156 48 HH21 ARG 6 HH11 ARG 6 -7.825 -10.673 9.457 49 HH22 ARG 6 HH12 ARG 6 -8.850 -9.774 8.378 50 H ASP 7 H ASP 7 -0.468 -12.473 7.334 51 HA ASP 7 HA ASP 7 1.243 -11.620 9.421 52 HB2 ASP 7 HB2 ASP 7 -0.905 -11.416 10.712 53 HB3 ASP 7 HB3 ASP 7 -1.349 -13.053 10.219 54 H GLU 8 H GLU 8 2.543 -13.595 9.901 55 HA GLU 8 HA GLU 8 2.702 -15.355 7.723 56 HB2 GLU 8 HB2 GLU 8 3.731 -15.722 10.568 57 HB3 GLU 8 HB3 GLU 8 4.197 -16.718 9.180 58 HG2 GLU 8 HG2 GLU 8 5.056 -14.685 8.017 59 HG3 GLU 8 HG3 GLU 8 4.672 -13.717 9.442 60 H THR 9 H THR 9 0.722 -15.643 10.668 61 HA THR 9 HA THR 9 0.016 -18.368 10.522 62 HB THR 9 HB THR 9 -1.798 -16.056 11.253 63 HG1 THR 9 HG1 THR 9 -0.064 -15.664 12.375 64 HG21 THR 9 HG21 THR 9 -1.653 -18.935 12.243 65 HG22 THR 9 HG22 THR 9 -2.722 -17.671 12.902 66 HG23 THR 9 HG23 THR 9 -2.931 -18.220 11.234 67 H ARG 10 H ARG 10 -1.294 -15.535 8.650 68 HA ARG 10 HA ARG 10 -3.443 -17.104 7.509 69 HB2 ARG 10 HB2 ARG 10 -3.591 -14.651 7.594 70 HB3 ARG 10 HB3 ARG 10 -2.115 -14.495 6.638 71 HG2 ARG 10 HG2 ARG 10 -4.077 -14.051 5.258 72 HG3 ARG 10 HG3 ARG 10 -3.210 -15.459 4.671 73 HD2 ARG 10 HD2 ARG 10 -4.862 -16.941 5.813 74 HD3 ARG 10 HD3 ARG 10 -5.745 -15.507 6.372 75 HE ARG 10 HE ARG 10 -5.644 -15.081 3.690 76 HH11 ARG 10 HH21 ARG 10 -6.823 -17.796 5.671 77 HH12 ARG 10 HH22 ARG 10 -7.922 -18.374 4.480 78 HH21 ARG 10 HH11 ARG 10 -6.963 -15.935 2.054 79 HH22 ARG 10 HH12 ARG 10 -8.001 -17.295 2.337 80 H GLU 11 H GLU 11 -0.107 -16.251 6.526 81 HA GLU 11 HA GLU 11 -0.378 -17.312 3.889 82 HB2 GLU 11 HB2 GLU 11 2.237 -17.100 5.406 83 HB3 GLU 11 HB3 GLU 11 1.964 -16.995 3.672 84 HG2 GLU 11 HG2 GLU 11 1.355 -14.944 5.818 85 HG3 GLU 11 HG3 GLU 11 2.456 -14.794 4.467 86 H HIS 12 H HIS 12 0.963 -18.748 6.907 87 HA HIS 12 HA HIS 12 1.441 -21.342 5.874 88 HB2 HIS 12 HB2 HIS 12 0.566 -20.513 8.674 89 HB3 HIS 12 HB3 HIS 12 1.135 -22.119 8.234 90 HD1 HIS 12 HD1 HIS 12 3.814 -21.703 6.800 91 HD2 HIS 12 HD2 HIS 12 2.414 -19.345 9.990 92 HE1 HIS 12 HE1 HIS 12 5.874 -20.665 7.870 93 H ARG 13 H ARG 13 -1.557 -20.037 7.457 94 HA ARG 13 HA ARG 13 -2.902 -22.543 7.302 95 HB2 ARG 13 HB2 ARG 13 -3.952 -19.714 7.668 96 HB3 ARG 13 HB3 ARG 13 -4.997 -21.136 7.603 97 HG2 ARG 13 HG2 ARG 13 -3.627 -22.165 9.486 98 HG3 ARG 13 HG3 ARG 13 -2.785 -20.632 9.648 99 HD2 ARG 13 HD2 ARG 13 -4.557 -20.678 11.276 100 HD3 ARG 13 HD3 ARG 13 -5.014 -19.509 10.020 101 HE ARG 13 HE ARG 13 -5.938 -22.271 9.606 102 HH11 ARG 13 HH11 ARG 13 -6.857 -19.213 11.173 103 HH12 ARG 13 HH12 ARG 13 -8.553 -19.484 11.007 104 HH21 ARG 13 HH21 ARG 13 -8.122 -22.571 9.247 105 HH22 ARG 13 HH22 ARG 13 -9.305 -21.493 9.936 106 H ILE 14 H ILE 14 -2.968 -19.772 4.942 107 HA ILE 14 HA ILE 14 -5.007 -21.028 3.411 108 HB ILE 14 HB ILE 14 -4.302 -18.615 3.306 109 HG12 ILE 14 HG12 ILE 14 -4.775 -20.232 0.786 110 HG13 ILE 14 HG13 ILE 14 -5.963 -19.494 1.851 111 HG21 ILE 14 HG21 ILE 14 -2.596 -17.859 1.789 112 HG22 ILE 14 HG22 ILE 14 -1.866 -18.949 2.951 113 HG23 ILE 14 HG23 ILE 14 -2.201 -19.517 1.299 114 HD11 ILE 14 HD11 ILE 14 -5.861 -18.165 -0.101 115 HD12 ILE 14 HD12 ILE 14 -5.035 -17.229 1.164 116 HD13 ILE 14 HD13 ILE 14 -4.090 -18.091 -0.077 117 H GLU 15 H GLU 15 -1.420 -21.299 3.300 118 HA GLU 15 HA GLU 15 -1.279 -23.027 1.036 119 HB2 GLU 15 HB2 GLU 15 0.639 -21.829 1.916 120 HB3 GLU 15 HB3 GLU 15 0.523 -22.682 3.452 121 HG2 GLU 15 HG2 GLU 15 2.315 -23.606 2.086 122 HG3 GLU 15 HG3 GLU 15 1.059 -24.797 2.408 123 H THR 16 H THR 16 -1.878 -23.726 4.504 124 HA THR 16 HA THR 16 -1.727 -26.608 3.919 125 HB THR 16 HB THR 16 -1.680 -26.818 6.405 126 HG1 THR 16 HG1 THR 16 -1.291 -24.010 6.356 127 HG21 THR 16 HG21 THR 16 0.623 -26.016 6.640 128 HG22 THR 16 HG22 THR 16 0.386 -26.784 5.063 129 HG23 THR 16 HG23 THR 16 0.458 -25.014 5.181 130 H GLU 17 H GLU 17 -4.287 -24.394 4.011 131 HA GLU 17 HA GLU 17 -6.194 -26.626 4.620 132 HB2 GLU 17 HB2 GLU 17 -6.459 -23.692 5.384 133 HB3 GLU 17 HB3 GLU 17 -7.660 -24.949 5.647 134 HG2 GLU 17 HG2 GLU 17 -6.160 -26.152 7.167 135 HG3 GLU 17 HG3 GLU 17 -4.882 -24.963 6.890 136 H ILE 18 H ILE 18 -5.390 -24.043 2.344 137 HA ILE 18 HA ILE 18 -8.103 -24.342 1.106 138 HB ILE 18 HB ILE 18 -6.315 -21.988 1.627 139 HG12 ILE 18 HG12 ILE 18 -9.330 -22.374 1.904 140 HG13 ILE 18 HG13 ILE 18 -8.189 -22.778 3.182 141 HG21 ILE 18 HG21 ILE 18 -6.760 -21.731 -0.748 142 HG22 ILE 18 HG22 ILE 18 -8.489 -22.048 -0.494 143 HG23 ILE 18 HG23 ILE 18 -7.718 -20.575 0.145 144 HD11 ILE 18 HD11 ILE 18 -8.622 -19.981 2.076 145 HD12 ILE 18 HD12 ILE 18 -9.195 -20.626 3.619 146 HD13 ILE 18 HD13 ILE 18 -7.454 -20.449 3.341 147 H ILE 19 H ILE 19 -4.599 -24.140 0.344 148 HA ILE 19 HA ILE 19 -5.336 -25.447 -2.244 149 HB ILE 19 HB ILE 19 -3.304 -24.452 -3.226 150 HG12 ILE 19 HG12 ILE 19 -2.322 -23.718 -0.935 151 HG13 ILE 19 HG13 ILE 19 -2.031 -22.796 -2.402 152 HG21 ILE 19 HG21 ILE 19 -5.504 -23.690 -3.832 153 HG22 ILE 19 HG22 ILE 19 -5.538 -22.543 -2.490 154 HG23 ILE 19 HG23 ILE 19 -4.378 -22.326 -3.813 155 HD11 ILE 19 HD11 ILE 19 -4.195 -22.013 -0.442 156 HD12 ILE 19 HD12 ILE 19 -2.529 -21.392 -0.393 157 HD13 ILE 19 HD13 ILE 19 -3.559 -21.066 -1.794 158 H VAL 20 H VAL 20 -4.396 -26.401 0.596 159 HA VAL 20 HA VAL 20 -1.936 -27.693 0.281 160 HB VAL 20 HB VAL 20 -3.319 -27.317 2.316 161 HG11 VAL 20 HG11 VAL 20 -5.496 -28.205 1.615 162 HG12 VAL 20 HG12 VAL 20 -4.819 -29.853 1.633 163 HG13 VAL 20 HG13 VAL 20 -4.925 -28.915 3.127 164 HG21 VAL 20 HG21 VAL 20 -2.491 -29.261 3.547 165 HG22 VAL 20 HG22 VAL 20 -2.260 -30.149 2.026 166 HG23 VAL 20 HG23 VAL 20 -1.286 -28.702 2.374 167 H ASP 21 H ASP 21 -5.140 -28.647 -0.766 168 HA ASP 21 HA ASP 21 -4.506 -31.363 -1.478 169 HB2 ASP 21 HB2 ASP 21 -6.742 -30.513 -0.766 170 HB3 ASP 21 HB3 ASP 21 -6.860 -29.605 -2.273 171 H ALA 22 H ALA 22 -3.397 -28.619 -2.995 172 HA ALA 22 HA ALA 22 -3.546 -29.749 -5.747 173 HB1 ALA 22 HB1 ALA 22 -3.915 -27.323 -6.430 174 HB2 ALA 22 HB2 ALA 22 -5.292 -28.095 -5.614 175 HB3 ALA 22 HB3 ALA 22 -4.251 -26.968 -4.725 176 H GLU 23 H GLU 23 -1.793 -29.204 -7.066 177 HA GLU 23 HA GLU 23 0.559 -27.919 -5.768 178 HB2 GLU 23 HB2 GLU 23 1.936 -29.813 -6.390 179 HB3 GLU 23 HB3 GLU 23 0.611 -30.332 -5.355 180 HG2 GLU 23 HG2 GLU 23 -0.630 -31.169 -7.345 181 HG3 GLU 23 HG3 GLU 23 0.684 -30.639 -8.393 182 H ASP 24 H ASP 24 -1.465 -27.637 -8.325 183 HA ASP 24 HA ASP 24 0.643 -26.523 -10.102 184 HB2 ASP 24 HB2 ASP 24 -0.042 -28.700 -11.043 185 HB3 ASP 24 HB3 ASP 24 -1.744 -28.245 -10.901 186 H LYS 25 H LYS 25 -0.093 -24.651 -11.229 187 HA LYS 25 HA LYS 25 -1.691 -22.953 -9.746 188 HB2 LYS 25 HB2 LYS 25 -1.557 -21.403 -11.621 189 HB3 LYS 25 HB3 LYS 25 -0.009 -22.221 -11.394 190 HG2 LYS 25 HG2 LYS 25 -0.659 -23.817 -13.257 191 HG3 LYS 25 HG3 LYS 25 -2.116 -22.840 -13.516 192 HD2 LYS 25 HD2 LYS 25 -0.733 -20.881 -14.060 193 HD3 LYS 25 HD3 LYS 25 0.744 -21.846 -13.790 194 HE2 LYS 25 HE2 LYS 25 -0.027 -23.469 -15.520 195 HE3 LYS 25 HE3 LYS 25 -1.466 -22.490 -15.800 196 HZ1 LYS 25 HZ1 LYS 25 1.323 -21.599 -16.293 197 HZ2 LYS 25 HZ2 LYS 25 0.250 -22.026 -17.439 198 HZ3 LYS 25 HZ3 LYS 25 -0.009 -20.686 -16.551 199 H GLU 26 H GLU 26 -2.836 -25.130 -12.384 200 HA GLU 26 HA GLU 26 -5.376 -23.752 -12.646 201 HB2 GLU 26 HB2 GLU 26 -4.403 -26.541 -13.418 202 HB3 GLU 26 HB3 GLU 26 -6.015 -25.944 -13.776 203 HG2 GLU 26 HG2 GLU 26 -5.019 -24.017 -15.033 204 HG3 GLU 26 HG3 GLU 26 -3.410 -24.673 -14.739 205 H GLU 27 H GLU 27 -4.174 -26.534 -10.759 206 HA GLU 27 HA GLU 27 -6.735 -27.240 -9.624 207 HB2 GLU 27 HB2 GLU 27 -3.895 -27.833 -8.682 208 HB3 GLU 27 HB3 GLU 27 -5.358 -28.626 -8.098 209 HG2 GLU 27 HG2 GLU 27 -4.285 -28.725 -10.954 210 HG3 GLU 27 HG3 GLU 27 -4.102 -29.985 -9.742 211 H ARG 28 H ARG 28 -3.999 -25.145 -8.624 212 HA ARG 28 HA ARG 28 -5.170 -24.544 -6.049 213 HB2 ARG 28 HB2 ARG 28 -2.937 -23.191 -7.637 214 HB3 ARG 28 HB3 ARG 28 -3.447 -22.721 -6.004 215 HG2 ARG 28 HG2 ARG 28 -3.116 -25.132 -5.310 216 HG3 ARG 28 HG3 ARG 28 -2.297 -25.421 -6.839 217 HD2 ARG 28 HD2 ARG 28 -0.477 -23.994 -6.238 218 HD3 ARG 28 HD3 ARG 28 -1.422 -23.246 -4.930 219 HE ARG 28 HE ARG 28 -1.059 -26.136 -4.650 220 HH11 ARG 28 HH11 ARG 28 0.400 -23.018 -3.764 221 HH12 ARG 28 HH12 ARG 28 0.785 -23.549 -2.142 222 HH21 ARG 28 HH21 ARG 28 -0.513 -26.798 -2.632 223 HH22 ARG 28 HH22 ARG 28 0.460 -25.785 -1.565 224 H ALA 29 H ALA 29 -5.602 -23.127 -9.266 225 HA ALA 29 HA ALA 29 -6.994 -20.773 -8.354 226 HB1 ALA 29 HB1 ALA 29 -7.925 -20.676 -10.604 227 HB2 ALA 29 HB2 ALA 29 -6.200 -21.063 -10.709 228 HB3 ALA 29 HB3 ALA 29 -7.425 -22.334 -10.942 229 H MET 30 H MET 30 -7.994 -24.198 -9.008 230 HA MET 30 HA MET 30 -10.757 -23.699 -8.389 231 HB2 MET 30 HB2 MET 30 -9.213 -26.303 -8.263 232 HB3 MET 30 HB3 MET 30 -10.961 -26.124 -8.162 233 HG2 MET 30 HG2 MET 30 -9.259 -25.343 -10.555 234 HG3 MET 30 HG3 MET 30 -10.209 -26.806 -10.386 235 HE1 MET 30 HE1 MET 30 -11.133 -22.673 -10.113 236 HE2 MET 30 HE2 MET 30 -9.987 -23.221 -11.354 237 HE3 MET 30 HE3 MET 30 -11.631 -22.721 -11.802 238 H GLY 31 H GLY 31 -7.982 -24.653 -6.304 239 HA2 GLY 31 HA2 GLY 31 -9.394 -25.046 -3.903 240 HA3 GLY 31 HA3 GLY 31 -7.758 -24.376 -4.020 241 H TRP 32 H TRP 32 -7.965 -21.949 -5.109 242 HA TRP 32 HA TRP 32 -9.122 -20.183 -3.266 243 HB2 TRP 32 HB2 TRP 32 -8.174 -19.938 -6.120 244 HB3 TRP 32 HB3 TRP 32 -9.072 -18.620 -5.395 245 HD1 TRP 32 HD1 TRP 32 -5.662 -20.247 -5.274 246 HE1 TRP 32 HE1 TRP 32 -4.074 -18.785 -3.895 247 HE3 TRP 32 HE3 TRP 32 -9.081 -16.989 -3.292 248 HZ2 TRP 32 HZ2 TRP 32 -4.268 -16.513 -2.120 249 HZ3 TRP 32 HZ3 TRP 32 -8.347 -15.207 -1.731 250 HH2 TRP 32 HH2 TRP 32 -5.944 -14.940 -1.171 251 H TYR 33 H TYR 33 -10.468 -21.217 -6.475 252 HA TYR 33 HA TYR 33 -12.777 -19.670 -6.383 253 HB2 TYR 33 HB2 TYR 33 -12.099 -20.840 -8.398 254 HB3 TYR 33 HB3 TYR 33 -12.307 -22.404 -7.619 255 HD1 TYR 33 HD2 TYR 33 -14.550 -23.321 -7.110 256 HD2 TYR 33 HD1 TYR 33 -14.050 -19.617 -9.258 257 HE1 TYR 33 HE2 TYR 33 -16.954 -23.327 -7.650 258 HE2 TYR 33 HE1 TYR 33 -16.418 -19.710 -9.961 259 HH TYR 33 HH TYR 33 -18.671 -22.280 -8.847 260 H TYR 34 H TYR 34 -12.365 -23.042 -5.072 261 HA TYR 34 HA TYR 34 -15.133 -23.323 -4.512 262 HB2 TYR 34 HB2 TYR 34 -12.707 -24.742 -3.339 263 HB3 TYR 34 HB3 TYR 34 -14.367 -25.197 -2.994 264 HD1 TYR 34 HD2 TYR 34 -15.794 -25.189 -5.521 265 HD2 TYR 34 HD1 TYR 34 -11.754 -26.441 -4.651 266 HE1 TYR 34 HE2 TYR 34 -15.850 -26.697 -7.469 267 HE2 TYR 34 HE1 TYR 34 -11.818 -27.989 -6.580 268 HH TYR 34 HH TYR 34 -14.686 -28.276 -8.732 269 H TYR 35 H TYR 35 -12.383 -22.411 -2.282 270 HA TYR 35 HA TYR 35 -14.266 -22.192 -0.106 271 HB2 TYR 35 HB2 TYR 35 -12.542 -21.886 1.241 272 HB3 TYR 35 HB3 TYR 35 -11.581 -22.430 -0.116 273 HD1 TYR 35 HD1 TYR 35 -10.257 -20.785 -1.429 274 HD2 TYR 35 HD2 TYR 35 -12.574 -19.556 1.989 275 HE1 TYR 35 HE1 TYR 35 -9.004 -18.660 -1.362 276 HE2 TYR 35 HE2 TYR 35 -11.372 -17.404 2.048 277 HH TYR 35 HH TYR 35 -9.770 -16.066 1.045 278 H LEU 36 H LEU 36 -12.979 -19.851 -2.496 279 HA LEU 36 HA LEU 36 -13.967 -17.509 -1.250 280 HB2 LEU 36 HB2 LEU 36 -12.326 -17.467 -3.048 281 HB3 LEU 36 HB3 LEU 36 -13.480 -18.201 -4.169 282 HG LEU 36 HG LEU 36 -14.897 -16.194 -4.093 283 HD11 LEU 36 HD11 LEU 36 -14.446 -15.323 -1.839 284 HD12 LEU 36 HD12 LEU 36 -12.738 -15.047 -2.258 285 HD13 LEU 36 HD13 LEU 36 -14.020 -14.101 -3.041 286 HD21 LEU 36 HD21 LEU 36 -13.427 -14.792 -5.385 287 HD22 LEU 36 HD22 LEU 36 -11.977 -15.522 -4.652 288 HD23 LEU 36 HD23 LEU 36 -13.028 -16.471 -5.725 289 H ASP 37 H ASP 37 -15.477 -19.591 -3.825 290 HA ASP 37 HA ASP 37 -17.904 -18.132 -4.028 291 HB2 ASP 37 HB2 ASP 37 -17.195 -19.850 -5.656 292 HB3 ASP 37 HB3 ASP 37 -17.363 -21.104 -4.428 293 H ASP 38 H ASP 38 -16.992 -20.868 -1.890 294 HA ASP 38 HA ASP 38 -19.494 -21.076 -0.540 295 HB2 ASP 38 HB2 ASP 38 -17.760 -22.806 -0.470 296 HB3 ASP 38 HB3 ASP 38 -16.687 -21.726 0.421 297 H THR 39 H THR 39 -16.943 -18.665 -0.184 298 HA THR 39 HA THR 39 -17.862 -17.889 2.516 299 HB THR 39 HB THR 39 -15.536 -16.925 0.803 300 HG1 THR 39 HG1 THR 39 -15.191 -18.965 1.440 301 HG21 THR 39 HG21 THR 39 -14.697 -16.049 3.055 302 HG22 THR 39 HG22 THR 39 -16.028 -15.144 2.321 303 HG23 THR 39 HG23 THR 39 -16.359 -16.256 3.656 304 H LEU 40 H LEU 40 -17.844 -16.616 -0.844 305 HA LEU 40 HA LEU 40 -18.540 -13.946 -0.261 306 HB2 LEU 40 HB2 LEU 40 -19.231 -15.695 -2.638 307 HB3 LEU 40 HB3 LEU 40 -19.617 -13.977 -2.563 308 HG LEU 40 HG LEU 40 -16.823 -15.148 -2.509 309 HD11 LEU 40 HD11 LEU 40 -17.980 -15.423 -4.669 310 HD12 LEU 40 HD12 LEU 40 -18.308 -13.680 -4.721 311 HD13 LEU 40 HD13 LEU 40 -16.637 -14.279 -4.792 312 HD21 LEU 40 HD21 LEU 40 -16.100 -12.796 -3.008 313 HD22 LEU 40 HD22 LEU 40 -17.719 -12.276 -2.501 314 HD23 LEU 40 HD23 LEU 40 -16.618 -13.124 -1.361 315 H GLU 41 H GLU 41 -20.324 -13.218 0.851 316 HA GLU 41 HA GLU 41 -22.805 -14.748 0.993 317 HB2 GLU 41 HB2 GLU 41 -21.924 -12.046 2.085 318 HB3 GLU 41 HB3 GLU 41 -23.534 -12.719 2.361 319 HG2 GLU 41 HG2 GLU 41 -21.037 -14.288 3.052 320 HG3 GLU 41 HG3 GLU 41 -21.740 -13.116 4.169 321 H PHE 42 H PHE 42 -22.394 -14.496 -1.532 322 HA PHE 42 HA PHE 42 -23.260 -12.098 -2.810 323 HB2 PHE 42 HB2 PHE 42 -23.237 -13.367 -4.866 324 HB3 PHE 42 HB3 PHE 42 -21.830 -13.750 -3.912 325 HD1 PHE 42 HD2 PHE 42 -25.213 -15.017 -4.932 326 HD2 PHE 42 HD1 PHE 42 -21.316 -16.049 -3.383 327 HE1 PHE 42 HE2 PHE 42 -25.738 -17.422 -5.191 328 HE2 PHE 42 HE1 PHE 42 -21.849 -18.443 -3.645 329 HZ PHE 42 HZ PHE 42 -24.061 -19.145 -4.544 330 HA PRO 43 HA PRO 43 -24.468 -11.561 -4.885 331 HB2 PRO 43 HB2 PRO 43 -26.452 -9.778 -5.397 332 HB3 PRO 43 HB3 PRO 43 -26.451 -11.435 -6.076 333 HG2 PRO 43 HG2 PRO 43 -27.923 -10.446 -3.616 334 HG3 PRO 43 HG3 PRO 43 -28.570 -11.410 -4.983 335 HD2 PRO 43 HD2 PRO 43 -27.735 -12.564 -2.646 336 HD3 PRO 43 HD3 PRO 43 -27.505 -13.372 -4.224 337 H PHE 44 H PHE 44 -23.684 -9.365 -4.796 338 HA PHE 44 HA PHE 44 -24.178 -7.750 -2.392 339 HB2 PHE 44 HB2 PHE 44 -21.910 -7.663 -1.683 340 HB3 PHE 44 HB3 PHE 44 -22.448 -9.325 -1.651 341 HD1 PHE 44 HD1 PHE 44 -21.625 -10.939 -3.484 342 HD2 PHE 44 HD2 PHE 44 -19.920 -7.039 -2.832 343 HE1 PHE 44 HE1 PHE 44 -19.543 -11.664 -4.610 344 HE2 PHE 44 HE2 PHE 44 -17.871 -7.740 -4.032 345 HZ PHE 44 HZ PHE 44 -17.665 -10.061 -4.902 346 H MET 45 H MET 45 -22.160 -5.833 -2.774 347 HA MET 45 HA MET 45 -22.324 -5.131 -5.642 348 HB2 MET 45 HB2 MET 45 -23.150 -2.998 -5.321 349 HB3 MET 45 HB3 MET 45 -24.211 -4.015 -4.370 350 HG2 MET 45 HG2 MET 45 -23.511 -3.125 -2.360 351 HG3 MET 45 HG3 MET 45 -21.887 -2.770 -2.921 352 HE1 MET 45 HE1 MET 45 -21.089 -0.788 -4.293 353 HE2 MET 45 HE2 MET 45 -22.263 -0.955 -5.607 354 HE3 MET 45 HE3 MET 45 -22.095 0.593 -4.754 355 H GLY 46 H GLY 46 -20.919 -3.319 -6.231 356 HA2 GLY 46 HA2 GLY 46 -18.599 -2.791 -4.479 357 HA3 GLY 46 HA3 GLY 46 -18.305 -3.917 -5.816 358 H LYS 47 H LYS 47 -16.761 -1.949 -5.934 359 HA LYS 47 HA LYS 47 -17.876 -0.232 -8.114 360 HB2 LYS 47 HB2 LYS 47 -16.963 0.963 -5.983 361 HB3 LYS 47 HB3 LYS 47 -15.380 0.365 -6.466 362 HG2 LYS 47 HG2 LYS 47 -15.441 2.521 -7.402 363 HG3 LYS 47 HG3 LYS 47 -15.880 1.490 -8.766 364 HD2 LYS 47 HD2 LYS 47 -17.414 3.267 -8.863 365 HD3 LYS 47 HD3 LYS 47 -18.326 1.940 -8.129 366 HE2 LYS 47 HE2 LYS 47 -18.056 2.904 -5.907 367 HE3 LYS 47 HE3 LYS 47 -16.974 4.155 -6.538 368 HZ1 LYS 47 HZ1 LYS 47 -19.811 3.888 -7.387 369 HZ2 LYS 47 HZ2 LYS 47 -19.297 4.905 -6.206 370 HZ3 LYS 47 HZ3 LYS 47 -18.793 5.112 -7.739 371 H TRP 48 H TRP 48 -17.128 -0.877 -10.063 372 HA TRP 48 HA TRP 48 -14.833 -2.719 -10.268 373 HB2 TRP 48 HB2 TRP 48 -16.856 -2.861 -11.780 374 HB3 TRP 48 HB3 TRP 48 -16.364 -1.341 -12.509 375 HD1 TRP 48 HD1 TRP 48 -13.125 -2.606 -12.241 376 HE1 TRP 48 HE1 TRP 48 -12.329 -4.073 -14.104 377 HE3 TRP 48 HE3 TRP 48 -17.674 -3.746 -14.326 378 HZ2 TRP 48 HZ2 TRP 48 -13.492 -5.742 -16.166 379 HZ3 TRP 48 HZ3 TRP 48 -17.764 -5.339 -16.236 380 HH2 TRP 48 HH2 TRP 48 -15.695 -6.346 -17.143 381 H LYS 49 H LYS 49 -13.023 -1.714 -9.631 382 HA LYS 49 HA LYS 49 -12.360 1.053 -10.237 383 HB2 LYS 49 HB2 LYS 49 -10.757 -1.307 -9.087 384 HB3 LYS 49 HB3 LYS 49 -10.202 0.359 -9.111 385 HG2 LYS 49 HG2 LYS 49 -12.581 -0.684 -7.515 386 HG3 LYS 49 HG3 LYS 49 -10.960 -0.333 -6.909 387 HD2 LYS 49 HD2 LYS 49 -11.280 2.060 -7.768 388 HD3 LYS 49 HD3 LYS 49 -12.999 1.638 -8.003 389 HE2 LYS 49 HE2 LYS 49 -13.306 1.222 -5.662 390 HE3 LYS 49 HE3 LYS 49 -11.561 1.109 -5.381 391 HZ1 LYS 49 HZ1 LYS 49 -12.559 3.197 -4.574 392 HZ2 LYS 49 HZ2 LYS 49 -11.338 3.435 -5.621 393 HZ3 LYS 49 HZ3 LYS 49 -12.877 3.665 -6.115 394 H LYS 50 H LYS 50 -12.883 0.243 -12.651 395 HA LYS 50 HA LYS 50 -11.228 -1.681 -13.908 396 HB2 LYS 50 HB2 LYS 50 -13.402 -0.980 -14.793 397 HB3 LYS 50 HB3 LYS 50 -12.761 0.621 -15.183 398 HG2 LYS 50 HG2 LYS 50 -11.224 -0.283 -16.812 399 HG3 LYS 50 HG3 LYS 50 -11.536 -1.943 -16.297 400 HD2 LYS 50 HD2 LYS 50 -13.612 -0.120 -17.596 401 HD3 LYS 50 HD3 LYS 50 -12.608 -1.298 -18.462 402 HE2 LYS 50 HE2 LYS 50 -13.527 -3.115 -16.987 403 HE3 LYS 50 HE3 LYS 50 -14.627 -1.938 -16.263 404 HZ1 LYS 50 HZ1 LYS 50 -15.702 -3.174 -18.024 405 HZ2 LYS 50 HZ2 LYS 50 -15.595 -1.609 -18.483 406 HZ3 LYS 50 HZ3 LYS 50 -14.587 -2.725 -19.123 407 H LYS 51 H LYS 51 -9.095 -1.635 -14.203 408 HA LYS 51 HA LYS 51 -7.554 0.828 -14.343 409 HB2 LYS 51 HB2 LYS 51 -6.882 -2.060 -15.068 410 HB3 LYS 51 HB3 LYS 51 -5.709 -0.734 -15.064 411 HG2 LYS 51 HG2 LYS 51 -6.067 -0.353 -12.664 412 HG3 LYS 51 HG3 LYS 51 -7.346 -1.564 -12.631 413 HD2 LYS 51 HD2 LYS 51 -5.506 -3.238 -13.473 414 HD3 LYS 51 HD3 LYS 51 -4.368 -1.973 -12.987 415 HE2 LYS 51 HE2 LYS 51 -4.538 -3.355 -11.073 416 HE3 LYS 51 HE3 LYS 51 -5.572 -1.969 -10.707 417 HZ1 LYS 51 HZ1 LYS 51 -7.476 -3.413 -11.531 418 HZ2 LYS 51 HZ2 LYS 51 -6.430 -4.665 -11.567 419 HZ3 LYS 51 HZ3 LYS 51 -6.751 -3.942 -10.145 420 H SER 52 H SER 52 -7.437 2.127 -16.155 421 HA SER 52 HA SER 52 -8.884 1.569 -18.504 422 HB2 SER 52 HB2 SER 52 -6.647 3.575 -18.002 423 HB3 SER 52 HB3 SER 52 -7.733 3.588 -19.405 424 HG SER 52 HG SER 52 -8.348 3.945 -16.667 425 H ARG 53 H ARG 53 -8.400 0.801 -20.418 426 HA ARG 53 HA ARG 53 -7.385 -0.925 -21.677 427 HB2 ARG 53 HB2 ARG 53 -6.220 1.785 -22.448 428 HB3 ARG 53 HB3 ARG 53 -6.174 0.338 -23.449 429 HG2 ARG 53 HG2 ARG 53 -7.899 1.595 -24.311 430 HG3 ARG 53 HG3 ARG 53 -8.708 0.306 -23.440 431 HD2 ARG 53 HD2 ARG 53 -8.236 2.935 -22.018 432 HD3 ARG 53 HD3 ARG 53 -9.420 2.909 -23.330 433 HE ARG 53 HE ARG 53 -10.256 0.793 -21.901 434 HH11 ARG 53 HH11 ARG 53 -9.728 4.225 -21.116 435 HH12 ARG 53 HH12 ARG 53 -10.859 4.235 -19.794 436 HH21 ARG 53 HH21 ARG 53 -11.755 0.839 -20.122 437 HH22 ARG 53 HH22 ARG 53 -11.971 2.311 -19.211 438 H LYS 54 H LYS 54 -4.500 1.070 -21.772 439 HA LYS 54 HA LYS 54 -2.970 -0.883 -20.135 440 HB2 LYS 54 HB2 LYS 54 -2.083 0.285 -22.812 441 HB3 LYS 54 HB3 LYS 54 -1.061 -0.654 -21.717 442 HG2 LYS 54 HG2 LYS 54 -2.630 -2.590 -21.932 443 HG3 LYS 54 HG3 LYS 54 -3.548 -1.690 -23.146 444 HD2 LYS 54 HD2 LYS 54 -0.609 -2.471 -23.373 445 HD3 LYS 54 HD3 LYS 54 -1.965 -3.318 -24.132 446 HE2 LYS 54 HE2 LYS 54 -2.546 -1.250 -25.400 447 HE3 LYS 54 HE3 LYS 54 -1.159 -0.424 -24.677 448 HZ1 LYS 54 HZ1 LYS 54 -0.995 -2.807 -26.429 449 HZ2 LYS 54 HZ2 LYS 54 -0.631 -1.281 -26.864 450 HZ3 LYS 54 HZ3 LYS 54 0.287 -2.045 -25.758 451 H THR 55 H THR 55 -4.091 2.230 -20.387 452 HA THR 55 HA THR 55 -1.747 3.745 -19.617 453 HB THR 55 HB THR 55 -3.750 5.382 -19.096 454 HG1 THR 55 HG1 THR 55 -5.635 4.796 -20.196 455 HG21 THR 55 HG21 THR 55 -3.972 5.933 -21.489 456 HG22 THR 55 HG22 THR 55 -2.288 5.558 -21.095 457 HG23 THR 55 HG23 THR 55 -3.288 4.355 -21.939 458 H SER 56 H SER 56 -4.170 1.751 -18.054 459 HA SER 56 HA SER 56 -4.468 1.009 -16.019 460 HB2 SER 56 HB2 SER 56 -1.714 2.073 -15.331 461 HB3 SER 56 HB3 SER 56 -2.610 0.795 -14.497 462 HG SER 56 HG SER 56 -1.071 -0.028 -15.995 463 H THR 57 H THR 57 -4.515 4.324 -16.480 464 HA THR 57 HA THR 57 -4.985 5.353 -13.905 465 HB THR 57 HB THR 57 -6.541 5.979 -16.441 466 HG1 THR 57 HG1 THR 57 -4.857 7.344 -16.991 467 HG21 THR 57 HG21 THR 57 -5.701 7.727 -14.078 468 HG22 THR 57 HG22 THR 57 -6.579 8.286 -15.522 469 HG23 THR 57 HG23 THR 57 -7.345 7.142 -14.412 470 H ILE 58 H ILE 58 -6.718 4.990 -12.437 471 HA ILE 58 HA ILE 58 -8.535 2.831 -13.222 472 HB ILE 58 HB ILE 58 -7.795 4.130 -10.612 473 HG12 ILE 58 HG12 ILE 58 -7.843 1.308 -11.804 474 HG13 ILE 58 HG13 ILE 58 -6.426 2.343 -11.644 475 HG21 ILE 58 HG21 ILE 58 -10.154 2.234 -10.963 476 HG22 ILE 58 HG22 ILE 58 -9.467 2.765 -9.411 477 HG23 ILE 58 HG23 ILE 58 -10.261 3.930 -10.457 478 HD11 ILE 58 HD11 ILE 58 -6.342 0.656 -9.982 479 HD12 ILE 58 HD12 ILE 58 -6.662 2.203 -9.157 480 HD13 ILE 58 HD13 ILE 58 -7.975 1.017 -9.410 481 H GLU 59 H GLU 59 -10.568 2.887 -13.488 482 HA GLU 59 HA GLU 59 -12.099 5.453 -13.542 483 HB2 GLU 59 HB2 GLU 59 -12.332 2.960 -15.291 484 HB3 GLU 59 HB3 GLU 59 -13.535 4.258 -15.247 485 HG2 GLU 59 HG2 GLU 59 -11.915 5.877 -16.075 486 HG3 GLU 59 HG3 GLU 59 -10.623 4.679 -16.030 487 H GLU 60 H GLU 60 -14.310 5.105 -12.696 488 HA GLU 60 HA GLU 60 -14.457 2.751 -10.855 489 HB2 GLU 60 HB2 GLU 60 -14.959 5.687 -10.212 490 HB3 GLU 60 HB3 GLU 60 -15.236 4.319 -9.130 491 HG2 GLU 60 HG2 GLU 60 -12.775 3.769 -9.296 492 HG3 GLU 60 HG3 GLU 60 -12.542 5.246 -10.237 493 H LYS 61 H LYS 61 -16.214 1.619 -11.470 494 HA LYS 61 HA LYS 61 -18.716 3.171 -12.085 495 HB2 LYS 61 HB2 LYS 61 -17.610 2.135 -14.086 496 HB3 LYS 61 HB3 LYS 61 -17.828 0.540 -13.338 497 HG2 LYS 61 HG2 LYS 61 -20.274 0.827 -13.366 498 HG3 LYS 61 HG3 LYS 61 -20.098 2.500 -13.910 499 HD2 LYS 61 HD2 LYS 61 -20.735 1.160 -15.781 500 HD3 LYS 61 HD3 LYS 61 -19.070 1.700 -16.032 501 HE2 LYS 61 HE2 LYS 61 -18.214 -0.505 -15.374 502 HE3 LYS 61 HE3 LYS 61 -19.849 -1.027 -14.920 503 HZ1 LYS 61 HZ1 LYS 61 -19.233 -1.832 -17.123 504 HZ2 LYS 61 HZ2 LYS 61 -20.532 -0.835 -17.194 505 HZ3 LYS 61 HZ3 LYS 61 -19.051 -0.302 -17.679 506 H THR 62 H THR 62 -20.397 2.707 -10.724 507 HA THR 62 HA THR 62 -20.064 0.752 -8.657 508 HB THR 62 HB THR 62 -22.637 2.165 -9.466 509 HG1 THR 62 HG1 THR 62 -21.877 3.981 -8.622 510 HG21 THR 62 HG21 THR 62 -22.741 0.544 -7.566 511 HG22 THR 62 HG22 THR 62 -21.434 1.437 -6.757 512 HG23 THR 62 HG23 THR 62 -23.015 2.209 -7.027 513 H VAL 63 H VAL 63 -20.759 -1.303 -8.553 514 HA VAL 63 HA VAL 63 -22.538 -2.377 -10.711 515 HB VAL 63 HB VAL 63 -21.040 -4.254 -10.944 516 HG11 VAL 63 HG11 VAL 63 -21.030 -2.394 -12.587 517 HG12 VAL 63 HG12 VAL 63 -19.656 -1.669 -11.733 518 HG13 VAL 63 HG13 VAL 63 -19.488 -3.259 -12.499 519 HG21 VAL 63 HG21 VAL 63 -18.922 -2.620 -9.490 520 HG22 VAL 63 HG22 VAL 63 -19.696 -4.094 -8.865 521 HG23 VAL 63 HG23 VAL 63 -18.679 -4.178 -10.307 522 H GLU 64 H GLU 64 -23.492 -4.432 -10.261 523 HA GLU 64 HA GLU 64 -23.644 -5.160 -7.364 524 HB2 GLU 64 HB2 GLU 64 -25.774 -4.352 -8.299 525 HB3 GLU 64 HB3 GLU 64 -25.675 -5.540 -9.602 526 HG2 GLU 64 HG2 GLU 64 -25.816 -7.379 -7.953 527 HG3 GLU 64 HG3 GLU 64 -25.796 -6.208 -6.631 528 H VAL 65 H VAL 65 -23.020 -7.261 -6.910 529 HA VAL 65 HA VAL 65 -21.811 -8.786 -9.178 530 HB VAL 65 HB VAL 65 -20.917 -8.706 -6.269 531 HG11 VAL 65 HG11 VAL 65 -18.836 -9.687 -7.245 532 HG12 VAL 65 HG12 VAL 65 -20.239 -10.725 -7.532 533 HG13 VAL 65 HG13 VAL 65 -19.612 -9.697 -8.843 534 HG21 VAL 65 HG21 VAL 65 -20.559 -6.453 -7.186 535 HG22 VAL 65 HG22 VAL 65 -19.019 -7.299 -7.072 536 HG23 VAL 65 HG23 VAL 65 -19.819 -7.138 -8.651 537 H LEU 66 H LEU 66 -22.846 -10.638 -9.618 538 HA LEU 66 HA LEU 66 -25.045 -11.419 -7.855 539 HB2 LEU 66 HB2 LEU 66 -24.155 -12.565 -10.536 540 HB3 LEU 66 HB3 LEU 66 -25.587 -13.033 -9.653 541 HG LEU 66 HG LEU 66 -26.365 -11.671 -11.338 542 HD11 LEU 66 HD11 LEU 66 -27.417 -9.775 -10.263 543 HD12 LEU 66 HD12 LEU 66 -27.353 -11.128 -9.120 544 HD13 LEU 66 HD13 LEU 66 -26.212 -9.770 -8.963 545 HD21 LEU 66 HD21 LEU 66 -25.571 -9.535 -12.013 546 HD22 LEU 66 HD22 LEU 66 -24.412 -9.439 -10.680 547 HD23 LEU 66 HD23 LEU 66 -24.197 -10.637 -11.984 548 H GLY 67 H GLY 67 -21.803 -12.656 -8.565 549 HA2 GLY 67 HA2 GLY 67 -21.418 -14.411 -6.553 550 HA3 GLY 67 HA3 GLY 67 -22.364 -15.362 -7.721 551 H MET 68 H MET 68 -20.055 -16.407 -7.515 552 HA MET 68 HA MET 68 -17.906 -15.320 -9.118 553 HB2 MET 68 HB2 MET 68 -18.591 -18.183 -8.318 554 HB3 MET 68 HB3 MET 68 -17.144 -17.721 -9.205 555 HG2 MET 68 HG2 MET 68 -17.872 -16.768 -6.423 556 HG3 MET 68 HG3 MET 68 -16.699 -18.020 -6.809 557 HE1 MET 68 HE1 MET 68 -14.325 -17.669 -7.756 558 HE2 MET 68 HE2 MET 68 -15.025 -16.969 -9.237 559 HE3 MET 68 HE3 MET 68 -13.720 -16.124 -8.390 560 H ALA 69 H ALA 69 -17.271 -15.887 -11.184 561 HA ALA 69 HA ALA 69 -19.327 -16.392 -13.193 562 HB1 ALA 69 HB1 ALA 69 -16.285 -16.403 -13.373 563 HB2 ALA 69 HB2 ALA 69 -17.410 -16.222 -14.727 564 HB3 ALA 69 HB3 ALA 69 -17.291 -14.938 -13.522 565 HA PRO 70 HA PRO 70 -18.971 -20.877 -13.527 566 HB2 PRO 70 HB2 PRO 70 -17.633 -20.437 -16.211 567 HB3 PRO 70 HB3 PRO 70 -18.882 -21.644 -15.765 568 HG2 PRO 70 HG2 PRO 70 -19.612 -19.383 -17.054 569 HG3 PRO 70 HG3 PRO 70 -20.578 -19.948 -15.650 570 HD2 PRO 70 HD2 PRO 70 -18.472 -17.788 -15.742 571 HD3 PRO 70 HD3 PRO 70 -20.061 -17.769 -14.917 572 H ASP 71 H ASP 71 -17.481 -22.363 -12.818 573 HA ASP 71 HA ASP 71 -14.911 -21.581 -11.997 574 HB2 ASP 71 HB2 ASP 71 -14.565 -23.781 -11.296 575 HB3 ASP 71 HB3 ASP 71 -16.292 -23.519 -11.107 576 H ASP 72 H ASP 72 -16.027 -22.928 -15.050 577 HA ASP 72 HA ASP 72 -13.616 -23.784 -16.216 578 HB2 ASP 72 HB2 ASP 72 -15.817 -24.213 -17.181 579 HB3 ASP 72 HB3 ASP 72 -16.061 -22.487 -17.469 580 H GLU 73 H GLU 73 -14.870 -20.473 -15.755 581 HA GLU 73 HA GLU 73 -12.727 -19.321 -17.455 582 HB2 GLU 73 HB2 GLU 73 -14.999 -18.029 -15.877 583 HB3 GLU 73 HB3 GLU 73 -13.772 -17.157 -16.807 584 HG2 GLU 73 HG2 GLU 73 -14.474 -18.486 -18.851 585 HG3 GLU 73 HG3 GLU 73 -15.816 -19.134 -17.905 586 H CYS 74 H CYS 74 -13.552 -19.926 -14.073 587 HA CYS 74 HA CYS 74 -11.560 -18.112 -13.020 588 HB2 CYS 74 HB2 CYS 74 -13.170 -20.278 -11.625 589 HB3 CYS 74 HB3 CYS 74 -12.228 -18.998 -10.845 590 HG CYS 74 HG CYS 74 -14.878 -18.762 -12.829 591 H LEU 75 H LEU 75 -10.629 -20.368 -14.826 592 HA LEU 75 HA LEU 75 -9.331 -22.345 -13.212 593 HB2 LEU 75 HB2 LEU 75 -9.889 -21.904 -16.022 594 HB3 LEU 75 HB3 LEU 75 -8.172 -22.178 -15.863 595 HG LEU 75 HG LEU 75 -9.268 -24.243 -16.334 596 HD11 LEU 75 HD11 LEU 75 -8.448 -24.346 -13.398 597 HD12 LEU 75 HD12 LEU 75 -8.445 -25.671 -14.577 598 HD13 LEU 75 HD13 LEU 75 -7.340 -24.303 -14.783 599 HD21 LEU 75 HD21 LEU 75 -10.931 -25.300 -14.907 600 HD22 LEU 75 HD22 LEU 75 -10.921 -23.911 -13.802 601 HD23 LEU 75 HD23 LEU 75 -11.505 -23.720 -15.460 602 H LYS 76 H LYS 76 -8.453 -19.141 -13.741 603 HA LYS 76 HA LYS 76 -5.713 -19.668 -12.802 604 HB2 LYS 76 HB2 LYS 76 -4.655 -18.329 -14.529 605 HB3 LYS 76 HB3 LYS 76 -5.433 -19.750 -15.220 606 HG2 LYS 76 HG2 LYS 76 -7.319 -18.389 -16.021 607 HG3 LYS 76 HG3 LYS 76 -6.642 -16.939 -15.274 608 HD2 LYS 76 HD2 LYS 76 -5.276 -18.542 -17.474 609 HD3 LYS 76 HD3 LYS 76 -6.262 -17.093 -17.728 610 HE2 LYS 76 HE2 LYS 76 -4.720 -15.792 -16.255 611 HE3 LYS 76 HE3 LYS 76 -3.700 -17.222 -16.072 612 HZ1 LYS 76 HZ1 LYS 76 -2.858 -15.760 -17.791 613 HZ2 LYS 76 HZ2 LYS 76 -3.311 -17.168 -18.472 614 HZ3 LYS 76 HZ3 LYS 76 -4.247 -15.838 -18.635 615 H ASP 77 H ASP 77 -8.433 -17.488 -13.097 616 HA ASP 77 HA ASP 77 -7.228 -15.548 -11.240 617 HB2 ASP 77 HB2 ASP 77 -6.543 -14.692 -13.435 618 HB3 ASP 77 HB3 ASP 77 -8.168 -14.932 -14.078 619 H MET 78 H MET 78 -8.980 -14.471 -10.101 620 HA MET 78 HA MET 78 -11.433 -16.087 -10.158 621 HB2 MET 78 HB2 MET 78 -10.504 -13.807 -8.370 622 HB3 MET 78 HB3 MET 78 -12.031 -14.658 -8.170 623 HG2 MET 78 HG2 MET 78 -9.259 -15.904 -7.975 624 HG3 MET 78 HG3 MET 78 -10.328 -15.503 -6.644 625 HE1 MET 78 HE1 MET 78 -10.239 -19.372 -9.031 626 HE2 MET 78 HE2 MET 78 -9.936 -17.840 -9.865 627 HE3 MET 78 HE3 MET 78 -8.905 -18.329 -8.500 628 H TYR 79 H TYR 79 -13.303 -15.543 -11.172 629 HA TYR 79 HA TYR 79 -13.708 -12.734 -12.083 630 HB2 TYR 79 HB2 TYR 79 -14.281 -15.387 -13.453 631 HB3 TYR 79 HB3 TYR 79 -14.992 -13.870 -13.962 632 HD1 TYR 79 HD2 TYR 79 -13.604 -12.066 -14.966 633 HD2 TYR 79 HD1 TYR 79 -12.019 -15.975 -14.069 634 HE1 TYR 79 HE2 TYR 79 -11.767 -11.680 -16.570 635 HE2 TYR 79 HE1 TYR 79 -10.159 -15.594 -15.645 636 HH TYR 79 HH TYR 79 -9.836 -12.557 -17.555 637 H VAL 80 H VAL 80 -15.872 -12.007 -12.053 638 HA VAL 80 HA VAL 80 -17.874 -13.712 -10.640 639 HB VAL 80 HB VAL 80 -18.544 -11.593 -9.475 640 HG11 VAL 80 HG11 VAL 80 -16.862 -11.784 -7.692 641 HG12 VAL 80 HG12 VAL 80 -17.390 -13.359 -8.275 642 HG13 VAL 80 HG13 VAL 80 -15.810 -12.725 -8.774 643 HG21 VAL 80 HG21 VAL 80 -16.919 -9.798 -9.144 644 HG22 VAL 80 HG22 VAL 80 -15.760 -10.580 -10.231 645 HG23 VAL 80 HG23 VAL 80 -17.293 -9.940 -10.865 646 H GLU 81 H GLU 81 -20.027 -13.325 -11.151 647 HA GLU 81 HA GLU 81 -20.561 -12.086 -13.791 648 HB2 GLU 81 HB2 GLU 81 -22.370 -13.414 -11.717 649 HB3 GLU 81 HB3 GLU 81 -22.923 -12.723 -13.253 650 HG2 GLU 81 HG2 GLU 81 -21.346 -14.309 -14.442 651 HG3 GLU 81 HG3 GLU 81 -21.033 -15.074 -12.881 652 H VAL 82 H VAL 82 -21.524 -10.029 -13.992 653 HA VAL 82 HA VAL 82 -22.092 -8.542 -11.499 654 HB VAL 82 HB VAL 82 -19.678 -8.422 -11.976 655 HG11 VAL 82 HG11 VAL 82 -18.800 -7.264 -13.960 656 HG12 VAL 82 HG12 VAL 82 -19.625 -8.756 -14.404 657 HG13 VAL 82 HG13 VAL 82 -20.404 -7.178 -14.665 658 HG21 VAL 82 HG21 VAL 82 -21.062 -5.806 -12.573 659 HG22 VAL 82 HG22 VAL 82 -20.745 -6.507 -10.962 660 HG23 VAL 82 HG23 VAL 82 -19.392 -6.020 -11.994 661 H ALA 83 H ALA 83 -23.734 -7.137 -11.699 662 HA ALA 83 HA ALA 83 -24.925 -6.689 -14.395 663 HB1 ALA 83 HB1 ALA 83 -26.130 -6.558 -11.613 664 HB2 ALA 83 HB2 ALA 83 -26.936 -5.972 -13.093 665 HB3 ALA 83 HB3 ALA 83 -26.536 -7.688 -12.929 666 H ASP 84 H ASP 84 -24.915 -4.628 -15.189 667 HA ASP 84 HA ASP 84 -23.059 -2.839 -13.793 668 HB2 ASP 84 HB2 ASP 84 -22.696 -3.467 -16.127 669 HB3 ASP 84 HB3 ASP 84 -24.237 -2.719 -16.578 670 H ILE 85 H ILE 85 -24.762 -2.467 -12.118 671 HA ILE 85 HA ILE 85 -27.005 -0.795 -12.672 672 HB ILE 85 HB ILE 85 -27.093 -0.327 -10.311 673 HG12 ILE 85 HG12 ILE 85 -24.441 -1.765 -10.009 674 HG13 ILE 85 HG13 ILE 85 -24.621 -0.013 -9.922 675 HG21 ILE 85 HG21 ILE 85 -27.844 -2.537 -11.258 676 HG22 ILE 85 HG22 ILE 85 -26.302 -3.246 -10.733 677 HG23 ILE 85 HG23 ILE 85 -27.444 -2.592 -9.543 678 HD11 ILE 85 HD11 ILE 85 -25.876 -2.021 -8.004 679 HD12 ILE 85 HD12 ILE 85 -24.501 -0.966 -7.683 680 HD13 ILE 85 HD13 ILE 85 -26.107 -0.257 -7.956 681 H GLY 86 H GLY 86 -23.795 0.026 -13.198 682 HA2 GLY 86 HA2 GLY 86 -24.160 2.912 -12.629 683 HA3 GLY 86 HA3 GLY 86 -22.664 2.062 -13.036 684 H GLY 87 H GLY 87 -24.483 0.641 -15.265 685 HA2 GLY 87 HA2 GLY 87 -24.445 2.889 -17.244 686 HA3 GLY 87 HA3 GLY 87 -23.406 1.477 -17.431 687 H LYS 88 H LYS 88 -25.909 -0.182 -16.342 688 HA LYS 88 HA LYS 88 -27.617 -0.020 -18.787 689 HB2 LYS 88 HB2 LYS 88 -26.367 -2.573 -17.679 690 HB3 LYS 88 HB3 LYS 88 -27.584 -2.505 -18.939 691 HG2 LYS 88 HG2 LYS 88 -24.775 -1.349 -19.173 692 HG3 LYS 88 HG3 LYS 88 -25.272 -2.925 -19.759 693 HD2 LYS 88 HD2 LYS 88 -26.511 -0.328 -20.736 694 HD3 LYS 88 HD3 LYS 88 -25.136 -1.094 -21.506 695 HE2 LYS 88 HE2 LYS 88 -27.821 -2.502 -21.123 696 HE3 LYS 88 HE3 LYS 88 -27.422 -1.520 -22.530 697 HZ1 LYS 88 HZ1 LYS 88 -25.500 -3.027 -22.899 698 HZ2 LYS 88 HZ2 LYS 88 -26.081 -4.056 -21.755 699 HZ3 LYS 88 HZ3 LYS 88 -26.953 -3.734 -23.084 700 H ASP 89 H ASP 89 -27.149 -1.276 -15.506 701 HA ASP 89 HA ASP 89 -28.415 -1.852 -13.818 702 HB2 ASP 89 HB2 ASP 89 -29.288 0.421 -14.015 703 HB3 ASP 89 HB3 ASP 89 -30.553 -0.142 -15.112 704 H ASP 90 H ASP 90 -29.847 -2.581 -16.897 705 HA ASP 90 HA ASP 90 -31.423 -4.826 -15.738 706 HB2 ASP 90 HB2 ASP 90 -32.570 -2.906 -16.881 707 HB3 ASP 90 HB3 ASP 90 -31.669 -3.309 -18.347 708 H ASP 91 H ASP 91 -28.457 -4.608 -16.777 709 HA ASP 91 HA ASP 91 -28.514 -7.075 -18.424 710 HB2 ASP 91 HB2 ASP 91 -28.325 -4.968 -19.885 711 HB3 ASP 91 HB3 ASP 91 -26.738 -4.749 -19.117 712 H VAL 92 H VAL 92 -26.413 -8.063 -18.581 713 HA VAL 92 HA VAL 92 -24.736 -7.720 -16.168 714 HB VAL 92 HB VAL 92 -26.616 -9.186 -15.664 715 HG11 VAL 92 HG11 VAL 92 -26.955 -11.360 -16.738 716 HG12 VAL 92 HG12 VAL 92 -27.173 -10.049 -17.895 717 HG13 VAL 92 HG13 VAL 92 -25.673 -11.006 -17.913 718 HG21 VAL 92 HG21 VAL 92 -25.477 -11.178 -14.842 719 HG22 VAL 92 HG22 VAL 92 -24.054 -10.808 -15.834 720 HG23 VAL 92 HG23 VAL 92 -24.552 -9.719 -14.516 721 H TYR 93 H TYR 93 -22.719 -8.600 -16.239 722 HA TYR 93 HA TYR 93 -21.540 -9.598 -18.768 723 HB2 TYR 93 HB2 TYR 93 -20.506 -7.256 -17.100 724 HB3 TYR 93 HB3 TYR 93 -19.735 -7.926 -18.524 725 HD1 TYR 93 HD1 TYR 93 -20.592 -7.494 -20.788 726 HD2 TYR 93 HD2 TYR 93 -22.430 -5.745 -17.295 727 HE1 TYR 93 HE1 TYR 93 -21.722 -5.832 -22.225 728 HE2 TYR 93 HE2 TYR 93 -23.580 -4.093 -18.721 729 HH TYR 93 HH TYR 93 -23.078 -3.968 -22.298 730 H THR 94 H THR 94 -18.903 -9.590 -17.841 731 HA THR 94 HA THR 94 -18.892 -10.938 -15.203 732 HB THR 94 HB THR 94 -17.283 -11.751 -17.660 733 HG1 THR 94 HG1 THR 94 -19.437 -12.407 -17.773 734 HG21 THR 94 HG21 THR 94 -16.602 -13.711 -16.280 735 HG22 THR 94 HG22 THR 94 -15.996 -12.189 -15.622 736 HG23 THR 94 HG23 THR 94 -17.397 -12.979 -14.869 737 H ALA 95 H ALA 95 -17.070 -10.390 -13.975 738 HA ALA 95 HA ALA 95 -15.157 -8.403 -15.096 739 HB1 ALA 95 HB1 ALA 95 -15.242 -7.191 -12.870 740 HB2 ALA 95 HB2 ALA 95 -16.675 -6.993 -13.870 741 HB3 ALA 95 HB3 ALA 95 -16.711 -8.120 -12.490 742 H LYS 96 H LYS 96 -13.186 -8.303 -13.940 743 HA LYS 96 HA LYS 96 -12.269 -10.878 -12.839 744 HB2 LYS 96 HB2 LYS 96 -10.888 -8.170 -13.018 745 HB3 LYS 96 HB3 LYS 96 -10.108 -9.705 -12.697 746 HG2 LYS 96 HG2 LYS 96 -10.140 -10.379 -14.903 747 HG3 LYS 96 HG3 LYS 96 -11.586 -9.478 -15.327 748 HD2 LYS 96 HD2 LYS 96 -8.895 -8.187 -14.775 749 HD3 LYS 96 HD3 LYS 96 -9.504 -8.601 -16.386 750 HE2 LYS 96 HE2 LYS 96 -11.423 -7.071 -16.127 751 HE3 LYS 96 HE3 LYS 96 -10.970 -6.737 -14.464 752 HZ1 LYS 96 HZ1 LYS 96 -8.777 -5.916 -15.509 753 HZ2 LYS 96 HZ2 LYS 96 -9.640 -5.792 -16.894 754 HZ3 LYS 96 HZ3 LYS 96 -10.089 -4.961 -15.532 755 H LEU 97 H LEU 97 -12.437 -11.257 -10.595 756 HA LEU 97 HA LEU 97 -13.574 -9.273 -8.825 757 HB2 LEU 97 HB2 LEU 97 -13.694 -11.726 -8.408 758 HB3 LEU 97 HB3 LEU 97 -11.940 -11.772 -8.204 759 HG LEU 97 HG LEU 97 -12.110 -10.299 -6.214 760 HD11 LEU 97 HD11 LEU 97 -15.118 -10.432 -6.747 761 HD12 LEU 97 HD12 LEU 97 -14.400 -9.886 -5.223 762 HD13 LEU 97 HD13 LEU 97 -14.101 -8.973 -6.694 763 HD21 LEU 97 HD21 LEU 97 -12.216 -12.768 -6.025 764 HD22 LEU 97 HD22 LEU 97 -13.091 -11.955 -4.730 765 HD23 LEU 97 HD23 LEU 97 -13.995 -12.678 -6.081 766 H SER 98 H SER 98 -10.326 -10.335 -9.672 767 HA SER 98 HA SER 98 -8.588 -8.876 -8.187 768 HB2 SER 98 HB2 SER 98 -8.429 -9.415 -11.178 769 HB3 SER 98 HB3 SER 98 -7.104 -9.422 -10.007 770 HG SER 98 HG SER 98 -8.009 -11.579 -10.635 771 H ASP 99 H ASP 99 -10.951 -7.446 -10.298 772 HA ASP 99 HA ASP 99 -9.453 -4.888 -10.316 773 HB2 ASP 99 HB2 ASP 99 -9.655 -6.262 -12.505 774 HB3 ASP 99 HB3 ASP 99 -11.365 -5.819 -12.479 775 H ILE 100 H ILE 100 -11.705 -6.216 -8.654 776 HA ILE 100 HA ILE 100 -13.580 -3.892 -8.652 777 HB ILE 100 HB ILE 100 -14.019 -6.812 -8.736 778 HG12 ILE 100 HG12 ILE 100 -15.872 -4.451 -9.236 779 HG13 ILE 100 HG13 ILE 100 -14.748 -5.125 -10.435 780 HG21 ILE 100 HG21 ILE 100 -15.871 -5.302 -6.869 781 HG22 ILE 100 HG22 ILE 100 -15.997 -6.994 -7.387 782 HG23 ILE 100 HG23 ILE 100 -14.666 -6.512 -6.358 783 HD11 ILE 100 HD11 ILE 100 -16.920 -5.988 -10.914 784 HD12 ILE 100 HD12 ILE 100 -15.976 -7.327 -10.220 785 HD13 ILE 100 HD13 ILE 100 -17.193 -6.471 -9.236 786 H GLU 101 H GLU 101 -14.404 -3.291 -6.661 787 HA GLU 101 HA GLU 101 -12.989 -4.225 -4.224 788 HB2 GLU 101 HB2 GLU 101 -12.190 -1.955 -4.815 789 HB3 GLU 101 HB3 GLU 101 -13.866 -1.399 -4.981 790 HG2 GLU 101 HG2 GLU 101 -12.902 -0.674 -2.855 791 HG3 GLU 101 HG3 GLU 101 -14.271 -1.743 -2.604 792 H ALA 102 H ALA 102 -14.441 -4.631 -2.517 793 HA ALA 102 HA ALA 102 -17.280 -4.882 -3.371 794 HB1 ALA 102 HB1 ALA 102 -16.109 -6.862 -2.474 795 HB2 ALA 102 HB2 ALA 102 -15.844 -6.017 -0.932 796 HB3 ALA 102 HB3 ALA 102 -17.498 -6.383 -1.483 797 H ILE 103 H ILE 103 -18.893 -3.846 -2.332 798 HA ILE 103 HA ILE 103 -18.265 -1.957 -0.103 799 HB ILE 103 HB ILE 103 -19.770 -1.583 -2.702 800 HG12 ILE 103 HG12 ILE 103 -17.578 0.091 -1.393 801 HG13 ILE 103 HG13 ILE 103 -17.287 -1.147 -2.616 802 HG21 ILE 103 HG21 ILE 103 -19.895 0.291 -0.298 803 HG22 ILE 103 HG22 ILE 103 -20.563 0.625 -1.911 804 HG23 ILE 103 HG23 ILE 103 -21.244 -0.667 -0.955 805 HD11 ILE 103 HD11 ILE 103 -18.732 0.072 -4.211 806 HD12 ILE 103 HD12 ILE 103 -18.846 1.412 -3.038 807 HD13 ILE 103 HD13 ILE 103 -17.272 0.958 -3.702 808 H ASP 104 H ASP 104 -19.730 -1.885 1.518 809 HA ASP 104 HA ASP 104 -21.410 -2.444 2.873 810 HB2 ASP 104 HB2 ASP 104 -22.501 -0.900 1.289 811 HB3 ASP 104 HB3 ASP 104 -23.082 -2.274 0.349 812 H VAL 105 H VAL 105 -19.930 -4.694 2.025 813 HA VAL 105 HA VAL 105 -21.994 -6.840 2.056 814 HB VAL 105 HB VAL 105 -20.361 -6.616 0.118 815 HG11 VAL 105 HG11 VAL 105 -18.271 -6.171 1.310 816 HG12 VAL 105 HG12 VAL 105 -18.360 -7.768 2.079 817 HG13 VAL 105 HG13 VAL 105 -18.157 -7.640 0.330 818 HG21 VAL 105 HG21 VAL 105 -20.431 -9.302 1.496 819 HG22 VAL 105 HG22 VAL 105 -21.769 -8.582 0.593 820 HG23 VAL 105 HG23 VAL 105 -20.248 -8.942 -0.231 821 H ASP 106 H ASP 106 -21.140 -8.913 3.207 822 HA ASP 106 HA ASP 106 -20.790 -8.302 5.990 823 HB2 ASP 106 HB2 ASP 106 -21.970 -10.317 5.178 824 HB3 ASP 106 HB3 ASP 106 -20.451 -10.911 4.479 825 H ASP 107 H ASP 107 -19.042 -8.859 7.304 826 HA ASP 107 HA ASP 107 -16.532 -7.872 6.462 827 HB2 ASP 107 HB2 ASP 107 -17.281 -7.854 8.793 828 HB3 ASP 107 HB3 ASP 107 -17.275 -9.619 8.838 829 H ASP 108 H ASP 108 -17.664 -11.318 6.684 830 HA ASP 108 HA ASP 108 -14.963 -12.275 6.242 831 HB2 ASP 108 HB2 ASP 108 -16.929 -13.502 7.401 832 HB3 ASP 108 HB3 ASP 108 -17.483 -13.886 5.762 833 H THR 109 H THR 109 -17.601 -11.254 4.192 834 HA THR 109 HA THR 109 -16.639 -12.535 1.727 835 HB THR 109 HB THR 109 -18.626 -10.255 2.213 836 HG1 THR 109 HG1 THR 109 -19.106 -12.438 3.030 837 HG21 THR 109 HG21 THR 109 -17.955 -10.080 -0.065 838 HG22 THR 109 HG22 THR 109 -17.874 -11.834 -0.238 839 HG23 THR 109 HG23 THR 109 -19.447 -11.053 -0.095 840 H GLN 110 H GLN 110 -16.602 -9.229 3.218 841 HA GLN 110 HA GLN 110 -15.059 -8.024 1.199 842 HB2 GLN 110 HB2 GLN 110 -16.365 -7.060 3.301 843 HB3 GLN 110 HB3 GLN 110 -14.811 -7.203 4.113 844 HG2 GLN 110 HG2 GLN 110 -15.438 -5.618 1.578 845 HG3 GLN 110 HG3 GLN 110 -15.195 -4.946 3.184 846 HE21 GLN 110 HE22 GLN 110 -13.641 -5.527 0.240 847 HE22 GLN 110 HE21 GLN 110 -11.993 -5.509 0.790 848 H GLU 111 H GLU 111 -14.019 -9.665 4.247 849 HA GLU 111 HA GLU 111 -11.251 -9.243 3.909 850 HB2 GLU 111 HB2 GLU 111 -12.874 -11.350 5.374 851 HB3 GLU 111 HB3 GLU 111 -11.118 -11.320 5.454 852 HG2 GLU 111 HG2 GLU 111 -12.711 -8.818 6.150 853 HG3 GLU 111 HG3 GLU 111 -12.506 -10.131 7.307 854 H ALA 112 H ALA 112 -13.325 -11.934 2.649 855 HA ALA 112 HA ALA 112 -11.134 -13.511 1.694 856 HB1 ALA 112 HB1 ALA 112 -13.434 -14.379 1.895 857 HB2 ALA 112 HB2 ALA 112 -13.971 -13.301 0.584 858 HB3 ALA 112 HB3 ALA 112 -12.804 -14.598 0.253 859 H ILE 113 H ILE 113 -13.021 -10.864 0.198 860 HA ILE 113 HA ILE 113 -11.752 -11.035 -2.378 861 HB ILE 113 HB ILE 113 -13.349 -8.841 -0.988 862 HG12 ILE 113 HG12 ILE 113 -14.196 -10.834 -3.143 863 HG13 ILE 113 HG13 ILE 113 -14.471 -11.100 -1.441 864 HG21 ILE 113 HG21 ILE 113 -13.686 -7.879 -3.275 865 HG22 ILE 113 HG22 ILE 113 -12.010 -7.802 -2.757 866 HG23 ILE 113 HG23 ILE 113 -12.509 -9.047 -3.916 867 HD11 ILE 113 HD11 ILE 113 -15.694 -8.926 -3.132 868 HD12 ILE 113 HD12 ILE 113 -16.493 -10.270 -2.309 869 HD13 ILE 113 HD13 ILE 113 -15.786 -8.966 -1.343 870 H ALA 114 H ALA 114 -11.209 -8.924 0.513 871 HA ALA 114 HA ALA 114 -9.070 -7.414 -0.567 872 HB1 ALA 114 HB1 ALA 114 -8.507 -6.950 1.787 873 HB2 ALA 114 HB2 ALA 114 -10.258 -6.833 1.526 874 HB3 ALA 114 HB3 ALA 114 -9.570 -8.267 2.322 875 H ASP 115 H ASP 115 -9.091 -10.553 1.168 876 HA ASP 115 HA ASP 115 -6.261 -10.838 1.327 877 HB2 ASP 115 HB2 ASP 115 -7.851 -12.055 2.744 878 HB3 ASP 115 HB3 ASP 115 -8.438 -12.955 1.340 879 H TRP 116 H TRP 116 -8.611 -11.862 -1.212 880 HA TRP 116 HA TRP 116 -6.692 -13.214 -2.870 881 HB2 TRP 116 HB2 TRP 116 -9.033 -13.535 -3.295 882 HB3 TRP 116 HB3 TRP 116 -9.321 -11.810 -3.441 883 HD1 TRP 116 HD1 TRP 116 -9.493 -10.927 -5.791 884 HE1 TRP 116 HE1 TRP 116 -8.694 -11.610 -8.138 885 HE3 TRP 116 HE3 TRP 116 -6.766 -15.091 -4.577 886 HZ2 TRP 116 HZ2 TRP 116 -7.164 -13.721 -9.330 887 HZ3 TRP 116 HZ3 TRP 116 -5.663 -16.427 -6.340 888 HH2 TRP 116 HH2 TRP 116 -5.851 -15.756 -8.724 889 H LEU 117 H LEU 117 -7.789 -9.781 -2.731 890 HA LEU 117 HA LEU 117 -6.226 -8.916 -4.949 891 HB2 LEU 117 HB2 LEU 117 -7.322 -7.443 -2.525 892 HB3 LEU 117 HB3 LEU 117 -6.505 -6.621 -3.845 893 HG LEU 117 HG LEU 117 -8.926 -8.401 -4.357 894 HD11 LEU 117 HD11 LEU 117 -8.916 -5.421 -3.730 895 HD12 LEU 117 HD12 LEU 117 -10.310 -6.366 -4.304 896 HD13 LEU 117 HD13 LEU 117 -9.605 -6.716 -2.722 897 HD21 LEU 117 HD21 LEU 117 -9.159 -7.031 -6.379 898 HD22 LEU 117 HD22 LEU 117 -7.724 -6.085 -5.931 899 HD23 LEU 117 HD23 LEU 117 -7.569 -7.806 -6.336 900 H TYR 118 H TYR 118 -5.481 -9.011 -1.408 901 HA TYR 118 HA TYR 118 -2.837 -7.940 -1.632 902 HB2 TYR 118 HB2 TYR 118 -3.887 -9.981 0.365 903 HB3 TYR 118 HB3 TYR 118 -2.420 -9.032 0.529 904 HD1 TYR 118 HD2 TYR 118 -3.766 -6.310 -0.466 905 HD2 TYR 118 HD1 TYR 118 -4.791 -9.302 2.478 906 HE1 TYR 118 HE2 TYR 118 -5.023 -4.619 0.811 907 HE2 TYR 118 HE1 TYR 118 -6.055 -7.611 3.761 908 HH TYR 118 HH TYR 118 -6.733 -5.381 3.881 909 H TRP 119 H TRP 119 -4.025 -11.375 -1.716 910 HA TRP 119 HA TRP 119 -1.553 -12.632 -1.889 911 HB2 TRP 119 HB2 TRP 119 -3.413 -14.000 -1.573 912 HB3 TRP 119 HB3 TRP 119 -4.290 -13.316 -2.938 913 HD1 TRP 119 HD1 TRP 119 -4.053 -14.379 -5.215 914 HE1 TRP 119 HE1 TRP 119 -2.657 -16.242 -6.282 915 HE3 TRP 119 HE3 TRP 119 -0.938 -15.347 -1.275 916 HZ2 TRP 119 HZ2 TRP 119 -0.408 -17.915 -5.507 917 HZ3 TRP 119 HZ3 TRP 119 0.865 -17.040 -1.485 918 HH2 TRP 119 HH2 TRP 119 1.143 -18.319 -3.600 919 H LEU 120 H LEU 120 -3.511 -11.234 -4.571 920 HA LEU 120 HA LEU 120 -1.818 -12.062 -6.705 921 HB2 LEU 120 HB2 LEU 120 -3.590 -9.601 -6.304 922 HB3 LEU 120 HB3 LEU 120 -2.749 -9.910 -7.809 923 HG LEU 120 HG LEU 120 -4.797 -11.831 -6.620 924 HD11 LEU 120 HD11 LEU 120 -6.279 -10.876 -8.355 925 HD12 LEU 120 HD12 LEU 120 -5.801 -9.655 -7.164 926 HD13 LEU 120 HD13 LEU 120 -5.030 -9.672 -8.764 927 HD21 LEU 120 HD21 LEU 120 -3.244 -12.935 -8.128 928 HD22 LEU 120 HD22 LEU 120 -4.779 -12.715 -8.970 929 HD23 LEU 120 HD23 LEU 120 -3.417 -11.638 -9.335 930 H ALA 121 H ALA 121 -1.812 -9.186 -4.579 931 HA ALA 121 HA ALA 121 0.061 -7.746 -6.088 932 HB1 ALA 121 HB1 ALA 121 0.082 -6.219 -4.156 933 HB2 ALA 121 HB2 ALA 121 -1.575 -6.786 -4.476 934 HB3 ALA 121 HB3 ALA 121 -0.646 -7.471 -3.129 935 H ARG 122 H ARG 122 0.556 -10.264 -3.621 936 HA ARG 122 HA ARG 122 3.340 -9.654 -3.076 937 HB2 ARG 122 HB2 ARG 122 1.887 -12.342 -3.001 938 HB3 ARG 122 HB3 ARG 122 3.575 -12.139 -2.593 939 HG2 ARG 122 HG2 ARG 122 2.462 -12.235 -0.548 940 HG3 ARG 122 HG3 ARG 122 2.941 -10.545 -0.750 941 HD2 ARG 122 HD2 ARG 122 0.725 -9.914 -1.405 942 HD3 ARG 122 HD3 ARG 122 0.206 -11.593 -1.564 943 HE ARG 122 HE ARG 122 0.216 -9.941 0.795 944 HH11 ARG 122 HH21 ARG 122 0.640 -13.378 -0.095 945 HH12 ARG 122 HH22 ARG 122 -0.003 -13.935 1.427 946 HH21 ARG 122 HH11 ARG 122 -0.758 -10.710 2.625 947 HH22 ARG 122 HH12 ARG 122 -0.718 -12.427 3.006 948 H GLY 123 H GLY 123 1.816 -10.914 -5.972 949 HA2 GLY 123 HA2 GLY 123 3.518 -11.096 -7.866 950 HA3 GLY 123 HA3 GLY 123 4.346 -12.268 -6.826 951 H TYR 124 H TYR 124 1.354 -11.594 -8.606 952 HA TYR 124 HA TYR 124 -0.169 -13.862 -8.122 953 HB2 TYR 124 HB2 TYR 124 -1.044 -12.028 -9.362 954 HB3 TYR 124 HB3 TYR 124 0.257 -12.091 -10.537 955 HD1 TYR 124 HD2 TYR 124 -2.272 -14.636 -9.259 956 HD2 TYR 124 HD1 TYR 124 -0.451 -12.674 -12.654 957 HE1 TYR 124 HE2 TYR 124 -3.717 -15.927 -10.771 958 HE2 TYR 124 HE1 TYR 124 -1.872 -14.003 -14.181 959 HH TYR 124 HH TYR 124 -4.307 -16.337 -12.944 960 H LYS 125 H LYS 125 0.151 -15.957 -8.443 961 HA LYS 125 HA LYS 125 1.678 -16.936 -10.779 962 HB2 LYS 125 HB2 LYS 125 2.917 -18.528 -9.390 963 HB3 LYS 125 HB3 LYS 125 3.322 -16.854 -9.013 964 HG2 LYS 125 HG2 LYS 125 1.818 -16.955 -7.006 965 HG3 LYS 125 HG3 LYS 125 1.493 -18.651 -7.356 966 HD2 LYS 125 HD2 LYS 125 4.223 -17.454 -6.727 967 HD3 LYS 125 HD3 LYS 125 3.186 -18.318 -5.583 968 HE2 LYS 125 HE2 LYS 125 3.321 -20.364 -6.996 969 HE3 LYS 125 HE3 LYS 125 4.380 -19.511 -8.127 970 HZ1 LYS 125 HZ1 LYS 125 6.001 -19.276 -6.340 971 HZ2 LYS 125 HZ2 LYS 125 5.028 -20.065 -5.289 972 HZ3 LYS 125 HZ3 LYS 125 5.648 -20.846 -6.577 973 H PHE 126 H PHE 126 -0.884 -17.417 -8.395 974 HA PHE 126 HA PHE 126 -2.293 -19.076 -10.185 975 HB2 PHE 126 HB2 PHE 126 -2.777 -20.895 -8.623 976 HB3 PHE 126 HB3 PHE 126 -1.101 -20.892 -9.125 977 HD1 PHE 126 HD2 PHE 126 -3.351 -19.985 -6.262 978 HD2 PHE 126 HD1 PHE 126 0.646 -20.968 -7.537 979 HE1 PHE 126 HE2 PHE 126 -2.644 -20.235 -3.888 980 HE2 PHE 126 HE1 PHE 126 1.360 -21.152 -5.169 981 HZ PHE 126 HZ PHE 126 -0.295 -20.780 -3.335 Start of MODEL 12 1 H1 MET 1 H1 MET 1 7.778 -9.826 -5.005 2 H2 MET 1 H2 MET 1 6.861 -11.140 -5.359 3 H3 MET 1 H3 MET 1 6.238 -9.633 -5.516 4 HA MET 1 HA MET 1 5.372 -10.670 -3.546 5 HB2 MET 1 HB2 MET 1 7.140 -12.221 -3.087 6 HB3 MET 1 HB3 MET 1 8.311 -10.932 -2.816 7 HG2 MET 1 HG2 MET 1 7.499 -12.050 -0.758 8 HG3 MET 1 HG3 MET 1 7.302 -10.307 -0.749 9 HE1 MET 1 HE1 MET 1 4.389 -11.901 1.470 10 HE2 MET 1 HE2 MET 1 5.894 -12.777 1.114 11 HE3 MET 1 HE3 MET 1 5.949 -11.046 1.506 12 H ALA 2 H ALA 2 4.288 -8.730 -3.331 13 HA ALA 2 HA ALA 2 5.659 -6.254 -2.779 14 HB1 ALA 2 HB1 ALA 2 2.721 -7.019 -2.537 15 HB2 ALA 2 HB2 ALA 2 3.374 -5.366 -2.574 16 HB3 ALA 2 HB3 ALA 2 3.517 -6.402 -4.005 17 H SER 3 H SER 3 4.955 -8.869 -0.672 18 HA SER 3 HA SER 3 4.725 -9.142 1.540 19 HB2 SER 3 HB2 SER 3 6.470 -6.665 1.712 20 HB3 SER 3 HB3 SER 3 6.324 -7.961 2.912 21 HG SER 3 HG SER 3 8.161 -8.198 1.539 22 H VAL 4 H VAL 4 2.567 -7.615 0.342 23 HA VAL 4 HA VAL 4 1.530 -5.591 2.003 24 HB VAL 4 HB VAL 4 -0.713 -6.525 1.190 25 HG11 VAL 4 HG11 VAL 4 1.421 -5.862 -0.884 26 HG12 VAL 4 HG12 VAL 4 -0.336 -5.770 -1.128 27 HG13 VAL 4 HG13 VAL 4 0.452 -4.704 0.044 28 HG21 VAL 4 HG21 VAL 4 1.030 -8.373 -0.528 29 HG22 VAL 4 HG22 VAL 4 0.012 -8.917 0.825 30 HG23 VAL 4 HG23 VAL 4 -0.715 -8.165 -0.596 31 H GLU 5 H GLU 5 1.735 -9.066 2.495 32 HA GLU 5 HA GLU 5 1.213 -8.754 5.329 33 HB2 GLU 5 HB2 GLU 5 -0.156 -10.942 3.699 34 HB3 GLU 5 HB3 GLU 5 -0.160 -10.783 5.451 35 HG2 GLU 5 HG2 GLU 5 -1.413 -8.608 5.196 36 HG3 GLU 5 HG3 GLU 5 -1.532 -8.929 3.459 37 H ARG 6 H ARG 6 2.658 -10.239 6.360 38 HA ARG 6 HA ARG 6 4.356 -11.929 4.606 39 HB2 ARG 6 HB2 ARG 6 6.359 -10.800 5.389 40 HB3 ARG 6 HB3 ARG 6 5.248 -9.664 4.631 41 HG2 ARG 6 HG2 ARG 6 4.465 -9.035 7.020 42 HG3 ARG 6 HG3 ARG 6 5.829 -9.995 7.601 43 HD2 ARG 6 HD2 ARG 6 6.511 -7.705 7.539 44 HD3 ARG 6 HD3 ARG 6 7.360 -8.537 6.224 45 HE ARG 6 HE ARG 6 4.992 -7.494 5.117 46 HH11 ARG 6 HH11 ARG 6 7.882 -6.138 6.677 47 HH12 ARG 6 HH12 ARG 6 7.800 -4.639 5.830 48 HH21 ARG 6 HH21 ARG 6 4.905 -5.569 3.968 49 HH22 ARG 6 HH22 ARG 6 6.040 -4.286 4.260 50 H ASP 7 H ASP 7 2.388 -12.145 7.078 51 HA ASP 7 HA ASP 7 4.021 -13.633 9.015 52 HB2 ASP 7 HB2 ASP 7 2.034 -12.476 9.805 53 HB3 ASP 7 HB3 ASP 7 1.021 -13.321 8.631 54 H GLU 8 H GLU 8 4.888 -15.482 8.267 55 HA GLU 8 HA GLU 8 4.132 -16.870 5.944 56 HB2 GLU 8 HB2 GLU 8 5.665 -17.858 8.386 57 HB3 GLU 8 HB3 GLU 8 5.587 -18.685 6.824 58 HG2 GLU 8 HG2 GLU 8 6.619 -16.699 5.727 59 HG3 GLU 8 HG3 GLU 8 6.767 -15.915 7.301 60 H THR 9 H THR 9 2.653 -17.021 9.139 61 HA THR 9 HA THR 9 1.544 -19.620 9.072 62 HB THR 9 HB THR 9 0.184 -17.136 10.129 63 HG1 THR 9 HG1 THR 9 2.108 -16.939 10.954 64 HG21 THR 9 HG21 THR 9 -1.128 -19.192 10.292 65 HG22 THR 9 HG22 THR 9 0.221 -20.030 11.090 66 HG23 THR 9 HG23 THR 9 -0.606 -18.675 11.901 67 H ARG 10 H ARG 10 0.482 -16.619 7.327 68 HA ARG 10 HA ARG 10 -2.013 -17.840 6.566 69 HB2 ARG 10 HB2 ARG 10 -1.747 -15.386 6.589 70 HB3 ARG 10 HB3 ARG 10 -0.498 -15.482 5.345 71 HG2 ARG 10 HG2 ARG 10 -2.643 -14.768 4.398 72 HG3 ARG 10 HG3 ARG 10 -2.124 -16.306 3.708 73 HD2 ARG 10 HD2 ARG 10 -3.661 -17.481 5.330 74 HD3 ARG 10 HD3 ARG 10 -4.253 -15.899 5.858 75 HE ARG 10 HE ARG 10 -4.723 -15.720 3.217 76 HH11 ARG 10 HH11 ARG 10 -5.492 -18.295 5.562 77 HH12 ARG 10 HH12 ARG 10 -6.790 -18.948 4.640 78 HH21 ARG 10 HH21 ARG 10 -6.411 -16.647 1.955 79 HH22 ARG 10 HH22 ARG 10 -7.352 -17.975 2.564 80 H GLU 11 H GLU 11 1.223 -17.611 5.050 81 HA GLU 11 HA GLU 11 0.455 -18.799 2.555 82 HB2 GLU 11 HB2 GLU 11 3.168 -18.719 3.953 83 HB3 GLU 11 HB3 GLU 11 2.884 -19.218 2.282 84 HG2 GLU 11 HG2 GLU 11 1.924 -16.947 1.803 85 HG3 GLU 11 HG3 GLU 11 2.343 -16.453 3.447 86 H HIS 12 H HIS 12 1.749 -20.145 5.632 87 HA HIS 12 HA HIS 12 1.862 -22.874 4.837 88 HB2 HIS 12 HB2 HIS 12 2.973 -22.323 6.822 89 HB3 HIS 12 HB3 HIS 12 1.649 -21.334 7.420 90 HD1 HIS 12 HD1 HIS 12 2.010 -25.179 6.748 91 HD2 HIS 12 HD2 HIS 12 0.345 -22.307 9.340 92 HE1 HIS 12 HE1 HIS 12 0.804 -26.480 8.573 93 H ARG 13 H ARG 13 -0.820 -21.013 6.464 94 HA ARG 13 HA ARG 13 -2.533 -23.302 6.590 95 HB2 ARG 13 HB2 ARG 13 -3.051 -20.306 6.745 96 HB3 ARG 13 HB3 ARG 13 -4.343 -21.506 6.902 97 HG2 ARG 13 HG2 ARG 13 -3.273 -22.543 8.820 98 HG3 ARG 13 HG3 ARG 13 -1.857 -21.487 8.674 99 HD2 ARG 13 HD2 ARG 13 -3.210 -19.516 9.136 100 HD3 ARG 13 HD3 ARG 13 -4.691 -20.502 9.196 101 HE ARG 13 HE ARG 13 -2.980 -21.651 11.055 102 HH11 ARG 13 HH11 ARG 13 -4.501 -18.468 10.646 103 HH12 ARG 13 HH12 ARG 13 -4.514 -18.098 12.329 104 HH21 ARG 13 HH21 ARG 13 -3.001 -21.162 13.303 105 HH22 ARG 13 HH22 ARG 13 -3.650 -19.673 13.872 106 H ILE 14 H ILE 14 -2.498 -20.578 4.160 107 HA ILE 14 HA ILE 14 -4.684 -21.608 2.794 108 HB ILE 14 HB ILE 14 -3.578 -19.306 2.642 109 HG12 ILE 14 HG12 ILE 14 -4.701 -20.697 0.194 110 HG13 ILE 14 HG13 ILE 14 -5.573 -19.869 1.501 111 HG21 ILE 14 HG21 ILE 14 -2.065 -20.527 0.310 112 HG22 ILE 14 HG22 ILE 14 -2.019 -18.844 0.882 113 HG23 ILE 14 HG23 ILE 14 -1.339 -20.122 1.882 114 HD11 ILE 14 HD11 ILE 14 -3.836 -18.582 -0.621 115 HD12 ILE 14 HD12 ILE 14 -5.583 -18.415 -0.366 116 HD13 ILE 14 HD13 ILE 14 -4.450 -17.722 0.813 117 H GLU 15 H GLU 15 -1.209 -22.406 2.430 118 HA GLU 15 HA GLU 15 -1.417 -24.095 0.143 119 HB2 GLU 15 HB2 GLU 15 0.686 -23.192 0.981 120 HB3 GLU 15 HB3 GLU 15 0.494 -24.064 2.500 121 HG2 GLU 15 HG2 GLU 15 2.097 -25.202 1.103 122 HG3 GLU 15 HG3 GLU 15 0.676 -26.209 1.355 123 H THR 16 H THR 16 -1.900 -24.732 3.663 124 HA THR 16 HA THR 16 -2.155 -27.608 3.051 125 HB THR 16 HB THR 16 -1.976 -27.852 5.532 126 HG1 THR 16 HG1 THR 16 -1.238 -25.115 5.496 127 HG21 THR 16 HG21 THR 16 -0.002 -28.052 4.070 128 HG22 THR 16 HG22 THR 16 0.302 -26.309 4.213 129 HG23 THR 16 HG23 THR 16 0.414 -27.358 5.644 130 H GLU 17 H GLU 17 -4.346 -25.150 3.037 131 HA GLU 17 HA GLU 17 -6.528 -26.961 4.020 132 HB2 GLU 17 HB2 GLU 17 -6.292 -23.936 4.218 133 HB3 GLU 17 HB3 GLU 17 -7.714 -24.854 4.663 134 HG2 GLU 17 HG2 GLU 17 -4.977 -25.121 5.976 135 HG3 GLU 17 HG3 GLU 17 -6.335 -24.206 6.608 136 H ILE 18 H ILE 18 -5.526 -24.698 1.424 137 HA ILE 18 HA ILE 18 -8.281 -24.896 0.285 138 HB ILE 18 HB ILE 18 -6.026 -23.038 -0.521 139 HG12 ILE 18 HG12 ILE 18 -6.290 -22.474 1.746 140 HG13 ILE 18 HG13 ILE 18 -7.084 -21.247 0.774 141 HG21 ILE 18 HG21 ILE 18 -7.818 -23.179 -2.166 142 HG22 ILE 18 HG22 ILE 18 -9.027 -22.859 -0.912 143 HG23 ILE 18 HG23 ILE 18 -7.838 -21.609 -1.381 144 HD11 ILE 18 HD11 ILE 18 -8.250 -21.702 2.824 145 HD12 ILE 18 HD12 ILE 18 -9.272 -22.111 1.421 146 HD13 ILE 18 HD13 ILE 18 -8.485 -23.399 2.376 147 H ILE 19 H ILE 19 -4.877 -25.555 -0.448 148 HA ILE 19 HA ILE 19 -5.624 -26.633 -3.123 149 HB ILE 19 HB ILE 19 -3.547 -25.527 -3.940 150 HG12 ILE 19 HG12 ILE 19 -3.410 -24.460 -1.101 151 HG13 ILE 19 HG13 ILE 19 -2.171 -25.254 -2.050 152 HG21 ILE 19 HG21 ILE 19 -5.857 -24.536 -4.175 153 HG22 ILE 19 HG22 ILE 19 -5.507 -23.497 -2.786 154 HG23 ILE 19 HG23 ILE 19 -4.545 -23.369 -4.260 155 HD11 ILE 19 HD11 ILE 19 -2.145 -23.170 -3.517 156 HD12 ILE 19 HD12 ILE 19 -3.236 -22.420 -2.322 157 HD13 ILE 19 HD13 ILE 19 -1.618 -22.932 -1.834 158 H VAL 20 H VAL 20 -5.007 -28.014 -0.457 159 HA VAL 20 HA VAL 20 -2.536 -29.353 -0.611 160 HB VAL 20 HB VAL 20 -3.754 -31.209 0.625 161 HG11 VAL 20 HG11 VAL 20 -2.538 -29.406 1.730 162 HG12 VAL 20 HG12 VAL 20 -3.988 -28.375 1.674 163 HG13 VAL 20 HG13 VAL 20 -3.975 -29.859 2.661 164 HG21 VAL 20 HG21 VAL 20 -6.076 -30.863 -0.203 165 HG22 VAL 20 HG22 VAL 20 -5.969 -30.760 1.552 166 HG23 VAL 20 HG23 VAL 20 -6.129 -29.276 0.602 167 H ASP 21 H ASP 21 -5.549 -29.935 -2.375 168 HA ASP 21 HA ASP 21 -4.672 -32.536 -3.393 169 HB2 ASP 21 HB2 ASP 21 -6.974 -32.069 -2.542 170 HB3 ASP 21 HB3 ASP 21 -7.215 -30.937 -3.872 171 H ALA 22 H ALA 22 -3.763 -29.530 -4.325 172 HA ALA 22 HA ALA 22 -4.007 -30.030 -7.260 173 HB1 ALA 22 HB1 ALA 22 -5.687 -28.390 -6.602 174 HB2 ALA 22 HB2 ALA 22 -4.488 -27.477 -5.662 175 HB3 ALA 22 HB3 ALA 22 -4.360 -27.552 -7.429 176 H GLU 23 H GLU 23 -2.199 -29.574 -8.435 177 HA GLU 23 HA GLU 23 0.173 -28.403 -7.065 178 HB2 GLU 23 HB2 GLU 23 1.529 -30.253 -7.846 179 HB3 GLU 23 HB3 GLU 23 0.212 -30.838 -6.836 180 HG2 GLU 23 HG2 GLU 23 -1.059 -31.522 -8.862 181 HG3 GLU 23 HG3 GLU 23 0.240 -30.917 -9.890 182 H ASP 24 H ASP 24 -1.877 -27.854 -9.520 183 HA ASP 24 HA ASP 24 0.207 -26.691 -11.293 184 HB2 ASP 24 HB2 ASP 24 -0.599 -28.789 -12.331 185 HB3 ASP 24 HB3 ASP 24 -2.274 -28.262 -12.129 186 H LYS 25 H LYS 25 -0.487 -24.703 -12.230 187 HA LYS 25 HA LYS 25 -2.049 -23.103 -10.599 188 HB2 LYS 25 HB2 LYS 25 -1.824 -21.363 -12.161 189 HB3 LYS 25 HB3 LYS 25 -0.324 -22.268 -12.205 190 HG2 LYS 25 HG2 LYS 25 -2.569 -22.523 -14.260 191 HG3 LYS 25 HG3 LYS 25 -1.230 -21.406 -14.416 192 HD2 LYS 25 HD2 LYS 25 0.369 -23.097 -14.785 193 HD3 LYS 25 HD3 LYS 25 -0.652 -24.351 -14.098 194 HE2 LYS 25 HE2 LYS 25 -2.242 -23.399 -16.150 195 HE3 LYS 25 HE3 LYS 25 -0.634 -23.265 -16.857 196 HZ1 LYS 25 HZ1 LYS 25 -1.524 -25.742 -15.506 197 HZ2 LYS 25 HZ2 LYS 25 -1.959 -25.462 -17.047 198 HZ3 LYS 25 HZ3 LYS 25 -0.351 -25.583 -16.644 199 H GLU 26 H GLU 26 -3.260 -25.112 -13.306 200 HA GLU 26 HA GLU 26 -5.779 -23.677 -13.521 201 HB2 GLU 26 HB2 GLU 26 -4.812 -26.447 -14.375 202 HB3 GLU 26 HB3 GLU 26 -6.441 -25.862 -14.695 203 HG2 GLU 26 HG2 GLU 26 -5.598 -24.000 -16.029 204 HG3 GLU 26 HG3 GLU 26 -3.943 -24.373 -15.583 205 H GLU 27 H GLU 27 -4.593 -26.552 -11.753 206 HA GLU 27 HA GLU 27 -7.165 -27.243 -10.631 207 HB2 GLU 27 HB2 GLU 27 -4.334 -27.985 -9.767 208 HB3 GLU 27 HB3 GLU 27 -5.816 -28.759 -9.203 209 HG2 GLU 27 HG2 GLU 27 -4.784 -28.740 -12.074 210 HG3 GLU 27 HG3 GLU 27 -4.649 -30.075 -10.938 211 H ARG 28 H ARG 28 -4.353 -25.290 -9.555 212 HA ARG 28 HA ARG 28 -5.488 -24.796 -6.933 213 HB2 ARG 28 HB2 ARG 28 -3.224 -23.417 -8.452 214 HB3 ARG 28 HB3 ARG 28 -3.713 -23.036 -6.785 215 HG2 ARG 28 HG2 ARG 28 -3.447 -25.455 -6.207 216 HG3 ARG 28 HG3 ARG 28 -2.726 -25.744 -7.789 217 HD2 ARG 28 HD2 ARG 28 -0.798 -24.422 -7.243 218 HD3 ARG 28 HD3 ARG 28 -1.607 -23.746 -5.811 219 HE ARG 28 HE ARG 28 -1.351 -26.680 -5.874 220 HH11 ARG 28 HH11 ARG 28 0.219 -23.739 -4.641 221 HH12 ARG 28 HH12 ARG 28 0.597 -24.477 -3.098 222 HH21 ARG 28 HH21 ARG 28 -0.865 -27.585 -3.938 223 HH22 ARG 28 HH22 ARG 28 0.109 -26.733 -2.748 224 H ALA 29 H ALA 29 -5.905 -23.204 -10.077 225 HA ALA 29 HA ALA 29 -7.238 -20.880 -9.039 226 HB1 ALA 29 HB1 ALA 29 -6.517 -21.069 -11.421 227 HB2 ALA 29 HB2 ALA 29 -7.755 -22.320 -11.685 228 HB3 ALA 29 HB3 ALA 29 -8.235 -20.677 -11.260 229 H MET 30 H MET 30 -8.351 -24.240 -9.845 230 HA MET 30 HA MET 30 -11.086 -23.709 -9.124 231 HB2 MET 30 HB2 MET 30 -9.584 -26.345 -9.204 232 HB3 MET 30 HB3 MET 30 -11.325 -26.154 -9.034 233 HG2 MET 30 HG2 MET 30 -9.671 -25.264 -11.429 234 HG3 MET 30 HG3 MET 30 -10.679 -26.694 -11.322 235 HE1 MET 30 HE1 MET 30 -10.341 -23.072 -12.139 236 HE2 MET 30 HE2 MET 30 -11.985 -22.462 -12.406 237 HE3 MET 30 HE3 MET 30 -11.350 -22.562 -10.771 238 H GLY 31 H GLY 31 -8.314 -24.927 -7.167 239 HA2 GLY 31 HA2 GLY 31 -9.729 -25.417 -4.782 240 HA3 GLY 31 HA3 GLY 31 -8.051 -24.850 -4.872 241 H TRP 32 H TRP 32 -8.125 -22.344 -5.813 242 HA TRP 32 HA TRP 32 -9.045 -20.674 -3.798 243 HB2 TRP 32 HB2 TRP 32 -8.173 -20.288 -6.647 244 HB3 TRP 32 HB3 TRP 32 -9.038 -18.974 -5.882 245 HD1 TRP 32 HD1 TRP 32 -5.666 -20.646 -5.835 246 HE1 TRP 32 HE1 TRP 32 -4.051 -19.232 -4.443 247 HE3 TRP 32 HE3 TRP 32 -9.040 -17.439 -3.704 248 HZ2 TRP 32 HZ2 TRP 32 -4.207 -17.007 -2.593 249 HZ3 TRP 32 HZ3 TRP 32 -8.280 -15.719 -2.085 250 HH2 TRP 32 HH2 TRP 32 -5.868 -15.474 -1.554 251 H TYR 33 H TYR 33 -10.566 -21.334 -7.018 252 HA TYR 33 HA TYR 33 -12.720 -19.610 -6.804 253 HB2 TYR 33 HB2 TYR 33 -12.105 -20.745 -8.882 254 HB3 TYR 33 HB3 TYR 33 -12.545 -22.309 -8.202 255 HD1 TYR 33 HD1 TYR 33 -14.935 -22.938 -7.845 256 HD2 TYR 33 HD2 TYR 33 -13.817 -19.171 -9.611 257 HE1 TYR 33 HE1 TYR 33 -17.279 -22.569 -8.522 258 HE2 TYR 33 HE2 TYR 33 -16.109 -18.890 -10.470 259 HH TYR 33 HH TYR 33 -18.205 -19.769 -10.624 260 H TYR 34 H TYR 34 -12.645 -23.107 -5.767 261 HA TYR 34 HA TYR 34 -15.470 -22.995 -5.246 262 HB2 TYR 34 HB2 TYR 34 -13.342 -25.077 -4.697 263 HB3 TYR 34 HB3 TYR 34 -14.988 -25.252 -4.098 264 HD1 TYR 34 HD2 TYR 34 -16.927 -24.794 -5.871 265 HD2 TYR 34 HD1 TYR 34 -12.914 -26.029 -6.861 266 HE1 TYR 34 HE2 TYR 34 -17.721 -25.577 -8.074 267 HE2 TYR 34 HE1 TYR 34 -13.698 -26.805 -9.080 268 HH TYR 34 HH TYR 34 -17.135 -26.554 -10.106 269 H TYR 35 H TYR 35 -12.565 -22.710 -3.053 270 HA TYR 35 HA TYR 35 -14.336 -22.617 -0.762 271 HB2 TYR 35 HB2 TYR 35 -12.551 -22.530 0.522 272 HB3 TYR 35 HB3 TYR 35 -11.662 -22.963 -0.920 273 HD1 TYR 35 HD1 TYR 35 -10.337 -21.242 -2.111 274 HD2 TYR 35 HD2 TYR 35 -12.435 -20.282 1.522 275 HE1 TYR 35 HE1 TYR 35 -8.942 -19.223 -1.863 276 HE2 TYR 35 HE2 TYR 35 -11.084 -18.235 1.776 277 HH TYR 35 HH TYR 35 -9.393 -16.919 0.892 278 H LEU 36 H LEU 36 -12.980 -20.118 -2.968 279 HA LEU 36 HA LEU 36 -13.818 -17.882 -1.448 280 HB2 LEU 36 HB2 LEU 36 -12.196 -17.704 -3.248 281 HB3 LEU 36 HB3 LEU 36 -13.387 -18.246 -4.436 282 HG LEU 36 HG LEU 36 -14.705 -16.203 -4.129 283 HD11 LEU 36 HD11 LEU 36 -14.266 -15.638 -1.779 284 HD12 LEU 36 HD12 LEU 36 -12.543 -15.367 -2.141 285 HD13 LEU 36 HD13 LEU 36 -13.785 -14.292 -2.813 286 HD21 LEU 36 HD21 LEU 36 -12.821 -16.320 -5.760 287 HD22 LEU 36 HD22 LEU 36 -13.154 -14.685 -5.195 288 HD23 LEU 36 HD23 LEU 36 -11.752 -15.575 -4.556 289 H ASP 37 H ASP 37 -15.466 -19.510 -4.259 290 HA ASP 37 HA ASP 37 -17.792 -17.911 -4.205 291 HB2 ASP 37 HB2 ASP 37 -17.224 -19.403 -6.074 292 HB3 ASP 37 HB3 ASP 37 -17.454 -20.816 -5.042 293 H ASP 38 H ASP 38 -17.072 -20.980 -2.476 294 HA ASP 38 HA ASP 38 -19.587 -21.212 -1.159 295 HB2 ASP 38 HB2 ASP 38 -17.967 -23.040 -1.298 296 HB3 ASP 38 HB3 ASP 38 -16.827 -22.140 -0.292 297 H THR 39 H THR 39 -16.884 -19.051 -0.482 298 HA THR 39 HA THR 39 -17.770 -18.527 2.285 299 HB THR 39 HB THR 39 -15.479 -17.383 0.631 300 HG1 THR 39 HG1 THR 39 -15.118 -19.479 1.070 301 HG21 THR 39 HG21 THR 39 -14.613 -16.712 2.945 302 HG22 THR 39 HG22 THR 39 -15.965 -15.756 2.320 303 HG23 THR 39 HG23 THR 39 -16.262 -16.995 3.547 304 H LEU 40 H LEU 40 -17.767 -16.964 -0.944 305 HA LEU 40 HA LEU 40 -18.393 -14.346 -0.136 306 HB2 LEU 40 HB2 LEU 40 -19.137 -15.862 -2.658 307 HB3 LEU 40 HB3 LEU 40 -19.487 -14.152 -2.433 308 HG LEU 40 HG LEU 40 -16.707 -15.358 -2.484 309 HD11 LEU 40 HD11 LEU 40 -16.509 -14.346 -4.693 310 HD12 LEU 40 HD12 LEU 40 -17.900 -15.439 -4.656 311 HD13 LEU 40 HD13 LEU 40 -18.156 -13.687 -4.571 312 HD21 LEU 40 HD21 LEU 40 -15.964 -12.982 -2.789 313 HD22 LEU 40 HD22 LEU 40 -17.578 -12.488 -2.237 314 HD23 LEU 40 HD23 LEU 40 -16.485 -13.435 -1.173 315 H GLU 41 H GLU 41 -20.037 -13.594 0.986 316 HA GLU 41 HA GLU 41 -22.637 -14.823 1.156 317 HB2 GLU 41 HB2 GLU 41 -21.420 -13.635 2.989 318 HB3 GLU 41 HB3 GLU 41 -21.528 -12.129 2.069 319 HG2 GLU 41 HG2 GLU 41 -23.141 -12.118 3.786 320 HG3 GLU 41 HG3 GLU 41 -23.990 -12.234 2.253 321 H PHE 42 H PHE 42 -22.304 -14.670 -1.431 322 HA PHE 42 HA PHE 42 -23.027 -12.155 -2.642 323 HB2 PHE 42 HB2 PHE 42 -23.085 -13.334 -4.722 324 HB3 PHE 42 HB3 PHE 42 -21.678 -13.831 -3.821 325 HD1 PHE 42 HD1 PHE 42 -25.101 -14.878 -4.912 326 HD2 PHE 42 HD2 PHE 42 -21.313 -16.171 -3.296 327 HE1 PHE 42 HE1 PHE 42 -25.753 -17.242 -5.257 328 HE2 PHE 42 HE2 PHE 42 -21.970 -18.525 -3.644 329 HZ PHE 42 HZ PHE 42 -24.193 -19.075 -4.620 330 HA PRO 43 HA PRO 43 -24.255 -11.433 -4.546 331 HB2 PRO 43 HB2 PRO 43 -26.213 -9.582 -4.905 332 HB3 PRO 43 HB3 PRO 43 -26.243 -11.180 -5.713 333 HG2 PRO 43 HG2 PRO 43 -27.693 -10.358 -3.181 334 HG3 PRO 43 HG3 PRO 43 -28.354 -11.216 -4.609 335 HD2 PRO 43 HD2 PRO 43 -27.520 -12.535 -2.354 336 HD3 PRO 43 HD3 PRO 43 -27.326 -13.241 -3.984 337 H PHE 44 H PHE 44 -23.365 -9.307 -4.233 338 HA PHE 44 HA PHE 44 -23.865 -7.892 -1.703 339 HB2 PHE 44 HB2 PHE 44 -21.595 -7.881 -0.989 340 HB3 PHE 44 HB3 PHE 44 -22.142 -9.536 -1.101 341 HD1 PHE 44 HD1 PHE 44 -21.319 -10.999 -3.043 342 HD2 PHE 44 HD2 PHE 44 -19.622 -7.152 -2.121 343 HE1 PHE 44 HE1 PHE 44 -19.265 -11.612 -4.279 344 HE2 PHE 44 HE2 PHE 44 -17.595 -7.740 -3.413 345 HZ PHE 44 HZ PHE 44 -17.397 -9.981 -4.475 346 H MET 45 H MET 45 -21.850 -5.946 -1.936 347 HA MET 45 HA MET 45 -22.069 -5.013 -4.739 348 HB2 MET 45 HB2 MET 45 -22.881 -2.923 -4.241 349 HB3 MET 45 HB3 MET 45 -23.908 -3.990 -3.314 350 HG2 MET 45 HG2 MET 45 -23.137 -3.210 -1.288 351 HG3 MET 45 HG3 MET 45 -21.522 -2.861 -1.877 352 HE1 MET 45 HE1 MET 45 -20.729 -0.813 -3.184 353 HE2 MET 45 HE2 MET 45 -21.953 -0.896 -4.461 354 HE3 MET 45 HE3 MET 45 -21.726 0.604 -3.542 355 H GLY 46 H GLY 46 -20.653 -3.230 -5.256 356 HA2 GLY 46 HA2 GLY 46 -18.262 -2.856 -3.553 357 HA3 GLY 46 HA3 GLY 46 -18.046 -3.881 -4.985 358 H LYS 47 H LYS 47 -16.465 -1.935 -4.998 359 HA LYS 47 HA LYS 47 -17.608 -0.068 -7.043 360 HB2 LYS 47 HB2 LYS 47 -16.658 0.954 -4.825 361 HB3 LYS 47 HB3 LYS 47 -15.085 0.426 -5.405 362 HG2 LYS 47 HG2 LYS 47 -15.210 2.650 -6.158 363 HG3 LYS 47 HG3 LYS 47 -15.677 1.728 -7.588 364 HD2 LYS 47 HD2 LYS 47 -17.246 3.489 -7.463 365 HD3 LYS 47 HD3 LYS 47 -18.111 2.074 -6.869 366 HE2 LYS 47 HE2 LYS 47 -17.867 2.803 -4.568 367 HE3 LYS 47 HE3 LYS 47 -16.761 4.101 -5.044 368 HZ1 LYS 47 HZ1 LYS 47 -18.545 5.220 -6.142 369 HZ2 LYS 47 HZ2 LYS 47 -19.585 3.981 -5.955 370 HZ3 LYS 47 HZ3 LYS 47 -19.080 4.843 -4.650 371 H TRP 48 H TRP 48 -16.928 -0.617 -9.033 372 HA TRP 48 HA TRP 48 -14.577 -2.371 -9.402 373 HB2 TRP 48 HB2 TRP 48 -16.664 -2.604 -10.795 374 HB3 TRP 48 HB3 TRP 48 -16.329 -1.029 -11.490 375 HD1 TRP 48 HD1 TRP 48 -13.001 -2.244 -11.428 376 HE1 TRP 48 HE1 TRP 48 -12.277 -3.509 -13.456 377 HE3 TRP 48 HE3 TRP 48 -17.630 -3.178 -13.448 378 HZ2 TRP 48 HZ2 TRP 48 -13.519 -4.933 -15.655 379 HZ3 TRP 48 HZ3 TRP 48 -17.798 -4.534 -15.524 380 HH2 TRP 48 HH2 TRP 48 -15.754 -5.421 -16.620 381 H LYS 49 H LYS 49 -12.714 -1.371 -9.028 382 HA LYS 49 HA LYS 49 -12.304 1.509 -9.409 383 HB2 LYS 49 HB2 LYS 49 -10.339 -0.708 -8.638 384 HB3 LYS 49 HB3 LYS 49 -10.112 1.017 -8.389 385 HG2 LYS 49 HG2 LYS 49 -12.181 -0.753 -6.988 386 HG3 LYS 49 HG3 LYS 49 -10.632 -0.290 -6.327 387 HD2 LYS 49 HD2 LYS 49 -12.813 1.719 -7.040 388 HD3 LYS 49 HD3 LYS 49 -12.575 0.989 -5.442 389 HE2 LYS 49 HE2 LYS 49 -10.116 1.803 -5.633 390 HE3 LYS 49 HE3 LYS 49 -10.688 2.846 -6.941 391 HZ1 LYS 49 HZ1 LYS 49 -11.768 2.886 -4.175 392 HZ2 LYS 49 HZ2 LYS 49 -10.647 3.918 -4.743 393 HZ3 LYS 49 HZ3 LYS 49 -12.143 3.953 -5.378 394 H LYS 50 H LYS 50 -12.974 0.905 -11.817 395 HA LYS 50 HA LYS 50 -11.287 -0.828 -13.365 396 HB2 LYS 50 HB2 LYS 50 -13.652 -0.301 -13.902 397 HB3 LYS 50 HB3 LYS 50 -13.202 1.366 -14.291 398 HG2 LYS 50 HG2 LYS 50 -11.786 0.611 -16.137 399 HG3 LYS 50 HG3 LYS 50 -12.038 -1.084 -15.702 400 HD2 LYS 50 HD2 LYS 50 -14.246 0.815 -16.617 401 HD3 LYS 50 HD3 LYS 50 -13.360 -0.296 -17.674 402 HE2 LYS 50 HE2 LYS 50 -14.108 -2.214 -16.236 403 HE3 LYS 50 HE3 LYS 50 -15.097 -1.097 -15.292 404 HZ1 LYS 50 HZ1 LYS 50 -16.397 -2.199 -16.987 405 HZ2 LYS 50 HZ2 LYS 50 -16.337 -0.603 -17.337 406 HZ3 LYS 50 HZ3 LYS 50 -15.427 -1.665 -18.183 407 H LYS 51 H LYS 51 -9.390 -0.399 -14.489 408 HA LYS 51 HA LYS 51 -8.117 2.172 -14.015 409 HB2 LYS 51 HB2 LYS 51 -7.032 -0.165 -13.924 410 HB3 LYS 51 HB3 LYS 51 -6.961 -0.076 -15.690 411 HG2 LYS 51 HG2 LYS 51 -5.664 2.087 -15.459 412 HG3 LYS 51 HG3 LYS 51 -5.760 1.918 -13.695 413 HD2 LYS 51 HD2 LYS 51 -4.532 -0.239 -13.840 414 HD3 LYS 51 HD3 LYS 51 -4.419 -0.052 -15.605 415 HE2 LYS 51 HE2 LYS 51 -3.154 2.062 -15.302 416 HE3 LYS 51 HE3 LYS 51 -3.292 1.903 -13.546 417 HZ1 LYS 51 HZ1 LYS 51 -1.851 0.009 -15.315 418 HZ2 LYS 51 HZ2 LYS 51 -1.156 1.110 -14.337 419 HZ3 LYS 51 HZ3 LYS 51 -1.982 -0.134 -13.691 420 H SER 52 H SER 52 -10.235 2.893 -15.320 421 HA SER 52 HA SER 52 -11.235 3.731 -17.171 422 HB2 SER 52 HB2 SER 52 -8.448 4.858 -17.551 423 HB3 SER 52 HB3 SER 52 -9.984 5.578 -18.102 424 HG SER 52 HG SER 52 -9.015 5.126 -15.489 425 H ARG 53 H ARG 53 -8.489 3.891 -19.319 426 HA ARG 53 HA ARG 53 -9.356 1.423 -20.745 427 HB2 ARG 53 HB2 ARG 53 -8.773 4.126 -22.054 428 HB3 ARG 53 HB3 ARG 53 -9.101 2.605 -22.874 429 HG2 ARG 53 HG2 ARG 53 -11.162 3.517 -23.042 430 HG3 ARG 53 HG3 ARG 53 -11.373 2.655 -21.516 431 HD2 ARG 53 HD2 ARG 53 -10.842 4.831 -20.318 432 HD3 ARG 53 HD3 ARG 53 -10.742 5.620 -21.901 433 HE ARG 53 HE ARG 53 -13.226 4.261 -21.703 434 HH11 ARG 53 HH21 ARG 53 -11.605 7.113 -20.335 435 HH12 ARG 53 HH22 ARG 53 -13.069 7.942 -19.967 436 HH21 ARG 53 HH12 ARG 53 -15.178 5.378 -21.229 437 HH22 ARG 53 HH11 ARG 53 -15.143 6.937 -20.500 438 H LYS 54 H LYS 54 -7.312 1.586 -18.856 439 HA LYS 54 HA LYS 54 -5.133 1.335 -18.435 440 HB2 LYS 54 HB2 LYS 54 -4.821 0.449 -21.332 441 HB3 LYS 54 HB3 LYS 54 -3.640 0.247 -20.036 442 HG2 LYS 54 HG2 LYS 54 -5.266 -1.156 -18.770 443 HG3 LYS 54 HG3 LYS 54 -6.422 -0.996 -20.108 444 HD2 LYS 54 HD2 LYS 54 -4.775 -2.075 -21.648 445 HD3 LYS 54 HD3 LYS 54 -3.633 -2.212 -20.308 446 HE2 LYS 54 HE2 LYS 54 -4.659 -4.349 -20.574 447 HE3 LYS 54 HE3 LYS 54 -5.264 -3.648 -19.073 448 HZ1 LYS 54 HZ1 LYS 54 -7.022 -4.668 -20.388 449 HZ2 LYS 54 HZ2 LYS 54 -7.311 -3.071 -20.254 450 HZ3 LYS 54 HZ3 LYS 54 -6.729 -3.691 -21.654 451 H THR 55 H THR 55 -5.959 3.789 -18.625 452 HA THR 55 HA THR 55 -3.984 5.357 -20.185 453 HB THR 55 HB THR 55 -6.017 7.058 -19.993 454 HG1 THR 55 HG1 THR 55 -7.943 6.141 -19.811 455 HG21 THR 55 HG21 THR 55 -5.157 6.208 -22.109 456 HG22 THR 55 HG22 THR 55 -6.020 4.676 -21.882 457 HG23 THR 55 HG23 THR 55 -6.928 6.185 -22.115 458 H SER 56 H SER 56 -3.438 4.316 -17.577 459 HA SER 56 HA SER 56 -2.699 4.896 -15.525 460 HB2 SER 56 HB2 SER 56 -2.019 7.490 -16.952 461 HB3 SER 56 HB3 SER 56 -1.186 6.789 -15.554 462 HG SER 56 HG SER 56 -0.121 6.339 -17.539 463 H THR 57 H THR 57 -5.522 5.361 -15.755 464 HA THR 57 HA THR 57 -5.992 7.410 -13.688 465 HB THR 57 HB THR 57 -7.516 7.234 -16.324 466 HG1 THR 57 HG1 THR 57 -5.568 8.146 -16.759 467 HG21 THR 57 HG21 THR 57 -7.707 9.223 -14.015 468 HG22 THR 57 HG22 THR 57 -8.493 9.431 -15.597 469 HG23 THR 57 HG23 THR 57 -8.962 8.086 -14.559 470 H ILE 58 H ILE 58 -8.063 6.922 -12.576 471 HA ILE 58 HA ILE 58 -9.116 4.192 -13.129 472 HB ILE 58 HB ILE 58 -8.352 5.425 -10.472 473 HG12 ILE 58 HG12 ILE 58 -7.526 2.957 -12.056 474 HG13 ILE 58 HG13 ILE 58 -6.531 4.347 -11.627 475 HG21 ILE 58 HG21 ILE 58 -9.373 3.469 -9.359 476 HG22 ILE 58 HG22 ILE 58 -10.589 4.413 -10.191 477 HG23 ILE 58 HG23 ILE 58 -10.002 2.908 -10.927 478 HD11 ILE 58 HD11 ILE 58 -6.710 3.639 -9.215 479 HD12 ILE 58 HD12 ILE 58 -7.546 2.163 -9.777 480 HD13 ILE 58 HD13 ILE 58 -5.882 2.479 -10.285 481 H GLU 59 H GLU 59 -11.225 3.936 -12.954 482 HA GLU 59 HA GLU 59 -13.005 6.267 -12.462 483 HB2 GLU 59 HB2 GLU 59 -13.169 3.980 -14.481 484 HB3 GLU 59 HB3 GLU 59 -14.597 4.878 -13.974 485 HG2 GLU 59 HG2 GLU 59 -12.151 6.218 -15.203 486 HG3 GLU 59 HG3 GLU 59 -13.513 5.625 -16.143 487 H GLU 60 H GLU 60 -14.908 5.642 -11.284 488 HA GLU 60 HA GLU 60 -14.531 3.176 -9.640 489 HB2 GLU 60 HB2 GLU 60 -15.192 6.015 -8.744 490 HB3 GLU 60 HB3 GLU 60 -15.200 4.581 -7.711 491 HG2 GLU 60 HG2 GLU 60 -12.772 4.228 -8.240 492 HG3 GLU 60 HG3 GLU 60 -12.773 5.740 -9.155 493 H LYS 61 H LYS 61 -16.079 2.020 -10.743 494 HA LYS 61 HA LYS 61 -18.758 3.261 -11.187 495 HB2 LYS 61 HB2 LYS 61 -17.695 2.195 -13.104 496 HB3 LYS 61 HB3 LYS 61 -17.477 0.693 -12.201 497 HG2 LYS 61 HG2 LYS 61 -19.891 0.365 -12.051 498 HG3 LYS 61 HG3 LYS 61 -20.195 1.916 -12.821 499 HD2 LYS 61 HD2 LYS 61 -18.571 -0.286 -14.176 500 HD3 LYS 61 HD3 LYS 61 -20.318 -0.285 -14.251 501 HE2 LYS 61 HE2 LYS 61 -18.516 1.964 -15.252 502 HE3 LYS 61 HE3 LYS 61 -19.289 0.733 -16.256 503 HZ1 LYS 61 HZ1 LYS 61 -20.750 2.734 -14.637 504 HZ2 LYS 61 HZ2 LYS 61 -20.558 2.783 -16.264 505 HZ3 LYS 61 HZ3 LYS 61 -21.458 1.602 -15.564 506 H THR 62 H THR 62 -20.226 2.971 -9.536 507 HA THR 62 HA THR 62 -19.854 0.985 -7.492 508 HB THR 62 HB THR 62 -22.400 2.508 -8.188 509 HG1 THR 62 HG1 THR 62 -21.538 4.255 -7.340 510 HG21 THR 62 HG21 THR 62 -21.193 1.601 -5.531 511 HG22 THR 62 HG22 THR 62 -22.735 2.464 -5.737 512 HG23 THR 62 HG23 THR 62 -22.557 0.814 -6.355 513 H VAL 63 H VAL 63 -20.593 -1.071 -7.402 514 HA VAL 63 HA VAL 63 -22.408 -2.047 -9.571 515 HB VAL 63 HB VAL 63 -20.894 -3.958 -9.821 516 HG11 VAL 63 HG11 VAL 63 -20.933 -2.107 -11.477 517 HG12 VAL 63 HG12 VAL 63 -19.552 -1.368 -10.637 518 HG13 VAL 63 HG13 VAL 63 -19.379 -2.950 -11.413 519 HG21 VAL 63 HG21 VAL 63 -19.507 -3.759 -7.775 520 HG22 VAL 63 HG22 VAL 63 -18.526 -3.854 -9.241 521 HG23 VAL 63 HG23 VAL 63 -18.760 -2.289 -8.441 522 H GLU 64 H GLU 64 -23.377 -4.052 -9.233 523 HA GLU 64 HA GLU 64 -23.486 -5.030 -6.408 524 HB2 GLU 64 HB2 GLU 64 -25.660 -4.269 -7.246 525 HB3 GLU 64 HB3 GLU 64 -25.495 -5.274 -8.691 526 HG2 GLU 64 HG2 GLU 64 -25.558 -7.312 -7.306 527 HG3 GLU 64 HG3 GLU 64 -25.569 -6.334 -5.835 528 H VAL 65 H VAL 65 -22.675 -7.086 -6.157 529 HA VAL 65 HA VAL 65 -21.515 -8.400 -8.574 530 HB VAL 65 HB VAL 65 -20.602 -8.632 -5.680 531 HG11 VAL 65 HG11 VAL 65 -19.957 -10.513 -7.156 532 HG12 VAL 65 HG12 VAL 65 -19.325 -9.362 -8.357 533 HG13 VAL 65 HG13 VAL 65 -18.538 -9.528 -6.774 534 HG21 VAL 65 HG21 VAL 65 -19.504 -6.831 -7.890 535 HG22 VAL 65 HG22 VAL 65 -20.230 -6.298 -6.356 536 HG23 VAL 65 HG23 VAL 65 -18.696 -7.164 -6.342 537 H LEU 66 H LEU 66 -22.680 -10.101 -9.201 538 HA LEU 66 HA LEU 66 -24.887 -11.000 -7.540 539 HB2 LEU 66 HB2 LEU 66 -23.918 -11.876 -10.297 540 HB3 LEU 66 HB3 LEU 66 -25.335 -12.522 -9.505 541 HG LEU 66 HG LEU 66 -26.101 -10.995 -11.088 542 HD11 LEU 66 HD11 LEU 66 -27.268 -10.922 -8.888 543 HD12 LEU 66 HD12 LEU 66 -26.294 -9.500 -8.443 544 HD13 LEU 66 HD13 LEU 66 -27.411 -9.419 -9.814 545 HD21 LEU 66 HD21 LEU 66 -24.417 -8.746 -9.927 546 HD22 LEU 66 HD22 LEU 66 -24.022 -9.674 -11.398 547 HD23 LEU 66 HD23 LEU 66 -25.493 -8.700 -11.328 548 H GLY 67 H GLY 67 -21.676 -12.271 -8.319 549 HA2 GLY 67 HA2 GLY 67 -21.300 -14.121 -6.393 550 HA3 GLY 67 HA3 GLY 67 -22.276 -15.002 -7.594 551 H MET 68 H MET 68 -19.929 -16.062 -7.440 552 HA MET 68 HA MET 68 -17.891 -14.898 -9.152 553 HB2 MET 68 HB2 MET 68 -18.355 -17.790 -8.332 554 HB3 MET 68 HB3 MET 68 -17.009 -17.184 -9.292 555 HG2 MET 68 HG2 MET 68 -16.811 -15.458 -7.222 556 HG3 MET 68 HG3 MET 68 -17.577 -16.808 -6.387 557 HE1 MET 68 HE1 MET 68 -13.402 -16.801 -8.379 558 HE2 MET 68 HE2 MET 68 -14.873 -16.712 -9.353 559 HE3 MET 68 HE3 MET 68 -14.476 -15.392 -8.230 560 H ALA 69 H ALA 69 -17.368 -15.517 -11.262 561 HA ALA 69 HA ALA 69 -19.582 -15.976 -13.105 562 HB1 ALA 69 HB1 ALA 69 -17.848 -15.733 -14.789 563 HB2 ALA 69 HB2 ALA 69 -17.496 -14.556 -13.528 564 HB3 ALA 69 HB3 ALA 69 -16.583 -16.087 -13.604 565 HA PRO 70 HA PRO 70 -19.305 -20.445 -13.518 566 HB2 PRO 70 HB2 PRO 70 -18.081 -20.108 -16.264 567 HB3 PRO 70 HB3 PRO 70 -19.390 -21.217 -15.745 568 HG2 PRO 70 HG2 PRO 70 -20.005 -18.931 -17.056 569 HG3 PRO 70 HG3 PRO 70 -20.964 -19.411 -15.615 570 HD2 PRO 70 HD2 PRO 70 -18.702 -17.419 -15.796 571 HD3 PRO 70 HD3 PRO 70 -20.275 -17.249 -14.953 572 H ASP 71 H ASP 71 -17.803 -22.040 -13.013 573 HA ASP 71 HA ASP 71 -15.167 -21.357 -12.296 574 HB2 ASP 71 HB2 ASP 71 -14.831 -23.615 -11.784 575 HB3 ASP 71 HB3 ASP 71 -16.532 -23.330 -11.458 576 H ASP 72 H ASP 72 -16.498 -22.503 -15.372 577 HA ASP 72 HA ASP 72 -14.095 -23.284 -16.643 578 HB2 ASP 72 HB2 ASP 72 -16.343 -23.810 -17.488 579 HB3 ASP 72 HB3 ASP 72 -16.629 -22.100 -17.832 580 H GLU 73 H GLU 73 -15.447 -20.046 -16.066 581 HA GLU 73 HA GLU 73 -13.553 -18.696 -17.882 582 HB2 GLU 73 HB2 GLU 73 -15.350 -17.621 -15.650 583 HB3 GLU 73 HB3 GLU 73 -14.385 -16.639 -16.737 584 HG2 GLU 73 HG2 GLU 73 -16.700 -18.444 -17.564 585 HG3 GLU 73 HG3 GLU 73 -16.768 -16.700 -17.368 586 H CYS 74 H CYS 74 -13.987 -19.456 -14.439 587 HA CYS 74 HA CYS 74 -11.779 -17.841 -13.600 588 HB2 CYS 74 HB2 CYS 74 -13.455 -19.825 -12.024 589 HB3 CYS 74 HB3 CYS 74 -12.392 -18.569 -11.359 590 HG CYS 74 HG CYS 74 -15.163 -18.305 -13.149 591 H LEU 75 H LEU 75 -11.060 -20.110 -15.356 592 HA LEU 75 HA LEU 75 -9.452 -21.962 -13.798 593 HB2 LEU 75 HB2 LEU 75 -10.113 -21.494 -16.662 594 HB3 LEU 75 HB3 LEU 75 -8.434 -21.882 -16.432 595 HG LEU 75 HG LEU 75 -9.593 -23.876 -16.933 596 HD11 LEU 75 HD11 LEU 75 -8.901 -25.329 -15.180 597 HD12 LEU 75 HD12 LEU 75 -7.774 -23.960 -15.194 598 HD13 LEU 75 HD13 LEU 75 -9.029 -24.069 -13.945 599 HD21 LEU 75 HD21 LEU 75 -11.852 -23.235 -16.224 600 HD22 LEU 75 HD22 LEU 75 -11.398 -24.826 -15.591 601 HD23 LEU 75 HD23 LEU 75 -11.385 -23.407 -14.525 602 H LYS 76 H LYS 76 -9.120 -18.683 -14.457 603 HA LYS 76 HA LYS 76 -6.155 -18.766 -14.210 604 HB2 LYS 76 HB2 LYS 76 -5.935 -17.197 -16.030 605 HB3 LYS 76 HB3 LYS 76 -6.830 -18.607 -16.585 606 HG2 LYS 76 HG2 LYS 76 -8.983 -17.176 -16.097 607 HG3 LYS 76 HG3 LYS 76 -7.871 -15.814 -15.969 608 HD2 LYS 76 HD2 LYS 76 -8.621 -15.730 -18.198 609 HD3 LYS 76 HD3 LYS 76 -7.020 -16.451 -18.298 610 HE2 LYS 76 HE2 LYS 76 -8.356 -17.750 -19.744 611 HE3 LYS 76 HE3 LYS 76 -8.172 -18.748 -18.304 612 HZ1 LYS 76 HZ1 LYS 76 -10.548 -17.103 -18.991 613 HZ2 LYS 76 HZ2 LYS 76 -10.451 -18.722 -19.099 614 HZ3 LYS 76 HZ3 LYS 76 -10.437 -18.010 -17.628 615 H ASP 77 H ASP 77 -9.202 -16.993 -13.578 616 HA ASP 77 HA ASP 77 -7.820 -15.259 -11.630 617 HB2 ASP 77 HB2 ASP 77 -7.564 -14.018 -13.744 618 HB3 ASP 77 HB3 ASP 77 -9.271 -14.241 -14.115 619 H MET 78 H MET 78 -9.434 -14.297 -10.189 620 HA MET 78 HA MET 78 -11.830 -15.974 -9.960 621 HB2 MET 78 HB2 MET 78 -10.722 -13.744 -8.210 622 HB3 MET 78 HB3 MET 78 -12.130 -14.727 -7.825 623 HG2 MET 78 HG2 MET 78 -9.273 -15.736 -8.143 624 HG3 MET 78 HG3 MET 78 -10.135 -15.477 -6.640 625 HE1 MET 78 HE1 MET 78 -8.906 -18.035 -9.026 626 HE2 MET 78 HE2 MET 78 -10.198 -19.236 -9.226 627 HE3 MET 78 HE3 MET 78 -10.320 -17.674 -10.044 628 H TYR 79 H TYR 79 -12.927 -15.288 -11.923 629 HA TYR 79 HA TYR 79 -13.718 -12.504 -12.225 630 HB2 TYR 79 HB2 TYR 79 -14.608 -15.065 -13.594 631 HB3 TYR 79 HB3 TYR 79 -15.205 -13.474 -14.013 632 HD1 TYR 79 HD2 TYR 79 -13.579 -11.710 -14.878 633 HD2 TYR 79 HD1 TYR 79 -12.580 -15.890 -14.528 634 HE1 TYR 79 HE2 TYR 79 -11.782 -11.410 -16.546 635 HE2 TYR 79 HE1 TYR 79 -10.772 -15.603 -16.189 636 HH TYR 79 HH TYR 79 -10.050 -12.444 -17.742 637 H VAL 80 H VAL 80 -15.796 -11.645 -11.928 638 HA VAL 80 HA VAL 80 -17.846 -13.313 -10.548 639 HB VAL 80 HB VAL 80 -18.350 -11.267 -9.206 640 HG11 VAL 80 HG11 VAL 80 -17.171 -13.120 -8.167 641 HG12 VAL 80 HG12 VAL 80 -15.608 -12.505 -8.744 642 HG13 VAL 80 HG13 VAL 80 -16.554 -11.594 -7.548 643 HG21 VAL 80 HG21 VAL 80 -17.134 -9.560 -10.564 644 HG22 VAL 80 HG22 VAL 80 -16.662 -9.537 -8.862 645 HG23 VAL 80 HG23 VAL 80 -15.589 -10.279 -10.060 646 H GLU 81 H GLU 81 -20.000 -12.770 -10.977 647 HA GLU 81 HA GLU 81 -20.489 -11.289 -13.508 648 HB2 GLU 81 HB2 GLU 81 -22.282 -12.857 -11.601 649 HB3 GLU 81 HB3 GLU 81 -22.888 -11.903 -12.968 650 HG2 GLU 81 HG2 GLU 81 -21.441 -13.261 -14.505 651 HG3 GLU 81 HG3 GLU 81 -20.978 -14.268 -13.134 652 H VAL 82 H VAL 82 -21.408 -9.229 -13.514 653 HA VAL 82 HA VAL 82 -21.855 -7.943 -10.891 654 HB VAL 82 HB VAL 82 -19.438 -7.919 -11.468 655 HG11 VAL 82 HG11 VAL 82 -20.237 -6.308 -13.933 656 HG12 VAL 82 HG12 VAL 82 -18.606 -6.521 -13.325 657 HG13 VAL 82 HG13 VAL 82 -19.496 -7.925 -13.917 658 HG21 VAL 82 HG21 VAL 82 -19.037 -5.562 -11.153 659 HG22 VAL 82 HG22 VAL 82 -20.700 -5.187 -11.660 660 HG23 VAL 82 HG23 VAL 82 -20.399 -6.114 -10.162 661 H ALA 83 H ALA 83 -23.308 -6.261 -10.971 662 HA ALA 83 HA ALA 83 -24.445 -5.516 -13.635 663 HB1 ALA 83 HB1 ALA 83 -25.833 -5.792 -10.943 664 HB2 ALA 83 HB2 ALA 83 -26.560 -5.070 -12.395 665 HB3 ALA 83 HB3 ALA 83 -26.097 -6.777 -12.405 666 H ASP 84 H ASP 84 -24.655 -3.395 -14.082 667 HA ASP 84 HA ASP 84 -22.911 -1.617 -12.551 668 HB2 ASP 84 HB2 ASP 84 -22.652 -1.852 -14.954 669 HB3 ASP 84 HB3 ASP 84 -24.334 -1.361 -15.209 670 H ILE 85 H ILE 85 -24.576 -1.725 -10.741 671 HA ILE 85 HA ILE 85 -26.981 -0.208 -10.923 672 HB ILE 85 HB ILE 85 -26.937 -0.070 -8.514 673 HG12 ILE 85 HG12 ILE 85 -24.137 -1.220 -8.610 674 HG13 ILE 85 HG13 ILE 85 -24.534 0.437 -8.166 675 HG21 ILE 85 HG21 ILE 85 -27.583 -2.175 -9.737 676 HG22 ILE 85 HG22 ILE 85 -25.964 -2.821 -9.400 677 HG23 ILE 85 HG23 ILE 85 -27.079 -2.436 -8.071 678 HD11 ILE 85 HD11 ILE 85 -24.125 -0.872 -6.161 679 HD12 ILE 85 HD12 ILE 85 -25.837 -0.405 -6.218 680 HD13 ILE 85 HD13 ILE 85 -25.335 -2.064 -6.623 681 H GLY 86 H GLY 86 -23.720 0.901 -11.088 682 HA2 GLY 86 HA2 GLY 86 -24.274 3.656 -10.285 683 HA3 GLY 86 HA3 GLY 86 -22.782 2.980 -10.958 684 H GLY 87 H GLY 87 -24.967 1.824 -13.124 685 HA2 GLY 87 HA2 GLY 87 -25.292 4.290 -14.748 686 HA3 GLY 87 HA3 GLY 87 -24.192 3.030 -15.318 687 H LYS 88 H LYS 88 -25.058 0.986 -16.002 688 HA LYS 88 HA LYS 88 -27.460 1.237 -17.461 689 HB2 LYS 88 HB2 LYS 88 -26.176 -1.372 -16.546 690 HB3 LYS 88 HB3 LYS 88 -27.340 -1.198 -17.843 691 HG2 LYS 88 HG2 LYS 88 -24.538 -0.004 -17.842 692 HG3 LYS 88 HG3 LYS 88 -25.007 -1.502 -18.624 693 HD2 LYS 88 HD2 LYS 88 -26.156 1.225 -19.328 694 HD3 LYS 88 HD3 LYS 88 -24.810 0.477 -20.164 695 HE2 LYS 88 HE2 LYS 88 -27.581 -0.801 -19.970 696 HE3 LYS 88 HE3 LYS 88 -27.070 0.265 -21.276 697 HZ1 LYS 88 HZ1 LYS 88 -26.732 -1.924 -22.002 698 HZ2 LYS 88 HZ2 LYS 88 -25.242 -1.336 -21.718 699 HZ3 LYS 88 HZ3 LYS 88 -25.927 -2.415 -20.683 700 H ASP 89 H ASP 89 -26.965 -0.138 -14.273 701 HA ASP 89 HA ASP 89 -28.156 -0.915 -12.628 702 HB2 ASP 89 HB2 ASP 89 -29.060 1.352 -12.672 703 HB3 ASP 89 HB3 ASP 89 -30.353 0.834 -13.758 704 H ASP 90 H ASP 90 -29.684 -1.500 -15.690 705 HA ASP 90 HA ASP 90 -31.185 -3.840 -14.612 706 HB2 ASP 90 HB2 ASP 90 -32.438 -1.852 -15.501 707 HB3 ASP 90 HB3 ASP 90 -31.630 -2.104 -17.053 708 H ASP 91 H ASP 91 -28.314 -3.491 -15.758 709 HA ASP 91 HA ASP 91 -28.410 -5.773 -17.661 710 HB2 ASP 91 HB2 ASP 91 -28.164 -3.492 -18.850 711 HB3 ASP 91 HB3 ASP 91 -26.565 -3.438 -18.073 712 H VAL 92 H VAL 92 -26.319 -6.795 -17.896 713 HA VAL 92 HA VAL 92 -24.636 -6.679 -15.458 714 HB VAL 92 HB VAL 92 -26.587 -8.124 -15.098 715 HG11 VAL 92 HG11 VAL 92 -27.055 -8.862 -17.400 716 HG12 VAL 92 HG12 VAL 92 -25.579 -9.853 -17.388 717 HG13 VAL 92 HG13 VAL 92 -26.922 -10.226 -16.290 718 HG21 VAL 92 HG21 VAL 92 -25.492 -10.170 -14.343 719 HG22 VAL 92 HG22 VAL 92 -24.025 -9.742 -15.243 720 HG23 VAL 92 HG23 VAL 92 -24.591 -8.727 -13.893 721 H TYR 93 H TYR 93 -22.646 -7.653 -15.618 722 HA TYR 93 HA TYR 93 -21.520 -8.451 -18.242 723 HB2 TYR 93 HB2 TYR 93 -20.404 -6.310 -16.368 724 HB3 TYR 93 HB3 TYR 93 -19.659 -6.864 -17.854 725 HD1 TYR 93 HD1 TYR 93 -20.535 -6.217 -20.064 726 HD2 TYR 93 HD2 TYR 93 -22.259 -4.709 -16.405 727 HE1 TYR 93 HE1 TYR 93 -21.622 -4.399 -21.335 728 HE2 TYR 93 HE2 TYR 93 -23.374 -2.905 -17.667 729 HH TYR 93 HH TYR 93 -22.911 -2.493 -21.228 730 H THR 94 H THR 94 -18.899 -8.669 -17.418 731 HA THR 94 HA THR 94 -18.857 -10.203 -14.882 732 HB THR 94 HB THR 94 -17.354 -10.892 -17.441 733 HG1 THR 94 HG1 THR 94 -19.540 -11.436 -17.550 734 HG21 THR 94 HG21 THR 94 -16.724 -12.978 -16.250 735 HG22 THR 94 HG22 THR 94 -16.053 -11.549 -15.462 736 HG23 THR 94 HG23 THR 94 -17.474 -12.355 -14.765 737 H ALA 95 H ALA 95 -16.977 -9.813 -13.674 738 HA ALA 95 HA ALA 95 -14.989 -7.866 -14.711 739 HB1 ALA 95 HB1 ALA 95 -16.525 -7.594 -12.088 740 HB2 ALA 95 HB2 ALA 95 -15.034 -6.703 -12.461 741 HB3 ALA 95 HB3 ALA 95 -16.467 -6.438 -13.444 742 H LYS 96 H LYS 96 -13.060 -7.831 -13.414 743 HA LYS 96 HA LYS 96 -12.297 -10.492 -12.389 744 HB2 LYS 96 HB2 LYS 96 -10.561 -7.990 -12.290 745 HB3 LYS 96 HB3 LYS 96 -10.092 -9.677 -12.320 746 HG2 LYS 96 HG2 LYS 96 -9.572 -9.160 -14.480 747 HG3 LYS 96 HG3 LYS 96 -11.257 -9.613 -14.738 748 HD2 LYS 96 HD2 LYS 96 -11.722 -7.024 -14.315 749 HD3 LYS 96 HD3 LYS 96 -10.004 -6.833 -14.594 750 HE2 LYS 96 HE2 LYS 96 -11.993 -8.124 -16.530 751 HE3 LYS 96 HE3 LYS 96 -11.467 -6.447 -16.602 752 HZ1 LYS 96 HZ1 LYS 96 -9.198 -7.224 -16.992 753 HZ2 LYS 96 HZ2 LYS 96 -9.674 -8.789 -16.940 754 HZ3 LYS 96 HZ3 LYS 96 -10.204 -7.810 -18.129 755 H LEU 97 H LEU 97 -12.554 -10.939 -10.151 756 HA LEU 97 HA LEU 97 -13.466 -8.951 -8.298 757 HB2 LEU 97 HB2 LEU 97 -13.641 -11.421 -7.943 758 HB3 LEU 97 HB3 LEU 97 -11.881 -11.506 -7.801 759 HG LEU 97 HG LEU 97 -11.980 -10.058 -5.772 760 HD11 LEU 97 HD11 LEU 97 -14.239 -9.734 -4.686 761 HD12 LEU 97 HD12 LEU 97 -14.040 -8.796 -6.159 762 HD13 LEU 97 HD13 LEU 97 -15.003 -10.290 -6.182 763 HD21 LEU 97 HD21 LEU 97 -12.018 -12.557 -5.698 764 HD22 LEU 97 HD22 LEU 97 -12.776 -11.795 -4.307 765 HD23 LEU 97 HD23 LEU 97 -13.795 -12.486 -5.592 766 H SER 98 H SER 98 -10.313 -10.035 -9.408 767 HA SER 98 HA SER 98 -8.460 -8.778 -7.849 768 HB2 SER 98 HB2 SER 98 -8.396 -9.037 -10.876 769 HB3 SER 98 HB3 SER 98 -7.042 -9.192 -9.748 770 HG SER 98 HG SER 98 -8.136 -11.217 -10.622 771 H ASP 99 H ASP 99 -10.825 -7.122 -9.797 772 HA ASP 99 HA ASP 99 -9.264 -4.607 -9.653 773 HB2 ASP 99 HB2 ASP 99 -9.479 -5.761 -11.946 774 HB3 ASP 99 HB3 ASP 99 -11.196 -5.369 -11.870 775 H ILE 100 H ILE 100 -11.533 -6.014 -8.086 776 HA ILE 100 HA ILE 100 -13.360 -3.663 -7.866 777 HB ILE 100 HB ILE 100 -13.841 -6.572 -8.144 778 HG12 ILE 100 HG12 ILE 100 -15.670 -4.166 -8.492 779 HG13 ILE 100 HG13 ILE 100 -14.531 -4.742 -9.730 780 HG21 ILE 100 HG21 ILE 100 -15.834 -6.787 -6.816 781 HG22 ILE 100 HG22 ILE 100 -14.499 -6.394 -5.754 782 HG23 ILE 100 HG23 ILE 100 -15.673 -5.131 -6.201 783 HD11 ILE 100 HD11 ILE 100 -16.693 -5.566 -10.297 784 HD12 ILE 100 HD12 ILE 100 -15.751 -6.954 -9.705 785 HD13 ILE 100 HD13 ILE 100 -16.979 -6.184 -8.664 786 H GLU 101 H GLU 101 -14.165 -3.227 -5.815 787 HA GLU 101 HA GLU 101 -12.699 -4.353 -3.492 788 HB2 GLU 101 HB2 GLU 101 -11.897 -2.049 -3.916 789 HB3 GLU 101 HB3 GLU 101 -13.572 -1.471 -3.997 790 HG2 GLU 101 HG2 GLU 101 -12.559 -0.928 -1.841 791 HG3 GLU 101 HG3 GLU 101 -13.927 -2.011 -1.647 792 H ALA 102 H ALA 102 -14.104 -4.922 -1.816 793 HA ALA 102 HA ALA 102 -16.974 -5.079 -2.561 794 HB1 ALA 102 HB1 ALA 102 -15.466 -6.292 -0.201 795 HB2 ALA 102 HB2 ALA 102 -17.141 -6.633 -0.703 796 HB3 ALA 102 HB3 ALA 102 -15.789 -7.097 -1.752 797 H ILE 103 H ILE 103 -18.527 -4.012 -1.460 798 HA ILE 103 HA ILE 103 -17.791 -2.277 0.860 799 HB ILE 103 HB ILE 103 -19.383 -1.727 -1.653 800 HG12 ILE 103 HG12 ILE 103 -17.132 -0.169 -0.303 801 HG13 ILE 103 HG13 ILE 103 -16.897 -1.322 -1.617 802 HG21 ILE 103 HG21 ILE 103 -19.403 -0.006 0.871 803 HG22 ILE 103 HG22 ILE 103 -20.137 0.426 -0.691 804 HG23 ILE 103 HG23 ILE 103 -20.786 -0.916 0.218 805 HD11 ILE 103 HD11 ILE 103 -18.365 0.022 -3.079 806 HD12 ILE 103 HD12 ILE 103 -18.441 1.275 -1.810 807 HD13 ILE 103 HD13 ILE 103 -16.887 0.861 -2.545 808 H ASP 104 H ASP 104 -19.123 -2.363 2.564 809 HA ASP 104 HA ASP 104 -20.727 -2.992 3.973 810 HB2 ASP 104 HB2 ASP 104 -21.874 -1.298 2.590 811 HB3 ASP 104 HB3 ASP 104 -22.563 -2.581 1.596 812 H VAL 105 H VAL 105 -19.375 -5.207 2.812 813 HA VAL 105 HA VAL 105 -21.499 -7.290 2.864 814 HB VAL 105 HB VAL 105 -19.910 -7.037 0.877 815 HG11 VAL 105 HG11 VAL 105 -17.777 -8.173 0.947 816 HG12 VAL 105 HG12 VAL 105 -17.773 -6.794 2.059 817 HG13 VAL 105 HG13 VAL 105 -17.940 -8.447 2.686 818 HG21 VAL 105 HG21 VAL 105 -21.438 -8.924 1.289 819 HG22 VAL 105 HG22 VAL 105 -19.970 -9.336 0.402 820 HG23 VAL 105 HG23 VAL 105 -20.126 -9.777 2.117 821 H ASP 106 H ASP 106 -20.694 -9.430 3.920 822 HA ASP 106 HA ASP 106 -20.195 -8.848 6.693 823 HB2 ASP 106 HB2 ASP 106 -21.138 -10.798 6.989 824 HB3 ASP 106 HB3 ASP 106 -21.296 -11.009 5.248 825 H ASP 107 H ASP 107 -18.475 -9.781 7.970 826 HA ASP 107 HA ASP 107 -15.974 -8.887 7.086 827 HB2 ASP 107 HB2 ASP 107 -16.613 -9.013 9.445 828 HB3 ASP 107 HB3 ASP 107 -16.705 -10.774 9.356 829 H ASP 108 H ASP 108 -17.301 -12.257 7.038 830 HA ASP 108 HA ASP 108 -14.695 -13.392 6.529 831 HB2 ASP 108 HB2 ASP 108 -16.792 -14.563 7.480 832 HB3 ASP 108 HB3 ASP 108 -17.336 -14.693 5.799 833 H THR 109 H THR 109 -17.476 -12.456 4.471 834 HA THR 109 HA THR 109 -16.397 -13.151 1.945 835 HB THR 109 HB THR 109 -18.312 -10.881 2.724 836 HG1 THR 109 HG1 THR 109 -19.076 -12.775 3.484 837 HG21 THR 109 HG21 THR 109 -19.315 -11.490 0.454 838 HG22 THR 109 HG22 THR 109 -17.789 -10.568 0.418 839 HG23 THR 109 HG23 THR 109 -17.785 -12.306 0.114 840 H GLN 110 H GLN 110 -16.233 -10.005 3.768 841 HA GLN 110 HA GLN 110 -14.705 -8.693 1.803 842 HB2 GLN 110 HB2 GLN 110 -15.939 -7.828 3.981 843 HB3 GLN 110 HB3 GLN 110 -14.371 -8.051 4.748 844 HG2 GLN 110 HG2 GLN 110 -15.005 -6.329 2.303 845 HG3 GLN 110 HG3 GLN 110 -14.755 -5.735 3.936 846 HE21 GLN 110 HE22 GLN 110 -13.202 -6.132 0.969 847 HE22 GLN 110 HE21 GLN 110 -11.554 -6.165 1.525 848 H GLU 111 H GLU 111 -13.599 -10.603 4.684 849 HA GLU 111 HA GLU 111 -10.831 -10.142 4.249 850 HB2 GLU 111 HB2 GLU 111 -12.381 -12.331 5.678 851 HB3 GLU 111 HB3 GLU 111 -10.622 -12.311 5.639 852 HG2 GLU 111 HG2 GLU 111 -12.261 -9.954 6.678 853 HG3 GLU 111 HG3 GLU 111 -11.704 -11.280 7.692 854 H ALA 112 H ALA 112 -13.012 -12.670 2.891 855 HA ALA 112 HA ALA 112 -10.916 -14.247 1.725 856 HB1 ALA 112 HB1 ALA 112 -13.248 -15.039 1.989 857 HB2 ALA 112 HB2 ALA 112 -13.789 -13.873 0.757 858 HB3 ALA 112 HB3 ALA 112 -12.681 -15.190 0.319 859 H ILE 113 H ILE 113 -12.844 -11.481 0.512 860 HA ILE 113 HA ILE 113 -11.680 -11.422 -2.107 861 HB ILE 113 HB ILE 113 -13.154 -9.349 -0.427 862 HG12 ILE 113 HG12 ILE 113 -14.142 -11.034 -2.774 863 HG13 ILE 113 HG13 ILE 113 -14.354 -11.506 -1.108 864 HG21 ILE 113 HG21 ILE 113 -12.353 -9.206 -3.364 865 HG22 ILE 113 HG22 ILE 113 -13.539 -8.126 -2.596 866 HG23 ILE 113 HG23 ILE 113 -11.866 -8.105 -2.065 867 HD11 ILE 113 HD11 ILE 113 -15.578 -9.324 -0.711 868 HD12 ILE 113 HD12 ILE 113 -15.575 -9.125 -2.490 869 HD13 ILE 113 HD13 ILE 113 -16.381 -10.514 -1.752 870 H ALA 114 H ALA 114 -10.967 -9.602 0.927 871 HA ALA 114 HA ALA 114 -8.875 -8.011 -0.092 872 HB1 ALA 114 HB1 ALA 114 -9.223 -9.131 2.726 873 HB2 ALA 114 HB2 ALA 114 -8.208 -7.753 2.258 874 HB3 ALA 114 HB3 ALA 114 -9.970 -7.642 2.103 875 H ASP 115 H ASP 115 -8.784 -11.311 1.370 876 HA ASP 115 HA ASP 115 -5.922 -11.503 1.229 877 HB2 ASP 115 HB2 ASP 115 -7.164 -12.881 2.775 878 HB3 ASP 115 HB3 ASP 115 -8.017 -13.674 1.442 879 H TRP 116 H TRP 116 -8.492 -12.335 -1.176 880 HA TRP 116 HA TRP 116 -6.686 -13.623 -3.017 881 HB2 TRP 116 HB2 TRP 116 -9.030 -13.879 -3.415 882 HB3 TRP 116 HB3 TRP 116 -9.308 -12.145 -3.383 883 HD1 TRP 116 HD1 TRP 116 -9.482 -11.005 -5.623 884 HE1 TRP 116 HE1 TRP 116 -8.704 -11.432 -8.037 885 HE3 TRP 116 HE3 TRP 116 -6.854 -15.352 -4.914 886 HZ2 TRP 116 HZ2 TRP 116 -7.203 -13.401 -9.473 887 HZ3 TRP 116 HZ3 TRP 116 -5.759 -16.475 -6.823 888 HH2 TRP 116 HH2 TRP 116 -5.918 -15.513 -9.108 889 H LEU 117 H LEU 117 -7.682 -10.191 -2.570 890 HA LEU 117 HA LEU 117 -6.153 -9.171 -4.764 891 HB2 LEU 117 HB2 LEU 117 -7.136 -7.900 -2.176 892 HB3 LEU 117 HB3 LEU 117 -6.356 -6.982 -3.452 893 HG LEU 117 HG LEU 117 -8.825 -8.668 -4.036 894 HD11 LEU 117 HD11 LEU 117 -8.767 -5.784 -3.062 895 HD12 LEU 117 HD12 LEU 117 -10.190 -6.648 -3.693 896 HD13 LEU 117 HD13 LEU 117 -9.428 -7.189 -2.192 897 HD21 LEU 117 HD21 LEU 117 -7.676 -6.178 -5.369 898 HD22 LEU 117 HD22 LEU 117 -7.512 -7.839 -5.971 899 HD23 LEU 117 HD23 LEU 117 -9.113 -7.085 -5.884 900 H TYR 118 H TYR 118 -5.394 -9.489 -1.251 901 HA TYR 118 HA TYR 118 -2.762 -8.461 -1.467 902 HB2 TYR 118 HB2 TYR 118 -3.902 -10.468 0.515 903 HB3 TYR 118 HB3 TYR 118 -2.346 -9.675 0.672 904 HD1 TYR 118 HD1 TYR 118 -3.079 -6.810 -0.109 905 HD2 TYR 118 HD2 TYR 118 -4.985 -9.701 2.474 906 HE1 TYR 118 HE1 TYR 118 -4.072 -4.979 1.204 907 HE2 TYR 118 HE2 TYR 118 -5.973 -7.872 3.800 908 HH TYR 118 HH TYR 118 -6.183 -5.561 4.058 909 H TRP 119 H TRP 119 -3.951 -11.887 -1.745 910 HA TRP 119 HA TRP 119 -1.436 -13.088 -2.100 911 HB2 TRP 119 HB2 TRP 119 -3.269 -14.536 -1.834 912 HB3 TRP 119 HB3 TRP 119 -4.218 -13.732 -3.077 913 HD1 TRP 119 HD1 TRP 119 -4.107 -14.566 -5.464 914 HE1 TRP 119 HE1 TRP 119 -2.822 -16.369 -6.756 915 HE3 TRP 119 HE3 TRP 119 -0.774 -15.915 -1.818 916 HZ2 TRP 119 HZ2 TRP 119 -0.640 -18.201 -6.238 917 HZ3 TRP 119 HZ3 TRP 119 0.922 -17.671 -2.259 918 HH2 TRP 119 HH2 TRP 119 0.998 -18.816 -4.465 919 H LEU 120 H LEU 120 -3.511 -11.371 -4.485 920 HA LEU 120 HA LEU 120 -2.066 -12.154 -6.778 921 HB2 LEU 120 HB2 LEU 120 -4.359 -10.878 -6.514 922 HB3 LEU 120 HB3 LEU 120 -3.368 -9.426 -6.412 923 HG LEU 120 HG LEU 120 -2.321 -10.219 -8.674 924 HD11 LEU 120 HD11 LEU 120 -3.788 -11.644 -10.043 925 HD12 LEU 120 HD12 LEU 120 -3.312 -12.535 -8.590 926 HD13 LEU 120 HD13 LEU 120 -4.928 -11.822 -8.695 927 HD21 LEU 120 HD21 LEU 120 -3.777 -8.268 -8.491 928 HD22 LEU 120 HD22 LEU 120 -4.216 -9.194 -9.934 929 HD23 LEU 120 HD23 LEU 120 -5.218 -9.302 -8.465 930 H ALA 121 H ALA 121 -1.623 -9.490 -4.452 931 HA ALA 121 HA ALA 121 0.680 -8.324 -5.793 932 HB1 ALA 121 HB1 ALA 121 -0.485 -7.954 -2.999 933 HB2 ALA 121 HB2 ALA 121 0.694 -6.880 -3.791 934 HB3 ALA 121 HB3 ALA 121 -0.953 -7.037 -4.438 935 H ARG 122 H ARG 122 0.215 -10.721 -3.168 936 HA ARG 122 HA ARG 122 2.972 -10.885 -2.335 937 HB2 ARG 122 HB2 ARG 122 0.755 -12.934 -2.200 938 HB3 ARG 122 HB3 ARG 122 2.386 -13.147 -1.562 939 HG2 ARG 122 HG2 ARG 122 2.058 -10.935 -0.291 940 HG3 ARG 122 HG3 ARG 122 0.343 -11.071 -0.663 941 HD2 ARG 122 HD2 ARG 122 2.009 -13.161 0.723 942 HD3 ARG 122 HD3 ARG 122 1.063 -11.934 1.563 943 HE ARG 122 HE ARG 122 0.069 -14.340 0.162 944 HH11 ARG 122 HH21 ARG 122 -0.799 -11.344 1.791 945 HH12 ARG 122 HH22 ARG 122 -2.340 -11.874 2.357 946 HH21 ARG 122 HH11 ARG 122 -2.120 -15.018 0.690 947 HH22 ARG 122 HH12 ARG 122 -3.183 -13.946 1.540 948 H GLY 123 H GLY 123 1.154 -12.253 -5.059 949 HA2 GLY 123 HA2 GLY 123 3.031 -12.425 -6.932 950 HA3 GLY 123 HA3 GLY 123 3.416 -13.890 -6.005 951 H TYR 124 H TYR 124 1.511 -12.694 -8.537 952 HA TYR 124 HA TYR 124 -0.803 -14.405 -8.245 953 HB2 TYR 124 HB2 TYR 124 -0.905 -12.224 -9.330 954 HB3 TYR 124 HB3 TYR 124 0.347 -12.687 -10.469 955 HD1 TYR 124 HD2 TYR 124 -2.541 -14.958 -9.616 956 HD2 TYR 124 HD1 TYR 124 -0.889 -12.100 -12.409 957 HE1 TYR 124 HE2 TYR 124 -4.226 -15.616 -11.274 958 HE2 TYR 124 HE1 TYR 124 -2.597 -12.745 -14.075 959 HH TYR 124 HH TYR 124 -5.050 -15.288 -13.431 960 H LYS 125 H LYS 125 0.901 -16.237 -7.769 961 HA LYS 125 HA LYS 125 2.276 -17.431 -10.042 962 HB2 LYS 125 HB2 LYS 125 1.532 -18.544 -7.295 963 HB3 LYS 125 HB3 LYS 125 2.555 -19.360 -8.481 964 HG2 LYS 125 HG2 LYS 125 4.202 -17.507 -8.367 965 HG3 LYS 125 HG3 LYS 125 3.175 -16.649 -7.220 966 HD2 LYS 125 HD2 LYS 125 4.940 -17.731 -5.988 967 HD3 LYS 125 HD3 LYS 125 3.399 -18.473 -5.586 968 HE2 LYS 125 HE2 LYS 125 5.037 -20.215 -5.773 969 HE3 LYS 125 HE3 LYS 125 3.917 -20.378 -7.123 970 HZ1 LYS 125 HZ1 LYS 125 6.223 -20.632 -7.811 971 HZ2 LYS 125 HZ2 LYS 125 5.598 -19.319 -8.541 972 HZ3 LYS 125 HZ3 LYS 125 6.616 -19.150 -7.271 973 H PHE 126 H PHE 126 -0.921 -17.689 -8.557 974 HA PHE 126 HA PHE 126 -2.097 -19.059 -10.745 975 HB2 PHE 126 HB2 PHE 126 -2.977 -20.949 -9.291 976 HB3 PHE 126 HB3 PHE 126 -1.311 -21.079 -9.806 977 HD1 PHE 126 HD1 PHE 126 -3.464 -20.303 -6.859 978 HD2 PHE 126 HD2 PHE 126 0.498 -21.245 -8.268 979 HE1 PHE 126 HE1 PHE 126 -2.721 -20.741 -4.518 980 HE2 PHE 126 HE2 PHE 126 1.247 -21.617 -5.935 981 HZ PHE 126 HZ PHE 126 -0.367 -21.356 -4.052 Start of MODEL 13 1 H1 MET 1 H1 MET 1 3.132 -0.581 -3.443 2 H2 MET 1 H2 MET 1 3.418 -0.708 -1.839 3 H3 MET 1 H3 MET 1 4.373 0.256 -2.771 4 HA MET 1 HA MET 1 5.192 -1.609 -3.982 5 HB2 MET 1 HB2 MET 1 6.626 -2.600 -2.344 6 HB3 MET 1 HB3 MET 1 6.469 -0.892 -1.993 7 HG2 MET 1 HG2 MET 1 4.996 -3.120 -0.516 8 HG3 MET 1 HG3 MET 1 6.504 -2.383 -0.004 9 HE1 MET 1 HE1 MET 1 4.075 -1.094 2.734 10 HE2 MET 1 HE2 MET 1 4.062 -2.685 1.943 11 HE3 MET 1 HE3 MET 1 5.608 -1.924 2.386 12 H ALA 2 H ALA 2 5.431 -3.997 -4.119 13 HA ALA 2 HA ALA 2 2.890 -5.279 -4.268 14 HB1 ALA 2 HB1 ALA 2 4.766 -5.842 -5.748 15 HB2 ALA 2 HB2 ALA 2 5.715 -6.432 -4.361 16 HB3 ALA 2 HB3 ALA 2 4.236 -7.279 -4.854 17 H SER 3 H SER 3 5.429 -5.341 -1.730 18 HA SER 3 HA SER 3 4.435 -7.564 -0.317 19 HB2 SER 3 HB2 SER 3 5.933 -5.146 0.764 20 HB3 SER 3 HB3 SER 3 5.844 -6.758 1.504 21 HG SER 3 HG SER 3 7.772 -6.314 0.204 22 H VAL 4 H VAL 4 2.927 -7.876 1.106 23 HA VAL 4 HA VAL 4 1.347 -5.683 2.326 24 HB VAL 4 HB VAL 4 -0.755 -6.904 1.604 25 HG11 VAL 4 HG11 VAL 4 0.824 -5.752 -0.720 26 HG12 VAL 4 HG12 VAL 4 -0.935 -5.876 -0.564 27 HG13 VAL 4 HG13 VAL 4 -0.029 -4.801 0.513 28 HG21 VAL 4 HG21 VAL 4 0.278 -9.069 0.930 29 HG22 VAL 4 HG22 VAL 4 -0.697 -8.340 -0.353 30 HG23 VAL 4 HG23 VAL 4 1.062 -8.259 -0.447 31 H GLU 5 H GLU 5 3.073 -8.492 2.761 32 HA GLU 5 HA GLU 5 1.456 -10.064 4.463 33 HB2 GLU 5 HB2 GLU 5 4.499 -9.755 4.487 34 HB3 GLU 5 HB3 GLU 5 3.555 -11.082 5.152 35 HG2 GLU 5 HG2 GLU 5 4.164 -12.074 3.213 36 HG3 GLU 5 HG3 GLU 5 2.688 -11.317 2.632 37 H ARG 6 H ARG 6 1.315 -10.136 6.735 38 HA ARG 6 HA ARG 6 2.510 -7.920 8.293 39 HB2 ARG 6 HB2 ARG 6 0.359 -7.211 9.122 40 HB3 ARG 6 HB3 ARG 6 0.421 -7.144 7.365 41 HG2 ARG 6 HG2 ARG 6 -0.772 -9.526 7.502 42 HG3 ARG 6 HG3 ARG 6 -1.157 -9.014 9.148 43 HD2 ARG 6 HD2 ARG 6 -2.996 -8.425 7.704 44 HD3 ARG 6 HD3 ARG 6 -2.187 -6.918 8.178 45 HE ARG 6 HE ARG 6 -0.976 -7.735 5.783 46 HH11 ARG 6 HH11 ARG 6 -4.236 -6.709 6.762 47 HH12 ARG 6 HH12 ARG 6 -4.689 -6.182 5.179 48 HH21 ARG 6 HH21 ARG 6 -1.515 -7.061 3.772 49 HH22 ARG 6 HH22 ARG 6 -3.101 -6.452 3.381 50 H ASP 7 H ASP 7 1.158 -11.222 8.288 51 HA ASP 7 HA ASP 7 2.734 -11.732 10.638 52 HB2 ASP 7 HB2 ASP 7 0.550 -10.929 11.653 53 HB3 ASP 7 HB3 ASP 7 -0.266 -12.255 10.825 54 H GLU 8 H GLU 8 3.278 -13.945 10.688 55 HA GLU 8 HA GLU 8 3.177 -15.259 8.169 56 HB2 GLU 8 HB2 GLU 8 4.040 -16.265 10.916 57 HB3 GLU 8 HB3 GLU 8 4.381 -17.083 9.393 58 HG2 GLU 8 HG2 GLU 8 5.394 -14.315 10.179 59 HG3 GLU 8 HG3 GLU 8 6.316 -15.807 10.237 60 H THR 9 H THR 9 0.949 -15.484 10.920 61 HA THR 9 HA THR 9 0.034 -18.111 10.681 62 HB THR 9 HB THR 9 -2.150 -16.995 11.453 63 HG1 THR 9 HG1 THR 9 -0.488 -14.752 11.809 64 HG21 THR 9 HG21 THR 9 -1.217 -16.431 13.688 65 HG22 THR 9 HG22 THR 9 -0.636 -17.983 13.045 66 HG23 THR 9 HG23 THR 9 0.419 -16.557 12.990 67 H ARG 10 H ARG 10 -0.777 -15.254 8.762 68 HA ARG 10 HA ARG 10 -3.038 -16.355 7.365 69 HB2 ARG 10 HB2 ARG 10 -1.040 -14.158 6.645 70 HB3 ARG 10 HB3 ARG 10 -2.383 -14.604 5.603 71 HG2 ARG 10 HG2 ARG 10 -2.941 -12.645 6.897 72 HG3 ARG 10 HG3 ARG 10 -4.019 -13.984 7.295 73 HD2 ARG 10 HD2 ARG 10 -2.900 -14.350 9.411 74 HD3 ARG 10 HD3 ARG 10 -1.623 -13.180 8.999 75 HE ARG 10 HE ARG 10 -3.950 -11.728 8.815 76 HH11 ARG 10 HH11 ARG 10 -2.501 -13.690 11.426 77 HH12 ARG 10 HH12 ARG 10 -3.160 -12.711 12.688 78 HH21 ARG 10 HH21 ARG 10 -4.823 -10.454 10.513 79 HH22 ARG 10 HH22 ARG 10 -4.508 -10.848 12.158 80 H GLU 11 H GLU 11 0.453 -16.342 6.537 81 HA GLU 11 HA GLU 11 0.098 -17.687 4.022 82 HB2 GLU 11 HB2 GLU 11 2.536 -17.486 5.851 83 HB3 GLU 11 HB3 GLU 11 2.558 -18.067 4.188 84 HG2 GLU 11 HG2 GLU 11 1.797 -15.248 5.079 85 HG3 GLU 11 HG3 GLU 11 3.335 -15.733 4.384 86 H HIS 12 H HIS 12 0.908 -18.802 7.339 87 HA HIS 12 HA HIS 12 1.211 -21.558 6.731 88 HB2 HIS 12 HB2 HIS 12 2.012 -20.841 8.815 89 HB3 HIS 12 HB3 HIS 12 0.567 -19.908 9.175 90 HD1 HIS 12 HD1 HIS 12 1.313 -23.738 8.826 91 HD2 HIS 12 HD2 HIS 12 -1.000 -20.888 10.886 92 HE1 HIS 12 HE1 HIS 12 -0.069 -25.036 10.525 93 H ARG 13 H ARG 13 -1.744 -19.730 7.772 94 HA ARG 13 HA ARG 13 -3.391 -22.056 7.917 95 HB2 ARG 13 HB2 ARG 13 -3.998 -19.085 7.620 96 HB3 ARG 13 HB3 ARG 13 -5.270 -20.300 7.783 97 HG2 ARG 13 HG2 ARG 13 -4.574 -20.941 9.974 98 HG3 ARG 13 HG3 ARG 13 -3.040 -20.075 9.839 99 HD2 ARG 13 HD2 ARG 13 -4.275 -17.920 9.680 100 HD3 ARG 13 HD3 ARG 13 -5.802 -18.796 9.925 101 HE ARG 13 HE ARG 13 -4.238 -19.571 12.057 102 HH11 ARG 13 HH21 ARG 13 -5.401 -16.444 10.842 103 HH12 ARG 13 HH22 ARG 13 -5.342 -15.662 12.376 104 HH21 ARG 13 HH11 ARG 13 -4.174 -18.533 14.112 105 HH22 ARG 13 HH12 ARG 13 -4.639 -16.885 14.278 106 H ILE 14 H ILE 14 -2.992 -19.631 5.237 107 HA ILE 14 HA ILE 14 -4.975 -20.903 3.667 108 HB ILE 14 HB ILE 14 -4.085 -18.566 3.394 109 HG12 ILE 14 HG12 ILE 14 -4.366 -20.358 0.946 110 HG13 ILE 14 HG13 ILE 14 -5.660 -19.591 1.860 111 HG21 ILE 14 HG21 ILE 14 -2.202 -18.090 1.968 112 HG22 ILE 14 HG22 ILE 14 -1.657 -19.097 3.298 113 HG23 ILE 14 HG23 ILE 14 -1.891 -19.815 1.688 114 HD11 ILE 14 HD11 ILE 14 -5.373 -18.358 -0.128 115 HD12 ILE 14 HD12 ILE 14 -4.740 -17.347 1.185 116 HD13 ILE 14 HD13 ILE 14 -3.622 -18.207 0.091 117 H GLU 15 H GLU 15 -1.434 -21.425 3.898 118 HA GLU 15 HA GLU 15 -1.227 -23.319 1.790 119 HB2 GLU 15 HB2 GLU 15 0.672 -22.135 2.712 120 HB3 GLU 15 HB3 GLU 15 0.413 -22.842 4.315 121 HG2 GLU 15 HG2 GLU 15 0.998 -25.046 3.526 122 HG3 GLU 15 HG3 GLU 15 1.065 -24.488 1.847 123 H THR 16 H THR 16 -2.089 -23.739 5.260 124 HA THR 16 HA THR 16 -1.972 -26.658 4.902 125 HB THR 16 HB THR 16 -2.271 -26.688 7.378 126 HG1 THR 16 HG1 THR 16 -1.799 -23.901 7.204 127 HG21 THR 16 HG21 THR 16 0.071 -25.022 6.352 128 HG22 THR 16 HG22 THR 16 0.000 -25.932 7.879 129 HG23 THR 16 HG23 THR 16 -0.042 -26.793 6.335 130 H GLU 17 H GLU 17 -4.479 -24.322 4.655 131 HA GLU 17 HA GLU 17 -6.485 -26.500 5.126 132 HB2 GLU 17 HB2 GLU 17 -6.750 -23.559 5.853 133 HB3 GLU 17 HB3 GLU 17 -7.978 -24.806 6.049 134 HG2 GLU 17 HG2 GLU 17 -6.387 -26.048 7.577 135 HG3 GLU 17 HG3 GLU 17 -5.322 -24.640 7.526 136 H ILE 18 H ILE 18 -5.513 -23.908 2.894 137 HA ILE 18 HA ILE 18 -8.162 -24.180 1.548 138 HB ILE 18 HB ILE 18 -6.216 -21.898 1.826 139 HG12 ILE 18 HG12 ILE 18 -9.187 -22.197 2.494 140 HG13 ILE 18 HG13 ILE 18 -7.892 -22.425 3.662 141 HG21 ILE 18 HG21 ILE 18 -8.644 -22.026 -0.003 142 HG22 ILE 18 HG22 ILE 18 -7.731 -20.546 0.386 143 HG23 ILE 18 HG23 ILE 18 -6.957 -21.831 -0.509 144 HD11 ILE 18 HD11 ILE 18 -8.904 -20.257 3.958 145 HD12 ILE 18 HD12 ILE 18 -7.219 -20.075 3.454 146 HD13 ILE 18 HD13 ILE 18 -8.543 -19.792 2.294 147 H ILE 19 H ILE 19 -4.632 -24.281 0.842 148 HA ILE 19 HA ILE 19 -5.441 -25.707 -1.655 149 HB ILE 19 HB ILE 19 -3.553 -24.850 -2.848 150 HG12 ILE 19 HG12 ILE 19 -2.166 -24.240 -0.744 151 HG13 ILE 19 HG13 ILE 19 -1.997 -23.322 -2.229 152 HG21 ILE 19 HG21 ILE 19 -5.727 -23.805 -3.138 153 HG22 ILE 19 HG22 ILE 19 -5.360 -22.614 -1.887 154 HG23 ILE 19 HG23 ILE 19 -4.413 -22.644 -3.383 155 HD11 ILE 19 HD11 ILE 19 -3.254 -21.461 -1.352 156 HD12 ILE 19 HD12 ILE 19 -3.744 -22.393 0.065 157 HD13 ILE 19 HD13 ILE 19 -2.044 -21.926 -0.145 158 H VAL 20 H VAL 20 -4.603 -26.573 1.169 159 HA VAL 20 HA VAL 20 -2.062 -27.695 1.111 160 HB VAL 20 HB VAL 20 -3.625 -27.359 3.001 161 HG11 VAL 20 HG11 VAL 20 -5.671 -28.428 2.165 162 HG12 VAL 20 HG12 VAL 20 -4.889 -30.021 2.324 163 HG13 VAL 20 HG13 VAL 20 -5.183 -29.023 3.754 164 HG21 VAL 20 HG21 VAL 20 -2.773 -29.200 4.374 165 HG22 VAL 20 HG22 VAL 20 -2.361 -30.122 2.913 166 HG23 VAL 20 HG23 VAL 20 -1.516 -28.602 3.277 167 H ASP 21 H ASP 21 -5.088 -29.052 -0.093 168 HA ASP 21 HA ASP 21 -3.995 -31.673 -0.682 169 HB2 ASP 21 HB2 ASP 21 -6.344 -31.258 -0.021 170 HB3 ASP 21 HB3 ASP 21 -6.604 -30.342 -1.506 171 H ALA 22 H ALA 22 -3.782 -28.698 -2.364 172 HA ALA 22 HA ALA 22 -4.256 -29.685 -5.054 173 HB1 ALA 22 HB1 ALA 22 -2.999 -27.099 -4.059 174 HB2 ALA 22 HB2 ALA 22 -3.560 -27.415 -5.707 175 HB3 ALA 22 HB3 ALA 22 -4.736 -27.346 -4.380 176 H GLU 23 H GLU 23 -2.647 -29.504 -6.774 177 HA GLU 23 HA GLU 23 0.203 -29.872 -5.994 178 HB2 GLU 23 HB2 GLU 23 -1.402 -31.692 -7.841 179 HB3 GLU 23 HB3 GLU 23 0.357 -31.712 -7.670 180 HG2 GLU 23 HG2 GLU 23 0.094 -32.249 -5.240 181 HG3 GLU 23 HG3 GLU 23 -1.655 -32.347 -5.472 182 H ASP 24 H ASP 24 -2.231 -28.946 -8.435 183 HA ASP 24 HA ASP 24 -0.119 -27.629 -10.093 184 HB2 ASP 24 HB2 ASP 24 -1.008 -29.603 -11.221 185 HB3 ASP 24 HB3 ASP 24 -2.666 -29.096 -10.887 186 H LYS 25 H LYS 25 -0.845 -25.577 -11.102 187 HA LYS 25 HA LYS 25 -2.218 -23.945 -9.321 188 HB2 LYS 25 HB2 LYS 25 -2.272 -22.253 -10.991 189 HB3 LYS 25 HB3 LYS 25 -0.707 -23.043 -11.011 190 HG2 LYS 25 HG2 LYS 25 -1.051 -24.027 -13.102 191 HG3 LYS 25 HG3 LYS 25 -2.807 -24.003 -12.989 192 HD2 LYS 25 HD2 LYS 25 -1.095 -21.526 -13.319 193 HD3 LYS 25 HD3 LYS 25 -1.913 -22.386 -14.631 194 HE2 LYS 25 HE2 LYS 25 -3.906 -21.440 -14.208 195 HE3 LYS 25 HE3 LYS 25 -3.814 -21.856 -12.495 196 HZ1 LYS 25 HZ1 LYS 25 -2.626 -19.421 -13.704 197 HZ2 LYS 25 HZ2 LYS 25 -3.946 -19.473 -12.749 198 HZ3 LYS 25 HZ3 LYS 25 -2.485 -19.857 -12.127 199 H GLU 26 H GLU 26 -3.746 -25.990 -11.824 200 HA GLU 26 HA GLU 26 -6.246 -24.530 -11.795 201 HB2 GLU 26 HB2 GLU 26 -5.508 -27.394 -12.527 202 HB3 GLU 26 HB3 GLU 26 -7.152 -26.758 -12.643 203 HG2 GLU 26 HG2 GLU 26 -6.515 -25.103 -14.273 204 HG3 GLU 26 HG3 GLU 26 -4.799 -25.442 -14.060 205 H GLU 27 H GLU 27 -4.855 -27.201 -9.867 206 HA GLU 27 HA GLU 27 -7.255 -27.696 -8.337 207 HB2 GLU 27 HB2 GLU 27 -4.349 -28.341 -7.698 208 HB3 GLU 27 HB3 GLU 27 -5.762 -29.014 -6.891 209 HG2 GLU 27 HG2 GLU 27 -5.013 -29.380 -9.825 210 HG3 GLU 27 HG3 GLU 27 -4.770 -30.562 -8.545 211 H ARG 28 H ARG 28 -4.343 -25.635 -7.935 212 HA ARG 28 HA ARG 28 -5.063 -24.700 -5.298 213 HB2 ARG 28 HB2 ARG 28 -3.327 -23.381 -7.441 214 HB3 ARG 28 HB3 ARG 28 -3.477 -22.833 -5.768 215 HG2 ARG 28 HG2 ARG 28 -2.659 -25.030 -4.965 216 HG3 ARG 28 HG3 ARG 28 -2.415 -25.561 -6.636 217 HD2 ARG 28 HD2 ARG 28 -0.730 -23.771 -6.950 218 HD3 ARG 28 HD3 ARG 28 -1.050 -23.210 -5.308 219 HE ARG 28 HE ARG 28 0.106 -24.953 -4.387 220 HH11 ARG 28 HH12 ARG 28 -0.009 -25.416 -7.900 221 HH12 ARG 28 HH11 ARG 28 0.920 -26.890 -7.865 222 HH21 ARG 28 HH21 ARG 28 1.471 -26.813 -4.383 223 HH22 ARG 28 HH22 ARG 28 1.907 -27.573 -5.867 224 H ALA 29 H ALA 29 -5.907 -23.565 -8.580 225 HA ALA 29 HA ALA 29 -7.265 -21.192 -7.706 226 HB1 ALA 29 HB1 ALA 29 -8.204 -21.157 -9.942 227 HB2 ALA 29 HB2 ALA 29 -6.496 -21.599 -10.055 228 HB3 ALA 29 HB3 ALA 29 -7.753 -22.848 -10.223 229 H MET 30 H MET 30 -8.323 -24.622 -8.250 230 HA MET 30 HA MET 30 -11.045 -24.153 -7.546 231 HB2 MET 30 HB2 MET 30 -9.352 -26.661 -7.310 232 HB3 MET 30 HB3 MET 30 -11.084 -26.595 -6.999 233 HG2 MET 30 HG2 MET 30 -9.785 -25.893 -9.645 234 HG3 MET 30 HG3 MET 30 -10.533 -27.424 -9.238 235 HE1 MET 30 HE1 MET 30 -12.410 -23.709 -10.917 236 HE2 MET 30 HE2 MET 30 -12.052 -23.370 -9.218 237 HE3 MET 30 HE3 MET 30 -10.753 -23.908 -10.302 238 H GLY 31 H GLY 31 -8.231 -25.003 -5.446 239 HA2 GLY 31 HA2 GLY 31 -9.609 -25.234 -3.018 240 HA3 GLY 31 HA3 GLY 31 -7.959 -24.612 -3.197 241 H TRP 32 H TRP 32 -8.125 -22.244 -4.388 242 HA TRP 32 HA TRP 32 -9.166 -20.355 -2.605 243 HB2 TRP 32 HB2 TRP 32 -8.299 -20.296 -5.492 244 HB3 TRP 32 HB3 TRP 32 -9.181 -18.926 -4.853 245 HD1 TRP 32 HD1 TRP 32 -5.774 -20.571 -4.629 246 HE1 TRP 32 HE1 TRP 32 -4.155 -18.994 -3.430 247 HE3 TRP 32 HE3 TRP 32 -9.143 -17.106 -2.936 248 HZ2 TRP 32 HZ2 TRP 32 -4.300 -16.494 -1.967 249 HZ3 TRP 32 HZ3 TRP 32 -8.377 -15.166 -1.599 250 HH2 TRP 32 HH2 TRP 32 -5.961 -14.838 -1.128 251 H TYR 33 H TYR 33 -10.642 -21.481 -5.723 252 HA TYR 33 HA TYR 33 -12.931 -19.889 -5.591 253 HB2 TYR 33 HB2 TYR 33 -12.326 -21.046 -7.616 254 HB3 TYR 33 HB3 TYR 33 -12.455 -22.614 -6.833 255 HD1 TYR 33 HD1 TYR 33 -14.616 -23.664 -6.360 256 HD2 TYR 33 HD2 TYR 33 -14.376 -19.820 -8.299 257 HE1 TYR 33 HE1 TYR 33 -17.014 -23.815 -6.944 258 HE2 TYR 33 HE2 TYR 33 -16.714 -20.046 -9.049 259 HH TYR 33 HH TYR 33 -18.673 -21.320 -8.939 260 H TYR 34 H TYR 34 -12.462 -23.211 -4.199 261 HA TYR 34 HA TYR 34 -15.197 -23.583 -3.581 262 HB2 TYR 34 HB2 TYR 34 -12.710 -24.766 -2.279 263 HB3 TYR 34 HB3 TYR 34 -14.347 -25.294 -1.936 264 HD1 TYR 34 HD1 TYR 34 -15.581 -25.420 -4.688 265 HD2 TYR 34 HD2 TYR 34 -11.727 -26.691 -3.208 266 HE1 TYR 34 HE1 TYR 34 -15.461 -27.122 -6.468 267 HE2 TYR 34 HE2 TYR 34 -11.620 -28.425 -4.962 268 HH TYR 34 HH TYR 34 -12.692 -29.393 -6.797 269 H TYR 35 H TYR 35 -12.483 -22.410 -1.419 270 HA TYR 35 HA TYR 35 -14.405 -22.079 0.718 271 HB2 TYR 35 HB2 TYR 35 -12.708 -21.601 2.067 272 HB3 TYR 35 HB3 TYR 35 -11.739 -22.308 0.793 273 HD1 TYR 35 HD1 TYR 35 -10.467 -20.792 -0.767 274 HD2 TYR 35 HD2 TYR 35 -12.622 -19.251 2.629 275 HE1 TYR 35 HE1 TYR 35 -9.237 -18.659 -0.972 276 HE2 TYR 35 HE2 TYR 35 -11.419 -17.103 2.434 277 HH TYR 35 HH TYR 35 -9.821 -15.889 1.269 278 H LEU 36 H LEU 36 -13.078 -19.885 -1.786 279 HA LEU 36 HA LEU 36 -14.051 -17.485 -0.663 280 HB2 LEU 36 HB2 LEU 36 -12.306 -17.652 -2.399 281 HB3 LEU 36 HB3 LEU 36 -13.496 -18.265 -3.553 282 HG LEU 36 HG LEU 36 -14.693 -16.084 -3.465 283 HD11 LEU 36 HD11 LEU 36 -13.534 -14.124 -2.441 284 HD12 LEU 36 HD12 LEU 36 -14.041 -15.291 -1.216 285 HD13 LEU 36 HD13 LEU 36 -12.335 -15.216 -1.714 286 HD21 LEU 36 HD21 LEU 36 -11.716 -15.863 -4.096 287 HD22 LEU 36 HD22 LEU 36 -12.944 -16.585 -5.155 288 HD23 LEU 36 HD23 LEU 36 -13.031 -14.869 -4.760 289 H ASP 37 H ASP 37 -15.490 -19.599 -3.230 290 HA ASP 37 HA ASP 37 -17.839 -18.054 -3.629 291 HB2 ASP 37 HB2 ASP 37 -17.061 -19.796 -5.192 292 HB3 ASP 37 HB3 ASP 37 -17.380 -21.042 -3.981 293 H ASP 38 H ASP 38 -17.136 -20.777 -1.394 294 HA ASP 38 HA ASP 38 -19.739 -20.930 -0.231 295 HB2 ASP 38 HB2 ASP 38 -18.061 -22.695 0.001 296 HB3 ASP 38 HB3 ASP 38 -17.012 -21.614 0.924 297 H THR 39 H THR 39 -17.129 -18.606 0.288 298 HA THR 39 HA THR 39 -18.155 -17.736 2.902 299 HB THR 39 HB THR 39 -15.891 -16.713 1.130 300 HG1 THR 39 HG1 THR 39 -15.430 -18.686 1.946 301 HG21 THR 39 HG21 THR 39 -16.539 -14.865 2.483 302 HG22 THR 39 HG22 THR 39 -16.806 -15.885 3.906 303 HG23 THR 39 HG23 THR 39 -15.155 -15.600 3.308 304 H LEU 40 H LEU 40 -18.032 -16.548 -0.486 305 HA LEU 40 HA LEU 40 -19.029 -13.951 -0.098 306 HB2 LEU 40 HB2 LEU 40 -18.853 -15.912 -2.369 307 HB3 LEU 40 HB3 LEU 40 -20.036 -14.624 -2.535 308 HG LEU 40 HG LEU 40 -18.405 -12.908 -2.295 309 HD11 LEU 40 HD11 LEU 40 -16.005 -13.277 -2.204 310 HD12 LEU 40 HD12 LEU 40 -16.744 -14.021 -0.779 311 HD13 LEU 40 HD13 LEU 40 -16.250 -15.027 -2.147 312 HD21 LEU 40 HD21 LEU 40 -18.842 -13.934 -4.534 313 HD22 LEU 40 HD22 LEU 40 -17.212 -13.248 -4.407 314 HD23 LEU 40 HD23 LEU 40 -17.451 -15.005 -4.293 315 H GLU 41 H GLU 41 -20.900 -13.329 0.833 316 HA GLU 41 HA GLU 41 -23.283 -15.011 0.797 317 HB2 GLU 41 HB2 GLU 41 -24.356 -13.190 1.977 318 HB3 GLU 41 HB3 GLU 41 -22.863 -13.686 2.757 319 HG2 GLU 41 HG2 GLU 41 -21.752 -11.707 2.291 320 HG3 GLU 41 HG3 GLU 41 -22.692 -11.362 0.851 321 H PHE 42 H PHE 42 -22.535 -14.731 -1.814 322 HA PHE 42 HA PHE 42 -23.409 -12.423 -3.161 323 HB2 PHE 42 HB2 PHE 42 -23.114 -13.694 -5.199 324 HB3 PHE 42 HB3 PHE 42 -21.815 -14.044 -4.091 325 HD1 PHE 42 HD2 PHE 42 -24.934 -15.377 -5.640 326 HD2 PHE 42 HD1 PHE 42 -21.447 -16.331 -3.279 327 HE1 PHE 42 HE2 PHE 42 -25.395 -17.794 -5.922 328 HE2 PHE 42 HE1 PHE 42 -21.918 -18.737 -3.560 329 HZ PHE 42 HZ PHE 42 -23.894 -19.483 -4.878 330 HA PRO 43 HA PRO 43 -24.413 -11.950 -5.396 331 HB2 PRO 43 HB2 PRO 43 -26.377 -10.208 -6.100 332 HB3 PRO 43 HB3 PRO 43 -26.268 -11.863 -6.770 333 HG2 PRO 43 HG2 PRO 43 -27.993 -10.913 -4.464 334 HG3 PRO 43 HG3 PRO 43 -28.484 -11.887 -5.888 335 HD2 PRO 43 HD2 PRO 43 -27.857 -13.036 -3.489 336 HD3 PRO 43 HD3 PRO 43 -27.439 -13.825 -5.037 337 H PHE 44 H PHE 44 -23.744 -9.710 -5.300 338 HA PHE 44 HA PHE 44 -24.394 -8.069 -2.960 339 HB2 PHE 44 HB2 PHE 44 -22.202 -7.983 -2.066 340 HB3 PHE 44 HB3 PHE 44 -22.723 -9.650 -2.065 341 HD1 PHE 44 HD1 PHE 44 -21.850 -11.170 -4.070 342 HD2 PHE 44 HD2 PHE 44 -20.055 -7.438 -2.865 343 HE1 PHE 44 HE1 PHE 44 -19.714 -11.864 -5.096 344 HE2 PHE 44 HE2 PHE 44 -17.928 -8.130 -3.922 345 HZ PHE 44 HZ PHE 44 -17.736 -10.359 -5.007 346 H MET 45 H MET 45 -22.255 -6.232 -3.288 347 HA MET 45 HA MET 45 -22.289 -5.606 -6.180 348 HB2 MET 45 HB2 MET 45 -23.050 -3.442 -5.970 349 HB3 MET 45 HB3 MET 45 -24.181 -4.394 -5.028 350 HG2 MET 45 HG2 MET 45 -23.476 -3.500 -3.004 351 HG3 MET 45 HG3 MET 45 -21.866 -3.106 -3.583 352 HE1 MET 45 HE1 MET 45 -22.242 -1.381 -6.267 353 HE2 MET 45 HE2 MET 45 -22.194 0.212 -5.487 354 HE3 MET 45 HE3 MET 45 -21.121 -1.082 -4.928 355 H GLY 46 H GLY 46 -20.846 -3.794 -6.752 356 HA2 GLY 46 HA2 GLY 46 -18.627 -3.186 -4.937 357 HA3 GLY 46 HA3 GLY 46 -18.218 -4.352 -6.208 358 H LYS 47 H LYS 47 -16.765 -2.338 -6.341 359 HA LYS 47 HA LYS 47 -17.791 -0.748 -8.653 360 HB2 LYS 47 HB2 LYS 47 -17.080 0.525 -6.487 361 HB3 LYS 47 HB3 LYS 47 -15.447 -0.005 -6.849 362 HG2 LYS 47 HG2 LYS 47 -15.537 2.125 -7.822 363 HG3 LYS 47 HG3 LYS 47 -15.843 1.064 -9.200 364 HD2 LYS 47 HD2 LYS 47 -17.452 2.789 -9.385 365 HD3 LYS 47 HD3 LYS 47 -18.341 1.409 -8.746 366 HE2 LYS 47 HE2 LYS 47 -18.334 2.344 -6.510 367 HE3 LYS 47 HE3 LYS 47 -17.211 3.625 -6.993 368 HZ1 LYS 47 HZ1 LYS 47 -19.567 4.338 -6.887 369 HZ2 LYS 47 HZ2 LYS 47 -18.905 4.592 -8.353 370 HZ3 LYS 47 HZ3 LYS 47 -19.935 3.347 -8.144 371 H TRP 48 H TRP 48 -16.963 -1.533 -10.498 372 HA TRP 48 HA TRP 48 -14.525 -3.210 -10.508 373 HB2 TRP 48 HB2 TRP 48 -16.477 -3.744 -11.973 374 HB3 TRP 48 HB3 TRP 48 -16.274 -2.208 -12.787 375 HD1 TRP 48 HD1 TRP 48 -12.842 -3.210 -12.514 376 HE1 TRP 48 HE1 TRP 48 -11.980 -4.497 -14.475 377 HE3 TRP 48 HE3 TRP 48 -17.338 -4.454 -14.646 378 HZ2 TRP 48 HZ2 TRP 48 -13.079 -6.089 -16.650 379 HZ3 TRP 48 HZ3 TRP 48 -17.378 -5.891 -16.669 380 HH2 TRP 48 HH2 TRP 48 -15.251 -6.729 -17.656 381 H LYS 49 H LYS 49 -12.726 -2.080 -10.179 382 HA LYS 49 HA LYS 49 -12.480 0.777 -10.732 383 HB2 LYS 49 HB2 LYS 49 -10.378 -1.223 -9.780 384 HB3 LYS 49 HB3 LYS 49 -10.355 0.521 -9.549 385 HG2 LYS 49 HG2 LYS 49 -12.318 -1.430 -8.245 386 HG3 LYS 49 HG3 LYS 49 -10.855 -0.850 -7.503 387 HD2 LYS 49 HD2 LYS 49 -13.038 1.087 -8.385 388 HD3 LYS 49 HD3 LYS 49 -13.063 0.237 -6.835 389 HE2 LYS 49 HE2 LYS 49 -10.673 1.105 -6.463 390 HE3 LYS 49 HE3 LYS 49 -10.975 2.221 -7.804 391 HZ1 LYS 49 HZ1 LYS 49 -12.779 3.176 -6.557 392 HZ2 LYS 49 HZ2 LYS 49 -12.642 2.018 -5.354 393 HZ3 LYS 49 HZ3 LYS 49 -11.470 3.140 -5.586 394 H LYS 50 H LYS 50 -13.011 -0.214 -13.176 395 HA LYS 50 HA LYS 50 -11.079 -1.829 -14.468 396 HB2 LYS 50 HB2 LYS 50 -13.354 -1.616 -15.266 397 HB3 LYS 50 HB3 LYS 50 -13.153 0.111 -15.579 398 HG2 LYS 50 HG2 LYS 50 -11.570 -0.283 -17.356 399 HG3 LYS 50 HG3 LYS 50 -11.461 -2.006 -16.972 400 HD2 LYS 50 HD2 LYS 50 -13.963 -0.579 -17.993 401 HD3 LYS 50 HD3 LYS 50 -12.821 -1.488 -18.996 402 HE2 LYS 50 HE2 LYS 50 -13.279 -3.533 -17.604 403 HE3 LYS 50 HE3 LYS 50 -14.518 -2.628 -16.727 404 HZ1 LYS 50 HZ1 LYS 50 -14.554 -3.234 -19.628 405 HZ2 LYS 50 HZ2 LYS 50 -15.494 -3.924 -18.488 406 HZ3 LYS 50 HZ3 LYS 50 -15.689 -2.346 -18.857 407 H LYS 51 H LYS 51 -9.008 -1.381 -14.967 408 HA LYS 51 HA LYS 51 -7.983 1.330 -15.259 409 HB2 LYS 51 HB2 LYS 51 -6.883 -1.398 -16.074 410 HB3 LYS 51 HB3 LYS 51 -6.035 0.132 -16.367 411 HG2 LYS 51 HG2 LYS 51 -6.060 0.630 -13.934 412 HG3 LYS 51 HG3 LYS 51 -6.874 -0.916 -13.625 413 HD2 LYS 51 HD2 LYS 51 -4.935 -2.131 -14.589 414 HD3 LYS 51 HD3 LYS 51 -4.118 -0.580 -14.893 415 HE2 LYS 51 HE2 LYS 51 -4.183 -0.073 -12.460 416 HE3 LYS 51 HE3 LYS 51 -4.999 -1.612 -12.156 417 HZ1 LYS 51 HZ1 LYS 51 -3.022 -2.749 -12.987 418 HZ2 LYS 51 HZ2 LYS 51 -2.266 -1.326 -13.269 419 HZ3 LYS 51 HZ3 LYS 51 -2.629 -1.772 -11.746 420 H SER 52 H SER 52 -8.488 2.635 -16.943 421 HA SER 52 HA SER 52 -9.877 1.392 -19.242 422 HB2 SER 52 HB2 SER 52 -10.880 3.691 -19.370 423 HB3 SER 52 HB3 SER 52 -11.192 2.806 -17.867 424 HG SER 52 HG SER 52 -10.552 4.992 -17.508 425 H ARG 53 H ARG 53 -6.882 3.129 -18.627 426 HA ARG 53 HA ARG 53 -6.398 3.239 -21.530 427 HB2 ARG 53 HB2 ARG 53 -6.266 5.723 -19.745 428 HB3 ARG 53 HB3 ARG 53 -5.468 5.581 -21.299 429 HG2 ARG 53 HG2 ARG 53 -7.288 6.724 -21.946 430 HG3 ARG 53 HG3 ARG 53 -7.850 5.086 -22.256 431 HD2 ARG 53 HD2 ARG 53 -9.085 5.179 -20.032 432 HD3 ARG 53 HD3 ARG 53 -8.462 6.802 -19.800 433 HE ARG 53 HE ARG 53 -10.032 7.633 -21.210 434 HH11 ARG 53 HH11 ARG 53 -9.901 4.109 -21.809 435 HH12 ARG 53 HH12 ARG 53 -11.338 4.105 -22.769 436 HH21 ARG 53 HH21 ARG 53 -11.918 7.592 -22.502 437 HH22 ARG 53 HH22 ARG 53 -12.493 6.118 -23.179 438 H LYS 54 H LYS 54 -4.102 3.556 -21.987 439 HA LYS 54 HA LYS 54 -2.384 2.087 -20.257 440 HB2 LYS 54 HB2 LYS 54 -1.657 3.997 -22.525 441 HB3 LYS 54 HB3 LYS 54 -0.582 2.802 -21.809 442 HG2 LYS 54 HG2 LYS 54 -3.114 2.198 -23.398 443 HG3 LYS 54 HG3 LYS 54 -1.449 2.044 -23.958 444 HD2 LYS 54 HD2 LYS 54 -1.035 0.310 -22.196 445 HD3 LYS 54 HD3 LYS 54 -2.752 0.407 -21.736 446 HE2 LYS 54 HE2 LYS 54 -3.408 -0.219 -24.046 447 HE3 LYS 54 HE3 LYS 54 -1.705 -0.317 -24.508 448 HZ1 LYS 54 HZ1 LYS 54 -3.019 -2.037 -22.484 449 HZ2 LYS 54 HZ2 LYS 54 -2.604 -2.491 -23.991 450 HZ3 LYS 54 HZ3 LYS 54 -1.442 -2.125 -22.911 451 H THR 55 H THR 55 -3.213 5.491 -20.198 452 HA THR 55 HA THR 55 -1.021 6.439 -18.637 453 HB THR 55 HB THR 55 -2.948 8.202 -18.119 454 HG1 THR 55 HG1 THR 55 -4.785 7.394 -18.837 455 HG21 THR 55 HG21 THR 55 -1.936 7.701 -20.958 456 HG22 THR 55 HG22 THR 55 -2.597 9.228 -20.331 457 HG23 THR 55 HG23 THR 55 -1.077 8.593 -19.684 458 H SER 56 H SER 56 -3.045 3.954 -17.795 459 HA SER 56 HA SER 56 -3.731 2.983 -15.944 460 HB2 SER 56 HB2 SER 56 -1.888 4.821 -14.376 461 HB3 SER 56 HB3 SER 56 -2.596 3.295 -13.831 462 HG SER 56 HG SER 56 -0.825 3.622 -16.040 463 H THR 57 H THR 57 -5.078 5.380 -17.067 464 HA THR 57 HA THR 57 -6.532 6.694 -14.973 465 HB THR 57 HB THR 57 -7.461 5.986 -17.773 466 HG1 THR 57 HG1 THR 57 -5.826 8.170 -16.986 467 HG21 THR 57 HG21 THR 57 -8.089 8.349 -15.950 468 HG22 THR 57 HG22 THR 57 -8.587 8.219 -17.654 469 HG23 THR 57 HG23 THR 57 -9.206 7.068 -16.464 470 H ILE 58 H ILE 58 -8.709 6.120 -14.260 471 HA ILE 58 HA ILE 58 -9.460 3.286 -14.674 472 HB ILE 58 HB ILE 58 -9.224 4.834 -12.081 473 HG12 ILE 58 HG12 ILE 58 -8.053 2.219 -13.134 474 HG13 ILE 58 HG13 ILE 58 -7.196 3.740 -12.872 475 HG21 ILE 58 HG21 ILE 58 -11.399 3.737 -11.990 476 HG22 ILE 58 HG22 ILE 58 -10.688 2.218 -12.552 477 HG23 ILE 58 HG23 ILE 58 -10.292 2.877 -10.943 478 HD11 ILE 58 HD11 ILE 58 -7.677 3.514 -10.408 479 HD12 ILE 58 HD12 ILE 58 -8.294 1.874 -10.753 480 HD13 ILE 58 HD13 ILE 58 -6.607 2.273 -11.100 481 H GLU 59 H GLU 59 -11.522 2.849 -14.893 482 HA GLU 59 HA GLU 59 -13.578 5.011 -14.831 483 HB2 GLU 59 HB2 GLU 59 -13.242 2.480 -16.490 484 HB3 GLU 59 HB3 GLU 59 -14.848 3.130 -16.172 485 HG2 GLU 59 HG2 GLU 59 -12.631 4.810 -17.408 486 HG3 GLU 59 HG3 GLU 59 -13.747 3.838 -18.360 487 H GLU 60 H GLU 60 -14.369 4.898 -12.808 488 HA GLU 60 HA GLU 60 -14.452 2.371 -11.300 489 HB2 GLU 60 HB2 GLU 60 -15.299 5.225 -10.603 490 HB3 GLU 60 HB3 GLU 60 -15.373 3.836 -9.515 491 HG2 GLU 60 HG2 GLU 60 -12.865 3.536 -9.891 492 HG3 GLU 60 HG3 GLU 60 -12.876 5.100 -10.716 493 H LYS 61 H LYS 61 -15.931 1.062 -12.340 494 HA LYS 61 HA LYS 61 -18.582 2.173 -13.129 495 HB2 LYS 61 HB2 LYS 61 -17.274 0.952 -14.806 496 HB3 LYS 61 HB3 LYS 61 -17.161 -0.452 -13.738 497 HG2 LYS 61 HG2 LYS 61 -19.562 -0.818 -13.844 498 HG3 LYS 61 HG3 LYS 61 -19.794 0.652 -14.786 499 HD2 LYS 61 HD2 LYS 61 -18.025 -1.662 -15.712 500 HD3 LYS 61 HD3 LYS 61 -19.744 -1.622 -16.048 501 HE2 LYS 61 HE2 LYS 61 -17.733 0.496 -16.942 502 HE3 LYS 61 HE3 LYS 61 -18.383 -0.801 -17.949 503 HZ1 LYS 61 HZ1 LYS 61 -20.604 0.142 -17.642 504 HZ2 LYS 61 HZ2 LYS 61 -19.998 1.367 -16.747 505 HZ3 LYS 61 HZ3 LYS 61 -19.588 1.237 -18.328 506 H THR 62 H THR 62 -20.196 1.983 -11.577 507 HA THR 62 HA THR 62 -19.976 0.167 -9.363 508 HB THR 62 HB THR 62 -22.507 1.508 -10.386 509 HG1 THR 62 HG1 THR 62 -21.792 3.377 -9.665 510 HG21 THR 62 HG21 THR 62 -21.443 0.964 -7.572 511 HG22 THR 62 HG22 THR 62 -23.021 1.678 -7.981 512 HG23 THR 62 HG23 THR 62 -22.679 -0.010 -8.394 513 H VAL 63 H VAL 63 -20.636 -1.908 -9.178 514 HA VAL 63 HA VAL 63 -22.292 -3.096 -11.356 515 HB VAL 63 HB VAL 63 -20.740 -5.046 -11.373 516 HG11 VAL 63 HG11 VAL 63 -19.122 -4.126 -12.899 517 HG12 VAL 63 HG12 VAL 63 -20.659 -3.285 -13.142 518 HG13 VAL 63 HG13 VAL 63 -19.341 -2.492 -12.253 519 HG21 VAL 63 HG21 VAL 63 -18.430 -4.847 -10.610 520 HG22 VAL 63 HG22 VAL 63 -18.746 -3.234 -9.945 521 HG23 VAL 63 HG23 VAL 63 -19.524 -4.664 -9.234 522 H GLU 64 H GLU 64 -23.459 -4.907 -10.831 523 HA GLU 64 HA GLU 64 -23.719 -5.573 -7.921 524 HB2 GLU 64 HB2 GLU 64 -25.836 -5.002 -9.031 525 HB3 GLU 64 HB3 GLU 64 -25.526 -6.186 -10.306 526 HG2 GLU 64 HG2 GLU 64 -25.655 -8.017 -8.660 527 HG3 GLU 64 HG3 GLU 64 -25.816 -6.846 -7.347 528 H VAL 65 H VAL 65 -22.913 -7.590 -7.351 529 HA VAL 65 HA VAL 65 -21.460 -9.076 -9.485 530 HB VAL 65 HB VAL 65 -20.854 -9.041 -6.508 531 HG11 VAL 65 HG11 VAL 65 -19.264 -9.848 -8.989 532 HG12 VAL 65 HG12 VAL 65 -18.632 -9.868 -7.334 533 HG13 VAL 65 HG13 VAL 65 -19.952 -10.958 -7.784 534 HG21 VAL 65 HG21 VAL 65 -19.556 -7.301 -8.652 535 HG22 VAL 65 HG22 VAL 65 -20.534 -6.728 -7.291 536 HG23 VAL 65 HG23 VAL 65 -18.985 -7.504 -6.985 537 H LEU 66 H LEU 66 -22.572 -10.800 -10.093 538 HA LEU 66 HA LEU 66 -24.877 -11.674 -8.582 539 HB2 LEU 66 HB2 LEU 66 -23.562 -12.737 -11.124 540 HB3 LEU 66 HB3 LEU 66 -25.017 -13.412 -10.428 541 HG LEU 66 HG LEU 66 -25.667 -12.075 -12.237 542 HD11 LEU 66 HD11 LEU 66 -27.114 -11.954 -10.210 543 HD12 LEU 66 HD12 LEU 66 -26.318 -10.426 -9.761 544 HD13 LEU 66 HD13 LEU 66 -27.249 -10.536 -11.263 545 HD21 LEU 66 HD21 LEU 66 -25.205 -9.754 -12.576 546 HD22 LEU 66 HD22 LEU 66 -24.331 -9.620 -11.045 547 HD23 LEU 66 HD23 LEU 66 -23.668 -10.603 -12.376 548 H GLY 67 H GLY 67 -21.558 -12.874 -8.972 549 HA2 GLY 67 HA2 GLY 67 -21.287 -14.513 -6.841 550 HA3 GLY 67 HA3 GLY 67 -22.119 -15.543 -8.031 551 H MET 68 H MET 68 -19.820 -16.522 -7.613 552 HA MET 68 HA MET 68 -17.600 -15.464 -9.145 553 HB2 MET 68 HB2 MET 68 -18.226 -18.304 -8.246 554 HB3 MET 68 HB3 MET 68 -16.709 -17.778 -8.974 555 HG2 MET 68 HG2 MET 68 -17.831 -16.793 -6.327 556 HG3 MET 68 HG3 MET 68 -16.562 -17.991 -6.524 557 HE1 MET 68 HE1 MET 68 -13.497 -15.933 -7.754 558 HE2 MET 68 HE2 MET 68 -14.098 -17.519 -7.225 559 HE3 MET 68 HE3 MET 68 -14.633 -16.831 -8.777 560 H ALA 69 H ALA 69 -16.794 -16.294 -11.105 561 HA ALA 69 HA ALA 69 -18.713 -16.590 -13.233 562 HB1 ALA 69 HB1 ALA 69 -16.517 -15.401 -13.339 563 HB2 ALA 69 HB2 ALA 69 -15.696 -16.977 -13.167 564 HB3 ALA 69 HB3 ALA 69 -16.659 -16.605 -14.603 565 HA PRO 70 HA PRO 70 -18.911 -21.053 -13.994 566 HB2 PRO 70 HB2 PRO 70 -17.125 -20.560 -16.381 567 HB3 PRO 70 HB3 PRO 70 -18.553 -21.640 -16.246 568 HG2 PRO 70 HG2 PRO 70 -18.852 -19.213 -17.375 569 HG3 PRO 70 HG3 PRO 70 -20.050 -19.752 -16.149 570 HD2 PRO 70 HD2 PRO 70 -17.683 -17.923 -15.808 571 HD3 PRO 70 HD3 PRO 70 -19.346 -17.711 -15.178 572 H ASP 71 H ASP 71 -17.801 -22.945 -13.716 573 HA ASP 71 HA ASP 71 -15.620 -23.029 -12.011 574 HB2 ASP 71 HB2 ASP 71 -17.260 -24.888 -12.587 575 HB3 ASP 71 HB3 ASP 71 -16.339 -25.150 -14.077 576 H ASP 72 H ASP 72 -15.708 -23.146 -15.542 577 HA ASP 72 HA ASP 72 -12.948 -23.905 -15.939 578 HB2 ASP 72 HB2 ASP 72 -14.692 -24.360 -17.606 579 HB3 ASP 72 HB3 ASP 72 -14.962 -22.629 -17.829 580 H GLU 73 H GLU 73 -14.594 -20.774 -15.574 581 HA GLU 73 HA GLU 73 -12.273 -19.239 -16.525 582 HB2 GLU 73 HB2 GLU 73 -14.837 -18.437 -15.104 583 HB3 GLU 73 HB3 GLU 73 -13.565 -17.302 -15.553 584 HG2 GLU 73 HG2 GLU 73 -15.071 -19.061 -17.541 585 HG3 GLU 73 HG3 GLU 73 -15.480 -17.397 -17.157 586 H CYS 74 H CYS 74 -13.767 -20.249 -13.461 587 HA CYS 74 HA CYS 74 -11.820 -18.922 -11.816 588 HB2 CYS 74 HB2 CYS 74 -13.799 -21.133 -11.149 589 HB3 CYS 74 HB3 CYS 74 -12.879 -20.152 -9.989 590 HG CYS 74 HG CYS 74 -15.233 -19.346 -12.147 591 H LEU 75 H LEU 75 -11.316 -21.430 -13.835 592 HA LEU 75 HA LEU 75 -9.872 -23.238 -12.138 593 HB2 LEU 75 HB2 LEU 75 -11.313 -23.571 -14.331 594 HB3 LEU 75 HB3 LEU 75 -9.831 -23.151 -15.171 595 HG LEU 75 HG LEU 75 -8.752 -25.088 -14.418 596 HD11 LEU 75 HD11 LEU 75 -9.383 -25.324 -12.085 597 HD12 LEU 75 HD12 LEU 75 -11.097 -25.568 -12.534 598 HD13 LEU 75 HD13 LEU 75 -9.868 -26.796 -12.916 599 HD21 LEU 75 HD21 LEU 75 -11.656 -25.810 -15.038 600 HD22 LEU 75 HD22 LEU 75 -10.428 -25.351 -16.240 601 HD23 LEU 75 HD23 LEU 75 -10.235 -26.848 -15.315 602 H LYS 76 H LYS 76 -9.038 -20.250 -13.556 603 HA LYS 76 HA LYS 76 -6.163 -20.915 -13.245 604 HB2 LYS 76 HB2 LYS 76 -5.590 -19.679 -15.286 605 HB3 LYS 76 HB3 LYS 76 -6.483 -21.150 -15.614 606 HG2 LYS 76 HG2 LYS 76 -8.033 -18.551 -15.454 607 HG3 LYS 76 HG3 LYS 76 -6.981 -18.821 -16.839 608 HD2 LYS 76 HD2 LYS 76 -8.143 -20.884 -17.424 609 HD3 LYS 76 HD3 LYS 76 -9.198 -20.735 -16.004 610 HE2 LYS 76 HE2 LYS 76 -10.125 -18.643 -16.837 611 HE3 LYS 76 HE3 LYS 76 -9.010 -18.633 -18.210 612 HZ1 LYS 76 HZ1 LYS 76 -11.316 -19.445 -18.675 613 HZ2 LYS 76 HZ2 LYS 76 -10.131 -20.496 -19.140 614 HZ3 LYS 76 HZ3 LYS 76 -11.003 -20.776 -17.773 615 H ASP 77 H ASP 77 -8.702 -18.557 -12.956 616 HA ASP 77 HA ASP 77 -7.059 -16.836 -11.298 617 HB2 ASP 77 HB2 ASP 77 -6.478 -15.973 -13.532 618 HB3 ASP 77 HB3 ASP 77 -8.182 -15.860 -13.955 619 H MET 78 H MET 78 -8.577 -15.181 -10.235 620 HA MET 78 HA MET 78 -11.187 -16.526 -9.790 621 HB2 MET 78 HB2 MET 78 -9.802 -14.218 -8.374 622 HB3 MET 78 HB3 MET 78 -11.417 -14.797 -7.972 623 HG2 MET 78 HG2 MET 78 -8.857 -16.432 -7.795 624 HG3 MET 78 HG3 MET 78 -9.736 -15.702 -6.461 625 HE1 MET 78 HE1 MET 78 -8.948 -18.925 -8.043 626 HE2 MET 78 HE2 MET 78 -10.475 -19.784 -8.326 627 HE3 MET 78 HE3 MET 78 -10.022 -18.428 -9.371 628 H TYR 79 H TYR 79 -12.958 -15.930 -10.921 629 HA TYR 79 HA TYR 79 -13.186 -13.138 -11.935 630 HB2 TYR 79 HB2 TYR 79 -13.801 -15.800 -13.266 631 HB3 TYR 79 HB3 TYR 79 -14.457 -14.278 -13.830 632 HD1 TYR 79 HD1 TYR 79 -12.970 -12.516 -14.792 633 HD2 TYR 79 HD2 TYR 79 -11.597 -16.500 -13.899 634 HE1 TYR 79 HE1 TYR 79 -11.118 -12.220 -16.395 635 HE2 TYR 79 HE2 TYR 79 -9.775 -16.248 -15.546 636 HH TYR 79 HH TYR 79 -9.271 -13.221 -17.426 637 H VAL 80 H VAL 80 -15.334 -12.347 -12.059 638 HA VAL 80 HA VAL 80 -17.462 -13.927 -10.689 639 HB VAL 80 HB VAL 80 -18.109 -11.710 -9.654 640 HG11 VAL 80 HG11 VAL 80 -16.591 -11.925 -7.743 641 HG12 VAL 80 HG12 VAL 80 -17.142 -13.495 -8.311 642 HG13 VAL 80 HG13 VAL 80 -15.498 -12.948 -8.703 643 HG21 VAL 80 HG21 VAL 80 -15.211 -10.900 -10.189 644 HG22 VAL 80 HG22 VAL 80 -16.621 -10.214 -11.021 645 HG23 VAL 80 HG23 VAL 80 -16.432 -9.996 -9.277 646 H GLU 81 H GLU 81 -19.570 -13.474 -11.358 647 HA GLU 81 HA GLU 81 -19.818 -12.208 -14.044 648 HB2 GLU 81 HB2 GLU 81 -21.750 -13.768 -12.277 649 HB3 GLU 81 HB3 GLU 81 -22.254 -12.888 -13.731 650 HG2 GLU 81 HG2 GLU 81 -20.610 -14.211 -15.075 651 HG3 GLU 81 HG3 GLU 81 -20.228 -15.151 -13.634 652 H VAL 82 H VAL 82 -20.798 -10.210 -14.319 653 HA VAL 82 HA VAL 82 -21.725 -8.777 -11.917 654 HB VAL 82 HB VAL 82 -20.268 -6.848 -12.713 655 HG11 VAL 82 HG11 VAL 82 -18.330 -7.586 -11.479 656 HG12 VAL 82 HG12 VAL 82 -19.799 -8.186 -10.704 657 HG13 VAL 82 HG13 VAL 82 -18.790 -9.290 -11.662 658 HG21 VAL 82 HG21 VAL 82 -19.647 -7.788 -14.964 659 HG22 VAL 82 HG22 VAL 82 -18.270 -7.273 -13.987 660 HG23 VAL 82 HG23 VAL 82 -18.647 -9.002 -14.139 661 H ALA 83 H ALA 83 -23.238 -7.249 -12.291 662 HA ALA 83 HA ALA 83 -24.116 -6.812 -15.121 663 HB1 ALA 83 HB1 ALA 83 -26.306 -6.193 -14.144 664 HB2 ALA 83 HB2 ALA 83 -25.865 -7.874 -13.800 665 HB3 ALA 83 HB3 ALA 83 -25.702 -6.636 -12.531 666 H ASP 84 H ASP 84 -24.139 -4.748 -15.879 667 HA ASP 84 HA ASP 84 -22.512 -2.822 -14.412 668 HB2 ASP 84 HB2 ASP 84 -22.145 -3.302 -16.793 669 HB3 ASP 84 HB3 ASP 84 -23.774 -2.721 -17.171 670 H ILE 85 H ILE 85 -24.346 -2.798 -12.734 671 HA ILE 85 HA ILE 85 -26.744 -1.364 -13.230 672 HB ILE 85 HB ILE 85 -26.911 -1.064 -10.844 673 HG12 ILE 85 HG12 ILE 85 -24.078 -2.111 -10.600 674 HG13 ILE 85 HG13 ILE 85 -24.554 -0.435 -10.347 675 HG21 ILE 85 HG21 ILE 85 -25.754 -3.827 -11.392 676 HG22 ILE 85 HG22 ILE 85 -27.038 -3.377 -10.248 677 HG23 ILE 85 HG23 ILE 85 -27.339 -3.291 -11.979 678 HD11 ILE 85 HD11 ILE 85 -24.307 -1.567 -8.200 679 HD12 ILE 85 HD12 ILE 85 -26.006 -1.119 -8.456 680 HD13 ILE 85 HD13 ILE 85 -25.471 -2.802 -8.662 681 H GLY 86 H GLY 86 -23.562 -0.156 -13.306 682 HA2 GLY 86 HA2 GLY 86 -24.268 2.621 -12.624 683 HA3 GLY 86 HA3 GLY 86 -22.684 1.972 -13.066 684 H GLY 87 H GLY 87 -24.303 0.617 -15.485 685 HA2 GLY 87 HA2 GLY 87 -24.299 3.050 -17.246 686 HA3 GLY 87 HA3 GLY 87 -23.270 1.642 -17.526 687 H LYS 88 H LYS 88 -25.544 -0.261 -16.778 688 HA LYS 88 HA LYS 88 -27.315 0.108 -19.159 689 HB2 LYS 88 HB2 LYS 88 -25.666 -2.381 -18.519 690 HB3 LYS 88 HB3 LYS 88 -26.917 -2.297 -19.747 691 HG2 LYS 88 HG2 LYS 88 -24.346 -0.656 -19.791 692 HG3 LYS 88 HG3 LYS 88 -24.608 -2.175 -20.641 693 HD2 LYS 88 HD2 LYS 88 -26.444 -1.177 -21.956 694 HD3 LYS 88 HD3 LYS 88 -26.212 0.374 -21.124 695 HE2 LYS 88 HE2 LYS 88 -23.873 0.472 -21.954 696 HE3 LYS 88 HE3 LYS 88 -24.105 -1.066 -22.794 697 HZ1 LYS 88 HZ1 LYS 88 -25.807 0.008 -24.152 698 HZ2 LYS 88 HZ2 LYS 88 -25.593 1.431 -23.373 699 HZ3 LYS 88 HZ3 LYS 88 -24.396 0.808 -24.283 700 H ASP 89 H ASP 89 -26.611 -1.651 -16.171 701 HA ASP 89 HA ASP 89 -27.723 -2.739 -14.638 702 HB2 ASP 89 HB2 ASP 89 -28.937 -0.707 -14.279 703 HB3 ASP 89 HB3 ASP 89 -30.069 -1.070 -15.578 704 H ASP 90 H ASP 90 -29.322 -2.947 -17.786 705 HA ASP 90 HA ASP 90 -30.859 -5.301 -17.075 706 HB2 ASP 90 HB2 ASP 90 -31.671 -3.354 -18.422 707 HB3 ASP 90 HB3 ASP 90 -30.526 -3.792 -19.691 708 H ASP 91 H ASP 91 -27.645 -5.175 -17.819 709 HA ASP 91 HA ASP 91 -27.694 -7.781 -19.200 710 HB2 ASP 91 HB2 ASP 91 -27.427 -5.884 -20.910 711 HB3 ASP 91 HB3 ASP 91 -25.855 -5.580 -20.152 712 H VAL 92 H VAL 92 -25.515 -8.760 -19.218 713 HA VAL 92 HA VAL 92 -24.037 -8.216 -16.709 714 HB VAL 92 HB VAL 92 -25.914 -9.679 -16.214 715 HG11 VAL 92 HG11 VAL 92 -26.148 -11.934 -17.148 716 HG12 VAL 92 HG12 VAL 92 -26.329 -10.706 -18.400 717 HG13 VAL 92 HG13 VAL 92 -24.812 -11.626 -18.276 718 HG21 VAL 92 HG21 VAL 92 -23.326 -11.267 -16.121 719 HG22 VAL 92 HG22 VAL 92 -23.895 -10.077 -14.926 720 HG23 VAL 92 HG23 VAL 92 -24.794 -11.570 -15.172 721 H TYR 93 H TYR 93 -21.994 -9.164 -16.585 722 HA TYR 93 HA TYR 93 -20.644 -10.092 -19.050 723 HB2 TYR 93 HB2 TYR 93 -19.773 -7.715 -17.343 724 HB3 TYR 93 HB3 TYR 93 -18.977 -8.315 -18.785 725 HD1 TYR 93 HD2 TYR 93 -19.904 -7.866 -21.040 726 HD2 TYR 93 HD1 TYR 93 -21.774 -6.306 -17.476 727 HE1 TYR 93 HE2 TYR 93 -21.197 -6.268 -22.422 728 HE2 TYR 93 HE1 TYR 93 -23.087 -4.719 -18.849 729 HH TYR 93 HH TYR 93 -23.526 -3.934 -21.000 730 H THR 94 H THR 94 -18.085 -10.148 -18.099 731 HA THR 94 HA THR 94 -18.145 -11.326 -15.374 732 HB THR 94 HB THR 94 -16.493 -12.349 -17.715 733 HG1 THR 94 HG1 THR 94 -18.670 -12.891 -17.931 734 HG21 THR 94 HG21 THR 94 -16.857 -13.453 -14.890 735 HG22 THR 94 HG22 THR 94 -16.000 -14.269 -16.217 736 HG23 THR 94 HG23 THR 94 -15.370 -12.755 -15.563 737 H ALA 95 H ALA 95 -16.330 -10.810 -14.133 738 HA ALA 95 HA ALA 95 -14.301 -8.961 -15.271 739 HB1 ALA 95 HB1 ALA 95 -15.973 -7.515 -14.195 740 HB2 ALA 95 HB2 ALA 95 -15.906 -8.499 -12.716 741 HB3 ALA 95 HB3 ALA 95 -14.494 -7.544 -13.222 742 H LYS 96 H LYS 96 -12.315 -8.999 -14.095 743 HA LYS 96 HA LYS 96 -11.775 -11.520 -12.660 744 HB2 LYS 96 HB2 LYS 96 -9.476 -10.498 -12.394 745 HB3 LYS 96 HB3 LYS 96 -9.946 -10.976 -14.013 746 HG2 LYS 96 HG2 LYS 96 -10.398 -8.126 -13.183 747 HG3 LYS 96 HG3 LYS 96 -8.747 -8.644 -13.507 748 HD2 LYS 96 HD2 LYS 96 -9.163 -9.046 -15.797 749 HD3 LYS 96 HD3 LYS 96 -10.896 -9.207 -15.564 750 HE2 LYS 96 HE2 LYS 96 -10.615 -7.107 -16.633 751 HE3 LYS 96 HE3 LYS 96 -11.027 -6.772 -14.953 752 HZ1 LYS 96 HZ1 LYS 96 -8.443 -6.618 -14.714 753 HZ2 LYS 96 HZ2 LYS 96 -8.481 -6.345 -16.326 754 HZ3 LYS 96 HZ3 LYS 96 -9.310 -5.361 -15.289 755 H LEU 97 H LEU 97 -11.728 -11.694 -10.464 756 HA LEU 97 HA LEU 97 -13.035 -9.685 -8.903 757 HB2 LEU 97 HB2 LEU 97 -12.986 -12.118 -8.360 758 HB3 LEU 97 HB3 LEU 97 -11.255 -12.000 -8.024 759 HG LEU 97 HG LEU 97 -11.701 -10.473 -6.122 760 HD11 LEU 97 HD11 LEU 97 -13.730 -9.313 -6.810 761 HD12 LEU 97 HD12 LEU 97 -14.631 -10.844 -6.908 762 HD13 LEU 97 HD13 LEU 97 -14.102 -10.211 -5.342 763 HD21 LEU 97 HD21 LEU 97 -12.718 -12.128 -4.649 764 HD22 LEU 97 HD22 LEU 97 -13.410 -12.984 -6.047 765 HD23 LEU 97 HD23 LEU 97 -11.647 -12.925 -5.804 766 H SER 98 H SER 98 -9.658 -10.357 -9.662 767 HA SER 98 HA SER 98 -8.221 -8.773 -7.944 768 HB2 SER 98 HB2 SER 98 -7.777 -9.059 -10.936 769 HB3 SER 98 HB3 SER 98 -6.549 -8.891 -9.670 770 HG SER 98 HG SER 98 -6.929 -11.092 -10.443 771 H ASP 99 H ASP 99 -10.479 -7.624 -10.409 772 HA ASP 99 HA ASP 99 -9.266 -4.911 -10.283 773 HB2 ASP 99 HB2 ASP 99 -9.318 -6.278 -12.444 774 HB3 ASP 99 HB3 ASP 99 -11.067 -6.010 -12.455 775 H ILE 100 H ILE 100 -11.399 -6.363 -8.577 776 HA ILE 100 HA ILE 100 -13.444 -4.194 -8.681 777 HB ILE 100 HB ILE 100 -13.691 -7.149 -8.644 778 HG12 ILE 100 HG12 ILE 100 -15.574 -4.897 -9.458 779 HG13 ILE 100 HG13 ILE 100 -14.316 -5.583 -10.508 780 HG21 ILE 100 HG21 ILE 100 -15.804 -7.296 -7.471 781 HG22 ILE 100 HG22 ILE 100 -14.570 -6.729 -6.365 782 HG23 ILE 100 HG23 ILE 100 -15.745 -5.574 -7.047 783 HD11 ILE 100 HD11 ILE 100 -16.388 -6.526 -11.143 784 HD12 ILE 100 HD12 ILE 100 -15.473 -7.807 -10.316 785 HD13 ILE 100 HD13 ILE 100 -16.811 -6.965 -9.480 786 H GLU 101 H GLU 101 -14.333 -3.533 -6.848 787 HA GLU 101 HA GLU 101 -12.955 -4.081 -4.261 788 HB2 GLU 101 HB2 GLU 101 -12.292 -1.899 -5.136 789 HB3 GLU 101 HB3 GLU 101 -13.980 -1.468 -5.458 790 HG2 GLU 101 HG2 GLU 101 -14.495 -1.400 -3.092 791 HG3 GLU 101 HG3 GLU 101 -12.930 -2.104 -2.681 792 H ALA 102 H ALA 102 -14.405 -4.995 -2.878 793 HA ALA 102 HA ALA 102 -17.208 -5.244 -3.704 794 HB1 ALA 102 HB1 ALA 102 -15.817 -6.224 -1.169 795 HB2 ALA 102 HB2 ALA 102 -17.398 -6.736 -1.800 796 HB3 ALA 102 HB3 ALA 102 -15.920 -7.118 -2.703 797 H ILE 103 H ILE 103 -18.934 -4.246 -2.800 798 HA ILE 103 HA ILE 103 -18.539 -2.315 -0.556 799 HB ILE 103 HB ILE 103 -19.874 -1.945 -3.251 800 HG12 ILE 103 HG12 ILE 103 -17.699 -0.292 -1.883 801 HG13 ILE 103 HG13 ILE 103 -17.377 -1.554 -3.071 802 HG21 ILE 103 HG21 ILE 103 -20.635 0.293 -2.522 803 HG22 ILE 103 HG22 ILE 103 -21.385 -0.959 -1.569 804 HG23 ILE 103 HG23 ILE 103 -20.032 -0.029 -0.882 805 HD11 ILE 103 HD11 ILE 103 -18.737 -0.354 -4.744 806 HD12 ILE 103 HD12 ILE 103 -18.869 1.017 -3.608 807 HD13 ILE 103 HD13 ILE 103 -17.279 0.514 -4.197 808 H ASP 104 H ASP 104 -20.253 -2.144 0.848 809 HA ASP 104 HA ASP 104 -22.025 -2.787 2.048 810 HB2 ASP 104 HB2 ASP 104 -23.035 -1.369 0.308 811 HB3 ASP 104 HB3 ASP 104 -23.407 -2.803 -0.650 812 H VAL 105 H VAL 105 -20.323 -4.931 1.549 813 HA VAL 105 HA VAL 105 -22.241 -7.215 1.576 814 HB VAL 105 HB VAL 105 -20.550 -7.001 -0.345 815 HG11 VAL 105 HG11 VAL 105 -18.319 -7.879 -0.018 816 HG12 VAL 105 HG12 VAL 105 -18.537 -6.402 0.930 817 HG13 VAL 105 HG13 VAL 105 -18.577 -7.988 1.728 818 HG21 VAL 105 HG21 VAL 105 -20.599 -9.594 1.191 819 HG22 VAL 105 HG22 VAL 105 -21.894 -8.982 0.161 820 HG23 VAL 105 HG23 VAL 105 -20.320 -9.347 -0.549 821 H ASP 106 H ASP 106 -21.427 -9.085 2.955 822 HA ASP 106 HA ASP 106 -21.101 -8.162 5.639 823 HB2 ASP 106 HB2 ASP 106 -22.210 -10.284 5.077 824 HB3 ASP 106 HB3 ASP 106 -20.667 -10.933 4.481 825 H ASP 107 H ASP 107 -19.381 -8.520 7.074 826 HA ASP 107 HA ASP 107 -16.866 -7.588 6.218 827 HB2 ASP 107 HB2 ASP 107 -17.683 -7.363 8.512 828 HB3 ASP 107 HB3 ASP 107 -17.660 -9.115 8.725 829 H ASP 108 H ASP 108 -17.976 -11.005 6.706 830 HA ASP 108 HA ASP 108 -15.266 -11.993 6.433 831 HB2 ASP 108 HB2 ASP 108 -17.203 -13.127 7.651 832 HB3 ASP 108 HB3 ASP 108 -17.825 -13.578 6.056 833 H THR 109 H THR 109 -17.856 -11.189 4.187 834 HA THR 109 HA THR 109 -16.684 -12.621 1.904 835 HB THR 109 HB THR 109 -18.841 -10.454 2.077 836 HG1 THR 109 HG1 THR 109 -19.272 -12.633 2.903 837 HG21 THR 109 HG21 THR 109 -19.344 -11.391 -0.281 838 HG22 THR 109 HG22 THR 109 -17.995 -10.252 -0.115 839 HG23 THR 109 HG23 THR 109 -17.668 -11.982 -0.257 840 H GLN 110 H GLN 110 -16.848 -9.219 3.133 841 HA GLN 110 HA GLN 110 -15.275 -8.096 1.102 842 HB2 GLN 110 HB2 GLN 110 -16.693 -7.041 3.070 843 HB3 GLN 110 HB3 GLN 110 -15.175 -7.073 3.960 844 HG2 GLN 110 HG2 GLN 110 -15.721 -5.683 1.294 845 HG3 GLN 110 HG3 GLN 110 -15.614 -4.898 2.860 846 HE21 GLN 110 HE22 GLN 110 -13.816 -5.813 0.087 847 HE22 GLN 110 HE21 GLN 110 -12.215 -5.587 0.741 848 H GLU 111 H GLU 111 -14.252 -9.466 4.299 849 HA GLU 111 HA GLU 111 -11.489 -8.960 3.947 850 HB2 GLU 111 HB2 GLU 111 -13.041 -10.978 5.607 851 HB3 GLU 111 HB3 GLU 111 -11.286 -10.877 5.668 852 HG2 GLU 111 HG2 GLU 111 -13.084 -8.475 6.233 853 HG3 GLU 111 HG3 GLU 111 -12.532 -9.598 7.470 854 H ALA 112 H ALA 112 -13.489 -11.747 2.808 855 HA ALA 112 HA ALA 112 -11.205 -13.349 2.087 856 HB1 ALA 112 HB1 ALA 112 -13.476 -14.285 2.370 857 HB2 ALA 112 HB2 ALA 112 -14.033 -13.381 0.939 858 HB3 ALA 112 HB3 ALA 112 -12.802 -14.652 0.775 859 H ILE 113 H ILE 113 -13.198 -10.936 0.337 860 HA ILE 113 HA ILE 113 -11.821 -11.229 -2.178 861 HB ILE 113 HB ILE 113 -13.564 -9.028 -1.000 862 HG12 ILE 113 HG12 ILE 113 -14.196 -11.143 -3.120 863 HG13 ILE 113 HG13 ILE 113 -14.560 -11.357 -1.420 864 HG21 ILE 113 HG21 ILE 113 -12.484 -9.332 -3.837 865 HG22 ILE 113 HG22 ILE 113 -13.783 -8.210 -3.377 866 HG23 ILE 113 HG23 ILE 113 -12.169 -7.998 -2.715 867 HD11 ILE 113 HD11 ILE 113 -15.965 -9.284 -1.476 868 HD12 ILE 113 HD12 ILE 113 -15.762 -9.276 -3.251 869 HD13 ILE 113 HD13 ILE 113 -16.560 -10.641 -2.454 870 H ALA 114 H ALA 114 -11.398 -9.006 0.643 871 HA ALA 114 HA ALA 114 -9.244 -7.506 -0.420 872 HB1 ALA 114 HB1 ALA 114 -8.721 -6.975 1.912 873 HB2 ALA 114 HB2 ALA 114 -10.475 -6.901 1.650 874 HB3 ALA 114 HB3 ALA 114 -9.752 -8.300 2.478 875 H ASP 115 H ASP 115 -9.302 -10.685 1.246 876 HA ASP 115 HA ASP 115 -6.449 -10.909 1.393 877 HB2 ASP 115 HB2 ASP 115 -8.012 -12.198 2.823 878 HB3 ASP 115 HB3 ASP 115 -8.498 -13.145 1.410 879 H TRP 116 H TRP 116 -8.828 -11.951 -1.121 880 HA TRP 116 HA TRP 116 -6.875 -13.200 -2.818 881 HB2 TRP 116 HB2 TRP 116 -9.204 -13.527 -3.344 882 HB3 TRP 116 HB3 TRP 116 -9.491 -11.791 -3.466 883 HD1 TRP 116 HD1 TRP 116 -9.200 -10.707 -5.772 884 HE1 TRP 116 HE1 TRP 116 -8.117 -11.332 -8.024 885 HE3 TRP 116 HE3 TRP 116 -7.186 -15.240 -4.500 886 HZ2 TRP 116 HZ2 TRP 116 -6.537 -13.464 -9.088 887 HZ3 TRP 116 HZ3 TRP 116 -5.905 -16.554 -6.152 888 HH2 TRP 116 HH2 TRP 116 -5.560 -15.672 -8.460 889 H LEU 117 H LEU 117 -7.998 -9.782 -2.523 890 HA LEU 117 HA LEU 117 -6.380 -8.808 -4.647 891 HB2 LEU 117 HB2 LEU 117 -7.512 -7.442 -2.179 892 HB3 LEU 117 HB3 LEU 117 -6.651 -6.570 -3.436 893 HG LEU 117 HG LEU 117 -9.097 -8.276 -4.072 894 HD11 LEU 117 HD11 LEU 117 -10.422 -6.198 -4.004 895 HD12 LEU 117 HD12 LEU 117 -9.780 -6.615 -2.413 896 HD13 LEU 117 HD13 LEU 117 -9.018 -5.315 -3.358 897 HD21 LEU 117 HD21 LEU 117 -7.805 -5.944 -5.549 898 HD22 LEU 117 HD22 LEU 117 -7.666 -7.654 -5.997 899 HD23 LEU 117 HD23 LEU 117 -9.241 -6.855 -6.062 900 H TYR 118 H TYR 118 -5.634 -9.144 -1.123 901 HA TYR 118 HA TYR 118 -3.007 -8.058 -1.293 902 HB2 TYR 118 HB2 TYR 118 -4.058 -10.254 0.533 903 HB3 TYR 118 HB3 TYR 118 -2.559 -9.382 0.763 904 HD1 TYR 118 HD2 TYR 118 -3.684 -6.513 0.114 905 HD2 TYR 118 HD1 TYR 118 -5.004 -9.754 2.648 906 HE1 TYR 118 HE2 TYR 118 -4.811 -4.895 1.590 907 HE2 TYR 118 HE1 TYR 118 -6.162 -8.141 4.114 908 HH TYR 118 HH TYR 118 -6.077 -4.596 3.538 909 H TRP 119 H TRP 119 -4.149 -11.476 -1.653 910 HA TRP 119 HA TRP 119 -1.603 -12.636 -2.123 911 HB2 TRP 119 HB2 TRP 119 -3.465 -14.057 -1.697 912 HB3 TRP 119 HB3 TRP 119 -4.447 -13.312 -2.949 913 HD1 TRP 119 HD1 TRP 119 -4.197 -14.099 -5.402 914 HE1 TRP 119 HE1 TRP 119 -2.958 -15.982 -6.579 915 HE3 TRP 119 HE3 TRP 119 -1.323 -15.691 -1.480 916 HZ2 TRP 119 HZ2 TRP 119 -0.814 -17.855 -5.934 917 HZ3 TRP 119 HZ3 TRP 119 0.334 -17.511 -1.798 918 HH2 TRP 119 HH2 TRP 119 0.617 -18.571 -4.029 919 H LEU 120 H LEU 120 -3.898 -11.154 -4.432 920 HA LEU 120 HA LEU 120 -2.352 -11.815 -6.719 921 HB2 LEU 120 HB2 LEU 120 -4.795 -11.303 -6.604 922 HB3 LEU 120 HB3 LEU 120 -4.437 -9.613 -6.307 923 HG LEU 120 HG LEU 120 -5.156 -10.280 -8.609 924 HD11 LEU 120 HD11 LEU 120 -2.457 -8.892 -8.645 925 HD12 LEU 120 HD12 LEU 120 -3.774 -8.752 -9.815 926 HD13 LEU 120 HD13 LEU 120 -3.992 -8.126 -8.175 927 HD21 LEU 120 HD21 LEU 120 -3.639 -11.293 -10.179 928 HD22 LEU 120 HD22 LEU 120 -2.361 -11.405 -8.952 929 HD23 LEU 120 HD23 LEU 120 -3.846 -12.375 -8.792 930 H ALA 121 H ALA 121 -2.551 -8.855 -4.689 931 HA ALA 121 HA ALA 121 -0.681 -7.276 -6.104 932 HB1 ALA 121 HB1 ALA 121 -2.202 -6.406 -4.376 933 HB2 ALA 121 HB2 ALA 121 -1.368 -7.359 -3.132 934 HB3 ALA 121 HB3 ALA 121 -0.514 -6.034 -3.956 935 H ARG 122 H ARG 122 -0.172 -9.652 -3.438 936 HA ARG 122 HA ARG 122 2.636 -9.337 -3.236 937 HB2 ARG 122 HB2 ARG 122 1.271 -10.524 -1.575 938 HB3 ARG 122 HB3 ARG 122 0.854 -11.760 -2.747 939 HG2 ARG 122 HG2 ARG 122 2.461 -12.628 -1.214 940 HG3 ARG 122 HG3 ARG 122 3.216 -12.543 -2.798 941 HD2 ARG 122 HD2 ARG 122 3.559 -10.392 -0.679 942 HD3 ARG 122 HD3 ARG 122 4.596 -11.830 -0.753 943 HE ARG 122 HE ARG 122 4.654 -10.704 -3.310 944 HH11 ARG 122 HH11 ARG 122 5.689 -9.826 -0.004 945 HH12 ARG 122 HH12 ARG 122 6.703 -8.522 -0.555 946 HH21 ARG 122 HH21 ARG 122 6.231 -9.175 -4.003 947 HH22 ARG 122 HH22 ARG 122 7.175 -8.305 -2.848 948 H GLY 123 H GLY 123 0.647 -11.035 -5.601 949 HA2 GLY 123 HA2 GLY 123 1.996 -10.811 -7.753 950 HA3 GLY 123 HA3 GLY 123 3.049 -12.044 -7.053 951 H TYR 124 H TYR 124 0.961 -11.835 -9.341 952 HA TYR 124 HA TYR 124 -0.820 -14.103 -8.937 953 HB2 TYR 124 HB2 TYR 124 -1.344 -12.533 -10.707 954 HB3 TYR 124 HB3 TYR 124 0.248 -12.707 -11.421 955 HD1 TYR 124 HD1 TYR 124 -2.805 -14.783 -10.571 956 HD2 TYR 124 HD2 TYR 124 0.537 -14.164 -13.234 957 HE1 TYR 124 HE1 TYR 124 -3.637 -16.602 -12.037 958 HE2 TYR 124 HE2 TYR 124 -0.292 -15.963 -14.707 959 HH TYR 124 HH TYR 124 -1.962 -17.510 -15.099 960 H LYS 125 H LYS 125 0.238 -15.934 -8.219 961 HA LYS 125 HA LYS 125 2.518 -16.976 -9.817 962 HB2 LYS 125 HB2 LYS 125 3.721 -17.440 -7.728 963 HB3 LYS 125 HB3 LYS 125 3.389 -15.734 -7.976 964 HG2 LYS 125 HG2 LYS 125 1.248 -16.274 -6.436 965 HG3 LYS 125 HG3 LYS 125 2.256 -17.621 -5.903 966 HD2 LYS 125 HD2 LYS 125 4.037 -16.081 -5.246 967 HD3 LYS 125 HD3 LYS 125 3.194 -14.713 -5.972 968 HE2 LYS 125 HE2 LYS 125 2.286 -16.271 -3.520 969 HE3 LYS 125 HE3 LYS 125 3.009 -14.662 -3.548 970 HZ1 LYS 125 HZ1 LYS 125 0.994 -14.059 -5.020 971 HZ2 LYS 125 HZ2 LYS 125 0.347 -15.460 -4.505 972 HZ3 LYS 125 HZ3 LYS 125 0.702 -14.308 -3.413 973 H PHE 126 H PHE 126 -0.531 -17.742 -8.811 974 HA PHE 126 HA PHE 126 0.068 -20.655 -9.042 975 HB2 PHE 126 HB2 PHE 126 -2.237 -19.343 -7.549 976 HB3 PHE 126 HB3 PHE 126 -2.181 -21.033 -8.009 977 HD1 PHE 126 HD1 PHE 126 1.064 -20.998 -7.134 978 HD2 PHE 126 HD2 PHE 126 -2.770 -20.241 -5.298 979 HE1 PHE 126 HE1 PHE 126 1.995 -21.607 -4.936 980 HE2 PHE 126 HE2 PHE 126 -1.822 -20.859 -3.092 981 HZ PHE 126 HZ PHE 126 0.560 -21.548 -2.902 Start of MODEL 14 1 H1 MET 1 H1 MET 1 9.978 -4.591 -0.221 2 H2 MET 1 H2 MET 1 10.693 -4.568 -1.703 3 H3 MET 1 H3 MET 1 9.328 -3.700 -1.426 4 HA MET 1 HA MET 1 8.821 -5.631 -2.697 5 HB2 MET 1 HB2 MET 1 9.133 -7.840 -1.917 6 HB3 MET 1 HB3 MET 1 10.686 -7.042 -1.793 7 HG2 MET 1 HG2 MET 1 8.773 -7.599 0.520 8 HG3 MET 1 HG3 MET 1 10.185 -8.548 0.093 9 HE1 MET 1 HE1 MET 1 11.031 -8.520 2.558 10 HE2 MET 1 HE2 MET 1 11.196 -7.041 3.529 11 HE3 MET 1 HE3 MET 1 9.587 -7.583 3.002 12 H ALA 2 H ALA 2 6.801 -6.962 -2.304 13 HA ALA 2 HA ALA 2 4.910 -5.570 -0.605 14 HB1 ALA 2 HB1 ALA 2 3.365 -7.361 -1.329 15 HB2 ALA 2 HB2 ALA 2 4.227 -6.675 -2.717 16 HB3 ALA 2 HB3 ALA 2 4.714 -8.255 -2.056 17 H SER 3 H SER 3 4.258 -6.115 1.443 18 HA SER 3 HA SER 3 5.405 -8.543 2.733 19 HB2 SER 3 HB2 SER 3 5.267 -5.737 3.889 20 HB3 SER 3 HB3 SER 3 5.931 -7.175 4.685 21 HG SER 3 HG SER 3 7.528 -5.829 3.695 22 H VAL 4 H VAL 4 2.541 -7.402 1.789 23 HA VAL 4 HA VAL 4 0.877 -7.225 4.037 24 HB VAL 4 HB VAL 4 -0.904 -7.993 2.326 25 HG11 VAL 4 HG11 VAL 4 -0.544 -5.664 3.008 26 HG12 VAL 4 HG12 VAL 4 0.764 -5.489 1.819 27 HG13 VAL 4 HG13 VAL 4 -0.908 -5.761 1.280 28 HG21 VAL 4 HG21 VAL 4 -0.381 -7.870 -0.005 29 HG22 VAL 4 HG22 VAL 4 1.297 -7.387 0.290 30 HG23 VAL 4 HG23 VAL 4 0.754 -9.029 0.686 31 H GLU 5 H GLU 5 0.931 -8.590 5.559 32 HA GLU 5 HA GLU 5 0.880 -10.441 6.838 33 HB2 GLU 5 HB2 GLU 5 -0.904 -11.547 4.633 34 HB3 GLU 5 HB3 GLU 5 -0.775 -12.165 6.272 35 HG2 GLU 5 HG2 GLU 5 -1.878 -9.463 5.436 36 HG3 GLU 5 HG3 GLU 5 -2.779 -10.834 6.068 37 H ARG 6 H ARG 6 3.113 -10.182 5.075 38 HA ARG 6 HA ARG 6 3.861 -12.829 4.113 39 HB2 ARG 6 HB2 ARG 6 4.510 -10.719 3.022 40 HB3 ARG 6 HB3 ARG 6 5.478 -10.262 4.432 41 HG2 ARG 6 HG2 ARG 6 7.042 -12.082 4.022 42 HG3 ARG 6 HG3 ARG 6 5.973 -12.785 2.793 43 HD2 ARG 6 HD2 ARG 6 6.197 -10.707 1.443 44 HD3 ARG 6 HD3 ARG 6 7.356 -10.068 2.625 45 HE ARG 6 HE ARG 6 8.513 -12.416 1.997 46 HH11 ARG 6 HH11 ARG 6 7.249 -9.803 -0.069 47 HH12 ARG 6 HH12 ARG 6 8.194 -10.267 -1.448 48 HH21 ARG 6 HH21 ARG 6 9.859 -12.930 0.206 49 HH22 ARG 6 HH22 ARG 6 9.780 -12.012 -1.247 50 H ASP 7 H ASP 7 3.332 -13.854 6.207 51 HA ASP 7 HA ASP 7 5.754 -14.134 7.875 52 HB2 ASP 7 HB2 ASP 7 4.622 -12.620 9.275 53 HB3 ASP 7 HB3 ASP 7 3.036 -13.240 8.848 54 H GLU 8 H GLU 8 5.985 -16.213 8.643 55 HA GLU 8 HA GLU 8 5.018 -18.172 6.924 56 HB2 GLU 8 HB2 GLU 8 6.229 -19.763 8.281 57 HB3 GLU 8 HB3 GLU 8 7.167 -18.291 8.038 58 HG2 GLU 8 HG2 GLU 8 6.506 -17.527 10.340 59 HG3 GLU 8 HG3 GLU 8 5.641 -19.047 10.572 60 H THR 9 H THR 9 3.588 -17.161 10.031 61 HA THR 9 HA THR 9 2.056 -19.530 10.480 62 HB THR 9 HB THR 9 0.915 -16.834 11.163 63 HG1 THR 9 HG1 THR 9 2.894 -16.315 11.609 64 HG21 THR 9 HG21 THR 9 1.384 -19.361 12.806 65 HG22 THR 9 HG22 THR 9 0.464 -17.924 13.314 66 HG23 THR 9 HG23 THR 9 -0.128 -18.929 11.980 67 H ARG 10 H ARG 10 1.424 -16.569 8.534 68 HA ARG 10 HA ARG 10 -1.221 -17.487 7.740 69 HB2 ARG 10 HB2 ARG 10 0.540 -15.390 6.388 70 HB3 ARG 10 HB3 ARG 10 -1.153 -15.724 6.063 71 HG2 ARG 10 HG2 ARG 10 -1.370 -13.911 7.418 72 HG3 ARG 10 HG3 ARG 10 -1.545 -15.189 8.610 73 HD2 ARG 10 HD2 ARG 10 0.667 -14.852 9.450 74 HD3 ARG 10 HD3 ARG 10 1.163 -13.950 8.003 75 HE ARG 10 HE ARG 10 -0.658 -12.263 8.799 76 HH11 ARG 10 HH11 ARG 10 1.698 -13.902 10.965 77 HH12 ARG 10 HH12 ARG 10 1.544 -12.672 12.175 78 HH21 ARG 10 HH21 ARG 10 -0.704 -10.712 10.199 79 HH22 ARG 10 HH22 ARG 10 0.159 -10.736 11.727 80 H GLU 11 H GLU 11 2.094 -17.689 6.383 81 HA GLU 11 HA GLU 11 1.422 -18.665 3.857 82 HB2 GLU 11 HB2 GLU 11 3.727 -17.986 4.976 83 HB3 GLU 11 HB3 GLU 11 3.821 -19.688 5.413 84 HG2 GLU 11 HG2 GLU 11 4.946 -19.694 3.422 85 HG3 GLU 11 HG3 GLU 11 3.327 -20.097 2.846 86 H HIS 12 H HIS 12 2.116 -20.536 6.833 87 HA HIS 12 HA HIS 12 1.470 -23.098 5.712 88 HB2 HIS 12 HB2 HIS 12 1.448 -22.146 8.612 89 HB3 HIS 12 HB3 HIS 12 1.272 -23.823 8.104 90 HD1 HIS 12 HD1 HIS 12 3.590 -24.506 6.310 91 HD2 HIS 12 HD2 HIS 12 3.842 -21.693 9.431 92 HE1 HIS 12 HE1 HIS 12 6.058 -24.312 6.894 93 H ARG 13 H ARG 13 -0.505 -20.816 7.746 94 HA ARG 13 HA ARG 13 -2.750 -22.544 7.823 95 HB2 ARG 13 HB2 ARG 13 -2.526 -19.522 8.100 96 HB3 ARG 13 HB3 ARG 13 -4.045 -20.394 8.319 97 HG2 ARG 13 HG2 ARG 13 -3.126 -21.709 10.162 98 HG3 ARG 13 HG3 ARG 13 -1.520 -21.025 9.917 99 HD2 ARG 13 HD2 ARG 13 -2.537 -19.910 11.791 100 HD3 ARG 13 HD3 ARG 13 -2.396 -18.763 10.447 101 HE ARG 13 HE ARG 13 -4.965 -20.123 10.531 102 HH11 ARG 13 HH11 ARG 13 -3.173 -17.420 11.978 103 HH12 ARG 13 HH12 ARG 13 -4.583 -16.513 12.377 104 HH21 ARG 13 HH21 ARG 13 -6.846 -18.908 11.052 105 HH22 ARG 13 HH22 ARG 13 -6.715 -17.387 11.845 106 H ILE 14 H ILE 14 -2.176 -19.830 5.481 107 HA ILE 14 HA ILE 14 -4.640 -20.200 4.187 108 HB ILE 14 HB ILE 14 -2.977 -18.237 4.095 109 HG12 ILE 14 HG12 ILE 14 -4.385 -19.102 1.550 110 HG13 ILE 14 HG13 ILE 14 -5.144 -18.364 2.973 111 HG21 ILE 14 HG21 ILE 14 -1.418 -18.075 2.271 112 HG22 ILE 14 HG22 ILE 14 -1.027 -19.540 3.156 113 HG23 ILE 14 HG23 ILE 14 -1.909 -19.651 1.617 114 HD11 ILE 14 HD11 ILE 14 -4.838 -16.627 1.379 115 HD12 ILE 14 HD12 ILE 14 -3.654 -16.352 2.665 116 HD13 ILE 14 HD13 ILE 14 -3.142 -17.050 1.107 117 H GLU 15 H GLU 15 -1.429 -21.697 3.567 118 HA GLU 15 HA GLU 15 -2.235 -23.179 1.311 119 HB2 GLU 15 HB2 GLU 15 0.084 -22.884 1.867 120 HB3 GLU 15 HB3 GLU 15 -0.096 -23.771 3.392 121 HG2 GLU 15 HG2 GLU 15 -0.358 -25.843 2.315 122 HG3 GLU 15 HG3 GLU 15 -0.856 -25.110 0.787 123 H THR 16 H THR 16 -2.154 -24.205 4.778 124 HA THR 16 HA THR 16 -3.296 -26.733 4.133 125 HB THR 16 HB THR 16 -3.376 -27.003 6.635 126 HG1 THR 16 HG1 THR 16 -2.072 -24.484 6.629 127 HG21 THR 16 HG21 THR 16 -1.414 -27.682 5.329 128 HG22 THR 16 HG22 THR 16 -0.732 -26.048 5.444 129 HG23 THR 16 HG23 THR 16 -0.933 -27.040 6.906 130 H GLU 17 H GLU 17 -4.939 -23.791 4.254 131 HA GLU 17 HA GLU 17 -7.497 -25.218 4.878 132 HB2 GLU 17 HB2 GLU 17 -6.728 -22.287 5.080 133 HB3 GLU 17 HB3 GLU 17 -8.373 -22.875 5.243 134 HG2 GLU 17 HG2 GLU 17 -6.044 -23.654 7.052 135 HG3 GLU 17 HG3 GLU 17 -7.302 -22.486 7.430 136 H ILE 18 H ILE 18 -5.830 -23.342 2.322 137 HA ILE 18 HA ILE 18 -8.374 -23.408 0.770 138 HB ILE 18 HB ILE 18 -6.066 -21.445 0.646 139 HG12 ILE 18 HG12 ILE 18 -8.796 -21.256 1.996 140 HG13 ILE 18 HG13 ILE 18 -7.214 -21.222 2.778 141 HG21 ILE 18 HG21 ILE 18 -8.793 -21.389 -0.689 142 HG22 ILE 18 HG22 ILE 18 -7.592 -20.073 -0.744 143 HG23 ILE 18 HG23 ILE 18 -7.245 -21.602 -1.512 144 HD11 ILE 18 HD11 ILE 18 -8.487 -19.045 1.127 145 HD12 ILE 18 HD12 ILE 18 -7.907 -18.999 2.801 146 HD13 ILE 18 HD13 ILE 18 -6.746 -19.080 1.461 147 H ILE 19 H ILE 19 -4.902 -24.242 0.528 148 HA ILE 19 HA ILE 19 -5.483 -25.513 -2.091 149 HB ILE 19 HB ILE 19 -3.391 -24.660 -3.007 150 HG12 ILE 19 HG12 ILE 19 -2.434 -23.936 -0.737 151 HG13 ILE 19 HG13 ILE 19 -2.050 -23.028 -2.193 152 HG21 ILE 19 HG21 ILE 19 -5.455 -22.504 -2.444 153 HG22 ILE 19 HG22 ILE 19 -4.258 -22.502 -3.746 154 HG23 ILE 19 HG23 ILE 19 -5.535 -23.732 -3.707 155 HD11 ILE 19 HD11 ILE 19 -3.612 -21.241 -1.579 156 HD12 ILE 19 HD12 ILE 19 -4.070 -22.139 -0.114 157 HD13 ILE 19 HD13 ILE 19 -2.422 -21.526 -0.309 158 H VAL 20 H VAL 20 -5.452 -26.666 0.288 159 HA VAL 20 HA VAL 20 -3.260 -27.611 1.503 160 HB VAL 20 HB VAL 20 -5.653 -29.435 1.090 161 HG11 VAL 20 HG11 VAL 20 -3.847 -30.217 2.586 162 HG12 VAL 20 HG12 VAL 20 -4.021 -28.750 3.570 163 HG13 VAL 20 HG13 VAL 20 -5.347 -29.924 3.471 164 HG21 VAL 20 HG21 VAL 20 -5.670 -26.800 2.578 165 HG22 VAL 20 HG22 VAL 20 -6.811 -27.383 1.350 166 HG23 VAL 20 HG23 VAL 20 -6.800 -28.120 2.947 167 H ASP 21 H ASP 21 -4.800 -29.218 -1.308 168 HA ASP 21 HA ASP 21 -2.458 -31.079 -1.511 169 HB2 ASP 21 HB2 ASP 21 -4.449 -32.144 -0.550 170 HB3 ASP 21 HB3 ASP 21 -5.416 -31.620 -1.930 171 H ALA 22 H ALA 22 -4.478 -28.807 -3.163 172 HA ALA 22 HA ALA 22 -3.958 -29.627 -5.890 173 HB1 ALA 22 HB1 ALA 22 -4.524 -27.212 -6.335 174 HB2 ALA 22 HB2 ALA 22 -5.773 -28.064 -5.406 175 HB3 ALA 22 HB3 ALA 22 -4.654 -26.946 -4.589 176 H GLU 23 H GLU 23 -2.135 -29.146 -7.123 177 HA GLU 23 HA GLU 23 0.116 -27.716 -5.786 178 HB2 GLU 23 HB2 GLU 23 1.586 -29.541 -6.375 179 HB3 GLU 23 HB3 GLU 23 0.250 -30.135 -5.395 180 HG2 GLU 23 HG2 GLU 23 -0.876 -31.019 -7.418 181 HG3 GLU 23 HG3 GLU 23 0.410 -30.378 -8.437 182 H ASP 24 H ASP 24 -1.834 -27.493 -8.405 183 HA ASP 24 HA ASP 24 0.304 -26.369 -10.154 184 HB2 ASP 24 HB2 ASP 24 -0.453 -28.514 -11.099 185 HB3 ASP 24 HB3 ASP 24 -2.141 -28.021 -10.931 186 H LYS 25 H LYS 25 -0.339 -24.417 -11.178 187 HA LYS 25 HA LYS 25 -1.961 -22.741 -9.730 188 HB2 LYS 25 HB2 LYS 25 -1.682 -21.100 -11.358 189 HB3 LYS 25 HB3 LYS 25 -0.204 -22.037 -11.379 190 HG2 LYS 25 HG2 LYS 25 -2.480 -22.299 -13.397 191 HG3 LYS 25 HG3 LYS 25 -1.086 -21.264 -13.619 192 HD2 LYS 25 HD2 LYS 25 0.415 -23.050 -13.931 193 HD3 LYS 25 HD3 LYS 25 -0.648 -24.209 -13.148 194 HE2 LYS 25 HE2 LYS 25 -2.251 -23.341 -15.206 195 HE3 LYS 25 HE3 LYS 25 -0.663 -23.272 -15.967 196 HZ1 LYS 25 HZ1 LYS 25 -2.021 -25.443 -16.018 197 HZ2 LYS 25 HZ2 LYS 25 -0.410 -25.582 -15.634 198 HZ3 LYS 25 HZ3 LYS 25 -1.564 -25.661 -14.468 199 H GLU 26 H GLU 26 -3.161 -24.923 -12.315 200 HA GLU 26 HA GLU 26 -5.699 -23.476 -12.549 201 HB2 GLU 26 HB2 GLU 26 -4.678 -26.194 -13.470 202 HB3 GLU 26 HB3 GLU 26 -6.364 -25.720 -13.653 203 HG2 GLU 26 HG2 GLU 26 -5.803 -23.837 -15.049 204 HG3 GLU 26 HG3 GLU 26 -4.085 -24.023 -14.718 205 H GLU 27 H GLU 27 -4.479 -26.381 -10.829 206 HA GLU 27 HA GLU 27 -7.016 -27.096 -9.675 207 HB2 GLU 27 HB2 GLU 27 -4.168 -27.729 -8.774 208 HB3 GLU 27 HB3 GLU 27 -5.626 -28.531 -8.192 209 HG2 GLU 27 HG2 GLU 27 -4.605 -28.571 -11.068 210 HG3 GLU 27 HG3 GLU 27 -4.402 -29.856 -9.886 211 H ARG 28 H ARG 28 -4.295 -25.030 -8.633 212 HA ARG 28 HA ARG 28 -5.440 -24.500 -6.020 213 HB2 ARG 28 HB2 ARG 28 -3.198 -23.208 -7.635 214 HB3 ARG 28 HB3 ARG 28 -3.688 -22.637 -6.030 215 HG2 ARG 28 HG2 ARG 28 -3.407 -25.014 -5.200 216 HG3 ARG 28 HG3 ARG 28 -2.642 -25.425 -6.729 217 HD2 ARG 28 HD2 ARG 28 -0.729 -24.138 -6.260 218 HD3 ARG 28 HD3 ARG 28 -1.581 -23.132 -5.065 219 HE ARG 28 HE ARG 28 -1.513 -25.934 -4.315 220 HH11 ARG 28 HH11 ARG 28 0.689 -23.153 -4.363 221 HH12 ARG 28 HH12 ARG 28 1.302 -23.473 -2.762 222 HH21 ARG 28 HH21 ARG 28 -0.892 -26.195 -2.145 223 HH22 ARG 28 HH22 ARG 28 0.473 -25.299 -1.522 224 H ALA 29 H ALA 29 -5.847 -23.010 -9.217 225 HA ALA 29 HA ALA 29 -7.231 -20.674 -8.205 226 HB1 ALA 29 HB1 ALA 29 -7.504 -22.055 -10.911 227 HB2 ALA 29 HB2 ALA 29 -8.081 -20.438 -10.482 228 HB3 ALA 29 HB3 ALA 29 -6.341 -20.763 -10.523 229 H MET 30 H MET 30 -8.202 -24.044 -9.173 230 HA MET 30 HA MET 30 -10.975 -23.648 -8.628 231 HB2 MET 30 HB2 MET 30 -9.320 -26.191 -8.506 232 HB3 MET 30 HB3 MET 30 -11.070 -26.119 -8.379 233 HG2 MET 30 HG2 MET 30 -9.505 -25.142 -10.788 234 HG3 MET 30 HG3 MET 30 -10.218 -26.735 -10.616 235 HE1 MET 30 HE1 MET 30 -12.177 -22.933 -12.033 236 HE2 MET 30 HE2 MET 30 -11.925 -22.800 -10.286 237 HE3 MET 30 HE3 MET 30 -10.545 -23.135 -11.353 238 H GLY 31 H GLY 31 -8.318 -24.756 -6.421 239 HA2 GLY 31 HA2 GLY 31 -9.887 -25.224 -4.149 240 HA3 GLY 31 HA3 GLY 31 -8.221 -24.620 -4.121 241 H TRP 32 H TRP 32 -8.271 -22.125 -5.061 242 HA TRP 32 HA TRP 32 -9.395 -20.518 -3.075 243 HB2 TRP 32 HB2 TRP 32 -8.254 -19.996 -5.813 244 HB3 TRP 32 HB3 TRP 32 -9.100 -18.707 -4.976 245 HD1 TRP 32 HD1 TRP 32 -5.934 -20.831 -4.610 246 HE1 TRP 32 HE1 TRP 32 -4.318 -19.649 -3.036 247 HE3 TRP 32 HE3 TRP 32 -9.014 -17.077 -3.007 248 HZ2 TRP 32 HZ2 TRP 32 -4.413 -17.438 -1.139 249 HZ3 TRP 32 HZ3 TRP 32 -8.247 -15.484 -1.277 250 HH2 TRP 32 HH2 TRP 32 -5.959 -15.639 -0.352 251 H TYR 33 H TYR 33 -10.665 -21.214 -6.403 252 HA TYR 33 HA TYR 33 -12.934 -19.548 -6.262 253 HB2 TYR 33 HB2 TYR 33 -12.223 -20.481 -8.358 254 HB3 TYR 33 HB3 TYR 33 -12.378 -22.126 -7.762 255 HD1 TYR 33 HD2 TYR 33 -14.581 -23.199 -7.446 256 HD2 TYR 33 HD1 TYR 33 -14.207 -19.242 -9.113 257 HE1 TYR 33 HE2 TYR 33 -16.943 -23.289 -8.161 258 HE2 TYR 33 HE1 TYR 33 -16.500 -19.408 -10.019 259 HH TYR 33 HH TYR 33 -18.647 -22.214 -9.350 260 H TYR 34 H TYR 34 -12.577 -23.014 -5.245 261 HA TYR 34 HA TYR 34 -15.322 -23.431 -4.817 262 HB2 TYR 34 HB2 TYR 34 -12.937 -24.754 -3.461 263 HB3 TYR 34 HB3 TYR 34 -14.593 -25.310 -3.307 264 HD1 TYR 34 HD1 TYR 34 -15.606 -25.143 -6.143 265 HD2 TYR 34 HD2 TYR 34 -11.876 -26.576 -4.504 266 HE1 TYR 34 HE1 TYR 34 -15.333 -26.632 -8.085 267 HE2 TYR 34 HE2 TYR 34 -11.612 -28.099 -6.434 268 HH TYR 34 HH TYR 34 -14.006 -28.251 -9.115 269 H TYR 35 H TYR 35 -12.790 -22.520 -2.337 270 HA TYR 35 HA TYR 35 -14.876 -22.371 -0.336 271 HB2 TYR 35 HB2 TYR 35 -13.307 -21.961 1.198 272 HB3 TYR 35 HB3 TYR 35 -12.229 -22.594 -0.034 273 HD1 TYR 35 HD1 TYR 35 -10.935 -20.969 -1.464 274 HD2 TYR 35 HD2 TYR 35 -13.251 -19.652 1.918 275 HE1 TYR 35 HE1 TYR 35 -9.875 -18.750 -1.621 276 HE2 TYR 35 HE2 TYR 35 -12.204 -17.417 1.782 277 HH TYR 35 HH TYR 35 -10.739 -16.043 0.607 278 H LEU 36 H LEU 36 -13.375 -19.946 -2.530 279 HA LEU 36 HA LEU 36 -14.422 -17.687 -1.206 280 HB2 LEU 36 HB2 LEU 36 -12.584 -17.559 -2.792 281 HB3 LEU 36 HB3 LEU 36 -13.631 -18.104 -4.110 282 HG LEU 36 HG LEU 36 -14.930 -16.040 -4.008 283 HD11 LEU 36 HD11 LEU 36 -14.191 -14.125 -2.601 284 HD12 LEU 36 HD12 LEU 36 -14.804 -15.458 -1.623 285 HD13 LEU 36 HD13 LEU 36 -13.048 -15.193 -1.759 286 HD21 LEU 36 HD21 LEU 36 -11.934 -15.460 -4.023 287 HD22 LEU 36 HD22 LEU 36 -12.835 -16.196 -5.362 288 HD23 LEU 36 HD23 LEU 36 -13.214 -14.549 -4.855 289 H ASP 37 H ASP 37 -15.724 -19.474 -4.091 290 HA ASP 37 HA ASP 37 -18.041 -17.863 -4.394 291 HB2 ASP 37 HB2 ASP 37 -17.237 -19.421 -6.124 292 HB3 ASP 37 HB3 ASP 37 -17.611 -20.794 -5.078 293 H ASP 38 H ASP 38 -17.425 -20.771 -2.391 294 HA ASP 38 HA ASP 38 -20.095 -21.029 -1.385 295 HB2 ASP 38 HB2 ASP 38 -18.440 -22.830 -1.280 296 HB3 ASP 38 HB3 ASP 38 -17.437 -21.878 -0.183 297 H THR 39 H THR 39 -17.531 -18.764 -0.533 298 HA THR 39 HA THR 39 -18.745 -18.185 2.107 299 HB THR 39 HB THR 39 -16.198 -17.130 0.812 300 HG1 THR 39 HG1 THR 39 -15.989 -19.268 1.209 301 HG21 THR 39 HG21 THR 39 -17.329 -16.873 3.634 302 HG22 THR 39 HG22 THR 39 -15.625 -16.560 3.224 303 HG23 THR 39 HG23 THR 39 -16.908 -15.569 2.519 304 H LEU 40 H LEU 40 -18.341 -16.723 -1.118 305 HA LEU 40 HA LEU 40 -19.226 -14.075 -0.457 306 HB2 LEU 40 HB2 LEU 40 -19.443 -15.725 -3.008 307 HB3 LEU 40 HB3 LEU 40 -19.929 -14.038 -2.906 308 HG LEU 40 HG LEU 40 -17.091 -15.003 -2.386 309 HD11 LEU 40 HD11 LEU 40 -18.282 -13.765 -4.901 310 HD12 LEU 40 HD12 LEU 40 -16.571 -14.167 -4.638 311 HD13 LEU 40 HD13 LEU 40 -17.775 -15.457 -4.708 312 HD21 LEU 40 HD21 LEU 40 -18.230 -12.224 -2.705 313 HD22 LEU 40 HD22 LEU 40 -17.351 -12.919 -1.311 314 HD23 LEU 40 HD23 LEU 40 -16.503 -12.623 -2.823 315 H GLU 41 H GLU 41 -21.211 -13.616 0.467 316 HA GLU 41 HA GLU 41 -23.469 -15.461 0.131 317 HB2 GLU 41 HB2 GLU 41 -23.235 -12.853 1.689 318 HB3 GLU 41 HB3 GLU 41 -24.647 -13.927 1.644 319 HG2 GLU 41 HG2 GLU 41 -22.985 -15.795 2.391 320 HG3 GLU 41 HG3 GLU 41 -21.930 -14.464 2.870 321 H PHE 42 H PHE 42 -22.883 -14.878 -2.278 322 HA PHE 42 HA PHE 42 -23.794 -12.458 -3.414 323 HB2 PHE 42 HB2 PHE 42 -23.554 -13.605 -5.551 324 HB3 PHE 42 HB3 PHE 42 -22.213 -13.982 -4.505 325 HD1 PHE 42 HD2 PHE 42 -25.427 -15.322 -5.898 326 HD2 PHE 42 HD1 PHE 42 -21.681 -16.275 -3.975 327 HE1 PHE 42 HE2 PHE 42 -25.834 -17.733 -6.290 328 HE2 PHE 42 HE1 PHE 42 -22.095 -18.679 -4.371 329 HZ PHE 42 HZ PHE 42 -24.172 -19.422 -5.523 330 HA PRO 43 HA PRO 43 -24.842 -11.910 -5.623 331 HB2 PRO 43 HB2 PRO 43 -26.831 -10.156 -6.216 332 HB3 PRO 43 HB3 PRO 43 -26.709 -11.775 -6.967 333 HG2 PRO 43 HG2 PRO 43 -28.424 -10.949 -4.606 334 HG3 PRO 43 HG3 PRO 43 -28.913 -11.879 -6.059 335 HD2 PRO 43 HD2 PRO 43 -28.244 -13.097 -3.702 336 HD3 PRO 43 HD3 PRO 43 -27.843 -13.832 -5.282 337 H PHE 44 H PHE 44 -24.089 -9.749 -5.397 338 HA PHE 44 HA PHE 44 -24.834 -8.176 -3.017 339 HB2 PHE 44 HB2 PHE 44 -22.618 -7.998 -2.168 340 HB3 PHE 44 HB3 PHE 44 -23.096 -9.674 -2.157 341 HD1 PHE 44 HD1 PHE 44 -22.099 -11.279 -3.893 342 HD2 PHE 44 HD2 PHE 44 -20.598 -7.294 -3.266 343 HE1 PHE 44 HE1 PHE 44 -19.934 -11.940 -4.890 344 HE2 PHE 44 HE2 PHE 44 -18.435 -7.951 -4.270 345 HZ PHE 44 HZ PHE 44 -18.085 -10.283 -5.062 346 H MET 45 H MET 45 -22.861 -6.180 -3.258 347 HA MET 45 HA MET 45 -22.821 -5.502 -6.132 348 HB2 MET 45 HB2 MET 45 -23.788 -3.418 -5.927 349 HB3 MET 45 HB3 MET 45 -24.871 -4.484 -5.057 350 HG2 MET 45 HG2 MET 45 -24.408 -3.534 -3.008 351 HG3 MET 45 HG3 MET 45 -22.769 -3.076 -3.432 352 HE1 MET 45 HE1 MET 45 -23.020 -1.337 -6.167 353 HE2 MET 45 HE2 MET 45 -23.065 0.243 -5.361 354 HE3 MET 45 HE3 MET 45 -21.998 -1.033 -4.754 355 H GLY 46 H GLY 46 -21.485 -3.600 -6.612 356 HA2 GLY 46 HA2 GLY 46 -19.433 -2.828 -4.669 357 HA3 GLY 46 HA3 GLY 46 -18.866 -3.972 -5.898 358 H LYS 47 H LYS 47 -17.553 -1.870 -5.968 359 HA LYS 47 HA LYS 47 -18.549 -0.364 -8.350 360 HB2 LYS 47 HB2 LYS 47 -18.034 0.971 -6.171 361 HB3 LYS 47 HB3 LYS 47 -16.356 0.523 -6.426 362 HG2 LYS 47 HG2 LYS 47 -16.476 2.627 -7.447 363 HG3 LYS 47 HG3 LYS 47 -16.673 1.537 -8.821 364 HD2 LYS 47 HD2 LYS 47 -18.346 3.171 -9.131 365 HD3 LYS 47 HD3 LYS 47 -19.209 1.784 -8.462 366 HE2 LYS 47 HE2 LYS 47 -19.292 2.795 -6.260 367 HE3 LYS 47 HE3 LYS 47 -18.214 4.105 -6.762 368 HZ1 LYS 47 HZ1 LYS 47 -19.916 4.949 -8.195 369 HZ2 LYS 47 HZ2 LYS 47 -20.896 3.668 -7.960 370 HZ3 LYS 47 HZ3 LYS 47 -20.598 4.719 -6.735 371 H TRP 48 H TRP 48 -17.545 -1.065 -10.162 372 HA TRP 48 HA TRP 48 -15.050 -2.635 -10.027 373 HB2 TRP 48 HB2 TRP 48 -16.869 -3.099 -11.705 374 HB3 TRP 48 HB3 TRP 48 -16.534 -1.546 -12.447 375 HD1 TRP 48 HD1 TRP 48 -13.183 -2.533 -11.812 376 HE1 TRP 48 HE1 TRP 48 -12.089 -3.835 -13.652 377 HE3 TRP 48 HE3 TRP 48 -17.388 -3.837 -14.450 378 HZ2 TRP 48 HZ2 TRP 48 -12.904 -5.452 -15.913 379 HZ3 TRP 48 HZ3 TRP 48 -17.163 -5.316 -16.438 380 HH2 TRP 48 HH2 TRP 48 -14.942 -6.134 -17.159 381 H LYS 49 H LYS 49 -13.323 -1.495 -9.455 382 HA LYS 49 HA LYS 49 -13.016 1.373 -10.013 383 HB2 LYS 49 HB2 LYS 49 -11.065 -0.595 -8.712 384 HB3 LYS 49 HB3 LYS 49 -11.054 1.157 -8.557 385 HG2 LYS 49 HG2 LYS 49 -13.175 -0.735 -7.433 386 HG3 LYS 49 HG3 LYS 49 -11.818 -0.114 -6.533 387 HD2 LYS 49 HD2 LYS 49 -13.886 1.750 -7.778 388 HD3 LYS 49 HD3 LYS 49 -14.078 0.994 -6.194 389 HE2 LYS 49 HE2 LYS 49 -11.702 1.913 -5.666 390 HE3 LYS 49 HE3 LYS 49 -11.967 2.997 -7.043 391 HZ1 LYS 49 HZ1 LYS 49 -13.760 2.748 -4.687 392 HZ2 LYS 49 HZ2 LYS 49 -12.644 3.936 -4.885 393 HZ3 LYS 49 HZ3 LYS 49 -13.904 3.866 -5.922 394 H LYS 50 H LYS 50 -13.235 0.479 -12.387 395 HA LYS 50 HA LYS 50 -11.408 -1.339 -13.529 396 HB2 LYS 50 HB2 LYS 50 -13.591 -0.794 -14.480 397 HB3 LYS 50 HB3 LYS 50 -13.072 0.859 -14.829 398 HG2 LYS 50 HG2 LYS 50 -11.450 0.107 -16.450 399 HG3 LYS 50 HG3 LYS 50 -11.668 -1.587 -15.993 400 HD2 LYS 50 HD2 LYS 50 -13.827 0.168 -17.253 401 HD3 LYS 50 HD3 LYS 50 -12.755 -0.919 -18.151 402 HE2 LYS 50 HE2 LYS 50 -13.596 -2.844 -16.787 403 HE3 LYS 50 HE3 LYS 50 -14.745 -1.762 -15.993 404 HZ1 LYS 50 HZ1 LYS 50 -14.687 -2.381 -18.892 405 HZ2 LYS 50 HZ2 LYS 50 -15.771 -2.948 -17.815 406 HZ3 LYS 50 HZ3 LYS 50 -15.745 -1.357 -18.182 407 H LYS 51 H LYS 51 -9.287 -1.156 -13.844 408 HA LYS 51 HA LYS 51 -7.956 1.371 -13.564 409 HB2 LYS 51 HB2 LYS 51 -7.110 -1.063 -13.078 410 HB3 LYS 51 HB3 LYS 51 -6.627 -1.063 -14.779 411 HG2 LYS 51 HG2 LYS 51 -5.175 0.931 -14.348 412 HG3 LYS 51 HG3 LYS 51 -5.775 1.012 -12.684 413 HD2 LYS 51 HD2 LYS 51 -4.800 -1.223 -12.225 414 HD3 LYS 51 HD3 LYS 51 -4.216 -1.313 -13.903 415 HE2 LYS 51 HE2 LYS 51 -2.851 0.732 -13.532 416 HE3 LYS 51 HE3 LYS 51 -3.434 0.824 -11.865 417 HZ1 LYS 51 HZ1 LYS 51 -2.355 -1.309 -11.440 418 HZ2 LYS 51 HZ2 LYS 51 -1.816 -1.394 -12.982 419 HZ3 LYS 51 HZ3 LYS 51 -1.268 -0.227 -11.988 420 H SER 52 H SER 52 -6.331 2.104 -15.218 421 HA SER 52 HA SER 52 -7.382 3.470 -17.208 422 HB2 SER 52 HB2 SER 52 -4.625 2.219 -17.319 423 HB3 SER 52 HB3 SER 52 -5.136 3.822 -17.870 424 HG SER 52 HG SER 52 -4.023 3.483 -15.684 425 H ARG 53 H ARG 53 -7.574 3.444 -19.409 426 HA ARG 53 HA ARG 53 -8.061 0.842 -20.716 427 HB2 ARG 53 HB2 ARG 53 -8.275 3.702 -21.762 428 HB3 ARG 53 HB3 ARG 53 -8.829 2.244 -22.593 429 HG2 ARG 53 HG2 ARG 53 -10.514 1.843 -20.840 430 HG3 ARG 53 HG3 ARG 53 -9.910 3.230 -19.905 431 HD2 ARG 53 HD2 ARG 53 -10.390 4.722 -21.829 432 HD3 ARG 53 HD3 ARG 53 -11.099 3.332 -22.691 433 HE ARG 53 HE ARG 53 -12.191 3.933 -20.015 434 HH11 ARG 53 HH21 ARG 53 -12.643 4.366 -23.524 435 HH12 ARG 53 HH22 ARG 53 -14.273 4.909 -23.382 436 HH21 ARG 53 HH11 ARG 53 -14.275 4.776 -19.816 437 HH22 ARG 53 HH12 ARG 53 -15.250 5.093 -21.221 438 H LYS 54 H LYS 54 -6.229 3.779 -21.499 439 HA LYS 54 HA LYS 54 -3.689 2.447 -21.853 440 HB2 LYS 54 HB2 LYS 54 -4.886 2.196 -24.117 441 HB3 LYS 54 HB3 LYS 54 -4.844 3.956 -24.256 442 HG2 LYS 54 HG2 LYS 54 -2.325 3.847 -24.043 443 HG3 LYS 54 HG3 LYS 54 -2.433 2.088 -23.976 444 HD2 LYS 54 HD2 LYS 54 -3.352 3.828 -26.309 445 HD3 LYS 54 HD3 LYS 54 -1.806 2.971 -26.214 446 HE2 LYS 54 HE2 LYS 54 -3.024 0.801 -26.041 447 HE3 LYS 54 HE3 LYS 54 -4.562 1.659 -26.196 448 HZ1 LYS 54 HZ1 LYS 54 -2.435 1.595 -28.257 449 HZ2 LYS 54 HZ2 LYS 54 -3.836 0.767 -28.311 450 HZ3 LYS 54 HZ3 LYS 54 -3.856 2.393 -28.399 451 H THR 55 H THR 55 -4.572 3.957 -19.911 452 HA THR 55 HA THR 55 -3.695 6.770 -20.236 453 HB THR 55 HB THR 55 -5.853 7.172 -18.787 454 HG1 THR 55 HG1 THR 55 -7.427 5.680 -18.980 455 HG21 THR 55 HG21 THR 55 -7.270 7.422 -20.723 456 HG22 THR 55 HG22 THR 55 -5.622 7.897 -21.160 457 HG23 THR 55 HG23 THR 55 -6.263 6.321 -21.680 458 H SER 56 H SER 56 -4.337 7.447 -17.530 459 HA SER 56 HA SER 56 -3.137 5.402 -15.783 460 HB2 SER 56 HB2 SER 56 -2.171 8.280 -15.750 461 HB3 SER 56 HB3 SER 56 -1.628 6.928 -14.734 462 HG SER 56 HG SER 56 -0.189 7.388 -16.467 463 H THR 57 H THR 57 -5.757 5.639 -15.908 464 HA THR 57 HA THR 57 -6.621 7.385 -13.686 465 HB THR 57 HB THR 57 -8.002 7.459 -16.386 466 HG1 THR 57 HG1 THR 57 -6.032 9.223 -15.381 467 HG21 THR 57 HG21 THR 57 -9.396 8.155 -14.499 468 HG22 THR 57 HG22 THR 57 -8.151 9.300 -13.958 469 HG23 THR 57 HG23 THR 57 -8.997 9.552 -15.505 470 H ILE 58 H ILE 58 -7.834 6.142 -12.385 471 HA ILE 58 HA ILE 58 -9.118 3.658 -13.286 472 HB ILE 58 HB ILE 58 -8.850 5.155 -10.669 473 HG12 ILE 58 HG12 ILE 58 -8.149 2.345 -11.637 474 HG13 ILE 58 HG13 ILE 58 -7.019 3.688 -11.463 475 HG21 ILE 58 HG21 ILE 58 -10.242 3.465 -9.526 476 HG22 ILE 58 HG22 ILE 58 -11.194 4.404 -10.654 477 HG23 ILE 58 HG23 ILE 58 -10.679 2.766 -11.103 478 HD11 ILE 58 HD11 ILE 58 -8.431 2.160 -9.250 479 HD12 ILE 58 HD12 ILE 58 -6.703 2.209 -9.623 480 HD13 ILE 58 HD13 ILE 58 -7.502 3.662 -8.978 481 H GLU 59 H GLU 59 -11.281 3.351 -13.516 482 HA GLU 59 HA GLU 59 -13.110 5.706 -13.543 483 HB2 GLU 59 HB2 GLU 59 -13.117 3.194 -15.285 484 HB3 GLU 59 HB3 GLU 59 -14.406 4.402 -15.235 485 HG2 GLU 59 HG2 GLU 59 -12.841 6.131 -16.064 486 HG3 GLU 59 HG3 GLU 59 -11.529 4.947 -16.107 487 H GLU 60 H GLU 60 -15.283 5.102 -12.733 488 HA GLU 60 HA GLU 60 -15.212 2.770 -10.861 489 HB2 GLU 60 HB2 GLU 60 -16.029 5.653 -10.324 490 HB3 GLU 60 HB3 GLU 60 -16.329 4.294 -9.239 491 HG2 GLU 60 HG2 GLU 60 -13.848 3.851 -9.185 492 HG3 GLU 60 HG3 GLU 60 -13.612 5.335 -10.119 493 H LYS 61 H LYS 61 -16.665 1.414 -11.774 494 HA LYS 61 HA LYS 61 -19.283 2.540 -12.726 495 HB2 LYS 61 HB2 LYS 61 -17.942 1.428 -14.449 496 HB3 LYS 61 HB3 LYS 61 -17.807 -0.025 -13.443 497 HG2 LYS 61 HG2 LYS 61 -20.205 -0.413 -13.564 498 HG3 LYS 61 HG3 LYS 61 -20.453 1.084 -14.454 499 HD2 LYS 61 HD2 LYS 61 -18.630 -1.140 -15.480 500 HD3 LYS 61 HD3 LYS 61 -20.358 -1.202 -15.747 501 HE2 LYS 61 HE2 LYS 61 -18.518 1.043 -16.683 502 HE3 LYS 61 HE3 LYS 61 -19.137 -0.274 -17.684 503 HZ1 LYS 61 HZ1 LYS 61 -20.463 1.715 -17.970 504 HZ2 LYS 61 HZ2 LYS 61 -21.399 0.555 -17.283 505 HZ3 LYS 61 HZ3 LYS 61 -20.824 1.774 -16.373 506 H THR 62 H THR 62 -20.951 2.230 -11.280 507 HA THR 62 HA THR 62 -20.745 0.392 -9.093 508 HB THR 62 HB THR 62 -23.308 1.607 -10.184 509 HG1 THR 62 HG1 THR 62 -22.721 3.528 -9.478 510 HG21 THR 62 HG21 THR 62 -23.868 1.801 -7.795 511 HG22 THR 62 HG22 THR 62 -23.428 0.126 -8.166 512 HG23 THR 62 HG23 THR 62 -22.260 1.184 -7.346 513 H VAL 63 H VAL 63 -21.309 -1.725 -8.979 514 HA VAL 63 HA VAL 63 -22.867 -2.929 -11.217 515 HB VAL 63 HB VAL 63 -21.204 -4.806 -11.210 516 HG11 VAL 63 HG11 VAL 63 -21.227 -3.053 -12.987 517 HG12 VAL 63 HG12 VAL 63 -19.971 -2.170 -12.092 518 HG13 VAL 63 HG13 VAL 63 -19.635 -3.786 -12.731 519 HG21 VAL 63 HG21 VAL 63 -20.027 -4.343 -9.067 520 HG22 VAL 63 HG22 VAL 63 -18.915 -4.457 -10.437 521 HG23 VAL 63 HG23 VAL 63 -19.335 -2.868 -9.776 522 H GLU 64 H GLU 64 -23.970 -4.804 -10.762 523 HA GLU 64 HA GLU 64 -24.234 -5.569 -7.880 524 HB2 GLU 64 HB2 GLU 64 -26.352 -4.990 -9.003 525 HB3 GLU 64 HB3 GLU 64 -26.009 -6.139 -10.300 526 HG2 GLU 64 HG2 GLU 64 -26.114 -8.008 -8.689 527 HG3 GLU 64 HG3 GLU 64 -26.323 -6.867 -7.357 528 H VAL 65 H VAL 65 -23.295 -7.525 -7.379 529 HA VAL 65 HA VAL 65 -21.858 -8.942 -9.564 530 HB VAL 65 HB VAL 65 -21.292 -9.049 -6.579 531 HG11 VAL 65 HG11 VAL 65 -20.332 -10.876 -7.930 532 HG12 VAL 65 HG12 VAL 65 -19.652 -9.696 -9.072 533 HG13 VAL 65 HG13 VAL 65 -19.043 -9.782 -7.410 534 HG21 VAL 65 HG21 VAL 65 -20.061 -7.148 -8.627 535 HG22 VAL 65 HG22 VAL 65 -21.005 -6.697 -7.194 536 HG23 VAL 65 HG23 VAL 65 -19.427 -7.450 -6.997 537 H LEU 66 H LEU 66 -22.762 -10.795 -10.206 538 HA LEU 66 HA LEU 66 -25.105 -11.775 -8.756 539 HB2 LEU 66 HB2 LEU 66 -23.799 -12.687 -11.362 540 HB3 LEU 66 HB3 LEU 66 -25.260 -13.369 -10.689 541 HG LEU 66 HG LEU 66 -25.969 -11.975 -12.391 542 HD11 LEU 66 HD11 LEU 66 -27.295 -11.766 -10.292 543 HD12 LEU 66 HD12 LEU 66 -26.387 -10.288 -9.892 544 HD13 LEU 66 HD13 LEU 66 -27.405 -10.342 -11.340 545 HD21 LEU 66 HD21 LEU 66 -25.405 -9.671 -12.752 546 HD22 LEU 66 HD22 LEU 66 -24.407 -9.613 -11.294 547 HD23 LEU 66 HD23 LEU 66 -23.918 -10.623 -12.677 548 H GLY 67 H GLY 67 -21.747 -12.856 -9.208 549 HA2 GLY 67 HA2 GLY 67 -21.464 -14.643 -7.188 550 HA3 GLY 67 HA3 GLY 67 -22.243 -15.596 -8.473 551 H MET 68 H MET 68 -19.846 -16.490 -8.021 552 HA MET 68 HA MET 68 -17.730 -15.166 -9.512 553 HB2 MET 68 HB2 MET 68 -17.940 -18.043 -8.571 554 HB3 MET 68 HB3 MET 68 -16.544 -17.282 -9.346 555 HG2 MET 68 HG2 MET 68 -16.848 -15.478 -7.407 556 HG3 MET 68 HG3 MET 68 -17.666 -16.816 -6.604 557 HE1 MET 68 HE1 MET 68 -14.478 -16.595 -9.025 558 HE2 MET 68 HE2 MET 68 -14.393 -15.233 -7.886 559 HE3 MET 68 HE3 MET 68 -13.210 -16.554 -7.794 560 H ALA 69 H ALA 69 -16.812 -15.862 -11.475 561 HA ALA 69 HA ALA 69 -18.776 -16.307 -13.544 562 HB1 ALA 69 HB1 ALA 69 -16.876 -15.901 -15.027 563 HB2 ALA 69 HB2 ALA 69 -16.766 -14.785 -13.667 564 HB3 ALA 69 HB3 ALA 69 -15.743 -16.248 -13.716 565 HA PRO 70 HA PRO 70 -18.446 -20.651 -14.454 566 HB2 PRO 70 HB2 PRO 70 -17.210 -19.897 -17.109 567 HB3 PRO 70 HB3 PRO 70 -18.490 -21.106 -16.767 568 HG2 PRO 70 HG2 PRO 70 -19.177 -18.672 -17.708 569 HG3 PRO 70 HG3 PRO 70 -20.101 -19.375 -16.338 570 HD2 PRO 70 HD2 PRO 70 -17.881 -17.331 -16.266 571 HD3 PRO 70 HD3 PRO 70 -19.438 -17.326 -15.381 572 H ASP 71 H ASP 71 -17.114 -22.403 -14.604 573 HA ASP 71 HA ASP 71 -14.539 -22.567 -13.607 574 HB2 ASP 71 HB2 ASP 71 -15.906 -24.506 -13.825 575 HB3 ASP 71 HB3 ASP 71 -16.153 -24.245 -15.549 576 H ASP 72 H ASP 72 -15.551 -21.975 -16.963 577 HA ASP 72 HA ASP 72 -13.127 -22.520 -18.264 578 HB2 ASP 72 HB2 ASP 72 -15.324 -22.263 -19.368 579 HB3 ASP 72 HB3 ASP 72 -15.306 -20.533 -19.015 580 H GLU 73 H GLU 73 -13.877 -19.778 -16.268 581 HA GLU 73 HA GLU 73 -11.410 -18.361 -17.222 582 HB2 GLU 73 HB2 GLU 73 -14.017 -17.151 -16.211 583 HB3 GLU 73 HB3 GLU 73 -12.530 -16.265 -16.580 584 HG2 GLU 73 HG2 GLU 73 -12.632 -17.078 -18.934 585 HG3 GLU 73 HG3 GLU 73 -14.175 -17.860 -18.583 586 H CYS 74 H CYS 74 -13.455 -19.321 -14.430 587 HA CYS 74 HA CYS 74 -11.689 -18.240 -12.471 588 HB2 CYS 74 HB2 CYS 74 -13.875 -20.329 -12.376 589 HB3 CYS 74 HB3 CYS 74 -12.952 -19.819 -10.944 590 HG CYS 74 HG CYS 74 -15.494 -18.630 -11.824 591 H LEU 75 H LEU 75 -10.924 -20.565 -14.598 592 HA LEU 75 HA LEU 75 -9.295 -22.305 -12.902 593 HB2 LEU 75 HB2 LEU 75 -9.829 -21.992 -15.858 594 HB3 LEU 75 HB3 LEU 75 -8.352 -22.808 -15.372 595 HG LEU 75 HG LEU 75 -11.057 -23.674 -14.292 596 HD11 LEU 75 HD11 LEU 75 -9.562 -24.731 -16.738 597 HD12 LEU 75 HD12 LEU 75 -11.025 -25.443 -16.014 598 HD13 LEU 75 HD13 LEU 75 -11.101 -23.840 -16.750 599 HD21 LEU 75 HD21 LEU 75 -9.025 -24.451 -13.040 600 HD22 LEU 75 HD22 LEU 75 -9.904 -25.773 -13.811 601 HD23 LEU 75 HD23 LEU 75 -8.408 -25.159 -14.545 602 H LYS 76 H LYS 76 -8.936 -19.072 -14.062 603 HA LYS 76 HA LYS 76 -6.025 -19.310 -13.443 604 HB2 LYS 76 HB2 LYS 76 -5.390 -17.923 -15.240 605 HB3 LYS 76 HB3 LYS 76 -6.364 -19.239 -15.897 606 HG2 LYS 76 HG2 LYS 76 -8.327 -17.662 -16.003 607 HG3 LYS 76 HG3 LYS 76 -7.268 -16.361 -15.429 608 HD2 LYS 76 HD2 LYS 76 -5.792 -16.781 -17.459 609 HD3 LYS 76 HD3 LYS 76 -6.995 -17.954 -18.009 610 HE2 LYS 76 HE2 LYS 76 -7.542 -15.965 -19.167 611 HE3 LYS 76 HE3 LYS 76 -8.736 -16.096 -17.875 612 HZ1 LYS 76 HZ1 LYS 76 -6.393 -14.291 -17.987 613 HZ2 LYS 76 HZ2 LYS 76 -7.975 -13.875 -17.892 614 HZ3 LYS 76 HZ3 LYS 76 -7.234 -14.523 -16.602 615 H ASP 77 H ASP 77 -8.967 -17.330 -13.177 616 HA ASP 77 HA ASP 77 -7.590 -15.706 -11.139 617 HB2 ASP 77 HB2 ASP 77 -7.011 -14.502 -13.193 618 HB3 ASP 77 HB3 ASP 77 -8.697 -14.513 -13.703 619 H MET 78 H MET 78 -9.158 -14.359 -9.943 620 HA MET 78 HA MET 78 -11.632 -15.910 -9.578 621 HB2 MET 78 HB2 MET 78 -10.444 -13.604 -7.996 622 HB3 MET 78 HB3 MET 78 -11.887 -14.510 -7.547 623 HG2 MET 78 HG2 MET 78 -9.058 -15.620 -7.760 624 HG3 MET 78 HG3 MET 78 -9.937 -15.233 -6.294 625 HE1 MET 78 HE1 MET 78 -8.819 -17.960 -8.601 626 HE2 MET 78 HE2 MET 78 -10.124 -19.163 -8.627 627 HE3 MET 78 HE3 MET 78 -10.296 -17.670 -9.551 628 H TYR 79 H TYR 79 -12.557 -15.337 -11.635 629 HA TYR 79 HA TYR 79 -13.379 -12.549 -12.090 630 HB2 TYR 79 HB2 TYR 79 -13.823 -15.183 -13.523 631 HB3 TYR 79 HB3 TYR 79 -14.644 -13.705 -13.999 632 HD1 TYR 79 HD2 TYR 79 -13.304 -11.699 -14.774 633 HD2 TYR 79 HD1 TYR 79 -11.583 -15.618 -14.246 634 HE1 TYR 79 HE2 TYR 79 -11.481 -11.098 -16.333 635 HE2 TYR 79 HE1 TYR 79 -9.787 -15.052 -15.835 636 HH TYR 79 HH TYR 79 -9.564 -11.830 -17.433 637 H VAL 80 H VAL 80 -15.543 -11.833 -12.072 638 HA VAL 80 HA VAL 80 -17.619 -13.608 -10.887 639 HB VAL 80 HB VAL 80 -18.393 -11.558 -9.648 640 HG11 VAL 80 HG11 VAL 80 -17.323 -13.350 -8.425 641 HG12 VAL 80 HG12 VAL 80 -15.707 -12.719 -8.812 642 HG13 VAL 80 HG13 VAL 80 -16.812 -11.804 -7.763 643 HG21 VAL 80 HG21 VAL 80 -17.034 -9.838 -10.868 644 HG22 VAL 80 HG22 VAL 80 -16.838 -9.764 -9.113 645 HG23 VAL 80 HG23 VAL 80 -15.568 -10.493 -10.112 646 H GLU 81 H GLU 81 -19.754 -13.151 -11.554 647 HA GLU 81 HA GLU 81 -19.954 -11.748 -14.170 648 HB2 GLU 81 HB2 GLU 81 -21.900 -13.439 -12.543 649 HB3 GLU 81 HB3 GLU 81 -22.350 -12.550 -14.009 650 HG2 GLU 81 HG2 GLU 81 -20.587 -13.795 -15.275 651 HG3 GLU 81 HG3 GLU 81 -20.246 -14.739 -13.826 652 H VAL 82 H VAL 82 -21.072 -9.832 -14.407 653 HA VAL 82 HA VAL 82 -22.094 -8.526 -11.965 654 HB VAL 82 HB VAL 82 -20.800 -6.481 -12.590 655 HG11 VAL 82 HG11 VAL 82 -18.753 -7.130 -11.496 656 HG12 VAL 82 HG12 VAL 82 -20.106 -7.990 -10.750 657 HG13 VAL 82 HG13 VAL 82 -19.026 -8.844 -11.870 658 HG21 VAL 82 HG21 VAL 82 -18.829 -6.579 -13.965 659 HG22 VAL 82 HG22 VAL 82 -19.074 -8.307 -14.307 660 HG23 VAL 82 HG23 VAL 82 -20.199 -7.088 -14.942 661 H ALA 83 H ALA 83 -23.632 -6.982 -12.311 662 HA ALA 83 HA ALA 83 -24.522 -6.525 -15.137 663 HB1 ALA 83 HB1 ALA 83 -26.179 -6.577 -12.584 664 HB2 ALA 83 HB2 ALA 83 -26.770 -6.113 -14.196 665 HB3 ALA 83 HB3 ALA 83 -26.219 -7.772 -13.904 666 H ASP 84 H ASP 84 -24.659 -4.441 -15.785 667 HA ASP 84 HA ASP 84 -23.125 -2.522 -14.223 668 HB2 ASP 84 HB2 ASP 84 -22.707 -2.878 -16.602 669 HB3 ASP 84 HB3 ASP 84 -24.362 -2.377 -16.984 670 H ILE 85 H ILE 85 -24.965 -2.616 -12.554 671 HA ILE 85 HA ILE 85 -27.364 -1.162 -12.995 672 HB ILE 85 HB ILE 85 -27.504 -0.935 -10.579 673 HG12 ILE 85 HG12 ILE 85 -24.725 -2.119 -10.411 674 HG13 ILE 85 HG13 ILE 85 -25.108 -0.428 -10.103 675 HG21 ILE 85 HG21 ILE 85 -27.686 -3.285 -10.087 676 HG22 ILE 85 HG22 ILE 85 -28.057 -3.074 -11.795 677 HG23 ILE 85 HG23 ILE 85 -26.471 -3.708 -11.312 678 HD11 ILE 85 HD11 ILE 85 -26.557 -1.080 -8.209 679 HD12 ILE 85 HD12 ILE 85 -26.140 -2.788 -8.477 680 HD13 ILE 85 HD13 ILE 85 -24.887 -1.647 -7.999 681 H GLY 86 H GLY 86 -24.127 0.038 -12.866 682 HA2 GLY 86 HA2 GLY 86 -24.844 2.800 -12.208 683 HA3 GLY 86 HA3 GLY 86 -23.264 2.154 -12.680 684 H GLY 87 H GLY 87 -25.183 0.872 -15.027 685 HA2 GLY 87 HA2 GLY 87 -25.372 3.255 -16.780 686 HA3 GLY 87 HA3 GLY 87 -24.181 2.007 -17.169 687 H LYS 88 H LYS 88 -24.871 0.014 -18.007 688 HA LYS 88 HA LYS 88 -27.176 0.216 -19.630 689 HB2 LYS 88 HB2 LYS 88 -25.681 -2.333 -18.874 690 HB3 LYS 88 HB3 LYS 88 -26.761 -2.149 -20.240 691 HG2 LYS 88 HG2 LYS 88 -24.079 -0.762 -19.844 692 HG3 LYS 88 HG3 LYS 88 -24.437 -2.065 -20.956 693 HD2 LYS 88 HD2 LYS 88 -25.534 0.773 -21.128 694 HD3 LYS 88 HD3 LYS 88 -24.252 0.072 -22.118 695 HE2 LYS 88 HE2 LYS 88 -25.853 -1.621 -23.003 696 HE3 LYS 88 HE3 LYS 88 -27.151 -0.886 -22.053 697 HZ1 LYS 88 HZ1 LYS 88 -26.838 1.156 -23.331 698 HZ2 LYS 88 HZ2 LYS 88 -25.641 0.472 -24.211 699 HZ3 LYS 88 HZ3 LYS 88 -27.164 -0.090 -24.327 700 H ASP 89 H ASP 89 -26.831 -1.293 -16.499 701 HA ASP 89 HA ASP 89 -28.105 -2.210 -14.989 702 HB2 ASP 89 HB2 ASP 89 -29.120 -0.011 -15.054 703 HB3 ASP 89 HB3 ASP 89 -30.256 -0.532 -16.301 704 H ASP 90 H ASP 90 -29.369 -2.815 -18.185 705 HA ASP 90 HA ASP 90 -31.006 -5.098 -17.231 706 HB2 ASP 90 HB2 ASP 90 -32.025 -3.144 -18.431 707 HB3 ASP 90 HB3 ASP 90 -31.004 -3.525 -19.822 708 H ASP 91 H ASP 91 -27.953 -4.885 -18.041 709 HA ASP 91 HA ASP 91 -27.928 -7.433 -19.518 710 HB2 ASP 91 HB2 ASP 91 -27.614 -5.455 -21.150 711 HB3 ASP 91 HB3 ASP 91 -26.047 -5.223 -20.363 712 H VAL 92 H VAL 92 -25.718 -8.389 -19.474 713 HA VAL 92 HA VAL 92 -24.370 -7.883 -16.881 714 HB VAL 92 HB VAL 92 -26.220 -9.425 -16.551 715 HG11 VAL 92 HG11 VAL 92 -24.954 -11.251 -18.629 716 HG12 VAL 92 HG12 VAL 92 -26.339 -11.639 -17.589 717 HG13 VAL 92 HG13 VAL 92 -26.488 -10.367 -18.800 718 HG21 VAL 92 HG21 VAL 92 -23.574 -10.906 -16.385 719 HG22 VAL 92 HG22 VAL 92 -24.287 -9.824 -15.163 720 HG23 VAL 92 HG23 VAL 92 -25.080 -11.345 -15.555 721 H TYR 93 H TYR 93 -22.298 -8.646 -16.721 722 HA TYR 93 HA TYR 93 -20.792 -9.494 -19.127 723 HB2 TYR 93 HB2 TYR 93 -20.199 -7.045 -17.399 724 HB3 TYR 93 HB3 TYR 93 -19.246 -7.606 -18.762 725 HD1 TYR 93 HD2 TYR 93 -20.124 -7.424 -21.101 726 HD2 TYR 93 HD1 TYR 93 -22.192 -5.688 -17.732 727 HE1 TYR 93 HE2 TYR 93 -21.438 -6.011 -22.646 728 HE2 TYR 93 HE1 TYR 93 -23.525 -4.278 -19.272 729 HH TYR 93 HH TYR 93 -23.089 -4.394 -22.846 730 H THR 94 H THR 94 -18.251 -9.262 -18.002 731 HA THR 94 HA THR 94 -18.368 -10.683 -15.400 732 HB THR 94 HB THR 94 -16.467 -11.395 -17.663 733 HG1 THR 94 HG1 THR 94 -18.556 -11.982 -18.250 734 HG21 THR 94 HG21 THR 94 -15.676 -11.995 -15.381 735 HG22 THR 94 HG22 THR 94 -17.193 -12.874 -15.094 736 HG23 THR 94 HG23 THR 94 -16.054 -13.431 -16.339 737 H ALA 95 H ALA 95 -16.642 -10.158 -14.026 738 HA ALA 95 HA ALA 95 -14.723 -8.070 -14.885 739 HB1 ALA 95 HB1 ALA 95 -16.613 -6.863 -13.845 740 HB2 ALA 95 HB2 ALA 95 -16.504 -7.908 -12.411 741 HB3 ALA 95 HB3 ALA 95 -15.183 -6.788 -12.809 742 H LYS 96 H LYS 96 -12.942 -7.874 -13.405 743 HA LYS 96 HA LYS 96 -12.107 -10.453 -12.233 744 HB2 LYS 96 HB2 LYS 96 -10.747 -7.730 -12.244 745 HB3 LYS 96 HB3 LYS 96 -9.988 -9.255 -11.839 746 HG2 LYS 96 HG2 LYS 96 -9.818 -9.955 -14.050 747 HG3 LYS 96 HG3 LYS 96 -11.174 -9.000 -14.621 748 HD2 LYS 96 HD2 LYS 96 -8.529 -7.796 -13.741 749 HD3 LYS 96 HD3 LYS 96 -8.950 -8.183 -15.418 750 HE2 LYS 96 HE2 LYS 96 -10.845 -6.614 -15.383 751 HE3 LYS 96 HE3 LYS 96 -10.605 -6.310 -13.669 752 HZ1 LYS 96 HZ1 LYS 96 -8.929 -5.378 -15.885 753 HZ2 LYS 96 HZ2 LYS 96 -9.589 -4.533 -14.622 754 HZ3 LYS 96 HZ3 LYS 96 -8.300 -5.492 -14.378 755 H LEU 97 H LEU 97 -12.560 -10.882 -10.012 756 HA LEU 97 HA LEU 97 -13.821 -8.944 -8.326 757 HB2 LEU 97 HB2 LEU 97 -13.878 -11.407 -7.940 758 HB3 LEU 97 HB3 LEU 97 -12.146 -11.381 -7.590 759 HG LEU 97 HG LEU 97 -12.556 -9.927 -5.616 760 HD11 LEU 97 HD11 LEU 97 -14.916 -9.666 -4.794 761 HD12 LEU 97 HD12 LEU 97 -14.615 -8.761 -6.269 762 HD13 LEU 97 HD13 LEU 97 -15.504 -10.300 -6.341 763 HD21 LEU 97 HD21 LEU 97 -12.468 -12.392 -5.465 764 HD22 LEU 97 HD22 LEU 97 -13.494 -11.682 -4.225 765 HD23 LEU 97 HD23 LEU 97 -14.238 -12.459 -5.642 766 H SER 98 H SER 98 -10.454 -9.841 -8.935 767 HA SER 98 HA SER 98 -8.958 -8.400 -7.174 768 HB2 SER 98 HB2 SER 98 -8.436 -8.656 -10.155 769 HB3 SER 98 HB3 SER 98 -7.258 -8.677 -8.837 770 HG SER 98 HG SER 98 -7.919 -10.793 -9.778 771 H ASP 99 H ASP 99 -11.101 -6.988 -9.569 772 HA ASP 99 HA ASP 99 -9.694 -4.378 -9.382 773 HB2 ASP 99 HB2 ASP 99 -9.627 -5.751 -11.579 774 HB3 ASP 99 HB3 ASP 99 -11.342 -5.370 -11.731 775 H ILE 100 H ILE 100 -12.060 -5.815 -7.977 776 HA ILE 100 HA ILE 100 -14.033 -3.590 -8.194 777 HB ILE 100 HB ILE 100 -14.301 -6.547 -8.066 778 HG12 ILE 100 HG12 ILE 100 -16.116 -4.326 -9.082 779 HG13 ILE 100 HG13 ILE 100 -14.825 -5.086 -10.034 780 HG21 ILE 100 HG21 ILE 100 -16.470 -6.641 -6.999 781 HG22 ILE 100 HG22 ILE 100 -15.293 -6.032 -5.857 782 HG23 ILE 100 HG23 ILE 100 -16.424 -4.902 -6.646 783 HD11 ILE 100 HD11 ILE 100 -16.908 -6.022 -10.703 784 HD12 ILE 100 HD12 ILE 100 -16.047 -7.278 -9.783 785 HD13 ILE 100 HD13 ILE 100 -17.393 -6.367 -9.040 786 H GLU 101 H GLU 101 -14.999 -2.880 -6.398 787 HA GLU 101 HA GLU 101 -13.717 -3.385 -3.748 788 HB2 GLU 101 HB2 GLU 101 -13.168 -1.156 -4.554 789 HB3 GLU 101 HB3 GLU 101 -14.860 -0.837 -4.973 790 HG2 GLU 101 HG2 GLU 101 -15.522 -0.810 -2.652 791 HG3 GLU 101 HG3 GLU 101 -13.960 -1.450 -2.140 792 H ALA 102 H ALA 102 -15.151 -4.437 -2.451 793 HA ALA 102 HA ALA 102 -17.878 -4.877 -3.384 794 HB1 ALA 102 HB1 ALA 102 -17.994 -6.413 -1.512 795 HB2 ALA 102 HB2 ALA 102 -16.446 -6.631 -2.348 796 HB3 ALA 102 HB3 ALA 102 -16.502 -5.754 -0.802 797 H ILE 103 H ILE 103 -19.713 -4.018 -2.561 798 HA ILE 103 HA ILE 103 -19.566 -2.095 -0.277 799 HB ILE 103 HB ILE 103 -20.844 -1.857 -3.013 800 HG12 ILE 103 HG12 ILE 103 -18.905 -0.001 -1.561 801 HG13 ILE 103 HG13 ILE 103 -18.416 -1.207 -2.746 802 HG21 ILE 103 HG21 ILE 103 -21.866 0.277 -2.285 803 HG22 ILE 103 HG22 ILE 103 -22.504 -1.070 -1.369 804 HG23 ILE 103 HG23 ILE 103 -21.283 -0.006 -0.629 805 HD11 ILE 103 HD11 ILE 103 -20.142 1.214 -3.324 806 HD12 ILE 103 HD12 ILE 103 -18.481 0.898 -3.839 807 HD13 ILE 103 HD13 ILE 103 -19.802 -0.106 -4.474 808 H ASP 104 H ASP 104 -21.167 -2.275 1.211 809 HA ASP 104 HA ASP 104 -22.891 -3.042 2.373 810 HB2 ASP 104 HB2 ASP 104 -24.109 -1.838 0.577 811 HB3 ASP 104 HB3 ASP 104 -24.326 -3.365 -0.278 812 H VAL 105 H VAL 105 -20.908 -5.037 1.317 813 HA VAL 105 HA VAL 105 -22.326 -7.570 1.192 814 HB VAL 105 HB VAL 105 -19.902 -8.436 1.532 815 HG11 VAL 105 HG11 VAL 105 -19.409 -8.076 -0.827 816 HG12 VAL 105 HG12 VAL 105 -21.104 -8.473 -0.535 817 HG13 VAL 105 HG13 VAL 105 -20.642 -6.787 -0.898 818 HG21 VAL 105 HG21 VAL 105 -18.078 -7.009 1.071 819 HG22 VAL 105 HG22 VAL 105 -19.114 -5.596 0.781 820 HG23 VAL 105 HG23 VAL 105 -18.963 -6.279 2.421 821 H ASP 106 H ASP 106 -21.781 -9.331 2.647 822 HA ASP 106 HA ASP 106 -22.181 -8.688 5.486 823 HB2 ASP 106 HB2 ASP 106 -23.180 -10.711 4.502 824 HB3 ASP 106 HB3 ASP 106 -21.568 -11.293 4.043 825 H ASP 107 H ASP 107 -20.589 -9.399 7.102 826 HA ASP 107 HA ASP 107 -17.965 -8.381 6.664 827 HB2 ASP 107 HB2 ASP 107 -19.005 -8.492 8.875 828 HB3 ASP 107 HB3 ASP 107 -19.050 -10.256 8.798 829 H ASP 108 H ASP 108 -19.168 -11.820 6.566 830 HA ASP 108 HA ASP 108 -16.438 -12.787 6.355 831 HB2 ASP 108 HB2 ASP 108 -18.571 -14.040 7.210 832 HB3 ASP 108 HB3 ASP 108 -18.865 -14.374 5.493 833 H THR 109 H THR 109 -18.862 -11.654 4.115 834 HA THR 109 HA THR 109 -17.684 -12.794 1.692 835 HB THR 109 HB THR 109 -19.715 -10.590 2.234 836 HG1 THR 109 HG1 THR 109 -20.203 -12.865 2.673 837 HG21 THR 109 HG21 THR 109 -20.369 -10.711 -0.100 838 HG22 THR 109 HG22 THR 109 -18.665 -10.222 0.000 839 HG23 THR 109 HG23 THR 109 -19.098 -11.885 -0.439 840 H GLN 110 H GLN 110 -17.703 -9.541 3.349 841 HA GLN 110 HA GLN 110 -15.909 -8.298 1.592 842 HB2 GLN 110 HB2 GLN 110 -17.369 -7.410 3.625 843 HB3 GLN 110 HB3 GLN 110 -15.915 -7.678 4.567 844 HG2 GLN 110 HG2 GLN 110 -16.157 -5.922 2.075 845 HG3 GLN 110 HG3 GLN 110 -16.160 -5.344 3.731 846 HE21 GLN 110 HE22 GLN 110 -14.164 -5.859 1.034 847 HE22 GLN 110 HE21 GLN 110 -12.625 -5.824 1.852 848 H GLU 111 H GLU 111 -15.222 -10.136 4.633 849 HA GLU 111 HA GLU 111 -12.424 -9.744 4.582 850 HB2 GLU 111 HB2 GLU 111 -14.201 -11.896 5.785 851 HB3 GLU 111 HB3 GLU 111 -12.458 -11.888 6.025 852 HG2 GLU 111 HG2 GLU 111 -14.214 -9.496 6.754 853 HG3 GLU 111 HG3 GLU 111 -13.861 -10.815 7.861 854 H ALA 112 H ALA 112 -14.429 -12.237 2.931 855 HA ALA 112 HA ALA 112 -12.172 -13.844 2.127 856 HB1 ALA 112 HB1 ALA 112 -14.917 -13.576 0.816 857 HB2 ALA 112 HB2 ALA 112 -13.738 -14.883 0.570 858 HB3 ALA 112 HB3 ALA 112 -14.505 -14.680 2.151 859 H ILE 113 H ILE 113 -13.971 -11.146 0.588 860 HA ILE 113 HA ILE 113 -12.497 -11.153 -1.868 861 HB ILE 113 HB ILE 113 -14.078 -8.974 -0.434 862 HG12 ILE 113 HG12 ILE 113 -14.878 -10.745 -2.788 863 HG13 ILE 113 HG13 ILE 113 -15.298 -11.110 -1.138 864 HG21 ILE 113 HG21 ILE 113 -12.553 -7.901 -2.022 865 HG22 ILE 113 HG22 ILE 113 -13.033 -9.032 -3.300 866 HG23 ILE 113 HG23 ILE 113 -14.186 -7.838 -2.664 867 HD11 ILE 113 HD11 ILE 113 -16.258 -8.761 -2.770 868 HD12 ILE 113 HD12 ILE 113 -17.197 -10.087 -2.072 869 HD13 ILE 113 HD13 ILE 113 -16.475 -8.871 -0.998 870 H ALA 114 H ALA 114 -12.087 -9.309 1.210 871 HA ALA 114 HA ALA 114 -9.833 -7.799 0.427 872 HB1 ALA 114 HB1 ALA 114 -9.434 -7.541 2.836 873 HB2 ALA 114 HB2 ALA 114 -11.162 -7.370 2.477 874 HB3 ALA 114 HB3 ALA 114 -10.545 -8.877 3.192 875 H ASP 115 H ASP 115 -10.044 -11.082 1.899 876 HA ASP 115 HA ASP 115 -7.231 -11.408 2.183 877 HB2 ASP 115 HB2 ASP 115 -8.904 -12.746 3.401 878 HB3 ASP 115 HB3 ASP 115 -9.380 -13.534 1.890 879 H TRP 116 H TRP 116 -9.434 -12.206 -0.557 880 HA TRP 116 HA TRP 116 -7.413 -13.450 -2.185 881 HB2 TRP 116 HB2 TRP 116 -9.678 -13.734 -2.870 882 HB3 TRP 116 HB3 TRP 116 -10.002 -12.003 -2.824 883 HD1 TRP 116 HD1 TRP 116 -9.919 -10.803 -5.059 884 HE1 TRP 116 HE1 TRP 116 -8.790 -11.137 -7.347 885 HE3 TRP 116 HE3 TRP 116 -7.341 -15.121 -4.092 886 HZ2 TRP 116 HZ2 TRP 116 -6.951 -12.977 -8.556 887 HZ3 TRP 116 HZ3 TRP 116 -5.934 -16.158 -5.835 888 HH2 TRP 116 HH2 TRP 116 -5.705 -15.081 -8.073 889 H LEU 117 H LEU 117 -8.479 -10.018 -1.833 890 HA LEU 117 HA LEU 117 -6.750 -8.999 -3.851 891 HB2 LEU 117 HB2 LEU 117 -7.969 -7.723 -1.373 892 HB3 LEU 117 HB3 LEU 117 -7.032 -6.808 -2.542 893 HG LEU 117 HG LEU 117 -9.460 -8.435 -3.404 894 HD11 LEU 117 HD11 LEU 117 -10.781 -6.356 -3.245 895 HD12 LEU 117 HD12 LEU 117 -10.217 -6.902 -1.659 896 HD13 LEU 117 HD13 LEU 117 -9.406 -5.538 -2.463 897 HD21 LEU 117 HD21 LEU 117 -8.079 -6.012 -4.632 898 HD22 LEU 117 HD22 LEU 117 -7.931 -7.686 -5.200 899 HD23 LEU 117 HD23 LEU 117 -9.495 -6.861 -5.284 900 H TYR 118 H TYR 118 -6.243 -9.396 -0.290 901 HA TYR 118 HA TYR 118 -3.605 -8.331 -0.253 902 HB2 TYR 118 HB2 TYR 118 -4.807 -10.474 1.537 903 HB3 TYR 118 HB3 TYR 118 -3.351 -9.552 1.873 904 HD1 TYR 118 HD2 TYR 118 -4.541 -6.756 0.952 905 HD2 TYR 118 HD1 TYR 118 -5.923 -9.903 3.573 906 HE1 TYR 118 HE2 TYR 118 -5.882 -5.117 2.203 907 HE2 TYR 118 HE1 TYR 118 -7.272 -8.259 4.834 908 HH TYR 118 HH TYR 118 -7.358 -4.766 3.974 909 H TRP 119 H TRP 119 -4.757 -11.726 -0.780 910 HA TRP 119 HA TRP 119 -2.155 -12.879 -1.013 911 HB2 TRP 119 HB2 TRP 119 -3.976 -14.358 -0.792 912 HB3 TRP 119 HB3 TRP 119 -4.896 -13.591 -2.080 913 HD1 TRP 119 HD1 TRP 119 -4.473 -14.286 -4.527 914 HE1 TRP 119 HE1 TRP 119 -3.203 -16.173 -5.677 915 HE3 TRP 119 HE3 TRP 119 -1.718 -15.920 -0.534 916 HZ2 TRP 119 HZ2 TRP 119 -1.230 -18.170 -4.946 917 HZ3 TRP 119 HZ3 TRP 119 -0.152 -17.826 -0.790 918 HH2 TRP 119 HH2 TRP 119 0.102 -18.958 -2.991 919 H LEU 120 H LEU 120 -4.272 -11.333 -3.531 920 HA LEU 120 HA LEU 120 -2.472 -12.017 -5.612 921 HB2 LEU 120 HB2 LEU 120 -4.870 -11.362 -5.916 922 HB3 LEU 120 HB3 LEU 120 -4.445 -9.696 -5.503 923 HG LEU 120 HG LEU 120 -2.919 -9.603 -7.484 924 HD11 LEU 120 HD11 LEU 120 -3.998 -12.406 -8.051 925 HD12 LEU 120 HD12 LEU 120 -3.116 -11.402 -9.224 926 HD13 LEU 120 HD13 LEU 120 -2.300 -11.960 -7.767 927 HD21 LEU 120 HD21 LEU 120 -5.248 -8.853 -7.649 928 HD22 LEU 120 HD22 LEU 120 -4.699 -9.553 -9.180 929 HD23 LEU 120 HD23 LEU 120 -5.759 -10.495 -8.106 930 H ALA 121 H ALA 121 -2.718 -9.154 -3.498 931 HA ALA 121 HA ALA 121 -0.624 -7.633 -4.703 932 HB1 ALA 121 HB1 ALA 121 -1.786 -7.678 -1.884 933 HB2 ALA 121 HB2 ALA 121 -0.701 -6.412 -2.514 934 HB3 ALA 121 HB3 ALA 121 -2.311 -6.655 -3.230 935 H ARG 122 H ARG 122 -0.594 -10.067 -2.042 936 HA ARG 122 HA ARG 122 2.196 -9.959 -1.461 937 HB2 ARG 122 HB2 ARG 122 0.578 -11.130 -0.016 938 HB3 ARG 122 HB3 ARG 122 0.138 -12.205 -1.320 939 HG2 ARG 122 HG2 ARG 122 1.455 -13.441 0.151 940 HG3 ARG 122 HG3 ARG 122 2.411 -13.197 -1.298 941 HD2 ARG 122 HD2 ARG 122 3.501 -11.203 -0.030 942 HD3 ARG 122 HD3 ARG 122 2.745 -11.862 1.424 943 HE ARG 122 HE ARG 122 5.075 -12.810 0.020 944 HH11 ARG 122 HH11 ARG 122 2.372 -14.082 1.971 945 HH12 ARG 122 HH12 ARG 122 3.057 -15.681 2.073 946 HH21 ARG 122 HH21 ARG 122 6.039 -14.878 0.391 947 HH22 ARG 122 HH22 ARG 122 5.183 -16.083 1.307 948 H GLY 123 H GLY 123 0.357 -11.495 -4.054 949 HA2 GLY 123 HA2 GLY 123 1.858 -11.282 -6.104 950 HA3 GLY 123 HA3 GLY 123 2.840 -12.538 -5.342 951 H TYR 124 H TYR 124 1.279 -12.483 -7.848 952 HA TYR 124 HA TYR 124 -0.748 -14.584 -7.621 953 HB2 TYR 124 HB2 TYR 124 -0.753 -12.842 -9.418 954 HB3 TYR 124 HB3 TYR 124 0.735 -13.505 -10.059 955 HD1 TYR 124 HD1 TYR 124 -2.894 -14.129 -9.510 956 HD2 TYR 124 HD2 TYR 124 0.708 -15.543 -11.420 957 HE1 TYR 124 HE1 TYR 124 -4.242 -15.658 -10.904 958 HE2 TYR 124 HE2 TYR 124 -0.629 -17.106 -12.795 959 HH TYR 124 HH TYR 124 -4.219 -17.237 -12.587 960 H LYS 125 H LYS 125 0.613 -15.995 -6.249 961 HA LYS 125 HA LYS 125 2.718 -17.515 -7.709 962 HB2 LYS 125 HB2 LYS 125 2.766 -16.420 -4.861 963 HB3 LYS 125 HB3 LYS 125 3.973 -17.508 -5.527 964 HG2 LYS 125 HG2 LYS 125 3.398 -14.695 -6.537 965 HG3 LYS 125 HG3 LYS 125 4.698 -15.134 -5.449 966 HD2 LYS 125 HD2 LYS 125 4.391 -16.071 -8.333 967 HD3 LYS 125 HD3 LYS 125 5.496 -14.836 -7.766 968 HE2 LYS 125 HE2 LYS 125 5.584 -17.780 -6.953 969 HE3 LYS 125 HE3 LYS 125 6.573 -17.040 -8.208 970 HZ1 LYS 125 HZ1 LYS 125 6.680 -16.317 -5.337 971 HZ2 LYS 125 HZ2 LYS 125 7.788 -17.188 -6.151 972 HZ3 LYS 125 HZ3 LYS 125 7.572 -15.619 -6.519 973 H PHE 126 H PHE 126 0.212 -18.478 -7.795 974 HA PHE 126 HA PHE 126 -0.578 -20.270 -5.731 975 HB2 PHE 126 HB2 PHE 126 -0.719 -20.611 -8.751 976 HB3 PHE 126 HB3 PHE 126 -1.516 -21.639 -7.582 977 HD1 PHE 126 HD1 PHE 126 -2.845 -19.890 -5.670 978 HD2 PHE 126 HD2 PHE 126 -2.344 -19.402 -9.934 979 HE1 PHE 126 HE1 PHE 126 -4.877 -18.482 -5.764 980 HE2 PHE 126 HE2 PHE 126 -4.427 -18.072 -10.020 981 HZ PHE 126 HZ PHE 126 -5.699 -17.605 -7.936 Start of MODEL 15 1 H1 MET 1 H1 MET 1 5.575 -6.806 -4.824 2 H2 MET 1 H2 MET 1 5.931 -7.640 -3.458 3 H3 MET 1 H3 MET 1 4.415 -7.702 -4.081 4 HA MET 1 HA MET 1 5.699 -5.303 -2.971 5 HB2 MET 1 HB2 MET 1 4.144 -4.766 -4.794 6 HB3 MET 1 HB3 MET 1 2.864 -5.700 -4.021 7 HG2 MET 1 HG2 MET 1 2.953 -4.160 -2.062 8 HG3 MET 1 HG3 MET 1 4.185 -3.201 -2.886 9 HE1 MET 1 HE1 MET 1 2.201 -1.462 -5.752 10 HE2 MET 1 HE2 MET 1 3.742 -1.590 -4.877 11 HE3 MET 1 HE3 MET 1 3.182 -2.932 -5.904 12 H ALA 2 H ALA 2 6.135 -5.921 -0.865 13 HA ALA 2 HA ALA 2 4.289 -7.641 0.608 14 HB1 ALA 2 HB1 ALA 2 6.828 -6.205 1.489 15 HB2 ALA 2 HB2 ALA 2 5.982 -7.495 2.369 16 HB3 ALA 2 HB3 ALA 2 6.743 -7.854 0.812 17 H SER 3 H SER 3 4.034 -4.392 -0.111 18 HA SER 3 HA SER 3 3.538 -3.169 2.353 19 HB2 SER 3 HB2 SER 3 2.171 -2.499 -0.269 20 HB3 SER 3 HB3 SER 3 2.657 -1.397 1.032 21 HG SER 3 HG SER 3 4.140 -1.289 -0.678 22 H VAL 4 H VAL 4 1.580 -5.646 0.905 23 HA VAL 4 HA VAL 4 -0.969 -4.659 1.954 24 HB VAL 4 HB VAL 4 -1.782 -6.768 0.913 25 HG11 VAL 4 HG11 VAL 4 -1.762 -4.599 -0.314 26 HG12 VAL 4 HG12 VAL 4 -0.204 -5.046 -1.043 27 HG13 VAL 4 HG13 VAL 4 -1.660 -6.004 -1.376 28 HG21 VAL 4 HG21 VAL 4 0.292 -8.136 1.031 29 HG22 VAL 4 HG22 VAL 4 -0.377 -8.060 -0.600 30 HG23 VAL 4 HG23 VAL 4 1.042 -7.099 -0.206 31 H GLU 5 H GLU 5 -2.025 -6.900 2.921 32 HA GLU 5 HA GLU 5 -0.652 -7.292 5.479 33 HB2 GLU 5 HB2 GLU 5 -3.104 -8.686 4.324 34 HB3 GLU 5 HB3 GLU 5 -2.457 -8.885 5.961 35 HG2 GLU 5 HG2 GLU 5 -2.750 -6.385 6.287 36 HG3 GLU 5 HG3 GLU 5 -3.627 -6.344 4.756 37 H ARG 6 H ARG 6 0.918 -8.777 5.798 38 HA ARG 6 HA ARG 6 0.707 -11.393 4.575 39 HB2 ARG 6 HB2 ARG 6 2.902 -11.528 3.812 40 HB3 ARG 6 HB3 ARG 6 2.241 -10.035 3.147 41 HG2 ARG 6 HG2 ARG 6 4.249 -10.175 5.441 42 HG3 ARG 6 HG3 ARG 6 4.620 -9.947 3.745 43 HD2 ARG 6 HD2 ARG 6 4.671 -7.783 4.422 44 HD3 ARG 6 HD3 ARG 6 3.001 -7.905 3.849 45 HE ARG 6 HE ARG 6 3.079 -8.550 6.615 46 HH11 ARG 6 HH11 ARG 6 3.428 -5.762 4.454 47 HH12 ARG 6 HH12 ARG 6 3.176 -4.570 5.692 48 HH21 ARG 6 HH21 ARG 6 2.620 -6.986 8.251 49 HH22 ARG 6 HH22 ARG 6 2.634 -5.302 7.895 50 H ASP 7 H ASP 7 0.850 -12.810 6.229 51 HA ASP 7 HA ASP 7 2.391 -12.294 8.642 52 HB2 ASP 7 HB2 ASP 7 0.303 -10.979 9.068 53 HB3 ASP 7 HB3 ASP 7 -0.664 -12.413 8.715 54 H GLU 8 H GLU 8 2.551 -14.266 9.859 55 HA GLU 8 HA GLU 8 2.538 -16.633 8.353 56 HB2 GLU 8 HB2 GLU 8 3.102 -17.740 10.428 57 HB3 GLU 8 HB3 GLU 8 3.971 -16.219 10.289 58 HG2 GLU 8 HG2 GLU 8 2.317 -15.160 11.850 59 HG3 GLU 8 HG3 GLU 8 1.498 -16.716 12.010 60 H THR 9 H THR 9 -0.102 -15.245 10.353 61 HA THR 9 HA THR 9 -1.662 -17.625 10.489 62 HB THR 9 HB THR 9 -2.783 -14.819 10.347 63 HG1 THR 9 HG1 THR 9 -1.155 -14.573 11.705 64 HG21 THR 9 HG21 THR 9 -4.402 -16.674 10.573 65 HG22 THR 9 HG22 THR 9 -3.534 -17.270 12.004 66 HG23 THR 9 HG23 THR 9 -4.356 -15.691 12.044 67 H ARG 10 H ARG 10 -1.512 -14.983 8.014 68 HA ARG 10 HA ARG 10 -3.675 -16.062 6.405 69 HB2 ARG 10 HB2 ARG 10 -1.305 -14.293 5.612 70 HB3 ARG 10 HB3 ARG 10 -2.672 -14.661 4.580 71 HG2 ARG 10 HG2 ARG 10 -2.820 -13.073 7.180 72 HG3 ARG 10 HG3 ARG 10 -2.762 -12.411 5.546 73 HD2 ARG 10 HD2 ARG 10 -4.903 -13.728 5.054 74 HD3 ARG 10 HD3 ARG 10 -5.001 -14.029 6.802 75 HE ARG 10 HE ARG 10 -4.656 -11.217 6.059 76 HH11 ARG 10 HH11 ARG 10 -7.139 -13.727 6.611 77 HH12 ARG 10 HH12 ARG 10 -8.385 -12.542 6.936 78 HH21 ARG 10 HH21 ARG 10 -6.340 -9.739 6.395 79 HH22 ARG 10 HH22 ARG 10 -7.994 -10.305 6.607 80 H GLU 11 H GLU 11 -0.110 -16.309 6.354 81 HA GLU 11 HA GLU 11 0.085 -17.821 3.996 82 HB2 GLU 11 HB2 GLU 11 1.902 -16.533 4.958 83 HB3 GLU 11 HB3 GLU 11 1.929 -17.543 6.408 84 HG2 GLU 11 HG2 GLU 11 2.734 -19.446 5.182 85 HG3 GLU 11 HG3 GLU 11 2.487 -18.632 3.629 86 H HIS 12 H HIS 12 0.252 -19.061 7.415 87 HA HIS 12 HA HIS 12 0.502 -21.776 6.592 88 HB2 HIS 12 HB2 HIS 12 -0.563 -20.613 9.199 89 HB3 HIS 12 HB3 HIS 12 -0.270 -22.326 8.922 90 HD1 HIS 12 HD1 HIS 12 2.564 -22.634 7.920 91 HD2 HIS 12 HD2 HIS 12 1.317 -19.626 10.581 92 HE1 HIS 12 HE1 HIS 12 4.652 -21.893 9.171 93 H ARG 13 H ARG 13 -2.433 -19.874 7.589 94 HA ARG 13 HA ARG 13 -4.130 -22.173 7.447 95 HB2 ARG 13 HB2 ARG 13 -4.820 -19.218 7.148 96 HB3 ARG 13 HB3 ARG 13 -6.008 -20.500 7.323 97 HG2 ARG 13 HG2 ARG 13 -3.876 -19.813 9.399 98 HG3 ARG 13 HG3 ARG 13 -5.555 -19.292 9.452 99 HD2 ARG 13 HD2 ARG 13 -4.552 -22.169 9.596 100 HD3 ARG 13 HD3 ARG 13 -5.096 -21.198 10.954 101 HE ARG 13 HE ARG 13 -6.748 -22.511 8.894 102 HH11 ARG 13 HH11 ARG 13 -6.815 -20.128 11.553 103 HH12 ARG 13 HH12 ARG 13 -8.527 -20.228 11.737 104 HH21 ARG 13 HH21 ARG 13 -8.840 -22.649 9.122 105 HH22 ARG 13 HH22 ARG 13 -9.767 -21.727 10.297 106 H ILE 14 H ILE 14 -3.346 -19.736 4.879 107 HA ILE 14 HA ILE 14 -5.203 -20.961 3.100 108 HB ILE 14 HB ILE 14 -4.197 -18.600 3.052 109 HG12 ILE 14 HG12 ILE 14 -4.561 -20.125 0.450 110 HG13 ILE 14 HG13 ILE 14 -5.850 -19.535 1.504 111 HG21 ILE 14 HG21 ILE 14 -2.127 -19.852 1.201 112 HG22 ILE 14 HG22 ILE 14 -2.328 -18.138 1.602 113 HG23 ILE 14 HG23 ILE 14 -1.788 -19.257 2.843 114 HD11 ILE 14 HD11 ILE 14 -4.983 -17.199 1.203 115 HD12 ILE 14 HD12 ILE 14 -3.893 -17.837 -0.054 116 HD13 ILE 14 HD13 ILE 14 -5.655 -17.979 -0.242 117 H GLU 15 H GLU 15 -1.709 -21.488 3.697 118 HA GLU 15 HA GLU 15 -1.269 -23.290 1.544 119 HB2 GLU 15 HB2 GLU 15 0.517 -22.163 2.752 120 HB3 GLU 15 HB3 GLU 15 0.077 -22.976 4.263 121 HG2 GLU 15 HG2 GLU 15 0.721 -25.140 3.349 122 HG3 GLU 15 HG3 GLU 15 1.022 -24.423 1.760 123 H THR 16 H THR 16 -2.481 -23.842 4.878 124 HA THR 16 HA THR 16 -2.314 -26.740 4.459 125 HB THR 16 HB THR 16 -2.908 -26.844 6.874 126 HG1 THR 16 HG1 THR 16 -2.549 -24.034 6.814 127 HG21 THR 16 HG21 THR 16 -0.563 -26.844 6.148 128 HG22 THR 16 HG22 THR 16 -0.520 -25.070 6.189 129 HG23 THR 16 HG23 THR 16 -0.755 -25.995 7.689 130 H GLU 17 H GLU 17 -4.823 -24.427 3.979 131 HA GLU 17 HA GLU 17 -6.807 -26.675 4.061 132 HB2 GLU 17 HB2 GLU 17 -7.237 -23.815 5.007 133 HB3 GLU 17 HB3 GLU 17 -8.464 -25.076 4.912 134 HG2 GLU 17 HG2 GLU 17 -7.082 -26.462 6.515 135 HG3 GLU 17 HG3 GLU 17 -6.042 -25.050 6.750 136 H ILE 18 H ILE 18 -5.597 -23.971 2.136 137 HA ILE 18 HA ILE 18 -8.081 -24.110 0.481 138 HB ILE 18 HB ILE 18 -6.221 -21.887 1.259 139 HG12 ILE 18 HG12 ILE 18 -9.260 -22.117 1.266 140 HG13 ILE 18 HG13 ILE 18 -8.266 -22.601 2.630 141 HG21 ILE 18 HG21 ILE 18 -8.154 -21.848 -1.078 142 HG22 ILE 18 HG22 ILE 18 -7.456 -20.391 -0.331 143 HG23 ILE 18 HG23 ILE 18 -6.407 -21.549 -1.119 144 HD11 ILE 18 HD11 ILE 18 -8.410 -19.760 1.565 145 HD12 ILE 18 HD12 ILE 18 -9.230 -20.402 2.994 146 HD13 ILE 18 HD13 ILE 18 -7.463 -20.331 2.961 147 H ILE 19 H ILE 19 -4.488 -24.129 0.192 148 HA ILE 19 HA ILE 19 -4.990 -25.455 -2.438 149 HB ILE 19 HB ILE 19 -2.918 -24.548 -3.326 150 HG12 ILE 19 HG12 ILE 19 -1.958 -23.916 -0.988 151 HG13 ILE 19 HG13 ILE 19 -1.542 -23.002 -2.426 152 HG21 ILE 19 HG21 ILE 19 -4.977 -22.426 -2.655 153 HG22 ILE 19 HG22 ILE 19 -3.789 -22.377 -3.972 154 HG23 ILE 19 HG23 ILE 19 -5.062 -23.608 -3.964 155 HD11 ILE 19 HD11 ILE 19 -3.694 -22.090 -0.489 156 HD12 ILE 19 HD12 ILE 19 -1.990 -21.600 -0.410 157 HD13 ILE 19 HD13 ILE 19 -2.971 -21.167 -1.819 158 H VAL 20 H VAL 20 -4.511 -26.420 0.431 159 HA VAL 20 HA VAL 20 -2.028 -27.698 0.586 160 HB VAL 20 HB VAL 20 -3.773 -27.355 2.326 161 HG11 VAL 20 HG11 VAL 20 -5.773 -28.237 1.210 162 HG12 VAL 20 HG12 VAL 20 -5.106 -29.883 1.339 163 HG13 VAL 20 HG13 VAL 20 -5.497 -28.960 2.796 164 HG21 VAL 20 HG21 VAL 20 -1.783 -28.739 2.748 165 HG22 VAL 20 HG22 VAL 20 -3.186 -29.325 3.657 166 HG23 VAL 20 HG23 VAL 20 -2.663 -30.181 2.192 167 H ASP 21 H ASP 21 -4.973 -28.675 -1.050 168 HA ASP 21 HA ASP 21 -4.033 -31.348 -1.729 169 HB2 ASP 21 HB2 ASP 21 -6.384 -30.768 -1.107 170 HB3 ASP 21 HB3 ASP 21 -6.523 -29.828 -2.593 171 H ALA 22 H ALA 22 -3.043 -28.492 -3.016 172 HA ALA 22 HA ALA 22 -3.233 -29.346 -5.878 173 HB1 ALA 22 HB1 ALA 22 -3.349 -26.576 -4.605 174 HB2 ALA 22 HB2 ALA 22 -3.281 -26.895 -6.337 175 HB3 ALA 22 HB3 ALA 22 -4.692 -27.434 -5.397 176 H GLU 23 H GLU 23 -1.474 -29.001 -7.183 177 HA GLU 23 HA GLU 23 0.828 -27.485 -6.133 178 HB2 GLU 23 HB2 GLU 23 2.456 -29.148 -6.808 179 HB3 GLU 23 HB3 GLU 23 1.392 -29.770 -5.551 180 HG2 GLU 23 HG2 GLU 23 0.117 -31.057 -7.250 181 HG3 GLU 23 HG3 GLU 23 1.163 -30.422 -8.524 182 H ASP 24 H ASP 24 -1.023 -28.759 -8.884 183 HA ASP 24 HA ASP 24 0.653 -27.278 -10.836 184 HB2 ASP 24 HB2 ASP 24 -0.325 -29.429 -11.496 185 HB3 ASP 24 HB3 ASP 24 -1.944 -28.823 -11.149 186 H LYS 25 H LYS 25 -0.089 -25.424 -11.964 187 HA LYS 25 HA LYS 25 -1.374 -23.470 -10.484 188 HB2 LYS 25 HB2 LYS 25 -1.475 -22.152 -12.526 189 HB3 LYS 25 HB3 LYS 25 0.072 -22.996 -12.392 190 HG2 LYS 25 HG2 LYS 25 -0.815 -24.746 -13.989 191 HG3 LYS 25 HG3 LYS 25 -2.290 -23.777 -14.165 192 HD2 LYS 25 HD2 LYS 25 -0.957 -21.893 -15.048 193 HD3 LYS 25 HD3 LYS 25 0.522 -22.878 -14.898 194 HE2 LYS 25 HE2 LYS 25 -0.487 -24.600 -16.383 195 HE3 LYS 25 HE3 LYS 25 -1.952 -23.629 -16.526 196 HZ1 LYS 25 HZ1 LYS 25 0.736 -22.803 -17.476 197 HZ2 LYS 25 HZ2 LYS 25 -0.489 -23.306 -18.423 198 HZ3 LYS 25 HZ3 LYS 25 -0.622 -21.901 -17.610 199 H GLU 26 H GLU 26 -2.999 -25.771 -12.743 200 HA GLU 26 HA GLU 26 -5.498 -24.297 -12.699 201 HB2 GLU 26 HB2 GLU 26 -4.871 -27.212 -13.360 202 HB3 GLU 26 HB3 GLU 26 -6.452 -26.455 -13.549 203 HG2 GLU 26 HG2 GLU 26 -5.469 -24.776 -15.105 204 HG3 GLU 26 HG3 GLU 26 -3.908 -25.587 -14.989 205 H GLU 27 H GLU 27 -4.081 -26.943 -10.740 206 HA GLU 27 HA GLU 27 -6.453 -27.515 -9.214 207 HB2 GLU 27 HB2 GLU 27 -3.534 -27.828 -8.430 208 HB3 GLU 27 HB3 GLU 27 -4.910 -28.619 -7.660 209 HG2 GLU 27 HG2 GLU 27 -5.356 -29.921 -9.667 210 HG3 GLU 27 HG3 GLU 27 -4.069 -29.093 -10.548 211 H ARG 28 H ARG 28 -3.686 -25.261 -8.809 212 HA ARG 28 HA ARG 28 -4.466 -24.318 -6.208 213 HB2 ARG 28 HB2 ARG 28 -2.860 -22.973 -8.416 214 HB3 ARG 28 HB3 ARG 28 -3.012 -22.342 -6.773 215 HG2 ARG 28 HG2 ARG 28 -1.848 -24.258 -5.832 216 HG3 ARG 28 HG3 ARG 28 -1.861 -25.100 -7.382 217 HD2 ARG 28 HD2 ARG 28 -0.525 -23.162 -8.347 218 HD3 ARG 28 HD3 ARG 28 -0.317 -22.570 -6.699 219 HE ARG 28 HE ARG 28 0.742 -25.081 -7.924 220 HH11 ARG 28 HH11 ARG 28 0.800 -22.926 -5.086 221 HH12 ARG 28 HH12 ARG 28 2.263 -23.594 -4.465 222 HH21 ARG 28 HH21 ARG 28 2.606 -25.927 -7.142 223 HH22 ARG 28 HH22 ARG 28 3.338 -25.363 -5.668 224 H ALA 29 H ALA 29 -5.364 -23.251 -9.521 225 HA ALA 29 HA ALA 29 -6.864 -20.962 -8.656 226 HB1 ALA 29 HB1 ALA 29 -7.832 -21.003 -10.882 227 HB2 ALA 29 HB2 ALA 29 -6.101 -21.357 -11.014 228 HB3 ALA 29 HB3 ALA 29 -7.295 -22.670 -11.148 229 H MET 30 H MET 30 -7.720 -24.441 -9.206 230 HA MET 30 HA MET 30 -10.470 -24.135 -8.524 231 HB2 MET 30 HB2 MET 30 -8.656 -26.559 -8.325 232 HB3 MET 30 HB3 MET 30 -10.400 -26.590 -8.092 233 HG2 MET 30 HG2 MET 30 -9.042 -25.700 -10.655 234 HG3 MET 30 HG3 MET 30 -9.655 -27.310 -10.335 235 HE1 MET 30 HE1 MET 30 -10.231 -23.724 -11.145 236 HE2 MET 30 HE2 MET 30 -11.880 -23.662 -11.820 237 HE3 MET 30 HE3 MET 30 -11.636 -23.476 -10.084 238 H GLY 31 H GLY 31 -7.640 -24.863 -6.413 239 HA2 GLY 31 HA2 GLY 31 -9.050 -25.306 -4.026 240 HA3 GLY 31 HA3 GLY 31 -7.427 -24.600 -4.152 241 H TRP 32 H TRP 32 -7.695 -22.191 -5.244 242 HA TRP 32 HA TRP 32 -8.859 -20.462 -3.366 243 HB2 TRP 32 HB2 TRP 32 -7.946 -20.158 -6.227 244 HB3 TRP 32 HB3 TRP 32 -8.833 -18.860 -5.452 245 HD1 TRP 32 HD1 TRP 32 -5.453 -20.620 -5.253 246 HE1 TRP 32 HE1 TRP 32 -3.802 -19.084 -4.077 247 HE3 TRP 32 HE3 TRP 32 -8.755 -17.109 -3.532 248 HZ2 TRP 32 HZ2 TRP 32 -3.947 -16.747 -2.328 249 HZ3 TRP 32 HZ3 TRP 32 -7.981 -15.281 -2.052 250 HH2 TRP 32 HH2 TRP 32 -5.575 -15.076 -1.462 251 H TYR 33 H TYR 33 -10.218 -21.535 -6.566 252 HA TYR 33 HA TYR 33 -12.589 -20.058 -6.397 253 HB2 TYR 33 HB2 TYR 33 -11.942 -21.118 -8.461 254 HB3 TYR 33 HB3 TYR 33 -11.990 -22.716 -7.730 255 HD1 TYR 33 HD1 TYR 33 -14.076 -19.920 -8.979 256 HD2 TYR 33 HD2 TYR 33 -14.080 -23.903 -7.332 257 HE1 TYR 33 HE1 TYR 33 -16.433 -20.176 -9.634 258 HE2 TYR 33 HE2 TYR 33 -16.496 -24.108 -7.824 259 HH TYR 33 HH TYR 33 -18.342 -21.534 -9.535 260 H TYR 34 H TYR 34 -11.971 -23.411 -5.142 261 HA TYR 34 HA TYR 34 -14.671 -23.944 -4.545 262 HB2 TYR 34 HB2 TYR 34 -12.146 -25.024 -3.227 263 HB3 TYR 34 HB3 TYR 34 -13.756 -25.666 -2.957 264 HD1 TYR 34 HD2 TYR 34 -14.894 -25.761 -5.749 265 HD2 TYR 34 HD1 TYR 34 -11.013 -26.843 -4.193 266 HE1 TYR 34 HE2 TYR 34 -14.610 -27.366 -7.594 267 HE2 TYR 34 HE1 TYR 34 -10.736 -28.483 -6.023 268 HH TYR 34 HH TYR 34 -13.227 -28.971 -8.572 269 H TYR 35 H TYR 35 -12.056 -22.693 -2.319 270 HA TYR 35 HA TYR 35 -14.015 -22.502 -0.197 271 HB2 TYR 35 HB2 TYR 35 -12.368 -21.964 1.186 272 HB3 TYR 35 HB3 TYR 35 -11.340 -22.583 -0.089 273 HD1 TYR 35 HD1 TYR 35 -10.194 -20.947 -1.630 274 HD2 TYR 35 HD2 TYR 35 -12.387 -19.637 1.834 275 HE1 TYR 35 HE1 TYR 35 -9.074 -18.749 -1.772 276 HE2 TYR 35 HE2 TYR 35 -11.292 -17.425 1.708 277 HH TYR 35 HH TYR 35 -9.745 -16.101 0.588 278 H LEU 36 H LEU 36 -12.767 -20.183 -2.650 279 HA LEU 36 HA LEU 36 -13.865 -17.870 -1.482 280 HB2 LEU 36 HB2 LEU 36 -12.167 -17.817 -3.230 281 HB3 LEU 36 HB3 LEU 36 -13.281 -18.564 -4.383 282 HG LEU 36 HG LEU 36 -14.714 -16.561 -4.346 283 HD11 LEU 36 HD11 LEU 36 -14.283 -15.690 -2.074 284 HD12 LEU 36 HD12 LEU 36 -12.582 -15.381 -2.500 285 HD13 LEU 36 HD13 LEU 36 -13.885 -14.465 -3.283 286 HD21 LEU 36 HD21 LEU 36 -11.778 -15.891 -4.843 287 HD22 LEU 36 HD22 LEU 36 -12.811 -16.826 -5.942 288 HD23 LEU 36 HD23 LEU 36 -13.204 -15.142 -5.601 289 H ASP 37 H ASP 37 -15.254 -20.007 -4.065 290 HA ASP 37 HA ASP 37 -17.691 -18.578 -4.372 291 HB2 ASP 37 HB2 ASP 37 -16.885 -20.268 -5.973 292 HB3 ASP 37 HB3 ASP 37 -17.076 -21.536 -4.759 293 H ASP 38 H ASP 38 -16.777 -21.230 -2.142 294 HA ASP 38 HA ASP 38 -19.363 -21.502 -0.925 295 HB2 ASP 38 HB2 ASP 38 -17.629 -23.230 -0.800 296 HB3 ASP 38 HB3 ASP 38 -16.587 -22.151 0.131 297 H THR 39 H THR 39 -16.822 -19.101 -0.461 298 HA THR 39 HA THR 39 -17.804 -18.362 2.227 299 HB THR 39 HB THR 39 -15.436 -17.397 0.570 300 HG1 THR 39 HG1 THR 39 -15.112 -19.424 1.219 301 HG21 THR 39 HG21 THR 39 -15.947 -15.606 2.057 302 HG22 THR 39 HG22 THR 39 -16.333 -16.700 3.391 303 HG23 THR 39 HG23 THR 39 -14.650 -16.516 2.843 304 H LEU 40 H LEU 40 -17.676 -17.039 -1.112 305 HA LEU 40 HA LEU 40 -18.507 -14.396 -0.515 306 HB2 LEU 40 HB2 LEU 40 -18.989 -16.133 -2.958 307 HB3 LEU 40 HB3 LEU 40 -19.441 -14.432 -2.871 308 HG LEU 40 HG LEU 40 -16.614 -15.503 -2.683 309 HD11 LEU 40 HD11 LEU 40 -16.339 -14.561 -4.940 310 HD12 LEU 40 HD12 LEU 40 -17.616 -15.782 -4.918 311 HD13 LEU 40 HD13 LEU 40 -18.043 -14.058 -4.950 312 HD21 LEU 40 HD21 LEU 40 -15.964 -13.107 -3.106 313 HD22 LEU 40 HD22 LEU 40 -17.622 -12.670 -2.648 314 HD23 LEU 40 HD23 LEU 40 -16.533 -13.509 -1.493 315 H GLU 41 H GLU 41 -20.384 -13.880 0.617 316 HA GLU 41 HA GLU 41 -22.767 -15.582 0.419 317 HB2 GLU 41 HB2 GLU 41 -22.271 -12.973 1.916 318 HB3 GLU 41 HB3 GLU 41 -23.775 -13.912 1.939 319 HG2 GLU 41 HG2 GLU 41 -22.286 -15.921 2.664 320 HG3 GLU 41 HG3 GLU 41 -21.074 -14.703 3.060 321 H PHE 42 H PHE 42 -22.237 -15.060 -2.042 322 HA PHE 42 HA PHE 42 -23.107 -12.593 -3.138 323 HB2 PHE 42 HB2 PHE 42 -22.953 -13.710 -5.287 324 HB3 PHE 42 HB3 PHE 42 -21.586 -14.130 -4.291 325 HD1 PHE 42 HD2 PHE 42 -24.861 -15.385 -5.611 326 HD2 PHE 42 HD1 PHE 42 -21.076 -16.453 -3.828 327 HE1 PHE 42 HE2 PHE 42 -25.316 -17.777 -6.059 328 HE2 PHE 42 HE1 PHE 42 -21.540 -18.835 -4.277 329 HZ PHE 42 HZ PHE 42 -23.660 -19.512 -5.390 330 HA PRO 43 HA PRO 43 -24.221 -11.964 -5.264 331 HB2 PRO 43 HB2 PRO 43 -26.210 -10.175 -5.743 332 HB3 PRO 43 HB3 PRO 43 -26.131 -11.773 -6.545 333 HG2 PRO 43 HG2 PRO 43 -27.761 -11.001 -4.106 334 HG3 PRO 43 HG3 PRO 43 -28.306 -11.880 -5.571 335 HD2 PRO 43 HD2 PRO 43 -27.575 -13.178 -3.275 336 HD3 PRO 43 HD3 PRO 43 -27.235 -13.867 -4.889 337 H PHE 44 H PHE 44 -23.439 -9.806 -4.976 338 HA PHE 44 HA PHE 44 -24.111 -8.315 -2.537 339 HB2 PHE 44 HB2 PHE 44 -21.897 -8.233 -1.672 340 HB3 PHE 44 HB3 PHE 44 -22.392 -9.906 -1.757 341 HD1 PHE 44 HD1 PHE 44 -21.429 -11.392 -3.641 342 HD2 PHE 44 HD2 PHE 44 -19.866 -7.498 -2.670 343 HE1 PHE 44 HE1 PHE 44 -19.291 -11.979 -4.741 344 HE2 PHE 44 HE2 PHE 44 -17.757 -8.059 -3.835 345 HZ PHE 44 HZ PHE 44 -17.452 -10.308 -4.854 346 H MET 45 H MET 45 -22.106 -6.353 -2.724 347 HA MET 45 HA MET 45 -22.188 -5.526 -5.571 348 HB2 MET 45 HB2 MET 45 -23.036 -3.424 -5.179 349 HB3 MET 45 HB3 MET 45 -24.108 -4.482 -4.291 350 HG2 MET 45 HG2 MET 45 -23.433 -3.678 -2.228 351 HG3 MET 45 HG3 MET 45 -21.814 -3.262 -2.763 352 HE1 MET 45 HE1 MET 45 -21.064 -1.203 -4.059 353 HE2 MET 45 HE2 MET 45 -22.232 -1.347 -5.382 354 HE3 MET 45 HE3 MET 45 -22.104 0.169 -4.470 355 H GLY 46 H GLY 46 -20.810 -3.692 -6.066 356 HA2 GLY 46 HA2 GLY 46 -18.566 -3.115 -4.267 357 HA3 GLY 46 HA3 GLY 46 -18.169 -4.214 -5.603 358 H LYS 47 H LYS 47 -16.750 -2.219 -5.724 359 HA LYS 47 HA LYS 47 -17.884 -0.522 -7.899 360 HB2 LYS 47 HB2 LYS 47 -17.033 0.660 -5.739 361 HB3 LYS 47 HB3 LYS 47 -15.430 0.121 -6.211 362 HG2 LYS 47 HG2 LYS 47 -15.531 2.279 -7.117 363 HG3 LYS 47 HG3 LYS 47 -15.953 1.269 -8.504 364 HD2 LYS 47 HD2 LYS 47 -17.528 3.021 -8.550 365 HD3 LYS 47 HD3 LYS 47 -18.405 1.650 -7.864 366 HE2 LYS 47 HE2 LYS 47 -18.186 2.544 -5.615 367 HE3 LYS 47 HE3 LYS 47 -17.113 3.832 -6.181 368 HZ1 LYS 47 HZ1 LYS 47 -19.448 4.541 -5.860 369 HZ2 LYS 47 HZ2 LYS 47 -18.928 4.804 -7.380 370 HZ3 LYS 47 HZ3 LYS 47 -19.933 3.557 -7.080 371 H TRP 48 H TRP 48 -17.142 -1.204 -9.841 372 HA TRP 48 HA TRP 48 -14.746 -2.939 -10.021 373 HB2 TRP 48 HB2 TRP 48 -16.744 -3.345 -11.477 374 HB3 TRP 48 HB3 TRP 48 -16.491 -1.779 -12.228 375 HD1 TRP 48 HD1 TRP 48 -13.091 -2.855 -12.021 376 HE1 TRP 48 HE1 TRP 48 -12.252 -4.064 -14.026 377 HE3 TRP 48 HE3 TRP 48 -17.614 -4.074 -14.113 378 HZ2 TRP 48 HZ2 TRP 48 -13.367 -5.542 -16.267 379 HZ3 TRP 48 HZ3 TRP 48 -17.659 -5.447 -16.178 380 HH2 TRP 48 HH2 TRP 48 -15.546 -6.182 -17.257 381 H LYS 49 H LYS 49 -12.906 -1.869 -9.708 382 HA LYS 49 HA LYS 49 -12.598 1.003 -10.190 383 HB2 LYS 49 HB2 LYS 49 -10.524 -1.078 -9.358 384 HB3 LYS 49 HB3 LYS 49 -10.441 0.660 -9.097 385 HG2 LYS 49 HG2 LYS 49 -12.408 -1.265 -7.760 386 HG3 LYS 49 HG3 LYS 49 -10.903 -0.739 -7.060 387 HD2 LYS 49 HD2 LYS 49 -13.069 1.269 -7.819 388 HD3 LYS 49 HD3 LYS 49 -13.059 0.384 -6.290 389 HE2 LYS 49 HE2 LYS 49 -10.621 1.186 -6.009 390 HE3 LYS 49 HE3 LYS 49 -10.981 2.361 -7.286 391 HZ1 LYS 49 HZ1 LYS 49 -11.344 3.196 -5.010 392 HZ2 LYS 49 HZ2 LYS 49 -12.708 3.274 -5.905 393 HZ3 LYS 49 HZ3 LYS 49 -12.513 2.071 -4.757 394 H LYS 50 H LYS 50 -13.258 0.221 -12.625 395 HA LYS 50 HA LYS 50 -11.511 -1.497 -14.047 396 HB2 LYS 50 HB2 LYS 50 -13.822 -1.030 -14.721 397 HB3 LYS 50 HB3 LYS 50 -13.403 0.644 -15.107 398 HG2 LYS 50 HG2 LYS 50 -11.899 -0.060 -16.886 399 HG3 LYS 50 HG3 LYS 50 -12.090 -1.762 -16.448 400 HD2 LYS 50 HD2 LYS 50 -14.344 0.029 -17.465 401 HD3 LYS 50 HD3 LYS 50 -13.366 -1.049 -18.475 402 HE2 LYS 50 HE2 LYS 50 -14.087 -2.985 -17.031 403 HE3 LYS 50 HE3 LYS 50 -15.183 -1.900 -16.172 404 HZ1 LYS 50 HZ1 LYS 50 -16.329 -3.092 -17.916 405 HZ2 LYS 50 HZ2 LYS 50 -16.312 -1.507 -18.315 406 HZ3 LYS 50 HZ3 LYS 50 -15.306 -2.553 -19.064 407 H LYS 51 H LYS 51 -9.511 -1.187 -14.865 408 HA LYS 51 HA LYS 51 -8.257 1.416 -14.615 409 HB2 LYS 51 HB2 LYS 51 -7.223 -0.888 -14.130 410 HB3 LYS 51 HB3 LYS 51 -7.021 -1.056 -15.878 411 HG2 LYS 51 HG2 LYS 51 -5.740 1.150 -15.832 412 HG3 LYS 51 HG3 LYS 51 -5.894 1.133 -14.061 413 HD2 LYS 51 HD2 LYS 51 -4.762 -1.151 -14.093 414 HD3 LYS 51 HD3 LYS 51 -4.437 -0.910 -15.812 415 HE2 LYS 51 HE2 LYS 51 -3.481 0.862 -13.514 416 HE3 LYS 51 HE3 LYS 51 -2.503 -0.346 -14.348 417 HZ1 LYS 51 HZ1 LYS 51 -3.641 2.079 -15.630 418 HZ2 LYS 51 HZ2 LYS 51 -2.074 1.869 -15.185 419 HZ3 LYS 51 HZ3 LYS 51 -2.719 0.977 -16.390 420 H SER 52 H SER 52 -10.064 2.179 -16.077 421 HA SER 52 HA SER 52 -10.996 2.754 -18.092 422 HB2 SER 52 HB2 SER 52 -9.575 4.584 -19.005 423 HB3 SER 52 HB3 SER 52 -9.777 4.611 -17.251 424 HG SER 52 HG SER 52 -7.735 3.947 -16.944 425 H ARG 53 H ARG 53 -7.860 2.866 -19.606 426 HA ARG 53 HA ARG 53 -8.420 0.538 -21.345 427 HB2 ARG 53 HB2 ARG 53 -7.784 1.825 -23.374 428 HB3 ARG 53 HB3 ARG 53 -9.349 2.244 -22.717 429 HG2 ARG 53 HG2 ARG 53 -6.930 3.906 -21.973 430 HG3 ARG 53 HG3 ARG 53 -7.666 4.109 -23.552 431 HD2 ARG 53 HD2 ARG 53 -9.523 5.131 -22.784 432 HD3 ARG 53 HD3 ARG 53 -9.632 4.148 -21.325 433 HE ARG 53 HE ARG 53 -7.502 5.570 -20.666 434 HH11 ARG 53 HH11 ARG 53 -10.458 6.783 -22.215 435 HH12 ARG 53 HH12 ARG 53 -10.446 8.294 -21.385 436 HH21 ARG 53 HH21 ARG 53 -7.575 7.540 -19.425 437 HH22 ARG 53 HH22 ARG 53 -8.716 8.754 -19.845 438 H LYS 54 H LYS 54 -6.854 0.498 -19.218 439 HA LYS 54 HA LYS 54 -4.914 -0.192 -18.456 440 HB2 LYS 54 HB2 LYS 54 -4.721 -1.328 -20.725 441 HB3 LYS 54 HB3 LYS 54 -3.624 -0.022 -21.196 442 HG2 LYS 54 HG2 LYS 54 -2.068 -0.647 -19.399 443 HG3 LYS 54 HG3 LYS 54 -3.211 -1.869 -18.802 444 HD2 LYS 54 HD2 LYS 54 -3.037 -3.076 -20.962 445 HD3 LYS 54 HD3 LYS 54 -1.883 -1.879 -21.558 446 HE2 LYS 54 HE2 LYS 54 -1.475 -3.646 -19.097 447 HE3 LYS 54 HE3 LYS 54 -0.863 -4.021 -20.709 448 HZ1 LYS 54 HZ1 LYS 54 -0.068 -1.658 -19.109 449 HZ2 LYS 54 HZ2 LYS 54 0.835 -2.987 -19.372 450 HZ3 LYS 54 HZ3 LYS 54 0.475 -2.002 -20.616 451 H THR 55 H THR 55 -5.269 2.868 -19.902 452 HA THR 55 HA THR 55 -2.881 4.183 -19.181 453 HB THR 55 HB THR 55 -4.687 6.132 -18.986 454 HG1 THR 55 HG1 THR 55 -6.513 4.665 -18.859 455 HG21 THR 55 HG21 THR 55 -3.182 5.819 -20.925 456 HG22 THR 55 HG22 THR 55 -4.275 4.578 -21.581 457 HG23 THR 55 HG23 THR 55 -4.818 6.265 -21.440 458 H SER 56 H SER 56 -2.891 5.949 -17.372 459 HA SER 56 HA SER 56 -2.993 4.691 -14.818 460 HB2 SER 56 HB2 SER 56 -2.619 7.189 -14.148 461 HB3 SER 56 HB3 SER 56 -1.379 6.334 -15.076 462 HG SER 56 HG SER 56 -1.835 8.410 -15.935 463 H THR 57 H THR 57 -5.440 6.430 -16.684 464 HA THR 57 HA THR 57 -7.037 7.379 -14.574 465 HB THR 57 HB THR 57 -8.235 6.398 -17.155 466 HG1 THR 57 HG1 THR 57 -6.469 8.605 -17.038 467 HG21 THR 57 HG21 THR 57 -9.654 7.671 -15.623 468 HG22 THR 57 HG22 THR 57 -8.492 9.014 -15.628 469 HG23 THR 57 HG23 THR 57 -9.370 8.580 -17.114 470 H ILE 58 H ILE 58 -8.895 6.522 -13.574 471 HA ILE 58 HA ILE 58 -9.552 3.668 -14.057 472 HB ILE 58 HB ILE 58 -9.170 5.094 -11.410 473 HG12 ILE 58 HG12 ILE 58 -7.891 2.708 -12.809 474 HG13 ILE 58 HG13 ILE 58 -7.130 4.226 -12.341 475 HG21 ILE 58 HG21 ILE 58 -10.407 2.356 -11.880 476 HG22 ILE 58 HG22 ILE 58 -10.041 3.073 -10.293 477 HG23 ILE 58 HG23 ILE 58 -11.284 3.786 -11.302 478 HD11 ILE 58 HD11 ILE 58 -8.019 1.985 -10.500 479 HD12 ILE 58 HD12 ILE 58 -6.370 2.484 -10.893 480 HD13 ILE 58 HD13 ILE 58 -7.412 3.569 -9.937 481 H GLU 59 H GLU 59 -11.652 3.210 -14.135 482 HA GLU 59 HA GLU 59 -13.635 5.438 -14.047 483 HB2 GLU 59 HB2 GLU 59 -13.516 2.924 -15.782 484 HB3 GLU 59 HB3 GLU 59 -14.914 3.988 -15.664 485 HG2 GLU 59 HG2 GLU 59 -12.150 4.732 -16.718 486 HG3 GLU 59 HG3 GLU 59 -13.583 4.424 -17.688 487 H GLU 60 H GLU 60 -14.371 5.217 -12.004 488 HA GLU 60 HA GLU 60 -14.594 2.599 -10.698 489 HB2 GLU 60 HB2 GLU 60 -15.290 5.437 -9.801 490 HB3 GLU 60 HB3 GLU 60 -15.401 3.989 -8.798 491 HG2 GLU 60 HG2 GLU 60 -12.932 3.600 -9.200 492 HG3 GLU 60 HG3 GLU 60 -12.867 5.167 -10.017 493 H LYS 61 H LYS 61 -16.266 1.361 -11.480 494 HA LYS 61 HA LYS 61 -18.898 2.685 -12.074 495 HB2 LYS 61 HB2 LYS 61 -17.765 -0.010 -12.937 496 HB3 LYS 61 HB3 LYS 61 -19.392 0.578 -13.288 497 HG2 LYS 61 HG2 LYS 61 -18.430 2.478 -14.580 498 HG3 LYS 61 HG3 LYS 61 -16.801 1.910 -14.205 499 HD2 LYS 61 HD2 LYS 61 -17.353 1.172 -16.438 500 HD3 LYS 61 HD3 LYS 61 -17.245 -0.223 -15.362 501 HE2 LYS 61 HE2 LYS 61 -19.125 -0.531 -16.854 502 HE3 LYS 61 HE3 LYS 61 -19.709 -0.330 -15.204 503 HZ1 LYS 61 HZ1 LYS 61 -19.778 1.739 -17.324 504 HZ2 LYS 61 HZ2 LYS 61 -21.054 0.912 -16.681 505 HZ3 LYS 61 HZ3 LYS 61 -20.245 1.980 -15.761 506 H THR 62 H THR 62 -20.489 2.366 -10.529 507 HA THR 62 HA THR 62 -20.125 0.466 -8.384 508 HB THR 62 HB THR 62 -22.696 1.853 -9.247 509 HG1 THR 62 HG1 THR 62 -21.978 3.651 -8.336 510 HG21 THR 62 HG21 THR 62 -22.868 0.190 -7.387 511 HG22 THR 62 HG22 THR 62 -21.591 1.065 -6.512 512 HG23 THR 62 HG23 THR 62 -23.161 1.843 -6.820 513 H VAL 63 H VAL 63 -20.742 -1.643 -8.320 514 HA VAL 63 HA VAL 63 -22.432 -2.715 -10.538 515 HB VAL 63 HB VAL 63 -20.844 -4.536 -10.779 516 HG11 VAL 63 HG11 VAL 63 -20.833 -2.674 -12.402 517 HG12 VAL 63 HG12 VAL 63 -19.544 -1.883 -11.484 518 HG13 VAL 63 HG13 VAL 63 -19.256 -3.451 -12.256 519 HG21 VAL 63 HG21 VAL 63 -18.506 -4.383 -10.072 520 HG22 VAL 63 HG22 VAL 63 -18.839 -2.854 -9.230 521 HG23 VAL 63 HG23 VAL 63 -19.568 -4.372 -8.662 522 H GLU 64 H GLU 64 -23.352 -4.746 -10.182 523 HA GLU 64 HA GLU 64 -23.534 -5.636 -7.331 524 HB2 GLU 64 HB2 GLU 64 -25.700 -5.065 -8.390 525 HB3 GLU 64 HB3 GLU 64 -25.367 -6.198 -9.705 526 HG2 GLU 64 HG2 GLU 64 -25.342 -8.073 -8.075 527 HG3 GLU 64 HG3 GLU 64 -25.599 -6.930 -6.755 528 H VAL 65 H VAL 65 -22.586 -7.609 -6.933 529 HA VAL 65 HA VAL 65 -21.260 -8.995 -9.218 530 HB VAL 65 HB VAL 65 -20.542 -9.129 -6.265 531 HG11 VAL 65 HG11 VAL 65 -18.397 -10.026 -7.206 532 HG12 VAL 65 HG12 VAL 65 -19.778 -11.041 -7.642 533 HG13 VAL 65 HG13 VAL 65 -19.090 -9.918 -8.836 534 HG21 VAL 65 HG21 VAL 65 -18.608 -7.653 -6.861 535 HG22 VAL 65 HG22 VAL 65 -19.345 -7.367 -8.454 536 HG23 VAL 65 HG23 VAL 65 -20.153 -6.813 -6.971 537 H LEU 66 H LEU 66 -22.331 -10.728 -9.861 538 HA LEU 66 HA LEU 66 -24.666 -11.614 -8.373 539 HB2 LEU 66 HB2 LEU 66 -23.447 -12.291 -11.069 540 HB3 LEU 66 HB3 LEU 66 -24.775 -13.230 -10.404 541 HG LEU 66 HG LEU 66 -26.205 -11.228 -10.292 542 HD11 LEU 66 HD11 LEU 66 -23.908 -9.809 -11.717 543 HD12 LEU 66 HD12 LEU 66 -25.569 -9.192 -11.567 544 HD13 LEU 66 HD13 LEU 66 -24.591 -9.393 -10.126 545 HD21 LEU 66 HD21 LEU 66 -24.955 -11.804 -13.013 546 HD22 LEU 66 HD22 LEU 66 -26.267 -12.718 -12.244 547 HD23 LEU 66 HD23 LEU 66 -26.542 -11.046 -12.751 548 H GLY 67 H GLY 67 -21.394 -12.913 -8.955 549 HA2 GLY 67 HA2 GLY 67 -21.151 -14.779 -7.013 550 HA3 GLY 67 HA3 GLY 67 -22.075 -15.633 -8.271 551 H MET 68 H MET 68 -19.790 -16.763 -8.035 552 HA MET 68 HA MET 68 -17.572 -15.609 -9.496 553 HB2 MET 68 HB2 MET 68 -18.244 -18.511 -8.872 554 HB3 MET 68 HB3 MET 68 -16.752 -17.957 -9.631 555 HG2 MET 68 HG2 MET 68 -17.700 -17.212 -6.847 556 HG3 MET 68 HG3 MET 68 -16.450 -18.386 -7.233 557 HE1 MET 68 HE1 MET 68 -14.634 -17.078 -9.444 558 HE2 MET 68 HE2 MET 68 -13.458 -16.192 -8.456 559 HE3 MET 68 HE3 MET 68 -13.981 -17.815 -7.960 560 H ALA 69 H ALA 69 -16.820 -16.187 -11.537 561 HA ALA 69 HA ALA 69 -18.736 -16.379 -13.693 562 HB1 ALA 69 HB1 ALA 69 -16.589 -15.124 -13.743 563 HB2 ALA 69 HB2 ALA 69 -15.705 -16.670 -13.601 564 HB3 ALA 69 HB3 ALA 69 -16.655 -16.299 -15.046 565 HA PRO 70 HA PRO 70 -18.796 -20.789 -14.652 566 HB2 PRO 70 HB2 PRO 70 -17.101 -20.136 -17.072 567 HB3 PRO 70 HB3 PRO 70 -18.499 -21.254 -16.946 568 HG2 PRO 70 HG2 PRO 70 -18.880 -18.780 -17.944 569 HG3 PRO 70 HG3 PRO 70 -20.034 -19.412 -16.721 570 HD2 PRO 70 HD2 PRO 70 -17.710 -17.535 -16.337 571 HD3 PRO 70 HD3 PRO 70 -19.363 -17.411 -15.659 572 H ASP 71 H ASP 71 -17.609 -22.655 -14.485 573 HA ASP 71 HA ASP 71 -15.267 -22.713 -12.961 574 HB2 ASP 71 HB2 ASP 71 -16.905 -24.558 -13.222 575 HB3 ASP 71 HB3 ASP 71 -16.382 -24.786 -14.894 576 H ASP 72 H ASP 72 -15.696 -22.698 -16.477 577 HA ASP 72 HA ASP 72 -13.029 -23.433 -17.220 578 HB2 ASP 72 HB2 ASP 72 -14.940 -23.542 -18.765 579 HB3 ASP 72 HB3 ASP 72 -15.092 -21.782 -18.723 580 H GLU 73 H GLU 73 -14.470 -20.326 -16.278 581 HA GLU 73 HA GLU 73 -12.142 -18.762 -17.169 582 HB2 GLU 73 HB2 GLU 73 -14.581 -18.036 -15.502 583 HB3 GLU 73 HB3 GLU 73 -13.329 -16.905 -15.993 584 HG2 GLU 73 HG2 GLU 73 -15.075 -18.466 -17.945 585 HG3 GLU 73 HG3 GLU 73 -15.396 -16.834 -17.388 586 H CYS 74 H CYS 74 -13.587 -20.011 -14.168 587 HA CYS 74 HA CYS 74 -11.634 -18.857 -12.452 588 HB2 CYS 74 HB2 CYS 74 -13.568 -21.148 -11.948 589 HB3 CYS 74 HB3 CYS 74 -12.678 -20.223 -10.723 590 HG CYS 74 HG CYS 74 -15.021 -19.297 -12.866 591 H LEU 75 H LEU 75 -11.128 -21.285 -14.584 592 HA LEU 75 HA LEU 75 -9.348 -22.965 -12.982 593 HB2 LEU 75 HB2 LEU 75 -10.429 -22.947 -15.775 594 HB3 LEU 75 HB3 LEU 75 -8.833 -23.650 -15.594 595 HG LEU 75 HG LEU 75 -11.140 -24.499 -13.808 596 HD11 LEU 75 HD11 LEU 75 -11.850 -24.918 -16.085 597 HD12 LEU 75 HD12 LEU 75 -10.297 -25.700 -16.476 598 HD13 LEU 75 HD13 LEU 75 -11.425 -26.444 -15.313 599 HD21 LEU 75 HD21 LEU 75 -8.542 -25.890 -14.600 600 HD22 LEU 75 HD22 LEU 75 -8.832 -25.092 -13.043 601 HD23 LEU 75 HD23 LEU 75 -9.774 -26.518 -13.485 602 H LYS 76 H LYS 76 -9.011 -19.886 -14.498 603 HA LYS 76 HA LYS 76 -6.058 -20.223 -14.267 604 HB2 LYS 76 HB2 LYS 76 -5.677 -18.911 -16.249 605 HB3 LYS 76 HB3 LYS 76 -6.490 -20.418 -16.621 606 HG2 LYS 76 HG2 LYS 76 -8.202 -17.948 -16.285 607 HG3 LYS 76 HG3 LYS 76 -7.153 -18.041 -17.695 608 HD2 LYS 76 HD2 LYS 76 -8.165 -20.167 -18.389 609 HD3 LYS 76 HD3 LYS 76 -9.231 -20.145 -16.965 610 HE2 LYS 76 HE2 LYS 76 -10.231 -18.033 -17.706 611 HE3 LYS 76 HE3 LYS 76 -9.137 -17.948 -19.091 612 HZ1 LYS 76 HZ1 LYS 76 -11.034 -20.184 -18.711 613 HZ2 LYS 76 HZ2 LYS 76 -11.445 -18.814 -19.504 614 HZ3 LYS 76 HZ3 LYS 76 -10.232 -19.775 -20.089 615 H ASP 77 H ASP 77 -8.824 -18.102 -13.769 616 HA ASP 77 HA ASP 77 -7.170 -16.448 -12.024 617 HB2 ASP 77 HB2 ASP 77 -6.758 -15.364 -14.204 618 HB3 ASP 77 HB3 ASP 77 -8.487 -15.275 -14.496 619 H MET 78 H MET 78 -8.618 -14.977 -10.726 620 HA MET 78 HA MET 78 -11.174 -16.390 -10.215 621 HB2 MET 78 HB2 MET 78 -9.762 -14.140 -8.732 622 HB3 MET 78 HB3 MET 78 -11.316 -14.828 -8.263 623 HG2 MET 78 HG2 MET 78 -8.675 -16.338 -8.394 624 HG3 MET 78 HG3 MET 78 -9.486 -15.759 -6.949 625 HE1 MET 78 HE1 MET 78 -10.179 -19.717 -9.090 626 HE2 MET 78 HE2 MET 78 -9.859 -18.263 -10.046 627 HE3 MET 78 HE3 MET 78 -8.673 -18.814 -8.840 628 H TYR 79 H TYR 79 -12.889 -15.825 -11.412 629 HA TYR 79 HA TYR 79 -13.248 -12.980 -12.238 630 HB2 TYR 79 HB2 TYR 79 -13.717 -15.609 -13.685 631 HB3 TYR 79 HB3 TYR 79 -14.528 -14.129 -14.155 632 HD1 TYR 79 HD1 TYR 79 -13.179 -12.119 -14.887 633 HD2 TYR 79 HD2 TYR 79 -11.546 -16.099 -14.583 634 HE1 TYR 79 HE1 TYR 79 -11.443 -11.520 -16.542 635 HE2 TYR 79 HE2 TYR 79 -9.868 -15.544 -16.305 636 HH TYR 79 HH TYR 79 -8.997 -13.889 -17.706 637 H VAL 80 H VAL 80 -15.397 -12.214 -12.202 638 HA VAL 80 HA VAL 80 -17.461 -13.939 -10.915 639 HB VAL 80 HB VAL 80 -18.120 -11.860 -9.664 640 HG11 VAL 80 HG11 VAL 80 -16.990 -13.699 -8.534 641 HG12 VAL 80 HG12 VAL 80 -15.400 -13.031 -8.957 642 HG13 VAL 80 HG13 VAL 80 -16.488 -12.152 -7.859 643 HG21 VAL 80 HG21 VAL 80 -16.484 -10.105 -9.226 644 HG22 VAL 80 HG22 VAL 80 -15.310 -10.853 -10.320 645 HG23 VAL 80 HG23 VAL 80 -16.820 -10.166 -10.959 646 H GLU 81 H GLU 81 -19.595 -13.478 -11.472 647 HA GLU 81 HA GLU 81 -20.020 -12.056 -14.046 648 HB2 GLU 81 HB2 GLU 81 -21.883 -13.577 -12.163 649 HB3 GLU 81 HB3 GLU 81 -22.414 -12.712 -13.618 650 HG2 GLU 81 HG2 GLU 81 -20.821 -14.144 -14.962 651 HG3 GLU 81 HG3 GLU 81 -20.513 -15.085 -13.501 652 H VAL 82 H VAL 82 -21.002 -10.027 -14.151 653 HA VAL 82 HA VAL 82 -21.597 -8.666 -11.600 654 HB VAL 82 HB VAL 82 -19.165 -8.576 -12.011 655 HG11 VAL 82 HG11 VAL 82 -19.035 -8.775 -14.440 656 HG12 VAL 82 HG12 VAL 82 -19.826 -7.195 -14.649 657 HG13 VAL 82 HG13 VAL 82 -18.233 -7.297 -13.910 658 HG21 VAL 82 HG21 VAL 82 -20.457 -5.893 -12.500 659 HG22 VAL 82 HG22 VAL 82 -20.236 -6.695 -10.917 660 HG23 VAL 82 HG23 VAL 82 -18.826 -6.191 -11.863 661 H ALA 83 H ALA 83 -23.059 -6.988 -11.831 662 HA ALA 83 HA ALA 83 -24.046 -6.371 -14.591 663 HB1 ALA 83 HB1 ALA 83 -25.639 -6.483 -12.002 664 HB2 ALA 83 HB2 ALA 83 -26.257 -6.013 -13.601 665 HB3 ALA 83 HB3 ALA 83 -25.698 -7.672 -13.324 666 H ASP 84 H ASP 84 -24.272 -4.252 -15.113 667 HA ASP 84 HA ASP 84 -22.666 -2.417 -13.498 668 HB2 ASP 84 HB2 ASP 84 -22.233 -2.726 -15.884 669 HB3 ASP 84 HB3 ASP 84 -23.871 -2.168 -16.260 670 H ILE 85 H ILE 85 -24.517 -2.555 -11.848 671 HA ILE 85 HA ILE 85 -26.924 -1.137 -12.245 672 HB ILE 85 HB ILE 85 -27.111 -0.977 -9.852 673 HG12 ILE 85 HG12 ILE 85 -24.225 -1.895 -9.672 674 HG13 ILE 85 HG13 ILE 85 -24.806 -0.280 -9.282 675 HG21 ILE 85 HG21 ILE 85 -25.855 -3.663 -10.568 676 HG22 ILE 85 HG22 ILE 85 -27.125 -3.333 -9.370 677 HG23 ILE 85 HG23 ILE 85 -27.475 -3.147 -11.086 678 HD11 ILE 85 HD11 ILE 85 -25.504 -2.839 -7.791 679 HD12 ILE 85 HD12 ILE 85 -24.472 -1.523 -7.235 680 HD13 ILE 85 HD13 ILE 85 -26.210 -1.239 -7.458 681 H GLY 86 H GLY 86 -23.709 0.167 -11.965 682 HA2 GLY 86 HA2 GLY 86 -24.555 2.890 -11.333 683 HA3 GLY 86 HA3 GLY 86 -22.932 2.305 -11.725 684 H GLY 87 H GLY 87 -24.701 1.025 -14.209 685 HA2 GLY 87 HA2 GLY 87 -24.847 3.479 -15.880 686 HA3 GLY 87 HA3 GLY 87 -23.702 2.209 -16.321 687 H LYS 88 H LYS 88 -24.494 0.198 -17.121 688 HA LYS 88 HA LYS 88 -26.785 0.463 -18.762 689 HB2 LYS 88 HB2 LYS 88 -25.495 -2.150 -17.858 690 HB3 LYS 88 HB3 LYS 88 -26.555 -1.947 -19.240 691 HG2 LYS 88 HG2 LYS 88 -23.779 -0.725 -18.945 692 HG3 LYS 88 HG3 LYS 88 -24.225 -2.132 -19.905 693 HD2 LYS 88 HD2 LYS 88 -25.725 -0.694 -21.297 694 HD3 LYS 88 HD3 LYS 88 -25.168 0.728 -20.380 695 HE2 LYS 88 HE2 LYS 88 -22.832 0.255 -21.058 696 HE3 LYS 88 HE3 LYS 88 -23.372 -1.169 -21.955 697 HZ1 LYS 88 HZ1 LYS 88 -24.148 1.625 -22.571 698 HZ2 LYS 88 HZ2 LYS 88 -23.076 0.731 -23.409 699 HZ3 LYS 88 HZ3 LYS 88 -24.647 0.306 -23.401 700 H ASP 89 H ASP 89 -26.483 -1.019 -15.600 701 HA ASP 89 HA ASP 89 -27.768 -1.918 -14.088 702 HB2 ASP 89 HB2 ASP 89 -28.701 0.325 -14.048 703 HB3 ASP 89 HB3 ASP 89 -29.890 -0.117 -15.277 704 H ASP 90 H ASP 90 -29.112 -2.347 -17.276 705 HA ASP 90 HA ASP 90 -30.766 -4.642 -16.383 706 HB2 ASP 90 HB2 ASP 90 -31.787 -2.634 -17.484 707 HB3 ASP 90 HB3 ASP 90 -30.797 -2.965 -18.909 708 H ASP 91 H ASP 91 -27.714 -4.402 -17.292 709 HA ASP 91 HA ASP 91 -27.787 -6.904 -18.868 710 HB2 ASP 91 HB2 ASP 91 -27.443 -4.862 -20.402 711 HB3 ASP 91 HB3 ASP 91 -25.858 -4.710 -19.624 712 H VAL 92 H VAL 92 -25.664 -7.961 -18.934 713 HA VAL 92 HA VAL 92 -24.196 -7.677 -16.361 714 HB VAL 92 HB VAL 92 -25.319 -10.278 -17.473 715 HG11 VAL 92 HG11 VAL 92 -24.320 -9.654 -14.667 716 HG12 VAL 92 HG12 VAL 92 -24.883 -11.220 -15.288 717 HG13 VAL 92 HG13 VAL 92 -23.390 -10.529 -15.906 718 HG21 VAL 92 HG21 VAL 92 -26.554 -8.508 -15.328 719 HG22 VAL 92 HG22 VAL 92 -27.290 -9.013 -16.864 720 HG23 VAL 92 HG23 VAL 92 -26.998 -10.205 -15.605 721 H TYR 93 H TYR 93 -22.134 -8.553 -16.383 722 HA TYR 93 HA TYR 93 -20.860 -9.433 -18.907 723 HB2 TYR 93 HB2 TYR 93 -19.901 -7.159 -17.106 724 HB3 TYR 93 HB3 TYR 93 -19.075 -7.763 -18.530 725 HD1 TYR 93 HD2 TYR 93 -19.956 -7.331 -20.814 726 HD2 TYR 93 HD1 TYR 93 -21.774 -5.603 -17.300 727 HE1 TYR 93 HE2 TYR 93 -21.116 -5.677 -22.238 728 HE2 TYR 93 HE1 TYR 93 -22.958 -3.957 -18.716 729 HH TYR 93 HH TYR 93 -22.560 -3.870 -22.302 730 H THR 94 H THR 94 -18.278 -9.556 -17.967 731 HA THR 94 HA THR 94 -18.332 -10.961 -15.356 732 HB THR 94 HB THR 94 -16.637 -11.757 -17.756 733 HG1 THR 94 HG1 THR 94 -18.809 -12.271 -18.096 734 HG21 THR 94 HG21 THR 94 -17.125 -13.178 -15.100 735 HG22 THR 94 HG22 THR 94 -16.155 -13.795 -16.454 736 HG23 THR 94 HG23 THR 94 -15.620 -12.360 -15.572 737 H ALA 95 H ALA 95 -16.529 -10.485 -14.077 738 HA ALA 95 HA ALA 95 -14.529 -8.536 -15.110 739 HB1 ALA 95 HB1 ALA 95 -16.131 -8.254 -12.529 740 HB2 ALA 95 HB2 ALA 95 -14.649 -7.341 -12.886 741 HB3 ALA 95 HB3 ALA 95 -16.071 -7.119 -13.902 742 H LYS 96 H LYS 96 -12.565 -8.566 -13.941 743 HA LYS 96 HA LYS 96 -11.886 -11.172 -12.713 744 HB2 LYS 96 HB2 LYS 96 -9.640 -9.923 -12.394 745 HB3 LYS 96 HB3 LYS 96 -10.069 -10.520 -13.982 746 HG2 LYS 96 HG2 LYS 96 -10.807 -7.676 -13.331 747 HG3 LYS 96 HG3 LYS 96 -9.104 -8.050 -13.589 748 HD2 LYS 96 HD2 LYS 96 -9.434 -8.756 -15.809 749 HD3 LYS 96 HD3 LYS 96 -11.186 -8.908 -15.634 750 HE2 LYS 96 HE2 LYS 96 -11.489 -6.510 -15.496 751 HE3 LYS 96 HE3 LYS 96 -9.744 -6.240 -15.357 752 HZ1 LYS 96 HZ1 LYS 96 -11.098 -7.316 -17.769 753 HZ2 LYS 96 HZ2 LYS 96 -10.521 -5.799 -17.598 754 HZ3 LYS 96 HZ3 LYS 96 -9.492 -7.056 -17.625 755 H LEU 97 H LEU 97 -11.915 -11.467 -10.528 756 HA LEU 97 HA LEU 97 -13.168 -9.519 -8.845 757 HB2 LEU 97 HB2 LEU 97 -13.162 -11.976 -8.427 758 HB3 LEU 97 HB3 LEU 97 -11.424 -11.914 -8.115 759 HG LEU 97 HG LEU 97 -11.804 -10.479 -6.135 760 HD11 LEU 97 HD11 LEU 97 -14.179 -10.184 -5.299 761 HD12 LEU 97 HD12 LEU 97 -13.817 -9.239 -6.735 762 HD13 LEU 97 HD13 LEU 97 -14.759 -10.741 -6.876 763 HD21 LEU 97 HD21 LEU 97 -12.808 -12.184 -4.722 764 HD22 LEU 97 HD22 LEU 97 -13.593 -12.936 -6.128 765 HD23 LEU 97 HD23 LEU 97 -11.820 -12.960 -5.960 766 H SER 98 H SER 98 -9.834 -10.232 -9.675 767 HA SER 98 HA SER 98 -8.255 -8.768 -8.010 768 HB2 SER 98 HB2 SER 98 -8.035 -8.855 -11.038 769 HB3 SER 98 HB3 SER 98 -6.722 -8.877 -9.853 770 HG SER 98 HG SER 98 -7.280 -10.976 -10.772 771 H ASP 99 H ASP 99 -10.648 -7.418 -10.235 772 HA ASP 99 HA ASP 99 -9.365 -4.745 -10.018 773 HB2 ASP 99 HB2 ASP 99 -9.483 -6.029 -12.258 774 HB3 ASP 99 HB3 ASP 99 -11.215 -5.674 -12.226 775 H ILE 100 H ILE 100 -11.524 -6.256 -8.396 776 HA ILE 100 HA ILE 100 -13.539 -4.053 -8.357 777 HB ILE 100 HB ILE 100 -13.802 -7.003 -8.404 778 HG12 ILE 100 HG12 ILE 100 -15.746 -4.742 -9.028 779 HG13 ILE 100 HG13 ILE 100 -14.540 -5.370 -10.172 780 HG21 ILE 100 HG21 ILE 100 -15.836 -7.212 -7.118 781 HG22 ILE 100 HG22 ILE 100 -14.547 -6.673 -6.065 782 HG23 ILE 100 HG23 ILE 100 -15.767 -5.505 -6.636 783 HD11 ILE 100 HD11 ILE 100 -16.942 -6.837 -9.042 784 HD12 ILE 100 HD12 ILE 100 -16.648 -6.344 -10.715 785 HD13 ILE 100 HD13 ILE 100 -15.650 -7.625 -9.990 786 H GLU 101 H GLU 101 -14.343 -3.442 -6.452 787 HA GLU 101 HA GLU 101 -12.849 -4.090 -3.952 788 HB2 GLU 101 HB2 GLU 101 -12.201 -1.892 -4.801 789 HB3 GLU 101 HB3 GLU 101 -13.897 -1.423 -4.998 790 HG2 GLU 101 HG2 GLU 101 -14.259 -1.432 -2.603 791 HG3 GLU 101 HG3 GLU 101 -12.686 -2.181 -2.318 792 H ALA 102 H ALA 102 -14.236 -5.029 -2.517 793 HA ALA 102 HA ALA 102 -17.074 -5.226 -3.218 794 HB1 ALA 102 HB1 ALA 102 -15.757 -7.151 -2.373 795 HB2 ALA 102 HB2 ALA 102 -15.567 -6.334 -0.806 796 HB3 ALA 102 HB3 ALA 102 -17.183 -6.807 -1.376 797 H ILE 103 H ILE 103 -18.753 -4.287 -2.173 798 HA ILE 103 HA ILE 103 -18.221 -2.440 0.119 799 HB ILE 103 HB ILE 103 -19.729 -2.033 -2.475 800 HG12 ILE 103 HG12 ILE 103 -17.533 -0.375 -1.146 801 HG13 ILE 103 HG13 ILE 103 -17.251 -1.567 -2.415 802 HG21 ILE 103 HG21 ILE 103 -19.850 -0.207 -0.036 803 HG22 ILE 103 HG22 ILE 103 -20.536 0.149 -1.637 804 HG23 ILE 103 HG23 ILE 103 -21.196 -1.166 -0.701 805 HD11 ILE 103 HD11 ILE 103 -18.823 0.995 -2.721 806 HD12 ILE 103 HD12 ILE 103 -17.265 0.559 -3.437 807 HD13 ILE 103 HD13 ILE 103 -18.738 -0.308 -3.939 808 H ASP 104 H ASP 104 -19.744 -2.389 1.691 809 HA ASP 104 HA ASP 104 -21.430 -3.031 3.010 810 HB2 ASP 104 HB2 ASP 104 -22.542 -1.504 1.434 811 HB3 ASP 104 HB3 ASP 104 -23.042 -2.878 0.446 812 H VAL 105 H VAL 105 -19.854 -5.199 2.264 813 HA VAL 105 HA VAL 105 -21.849 -7.414 2.295 814 HB VAL 105 HB VAL 105 -20.275 -7.101 0.274 815 HG11 VAL 105 HG11 VAL 105 -18.153 -6.781 1.475 816 HG12 VAL 105 HG12 VAL 105 -18.265 -8.443 2.094 817 HG13 VAL 105 HG13 VAL 105 -18.109 -8.151 0.354 818 HG21 VAL 105 HG21 VAL 105 -20.244 -9.424 -0.156 819 HG22 VAL 105 HG22 VAL 105 -20.444 -9.825 1.565 820 HG23 VAL 105 HG23 VAL 105 -21.745 -9.017 0.676 821 H ASP 106 H ASP 106 -21.003 -9.435 3.407 822 HA ASP 106 HA ASP 106 -20.527 -8.798 6.164 823 HB2 ASP 106 HB2 ASP 106 -21.847 -10.743 5.390 824 HB3 ASP 106 HB3 ASP 106 -20.372 -11.444 4.689 825 H ASP 107 H ASP 107 -18.782 -9.476 7.444 826 HA ASP 107 HA ASP 107 -16.189 -8.734 6.616 827 HB2 ASP 107 HB2 ASP 107 -16.936 -8.750 8.947 828 HB3 ASP 107 HB3 ASP 107 -17.101 -10.507 8.909 829 H ASP 108 H ASP 108 -17.654 -12.060 6.658 830 HA ASP 108 HA ASP 108 -15.060 -13.235 6.171 831 HB2 ASP 108 HB2 ASP 108 -17.161 -14.332 7.209 832 HB3 ASP 108 HB3 ASP 108 -17.711 -14.558 5.540 833 H THR 109 H THR 109 -17.661 -12.010 4.124 834 HA THR 109 HA THR 109 -16.668 -13.156 1.616 835 HB THR 109 HB THR 109 -18.628 -10.873 2.200 836 HG1 THR 109 HG1 THR 109 -19.204 -13.079 2.840 837 HG21 THR 109 HG21 THR 109 -19.397 -11.488 -0.183 838 HG22 THR 109 HG22 THR 109 -17.893 -10.545 -0.045 839 HG23 THR 109 HG23 THR 109 -17.835 -12.282 -0.346 840 H GLN 110 H GLN 110 -16.564 -9.939 3.280 841 HA GLN 110 HA GLN 110 -14.967 -8.682 1.354 842 HB2 GLN 110 HB2 GLN 110 -16.305 -7.809 3.490 843 HB3 GLN 110 HB3 GLN 110 -14.746 -7.957 4.291 844 HG2 GLN 110 HG2 GLN 110 -15.384 -6.320 1.789 845 HG3 GLN 110 HG3 GLN 110 -15.223 -5.677 3.415 846 HE21 GLN 110 HE22 GLN 110 -13.547 -6.111 0.520 847 HE22 GLN 110 HE21 GLN 110 -11.920 -5.986 1.136 848 H GLU 111 H GLU 111 -13.968 -10.528 4.295 849 HA GLU 111 HA GLU 111 -11.193 -10.127 4.114 850 HB2 GLU 111 HB2 GLU 111 -12.984 -12.317 5.202 851 HB3 GLU 111 HB3 GLU 111 -11.251 -12.561 5.191 852 HG2 GLU 111 HG2 GLU 111 -12.371 -10.003 6.393 853 HG3 GLU 111 HG3 GLU 111 -12.408 -11.512 7.297 854 H ALA 112 H ALA 112 -13.249 -12.576 2.436 855 HA ALA 112 HA ALA 112 -11.019 -14.064 1.416 856 HB1 ALA 112 HB1 ALA 112 -13.324 -14.965 1.553 857 HB2 ALA 112 HB2 ALA 112 -13.850 -13.826 0.291 858 HB3 ALA 112 HB3 ALA 112 -12.659 -15.091 -0.084 859 H ILE 113 H ILE 113 -12.981 -11.385 0.082 860 HA ILE 113 HA ILE 113 -11.642 -11.296 -2.458 861 HB ILE 113 HB ILE 113 -13.311 -9.237 -0.949 862 HG12 ILE 113 HG12 ILE 113 -14.133 -11.143 -3.193 863 HG13 ILE 113 HG13 ILE 113 -14.417 -11.474 -1.500 864 HG21 ILE 113 HG21 ILE 113 -12.448 -9.293 -3.878 865 HG22 ILE 113 HG22 ILE 113 -13.656 -8.178 -3.204 866 HG23 ILE 113 HG23 ILE 113 -11.987 -8.091 -2.662 867 HD11 ILE 113 HD11 ILE 113 -15.741 -9.346 -1.333 868 HD12 ILE 113 HD12 ILE 113 -15.647 -9.251 -3.118 869 HD13 ILE 113 HD13 ILE 113 -16.438 -10.626 -2.337 870 H ALA 114 H ALA 114 -11.244 -9.461 0.618 871 HA ALA 114 HA ALA 114 -9.236 -7.688 -0.242 872 HB1 ALA 114 HB1 ALA 114 -8.700 -7.470 2.153 873 HB2 ALA 114 HB2 ALA 114 -10.452 -7.454 1.899 874 HB3 ALA 114 HB3 ALA 114 -9.657 -8.917 2.522 875 H ASP 115 H ASP 115 -8.942 -11.009 1.208 876 HA ASP 115 HA ASP 115 -6.071 -10.774 1.096 877 HB2 ASP 115 HB2 ASP 115 -7.283 -12.210 2.780 878 HB3 ASP 115 HB3 ASP 115 -7.488 -13.404 1.484 879 H TRP 116 H TRP 116 -8.454 -11.857 -1.284 880 HA TRP 116 HA TRP 116 -6.552 -13.216 -2.992 881 HB2 TRP 116 HB2 TRP 116 -8.876 -13.511 -3.488 882 HB3 TRP 116 HB3 TRP 116 -9.179 -11.783 -3.517 883 HD1 TRP 116 HD1 TRP 116 -9.202 -10.666 -5.802 884 HE1 TRP 116 HE1 TRP 116 -8.330 -11.201 -8.171 885 HE3 TRP 116 HE3 TRP 116 -6.732 -15.047 -4.826 886 HZ2 TRP 116 HZ2 TRP 116 -6.822 -13.258 -9.456 887 HZ3 TRP 116 HZ3 TRP 116 -5.598 -16.271 -6.634 888 HH2 TRP 116 HH2 TRP 116 -5.625 -15.386 -8.969 889 H LEU 117 H LEU 117 -7.677 -9.808 -2.715 890 HA LEU 117 HA LEU 117 -6.034 -8.779 -4.813 891 HB2 LEU 117 HB2 LEU 117 -7.170 -7.457 -2.314 892 HB3 LEU 117 HB3 LEU 117 -6.419 -6.573 -3.630 893 HG LEU 117 HG LEU 117 -8.800 -8.405 -4.147 894 HD11 LEU 117 HD11 LEU 117 -9.496 -6.880 -2.384 895 HD12 LEU 117 HD12 LEU 117 -8.893 -5.482 -3.308 896 HD13 LEU 117 HD13 LEU 117 -10.265 -6.441 -3.916 897 HD21 LEU 117 HD21 LEU 117 -7.769 -5.939 -5.603 898 HD22 LEU 117 HD22 LEU 117 -7.511 -7.620 -6.109 899 HD23 LEU 117 HD23 LEU 117 -9.150 -6.951 -6.074 900 H TYR 118 H TYR 118 -5.517 -9.056 -1.255 901 HA TYR 118 HA TYR 118 -2.900 -7.979 -1.231 902 HB2 TYR 118 HB2 TYR 118 -3.990 -10.171 0.559 903 HB3 TYR 118 HB3 TYR 118 -2.575 -9.186 0.870 904 HD1 TYR 118 HD2 TYR 118 -4.061 -6.475 -0.118 905 HD2 TYR 118 HD1 TYR 118 -4.961 -9.615 2.712 906 HE1 TYR 118 HE2 TYR 118 -5.438 -4.907 1.174 907 HE2 TYR 118 HE1 TYR 118 -6.386 -8.055 3.984 908 HH TYR 118 HH TYR 118 -6.822 -4.615 3.030 909 H TRP 119 H TRP 119 -3.896 -11.464 -1.530 910 HA TRP 119 HA TRP 119 -1.410 -12.629 -1.798 911 HB2 TRP 119 HB2 TRP 119 -3.172 -14.115 -1.686 912 HB3 TRP 119 HB3 TRP 119 -4.157 -13.220 -2.821 913 HD1 TRP 119 HD1 TRP 119 -4.050 -13.701 -5.319 914 HE1 TRP 119 HE1 TRP 119 -3.208 -15.660 -6.688 915 HE3 TRP 119 HE3 TRP 119 -1.086 -15.907 -1.773 916 HZ2 TRP 119 HZ2 TRP 119 -1.527 -18.004 -6.263 917 HZ3 TRP 119 HZ3 TRP 119 0.037 -18.062 -2.251 918 HH2 TRP 119 HH2 TRP 119 -0.209 -19.140 -4.469 919 H LEU 120 H LEU 120 -3.264 -10.939 -4.375 920 HA LEU 120 HA LEU 120 -1.593 -11.768 -6.526 921 HB2 LEU 120 HB2 LEU 120 -3.308 -9.288 -6.071 922 HB3 LEU 120 HB3 LEU 120 -2.400 -9.524 -7.552 923 HG LEU 120 HG LEU 120 -4.526 -11.471 -6.553 924 HD11 LEU 120 HD11 LEU 120 -5.903 -10.445 -8.296 925 HD12 LEU 120 HD12 LEU 120 -5.427 -9.235 -7.094 926 HD13 LEU 120 HD13 LEU 120 -4.605 -9.277 -8.668 927 HD21 LEU 120 HD21 LEU 120 -2.901 -11.243 -9.119 928 HD22 LEU 120 HD22 LEU 120 -2.960 -12.608 -7.983 929 HD23 LEU 120 HD23 LEU 120 -4.372 -12.236 -8.970 930 H ALA 121 H ALA 121 -1.579 -8.861 -4.440 931 HA ALA 121 HA ALA 121 0.691 -7.747 -5.766 932 HB1 ALA 121 HB1 ALA 121 -0.637 -7.185 -3.070 933 HB2 ALA 121 HB2 ALA 121 0.554 -6.102 -3.833 934 HB3 ALA 121 HB3 ALA 121 -1.023 -6.392 -4.607 935 H ARG 122 H ARG 122 0.196 -9.670 -2.877 936 HA ARG 122 HA ARG 122 2.659 -9.568 -1.533 937 HB2 ARG 122 HB2 ARG 122 0.433 -10.353 -0.795 938 HB3 ARG 122 HB3 ARG 122 0.673 -11.854 -1.693 939 HG2 ARG 122 HG2 ARG 122 2.334 -12.597 -0.161 940 HG3 ARG 122 HG3 ARG 122 2.651 -10.944 0.413 941 HD2 ARG 122 HD2 ARG 122 1.355 -12.037 2.111 942 HD3 ARG 122 HD3 ARG 122 0.388 -10.787 1.315 943 HE ARG 122 HE ARG 122 0.156 -13.620 0.409 944 HH11 ARG 122 HH11 ARG 122 -1.410 -11.044 2.358 945 HH12 ARG 122 HH12 ARG 122 -2.960 -11.866 2.344 946 HH21 ARG 122 HH21 ARG 122 -1.928 -14.663 0.551 947 HH22 ARG 122 HH22 ARG 122 -3.254 -13.855 1.329 948 H GLY 123 H GLY 123 1.619 -11.448 -4.383 949 HA2 GLY 123 HA2 GLY 123 3.802 -12.013 -5.716 950 HA3 GLY 123 HA3 GLY 123 4.093 -13.098 -4.346 951 H TYR 124 H TYR 124 1.707 -12.308 -6.906 952 HA TYR 124 HA TYR 124 -0.018 -14.484 -6.641 953 HB2 TYR 124 HB2 TYR 124 -0.258 -12.444 -8.091 954 HB3 TYR 124 HB3 TYR 124 0.937 -13.093 -9.183 955 HD1 TYR 124 HD1 TYR 124 -1.363 -15.678 -7.934 956 HD2 TYR 124 HD2 TYR 124 -0.872 -12.522 -10.843 957 HE1 TYR 124 HE1 TYR 124 -3.279 -16.551 -9.206 958 HE2 TYR 124 HE2 TYR 124 -2.784 -13.411 -12.130 959 HH TYR 124 HH TYR 124 -4.451 -15.030 -12.237 960 H LYS 125 H LYS 125 0.742 -16.614 -6.415 961 HA LYS 125 HA LYS 125 3.162 -17.427 -7.817 962 HB2 LYS 125 HB2 LYS 125 1.294 -19.157 -6.155 963 HB3 LYS 125 HB3 LYS 125 2.928 -19.545 -6.650 964 HG2 LYS 125 HG2 LYS 125 2.127 -17.349 -4.700 965 HG3 LYS 125 HG3 LYS 125 2.839 -18.907 -4.299 966 HD2 LYS 125 HD2 LYS 125 4.911 -18.307 -5.516 967 HD3 LYS 125 HD3 LYS 125 4.216 -16.722 -5.929 968 HE2 LYS 125 HE2 LYS 125 3.989 -16.162 -3.547 969 HE3 LYS 125 HE3 LYS 125 4.620 -17.750 -3.088 970 HZ1 LYS 125 HZ1 LYS 125 6.150 -15.684 -4.567 971 HZ2 LYS 125 HZ2 LYS 125 6.334 -16.055 -2.990 972 HZ3 LYS 125 HZ3 LYS 125 6.725 -17.151 -4.127 973 H PHE 126 H PHE 126 -0.283 -18.569 -7.983 974 HA PHE 126 HA PHE 126 0.459 -20.528 -9.950 975 HB2 PHE 126 HB2 PHE 126 -1.752 -21.240 -10.006 976 HB3 PHE 126 HB3 PHE 126 -1.336 -20.919 -8.340 977 HD1 PHE 126 HD2 PHE 126 -3.203 -19.565 -11.286 978 HD2 PHE 126 HD1 PHE 126 -2.864 -19.648 -6.971 979 HE1 PHE 126 HE2 PHE 126 -5.393 -18.428 -11.079 980 HE2 PHE 126 HE1 PHE 126 -5.012 -18.468 -6.797 981 HZ PHE 126 HZ PHE 126 -6.310 -17.881 -8.832 Start of MODEL 16 1 H1 MET 1 H1 MET 1 4.600 -6.283 -5.090 2 H2 MET 1 H2 MET 1 5.134 -7.676 -4.414 3 H3 MET 1 H3 MET 1 3.530 -7.368 -4.466 4 HA MET 1 HA MET 1 5.536 -5.912 -2.886 5 HB2 MET 1 HB2 MET 1 3.828 -4.367 -3.772 6 HB3 MET 1 HB3 MET 1 2.541 -5.376 -3.105 7 HG2 MET 1 HG2 MET 1 3.436 -4.949 -0.809 8 HG3 MET 1 HG3 MET 1 4.689 -3.918 -1.506 9 HE1 MET 1 HE1 MET 1 2.198 -1.506 0.427 10 HE2 MET 1 HE2 MET 1 2.541 -3.196 0.856 11 HE3 MET 1 HE3 MET 1 3.863 -2.120 0.340 12 H ALA 2 H ALA 2 6.177 -7.872 -1.754 13 HA ALA 2 HA ALA 2 4.276 -9.635 -0.547 14 HB1 ALA 2 HB1 ALA 2 6.621 -10.267 -0.918 15 HB2 ALA 2 HB2 ALA 2 7.156 -9.027 0.242 16 HB3 ALA 2 HB3 ALA 2 6.192 -10.411 0.796 17 H SER 3 H SER 3 5.630 -6.543 0.492 18 HA SER 3 HA SER 3 5.327 -6.567 3.189 19 HB2 SER 3 HB2 SER 3 4.860 -4.210 1.358 20 HB3 SER 3 HB3 SER 3 5.470 -4.178 3.026 21 HG SER 3 HG SER 3 7.140 -4.058 1.442 22 H VAL 4 H VAL 4 2.561 -6.709 1.091 23 HA VAL 4 HA VAL 4 0.709 -5.391 2.858 24 HB VAL 4 HB VAL 4 -1.017 -6.628 1.647 25 HG11 VAL 4 HG11 VAL 4 -0.012 -4.549 0.689 26 HG12 VAL 4 HG12 VAL 4 1.081 -5.555 -0.288 27 HG13 VAL 4 HG13 VAL 4 -0.671 -5.643 -0.534 28 HG21 VAL 4 HG21 VAL 4 -0.004 -8.808 1.246 29 HG22 VAL 4 HG22 VAL 4 -0.426 -8.067 -0.293 30 HG23 VAL 4 HG23 VAL 4 1.262 -8.090 0.227 31 H GLU 5 H GLU 5 2.150 -8.673 2.783 32 HA GLU 5 HA GLU 5 1.051 -9.331 5.421 33 HB2 GLU 5 HB2 GLU 5 0.212 -10.774 2.874 34 HB3 GLU 5 HB3 GLU 5 0.051 -11.490 4.471 35 HG2 GLU 5 HG2 GLU 5 -1.400 -9.031 3.450 36 HG3 GLU 5 HG3 GLU 5 -2.061 -10.636 3.677 37 H ARG 6 H ARG 6 3.613 -8.941 5.199 38 HA ARG 6 HA ARG 6 5.127 -11.238 4.256 39 HB2 ARG 6 HB2 ARG 6 5.789 -8.928 6.124 40 HB3 ARG 6 HB3 ARG 6 6.926 -10.254 5.837 41 HG2 ARG 6 HG2 ARG 6 6.958 -9.832 3.444 42 HG3 ARG 6 HG3 ARG 6 5.708 -8.599 3.618 43 HD2 ARG 6 HD2 ARG 6 7.270 -7.272 5.076 44 HD3 ARG 6 HD3 ARG 6 8.538 -8.454 4.747 45 HE ARG 6 HE ARG 6 7.449 -6.387 2.953 46 HH11 ARG 6 HH11 ARG 6 9.515 -9.282 3.100 47 HH12 ARG 6 HH12 ARG 6 10.258 -8.973 1.576 48 HH21 ARG 6 HH21 ARG 6 8.356 -6.008 0.998 49 HH22 ARG 6 HH22 ARG 6 9.609 -7.020 0.341 50 H ASP 7 H ASP 7 3.232 -10.651 7.135 51 HA ASP 7 HA ASP 7 4.513 -12.460 8.917 52 HB2 ASP 7 HB2 ASP 7 2.779 -10.818 9.588 53 HB3 ASP 7 HB3 ASP 7 1.558 -11.757 8.720 54 H GLU 8 H GLU 8 4.534 -14.659 9.007 55 HA GLU 8 HA GLU 8 3.898 -16.046 6.613 56 HB2 GLU 8 HB2 GLU 8 4.835 -17.056 9.333 57 HB3 GLU 8 HB3 GLU 8 4.768 -18.036 7.862 58 HG2 GLU 8 HG2 GLU 8 6.324 -16.446 6.736 59 HG3 GLU 8 HG3 GLU 8 6.465 -15.532 8.240 60 H THR 9 H THR 9 1.775 -15.420 9.303 61 HA THR 9 HA THR 9 0.475 -17.889 9.604 62 HB THR 9 HB THR 9 -0.784 -15.139 9.758 63 HG1 THR 9 HG1 THR 9 0.948 -15.021 10.976 64 HG21 THR 9 HG21 THR 9 -2.431 -16.937 9.985 65 HG22 THR 9 HG22 THR 9 -1.409 -17.763 11.183 66 HG23 THR 9 HG23 THR 9 -2.150 -16.188 11.561 67 H ARG 10 H ARG 10 -0.324 -15.300 7.149 68 HA ARG 10 HA ARG 10 -2.529 -16.874 6.169 69 HB2 ARG 10 HB2 ARG 10 -0.978 -14.609 4.843 70 HB3 ARG 10 HB3 ARG 10 -2.334 -15.427 4.078 71 HG2 ARG 10 HG2 ARG 10 -2.431 -13.808 6.643 72 HG3 ARG 10 HG3 ARG 10 -3.115 -13.368 5.080 73 HD2 ARG 10 HD2 ARG 10 -4.014 -15.647 6.879 74 HD3 ARG 10 HD3 ARG 10 -4.855 -14.120 6.634 75 HE ARG 10 HE ARG 10 -5.042 -14.801 4.183 76 HH11 ARG 10 HH11 ARG 10 -5.372 -17.104 6.896 77 HH12 ARG 10 HH12 ARG 10 -6.204 -18.304 5.941 78 HH21 ARG 10 HH21 ARG 10 -6.251 -16.342 3.000 79 HH22 ARG 10 HH22 ARG 10 -6.721 -17.845 3.751 80 H GLU 11 H GLU 11 0.888 -16.939 5.341 81 HA GLU 11 HA GLU 11 0.537 -18.572 2.972 82 HB2 GLU 11 HB2 GLU 11 2.937 -18.224 4.830 83 HB3 GLU 11 HB3 GLU 11 2.970 -19.102 3.305 84 HG2 GLU 11 HG2 GLU 11 2.329 -16.135 3.608 85 HG3 GLU 11 HG3 GLU 11 3.880 -16.805 3.122 86 H HIS 12 H HIS 12 1.249 -19.283 6.431 87 HA HIS 12 HA HIS 12 1.303 -22.141 6.188 88 HB2 HIS 12 HB2 HIS 12 2.203 -21.307 8.168 89 HB3 HIS 12 HB3 HIS 12 0.960 -20.080 8.355 90 HD1 HIS 12 HD1 HIS 12 0.792 -23.993 8.513 91 HD2 HIS 12 HD2 HIS 12 -0.565 -20.441 10.323 92 HE1 HIS 12 HE1 HIS 12 -0.720 -24.703 10.432 93 H ARG 13 H ARG 13 -1.368 -19.816 6.867 94 HA ARG 13 HA ARG 13 -3.245 -21.917 7.437 95 HB2 ARG 13 HB2 ARG 13 -3.530 -18.933 6.888 96 HB3 ARG 13 HB3 ARG 13 -4.900 -19.972 7.210 97 HG2 ARG 13 HG2 ARG 13 -2.659 -19.339 9.147 98 HG3 ARG 13 HG3 ARG 13 -4.346 -18.860 9.246 99 HD2 ARG 13 HD2 ARG 13 -3.152 -21.626 9.571 100 HD3 ARG 13 HD3 ARG 13 -3.914 -20.628 10.812 101 HE ARG 13 HE ARG 13 -5.827 -21.035 8.743 102 HH11 ARG 13 HH21 ARG 13 -4.127 -23.080 11.109 103 HH12 ARG 13 HH22 ARG 13 -5.398 -24.248 11.184 104 HH21 ARG 13 HH11 ARG 13 -7.379 -22.477 8.777 105 HH22 ARG 13 HH12 ARG 13 -7.373 -23.899 9.811 106 H ILE 14 H ILE 14 -2.745 -19.899 4.461 107 HA ILE 14 HA ILE 14 -4.921 -21.092 3.136 108 HB ILE 14 HB ILE 14 -3.725 -19.030 2.409 109 HG12 ILE 14 HG12 ILE 14 -4.219 -21.222 0.344 110 HG13 ILE 14 HG13 ILE 14 -5.422 -20.152 1.067 111 HG21 ILE 14 HG21 ILE 14 -1.783 -19.076 0.997 112 HG22 ILE 14 HG22 ILE 14 -1.378 -19.942 2.467 113 HG23 ILE 14 HG23 ILE 14 -1.735 -20.852 0.989 114 HD11 ILE 14 HD11 ILE 14 -4.279 -18.201 0.012 115 HD12 ILE 14 HD12 ILE 14 -3.206 -19.342 -0.843 116 HD13 ILE 14 HD13 ILE 14 -4.952 -19.389 -1.129 117 H GLU 15 H GLU 15 -1.507 -22.148 3.427 118 HA GLU 15 HA GLU 15 -1.670 -24.380 1.661 119 HB2 GLU 15 HB2 GLU 15 0.420 -23.411 2.314 120 HB3 GLU 15 HB3 GLU 15 0.089 -23.654 4.033 121 HG2 GLU 15 HG2 GLU 15 0.263 -26.046 3.821 122 HG3 GLU 15 HG3 GLU 15 0.417 -25.934 2.059 123 H THR 16 H THR 16 -2.743 -23.988 5.028 124 HA THR 16 HA THR 16 -3.132 -26.939 5.219 125 HB THR 16 HB THR 16 -3.227 -26.497 7.681 126 HG1 THR 16 HG1 THR 16 -2.116 -23.978 7.016 127 HG21 THR 16 HG21 THR 16 -1.163 -27.293 6.587 128 HG22 THR 16 HG22 THR 16 -0.651 -25.617 6.302 129 HG23 THR 16 HG23 THR 16 -0.815 -26.235 7.962 130 H GLU 17 H GLU 17 -5.005 -24.210 4.534 131 HA GLU 17 HA GLU 17 -7.432 -25.629 5.517 132 HB2 GLU 17 HB2 GLU 17 -8.234 -23.782 6.531 133 HB3 GLU 17 HB3 GLU 17 -6.513 -23.523 6.752 134 HG2 GLU 17 HG2 GLU 17 -6.754 -22.098 4.509 135 HG3 GLU 17 HG3 GLU 17 -8.469 -22.114 4.944 136 H ILE 18 H ILE 18 -6.023 -23.971 2.719 137 HA ILE 18 HA ILE 18 -8.612 -24.407 1.282 138 HB ILE 18 HB ILE 18 -6.569 -22.184 1.061 139 HG12 ILE 18 HG12 ILE 18 -9.561 -21.828 1.416 140 HG13 ILE 18 HG13 ILE 18 -8.602 -22.236 2.803 141 HG21 ILE 18 HG21 ILE 18 -8.998 -22.686 -0.721 142 HG22 ILE 18 HG22 ILE 18 -7.975 -21.231 -0.756 143 HG23 ILE 18 HG23 ILE 18 -7.315 -22.783 -1.243 144 HD11 ILE 18 HD11 ILE 18 -8.932 -19.804 2.600 145 HD12 ILE 18 HD12 ILE 18 -7.220 -20.259 2.582 146 HD13 ILE 18 HD13 ILE 18 -8.035 -19.809 1.068 147 H ILE 19 H ILE 19 -5.053 -24.002 0.486 148 HA ILE 19 HA ILE 19 -5.621 -25.602 -1.923 149 HB ILE 19 HB ILE 19 -3.486 -24.801 -2.731 150 HG12 ILE 19 HG12 ILE 19 -3.203 -23.379 -0.060 151 HG13 ILE 19 HG13 ILE 19 -2.199 -24.702 -0.648 152 HG21 ILE 19 HG21 ILE 19 -5.632 -23.465 -2.970 153 HG22 ILE 19 HG22 ILE 19 -5.085 -22.459 -1.613 154 HG23 ILE 19 HG23 ILE 19 -4.157 -22.518 -3.114 155 HD11 ILE 19 HD11 ILE 19 -2.360 -21.883 -1.769 156 HD12 ILE 19 HD12 ILE 19 -1.013 -22.627 -0.896 157 HD13 ILE 19 HD13 ILE 19 -1.435 -23.215 -2.519 158 H VAL 20 H VAL 20 -5.478 -26.871 0.759 159 HA VAL 20 HA VAL 20 -3.082 -28.075 1.358 160 HB VAL 20 HB VAL 20 -5.678 -29.557 1.824 161 HG11 VAL 20 HG11 VAL 20 -4.687 -29.947 4.043 162 HG12 VAL 20 HG12 VAL 20 -3.571 -30.453 2.769 163 HG13 VAL 20 HG13 VAL 20 -3.298 -28.920 3.622 164 HG21 VAL 20 HG21 VAL 20 -6.101 -28.049 3.810 165 HG22 VAL 20 HG22 VAL 20 -4.962 -26.893 3.079 166 HG23 VAL 20 HG23 VAL 20 -6.469 -27.342 2.243 167 H ASP 21 H ASP 21 -5.551 -29.226 -0.937 168 HA ASP 21 HA ASP 21 -4.081 -31.751 -1.398 169 HB2 ASP 21 HB2 ASP 21 -6.524 -31.719 -0.899 170 HB3 ASP 21 HB3 ASP 21 -6.795 -30.798 -2.379 171 H ALA 22 H ALA 22 -3.663 -28.733 -2.575 172 HA ALA 22 HA ALA 22 -3.682 -29.452 -5.475 173 HB1 ALA 22 HB1 ALA 22 -5.131 -27.566 -4.878 174 HB2 ALA 22 HB2 ALA 22 -3.787 -26.761 -4.037 175 HB3 ALA 22 HB3 ALA 22 -3.725 -26.985 -5.789 176 H GLU 23 H GLU 23 -1.791 -29.338 -6.627 177 HA GLU 23 HA GLU 23 0.685 -28.372 -5.258 178 HB2 GLU 23 HB2 GLU 23 0.262 -30.933 -6.849 179 HB3 GLU 23 HB3 GLU 23 1.822 -30.339 -6.267 180 HG2 GLU 23 HG2 GLU 23 0.961 -30.443 -3.918 181 HG3 GLU 23 HG3 GLU 23 -0.528 -31.178 -4.520 182 H ASP 24 H ASP 24 -1.307 -27.802 -7.896 183 HA ASP 24 HA ASP 24 0.917 -26.708 -9.547 184 HB2 ASP 24 HB2 ASP 24 0.275 -28.847 -10.548 185 HB3 ASP 24 HB3 ASP 24 -1.437 -28.434 -10.428 186 H LYS 25 H LYS 25 0.236 -24.840 -10.801 187 HA LYS 25 HA LYS 25 -1.358 -23.107 -9.359 188 HB2 LYS 25 HB2 LYS 25 -1.067 -21.525 -11.113 189 HB3 LYS 25 HB3 LYS 25 0.400 -22.464 -10.947 190 HG2 LYS 25 HG2 LYS 25 0.298 -22.512 -13.198 191 HG3 LYS 25 HG3 LYS 25 -0.763 -23.899 -12.938 192 HD2 LYS 25 HD2 LYS 25 -2.746 -22.370 -13.124 193 HD3 LYS 25 HD3 LYS 25 -1.666 -21.006 -13.398 194 HE2 LYS 25 HE2 LYS 25 -1.831 -23.491 -15.169 195 HE3 LYS 25 HE3 LYS 25 -2.706 -21.989 -15.472 196 HZ1 LYS 25 HZ1 LYS 25 0.247 -22.247 -15.428 197 HZ2 LYS 25 HZ2 LYS 25 -0.680 -22.072 -16.753 198 HZ3 LYS 25 HZ3 LYS 25 -0.572 -20.851 -15.683 199 H GLU 26 H GLU 26 -2.523 -25.328 -11.920 200 HA GLU 26 HA GLU 26 -5.053 -23.909 -12.242 201 HB2 GLU 26 HB2 GLU 26 -4.220 -26.778 -12.876 202 HB3 GLU 26 HB3 GLU 26 -5.767 -26.052 -13.311 203 HG2 GLU 26 HG2 GLU 26 -4.520 -24.271 -14.590 204 HG3 GLU 26 HG3 GLU 26 -3.023 -25.151 -14.289 205 H GLU 27 H GLU 27 -3.810 -26.600 -10.232 206 HA GLU 27 HA GLU 27 -6.363 -27.233 -9.042 207 HB2 GLU 27 HB2 GLU 27 -3.533 -27.809 -8.068 208 HB3 GLU 27 HB3 GLU 27 -5.010 -28.542 -7.446 209 HG2 GLU 27 HG2 GLU 27 -3.934 -28.831 -10.284 210 HG3 GLU 27 HG3 GLU 27 -3.792 -30.024 -9.000 211 H ARG 28 H ARG 28 -3.657 -25.026 -8.205 212 HA ARG 28 HA ARG 28 -4.778 -24.213 -5.659 213 HB2 ARG 28 HB2 ARG 28 -2.765 -22.976 -7.565 214 HB3 ARG 28 HB3 ARG 28 -3.448 -22.031 -6.248 215 HG2 ARG 28 HG2 ARG 28 -1.458 -22.797 -5.343 216 HG3 ARG 28 HG3 ARG 28 -2.707 -23.813 -4.635 217 HD2 ARG 28 HD2 ARG 28 -2.113 -25.515 -6.490 218 HD3 ARG 28 HD3 ARG 28 -0.674 -24.539 -6.778 219 HE ARG 28 HE ARG 28 -1.336 -26.260 -4.480 220 HH11 ARG 28 HH11 ARG 28 1.020 -23.783 -5.623 221 HH12 ARG 28 HH12 ARG 28 2.210 -24.313 -4.493 222 HH21 ARG 28 HH21 ARG 28 0.223 -26.938 -3.141 223 HH22 ARG 28 HH22 ARG 28 1.751 -26.120 -3.006 224 H ALA 29 H ALA 29 -5.332 -23.097 -9.029 225 HA ALA 29 HA ALA 29 -6.938 -20.835 -8.249 226 HB1 ALA 29 HB1 ALA 29 -7.727 -20.844 -10.555 227 HB2 ALA 29 HB2 ALA 29 -5.975 -21.123 -10.535 228 HB3 ALA 29 HB3 ALA 29 -7.098 -22.475 -10.812 229 H MET 30 H MET 30 -7.688 -24.311 -8.939 230 HA MET 30 HA MET 30 -10.497 -24.047 -8.472 231 HB2 MET 30 HB2 MET 30 -8.680 -26.461 -8.163 232 HB3 MET 30 HB3 MET 30 -10.440 -26.510 -8.133 233 HG2 MET 30 HG2 MET 30 -8.794 -25.542 -10.506 234 HG3 MET 30 HG3 MET 30 -9.417 -27.164 -10.297 235 HE1 MET 30 HE1 MET 30 -11.474 -23.384 -10.142 236 HE2 MET 30 HE2 MET 30 -9.994 -23.541 -11.119 237 HE3 MET 30 HE3 MET 30 -11.594 -23.500 -11.896 238 H GLY 31 H GLY 31 -7.808 -24.760 -6.179 239 HA2 GLY 31 HA2 GLY 31 -9.409 -25.227 -3.898 240 HA3 GLY 31 HA3 GLY 31 -7.762 -24.564 -3.895 241 H TRP 32 H TRP 32 -7.927 -22.131 -5.045 242 HA TRP 32 HA TRP 32 -9.098 -20.387 -3.222 243 HB2 TRP 32 HB2 TRP 32 -8.109 -20.130 -6.061 244 HB3 TRP 32 HB3 TRP 32 -9.053 -18.822 -5.379 245 HD1 TRP 32 HD1 TRP 32 -5.599 -20.300 -5.204 246 HE1 TRP 32 HE1 TRP 32 -4.098 -18.782 -3.808 247 HE3 TRP 32 HE3 TRP 32 -9.194 -17.224 -3.250 248 HZ2 TRP 32 HZ2 TRP 32 -4.447 -16.612 -1.899 249 HZ3 TRP 32 HZ3 TRP 32 -8.582 -15.469 -1.610 250 HH2 TRP 32 HH2 TRP 32 -6.216 -15.159 -0.925 251 H TYR 33 H TYR 33 -10.397 -21.397 -6.458 252 HA TYR 33 HA TYR 33 -12.723 -19.816 -6.381 253 HB2 TYR 33 HB2 TYR 33 -12.030 -20.820 -8.447 254 HB3 TYR 33 HB3 TYR 33 -12.066 -22.441 -7.763 255 HD1 TYR 33 HD1 TYR 33 -14.151 -23.681 -7.458 256 HD2 TYR 33 HD2 TYR 33 -14.179 -19.662 -9.026 257 HE1 TYR 33 HE1 TYR 33 -16.545 -23.915 -7.995 258 HE2 TYR 33 HE2 TYR 33 -16.533 -19.948 -9.718 259 HH TYR 33 HH TYR 33 -18.414 -22.924 -8.993 260 H TYR 34 H TYR 34 -12.221 -23.204 -5.269 261 HA TYR 34 HA TYR 34 -14.890 -23.833 -4.773 262 HB2 TYR 34 HB2 TYR 34 -13.303 -25.575 -4.885 263 HB3 TYR 34 HB3 TYR 34 -12.224 -24.808 -3.731 264 HD1 TYR 34 HD2 TYR 34 -15.610 -26.406 -3.959 265 HD2 TYR 34 HD1 TYR 34 -12.257 -25.345 -1.477 266 HE1 TYR 34 HE2 TYR 34 -16.601 -27.710 -2.091 267 HE2 TYR 34 HE1 TYR 34 -13.230 -26.644 0.413 268 HH TYR 34 HH TYR 34 -16.359 -28.401 0.123 269 H TYR 35 H TYR 35 -12.420 -22.658 -2.353 270 HA TYR 35 HA TYR 35 -14.488 -22.563 -0.337 271 HB2 TYR 35 HB2 TYR 35 -12.889 -22.171 1.158 272 HB3 TYR 35 HB3 TYR 35 -11.821 -22.736 -0.108 273 HD1 TYR 35 HD1 TYR 35 -10.551 -21.025 -1.490 274 HD2 TYR 35 HD2 TYR 35 -12.874 -19.904 1.962 275 HE1 TYR 35 HE1 TYR 35 -9.381 -18.857 -1.427 276 HE2 TYR 35 HE2 TYR 35 -11.731 -17.716 2.034 277 HH TYR 35 HH TYR 35 -10.124 -16.352 1.075 278 H LEU 36 H LEU 36 -13.069 -20.140 -2.573 279 HA LEU 36 HA LEU 36 -14.139 -17.858 -1.297 280 HB2 LEU 36 HB2 LEU 36 -12.356 -17.761 -2.954 281 HB3 LEU 36 HB3 LEU 36 -13.441 -18.379 -4.209 282 HG LEU 36 HG LEU 36 -14.787 -16.336 -4.119 283 HD11 LEU 36 HD11 LEU 36 -14.548 -15.647 -1.772 284 HD12 LEU 36 HD12 LEU 36 -12.800 -15.393 -1.999 285 HD13 LEU 36 HD13 LEU 36 -13.976 -14.354 -2.828 286 HD21 LEU 36 HD21 LEU 36 -13.152 -14.875 -5.132 287 HD22 LEU 36 HD22 LEU 36 -11.807 -15.704 -4.315 288 HD23 LEU 36 HD23 LEU 36 -12.750 -16.534 -5.567 289 H ASP 37 H ASP 37 -15.475 -19.801 -4.078 290 HA ASP 37 HA ASP 37 -17.860 -18.277 -4.362 291 HB2 ASP 37 HB2 ASP 37 -17.076 -19.869 -6.062 292 HB3 ASP 37 HB3 ASP 37 -17.322 -21.215 -4.945 293 H ASP 38 H ASP 38 -17.102 -21.103 -2.288 294 HA ASP 38 HA ASP 38 -19.718 -21.374 -1.159 295 HB2 ASP 38 HB2 ASP 38 -18.010 -23.126 -1.042 296 HB3 ASP 38 HB3 ASP 38 -16.993 -22.102 -0.028 297 H THR 39 H THR 39 -17.194 -19.003 -0.532 298 HA THR 39 HA THR 39 -18.288 -18.316 2.129 299 HB THR 39 HB THR 39 -15.832 -17.340 0.614 300 HG1 THR 39 HG1 THR 39 -15.567 -19.404 1.201 301 HG21 THR 39 HG21 THR 39 -16.827 -16.755 3.429 302 HG22 THR 39 HG22 THR 39 -15.128 -16.552 2.938 303 HG23 THR 39 HG23 THR 39 -16.398 -15.601 2.157 304 H LEU 40 H LEU 40 -18.035 -16.946 -1.177 305 HA LEU 40 HA LEU 40 -18.751 -14.279 -0.569 306 HB2 LEU 40 HB2 LEU 40 -19.299 -15.962 -3.035 307 HB3 LEU 40 HB3 LEU 40 -19.660 -14.241 -2.936 308 HG LEU 40 HG LEU 40 -16.892 -15.457 -2.723 309 HD11 LEU 40 HD11 LEU 40 -16.528 -14.558 -4.963 310 HD12 LEU 40 HD12 LEU 40 -17.923 -15.647 -4.971 311 HD13 LEU 40 HD13 LEU 40 -18.175 -13.889 -4.992 312 HD21 LEU 40 HD21 LEU 40 -17.750 -12.581 -2.674 313 HD22 LEU 40 HD22 LEU 40 -16.734 -13.489 -1.501 314 HD23 LEU 40 HD23 LEU 40 -16.107 -13.105 -3.099 315 H GLU 41 H GLU 41 -20.609 -13.578 0.427 316 HA GLU 41 HA GLU 41 -23.071 -15.137 0.422 317 HB2 GLU 41 HB2 GLU 41 -22.268 -12.436 1.575 318 HB3 GLU 41 HB3 GLU 41 -23.893 -13.106 1.754 319 HG2 GLU 41 HG2 GLU 41 -21.434 -14.668 2.590 320 HG3 GLU 41 HG3 GLU 41 -22.230 -13.520 3.666 321 H PHE 42 H PHE 42 -22.531 -14.856 -2.090 322 HA PHE 42 HA PHE 42 -23.385 -12.455 -3.369 323 HB2 PHE 42 HB2 PHE 42 -23.186 -13.655 -5.444 324 HB3 PHE 42 HB3 PHE 42 -21.844 -14.062 -4.409 325 HD1 PHE 42 HD2 PHE 42 -25.105 -15.305 -5.765 326 HD2 PHE 42 HD1 PHE 42 -21.386 -16.377 -3.850 327 HE1 PHE 42 HE2 PHE 42 -25.595 -17.704 -6.141 328 HE2 PHE 42 HE1 PHE 42 -21.884 -18.765 -4.228 329 HZ PHE 42 HZ PHE 42 -23.989 -19.443 -5.369 330 HA PRO 43 HA PRO 43 -24.461 -11.870 -5.460 331 HB2 PRO 43 HB2 PRO 43 -26.456 -10.116 -6.035 332 HB3 PRO 43 HB3 PRO 43 -26.345 -11.734 -6.793 333 HG2 PRO 43 HG2 PRO 43 -28.042 -10.913 -4.418 334 HG3 PRO 43 HG3 PRO 43 -28.540 -11.839 -5.870 335 HD2 PRO 43 HD2 PRO 43 -27.850 -13.059 -3.516 336 HD3 PRO 43 HD3 PRO 43 -27.476 -13.796 -5.100 337 H PHE 44 H PHE 44 -23.660 -9.735 -5.164 338 HA PHE 44 HA PHE 44 -24.427 -8.196 -2.773 339 HB2 PHE 44 HB2 PHE 44 -22.238 -8.088 -1.858 340 HB3 PHE 44 HB3 PHE 44 -22.727 -9.764 -1.931 341 HD1 PHE 44 HD1 PHE 44 -21.700 -11.281 -3.747 342 HD2 PHE 44 HD2 PHE 44 -20.177 -7.364 -2.812 343 HE1 PHE 44 HE1 PHE 44 -19.522 -11.895 -4.742 344 HE2 PHE 44 HE2 PHE 44 -18.016 -7.961 -3.861 345 HZ PHE 44 HZ PHE 44 -17.669 -10.236 -4.802 346 H MET 45 H MET 45 -22.452 -6.201 -2.922 347 HA MET 45 HA MET 45 -22.488 -5.412 -5.783 348 HB2 MET 45 HB2 MET 45 -23.363 -3.314 -5.417 349 HB3 MET 45 HB3 MET 45 -24.440 -4.379 -4.544 350 HG2 MET 45 HG2 MET 45 -23.813 -3.552 -2.475 351 HG3 MET 45 HG3 MET 45 -22.185 -3.137 -2.981 352 HE1 MET 45 HE1 MET 45 -21.413 -1.085 -4.281 353 HE2 MET 45 HE2 MET 45 -22.557 -1.240 -5.622 354 HE3 MET 45 HE3 MET 45 -22.447 0.283 -4.719 355 H GLY 46 H GLY 46 -21.130 -3.547 -6.255 356 HA2 GLY 46 HA2 GLY 46 -18.916 -2.958 -4.425 357 HA3 GLY 46 HA3 GLY 46 -18.480 -4.054 -5.749 358 H LYS 47 H LYS 47 -17.081 -2.021 -5.812 359 HA LYS 47 HA LYS 47 -18.172 -0.386 -8.059 360 HB2 LYS 47 HB2 LYS 47 -17.497 0.856 -5.856 361 HB3 LYS 47 HB3 LYS 47 -15.842 0.435 -6.287 362 HG2 LYS 47 HG2 LYS 47 -16.095 2.579 -7.217 363 HG3 LYS 47 HG3 LYS 47 -16.404 1.529 -8.601 364 HD2 LYS 47 HD2 LYS 47 -18.106 3.154 -8.700 365 HD3 LYS 47 HD3 LYS 47 -18.895 1.735 -8.009 366 HE2 LYS 47 HE2 LYS 47 -18.822 2.669 -5.781 367 HE3 LYS 47 HE3 LYS 47 -17.783 4.000 -6.310 368 HZ1 LYS 47 HZ1 LYS 47 -20.161 4.604 -6.084 369 HZ2 LYS 47 HZ2 LYS 47 -19.582 4.898 -7.577 370 HZ3 LYS 47 HZ3 LYS 47 -20.544 3.607 -7.331 371 H TRP 48 H TRP 48 -17.316 -1.042 -9.936 372 HA TRP 48 HA TRP 48 -14.835 -2.654 -10.007 373 HB2 TRP 48 HB2 TRP 48 -16.799 -3.103 -11.524 374 HB3 TRP 48 HB3 TRP 48 -16.501 -1.560 -12.305 375 HD1 TRP 48 HD1 TRP 48 -13.124 -2.497 -11.997 376 HE1 TRP 48 HE1 TRP 48 -12.202 -3.873 -13.873 377 HE3 TRP 48 HE3 TRP 48 -17.550 -4.062 -14.082 378 HZ2 TRP 48 HZ2 TRP 48 -13.196 -5.533 -16.012 379 HZ3 TRP 48 HZ3 TRP 48 -17.488 -5.580 -16.048 380 HH2 TRP 48 HH2 TRP 48 -15.328 -6.310 -17.017 381 H LYS 49 H LYS 49 -13.046 -1.526 -9.607 382 HA LYS 49 HA LYS 49 -12.756 1.330 -10.215 383 HB2 LYS 49 HB2 LYS 49 -10.725 -0.720 -9.187 384 HB3 LYS 49 HB3 LYS 49 -10.543 1.033 -9.166 385 HG2 LYS 49 HG2 LYS 49 -12.470 -0.624 -7.497 386 HG3 LYS 49 HG3 LYS 49 -10.990 0.179 -6.973 387 HD2 LYS 49 HD2 LYS 49 -12.135 2.397 -7.727 388 HD3 LYS 49 HD3 LYS 49 -13.638 1.431 -7.766 389 HE2 LYS 49 HE2 LYS 49 -12.910 0.627 -5.395 390 HE3 LYS 49 HE3 LYS 49 -11.732 1.944 -5.443 391 HZ1 LYS 49 HZ1 LYS 49 -13.596 3.502 -5.655 392 HZ2 LYS 49 HZ2 LYS 49 -14.665 2.267 -5.610 393 HZ3 LYS 49 HZ3 LYS 49 -13.759 2.520 -4.294 394 H LYS 50 H LYS 50 -13.291 0.484 -12.587 395 HA LYS 50 HA LYS 50 -11.475 -1.249 -13.942 396 HB2 LYS 50 HB2 LYS 50 -13.819 -0.863 -14.616 397 HB3 LYS 50 HB3 LYS 50 -13.440 0.806 -15.063 398 HG2 LYS 50 HG2 LYS 50 -11.958 0.081 -16.832 399 HG3 LYS 50 HG3 LYS 50 -12.053 -1.608 -16.318 400 HD2 LYS 50 HD2 LYS 50 -14.421 0.007 -17.369 401 HD3 LYS 50 HD3 LYS 50 -13.393 -1.040 -18.360 402 HE2 LYS 50 HE2 LYS 50 -13.956 -2.964 -16.829 403 HE3 LYS 50 HE3 LYS 50 -15.117 -1.924 -16.001 404 HZ1 LYS 50 HZ1 LYS 50 -16.194 -3.263 -17.678 405 HZ2 LYS 50 HZ2 LYS 50 -16.290 -1.699 -18.147 406 HZ3 LYS 50 HZ3 LYS 50 -15.221 -2.707 -18.861 407 H LYS 51 H LYS 51 -9.486 -0.890 -14.678 408 HA LYS 51 HA LYS 51 -8.398 1.866 -14.759 409 HB2 LYS 51 HB2 LYS 51 -7.185 -0.912 -15.038 410 HB3 LYS 51 HB3 LYS 51 -6.235 0.577 -15.182 411 HG2 LYS 51 HG2 LYS 51 -6.501 1.171 -12.941 412 HG3 LYS 51 HG3 LYS 51 -7.999 0.263 -12.775 413 HD2 LYS 51 HD2 LYS 51 -6.646 -1.888 -12.976 414 HD3 LYS 51 HD3 LYS 51 -5.198 -0.882 -12.822 415 HE2 LYS 51 HE2 LYS 51 -5.811 -1.787 -10.645 416 HE3 LYS 51 HE3 LYS 51 -6.035 -0.037 -10.630 417 HZ1 LYS 51 HZ1 LYS 51 -8.214 -2.028 -11.024 418 HZ2 LYS 51 HZ2 LYS 51 -7.907 -1.236 -9.614 419 HZ3 LYS 51 HZ3 LYS 51 -8.450 -0.444 -10.958 420 H SER 52 H SER 52 -9.660 -0.513 -17.001 421 HA SER 52 HA SER 52 -8.250 0.168 -19.334 422 HB2 SER 52 HB2 SER 52 -11.152 -0.714 -19.174 423 HB3 SER 52 HB3 SER 52 -9.975 -1.063 -20.448 424 HG SER 52 HG SER 52 -8.883 -2.413 -19.016 425 H ARG 53 H ARG 53 -8.135 2.143 -20.254 426 HA ARG 53 HA ARG 53 -10.484 3.588 -21.070 427 HB2 ARG 53 HB2 ARG 53 -9.751 4.323 -18.555 428 HB3 ARG 53 HB3 ARG 53 -8.577 5.285 -19.439 429 HG2 ARG 53 HG2 ARG 53 -10.501 6.316 -20.741 430 HG3 ARG 53 HG3 ARG 53 -11.602 5.330 -19.772 431 HD2 ARG 53 HD2 ARG 53 -11.606 7.434 -18.755 432 HD3 ARG 53 HD3 ARG 53 -10.602 6.421 -17.703 433 HE ARG 53 HE ARG 53 -8.740 7.605 -19.330 434 HH11 ARG 53 HH21 ARG 53 -11.243 8.829 -17.115 435 HH12 ARG 53 HH22 ARG 53 -10.580 10.433 -17.061 436 HH21 ARG 53 HH11 ARG 53 -7.789 9.616 -19.121 437 HH22 ARG 53 HH12 ARG 53 -8.521 10.884 -18.194 438 H LYS 54 H LYS 54 -9.366 5.813 -22.143 439 HA LYS 54 HA LYS 54 -7.318 4.988 -23.995 440 HB2 LYS 54 HB2 LYS 54 -8.181 7.794 -23.145 441 HB3 LYS 54 HB3 LYS 54 -7.200 7.419 -24.550 442 HG2 LYS 54 HG2 LYS 54 -10.116 6.647 -24.111 443 HG3 LYS 54 HG3 LYS 54 -9.502 7.878 -25.204 444 HD2 LYS 54 HD2 LYS 54 -9.067 4.870 -25.471 445 HD3 LYS 54 HD3 LYS 54 -10.174 5.868 -26.414 446 HE2 LYS 54 HE2 LYS 54 -8.248 7.182 -27.296 447 HE3 LYS 54 HE3 LYS 54 -7.134 6.150 -26.391 448 HZ1 LYS 54 HZ1 LYS 54 -7.919 4.265 -27.709 449 HZ2 LYS 54 HZ2 LYS 54 -8.944 5.225 -28.547 450 HZ3 LYS 54 HZ3 LYS 54 -7.336 5.433 -28.682 451 H THR 55 H THR 55 -7.117 5.781 -20.689 452 HA THR 55 HA THR 55 -4.187 6.072 -20.727 453 HB THR 55 HB THR 55 -4.588 7.769 -18.842 454 HG1 THR 55 HG1 THR 55 -6.553 8.068 -18.303 455 HG21 THR 55 HG21 THR 55 -4.912 9.682 -20.290 456 HG22 THR 55 HG22 THR 55 -3.909 8.494 -21.140 457 HG23 THR 55 HG23 THR 55 -5.628 8.674 -21.562 458 H SER 56 H SER 56 -3.453 5.615 -18.295 459 HA SER 56 HA SER 56 -4.620 3.149 -17.411 460 HB2 SER 56 HB2 SER 56 -2.689 4.969 -15.924 461 HB3 SER 56 HB3 SER 56 -2.884 3.217 -15.741 462 HG SER 56 HG SER 56 -1.071 3.767 -17.037 463 H THR 57 H THR 57 -5.913 6.197 -17.005 464 HA THR 57 HA THR 57 -6.251 6.627 -14.317 465 HB THR 57 HB THR 57 -8.298 7.303 -16.437 466 HG1 THR 57 HG1 THR 57 -5.809 8.606 -16.039 467 HG21 THR 57 HG21 THR 57 -8.823 8.167 -14.209 468 HG22 THR 57 HG22 THR 57 -7.205 8.889 -14.075 469 HG23 THR 57 HG23 THR 57 -8.361 9.496 -15.282 470 H ILE 58 H ILE 58 -7.547 5.862 -12.731 471 HA ILE 58 HA ILE 58 -9.241 3.577 -13.038 472 HB ILE 58 HB ILE 58 -8.896 5.679 -10.879 473 HG12 ILE 58 HG12 ILE 58 -6.992 3.998 -11.488 474 HG13 ILE 58 HG13 ILE 58 -7.409 4.274 -9.800 475 HG21 ILE 58 HG21 ILE 58 -11.105 4.850 -10.480 476 HG22 ILE 58 HG22 ILE 58 -10.607 3.167 -10.717 477 HG23 ILE 58 HG23 ILE 58 -10.046 4.084 -9.299 478 HD11 ILE 58 HD11 ILE 58 -8.526 2.158 -9.642 479 HD12 ILE 58 HD12 ILE 58 -8.493 1.950 -11.410 480 HD13 ILE 58 HD13 ILE 58 -6.984 1.887 -10.464 481 H GLU 59 H GLU 59 -11.384 3.429 -13.351 482 HA GLU 59 HA GLU 59 -13.136 5.820 -13.295 483 HB2 GLU 59 HB2 GLU 59 -13.141 3.480 -15.268 484 HB3 GLU 59 HB3 GLU 59 -14.501 4.572 -15.054 485 HG2 GLU 59 HG2 GLU 59 -11.710 5.359 -15.991 486 HG3 GLU 59 HG3 GLU 59 -13.127 5.169 -17.014 487 H GLU 60 H GLU 60 -15.230 5.238 -12.387 488 HA GLU 60 HA GLU 60 -15.070 2.793 -10.666 489 HB2 GLU 60 HB2 GLU 60 -15.820 5.651 -9.924 490 HB3 GLU 60 HB3 GLU 60 -16.030 4.244 -8.882 491 HG2 GLU 60 HG2 GLU 60 -13.548 3.800 -9.087 492 HG3 GLU 60 HG3 GLU 60 -13.393 5.339 -9.937 493 H LYS 61 H LYS 61 -16.559 1.496 -11.599 494 HA LYS 61 HA LYS 61 -19.236 2.655 -12.326 495 HB2 LYS 61 HB2 LYS 61 -17.964 -0.017 -13.054 496 HB3 LYS 61 HB3 LYS 61 -19.594 0.498 -13.482 497 HG2 LYS 61 HG2 LYS 61 -18.643 2.396 -14.798 498 HG3 LYS 61 HG3 LYS 61 -17.014 1.873 -14.361 499 HD2 LYS 61 HD2 LYS 61 -17.492 1.059 -16.588 500 HD3 LYS 61 HD3 LYS 61 -17.388 -0.304 -15.470 501 HE2 LYS 61 HE2 LYS 61 -19.216 -0.689 -17.002 502 HE3 LYS 61 HE3 LYS 61 -19.852 -0.453 -15.377 503 HZ1 LYS 61 HZ1 LYS 61 -20.417 1.828 -16.018 504 HZ2 LYS 61 HZ2 LYS 61 -19.898 1.552 -17.558 505 HZ3 LYS 61 HZ3 LYS 61 -21.174 0.715 -16.930 506 H THR 62 H THR 62 -20.838 2.347 -10.795 507 HA THR 62 HA THR 62 -20.512 0.492 -8.607 508 HB THR 62 HB THR 62 -23.099 1.757 -9.594 509 HG1 THR 62 HG1 THR 62 -22.483 3.618 -8.753 510 HG21 THR 62 HG21 THR 62 -23.639 1.799 -7.186 511 HG22 THR 62 HG22 THR 62 -23.234 0.147 -7.678 512 HG23 THR 62 HG23 THR 62 -22.039 1.126 -6.798 513 H VAL 63 H VAL 63 -21.064 -1.620 -8.523 514 HA VAL 63 HA VAL 63 -22.640 -2.790 -10.780 515 HB VAL 63 HB VAL 63 -20.988 -4.584 -10.845 516 HG11 VAL 63 HG11 VAL 63 -20.994 -2.831 -12.580 517 HG12 VAL 63 HG12 VAL 63 -19.781 -1.921 -11.665 518 HG13 VAL 63 HG13 VAL 63 -19.387 -3.517 -12.330 519 HG21 VAL 63 HG21 VAL 63 -19.073 -2.751 -9.365 520 HG22 VAL 63 HG22 VAL 63 -19.790 -4.239 -8.703 521 HG23 VAL 63 HG23 VAL 63 -18.693 -4.329 -10.085 522 H GLU 64 H GLU 64 -23.547 -4.844 -10.395 523 HA GLU 64 HA GLU 64 -23.773 -5.645 -7.524 524 HB2 GLU 64 HB2 GLU 64 -25.910 -4.984 -8.627 525 HB3 GLU 64 HB3 GLU 64 -25.672 -6.261 -9.824 526 HG2 GLU 64 HG2 GLU 64 -25.721 -7.955 -8.003 527 HG3 GLU 64 HG3 GLU 64 -25.860 -6.666 -6.807 528 H VAL 65 H VAL 65 -22.603 -7.440 -7.097 529 HA VAL 65 HA VAL 65 -21.343 -8.921 -9.330 530 HB VAL 65 HB VAL 65 -20.759 -9.049 -6.338 531 HG11 VAL 65 HG11 VAL 65 -18.594 -10.011 -7.182 532 HG12 VAL 65 HG12 VAL 65 -19.984 -11.002 -7.643 533 HG13 VAL 65 HG13 VAL 65 -19.235 -9.916 -8.835 534 HG21 VAL 65 HG21 VAL 65 -19.415 -7.353 -8.494 535 HG22 VAL 65 HG22 VAL 65 -20.271 -6.755 -7.055 536 HG23 VAL 65 HG23 VAL 65 -18.759 -7.637 -6.865 537 H LEU 66 H LEU 66 -22.373 -10.716 -9.971 538 HA LEU 66 HA LEU 66 -24.758 -11.533 -8.500 539 HB2 LEU 66 HB2 LEU 66 -23.639 -12.623 -11.103 540 HB3 LEU 66 HB3 LEU 66 -25.265 -12.848 -10.473 541 HG LEU 66 HG LEU 66 -24.038 -10.248 -11.492 542 HD11 LEU 66 HD11 LEU 66 -26.352 -11.940 -12.521 543 HD12 LEU 66 HD12 LEU 66 -25.745 -10.432 -13.237 544 HD13 LEU 66 HD13 LEU 66 -24.719 -11.877 -13.214 545 HD21 LEU 66 HD21 LEU 66 -25.515 -9.669 -9.632 546 HD22 LEU 66 HD22 LEU 66 -26.286 -9.240 -11.156 547 HD23 LEU 66 HD23 LEU 66 -26.805 -10.703 -10.289 548 H GLY 67 H GLY 67 -21.515 -12.885 -9.051 549 HA2 GLY 67 HA2 GLY 67 -21.374 -14.740 -7.064 550 HA3 GLY 67 HA3 GLY 67 -22.198 -15.597 -8.389 551 H MET 68 H MET 68 -19.853 -16.662 -7.946 552 HA MET 68 HA MET 68 -17.641 -15.420 -9.362 553 HB2 MET 68 HB2 MET 68 -18.079 -18.321 -8.574 554 HB3 MET 68 HB3 MET 68 -16.637 -17.669 -9.356 555 HG2 MET 68 HG2 MET 68 -16.864 -15.902 -7.290 556 HG3 MET 68 HG3 MET 68 -17.585 -17.329 -6.556 557 HE1 MET 68 HE1 MET 68 -14.548 -16.865 -9.147 558 HE2 MET 68 HE2 MET 68 -14.456 -15.551 -7.953 559 HE3 MET 68 HE3 MET 68 -13.212 -16.818 -7.987 560 H ALA 69 H ALA 69 -16.775 -16.029 -11.351 561 HA ALA 69 HA ALA 69 -18.648 -16.317 -13.527 562 HB1 ALA 69 HB1 ALA 69 -15.614 -16.479 -13.432 563 HB2 ALA 69 HB2 ALA 69 -16.585 -16.125 -14.867 564 HB3 ALA 69 HB3 ALA 69 -16.550 -14.963 -13.551 565 HA PRO 70 HA PRO 70 -18.533 -20.717 -14.470 566 HB2 PRO 70 HB2 PRO 70 -16.908 -20.011 -16.915 567 HB3 PRO 70 HB3 PRO 70 -18.267 -21.169 -16.762 568 HG2 PRO 70 HG2 PRO 70 -18.735 -18.705 -17.761 569 HG3 PRO 70 HG3 PRO 70 -19.858 -19.385 -16.536 570 HD2 PRO 70 HD2 PRO 70 -17.620 -17.406 -16.156 571 HD3 PRO 70 HD3 PRO 70 -19.270 -17.372 -15.462 572 H ASP 71 H ASP 71 -17.282 -22.516 -14.313 573 HA ASP 71 HA ASP 71 -14.978 -22.491 -12.756 574 HB2 ASP 71 HB2 ASP 71 -16.570 -24.376 -13.091 575 HB3 ASP 71 HB3 ASP 71 -15.953 -24.598 -14.730 576 H ASP 72 H ASP 72 -15.317 -22.487 -16.275 577 HA ASP 72 HA ASP 72 -12.561 -23.100 -16.898 578 HB2 ASP 72 HB2 ASP 72 -14.411 -23.539 -18.457 579 HB3 ASP 72 HB3 ASP 72 -14.751 -21.809 -18.567 580 H GLU 73 H GLU 73 -14.279 -20.091 -16.155 581 HA GLU 73 HA GLU 73 -12.117 -18.351 -17.125 582 HB2 GLU 73 HB2 GLU 73 -14.388 -17.770 -15.172 583 HB3 GLU 73 HB3 GLU 73 -13.287 -16.592 -15.861 584 HG2 GLU 73 HG2 GLU 73 -15.377 -18.227 -17.340 585 HG3 GLU 73 HG3 GLU 73 -15.422 -16.503 -17.004 586 H CYS 74 H CYS 74 -13.361 -19.644 -14.043 587 HA CYS 74 HA CYS 74 -11.352 -18.486 -12.415 588 HB2 CYS 74 HB2 CYS 74 -13.298 -20.737 -11.803 589 HB3 CYS 74 HB3 CYS 74 -12.397 -19.762 -10.626 590 HG CYS 74 HG CYS 74 -14.795 -18.963 -12.743 591 H LEU 75 H LEU 75 -10.656 -20.758 -14.559 592 HA LEU 75 HA LEU 75 -9.268 -22.780 -13.061 593 HB2 LEU 75 HB2 LEU 75 -10.125 -22.381 -15.728 594 HB3 LEU 75 HB3 LEU 75 -8.386 -22.304 -15.846 595 HG LEU 75 HG LEU 75 -9.085 -24.505 -16.323 596 HD11 LEU 75 HD11 LEU 75 -8.004 -24.639 -13.478 597 HD12 LEU 75 HD12 LEU 75 -7.916 -25.900 -14.723 598 HD13 LEU 75 HD13 LEU 75 -7.035 -24.381 -14.946 599 HD21 LEU 75 HD21 LEU 75 -10.580 -24.596 -13.682 600 HD22 LEU 75 HD22 LEU 75 -11.304 -24.481 -15.291 601 HD23 LEU 75 HD23 LEU 75 -10.406 -25.933 -14.833 602 H LYS 76 H LYS 76 -8.496 -19.503 -13.750 603 HA LYS 76 HA LYS 76 -5.605 -19.968 -13.222 604 HB2 LYS 76 HB2 LYS 76 -4.935 -18.786 -15.196 605 HB3 LYS 76 HB3 LYS 76 -6.041 -20.066 -15.672 606 HG2 LYS 76 HG2 LYS 76 -7.855 -18.052 -15.478 607 HG3 LYS 76 HG3 LYS 76 -6.411 -17.070 -15.687 608 HD2 LYS 76 HD2 LYS 76 -7.245 -17.361 -17.880 609 HD3 LYS 76 HD3 LYS 76 -5.907 -18.503 -17.766 610 HE2 LYS 76 HE2 LYS 76 -7.688 -19.687 -18.826 611 HE3 LYS 76 HE3 LYS 76 -7.612 -20.312 -17.179 612 HZ1 LYS 76 HZ1 LYS 76 -9.491 -18.762 -16.649 613 HZ2 LYS 76 HZ2 LYS 76 -9.560 -18.346 -18.239 614 HZ3 LYS 76 HZ3 LYS 76 -9.895 -19.878 -17.769 615 H ASP 77 H ASP 77 -8.380 -17.807 -13.041 616 HA ASP 77 HA ASP 77 -6.953 -15.995 -11.249 617 HB2 ASP 77 HB2 ASP 77 -6.329 -15.061 -13.440 618 HB3 ASP 77 HB3 ASP 77 -8.009 -15.108 -13.967 619 H MET 78 H MET 78 -8.615 -14.571 -10.184 620 HA MET 78 HA MET 78 -11.124 -16.137 -9.948 621 HB2 MET 78 HB2 MET 78 -9.994 -13.862 -8.275 622 HB3 MET 78 HB3 MET 78 -11.529 -14.676 -7.969 623 HG2 MET 78 HG2 MET 78 -8.782 -15.989 -7.918 624 HG3 MET 78 HG3 MET 78 -9.747 -15.519 -6.531 625 HE1 MET 78 HE1 MET 78 -9.975 -19.462 -8.802 626 HE2 MET 78 HE2 MET 78 -9.761 -17.973 -9.733 627 HE3 MET 78 HE3 MET 78 -8.571 -18.420 -8.488 628 H TYR 79 H TYR 79 -12.879 -15.573 -11.077 629 HA TYR 79 HA TYR 79 -13.245 -12.746 -11.953 630 HB2 TYR 79 HB2 TYR 79 -13.701 -15.375 -13.406 631 HB3 TYR 79 HB3 TYR 79 -14.411 -13.860 -13.926 632 HD1 TYR 79 HD1 TYR 79 -12.958 -11.977 -14.731 633 HD2 TYR 79 HD2 TYR 79 -11.468 -15.964 -14.032 634 HE1 TYR 79 HE1 TYR 79 -11.089 -11.541 -16.285 635 HE2 TYR 79 HE2 TYR 79 -9.606 -15.550 -15.598 636 HH TYR 79 HH TYR 79 -9.179 -12.416 -17.314 637 H VAL 80 H VAL 80 -15.432 -12.053 -12.049 638 HA VAL 80 HA VAL 80 -17.480 -13.836 -10.811 639 HB VAL 80 HB VAL 80 -18.249 -11.818 -9.570 640 HG11 VAL 80 HG11 VAL 80 -16.975 -13.576 -8.424 641 HG12 VAL 80 HG12 VAL 80 -15.451 -12.754 -8.817 642 HG13 VAL 80 HG13 VAL 80 -16.641 -11.989 -7.742 643 HG21 VAL 80 HG21 VAL 80 -16.705 -9.957 -9.123 644 HG22 VAL 80 HG22 VAL 80 -15.514 -10.625 -10.249 645 HG23 VAL 80 HG23 VAL 80 -17.081 -10.034 -10.847 646 H GLU 81 H GLU 81 -19.618 -13.457 -11.448 647 HA GLU 81 HA GLU 81 -19.995 -12.099 -14.059 648 HB2 GLU 81 HB2 GLU 81 -21.890 -13.612 -12.199 649 HB3 GLU 81 HB3 GLU 81 -22.373 -12.820 -13.711 650 HG2 GLU 81 HG2 GLU 81 -20.687 -14.276 -14.917 651 HG3 GLU 81 HG3 GLU 81 -20.449 -15.150 -13.401 652 H VAL 82 H VAL 82 -21.107 -10.136 -14.231 653 HA VAL 82 HA VAL 82 -21.795 -8.747 -11.714 654 HB VAL 82 HB VAL 82 -19.352 -8.565 -12.090 655 HG11 VAL 82 HG11 VAL 82 -19.160 -8.751 -14.509 656 HG12 VAL 82 HG12 VAL 82 -20.043 -7.223 -14.741 657 HG13 VAL 82 HG13 VAL 82 -18.461 -7.223 -13.975 658 HG21 VAL 82 HG21 VAL 82 -20.757 -5.948 -12.593 659 HG22 VAL 82 HG22 VAL 82 -20.563 -6.762 -11.012 660 HG23 VAL 82 HG23 VAL 82 -19.137 -6.188 -11.896 661 H ALA 83 H ALA 83 -23.302 -7.134 -11.990 662 HA ALA 83 HA ALA 83 -24.276 -6.605 -14.772 663 HB1 ALA 83 HB1 ALA 83 -26.479 -6.244 -13.833 664 HB2 ALA 83 HB2 ALA 83 -25.905 -7.859 -13.373 665 HB3 ALA 83 HB3 ALA 83 -25.874 -6.538 -12.183 666 H ASP 84 H ASP 84 -24.407 -4.487 -15.364 667 HA ASP 84 HA ASP 84 -22.829 -2.621 -13.745 668 HB2 ASP 84 HB2 ASP 84 -22.304 -2.964 -16.100 669 HB3 ASP 84 HB3 ASP 84 -23.934 -2.432 -16.553 670 H ILE 85 H ILE 85 -24.713 -2.694 -12.144 671 HA ILE 85 HA ILE 85 -27.109 -1.293 -12.651 672 HB ILE 85 HB ILE 85 -27.351 -1.041 -10.266 673 HG12 ILE 85 HG12 ILE 85 -24.511 -2.053 -9.956 674 HG13 ILE 85 HG13 ILE 85 -25.009 -0.384 -9.696 675 HG21 ILE 85 HG21 ILE 85 -27.724 -3.240 -11.442 676 HG22 ILE 85 HG22 ILE 85 -26.122 -3.764 -10.878 677 HG23 ILE 85 HG23 ILE 85 -27.410 -3.384 -9.715 678 HD11 ILE 85 HD11 ILE 85 -26.505 -1.101 -7.857 679 HD12 ILE 85 HD12 ILE 85 -25.948 -2.777 -8.065 680 HD13 ILE 85 HD13 ILE 85 -24.808 -1.534 -7.561 681 H GLY 86 H GLY 86 -23.905 0.033 -12.316 682 HA2 GLY 86 HA2 GLY 86 -24.775 2.767 -11.786 683 HA3 GLY 86 HA3 GLY 86 -23.142 2.178 -12.130 684 H GLY 87 H GLY 87 -24.830 0.812 -14.611 685 HA2 GLY 87 HA2 GLY 87 -24.979 3.215 -16.354 686 HA3 GLY 87 HA3 GLY 87 -23.809 1.948 -16.734 687 H LYS 88 H LYS 88 -24.552 -0.089 -17.494 688 HA LYS 88 HA LYS 88 -26.811 0.133 -19.192 689 HB2 LYS 88 HB2 LYS 88 -25.488 -2.463 -18.287 690 HB3 LYS 88 HB3 LYS 88 -26.486 -2.235 -19.721 691 HG2 LYS 88 HG2 LYS 88 -23.752 -1.016 -19.255 692 HG3 LYS 88 HG3 LYS 88 -24.153 -2.390 -20.283 693 HD2 LYS 88 HD2 LYS 88 -25.612 -0.888 -21.689 694 HD3 LYS 88 HD3 LYS 88 -25.120 0.476 -20.666 695 HE2 LYS 88 HE2 LYS 88 -23.674 0.593 -22.504 696 HE3 LYS 88 HE3 LYS 88 -22.728 -0.096 -21.172 697 HZ1 LYS 88 HZ1 LYS 88 -22.339 -1.287 -23.234 698 HZ2 LYS 88 HZ2 LYS 88 -23.076 -2.295 -22.178 699 HZ3 LYS 88 HZ3 LYS 88 -23.921 -1.626 -23.415 700 H ASP 89 H ASP 89 -26.558 -1.297 -16.011 701 HA ASP 89 HA ASP 89 -27.874 -2.151 -14.499 702 HB2 ASP 89 HB2 ASP 89 -28.806 0.088 -14.569 703 HB3 ASP 89 HB3 ASP 89 -29.964 -0.398 -15.810 704 H ASP 90 H ASP 90 -29.159 -2.713 -17.693 705 HA ASP 90 HA ASP 90 -30.815 -4.982 -16.730 706 HB2 ASP 90 HB2 ASP 90 -31.842 -3.028 -17.918 707 HB3 ASP 90 HB3 ASP 90 -30.833 -3.403 -19.318 708 H ASP 91 H ASP 91 -27.755 -4.743 -17.612 709 HA ASP 91 HA ASP 91 -27.778 -7.295 -19.105 710 HB2 ASP 91 HB2 ASP 91 -27.463 -5.288 -20.695 711 HB3 ASP 91 HB3 ASP 91 -25.880 -5.096 -19.926 712 H VAL 92 H VAL 92 -25.635 -8.307 -19.131 713 HA VAL 92 HA VAL 92 -24.216 -7.964 -16.538 714 HB VAL 92 HB VAL 92 -25.348 -10.511 -17.768 715 HG11 VAL 92 HG11 VAL 92 -24.019 -10.158 -15.055 716 HG12 VAL 92 HG12 VAL 92 -24.760 -11.643 -15.682 717 HG13 VAL 92 HG13 VAL 92 -23.316 -11.003 -16.452 718 HG21 VAL 92 HG21 VAL 92 -26.320 -8.921 -15.366 719 HG22 VAL 92 HG22 VAL 92 -27.209 -9.240 -16.869 720 HG23 VAL 92 HG23 VAL 92 -26.860 -10.566 -15.766 721 H TYR 93 H TYR 93 -22.113 -8.652 -16.518 722 HA TYR 93 HA TYR 93 -20.751 -9.609 -18.969 723 HB2 TYR 93 HB2 TYR 93 -19.900 -7.226 -17.259 724 HB3 TYR 93 HB3 TYR 93 -19.025 -7.872 -18.637 725 HD1 TYR 93 HD2 TYR 93 -19.988 -7.698 -20.959 726 HD2 TYR 93 HD1 TYR 93 -21.726 -5.662 -17.572 727 HE1 TYR 93 HE2 TYR 93 -21.218 -6.207 -22.497 728 HE2 TYR 93 HE1 TYR 93 -22.971 -4.172 -19.099 729 HH TYR 93 HH TYR 93 -22.741 -4.505 -22.688 730 H THR 94 H THR 94 -18.180 -9.574 -17.930 731 HA THR 94 HA THR 94 -18.281 -10.965 -15.310 732 HB THR 94 HB THR 94 -16.516 -11.679 -17.689 733 HG1 THR 94 HG1 THR 94 -18.647 -12.362 -17.963 734 HG21 THR 94 HG21 THR 94 -16.798 -13.017 -14.963 735 HG22 THR 94 HG22 THR 94 -15.885 -13.668 -16.341 736 HG23 THR 94 HG23 THR 94 -15.364 -12.165 -15.576 737 H ALA 95 H ALA 95 -16.570 -10.392 -13.951 738 HA ALA 95 HA ALA 95 -14.660 -8.305 -14.895 739 HB1 ALA 95 HB1 ALA 95 -16.276 -8.247 -12.307 740 HB2 ALA 95 HB2 ALA 95 -14.886 -7.193 -12.656 741 HB3 ALA 95 HB3 ALA 95 -16.338 -7.072 -13.642 742 H LYS 96 H LYS 96 -12.726 -8.232 -13.717 743 HA LYS 96 HA LYS 96 -11.761 -10.794 -12.628 744 HB2 LYS 96 HB2 LYS 96 -10.478 -8.027 -12.664 745 HB3 LYS 96 HB3 LYS 96 -9.654 -9.538 -12.349 746 HG2 LYS 96 HG2 LYS 96 -9.510 -10.124 -14.566 747 HG3 LYS 96 HG3 LYS 96 -11.016 -9.354 -15.035 748 HD2 LYS 96 HD2 LYS 96 -8.466 -7.845 -14.373 749 HD3 LYS 96 HD3 LYS 96 -9.010 -8.258 -16.007 750 HE2 LYS 96 HE2 LYS 96 -11.058 -6.892 -15.732 751 HE3 LYS 96 HE3 LYS 96 -10.638 -6.561 -14.058 752 HZ1 LYS 96 HZ1 LYS 96 -8.511 -5.555 -15.057 753 HZ2 LYS 96 HZ2 LYS 96 -9.357 -5.475 -16.456 754 HZ3 LYS 96 HZ3 LYS 96 -9.892 -4.704 -15.090 755 H LEU 97 H LEU 97 -11.942 -11.229 -10.381 756 HA LEU 97 HA LEU 97 -13.376 -9.409 -8.683 757 HB2 LEU 97 HB2 LEU 97 -13.248 -11.850 -8.277 758 HB3 LEU 97 HB3 LEU 97 -11.514 -11.712 -7.961 759 HG LEU 97 HG LEU 97 -11.947 -10.314 -5.972 760 HD11 LEU 97 HD11 LEU 97 -14.314 -10.097 -5.121 761 HD12 LEU 97 HD12 LEU 97 -14.016 -9.147 -6.567 762 HD13 LEU 97 HD13 LEU 97 -14.898 -10.687 -6.686 763 HD21 LEU 97 HD21 LEU 97 -13.644 -12.832 -5.989 764 HD22 LEU 97 HD22 LEU 97 -11.870 -12.790 -5.817 765 HD23 LEU 97 HD23 LEU 97 -12.889 -12.064 -4.573 766 H SER 98 H SER 98 -9.947 -9.973 -9.335 767 HA SER 98 HA SER 98 -8.614 -8.417 -7.533 768 HB2 SER 98 HB2 SER 98 -8.033 -8.603 -10.507 769 HB3 SER 98 HB3 SER 98 -6.870 -8.501 -9.176 770 HG SER 98 HG SER 98 -7.269 -10.664 -10.108 771 H ASP 99 H ASP 99 -10.855 -7.180 -9.939 772 HA ASP 99 HA ASP 99 -9.560 -4.510 -9.858 773 HB2 ASP 99 HB2 ASP 99 -9.677 -5.935 -12.020 774 HB3 ASP 99 HB3 ASP 99 -11.398 -5.546 -12.036 775 H ILE 100 H ILE 100 -11.759 -5.941 -8.205 776 HA ILE 100 HA ILE 100 -13.749 -3.719 -8.257 777 HB ILE 100 HB ILE 100 -14.042 -6.680 -8.222 778 HG12 ILE 100 HG12 ILE 100 -15.888 -4.412 -9.074 779 HG13 ILE 100 HG13 ILE 100 -14.647 -5.141 -10.115 780 HG21 ILE 100 HG21 ILE 100 -16.074 -5.060 -6.647 781 HG22 ILE 100 HG22 ILE 100 -16.156 -6.786 -7.052 782 HG23 ILE 100 HG23 ILE 100 -14.919 -6.227 -5.952 783 HD11 ILE 100 HD11 ILE 100 -15.851 -7.347 -9.852 784 HD12 ILE 100 HD12 ILE 100 -17.158 -6.448 -9.030 785 HD13 ILE 100 HD13 ILE 100 -16.757 -6.079 -10.713 786 H GLU 101 H GLU 101 -14.587 -3.068 -6.386 787 HA GLU 101 HA GLU 101 -13.229 -3.785 -3.824 788 HB2 GLU 101 HB2 GLU 101 -12.652 -1.503 -4.472 789 HB3 GLU 101 HB3 GLU 101 -14.352 -1.110 -4.781 790 HG2 GLU 101 HG2 GLU 101 -14.902 -1.336 -2.419 791 HG3 GLU 101 HG3 GLU 101 -13.302 -1.985 -2.060 792 H ALA 102 H ALA 102 -14.653 -4.900 -2.561 793 HA ALA 102 HA ALA 102 -17.465 -5.106 -3.339 794 HB1 ALA 102 HB1 ALA 102 -16.155 -7.039 -2.478 795 HB2 ALA 102 HB2 ALA 102 -16.005 -6.229 -0.901 796 HB3 ALA 102 HB3 ALA 102 -17.605 -6.707 -1.511 797 H ILE 103 H ILE 103 -19.168 -4.167 -2.336 798 HA ILE 103 HA ILE 103 -18.702 -2.324 -0.028 799 HB ILE 103 HB ILE 103 -20.148 -1.915 -2.655 800 HG12 ILE 103 HG12 ILE 103 -17.988 -0.254 -1.271 801 HG13 ILE 103 HG13 ILE 103 -17.671 -1.446 -2.531 802 HG21 ILE 103 HG21 ILE 103 -21.653 -1.049 -0.903 803 HG22 ILE 103 HG22 ILE 103 -20.324 -0.073 -0.233 804 HG23 ILE 103 HG23 ILE 103 -20.987 0.256 -1.851 805 HD11 ILE 103 HD11 ILE 103 -19.111 -0.184 -4.100 806 HD12 ILE 103 HD12 ILE 103 -19.234 1.118 -2.884 807 HD13 ILE 103 HD13 ILE 103 -17.655 0.683 -3.550 808 H ASP 104 H ASP 104 -20.235 -2.335 1.529 809 HA ASP 104 HA ASP 104 -21.941 -2.989 2.805 810 HB2 ASP 104 HB2 ASP 104 -23.026 -1.445 1.216 811 HB3 ASP 104 HB3 ASP 104 -23.523 -2.816 0.224 812 H VAL 105 H VAL 105 -20.350 -5.171 1.941 813 HA VAL 105 HA VAL 105 -22.339 -7.379 1.819 814 HB VAL 105 HB VAL 105 -20.599 -7.045 -0.010 815 HG11 VAL 105 HG11 VAL 105 -18.691 -8.244 2.012 816 HG12 VAL 105 HG12 VAL 105 -18.389 -7.999 0.287 817 HG13 VAL 105 HG13 VAL 105 -18.603 -6.600 1.349 818 HG21 VAL 105 HG21 VAL 105 -21.996 -9.053 0.326 819 HG22 VAL 105 HG22 VAL 105 -20.428 -9.353 -0.432 820 HG23 VAL 105 HG23 VAL 105 -20.693 -9.777 1.271 821 H ASP 106 H ASP 106 -21.518 -9.452 2.958 822 HA ASP 106 HA ASP 106 -21.347 -8.910 5.773 823 HB2 ASP 106 HB2 ASP 106 -22.467 -10.905 4.820 824 HB3 ASP 106 HB3 ASP 106 -20.898 -11.480 4.224 825 H ASP 107 H ASP 107 -19.683 -9.513 7.180 826 HA ASP 107 HA ASP 107 -17.113 -8.525 6.549 827 HB2 ASP 107 HB2 ASP 107 -18.007 -8.606 8.823 828 HB3 ASP 107 HB3 ASP 107 -18.023 -10.371 8.787 829 H ASP 108 H ASP 108 -18.290 -11.962 6.545 830 HA ASP 108 HA ASP 108 -15.578 -12.934 6.242 831 HB2 ASP 108 HB2 ASP 108 -17.619 -14.175 7.228 832 HB3 ASP 108 HB3 ASP 108 -18.085 -14.487 5.547 833 H THR 109 H THR 109 -18.069 -11.819 4.050 834 HA THR 109 HA THR 109 -16.921 -12.991 1.607 835 HB THR 109 HB THR 109 -18.935 -10.731 2.057 836 HG1 THR 109 HG1 THR 109 -19.467 -12.971 2.690 837 HG21 THR 109 HG21 THR 109 -17.926 -12.125 -0.408 838 HG22 THR 109 HG22 THR 109 -19.549 -11.434 -0.371 839 HG23 THR 109 HG23 THR 109 -18.123 -10.396 -0.136 840 H GLN 110 H GLN 110 -17.005 -9.745 3.235 841 HA GLN 110 HA GLN 110 -15.323 -8.470 1.391 842 HB2 GLN 110 HB2 GLN 110 -16.776 -7.593 3.436 843 HB3 GLN 110 HB3 GLN 110 -15.270 -7.737 4.334 844 HG2 GLN 110 HG2 GLN 110 -15.758 -6.098 1.801 845 HG3 GLN 110 HG3 GLN 110 -15.660 -5.459 3.434 846 HE21 GLN 110 HE22 GLN 110 -13.847 -6.089 0.609 847 HE22 GLN 110 HE21 GLN 110 -12.250 -5.968 1.298 848 H GLU 111 H GLU 111 -14.457 -10.224 4.441 849 HA GLU 111 HA GLU 111 -11.669 -9.762 4.251 850 HB2 GLU 111 HB2 GLU 111 -13.334 -11.918 5.598 851 HB3 GLU 111 HB3 GLU 111 -11.581 -11.874 5.736 852 HG2 GLU 111 HG2 GLU 111 -13.352 -9.513 6.524 853 HG3 GLU 111 HG3 GLU 111 -12.861 -10.787 7.634 854 H ALA 112 H ALA 112 -13.681 -12.378 2.772 855 HA ALA 112 HA ALA 112 -11.421 -13.930 1.908 856 HB1 ALA 112 HB1 ALA 112 -14.202 -13.739 0.658 857 HB2 ALA 112 HB2 ALA 112 -13.002 -15.019 0.384 858 HB3 ALA 112 HB3 ALA 112 -13.728 -14.827 1.986 859 H ILE 113 H ILE 113 -13.298 -11.286 0.378 860 HA ILE 113 HA ILE 113 -11.869 -11.344 -2.111 861 HB ILE 113 HB ILE 113 -13.560 -9.209 -0.747 862 HG12 ILE 113 HG12 ILE 113 -14.271 -11.104 -3.039 863 HG13 ILE 113 HG13 ILE 113 -14.643 -11.457 -1.370 864 HG21 ILE 113 HG21 ILE 113 -13.756 -8.160 -3.015 865 HG22 ILE 113 HG22 ILE 113 -12.116 -8.100 -2.390 866 HG23 ILE 113 HG23 ILE 113 -12.538 -9.303 -3.622 867 HD11 ILE 113 HD11 ILE 113 -15.770 -9.188 -3.015 868 HD12 ILE 113 HD12 ILE 113 -16.612 -10.573 -2.308 869 HD13 ILE 113 HD13 ILE 113 -15.962 -9.315 -1.242 870 H ALA 114 H ALA 114 -11.476 -9.401 0.912 871 HA ALA 114 HA ALA 114 -9.298 -7.822 0.028 872 HB1 ALA 114 HB1 ALA 114 -9.896 -8.854 2.835 873 HB2 ALA 114 HB2 ALA 114 -8.845 -7.489 2.414 874 HB3 ALA 114 HB3 ALA 114 -10.587 -7.388 2.104 875 H ASP 115 H ASP 115 -9.378 -11.086 1.542 876 HA ASP 115 HA ASP 115 -6.532 -11.333 1.725 877 HB2 ASP 115 HB2 ASP 115 -8.119 -12.707 3.036 878 HB3 ASP 115 HB3 ASP 115 -8.593 -13.555 1.558 879 H TRP 116 H TRP 116 -8.842 -12.178 -0.912 880 HA TRP 116 HA TRP 116 -6.889 -13.402 -2.627 881 HB2 TRP 116 HB2 TRP 116 -9.196 -13.666 -3.205 882 HB3 TRP 116 HB3 TRP 116 -9.484 -11.931 -3.191 883 HD1 TRP 116 HD1 TRP 116 -9.323 -10.715 -5.425 884 HE1 TRP 116 HE1 TRP 116 -8.278 -11.144 -7.735 885 HE3 TRP 116 HE3 TRP 116 -7.092 -15.228 -4.495 886 HZ2 TRP 116 HZ2 TRP 116 -6.623 -13.134 -8.971 887 HZ3 TRP 116 HZ3 TRP 116 -5.811 -16.383 -6.261 888 HH2 TRP 116 HH2 TRP 116 -5.542 -15.331 -8.508 889 H LEU 117 H LEU 117 -7.939 -9.972 -2.233 890 HA LEU 117 HA LEU 117 -6.278 -8.951 -4.308 891 HB2 LEU 117 HB2 LEU 117 -7.433 -7.675 -1.798 892 HB3 LEU 117 HB3 LEU 117 -6.550 -6.756 -3.004 893 HG LEU 117 HG LEU 117 -8.975 -8.428 -3.781 894 HD11 LEU 117 HD11 LEU 117 -10.335 -6.376 -3.584 895 HD12 LEU 117 HD12 LEU 117 -9.722 -6.920 -2.017 896 HD13 LEU 117 HD13 LEU 117 -8.958 -5.534 -2.831 897 HD21 LEU 117 HD21 LEU 117 -7.689 -5.972 -5.046 898 HD22 LEU 117 HD22 LEU 117 -7.516 -7.641 -5.621 899 HD23 LEU 117 HD23 LEU 117 -9.102 -6.856 -5.657 900 H TYR 118 H TYR 118 -5.671 -9.277 -0.754 901 HA TYR 118 HA TYR 118 -3.014 -8.237 -0.862 902 HB2 TYR 118 HB2 TYR 118 -4.195 -10.251 1.086 903 HB3 TYR 118 HB3 TYR 118 -2.709 -9.343 1.320 904 HD1 TYR 118 HD2 TYR 118 -3.656 -6.560 0.406 905 HD2 TYR 118 HD1 TYR 118 -5.435 -9.547 2.972 906 HE1 TYR 118 HE2 TYR 118 -4.923 -4.799 1.567 907 HE2 TYR 118 HE1 TYR 118 -6.705 -7.781 4.147 908 HH TYR 118 HH TYR 118 -6.464 -4.306 3.247 909 H TRP 119 H TRP 119 -4.255 -11.608 -1.280 910 HA TRP 119 HA TRP 119 -1.693 -12.855 -1.472 911 HB2 TRP 119 HB2 TRP 119 -3.519 -14.302 -1.255 912 HB3 TRP 119 HB3 TRP 119 -4.476 -13.463 -2.463 913 HD1 TRP 119 HD1 TRP 119 -4.362 -14.181 -4.895 914 HE1 TRP 119 HE1 TRP 119 -3.199 -16.036 -6.200 915 HE3 TRP 119 HE3 TRP 119 -1.149 -15.813 -1.253 916 HZ2 TRP 119 HZ2 TRP 119 -1.104 -17.945 -5.741 917 HZ3 TRP 119 HZ3 TRP 119 0.435 -17.659 -1.721 918 HH2 TRP 119 HH2 TRP 119 0.479 -18.740 -3.960 919 H LEU 120 H LEU 120 -3.758 -11.283 -3.994 920 HA LEU 120 HA LEU 120 -2.058 -12.042 -6.123 921 HB2 LEU 120 HB2 LEU 120 -4.417 -11.259 -6.368 922 HB3 LEU 120 HB3 LEU 120 -3.913 -9.630 -5.904 923 HG LEU 120 HG LEU 120 -2.415 -9.540 -7.919 924 HD11 LEU 120 HD11 LEU 120 -3.731 -12.213 -8.607 925 HD12 LEU 120 HD12 LEU 120 -2.748 -11.234 -9.719 926 HD13 LEU 120 HD13 LEU 120 -2.003 -11.943 -8.287 927 HD21 LEU 120 HD21 LEU 120 -5.326 -10.208 -8.473 928 HD22 LEU 120 HD22 LEU 120 -4.692 -8.621 -7.979 929 HD23 LEU 120 HD23 LEU 120 -4.243 -9.299 -9.554 930 H ALA 121 H ALA 121 -2.165 -9.103 -4.089 931 HA ALA 121 HA ALA 121 0.018 -7.727 -5.301 932 HB1 ALA 121 HB1 ALA 121 -1.135 -7.695 -2.477 933 HB2 ALA 121 HB2 ALA 121 0.025 -6.498 -3.106 934 HB3 ALA 121 HB3 ALA 121 -1.600 -6.639 -3.820 935 H ARG 122 H ARG 122 -0.104 -10.134 -2.633 936 HA ARG 122 HA ARG 122 2.643 -10.049 -1.949 937 HB2 ARG 122 HB2 ARG 122 0.837 -10.962 -0.600 938 HB3 ARG 122 HB3 ARG 122 0.699 -12.362 -1.676 939 HG2 ARG 122 HG2 ARG 122 2.794 -13.239 -0.993 940 HG3 ARG 122 HG3 ARG 122 3.364 -11.664 -0.420 941 HD2 ARG 122 HD2 ARG 122 2.905 -12.900 1.520 942 HD3 ARG 122 HD3 ARG 122 1.634 -11.695 1.362 943 HE ARG 122 HE ARG 122 1.446 -14.657 1.015 944 HH11 ARG 122 HH21 ARG 122 -0.459 -11.633 0.952 945 HH12 ARG 122 HH22 ARG 122 -1.939 -12.462 1.299 946 HH21 ARG 122 HH12 ARG 122 -0.354 -15.657 1.374 947 HH22 ARG 122 HH11 ARG 122 -1.919 -14.862 1.475 948 H GLY 123 H GLY 123 1.000 -11.590 -4.668 949 HA2 GLY 123 HA2 GLY 123 2.810 -11.652 -6.472 950 HA3 GLY 123 HA3 GLY 123 3.507 -12.966 -5.519 951 H TYR 124 H TYR 124 1.845 -12.511 -8.214 952 HA TYR 124 HA TYR 124 -0.129 -14.656 -8.072 953 HB2 TYR 124 HB2 TYR 124 -0.316 -12.727 -9.624 954 HB3 TYR 124 HB3 TYR 124 1.150 -13.227 -10.437 955 HD1 TYR 124 HD2 TYR 124 -2.365 -14.285 -9.644 956 HD2 TYR 124 HD1 TYR 124 1.061 -14.835 -12.212 957 HE1 TYR 124 HE2 TYR 124 -3.733 -15.682 -11.161 958 HE2 TYR 124 HE1 TYR 124 -0.296 -16.246 -13.727 959 HH TYR 124 HH TYR 124 -3.742 -17.024 -13.059 960 H LYS 125 H LYS 125 1.343 -16.211 -7.011 961 HA LYS 125 HA LYS 125 3.350 -17.442 -8.872 962 HB2 LYS 125 HB2 LYS 125 3.348 -17.215 -5.837 963 HB3 LYS 125 HB3 LYS 125 4.517 -18.142 -6.785 964 HG2 LYS 125 HG2 LYS 125 5.239 -16.083 -7.958 965 HG3 LYS 125 HG3 LYS 125 4.091 -15.127 -7.001 966 HD2 LYS 125 HD2 LYS 125 5.245 -15.794 -4.918 967 HD3 LYS 125 HD3 LYS 125 6.393 -16.770 -5.862 968 HE2 LYS 125 HE2 LYS 125 7.125 -14.726 -7.076 969 HE3 LYS 125 HE3 LYS 125 5.991 -13.753 -6.132 970 HZ1 LYS 125 HZ1 LYS 125 8.222 -13.647 -5.222 971 HZ2 LYS 125 HZ2 LYS 125 7.238 -14.359 -4.137 972 HZ3 LYS 125 HZ3 LYS 125 8.285 -15.260 -5.013 973 H PHE 126 H PHE 126 0.601 -18.073 -6.816 974 HA PHE 126 HA PHE 126 -0.332 -19.961 -5.945 975 HB2 PHE 126 HB2 PHE 126 -0.025 -20.748 -8.850 976 HB3 PHE 126 HB3 PHE 126 -1.013 -21.603 -7.688 977 HD1 PHE 126 HD2 PHE 126 -2.642 -19.847 -6.233 978 HD2 PHE 126 HD1 PHE 126 -1.304 -19.418 -10.317 979 HE1 PHE 126 HE2 PHE 126 -4.656 -18.510 -6.762 980 HE2 PHE 126 HE1 PHE 126 -3.357 -18.152 -10.846 981 HZ PHE 126 HZ PHE 126 -5.037 -17.683 -9.077 Start of MODEL 17 1 H1 MET 1 H1 MET 1 7.661 -3.367 -1.921 2 H2 MET 1 H2 MET 1 6.928 -3.352 -0.460 3 H3 MET 1 H3 MET 1 8.515 -2.940 -0.588 4 HA MET 1 HA MET 1 9.094 -5.138 -1.283 5 HB2 MET 1 HB2 MET 1 8.894 -6.308 0.783 6 HB3 MET 1 HB3 MET 1 9.190 -4.619 1.146 7 HG2 MET 1 HG2 MET 1 6.480 -6.015 1.310 8 HG3 MET 1 HG3 MET 1 7.564 -5.724 2.656 9 HE1 MET 1 HE1 MET 1 4.523 -3.391 3.439 10 HE2 MET 1 HE2 MET 1 4.424 -4.929 2.556 11 HE3 MET 1 HE3 MET 1 5.496 -4.782 3.968 12 H ALA 2 H ALA 2 8.500 -7.279 -1.887 13 HA ALA 2 HA ALA 2 5.946 -7.577 -3.140 14 HB1 ALA 2 HB1 ALA 2 6.652 -9.908 -3.495 15 HB2 ALA 2 HB2 ALA 2 7.970 -8.786 -3.882 16 HB3 ALA 2 HB3 ALA 2 7.994 -9.700 -2.352 17 H SER 3 H SER 3 7.163 -8.537 0.073 18 HA SER 3 HA SER 3 4.952 -10.122 0.879 19 HB2 SER 3 HB2 SER 3 6.925 -8.595 2.614 20 HB3 SER 3 HB3 SER 3 5.998 -10.046 3.043 21 HG SER 3 HG SER 3 8.159 -10.534 2.433 22 H VAL 4 H VAL 4 3.400 -8.400 -0.139 23 HA VAL 4 HA VAL 4 2.643 -6.090 1.339 24 HB VAL 4 HB VAL 4 0.484 -6.337 0.112 25 HG11 VAL 4 HG11 VAL 4 2.960 -6.669 -1.643 26 HG12 VAL 4 HG12 VAL 4 1.415 -5.930 -2.107 27 HG13 VAL 4 HG13 VAL 4 2.427 -5.158 -0.878 28 HG21 VAL 4 HG21 VAL 4 0.189 -8.059 -1.572 29 HG22 VAL 4 HG22 VAL 4 1.731 -8.821 -1.159 30 HG23 VAL 4 HG23 VAL 4 0.386 -8.838 -0.002 31 H GLU 5 H GLU 5 2.166 -9.502 1.981 32 HA GLU 5 HA GLU 5 0.728 -8.775 4.468 33 HB2 GLU 5 HB2 GLU 5 -0.404 -10.847 4.462 34 HB3 GLU 5 HB3 GLU 5 -0.742 -10.080 2.919 35 HG2 GLU 5 HG2 GLU 5 1.294 -12.328 3.344 36 HG3 GLU 5 HG3 GLU 5 -0.367 -12.558 2.854 37 H ARG 6 H ARG 6 1.533 -9.870 6.327 38 HA ARG 6 HA ARG 6 4.085 -11.383 5.987 39 HB2 ARG 6 HB2 ARG 6 3.545 -9.116 7.952 40 HB3 ARG 6 HB3 ARG 6 4.973 -10.158 7.956 41 HG2 ARG 6 HG2 ARG 6 5.576 -9.359 5.674 42 HG3 ARG 6 HG3 ARG 6 4.166 -8.292 5.681 43 HD2 ARG 6 HD2 ARG 6 6.096 -6.989 6.222 44 HD3 ARG 6 HD3 ARG 6 5.064 -7.085 7.642 45 HE ARG 6 HE ARG 6 7.658 -8.495 7.170 46 HH11 ARG 6 HH11 ARG 6 5.174 -7.502 9.514 47 HH12 ARG 6 HH12 ARG 6 6.097 -7.966 10.893 48 HH21 ARG 6 HH21 ARG 6 8.879 -9.104 9.005 49 HH22 ARG 6 HH22 ARG 6 8.250 -8.891 10.593 50 H ASP 7 H ASP 7 0.957 -11.570 7.073 51 HA ASP 7 HA ASP 7 1.507 -13.203 9.463 52 HB2 ASP 7 HB2 ASP 7 -0.532 -11.909 9.517 53 HB3 ASP 7 HB3 ASP 7 -1.063 -12.587 7.970 54 H GLU 8 H GLU 8 2.920 -14.705 8.519 55 HA GLU 8 HA GLU 8 2.522 -16.147 6.157 56 HB2 GLU 8 HB2 GLU 8 3.961 -16.959 8.715 57 HB3 GLU 8 HB3 GLU 8 4.087 -17.819 7.174 58 HG2 GLU 8 HG2 GLU 8 4.962 -15.761 6.089 59 HG3 GLU 8 HG3 GLU 8 4.901 -14.920 7.640 60 H THR 9 H THR 9 0.667 -16.483 9.099 61 HA THR 9 HA THR 9 -0.136 -19.182 8.907 62 HB THR 9 HB THR 9 -2.002 -16.930 9.645 63 HG1 THR 9 HG1 THR 9 -0.416 -16.290 10.789 64 HG21 THR 9 HG21 THR 9 -1.558 -19.716 10.801 65 HG22 THR 9 HG22 THR 9 -2.757 -18.527 11.367 66 HG23 THR 9 HG23 THR 9 -2.895 -19.213 9.743 67 H ARG 10 H ARG 10 -1.095 -16.322 6.948 68 HA ARG 10 HA ARG 10 -3.316 -17.648 5.640 69 HB2 ARG 10 HB2 ARG 10 -1.506 -15.303 4.856 70 HB3 ARG 10 HB3 ARG 10 -2.758 -15.904 3.787 71 HG2 ARG 10 HG2 ARG 10 -3.193 -14.729 6.560 72 HG3 ARG 10 HG3 ARG 10 -3.558 -13.962 5.014 73 HD2 ARG 10 HD2 ARG 10 -4.901 -16.399 6.224 74 HD3 ARG 10 HD3 ARG 10 -5.614 -14.804 5.982 75 HE ARG 10 HE ARG 10 -5.125 -15.265 3.470 76 HH11 ARG 10 HH11 ARG 10 -6.312 -17.692 5.792 77 HH12 ARG 10 HH12 ARG 10 -7.017 -18.705 4.589 78 HH21 ARG 10 HH21 ARG 10 -6.123 -16.560 1.880 79 HH22 ARG 10 HH22 ARG 10 -6.926 -18.035 2.313 80 H GLU 11 H GLU 11 0.128 -17.345 4.846 81 HA GLU 11 HA GLU 11 -0.041 -18.676 2.316 82 HB2 GLU 11 HB2 GLU 11 2.296 -18.268 4.238 83 HB3 GLU 11 HB3 GLU 11 2.448 -18.911 2.597 84 HG2 GLU 11 HG2 GLU 11 1.584 -16.846 1.635 85 HG3 GLU 11 HG3 GLU 11 1.206 -16.198 3.230 86 H HIS 12 H HIS 12 0.765 -19.826 5.614 87 HA HIS 12 HA HIS 12 1.062 -22.577 5.032 88 HB2 HIS 12 HB2 HIS 12 1.741 -22.099 7.151 89 HB3 HIS 12 HB3 HIS 12 0.528 -20.862 7.394 90 HD1 HIS 12 HD1 HIS 12 -0.827 -24.456 6.783 91 HD2 HIS 12 HD2 HIS 12 -0.086 -21.560 9.751 92 HE1 HIS 12 HE1 HIS 12 -1.935 -25.301 8.877 93 H ARG 13 H ARG 13 -1.949 -20.840 6.137 94 HA ARG 13 HA ARG 13 -3.428 -23.261 6.009 95 HB2 ARG 13 HB2 ARG 13 -4.313 -20.356 6.184 96 HB3 ARG 13 HB3 ARG 13 -5.437 -21.720 6.188 97 HG2 ARG 13 HG2 ARG 13 -4.232 -22.700 8.164 98 HG3 ARG 13 HG3 ARG 13 -3.185 -21.283 8.213 99 HD2 ARG 13 HD2 ARG 13 -4.943 -21.003 9.845 100 HD3 ARG 13 HD3 ARG 13 -5.216 -19.840 8.529 101 HE ARG 13 HE ARG 13 -6.600 -22.273 7.946 102 HH11 ARG 13 HH11 ARG 13 -6.959 -19.546 10.217 103 HH12 ARG 13 HH12 ARG 13 -8.667 -19.753 10.349 104 HH21 ARG 13 HH21 ARG 13 -8.660 -22.550 8.104 105 HH22 ARG 13 HH22 ARG 13 -9.720 -21.554 9.089 106 H ILE 14 H ILE 14 -3.049 -20.697 3.487 107 HA ILE 14 HA ILE 14 -5.123 -21.856 1.920 108 HB ILE 14 HB ILE 14 -4.167 -19.545 1.677 109 HG12 ILE 14 HG12 ILE 14 -4.544 -21.217 -0.835 110 HG13 ILE 14 HG13 ILE 14 -5.818 -20.563 0.193 111 HG21 ILE 14 HG21 ILE 14 -1.759 -20.166 1.509 112 HG22 ILE 14 HG22 ILE 14 -2.064 -20.852 -0.099 113 HG23 ILE 14 HG23 ILE 14 -2.299 -19.118 0.206 114 HD11 ILE 14 HD11 ILE 14 -4.985 -18.245 -0.291 115 HD12 ILE 14 HD12 ILE 14 -3.892 -18.959 -1.504 116 HD13 ILE 14 HD13 ILE 14 -5.650 -19.137 -1.669 117 H GLU 15 H GLU 15 -1.615 -22.555 2.170 118 HA GLU 15 HA GLU 15 -1.555 -24.526 0.107 119 HB2 GLU 15 HB2 GLU 15 0.426 -23.403 1.069 120 HB3 GLU 15 HB3 GLU 15 0.146 -24.203 2.608 121 HG2 GLU 15 HG2 GLU 15 1.899 -25.353 1.452 122 HG3 GLU 15 HG3 GLU 15 0.501 -26.410 1.565 123 H THR 16 H THR 16 -2.157 -24.819 3.706 124 HA THR 16 HA THR 16 -2.375 -27.706 3.363 125 HB THR 16 HB THR 16 -2.481 -27.694 5.843 126 HG1 THR 16 HG1 THR 16 -3.375 -25.770 6.361 127 HG21 THR 16 HG21 THR 16 -0.202 -26.927 6.223 128 HG22 THR 16 HG22 THR 16 -0.302 -27.771 4.669 129 HG23 THR 16 HG23 THR 16 -0.213 -25.998 4.710 130 H GLU 17 H GLU 17 -4.744 -25.254 3.112 131 HA GLU 17 HA GLU 17 -6.852 -27.279 3.763 132 HB2 GLU 17 HB2 GLU 17 -7.097 -24.300 4.287 133 HB3 GLU 17 HB3 GLU 17 -8.196 -25.591 4.757 134 HG2 GLU 17 HG2 GLU 17 -6.265 -26.524 6.175 135 HG3 GLU 17 HG3 GLU 17 -5.455 -24.976 5.900 136 H ILE 18 H ILE 18 -5.829 -24.807 1.410 137 HA ILE 18 HA ILE 18 -8.545 -24.966 0.173 138 HB ILE 18 HB ILE 18 -6.457 -22.796 0.306 139 HG12 ILE 18 HG12 ILE 18 -9.399 -22.804 1.116 140 HG13 ILE 18 HG13 ILE 18 -8.113 -23.224 2.234 141 HG21 ILE 18 HG21 ILE 18 -7.377 -22.748 -2.002 142 HG22 ILE 18 HG22 ILE 18 -9.013 -22.739 -1.334 143 HG23 ILE 18 HG23 ILE 18 -7.902 -21.366 -1.080 144 HD11 ILE 18 HD11 ILE 18 -8.863 -20.930 2.557 145 HD12 ILE 18 HD12 ILE 18 -7.153 -21.001 2.115 146 HD13 ILE 18 HD13 ILE 18 -8.365 -20.502 0.916 147 H ILE 19 H ILE 19 -5.068 -25.301 -0.612 148 HA ILE 19 HA ILE 19 -5.898 -26.267 -3.321 149 HB ILE 19 HB ILE 19 -3.919 -25.265 -4.231 150 HG12 ILE 19 HG12 ILE 19 -3.161 -24.871 -1.372 151 HG13 ILE 19 HG13 ILE 19 -2.190 -25.351 -2.744 152 HG21 ILE 19 HG21 ILE 19 -5.279 -23.130 -2.562 153 HG22 ILE 19 HG22 ILE 19 -4.569 -22.974 -4.174 154 HG23 ILE 19 HG23 ILE 19 -6.045 -23.914 -3.961 155 HD11 ILE 19 HD11 ILE 19 -3.052 -22.529 -2.013 156 HD12 ILE 19 HD12 ILE 19 -1.433 -23.217 -1.922 157 HD13 ILE 19 HD13 ILE 19 -2.183 -22.950 -3.514 158 H VAL 20 H VAL 20 -5.533 -27.794 -0.826 159 HA VAL 20 HA VAL 20 -3.161 -28.973 -0.350 160 HB VAL 20 HB VAL 20 -4.483 -30.910 0.549 161 HG11 VAL 20 HG11 VAL 20 -5.601 -29.582 2.268 162 HG12 VAL 20 HG12 VAL 20 -4.038 -28.873 1.837 163 HG13 VAL 20 HG13 VAL 20 -5.541 -28.136 1.238 164 HG21 VAL 20 HG21 VAL 20 -6.932 -30.796 0.604 165 HG22 VAL 20 HG22 VAL 20 -6.936 -29.412 -0.500 166 HG23 VAL 20 HG23 VAL 20 -6.370 -31.005 -1.052 167 H ASP 21 H ASP 21 -5.289 -30.030 -2.993 168 HA ASP 21 HA ASP 21 -3.390 -32.257 -3.604 169 HB2 ASP 21 HB2 ASP 21 -5.677 -32.864 -2.843 170 HB3 ASP 21 HB3 ASP 21 -6.352 -31.979 -4.211 171 H ALA 22 H ALA 22 -3.874 -29.199 -4.608 172 HA ALA 22 HA ALA 22 -4.184 -29.615 -7.496 173 HB1 ALA 22 HB1 ALA 22 -5.132 -27.604 -6.404 174 HB2 ALA 22 HB2 ALA 22 -3.506 -27.141 -5.838 175 HB3 ALA 22 HB3 ALA 22 -3.865 -27.170 -7.571 176 H GLU 23 H GLU 23 -2.554 -29.605 -8.969 177 HA GLU 23 HA GLU 23 0.207 -28.823 -8.143 178 HB2 GLU 23 HB2 GLU 23 -0.635 -31.143 -9.933 179 HB3 GLU 23 HB3 GLU 23 1.018 -30.545 -9.754 180 HG2 GLU 23 HG2 GLU 23 0.913 -31.039 -7.302 181 HG3 GLU 23 HG3 GLU 23 -0.686 -31.752 -7.534 182 H ASP 24 H ASP 24 -2.467 -28.527 -10.393 183 HA ASP 24 HA ASP 24 -0.762 -26.909 -12.252 184 HB2 ASP 24 HB2 ASP 24 -1.758 -28.898 -13.300 185 HB3 ASP 24 HB3 ASP 24 -3.367 -28.385 -12.772 186 H LYS 25 H LYS 25 -1.569 -24.947 -12.991 187 HA LYS 25 HA LYS 25 -2.768 -23.151 -11.321 188 HB2 LYS 25 HB2 LYS 25 -2.961 -21.706 -13.226 189 HB3 LYS 25 HB3 LYS 25 -1.542 -22.724 -13.484 190 HG2 LYS 25 HG2 LYS 25 -3.396 -24.260 -14.680 191 HG3 LYS 25 HG3 LYS 25 -4.207 -22.720 -14.889 192 HD2 LYS 25 HD2 LYS 25 -2.324 -21.945 -16.254 193 HD3 LYS 25 HD3 LYS 25 -1.401 -23.425 -15.895 194 HE2 LYS 25 HE2 LYS 25 -4.171 -23.395 -17.174 195 HE3 LYS 25 HE3 LYS 25 -2.684 -23.458 -18.125 196 HZ1 LYS 25 HZ1 LYS 25 -2.273 -25.623 -17.389 197 HZ2 LYS 25 HZ2 LYS 25 -3.245 -25.531 -16.075 198 HZ3 LYS 25 HZ3 LYS 25 -3.926 -25.619 -17.536 199 H GLU 26 H GLU 26 -4.570 -25.369 -13.537 200 HA GLU 26 HA GLU 26 -7.084 -24.001 -13.216 201 HB2 GLU 26 HB2 GLU 26 -6.267 -26.781 -14.170 202 HB3 GLU 26 HB3 GLU 26 -7.937 -26.228 -14.169 203 HG2 GLU 26 HG2 GLU 26 -7.490 -24.477 -15.747 204 HG3 GLU 26 HG3 GLU 26 -5.748 -24.653 -15.577 205 H GLU 27 H GLU 27 -5.451 -26.700 -11.547 206 HA GLU 27 HA GLU 27 -7.754 -27.474 -9.963 207 HB2 GLU 27 HB2 GLU 27 -4.781 -27.964 -9.536 208 HB3 GLU 27 HB3 GLU 27 -6.101 -28.804 -8.711 209 HG2 GLU 27 HG2 GLU 27 -6.855 -29.770 -10.845 210 HG3 GLU 27 HG3 GLU 27 -5.584 -28.905 -11.721 211 H ARG 28 H ARG 28 -4.858 -25.380 -9.489 212 HA ARG 28 HA ARG 28 -5.516 -24.599 -6.793 213 HB2 ARG 28 HB2 ARG 28 -3.921 -23.184 -8.984 214 HB3 ARG 28 HB3 ARG 28 -4.124 -22.545 -7.348 215 HG2 ARG 28 HG2 ARG 28 -3.138 -24.636 -6.415 216 HG3 ARG 28 HG3 ARG 28 -2.815 -25.206 -8.059 217 HD2 ARG 28 HD2 ARG 28 -1.729 -22.590 -6.940 218 HD3 ARG 28 HD3 ARG 28 -0.868 -24.119 -6.811 219 HE ARG 28 HE ARG 28 -1.253 -22.471 -9.222 220 HH11 ARG 28 HH11 ARG 28 -0.191 -25.662 -8.041 221 HH12 ARG 28 HH12 ARG 28 0.596 -26.072 -9.531 222 HH21 ARG 28 HH21 ARG 28 -0.147 -22.880 -10.970 223 HH22 ARG 28 HH22 ARG 28 0.812 -24.337 -11.213 224 H ALA 29 H ALA 29 -6.580 -23.393 -9.982 225 HA ALA 29 HA ALA 29 -7.905 -21.078 -8.939 226 HB1 ALA 29 HB1 ALA 29 -8.940 -20.912 -11.108 227 HB2 ALA 29 HB2 ALA 29 -7.267 -21.418 -11.360 228 HB3 ALA 29 HB3 ALA 29 -8.583 -22.606 -11.489 229 H MET 30 H MET 30 -9.008 -24.471 -9.556 230 HA MET 30 HA MET 30 -11.691 -23.976 -8.676 231 HB2 MET 30 HB2 MET 30 -10.048 -26.526 -8.719 232 HB3 MET 30 HB3 MET 30 -11.766 -26.447 -8.328 233 HG2 MET 30 HG2 MET 30 -10.547 -25.576 -10.971 234 HG3 MET 30 HG3 MET 30 -11.326 -27.112 -10.652 235 HE1 MET 30 HE1 MET 30 -13.227 -23.188 -11.863 236 HE2 MET 30 HE2 MET 30 -12.739 -23.064 -10.176 237 HE3 MET 30 HE3 MET 30 -11.532 -23.478 -11.413 238 H GLY 31 H GLY 31 -8.769 -25.030 -6.839 239 HA2 GLY 31 HA2 GLY 31 -9.985 -25.387 -4.334 240 HA3 GLY 31 HA3 GLY 31 -8.328 -24.811 -4.599 241 H TRP 32 H TRP 32 -8.435 -22.376 -5.587 242 HA TRP 32 HA TRP 32 -9.259 -20.586 -3.629 243 HB2 TRP 32 HB2 TRP 32 -8.683 -20.303 -6.579 244 HB3 TRP 32 HB3 TRP 32 -9.360 -18.956 -5.693 245 HD1 TRP 32 HD1 TRP 32 -6.108 -20.848 -6.081 246 HE1 TRP 32 HE1 TRP 32 -4.228 -19.426 -5.176 247 HE3 TRP 32 HE3 TRP 32 -8.913 -17.333 -3.635 248 HZ2 TRP 32 HZ2 TRP 32 -3.947 -17.078 -3.457 249 HZ3 TRP 32 HZ3 TRP 32 -7.807 -15.584 -2.274 250 HH2 TRP 32 HH2 TRP 32 -5.330 -15.434 -2.190 251 H TYR 33 H TYR 33 -10.995 -21.368 -6.727 252 HA TYR 33 HA TYR 33 -13.135 -19.624 -6.393 253 HB2 TYR 33 HB2 TYR 33 -12.809 -20.671 -8.511 254 HB3 TYR 33 HB3 TYR 33 -12.860 -22.285 -7.813 255 HD1 TYR 33 HD1 TYR 33 -14.974 -19.319 -8.629 256 HD2 TYR 33 HD2 TYR 33 -14.903 -23.471 -7.452 257 HE1 TYR 33 HE1 TYR 33 -17.415 -19.459 -8.956 258 HE2 TYR 33 HE2 TYR 33 -17.359 -23.586 -7.684 259 HH TYR 33 HH TYR 33 -19.303 -22.445 -8.301 260 H TYR 34 H TYR 34 -12.910 -23.053 -5.258 261 HA TYR 34 HA TYR 34 -15.642 -23.182 -4.483 262 HB2 TYR 34 HB2 TYR 34 -13.219 -24.793 -3.588 263 HB3 TYR 34 HB3 TYR 34 -14.856 -25.137 -3.057 264 HD1 TYR 34 HD1 TYR 34 -16.553 -24.952 -5.421 265 HD2 TYR 34 HD2 TYR 34 -12.570 -26.565 -4.994 266 HE1 TYR 34 HE1 TYR 34 -16.950 -26.435 -7.354 267 HE2 TYR 34 HE2 TYR 34 -12.977 -28.085 -6.898 268 HH TYR 34 HH TYR 34 -14.484 -28.765 -8.546 269 H TYR 35 H TYR 35 -12.656 -22.501 -2.470 270 HA TYR 35 HA TYR 35 -14.344 -22.213 -0.142 271 HB2 TYR 35 HB2 TYR 35 -12.500 -22.021 1.071 272 HB3 TYR 35 HB3 TYR 35 -11.689 -22.619 -0.360 273 HD1 TYR 35 HD1 TYR 35 -10.453 -21.018 -1.825 274 HD2 TYR 35 HD2 TYR 35 -12.243 -19.733 1.868 275 HE1 TYR 35 HE1 TYR 35 -9.103 -18.947 -1.912 276 HE2 TYR 35 HE2 TYR 35 -10.929 -17.641 1.794 277 HH TYR 35 HH TYR 35 -9.354 -16.391 0.621 278 H LEU 36 H LEU 36 -13.061 -19.899 -2.572 279 HA LEU 36 HA LEU 36 -13.646 -17.589 -1.062 280 HB2 LEU 36 HB2 LEU 36 -12.161 -17.933 -3.147 281 HB3 LEU 36 HB3 LEU 36 -13.616 -17.641 -4.101 282 HG LEU 36 HG LEU 36 -12.259 -15.792 -2.081 283 HD11 LEU 36 HD11 LEU 36 -11.561 -14.491 -4.001 284 HD12 LEU 36 HD12 LEU 36 -11.042 -16.159 -4.231 285 HD13 LEU 36 HD13 LEU 36 -12.455 -15.552 -5.116 286 HD21 LEU 36 HD21 LEU 36 -14.711 -15.260 -3.803 287 HD22 LEU 36 HD22 LEU 36 -14.582 -15.185 -2.027 288 HD23 LEU 36 HD23 LEU 36 -13.747 -13.991 -3.014 289 H ASP 37 H ASP 37 -15.573 -19.133 -3.757 290 HA ASP 37 HA ASP 37 -17.757 -17.311 -3.542 291 HB2 ASP 37 HB2 ASP 37 -17.367 -18.940 -5.450 292 HB3 ASP 37 HB3 ASP 37 -17.922 -20.226 -4.393 293 H ASP 38 H ASP 38 -17.148 -20.437 -1.884 294 HA ASP 38 HA ASP 38 -19.603 -20.534 -0.444 295 HB2 ASP 38 HB2 ASP 38 -18.085 -22.441 -0.632 296 HB3 ASP 38 HB3 ASP 38 -16.854 -21.587 0.306 297 H THR 39 H THR 39 -16.741 -18.534 0.079 298 HA THR 39 HA THR 39 -17.487 -17.868 2.847 299 HB THR 39 HB THR 39 -15.229 -16.869 1.057 300 HG1 THR 39 HG1 THR 39 -14.950 -18.981 1.518 301 HG21 THR 39 HG21 THR 39 -15.567 -15.208 2.754 302 HG22 THR 39 HG22 THR 39 -15.827 -16.431 4.006 303 HG23 THR 39 HG23 THR 39 -14.211 -16.204 3.297 304 H LEU 40 H LEU 40 -17.749 -16.476 -0.442 305 HA LEU 40 HA LEU 40 -18.283 -13.800 0.280 306 HB2 LEU 40 HB2 LEU 40 -19.366 -15.421 -2.034 307 HB3 LEU 40 HB3 LEU 40 -19.587 -13.680 -1.857 308 HG LEU 40 HG LEU 40 -16.964 -15.126 -2.215 309 HD11 LEU 40 HD11 LEU 40 -16.952 -14.154 -4.456 310 HD12 LEU 40 HD12 LEU 40 -18.432 -15.099 -4.218 311 HD13 LEU 40 HD13 LEU 40 -18.488 -13.331 -4.136 312 HD21 LEU 40 HD21 LEU 40 -16.395 -13.220 -0.969 313 HD22 LEU 40 HD22 LEU 40 -16.010 -12.847 -2.646 314 HD23 LEU 40 HD23 LEU 40 -17.494 -12.179 -1.940 315 H GLU 41 H GLU 41 -19.932 -13.030 1.568 316 HA GLU 41 HA GLU 41 -22.423 -14.497 1.976 317 HB2 GLU 41 HB2 GLU 41 -21.347 -11.817 2.942 318 HB3 GLU 41 HB3 GLU 41 -22.950 -12.419 3.382 319 HG2 GLU 41 HG2 GLU 41 -20.445 -14.062 3.856 320 HG3 GLU 41 HG3 GLU 41 -21.033 -12.878 5.023 321 H PHE 42 H PHE 42 -22.240 -14.255 -0.602 322 HA PHE 42 HA PHE 42 -23.093 -11.803 -1.771 323 HB2 PHE 42 HB2 PHE 42 -23.146 -13.002 -3.851 324 HB3 PHE 42 HB3 PHE 42 -21.753 -13.519 -2.946 325 HD1 PHE 42 HD2 PHE 42 -25.223 -14.508 -3.975 326 HD2 PHE 42 HD1 PHE 42 -21.408 -15.880 -2.488 327 HE1 PHE 42 HE2 PHE 42 -25.933 -16.857 -4.294 328 HE2 PHE 42 HE1 PHE 42 -22.123 -18.213 -2.810 329 HZ PHE 42 HZ PHE 42 -24.390 -18.721 -3.707 330 HA PRO 43 HA PRO 43 -24.419 -11.211 -3.864 331 HB2 PRO 43 HB2 PRO 43 -26.864 -9.541 -3.388 332 HB3 PRO 43 HB3 PRO 43 -26.107 -10.023 -4.935 333 HG2 PRO 43 HG2 PRO 43 -28.395 -11.215 -4.078 334 HG3 PRO 43 HG3 PRO 43 -27.088 -12.195 -4.823 335 HD2 PRO 43 HD2 PRO 43 -27.667 -11.783 -1.870 336 HD3 PRO 43 HD3 PRO 43 -27.350 -13.308 -2.752 337 H PHE 44 H PHE 44 -23.489 -9.063 -3.707 338 HA PHE 44 HA PHE 44 -23.837 -7.493 -1.247 339 HB2 PHE 44 HB2 PHE 44 -21.541 -7.501 -0.626 340 HB3 PHE 44 HB3 PHE 44 -22.128 -9.147 -0.611 341 HD1 PHE 44 HD1 PHE 44 -21.548 -10.651 -2.699 342 HD2 PHE 44 HD2 PHE 44 -19.504 -6.987 -1.711 343 HE1 PHE 44 HE1 PHE 44 -19.580 -11.406 -3.978 344 HE2 PHE 44 HE2 PHE 44 -17.547 -7.734 -3.032 345 HZ PHE 44 HZ PHE 44 -17.561 -9.960 -4.139 346 H MET 45 H MET 45 -21.745 -5.657 -1.692 347 HA MET 45 HA MET 45 -22.110 -4.863 -4.526 348 HB2 MET 45 HB2 MET 45 -22.760 -2.699 -4.064 349 HB3 MET 45 HB3 MET 45 -23.799 -3.687 -3.060 350 HG2 MET 45 HG2 MET 45 -22.831 -2.956 -1.082 351 HG3 MET 45 HG3 MET 45 -21.273 -2.609 -1.815 352 HE1 MET 45 HE1 MET 45 -21.881 -0.668 -4.338 353 HE2 MET 45 HE2 MET 45 -21.598 0.843 -3.452 354 HE3 MET 45 HE3 MET 45 -20.574 -0.568 -3.151 355 H GLY 46 H GLY 46 -20.707 -3.070 -5.165 356 HA2 GLY 46 HA2 GLY 46 -18.243 -2.644 -3.641 357 HA3 GLY 46 HA3 GLY 46 -18.046 -3.753 -5.011 358 H LYS 47 H LYS 47 -16.557 -1.789 -5.246 359 HA LYS 47 HA LYS 47 -17.832 -0.043 -7.306 360 HB2 LYS 47 HB2 LYS 47 -16.776 1.112 -5.237 361 HB3 LYS 47 HB3 LYS 47 -15.234 0.493 -5.805 362 HG2 LYS 47 HG2 LYS 47 -15.284 2.656 -6.711 363 HG3 LYS 47 HG3 LYS 47 -15.848 1.670 -8.064 364 HD2 LYS 47 HD2 LYS 47 -17.340 3.492 -8.009 365 HD3 LYS 47 HD3 LYS 47 -18.230 2.165 -7.247 366 HE2 LYS 47 HE2 LYS 47 -17.759 3.067 -5.023 367 HE3 LYS 47 HE3 LYS 47 -16.721 4.322 -5.717 368 HZ1 LYS 47 HZ1 LYS 47 -18.999 5.086 -5.179 369 HZ2 LYS 47 HZ2 LYS 47 -18.630 5.312 -6.748 370 HZ3 LYS 47 HZ3 LYS 47 -19.624 4.090 -6.323 371 H TRP 48 H TRP 48 -17.233 -0.644 -9.311 372 HA TRP 48 HA TRP 48 -15.013 -2.531 -9.758 373 HB2 TRP 48 HB2 TRP 48 -17.177 -2.564 -11.061 374 HB3 TRP 48 HB3 TRP 48 -16.718 -1.033 -11.788 375 HD1 TRP 48 HD1 TRP 48 -13.513 -2.371 -11.974 376 HE1 TRP 48 HE1 TRP 48 -13.008 -3.819 -13.953 377 HE3 TRP 48 HE3 TRP 48 -18.327 -3.418 -13.416 378 HZ2 TRP 48 HZ2 TRP 48 -14.482 -5.297 -15.967 379 HZ3 TRP 48 HZ3 TRP 48 -18.724 -4.886 -15.379 380 HH2 TRP 48 HH2 TRP 48 -16.805 -5.830 -16.650 381 H LYS 49 H LYS 49 -13.076 -1.605 -9.331 382 HA LYS 49 HA LYS 49 -12.517 1.215 -9.801 383 HB2 LYS 49 HB2 LYS 49 -10.681 -1.067 -8.891 384 HB3 LYS 49 HB3 LYS 49 -10.387 0.654 -8.672 385 HG2 LYS 49 HG2 LYS 49 -12.600 -0.961 -7.327 386 HG3 LYS 49 HG3 LYS 49 -11.042 -0.624 -6.619 387 HD2 LYS 49 HD2 LYS 49 -12.930 1.616 -7.463 388 HD3 LYS 49 HD3 LYS 49 -12.993 0.817 -5.888 389 HE2 LYS 49 HE2 LYS 49 -10.441 1.311 -5.742 390 HE3 LYS 49 HE3 LYS 49 -10.746 2.505 -7.016 391 HZ1 LYS 49 HZ1 LYS 49 -10.900 3.404 -4.743 392 HZ2 LYS 49 HZ2 LYS 49 -12.304 3.592 -5.559 393 HZ3 LYS 49 HZ3 LYS 49 -12.146 2.390 -4.401 394 H LYS 50 H LYS 50 -13.084 0.539 -12.220 395 HA LYS 50 HA LYS 50 -11.447 -1.330 -13.632 396 HB2 LYS 50 HB2 LYS 50 -13.681 -0.698 -14.386 397 HB3 LYS 50 HB3 LYS 50 -13.169 0.974 -14.658 398 HG2 LYS 50 HG2 LYS 50 -11.682 0.347 -16.436 399 HG3 LYS 50 HG3 LYS 50 -11.811 -1.372 -16.049 400 HD2 LYS 50 HD2 LYS 50 -14.108 0.351 -17.088 401 HD3 LYS 50 HD3 LYS 50 -13.066 -0.668 -18.095 402 HE2 LYS 50 HE2 LYS 50 -13.761 -2.669 -16.747 403 HE3 LYS 50 HE3 LYS 50 -14.886 -1.647 -15.847 404 HZ1 LYS 50 HZ1 LYS 50 -16.003 -2.791 -17.642 405 HZ2 LYS 50 HZ2 LYS 50 -16.027 -1.189 -17.956 406 HZ3 LYS 50 HZ3 LYS 50 -14.998 -2.168 -18.763 407 H LYS 51 H LYS 51 -9.304 -1.119 -14.012 408 HA LYS 51 HA LYS 51 -8.002 1.477 -14.047 409 HB2 LYS 51 HB2 LYS 51 -6.947 -0.785 -13.425 410 HB3 LYS 51 HB3 LYS 51 -6.856 -1.108 -15.166 411 HG2 LYS 51 HG2 LYS 51 -5.507 0.959 -15.458 412 HG3 LYS 51 HG3 LYS 51 -5.657 1.312 -13.718 413 HD2 LYS 51 HD2 LYS 51 -4.435 -0.678 -13.113 414 HD3 LYS 51 HD3 LYS 51 -4.392 -1.256 -14.782 415 HE2 LYS 51 HE2 LYS 51 -3.104 1.351 -13.845 416 HE3 LYS 51 HE3 LYS 51 -2.252 -0.197 -13.924 417 HZ1 LYS 51 HZ1 LYS 51 -2.758 -0.263 -16.308 418 HZ2 LYS 51 HZ2 LYS 51 -3.457 1.223 -16.237 419 HZ3 LYS 51 HZ3 LYS 51 -1.869 1.059 -15.936 420 H SER 52 H SER 52 -8.214 2.924 -15.661 421 HA SER 52 HA SER 52 -9.920 2.388 -17.788 422 HB2 SER 52 HB2 SER 52 -7.962 4.689 -17.797 423 HB3 SER 52 HB3 SER 52 -9.656 4.653 -18.312 424 HG SER 52 HG SER 52 -9.682 5.629 -16.364 425 H ARG 53 H ARG 53 -6.330 2.550 -17.800 426 HA ARG 53 HA ARG 53 -6.138 1.401 -20.491 427 HB2 ARG 53 HB2 ARG 53 -5.487 4.320 -19.838 428 HB3 ARG 53 HB3 ARG 53 -4.583 3.463 -21.065 429 HG2 ARG 53 HG2 ARG 53 -6.061 4.310 -22.467 430 HG3 ARG 53 HG3 ARG 53 -7.009 2.896 -22.031 431 HD2 ARG 53 HD2 ARG 53 -8.250 4.350 -20.349 432 HD3 ARG 53 HD3 ARG 53 -7.252 5.705 -20.850 433 HE ARG 53 HE ARG 53 -8.495 5.957 -22.742 434 HH11 ARG 53 HH11 ARG 53 -9.320 2.762 -21.368 435 HH12 ARG 53 HH12 ARG 53 -10.652 2.515 -22.442 436 HH21 ARG 53 HH21 ARG 53 -10.261 5.597 -24.151 437 HH22 ARG 53 HH22 ARG 53 -11.193 4.154 -24.050 438 H LYS 54 H LYS 54 -3.534 1.665 -20.986 439 HA LYS 54 HA LYS 54 -2.104 0.193 -19.024 440 HB2 LYS 54 HB2 LYS 54 -1.553 0.332 -21.451 441 HB3 LYS 54 HB3 LYS 54 -1.023 2.007 -21.227 442 HG2 LYS 54 HG2 LYS 54 0.761 1.247 -19.687 443 HG3 LYS 54 HG3 LYS 54 0.184 -0.426 -19.829 444 HD2 LYS 54 HD2 LYS 54 0.695 -0.393 -22.257 445 HD3 LYS 54 HD3 LYS 54 1.261 1.288 -22.115 446 HE2 LYS 54 HE2 LYS 54 3.002 0.558 -20.495 447 HE3 LYS 54 HE3 LYS 54 2.439 -1.112 -20.637 448 HZ1 LYS 54 HZ1 LYS 54 3.593 0.489 -22.848 449 HZ2 LYS 54 HZ2 LYS 54 4.354 -0.703 -22.041 450 HZ3 LYS 54 HZ3 LYS 54 3.071 -1.056 -22.979 451 H THR 55 H THR 55 -2.526 3.728 -19.478 452 HA THR 55 HA THR 55 -0.581 4.611 -17.598 453 HB THR 55 HB THR 55 -2.247 6.642 -17.639 454 HG1 THR 55 HG1 THR 55 -3.733 6.570 -19.272 455 HG21 THR 55 HG21 THR 55 -1.437 7.317 -19.870 456 HG22 THR 55 HG22 THR 55 -0.141 6.548 -18.943 457 HG23 THR 55 HG23 THR 55 -0.965 5.641 -20.230 458 H SER 56 H SER 56 -1.176 5.721 -15.509 459 HA SER 56 HA SER 56 -2.166 3.803 -13.736 460 HB2 SER 56 HB2 SER 56 -1.762 6.765 -13.190 461 HB3 SER 56 HB3 SER 56 -1.587 5.418 -12.051 462 HG SER 56 HG SER 56 0.434 6.160 -12.841 463 H THR 57 H THR 57 -4.137 5.887 -15.606 464 HA THR 57 HA THR 57 -5.937 6.901 -13.752 465 HB THR 57 HB THR 57 -6.679 6.067 -16.564 466 HG1 THR 57 HG1 THR 57 -5.600 7.873 -17.306 467 HG21 THR 57 HG21 THR 57 -7.332 8.546 -14.888 468 HG22 THR 57 HG22 THR 57 -7.912 8.224 -16.539 469 HG23 THR 57 HG23 THR 57 -8.440 7.200 -15.200 470 H ILE 58 H ILE 58 -7.915 6.261 -12.970 471 HA ILE 58 HA ILE 58 -8.942 3.540 -13.528 472 HB ILE 58 HB ILE 58 -8.436 4.826 -10.818 473 HG12 ILE 58 HG12 ILE 58 -7.412 2.334 -12.223 474 HG13 ILE 58 HG13 ILE 58 -6.492 3.738 -11.700 475 HG21 ILE 58 HG21 ILE 58 -10.046 2.334 -11.443 476 HG22 ILE 58 HG22 ILE 58 -9.567 2.854 -9.807 477 HG23 ILE 58 HG23 ILE 58 -10.668 3.840 -10.742 478 HD11 ILE 58 HD11 ILE 58 -6.913 3.067 -9.325 479 HD12 ILE 58 HD12 ILE 58 -7.690 1.578 -9.941 480 HD13 ILE 58 HD13 ILE 58 -5.986 1.889 -10.290 481 H GLU 59 H GLU 59 -11.096 3.397 -13.492 482 HA GLU 59 HA GLU 59 -12.758 5.857 -13.169 483 HB2 GLU 59 HB2 GLU 59 -13.054 3.520 -15.118 484 HB3 GLU 59 HB3 GLU 59 -14.400 4.570 -14.658 485 HG2 GLU 59 HG2 GLU 59 -13.136 6.555 -15.460 486 HG3 GLU 59 HG3 GLU 59 -11.834 5.502 -16.002 487 H GLU 60 H GLU 60 -14.720 5.403 -11.989 488 HA GLU 60 HA GLU 60 -14.570 2.931 -10.317 489 HB2 GLU 60 HB2 GLU 60 -14.898 5.823 -9.407 490 HB3 GLU 60 HB3 GLU 60 -15.072 4.394 -8.385 491 HG2 GLU 60 HG2 GLU 60 -12.683 3.778 -8.941 492 HG3 GLU 60 HG3 GLU 60 -12.526 5.311 -9.807 493 H LYS 61 H LYS 61 -16.429 1.858 -10.675 494 HA LYS 61 HA LYS 61 -18.945 3.453 -11.075 495 HB2 LYS 61 HB2 LYS 61 -17.976 2.461 -13.174 496 HB3 LYS 61 HB3 LYS 61 -18.157 0.850 -12.457 497 HG2 LYS 61 HG2 LYS 61 -20.595 1.139 -12.321 498 HG3 LYS 61 HG3 LYS 61 -20.456 2.833 -12.812 499 HD2 LYS 61 HD2 LYS 61 -21.225 1.526 -14.675 500 HD3 LYS 61 HD3 LYS 61 -19.604 2.139 -15.030 501 HE2 LYS 61 HE2 LYS 61 -18.616 -0.052 -14.531 502 HE3 LYS 61 HE3 LYS 61 -20.185 -0.656 -13.961 503 HZ1 LYS 61 HZ1 LYS 61 -19.709 -1.365 -16.234 504 HZ2 LYS 61 HZ2 LYS 61 -21.063 -0.443 -16.155 505 HZ3 LYS 61 HZ3 LYS 61 -19.660 0.189 -16.750 506 H THR 62 H THR 62 -20.533 2.958 -9.595 507 HA THR 62 HA THR 62 -20.019 0.948 -7.619 508 HB THR 62 HB THR 62 -22.652 2.387 -8.121 509 HG1 THR 62 HG1 THR 62 -21.802 4.183 -7.326 510 HG21 THR 62 HG21 THR 62 -22.556 0.719 -6.259 511 HG22 THR 62 HG22 THR 62 -21.169 1.594 -5.572 512 HG23 THR 62 HG23 THR 62 -22.768 2.371 -5.654 513 H VAL 63 H VAL 63 -20.754 -1.101 -7.474 514 HA VAL 63 HA VAL 63 -22.702 -2.123 -9.504 515 HB VAL 63 HB VAL 63 -21.233 -3.968 -9.942 516 HG11 VAL 63 HG11 VAL 63 -19.878 -1.366 -10.725 517 HG12 VAL 63 HG12 VAL 63 -19.815 -2.919 -11.572 518 HG13 VAL 63 HG13 VAL 63 -21.336 -2.019 -11.488 519 HG21 VAL 63 HG21 VAL 63 -19.725 -3.900 -7.966 520 HG22 VAL 63 HG22 VAL 63 -18.815 -3.906 -9.481 521 HG23 VAL 63 HG23 VAL 63 -19.007 -2.393 -8.576 522 H GLU 64 H GLU 64 -23.571 -4.228 -9.026 523 HA GLU 64 HA GLU 64 -23.556 -4.944 -6.121 524 HB2 GLU 64 HB2 GLU 64 -25.724 -4.134 -6.965 525 HB3 GLU 64 HB3 GLU 64 -25.709 -5.369 -8.227 526 HG2 GLU 64 HG2 GLU 64 -25.727 -7.140 -6.479 527 HG3 GLU 64 HG3 GLU 64 -25.678 -5.898 -5.225 528 H VAL 65 H VAL 65 -22.503 -6.856 -5.740 529 HA VAL 65 HA VAL 65 -21.557 -8.379 -8.105 530 HB VAL 65 HB VAL 65 -20.492 -8.422 -5.256 531 HG11 VAL 65 HG11 VAL 65 -18.477 -9.372 -6.415 532 HG12 VAL 65 HG12 VAL 65 -19.906 -10.388 -6.646 533 HG13 VAL 65 HG13 VAL 65 -19.361 -9.311 -7.953 534 HG21 VAL 65 HG21 VAL 65 -18.629 -6.994 -6.117 535 HG22 VAL 65 HG22 VAL 65 -19.537 -6.752 -7.626 536 HG23 VAL 65 HG23 VAL 65 -20.166 -6.137 -6.081 537 H LEU 66 H LEU 66 -22.533 -10.262 -8.500 538 HA LEU 66 HA LEU 66 -24.694 -11.074 -6.708 539 HB2 LEU 66 HB2 LEU 66 -23.893 -12.183 -9.423 540 HB3 LEU 66 HB3 LEU 66 -25.419 -12.440 -8.581 541 HG LEU 66 HG LEU 66 -24.404 -9.822 -9.776 542 HD11 LEU 66 HD11 LEU 66 -25.276 -11.474 -11.382 543 HD12 LEU 66 HD12 LEU 66 -26.798 -11.570 -10.471 544 HD13 LEU 66 HD13 LEU 66 -26.328 -10.053 -11.269 545 HD21 LEU 66 HD21 LEU 66 -25.622 -9.244 -7.740 546 HD22 LEU 66 HD22 LEU 66 -26.610 -8.860 -9.146 547 HD23 LEU 66 HD23 LEU 66 -26.965 -10.321 -8.194 548 H GLY 67 H GLY 67 -21.478 -12.292 -7.493 549 HA2 GLY 67 HA2 GLY 67 -20.966 -14.018 -5.516 550 HA3 GLY 67 HA3 GLY 67 -21.998 -14.999 -6.584 551 H MET 68 H MET 68 -19.600 -16.018 -6.537 552 HA MET 68 HA MET 68 -17.729 -14.914 -8.476 553 HB2 MET 68 HB2 MET 68 -18.130 -17.761 -7.504 554 HB3 MET 68 HB3 MET 68 -16.849 -17.240 -8.594 555 HG2 MET 68 HG2 MET 68 -17.243 -16.247 -5.754 556 HG3 MET 68 HG3 MET 68 -16.066 -17.445 -6.266 557 HE1 MET 68 HE1 MET 68 -14.732 -16.486 -8.832 558 HE2 MET 68 HE2 MET 68 -13.392 -15.527 -8.187 559 HE3 MET 68 HE3 MET 68 -13.852 -17.048 -7.392 560 H ALA 69 H ALA 69 -17.430 -15.622 -10.616 561 HA ALA 69 HA ALA 69 -19.809 -16.077 -12.203 562 HB1 ALA 69 HB1 ALA 69 -16.863 -16.325 -12.953 563 HB2 ALA 69 HB2 ALA 69 -18.213 -16.053 -14.064 564 HB3 ALA 69 HB3 ALA 69 -17.758 -14.787 -12.926 565 HA PRO 70 HA PRO 70 -19.979 -20.530 -12.415 566 HB2 PRO 70 HB2 PRO 70 -19.090 -20.394 -15.306 567 HB3 PRO 70 HB3 PRO 70 -20.412 -21.366 -14.583 568 HG2 PRO 70 HG2 PRO 70 -20.997 -19.075 -15.893 569 HG3 PRO 70 HG3 PRO 70 -21.790 -19.417 -14.319 570 HD2 PRO 70 HD2 PRO 70 -19.408 -17.648 -14.886 571 HD3 PRO 70 HD3 PRO 70 -20.828 -17.311 -13.847 572 H ASP 71 H ASP 71 -18.605 -22.394 -12.288 573 HA ASP 71 HA ASP 71 -15.850 -21.970 -11.809 574 HB2 ASP 71 HB2 ASP 71 -15.647 -24.260 -11.480 575 HB3 ASP 71 HB3 ASP 71 -17.292 -23.905 -10.977 576 H ASP 72 H ASP 72 -17.608 -22.728 -14.782 577 HA ASP 72 HA ASP 72 -15.450 -23.515 -16.441 578 HB2 ASP 72 HB2 ASP 72 -17.790 -23.729 -17.108 579 HB3 ASP 72 HB3 ASP 72 -17.990 -21.974 -17.089 580 H GLU 73 H GLU 73 -16.456 -20.281 -15.312 581 HA GLU 73 HA GLU 73 -14.524 -18.957 -17.102 582 HB2 GLU 73 HB2 GLU 73 -16.480 -17.938 -15.010 583 HB3 GLU 73 HB3 GLU 73 -15.238 -16.900 -15.693 584 HG2 GLU 73 HG2 GLU 73 -17.333 -18.363 -17.348 585 HG3 GLU 73 HG3 GLU 73 -17.483 -16.708 -16.769 586 H CYS 74 H CYS 74 -14.998 -19.761 -13.652 587 HA CYS 74 HA CYS 74 -12.655 -18.348 -12.831 588 HB2 CYS 74 HB2 CYS 74 -14.376 -20.327 -11.290 589 HB3 CYS 74 HB3 CYS 74 -13.159 -19.238 -10.602 590 HG CYS 74 HG CYS 74 -16.017 -18.623 -12.104 591 H LEU 75 H LEU 75 -12.355 -20.826 -14.699 592 HA LEU 75 HA LEU 75 -10.598 -22.603 -13.168 593 HB2 LEU 75 HB2 LEU 75 -11.772 -22.493 -15.923 594 HB3 LEU 75 HB3 LEU 75 -10.210 -23.281 -15.808 595 HG LEU 75 HG LEU 75 -12.486 -24.047 -13.952 596 HD11 LEU 75 HD11 LEU 75 -13.251 -24.356 -16.271 597 HD12 LEU 75 HD12 LEU 75 -11.785 -25.289 -16.645 598 HD13 LEU 75 HD13 LEU 75 -12.975 -25.912 -15.476 599 HD21 LEU 75 HD21 LEU 75 -11.233 -26.127 -13.697 600 HD22 LEU 75 HD22 LEU 75 -10.021 -25.574 -14.872 601 HD23 LEU 75 HD23 LEU 75 -10.179 -24.767 -13.299 602 H LYS 76 H LYS 76 -10.179 -19.561 -14.611 603 HA LYS 76 HA LYS 76 -7.248 -20.023 -14.967 604 HB2 LYS 76 HB2 LYS 76 -7.341 -18.670 -17.001 605 HB3 LYS 76 HB3 LYS 76 -8.385 -20.088 -17.124 606 HG2 LYS 76 HG2 LYS 76 -10.337 -18.589 -16.478 607 HG3 LYS 76 HG3 LYS 76 -9.250 -17.202 -16.623 608 HD2 LYS 76 HD2 LYS 76 -8.885 -17.690 -18.990 609 HD3 LYS 76 HD3 LYS 76 -9.831 -19.179 -18.879 610 HE2 LYS 76 HE2 LYS 76 -10.913 -16.361 -18.397 611 HE3 LYS 76 HE3 LYS 76 -11.100 -17.277 -19.891 612 HZ1 LYS 76 HZ1 LYS 76 -12.190 -18.123 -17.260 613 HZ2 LYS 76 HZ2 LYS 76 -13.067 -17.452 -18.469 614 HZ3 LYS 76 HZ3 LYS 76 -12.376 -18.919 -18.689 615 H ASP 77 H ASP 77 -9.761 -17.882 -13.785 616 HA ASP 77 HA ASP 77 -7.842 -16.326 -12.306 617 HB2 ASP 77 HB2 ASP 77 -7.731 -15.157 -14.515 618 HB3 ASP 77 HB3 ASP 77 -9.475 -14.942 -14.473 619 H MET 78 H MET 78 -9.137 -14.768 -10.852 620 HA MET 78 HA MET 78 -11.651 -16.109 -10.024 621 HB2 MET 78 HB2 MET 78 -9.979 -13.864 -8.821 622 HB3 MET 78 HB3 MET 78 -11.513 -14.397 -8.143 623 HG2 MET 78 HG2 MET 78 -9.028 -16.123 -8.457 624 HG3 MET 78 HG3 MET 78 -9.628 -15.390 -6.977 625 HE1 MET 78 HE1 MET 78 -9.295 -18.639 -8.703 626 HE2 MET 78 HE2 MET 78 -10.902 -19.382 -8.765 627 HE3 MET 78 HE3 MET 78 -10.522 -18.020 -9.832 628 H TYR 79 H TYR 79 -13.539 -15.500 -10.958 629 HA TYR 79 HA TYR 79 -13.880 -12.681 -11.879 630 HB2 TYR 79 HB2 TYR 79 -14.746 -15.342 -13.080 631 HB3 TYR 79 HB3 TYR 79 -15.477 -13.817 -13.532 632 HD1 TYR 79 HD1 TYR 79 -14.005 -11.957 -14.498 633 HD2 TYR 79 HD2 TYR 79 -12.791 -16.087 -14.232 634 HE1 TYR 79 HE1 TYR 79 -12.359 -11.581 -16.308 635 HE2 TYR 79 HE2 TYR 79 -11.156 -15.729 -16.042 636 HH TYR 79 HH TYR 79 -10.184 -14.170 -17.517 637 H VAL 80 H VAL 80 -15.969 -11.793 -11.573 638 HA VAL 80 HA VAL 80 -17.908 -13.400 -9.966 639 HB VAL 80 HB VAL 80 -18.440 -11.219 -8.838 640 HG11 VAL 80 HG11 VAL 80 -17.228 -12.981 -7.669 641 HG12 VAL 80 HG12 VAL 80 -15.679 -12.364 -8.282 642 HG13 VAL 80 HG13 VAL 80 -16.676 -11.392 -7.169 643 HG21 VAL 80 HG21 VAL 80 -15.695 -10.314 -9.829 644 HG22 VAL 80 HG22 VAL 80 -17.254 -9.651 -10.369 645 HG23 VAL 80 HG23 VAL 80 -16.750 -9.467 -8.685 646 H GLU 81 H GLU 81 -20.071 -13.045 -10.356 647 HA GLU 81 HA GLU 81 -20.761 -11.710 -12.930 648 HB2 GLU 81 HB2 GLU 81 -22.282 -13.453 -10.952 649 HB3 GLU 81 HB3 GLU 81 -23.130 -12.423 -12.119 650 HG2 GLU 81 HG2 GLU 81 -21.956 -13.482 -13.992 651 HG3 GLU 81 HG3 GLU 81 -21.060 -14.511 -12.884 652 H VAL 82 H VAL 82 -21.864 -9.737 -12.943 653 HA VAL 82 HA VAL 82 -22.335 -8.401 -10.349 654 HB VAL 82 HB VAL 82 -19.955 -8.212 -10.757 655 HG11 VAL 82 HG11 VAL 82 -20.579 -7.052 -13.505 656 HG12 VAL 82 HG12 VAL 82 -19.002 -7.052 -12.714 657 HG13 VAL 82 HG13 VAL 82 -19.749 -8.586 -13.156 658 HG21 VAL 82 HG21 VAL 82 -21.283 -5.596 -11.465 659 HG22 VAL 82 HG22 VAL 82 -21.093 -6.273 -9.824 660 HG23 VAL 82 HG23 VAL 82 -19.662 -5.825 -10.768 661 H ALA 83 H ALA 83 -23.935 -6.931 -10.445 662 HA ALA 83 HA ALA 83 -25.221 -6.413 -13.085 663 HB1 ALA 83 HB1 ALA 83 -26.357 -6.228 -10.274 664 HB2 ALA 83 HB2 ALA 83 -27.206 -5.803 -11.783 665 HB3 ALA 83 HB3 ALA 83 -26.719 -7.482 -11.488 666 H ASP 84 H ASP 84 -25.278 -4.325 -13.813 667 HA ASP 84 HA ASP 84 -23.323 -2.582 -12.489 668 HB2 ASP 84 HB2 ASP 84 -23.088 -3.164 -14.847 669 HB3 ASP 84 HB3 ASP 84 -24.661 -2.431 -15.203 670 H ILE 85 H ILE 85 -24.962 -2.232 -10.719 671 HA ILE 85 HA ILE 85 -27.273 -0.652 -11.123 672 HB ILE 85 HB ILE 85 -27.250 -0.173 -8.771 673 HG12 ILE 85 HG12 ILE 85 -24.474 -1.393 -8.642 674 HG13 ILE 85 HG13 ILE 85 -24.807 0.333 -8.512 675 HG21 ILE 85 HG21 ILE 85 -27.900 -2.440 -9.655 676 HG22 ILE 85 HG22 ILE 85 -26.284 -3.034 -9.218 677 HG23 ILE 85 HG23 ILE 85 -27.397 -2.445 -7.967 678 HD11 ILE 85 HD11 ILE 85 -24.464 -0.601 -6.301 679 HD12 ILE 85 HD12 ILE 85 -26.157 -0.091 -6.465 680 HD13 ILE 85 HD13 ILE 85 -25.718 -1.814 -6.553 681 H GLY 86 H GLY 86 -24.049 0.365 -11.594 682 HA2 GLY 86 HA2 GLY 86 -24.553 3.206 -11.000 683 HA3 GLY 86 HA3 GLY 86 -23.060 2.453 -11.579 684 H GLY 87 H GLY 87 -24.272 1.007 -13.816 685 HA2 GLY 87 HA2 GLY 87 -24.555 3.318 -15.684 686 HA3 GLY 87 HA3 GLY 87 -23.738 1.786 -15.975 687 H LYS 88 H LYS 88 -26.208 0.309 -14.775 688 HA LYS 88 HA LYS 88 -28.090 0.674 -17.076 689 HB2 LYS 88 HB2 LYS 88 -26.778 -1.943 -16.204 690 HB3 LYS 88 HB3 LYS 88 -28.112 -1.828 -17.339 691 HG2 LYS 88 HG2 LYS 88 -25.345 -0.634 -17.800 692 HG3 LYS 88 HG3 LYS 88 -25.918 -2.183 -18.411 693 HD2 LYS 88 HD2 LYS 88 -27.698 -1.066 -19.706 694 HD3 LYS 88 HD3 LYS 88 -27.146 0.517 -19.118 695 HE2 LYS 88 HE2 LYS 88 -24.913 0.115 -20.126 696 HE3 LYS 88 HE3 LYS 88 -25.464 -1.456 -20.720 697 HZ1 LYS 88 HZ1 LYS 88 -27.099 -0.291 -22.087 698 HZ2 LYS 88 HZ2 LYS 88 -26.590 1.163 -21.536 699 HZ3 LYS 88 HZ3 LYS 88 -25.598 0.236 -22.434 700 H ASP 89 H ASP 89 -27.456 -0.852 -13.945 701 HA ASP 89 HA ASP 89 -28.621 -1.670 -12.287 702 HB2 ASP 89 HB2 ASP 89 -29.545 0.562 -12.070 703 HB3 ASP 89 HB3 ASP 89 -30.837 0.177 -13.208 704 H ASP 90 H ASP 90 -30.258 -1.946 -15.368 705 HA ASP 90 HA ASP 90 -31.877 -4.231 -14.447 706 HB2 ASP 90 HB2 ASP 90 -32.842 -2.228 -15.600 707 HB3 ASP 90 HB3 ASP 90 -31.873 -2.628 -17.021 708 H ASP 91 H ASP 91 -28.793 -4.086 -15.487 709 HA ASP 91 HA ASP 91 -28.993 -6.613 -17.002 710 HB2 ASP 91 HB2 ASP 91 -28.824 -4.597 -18.597 711 HB3 ASP 91 HB3 ASP 91 -27.175 -4.411 -17.980 712 H VAL 92 H VAL 92 -26.908 -7.651 -17.259 713 HA VAL 92 HA VAL 92 -25.137 -7.330 -14.909 714 HB VAL 92 HB VAL 92 -26.960 -8.790 -14.298 715 HG11 VAL 92 HG11 VAL 92 -27.787 -9.527 -16.483 716 HG12 VAL 92 HG12 VAL 92 -26.321 -10.503 -16.732 717 HG13 VAL 92 HG13 VAL 92 -27.469 -10.910 -15.441 718 HG21 VAL 92 HG21 VAL 92 -24.802 -9.470 -13.401 719 HG22 VAL 92 HG22 VAL 92 -25.826 -10.872 -13.711 720 HG23 VAL 92 HG23 VAL 92 -24.500 -10.500 -14.821 721 H TYR 93 H TYR 93 -23.128 -8.229 -15.078 722 HA TYR 93 HA TYR 93 -22.086 -9.134 -17.704 723 HB2 TYR 93 HB2 TYR 93 -20.996 -6.846 -15.997 724 HB3 TYR 93 HB3 TYR 93 -20.274 -7.456 -17.474 725 HD1 TYR 93 HD2 TYR 93 -21.272 -6.999 -19.688 726 HD2 TYR 93 HD1 TYR 93 -22.939 -5.347 -16.066 727 HE1 TYR 93 HE2 TYR 93 -22.533 -5.350 -21.030 728 HE2 TYR 93 HE1 TYR 93 -24.218 -3.701 -17.400 729 HH TYR 93 HH TYR 93 -24.001 -3.565 -20.996 730 H THR 94 H THR 94 -19.457 -9.292 -17.049 731 HA THR 94 HA THR 94 -19.221 -10.628 -14.416 732 HB THR 94 HB THR 94 -17.855 -11.507 -16.991 733 HG1 THR 94 HG1 THR 94 -20.050 -12.033 -16.986 734 HG21 THR 94 HG21 THR 94 -16.506 -12.041 -14.994 735 HG22 THR 94 HG22 THR 94 -17.916 -12.795 -14.225 736 HG23 THR 94 HG23 THR 94 -17.201 -13.512 -15.685 737 H ALA 95 H ALA 95 -17.238 -10.177 -13.388 738 HA ALA 95 HA ALA 95 -15.392 -8.242 -14.692 739 HB1 ALA 95 HB1 ALA 95 -15.304 -6.911 -12.567 740 HB2 ALA 95 HB2 ALA 95 -16.869 -6.819 -13.381 741 HB3 ALA 95 HB3 ALA 95 -16.672 -7.861 -11.950 742 H LYS 96 H LYS 96 -13.326 -8.138 -13.655 743 HA LYS 96 HA LYS 96 -12.352 -10.740 -12.692 744 HB2 LYS 96 HB2 LYS 96 -10.935 -8.031 -12.842 745 HB3 LYS 96 HB3 LYS 96 -10.196 -9.569 -12.478 746 HG2 LYS 96 HG2 LYS 96 -9.590 -8.998 -14.683 747 HG3 LYS 96 HG3 LYS 96 -10.672 -10.375 -14.765 748 HD2 LYS 96 HD2 LYS 96 -11.008 -8.698 -16.581 749 HD3 LYS 96 HD3 LYS 96 -12.449 -9.051 -15.665 750 HE2 LYS 96 HE2 LYS 96 -12.473 -6.707 -16.046 751 HE3 LYS 96 HE3 LYS 96 -12.082 -6.910 -14.342 752 HZ1 LYS 96 HZ1 LYS 96 -10.671 -5.276 -15.204 753 HZ2 LYS 96 HZ2 LYS 96 -9.696 -6.582 -15.031 754 HZ3 LYS 96 HZ3 LYS 96 -10.231 -6.163 -16.519 755 H LEU 97 H LEU 97 -12.173 -11.227 -10.465 756 HA LEU 97 HA LEU 97 -13.327 -9.448 -8.537 757 HB2 LEU 97 HB2 LEU 97 -13.132 -11.916 -8.232 758 HB3 LEU 97 HB3 LEU 97 -11.374 -11.753 -8.119 759 HG LEU 97 HG LEU 97 -11.601 -10.394 -6.067 760 HD11 LEU 97 HD11 LEU 97 -14.596 -10.814 -6.464 761 HD12 LEU 97 HD12 LEU 97 -13.872 -10.245 -4.959 762 HD13 LEU 97 HD13 LEU 97 -13.736 -9.258 -6.401 763 HD21 LEU 97 HD21 LEU 97 -11.432 -12.845 -5.906 764 HD22 LEU 97 HD22 LEU 97 -12.396 -12.171 -4.585 765 HD23 LEU 97 HD23 LEU 97 -13.205 -12.979 -5.945 766 H SER 98 H SER 98 -10.018 -9.984 -9.701 767 HA SER 98 HA SER 98 -8.475 -8.442 -8.036 768 HB2 SER 98 HB2 SER 98 -8.217 -8.597 -11.055 769 HB3 SER 98 HB3 SER 98 -6.921 -8.524 -9.851 770 HG SER 98 HG SER 98 -7.392 -10.657 -10.768 771 H ASP 99 H ASP 99 -10.995 -7.216 -10.118 772 HA ASP 99 HA ASP 99 -9.716 -4.541 -10.289 773 HB2 ASP 99 HB2 ASP 99 -10.012 -6.017 -12.360 774 HB3 ASP 99 HB3 ASP 99 -11.750 -5.776 -12.176 775 H ILE 100 H ILE 100 -11.680 -5.937 -8.340 776 HA ILE 100 HA ILE 100 -13.632 -3.688 -8.165 777 HB ILE 100 HB ILE 100 -14.028 -6.621 -8.224 778 HG12 ILE 100 HG12 ILE 100 -15.924 -4.271 -8.628 779 HG13 ILE 100 HG13 ILE 100 -14.868 -4.940 -9.889 780 HG21 ILE 100 HG21 ILE 100 -14.529 -6.313 -5.819 781 HG22 ILE 100 HG22 ILE 100 -15.752 -5.089 -6.249 782 HG23 ILE 100 HG23 ILE 100 -15.933 -6.781 -6.752 783 HD11 ILE 100 HD11 ILE 100 -17.218 -6.309 -8.543 784 HD12 ILE 100 HD12 ILE 100 -17.065 -5.808 -10.232 785 HD13 ILE 100 HD13 ILE 100 -16.062 -7.142 -9.618 786 H GLU 101 H GLU 101 -14.257 -3.080 -6.177 787 HA GLU 101 HA GLU 101 -12.581 -3.832 -3.825 788 HB2 GLU 101 HB2 GLU 101 -11.935 -1.631 -4.623 789 HB3 GLU 101 HB3 GLU 101 -13.627 -1.113 -4.722 790 HG2 GLU 101 HG2 GLU 101 -13.860 -1.153 -2.315 791 HG3 GLU 101 HG3 GLU 101 -12.302 -1.961 -2.124 792 H ALA 102 H ALA 102 -13.863 -4.778 -2.317 793 HA ALA 102 HA ALA 102 -16.761 -4.867 -2.738 794 HB1 ALA 102 HB1 ALA 102 -16.738 -6.468 -0.908 795 HB2 ALA 102 HB2 ALA 102 -15.433 -6.855 -2.046 796 HB3 ALA 102 HB3 ALA 102 -15.058 -6.059 -0.500 797 H ILE 103 H ILE 103 -18.282 -3.853 -1.535 798 HA ILE 103 HA ILE 103 -17.460 -2.058 0.707 799 HB ILE 103 HB ILE 103 -19.139 -1.508 -1.750 800 HG12 ILE 103 HG12 ILE 103 -16.722 -0.019 -0.617 801 HG13 ILE 103 HG13 ILE 103 -16.631 -1.224 -1.900 802 HG21 ILE 103 HG21 ILE 103 -18.903 0.310 0.686 803 HG22 ILE 103 HG22 ILE 103 -19.704 0.719 -0.849 804 HG23 ILE 103 HG23 ILE 103 -20.372 -0.544 0.151 805 HD11 ILE 103 HD11 ILE 103 -18.159 0.131 -3.294 806 HD12 ILE 103 HD12 ILE 103 -18.034 1.441 -2.088 807 HD13 ILE 103 HD13 ILE 103 -16.585 0.885 -2.937 808 H ASP 104 H ASP 104 -18.921 -1.874 2.360 809 HA ASP 104 HA ASP 104 -20.539 -2.459 3.787 810 HB2 ASP 104 HB2 ASP 104 -21.688 -0.893 2.278 811 HB3 ASP 104 HB3 ASP 104 -22.295 -2.248 1.325 812 H VAL 105 H VAL 105 -19.092 -4.682 2.974 813 HA VAL 105 HA VAL 105 -21.153 -6.832 3.079 814 HB VAL 105 HB VAL 105 -19.707 -6.570 0.989 815 HG11 VAL 105 HG11 VAL 105 -17.511 -6.185 2.013 816 HG12 VAL 105 HG12 VAL 105 -17.549 -7.816 2.712 817 HG13 VAL 105 HG13 VAL 105 -17.512 -7.604 0.957 818 HG21 VAL 105 HG21 VAL 105 -21.104 -8.521 1.553 819 HG22 VAL 105 HG22 VAL 105 -19.675 -8.895 0.586 820 HG23 VAL 105 HG23 VAL 105 -19.706 -9.284 2.316 821 H ASP 106 H ASP 106 -20.239 -8.912 4.108 822 HA ASP 106 HA ASP 106 -19.620 -8.330 6.850 823 HB2 ASP 106 HB2 ASP 106 -20.949 -10.292 6.122 824 HB3 ASP 106 HB3 ASP 106 -19.510 -10.945 5.314 825 H ASP 107 H ASP 107 -17.792 -8.968 8.002 826 HA ASP 107 HA ASP 107 -15.307 -8.114 6.980 827 HB2 ASP 107 HB2 ASP 107 -15.852 -8.136 9.363 828 HB3 ASP 107 HB3 ASP 107 -15.949 -9.899 9.357 829 H ASP 108 H ASP 108 -16.617 -11.495 7.207 830 HA ASP 108 HA ASP 108 -14.029 -12.592 6.519 831 HB2 ASP 108 HB2 ASP 108 -15.953 -13.721 7.819 832 HB3 ASP 108 HB3 ASP 108 -16.683 -14.027 6.235 833 H THR 109 H THR 109 -16.766 -11.390 4.695 834 HA THR 109 HA THR 109 -16.049 -12.641 2.127 835 HB THR 109 HB THR 109 -17.859 -10.277 2.835 836 HG1 THR 109 HG1 THR 109 -18.399 -12.488 3.568 837 HG21 THR 109 HG21 THR 109 -17.381 -9.981 0.551 838 HG22 THR 109 HG22 THR 109 -17.239 -11.712 0.273 839 HG23 THR 109 HG23 THR 109 -18.839 -11.002 0.513 840 H GLN 110 H GLN 110 -15.749 -9.377 3.687 841 HA GLN 110 HA GLN 110 -14.287 -8.201 1.606 842 HB2 GLN 110 HB2 GLN 110 -15.383 -7.248 3.836 843 HB3 GLN 110 HB3 GLN 110 -13.769 -7.460 4.502 844 HG2 GLN 110 HG2 GLN 110 -14.563 -5.798 2.064 845 HG3 GLN 110 HG3 GLN 110 -14.169 -5.171 3.657 846 HE21 GLN 110 HE22 GLN 110 -12.873 -5.945 0.581 847 HE22 GLN 110 HE21 GLN 110 -11.180 -5.891 1.000 848 H GLU 111 H GLU 111 -13.086 -9.972 4.527 849 HA GLU 111 HA GLU 111 -10.337 -9.665 3.939 850 HB2 GLU 111 HB2 GLU 111 -11.901 -11.709 5.551 851 HB3 GLU 111 HB3 GLU 111 -10.146 -11.764 5.435 852 HG2 GLU 111 HG2 GLU 111 -11.645 -9.292 6.416 853 HG3 GLU 111 HG3 GLU 111 -11.083 -10.581 7.473 854 H ALA 112 H ALA 112 -12.666 -12.186 2.770 855 HA ALA 112 HA ALA 112 -10.636 -13.878 1.659 856 HB1 ALA 112 HB1 ALA 112 -12.963 -14.626 1.996 857 HB2 ALA 112 HB2 ALA 112 -13.533 -13.473 0.765 858 HB3 ALA 112 HB3 ALA 112 -12.472 -14.819 0.304 859 H ILE 113 H ILE 113 -12.480 -11.110 0.346 860 HA ILE 113 HA ILE 113 -11.370 -11.287 -2.308 861 HB ILE 113 HB ILE 113 -12.802 -9.068 -0.785 862 HG12 ILE 113 HG12 ILE 113 -13.845 -11.022 -2.899 863 HG13 ILE 113 HG13 ILE 113 -14.051 -11.259 -1.185 864 HG21 ILE 113 HG21 ILE 113 -13.229 -8.054 -3.044 865 HG22 ILE 113 HG22 ILE 113 -11.531 -8.035 -2.597 866 HG23 ILE 113 HG23 ILE 113 -12.113 -9.242 -3.753 867 HD11 ILE 113 HD11 ILE 113 -16.071 -10.333 -1.974 868 HD12 ILE 113 HD12 ILE 113 -15.264 -9.082 -1.020 869 HD13 ILE 113 HD13 ILE 113 -15.249 -9.011 -2.809 870 H ALA 114 H ALA 114 -10.569 -9.315 0.609 871 HA ALA 114 HA ALA 114 -8.420 -7.859 -0.519 872 HB1 ALA 114 HB1 ALA 114 -8.766 -8.839 2.347 873 HB2 ALA 114 HB2 ALA 114 -7.701 -7.531 1.800 874 HB3 ALA 114 HB3 ALA 114 -9.461 -7.345 1.675 875 H ASP 115 H ASP 115 -8.518 -11.124 0.980 876 HA ASP 115 HA ASP 115 -5.696 -11.524 0.964 877 HB2 ASP 115 HB2 ASP 115 -7.278 -12.834 2.333 878 HB3 ASP 115 HB3 ASP 115 -7.908 -13.604 0.871 879 H TRP 116 H TRP 116 -8.208 -12.257 -1.525 880 HA TRP 116 HA TRP 116 -6.415 -13.524 -3.377 881 HB2 TRP 116 HB2 TRP 116 -8.767 -13.723 -3.778 882 HB3 TRP 116 HB3 TRP 116 -9.004 -11.979 -3.737 883 HD1 TRP 116 HD1 TRP 116 -8.987 -10.759 -5.972 884 HE1 TRP 116 HE1 TRP 116 -8.168 -11.215 -8.364 885 HE3 TRP 116 HE3 TRP 116 -6.825 -15.343 -5.243 886 HZ2 TRP 116 HZ2 TRP 116 -6.721 -13.275 -9.755 887 HZ3 TRP 116 HZ3 TRP 116 -5.734 -16.528 -7.108 888 HH2 TRP 116 HH2 TRP 116 -5.668 -15.507 -9.381 889 H LEU 117 H LEU 117 -7.351 -10.078 -2.890 890 HA LEU 117 HA LEU 117 -5.819 -9.068 -5.067 891 HB2 LEU 117 HB2 LEU 117 -6.754 -7.793 -2.465 892 HB3 LEU 117 HB3 LEU 117 -5.942 -6.885 -3.727 893 HG LEU 117 HG LEU 117 -8.474 -8.479 -4.308 894 HD11 LEU 117 HD11 LEU 117 -9.019 -6.922 -2.509 895 HD12 LEU 117 HD12 LEU 117 -8.271 -5.578 -3.401 896 HD13 LEU 117 HD13 LEU 117 -9.734 -6.374 -4.029 897 HD21 LEU 117 HD21 LEU 117 -8.691 -6.903 -6.180 898 HD22 LEU 117 HD22 LEU 117 -7.192 -6.085 -5.696 899 HD23 LEU 117 HD23 LEU 117 -7.145 -7.763 -6.271 900 H TYR 118 H TYR 118 -4.969 -9.536 -1.585 901 HA TYR 118 HA TYR 118 -2.327 -8.507 -1.760 902 HB2 TYR 118 HB2 TYR 118 -3.398 -10.698 0.055 903 HB3 TYR 118 HB3 TYR 118 -1.887 -9.836 0.274 904 HD1 TYR 118 HD1 TYR 118 -3.162 -6.975 -0.446 905 HD2 TYR 118 HD2 TYR 118 -4.169 -10.179 2.275 906 HE1 TYR 118 HE1 TYR 118 -4.291 -5.362 1.033 907 HE2 TYR 118 HE2 TYR 118 -5.302 -8.566 3.760 908 HH TYR 118 HH TYR 118 -5.882 -6.332 4.109 909 H TRP 119 H TRP 119 -3.530 -11.913 -2.158 910 HA TRP 119 HA TRP 119 -1.031 -13.101 -2.694 911 HB2 TRP 119 HB2 TRP 119 -2.813 -14.585 -2.409 912 HB3 TRP 119 HB3 TRP 119 -3.886 -13.683 -3.466 913 HD1 TRP 119 HD1 TRP 119 -4.005 -14.265 -5.944 914 HE1 TRP 119 HE1 TRP 119 -2.988 -16.037 -7.456 915 HE3 TRP 119 HE3 TRP 119 -0.483 -16.112 -2.718 916 HZ2 TRP 119 HZ2 TRP 119 -0.919 -18.081 -7.268 917 HZ3 TRP 119 HZ3 TRP 119 0.999 -17.975 -3.416 918 HH2 TRP 119 HH2 TRP 119 0.785 -18.971 -5.684 919 H LEU 120 H LEU 120 -3.291 -11.457 -4.976 920 HA LEU 120 HA LEU 120 -1.796 -12.106 -7.284 921 HB2 LEU 120 HB2 LEU 120 -4.149 -11.317 -7.285 922 HB3 LEU 120 HB3 LEU 120 -3.620 -9.719 -6.752 923 HG LEU 120 HG LEU 120 -2.345 -9.422 -8.869 924 HD11 LEU 120 HD11 LEU 120 -1.819 -11.743 -9.457 925 HD12 LEU 120 HD12 LEU 120 -3.549 -12.130 -9.615 926 HD13 LEU 120 HD13 LEU 120 -2.763 -11.016 -10.756 927 HD21 LEU 120 HD21 LEU 120 -4.671 -8.641 -8.680 928 HD22 LEU 120 HD22 LEU 120 -4.313 -9.173 -10.331 929 HD23 LEU 120 HD23 LEU 120 -5.257 -10.221 -9.245 930 H ALA 121 H ALA 121 -1.689 -9.252 -5.131 931 HA ALA 121 HA ALA 121 0.338 -7.827 -6.561 932 HB1 ALA 121 HB1 ALA 121 -0.641 -7.760 -3.678 933 HB2 ALA 121 HB2 ALA 121 0.439 -6.539 -4.404 934 HB3 ALA 121 HB3 ALA 121 -1.218 -6.760 -5.017 935 H ARG 122 H ARG 122 0.479 -10.217 -3.893 936 HA ARG 122 HA ARG 122 3.255 -10.045 -3.330 937 HB2 ARG 122 HB2 ARG 122 1.641 -11.098 -1.840 938 HB3 ARG 122 HB3 ARG 122 1.209 -12.282 -3.059 939 HG2 ARG 122 HG2 ARG 122 2.519 -13.314 -1.360 940 HG3 ARG 122 HG3 ARG 122 3.407 -13.352 -2.877 941 HD2 ARG 122 HD2 ARG 122 4.823 -11.481 -2.127 942 HD3 ARG 122 HD3 ARG 122 3.880 -11.328 -0.642 943 HE ARG 122 HE ARG 122 5.909 -13.326 -1.311 944 HH11 ARG 122 HH11 ARG 122 3.285 -12.496 0.991 945 HH12 ARG 122 HH12 ARG 122 3.680 -13.830 2.059 946 HH21 ARG 122 HH21 ARG 122 6.325 -15.092 0.123 947 HH22 ARG 122 HH22 ARG 122 5.240 -15.405 1.444 948 H GLY 123 H GLY 123 1.515 -11.622 -5.960 949 HA2 GLY 123 HA2 GLY 123 3.257 -11.646 -7.867 950 HA3 GLY 123 HA3 GLY 123 3.979 -12.973 -6.941 951 H TYR 124 H TYR 124 2.223 -12.559 -9.571 952 HA TYR 124 HA TYR 124 0.081 -14.476 -9.184 953 HB2 TYR 124 HB2 TYR 124 -0.024 -12.576 -10.782 954 HB3 TYR 124 HB3 TYR 124 1.275 -13.288 -11.718 955 HD1 TYR 124 HD2 TYR 124 -2.160 -14.084 -10.361 956 HD2 TYR 124 HD1 TYR 124 0.717 -14.734 -13.513 957 HE1 TYR 124 HE2 TYR 124 -3.860 -15.342 -11.645 958 HE2 TYR 124 HE1 TYR 124 -0.970 -15.999 -14.800 959 HH TYR 124 HH TYR 124 -3.163 -16.769 -14.877 960 H LYS 125 H LYS 125 1.562 -16.100 -8.145 961 HA LYS 125 HA LYS 125 3.157 -17.725 -10.055 962 HB2 LYS 125 HB2 LYS 125 2.725 -18.027 -7.048 963 HB3 LYS 125 HB3 LYS 125 3.843 -18.962 -8.037 964 HG2 LYS 125 HG2 LYS 125 4.050 -15.985 -7.417 965 HG3 LYS 125 HG3 LYS 125 5.028 -17.286 -6.743 966 HD2 LYS 125 HD2 LYS 125 5.905 -17.791 -9.036 967 HD3 LYS 125 HD3 LYS 125 4.993 -16.397 -9.663 968 HE2 LYS 125 HE2 LYS 125 6.217 -14.896 -8.113 969 HE3 LYS 125 HE3 LYS 125 7.122 -16.277 -7.481 970 HZ1 LYS 125 HZ1 LYS 125 8.387 -15.083 -9.148 971 HZ2 LYS 125 HZ2 LYS 125 8.074 -16.585 -9.691 972 HZ3 LYS 125 HZ3 LYS 125 7.239 -15.307 -10.280 973 H PHE 126 H PHE 126 0.170 -17.335 -10.052 974 HA PHE 126 HA PHE 126 -1.254 -19.538 -9.008 975 HB2 PHE 126 HB2 PHE 126 -1.976 -17.187 -9.866 976 HB3 PHE 126 HB3 PHE 126 -1.932 -17.903 -11.466 977 HD1 PHE 126 HD2 PHE 126 -3.420 -18.557 -8.022 978 HD2 PHE 126 HD1 PHE 126 -3.974 -18.626 -12.317 979 HE1 PHE 126 HE2 PHE 126 -5.835 -18.911 -7.722 980 HE2 PHE 126 HE1 PHE 126 -6.393 -19.030 -11.986 981 HZ PHE 126 HZ PHE 126 -7.339 -19.108 -9.695 Start of MODEL 18 1 H1 MET 1 H1 MET 1 5.329 -3.274 -5.374 2 H2 MET 1 H2 MET 1 3.749 -2.977 -5.666 3 H3 MET 1 H3 MET 1 4.732 -1.764 -5.160 4 HA MET 1 HA MET 1 5.070 -2.845 -3.047 5 HB2 MET 1 HB2 MET 1 3.298 -1.178 -3.177 6 HB3 MET 1 HB3 MET 1 2.149 -2.371 -3.787 7 HG2 MET 1 HG2 MET 1 1.823 -1.857 -1.408 8 HG3 MET 1 HG3 MET 1 2.160 -3.560 -1.674 9 HE1 MET 1 HE1 MET 1 2.154 -1.964 1.088 10 HE2 MET 1 HE2 MET 1 2.501 -3.708 1.055 11 HE3 MET 1 HE3 MET 1 3.585 -2.599 1.922 12 H ALA 2 H ALA 2 5.494 -4.843 -2.280 13 HA ALA 2 HA ALA 2 3.552 -7.043 -2.793 14 HB1 ALA 2 HB1 ALA 2 5.420 -8.578 -3.211 15 HB2 ALA 2 HB2 ALA 2 5.427 -7.263 -4.396 16 HB3 ALA 2 HB3 ALA 2 6.585 -7.247 -3.043 17 H SER 3 H SER 3 4.970 -5.175 -0.409 18 HA SER 3 HA SER 3 5.790 -7.221 1.425 19 HB2 SER 3 HB2 SER 3 5.125 -4.317 2.014 20 HB3 SER 3 HB3 SER 3 6.243 -5.378 2.886 21 HG SER 3 HG SER 3 7.346 -3.960 1.475 22 H VAL 4 H VAL 4 2.868 -7.246 0.432 23 HA VAL 4 HA VAL 4 1.222 -6.387 2.645 24 HB VAL 4 HB VAL 4 -0.629 -7.161 1.181 25 HG11 VAL 4 HG11 VAL 4 0.314 -4.887 0.943 26 HG12 VAL 4 HG12 VAL 4 1.426 -5.476 -0.314 27 HG13 VAL 4 HG13 VAL 4 -0.326 -5.519 -0.579 28 HG21 VAL 4 HG21 VAL 4 1.549 -7.964 -0.821 29 HG22 VAL 4 HG22 VAL 4 0.496 -9.084 0.074 30 HG23 VAL 4 HG23 VAL 4 -0.202 -7.950 -1.076 31 H GLU 5 H GLU 5 3.102 -8.475 3.399 32 HA GLU 5 HA GLU 5 1.557 -10.934 3.825 33 HB2 GLU 5 HB2 GLU 5 4.018 -10.869 3.385 34 HB3 GLU 5 HB3 GLU 5 4.264 -10.107 4.953 35 HG2 GLU 5 HG2 GLU 5 3.288 -12.104 6.070 36 HG3 GLU 5 HG3 GLU 5 2.910 -12.812 4.497 37 H ARG 6 H ARG 6 -0.182 -9.579 4.694 38 HA ARG 6 HA ARG 6 -0.163 -7.851 6.804 39 HB2 ARG 6 HB2 ARG 6 -2.115 -8.131 5.492 40 HB3 ARG 6 HB3 ARG 6 -2.255 -9.849 5.885 41 HG2 ARG 6 HG2 ARG 6 -2.940 -9.397 8.134 42 HG3 ARG 6 HG3 ARG 6 -2.591 -7.657 7.974 43 HD2 ARG 6 HD2 ARG 6 -4.391 -7.347 6.410 44 HD3 ARG 6 HD3 ARG 6 -4.577 -9.098 6.190 45 HE ARG 6 HE ARG 6 -5.011 -8.354 8.934 46 HH11 ARG 6 HH11 ARG 6 -6.641 -8.085 5.779 47 HH12 ARG 6 HH12 ARG 6 -8.128 -8.807 6.360 48 HH21 ARG 6 HH21 ARG 6 -7.151 -8.921 9.732 49 HH22 ARG 6 HH22 ARG 6 -8.488 -8.985 8.611 50 H ASP 7 H ASP 7 -0.585 -11.427 7.186 51 HA ASP 7 HA ASP 7 0.886 -11.341 9.666 52 HB2 ASP 7 HB2 ASP 7 -1.450 -10.758 10.454 53 HB3 ASP 7 HB3 ASP 7 -2.021 -12.280 9.766 54 H GLU 8 H GLU 8 1.808 -13.403 9.987 55 HA GLU 8 HA GLU 8 1.903 -15.062 7.684 56 HB2 GLU 8 HB2 GLU 8 2.873 -15.558 10.534 57 HB3 GLU 8 HB3 GLU 8 3.273 -16.567 9.134 58 HG2 GLU 8 HG2 GLU 8 4.314 -14.618 8.011 59 HG3 GLU 8 HG3 GLU 8 3.981 -13.619 9.428 60 H THR 9 H THR 9 -0.365 -15.164 10.408 61 HA THR 9 HA THR 9 -1.115 -17.895 10.253 62 HB THR 9 HB THR 9 -2.957 -15.541 10.729 63 HG1 THR 9 HG1 THR 9 -1.313 -15.169 12.025 64 HG21 THR 9 HG21 THR 9 -4.101 -17.709 10.652 65 HG22 THR 9 HG22 THR 9 -2.938 -18.395 11.808 66 HG23 THR 9 HG23 THR 9 -4.061 -17.109 12.315 67 H ARG 10 H ARG 10 -1.851 -15.139 8.072 68 HA ARG 10 HA ARG 10 -3.972 -16.465 6.607 69 HB2 ARG 10 HB2 ARG 10 -1.977 -14.383 5.596 70 HB3 ARG 10 HB3 ARG 10 -3.544 -14.755 4.899 71 HG2 ARG 10 HG2 ARG 10 -3.107 -13.506 7.655 72 HG3 ARG 10 HG3 ARG 10 -3.428 -12.599 6.192 73 HD2 ARG 10 HD2 ARG 10 -5.355 -14.696 7.269 74 HD3 ARG 10 HD3 ARG 10 -5.382 -13.000 7.754 75 HE ARG 10 HE ARG 10 -5.601 -13.805 4.871 76 HH11 ARG 10 HH11 ARG 10 -7.078 -12.035 7.622 77 HH12 ARG 10 HH12 ARG 10 -8.199 -11.198 6.575 78 HH21 ARG 10 HH21 ARG 10 -7.056 -12.845 3.669 79 HH22 ARG 10 HH22 ARG 10 -8.315 -11.788 4.276 80 H GLU 11 H GLU 11 -0.445 -16.212 6.205 81 HA GLU 11 HA GLU 11 -0.259 -17.668 3.767 82 HB2 GLU 11 HB2 GLU 11 1.398 -16.034 4.610 83 HB3 GLU 11 HB3 GLU 11 1.764 -17.074 5.973 84 HG2 GLU 11 HG2 GLU 11 3.496 -17.229 4.320 85 HG3 GLU 11 HG3 GLU 11 2.695 -18.783 4.522 86 H HIS 12 H HIS 12 0.304 -18.664 7.202 87 HA HIS 12 HA HIS 12 0.912 -21.371 6.626 88 HB2 HIS 12 HB2 HIS 12 -0.397 -20.158 9.100 89 HB3 HIS 12 HB3 HIS 12 0.220 -21.802 8.994 90 HD1 HIS 12 HD1 HIS 12 3.100 -21.590 8.007 91 HD2 HIS 12 HD2 HIS 12 1.221 -18.763 10.492 92 HE1 HIS 12 HE1 HIS 12 4.965 -20.385 9.247 93 H ARG 13 H ARG 13 -2.280 -19.836 7.444 94 HA ARG 13 HA ARG 13 -3.634 -22.356 7.475 95 HB2 ARG 13 HB2 ARG 13 -4.656 -19.502 7.189 96 HB3 ARG 13 HB3 ARG 13 -5.714 -20.911 7.145 97 HG2 ARG 13 HG2 ARG 13 -4.746 -21.651 9.379 98 HG3 ARG 13 HG3 ARG 13 -3.881 -20.117 9.454 99 HD2 ARG 13 HD2 ARG 13 -5.901 -19.906 10.740 100 HD3 ARG 13 HD3 ARG 13 -6.092 -18.925 9.273 101 HE ARG 13 HE ARG 13 -7.067 -21.602 8.845 102 HH11 ARG 13 HH11 ARG 13 -8.024 -18.653 10.597 103 HH12 ARG 13 HH12 ARG 13 -9.715 -18.964 10.468 104 HH21 ARG 13 HH21 ARG 13 -9.277 -21.975 8.590 105 HH22 ARG 13 HH22 ARG 13 -10.450 -20.926 9.329 106 H ILE 14 H ILE 14 -3.339 -19.908 4.783 107 HA ILE 14 HA ILE 14 -5.044 -21.424 3.127 108 HB ILE 14 HB ILE 14 -4.378 -19.047 2.774 109 HG12 ILE 14 HG12 ILE 14 -4.194 -21.010 0.438 110 HG13 ILE 14 HG13 ILE 14 -5.656 -20.331 1.159 111 HG21 ILE 14 HG21 ILE 14 -1.888 -20.123 1.382 112 HG22 ILE 14 HG22 ILE 14 -2.413 -18.432 1.518 113 HG23 ILE 14 HG23 ILE 14 -1.906 -19.300 2.955 114 HD11 ILE 14 HD11 ILE 14 -3.598 -18.846 -0.487 115 HD12 ILE 14 HD12 ILE 14 -5.287 -19.220 -0.877 116 HD13 ILE 14 HD13 ILE 14 -4.923 -18.059 0.415 117 H GLU 15 H GLU 15 -1.517 -21.643 3.638 118 HA GLU 15 HA GLU 15 -0.971 -23.569 1.616 119 HB2 GLU 15 HB2 GLU 15 0.743 -22.206 2.627 120 HB3 GLU 15 HB3 GLU 15 0.390 -22.838 4.240 121 HG2 GLU 15 HG2 GLU 15 1.206 -25.033 3.645 122 HG3 GLU 15 HG3 GLU 15 1.401 -24.559 1.951 123 H THR 16 H THR 16 -2.184 -23.949 4.959 124 HA THR 16 HA THR 16 -1.783 -26.866 4.740 125 HB THR 16 HB THR 16 -2.112 -26.831 7.201 126 HG1 THR 16 HG1 THR 16 -1.877 -24.019 6.943 127 HG21 THR 16 HG21 THR 16 0.096 -24.999 6.161 128 HG22 THR 16 HG22 THR 16 0.072 -25.852 7.720 129 HG23 THR 16 HG23 THR 16 0.141 -26.772 6.210 130 H GLU 17 H GLU 17 -4.489 -24.687 4.499 131 HA GLU 17 HA GLU 17 -6.231 -27.098 4.702 132 HB2 GLU 17 HB2 GLU 17 -7.718 -26.140 6.131 133 HB3 GLU 17 HB3 GLU 17 -6.189 -25.547 6.751 134 HG2 GLU 17 HG2 GLU 17 -6.690 -23.385 5.379 135 HG3 GLU 17 HG3 GLU 17 -8.299 -24.050 5.156 136 H ILE 18 H ILE 18 -5.349 -24.531 2.583 137 HA ILE 18 HA ILE 18 -7.911 -24.957 1.088 138 HB ILE 18 HB ILE 18 -6.144 -22.519 1.323 139 HG12 ILE 18 HG12 ILE 18 -9.111 -22.898 1.938 140 HG13 ILE 18 HG13 ILE 18 -7.844 -23.007 3.152 141 HG21 ILE 18 HG21 ILE 18 -7.633 -21.395 -0.277 142 HG22 ILE 18 HG22 ILE 18 -6.894 -22.777 -1.051 143 HG23 ILE 18 HG23 ILE 18 -8.569 -22.896 -0.488 144 HD11 ILE 18 HD11 ILE 18 -8.460 -20.489 1.579 145 HD12 ILE 18 HD12 ILE 18 -8.938 -20.845 3.242 146 HD13 ILE 18 HD13 ILE 18 -7.224 -20.677 2.843 147 H ILE 19 H ILE 19 -4.445 -23.994 0.371 148 HA ILE 19 HA ILE 19 -4.740 -25.512 -2.159 149 HB ILE 19 HB ILE 19 -2.705 -24.381 -2.862 150 HG12 ILE 19 HG12 ILE 19 -2.802 -22.973 -0.169 151 HG13 ILE 19 HG13 ILE 19 -1.569 -24.121 -0.698 152 HG21 ILE 19 HG21 ILE 19 -4.706 -22.351 -1.798 153 HG22 ILE 19 HG22 ILE 19 -3.707 -22.242 -3.256 154 HG23 ILE 19 HG23 ILE 19 -5.021 -23.415 -3.189 155 HD11 ILE 19 HD11 ILE 19 -0.964 -22.489 -2.522 156 HD12 ILE 19 HD12 ILE 19 -2.117 -21.340 -1.783 157 HD13 ILE 19 HD13 ILE 19 -0.709 -21.889 -0.865 158 H VAL 20 H VAL 20 -4.114 -26.534 0.796 159 HA VAL 20 HA VAL 20 -1.617 -27.730 0.832 160 HB VAL 20 HB VAL 20 -3.304 -27.471 2.630 161 HG11 VAL 20 HG11 VAL 20 -4.969 -29.117 3.143 162 HG12 VAL 20 HG12 VAL 20 -5.317 -28.393 1.571 163 HG13 VAL 20 HG13 VAL 20 -4.606 -30.023 1.668 164 HG21 VAL 20 HG21 VAL 20 -1.267 -28.814 2.968 165 HG22 VAL 20 HG22 VAL 20 -2.623 -29.440 3.920 166 HG23 VAL 20 HG23 VAL 20 -2.133 -30.270 2.429 167 H ASP 21 H ASP 21 -4.582 -28.890 -0.684 168 HA ASP 21 HA ASP 21 -3.530 -31.481 -1.451 169 HB2 ASP 21 HB2 ASP 21 -5.915 -31.047 -0.982 170 HB3 ASP 21 HB3 ASP 21 -5.996 -29.952 -2.363 171 H ALA 22 H ALA 22 -3.147 -28.330 -2.824 172 HA ALA 22 HA ALA 22 -3.219 -29.170 -5.627 173 HB1 ALA 22 HB1 ALA 22 -2.372 -26.533 -4.347 174 HB2 ALA 22 HB2 ALA 22 -2.634 -26.817 -6.069 175 HB3 ALA 22 HB3 ALA 22 -4.006 -26.917 -4.947 176 H GLU 23 H GLU 23 -1.412 -28.930 -7.057 177 HA GLU 23 HA GLU 23 1.300 -28.752 -5.877 178 HB2 GLU 23 HB2 GLU 23 2.061 -30.700 -7.106 179 HB3 GLU 23 HB3 GLU 23 0.750 -31.140 -6.016 180 HG2 GLU 23 HG2 GLU 23 -0.849 -31.142 -7.924 181 HG3 GLU 23 HG3 GLU 23 0.451 -30.677 -9.021 182 H ASP 24 H ASP 24 -0.890 -27.741 -8.293 183 HA ASP 24 HA ASP 24 1.252 -26.546 -9.958 184 HB2 ASP 24 HB2 ASP 24 0.630 -28.643 -11.059 185 HB3 ASP 24 HB3 ASP 24 -1.084 -28.275 -10.878 186 H LYS 25 H LYS 25 0.415 -24.695 -11.189 187 HA LYS 25 HA LYS 25 -1.156 -22.959 -9.694 188 HB2 LYS 25 HB2 LYS 25 -1.135 -21.500 -11.630 189 HB3 LYS 25 HB3 LYS 25 0.439 -22.263 -11.426 190 HG2 LYS 25 HG2 LYS 25 -0.203 -23.928 -13.217 191 HG3 LYS 25 HG3 LYS 25 -1.715 -23.030 -13.448 192 HD2 LYS 25 HD2 LYS 25 -0.434 -21.013 -14.074 193 HD3 LYS 25 HD3 LYS 25 1.087 -21.921 -13.862 194 HE2 LYS 25 HE2 LYS 25 0.310 -23.586 -15.544 195 HE3 LYS 25 HE3 LYS 25 -1.187 -22.678 -15.758 196 HZ1 LYS 25 HZ1 LYS 25 0.422 -22.150 -17.484 197 HZ2 LYS 25 HZ2 LYS 25 0.141 -20.815 -16.594 198 HZ3 LYS 25 HZ3 LYS 25 1.528 -21.659 -16.394 199 H GLU 26 H GLU 26 -2.350 -25.240 -12.248 200 HA GLU 26 HA GLU 26 -4.971 -23.994 -12.329 201 HB2 GLU 26 HB2 GLU 26 -3.955 -26.751 -13.155 202 HB3 GLU 26 HB3 GLU 26 -5.613 -26.201 -13.393 203 HG2 GLU 26 HG2 GLU 26 -4.812 -24.297 -14.763 204 HG3 GLU 26 HG3 GLU 26 -3.145 -24.832 -14.551 205 H GLU 27 H GLU 27 -3.448 -26.561 -10.381 206 HA GLU 27 HA GLU 27 -5.920 -27.453 -9.157 207 HB2 GLU 27 HB2 GLU 27 -3.032 -27.793 -8.247 208 HB3 GLU 27 HB3 GLU 27 -4.426 -28.655 -7.606 209 HG2 GLU 27 HG2 GLU 27 -3.370 -28.809 -10.461 210 HG3 GLU 27 HG3 GLU 27 -3.130 -30.017 -9.204 211 H ARG 28 H ARG 28 -3.310 -25.130 -8.312 212 HA ARG 28 HA ARG 28 -4.406 -24.326 -5.780 213 HB2 ARG 28 HB2 ARG 28 -2.706 -22.787 -7.805 214 HB3 ARG 28 HB3 ARG 28 -3.172 -22.162 -6.221 215 HG2 ARG 28 HG2 ARG 28 -2.084 -24.146 -5.150 216 HG3 ARG 28 HG3 ARG 28 -1.472 -24.644 -6.728 217 HD2 ARG 28 HD2 ARG 28 -0.900 -21.941 -5.427 218 HD3 ARG 28 HD3 ARG 28 0.141 -23.344 -5.242 219 HE ARG 28 HE ARG 28 -0.056 -21.571 -7.547 220 HH11 ARG 28 HH11 ARG 28 1.000 -24.832 -6.554 221 HH12 ARG 28 HH12 ARG 28 2.233 -24.916 -7.757 222 HH21 ARG 28 HH21 ARG 28 1.445 -21.673 -9.044 223 HH22 ARG 28 HH22 ARG 28 2.504 -23.054 -9.275 224 H ALA 29 H ALA 29 -5.078 -23.255 -9.135 225 HA ALA 29 HA ALA 29 -6.747 -21.077 -8.421 226 HB1 ALA 29 HB1 ALA 29 -5.797 -21.592 -10.726 227 HB2 ALA 29 HB2 ALA 29 -7.069 -22.819 -10.897 228 HB3 ALA 29 HB3 ALA 29 -7.498 -21.113 -10.681 229 H MET 30 H MET 30 -7.528 -24.561 -8.980 230 HA MET 30 HA MET 30 -10.336 -24.199 -8.456 231 HB2 MET 30 HB2 MET 30 -8.595 -26.680 -8.375 232 HB3 MET 30 HB3 MET 30 -10.358 -26.678 -8.247 233 HG2 MET 30 HG2 MET 30 -8.776 -25.627 -10.627 234 HG3 MET 30 HG3 MET 30 -9.539 -27.199 -10.511 235 HE1 MET 30 HE1 MET 30 -11.034 -23.212 -10.109 236 HE2 MET 30 HE2 MET 30 -9.770 -23.566 -11.305 237 HE3 MET 30 HE3 MET 30 -11.446 -23.285 -11.823 238 H GLY 31 H GLY 31 -7.587 -25.051 -6.306 239 HA2 GLY 31 HA2 GLY 31 -9.103 -25.583 -3.968 240 HA3 GLY 31 HA3 GLY 31 -7.453 -24.931 -4.012 241 H TRP 32 H TRP 32 -7.700 -22.474 -5.147 242 HA TRP 32 HA TRP 32 -8.817 -20.754 -3.215 243 HB2 TRP 32 HB2 TRP 32 -7.853 -20.440 -6.050 244 HB3 TRP 32 HB3 TRP 32 -8.750 -19.141 -5.296 245 HD1 TRP 32 HD1 TRP 32 -5.409 -20.967 -4.924 246 HE1 TRP 32 HE1 TRP 32 -3.757 -19.306 -3.971 247 HE3 TRP 32 HE3 TRP 32 -8.696 -17.305 -3.524 248 HZ2 TRP 32 HZ2 TRP 32 -3.884 -16.889 -2.325 249 HZ3 TRP 32 HZ3 TRP 32 -7.915 -15.385 -2.170 250 HH2 TRP 32 HH2 TRP 32 -5.512 -15.166 -1.570 251 H TYR 33 H TYR 33 -10.130 -21.685 -6.466 252 HA TYR 33 HA TYR 33 -12.425 -20.097 -6.362 253 HB2 TYR 33 HB2 TYR 33 -11.760 -21.169 -8.420 254 HB3 TYR 33 HB3 TYR 33 -11.889 -22.771 -7.703 255 HD1 TYR 33 HD2 TYR 33 -14.070 -23.829 -7.252 256 HD2 TYR 33 HD1 TYR 33 -13.797 -19.967 -9.156 257 HE1 TYR 33 HE2 TYR 33 -16.471 -23.920 -7.753 258 HE2 TYR 33 HE1 TYR 33 -16.162 -20.139 -9.840 259 HH TYR 33 HH TYR 33 -18.266 -22.887 -8.857 260 H TYR 34 H TYR 34 -11.974 -23.466 -5.175 261 HA TYR 34 HA TYR 34 -14.652 -24.014 -4.549 262 HB2 TYR 34 HB2 TYR 34 -13.128 -25.806 -4.706 263 HB3 TYR 34 HB3 TYR 34 -11.954 -25.040 -3.649 264 HD1 TYR 34 HD1 TYR 34 -15.384 -26.565 -3.611 265 HD2 TYR 34 HD2 TYR 34 -11.856 -25.507 -1.375 266 HE1 TYR 34 HE1 TYR 34 -16.280 -27.783 -1.638 267 HE2 TYR 34 HE2 TYR 34 -12.733 -26.717 0.608 268 HH TYR 34 HH TYR 34 -14.490 -27.981 1.478 269 H TYR 35 H TYR 35 -12.005 -22.866 -2.288 270 HA TYR 35 HA TYR 35 -13.946 -22.674 -0.171 271 HB2 TYR 35 HB2 TYR 35 -12.267 -22.256 1.227 272 HB3 TYR 35 HB3 TYR 35 -11.271 -22.861 -0.080 273 HD1 TYR 35 HD1 TYR 35 -10.021 -21.233 -1.516 274 HD2 TYR 35 HD2 TYR 35 -12.244 -19.932 1.929 275 HE1 TYR 35 HE1 TYR 35 -8.851 -19.046 -1.606 276 HE2 TYR 35 HE2 TYR 35 -11.104 -17.742 1.857 277 HH TYR 35 HH TYR 35 -9.541 -16.417 0.761 278 H LEU 36 H LEU 36 -12.628 -20.297 -2.529 279 HA LEU 36 HA LEU 36 -13.630 -18.014 -1.210 280 HB2 LEU 36 HB2 LEU 36 -11.906 -17.926 -2.945 281 HB3 LEU 36 HB3 LEU 36 -13.057 -18.502 -4.158 282 HG LEU 36 HG LEU 36 -14.375 -16.441 -3.951 283 HD11 LEU 36 HD11 LEU 36 -13.486 -14.496 -2.666 284 HD12 LEU 36 HD12 LEU 36 -13.991 -15.809 -1.602 285 HD13 LEU 36 HD13 LEU 36 -12.260 -15.553 -1.935 286 HD21 LEU 36 HD21 LEU 36 -11.398 -15.874 -4.310 287 HD22 LEU 36 HD22 LEU 36 -12.467 -16.587 -5.533 288 HD23 LEU 36 HD23 LEU 36 -12.755 -14.937 -4.977 289 H ASP 37 H ASP 37 -15.078 -19.972 -3.907 290 HA ASP 37 HA ASP 37 -17.477 -18.457 -4.113 291 HB2 ASP 37 HB2 ASP 37 -16.750 -20.136 -5.786 292 HB3 ASP 37 HB3 ASP 37 -17.029 -21.427 -4.616 293 H ASP 38 H ASP 38 -16.627 -21.256 -2.037 294 HA ASP 38 HA ASP 38 -19.167 -21.479 -0.748 295 HB2 ASP 38 HB2 ASP 38 -17.472 -23.250 -0.736 296 HB3 ASP 38 HB3 ASP 38 -16.391 -22.241 0.226 297 H THR 39 H THR 39 -16.629 -19.092 -0.295 298 HA THR 39 HA THR 39 -17.561 -18.431 2.443 299 HB THR 39 HB THR 39 -15.158 -17.448 0.852 300 HG1 THR 39 HG1 THR 39 -14.908 -19.542 1.375 301 HG21 THR 39 HG21 THR 39 -16.024 -16.966 3.734 302 HG22 THR 39 HG22 THR 39 -14.356 -16.726 3.162 303 HG23 THR 39 HG23 THR 39 -15.674 -15.755 2.493 304 H LEU 40 H LEU 40 -17.442 -17.049 -0.871 305 HA LEU 40 HA LEU 40 -18.203 -14.396 -0.211 306 HB2 LEU 40 HB2 LEU 40 -18.801 -16.091 -2.659 307 HB3 LEU 40 HB3 LEU 40 -19.199 -14.380 -2.542 308 HG LEU 40 HG LEU 40 -16.382 -15.506 -2.424 309 HD11 LEU 40 HD11 LEU 40 -16.158 -14.650 -4.717 310 HD12 LEU 40 HD12 LEU 40 -17.460 -15.840 -4.624 311 HD13 LEU 40 HD13 LEU 40 -17.850 -14.108 -4.699 312 HD21 LEU 40 HD21 LEU 40 -15.706 -13.147 -2.946 313 HD22 LEU 40 HD22 LEU 40 -17.344 -12.659 -2.461 314 HD23 LEU 40 HD23 LEU 40 -16.240 -13.479 -1.307 315 H GLU 41 H GLU 41 -20.057 -13.841 0.954 316 HA GLU 41 HA GLU 41 -22.434 -15.551 0.892 317 HB2 GLU 41 HB2 GLU 41 -21.898 -12.900 2.297 318 HB3 GLU 41 HB3 GLU 41 -23.385 -13.864 2.419 319 HG2 GLU 41 HG2 GLU 41 -21.944 -15.817 3.174 320 HG3 GLU 41 HG3 GLU 41 -20.604 -14.683 3.336 321 H PHE 42 H PHE 42 -22.022 -15.074 -1.599 322 HA PHE 42 HA PHE 42 -22.940 -12.643 -2.717 323 HB2 PHE 42 HB2 PHE 42 -22.897 -13.832 -4.836 324 HB3 PHE 42 HB3 PHE 42 -21.486 -14.221 -3.893 325 HD1 PHE 42 HD2 PHE 42 -24.842 -15.520 -4.966 326 HD2 PHE 42 HD1 PHE 42 -20.936 -16.518 -3.421 327 HE1 PHE 42 HE2 PHE 42 -25.324 -17.928 -5.286 328 HE2 PHE 42 HE1 PHE 42 -21.423 -18.917 -3.749 329 HZ PHE 42 HZ PHE 42 -23.618 -19.636 -4.676 330 HA PRO 43 HA PRO 43 -24.131 -12.075 -4.808 331 HB2 PRO 43 HB2 PRO 43 -26.128 -10.295 -5.283 332 HB3 PRO 43 HB3 PRO 43 -26.077 -11.917 -6.036 333 HG2 PRO 43 HG2 PRO 43 -27.631 -11.059 -3.577 334 HG3 PRO 43 HG3 PRO 43 -28.221 -11.989 -4.991 335 HD2 PRO 43 HD2 PRO 43 -27.420 -13.200 -2.669 336 HD3 PRO 43 HD3 PRO 43 -27.139 -13.954 -4.265 337 H PHE 44 H PHE 44 -23.345 -9.908 -4.624 338 HA PHE 44 HA PHE 44 -23.943 -8.318 -2.231 339 HB2 PHE 44 HB2 PHE 44 -21.710 -8.180 -1.444 340 HB3 PHE 44 HB3 PHE 44 -22.194 -9.859 -1.431 341 HD1 PHE 44 HD1 PHE 44 -21.295 -11.416 -3.306 342 HD2 PHE 44 HD2 PHE 44 -19.687 -7.503 -2.485 343 HE1 PHE 44 HE1 PHE 44 -19.177 -12.054 -4.415 344 HE2 PHE 44 HE2 PHE 44 -17.587 -8.129 -3.633 345 HZ PHE 44 HZ PHE 44 -17.316 -10.412 -4.584 346 H MET 45 H MET 45 -21.955 -6.346 -2.577 347 HA MET 45 HA MET 45 -22.043 -5.732 -5.470 348 HB2 MET 45 HB2 MET 45 -22.903 -3.604 -5.235 349 HB3 MET 45 HB3 MET 45 -23.986 -4.621 -4.306 350 HG2 MET 45 HG2 MET 45 -23.349 -3.703 -2.276 351 HG3 MET 45 HG3 MET 45 -21.740 -3.264 -2.819 352 HE1 MET 45 HE1 MET 45 -21.042 -1.217 -4.181 353 HE2 MET 45 HE2 MET 45 -22.155 -1.533 -5.522 354 HE3 MET 45 HE3 MET 45 -22.144 0.056 -4.734 355 H GLY 46 H GLY 46 -20.662 -4.007 -6.126 356 HA2 GLY 46 HA2 GLY 46 -18.468 -3.196 -4.329 357 HA3 GLY 46 HA3 GLY 46 -18.026 -4.354 -5.599 358 H LYS 47 H LYS 47 -16.696 -2.210 -5.744 359 HA LYS 47 HA LYS 47 -17.885 -0.737 -8.064 360 HB2 LYS 47 HB2 LYS 47 -17.218 0.612 -5.931 361 HB3 LYS 47 HB3 LYS 47 -15.559 0.208 -6.340 362 HG2 LYS 47 HG2 LYS 47 -15.854 2.310 -7.334 363 HG3 LYS 47 HG3 LYS 47 -16.126 1.215 -8.690 364 HD2 LYS 47 HD2 LYS 47 -17.889 2.784 -8.842 365 HD3 LYS 47 HD3 LYS 47 -18.633 1.363 -8.119 366 HE2 LYS 47 HE2 LYS 47 -18.606 2.352 -5.918 367 HE3 LYS 47 HE3 LYS 47 -17.587 3.691 -6.463 368 HZ1 LYS 47 HZ1 LYS 47 -19.385 4.535 -7.759 369 HZ2 LYS 47 HZ2 LYS 47 -20.320 3.224 -7.522 370 HZ3 LYS 47 HZ3 LYS 47 -19.988 4.242 -6.275 371 H TRP 48 H TRP 48 -17.022 -1.369 -9.921 372 HA TRP 48 HA TRP 48 -14.546 -2.941 -10.073 373 HB2 TRP 48 HB2 TRP 48 -16.561 -3.354 -11.499 374 HB3 TRP 48 HB3 TRP 48 -16.350 -1.781 -12.233 375 HD1 TRP 48 HD1 TRP 48 -12.938 -2.842 -12.141 376 HE1 TRP 48 HE1 TRP 48 -12.183 -4.136 -14.155 377 HE3 TRP 48 HE3 TRP 48 -17.538 -3.848 -14.181 378 HZ2 TRP 48 HZ2 TRP 48 -13.407 -5.609 -16.346 379 HZ3 TRP 48 HZ3 TRP 48 -17.692 -5.247 -16.229 380 HH2 TRP 48 HH2 TRP 48 -15.630 -6.141 -17.298 381 H LYS 49 H LYS 49 -12.766 -1.794 -9.636 382 HA LYS 49 HA LYS 49 -12.525 1.084 -10.089 383 HB2 LYS 49 HB2 LYS 49 -10.466 -0.924 -9.067 384 HB3 LYS 49 HB3 LYS 49 -10.446 0.821 -8.833 385 HG2 LYS 49 HG2 LYS 49 -12.459 -1.135 -7.624 386 HG3 LYS 49 HG3 LYS 49 -11.044 -0.524 -6.809 387 HD2 LYS 49 HD2 LYS 49 -13.268 1.319 -7.799 388 HD3 LYS 49 HD3 LYS 49 -13.247 0.538 -6.215 389 HE2 LYS 49 HE2 LYS 49 -10.847 1.536 -5.978 390 HE3 LYS 49 HE3 LYS 49 -11.341 2.637 -7.276 391 HZ1 LYS 49 HZ1 LYS 49 -13.141 3.401 -5.880 392 HZ2 LYS 49 HZ2 LYS 49 -12.793 2.256 -4.712 393 HZ3 LYS 49 HZ3 LYS 49 -11.757 3.492 -5.017 394 H LYS 50 H LYS 50 -12.930 0.287 -12.508 395 HA LYS 50 HA LYS 50 -11.017 -1.345 -13.864 396 HB2 LYS 50 HB2 LYS 50 -13.372 -0.940 -14.559 397 HB3 LYS 50 HB3 LYS 50 -12.971 0.726 -14.980 398 HG2 LYS 50 HG2 LYS 50 -11.432 -0.040 -16.728 399 HG3 LYS 50 HG3 LYS 50 -11.677 -1.728 -16.262 400 HD2 LYS 50 HD2 LYS 50 -13.857 0.127 -17.332 401 HD3 LYS 50 HD3 LYS 50 -12.928 -1.022 -18.309 402 HE2 LYS 50 HE2 LYS 50 -13.746 -2.891 -16.861 403 HE3 LYS 50 HE3 LYS 50 -14.751 -1.747 -15.967 404 HZ1 LYS 50 HZ1 LYS 50 -15.942 -1.292 -18.046 405 HZ2 LYS 50 HZ2 LYS 50 -15.015 -2.370 -18.854 406 HZ3 LYS 50 HZ3 LYS 50 -16.013 -2.880 -17.671 407 H LYS 51 H LYS 51 -9.178 -0.806 -15.126 408 HA LYS 51 HA LYS 51 -8.234 2.031 -14.947 409 HB2 LYS 51 HB2 LYS 51 -7.364 0.196 -13.284 410 HB3 LYS 51 HB3 LYS 51 -6.442 -0.402 -14.664 411 HG2 LYS 51 HG2 LYS 51 -5.396 1.869 -14.888 412 HG3 LYS 51 HG3 LYS 51 -6.358 2.428 -13.507 413 HD2 LYS 51 HD2 LYS 51 -5.271 0.507 -12.178 414 HD3 LYS 51 HD3 LYS 51 -4.165 0.310 -13.535 415 HE2 LYS 51 HE2 LYS 51 -4.543 2.815 -11.821 416 HE3 LYS 51 HE3 LYS 51 -3.186 1.691 -11.734 417 HZ1 LYS 51 HZ1 LYS 51 -3.838 3.439 -14.041 418 HZ2 LYS 51 HZ2 LYS 51 -2.589 3.621 -13.004 419 HZ3 LYS 51 HZ3 LYS 51 -2.606 2.342 -14.014 420 H SER 52 H SER 52 -9.596 0.629 -17.198 421 HA SER 52 HA SER 52 -7.426 0.643 -19.246 422 HB2 SER 52 HB2 SER 52 -9.574 -1.485 -18.934 423 HB3 SER 52 HB3 SER 52 -8.204 -1.505 -20.059 424 HG SER 52 HG SER 52 -7.802 -2.822 -18.256 425 H ARG 53 H ARG 53 -9.956 2.452 -18.628 426 HA ARG 53 HA ARG 53 -11.726 1.849 -20.882 427 HB2 ARG 53 HB2 ARG 53 -12.435 2.689 -18.579 428 HB3 ARG 53 HB3 ARG 53 -11.812 4.275 -19.061 429 HG2 ARG 53 HG2 ARG 53 -13.407 4.174 -21.059 430 HG3 ARG 53 HG3 ARG 53 -14.046 2.662 -20.385 431 HD2 ARG 53 HD2 ARG 53 -14.639 3.894 -18.288 432 HD3 ARG 53 HD3 ARG 53 -14.032 5.390 -19.033 433 HE ARG 53 HE ARG 53 -15.995 4.133 -20.705 434 HH11 ARG 53 HH11 ARG 53 -15.708 6.123 -17.744 435 HH12 ARG 53 HH12 ARG 53 -17.308 6.768 -17.892 436 HH21 ARG 53 HH21 ARG 53 -18.100 5.029 -20.880 437 HH22 ARG 53 HH22 ARG 53 -18.682 6.146 -19.707 438 H LYS 54 H LYS 54 -9.546 2.074 -22.203 439 HA LYS 54 HA LYS 54 -8.141 3.156 -23.596 440 HB2 LYS 54 HB2 LYS 54 -10.446 5.091 -24.038 441 HB3 LYS 54 HB3 LYS 54 -9.031 4.891 -25.075 442 HG2 LYS 54 HG2 LYS 54 -9.664 2.497 -25.450 443 HG3 LYS 54 HG3 LYS 54 -11.156 2.768 -24.541 444 HD2 LYS 54 HD2 LYS 54 -10.347 4.227 -27.094 445 HD3 LYS 54 HD3 LYS 54 -11.481 2.873 -26.992 446 HE2 LYS 54 HE2 LYS 54 -12.960 4.223 -25.509 447 HE3 LYS 54 HE3 LYS 54 -11.847 5.590 -25.649 448 HZ1 LYS 54 HZ1 LYS 54 -12.299 5.629 -28.033 449 HZ2 LYS 54 HZ2 LYS 54 -13.332 4.368 -27.903 450 HZ3 LYS 54 HZ3 LYS 54 -13.684 5.790 -27.193 451 H THR 55 H THR 55 -8.022 3.809 -20.771 452 HA THR 55 HA THR 55 -6.066 5.879 -20.975 453 HB THR 55 HB THR 55 -8.033 7.322 -20.585 454 HG1 THR 55 HG1 THR 55 -6.290 8.072 -19.566 455 HG21 THR 55 HG21 THR 55 -9.326 7.236 -18.505 456 HG22 THR 55 HG22 THR 55 -9.589 5.772 -19.453 457 HG23 THR 55 HG23 THR 55 -8.530 5.720 -18.034 458 H SER 56 H SER 56 -4.698 5.772 -19.066 459 HA SER 56 HA SER 56 -4.804 3.247 -17.566 460 HB2 SER 56 HB2 SER 56 -2.869 5.592 -17.353 461 HB3 SER 56 HB3 SER 56 -2.638 3.953 -16.721 462 HG SER 56 HG SER 56 -1.545 4.300 -18.715 463 H THR 57 H THR 57 -6.287 6.303 -17.261 464 HA THR 57 HA THR 57 -6.059 6.725 -14.435 465 HB THR 57 HB THR 57 -8.366 7.562 -16.226 466 HG1 THR 57 HG1 THR 57 -6.691 8.246 -17.373 467 HG21 THR 57 HG21 THR 57 -8.339 9.601 -14.808 468 HG22 THR 57 HG22 THR 57 -8.621 8.150 -13.844 469 HG23 THR 57 HG23 THR 57 -7.016 8.911 -13.839 470 H ILE 58 H ILE 58 -7.419 6.026 -12.748 471 HA ILE 58 HA ILE 58 -8.945 3.604 -13.095 472 HB ILE 58 HB ILE 58 -8.570 5.599 -10.857 473 HG12 ILE 58 HG12 ILE 58 -6.714 3.975 -11.566 474 HG13 ILE 58 HG13 ILE 58 -7.144 4.030 -9.859 475 HG21 ILE 58 HG21 ILE 58 -10.790 4.796 -10.426 476 HG22 ILE 58 HG22 ILE 58 -10.328 3.116 -10.755 477 HG23 ILE 58 HG23 ILE 58 -9.700 3.962 -9.319 478 HD11 ILE 58 HD11 ILE 58 -6.732 1.735 -10.707 479 HD12 ILE 58 HD12 ILE 58 -8.354 1.918 -10.039 480 HD13 ILE 58 HD13 ILE 58 -8.119 1.902 -11.804 481 H GLU 59 H GLU 59 -11.091 3.326 -13.240 482 HA GLU 59 HA GLU 59 -13.002 5.594 -13.325 483 HB2 GLU 59 HB2 GLU 59 -12.778 3.094 -15.077 484 HB3 GLU 59 HB3 GLU 59 -14.209 4.114 -15.022 485 HG2 GLU 59 HG2 GLU 59 -11.450 5.126 -15.866 486 HG3 GLU 59 HG3 GLU 59 -12.641 4.463 -16.960 487 H GLU 60 H GLU 60 -15.086 4.897 -12.443 488 HA GLU 60 HA GLU 60 -14.864 2.525 -10.635 489 HB2 GLU 60 HB2 GLU 60 -15.742 5.380 -10.037 490 HB3 GLU 60 HB3 GLU 60 -15.992 4.012 -8.956 491 HG2 GLU 60 HG2 GLU 60 -13.487 3.591 -9.029 492 HG3 GLU 60 HG3 GLU 60 -13.323 5.127 -9.888 493 H LYS 61 H LYS 61 -16.221 1.135 -11.602 494 HA LYS 61 HA LYS 61 -18.920 2.062 -12.491 495 HB2 LYS 61 HB2 LYS 61 -16.918 0.008 -13.378 496 HB3 LYS 61 HB3 LYS 61 -18.605 -0.477 -13.494 497 HG2 LYS 61 HG2 LYS 61 -17.568 2.144 -14.638 498 HG3 LYS 61 HG3 LYS 61 -17.555 0.622 -15.531 499 HD2 LYS 61 HD2 LYS 61 -20.196 0.857 -14.441 500 HD3 LYS 61 HD3 LYS 61 -19.776 2.462 -15.070 501 HE2 LYS 61 HE2 LYS 61 -19.183 1.457 -17.251 502 HE3 LYS 61 HE3 LYS 61 -19.482 -0.164 -16.588 503 HZ1 LYS 61 HZ1 LYS 61 -21.569 1.923 -16.832 504 HZ2 LYS 61 HZ2 LYS 61 -21.370 0.669 -17.871 505 HZ3 LYS 61 HZ3 LYS 61 -21.778 0.351 -16.336 506 H THR 62 H THR 62 -20.383 1.834 -10.848 507 HA THR 62 HA THR 62 -20.134 -0.042 -8.738 508 HB THR 62 HB THR 62 -22.750 1.159 -9.697 509 HG1 THR 62 HG1 THR 62 -22.116 3.090 -9.089 510 HG21 THR 62 HG21 THR 62 -21.535 0.785 -6.915 511 HG22 THR 62 HG22 THR 62 -23.174 1.372 -7.283 512 HG23 THR 62 HG23 THR 62 -22.728 -0.302 -7.650 513 H VAL 63 H VAL 63 -20.694 -2.114 -8.532 514 HA VAL 63 HA VAL 63 -22.383 -3.399 -10.633 515 HB VAL 63 HB VAL 63 -20.724 -5.306 -10.605 516 HG11 VAL 63 HG11 VAL 63 -20.952 -3.773 -12.523 517 HG12 VAL 63 HG12 VAL 63 -19.712 -2.710 -11.829 518 HG13 VAL 63 HG13 VAL 63 -19.293 -4.358 -12.332 519 HG21 VAL 63 HG21 VAL 63 -19.365 -4.648 -8.628 520 HG22 VAL 63 HG22 VAL 63 -18.383 -4.879 -10.081 521 HG23 VAL 63 HG23 VAL 63 -18.758 -3.239 -9.526 522 H GLU 64 H GLU 64 -23.477 -5.234 -10.042 523 HA GLU 64 HA GLU 64 -23.541 -5.906 -7.126 524 HB2 GLU 64 HB2 GLU 64 -25.726 -5.283 -8.121 525 HB3 GLU 64 HB3 GLU 64 -25.533 -6.533 -9.352 526 HG2 GLU 64 HG2 GLU 64 -25.535 -8.275 -7.590 527 HG3 GLU 64 HG3 GLU 64 -25.619 -7.026 -6.346 528 H VAL 65 H VAL 65 -22.511 -7.826 -6.657 529 HA VAL 65 HA VAL 65 -21.256 -9.273 -8.923 530 HB VAL 65 HB VAL 65 -20.524 -9.420 -5.977 531 HG11 VAL 65 HG11 VAL 65 -19.004 -9.997 -8.561 532 HG12 VAL 65 HG12 VAL 65 -18.332 -10.154 -6.927 533 HG13 VAL 65 HG13 VAL 65 -19.651 -11.215 -7.440 534 HG21 VAL 65 HG21 VAL 65 -18.680 -7.822 -6.435 535 HG22 VAL 65 HG22 VAL 65 -19.379 -7.472 -8.026 536 HG23 VAL 65 HG23 VAL 65 -20.260 -7.056 -6.542 537 H LEU 66 H LEU 66 -22.273 -11.114 -9.503 538 HA LEU 66 HA LEU 66 -24.468 -12.078 -7.836 539 HB2 LEU 66 HB2 LEU 66 -23.456 -13.134 -10.513 540 HB3 LEU 66 HB3 LEU 66 -24.912 -13.629 -9.689 541 HG LEU 66 HG LEU 66 -25.698 -12.268 -11.346 542 HD11 LEU 66 HD11 LEU 66 -25.493 -10.314 -9.020 543 HD12 LEU 66 HD12 LEU 66 -26.703 -10.322 -10.314 544 HD13 LEU 66 HD13 LEU 66 -26.665 -11.648 -9.140 545 HD21 LEU 66 HD21 LEU 66 -23.658 -10.101 -10.749 546 HD22 LEU 66 HD22 LEU 66 -23.540 -11.299 -12.058 547 HD23 LEU 66 HD23 LEU 66 -24.863 -10.130 -12.044 548 H GLY 67 H GLY 67 -21.163 -13.155 -8.562 549 HA2 GLY 67 HA2 GLY 67 -20.716 -14.913 -6.542 550 HA3 GLY 67 HA3 GLY 67 -21.582 -15.886 -7.755 551 H MET 68 H MET 68 -19.272 -16.859 -7.595 552 HA MET 68 HA MET 68 -17.134 -15.608 -9.101 553 HB2 MET 68 HB2 MET 68 -17.704 -18.537 -8.473 554 HB3 MET 68 HB3 MET 68 -16.245 -17.942 -9.262 555 HG2 MET 68 HG2 MET 68 -17.145 -17.215 -6.458 556 HG3 MET 68 HG3 MET 68 -15.892 -18.378 -6.870 557 HE1 MET 68 HE1 MET 68 -13.498 -17.846 -7.666 558 HE2 MET 68 HE2 MET 68 -14.151 -17.071 -9.130 559 HE3 MET 68 HE3 MET 68 -12.940 -16.230 -8.149 560 H ALA 69 H ALA 69 -16.422 -16.162 -11.179 561 HA ALA 69 HA ALA 69 -18.428 -16.535 -13.251 562 HB1 ALA 69 HB1 ALA 69 -16.488 -16.322 -14.725 563 HB2 ALA 69 HB2 ALA 69 -16.346 -15.137 -13.431 564 HB3 ALA 69 HB3 ALA 69 -15.391 -16.640 -13.372 565 HA PRO 70 HA PRO 70 -18.198 -20.996 -13.880 566 HB2 PRO 70 HB2 PRO 70 -16.796 -20.444 -16.504 567 HB3 PRO 70 HB3 PRO 70 -18.121 -21.602 -16.159 568 HG2 PRO 70 HG2 PRO 70 -18.689 -19.229 -17.320 569 HG3 PRO 70 HG3 PRO 70 -19.721 -19.820 -15.976 570 HD2 PRO 70 HD2 PRO 70 -17.478 -17.803 -15.885 571 HD3 PRO 70 HD3 PRO 70 -19.093 -17.715 -15.113 572 H ASP 71 H ASP 71 -16.730 -22.725 -13.608 573 HA ASP 71 HA ASP 71 -14.223 -22.141 -12.475 574 HB2 ASP 71 HB2 ASP 71 -13.899 -24.418 -12.215 575 HB3 ASP 71 HB3 ASP 71 -15.645 -24.236 -12.143 576 H ASP 72 H ASP 72 -15.127 -22.717 -15.828 577 HA ASP 72 HA ASP 72 -12.544 -23.302 -16.887 578 HB2 ASP 72 HB2 ASP 72 -14.634 -23.693 -18.118 579 HB3 ASP 72 HB3 ASP 72 -14.938 -21.954 -18.186 580 H GLU 73 H GLU 73 -14.117 -20.225 -16.021 581 HA GLU 73 HA GLU 73 -11.996 -18.570 -17.234 582 HB2 GLU 73 HB2 GLU 73 -14.187 -17.858 -15.225 583 HB3 GLU 73 HB3 GLU 73 -13.129 -16.723 -16.042 584 HG2 GLU 73 HG2 GLU 73 -15.272 -18.469 -17.318 585 HG3 GLU 73 HG3 GLU 73 -15.342 -16.733 -17.055 586 H CYS 74 H CYS 74 -13.044 -19.822 -14.062 587 HA CYS 74 HA CYS 74 -11.119 -18.321 -12.573 588 HB2 CYS 74 HB2 CYS 74 -12.892 -20.658 -11.770 589 HB3 CYS 74 HB3 CYS 74 -11.987 -19.630 -10.660 590 HG CYS 74 HG CYS 74 -14.464 -18.932 -12.717 591 H LEU 75 H LEU 75 -10.264 -20.665 -14.583 592 HA LEU 75 HA LEU 75 -8.750 -22.413 -12.809 593 HB2 LEU 75 HB2 LEU 75 -9.572 -22.360 -15.649 594 HB3 LEU 75 HB3 LEU 75 -7.932 -22.943 -15.448 595 HG LEU 75 HG LEU 75 -10.261 -24.046 -13.827 596 HD11 LEU 75 HD11 LEU 75 -10.288 -25.934 -15.402 597 HD12 LEU 75 HD12 LEU 75 -10.684 -24.413 -16.213 598 HD13 LEU 75 HD13 LEU 75 -9.067 -25.124 -16.414 599 HD21 LEU 75 HD21 LEU 75 -8.755 -25.957 -13.448 600 HD22 LEU 75 HD22 LEU 75 -7.489 -25.167 -14.412 601 HD23 LEU 75 HD23 LEU 75 -7.999 -24.473 -12.863 602 H LYS 76 H LYS 76 -8.114 -19.323 -13.906 603 HA LYS 76 HA LYS 76 -5.185 -19.725 -13.580 604 HB2 LYS 76 HB2 LYS 76 -4.726 -18.388 -15.577 605 HB3 LYS 76 HB3 LYS 76 -5.579 -19.885 -15.958 606 HG2 LYS 76 HG2 LYS 76 -7.717 -18.598 -16.169 607 HG3 LYS 76 HG3 LYS 76 -6.830 -17.099 -15.828 608 HD2 LYS 76 HD2 LYS 76 -5.434 -17.461 -17.839 609 HD3 LYS 76 HD3 LYS 76 -6.290 -18.986 -18.164 610 HE2 LYS 76 HE2 LYS 76 -8.433 -17.733 -18.360 611 HE3 LYS 76 HE3 LYS 76 -7.572 -16.217 -18.061 612 HZ1 LYS 76 HZ1 LYS 76 -7.115 -18.005 -20.382 613 HZ2 LYS 76 HZ2 LYS 76 -7.915 -16.588 -20.420 614 HZ3 LYS 76 HZ3 LYS 76 -6.318 -16.604 -20.106 615 H ASP 77 H ASP 77 -7.977 -17.681 -13.152 616 HA ASP 77 HA ASP 77 -6.510 -15.836 -11.436 617 HB2 ASP 77 HB2 ASP 77 -6.055 -14.918 -13.683 618 HB3 ASP 77 HB3 ASP 77 -7.760 -14.951 -14.076 619 H MET 78 H MET 78 -8.185 -14.685 -10.051 620 HA MET 78 HA MET 78 -10.684 -16.217 -9.984 621 HB2 MET 78 HB2 MET 78 -9.638 -13.963 -8.248 622 HB3 MET 78 HB3 MET 78 -11.164 -14.793 -7.975 623 HG2 MET 78 HG2 MET 78 -8.448 -16.164 -7.987 624 HG3 MET 78 HG3 MET 78 -9.266 -15.561 -6.563 625 HE1 MET 78 HE1 MET 78 -10.007 -19.548 -8.668 626 HE2 MET 78 HE2 MET 78 -10.793 -18.234 -9.555 627 HE3 MET 78 HE3 MET 78 -9.041 -18.198 -9.292 628 H TYR 79 H TYR 79 -12.500 -15.706 -11.005 629 HA TYR 79 HA TYR 79 -12.945 -12.895 -11.914 630 HB2 TYR 79 HB2 TYR 79 -13.415 -15.557 -13.304 631 HB3 TYR 79 HB3 TYR 79 -14.209 -14.074 -13.799 632 HD1 TYR 79 HD2 TYR 79 -12.861 -12.118 -14.630 633 HD2 TYR 79 HD1 TYR 79 -11.191 -16.054 -14.072 634 HE1 TYR 79 HE2 TYR 79 -11.025 -11.550 -16.187 635 HE2 TYR 79 HE1 TYR 79 -9.387 -15.525 -15.662 636 HH TYR 79 HH TYR 79 -8.427 -13.885 -17.040 637 H VAL 80 H VAL 80 -15.117 -12.195 -11.896 638 HA VAL 80 HA VAL 80 -17.107 -13.930 -10.511 639 HB VAL 80 HB VAL 80 -17.791 -11.834 -9.289 640 HG11 VAL 80 HG11 VAL 80 -15.077 -12.999 -8.559 641 HG12 VAL 80 HG12 VAL 80 -16.176 -12.117 -7.473 642 HG13 VAL 80 HG13 VAL 80 -16.669 -13.668 -8.142 643 HG21 VAL 80 HG21 VAL 80 -14.976 -10.833 -9.925 644 HG22 VAL 80 HG22 VAL 80 -16.470 -10.166 -10.614 645 HG23 VAL 80 HG23 VAL 80 -16.179 -10.064 -8.873 646 H GLU 81 H GLU 81 -19.261 -13.478 -10.991 647 HA GLU 81 HA GLU 81 -19.719 -12.172 -13.618 648 HB2 GLU 81 HB2 GLU 81 -21.559 -13.665 -11.694 649 HB3 GLU 81 HB3 GLU 81 -22.074 -12.968 -13.234 650 HG2 GLU 81 HG2 GLU 81 -20.014 -15.175 -12.885 651 HG3 GLU 81 HG3 GLU 81 -21.689 -15.408 -13.347 652 H VAL 82 H VAL 82 -20.751 -10.188 -13.790 653 HA VAL 82 HA VAL 82 -21.609 -8.830 -11.307 654 HB VAL 82 HB VAL 82 -20.309 -6.816 -12.198 655 HG11 VAL 82 HG11 VAL 82 -18.314 -7.435 -10.977 656 HG12 VAL 82 HG12 VAL 82 -19.746 -8.073 -10.163 657 HG13 VAL 82 HG13 VAL 82 -18.706 -9.162 -11.109 658 HG21 VAL 82 HG21 VAL 82 -19.664 -7.751 -14.432 659 HG22 VAL 82 HG22 VAL 82 -18.304 -7.161 -13.479 660 HG23 VAL 82 HG23 VAL 82 -18.599 -8.908 -13.604 661 H ALA 83 H ALA 83 -23.295 -7.529 -11.538 662 HA ALA 83 HA ALA 83 -24.427 -7.143 -14.279 663 HB1 ALA 83 HB1 ALA 83 -25.754 -7.007 -11.549 664 HB2 ALA 83 HB2 ALA 83 -26.529 -6.590 -13.096 665 HB3 ALA 83 HB3 ALA 83 -25.998 -8.253 -12.799 666 H ASP 84 H ASP 84 -24.590 -5.082 -15.044 667 HA ASP 84 HA ASP 84 -22.839 -3.128 -13.757 668 HB2 ASP 84 HB2 ASP 84 -22.646 -3.680 -16.129 669 HB3 ASP 84 HB3 ASP 84 -24.322 -3.170 -16.400 670 H ILE 85 H ILE 85 -24.556 -3.104 -11.936 671 HA ILE 85 HA ILE 85 -26.933 -1.575 -12.277 672 HB ILE 85 HB ILE 85 -26.921 -1.257 -9.880 673 HG12 ILE 85 HG12 ILE 85 -24.185 -2.547 -9.816 674 HG13 ILE 85 HG13 ILE 85 -24.475 -0.827 -9.567 675 HG21 ILE 85 HG21 ILE 85 -27.149 -3.582 -9.285 676 HG22 ILE 85 HG22 ILE 85 -27.599 -3.432 -10.980 677 HG23 ILE 85 HG23 ILE 85 -26.008 -4.092 -10.547 678 HD11 ILE 85 HD11 ILE 85 -25.819 -1.306 -7.562 679 HD12 ILE 85 HD12 ILE 85 -25.552 -3.049 -7.778 680 HD13 ILE 85 HD13 ILE 85 -24.189 -1.997 -7.423 681 H GLY 86 H GLY 86 -23.648 -0.519 -12.378 682 HA2 GLY 86 HA2 GLY 86 -24.229 2.314 -11.941 683 HA3 GLY 86 HA3 GLY 86 -22.701 1.570 -12.436 684 H GLY 87 H GLY 87 -24.979 0.250 -14.523 685 HA2 GLY 87 HA2 GLY 87 -25.226 2.532 -16.377 686 HA3 GLY 87 HA3 GLY 87 -24.173 1.205 -16.878 687 H LYS 88 H LYS 88 -25.081 -0.846 -17.385 688 HA LYS 88 HA LYS 88 -27.553 -0.640 -18.751 689 HB2 LYS 88 HB2 LYS 88 -26.221 -3.229 -17.828 690 HB3 LYS 88 HB3 LYS 88 -27.428 -3.067 -19.093 691 HG2 LYS 88 HG2 LYS 88 -24.556 -2.111 -19.172 692 HG3 LYS 88 HG3 LYS 88 -25.323 -3.386 -20.122 693 HD2 LYS 88 HD2 LYS 88 -26.841 -1.571 -21.113 694 HD3 LYS 88 HD3 LYS 88 -25.769 -0.381 -20.364 695 HE2 LYS 88 HE2 LYS 88 -25.037 -2.485 -22.445 696 HE3 LYS 88 HE3 LYS 88 -25.176 -0.744 -22.710 697 HZ1 LYS 88 HZ1 LYS 88 -23.128 -2.126 -21.085 698 HZ2 LYS 88 HZ2 LYS 88 -22.891 -1.316 -22.479 699 HZ3 LYS 88 HZ3 LYS 88 -23.289 -0.483 -21.134 700 H ASP 89 H ASP 89 -26.895 -1.843 -15.528 701 HA ASP 89 HA ASP 89 -28.010 -2.609 -13.813 702 HB2 ASP 89 HB2 ASP 89 -29.084 -0.424 -13.914 703 HB3 ASP 89 HB3 ASP 89 -30.337 -1.061 -14.982 704 H ASP 90 H ASP 90 -29.519 -3.409 -16.837 705 HA ASP 90 HA ASP 90 -30.892 -5.772 -15.668 706 HB2 ASP 90 HB2 ASP 90 -32.199 -3.924 -16.750 707 HB3 ASP 90 HB3 ASP 90 -31.317 -4.242 -18.248 708 H ASP 91 H ASP 91 -27.977 -5.324 -16.817 709 HA ASP 91 HA ASP 91 -27.928 -7.868 -18.320 710 HB2 ASP 91 HB2 ASP 91 -27.855 -5.886 -19.949 711 HB3 ASP 91 HB3 ASP 91 -26.267 -5.527 -19.246 712 H VAL 92 H VAL 92 -25.736 -8.734 -18.464 713 HA VAL 92 HA VAL 92 -24.136 -8.200 -16.030 714 HB VAL 92 HB VAL 92 -25.884 -9.788 -15.492 715 HG11 VAL 92 HG11 VAL 92 -26.433 -10.706 -17.698 716 HG12 VAL 92 HG12 VAL 92 -24.869 -11.551 -17.756 717 HG13 VAL 92 HG13 VAL 92 -26.091 -11.997 -16.549 718 HG21 VAL 92 HG21 VAL 92 -23.742 -10.190 -14.397 719 HG22 VAL 92 HG22 VAL 92 -24.624 -11.690 -14.659 720 HG23 VAL 92 HG23 VAL 92 -23.250 -11.289 -15.706 721 H TYR 93 H TYR 93 -22.058 -8.946 -16.043 722 HA TYR 93 HA TYR 93 -20.776 -9.871 -18.553 723 HB2 TYR 93 HB2 TYR 93 -19.912 -7.484 -16.853 724 HB3 TYR 93 HB3 TYR 93 -19.092 -8.088 -18.278 725 HD1 TYR 93 HD1 TYR 93 -20.032 -7.742 -20.551 726 HD2 TYR 93 HD2 TYR 93 -21.869 -6.034 -17.038 727 HE1 TYR 93 HE1 TYR 93 -21.256 -6.138 -21.980 728 HE2 TYR 93 HE2 TYR 93 -23.115 -4.438 -18.462 729 HH TYR 93 HH TYR 93 -22.754 -4.390 -22.046 730 H THR 94 H THR 94 -18.200 -9.896 -17.714 731 HA THR 94 HA THR 94 -18.100 -11.194 -15.039 732 HB THR 94 HB THR 94 -16.401 -11.867 -17.468 733 HG1 THR 94 HG1 THR 94 -18.489 -13.433 -16.359 734 HG21 THR 94 HG21 THR 94 -16.651 -13.209 -14.748 735 HG22 THR 94 HG22 THR 94 -15.794 -13.907 -16.143 736 HG23 THR 94 HG23 THR 94 -15.224 -12.400 -15.419 737 H ALA 95 H ALA 95 -16.263 -10.593 -13.813 738 HA ALA 95 HA ALA 95 -14.374 -8.622 -14.969 739 HB1 ALA 95 HB1 ALA 95 -16.028 -7.229 -13.835 740 HB2 ALA 95 HB2 ALA 95 -15.929 -8.241 -12.372 741 HB3 ALA 95 HB3 ALA 95 -14.541 -7.252 -12.876 742 H LYS 96 H LYS 96 -12.379 -8.542 -13.849 743 HA LYS 96 HA LYS 96 -11.559 -11.055 -12.549 744 HB2 LYS 96 HB2 LYS 96 -9.395 -9.580 -12.270 745 HB3 LYS 96 HB3 LYS 96 -9.760 -10.360 -13.791 746 HG2 LYS 96 HG2 LYS 96 -10.733 -7.534 -13.426 747 HG3 LYS 96 HG3 LYS 96 -9.001 -7.798 -13.636 748 HD2 LYS 96 HD2 LYS 96 -9.252 -8.729 -15.790 749 HD3 LYS 96 HD3 LYS 96 -10.967 -9.034 -15.578 750 HE2 LYS 96 HE2 LYS 96 -10.578 -7.198 -17.131 751 HE3 LYS 96 HE3 LYS 96 -11.515 -6.672 -15.737 752 HZ1 LYS 96 HZ1 LYS 96 -8.596 -6.233 -15.825 753 HZ2 LYS 96 HZ2 LYS 96 -9.627 -5.210 -16.561 754 HZ3 LYS 96 HZ3 LYS 96 -9.745 -5.397 -14.961 755 H LEU 97 H LEU 97 -11.546 -11.313 -10.359 756 HA LEU 97 HA LEU 97 -12.884 -9.420 -8.690 757 HB2 LEU 97 HB2 LEU 97 -12.767 -11.867 -8.262 758 HB3 LEU 97 HB3 LEU 97 -11.033 -11.729 -7.956 759 HG LEU 97 HG LEU 97 -11.464 -10.316 -5.971 760 HD11 LEU 97 HD11 LEU 97 -14.409 -10.706 -6.692 761 HD12 LEU 97 HD12 LEU 97 -13.839 -10.119 -5.121 762 HD13 LEU 97 HD13 LEU 97 -13.533 -9.164 -6.566 763 HD21 LEU 97 HD21 LEU 97 -11.362 -12.784 -5.784 764 HD22 LEU 97 HD22 LEU 97 -12.416 -12.068 -4.562 765 HD23 LEU 97 HD23 LEU 97 -13.128 -12.862 -5.985 766 H SER 98 H SER 98 -9.485 -9.950 -9.496 767 HA SER 98 HA SER 98 -8.048 -8.394 -7.761 768 HB2 SER 98 HB2 SER 98 -7.692 -8.345 -10.772 769 HB3 SER 98 HB3 SER 98 -6.446 -8.390 -9.516 770 HG SER 98 HG SER 98 -6.876 -10.427 -10.645 771 H ASP 99 H ASP 99 -10.412 -7.270 -10.149 772 HA ASP 99 HA ASP 99 -9.301 -4.524 -10.077 773 HB2 ASP 99 HB2 ASP 99 -9.479 -6.023 -12.171 774 HB3 ASP 99 HB3 ASP 99 -11.222 -5.735 -12.083 775 H ILE 100 H ILE 100 -11.343 -6.062 -8.293 776 HA ILE 100 HA ILE 100 -13.436 -3.939 -8.264 777 HB ILE 100 HB ILE 100 -13.610 -6.907 -8.263 778 HG12 ILE 100 HG12 ILE 100 -15.556 -4.686 -9.019 779 HG13 ILE 100 HG13 ILE 100 -14.321 -5.355 -10.104 780 HG21 ILE 100 HG21 ILE 100 -14.439 -6.523 -5.960 781 HG22 ILE 100 HG22 ILE 100 -15.653 -5.385 -6.601 782 HG23 ILE 100 HG23 ILE 100 -15.690 -7.105 -7.039 783 HD11 ILE 100 HD11 ILE 100 -16.393 -6.335 -10.684 784 HD12 ILE 100 HD12 ILE 100 -15.453 -7.603 -9.865 785 HD13 ILE 100 HD13 ILE 100 -16.777 -6.761 -9.010 786 H GLU 101 H GLU 101 -14.287 -3.367 -6.361 787 HA GLU 101 HA GLU 101 -12.764 -3.927 -3.858 788 HB2 GLU 101 HB2 GLU 101 -12.191 -1.706 -4.694 789 HB3 GLU 101 HB3 GLU 101 -13.901 -1.307 -4.933 790 HG2 GLU 101 HG2 GLU 101 -14.318 -1.324 -2.547 791 HG3 GLU 101 HG3 GLU 101 -12.724 -2.005 -2.222 792 H ALA 102 H ALA 102 -14.115 -4.931 -2.470 793 HA ALA 102 HA ALA 102 -16.955 -5.220 -3.118 794 HB1 ALA 102 HB1 ALA 102 -15.581 -7.066 -2.163 795 HB2 ALA 102 HB2 ALA 102 -15.416 -6.147 -0.649 796 HB3 ALA 102 HB3 ALA 102 -17.018 -6.697 -1.193 797 H ILE 103 H ILE 103 -18.650 -4.243 -2.132 798 HA ILE 103 HA ILE 103 -18.141 -2.232 0.023 799 HB ILE 103 HB ILE 103 -19.721 -2.055 -2.552 800 HG12 ILE 103 HG12 ILE 103 -17.578 -0.228 -1.364 801 HG13 ILE 103 HG13 ILE 103 -17.255 -1.491 -2.551 802 HG21 ILE 103 HG21 ILE 103 -21.183 -1.135 -0.788 803 HG22 ILE 103 HG22 ILE 103 -19.864 -0.077 -0.233 804 HG23 ILE 103 HG23 ILE 103 -20.607 0.136 -1.835 805 HD11 ILE 103 HD11 ILE 103 -17.363 0.589 -3.685 806 HD12 ILE 103 HD12 ILE 103 -18.770 -0.397 -4.161 807 HD13 ILE 103 HD13 ILE 103 -18.958 0.967 -3.025 808 H ASP 104 H ASP 104 -19.509 -2.245 1.684 809 HA ASP 104 HA ASP 104 -21.089 -2.874 3.128 810 HB2 ASP 104 HB2 ASP 104 -22.310 -1.368 1.600 811 HB3 ASP 104 HB3 ASP 104 -22.891 -2.763 0.691 812 H VAL 105 H VAL 105 -19.576 -5.073 2.202 813 HA VAL 105 HA VAL 105 -21.565 -7.279 2.252 814 HB VAL 105 HB VAL 105 -19.887 -6.997 0.335 815 HG11 VAL 105 HG11 VAL 105 -17.710 -8.048 0.566 816 HG12 VAL 105 HG12 VAL 105 -17.819 -6.619 1.606 817 HG13 VAL 105 HG13 VAL 105 -17.954 -8.247 2.303 818 HG21 VAL 105 HG21 VAL 105 -19.820 -9.319 -0.044 819 HG22 VAL 105 HG22 VAL 105 -20.048 -9.695 1.679 820 HG23 VAL 105 HG23 VAL 105 -21.348 -8.939 0.756 821 H ASP 106 H ASP 106 -20.752 -9.308 3.437 822 HA ASP 106 HA ASP 106 -20.385 -8.576 6.199 823 HB2 ASP 106 HB2 ASP 106 -21.295 -10.524 6.593 824 HB3 ASP 106 HB3 ASP 106 -21.479 -10.775 4.860 825 H ASP 107 H ASP 107 -18.728 -9.486 7.584 826 HA ASP 107 HA ASP 107 -16.184 -8.612 6.811 827 HB2 ASP 107 HB2 ASP 107 -16.955 -8.705 9.132 828 HB3 ASP 107 HB3 ASP 107 -17.035 -10.467 9.065 829 H ASP 108 H ASP 108 -17.517 -11.983 6.776 830 HA ASP 108 HA ASP 108 -14.888 -13.123 6.414 831 HB2 ASP 108 HB2 ASP 108 -17.057 -14.243 7.323 832 HB3 ASP 108 HB3 ASP 108 -17.466 -14.498 5.619 833 H THR 109 H THR 109 -17.598 -12.273 4.216 834 HA THR 109 HA THR 109 -16.414 -13.096 1.780 835 HB THR 109 HB THR 109 -18.310 -10.753 2.336 836 HG1 THR 109 HG1 THR 109 -19.191 -12.591 3.121 837 HG21 THR 109 HG21 THR 109 -17.586 -12.294 -0.158 838 HG22 THR 109 HG22 THR 109 -19.121 -11.443 -0.025 839 HG23 THR 109 HG23 THR 109 -17.587 -10.544 0.075 840 H GLN 110 H GLN 110 -16.306 -9.868 3.455 841 HA GLN 110 HA GLN 110 -14.682 -8.629 1.528 842 HB2 GLN 110 HB2 GLN 110 -15.994 -7.693 3.621 843 HB3 GLN 110 HB3 GLN 110 -14.479 -7.940 4.481 844 HG2 GLN 110 HG2 GLN 110 -14.943 -6.226 1.995 845 HG3 GLN 110 HG3 GLN 110 -14.750 -5.629 3.635 846 HE21 GLN 110 HE22 GLN 110 -13.091 -6.221 0.738 847 HE22 GLN 110 HE21 GLN 110 -11.461 -6.237 1.362 848 H GLU 111 H GLU 111 -13.716 -10.407 4.531 849 HA GLU 111 HA GLU 111 -10.941 -9.974 4.264 850 HB2 GLU 111 HB2 GLU 111 -12.621 -12.099 5.641 851 HB3 GLU 111 HB3 GLU 111 -10.868 -12.155 5.712 852 HG2 GLU 111 HG2 GLU 111 -12.441 -9.681 6.566 853 HG3 GLU 111 HG3 GLU 111 -12.054 -11.015 7.656 854 H ALA 112 H ALA 112 -13.013 -12.477 2.761 855 HA ALA 112 HA ALA 112 -10.800 -14.078 1.820 856 HB1 ALA 112 HB1 ALA 112 -12.489 -15.182 0.445 857 HB2 ALA 112 HB2 ALA 112 -13.124 -14.934 2.079 858 HB3 ALA 112 HB3 ALA 112 -13.654 -13.876 0.748 859 H ILE 113 H ILE 113 -12.753 -11.420 0.405 860 HA ILE 113 HA ILE 113 -11.487 -11.493 -2.182 861 HB ILE 113 HB ILE 113 -13.043 -9.344 -0.685 862 HG12 ILE 113 HG12 ILE 113 -13.893 -11.153 -3.002 863 HG13 ILE 113 HG13 ILE 113 -14.203 -11.542 -1.325 864 HG21 ILE 113 HG21 ILE 113 -12.130 -9.374 -3.597 865 HG22 ILE 113 HG22 ILE 113 -13.308 -8.228 -2.919 866 HG23 ILE 113 HG23 ILE 113 -11.647 -8.214 -2.347 867 HD11 ILE 113 HD11 ILE 113 -16.187 -10.591 -2.157 868 HD12 ILE 113 HD12 ILE 113 -15.465 -9.373 -1.089 869 HD13 ILE 113 HD13 ILE 113 -15.343 -9.202 -2.863 870 H ALA 114 H ALA 114 -10.867 -9.627 0.839 871 HA ALA 114 HA ALA 114 -8.638 -8.148 -0.083 872 HB1 ALA 114 HB1 ALA 114 -9.791 -7.756 2.088 873 HB2 ALA 114 HB2 ALA 114 -9.128 -9.286 2.705 874 HB3 ALA 114 HB3 ALA 114 -8.040 -7.955 2.277 875 H ASP 115 H ASP 115 -8.879 -11.502 1.181 876 HA ASP 115 HA ASP 115 -6.112 -11.986 1.334 877 HB2 ASP 115 HB2 ASP 115 -8.173 -13.474 2.094 878 HB3 ASP 115 HB3 ASP 115 -7.956 -14.235 0.524 879 H TRP 116 H TRP 116 -8.343 -12.438 -1.443 880 HA TRP 116 HA TRP 116 -6.408 -13.555 -3.242 881 HB2 TRP 116 HB2 TRP 116 -8.729 -13.705 -3.822 882 HB3 TRP 116 HB3 TRP 116 -8.964 -11.970 -3.660 883 HD1 TRP 116 HD1 TRP 116 -8.916 -10.629 -5.804 884 HE1 TRP 116 HE1 TRP 116 -7.962 -10.897 -8.184 885 HE3 TRP 116 HE3 TRP 116 -6.543 -15.144 -5.268 886 HZ2 TRP 116 HZ2 TRP 116 -6.445 -12.810 -9.662 887 HZ3 TRP 116 HZ3 TRP 116 -5.268 -16.099 -7.153 888 HH2 TRP 116 HH2 TRP 116 -5.236 -14.978 -9.362 889 H LEU 117 H LEU 117 -7.358 -10.172 -2.516 890 HA LEU 117 HA LEU 117 -5.714 -9.003 -4.535 891 HB2 LEU 117 HB2 LEU 117 -6.819 -7.903 -1.919 892 HB3 LEU 117 HB3 LEU 117 -5.981 -6.911 -3.103 893 HG LEU 117 HG LEU 117 -8.456 -8.539 -3.836 894 HD11 LEU 117 HD11 LEU 117 -9.088 -7.037 -2.023 895 HD12 LEU 117 HD12 LEU 117 -8.333 -5.659 -2.858 896 HD13 LEU 117 HD13 LEU 117 -9.760 -6.464 -3.554 897 HD21 LEU 117 HD21 LEU 117 -8.638 -6.936 -5.685 898 HD22 LEU 117 HD22 LEU 117 -7.169 -6.103 -5.136 899 HD23 LEU 117 HD23 LEU 117 -7.079 -7.769 -5.739 900 H TYR 118 H TYR 118 -5.088 -9.702 -1.032 901 HA TYR 118 HA TYR 118 -2.450 -8.649 -0.953 902 HB2 TYR 118 HB2 TYR 118 -3.493 -11.086 0.543 903 HB3 TYR 118 HB3 TYR 118 -2.066 -10.153 0.945 904 HD1 TYR 118 HD2 TYR 118 -3.373 -7.313 0.647 905 HD2 TYR 118 HD1 TYR 118 -4.549 -10.964 2.634 906 HE1 TYR 118 HE2 TYR 118 -4.683 -6.003 2.277 907 HE2 TYR 118 HE1 TYR 118 -5.897 -9.666 4.239 908 HH TYR 118 HH TYR 118 -6.081 -6.074 4.138 909 H TRP 119 H TRP 119 -3.581 -12.025 -1.590 910 HA TRP 119 HA TRP 119 -1.060 -13.193 -1.949 911 HB2 TRP 119 HB2 TRP 119 -2.907 -14.630 -1.724 912 HB3 TRP 119 HB3 TRP 119 -3.849 -13.781 -2.946 913 HD1 TRP 119 HD1 TRP 119 -3.687 -14.472 -5.389 914 HE1 TRP 119 HE1 TRP 119 -2.433 -16.209 -6.732 915 HE3 TRP 119 HE3 TRP 119 -0.614 -16.234 -1.687 916 HZ2 TRP 119 HZ2 TRP 119 -0.340 -18.194 -6.257 917 HZ3 TRP 119 HZ3 TRP 119 0.997 -18.059 -2.166 918 HH2 TRP 119 HH2 TRP 119 1.146 -19.041 -4.446 919 H LEU 120 H LEU 120 -3.164 -11.576 -4.374 920 HA LEU 120 HA LEU 120 -1.657 -12.366 -6.623 921 HB2 LEU 120 HB2 LEU 120 -3.975 -11.520 -6.715 922 HB3 LEU 120 HB3 LEU 120 -3.440 -9.933 -6.154 923 HG LEU 120 HG LEU 120 -2.100 -9.643 -8.238 924 HD11 LEU 120 HD11 LEU 120 -1.643 -12.012 -8.794 925 HD12 LEU 120 HD12 LEU 120 -3.379 -12.292 -9.049 926 HD13 LEU 120 HD13 LEU 120 -2.464 -11.210 -10.131 927 HD21 LEU 120 HD21 LEU 120 -4.028 -9.343 -9.741 928 HD22 LEU 120 HD22 LEU 120 -5.020 -10.374 -8.681 929 HD23 LEU 120 HD23 LEU 120 -4.409 -8.812 -8.095 930 H ALA 121 H ALA 121 -1.484 -9.471 -4.536 931 HA ALA 121 HA ALA 121 0.649 -8.204 -6.025 932 HB1 ALA 121 HB1 ALA 121 -0.567 -7.830 -3.259 933 HB2 ALA 121 HB2 ALA 121 0.670 -6.742 -3.949 934 HB3 ALA 121 HB3 ALA 121 -0.929 -6.900 -4.718 935 H ARG 122 H ARG 122 0.496 -10.382 -3.182 936 HA ARG 122 HA ARG 122 3.228 -10.086 -2.446 937 HB2 ARG 122 HB2 ARG 122 1.337 -10.964 -1.013 938 HB3 ARG 122 HB3 ARG 122 1.338 -12.444 -1.961 939 HG2 ARG 122 HG2 ARG 122 2.463 -12.696 0.211 940 HG3 ARG 122 HG3 ARG 122 3.578 -13.013 -1.123 941 HD2 ARG 122 HD2 ARG 122 4.542 -10.781 -0.897 942 HD3 ARG 122 HD3 ARG 122 3.366 -10.355 0.366 943 HE ARG 122 HE ARG 122 4.592 -12.549 1.419 944 HH11 ARG 122 HH11 ARG 122 5.823 -9.506 0.071 945 HH12 ARG 122 HH12 ARG 122 7.323 -9.563 0.944 946 HH21 ARG 122 HH21 ARG 122 6.401 -12.477 2.781 947 HH22 ARG 122 HH22 ARG 122 7.671 -11.313 2.526 948 H GLY 123 H GLY 123 1.729 -11.971 -4.998 949 HA2 GLY 123 HA2 GLY 123 4.343 -13.233 -5.683 950 HA3 GLY 123 HA3 GLY 123 2.926 -14.245 -5.373 951 H TYR 124 H TYR 124 1.655 -14.714 -7.130 952 HA TYR 124 HA TYR 124 1.245 -12.763 -9.245 953 HB2 TYR 124 HB2 TYR 124 3.241 -14.147 -9.992 954 HB3 TYR 124 HB3 TYR 124 2.221 -15.580 -9.898 955 HD1 TYR 124 HD1 TYR 124 2.414 -12.169 -11.486 956 HD2 TYR 124 HD2 TYR 124 0.922 -16.208 -11.831 957 HE1 TYR 124 HE1 TYR 124 1.456 -11.622 -13.699 958 HE2 TYR 124 HE2 TYR 124 -0.163 -15.621 -13.989 959 HH TYR 124 HH TYR 124 0.229 -12.392 -15.520 960 H LYS 125 H LYS 125 -0.302 -14.302 -10.862 961 HA LYS 125 HA LYS 125 -2.776 -14.362 -9.489 962 HB2 LYS 125 HB2 LYS 125 -1.996 -15.705 -12.110 963 HB3 LYS 125 HB3 LYS 125 -3.646 -15.455 -11.522 964 HG2 LYS 125 HG2 LYS 125 -3.354 -13.038 -11.532 965 HG3 LYS 125 HG3 LYS 125 -1.670 -13.185 -12.064 966 HD2 LYS 125 HD2 LYS 125 -2.393 -14.250 -14.164 967 HD3 LYS 125 HD3 LYS 125 -4.067 -14.170 -13.651 968 HE2 LYS 125 HE2 LYS 125 -2.238 -11.811 -14.265 969 HE3 LYS 125 HE3 LYS 125 -3.593 -12.396 -15.234 970 HZ1 LYS 125 HZ1 LYS 125 -4.451 -10.606 -14.051 971 HZ2 LYS 125 HZ2 LYS 125 -4.983 -11.891 -13.159 972 HZ3 LYS 125 HZ3 LYS 125 -3.715 -11.000 -12.650 973 H PHE 126 H PHE 126 -0.840 -17.244 -10.593 974 HA PHE 126 HA PHE 126 -1.384 -18.568 -8.107 975 HB2 PHE 126 HB2 PHE 126 -2.402 -19.806 -10.694 976 HB3 PHE 126 HB3 PHE 126 -2.171 -20.687 -9.189 977 HD1 PHE 126 HD1 PHE 126 -3.329 -19.366 -7.023 978 HD2 PHE 126 HD2 PHE 126 -4.612 -19.213 -11.149 979 HE1 PHE 126 HE1 PHE 126 -5.504 -18.467 -6.341 980 HE2 PHE 126 HE2 PHE 126 -6.863 -18.449 -10.411 981 HZ PHE 126 HZ PHE 126 -7.294 -18.066 -7.981 Start of MODEL 19 1 H1 MET 1 H1 MET 1 3.877 -8.159 -5.124 2 H2 MET 1 H2 MET 1 4.830 -7.120 -5.978 3 H3 MET 1 H3 MET 1 5.488 -8.416 -5.223 4 HA MET 1 HA MET 1 5.991 -6.492 -3.941 5 HB2 MET 1 HB2 MET 1 4.143 -5.089 -4.783 6 HB3 MET 1 HB3 MET 1 2.971 -6.056 -3.883 7 HG2 MET 1 HG2 MET 1 4.074 -5.372 -1.753 8 HG3 MET 1 HG3 MET 1 5.230 -4.403 -2.674 9 HE1 MET 1 HE1 MET 1 4.545 -2.472 -0.924 10 HE2 MET 1 HE2 MET 1 2.899 -1.817 -0.774 11 HE3 MET 1 HE3 MET 1 3.253 -3.459 -0.197 12 H ALA 2 H ALA 2 6.842 -8.154 -2.585 13 HA ALA 2 HA ALA 2 5.222 -10.109 -1.333 14 HB1 ALA 2 HB1 ALA 2 7.227 -10.588 0.021 15 HB2 ALA 2 HB2 ALA 2 7.651 -10.358 -1.684 16 HB3 ALA 2 HB3 ALA 2 7.965 -9.061 -0.503 17 H SER 3 H SER 3 6.110 -6.840 -0.255 18 HA SER 3 HA SER 3 5.773 -7.066 2.446 19 HB2 SER 3 HB2 SER 3 5.072 -4.590 0.841 20 HB3 SER 3 HB3 SER 3 5.839 -4.685 2.437 21 HG SER 3 HG SER 3 7.369 -4.251 0.800 22 H VAL 4 H VAL 4 3.145 -7.397 0.264 23 HA VAL 4 HA VAL 4 1.110 -6.111 1.851 24 HB VAL 4 HB VAL 4 -0.460 -7.208 0.354 25 HG11 VAL 4 HG11 VAL 4 0.201 -6.199 -1.712 26 HG12 VAL 4 HG12 VAL 4 0.798 -5.173 -0.403 27 HG13 VAL 4 HG13 VAL 4 1.918 -6.241 -1.278 28 HG21 VAL 4 HG21 VAL 4 1.943 -8.813 -0.633 29 HG22 VAL 4 HG22 VAL 4 0.459 -9.422 0.121 30 HG23 VAL 4 HG23 VAL 4 0.397 -8.687 -1.478 31 H GLU 5 H GLU 5 2.946 -8.806 2.669 32 HA GLU 5 HA GLU 5 1.068 -10.576 3.820 33 HB2 GLU 5 HB2 GLU 5 2.847 -11.078 5.485 34 HB3 GLU 5 HB3 GLU 5 3.356 -11.194 3.809 35 HG2 GLU 5 HG2 GLU 5 4.550 -9.057 3.958 36 HG3 GLU 5 HG3 GLU 5 3.937 -8.786 5.589 37 H ARG 6 H ARG 6 -0.129 -10.549 5.700 38 HA ARG 6 HA ARG 6 -0.258 -7.965 7.231 39 HB2 ARG 6 HB2 ARG 6 -2.458 -10.045 6.882 40 HB3 ARG 6 HB3 ARG 6 -2.600 -8.466 7.634 41 HG2 ARG 6 HG2 ARG 6 -2.097 -8.972 4.663 42 HG3 ARG 6 HG3 ARG 6 -3.655 -8.675 5.409 43 HD2 ARG 6 HD2 ARG 6 -2.981 -6.632 4.423 44 HD3 ARG 6 HD3 ARG 6 -2.854 -6.424 6.181 45 HE ARG 6 HE ARG 6 -0.344 -7.270 5.289 46 HH11 ARG 6 HH11 ARG 6 -2.372 -4.430 4.627 47 HH12 ARG 6 HH12 ARG 6 -1.036 -3.425 4.202 48 HH21 ARG 6 HH21 ARG 6 1.376 -6.000 4.802 49 HH22 ARG 6 HH22 ARG 6 1.190 -4.346 4.310 50 H ASP 7 H ASP 7 -0.761 -11.522 7.463 51 HA ASP 7 HA ASP 7 0.970 -11.723 9.759 52 HB2 ASP 7 HB2 ASP 7 -1.177 -11.125 10.873 53 HB3 ASP 7 HB3 ASP 7 -1.999 -12.416 9.988 54 H GLU 8 H GLU 8 1.803 -13.876 9.732 55 HA GLU 8 HA GLU 8 1.629 -15.064 7.161 56 HB2 GLU 8 HB2 GLU 8 2.947 -16.069 9.724 57 HB3 GLU 8 HB3 GLU 8 3.199 -16.763 8.115 58 HG2 GLU 8 HG2 GLU 8 4.072 -14.584 7.302 59 HG3 GLU 8 HG3 GLU 8 3.884 -13.905 8.920 60 H THR 9 H THR 9 -0.409 -15.694 9.967 61 HA THR 9 HA THR 9 -1.033 -18.434 9.585 62 HB THR 9 HB THR 9 -3.164 -17.755 10.599 63 HG1 THR 9 HG1 THR 9 -2.111 -15.170 10.810 64 HG21 THR 9 HG21 THR 9 -2.249 -16.865 12.725 65 HG22 THR 9 HG22 THR 9 -1.428 -18.315 12.093 66 HG23 THR 9 HG23 THR 9 -0.669 -16.721 11.911 67 H ARG 10 H ARG 10 -1.901 -15.563 7.712 68 HA ARG 10 HA ARG 10 -4.119 -16.724 6.294 69 HB2 ARG 10 HB2 ARG 10 -2.066 -14.699 5.269 70 HB3 ARG 10 HB3 ARG 10 -3.609 -15.079 4.518 71 HG2 ARG 10 HG2 ARG 10 -3.140 -13.626 7.144 72 HG3 ARG 10 HG3 ARG 10 -3.871 -13.012 5.660 73 HD2 ARG 10 HD2 ARG 10 -5.740 -14.742 6.031 74 HD3 ARG 10 HD3 ARG 10 -5.010 -15.036 7.617 75 HE ARG 10 HE ARG 10 -5.676 -12.956 8.376 76 HH11 ARG 10 HH11 ARG 10 -6.538 -13.166 4.888 77 HH12 ARG 10 HH12 ARG 10 -7.759 -11.938 5.039 78 HH21 ARG 10 HH21 ARG 10 -7.247 -11.299 8.460 79 HH22 ARG 10 HH22 ARG 10 -8.154 -10.860 7.046 80 H GLU 11 H GLU 11 -0.593 -16.786 5.605 81 HA GLU 11 HA GLU 11 -0.941 -18.267 3.145 82 HB2 GLU 11 HB2 GLU 11 1.538 -17.794 4.860 83 HB3 GLU 11 HB3 GLU 11 1.521 -18.510 3.241 84 HG2 GLU 11 HG2 GLU 11 0.435 -16.399 2.381 85 HG3 GLU 11 HG3 GLU 11 0.678 -15.672 3.972 86 H HIS 12 H HIS 12 0.014 -19.140 6.523 87 HA HIS 12 HA HIS 12 0.442 -21.895 5.963 88 HB2 HIS 12 HB2 HIS 12 -0.512 -20.583 8.546 89 HB3 HIS 12 HB3 HIS 12 0.074 -22.236 8.401 90 HD1 HIS 12 HD1 HIS 12 2.793 -22.158 7.115 91 HD2 HIS 12 HD2 HIS 12 1.306 -19.064 9.549 92 HE1 HIS 12 HE1 HIS 12 4.823 -20.886 7.969 93 H ARG 13 H ARG 13 -2.578 -20.216 7.074 94 HA ARG 13 HA ARG 13 -4.016 -22.683 7.320 95 HB2 ARG 13 HB2 ARG 13 -4.974 -19.803 7.096 96 HB3 ARG 13 HB3 ARG 13 -6.053 -21.178 7.348 97 HG2 ARG 13 HG2 ARG 13 -4.913 -21.823 9.398 98 HG3 ARG 13 HG3 ARG 13 -3.716 -20.546 9.217 99 HD2 ARG 13 HD2 ARG 13 -6.708 -20.105 9.568 100 HD3 ARG 13 HD3 ARG 13 -5.487 -20.031 10.860 101 HE ARG 13 HE ARG 13 -4.544 -18.256 9.004 102 HH11 ARG 13 HH11 ARG 13 -7.770 -18.564 10.410 103 HH12 ARG 13 HH12 ARG 13 -7.957 -16.892 10.782 104 HH21 ARG 13 HH21 ARG 13 -4.644 -16.009 9.908 105 HH22 ARG 13 HH22 ARG 13 -6.198 -15.407 10.333 106 H ILE 14 H ILE 14 -3.838 -20.331 4.564 107 HA ILE 14 HA ILE 14 -5.805 -21.782 3.112 108 HB ILE 14 HB ILE 14 -5.074 -19.405 2.725 109 HG12 ILE 14 HG12 ILE 14 -5.381 -21.280 0.361 110 HG13 ILE 14 HG13 ILE 14 -6.662 -20.572 1.339 111 HG21 ILE 14 HG21 ILE 14 -2.889 -20.589 0.966 112 HG22 ILE 14 HG22 ILE 14 -3.281 -18.874 1.211 113 HG23 ILE 14 HG23 ILE 14 -2.623 -19.812 2.539 114 HD11 ILE 14 HD11 ILE 14 -6.542 -19.375 -0.718 115 HD12 ILE 14 HD12 ILE 14 -5.959 -18.301 0.570 116 HD13 ILE 14 HD13 ILE 14 -4.803 -19.091 -0.536 117 H GLU 15 H GLU 15 -2.232 -22.104 3.298 118 HA GLU 15 HA GLU 15 -1.980 -24.113 1.293 119 HB2 GLU 15 HB2 GLU 15 -0.109 -22.828 2.133 120 HB3 GLU 15 HB3 GLU 15 -0.337 -23.452 3.772 121 HG2 GLU 15 HG2 GLU 15 0.288 -25.687 3.090 122 HG3 GLU 15 HG3 GLU 15 0.337 -25.208 1.386 123 H THR 16 H THR 16 -2.788 -24.334 4.787 124 HA THR 16 HA THR 16 -2.632 -27.266 4.624 125 HB THR 16 HB THR 16 -2.835 -27.135 7.105 126 HG1 THR 16 HG1 THR 16 -2.438 -24.359 6.727 127 HG21 THR 16 HG21 THR 16 -0.571 -26.271 7.474 128 HG22 THR 16 HG22 THR 16 -0.642 -27.264 6.010 129 HG23 THR 16 HG23 THR 16 -0.576 -25.496 5.874 130 H GLU 17 H GLU 17 -5.161 -25.107 4.068 131 HA GLU 17 HA GLU 17 -7.104 -27.285 4.735 132 HB2 GLU 17 HB2 GLU 17 -7.511 -24.306 5.222 133 HB3 GLU 17 HB3 GLU 17 -8.710 -25.573 5.452 134 HG2 GLU 17 HG2 GLU 17 -7.189 -26.640 7.158 135 HG3 GLU 17 HG3 GLU 17 -6.145 -25.218 7.049 136 H ILE 18 H ILE 18 -6.093 -24.944 2.290 137 HA ILE 18 HA ILE 18 -8.692 -25.385 0.865 138 HB ILE 18 HB ILE 18 -6.939 -22.990 1.301 139 HG12 ILE 18 HG12 ILE 18 -9.967 -23.275 1.491 140 HG13 ILE 18 HG13 ILE 18 -8.920 -23.701 2.832 141 HG21 ILE 18 HG21 ILE 18 -8.250 -21.676 -0.299 142 HG22 ILE 18 HG22 ILE 18 -7.345 -22.924 -1.107 143 HG23 ILE 18 HG23 ILE 18 -9.088 -23.152 -0.840 144 HD11 ILE 18 HD11 ILE 18 -9.851 -21.474 3.122 145 HD12 ILE 18 HD12 ILE 18 -8.084 -21.438 3.034 146 HD13 ILE 18 HD13 ILE 18 -9.060 -20.917 1.642 147 H ILE 19 H ILE 19 -5.139 -25.275 0.354 148 HA ILE 19 HA ILE 19 -5.693 -26.691 -2.221 149 HB ILE 19 HB ILE 19 -3.694 -25.693 -3.199 150 HG12 ILE 19 HG12 ILE 19 -2.783 -24.919 -0.859 151 HG13 ILE 19 HG13 ILE 19 -2.360 -24.104 -2.357 152 HG21 ILE 19 HG21 ILE 19 -4.727 -23.599 -3.891 153 HG22 ILE 19 HG22 ILE 19 -5.899 -24.922 -3.827 154 HG23 ILE 19 HG23 ILE 19 -5.888 -23.693 -2.561 155 HD11 ILE 19 HD11 ILE 19 -4.579 -23.133 -0.538 156 HD12 ILE 19 HD12 ILE 19 -2.896 -22.566 -0.455 157 HD13 ILE 19 HD13 ILE 19 -3.858 -22.273 -1.912 158 H VAL 20 H VAL 20 -5.411 -27.908 0.274 159 HA VAL 20 HA VAL 20 -2.920 -28.770 1.050 160 HB VAL 20 HB VAL 20 -4.123 -30.771 1.985 161 HG11 VAL 20 HG11 VAL 20 -5.451 -28.069 2.444 162 HG12 VAL 20 HG12 VAL 20 -5.466 -29.458 3.552 163 HG13 VAL 20 HG13 VAL 20 -3.939 -28.645 3.180 164 HG21 VAL 20 HG21 VAL 20 -6.571 -30.878 1.894 165 HG22 VAL 20 HG22 VAL 20 -6.630 -29.562 0.713 166 HG23 VAL 20 HG23 VAL 20 -5.892 -31.125 0.289 167 H ASP 21 H ASP 21 -4.805 -30.150 -1.626 168 HA ASP 21 HA ASP 21 -2.582 -32.068 -2.200 169 HB2 ASP 21 HB2 ASP 21 -4.523 -33.089 -1.015 170 HB3 ASP 21 HB3 ASP 21 -5.578 -32.564 -2.327 171 H ALA 22 H ALA 22 -3.882 -29.371 -3.339 172 HA ALA 22 HA ALA 22 -4.508 -30.052 -6.110 173 HB1 ALA 22 HB1 ALA 22 -3.993 -27.397 -4.706 174 HB2 ALA 22 HB2 ALA 22 -4.564 -27.603 -6.371 175 HB3 ALA 22 HB3 ALA 22 -5.585 -28.129 -5.025 176 H GLU 23 H GLU 23 -2.792 -30.990 -7.132 177 HA GLU 23 HA GLU 23 -0.077 -30.350 -6.450 178 HB2 GLU 23 HB2 GLU 23 0.485 -32.150 -7.977 179 HB3 GLU 23 HB3 GLU 23 -0.853 -32.620 -6.932 180 HG2 GLU 23 HG2 GLU 23 -2.460 -32.159 -8.789 181 HG3 GLU 23 HG3 GLU 23 -1.116 -31.704 -9.835 182 H ASP 24 H ASP 24 -2.198 -28.923 -8.750 183 HA ASP 24 HA ASP 24 0.050 -27.749 -10.321 184 HB2 ASP 24 HB2 ASP 24 -0.692 -29.680 -11.558 185 HB3 ASP 24 HB3 ASP 24 -2.390 -29.307 -11.251 186 H LYS 25 H LYS 25 -0.462 -25.726 -11.295 187 HA LYS 25 HA LYS 25 -1.913 -23.984 -9.746 188 HB2 LYS 25 HB2 LYS 25 -1.506 -22.291 -11.296 189 HB3 LYS 25 HB3 LYS 25 -0.121 -23.362 -11.323 190 HG2 LYS 25 HG2 LYS 25 -2.272 -23.065 -13.459 191 HG3 LYS 25 HG3 LYS 25 -0.576 -22.576 -13.552 192 HD2 LYS 25 HD2 LYS 25 0.056 -25.023 -13.289 193 HD3 LYS 25 HD3 LYS 25 -1.677 -25.372 -13.406 194 HE2 LYS 25 HE2 LYS 25 -1.606 -24.205 -15.694 195 HE3 LYS 25 HE3 LYS 25 0.157 -24.354 -15.553 196 HZ1 LYS 25 HZ1 LYS 25 -0.554 -26.825 -14.950 197 HZ2 LYS 25 HZ2 LYS 25 -1.870 -26.444 -15.852 198 HZ3 LYS 25 HZ3 LYS 25 -0.382 -26.349 -16.531 199 H GLU 26 H GLU 26 -3.327 -25.970 -12.345 200 HA GLU 26 HA GLU 26 -5.688 -24.264 -12.619 201 HB2 GLU 26 HB2 GLU 26 -5.097 -27.143 -13.442 202 HB3 GLU 26 HB3 GLU 26 -6.561 -26.268 -13.858 203 HG2 GLU 26 HG2 GLU 26 -5.365 -24.673 -15.211 204 HG3 GLU 26 HG3 GLU 26 -3.808 -25.188 -14.594 205 H GLU 27 H GLU 27 -4.747 -27.230 -10.833 206 HA GLU 27 HA GLU 27 -7.315 -27.667 -9.596 207 HB2 GLU 27 HB2 GLU 27 -4.524 -28.494 -8.679 208 HB3 GLU 27 HB3 GLU 27 -6.042 -29.119 -8.048 209 HG2 GLU 27 HG2 GLU 27 -5.031 -29.427 -10.908 210 HG3 GLU 27 HG3 GLU 27 -4.967 -30.658 -9.653 211 H ARG 28 H ARG 28 -4.400 -25.771 -8.771 212 HA ARG 28 HA ARG 28 -5.323 -25.014 -6.146 213 HB2 ARG 28 HB2 ARG 28 -3.255 -23.772 -8.005 214 HB3 ARG 28 HB3 ARG 28 -3.513 -23.256 -6.335 215 HG2 ARG 28 HG2 ARG 28 -2.845 -25.374 -5.443 216 HG3 ARG 28 HG3 ARG 28 -2.905 -26.160 -7.020 217 HD2 ARG 28 HD2 ARG 28 -1.003 -24.778 -7.788 218 HD3 ARG 28 HD3 ARG 28 -0.852 -24.125 -6.134 219 HE ARG 28 HE ARG 28 -0.917 -26.879 -5.840 220 HH11 ARG 28 HH21 ARG 28 1.203 -24.710 -7.741 221 HH12 ARG 28 HH22 ARG 28 2.598 -25.712 -7.513 222 HH21 ARG 28 HH11 ARG 28 0.912 -28.110 -5.493 223 HH22 ARG 28 HH12 ARG 28 2.423 -27.720 -6.237 224 H ALA 29 H ALA 29 -5.872 -23.633 -9.376 225 HA ALA 29 HA ALA 29 -7.182 -21.238 -8.426 226 HB1 ALA 29 HB1 ALA 29 -8.077 -21.068 -10.688 227 HB2 ALA 29 HB2 ALA 29 -6.363 -21.513 -10.774 228 HB3 ALA 29 HB3 ALA 29 -7.626 -22.736 -11.044 229 H MET 30 H MET 30 -8.298 -24.608 -9.200 230 HA MET 30 HA MET 30 -11.050 -24.064 -8.610 231 HB2 MET 30 HB2 MET 30 -9.526 -26.687 -8.464 232 HB3 MET 30 HB3 MET 30 -11.274 -26.514 -8.349 233 HG2 MET 30 HG2 MET 30 -9.595 -25.740 -10.764 234 HG3 MET 30 HG3 MET 30 -10.518 -27.216 -10.571 235 HE1 MET 30 HE1 MET 30 -11.950 -23.179 -12.039 236 HE2 MET 30 HE2 MET 30 -11.621 -23.092 -10.312 237 HE3 MET 30 HE3 MET 30 -10.340 -23.613 -11.431 238 H GLY 31 H GLY 31 -8.362 -25.152 -6.470 239 HA2 GLY 31 HA2 GLY 31 -9.890 -25.482 -4.120 240 HA3 GLY 31 HA3 GLY 31 -8.190 -24.983 -4.180 241 H TRP 32 H TRP 32 -8.177 -22.512 -5.304 242 HA TRP 32 HA TRP 32 -9.111 -20.723 -3.396 243 HB2 TRP 32 HB2 TRP 32 -8.124 -20.515 -6.215 244 HB3 TRP 32 HB3 TRP 32 -9.061 -19.159 -5.625 245 HD1 TRP 32 HD1 TRP 32 -5.696 -20.786 -5.184 246 HE1 TRP 32 HE1 TRP 32 -4.204 -19.270 -3.763 247 HE3 TRP 32 HE3 TRP 32 -9.238 -17.453 -3.594 248 HZ2 TRP 32 HZ2 TRP 32 -4.545 -16.972 -2.012 249 HZ3 TRP 32 HZ3 TRP 32 -8.641 -15.651 -1.996 250 HH2 TRP 32 HH2 TRP 32 -6.297 -15.411 -1.194 251 H TYR 33 H TYR 33 -10.634 -21.519 -6.579 252 HA TYR 33 HA TYR 33 -12.811 -19.751 -6.381 253 HB2 TYR 33 HB2 TYR 33 -12.311 -20.748 -8.493 254 HB3 TYR 33 HB3 TYR 33 -12.392 -22.379 -7.839 255 HD1 TYR 33 HD1 TYR 33 -14.456 -19.447 -8.841 256 HD2 TYR 33 HD2 TYR 33 -14.484 -23.557 -7.526 257 HE1 TYR 33 HE1 TYR 33 -16.866 -19.590 -9.345 258 HE2 TYR 33 HE2 TYR 33 -16.921 -23.670 -7.923 259 HH TYR 33 HH TYR 33 -18.782 -20.912 -9.295 260 H TYR 34 H TYR 34 -12.517 -23.166 -5.290 261 HA TYR 34 HA TYR 34 -15.219 -23.598 -4.693 262 HB2 TYR 34 HB2 TYR 34 -13.785 -25.461 -4.880 263 HB3 TYR 34 HB3 TYR 34 -12.594 -24.789 -3.779 264 HD1 TYR 34 HD1 TYR 34 -16.087 -26.151 -3.859 265 HD2 TYR 34 HD2 TYR 34 -12.579 -25.299 -1.512 266 HE1 TYR 34 HE1 TYR 34 -17.086 -27.379 -1.941 267 HE2 TYR 34 HE2 TYR 34 -13.557 -26.520 0.420 268 HH TYR 34 HH TYR 34 -15.388 -27.730 1.213 269 H TYR 35 H TYR 35 -12.547 -22.603 -2.399 270 HA TYR 35 HA TYR 35 -14.507 -22.378 -0.289 271 HB2 TYR 35 HB2 TYR 35 -12.825 -22.097 1.138 272 HB3 TYR 35 HB3 TYR 35 -11.875 -22.772 -0.167 273 HD1 TYR 35 HD1 TYR 35 -10.477 -21.219 -1.596 274 HD2 TYR 35 HD2 TYR 35 -12.567 -19.826 1.904 275 HE1 TYR 35 HE1 TYR 35 -9.025 -19.226 -1.545 276 HE2 TYR 35 HE2 TYR 35 -11.138 -17.804 1.960 277 HH TYR 35 HH TYR 35 -8.531 -17.226 -0.433 278 H LEU 36 H LEU 36 -13.038 -20.044 -2.582 279 HA LEU 36 HA LEU 36 -13.904 -17.710 -1.234 280 HB2 LEU 36 HB2 LEU 36 -12.173 -17.716 -2.955 281 HB3 LEU 36 HB3 LEU 36 -13.342 -18.241 -4.174 282 HG LEU 36 HG LEU 36 -14.541 -16.113 -4.013 283 HD11 LEU 36 HD11 LEU 36 -12.420 -15.306 -1.971 284 HD12 LEU 36 HD12 LEU 36 -13.586 -14.204 -2.736 285 HD13 LEU 36 HD13 LEU 36 -14.166 -15.483 -1.667 286 HD21 LEU 36 HD21 LEU 36 -12.839 -14.739 -5.059 287 HD22 LEU 36 HD22 LEU 36 -11.533 -15.684 -4.311 288 HD23 LEU 36 HD23 LEU 36 -12.581 -16.415 -5.540 289 H ASP 37 H ASP 37 -15.446 -19.555 -3.950 290 HA ASP 37 HA ASP 37 -17.776 -17.955 -4.157 291 HB2 ASP 37 HB2 ASP 37 -17.148 -19.607 -5.853 292 HB3 ASP 37 HB3 ASP 37 -17.361 -20.922 -4.691 293 H ASP 38 H ASP 38 -17.058 -20.809 -2.104 294 HA ASP 38 HA ASP 38 -19.619 -20.962 -0.858 295 HB2 ASP 38 HB2 ASP 38 -17.985 -22.784 -0.823 296 HB3 ASP 38 HB3 ASP 38 -16.886 -21.814 0.160 297 H THR 39 H THR 39 -16.968 -18.705 -0.284 298 HA THR 39 HA THR 39 -17.948 -18.055 2.434 299 HB THR 39 HB THR 39 -15.503 -17.104 0.890 300 HG1 THR 39 HG1 THR 39 -15.301 -19.214 1.358 301 HG21 THR 39 HG21 THR 39 -16.375 -16.684 3.783 302 HG22 THR 39 HG22 THR 39 -14.704 -16.448 3.216 303 HG23 THR 39 HG23 THR 39 -16.013 -15.445 2.576 304 H LEU 40 H LEU 40 -17.728 -16.599 -0.828 305 HA LEU 40 HA LEU 40 -18.454 -13.929 -0.071 306 HB2 LEU 40 HB2 LEU 40 -18.866 -15.509 -2.643 307 HB3 LEU 40 HB3 LEU 40 -19.257 -13.800 -2.488 308 HG LEU 40 HG LEU 40 -16.454 -14.920 -2.093 309 HD11 LEU 40 HD11 LEU 40 -17.226 -15.316 -4.383 310 HD12 LEU 40 HD12 LEU 40 -17.693 -13.608 -4.548 311 HD13 LEU 40 HD13 LEU 40 -15.984 -14.061 -4.357 312 HD21 LEU 40 HD21 LEU 40 -16.608 -12.821 -0.985 313 HD22 LEU 40 HD22 LEU 40 -15.749 -12.586 -2.502 314 HD23 LEU 40 HD23 LEU 40 -17.447 -12.081 -2.381 315 H GLU 41 H GLU 41 -20.367 -13.341 0.902 316 HA GLU 41 HA GLU 41 -22.729 -15.072 0.696 317 HB2 GLU 41 HB2 GLU 41 -22.277 -12.473 2.222 318 HB3 GLU 41 HB3 GLU 41 -23.738 -13.479 2.271 319 HG2 GLU 41 HG2 GLU 41 -22.148 -15.420 2.946 320 HG3 GLU 41 HG3 GLU 41 -20.976 -14.155 3.319 321 H PHE 42 H PHE 42 -22.226 -14.488 -1.759 322 HA PHE 42 HA PHE 42 -23.108 -12.002 -2.792 323 HB2 PHE 42 HB2 PHE 42 -22.958 -13.085 -4.969 324 HB3 PHE 42 HB3 PHE 42 -21.598 -13.536 -3.978 325 HD1 PHE 42 HD2 PHE 42 -24.874 -14.725 -5.347 326 HD2 PHE 42 HD1 PHE 42 -21.140 -15.863 -3.505 327 HE1 PHE 42 HE2 PHE 42 -25.363 -17.107 -5.816 328 HE2 PHE 42 HE1 PHE 42 -21.640 -18.239 -3.969 329 HZ PHE 42 HZ PHE 42 -23.751 -18.874 -5.123 330 HA PRO 43 HA PRO 43 -24.235 -11.408 -5.009 331 HB2 PRO 43 HB2 PRO 43 -26.188 -9.578 -5.463 332 HB3 PRO 43 HB3 PRO 43 -26.167 -11.190 -6.238 333 HG2 PRO 43 HG2 PRO 43 -27.712 -10.338 -3.770 334 HG3 PRO 43 HG3 PRO 43 -28.319 -11.226 -5.206 335 HD2 PRO 43 HD2 PRO 43 -27.565 -12.511 -2.916 336 HD3 PRO 43 HD3 PRO 43 -27.268 -13.227 -4.526 337 H PHE 44 H PHE 44 -23.400 -9.278 -4.825 338 HA PHE 44 HA PHE 44 -23.955 -7.667 -2.430 339 HB2 PHE 44 HB2 PHE 44 -21.682 -7.554 -1.704 340 HB3 PHE 44 HB3 PHE 44 -22.242 -9.201 -1.613 341 HD1 PHE 44 HD1 PHE 44 -21.409 -10.915 -3.320 342 HD2 PHE 44 HD2 PHE 44 -19.691 -6.991 -2.938 343 HE1 PHE 44 HE1 PHE 44 -19.328 -11.727 -4.380 344 HE2 PHE 44 HE2 PHE 44 -17.610 -7.797 -4.000 345 HZ PHE 44 HZ PHE 44 -17.408 -10.177 -4.700 346 H MET 45 H MET 45 -21.918 -5.756 -2.807 347 HA MET 45 HA MET 45 -22.037 -5.107 -5.689 348 HB2 MET 45 HB2 MET 45 -22.876 -2.976 -5.436 349 HB3 MET 45 HB3 MET 45 -23.951 -3.979 -4.486 350 HG2 MET 45 HG2 MET 45 -23.294 -3.049 -2.478 351 HG3 MET 45 HG3 MET 45 -21.670 -2.675 -3.023 352 HE1 MET 45 HE1 MET 45 -21.949 0.649 -4.956 353 HE2 MET 45 HE2 MET 45 -20.904 -0.680 -4.430 354 HE3 MET 45 HE3 MET 45 -22.052 -0.932 -5.754 355 H GLY 46 H GLY 46 -20.648 -3.270 -6.275 356 HA2 GLY 46 HA2 GLY 46 -18.404 -2.636 -4.502 357 HA3 GLY 46 HA3 GLY 46 -18.009 -3.813 -5.768 358 H LYS 47 H LYS 47 -16.583 -1.792 -5.935 359 HA LYS 47 HA LYS 47 -17.669 -0.221 -8.236 360 HB2 LYS 47 HB2 LYS 47 -16.881 1.085 -6.138 361 HB3 LYS 47 HB3 LYS 47 -15.263 0.503 -6.514 362 HG2 LYS 47 HG2 LYS 47 -15.218 2.507 -7.685 363 HG3 LYS 47 HG3 LYS 47 -15.836 1.470 -8.946 364 HD2 LYS 47 HD2 LYS 47 -17.325 3.273 -9.020 365 HD3 LYS 47 HD3 LYS 47 -18.202 2.070 -8.122 366 HE2 LYS 47 HE2 LYS 47 -18.051 4.651 -7.437 367 HE3 LYS 47 HE3 LYS 47 -18.364 3.361 -6.277 368 HZ1 LYS 47 HZ1 LYS 47 -16.670 4.998 -5.581 369 HZ2 LYS 47 HZ2 LYS 47 -16.111 3.475 -5.545 370 HZ3 LYS 47 HZ3 LYS 47 -15.637 4.488 -6.739 371 H TRP 48 H TRP 48 -16.855 -0.934 -10.122 372 HA TRP 48 HA TRP 48 -14.480 -2.687 -10.228 373 HB2 TRP 48 HB2 TRP 48 -16.511 -2.986 -11.691 374 HB3 TRP 48 HB3 TRP 48 -16.134 -1.462 -12.469 375 HD1 TRP 48 HD1 TRP 48 -12.823 -2.675 -12.278 376 HE1 TRP 48 HE1 TRP 48 -12.090 -4.112 -14.202 377 HE3 TRP 48 HE3 TRP 48 -17.438 -3.728 -14.251 378 HZ2 TRP 48 HZ2 TRP 48 -13.340 -5.646 -16.336 379 HZ3 TRP 48 HZ3 TRP 48 -17.622 -5.198 -16.241 380 HH2 TRP 48 HH2 TRP 48 -15.572 -6.173 -17.272 381 H LYS 49 H LYS 49 -12.632 -1.619 -9.782 382 HA LYS 49 HA LYS 49 -12.257 1.225 -10.337 383 HB2 LYS 49 HB2 LYS 49 -10.292 -0.838 -9.227 384 HB3 LYS 49 HB3 LYS 49 -10.181 0.912 -9.067 385 HG2 LYS 49 HG2 LYS 49 -12.294 -0.876 -7.779 386 HG3 LYS 49 HG3 LYS 49 -10.844 -0.312 -6.989 387 HD2 LYS 49 HD2 LYS 49 -12.944 1.617 -8.071 388 HD3 LYS 49 HD3 LYS 49 -12.999 0.893 -6.462 389 HE2 LYS 49 HE2 LYS 49 -10.558 1.765 -6.194 390 HE3 LYS 49 HE3 LYS 49 -10.948 2.839 -7.547 391 HZ1 LYS 49 HZ1 LYS 49 -11.400 3.835 -5.362 392 HZ2 LYS 49 HZ2 LYS 49 -12.793 3.711 -6.217 393 HZ3 LYS 49 HZ3 LYS 49 -12.462 2.636 -4.996 394 H LYS 50 H LYS 50 -12.672 0.346 -12.736 395 HA LYS 50 HA LYS 50 -10.878 -1.449 -13.998 396 HB2 LYS 50 HB2 LYS 50 -13.137 -0.933 -14.795 397 HB3 LYS 50 HB3 LYS 50 -12.660 0.722 -15.192 398 HG2 LYS 50 HG2 LYS 50 -11.127 -0.035 -16.902 399 HG3 LYS 50 HG3 LYS 50 -11.317 -1.727 -16.420 400 HD2 LYS 50 HD2 LYS 50 -13.547 0.020 -17.562 401 HD3 LYS 50 HD3 LYS 50 -12.549 -1.095 -18.509 402 HE2 LYS 50 HE2 LYS 50 -13.319 -2.989 -17.066 403 HE3 LYS 50 HE3 LYS 50 -14.382 -1.881 -16.195 404 HZ1 LYS 50 HZ1 LYS 50 -14.579 -2.530 -19.080 405 HZ2 LYS 50 HZ2 LYS 50 -15.578 -3.063 -17.906 406 HZ3 LYS 50 HZ3 LYS 50 -15.552 -1.477 -18.295 407 H LYS 51 H LYS 51 -8.769 -1.191 -14.457 408 HA LYS 51 HA LYS 51 -7.656 1.539 -14.710 409 HB2 LYS 51 HB2 LYS 51 -6.725 -0.514 -13.337 410 HB3 LYS 51 HB3 LYS 51 -6.023 -1.004 -14.883 411 HG2 LYS 51 HG2 LYS 51 -4.800 1.143 -15.012 412 HG3 LYS 51 HG3 LYS 51 -5.640 1.730 -13.567 413 HD2 LYS 51 HD2 LYS 51 -4.634 -0.351 -12.367 414 HD3 LYS 51 HD3 LYS 51 -3.559 -0.481 -13.758 415 HE2 LYS 51 HE2 LYS 51 -3.848 1.889 -11.846 416 HE3 LYS 51 HE3 LYS 51 -2.524 0.724 -11.868 417 HZ1 LYS 51 HZ1 LYS 51 -3.151 2.686 -13.997 418 HZ2 LYS 51 HZ2 LYS 51 -1.872 2.720 -12.980 419 HZ3 LYS 51 HZ3 LYS 51 -1.963 1.540 -14.103 420 H SER 52 H SER 52 -8.866 -0.884 -16.766 421 HA SER 52 HA SER 52 -7.128 -0.841 -18.931 422 HB2 SER 52 HB2 SER 52 -10.093 -1.483 -18.992 423 HB3 SER 52 HB3 SER 52 -8.783 -2.258 -19.901 424 HG SER 52 HG SER 52 -9.417 -3.558 -18.162 425 H ARG 53 H ARG 53 -7.906 2.008 -18.334 426 HA ARG 53 HA ARG 53 -9.799 2.846 -20.393 427 HB2 ARG 53 HB2 ARG 53 -9.027 3.976 -18.055 428 HB3 ARG 53 HB3 ARG 53 -7.900 4.793 -19.135 429 HG2 ARG 53 HG2 ARG 53 -10.032 5.334 -20.588 430 HG3 ARG 53 HG3 ARG 53 -10.939 4.773 -19.187 431 HD2 ARG 53 HD2 ARG 53 -10.789 7.109 -18.902 432 HD3 ARG 53 HD3 ARG 53 -9.569 6.450 -17.811 433 HE ARG 53 HE ARG 53 -7.849 7.305 -19.153 434 HH11 ARG 53 HH11 ARG 53 -10.980 7.976 -20.717 435 HH12 ARG 53 HH12 ARG 53 -10.307 9.071 -21.865 436 HH21 ARG 53 HH21 ARG 53 -6.984 8.667 -20.640 437 HH22 ARG 53 HH22 ARG 53 -7.958 9.517 -21.811 438 H LYS 54 H LYS 54 -8.893 4.762 -21.884 439 HA LYS 54 HA LYS 54 -6.898 3.795 -23.692 440 HB2 LYS 54 HB2 LYS 54 -7.915 6.640 -23.234 441 HB3 LYS 54 HB3 LYS 54 -6.980 6.108 -24.623 442 HG2 LYS 54 HG2 LYS 54 -9.791 5.173 -23.911 443 HG3 LYS 54 HG3 LYS 54 -9.344 6.320 -25.174 444 HD2 LYS 54 HD2 LYS 54 -7.983 4.503 -26.275 445 HD3 LYS 54 HD3 LYS 54 -8.637 3.348 -25.108 446 HE2 LYS 54 HE2 LYS 54 -10.289 5.043 -27.038 447 HE3 LYS 54 HE3 LYS 54 -9.809 3.371 -27.323 448 HZ1 LYS 54 HZ1 LYS 54 -11.576 4.274 -25.125 449 HZ2 LYS 54 HZ2 LYS 54 -12.036 3.473 -26.462 450 HZ3 LYS 54 HZ3 LYS 54 -11.094 2.726 -25.367 451 H THR 55 H THR 55 -6.564 5.360 -20.612 452 HA THR 55 HA THR 55 -3.634 5.574 -20.991 453 HB THR 55 HB THR 55 -3.814 7.502 -19.319 454 HG1 THR 55 HG1 THR 55 -5.725 7.835 -18.568 455 HG21 THR 55 HG21 THR 55 -5.153 7.975 -22.023 456 HG22 THR 55 HG22 THR 55 -4.384 9.197 -20.986 457 HG23 THR 55 HG23 THR 55 -3.402 7.923 -21.727 458 H SER 56 H SER 56 -2.596 5.469 -18.681 459 HA SER 56 HA SER 56 -3.354 3.082 -17.412 460 HB2 SER 56 HB2 SER 56 -1.645 5.322 -16.263 461 HB3 SER 56 HB3 SER 56 -1.510 3.584 -15.944 462 HG SER 56 HG SER 56 0.060 4.322 -17.445 463 H THR 57 H THR 57 -5.016 5.985 -17.121 464 HA THR 57 HA THR 57 -5.350 6.429 -14.393 465 HB THR 57 HB THR 57 -7.458 6.963 -16.496 466 HG1 THR 57 HG1 THR 57 -5.014 8.388 -16.299 467 HG21 THR 57 HG21 THR 57 -6.289 8.709 -14.286 468 HG22 THR 57 HG22 THR 57 -7.571 9.182 -15.426 469 HG23 THR 57 HG23 THR 57 -7.865 7.890 -14.253 470 H ILE 58 H ILE 58 -6.775 5.671 -12.860 471 HA ILE 58 HA ILE 58 -8.379 3.277 -13.319 472 HB ILE 58 HB ILE 58 -8.066 5.248 -11.032 473 HG12 ILE 58 HG12 ILE 58 -6.116 3.720 -11.532 474 HG13 ILE 58 HG13 ILE 58 -6.762 3.632 -9.905 475 HG21 ILE 58 HG21 ILE 58 -9.269 3.577 -9.588 476 HG22 ILE 58 HG22 ILE 58 -10.297 4.415 -10.749 477 HG23 ILE 58 HG23 ILE 58 -9.793 2.747 -11.073 478 HD11 ILE 58 HD11 ILE 58 -7.474 1.617 -12.074 479 HD12 ILE 58 HD12 ILE 58 -6.157 1.414 -10.900 480 HD13 ILE 58 HD13 ILE 58 -7.828 1.508 -10.336 481 H GLU 59 H GLU 59 -10.559 3.182 -13.553 482 HA GLU 59 HA GLU 59 -12.220 5.645 -13.573 483 HB2 GLU 59 HB2 GLU 59 -12.246 3.263 -15.494 484 HB3 GLU 59 HB3 GLU 59 -13.625 4.332 -15.290 485 HG2 GLU 59 HG2 GLU 59 -10.859 5.180 -16.243 486 HG3 GLU 59 HG3 GLU 59 -12.268 4.907 -17.261 487 H GLU 60 H GLU 60 -14.387 5.162 -12.778 488 HA GLU 60 HA GLU 60 -14.440 2.776 -10.977 489 HB2 GLU 60 HB2 GLU 60 -15.075 5.704 -10.400 490 HB3 GLU 60 HB3 GLU 60 -15.479 4.367 -9.332 491 HG2 GLU 60 HG2 GLU 60 -12.989 3.737 -9.374 492 HG3 GLU 60 HG3 GLU 60 -12.709 5.304 -10.147 493 H LYS 61 H LYS 61 -16.035 1.510 -11.715 494 HA LYS 61 HA LYS 61 -18.626 2.780 -12.556 495 HB2 LYS 61 HB2 LYS 61 -17.479 1.635 -14.381 496 HB3 LYS 61 HB3 LYS 61 -17.284 0.180 -13.394 497 HG2 LYS 61 HG2 LYS 61 -19.684 -0.189 -13.333 498 HG3 LYS 61 HG3 LYS 61 -19.990 1.314 -14.196 499 HD2 LYS 61 HD2 LYS 61 -18.234 -0.887 -15.375 500 HD3 LYS 61 HD3 LYS 61 -19.975 -0.989 -15.494 501 HE2 LYS 61 HE2 LYS 61 -18.285 1.314 -16.566 502 HE3 LYS 61 HE3 LYS 61 -18.933 -0.022 -17.524 503 HZ1 LYS 61 HZ1 LYS 61 -20.581 1.959 -16.072 504 HZ2 LYS 61 HZ2 LYS 61 -20.350 1.913 -17.696 505 HZ3 LYS 61 HZ3 LYS 61 -21.183 0.719 -16.932 506 H THR 62 H THR 62 -20.217 2.507 -11.035 507 HA THR 62 HA THR 62 -19.929 0.701 -8.832 508 HB THR 62 HB THR 62 -22.521 1.973 -9.776 509 HG1 THR 62 HG1 THR 62 -21.847 3.891 -8.874 510 HG21 THR 62 HG21 THR 62 -21.288 1.592 -7.004 511 HG22 THR 62 HG22 THR 62 -22.915 2.223 -7.359 512 HG23 THR 62 HG23 THR 62 -22.523 0.536 -7.721 513 H VAL 63 H VAL 63 -20.548 -1.405 -8.670 514 HA VAL 63 HA VAL 63 -22.289 -2.562 -10.801 515 HB VAL 63 HB VAL 63 -20.715 -4.464 -10.960 516 HG11 VAL 63 HG11 VAL 63 -20.710 -2.639 -12.653 517 HG12 VAL 63 HG12 VAL 63 -19.388 -1.851 -11.767 518 HG13 VAL 63 HG13 VAL 63 -19.141 -3.443 -12.486 519 HG21 VAL 63 HG21 VAL 63 -18.693 -2.693 -9.513 520 HG22 VAL 63 HG22 VAL 63 -19.422 -4.172 -8.850 521 HG23 VAL 63 HG23 VAL 63 -18.372 -4.263 -10.268 522 H GLU 64 H GLU 64 -23.430 -4.413 -10.259 523 HA GLU 64 HA GLU 64 -23.541 -5.098 -7.351 524 HB2 GLU 64 HB2 GLU 64 -25.685 -4.452 -8.453 525 HB3 GLU 64 HB3 GLU 64 -25.497 -5.796 -9.584 526 HG2 GLU 64 HG2 GLU 64 -25.555 -7.393 -7.687 527 HG3 GLU 64 HG3 GLU 64 -25.617 -6.049 -6.547 528 H VAL 65 H VAL 65 -22.402 -6.915 -6.853 529 HA VAL 65 HA VAL 65 -21.188 -8.479 -9.047 530 HB VAL 65 HB VAL 65 -20.570 -8.577 -6.063 531 HG11 VAL 65 HG11 VAL 65 -18.415 -9.548 -6.955 532 HG12 VAL 65 HG12 VAL 65 -19.827 -10.539 -7.354 533 HG13 VAL 65 HG13 VAL 65 -19.105 -9.477 -8.584 534 HG21 VAL 65 HG21 VAL 65 -19.199 -6.912 -8.229 535 HG22 VAL 65 HG22 VAL 65 -20.070 -6.284 -6.815 536 HG23 VAL 65 HG23 VAL 65 -18.572 -7.182 -6.591 537 H LEU 66 H LEU 66 -22.413 -10.121 -9.696 538 HA LEU 66 HA LEU 66 -24.759 -10.882 -8.176 539 HB2 LEU 66 HB2 LEU 66 -23.643 -12.088 -10.736 540 HB3 LEU 66 HB3 LEU 66 -25.272 -12.288 -10.103 541 HG LEU 66 HG LEU 66 -24.041 -9.719 -11.195 542 HD11 LEU 66 HD11 LEU 66 -26.332 -11.457 -12.202 543 HD12 LEU 66 HD12 LEU 66 -25.734 -9.962 -12.953 544 HD13 LEU 66 HD13 LEU 66 -24.694 -11.394 -12.882 545 HD21 LEU 66 HD21 LEU 66 -25.543 -9.089 -9.374 546 HD22 LEU 66 HD22 LEU 66 -26.307 -8.721 -10.916 547 HD23 LEU 66 HD23 LEU 66 -26.816 -10.160 -10.004 548 H GLY 67 H GLY 67 -21.557 -12.322 -8.722 549 HA2 GLY 67 HA2 GLY 67 -21.376 -14.048 -6.635 550 HA3 GLY 67 HA3 GLY 67 -22.253 -14.981 -7.874 551 H MET 68 H MET 68 -19.910 -16.040 -7.434 552 HA MET 68 HA MET 68 -17.735 -14.966 -9.034 553 HB2 MET 68 HB2 MET 68 -18.263 -17.810 -8.098 554 HB3 MET 68 HB3 MET 68 -16.845 -17.268 -8.994 555 HG2 MET 68 HG2 MET 68 -16.772 -15.433 -7.014 556 HG3 MET 68 HG3 MET 68 -17.611 -16.727 -6.162 557 HE1 MET 68 HE1 MET 68 -14.701 -16.666 -8.908 558 HE2 MET 68 HE2 MET 68 -14.336 -15.382 -7.735 559 HE3 MET 68 HE3 MET 68 -13.295 -16.817 -7.843 560 H ALA 69 H ALA 69 -17.036 -15.696 -11.053 561 HA ALA 69 HA ALA 69 -19.075 -16.223 -13.055 562 HB1 ALA 69 HB1 ALA 69 -16.967 -14.891 -13.423 563 HB2 ALA 69 HB2 ALA 69 -16.038 -16.397 -13.200 564 HB3 ALA 69 HB3 ALA 69 -17.146 -16.219 -14.570 565 HA PRO 70 HA PRO 70 -19.007 -20.709 -13.173 566 HB2 PRO 70 HB2 PRO 70 -17.733 -20.496 -15.913 567 HB3 PRO 70 HB3 PRO 70 -19.073 -21.562 -15.378 568 HG2 PRO 70 HG2 PRO 70 -19.621 -19.304 -16.762 569 HG3 PRO 70 HG3 PRO 70 -20.606 -19.718 -15.320 570 HD2 PRO 70 HD2 PRO 70 -18.317 -17.762 -15.542 571 HD3 PRO 70 HD3 PRO 70 -19.885 -17.565 -14.699 572 H ASP 71 H ASP 71 -17.562 -22.480 -12.854 573 HA ASP 71 HA ASP 71 -14.924 -21.915 -12.005 574 HB2 ASP 71 HB2 ASP 71 -14.659 -24.199 -11.651 575 HB3 ASP 71 HB3 ASP 71 -16.368 -23.916 -11.368 576 H ASP 72 H ASP 72 -16.223 -22.740 -15.189 577 HA ASP 72 HA ASP 72 -13.793 -23.411 -16.502 578 HB2 ASP 72 HB2 ASP 72 -16.034 -23.849 -17.424 579 HB3 ASP 72 HB3 ASP 72 -16.314 -22.113 -17.596 580 H GLU 73 H GLU 73 -15.123 -20.269 -15.545 581 HA GLU 73 HA GLU 73 -13.133 -18.758 -17.144 582 HB2 GLU 73 HB2 GLU 73 -15.134 -17.850 -15.023 583 HB3 GLU 73 HB3 GLU 73 -14.076 -16.795 -15.941 584 HG2 GLU 73 HG2 GLU 73 -16.342 -18.505 -17.046 585 HG3 GLU 73 HG3 GLU 73 -16.346 -16.759 -16.839 586 H CYS 74 H CYS 74 -13.882 -19.734 -13.776 587 HA CYS 74 HA CYS 74 -11.656 -18.313 -12.678 588 HB2 CYS 74 HB2 CYS 74 -13.443 -20.397 -11.379 589 HB3 CYS 74 HB3 CYS 74 -12.354 -19.272 -10.552 590 HG CYS 74 HG CYS 74 -15.059 -18.713 -12.362 591 H LEU 75 H LEU 75 -11.028 -20.482 -14.670 592 HA LEU 75 HA LEU 75 -9.787 -22.693 -13.347 593 HB2 LEU 75 HB2 LEU 75 -10.664 -22.066 -15.929 594 HB3 LEU 75 HB3 LEU 75 -8.931 -22.022 -16.117 595 HG LEU 75 HG LEU 75 -9.789 -24.167 -16.740 596 HD11 LEU 75 HD11 LEU 75 -8.424 -24.563 -14.052 597 HD12 LEU 75 HD12 LEU 75 -8.490 -25.704 -15.411 598 HD13 LEU 75 HD13 LEU 75 -7.604 -24.182 -15.584 599 HD21 LEU 75 HD21 LEU 75 -10.963 -24.499 -13.952 600 HD22 LEU 75 HD22 LEU 75 -11.875 -24.163 -15.432 601 HD23 LEU 75 HD23 LEU 75 -10.990 -25.685 -15.269 602 H LYS 76 H LYS 76 -8.715 -19.457 -13.876 603 HA LYS 76 HA LYS 76 -5.951 -20.181 -13.092 604 HB2 LYS 76 HB2 LYS 76 -4.977 -18.912 -14.938 605 HB3 LYS 76 HB3 LYS 76 -5.915 -20.291 -15.510 606 HG2 LYS 76 HG2 LYS 76 -7.793 -18.758 -16.118 607 HG3 LYS 76 HG3 LYS 76 -6.868 -17.386 -15.498 608 HD2 LYS 76 HD2 LYS 76 -6.692 -17.409 -17.886 609 HD3 LYS 76 HD3 LYS 76 -5.108 -17.800 -17.201 610 HE2 LYS 76 HE2 LYS 76 -5.518 -20.216 -17.637 611 HE3 LYS 76 HE3 LYS 76 -7.124 -19.834 -18.274 612 HZ1 LYS 76 HZ1 LYS 76 -6.047 -18.581 -20.051 613 HZ2 LYS 76 HZ2 LYS 76 -4.562 -18.929 -19.461 614 HZ3 LYS 76 HZ3 LYS 76 -5.510 -20.118 -20.044 615 H ASP 77 H ASP 77 -8.528 -17.877 -13.060 616 HA ASP 77 HA ASP 77 -7.073 -16.038 -11.319 617 HB2 ASP 77 HB2 ASP 77 -6.476 -15.186 -13.553 618 HB3 ASP 77 HB3 ASP 77 -8.166 -15.235 -14.052 619 H MET 78 H MET 78 -8.721 -14.576 -10.274 620 HA MET 78 HA MET 78 -11.237 -16.132 -9.984 621 HB2 MET 78 HB2 MET 78 -10.047 -13.885 -8.316 622 HB3 MET 78 HB3 MET 78 -11.576 -14.697 -7.976 623 HG2 MET 78 HG2 MET 78 -8.834 -16.026 -8.018 624 HG3 MET 78 HG3 MET 78 -9.747 -15.552 -6.598 625 HE1 MET 78 HE1 MET 78 -10.066 -19.503 -8.832 626 HE2 MET 78 HE2 MET 78 -9.892 -18.026 -9.792 627 HE3 MET 78 HE3 MET 78 -8.656 -18.452 -8.585 628 H TYR 79 H TYR 79 -13.077 -15.503 -10.949 629 HA TYR 79 HA TYR 79 -13.362 -12.691 -11.906 630 HB2 TYR 79 HB2 TYR 79 -14.046 -15.344 -13.223 631 HB3 TYR 79 HB3 TYR 79 -14.693 -13.809 -13.765 632 HD1 TYR 79 HD2 TYR 79 -13.164 -12.031 -14.686 633 HD2 TYR 79 HD1 TYR 79 -11.872 -16.075 -13.922 634 HE1 TYR 79 HE2 TYR 79 -11.315 -11.736 -16.298 635 HE2 TYR 79 HE1 TYR 79 -10.017 -15.795 -15.525 636 HH TYR 79 HH TYR 79 -9.474 -12.733 -17.340 637 H VAL 80 H VAL 80 -15.498 -11.877 -11.938 638 HA VAL 80 HA VAL 80 -17.597 -13.481 -10.554 639 HB VAL 80 HB VAL 80 -18.223 -11.382 -9.383 640 HG11 VAL 80 HG11 VAL 80 -17.011 -13.135 -8.179 641 HG12 VAL 80 HG12 VAL 80 -15.456 -12.429 -8.667 642 HG13 VAL 80 HG13 VAL 80 -16.561 -11.538 -7.596 643 HG21 VAL 80 HG21 VAL 80 -16.592 -9.578 -9.057 644 HG22 VAL 80 HG22 VAL 80 -15.458 -10.348 -10.177 645 HG23 VAL 80 HG23 VAL 80 -17.010 -9.713 -10.768 646 H GLU 81 H GLU 81 -19.727 -13.000 -11.152 647 HA GLU 81 HA GLU 81 -20.057 -11.688 -13.800 648 HB2 GLU 81 HB2 GLU 81 -21.975 -13.171 -11.945 649 HB3 GLU 81 HB3 GLU 81 -22.472 -12.321 -13.421 650 HG2 GLU 81 HG2 GLU 81 -20.890 -13.755 -14.736 651 HG3 GLU 81 HG3 GLU 81 -20.538 -14.661 -13.264 652 H VAL 82 H VAL 82 -21.085 -9.685 -13.982 653 HA VAL 82 HA VAL 82 -21.727 -8.248 -11.484 654 HB VAL 82 HB VAL 82 -19.253 -8.169 -12.965 655 HG11 VAL 82 HG11 VAL 82 -20.625 -5.479 -13.053 656 HG12 VAL 82 HG12 VAL 82 -18.898 -5.801 -13.342 657 HG13 VAL 82 HG13 VAL 82 -20.113 -6.477 -14.434 658 HG21 VAL 82 HG21 VAL 82 -20.254 -6.636 -10.560 659 HG22 VAL 82 HG22 VAL 82 -19.368 -8.174 -10.589 660 HG23 VAL 82 HG23 VAL 82 -18.565 -6.690 -11.115 661 H ALA 83 H ALA 83 -23.239 -6.704 -11.745 662 HA ALA 83 HA ALA 83 -24.312 -6.250 -14.507 663 HB1 ALA 83 HB1 ALA 83 -25.809 -6.186 -11.865 664 HB2 ALA 83 HB2 ALA 83 -26.477 -5.791 -13.466 665 HB3 ALA 83 HB3 ALA 83 -25.928 -7.441 -13.127 666 H ASP 84 H ASP 84 -24.490 -4.184 -15.197 667 HA ASP 84 HA ASP 84 -22.747 -2.289 -13.827 668 HB2 ASP 84 HB2 ASP 84 -22.517 -2.760 -16.208 669 HB3 ASP 84 HB3 ASP 84 -24.171 -2.196 -16.498 670 H ILE 85 H ILE 85 -24.489 -2.255 -12.037 671 HA ILE 85 HA ILE 85 -26.833 -0.688 -12.367 672 HB ILE 85 HB ILE 85 -26.800 -0.379 -9.956 673 HG12 ILE 85 HG12 ILE 85 -24.088 -1.720 -9.931 674 HG13 ILE 85 HG13 ILE 85 -24.352 -0.002 -9.650 675 HG21 ILE 85 HG21 ILE 85 -25.974 -3.226 -10.674 676 HG22 ILE 85 HG22 ILE 85 -27.076 -2.703 -9.381 677 HG23 ILE 85 HG23 ILE 85 -27.554 -2.514 -11.064 678 HD11 ILE 85 HD11 ILE 85 -25.706 -0.517 -7.647 679 HD12 ILE 85 HD12 ILE 85 -25.406 -2.253 -7.889 680 HD13 ILE 85 HD13 ILE 85 -24.060 -1.176 -7.531 681 H GLY 86 H GLY 86 -23.525 0.354 -12.434 682 HA2 GLY 86 HA2 GLY 86 -24.092 3.163 -11.846 683 HA3 GLY 86 HA3 GLY 86 -22.561 2.429 -12.348 684 H GLY 87 H GLY 87 -24.663 1.194 -14.586 685 HA2 GLY 87 HA2 GLY 87 -24.728 3.545 -16.401 686 HA3 GLY 87 HA3 GLY 87 -23.696 2.169 -16.808 687 H LYS 88 H LYS 88 -24.639 0.230 -17.543 688 HA LYS 88 HA LYS 88 -27.040 0.589 -19.025 689 HB2 LYS 88 HB2 LYS 88 -25.755 -2.052 -18.212 690 HB3 LYS 88 HB3 LYS 88 -26.922 -1.829 -19.500 691 HG2 LYS 88 HG2 LYS 88 -24.066 -0.769 -19.467 692 HG3 LYS 88 HG3 LYS 88 -24.709 -2.124 -20.380 693 HD2 LYS 88 HD2 LYS 88 -24.645 -0.527 -22.008 694 HD3 LYS 88 HD3 LYS 88 -26.321 -0.371 -21.472 695 HE2 LYS 88 HE2 LYS 88 -25.633 1.584 -20.044 696 HE3 LYS 88 HE3 LYS 88 -23.966 1.372 -20.583 697 HZ1 LYS 88 HZ1 LYS 88 -24.701 1.867 -22.842 698 HZ2 LYS 88 HZ2 LYS 88 -26.248 2.057 -22.350 699 HZ3 LYS 88 HZ3 LYS 88 -25.095 3.091 -21.845 700 H ASP 89 H ASP 89 -26.591 -0.777 -15.833 701 HA ASP 89 HA ASP 89 -27.829 -1.540 -14.210 702 HB2 ASP 89 HB2 ASP 89 -28.807 0.687 -14.338 703 HB3 ASP 89 HB3 ASP 89 -30.029 0.111 -15.476 704 H ASP 90 H ASP 90 -29.200 -2.231 -17.327 705 HA ASP 90 HA ASP 90 -30.737 -4.547 -16.274 706 HB2 ASP 90 HB2 ASP 90 -31.901 -2.632 -17.402 707 HB3 ASP 90 HB3 ASP 90 -30.948 -2.968 -18.852 708 H ASP 91 H ASP 91 -27.744 -4.205 -17.253 709 HA ASP 91 HA ASP 91 -27.723 -6.714 -18.820 710 HB2 ASP 91 HB2 ASP 91 -27.444 -4.690 -20.368 711 HB3 ASP 91 HB3 ASP 91 -25.888 -4.439 -19.553 712 H VAL 92 H VAL 92 -25.625 -7.716 -18.850 713 HA VAL 92 HA VAL 92 -24.123 -7.372 -16.318 714 HB VAL 92 HB VAL 92 -25.969 -8.892 -15.989 715 HG11 VAL 92 HG11 VAL 92 -24.968 -10.533 -18.349 716 HG12 VAL 92 HG12 VAL 92 -26.270 -10.992 -17.234 717 HG13 VAL 92 HG13 VAL 92 -26.478 -9.595 -18.282 718 HG21 VAL 92 HG21 VAL 92 -23.402 -10.506 -16.194 719 HG22 VAL 92 HG22 VAL 92 -23.987 -9.568 -14.797 720 HG23 VAL 92 HG23 VAL 92 -24.872 -10.990 -15.334 721 H TYR 93 H TYR 93 -22.045 -8.154 -16.282 722 HA TYR 93 HA TYR 93 -20.740 -9.157 -18.754 723 HB2 TYR 93 HB2 TYR 93 -19.749 -6.902 -16.947 724 HB3 TYR 93 HB3 TYR 93 -18.904 -7.553 -18.338 725 HD1 TYR 93 HD1 TYR 93 -19.672 -7.083 -20.653 726 HD2 TYR 93 HD2 TYR 93 -21.554 -5.275 -17.213 727 HE1 TYR 93 HE1 TYR 93 -20.671 -5.352 -22.114 728 HE2 TYR 93 HE2 TYR 93 -22.569 -3.552 -18.662 729 HH TYR 93 HH TYR 93 -22.716 -2.694 -20.837 730 H THR 94 H THR 94 -18.240 -9.491 -17.847 731 HA THR 94 HA THR 94 -18.351 -10.756 -15.161 732 HB THR 94 HB THR 94 -16.757 -11.720 -17.572 733 HG1 THR 94 HG1 THR 94 -18.958 -12.208 -17.728 734 HG21 THR 94 HG21 THR 94 -17.046 -12.891 -14.767 735 HG22 THR 94 HG22 THR 94 -16.257 -13.698 -16.141 736 HG23 THR 94 HG23 THR 94 -15.570 -12.211 -15.479 737 H ALA 95 H ALA 95 -16.561 -10.258 -13.882 738 HA ALA 95 HA ALA 95 -14.602 -8.280 -14.939 739 HB1 ALA 95 HB1 ALA 95 -16.195 -8.055 -12.346 740 HB2 ALA 95 HB2 ALA 95 -14.909 -6.950 -12.875 741 HB3 ALA 95 HB3 ALA 95 -16.426 -7.048 -13.790 742 H LYS 96 H LYS 96 -12.637 -8.218 -13.748 743 HA LYS 96 HA LYS 96 -11.810 -10.786 -12.573 744 HB2 LYS 96 HB2 LYS 96 -10.337 -8.106 -12.663 745 HB3 LYS 96 HB3 LYS 96 -9.677 -9.639 -12.155 746 HG2 LYS 96 HG2 LYS 96 -8.799 -9.202 -14.286 747 HG3 LYS 96 HG3 LYS 96 -9.930 -10.530 -14.457 748 HD2 LYS 96 HD2 LYS 96 -9.964 -8.909 -16.353 749 HD3 LYS 96 HD3 LYS 96 -11.522 -9.151 -15.605 750 HE2 LYS 96 HE2 LYS 96 -11.351 -6.825 -16.066 751 HE3 LYS 96 HE3 LYS 96 -11.200 -6.989 -14.318 752 HZ1 LYS 96 HZ1 LYS 96 -9.600 -5.462 -15.043 753 HZ2 LYS 96 HZ2 LYS 96 -8.732 -6.808 -14.690 754 HZ3 LYS 96 HZ3 LYS 96 -9.037 -6.427 -16.252 755 H LEU 97 H LEU 97 -11.920 -11.189 -10.325 756 HA LEU 97 HA LEU 97 -13.196 -9.270 -8.594 757 HB2 LEU 97 HB2 LEU 97 -13.184 -11.716 -8.153 758 HB3 LEU 97 HB3 LEU 97 -11.435 -11.662 -7.901 759 HG LEU 97 HG LEU 97 -11.732 -10.190 -5.935 760 HD11 LEU 97 HD11 LEU 97 -13.769 -8.951 -6.493 761 HD12 LEU 97 HD12 LEU 97 -14.720 -10.454 -6.529 762 HD13 LEU 97 HD13 LEU 97 -14.052 -9.841 -5.008 763 HD21 LEU 97 HD21 LEU 97 -12.704 -11.855 -4.450 764 HD22 LEU 97 HD22 LEU 97 -13.522 -12.642 -5.819 765 HD23 LEU 97 HD23 LEU 97 -11.744 -12.652 -5.698 766 H SER 98 H SER 98 -9.834 -10.034 -9.411 767 HA SER 98 HA SER 98 -8.352 -8.520 -7.668 768 HB2 SER 98 HB2 SER 98 -7.814 -8.777 -10.641 769 HB3 SER 98 HB3 SER 98 -6.650 -8.805 -9.305 770 HG SER 98 HG SER 98 -7.258 -10.904 -10.284 771 H ASP 99 H ASP 99 -10.586 -7.259 -10.040 772 HA ASP 99 HA ASP 99 -9.217 -4.627 -10.120 773 HB2 ASP 99 HB2 ASP 99 -9.379 -6.103 -12.197 774 HB3 ASP 99 HB3 ASP 99 -11.121 -5.819 -12.161 775 H ILE 100 H ILE 100 -11.350 -5.915 -8.294 776 HA ILE 100 HA ILE 100 -13.323 -3.685 -8.400 777 HB ILE 100 HB ILE 100 -13.660 -6.635 -8.261 778 HG12 ILE 100 HG12 ILE 100 -15.498 -4.365 -9.125 779 HG13 ILE 100 HG13 ILE 100 -14.282 -5.122 -10.175 780 HG21 ILE 100 HG21 ILE 100 -15.750 -6.667 -7.038 781 HG22 ILE 100 HG22 ILE 100 -14.474 -6.103 -5.983 782 HG23 ILE 100 HG23 ILE 100 -15.623 -4.933 -6.682 783 HD11 ILE 100 HD11 ILE 100 -15.484 -7.311 -9.860 784 HD12 ILE 100 HD12 ILE 100 -16.777 -6.402 -9.025 785 HD13 ILE 100 HD13 ILE 100 -16.397 -6.047 -10.716 786 H GLU 101 H GLU 101 -14.121 -2.956 -6.552 787 HA GLU 101 HA GLU 101 -12.676 -3.493 -3.996 788 HB2 GLU 101 HB2 GLU 101 -12.068 -1.306 -4.866 789 HB3 GLU 101 HB3 GLU 101 -13.764 -0.904 -5.184 790 HG2 GLU 101 HG2 GLU 101 -14.275 -0.805 -2.826 791 HG3 GLU 101 HG3 GLU 101 -12.714 -1.511 -2.402 792 H ALA 102 H ALA 102 -14.068 -4.436 -2.572 793 HA ALA 102 HA ALA 102 -16.874 -4.746 -3.308 794 HB1 ALA 102 HB1 ALA 102 -16.949 -6.232 -1.392 795 HB2 ALA 102 HB2 ALA 102 -15.483 -6.565 -2.331 796 HB3 ALA 102 HB3 ALA 102 -15.373 -5.652 -0.808 797 H ILE 103 H ILE 103 -18.607 -3.794 -2.359 798 HA ILE 103 HA ILE 103 -18.205 -1.841 -0.136 799 HB ILE 103 HB ILE 103 -19.669 -1.568 -2.774 800 HG12 ILE 103 HG12 ILE 103 -17.531 0.207 -1.511 801 HG13 ILE 103 HG13 ILE 103 -17.194 -1.044 -2.704 802 HG21 ILE 103 HG21 ILE 103 -20.520 0.625 -2.013 803 HG22 ILE 103 HG22 ILE 103 -21.148 -0.663 -1.010 804 HG23 ILE 103 HG23 ILE 103 -19.815 0.349 -0.405 805 HD11 ILE 103 HD11 ILE 103 -18.649 0.086 -4.345 806 HD12 ILE 103 HD12 ILE 103 -18.844 1.445 -3.206 807 HD13 ILE 103 HD13 ILE 103 -17.241 1.041 -3.832 808 H ASP 104 H ASP 104 -19.758 -1.872 1.426 809 HA ASP 104 HA ASP 104 -21.400 -2.594 2.739 810 HB2 ASP 104 HB2 ASP 104 -22.680 -1.346 1.021 811 HB3 ASP 104 HB3 ASP 104 -23.017 -2.863 0.188 812 H VAL 105 H VAL 105 -19.563 -4.669 1.705 813 HA VAL 105 HA VAL 105 -21.119 -7.142 1.630 814 HB VAL 105 HB VAL 105 -18.711 -8.118 1.807 815 HG11 VAL 105 HG11 VAL 105 -20.078 -8.129 -0.163 816 HG12 VAL 105 HG12 VAL 105 -19.558 -6.476 -0.591 817 HG13 VAL 105 HG13 VAL 105 -18.390 -7.828 -0.584 818 HG21 VAL 105 HG21 VAL 105 -16.874 -6.775 1.174 819 HG22 VAL 105 HG22 VAL 105 -17.872 -5.327 0.932 820 HG23 VAL 105 HG23 VAL 105 -17.619 -5.979 2.571 821 H ASP 106 H ASP 106 -20.565 -8.923 3.056 822 HA ASP 106 HA ASP 106 -20.699 -8.249 5.913 823 HB2 ASP 106 HB2 ASP 106 -21.879 -10.222 5.028 824 HB3 ASP 106 HB3 ASP 106 -20.341 -10.886 4.441 825 H ASP 107 H ASP 107 -19.023 -9.031 7.397 826 HA ASP 107 HA ASP 107 -16.392 -8.154 6.749 827 HB2 ASP 107 HB2 ASP 107 -17.266 -8.219 9.036 828 HB3 ASP 107 HB3 ASP 107 -17.397 -9.978 8.966 829 H ASP 108 H ASP 108 -17.768 -11.527 6.749 830 HA ASP 108 HA ASP 108 -15.108 -12.616 6.324 831 HB2 ASP 108 HB2 ASP 108 -17.215 -13.763 7.375 832 HB3 ASP 108 HB3 ASP 108 -17.663 -14.106 5.694 833 H THR 109 H THR 109 -17.670 -11.403 4.287 834 HA THR 109 HA THR 109 -16.759 -12.616 1.787 835 HB THR 109 HB THR 109 -18.637 -10.315 2.465 836 HG1 THR 109 HG1 THR 109 -19.208 -12.527 3.024 837 HG21 THR 109 HG21 THR 109 -18.406 -11.712 -0.218 838 HG22 THR 109 HG22 THR 109 -19.503 -10.408 0.223 839 HG23 THR 109 HG23 THR 109 -17.760 -10.091 0.110 840 H GLN 110 H GLN 110 -16.492 -9.353 3.396 841 HA GLN 110 HA GLN 110 -14.792 -8.198 1.490 842 HB2 GLN 110 HB2 GLN 110 -16.029 -7.228 3.623 843 HB3 GLN 110 HB3 GLN 110 -14.536 -7.597 4.461 844 HG2 GLN 110 HG2 GLN 110 -14.839 -5.801 2.006 845 HG3 GLN 110 HG3 GLN 110 -14.669 -5.247 3.662 846 HE21 GLN 110 HE22 GLN 110 -12.939 -5.819 0.813 847 HE22 GLN 110 HE21 GLN 110 -11.341 -5.919 1.499 848 H GLU 111 H GLU 111 -13.941 -10.035 4.497 849 HA GLU 111 HA GLU 111 -11.149 -9.751 4.172 850 HB2 GLU 111 HB2 GLU 111 -12.890 -11.744 5.663 851 HB3 GLU 111 HB3 GLU 111 -11.139 -11.872 5.686 852 HG2 GLU 111 HG2 GLU 111 -12.709 -9.404 6.572 853 HG3 GLU 111 HG3 GLU 111 -12.038 -10.632 7.643 854 H ALA 112 H ALA 112 -13.368 -12.215 2.757 855 HA ALA 112 HA ALA 112 -11.236 -13.910 1.830 856 HB1 ALA 112 HB1 ALA 112 -13.608 -14.627 1.997 857 HB2 ALA 112 HB2 ALA 112 -14.032 -13.524 0.664 858 HB3 ALA 112 HB3 ALA 112 -12.931 -14.893 0.385 859 H ILE 113 H ILE 113 -12.961 -11.113 0.393 860 HA ILE 113 HA ILE 113 -11.632 -11.230 -2.153 861 HB ILE 113 HB ILE 113 -13.045 -8.958 -0.687 862 HG12 ILE 113 HG12 ILE 113 -14.051 -10.762 -2.936 863 HG13 ILE 113 HG13 ILE 113 -14.384 -11.055 -1.248 864 HG21 ILE 113 HG21 ILE 113 -13.239 -7.880 -2.939 865 HG22 ILE 113 HG22 ILE 113 -11.575 -7.994 -2.391 866 HG23 ILE 113 HG23 ILE 113 -12.174 -9.137 -3.606 867 HD11 ILE 113 HD11 ILE 113 -15.467 -8.788 -1.097 868 HD12 ILE 113 HD12 ILE 113 -15.353 -8.712 -2.881 869 HD13 ILE 113 HD13 ILE 113 -16.294 -9.992 -2.101 870 H ALA 114 H ALA 114 -10.994 -9.399 0.888 871 HA ALA 114 HA ALA 114 -8.709 -7.993 -0.011 872 HB1 ALA 114 HB1 ALA 114 -8.179 -7.749 2.364 873 HB2 ALA 114 HB2 ALA 114 -9.919 -7.526 2.117 874 HB3 ALA 114 HB3 ALA 114 -9.304 -9.052 2.789 875 H ASP 115 H ASP 115 -9.039 -11.281 1.421 876 HA ASP 115 HA ASP 115 -6.246 -11.773 1.599 877 HB2 ASP 115 HB2 ASP 115 -8.167 -13.023 2.744 878 HB3 ASP 115 HB3 ASP 115 -8.350 -13.929 1.240 879 H TRP 116 H TRP 116 -8.614 -12.417 -1.048 880 HA TRP 116 HA TRP 116 -6.772 -13.707 -2.821 881 HB2 TRP 116 HB2 TRP 116 -9.116 -13.787 -3.354 882 HB3 TRP 116 HB3 TRP 116 -9.260 -12.035 -3.315 883 HD1 TRP 116 HD1 TRP 116 -9.188 -10.882 -5.573 884 HE1 TRP 116 HE1 TRP 116 -8.191 -11.336 -7.899 885 HE3 TRP 116 HE3 TRP 116 -6.942 -15.390 -4.644 886 HZ2 TRP 116 HZ2 TRP 116 -6.587 -13.356 -9.159 887 HZ3 TRP 116 HZ3 TRP 116 -5.696 -16.556 -6.420 888 HH2 TRP 116 HH2 TRP 116 -5.493 -15.548 -8.692 889 H LEU 117 H LEU 117 -7.621 -10.228 -2.403 890 HA LEU 117 HA LEU 117 -5.959 -9.283 -4.501 891 HB2 LEU 117 HB2 LEU 117 -6.963 -7.980 -1.940 892 HB3 LEU 117 HB3 LEU 117 -6.058 -7.093 -3.156 893 HG LEU 117 HG LEU 117 -8.605 -8.598 -3.882 894 HD11 LEU 117 HD11 LEU 117 -9.817 -6.462 -3.622 895 HD12 LEU 117 HD12 LEU 117 -9.183 -7.054 -2.080 896 HD13 LEU 117 HD13 LEU 117 -8.361 -5.718 -2.918 897 HD21 LEU 117 HD21 LEU 117 -7.155 -7.896 -5.762 898 HD22 LEU 117 HD22 LEU 117 -8.682 -7.000 -5.742 899 HD23 LEU 117 HD23 LEU 117 -7.191 -6.224 -5.169 900 H TYR 118 H TYR 118 -5.277 -9.693 -0.973 901 HA TYR 118 HA TYR 118 -2.582 -8.782 -1.098 902 HB2 TYR 118 HB2 TYR 118 -3.802 -10.827 0.793 903 HB3 TYR 118 HB3 TYR 118 -2.270 -10.000 1.022 904 HD1 TYR 118 HD2 TYR 118 -3.166 -7.136 0.237 905 HD2 TYR 118 HD1 TYR 118 -4.902 -10.162 2.784 906 HE1 TYR 118 HE2 TYR 118 -4.326 -5.383 1.517 907 HE2 TYR 118 HE1 TYR 118 -6.071 -8.406 4.074 908 HH TYR 118 HH TYR 118 -5.781 -4.911 3.281 909 H TRP 119 H TRP 119 -3.943 -12.151 -1.442 910 HA TRP 119 HA TRP 119 -1.439 -13.435 -1.691 911 HB2 TRP 119 HB2 TRP 119 -3.345 -14.801 -1.398 912 HB3 TRP 119 HB3 TRP 119 -4.219 -14.039 -2.722 913 HD1 TRP 119 HD1 TRP 119 -3.980 -14.968 -5.071 914 HE1 TRP 119 HE1 TRP 119 -2.696 -16.866 -6.199 915 HE3 TRP 119 HE3 TRP 119 -0.975 -16.304 -1.153 916 HZ2 TRP 119 HZ2 TRP 119 -0.563 -18.718 -5.485 917 HZ3 TRP 119 HZ3 TRP 119 0.685 -18.128 -1.408 918 HH2 TRP 119 HH2 TRP 119 0.901 -19.339 -3.570 919 H LEU 120 H LEU 120 -3.504 -11.890 -4.219 920 HA LEU 120 HA LEU 120 -1.954 -12.846 -6.375 921 HB2 LEU 120 HB2 LEU 120 -4.282 -11.937 -6.523 922 HB3 LEU 120 HB3 LEU 120 -3.655 -10.318 -6.203 923 HG LEU 120 HG LEU 120 -2.304 -10.441 -8.310 924 HD11 LEU 120 HD11 LEU 120 -2.843 -12.247 -9.958 925 HD12 LEU 120 HD12 LEU 120 -2.001 -12.866 -8.538 926 HD13 LEU 120 HD13 LEU 120 -3.753 -13.105 -8.693 927 HD21 LEU 120 HD21 LEU 120 -4.223 -10.227 -9.844 928 HD22 LEU 120 HD22 LEU 120 -5.275 -11.003 -8.638 929 HD23 LEU 120 HD23 LEU 120 -4.538 -9.423 -8.298 930 H ALA 121 H ALA 121 -1.779 -9.824 -4.488 931 HA ALA 121 HA ALA 121 0.421 -8.686 -5.958 932 HB1 ALA 121 HB1 ALA 121 -0.843 -8.169 -3.239 933 HB2 ALA 121 HB2 ALA 121 0.457 -7.157 -3.936 934 HB3 ALA 121 HB3 ALA 121 -1.122 -7.289 -4.745 935 H ARG 122 H ARG 122 0.213 -10.740 -3.025 936 HA ARG 122 HA ARG 122 2.935 -10.647 -2.244 937 HB2 ARG 122 HB2 ARG 122 1.061 -11.527 -0.869 938 HB3 ARG 122 HB3 ARG 122 0.829 -12.839 -2.005 939 HG2 ARG 122 HG2 ARG 122 1.833 -13.705 -0.088 940 HG3 ARG 122 HG3 ARG 122 3.038 -13.790 -1.367 941 HD2 ARG 122 HD2 ARG 122 4.305 -11.989 -0.410 942 HD3 ARG 122 HD3 ARG 122 2.958 -11.507 0.648 943 HE ARG 122 HE ARG 122 3.541 -14.174 1.289 944 HH11 ARG 122 HH21 ARG 122 5.148 -10.998 1.593 945 HH12 ARG 122 HH22 ARG 122 5.963 -11.434 3.059 946 HH21 ARG 122 HH11 ARG 122 4.559 -14.654 3.273 947 HH22 ARG 122 HH12 ARG 122 5.768 -13.577 3.914 948 H GLY 123 H GLY 123 1.284 -12.444 -4.808 949 HA2 GLY 123 HA2 GLY 123 3.143 -12.589 -6.614 950 HA3 GLY 123 HA3 GLY 123 3.765 -13.884 -5.583 951 H TYR 124 H TYR 124 2.080 -13.452 -8.316 952 HA TYR 124 HA TYR 124 0.049 -15.536 -8.050 953 HB2 TYR 124 HB2 TYR 124 -0.114 -13.631 -9.654 954 HB3 TYR 124 HB3 TYR 124 1.310 -14.207 -10.490 955 HD1 TYR 124 HD2 TYR 124 -2.218 -15.080 -9.583 956 HD2 TYR 124 HD1 TYR 124 1.130 -15.921 -12.174 957 HE1 TYR 124 HE2 TYR 124 -3.690 -16.432 -11.032 958 HE2 TYR 124 HE1 TYR 124 -0.330 -17.307 -13.616 959 HH TYR 124 HH TYR 124 -3.836 -17.732 -12.925 960 H LYS 125 H LYS 125 1.496 -17.099 -6.980 961 HA LYS 125 HA LYS 125 3.481 -18.394 -8.803 962 HB2 LYS 125 HB2 LYS 125 3.674 -17.784 -5.823 963 HB3 LYS 125 HB3 LYS 125 4.850 -18.741 -6.712 964 HG2 LYS 125 HG2 LYS 125 4.254 -15.809 -7.274 965 HG3 LYS 125 HG3 LYS 125 5.589 -16.427 -6.307 966 HD2 LYS 125 HD2 LYS 125 6.470 -17.651 -8.284 967 HD3 LYS 125 HD3 LYS 125 5.157 -16.981 -9.277 968 HE2 LYS 125 HE2 LYS 125 5.930 -14.683 -8.756 969 HE3 LYS 125 HE3 LYS 125 7.238 -15.342 -7.765 970 HZ1 LYS 125 HZ1 LYS 125 8.141 -16.381 -9.763 971 HZ2 LYS 125 HZ2 LYS 125 6.932 -15.772 -10.682 972 HZ3 LYS 125 HZ3 LYS 125 8.007 -14.773 -9.977 973 H PHE 126 H PHE 126 0.526 -19.123 -7.689 974 HA PHE 126 HA PHE 126 1.112 -21.755 -6.576 975 HB2 PHE 126 HB2 PHE 126 -1.274 -22.267 -7.170 976 HB3 PHE 126 HB3 PHE 126 -0.945 -21.130 -5.892 977 HD1 PHE 126 HD2 PHE 126 -1.238 -20.551 -9.649 978 HD2 PHE 126 HD1 PHE 126 -2.899 -19.934 -5.719 979 HE1 PHE 126 HE2 PHE 126 -3.021 -19.141 -10.617 980 HE2 PHE 126 HE1 PHE 126 -4.677 -18.533 -6.684 981 HZ PHE 126 HZ PHE 126 -4.747 -18.116 -9.149 Start of MODEL 20 1 H1 MET 1 H1 MET 1 8.532 -3.080 -1.219 2 H2 MET 1 H2 MET 1 8.330 -3.304 0.387 3 H3 MET 1 H3 MET 1 9.807 -3.529 -0.294 4 HA MET 1 HA MET 1 8.998 -5.384 -1.573 5 HB2 MET 1 HB2 MET 1 10.030 -5.811 0.635 6 HB3 MET 1 HB3 MET 1 8.451 -5.673 1.417 7 HG2 MET 1 HG2 MET 1 7.637 -7.611 0.123 8 HG3 MET 1 HG3 MET 1 9.197 -7.753 -0.687 9 HE1 MET 1 HE1 MET 1 11.250 -8.941 0.260 10 HE2 MET 1 HE2 MET 1 11.463 -7.582 1.391 11 HE3 MET 1 HE3 MET 1 11.528 -9.254 1.987 12 H ALA 2 H ALA 2 7.264 -6.128 -2.700 13 HA ALA 2 HA ALA 2 4.679 -4.988 -2.389 14 HB1 ALA 2 HB1 ALA 2 5.528 -7.502 -3.899 15 HB2 ALA 2 HB2 ALA 2 4.038 -6.573 -4.147 16 HB3 ALA 2 HB3 ALA 2 5.601 -5.836 -4.528 17 H SER 3 H SER 3 6.067 -8.009 -1.094 18 HA SER 3 HA SER 3 3.701 -9.304 -0.326 19 HB2 SER 3 HB2 SER 3 6.330 -9.432 1.168 20 HB3 SER 3 HB3 SER 3 5.134 -10.713 0.933 21 HG SER 3 HG SER 3 5.684 -10.634 -1.333 22 H VAL 4 H VAL 4 2.159 -7.937 0.689 23 HA VAL 4 HA VAL 4 2.713 -6.321 2.957 24 HB VAL 4 HB VAL 4 0.270 -6.416 3.360 25 HG11 VAL 4 HG11 VAL 4 1.261 -4.801 1.770 26 HG12 VAL 4 HG12 VAL 4 1.015 -5.949 0.437 27 HG13 VAL 4 HG13 VAL 4 -0.379 -5.275 1.303 28 HG21 VAL 4 HG21 VAL 4 -1.238 -7.554 1.860 29 HG22 VAL 4 HG22 VAL 4 0.091 -8.249 0.923 30 HG23 VAL 4 HG23 VAL 4 -0.188 -8.762 2.606 31 H GLU 5 H GLU 5 2.524 -9.771 2.676 32 HA GLU 5 HA GLU 5 3.266 -10.068 5.495 33 HB2 GLU 5 HB2 GLU 5 1.156 -11.780 4.078 34 HB3 GLU 5 HB3 GLU 5 1.926 -12.177 5.618 35 HG2 GLU 5 HG2 GLU 5 0.973 -10.076 6.599 36 HG3 GLU 5 HG3 GLU 5 0.103 -9.793 5.084 37 H ARG 6 H ARG 6 5.077 -11.476 5.486 38 HA ARG 6 HA ARG 6 5.802 -12.715 2.876 39 HB2 ARG 6 HB2 ARG 6 6.823 -10.476 3.374 40 HB3 ARG 6 HB3 ARG 6 7.458 -11.115 4.885 41 HG2 ARG 6 HG2 ARG 6 9.213 -11.004 3.279 42 HG3 ARG 6 HG3 ARG 6 8.885 -12.699 3.622 43 HD2 ARG 6 HD2 ARG 6 7.595 -12.889 1.510 44 HD3 ARG 6 HD3 ARG 6 7.804 -11.153 1.236 45 HE ARG 6 HE ARG 6 10.212 -12.855 1.476 46 HH11 ARG 6 HH11 ARG 6 8.091 -10.952 -0.701 47 HH12 ARG 6 HH12 ARG 6 9.249 -10.921 -1.978 48 HH21 ARG 6 HH21 ARG 6 11.728 -12.755 -0.231 49 HH22 ARG 6 HH22 ARG 6 11.351 -11.948 -1.702 50 H ASP 7 H ASP 7 5.695 -13.101 6.388 51 HA ASP 7 HA ASP 7 7.850 -14.917 6.667 52 HB2 ASP 7 HB2 ASP 7 6.806 -13.663 8.533 53 HB3 ASP 7 HB3 ASP 7 5.344 -14.645 8.373 54 H GLU 8 H GLU 8 7.951 -17.161 6.740 55 HA GLU 8 HA GLU 8 6.501 -18.614 4.860 56 HB2 GLU 8 HB2 GLU 8 8.089 -19.565 7.278 57 HB3 GLU 8 HB3 GLU 8 7.546 -20.621 5.978 58 HG2 GLU 8 HG2 GLU 8 9.439 -18.256 5.617 59 HG3 GLU 8 HG3 GLU 8 9.928 -19.934 5.780 60 H THR 9 H THR 9 5.653 -18.059 8.278 61 HA THR 9 HA THR 9 3.897 -20.225 8.664 62 HB THR 9 HB THR 9 3.562 -17.414 9.736 63 HG1 THR 9 HG1 THR 9 5.596 -17.891 10.144 64 HG21 THR 9 HG21 THR 9 2.719 -18.604 11.757 65 HG22 THR 9 HG22 THR 9 1.718 -18.916 10.334 66 HG23 THR 9 HG23 THR 9 2.868 -20.153 10.891 67 H ARG 10 H ARG 10 3.265 -17.042 7.022 68 HA ARG 10 HA ARG 10 0.470 -17.518 6.775 69 HB2 ARG 10 HB2 ARG 10 1.512 -15.267 6.492 70 HB3 ARG 10 HB3 ARG 10 2.332 -15.829 5.034 71 HG2 ARG 10 HG2 ARG 10 0.428 -14.531 4.361 72 HG3 ARG 10 HG3 ARG 10 0.122 -16.210 3.950 73 HD2 ARG 10 HD2 ARG 10 -1.043 -16.091 6.443 74 HD3 ARG 10 HD3 ARG 10 -1.244 -14.429 5.946 75 HE ARG 10 HE ARG 10 -2.347 -16.884 4.699 76 HH11 ARG 10 HH11 ARG 10 -2.398 -13.269 4.680 77 HH12 ARG 10 HH12 ARG 10 -3.929 -13.247 3.823 78 HH21 ARG 10 HH21 ARG 10 -4.360 -16.697 3.601 79 HH22 ARG 10 HH22 ARG 10 -4.964 -15.141 3.135 80 H GLU 11 H GLU 11 3.239 -18.400 4.700 81 HA GLU 11 HA GLU 11 1.664 -19.373 2.528 82 HB2 GLU 11 HB2 GLU 11 4.411 -20.447 3.253 83 HB3 GLU 11 HB3 GLU 11 3.663 -20.317 1.668 84 HG2 GLU 11 HG2 GLU 11 4.808 -18.092 3.390 85 HG3 GLU 11 HG3 GLU 11 5.405 -18.672 1.842 86 H HIS 12 H HIS 12 3.165 -20.966 5.381 87 HA HIS 12 HA HIS 12 2.260 -23.607 4.868 88 HB2 HIS 12 HB2 HIS 12 3.955 -23.375 6.461 89 HB3 HIS 12 HB3 HIS 12 3.193 -21.998 7.240 90 HD1 HIS 12 HD1 HIS 12 2.130 -25.757 6.948 91 HD2 HIS 12 HD2 HIS 12 2.339 -22.459 9.555 92 HE1 HIS 12 HE1 HIS 12 1.172 -26.546 9.168 93 H ARG 13 H ARG 13 0.637 -20.882 6.659 94 HA ARG 13 HA ARG 13 -1.551 -22.663 7.445 95 HB2 ARG 13 HB2 ARG 13 -1.393 -19.614 7.462 96 HB3 ARG 13 HB3 ARG 13 -2.736 -20.563 8.085 97 HG2 ARG 13 HG2 ARG 13 0.035 -20.287 9.230 98 HG3 ARG 13 HG3 ARG 13 -1.518 -20.009 9.997 99 HD2 ARG 13 HD2 ARG 13 -0.258 -22.672 9.271 100 HD3 ARG 13 HD3 ARG 13 -0.457 -22.009 10.899 101 HE ARG 13 HE ARG 13 -3.041 -22.186 9.793 102 HH11 ARG 13 HH21 ARG 13 -0.409 -24.522 10.415 103 HH12 ARG 13 HH22 ARG 13 -1.501 -25.819 10.762 104 HH21 ARG 13 HH11 ARG 13 -4.385 -23.813 10.110 105 HH22 ARG 13 HH12 ARG 13 -3.880 -25.433 10.561 106 H ILE 14 H ILE 14 -1.282 -20.153 4.831 107 HA ILE 14 HA ILE 14 -3.915 -20.591 3.998 108 HB ILE 14 HB ILE 14 -2.336 -18.707 3.319 109 HG12 ILE 14 HG12 ILE 14 -4.188 -20.030 1.305 110 HG13 ILE 14 HG13 ILE 14 -4.612 -18.908 2.606 111 HG21 ILE 14 HG21 ILE 14 -0.526 -20.107 2.324 112 HG22 ILE 14 HG22 ILE 14 -1.620 -20.512 0.979 113 HG23 ILE 14 HG23 ILE 14 -1.103 -18.837 1.258 114 HD11 ILE 14 HD11 ILE 14 -3.153 -17.164 1.440 115 HD12 ILE 14 HD12 ILE 14 -3.091 -18.283 0.057 116 HD13 ILE 14 HD13 ILE 14 -4.648 -17.643 0.613 117 H GLU 15 H GLU 15 -0.906 -22.313 3.045 118 HA GLU 15 HA GLU 15 -2.098 -24.044 1.172 119 HB2 GLU 15 HB2 GLU 15 0.292 -23.734 1.377 120 HB3 GLU 15 HB3 GLU 15 0.304 -24.478 2.989 121 HG2 GLU 15 HG2 GLU 15 -0.173 -26.626 2.135 122 HG3 GLU 15 HG3 GLU 15 -0.785 -25.991 0.602 123 H THR 16 H THR 16 -1.429 -24.691 4.684 124 HA THR 16 HA THR 16 -2.766 -27.171 4.546 125 HB THR 16 HB THR 16 -2.508 -27.151 7.046 126 HG1 THR 16 HG1 THR 16 -1.113 -24.730 6.582 127 HG21 THR 16 HG21 THR 16 -0.782 -28.063 5.560 128 HG22 THR 16 HG22 THR 16 -0.035 -26.463 5.393 129 HG23 THR 16 HG23 THR 16 -0.061 -27.285 6.974 130 H GLU 17 H GLU 17 -4.309 -24.157 4.599 131 HA GLU 17 HA GLU 17 -6.746 -25.371 5.848 132 HB2 GLU 17 HB2 GLU 17 -5.835 -22.481 5.663 133 HB3 GLU 17 HB3 GLU 17 -7.422 -23.003 6.237 134 HG2 GLU 17 HG2 GLU 17 -6.433 -24.275 8.066 135 HG3 GLU 17 HG3 GLU 17 -4.805 -23.925 7.500 136 H ILE 18 H ILE 18 -5.576 -23.665 2.920 137 HA ILE 18 HA ILE 18 -8.359 -23.731 1.898 138 HB ILE 18 HB ILE 18 -6.051 -21.943 1.089 139 HG12 ILE 18 HG12 ILE 18 -8.261 -21.582 3.151 140 HG13 ILE 18 HG13 ILE 18 -6.518 -21.427 3.375 141 HG21 ILE 18 HG21 ILE 18 -7.738 -20.578 -0.014 142 HG22 ILE 18 HG22 ILE 18 -7.819 -22.201 -0.654 143 HG23 ILE 18 HG23 ILE 18 -9.024 -21.684 0.539 144 HD11 ILE 18 HD11 ILE 18 -7.331 -19.232 3.434 145 HD12 ILE 18 HD12 ILE 18 -6.645 -19.393 1.804 146 HD13 ILE 18 HD13 ILE 18 -8.401 -19.477 2.043 147 H ILE 19 H ILE 19 -5.046 -24.791 0.972 148 HA ILE 19 HA ILE 19 -6.279 -26.026 -1.444 149 HB ILE 19 HB ILE 19 -4.358 -25.387 -2.777 150 HG12 ILE 19 HG12 ILE 19 -2.846 -24.806 -0.764 151 HG13 ILE 19 HG13 ILE 19 -2.692 -23.944 -2.282 152 HG21 ILE 19 HG21 ILE 19 -6.460 -24.228 -3.012 153 HG22 ILE 19 HG22 ILE 19 -6.000 -23.034 -1.795 154 HG23 ILE 19 HG23 ILE 19 -5.110 -23.133 -3.323 155 HD11 ILE 19 HD11 ILE 19 -4.200 -22.829 0.094 156 HD12 ILE 19 HD12 ILE 19 -2.527 -22.433 -0.337 157 HD13 ILE 19 HD13 ILE 19 -3.843 -21.988 -1.425 158 H VAL 20 H VAL 20 -5.586 -27.259 1.101 159 HA VAL 20 HA VAL 20 -3.337 -28.905 0.968 160 HB VAL 20 HB VAL 20 -4.805 -30.594 2.183 161 HG11 VAL 20 HG11 VAL 20 -3.424 -28.916 3.327 162 HG12 VAL 20 HG12 VAL 20 -4.782 -27.763 3.276 163 HG13 VAL 20 HG13 VAL 20 -4.913 -29.260 4.222 164 HG21 VAL 20 HG21 VAL 20 -6.931 -28.398 2.089 165 HG22 VAL 20 HG22 VAL 20 -7.035 -29.975 1.272 166 HG23 VAL 20 HG23 VAL 20 -6.980 -29.894 3.032 167 H ASP 21 H ASP 21 -6.306 -29.138 -0.921 168 HA ASP 21 HA ASP 21 -5.788 -31.868 -1.788 169 HB2 ASP 21 HB2 ASP 21 -7.968 -31.851 -2.605 170 HB3 ASP 21 HB3 ASP 21 -8.064 -30.877 -1.147 171 H ALA 22 H ALA 22 -4.362 -29.081 -2.838 172 HA ALA 22 HA ALA 22 -4.428 -29.836 -5.723 173 HB1 ALA 22 HB1 ALA 22 -4.922 -27.118 -4.429 174 HB2 ALA 22 HB2 ALA 22 -4.580 -27.350 -6.154 175 HB3 ALA 22 HB3 ALA 22 -6.047 -28.048 -5.439 176 H GLU 23 H GLU 23 -2.518 -29.442 -6.825 177 HA GLU 23 HA GLU 23 -0.170 -28.477 -5.246 178 HB2 GLU 23 HB2 GLU 23 -0.430 -31.018 -6.907 179 HB3 GLU 23 HB3 GLU 23 1.073 -30.412 -6.201 180 HG2 GLU 23 HG2 GLU 23 0.054 -30.579 -3.924 181 HG3 GLU 23 HG3 GLU 23 -1.383 -31.312 -4.643 182 H ASP 24 H ASP 24 -1.979 -27.762 -7.906 183 HA ASP 24 HA ASP 24 0.336 -26.662 -9.419 184 HB2 ASP 24 HB2 ASP 24 -0.358 -28.733 -10.561 185 HB3 ASP 24 HB3 ASP 24 -2.044 -28.207 -10.537 186 H LYS 25 H LYS 25 -0.215 -24.701 -10.535 187 HA LYS 25 HA LYS 25 -1.839 -22.968 -9.103 188 HB2 LYS 25 HB2 LYS 25 -1.459 -21.362 -10.874 189 HB3 LYS 25 HB3 LYS 25 0.014 -22.287 -10.575 190 HG2 LYS 25 HG2 LYS 25 -0.566 -23.743 -12.564 191 HG3 LYS 25 HG3 LYS 25 -1.950 -22.681 -12.880 192 HD2 LYS 25 HD2 LYS 25 -0.435 -20.768 -13.205 193 HD3 LYS 25 HD3 LYS 25 0.967 -21.828 -12.895 194 HE2 LYS 25 HE2 LYS 25 0.256 -23.297 -14.773 195 HE3 LYS 25 HE3 LYS 25 -1.128 -22.249 -15.079 196 HZ1 LYS 25 HZ1 LYS 25 0.429 -20.460 -15.627 197 HZ2 LYS 25 HZ2 LYS 25 1.713 -21.432 -15.341 198 HZ3 LYS 25 HZ3 LYS 25 0.704 -21.754 -16.577 199 H GLU 26 H GLU 26 -2.864 -24.975 -11.932 200 HA GLU 26 HA GLU 26 -5.322 -23.472 -12.317 201 HB2 GLU 26 HB2 GLU 26 -4.357 -26.240 -13.170 202 HB3 GLU 26 HB3 GLU 26 -5.957 -25.634 -13.562 203 HG2 GLU 26 HG2 GLU 26 -4.960 -23.665 -14.708 204 HG3 GLU 26 HG3 GLU 26 -3.343 -24.265 -14.339 205 H GLU 27 H GLU 27 -4.374 -26.384 -10.476 206 HA GLU 27 HA GLU 27 -7.047 -27.017 -9.579 207 HB2 GLU 27 HB2 GLU 27 -4.324 -27.796 -8.445 208 HB3 GLU 27 HB3 GLU 27 -5.864 -28.542 -8.023 209 HG2 GLU 27 HG2 GLU 27 -4.570 -28.558 -10.788 210 HG3 GLU 27 HG3 GLU 27 -4.535 -29.880 -9.630 211 H ARG 28 H ARG 28 -4.319 -25.083 -8.296 212 HA ARG 28 HA ARG 28 -5.652 -24.530 -5.783 213 HB2 ARG 28 HB2 ARG 28 -3.231 -23.244 -7.138 214 HB3 ARG 28 HB3 ARG 28 -3.835 -22.803 -5.526 215 HG2 ARG 28 HG2 ARG 28 -3.687 -25.197 -4.852 216 HG3 ARG 28 HG3 ARG 28 -2.910 -25.588 -6.378 217 HD2 ARG 28 HD2 ARG 28 -0.943 -24.329 -5.787 218 HD3 ARG 28 HD3 ARG 28 -1.765 -23.626 -4.377 219 HE ARG 28 HE ARG 28 -1.776 -26.532 -4.357 220 HH11 ARG 28 HH11 ARG 28 0.237 -23.757 -3.317 221 HH12 ARG 28 HH12 ARG 28 0.905 -24.701 -1.986 222 HH21 ARG 28 HH21 ARG 28 -0.910 -27.591 -2.622 223 HH22 ARG 28 HH22 ARG 28 0.328 -26.791 -1.635 224 H ALA 29 H ALA 29 -5.772 -22.977 -8.970 225 HA ALA 29 HA ALA 29 -7.154 -20.611 -8.065 226 HB1 ALA 29 HB1 ALA 29 -7.915 -20.393 -10.375 227 HB2 ALA 29 HB2 ALA 29 -6.194 -20.816 -10.363 228 HB3 ALA 29 HB3 ALA 29 -7.421 -22.048 -10.748 229 H MET 30 H MET 30 -8.214 -23.954 -8.984 230 HA MET 30 HA MET 30 -10.995 -23.416 -8.516 231 HB2 MET 30 HB2 MET 30 -9.496 -26.049 -8.441 232 HB3 MET 30 HB3 MET 30 -11.245 -25.865 -8.394 233 HG2 MET 30 HG2 MET 30 -9.490 -24.895 -10.681 234 HG3 MET 30 HG3 MET 30 -10.325 -26.436 -10.622 235 HE1 MET 30 HE1 MET 30 -11.795 -22.438 -10.084 236 HE2 MET 30 HE2 MET 30 -10.415 -22.733 -11.170 237 HE3 MET 30 HE3 MET 30 -12.030 -22.398 -11.823 238 H GLY 31 H GLY 31 -8.409 -24.607 -6.308 239 HA2 GLY 31 HA2 GLY 31 -10.028 -25.019 -4.047 240 HA3 GLY 31 HA3 GLY 31 -8.340 -24.494 -4.009 241 H TRP 32 H TRP 32 -8.314 -21.966 -5.000 242 HA TRP 32 HA TRP 32 -9.396 -20.250 -3.077 243 HB2 TRP 32 HB2 TRP 32 -8.386 -19.867 -5.898 244 HB3 TRP 32 HB3 TRP 32 -9.214 -18.550 -5.101 245 HD1 TRP 32 HD1 TRP 32 -5.873 -20.260 -5.172 246 HE1 TRP 32 HE1 TRP 32 -4.214 -18.971 -3.729 247 HE3 TRP 32 HE3 TRP 32 -9.151 -17.094 -2.834 248 HZ2 TRP 32 HZ2 TRP 32 -4.304 -16.857 -1.742 249 HZ3 TRP 32 HZ3 TRP 32 -8.331 -15.455 -1.167 250 HH2 TRP 32 HH2 TRP 32 -5.912 -15.322 -0.616 251 H TYR 33 H TYR 33 -10.697 -20.990 -6.380 252 HA TYR 33 HA TYR 33 -12.957 -19.350 -6.255 253 HB2 TYR 33 HB2 TYR 33 -12.309 -20.292 -8.346 254 HB3 TYR 33 HB3 TYR 33 -12.379 -21.933 -7.723 255 HD1 TYR 33 HD1 TYR 33 -14.413 -19.127 -9.001 256 HD2 TYR 33 HD2 TYR 33 -14.486 -23.132 -7.404 257 HE1 TYR 33 HE1 TYR 33 -16.771 -19.368 -9.705 258 HE2 TYR 33 HE2 TYR 33 -16.884 -23.316 -7.950 259 HH TYR 33 HH TYR 33 -18.720 -22.297 -8.979 260 H TYR 34 H TYR 34 -12.670 -22.807 -5.136 261 HA TYR 34 HA TYR 34 -15.478 -23.073 -4.777 262 HB2 TYR 34 HB2 TYR 34 -13.136 -24.610 -3.585 263 HB3 TYR 34 HB3 TYR 34 -14.813 -25.035 -3.291 264 HD1 TYR 34 HD1 TYR 34 -16.203 -24.892 -5.821 265 HD2 TYR 34 HD2 TYR 34 -12.200 -26.267 -4.968 266 HE1 TYR 34 HE1 TYR 34 -16.268 -26.320 -7.834 267 HE2 TYR 34 HE2 TYR 34 -12.274 -27.731 -6.956 268 HH TYR 34 HH TYR 34 -13.526 -28.439 -8.794 269 H TYR 35 H TYR 35 -12.857 -22.344 -2.343 270 HA TYR 35 HA TYR 35 -14.857 -22.195 -0.265 271 HB2 TYR 35 HB2 TYR 35 -13.206 -21.970 1.196 272 HB3 TYR 35 HB3 TYR 35 -12.200 -22.531 -0.120 273 HD1 TYR 35 HD1 TYR 35 -10.744 -20.905 -1.341 274 HD2 TYR 35 HD2 TYR 35 -13.141 -19.682 2.026 275 HE1 TYR 35 HE1 TYR 35 -9.414 -18.834 -1.160 276 HE2 TYR 35 HE2 TYR 35 -11.836 -17.595 2.214 277 HH TYR 35 HH TYR 35 -10.083 -16.339 1.370 278 H LEU 36 H LEU 36 -13.374 -19.776 -2.460 279 HA LEU 36 HA LEU 36 -14.367 -17.471 -1.150 280 HB2 LEU 36 HB2 LEU 36 -12.629 -17.380 -2.846 281 HB3 LEU 36 HB3 LEU 36 -13.728 -18.042 -4.064 282 HG LEU 36 HG LEU 36 -15.110 -16.012 -3.979 283 HD11 LEU 36 HD11 LEU 36 -14.279 -13.983 -2.801 284 HD12 LEU 36 HD12 LEU 36 -14.749 -15.249 -1.664 285 HD13 LEU 36 HD13 LEU 36 -13.027 -14.961 -2.007 286 HD21 LEU 36 HD21 LEU 36 -12.160 -15.347 -4.348 287 HD22 LEU 36 HD22 LEU 36 -13.132 -16.281 -5.502 288 HD23 LEU 36 HD23 LEU 36 -13.567 -14.612 -5.157 289 H ASP 37 H ASP 37 -15.782 -19.350 -3.928 290 HA ASP 37 HA ASP 37 -18.165 -17.846 -4.157 291 HB2 ASP 37 HB2 ASP 37 -17.445 -19.459 -5.855 292 HB3 ASP 37 HB3 ASP 37 -17.637 -20.792 -4.713 293 H ASP 38 H ASP 38 -17.438 -20.736 -2.147 294 HA ASP 38 HA ASP 38 -19.999 -20.948 -0.931 295 HB2 ASP 38 HB2 ASP 38 -18.307 -22.718 -0.866 296 HB3 ASP 38 HB3 ASP 38 -17.260 -21.712 0.138 297 H THR 39 H THR 39 -17.431 -18.615 -0.303 298 HA THR 39 HA THR 39 -18.471 -17.970 2.389 299 HB THR 39 HB THR 39 -16.058 -16.957 0.829 300 HG1 THR 39 HG1 THR 39 -15.765 -19.022 1.398 301 HG21 THR 39 HG21 THR 39 -16.605 -15.230 2.394 302 HG22 THR 39 HG22 THR 39 -17.001 -16.393 3.667 303 HG23 THR 39 HG23 THR 39 -15.313 -16.176 3.146 304 H LEU 40 H LEU 40 -18.251 -16.523 -0.888 305 HA LEU 40 HA LEU 40 -18.990 -13.876 -0.206 306 HB2 LEU 40 HB2 LEU 40 -19.482 -15.521 -2.716 307 HB3 LEU 40 HB3 LEU 40 -19.876 -13.811 -2.603 308 HG LEU 40 HG LEU 40 -17.063 -14.919 -2.278 309 HD11 LEU 40 HD11 LEU 40 -18.374 -13.616 -4.698 310 HD12 LEU 40 HD12 LEU 40 -16.670 -14.102 -4.564 311 HD13 LEU 40 HD13 LEU 40 -17.938 -15.331 -4.537 312 HD21 LEU 40 HD21 LEU 40 -17.117 -12.831 -1.192 313 HD22 LEU 40 HD22 LEU 40 -16.388 -12.563 -2.769 314 HD23 LEU 40 HD23 LEU 40 -18.077 -12.085 -2.506 315 H GLU 41 H GLU 41 -20.843 -13.171 0.742 316 HA GLU 41 HA GLU 41 -23.287 -14.757 0.768 317 HB2 GLU 41 HB2 GLU 41 -22.489 -12.053 1.917 318 HB3 GLU 41 HB3 GLU 41 -24.104 -12.740 2.124 319 HG2 GLU 41 HG2 GLU 41 -21.625 -14.299 2.893 320 HG3 GLU 41 HG3 GLU 41 -22.375 -13.143 3.993 321 H PHE 42 H PHE 42 -22.785 -14.455 -1.750 322 HA PHE 42 HA PHE 42 -23.692 -12.058 -3.001 323 HB2 PHE 42 HB2 PHE 42 -23.520 -13.247 -5.092 324 HB3 PHE 42 HB3 PHE 42 -22.154 -13.640 -4.083 325 HD1 PHE 42 HD2 PHE 42 -25.417 -14.917 -5.394 326 HD2 PHE 42 HD1 PHE 42 -21.663 -15.947 -3.523 327 HE1 PHE 42 HE2 PHE 42 -25.881 -17.321 -5.771 328 HE2 PHE 42 HE1 PHE 42 -22.137 -18.342 -3.901 329 HZ PHE 42 HZ PHE 42 -24.246 -19.042 -5.021 330 HA PRO 43 HA PRO 43 -24.832 -11.521 -5.125 331 HB2 PRO 43 HB2 PRO 43 -26.835 -9.754 -5.628 332 HB3 PRO 43 HB3 PRO 43 -26.764 -11.379 -6.375 333 HG2 PRO 43 HG2 PRO 43 -28.354 -10.527 -3.937 334 HG3 PRO 43 HG3 PRO 43 -28.921 -11.460 -5.359 335 HD2 PRO 43 HD2 PRO 43 -28.144 -12.673 -3.032 336 HD3 PRO 43 HD3 PRO 43 -27.828 -13.417 -4.626 337 H PHE 44 H PHE 44 -24.009 -9.399 -4.921 338 HA PHE 44 HA PHE 44 -24.611 -7.790 -2.524 339 HB2 PHE 44 HB2 PHE 44 -22.351 -7.655 -1.796 340 HB3 PHE 44 HB3 PHE 44 -22.871 -9.318 -1.737 341 HD1 PHE 44 HD1 PHE 44 -21.995 -10.973 -3.489 342 HD2 PHE 44 HD2 PHE 44 -20.366 -7.023 -3.005 343 HE1 PHE 44 HE1 PHE 44 -19.894 -11.712 -4.558 344 HE2 PHE 44 HE2 PHE 44 -18.259 -7.759 -4.065 345 HZ PHE 44 HZ PHE 44 -18.001 -10.116 -4.820 346 H MET 45 H MET 45 -22.607 -5.835 -2.891 347 HA MET 45 HA MET 45 -22.713 -5.202 -5.775 348 HB2 MET 45 HB2 MET 45 -23.593 -3.089 -5.551 349 HB3 MET 45 HB3 MET 45 -24.659 -4.097 -4.594 350 HG2 MET 45 HG2 MET 45 -24.049 -3.117 -2.602 351 HG3 MET 45 HG3 MET 45 -22.415 -2.748 -3.118 352 HE1 MET 45 HE1 MET 45 -22.726 -1.059 -5.876 353 HE2 MET 45 HE2 MET 45 -22.661 0.541 -5.115 354 HE3 MET 45 HE3 MET 45 -21.620 -0.764 -4.525 355 H GLY 46 H GLY 46 -21.318 -3.453 -6.408 356 HA2 GLY 46 HA2 GLY 46 -19.135 -2.675 -4.586 357 HA3 GLY 46 HA3 GLY 46 -18.692 -3.870 -5.816 358 H LYS 47 H LYS 47 -17.289 -1.798 -5.984 359 HA LYS 47 HA LYS 47 -18.362 -0.309 -8.351 360 HB2 LYS 47 HB2 LYS 47 -17.654 1.010 -6.198 361 HB3 LYS 47 HB3 LYS 47 -16.017 0.514 -6.588 362 HG2 LYS 47 HG2 LYS 47 -16.174 2.626 -7.583 363 HG3 LYS 47 HG3 LYS 47 -16.474 1.540 -8.941 364 HD2 LYS 47 HD2 LYS 47 -18.128 3.227 -9.128 365 HD3 LYS 47 HD3 LYS 47 -18.977 1.837 -8.460 366 HE2 LYS 47 HE2 LYS 47 -18.963 2.795 -6.236 367 HE3 LYS 47 HE3 LYS 47 -17.867 4.089 -6.740 368 HZ1 LYS 47 HZ1 LYS 47 -20.595 3.759 -7.864 369 HZ2 LYS 47 HZ2 LYS 47 -20.235 4.763 -6.614 370 HZ3 LYS 47 HZ3 LYS 47 -19.589 5.020 -8.087 371 H TRP 48 H TRP 48 -17.525 -1.097 -10.200 372 HA TRP 48 HA TRP 48 -15.065 -2.739 -10.182 373 HB2 TRP 48 HB2 TRP 48 -16.992 -3.269 -11.693 374 HB3 TRP 48 HB3 TRP 48 -16.751 -1.734 -12.503 375 HD1 TRP 48 HD1 TRP 48 -13.338 -2.769 -12.091 376 HE1 TRP 48 HE1 TRP 48 -12.409 -4.069 -14.017 377 HE3 TRP 48 HE3 TRP 48 -17.753 -3.935 -14.424 378 HZ2 TRP 48 HZ2 TRP 48 -13.436 -5.628 -16.249 379 HZ3 TRP 48 HZ3 TRP 48 -17.724 -5.364 -16.455 380 HH2 TRP 48 HH2 TRP 48 -15.572 -6.228 -17.352 381 H LYS 49 H LYS 49 -13.261 -1.647 -9.890 382 HA LYS 49 HA LYS 49 -13.011 1.228 -10.439 383 HB2 LYS 49 HB2 LYS 49 -10.932 -0.766 -9.426 384 HB3 LYS 49 HB3 LYS 49 -10.889 0.985 -9.248 385 HG2 LYS 49 HG2 LYS 49 -12.890 -0.903 -7.913 386 HG3 LYS 49 HG3 LYS 49 -11.439 -0.294 -7.162 387 HD2 LYS 49 HD2 LYS 49 -13.629 1.585 -8.155 388 HD3 LYS 49 HD3 LYS 49 -13.643 0.816 -6.566 389 HE2 LYS 49 HE2 LYS 49 -11.240 1.732 -6.276 390 HE3 LYS 49 HE3 LYS 49 -11.617 2.807 -7.632 391 HZ1 LYS 49 HZ1 LYS 49 -13.204 2.609 -5.127 392 HZ2 LYS 49 HZ2 LYS 49 -12.073 3.761 -5.418 393 HZ3 LYS 49 HZ3 LYS 49 -13.415 3.733 -6.346 394 H LYS 50 H LYS 50 -13.535 0.273 -12.875 395 HA LYS 50 HA LYS 50 -11.525 -1.333 -14.154 396 HB2 LYS 50 HB2 LYS 50 -13.837 -1.248 -14.929 397 HB3 LYS 50 HB3 LYS 50 -13.725 0.484 -15.248 398 HG2 LYS 50 HG2 LYS 50 -12.121 0.144 -17.035 399 HG3 LYS 50 HG3 LYS 50 -12.004 -1.585 -16.679 400 HD2 LYS 50 HD2 LYS 50 -14.507 -0.126 -17.652 401 HD3 LYS 50 HD3 LYS 50 -13.387 -1.037 -18.676 402 HE2 LYS 50 HE2 LYS 50 -13.863 -3.095 -17.319 403 HE3 LYS 50 HE3 LYS 50 -15.069 -2.187 -16.402 404 HZ1 LYS 50 HZ1 LYS 50 -16.278 -1.843 -18.499 405 HZ2 LYS 50 HZ2 LYS 50 -15.170 -2.726 -19.315 406 HZ3 LYS 50 HZ3 LYS 50 -16.096 -3.433 -18.173 407 H LYS 51 H LYS 51 -9.488 -0.720 -14.784 408 HA LYS 51 HA LYS 51 -8.664 2.067 -14.931 409 HB2 LYS 51 HB2 LYS 51 -7.478 -0.516 -16.025 410 HB3 LYS 51 HB3 LYS 51 -6.761 1.083 -16.313 411 HG2 LYS 51 HG2 LYS 51 -6.584 1.453 -13.854 412 HG3 LYS 51 HG3 LYS 51 -7.282 -0.144 -13.566 413 HD2 LYS 51 HD2 LYS 51 -4.902 -0.290 -13.289 414 HD3 LYS 51 HD3 LYS 51 -5.349 -1.191 -14.747 415 HE2 LYS 51 HE2 LYS 51 -4.641 0.732 -16.155 416 HE3 LYS 51 HE3 LYS 51 -4.264 1.668 -14.709 417 HZ1 LYS 51 HZ1 LYS 51 -2.896 -0.837 -15.515 418 HZ2 LYS 51 HZ2 LYS 51 -2.282 0.667 -15.650 419 HZ3 LYS 51 HZ3 LYS 51 -2.548 0.032 -14.175 420 H SER 52 H SER 52 -9.323 3.487 -16.475 421 HA SER 52 HA SER 52 -11.364 2.885 -18.180 422 HB2 SER 52 HB2 SER 52 -9.367 5.109 -18.722 423 HB3 SER 52 HB3 SER 52 -11.111 5.087 -19.047 424 HG SER 52 HG SER 52 -10.937 6.181 -17.186 425 H ARG 53 H ARG 53 -7.909 2.992 -19.040 426 HA ARG 53 HA ARG 53 -8.252 1.159 -21.244 427 HB2 ARG 53 HB2 ARG 53 -7.026 3.916 -21.827 428 HB3 ARG 53 HB3 ARG 53 -7.009 2.519 -22.885 429 HG2 ARG 53 HG2 ARG 53 -8.665 3.688 -23.870 430 HG3 ARG 53 HG3 ARG 53 -9.628 2.673 -22.804 431 HD2 ARG 53 HD2 ARG 53 -9.678 4.631 -21.160 432 HD3 ARG 53 HD3 ARG 53 -8.758 5.563 -22.321 433 HE ARG 53 HE ARG 53 -10.608 5.817 -23.677 434 HH11 ARG 53 HH11 ARG 53 -11.524 3.421 -21.227 435 HH12 ARG 53 HH12 ARG 53 -13.098 4.080 -20.933 436 HH21 ARG 53 HH21 ARG 53 -12.841 6.429 -23.621 437 HH22 ARG 53 HH22 ARG 53 -13.936 5.608 -22.573 438 H LYS 54 H LYS 54 -5.507 1.463 -22.118 439 HA LYS 54 HA LYS 54 -4.006 0.579 -19.779 440 HB2 LYS 54 HB2 LYS 54 -3.687 -0.323 -22.102 441 HB3 LYS 54 HB3 LYS 54 -3.003 1.235 -22.582 442 HG2 LYS 54 HG2 LYS 54 -1.191 0.929 -20.868 443 HG3 LYS 54 HG3 LYS 54 -1.944 -0.586 -20.364 444 HD2 LYS 54 HD2 LYS 54 -0.062 -1.083 -21.777 445 HD3 LYS 54 HD3 LYS 54 -1.545 -1.536 -22.630 446 HE2 LYS 54 HE2 LYS 54 -1.435 0.576 -23.941 447 HE3 LYS 54 HE3 LYS 54 0.015 1.059 -23.053 448 HZ1 LYS 54 HZ1 LYS 54 1.154 -0.861 -24.001 449 HZ2 LYS 54 HZ2 LYS 54 -0.188 -1.312 -24.819 450 HZ3 LYS 54 HZ3 LYS 54 0.565 0.084 -25.188 451 H THR 55 H THR 55 -4.636 2.594 -18.566 452 HA THR 55 HA THR 55 -2.524 4.576 -18.607 453 HB THR 55 HB THR 55 -4.053 5.452 -20.337 454 HG1 THR 55 HG1 THR 55 -4.129 7.457 -19.520 455 HG21 THR 55 HG21 THR 55 -6.210 4.523 -19.641 456 HG22 THR 55 HG22 THR 55 -6.192 5.492 -18.158 457 HG23 THR 55 HG23 THR 55 -6.310 6.282 -19.745 458 H SER 56 H SER 56 -3.041 6.166 -16.715 459 HA SER 56 HA SER 56 -3.526 4.588 -14.352 460 HB2 SER 56 HB2 SER 56 -3.202 7.603 -14.624 461 HB3 SER 56 HB3 SER 56 -2.909 6.617 -13.181 462 HG SER 56 HG SER 56 -0.971 7.140 -14.296 463 H THR 57 H THR 57 -5.591 6.645 -16.359 464 HA THR 57 HA THR 57 -7.430 7.525 -14.451 465 HB THR 57 HB THR 57 -8.163 6.785 -17.293 466 HG1 THR 57 HG1 THR 57 -7.120 8.636 -17.987 467 HG21 THR 57 HG21 THR 57 -9.926 7.860 -15.908 468 HG22 THR 57 HG22 THR 57 -8.827 9.203 -15.538 469 HG23 THR 57 HG23 THR 57 -9.398 8.939 -17.202 470 H ILE 58 H ILE 58 -9.518 6.752 -13.833 471 HA ILE 58 HA ILE 58 -10.101 3.897 -14.368 472 HB ILE 58 HB ILE 58 -10.035 5.358 -11.711 473 HG12 ILE 58 HG12 ILE 58 -8.650 2.873 -12.813 474 HG13 ILE 58 HG13 ILE 58 -7.913 4.433 -12.439 475 HG21 ILE 58 HG21 ILE 58 -12.139 4.097 -11.756 476 HG22 ILE 58 HG22 ILE 58 -11.272 2.648 -12.282 477 HG23 ILE 58 HG23 ILE 58 -11.013 3.334 -10.658 478 HD11 ILE 58 HD11 ILE 58 -7.301 2.920 -10.712 479 HD12 ILE 58 HD12 ILE 58 -8.482 4.049 -10.013 480 HD13 ILE 58 HD13 ILE 58 -8.968 2.391 -10.465 481 H GLU 59 H GLU 59 -12.141 3.382 -14.671 482 HA GLU 59 HA GLU 59 -14.299 5.434 -14.634 483 HB2 GLU 59 HB2 GLU 59 -13.889 2.859 -16.231 484 HB3 GLU 59 HB3 GLU 59 -15.487 3.568 -15.962 485 HG2 GLU 59 HG2 GLU 59 -14.658 5.728 -16.961 486 HG3 GLU 59 HG3 GLU 59 -13.151 4.912 -17.369 487 H GLU 60 H GLU 60 -15.059 5.310 -12.585 488 HA GLU 60 HA GLU 60 -15.103 2.788 -11.064 489 HB2 GLU 60 HB2 GLU 60 -15.987 5.643 -10.419 490 HB3 GLU 60 HB3 GLU 60 -16.102 4.273 -9.312 491 HG2 GLU 60 HG2 GLU 60 -13.599 3.950 -9.570 492 HG3 GLU 60 HG3 GLU 60 -13.558 5.481 -10.456 493 H LYS 61 H LYS 61 -16.579 1.431 -12.095 494 HA LYS 61 HA LYS 61 -19.259 2.507 -12.844 495 HB2 LYS 61 HB2 LYS 61 -17.977 1.279 -14.541 496 HB3 LYS 61 HB3 LYS 61 -17.855 -0.122 -13.466 497 HG2 LYS 61 HG2 LYS 61 -20.249 -0.483 -13.526 498 HG3 LYS 61 HG3 LYS 61 -20.508 0.993 -14.452 499 HD2 LYS 61 HD2 LYS 61 -18.744 -1.291 -15.454 500 HD3 LYS 61 HD3 LYS 61 -20.477 -1.297 -15.711 501 HE2 LYS 61 HE2 LYS 61 -18.584 0.897 -16.677 502 HE3 LYS 61 HE3 LYS 61 -19.206 -0.429 -17.666 503 HZ1 LYS 61 HZ1 LYS 61 -20.881 1.654 -16.401 504 HZ2 LYS 61 HZ2 LYS 61 -20.521 1.547 -17.997 505 HZ3 LYS 61 HZ3 LYS 61 -21.456 0.402 -17.276 506 H THR 62 H THR 62 -20.842 2.318 -11.261 507 HA THR 62 HA THR 62 -20.570 0.513 -9.048 508 HB THR 62 HB THR 62 -23.148 1.804 -10.003 509 HG1 THR 62 HG1 THR 62 -22.439 3.706 -9.390 510 HG21 THR 62 HG21 THR 62 -23.185 0.332 -7.963 511 HG22 THR 62 HG22 THR 62 -21.954 1.369 -7.220 512 HG23 THR 62 HG23 THR 62 -23.569 2.020 -7.588 513 H VAL 63 H VAL 63 -21.218 -1.548 -8.829 514 HA VAL 63 HA VAL 63 -22.920 -2.782 -10.952 515 HB VAL 63 HB VAL 63 -21.339 -4.719 -10.943 516 HG11 VAL 63 HG11 VAL 63 -20.024 -2.166 -11.959 517 HG12 VAL 63 HG12 VAL 63 -19.789 -3.815 -12.560 518 HG13 VAL 63 HG13 VAL 63 -21.354 -3.016 -12.777 519 HG21 VAL 63 HG21 VAL 63 -20.054 -4.239 -8.867 520 HG22 VAL 63 HG22 VAL 63 -19.006 -4.439 -10.276 521 HG23 VAL 63 HG23 VAL 63 -19.335 -2.815 -9.652 522 H GLU 64 H GLU 64 -24.092 -4.589 -10.366 523 HA GLU 64 HA GLU 64 -24.225 -5.213 -7.441 524 HB2 GLU 64 HB2 GLU 64 -26.372 -4.555 -8.520 525 HB3 GLU 64 HB3 GLU 64 -26.203 -5.894 -9.660 526 HG2 GLU 64 HG2 GLU 64 -26.260 -7.503 -7.774 527 HG3 GLU 64 HG3 GLU 64 -26.313 -6.165 -6.625 528 H VAL 65 H VAL 65 -23.115 -7.060 -6.932 529 HA VAL 65 HA VAL 65 -21.884 -8.588 -9.139 530 HB VAL 65 HB VAL 65 -21.232 -8.726 -6.168 531 HG11 VAL 65 HG11 VAL 65 -20.416 -10.585 -7.585 532 HG12 VAL 65 HG12 VAL 65 -19.720 -9.411 -8.728 533 HG13 VAL 65 HG13 VAL 65 -19.054 -9.567 -7.093 534 HG21 VAL 65 HG21 VAL 65 -19.300 -7.221 -6.653 535 HG22 VAL 65 HG22 VAL 65 -19.970 -6.893 -8.263 536 HG23 VAL 65 HG23 VAL 65 -20.840 -6.384 -6.803 537 H LEU 66 H LEU 66 -23.007 -10.300 -9.772 538 HA LEU 66 HA LEU 66 -25.353 -11.106 -8.247 539 HB2 LEU 66 HB2 LEU 66 -24.240 -12.240 -10.840 540 HB3 LEU 66 HB3 LEU 66 -25.861 -12.478 -10.197 541 HG LEU 66 HG LEU 66 -24.677 -9.867 -11.242 542 HD11 LEU 66 HD11 LEU 66 -26.947 -11.612 -12.279 543 HD12 LEU 66 HD12 LEU 66 -26.364 -10.096 -12.998 544 HD13 LEU 66 HD13 LEU 66 -25.310 -11.519 -12.959 545 HD21 LEU 66 HD21 LEU 66 -26.956 -8.911 -10.927 546 HD22 LEU 66 HD22 LEU 66 -27.438 -10.378 -10.046 547 HD23 LEU 66 HD23 LEU 66 -26.177 -9.302 -9.398 548 H GLY 67 H GLY 67 -22.130 -12.467 -8.856 549 HA2 GLY 67 HA2 GLY 67 -21.911 -14.272 -6.829 550 HA3 GLY 67 HA3 GLY 67 -22.768 -15.165 -8.110 551 H MET 68 H MET 68 -20.385 -16.182 -7.700 552 HA MET 68 HA MET 68 -18.234 -14.955 -9.212 553 HB2 MET 68 HB2 MET 68 -18.618 -17.846 -8.365 554 HB3 MET 68 HB3 MET 68 -17.209 -17.182 -9.196 555 HG2 MET 68 HG2 MET 68 -17.336 -15.390 -7.184 556 HG3 MET 68 HG3 MET 68 -18.119 -16.748 -6.383 557 HE1 MET 68 HE1 MET 68 -13.738 -16.526 -7.870 558 HE2 MET 68 HE2 MET 68 -15.086 -16.545 -9.016 559 HE3 MET 68 HE3 MET 68 -14.909 -15.190 -7.879 560 H ALA 69 H ALA 69 -17.438 -15.565 -11.221 561 HA ALA 69 HA ALA 69 -19.363 -16.100 -13.329 562 HB1 ALA 69 HB1 ALA 69 -16.319 -16.127 -13.346 563 HB2 ALA 69 HB2 ALA 69 -17.367 -15.931 -14.756 564 HB3 ALA 69 HB3 ALA 69 -17.306 -14.653 -13.542 565 HA PRO 70 HA PRO 70 -19.000 -20.571 -13.700 566 HB2 PRO 70 HB2 PRO 70 -17.607 -20.082 -16.346 567 HB3 PRO 70 HB3 PRO 70 -18.875 -21.288 -15.950 568 HG2 PRO 70 HG2 PRO 70 -19.556 -18.999 -17.216 569 HG3 PRO 70 HG3 PRO 70 -20.561 -19.581 -15.847 570 HD2 PRO 70 HD2 PRO 70 -18.429 -17.444 -15.847 571 HD3 PRO 70 HD3 PRO 70 -20.043 -17.417 -15.070 572 H ASP 71 H ASP 71 -17.503 -22.160 -13.192 573 HA ASP 71 HA ASP 71 -14.987 -21.435 -12.171 574 HB2 ASP 71 HB2 ASP 71 -14.629 -23.696 -11.723 575 HB3 ASP 71 HB3 ASP 71 -16.366 -23.489 -11.588 576 H ASP 72 H ASP 72 -15.938 -22.403 -15.429 577 HA ASP 72 HA ASP 72 -13.447 -23.091 -16.539 578 HB2 ASP 72 HB2 ASP 72 -15.573 -23.421 -17.693 579 HB3 ASP 72 HB3 ASP 72 -15.830 -21.676 -17.786 580 H GLU 73 H GLU 73 -14.797 -19.843 -15.834 581 HA GLU 73 HA GLU 73 -12.556 -18.510 -17.217 582 HB2 GLU 73 HB2 GLU 73 -14.924 -17.531 -15.577 583 HB3 GLU 73 HB3 GLU 73 -13.590 -16.459 -15.974 584 HG2 GLU 73 HG2 GLU 73 -15.256 -17.957 -18.032 585 HG3 GLU 73 HG3 GLU 73 -15.517 -16.288 -17.531 586 H CYS 74 H CYS 74 -13.560 -19.462 -13.956 587 HA CYS 74 HA CYS 74 -11.601 -17.850 -12.638 588 HB2 CYS 74 HB2 CYS 74 -13.328 -20.092 -11.540 589 HB3 CYS 74 HB3 CYS 74 -12.425 -18.899 -10.594 590 HG CYS 74 HG CYS 74 -14.959 -18.488 -12.694 591 H LEU 75 H LEU 75 -10.653 -20.090 -14.536 592 HA LEU 75 HA LEU 75 -9.163 -21.959 -12.885 593 HB2 LEU 75 HB2 LEU 75 -9.809 -21.591 -15.744 594 HB3 LEU 75 HB3 LEU 75 -8.104 -21.877 -15.549 595 HG LEU 75 HG LEU 75 -9.093 -23.944 -15.987 596 HD11 LEU 75 HD11 LEU 75 -7.338 -23.889 -14.189 597 HD12 LEU 75 HD12 LEU 75 -8.629 -24.038 -12.979 598 HD13 LEU 75 HD13 LEU 75 -8.387 -25.318 -14.175 599 HD21 LEU 75 HD21 LEU 75 -10.880 -24.978 -14.657 600 HD22 LEU 75 HD22 LEU 75 -11.012 -23.501 -13.681 601 HD23 LEU 75 HD23 LEU 75 -11.410 -23.461 -15.405 602 H LYS 76 H LYS 76 -8.666 -18.720 -13.667 603 HA LYS 76 HA LYS 76 -5.698 -18.924 -13.409 604 HB2 LYS 76 HB2 LYS 76 -5.489 -17.296 -15.256 605 HB3 LYS 76 HB3 LYS 76 -6.245 -18.804 -15.772 606 HG2 LYS 76 HG2 LYS 76 -8.507 -17.651 -15.522 607 HG3 LYS 76 HG3 LYS 76 -7.637 -16.135 -15.260 608 HD2 LYS 76 HD2 LYS 76 -6.641 -16.277 -17.480 609 HD3 LYS 76 HD3 LYS 76 -7.368 -17.865 -17.759 610 HE2 LYS 76 HE2 LYS 76 -8.932 -15.284 -17.260 611 HE3 LYS 76 HE3 LYS 76 -8.599 -15.961 -18.855 612 HZ1 LYS 76 HZ1 LYS 76 -9.870 -17.919 -18.241 613 HZ2 LYS 76 HZ2 LYS 76 -10.199 -17.311 -16.747 614 HZ3 LYS 76 HZ3 LYS 76 -10.809 -16.592 -18.079 615 H ASP 77 H ASP 77 -8.641 -16.977 -12.936 616 HA ASP 77 HA ASP 77 -7.358 -15.271 -10.940 617 HB2 ASP 77 HB2 ASP 77 -6.734 -14.145 -13.060 618 HB3 ASP 77 HB3 ASP 77 -8.410 -14.200 -13.599 619 H MET 78 H MET 78 -9.201 -13.987 -9.888 620 HA MET 78 HA MET 78 -11.594 -15.758 -9.891 621 HB2 MET 78 HB2 MET 78 -10.789 -13.485 -8.047 622 HB3 MET 78 HB3 MET 78 -12.255 -14.448 -7.882 623 HG2 MET 78 HG2 MET 78 -9.412 -15.525 -7.717 624 HG3 MET 78 HG3 MET 78 -10.476 -15.188 -6.365 625 HE1 MET 78 HE1 MET 78 -10.211 -19.039 -8.770 626 HE2 MET 78 HE2 MET 78 -10.085 -17.501 -9.636 627 HE3 MET 78 HE3 MET 78 -8.936 -17.883 -8.332 628 H TYR 79 H TYR 79 -13.494 -15.226 -10.849 629 HA TYR 79 HA TYR 79 -13.894 -12.438 -11.835 630 HB2 TYR 79 HB2 TYR 79 -14.357 -15.109 -13.207 631 HB3 TYR 79 HB3 TYR 79 -15.047 -13.598 -13.774 632 HD1 TYR 79 HD2 TYR 79 -13.620 -11.806 -14.719 633 HD2 TYR 79 HD1 TYR 79 -12.049 -15.675 -13.641 634 HE1 TYR 79 HE2 TYR 79 -11.670 -11.411 -16.179 635 HE2 TYR 79 HE1 TYR 79 -10.071 -15.276 -15.055 636 HH TYR 79 HH TYR 79 -9.635 -12.265 -16.975 637 H VAL 80 H VAL 80 -16.060 -11.758 -11.974 638 HA VAL 80 HA VAL 80 -18.139 -13.450 -10.671 639 HB VAL 80 HB VAL 80 -18.850 -11.300 -9.546 640 HG11 VAL 80 HG11 VAL 80 -17.924 -13.082 -8.219 641 HG12 VAL 80 HG12 VAL 80 -16.261 -12.609 -8.630 642 HG13 VAL 80 HG13 VAL 80 -17.289 -11.554 -7.634 643 HG21 VAL 80 HG21 VAL 80 -17.390 -9.711 -10.812 644 HG22 VAL 80 HG22 VAL 80 -17.186 -9.582 -9.061 645 HG23 VAL 80 HG23 VAL 80 -15.963 -10.419 -10.029 646 H GLU 81 H GLU 81 -20.267 -12.999 -11.290 647 HA GLU 81 HA GLU 81 -20.583 -11.651 -13.919 648 HB2 GLU 81 HB2 GLU 81 -22.523 -13.175 -12.119 649 HB3 GLU 81 HB3 GLU 81 -22.967 -12.370 -13.635 650 HG2 GLU 81 HG2 GLU 81 -21.269 -13.808 -14.824 651 HG3 GLU 81 HG3 GLU 81 -21.021 -14.685 -13.312 652 H VAL 82 H VAL 82 -21.669 -9.685 -14.085 653 HA VAL 82 HA VAL 82 -22.459 -8.318 -11.577 654 HB VAL 82 HB VAL 82 -21.162 -6.311 -12.466 655 HG11 VAL 82 HG11 VAL 82 -20.479 -7.534 -10.466 656 HG12 VAL 82 HG12 VAL 82 -19.534 -8.673 -11.453 657 HG13 VAL 82 HG13 VAL 82 -19.080 -6.958 -11.374 658 HG21 VAL 82 HG21 VAL 82 -20.609 -7.218 -14.738 659 HG22 VAL 82 HG22 VAL 82 -19.227 -6.607 -13.841 660 HG23 VAL 82 HG23 VAL 82 -19.490 -8.362 -13.965 661 H ALA 83 H ALA 83 -24.065 -6.904 -11.811 662 HA ALA 83 HA ALA 83 -25.160 -6.487 -14.568 663 HB1 ALA 83 HB1 ALA 83 -26.545 -6.134 -11.890 664 HB2 ALA 83 HB2 ALA 83 -27.255 -5.899 -13.509 665 HB3 ALA 83 HB3 ALA 83 -26.751 -7.518 -12.989 666 H ASP 84 H ASP 84 -25.128 -4.399 -15.360 667 HA ASP 84 HA ASP 84 -23.304 -2.584 -13.968 668 HB2 ASP 84 HB2 ASP 84 -23.031 -3.089 -16.341 669 HB3 ASP 84 HB3 ASP 84 -24.645 -2.447 -16.683 670 H ILE 85 H ILE 85 -25.020 -2.407 -12.216 671 HA ILE 85 HA ILE 85 -27.373 -0.869 -12.633 672 HB ILE 85 HB ILE 85 -27.431 -0.553 -10.240 673 HG12 ILE 85 HG12 ILE 85 -24.675 -1.797 -10.094 674 HG13 ILE 85 HG13 ILE 85 -25.010 -0.085 -9.850 675 HG21 ILE 85 HG21 ILE 85 -26.470 -3.381 -10.845 676 HG22 ILE 85 HG22 ILE 85 -27.669 -2.862 -9.640 677 HG23 ILE 85 HG23 ILE 85 -28.046 -2.743 -11.355 678 HD11 ILE 85 HD11 ILE 85 -26.072 -2.346 -8.102 679 HD12 ILE 85 HD12 ILE 85 -24.769 -1.238 -7.698 680 HD13 ILE 85 HD13 ILE 85 -26.420 -0.615 -7.892 681 H GLY 86 H GLY 86 -24.174 0.204 -12.943 682 HA2 GLY 86 HA2 GLY 86 -24.754 3.020 -12.264 683 HA3 GLY 86 HA3 GLY 86 -23.212 2.309 -12.757 684 H GLY 87 H GLY 87 -24.914 0.930 -15.075 685 HA2 GLY 87 HA2 GLY 87 -24.947 3.319 -16.897 686 HA3 GLY 87 HA3 GLY 87 -23.967 1.879 -17.181 687 H LYS 88 H LYS 88 -26.312 0.102 -16.250 688 HA LYS 88 HA LYS 88 -28.149 0.454 -18.585 689 HB2 LYS 88 HB2 LYS 88 -26.641 -2.092 -17.825 690 HB3 LYS 88 HB3 LYS 88 -27.962 -2.038 -18.969 691 HG2 LYS 88 HG2 LYS 88 -25.289 -0.611 -19.301 692 HG3 LYS 88 HG3 LYS 88 -25.735 -2.140 -20.039 693 HD2 LYS 88 HD2 LYS 88 -27.091 0.532 -20.606 694 HD3 LYS 88 HD3 LYS 88 -25.885 -0.264 -21.619 695 HE2 LYS 88 HE2 LYS 88 -27.414 -2.217 -21.897 696 HE3 LYS 88 HE3 LYS 88 -28.639 -1.386 -20.929 697 HZ1 LYS 88 HZ1 LYS 88 -27.567 -0.417 -23.516 698 HZ2 LYS 88 HZ2 LYS 88 -29.031 -1.090 -23.288 699 HZ3 LYS 88 HZ3 LYS 88 -28.696 0.357 -22.621 700 H ASP 89 H ASP 89 -27.457 -1.137 -15.500 701 HA ASP 89 HA ASP 89 -28.582 -2.091 -13.890 702 HB2 ASP 89 HB2 ASP 89 -29.691 0.028 -13.616 703 HB3 ASP 89 HB3 ASP 89 -30.896 -0.380 -14.835 704 H ASP 90 H ASP 90 -30.161 -2.413 -17.011 705 HA ASP 90 HA ASP 90 -31.618 -4.829 -16.180 706 HB2 ASP 90 HB2 ASP 90 -32.692 -2.880 -17.325 707 HB3 ASP 90 HB3 ASP 90 -31.660 -3.179 -18.726 708 H ASP 91 H ASP 91 -28.529 -4.445 -17.150 709 HA ASP 91 HA ASP 91 -28.529 -6.967 -18.703 710 HB2 ASP 91 HB2 ASP 91 -28.342 -4.932 -20.254 711 HB3 ASP 91 HB3 ASP 91 -26.754 -4.668 -19.507 712 H VAL 92 H VAL 92 -26.422 -7.940 -18.823 713 HA VAL 92 HA VAL 92 -24.873 -7.626 -16.311 714 HB VAL 92 HB VAL 92 -26.008 -10.184 -17.516 715 HG11 VAL 92 HG11 VAL 92 -24.595 -9.816 -14.846 716 HG12 VAL 92 HG12 VAL 92 -25.335 -11.310 -15.452 717 HG13 VAL 92 HG13 VAL 92 -23.928 -10.647 -16.269 718 HG21 VAL 92 HG21 VAL 92 -26.918 -8.619 -15.067 719 HG22 VAL 92 HG22 VAL 92 -27.858 -8.940 -16.539 720 HG23 VAL 92 HG23 VAL 92 -27.450 -10.268 -15.462 721 H TYR 93 H TYR 93 -22.772 -8.278 -16.361 722 HA TYR 93 HA TYR 93 -21.471 -9.242 -18.847 723 HB2 TYR 93 HB2 TYR 93 -20.541 -6.895 -17.130 724 HB3 TYR 93 HB3 TYR 93 -19.719 -7.536 -18.538 725 HD1 TYR 93 HD1 TYR 93 -20.557 -7.111 -20.827 726 HD2 TYR 93 HD2 TYR 93 -22.487 -5.416 -17.357 727 HE1 TYR 93 HE1 TYR 93 -21.713 -5.469 -22.276 728 HE2 TYR 93 HE2 TYR 93 -23.657 -3.781 -18.795 729 HH TYR 93 HH TYR 93 -23.934 -2.967 -20.971 730 H THR 94 H THR 94 -18.896 -9.345 -17.914 731 HA THR 94 HA THR 94 -18.949 -10.660 -15.249 732 HB THR 94 HB THR 94 -17.329 -11.485 -17.692 733 HG1 THR 94 HG1 THR 94 -19.480 -12.158 -17.749 734 HG21 THR 94 HG21 THR 94 -15.971 -11.898 -15.717 735 HG22 THR 94 HG22 THR 94 -17.345 -12.628 -14.862 736 HG23 THR 94 HG23 THR 94 -16.630 -13.436 -16.275 737 H ALA 95 H ALA 95 -17.169 -10.152 -13.973 738 HA ALA 95 HA ALA 95 -15.241 -8.119 -14.961 739 HB1 ALA 95 HB1 ALA 95 -16.875 -7.935 -12.389 740 HB2 ALA 95 HB2 ALA 95 -15.532 -6.857 -12.831 741 HB3 ALA 95 HB3 ALA 95 -17.011 -6.864 -13.801 742 H LYS 96 H LYS 96 -13.332 -8.015 -13.701 743 HA LYS 96 HA LYS 96 -12.432 -10.547 -12.506 744 HB2 LYS 96 HB2 LYS 96 -11.240 -7.752 -12.659 745 HB3 LYS 96 HB3 LYS 96 -10.380 -9.159 -12.056 746 HG2 LYS 96 HG2 LYS 96 -10.037 -10.043 -14.163 747 HG3 LYS 96 HG3 LYS 96 -11.464 -9.300 -14.875 748 HD2 LYS 96 HD2 LYS 96 -9.127 -7.588 -13.952 749 HD3 LYS 96 HD3 LYS 96 -9.128 -8.373 -15.539 750 HE2 LYS 96 HE2 LYS 96 -11.110 -7.245 -16.252 751 HE3 LYS 96 HE3 LYS 96 -11.454 -6.620 -14.637 752 HZ1 LYS 96 HZ1 LYS 96 -9.860 -5.004 -14.837 753 HZ2 LYS 96 HZ2 LYS 96 -8.959 -5.819 -15.969 754 HZ3 LYS 96 HZ3 LYS 96 -10.361 -5.098 -16.375 755 H LEU 97 H LEU 97 -12.806 -10.977 -10.306 756 HA LEU 97 HA LEU 97 -14.095 -9.041 -8.564 757 HB2 LEU 97 HB2 LEU 97 -14.251 -11.480 -8.173 758 HB3 LEU 97 HB3 LEU 97 -12.501 -11.566 -7.947 759 HG LEU 97 HG LEU 97 -12.674 -10.120 -5.927 760 HD11 LEU 97 HD11 LEU 97 -14.687 -8.800 -6.416 761 HD12 LEU 97 HD12 LEU 97 -15.685 -10.272 -6.433 762 HD13 LEU 97 HD13 LEU 97 -14.935 -9.706 -4.930 763 HD21 LEU 97 HD21 LEU 97 -13.673 -11.819 -4.494 764 HD22 LEU 97 HD22 LEU 97 -14.519 -12.534 -5.885 765 HD23 LEU 97 HD23 LEU 97 -12.738 -12.567 -5.784 766 H SER 98 H SER 98 -10.792 -10.126 -9.199 767 HA SER 98 HA SER 98 -9.187 -8.678 -7.557 768 HB2 SER 98 HB2 SER 98 -8.741 -9.258 -10.509 769 HB3 SER 98 HB3 SER 98 -7.540 -9.250 -9.213 770 HG SER 98 HG SER 98 -8.398 -11.408 -9.903 771 H ASP 99 H ASP 99 -11.331 -7.240 -9.893 772 HA ASP 99 HA ASP 99 -9.798 -4.695 -9.797 773 HB2 ASP 99 HB2 ASP 99 -9.864 -6.018 -12.007 774 HB3 ASP 99 HB3 ASP 99 -11.588 -5.625 -12.060 775 H ILE 100 H ILE 100 -12.157 -6.030 -8.280 776 HA ILE 100 HA ILE 100 -14.032 -3.717 -8.413 777 HB ILE 100 HB ILE 100 -14.434 -6.657 -8.212 778 HG12 ILE 100 HG12 ILE 100 -16.188 -4.364 -9.173 779 HG13 ILE 100 HG13 ILE 100 -14.993 -5.207 -10.177 780 HG21 ILE 100 HG21 ILE 100 -16.387 -4.877 -6.711 781 HG22 ILE 100 HG22 ILE 100 -16.540 -6.617 -7.023 782 HG23 ILE 100 HG23 ILE 100 -15.271 -6.048 -5.961 783 HD11 ILE 100 HD11 ILE 100 -17.567 -6.342 -9.023 784 HD12 ILE 100 HD12 ILE 100 -17.157 -6.039 -10.712 785 HD13 ILE 100 HD13 ILE 100 -16.310 -7.326 -9.826 786 H GLU 101 H GLU 101 -14.888 -2.967 -6.547 787 HA GLU 101 HA GLU 101 -13.404 -3.455 -4.002 788 HB2 GLU 101 HB2 GLU 101 -12.815 -1.273 -4.904 789 HB3 GLU 101 HB3 GLU 101 -14.517 -0.879 -5.196 790 HG2 GLU 101 HG2 GLU 101 -14.989 -0.782 -2.826 791 HG3 GLU 101 HG3 GLU 101 -13.412 -1.470 -2.431 792 H ALA 102 H ALA 102 -14.763 -4.400 -2.581 793 HA ALA 102 HA ALA 102 -17.570 -4.785 -3.307 794 HB1 ALA 102 HB1 ALA 102 -16.120 -6.564 -2.340 795 HB2 ALA 102 HB2 ALA 102 -16.041 -5.659 -0.812 796 HB3 ALA 102 HB3 ALA 102 -17.598 -6.284 -1.402 797 H ILE 103 H ILE 103 -19.310 -3.816 -2.414 798 HA ILE 103 HA ILE 103 -18.943 -1.865 -0.178 799 HB ILE 103 HB ILE 103 -20.391 -1.634 -2.829 800 HG12 ILE 103 HG12 ILE 103 -18.277 0.150 -1.540 801 HG13 ILE 103 HG13 ILE 103 -17.930 -1.090 -2.742 802 HG21 ILE 103 HG21 ILE 103 -21.898 -0.727 -1.077 803 HG22 ILE 103 HG22 ILE 103 -20.580 0.311 -0.484 804 HG23 ILE 103 HG23 ILE 103 -21.281 0.551 -2.100 805 HD11 ILE 103 HD11 ILE 103 -17.965 1.009 -3.851 806 HD12 ILE 103 HD12 ILE 103 -19.373 0.068 -4.388 807 HD13 ILE 103 HD13 ILE 103 -19.570 1.410 -3.230 808 H ASP 104 H ASP 104 -20.362 -2.037 1.452 809 HA ASP 104 HA ASP 104 -22.033 -2.688 2.760 810 HB2 ASP 104 HB2 ASP 104 -23.331 -1.386 1.097 811 HB3 ASP 104 HB3 ASP 104 -23.720 -2.882 0.248 812 H VAL 105 H VAL 105 -20.266 -4.777 1.603 813 HA VAL 105 HA VAL 105 -21.831 -7.233 1.546 814 HB VAL 105 HB VAL 105 -19.432 -8.221 1.728 815 HG11 VAL 105 HG11 VAL 105 -20.257 -6.538 -0.649 816 HG12 VAL 105 HG12 VAL 105 -19.074 -7.875 -0.660 817 HG13 VAL 105 HG13 VAL 105 -20.759 -8.208 -0.259 818 HG21 VAL 105 HG21 VAL 105 -17.577 -6.881 1.145 819 HG22 VAL 105 HG22 VAL 105 -18.563 -5.423 0.914 820 HG23 VAL 105 HG23 VAL 105 -18.339 -6.107 2.545 821 H ASP 106 H ASP 106 -21.237 -9.041 2.966 822 HA ASP 106 HA ASP 106 -21.457 -8.404 5.819 823 HB2 ASP 106 HB2 ASP 106 -22.511 -10.434 4.865 824 HB3 ASP 106 HB3 ASP 106 -20.918 -11.011 4.349 825 H ASP 107 H ASP 107 -19.784 -9.108 7.347 826 HA ASP 107 HA ASP 107 -17.178 -8.107 6.761 827 HB2 ASP 107 HB2 ASP 107 -18.100 -8.191 9.024 828 HB3 ASP 107 HB3 ASP 107 -18.156 -9.956 8.967 829 H ASP 108 H ASP 108 -18.399 -11.536 6.770 830 HA ASP 108 HA ASP 108 -15.691 -12.529 6.436 831 HB2 ASP 108 HB2 ASP 108 -17.736 -13.752 7.451 832 HB3 ASP 108 HB3 ASP 108 -18.218 -14.067 5.775 833 H THR 109 H THR 109 -18.223 -11.423 4.307 834 HA THR 109 HA THR 109 -17.170 -12.575 1.833 835 HB THR 109 HB THR 109 -19.157 -10.358 2.478 836 HG1 THR 109 HG1 THR 109 -19.623 -12.630 2.947 837 HG21 THR 109 HG21 THR 109 -18.224 -9.999 0.187 838 HG22 THR 109 HG22 THR 109 -18.700 -11.658 -0.222 839 HG23 THR 109 HG23 THR 109 -19.936 -10.468 0.186 840 H GLN 110 H GLN 110 -17.082 -9.326 3.485 841 HA GLN 110 HA GLN 110 -15.407 -8.086 1.611 842 HB2 GLN 110 HB2 GLN 110 -16.730 -7.204 3.759 843 HB3 GLN 110 HB3 GLN 110 -15.192 -7.436 4.568 844 HG2 GLN 110 HG2 GLN 110 -15.712 -5.699 2.106 845 HG3 GLN 110 HG3 GLN 110 -15.534 -5.118 3.751 846 HE21 GLN 110 HE22 GLN 110 -13.857 -5.665 0.839 847 HE22 GLN 110 HE21 GLN 110 -12.236 -5.582 1.472 848 H GLU 111 H GLU 111 -14.533 -9.910 4.607 849 HA GLU 111 HA GLU 111 -11.745 -9.520 4.381 850 HB2 GLU 111 HB2 GLU 111 -13.442 -11.669 5.702 851 HB3 GLU 111 HB3 GLU 111 -11.687 -11.641 5.847 852 HG2 GLU 111 HG2 GLU 111 -13.438 -9.267 6.652 853 HG3 GLU 111 HG3 GLU 111 -12.987 -10.565 7.749 854 H ALA 112 H ALA 112 -13.839 -12.027 2.860 855 HA ALA 112 HA ALA 112 -11.642 -13.661 1.960 856 HB1 ALA 112 HB1 ALA 112 -14.448 -13.367 0.790 857 HB2 ALA 112 HB2 ALA 112 -13.295 -14.678 0.461 858 HB3 ALA 112 HB3 ALA 112 -13.968 -14.487 2.087 859 H ILE 113 H ILE 113 -13.530 -11.004 0.453 860 HA ILE 113 HA ILE 113 -12.164 -11.040 -2.063 861 HB ILE 113 HB ILE 113 -13.698 -8.832 -0.620 862 HG12 ILE 113 HG12 ILE 113 -14.633 -10.700 -2.845 863 HG13 ILE 113 HG13 ILE 113 -14.950 -11.002 -1.156 864 HG21 ILE 113 HG21 ILE 113 -12.279 -7.839 -2.360 865 HG22 ILE 113 HG22 ILE 113 -12.857 -9.019 -3.551 866 HG23 ILE 113 HG23 ILE 113 -13.952 -7.791 -2.880 867 HD11 ILE 113 HD11 ILE 113 -16.014 -8.708 -2.807 868 HD12 ILE 113 HD12 ILE 113 -16.907 -10.012 -2.016 869 HD13 ILE 113 HD13 ILE 113 -16.123 -8.766 -1.025 870 H ALA 114 H ALA 114 -11.680 -9.086 0.937 871 HA ALA 114 HA ALA 114 -9.554 -7.502 0.000 872 HB1 ALA 114 HB1 ALA 114 -9.054 -7.137 2.384 873 HB2 ALA 114 HB2 ALA 114 -10.799 -7.052 2.090 874 HB3 ALA 114 HB3 ALA 114 -10.092 -8.504 2.832 875 H ASP 115 H ASP 115 -9.471 -10.718 1.662 876 HA ASP 115 HA ASP 115 -6.611 -10.732 1.787 877 HB2 ASP 115 HB2 ASP 115 -8.074 -12.087 3.270 878 HB3 ASP 115 HB3 ASP 115 -8.467 -13.130 1.892 879 H TRP 116 H TRP 116 -8.903 -11.912 -0.704 880 HA TRP 116 HA TRP 116 -6.911 -13.220 -2.327 881 HB2 TRP 116 HB2 TRP 116 -9.219 -13.678 -2.763 882 HB3 TRP 116 HB3 TRP 116 -9.609 -11.970 -2.928 883 HD1 TRP 116 HD1 TRP 116 -9.767 -11.103 -5.292 884 HE1 TRP 116 HE1 TRP 116 -8.873 -11.738 -7.604 885 HE3 TRP 116 HE3 TRP 116 -6.866 -15.112 -3.978 886 HZ2 TRP 116 HZ2 TRP 116 -7.206 -13.806 -8.752 887 HZ3 TRP 116 HZ3 TRP 116 -5.673 -16.420 -5.698 888 HH2 TRP 116 HH2 TRP 116 -5.838 -15.777 -8.097 889 H LEU 117 H LEU 117 -8.195 -9.841 -2.241 890 HA LEU 117 HA LEU 117 -6.647 -8.876 -4.424 891 HB2 LEU 117 HB2 LEU 117 -7.793 -7.499 -1.966 892 HB3 LEU 117 HB3 LEU 117 -6.972 -6.617 -3.240 893 HG LEU 117 HG LEU 117 -9.360 -8.405 -3.855 894 HD11 LEU 117 HD11 LEU 117 -9.378 -5.453 -3.092 895 HD12 LEU 117 HD12 LEU 117 -10.762 -6.373 -3.729 896 HD13 LEU 117 HD13 LEU 117 -10.070 -6.797 -2.154 897 HD21 LEU 117 HD21 LEU 117 -7.982 -7.705 -5.786 898 HD22 LEU 117 HD22 LEU 117 -9.582 -6.947 -5.817 899 HD23 LEU 117 HD23 LEU 117 -8.165 -6.006 -5.307 900 H TYR 118 H TYR 118 -5.944 -8.970 -0.874 901 HA TYR 118 HA TYR 118 -3.372 -7.766 -1.008 902 HB2 TYR 118 HB2 TYR 118 -4.412 -9.886 0.913 903 HB3 TYR 118 HB3 TYR 118 -2.972 -8.925 1.153 904 HD1 TYR 118 HD1 TYR 118 -4.485 -6.230 0.084 905 HD2 TYR 118 HD2 TYR 118 -5.253 -9.240 3.090 906 HE1 TYR 118 HE1 TYR 118 -5.824 -4.608 1.364 907 HE2 TYR 118 HE2 TYR 118 -6.597 -7.617 4.376 908 HH TYR 118 HH TYR 118 -7.418 -5.435 4.480 909 H TRP 119 H TRP 119 -4.316 -11.253 -1.131 910 HA TRP 119 HA TRP 119 -1.760 -12.365 -1.376 911 HB2 TRP 119 HB2 TRP 119 -3.555 -13.837 -1.011 912 HB3 TRP 119 HB3 TRP 119 -4.518 -13.163 -2.314 913 HD1 TRP 119 HD1 TRP 119 -4.125 -13.956 -4.755 914 HE1 TRP 119 HE1 TRP 119 -2.925 -15.924 -5.810 915 HE3 TRP 119 HE3 TRP 119 -1.545 -15.562 -0.640 916 HZ2 TRP 119 HZ2 TRP 119 -1.073 -18.020 -4.947 917 HZ3 TRP 119 HZ3 TRP 119 -0.107 -17.590 -0.776 918 HH2 TRP 119 HH2 TRP 119 0.142 -18.802 -2.919 919 H LEU 120 H LEU 120 -3.903 -11.062 -3.971 920 HA LEU 120 HA LEU 120 -2.138 -11.763 -6.118 921 HB2 LEU 120 HB2 LEU 120 -4.296 -9.627 -5.769 922 HB3 LEU 120 HB3 LEU 120 -3.334 -9.736 -7.234 923 HG LEU 120 HG LEU 120 -5.191 -11.912 -6.181 924 HD11 LEU 120 HD11 LEU 120 -5.273 -9.973 -8.540 925 HD12 LEU 120 HD12 LEU 120 -6.430 -11.291 -8.261 926 HD13 LEU 120 HD13 LEU 120 -6.323 -9.949 -7.105 927 HD21 LEU 120 HD21 LEU 120 -3.394 -13.042 -7.297 928 HD22 LEU 120 HD22 LEU 120 -4.690 -12.916 -8.481 929 HD23 LEU 120 HD23 LEU 120 -3.308 -11.800 -8.573 930 H ALA 121 H ALA 121 -2.523 -8.817 -4.119 931 HA ALA 121 HA ALA 121 -0.735 -7.257 -5.588 932 HB1 ALA 121 HB1 ALA 121 -2.397 -6.379 -3.975 933 HB2 ALA 121 HB2 ALA 121 -1.482 -7.083 -2.628 934 HB3 ALA 121 HB3 ALA 121 -0.769 -5.772 -3.592 935 H ARG 122 H ARG 122 -0.115 -9.672 -3.048 936 HA ARG 122 HA ARG 122 2.601 -9.054 -2.445 937 HB2 ARG 122 HB2 ARG 122 1.374 -11.822 -2.647 938 HB3 ARG 122 HB3 ARG 122 2.881 -11.372 -1.864 939 HG2 ARG 122 HG2 ARG 122 1.327 -9.717 -0.466 940 HG3 ARG 122 HG3 ARG 122 0.058 -10.861 -0.946 941 HD2 ARG 122 HD2 ARG 122 2.662 -11.541 0.406 942 HD3 ARG 122 HD3 ARG 122 1.079 -11.473 1.219 943 HE ARG 122 HE ARG 122 0.714 -13.249 -0.880 944 HH11 ARG 122 HH11 ARG 122 2.922 -13.132 1.935 945 HH12 ARG 122 HH12 ARG 122 2.964 -14.891 2.052 946 HH21 ARG 122 HH21 ARG 122 1.056 -15.563 -0.773 947 HH22 ARG 122 HH22 ARG 122 2.175 -16.184 0.420 948 H GLY 123 H GLY 123 1.216 -10.343 -5.420 949 HA2 GLY 123 HA2 GLY 123 2.912 -10.310 -7.258 950 HA3 GLY 123 HA3 GLY 123 3.864 -11.429 -6.274 951 H TYR 124 H TYR 124 0.784 -12.433 -5.618 952 HA TYR 124 HA TYR 124 -0.331 -14.305 -6.095 953 HB2 TYR 124 HB2 TYR 124 -1.026 -12.858 -7.997 954 HB3 TYR 124 HB3 TYR 124 0.160 -13.640 -9.012 955 HD1 TYR 124 HD2 TYR 124 -1.094 -16.349 -7.078 956 HD2 TYR 124 HD1 TYR 124 -2.260 -13.575 -10.180 957 HE1 TYR 124 HE2 TYR 124 -2.846 -17.912 -7.820 958 HE2 TYR 124 HE1 TYR 124 -4.040 -15.127 -10.901 959 HH TYR 124 HH TYR 124 -4.936 -17.218 -10.661 960 H LYS 125 H LYS 125 1.157 -15.701 -5.074 961 HA LYS 125 HA LYS 125 3.671 -16.395 -6.109 962 HB2 LYS 125 HB2 LYS 125 1.945 -18.033 -4.203 963 HB3 LYS 125 HB3 LYS 125 3.669 -18.215 -4.439 964 HG2 LYS 125 HG2 LYS 125 2.294 -15.783 -3.217 965 HG3 LYS 125 HG3 LYS 125 3.160 -17.062 -2.365 966 HD2 LYS 125 HD2 LYS 125 5.238 -16.405 -3.749 967 HD3 LYS 125 HD3 LYS 125 4.315 -14.994 -4.274 968 HE2 LYS 125 HE2 LYS 125 5.653 -14.270 -2.455 969 HE3 LYS 125 HE3 LYS 125 3.999 -14.363 -1.843 970 HZ1 LYS 125 HZ1 LYS 125 5.666 -15.323 -0.328 971 HZ2 LYS 125 HZ2 LYS 125 4.575 -16.463 -0.750 972 HZ3 LYS 125 HZ3 LYS 125 6.074 -16.451 -1.428 973 H PHE 126 H PHE 126 0.615 -18.293 -6.312 974 HA PHE 126 HA PHE 126 1.880 -20.589 -7.420 975 HB2 PHE 126 HB2 PHE 126 -1.046 -19.799 -7.607 976 HB3 PHE 126 HB3 PHE 126 -0.376 -21.402 -7.858 977 HD1 PHE 126 HD2 PHE 126 1.596 -21.322 -5.391 978 HD2 PHE 126 HD1 PHE 126 -2.601 -20.400 -5.860 979 HE1 PHE 126 HE2 PHE 126 1.231 -21.753 -2.992 980 HE2 PHE 126 HE1 PHE 126 -2.963 -20.903 -3.462 981 HZ PHE 126 HZ PHE 126 -1.050 -21.556 -2.015
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