NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
598443 | 2n40 | 25663 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 6.664 -16.370 -2.346 2 H2 GLY 1 H2 GLY 1 7.601 -14.955 -2.249 3 H3 GLY 1 H3 GLY 1 7.292 -15.673 -3.758 4 HA2 GLY 1 HA3 GLY 1 4.806 -15.296 -3.020 5 HA3 GLY 1 HA2 GLY 1 5.569 -14.002 -2.097 6 H VAL 2 HN VAL 2 3.884 -13.157 -3.939 7 HA VAL 2 HA VAL 2 5.135 -12.720 -6.523 8 HB VAL 2 HB VAL 2 2.640 -11.475 -5.331 9 HG11 VAL 2 HG11 VAL 2 3.756 -11.635 -8.150 10 HG12 VAL 2 HG12 VAL 2 3.314 -10.191 -7.238 11 HG13 VAL 2 HG13 VAL 2 2.061 -11.278 -7.823 12 HG21 VAL 2 HG21 VAL 2 2.486 -13.925 -5.360 13 HG22 VAL 2 HG22 VAL 2 3.014 -13.955 -7.042 14 HG23 VAL 2 HG23 VAL 2 1.456 -13.246 -6.619 15 H TYR 3 HN TYR 3 5.451 -10.554 -7.393 16 HA TYR 3 HA TYR 3 5.832 -8.353 -5.527 17 HB2 TYR 3 HB2 TYR 3 8.207 -8.039 -6.019 18 HB3 TYR 3 HB1 TYR 3 7.928 -9.583 -5.222 19 HD1 TYR 3 HD1 TYR 3 8.742 -7.935 -8.435 20 HD2 TYR 3 HD2 TYR 3 8.277 -11.693 -6.402 21 HE1 TYR 3 HE1 TYR 3 9.862 -9.095 -10.318 22 HE2 TYR 3 HE2 TYR 3 9.396 -12.850 -8.288 23 HH TYR 3 HH TYR 3 11.226 -11.355 -10.531 24 H HIS 4 HN HIS 4 6.238 -6.362 -6.544 25 HA HIS 4 HA HIS 4 5.263 -6.280 -9.330 26 HB2 HIS 4 HB2 HIS 4 4.683 -3.986 -8.916 27 HB3 HIS 4 HB1 HIS 4 4.084 -4.955 -7.574 28 HD1 HIS 4 HD1 HIS 4 5.670 -4.934 -5.363 29 HD2 HIS 4 HD2 HIS 4 6.348 -1.911 -8.151 30 HE1 HIS 4 HE1 HIS 4 6.952 -3.117 -4.151 31 HE2 HIS 4 HE2 HIS 4 7.374 -1.267 -5.838 32 H ARG 5 HN ARG 5 6.288 -5.108 -10.937 33 HA ARG 5 HA ARG 5 9.064 -4.188 -10.415 34 HB2 ARG 5 HB2 ARG 5 9.855 -5.300 -12.465 35 HB3 ARG 5 HB1 ARG 5 9.288 -6.471 -11.278 36 HG2 ARG 5 HG2 ARG 5 7.203 -6.778 -12.460 37 HG3 ARG 5 HG1 ARG 5 7.569 -5.457 -13.568 38 HD2 ARG 5 HD2 ARG 5 8.036 -7.575 -14.658 39 HD3 ARG 5 HD1 ARG 5 9.544 -6.710 -14.387 40 HE ARG 5 HE ARG 5 9.001 -8.476 -12.219 41 HH11 ARG 5 HH21 ARG 5 10.074 -8.328 -15.511 42 HH12 ARG 5 HH22 ARG 5 10.874 -9.864 -15.461 43 HH21 ARG 5 HH11 ARG 5 10.057 -10.489 -12.151 44 HH22 ARG 5 HH12 ARG 5 10.861 -11.087 -13.563 45 H GLU 6 HN GLU 6 9.807 -2.607 -11.796 46 HA GLU 6 HA GLU 6 7.996 -1.546 -13.861 47 HB2 GLU 6 HB2 GLU 6 7.462 -0.442 -11.655 48 HB3 GLU 6 HB1 GLU 6 9.110 0.181 -11.634 49 HG2 GLU 6 HG2 GLU 6 8.721 1.394 -13.714 50 HG3 GLU 6 HG1 GLU 6 7.116 0.687 -13.859 51 H ALA 7 HN ALA 7 9.037 0.007 -15.243 52 HA ALA 7 HA ALA 7 11.554 -0.775 -16.144 53 HB1 ALA 7 HB1 ALA 7 11.540 1.288 -17.483 54 HB2 ALA 7 HB2 ALA 7 10.209 1.907 -16.508 55 HB3 ALA 7 HB3 ALA 7 9.968 0.489 -17.525 56 H ARG 8 HN ARG 8 13.604 -0.104 -15.810 57 HA ARG 8 HA ARG 8 14.173 1.295 -13.320 58 HB2 ARG 8 HB2 ARG 8 15.935 0.001 -15.413 59 HB3 ARG 8 HB1 ARG 8 16.551 0.765 -13.948 60 HG2 ARG 8 HG2 ARG 8 15.222 -0.791 -12.562 61 HG3 ARG 8 HG1 ARG 8 14.584 -1.551 -14.025 62 HD2 ARG 8 HD2 ARG 8 16.851 -2.171 -14.717 63 HD3 ARG 8 HD1 ARG 8 17.524 -1.387 -13.295 64 HE ARG 8 HE ARG 8 16.285 -4.001 -13.419 65 HH11 ARG 8 HH21 ARG 8 16.842 -1.256 -11.377 66 HH12 ARG 8 HH22 ARG 8 17.048 -2.195 -9.936 67 HH21 ARG 8 HH11 ARG 8 16.603 -5.241 -11.528 68 HH22 ARG 8 HH12 ARG 8 16.918 -4.444 -10.025 69 H SER 9 HN SER 9 14.729 1.795 -16.787 70 HA SER 9 HA SER 9 15.816 4.494 -16.291 71 HB2 SER 9 HB2 SER 9 16.971 2.922 -17.870 72 HB3 SER 9 HB1 SER 9 15.550 2.990 -18.906 73 HG SER 9 HG SER 9 17.308 5.081 -18.152 74 H GLY 10 HN GLY 10 12.927 3.726 -15.941 75 HA2 GLY 10 HA3 GLY 10 11.800 6.058 -17.108 76 HA3 GLY 10 HA2 GLY 10 11.320 4.638 -18.029 77 H LYS 11 HN LYS 11 9.339 4.077 -17.494 78 HA LYS 11 HA LYS 11 8.633 3.577 -14.696 79 HB2 LYS 11 HB2 LYS 11 7.155 5.567 -16.439 80 HB3 LYS 11 HB1 LYS 11 6.441 4.827 -15.012 81 HG2 LYS 11 HG2 LYS 11 8.349 5.721 -13.649 82 HG3 LYS 11 HG1 LYS 11 8.948 6.535 -15.088 83 HD2 LYS 11 HD2 LYS 11 7.714 8.238 -14.021 84 HD3 LYS 11 HD1 LYS 11 6.579 7.627 -15.218 85 HE2 LYS 11 HE2 LYS 11 5.457 6.276 -13.505 86 HE3 LYS 11 HE1 LYS 11 6.660 6.746 -12.308 87 HZ1 LYS 11 HZ1 LYS 11 5.969 9.077 -12.705 88 HZ2 LYS 11 HZ2 LYS 11 4.747 8.106 -12.032 89 HZ3 LYS 11 HZ3 LYS 11 4.709 8.504 -13.684 90 H TYR 12 HN TYR 12 6.316 4.058 -17.260 91 HA TYR 12 HA TYR 12 5.652 1.174 -17.193 92 HB2 TYR 12 HB2 TYR 12 4.064 3.523 -18.267 93 HB3 TYR 12 HB1 TYR 12 3.520 1.851 -18.188 94 HD1 TYR 12 HD2 TYR 12 3.049 0.767 -15.997 95 HD2 TYR 12 HD1 TYR 12 4.157 4.913 -16.263 96 HE1 TYR 12 HE2 TYR 12 2.230 1.141 -13.684 97 HE2 TYR 12 HE1 TYR 12 3.332 5.277 -13.953 98 HH TYR 12 HH TYR 12 3.026 3.640 -11.828 99 H LYS 13 HN LYS 13 7.497 0.681 -18.582 100 HA LYS 13 HA LYS 13 6.894 1.130 -21.463 101 HB2 LYS 13 HB2 LYS 13 9.581 1.253 -20.074 102 HB3 LYS 13 HB1 LYS 13 9.393 1.113 -21.823 103 HG2 LYS 13 HG2 LYS 13 8.068 3.201 -21.848 104 HG3 LYS 13 HG1 LYS 13 8.271 3.348 -20.102 105 HD2 LYS 13 HD2 LYS 13 10.689 3.518 -20.358 106 HD3 LYS 13 HD1 LYS 13 10.546 3.257 -22.095 107 HE2 LYS 13 HE2 LYS 13 10.802 5.654 -21.627 108 HE3 LYS 13 HE1 LYS 13 9.197 5.332 -22.283 109 HZ1 LYS 13 HZ1 LYS 13 8.203 5.641 -20.251 110 HZ2 LYS 13 HZ2 LYS 13 9.454 6.791 -20.182 111 HZ3 LYS 13 HZ3 LYS 13 9.614 5.306 -19.373 112 H LEU 14 HN LEU 14 6.164 -1.070 -19.692 113 HA LEU 14 HA LEU 14 7.732 -3.296 -20.932 114 HB2 LEU 14 HB2 LEU 14 6.103 -3.468 -18.388 115 HB3 LEU 14 HB1 LEU 14 7.233 -4.655 -19.031 116 HG LEU 14 HG LEU 14 7.948 -1.884 -18.032 117 HD11 LEU 14 HD11 LEU 14 9.076 -3.142 -16.213 118 HD12 LEU 14 HD12 LEU 14 8.455 -4.648 -16.887 119 HD13 LEU 14 HD13 LEU 14 7.339 -3.449 -16.235 120 HD21 LEU 14 HD21 LEU 14 10.329 -2.863 -18.225 121 HD22 LEU 14 HD22 LEU 14 9.544 -2.437 -19.739 122 HD23 LEU 14 HD23 LEU 14 9.615 -4.124 -19.231 123 H THR 15 HN THR 15 6.693 -4.358 -22.442 124 HA THR 15 HA THR 15 3.725 -4.292 -22.533 125 HB THR 15 HB THR 15 4.075 -5.196 -24.867 126 HG1 THR 15 HG1 THR 15 6.508 -4.433 -25.300 127 HG21 THR 15 HG21 THR 15 5.446 -2.568 -24.226 128 HG22 THR 15 HG22 THR 15 3.705 -2.791 -24.416 129 HG23 THR 15 HG23 THR 15 4.781 -3.036 -25.790 130 H TYR 16 HN TYR 16 2.708 -6.316 -23.385 131 HA TYR 16 HA TYR 16 3.038 -8.434 -21.598 132 HB2 TYR 16 HB2 TYR 16 0.954 -8.154 -22.741 133 HB3 TYR 16 HB1 TYR 16 1.725 -8.251 -24.317 134 HD1 TYR 16 HD1 TYR 16 1.109 -10.244 -21.195 135 HD2 TYR 16 HD2 TYR 16 1.870 -10.356 -25.427 136 HE1 TYR 16 HE1 TYR 16 0.721 -12.694 -21.210 137 HE2 TYR 16 HE2 TYR 16 1.482 -12.801 -25.433 138 HH TYR 16 HH TYR 16 0.771 -14.557 -22.419 139 H ALA 17 HN ALA 17 4.108 -8.185 -24.994 140 HA ALA 17 HA ALA 17 5.316 -10.692 -25.203 141 HB1 ALA 17 HB1 ALA 17 4.926 -9.065 -27.080 142 HB2 ALA 17 HB2 ALA 17 6.530 -9.799 -27.080 143 HB3 ALA 17 HB3 ALA 17 6.316 -8.148 -26.501 144 H GLU 18 HN GLU 18 6.640 -7.633 -23.968 145 HA GLU 18 HA GLU 18 9.289 -8.595 -23.608 146 HB2 GLU 18 HB2 GLU 18 8.620 -6.180 -23.681 147 HB3 GLU 18 HB1 GLU 18 7.880 -6.383 -22.095 148 HG2 GLU 18 HG2 GLU 18 10.080 -5.475 -21.757 149 HG3 GLU 18 HG1 GLU 18 10.124 -7.150 -21.235 150 H ALA 19 HN ALA 19 6.564 -8.194 -21.331 151 HA ALA 19 HA ALA 19 7.789 -9.126 -19.025 152 HB1 ALA 19 HB1 ALA 19 5.594 -9.469 -18.153 153 HB2 ALA 19 HB2 ALA 19 4.915 -9.726 -19.760 154 HB3 ALA 19 HB3 ALA 19 5.464 -8.122 -19.279 155 H LYS 20 HN LYS 20 6.483 -10.939 -21.740 156 HA LYS 20 HA LYS 20 6.618 -13.510 -20.488 157 HB2 LYS 20 HB2 LYS 20 5.274 -12.715 -22.623 158 HB3 LYS 20 HB1 LYS 20 6.745 -13.155 -23.478 159 HG2 LYS 20 HG2 LYS 20 5.610 -15.207 -23.549 160 HG3 LYS 20 HG1 LYS 20 6.523 -15.419 -22.056 161 HD2 LYS 20 HD2 LYS 20 4.473 -14.448 -20.838 162 HD3 LYS 20 HD1 LYS 20 3.609 -14.622 -22.361 163 HE2 LYS 20 HE2 LYS 20 4.834 -16.800 -20.659 164 HE3 LYS 20 HE1 LYS 20 3.149 -16.624 -21.146 165 HZ1 LYS 20 HZ1 LYS 20 3.979 -16.852 -23.494 166 HZ2 LYS 20 HZ2 LYS 20 4.067 -18.257 -22.541 167 HZ3 LYS 20 HZ3 LYS 20 5.467 -17.343 -22.843 168 H ALA 21 HN ALA 21 8.831 -11.533 -22.328 169 HA ALA 21 HA ALA 21 10.736 -13.576 -22.908 170 HB1 ALA 21 HB1 ALA 21 12.265 -11.714 -23.403 171 HB2 ALA 21 HB2 ALA 21 11.124 -10.585 -22.674 172 HB3 ALA 21 HB3 ALA 21 10.683 -11.461 -24.140 173 H VAL 22 HN VAL 22 10.745 -11.009 -20.414 174 HA VAL 22 HA VAL 22 13.118 -11.836 -19.131 175 HB VAL 22 HB VAL 22 12.107 -9.639 -18.728 176 HG11 VAL 22 HG11 VAL 22 10.064 -9.388 -17.460 177 HG12 VAL 22 HG12 VAL 22 9.953 -11.130 -17.209 178 HG13 VAL 22 HG13 VAL 22 9.748 -10.454 -18.824 179 HG21 VAL 22 HG21 VAL 22 13.559 -10.751 -16.966 180 HG22 VAL 22 HG22 VAL 22 12.076 -11.225 -16.138 181 HG23 VAL 22 HG23 VAL 22 12.463 -9.517 -16.350 182 H CYS 23 HN CYS 23 9.770 -12.865 -18.698 183 HA CYS 23 HA CYS 23 10.616 -14.803 -16.604 184 HB2 CYS 23 HB2 CYS 23 8.092 -13.339 -17.212 185 HB3 CYS 23 HB1 CYS 23 7.904 -15.003 -16.665 186 H GLU 24 HN GLU 24 9.144 -16.850 -16.761 187 HA GLU 24 HA GLU 24 8.627 -18.809 -17.855 188 HB2 GLU 24 HB2 GLU 24 7.244 -17.332 -19.356 189 HB3 GLU 24 HB1 GLU 24 8.629 -17.201 -20.429 190 HG2 GLU 24 HG2 GLU 24 8.637 -19.572 -20.841 191 HG3 GLU 24 HG1 GLU 24 7.386 -19.832 -19.629 192 H PHE 25 HN PHE 25 11.367 -16.934 -18.569 193 HA PHE 25 HA PHE 25 12.762 -18.566 -20.395 194 HB2 PHE 25 HB2 PHE 25 13.454 -16.290 -19.864 195 HB3 PHE 25 HB1 PHE 25 13.777 -16.747 -18.195 196 HD1 PHE 25 HD1 PHE 25 14.800 -17.379 -21.731 197 HD2 PHE 25 HD2 PHE 25 15.887 -17.715 -17.585 198 HE1 PHE 25 HE1 PHE 25 17.104 -18.025 -22.384 199 HE2 PHE 25 HE2 PHE 25 18.188 -18.362 -18.242 200 HZ PHE 25 HZ PHE 25 18.797 -18.514 -20.640 201 H GLU 26 HN GLU 26 12.780 -18.525 -16.832 202 HA GLU 26 HA GLU 26 14.399 -20.972 -16.754 203 HB2 GLU 26 HB2 GLU 26 14.413 -20.647 -14.329 204 HB3 GLU 26 HB1 GLU 26 14.926 -19.185 -15.167 205 HG2 GLU 26 HG2 GLU 26 12.643 -18.253 -14.916 206 HG3 GLU 26 HG1 GLU 26 12.157 -19.702 -14.039 207 H GLY 27 HN GLY 27 11.499 -20.789 -17.704 208 HA2 GLY 27 HA3 GLY 27 9.894 -22.480 -17.796 209 HA3 GLY 27 HA2 GLY 27 10.614 -23.239 -16.380 210 H GLY 28 HN GLY 28 10.192 -19.959 -15.823 211 HA2 GLY 28 HA3 GLY 28 8.153 -20.391 -13.865 212 HA3 GLY 28 HA2 GLY 28 8.830 -18.837 -14.334 213 H HIS 29 HN HIS 29 6.484 -18.280 -13.990 214 HA HIS 29 HA HIS 29 5.162 -18.122 -16.587 215 HB2 HIS 29 HB2 HIS 29 3.856 -19.496 -14.222 216 HB3 HIS 29 HB1 HIS 29 3.001 -18.981 -15.676 217 HD1 HIS 29 HD1 HIS 29 5.524 -21.494 -14.454 218 HD2 HIS 29 HD2 HIS 29 3.480 -20.586 -17.973 219 HE1 HIS 29 HE1 HIS 29 5.900 -23.445 -16.025 220 HE2 HIS 29 HE2 HIS 29 4.662 -22.907 -18.175 221 H LEU 30 HN LEU 30 3.794 -16.385 -16.755 222 HA LEU 30 HA LEU 30 4.155 -14.234 -14.925 223 HB2 LEU 30 HB2 LEU 30 2.310 -14.676 -17.281 224 HB3 LEU 30 HB1 LEU 30 2.269 -13.182 -16.357 225 HG LEU 30 HG LEU 30 3.709 -13.193 -18.492 226 HD11 LEU 30 HD11 LEU 30 5.379 -11.756 -17.561 227 HD12 LEU 30 HD12 LEU 30 5.210 -12.466 -15.965 228 HD13 LEU 30 HD13 LEU 30 3.901 -11.497 -16.644 229 HD21 LEU 30 HD21 LEU 30 5.916 -14.162 -18.366 230 HD22 LEU 30 HD22 LEU 30 4.748 -15.435 -18.039 231 HD23 LEU 30 HD23 LEU 30 5.646 -14.693 -16.720 232 H ALA 31 HN ALA 31 2.939 -13.521 -13.277 233 HA ALA 31 HA ALA 31 1.123 -15.227 -11.979 234 HB1 ALA 31 HB1 ALA 31 0.730 -13.392 -10.466 235 HB2 ALA 31 HB2 ALA 31 1.342 -12.230 -11.644 236 HB3 ALA 31 HB3 ALA 31 2.438 -13.392 -10.897 237 H THR 32 HN THR 32 -1.060 -15.330 -11.895 238 HA THR 32 HA THR 32 -2.613 -13.642 -13.808 239 HB THR 32 HB THR 32 -3.866 -15.495 -14.507 240 HG1 THR 32 HG1 THR 32 -2.827 -17.271 -12.645 241 HG21 THR 32 HG21 THR 32 -2.279 -17.133 -15.252 242 HG22 THR 32 HG22 THR 32 -1.191 -16.787 -13.908 243 HG23 THR 32 HG23 THR 32 -1.415 -15.597 -15.192 244 H TYR 33 HN TYR 33 -5.051 -13.965 -13.285 245 HA TYR 33 HA TYR 33 -5.601 -12.655 -10.886 246 HB2 TYR 33 HB2 TYR 33 -7.103 -12.503 -12.727 247 HB3 TYR 33 HB1 TYR 33 -7.352 -14.240 -12.770 248 HD1 TYR 33 HD1 TYR 33 -8.151 -11.093 -11.002 249 HD2 TYR 33 HD2 TYR 33 -8.782 -15.343 -11.098 250 HE1 TYR 33 HE1 TYR 33 -10.054 -10.848 -9.428 251 HE2 TYR 33 HE2 TYR 33 -10.682 -15.096 -9.524 252 HH TYR 33 HH TYR 33 -11.851 -13.698 -8.259 253 H LYS 34 HN LYS 34 -6.202 -16.069 -11.740 254 HA LYS 34 HA LYS 34 -7.198 -16.947 -9.296 255 HB2 LYS 34 HB2 LYS 34 -5.495 -18.395 -11.343 256 HB3 LYS 34 HB1 LYS 34 -6.321 -19.197 -10.009 257 HG2 LYS 34 HG2 LYS 34 -8.489 -18.382 -10.836 258 HG3 LYS 34 HG1 LYS 34 -7.678 -17.534 -12.155 259 HD2 LYS 34 HD2 LYS 34 -6.815 -19.681 -13.012 260 HD3 LYS 34 HD1 LYS 34 -7.616 -20.533 -11.692 261 HE2 LYS 34 HE2 LYS 34 -9.806 -19.728 -12.494 262 HE3 LYS 34 HE1 LYS 34 -9.009 -18.865 -13.809 263 HZ1 LYS 34 HZ1 LYS 34 -8.615 -20.761 -14.938 264 HZ2 LYS 34 HZ2 LYS 34 -9.948 -21.328 -14.052 265 HZ3 LYS 34 HZ3 LYS 34 -8.370 -21.690 -13.540 266 H GLN 35 HN GLN 35 -3.803 -16.917 -10.410 267 HA GLN 35 HA GLN 35 -2.713 -17.912 -7.981 268 HB2 GLN 35 HB2 GLN 35 -1.449 -16.319 -10.226 269 HB3 GLN 35 HB1 GLN 35 -0.542 -17.015 -8.883 270 HG2 GLN 35 HG2 GLN 35 -1.342 -19.259 -9.494 271 HG3 GLN 35 HG1 GLN 35 -2.262 -18.573 -10.833 272 HE21 GLN 35 HE21 GLN 35 -0.658 -20.242 -11.958 273 HE22 GLN 35 HE22 GLN 35 0.813 -19.586 -12.492 274 H LEU 36 HN LEU 36 -3.321 -14.658 -9.218 275 HA LEU 36 HA LEU 36 -1.945 -13.221 -7.218 276 HB2 LEU 36 HB2 LEU 36 -4.166 -12.614 -9.120 277 HB3 LEU 36 HB1 LEU 36 -3.813 -11.425 -7.902 278 HG LEU 36 HG LEU 36 -1.681 -12.526 -9.763 279 HD11 LEU 36 HD11 LEU 36 -3.374 -11.491 -11.172 280 HD12 LEU 36 HD12 LEU 36 -2.024 -10.367 -11.031 281 HD13 LEU 36 HD13 LEU 36 -3.487 -10.103 -10.088 282 HD21 LEU 36 HD21 LEU 36 -0.619 -10.270 -9.178 283 HD22 LEU 36 HD22 LEU 36 -0.712 -11.397 -7.838 284 HD23 LEU 36 HD23 LEU 36 -1.872 -10.079 -7.958 285 H GLU 37 HN GLU 37 -5.318 -14.337 -7.408 286 HA GLU 37 HA GLU 37 -6.307 -13.103 -5.116 287 HB2 GLU 37 HB2 GLU 37 -7.719 -14.276 -6.736 288 HB3 GLU 37 HB1 GLU 37 -7.019 -15.819 -6.246 289 HG2 GLU 37 HG2 GLU 37 -7.937 -15.581 -4.003 290 HG3 GLU 37 HG1 GLU 37 -8.510 -13.956 -4.374 291 H ALA 38 HN ALA 38 -4.803 -16.317 -5.416 292 HA ALA 38 HA ALA 38 -4.974 -17.167 -2.789 293 HB1 ALA 38 HB1 ALA 38 -2.932 -18.489 -3.235 294 HB2 ALA 38 HB2 ALA 38 -2.652 -17.540 -4.697 295 HB3 ALA 38 HB3 ALA 38 -4.075 -18.575 -4.576 296 H ALA 39 HN ALA 39 -2.886 -14.724 -4.158 297 HA ALA 39 HA ALA 39 -1.160 -14.538 -1.838 298 HB1 ALA 39 HB1 ALA 39 -0.084 -12.739 -2.990 299 HB2 ALA 39 HB2 ALA 39 -1.457 -12.523 -4.074 300 HB3 ALA 39 HB3 ALA 39 -0.456 -13.969 -4.199 301 H ARG 40 HN ARG 40 -3.979 -12.811 -3.100 302 HA ARG 40 HA ARG 40 -3.940 -10.572 -1.406 303 HB2 ARG 40 HB2 ARG 40 -6.415 -12.062 -2.316 304 HB3 ARG 40 HB1 ARG 40 -6.340 -10.386 -1.787 305 HG2 ARG 40 HG2 ARG 40 -4.841 -11.454 -4.182 306 HG3 ARG 40 HG1 ARG 40 -6.418 -10.704 -4.295 307 HD2 ARG 40 HD2 ARG 40 -3.812 -9.426 -3.419 308 HD3 ARG 40 HD1 ARG 40 -4.799 -9.016 -4.808 309 HE ARG 40 HE ARG 40 -5.154 -8.029 -2.156 310 HH11 ARG 40 HH21 ARG 40 -6.923 -9.078 -4.942 311 HH12 ARG 40 HH22 ARG 40 -8.220 -7.964 -4.669 312 HH21 ARG 40 HH11 ARG 40 -6.778 -6.560 -1.873 313 HH22 ARG 40 HH12 ARG 40 -8.125 -6.531 -2.961 314 H LYS 41 HN LYS 41 -4.927 -13.882 -0.783 315 HA LYS 41 HA LYS 41 -6.234 -13.363 1.710 316 HB2 LYS 41 HB2 LYS 41 -5.033 -15.897 0.564 317 HB3 LYS 41 HB1 LYS 41 -5.978 -15.823 2.051 318 HG2 LYS 41 HG2 LYS 41 -7.924 -15.026 0.856 319 HG3 LYS 41 HG1 LYS 41 -6.999 -14.875 -0.639 320 HD2 LYS 41 HD2 LYS 41 -8.317 -16.944 -0.680 321 HD3 LYS 41 HD1 LYS 41 -6.598 -17.322 -0.629 322 HE2 LYS 41 HE2 LYS 41 -8.120 -17.140 1.975 323 HE3 LYS 41 HE1 LYS 41 -8.260 -18.596 0.991 324 HZ1 LYS 41 HZ1 LYS 41 -6.385 -19.218 1.974 325 HZ2 LYS 41 HZ2 LYS 41 -6.045 -17.657 2.552 326 HZ3 LYS 41 HZ3 LYS 41 -5.600 -18.096 0.972 327 H ILE 42 HN ILE 42 -3.040 -13.068 0.837 328 HA ILE 42 HA ILE 42 -2.007 -13.801 3.533 329 HB ILE 42 HB ILE 42 -0.495 -13.381 0.937 330 HG12 ILE 42 HG12 ILE 42 -1.016 -15.930 2.510 331 HG13 ILE 42 HG11 ILE 42 -1.939 -15.452 1.089 332 HG21 ILE 42 HG21 ILE 42 0.377 -13.833 3.796 333 HG22 ILE 42 HG22 ILE 42 1.143 -12.863 2.537 334 HG23 ILE 42 HG23 ILE 42 1.312 -14.610 2.522 335 HD11 ILE 42 HD11 ILE 42 0.990 -16.186 1.247 336 HD12 ILE 42 HD12 ILE 42 0.321 -15.335 -0.144 337 HD13 ILE 42 HD13 ILE 42 -0.272 -16.941 0.274 338 H GLY 43 HN GLY 43 -3.314 -11.216 2.181 339 HA2 GLY 43 HA3 GLY 43 -3.293 -9.047 3.037 340 HA3 GLY 43 HA2 GLY 43 -1.726 -9.341 3.774 341 H PHE 44 HN PHE 44 -2.055 -10.289 0.482 342 HA PHE 44 HA PHE 44 -0.045 -8.439 -0.370 343 HB2 PHE 44 HB2 PHE 44 -0.632 -10.840 -1.249 344 HB3 PHE 44 HB1 PHE 44 -1.797 -10.020 -2.265 345 HD1 PHE 44 HD1 PHE 44 1.804 -9.819 -1.229 346 HD2 PHE 44 HD2 PHE 44 -1.058 -9.217 -4.383 347 HE1 PHE 44 HE1 PHE 44 3.643 -9.275 -2.799 348 HE2 PHE 44 HE2 PHE 44 0.785 -8.679 -5.946 349 HZ PHE 44 HZ PHE 44 3.133 -8.704 -5.157 350 H HIS 45 HN HIS 45 -0.319 -6.415 -0.998 351 HA HIS 45 HA HIS 45 -2.855 -5.570 -2.281 352 HB2 HIS 45 HB2 HIS 45 -3.091 -5.024 0.078 353 HB3 HIS 45 HB1 HIS 45 -1.520 -4.228 0.087 354 HD1 HIS 45 HD1 HIS 45 -4.865 -3.917 -1.736 355 HD2 HIS 45 HD2 HIS 45 -1.699 -1.524 -0.459 356 HE1 HIS 45 HE1 HIS 45 -5.523 -1.526 -2.247 357 HE2 HIS 45 HE2 HIS 45 -3.602 -0.054 -1.475 358 H VAL 46 HN VAL 46 -2.268 -4.869 -4.213 359 HA VAL 46 HA VAL 46 -0.073 -2.895 -4.428 360 HB VAL 46 HB VAL 46 0.664 -4.059 -6.571 361 HG11 VAL 46 HG11 VAL 46 1.014 -5.540 -3.948 362 HG12 VAL 46 HG12 VAL 46 1.983 -4.177 -4.506 363 HG13 VAL 46 HG13 VAL 46 2.050 -5.715 -5.363 364 HG21 VAL 46 HG21 VAL 46 -1.256 -5.548 -6.919 365 HG22 VAL 46 HG22 VAL 46 -0.968 -6.323 -5.367 366 HG23 VAL 46 HG23 VAL 46 0.193 -6.506 -6.677 367 H CYS 47 HN CYS 47 -0.986 -1.140 -5.206 368 HA CYS 47 HA CYS 47 -3.312 -1.309 -7.004 369 HB2 CYS 47 HB2 CYS 47 -2.996 0.276 -4.915 370 HB3 CYS 47 HB1 CYS 47 -2.117 1.294 -6.049 371 H ALA 48 HN ALA 48 -2.254 -2.073 -8.872 372 HA ALA 48 HA ALA 48 -1.296 -0.027 -10.615 373 HB1 ALA 48 HB1 ALA 48 0.968 -0.953 -11.001 374 HB2 ALA 48 HB2 ALA 48 0.728 -2.064 -9.653 375 HB3 ALA 48 HB3 ALA 48 0.783 -0.323 -9.365 376 H ALA 49 HN ALA 49 -1.565 -0.622 -12.695 377 HA ALA 49 HA ALA 49 -2.592 -3.336 -13.209 378 HB1 ALA 49 HB1 ALA 49 -2.674 -0.788 -14.819 379 HB2 ALA 49 HB2 ALA 49 -4.014 -1.567 -13.987 380 HB3 ALA 49 HB3 ALA 49 -3.290 -2.332 -15.401 381 H GLY 50 HN GLY 50 -1.534 -4.819 -14.353 382 HA2 GLY 50 HA3 GLY 50 0.730 -4.037 -16.095 383 HA3 GLY 50 HA2 GLY 50 1.056 -5.131 -14.756 384 H TRP 51 HN TRP 51 1.263 -5.529 -17.663 385 HA TRP 51 HA TRP 51 -0.814 -7.180 -18.633 386 HB2 TRP 51 HB2 TRP 51 2.127 -7.126 -19.346 387 HB3 TRP 51 HB1 TRP 51 0.896 -8.002 -20.250 388 HD1 TRP 51 HD1 TRP 51 2.598 -4.778 -20.212 389 HE1 TRP 51 HE1 TRP 51 1.323 -3.030 -21.616 390 HE3 TRP 51 HE3 TRP 51 -1.873 -7.190 -20.774 391 HZ2 TRP 51 HZ2 TRP 51 -1.254 -2.708 -22.819 392 HZ3 TRP 51 HZ3 TRP 51 -3.718 -6.130 -22.044 393 HH2 TRP 51 HH2 TRP 51 -3.413 -3.893 -23.062 394 H MET 52 HN MET 52 -0.906 -9.448 -18.828 395 HA MET 52 HA MET 52 0.956 -11.111 -17.307 396 HB2 MET 52 HB2 MET 52 -1.982 -11.028 -16.554 397 HB3 MET 52 HB1 MET 52 -0.785 -12.142 -15.943 398 HG2 MET 52 HG2 MET 52 0.524 -10.164 -15.083 399 HG3 MET 52 HG1 MET 52 -0.841 -9.146 -15.531 400 HE1 MET 52 HE1 MET 52 -3.000 -9.025 -14.564 401 HE2 MET 52 HE2 MET 52 -3.628 -9.911 -13.181 402 HE3 MET 52 HE3 MET 52 -3.508 -10.710 -14.743 403 H ALA 53 HN ALA 53 -0.077 -13.459 -17.296 404 HA ALA 53 HA ALA 53 0.069 -14.546 -19.777 405 HB1 ALA 53 HB1 ALA 53 -1.867 -15.533 -17.672 406 HB2 ALA 53 HB2 ALA 53 -0.127 -15.817 -17.631 407 HB3 ALA 53 HB3 ALA 53 -1.099 -16.486 -18.941 408 H LYS 54 HN LYS 54 -1.248 -15.022 -21.476 409 HA LYS 54 HA LYS 54 -2.909 -14.647 -23.018 410 HB2 LYS 54 HB2 LYS 54 -4.592 -14.707 -20.496 411 HB3 LYS 54 HB1 LYS 54 -5.255 -14.676 -22.126 412 HG2 LYS 54 HG2 LYS 54 -4.151 -16.780 -22.670 413 HG3 LYS 54 HG1 LYS 54 -3.336 -16.787 -21.110 414 HD2 LYS 54 HD2 LYS 54 -5.176 -18.263 -20.802 415 HD3 LYS 54 HD1 LYS 54 -5.708 -16.762 -20.057 416 HE2 LYS 54 HE2 LYS 54 -7.454 -17.814 -21.498 417 HE3 LYS 54 HE1 LYS 54 -7.024 -16.199 -22.040 418 HZ1 LYS 54 HZ1 LYS 54 -5.476 -18.386 -23.166 419 HZ2 LYS 54 HZ2 LYS 54 -6.074 -16.981 -23.910 420 HZ3 LYS 54 HZ3 LYS 54 -7.100 -18.309 -23.644 421 H GLY 55 HN GLY 55 -1.494 -12.341 -22.156 422 HA2 GLY 55 HA3 GLY 55 -1.582 -10.046 -22.222 423 HA3 GLY 55 HA2 GLY 55 -2.994 -10.277 -23.244 424 H ARG 56 HN ARG 56 -3.400 -11.719 -20.210 425 HA ARG 56 HA ARG 56 -5.544 -9.988 -19.506 426 HB2 ARG 56 HB2 ARG 56 -5.184 -12.449 -18.815 427 HB3 ARG 56 HB1 ARG 56 -4.121 -11.819 -17.568 428 HG2 ARG 56 HG2 ARG 56 -5.965 -10.438 -16.687 429 HG3 ARG 56 HG1 ARG 56 -7.034 -11.084 -17.929 430 HD2 ARG 56 HD2 ARG 56 -6.431 -13.419 -17.016 431 HD3 ARG 56 HD1 ARG 56 -5.744 -12.572 -15.632 432 HE ARG 56 HE ARG 56 -8.515 -12.999 -16.150 433 HH11 ARG 56 HH21 ARG 56 -6.227 -10.721 -14.887 434 HH12 ARG 56 HH22 ARG 56 -7.359 -10.005 -13.789 435 HH21 ARG 56 HH11 ARG 56 -9.984 -12.055 -14.723 436 HH22 ARG 56 HH12 ARG 56 -9.461 -10.789 -13.673 437 H VAL 57 HN VAL 57 -5.699 -8.355 -18.026 438 HA VAL 57 HA VAL 57 -3.311 -7.536 -16.506 439 HB VAL 57 HB VAL 57 -3.018 -6.300 -18.543 440 HG11 VAL 57 HG11 VAL 57 -5.827 -5.215 -18.254 441 HG12 VAL 57 HG12 VAL 57 -5.414 -6.564 -19.315 442 HG13 VAL 57 HG13 VAL 57 -4.703 -4.980 -19.594 443 HG21 VAL 57 HG21 VAL 57 -2.787 -5.085 -16.300 444 HG22 VAL 57 HG22 VAL 57 -4.360 -4.365 -16.629 445 HG23 VAL 57 HG23 VAL 57 -3.004 -4.052 -17.712 446 H GLY 58 HN GLY 58 -3.732 -6.402 -14.670 447 HA2 GLY 58 HA3 GLY 58 -6.295 -5.273 -14.058 448 HA3 GLY 58 HA2 GLY 58 -6.083 -6.850 -13.304 449 H TYR 59 HN TYR 59 -6.461 -4.675 -11.743 450 HA TYR 59 HA TYR 59 -3.815 -4.366 -10.415 451 HB2 TYR 59 HB2 TYR 59 -4.410 -2.045 -9.819 452 HB3 TYR 59 HB1 TYR 59 -4.172 -2.282 -11.543 453 HD1 TYR 59 HD2 TYR 59 -6.198 -2.556 -13.051 454 HD2 TYR 59 HD1 TYR 59 -6.502 -1.219 -8.975 455 HE1 TYR 59 HE2 TYR 59 -8.434 -1.597 -13.528 456 HE2 TYR 59 HE1 TYR 59 -8.733 -0.257 -9.459 457 HH TYR 59 HH TYR 59 -10.409 -0.892 -12.429 458 HA PRO 60 HA PRO 60 -6.986 -6.186 -7.559 459 HB2 PRO 60 HB2 PRO 60 -4.406 -7.232 -6.425 460 HB3 PRO 60 HB1 PRO 60 -5.947 -8.083 -6.680 461 HG2 PRO 60 HG2 PRO 60 -3.898 -8.504 -8.321 462 HG3 PRO 60 HG1 PRO 60 -5.552 -8.381 -8.959 463 HD2 PRO 60 HD2 PRO 60 -3.354 -6.317 -9.030 464 HD3 PRO 60 HD1 PRO 60 -4.559 -6.717 -10.276 465 H ILE 61 HN ILE 61 -7.631 -5.328 -5.639 466 HA ILE 61 HA ILE 61 -5.752 -3.899 -3.906 467 HB ILE 61 HB ILE 61 -7.257 -1.859 -3.903 468 HG12 ILE 61 HG12 ILE 61 -8.299 -3.127 -6.462 469 HG13 ILE 61 HG11 ILE 61 -9.215 -2.976 -4.965 470 HG21 ILE 61 HG21 ILE 61 -5.058 -2.027 -5.165 471 HG22 ILE 61 HG22 ILE 61 -6.200 -0.854 -5.812 472 HG23 ILE 61 HG23 ILE 61 -5.998 -2.411 -6.607 473 HD11 ILE 61 HD11 ILE 61 -8.857 -0.486 -5.081 474 HD12 ILE 61 HD12 ILE 61 -9.848 -1.136 -6.384 475 HD13 ILE 61 HD13 ILE 61 -8.161 -0.720 -6.685 476 H VAL 62 HN VAL 62 -6.289 -4.049 -1.843 477 HA VAL 62 HA VAL 62 -8.365 -5.768 -0.974 478 HB VAL 62 HB VAL 62 -6.808 -3.718 0.602 479 HG11 VAL 62 HG11 VAL 62 -8.728 -4.464 1.878 480 HG12 VAL 62 HG12 VAL 62 -7.315 -5.313 2.502 481 HG13 VAL 62 HG13 VAL 62 -8.438 -6.143 1.424 482 HG21 VAL 62 HG21 VAL 62 -5.403 -5.366 -0.642 483 HG22 VAL 62 HG22 VAL 62 -6.287 -6.675 0.145 484 HG23 VAL 62 HG23 VAL 62 -5.293 -5.579 1.105 485 H LYS 63 HN LYS 63 -8.073 -2.232 -0.922 486 HA LYS 63 HA LYS 63 -10.936 -1.914 -1.126 487 HB2 LYS 63 HB2 LYS 63 -9.549 -1.714 1.477 488 HB3 LYS 63 HB1 LYS 63 -10.477 -0.270 1.101 489 HG2 LYS 63 HG2 LYS 63 -12.476 -1.704 0.685 490 HG3 LYS 63 HG1 LYS 63 -11.549 -3.110 1.193 491 HD2 LYS 63 HD2 LYS 63 -11.917 -0.666 2.957 492 HD3 LYS 63 HD1 LYS 63 -13.022 -2.034 2.989 493 HE2 LYS 63 HE2 LYS 63 -10.987 -3.513 3.448 494 HE3 LYS 63 HE1 LYS 63 -10.081 -2.025 3.714 495 HZ1 LYS 63 HZ1 LYS 63 -10.938 -1.852 5.719 496 HZ2 LYS 63 HZ2 LYS 63 -11.711 -3.351 5.510 497 HZ3 LYS 63 HZ3 LYS 63 -12.519 -1.910 5.108 498 HA PRO 64 HA PRO 64 -8.883 2.426 -1.338 499 HB2 PRO 64 HB2 PRO 64 -6.140 2.588 -1.026 500 HB3 PRO 64 HB1 PRO 64 -7.281 2.727 0.331 501 HG2 PRO 64 HG2 PRO 64 -5.800 0.290 -0.626 502 HG3 PRO 64 HG1 PRO 64 -5.926 0.939 1.026 503 HD2 PRO 64 HD2 PRO 64 -7.500 -1.077 0.296 504 HD3 PRO 64 HD1 PRO 64 -8.178 0.248 1.256 505 H GLY 65 HN GLY 65 -8.406 3.332 -3.294 506 HA2 GLY 65 HA3 GLY 65 -6.466 2.395 -5.123 507 HA3 GLY 65 HA2 GLY 65 -8.028 1.710 -5.547 508 HA PRO 66 HA PRO 66 -8.861 6.392 -6.012 509 HB2 PRO 66 HB2 PRO 66 -6.966 8.205 -5.202 510 HB3 PRO 66 HB1 PRO 66 -8.158 7.510 -4.082 511 HG2 PRO 66 HG2 PRO 66 -5.313 6.667 -4.556 512 HG3 PRO 66 HG1 PRO 66 -6.157 6.933 -3.014 513 HD2 PRO 66 HD2 PRO 66 -5.834 4.432 -4.032 514 HD3 PRO 66 HD1 PRO 66 -7.305 4.883 -3.140 515 H ASN 67 HN ASN 67 -5.336 5.939 -6.304 516 HA ASN 67 HA ASN 67 -5.047 7.411 -8.711 517 HB2 ASN 67 HB2 ASN 67 -3.171 6.969 -7.191 518 HB3 ASN 67 HB1 ASN 67 -3.295 5.245 -7.525 519 HD21 ASN 67 HD21 ASN 67 -1.102 5.237 -8.445 520 HD22 ASN 67 HD22 ASN 67 -0.806 5.903 -9.977 521 H CYS 68 HN CYS 68 -5.569 3.988 -8.006 522 HA CYS 68 HA CYS 68 -5.539 3.308 -10.875 523 HB2 CYS 68 HB2 CYS 68 -6.212 1.259 -8.777 524 HB3 CYS 68 HB1 CYS 68 -5.221 1.098 -10.228 525 H GLY 69 HN GLY 69 -7.337 2.993 -12.049 526 HA2 GLY 69 HA3 GLY 69 -9.553 2.942 -12.646 527 HA3 GLY 69 HA2 GLY 69 -9.812 2.056 -11.148 528 H PHE 70 HN PHE 70 -11.465 2.973 -10.129 529 HA PHE 70 HA PHE 70 -11.316 5.726 -9.238 530 HB2 PHE 70 HB2 PHE 70 -12.283 5.967 -11.503 531 HB3 PHE 70 HB1 PHE 70 -13.574 4.853 -11.065 532 HD1 PHE 70 HD1 PHE 70 -12.165 8.229 -10.514 533 HD2 PHE 70 HD2 PHE 70 -15.368 5.531 -9.542 534 HE1 PHE 70 HE1 PHE 70 -13.468 10.114 -9.565 535 HE2 PHE 70 HE2 PHE 70 -16.666 7.418 -8.592 536 HZ PHE 70 HZ PHE 70 -15.717 9.708 -8.605 537 H GLY 71 HN GLY 71 -11.565 5.183 -7.143 538 HA2 GLY 71 HA3 GLY 71 -12.533 4.427 -5.196 539 HA3 GLY 71 HA2 GLY 71 -14.065 4.681 -6.027 540 H LYS 72 HN LYS 72 -15.160 2.905 -5.369 541 HA LYS 72 HA LYS 72 -15.814 0.716 -5.218 542 HB2 LYS 72 HB2 LYS 72 -15.337 1.119 -7.784 543 HB3 LYS 72 HB1 LYS 72 -13.973 0.042 -7.523 544 HG2 LYS 72 HG2 LYS 72 -15.478 -1.726 -6.733 545 HG3 LYS 72 HG1 LYS 72 -16.863 -0.639 -6.854 546 HD2 LYS 72 HD2 LYS 72 -16.381 -0.408 -9.313 547 HD3 LYS 72 HD1 LYS 72 -15.137 -1.642 -9.133 548 HE2 LYS 72 HE2 LYS 72 -18.045 -2.052 -8.394 549 HE3 LYS 72 HE1 LYS 72 -17.332 -2.556 -9.924 550 HZ1 LYS 72 HZ1 LYS 72 -15.968 -3.391 -7.486 551 HZ2 LYS 72 HZ2 LYS 72 -16.179 -4.220 -8.954 552 HZ3 LYS 72 HZ3 LYS 72 -17.450 -4.142 -7.829 553 H THR 73 HN THR 73 -14.977 -1.597 -4.981 554 HA THR 73 HA THR 73 -12.212 -1.709 -3.896 555 HB THR 73 HB THR 73 -12.986 -2.912 -1.930 556 HG1 THR 73 HG1 THR 73 -15.317 -2.904 -3.366 557 HG21 THR 73 HG21 THR 73 -14.231 -1.068 -0.806 558 HG22 THR 73 HG22 THR 73 -14.458 -0.300 -2.372 559 HG23 THR 73 HG23 THR 73 -12.833 -0.491 -1.714 560 H GLY 74 HN GLY 74 -11.352 -3.842 -3.718 561 HA2 GLY 74 HA3 GLY 74 -11.107 -6.081 -4.306 562 HA3 GLY 74 HA2 GLY 74 -12.776 -6.096 -4.866 563 H ILE 75 HN ILE 75 -10.428 -7.216 -6.129 564 HA ILE 75 HA ILE 75 -9.210 -5.875 -8.158 565 HB ILE 75 HB ILE 75 -10.536 -8.549 -8.664 566 HG12 ILE 75 HG12 ILE 75 -7.957 -9.133 -7.712 567 HG13 ILE 75 HG11 ILE 75 -8.452 -7.832 -6.639 568 HG21 ILE 75 HG21 ILE 75 -7.962 -7.276 -9.642 569 HG22 ILE 75 HG22 ILE 75 -9.429 -7.543 -10.582 570 HG23 ILE 75 HG23 ILE 75 -8.482 -8.919 -10.018 571 HD11 ILE 75 HD11 ILE 75 -9.751 -10.523 -7.058 572 HD12 ILE 75 HD12 ILE 75 -10.650 -9.182 -6.341 573 HD13 ILE 75 HD13 ILE 75 -9.192 -9.790 -5.555 574 H ILE 76 HN ILE 76 -9.649 -5.186 -10.248 575 HA ILE 76 HA ILE 76 -12.457 -5.276 -11.192 576 HB ILE 76 HB ILE 76 -10.871 -2.698 -11.397 577 HG12 ILE 76 HG12 ILE 76 -12.703 -3.459 -9.093 578 HG13 ILE 76 HG11 ILE 76 -10.950 -3.299 -8.985 579 HG21 ILE 76 HG21 ILE 76 -13.856 -3.228 -11.225 580 HG22 ILE 76 HG22 ILE 76 -12.970 -3.125 -12.744 581 HG23 ILE 76 HG23 ILE 76 -13.065 -1.719 -11.686 582 HD11 ILE 76 HD11 ILE 76 -11.132 -0.937 -9.719 583 HD12 ILE 76 HD12 ILE 76 -11.987 -1.240 -8.208 584 HD13 ILE 76 HD13 ILE 76 -12.888 -1.087 -9.711 585 H ASP 77 HN ASP 77 -10.457 -6.889 -12.174 586 HA ASP 77 HA ASP 77 -9.079 -5.773 -14.404 587 HB2 ASP 77 HB2 ASP 77 -8.811 -8.180 -15.075 588 HB3 ASP 77 HB1 ASP 77 -8.291 -7.826 -13.426 589 H TYR 78 HN TYR 78 -9.571 -5.827 -16.568 590 HA TYR 78 HA TYR 78 -12.435 -5.902 -17.230 591 HB2 TYR 78 HB2 TYR 78 -10.010 -5.048 -18.829 592 HB3 TYR 78 HB1 TYR 78 -11.669 -4.975 -19.418 593 HD1 TYR 78 HD1 TYR 78 -9.284 -3.623 -16.914 594 HD2 TYR 78 HD2 TYR 78 -13.200 -3.255 -18.649 595 HE1 TYR 78 HE1 TYR 78 -9.558 -1.409 -15.832 596 HE2 TYR 78 HE2 TYR 78 -13.472 -1.042 -17.563 597 HH TYR 78 HH TYR 78 -11.254 0.805 -16.587 598 H GLY 79 HN GLY 79 -9.925 -8.096 -17.173 599 HA2 GLY 79 HA3 GLY 79 -9.698 -10.213 -18.049 600 HA3 GLY 79 HA2 GLY 79 -11.352 -10.062 -18.632 601 H ILE 80 HN ILE 80 -8.001 -9.738 -19.399 602 HA ILE 80 HA ILE 80 -6.857 -9.407 -21.373 603 HB ILE 80 HB ILE 80 -9.346 -10.655 -22.568 604 HG12 ILE 80 HG12 ILE 80 -6.831 -12.027 -21.551 605 HG13 ILE 80 HG11 ILE 80 -8.326 -11.941 -20.629 606 HG21 ILE 80 HG21 ILE 80 -7.659 -11.492 -24.253 607 HG22 ILE 80 HG22 ILE 80 -6.459 -10.454 -23.491 608 HG23 ILE 80 HG23 ILE 80 -7.869 -9.744 -24.272 609 HD11 ILE 80 HD11 ILE 80 -8.207 -14.072 -21.838 610 HD12 ILE 80 HD12 ILE 80 -8.006 -13.212 -23.363 611 HD13 ILE 80 HD13 ILE 80 -9.523 -13.084 -22.474 612 H ARG 81 HN ARG 81 -6.633 -7.278 -21.807 613 HA ARG 81 HA ARG 81 -8.902 -5.763 -22.962 614 HB2 ARG 81 HB2 ARG 81 -6.219 -4.878 -21.853 615 HB3 ARG 81 HB1 ARG 81 -7.369 -3.785 -22.626 616 HG2 ARG 81 HG2 ARG 81 -9.081 -4.421 -20.954 617 HG3 ARG 81 HG1 ARG 81 -7.923 -5.492 -20.172 618 HD2 ARG 81 HD2 ARG 81 -7.936 -3.441 -18.921 619 HD3 ARG 81 HD1 ARG 81 -6.438 -3.462 -19.836 620 HE ARG 81 HE ARG 81 -8.444 -2.120 -21.321 621 HH11 ARG 81 HH21 ARG 81 -6.364 -1.819 -18.562 622 HH12 ARG 81 HH22 ARG 81 -6.400 -0.086 -18.554 623 HH21 ARG 81 HH11 ARG 81 -8.476 0.168 -21.317 624 HH22 ARG 81 HH12 ARG 81 -7.590 1.035 -20.105 625 H LEU 82 HN LEU 82 -8.675 -4.596 -24.890 626 HA LEU 82 HA LEU 82 -7.010 -5.922 -26.890 627 HB2 LEU 82 HB2 LEU 82 -9.242 -3.891 -26.992 628 HB3 LEU 82 HB1 LEU 82 -8.281 -4.235 -28.423 629 HG LEU 82 HG LEU 82 -10.424 -5.571 -28.236 630 HD11 LEU 82 HD11 LEU 82 -8.132 -7.538 -28.149 631 HD12 LEU 82 HD12 LEU 82 -8.209 -6.348 -29.447 632 HD13 LEU 82 HD13 LEU 82 -9.530 -7.485 -29.217 633 HD21 LEU 82 HD21 LEU 82 -10.645 -7.315 -26.612 634 HD22 LEU 82 HD22 LEU 82 -10.194 -5.865 -25.714 635 HD23 LEU 82 HD23 LEU 82 -8.987 -7.105 -26.054 636 H ASN 83 HN ASN 83 -6.525 -3.479 -24.756 637 HA ASN 83 HA ASN 83 -5.115 -1.611 -26.446 638 HB2 ASN 83 HB2 ASN 83 -5.438 -1.907 -23.455 639 HB3 ASN 83 HB1 ASN 83 -4.416 -0.676 -24.180 640 HD21 ASN 83 HD21 ASN 83 -6.671 0.099 -22.662 641 HD22 ASN 83 HD22 ASN 83 -7.803 0.798 -23.714 642 H ARG 84 HN ARG 84 -4.321 -4.519 -26.300 643 HA ARG 84 HA ARG 84 -1.900 -4.922 -24.987 644 HB2 ARG 84 HB2 ARG 84 -2.866 -5.948 -27.656 645 HB3 ARG 84 HB1 ARG 84 -1.352 -6.479 -26.933 646 HG2 ARG 84 HG2 ARG 84 -2.565 -7.296 -24.951 647 HG3 ARG 84 HG1 ARG 84 -4.090 -6.744 -25.650 648 HD2 ARG 84 HD2 ARG 84 -3.770 -8.212 -27.576 649 HD3 ARG 84 HD1 ARG 84 -2.216 -8.744 -26.949 650 HE ARG 84 HE ARG 84 -4.288 -9.262 -25.060 651 HH11 ARG 84 HH21 ARG 84 -2.864 -10.267 -28.043 652 HH12 ARG 84 HH22 ARG 84 -3.523 -11.868 -27.995 653 HH21 ARG 84 HH11 ARG 84 -5.175 -11.393 -24.985 654 HH22 ARG 84 HH12 ARG 84 -4.834 -12.499 -26.271 655 H SER 85 HN SER 85 -2.526 -2.507 -27.197 656 HA SER 85 HA SER 85 0.213 -2.385 -28.286 657 HB2 SER 85 HB2 SER 85 -1.701 -2.010 -29.807 658 HB3 SER 85 HB1 SER 85 -2.185 -0.625 -28.832 659 HG SER 85 HG SER 85 0.330 -0.249 -29.293 660 H GLU 86 HN GLU 86 -1.854 -0.916 -25.908 661 HA GLU 86 HA GLU 86 -0.362 1.501 -25.560 662 HB2 GLU 86 HB2 GLU 86 -2.281 0.075 -23.723 663 HB3 GLU 86 HB1 GLU 86 -1.611 1.669 -23.409 664 HG2 GLU 86 HG2 GLU 86 -2.580 2.499 -25.529 665 HG3 GLU 86 HG1 GLU 86 -3.276 0.909 -25.829 666 H ARG 87 HN ARG 87 0.787 2.027 -23.559 667 HA ARG 87 HA ARG 87 2.632 -0.129 -22.771 668 HB2 ARG 87 HB2 ARG 87 2.665 2.880 -22.465 669 HB3 ARG 87 HB1 ARG 87 3.879 1.820 -21.757 670 HG2 ARG 87 HG2 ARG 87 4.639 1.065 -23.890 671 HG3 ARG 87 HG1 ARG 87 3.233 1.743 -24.720 672 HD2 ARG 87 HD2 ARG 87 5.510 3.058 -24.802 673 HD3 ARG 87 HD1 ARG 87 4.020 3.956 -24.525 674 HE ARG 87 HE ARG 87 4.944 3.275 -22.013 675 HH11 ARG 87 HH21 ARG 87 6.169 4.938 -24.793 676 HH12 ARG 87 HH22 ARG 87 7.118 6.054 -23.869 677 HH21 ARG 87 HH11 ARG 87 6.144 4.767 -20.802 678 HH22 ARG 87 HH12 ARG 87 7.102 5.960 -21.613 679 H TRP 88 HN TRP 88 2.736 -0.950 -20.775 680 HA TRP 88 HA TRP 88 1.484 0.354 -18.475 681 HB2 TRP 88 HB2 TRP 88 0.467 -2.277 -19.577 682 HB3 TRP 88 HB1 TRP 88 0.130 -1.713 -17.947 683 HD1 TRP 88 HD1 TRP 88 -0.547 -0.819 -21.616 684 HE1 TRP 88 HE1 TRP 88 -2.652 0.663 -21.717 685 HE3 TRP 88 HE3 TRP 88 -1.344 -0.097 -16.638 686 HZ2 TRP 88 HZ2 TRP 88 -4.440 1.985 -19.918 687 HZ3 TRP 88 HZ3 TRP 88 -3.256 1.280 -15.852 688 HH2 TRP 88 HH2 TRP 88 -4.800 2.319 -17.487 689 H ASP 89 HN ASP 89 1.673 -1.227 -16.525 690 HA ASP 89 HA ASP 89 4.441 -1.887 -16.240 691 HB2 ASP 89 HB2 ASP 89 2.789 -1.055 -14.441 692 HB3 ASP 89 HB1 ASP 89 2.230 -2.717 -14.346 693 H ALA 90 HN ALA 90 4.404 -4.191 -14.705 694 HA ALA 90 HA ALA 90 3.133 -6.374 -16.112 695 HB1 ALA 90 HB1 ALA 90 5.206 -7.425 -16.912 696 HB2 ALA 90 HB2 ALA 90 6.129 -6.015 -16.392 697 HB3 ALA 90 HB3 ALA 90 4.945 -5.864 -17.690 698 H TYR 91 HN TYR 91 3.339 -8.333 -15.057 699 HA TYR 91 HA TYR 91 4.668 -8.280 -12.386 700 HB2 TYR 91 HB2 TYR 91 2.031 -9.525 -13.207 701 HB3 TYR 91 HB1 TYR 91 2.832 -9.837 -11.670 702 HD1 TYR 91 HD2 TYR 91 3.271 -7.936 -10.075 703 HD2 TYR 91 HD1 TYR 91 0.774 -7.489 -13.547 704 HE1 TYR 91 HE2 TYR 91 2.269 -5.890 -9.095 705 HE2 TYR 91 HE1 TYR 91 -0.227 -5.447 -12.562 706 HH TYR 91 HH TYR 91 1.096 -3.899 -9.792 707 H CYS 92 HN CYS 92 5.268 -10.378 -11.567 708 HA CYS 92 HA CYS 92 5.578 -12.551 -13.527 709 HB2 CYS 92 HB2 CYS 92 7.775 -10.780 -12.617 710 HB3 CYS 92 HB1 CYS 92 8.143 -12.489 -12.441 711 H TYR 93 HN TYR 93 7.178 -14.221 -12.176 712 HA TYR 93 HA TYR 93 6.438 -14.462 -9.389 713 HB2 TYR 93 HB2 TYR 93 4.355 -15.197 -10.369 714 HB3 TYR 93 HB1 TYR 93 5.195 -16.269 -11.476 715 HD1 TYR 93 HD1 TYR 93 4.542 -15.630 -7.852 716 HD2 TYR 93 HD2 TYR 93 5.742 -18.506 -10.817 717 HE1 TYR 93 HE1 TYR 93 4.419 -17.437 -6.157 718 HE2 TYR 93 HE2 TYR 93 5.618 -20.306 -9.120 719 HH TYR 93 HH TYR 93 5.379 -20.768 -6.948 720 H ASN 94 HN ASN 94 7.561 -16.117 -8.330 721 HA ASN 94 HA ASN 94 9.448 -17.722 -9.930 722 HB2 ASN 94 HB2 ASN 94 10.249 -15.718 -7.817 723 HB3 ASN 94 HB1 ASN 94 11.313 -17.024 -8.336 724 HD21 ASN 94 HD21 ASN 94 12.664 -16.502 -10.044 725 HD22 ASN 94 HD22 ASN 94 12.375 -15.271 -11.178 726 HA PRO 95 HA PRO 95 8.432 -20.677 -6.759 727 HB2 PRO 95 HB2 PRO 95 10.345 -22.566 -7.164 728 HB3 PRO 95 HB1 PRO 95 9.085 -22.248 -8.380 729 HG2 PRO 95 HG2 PRO 95 11.902 -21.200 -8.286 730 HG3 PRO 95 HG1 PRO 95 11.037 -21.953 -9.645 731 HD2 PRO 95 HD2 PRO 95 11.233 -19.243 -9.415 732 HD3 PRO 95 HD1 PRO 95 9.786 -20.027 -10.097 733 H HIS 96 HN HIS 96 10.832 -18.499 -6.450 734 HA HIS 96 HA HIS 96 12.681 -19.438 -4.599 735 HB2 HIS 96 HB2 HIS 96 12.901 -17.090 -3.885 736 HB3 HIS 96 HB1 HIS 96 12.818 -17.223 -5.642 737 HD1 HIS 96 HD1 HIS 96 9.834 -17.419 -6.143 738 HD2 HIS 96 HD2 HIS 96 11.457 -14.791 -3.344 739 HE1 HIS 96 HE1 HIS 96 8.139 -15.560 -5.838 740 HE2 HIS 96 HE2 HIS 96 9.115 -13.951 -4.135 741 H ALA 97 HN ALA 97 9.428 -18.163 -4.065 742 HA ALA 97 HA ALA 97 9.291 -19.577 -1.496 743 HB1 ALA 97 HB1 ALA 97 8.478 -17.503 -0.336 744 HB2 ALA 97 HB2 ALA 97 8.992 -16.568 -1.743 745 HB3 ALA 97 HB3 ALA 97 10.185 -17.442 -0.778 746 H LYS 98 HN LYS 98 7.196 -19.978 -0.830 747 HA LYS 98 HA LYS 98 4.990 -20.464 -1.186 748 HB2 LYS 98 HB2 LYS 98 5.080 -17.642 -2.297 749 HB3 LYS 98 HB1 LYS 98 3.610 -18.518 -1.891 750 HG2 LYS 98 HG2 LYS 98 4.310 -18.713 0.430 751 HG3 LYS 98 HG1 LYS 98 5.853 -17.944 0.058 752 HD2 LYS 98 HD2 LYS 98 4.731 -15.878 -0.560 753 HD3 LYS 98 HD1 LYS 98 3.152 -16.635 -0.349 754 HE2 LYS 98 HE2 LYS 98 3.682 -15.320 1.632 755 HE3 LYS 98 HE1 LYS 98 3.696 -17.033 2.042 756 HZ1 LYS 98 HZ1 LYS 98 6.172 -15.633 1.241 757 HZ2 LYS 98 HZ2 LYS 98 6.002 -17.079 2.117 758 HZ3 LYS 98 HZ3 LYS 98 5.624 -15.591 2.846 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 4.046 -17.253 -2.066 2 H2 GLY 1 H2 GLY 1 5.694 -16.932 -1.799 3 H3 GLY 1 H3 GLY 1 5.096 -17.070 -3.385 4 HA2 GLY 1 HA3 GLY 1 3.533 -15.119 -2.373 5 HA3 GLY 1 HA2 GLY 1 5.092 -14.808 -1.608 6 H VAL 2 HN VAL 2 3.775 -13.204 -3.631 7 HA VAL 2 HA VAL 2 5.856 -13.274 -5.750 8 HB VAL 2 HB VAL 2 3.769 -14.177 -6.678 9 HG11 VAL 2 HG11 VAL 2 2.545 -11.492 -5.975 10 HG12 VAL 2 HG12 VAL 2 2.258 -12.975 -5.064 11 HG13 VAL 2 HG13 VAL 2 1.743 -12.860 -6.747 12 HG21 VAL 2 HG21 VAL 2 3.663 -12.738 -8.603 13 HG22 VAL 2 HG22 VAL 2 5.321 -12.648 -8.008 14 HG23 VAL 2 HG23 VAL 2 4.191 -11.336 -7.672 15 H TYR 3 HN TYR 3 6.615 -11.355 -6.439 16 HA TYR 3 HA TYR 3 5.606 -8.893 -5.102 17 HB2 TYR 3 HB2 TYR 3 8.210 -8.249 -5.361 18 HB3 TYR 3 HB1 TYR 3 7.591 -9.078 -3.935 19 HD1 TYR 3 HD1 TYR 3 8.540 -10.163 -7.438 20 HD2 TYR 3 HD2 TYR 3 9.051 -10.780 -3.205 21 HE1 TYR 3 HE1 TYR 3 10.072 -12.049 -7.885 22 HE2 TYR 3 HE2 TYR 3 10.582 -12.662 -3.671 23 HH TYR 3 HH TYR 3 12.121 -13.332 -5.609 24 H HIS 4 HN HIS 4 6.159 -6.911 -6.188 25 HA HIS 4 HA HIS 4 5.595 -7.135 -9.015 26 HB2 HIS 4 HB2 HIS 4 5.375 -4.724 -8.984 27 HB3 HIS 4 HB1 HIS 4 4.520 -5.406 -7.606 28 HD1 HIS 4 HD1 HIS 4 5.611 -5.081 -5.239 29 HD2 HIS 4 HD2 HIS 4 7.580 -3.092 -8.328 30 HE1 HIS 4 HE1 HIS 4 7.170 -3.413 -4.140 31 HE2 HIS 4 HE2 HIS 4 8.376 -2.194 -6.012 32 H ARG 5 HN ARG 5 6.893 -6.660 -10.708 33 HA ARG 5 HA ARG 5 9.797 -6.374 -10.144 34 HB2 ARG 5 HB2 ARG 5 8.333 -7.380 -12.598 35 HB3 ARG 5 HB1 ARG 5 10.079 -7.217 -12.473 36 HG2 ARG 5 HG2 ARG 5 8.449 -8.912 -10.555 37 HG3 ARG 5 HG1 ARG 5 9.156 -9.558 -12.035 38 HD2 ARG 5 HD2 ARG 5 11.403 -8.701 -11.193 39 HD3 ARG 5 HD1 ARG 5 10.621 -8.393 -9.653 40 HE ARG 5 HE ARG 5 10.083 -11.035 -10.367 41 HH11 ARG 5 HH21 ARG 5 12.672 -8.908 -9.453 42 HH12 ARG 5 HH22 ARG 5 13.662 -10.163 -8.783 43 HH21 ARG 5 HH11 ARG 5 11.394 -12.706 -9.474 44 HH22 ARG 5 HH12 ARG 5 12.936 -12.308 -8.792 45 H GLU 6 HN GLU 6 11.052 -5.094 -11.641 46 HA GLU 6 HA GLU 6 9.623 -2.875 -12.964 47 HB2 GLU 6 HB2 GLU 6 10.128 -2.158 -10.641 48 HB3 GLU 6 HB1 GLU 6 11.834 -2.507 -10.913 49 HG2 GLU 6 HG2 GLU 6 11.932 -0.829 -12.686 50 HG3 GLU 6 HG1 GLU 6 10.201 -0.540 -12.537 51 H ALA 7 HN ALA 7 10.547 -2.280 -14.794 52 HA ALA 7 HA ALA 7 12.946 -3.691 -15.712 53 HB1 ALA 7 HB1 ALA 7 10.956 -1.875 -17.080 54 HB2 ALA 7 HB2 ALA 7 11.165 -3.608 -17.300 55 HB3 ALA 7 HB3 ALA 7 12.396 -2.493 -17.890 56 H ARG 8 HN ARG 8 14.584 -2.447 -16.953 57 HA ARG 8 HA ARG 8 15.750 -0.445 -15.303 58 HB2 ARG 8 HB2 ARG 8 17.103 -2.026 -16.614 59 HB3 ARG 8 HB1 ARG 8 16.479 -1.336 -18.108 60 HG2 ARG 8 HG2 ARG 8 18.585 -0.279 -17.855 61 HG3 ARG 8 HG1 ARG 8 17.477 0.924 -17.235 62 HD2 ARG 8 HD2 ARG 8 19.434 0.685 -15.769 63 HD3 ARG 8 HD1 ARG 8 17.975 0.199 -14.922 64 HE ARG 8 HE ARG 8 18.892 -1.921 -14.750 65 HH11 ARG 8 HH21 ARG 8 20.436 -0.121 -17.304 66 HH12 ARG 8 HH22 ARG 8 21.586 -1.365 -17.676 67 HH21 ARG 8 HH11 ARG 8 20.430 -3.544 -15.205 68 HH22 ARG 8 HH12 ARG 8 21.581 -3.312 -16.482 69 H SER 9 HN SER 9 13.938 -0.360 -18.332 70 HA SER 9 HA SER 9 14.351 2.432 -18.837 71 HB2 SER 9 HB2 SER 9 12.533 2.148 -20.491 72 HB3 SER 9 HB1 SER 9 13.761 0.893 -20.642 73 HG SER 9 HG SER 9 12.411 -0.551 -19.751 74 H GLY 10 HN GLY 10 12.315 0.665 -16.717 75 HA2 GLY 10 HA3 GLY 10 11.313 2.058 -14.920 76 HA3 GLY 10 HA2 GLY 10 10.650 3.087 -16.181 77 H LYS 11 HN LYS 11 8.563 2.742 -15.393 78 HA LYS 11 HA LYS 11 7.392 0.046 -15.852 79 HB2 LYS 11 HB2 LYS 11 6.529 2.258 -13.970 80 HB3 LYS 11 HB1 LYS 11 5.607 0.785 -14.274 81 HG2 LYS 11 HG2 LYS 11 7.535 -0.566 -13.499 82 HG3 LYS 11 HG1 LYS 11 8.420 0.922 -13.158 83 HD2 LYS 11 HD2 LYS 11 6.632 1.605 -11.576 84 HD3 LYS 11 HD1 LYS 11 5.805 0.076 -11.879 85 HE2 LYS 11 HE2 LYS 11 8.642 0.287 -10.829 86 HE3 LYS 11 HE1 LYS 11 7.226 0.059 -9.802 87 HZ1 LYS 11 HZ1 LYS 11 6.818 -1.878 -11.539 88 HZ2 LYS 11 HZ2 LYS 11 7.762 -2.096 -10.143 89 HZ3 LYS 11 HZ3 LYS 11 8.510 -1.806 -11.641 90 H TYR 12 HN TYR 12 4.861 0.446 -16.097 91 HA TYR 12 HA TYR 12 3.266 0.936 -17.700 92 HB2 TYR 12 HB2 TYR 12 4.394 3.694 -17.162 93 HB3 TYR 12 HB1 TYR 12 2.907 3.390 -18.053 94 HD1 TYR 12 HD2 TYR 12 0.900 2.528 -16.918 95 HD2 TYR 12 HD1 TYR 12 4.519 3.320 -14.738 96 HE1 TYR 12 HE2 TYR 12 -0.359 2.420 -14.788 97 HE2 TYR 12 HE1 TYR 12 3.256 3.214 -12.607 98 HH TYR 12 HH TYR 12 0.648 1.846 -12.076 99 H LYS 13 HN LYS 13 6.229 0.575 -18.555 100 HA LYS 13 HA LYS 13 5.889 1.538 -21.351 101 HB2 LYS 13 HB2 LYS 13 8.324 1.658 -19.563 102 HB3 LYS 13 HB1 LYS 13 8.462 1.727 -21.325 103 HG2 LYS 13 HG2 LYS 13 6.819 3.679 -21.262 104 HG3 LYS 13 HG1 LYS 13 6.988 3.671 -19.513 105 HD2 LYS 13 HD2 LYS 13 9.302 3.958 -21.451 106 HD3 LYS 13 HD1 LYS 13 8.495 5.313 -20.670 107 HE2 LYS 13 HE2 LYS 13 9.058 4.156 -18.434 108 HE3 LYS 13 HE1 LYS 13 10.149 3.134 -19.373 109 HZ1 LYS 13 HZ1 LYS 13 10.216 6.097 -19.245 110 HZ2 LYS 13 HZ2 LYS 13 11.240 5.130 -20.198 111 HZ3 LYS 13 HZ3 LYS 13 11.313 5.038 -18.501 112 H LEU 14 HN LEU 14 5.319 -1.052 -19.992 113 HA LEU 14 HA LEU 14 7.068 -2.799 -21.670 114 HB2 LEU 14 HB2 LEU 14 5.783 -3.557 -19.037 115 HB3 LEU 14 HB1 LEU 14 6.907 -4.521 -19.992 116 HG LEU 14 HG LEU 14 7.582 -1.839 -18.733 117 HD11 LEU 14 HD11 LEU 14 8.826 -3.114 -17.073 118 HD12 LEU 14 HD12 LEU 14 8.395 -4.630 -17.864 119 HD13 LEU 14 HD13 LEU 14 7.151 -3.662 -17.075 120 HD21 LEU 14 HD21 LEU 14 9.213 -3.910 -20.246 121 HD22 LEU 14 HD22 LEU 14 9.969 -2.708 -19.199 122 HD23 LEU 14 HD23 LEU 14 9.051 -2.192 -20.601 123 H THR 15 HN THR 15 6.074 -4.064 -23.081 124 HA THR 15 HA THR 15 3.115 -4.110 -23.118 125 HB THR 15 HB THR 15 3.372 -4.950 -25.416 126 HG1 THR 15 HG1 THR 15 6.139 -4.614 -24.895 127 HG21 THR 15 HG21 THR 15 3.286 -2.517 -24.976 128 HG22 THR 15 HG22 THR 15 4.278 -2.890 -26.388 129 HG23 THR 15 HG23 THR 15 5.046 -2.487 -24.850 130 H TYR 16 HN TYR 16 2.130 -6.184 -23.897 131 HA TYR 16 HA TYR 16 2.484 -8.217 -22.054 132 HB2 TYR 16 HB2 TYR 16 1.172 -9.642 -23.579 133 HB3 TYR 16 HB1 TYR 16 0.481 -8.027 -23.443 134 HD1 TYR 16 HD2 TYR 16 0.763 -6.369 -25.272 135 HD2 TYR 16 HD1 TYR 16 2.129 -10.425 -25.681 136 HE1 TYR 16 HE2 TYR 16 0.935 -6.067 -27.730 137 HE2 TYR 16 HE1 TYR 16 2.300 -10.118 -28.136 138 HH TYR 16 HH TYR 16 1.403 -8.707 -29.879 139 H ALA 17 HN ALA 17 3.673 -8.209 -25.424 140 HA ALA 17 HA ALA 17 5.050 -10.623 -25.375 141 HB1 ALA 17 HB1 ALA 17 6.390 -9.735 -27.210 142 HB2 ALA 17 HB2 ALA 17 5.905 -8.090 -26.798 143 HB3 ALA 17 HB3 ALA 17 4.707 -9.237 -27.404 144 H GLU 18 HN GLU 18 6.143 -7.415 -24.304 145 HA GLU 18 HA GLU 18 8.817 -8.238 -23.691 146 HB2 GLU 18 HB2 GLU 18 7.183 -5.906 -22.651 147 HB3 GLU 18 HB1 GLU 18 8.910 -6.121 -22.372 148 HG2 GLU 18 HG2 GLU 18 7.641 -5.948 -25.120 149 HG3 GLU 18 HG1 GLU 18 8.385 -4.585 -24.285 150 H ALA 19 HN ALA 19 5.961 -7.651 -21.620 151 HA ALA 19 HA ALA 19 7.004 -8.240 -19.144 152 HB1 ALA 19 HB1 ALA 19 4.280 -8.987 -20.230 153 HB2 ALA 19 HB2 ALA 19 4.714 -7.477 -19.429 154 HB3 ALA 19 HB3 ALA 19 4.716 -8.990 -18.520 155 H LYS 20 HN LYS 20 6.016 -10.508 -21.664 156 HA LYS 20 HA LYS 20 6.257 -12.882 -20.106 157 HB2 LYS 20 HB2 LYS 20 6.339 -12.398 -23.095 158 HB3 LYS 20 HB1 LYS 20 6.385 -14.006 -22.374 159 HG2 LYS 20 HG2 LYS 20 4.225 -13.571 -21.257 160 HG3 LYS 20 HG1 LYS 20 4.173 -11.967 -21.990 161 HD2 LYS 20 HD2 LYS 20 4.127 -12.938 -24.223 162 HD3 LYS 20 HD1 LYS 20 4.319 -14.559 -23.555 163 HE2 LYS 20 HE2 LYS 20 1.966 -14.175 -24.089 164 HE3 LYS 20 HE1 LYS 20 2.163 -14.281 -22.341 165 HZ1 LYS 20 HZ1 LYS 20 2.450 -11.624 -23.448 166 HZ2 LYS 20 HZ2 LYS 20 1.612 -12.142 -22.064 167 HZ3 LYS 20 HZ3 LYS 20 0.896 -12.289 -23.598 168 H ALA 21 HN ALA 21 8.492 -10.977 -22.026 169 HA ALA 21 HA ALA 21 10.588 -12.874 -22.169 170 HB1 ALA 21 HB1 ALA 21 12.005 -11.031 -22.815 171 HB2 ALA 21 HB2 ALA 21 10.896 -9.861 -22.101 172 HB3 ALA 21 HB3 ALA 21 10.415 -10.768 -23.536 173 H VAL 22 HN VAL 22 10.172 -10.123 -19.899 174 HA VAL 22 HA VAL 22 12.442 -10.686 -18.327 175 HB VAL 22 HB VAL 22 11.207 -9.363 -16.542 176 HG11 VAL 22 HG11 VAL 22 12.627 -8.269 -18.250 177 HG12 VAL 22 HG12 VAL 22 11.232 -7.271 -17.842 178 HG13 VAL 22 HG13 VAL 22 11.244 -8.194 -19.342 179 HG21 VAL 22 HG21 VAL 22 8.936 -10.128 -17.234 180 HG22 VAL 22 HG22 VAL 22 9.113 -9.212 -18.726 181 HG23 VAL 22 HG23 VAL 22 9.065 -8.371 -17.180 182 H CYS 23 HN CYS 23 9.298 -12.145 -18.424 183 HA CYS 23 HA CYS 23 9.858 -13.714 -15.962 184 HB2 CYS 23 HB2 CYS 23 7.262 -13.652 -17.525 185 HB3 CYS 23 HB1 CYS 23 7.536 -14.308 -15.919 186 H GLU 24 HN GLU 24 8.756 -15.985 -16.245 187 HA GLU 24 HA GLU 24 8.858 -18.099 -17.191 188 HB2 GLU 24 HB2 GLU 24 9.047 -16.533 -19.782 189 HB3 GLU 24 HB1 GLU 24 8.962 -18.272 -19.707 190 HG2 GLU 24 HG2 GLU 24 6.806 -18.154 -18.564 191 HG3 GLU 24 HG1 GLU 24 6.904 -16.393 -18.528 192 H PHE 25 HN PHE 25 11.361 -15.957 -17.101 193 HA PHE 25 HA PHE 25 13.432 -17.242 -18.522 194 HB2 PHE 25 HB2 PHE 25 13.603 -14.958 -17.659 195 HB3 PHE 25 HB1 PHE 25 13.541 -15.561 -16.005 196 HD1 PHE 25 HD1 PHE 25 15.505 -15.771 -19.181 197 HD2 PHE 25 HD2 PHE 25 15.551 -16.258 -14.908 198 HE1 PHE 25 HE1 PHE 25 17.964 -16.079 -19.239 199 HE2 PHE 25 HE2 PHE 25 18.010 -16.566 -14.972 200 HZ PHE 25 HZ PHE 25 19.216 -16.477 -17.136 201 H GLU 26 HN GLU 26 12.340 -17.578 -15.156 202 HA GLU 26 HA GLU 26 14.197 -19.834 -14.734 203 HB2 GLU 26 HB2 GLU 26 13.422 -19.721 -12.371 204 HB3 GLU 26 HB1 GLU 26 14.172 -18.233 -12.934 205 HG2 GLU 26 HG2 GLU 26 11.165 -18.645 -12.988 206 HG3 GLU 26 HG1 GLU 26 11.997 -17.979 -11.588 207 H GLY 27 HN GLY 27 11.322 -19.558 -16.152 208 HA2 GLY 27 HA3 GLY 27 10.076 -21.467 -16.843 209 HA3 GLY 27 HA2 GLY 27 10.477 -22.277 -15.333 210 H GLY 28 HN GLY 28 9.813 -19.641 -13.911 211 HA2 GLY 28 HA3 GLY 28 7.118 -20.294 -13.255 212 HA3 GLY 28 HA2 GLY 28 8.002 -18.877 -12.704 213 H HIS 29 HN HIS 29 5.213 -19.302 -13.788 214 HA HIS 29 HA HIS 29 5.250 -17.587 -16.199 215 HB2 HIS 29 HB2 HIS 29 3.035 -19.166 -14.862 216 HB3 HIS 29 HB1 HIS 29 2.820 -18.165 -16.296 217 HD1 HIS 29 HD1 HIS 29 4.061 -21.477 -15.183 218 HD2 HIS 29 HD2 HIS 29 4.280 -19.142 -18.630 219 HE1 HIS 29 HE1 HIS 29 4.855 -23.008 -17.038 220 HE2 HIS 29 HE2 HIS 29 4.992 -21.599 -19.146 221 H LEU 30 HN LEU 30 3.966 -15.710 -16.314 222 HA LEU 30 HA LEU 30 4.176 -13.954 -14.153 223 HB2 LEU 30 HB2 LEU 30 2.057 -13.655 -16.304 224 HB3 LEU 30 HB1 LEU 30 2.925 -12.393 -15.435 225 HG LEU 30 HG LEU 30 5.037 -13.757 -16.631 226 HD11 LEU 30 HD11 LEU 30 2.823 -13.692 -18.707 227 HD12 LEU 30 HD12 LEU 30 3.346 -15.164 -17.894 228 HD13 LEU 30 HD13 LEU 30 4.472 -14.278 -18.918 229 HD21 LEU 30 HD21 LEU 30 4.707 -11.311 -16.659 230 HD22 LEU 30 HD22 LEU 30 3.428 -11.487 -17.854 231 HD23 LEU 30 HD23 LEU 30 5.089 -11.904 -18.269 232 H ALA 31 HN ALA 31 2.760 -13.265 -12.578 233 HA ALA 31 HA ALA 31 0.990 -15.044 -11.416 234 HB1 ALA 31 HB1 ALA 31 0.224 -13.195 -10.056 235 HB2 ALA 31 HB2 ALA 31 0.822 -12.028 -11.233 236 HB3 ALA 31 HB3 ALA 31 1.959 -13.020 -10.317 237 H THR 32 HN THR 32 -1.150 -15.463 -11.558 238 HA THR 32 HA THR 32 -2.720 -14.043 -13.662 239 HB THR 32 HB THR 32 -2.893 -16.975 -12.917 240 HG1 THR 32 HG1 THR 32 -1.298 -17.169 -14.230 241 HG21 THR 32 HG21 THR 32 -4.122 -16.926 -15.235 242 HG22 THR 32 HG22 THR 32 -4.359 -15.216 -14.898 243 HG23 THR 32 HG23 THR 32 -5.015 -16.432 -13.802 244 H TYR 33 HN TYR 33 -5.111 -14.448 -13.376 245 HA TYR 33 HA TYR 33 -6.028 -13.255 -11.045 246 HB2 TYR 33 HB2 TYR 33 -7.203 -13.602 -13.309 247 HB3 TYR 33 HB1 TYR 33 -7.672 -15.183 -12.704 248 HD1 TYR 33 HD2 TYR 33 -8.900 -15.256 -10.386 249 HD2 TYR 33 HD1 TYR 33 -8.528 -11.695 -12.776 250 HE1 TYR 33 HE2 TYR 33 -10.804 -14.236 -9.175 251 HE2 TYR 33 HE1 TYR 33 -10.438 -10.684 -11.567 252 HH TYR 33 HH TYR 33 -12.035 -12.412 -8.884 253 H LYS 34 HN LYS 34 -6.204 -16.718 -11.905 254 HA LYS 34 HA LYS 34 -7.286 -17.655 -9.491 255 HB2 LYS 34 HB2 LYS 34 -7.109 -18.955 -11.612 256 HB3 LYS 34 HB1 LYS 34 -5.375 -19.097 -11.348 257 HG2 LYS 34 HG2 LYS 34 -5.752 -20.293 -9.247 258 HG3 LYS 34 HG1 LYS 34 -7.495 -20.098 -9.416 259 HD2 LYS 34 HD2 LYS 34 -5.945 -21.446 -11.647 260 HD3 LYS 34 HD1 LYS 34 -6.321 -22.364 -10.195 261 HE2 LYS 34 HE2 LYS 34 -8.371 -20.940 -11.925 262 HE3 LYS 34 HE1 LYS 34 -8.053 -22.674 -11.929 263 HZ1 LYS 34 HZ1 LYS 34 -8.468 -22.423 -9.393 264 HZ2 LYS 34 HZ2 LYS 34 -9.783 -22.531 -10.463 265 HZ3 LYS 34 HZ3 LYS 34 -9.304 -21.021 -9.852 266 H GLN 35 HN GLN 35 -3.878 -17.409 -10.510 267 HA GLN 35 HA GLN 35 -2.797 -18.396 -8.067 268 HB2 GLN 35 HB2 GLN 35 -1.564 -16.702 -10.256 269 HB3 GLN 35 HB1 GLN 35 -0.655 -17.359 -8.896 270 HG2 GLN 35 HG2 GLN 35 -1.347 -19.645 -9.552 271 HG3 GLN 35 HG1 GLN 35 -2.217 -18.976 -10.932 272 HE21 GLN 35 HE21 GLN 35 0.231 -16.898 -10.915 273 HE22 GLN 35 HE22 GLN 35 1.397 -17.743 -11.813 274 H LEU 36 HN LEU 36 -3.613 -15.179 -9.247 275 HA LEU 36 HA LEU 36 -2.358 -13.673 -7.221 276 HB2 LEU 36 HB2 LEU 36 -4.627 -13.195 -9.129 277 HB3 LEU 36 HB1 LEU 36 -4.332 -12.004 -7.892 278 HG LEU 36 HG LEU 36 -2.148 -12.944 -9.779 279 HD11 LEU 36 HD11 LEU 36 -2.615 -10.837 -11.045 280 HD12 LEU 36 HD12 LEU 36 -4.047 -10.590 -10.051 281 HD13 LEU 36 HD13 LEU 36 -3.952 -11.984 -11.128 282 HD21 LEU 36 HD21 LEU 36 -1.234 -10.619 -9.167 283 HD22 LEU 36 HD22 LEU 36 -1.202 -11.804 -7.873 284 HD23 LEU 36 HD23 LEU 36 -2.459 -10.571 -7.902 285 H GLU 37 HN GLU 37 -5.614 -15.082 -7.441 286 HA GLU 37 HA GLU 37 -6.768 -13.975 -5.174 287 HB2 GLU 37 HB2 GLU 37 -7.953 -15.375 -6.842 288 HB3 GLU 37 HB1 GLU 37 -7.135 -16.799 -6.199 289 HG2 GLU 37 HG2 GLU 37 -8.171 -16.452 -4.011 290 HG3 GLU 37 HG1 GLU 37 -8.909 -14.953 -4.574 291 H ALA 38 HN ALA 38 -4.408 -16.542 -5.450 292 HA ALA 38 HA ALA 38 -4.638 -17.574 -2.817 293 HB1 ALA 38 HB1 ALA 38 -3.477 -18.712 -4.728 294 HB2 ALA 38 HB2 ALA 38 -2.532 -18.663 -3.241 295 HB3 ALA 38 HB3 ALA 38 -2.166 -17.547 -4.557 296 H ALA 39 HN ALA 39 -2.829 -14.901 -4.207 297 HA ALA 39 HA ALA 39 -1.272 -14.412 -1.814 298 HB1 ALA 39 HB1 ALA 39 -1.688 -12.554 -4.167 299 HB2 ALA 39 HB2 ALA 39 -0.514 -13.871 -4.162 300 HB3 ALA 39 HB3 ALA 39 -0.359 -12.546 -3.006 301 H ARG 40 HN ARG 40 -4.346 -13.394 -3.082 302 HA ARG 40 HA ARG 40 -4.688 -10.950 -1.718 303 HB2 ARG 40 HB2 ARG 40 -6.754 -13.051 -2.407 304 HB3 ARG 40 HB1 ARG 40 -7.133 -11.412 -1.901 305 HG2 ARG 40 HG2 ARG 40 -5.503 -12.129 -4.355 306 HG3 ARG 40 HG1 ARG 40 -7.214 -11.745 -4.383 307 HD2 ARG 40 HD2 ARG 40 -4.874 -9.915 -3.828 308 HD3 ARG 40 HD1 ARG 40 -6.179 -9.711 -4.984 309 HE ARG 40 HE ARG 40 -6.761 -9.634 -2.077 310 HH11 ARG 40 HH21 ARG 40 -6.804 -8.078 -5.215 311 HH12 ARG 40 HH22 ARG 40 -7.541 -6.634 -4.625 312 HH21 ARG 40 HH11 ARG 40 -7.799 -7.755 -1.342 313 HH22 ARG 40 HH12 ARG 40 -8.138 -6.464 -2.447 314 H LYS 41 HN LYS 41 -5.102 -14.292 -0.651 315 HA LYS 41 HA LYS 41 -6.325 -13.638 1.863 316 HB2 LYS 41 HB2 LYS 41 -4.901 -16.141 0.917 317 HB3 LYS 41 HB1 LYS 41 -5.763 -16.004 2.451 318 HG2 LYS 41 HG2 LYS 41 -7.841 -15.447 1.227 319 HG3 LYS 41 HG1 LYS 41 -6.978 -15.631 -0.304 320 HD2 LYS 41 HD2 LYS 41 -6.476 -17.977 0.245 321 HD3 LYS 41 HD1 LYS 41 -7.305 -17.800 1.791 322 HE2 LYS 41 HE2 LYS 41 -8.806 -18.854 0.175 323 HE3 LYS 41 HE1 LYS 41 -9.404 -17.246 0.575 324 HZ1 LYS 41 HZ1 LYS 41 -8.580 -16.381 -1.435 325 HZ2 LYS 41 HZ2 LYS 41 -9.358 -17.833 -1.853 326 HZ3 LYS 41 HZ3 LYS 41 -7.662 -17.769 -1.762 327 H ILE 42 HN ILE 42 -3.176 -13.303 0.683 328 HA ILE 42 HA ILE 42 -1.906 -13.573 3.342 329 HB ILE 42 HB ILE 42 -0.556 -13.000 0.690 330 HG12 ILE 42 HG12 ILE 42 -1.779 -15.080 0.428 331 HG13 ILE 42 HG11 ILE 42 -0.074 -15.459 0.644 332 HG21 ILE 42 HG21 ILE 42 1.374 -14.159 1.945 333 HG22 ILE 42 HG22 ILE 42 0.414 -13.952 3.404 334 HG23 ILE 42 HG23 ILE 42 0.950 -12.543 2.494 335 HD11 ILE 42 HD11 ILE 42 -2.341 -15.804 2.605 336 HD12 ILE 42 HD12 ILE 42 -0.672 -15.735 3.168 337 HD13 ILE 42 HD13 ILE 42 -1.176 -17.001 2.053 338 H GLY 43 HN GLY 43 -3.579 -11.271 1.794 339 HA2 GLY 43 HA3 GLY 43 -3.816 -9.034 2.428 340 HA3 GLY 43 HA2 GLY 43 -2.284 -9.119 3.286 341 H PHE 44 HN PHE 44 -2.734 -10.090 -0.070 342 HA PHE 44 HA PHE 44 -0.555 -8.532 -0.993 343 HB2 PHE 44 HB2 PHE 44 -1.417 -10.618 -2.060 344 HB3 PHE 44 HB1 PHE 44 -2.824 -9.718 -2.606 345 HD1 PHE 44 HD1 PHE 44 0.864 -10.032 -2.884 346 HD2 PHE 44 HD2 PHE 44 -2.675 -8.200 -4.495 347 HE1 PHE 44 HE1 PHE 44 2.152 -9.280 -4.866 348 HE2 PHE 44 HE2 PHE 44 -1.381 -7.448 -6.473 349 HZ PHE 44 HZ PHE 44 1.030 -7.989 -6.659 350 H HIS 45 HN HIS 45 -0.447 -6.474 -1.616 351 HA HIS 45 HA HIS 45 -2.860 -5.050 -2.548 352 HB2 HIS 45 HB2 HIS 45 -2.747 -4.769 -0.069 353 HB3 HIS 45 HB1 HIS 45 -1.152 -4.053 -0.250 354 HD1 HIS 45 HD1 HIS 45 -4.598 -3.480 -1.816 355 HD2 HIS 45 HD2 HIS 45 -1.343 -1.313 -0.374 356 HE1 HIS 45 HE1 HIS 45 -5.224 -1.034 -2.008 357 HE2 HIS 45 HE2 HIS 45 -3.249 0.300 -1.138 358 H VAL 46 HN VAL 46 -2.075 -4.613 -4.528 359 HA VAL 46 HA VAL 46 0.236 -2.780 -4.698 360 HB VAL 46 HB VAL 46 -0.045 -5.173 -6.536 361 HG11 VAL 46 HG11 VAL 46 1.097 -3.228 -7.513 362 HG12 VAL 46 HG12 VAL 46 2.261 -4.508 -7.187 363 HG13 VAL 46 HG13 VAL 46 2.154 -3.121 -6.104 364 HG21 VAL 46 HG21 VAL 46 0.531 -6.003 -4.326 365 HG22 VAL 46 HG22 VAL 46 1.738 -4.732 -4.115 366 HG23 VAL 46 HG23 VAL 46 1.996 -6.006 -5.307 367 H CYS 47 HN CYS 47 -0.736 -1.018 -5.474 368 HA CYS 47 HA CYS 47 -2.864 -1.223 -7.500 369 HB2 CYS 47 HB2 CYS 47 -3.324 0.396 -5.809 370 HB3 CYS 47 HB1 CYS 47 -1.699 1.069 -5.900 371 H ALA 48 HN ALA 48 -1.770 -1.926 -9.320 372 HA ALA 48 HA ALA 48 -0.571 0.099 -10.927 373 HB1 ALA 48 HB1 ALA 48 1.652 -0.978 -11.198 374 HB2 ALA 48 HB2 ALA 48 1.255 -2.080 -9.878 375 HB3 ALA 48 HB3 ALA 48 1.399 -0.348 -9.571 376 H ALA 49 HN ALA 49 -1.663 -0.392 -12.716 377 HA ALA 49 HA ALA 49 -2.499 -3.015 -13.431 378 HB1 ALA 49 HB1 ALA 49 -3.756 -1.097 -14.199 379 HB2 ALA 49 HB2 ALA 49 -3.119 -1.949 -15.605 380 HB3 ALA 49 HB3 ALA 49 -2.347 -0.465 -15.050 381 H GLY 50 HN GLY 50 -1.634 -4.503 -14.794 382 HA2 GLY 50 HA3 GLY 50 0.626 -3.886 -16.522 383 HA3 GLY 50 HA2 GLY 50 1.045 -4.870 -15.130 384 H TRP 51 HN TRP 51 1.397 -5.786 -17.707 385 HA TRP 51 HA TRP 51 -0.806 -7.445 -18.560 386 HB2 TRP 51 HB2 TRP 51 2.115 -7.375 -19.367 387 HB3 TRP 51 HB1 TRP 51 0.909 -8.421 -20.117 388 HD1 TRP 51 HD1 TRP 51 2.163 -4.888 -20.060 389 HE1 TRP 51 HE1 TRP 51 0.838 -3.471 -21.751 390 HE3 TRP 51 HE3 TRP 51 -1.541 -8.185 -21.281 391 HZ2 TRP 51 HZ2 TRP 51 -1.455 -3.709 -23.439 392 HZ3 TRP 51 HZ3 TRP 51 -3.276 -7.567 -22.940 393 HH2 TRP 51 HH2 TRP 51 -3.239 -5.335 -24.020 394 H MET 52 HN MET 52 -0.663 -9.780 -18.699 395 HA MET 52 HA MET 52 1.184 -11.180 -16.944 396 HB2 MET 52 HB2 MET 52 -1.781 -11.148 -16.289 397 HB3 MET 52 HB1 MET 52 -0.594 -12.218 -15.589 398 HG2 MET 52 HG2 MET 52 0.666 -10.188 -14.778 399 HG3 MET 52 HG1 MET 52 -0.684 -9.203 -15.322 400 HE1 MET 52 HE1 MET 52 -2.906 -9.168 -14.564 401 HE2 MET 52 HE2 MET 52 -3.546 -9.826 -13.063 402 HE3 MET 52 HE3 MET 52 -3.395 -10.866 -14.477 403 H ALA 53 HN ALA 53 0.278 -13.584 -16.774 404 HA ALA 53 HA ALA 53 0.558 -14.770 -19.242 405 HB1 ALA 53 HB1 ALA 53 -0.240 -16.804 -18.243 406 HB2 ALA 53 HB2 ALA 53 -1.132 -15.914 -17.008 407 HB3 ALA 53 HB3 ALA 53 0.633 -15.911 -16.998 408 H LYS 54 HN LYS 54 -0.783 -15.557 -20.818 409 HA LYS 54 HA LYS 54 -2.560 -15.536 -22.263 410 HB2 LYS 54 HB2 LYS 54 -3.521 -16.815 -20.228 411 HB3 LYS 54 HB1 LYS 54 -4.381 -15.327 -19.847 412 HG2 LYS 54 HG2 LYS 54 -5.479 -15.369 -22.052 413 HG3 LYS 54 HG1 LYS 54 -4.562 -16.804 -22.500 414 HD2 LYS 54 HD2 LYS 54 -5.608 -18.038 -20.617 415 HD3 LYS 54 HD1 LYS 54 -6.568 -16.608 -20.238 416 HE2 LYS 54 HE2 LYS 54 -6.617 -18.087 -22.887 417 HE3 LYS 54 HE1 LYS 54 -7.842 -18.223 -21.625 418 HZ1 LYS 54 HZ1 LYS 54 -8.698 -16.631 -23.049 419 HZ2 LYS 54 HZ2 LYS 54 -7.189 -15.901 -23.326 420 HZ3 LYS 54 HZ3 LYS 54 -7.979 -15.690 -21.837 421 H GLY 55 HN GLY 55 -1.396 -13.043 -21.834 422 HA2 GLY 55 HA3 GLY 55 -1.756 -10.777 -22.084 423 HA3 GLY 55 HA2 GLY 55 -3.185 -11.277 -22.982 424 H ARG 56 HN ARG 56 -3.224 -12.399 -19.782 425 HA ARG 56 HA ARG 56 -5.542 -10.906 -19.110 426 HB2 ARG 56 HB2 ARG 56 -4.706 -13.196 -18.215 427 HB3 ARG 56 HB1 ARG 56 -3.723 -12.264 -17.105 428 HG2 ARG 56 HG2 ARG 56 -5.646 -12.549 -15.798 429 HG3 ARG 56 HG1 ARG 56 -6.030 -11.017 -16.580 430 HD2 ARG 56 HD2 ARG 56 -7.496 -12.084 -18.150 431 HD3 ARG 56 HD1 ARG 56 -6.890 -13.685 -17.743 432 HE ARG 56 HE ARG 56 -7.900 -12.764 -15.377 433 HH11 ARG 56 HH21 ARG 56 -9.125 -12.988 -18.616 434 HH12 ARG 56 HH22 ARG 56 -10.722 -13.453 -18.129 435 HH21 ARG 56 HH11 ARG 56 -10.010 -13.293 -14.719 436 HH22 ARG 56 HH12 ARG 56 -11.238 -13.593 -15.903 437 H VAL 57 HN VAL 57 -5.831 -9.105 -17.873 438 HA VAL 57 HA VAL 57 -3.449 -7.747 -16.724 439 HB VAL 57 HB VAL 57 -3.884 -5.696 -17.810 440 HG11 VAL 57 HG11 VAL 57 -4.667 -7.673 -19.964 441 HG12 VAL 57 HG12 VAL 57 -3.036 -7.591 -19.312 442 HG13 VAL 57 HG13 VAL 57 -3.724 -6.194 -20.134 443 HG21 VAL 57 HG21 VAL 57 -5.997 -5.418 -19.261 444 HG22 VAL 57 HG22 VAL 57 -6.244 -5.402 -17.520 445 HG23 VAL 57 HG23 VAL 57 -6.620 -6.852 -18.449 446 H GLY 58 HN GLY 58 -4.003 -6.039 -15.191 447 HA2 GLY 58 HA3 GLY 58 -6.476 -5.392 -14.197 448 HA3 GLY 58 HA2 GLY 58 -6.091 -6.915 -13.406 449 H TYR 59 HN TYR 59 -6.436 -5.010 -11.702 450 HA TYR 59 HA TYR 59 -3.726 -4.425 -10.700 451 HB2 TYR 59 HB2 TYR 59 -4.536 -2.069 -10.060 452 HB3 TYR 59 HB1 TYR 59 -4.081 -2.346 -11.736 453 HD1 TYR 59 HD2 TYR 59 -5.842 -2.703 -13.480 454 HD2 TYR 59 HD1 TYR 59 -6.808 -1.472 -9.477 455 HE1 TYR 59 HE2 TYR 59 -8.057 -1.908 -14.254 456 HE2 TYR 59 HE1 TYR 59 -9.022 -0.682 -10.254 457 HH TYR 59 HH TYR 59 -9.902 0.160 -12.739 458 HA PRO 60 HA PRO 60 -6.555 -6.259 -7.509 459 HB2 PRO 60 HB2 PRO 60 -3.818 -6.971 -6.470 460 HB3 PRO 60 HB1 PRO 60 -5.278 -7.979 -6.556 461 HG2 PRO 60 HG2 PRO 60 -3.300 -8.333 -8.297 462 HG3 PRO 60 HG1 PRO 60 -4.989 -8.418 -8.832 463 HD2 PRO 60 HD2 PRO 60 -3.012 -6.174 -9.204 464 HD3 PRO 60 HD1 PRO 60 -4.255 -6.773 -10.328 465 H ILE 61 HN ILE 61 -7.222 -5.230 -5.715 466 HA ILE 61 HA ILE 61 -5.397 -3.592 -4.116 467 HB ILE 61 HB ILE 61 -6.998 -1.613 -4.292 468 HG12 ILE 61 HG12 ILE 61 -7.920 -3.137 -6.753 469 HG13 ILE 61 HG11 ILE 61 -8.878 -2.888 -5.296 470 HG21 ILE 61 HG21 ILE 61 -5.643 -2.319 -6.913 471 HG22 ILE 61 HG22 ILE 61 -4.756 -1.785 -5.488 472 HG23 ILE 61 HG23 ILE 61 -5.929 -0.713 -6.247 473 HD11 ILE 61 HD11 ILE 61 -8.604 -0.399 -5.641 474 HD12 ILE 61 HD12 ILE 61 -9.548 -1.214 -6.890 475 HD13 ILE 61 HD13 ILE 61 -7.872 -0.765 -7.204 476 H VAL 62 HN VAL 62 -5.928 -3.597 -2.036 477 HA VAL 62 HA VAL 62 -7.986 -5.287 -1.063 478 HB VAL 62 HB VAL 62 -6.452 -3.144 0.416 479 HG11 VAL 62 HG11 VAL 62 -8.366 -3.818 1.713 480 HG12 VAL 62 HG12 VAL 62 -6.969 -4.647 2.390 481 HG13 VAL 62 HG13 VAL 62 -8.091 -5.520 1.346 482 HG21 VAL 62 HG21 VAL 62 -5.044 -4.894 -0.742 483 HG22 VAL 62 HG22 VAL 62 -5.906 -6.128 0.175 484 HG23 VAL 62 HG23 VAL 62 -4.909 -4.943 1.016 485 H LYS 63 HN LYS 63 -7.690 -1.764 -1.261 486 HA LYS 63 HA LYS 63 -10.493 -1.399 -1.556 487 HB2 LYS 63 HB2 LYS 63 -9.400 -1.394 1.163 488 HB3 LYS 63 HB1 LYS 63 -10.124 0.161 0.782 489 HG2 LYS 63 HG2 LYS 63 -12.264 -0.774 0.415 490 HG3 LYS 63 HG1 LYS 63 -11.636 -2.409 0.273 491 HD2 LYS 63 HD2 LYS 63 -12.799 -1.868 2.482 492 HD3 LYS 63 HD1 LYS 63 -11.178 -2.544 2.626 493 HE2 LYS 63 HE2 LYS 63 -10.233 -0.455 3.235 494 HE3 LYS 63 HE1 LYS 63 -11.589 0.452 2.579 495 HZ1 LYS 63 HZ1 LYS 63 -11.810 -1.377 4.899 496 HZ2 LYS 63 HZ2 LYS 63 -12.986 -0.291 4.327 497 HZ3 LYS 63 HZ3 LYS 63 -11.559 0.296 5.037 498 HA PRO 64 HA PRO 64 -8.423 2.908 -1.467 499 HB2 PRO 64 HB2 PRO 64 -5.806 3.156 -0.735 500 HB3 PRO 64 HB1 PRO 64 -7.116 3.102 0.467 501 HG2 PRO 64 HG2 PRO 64 -5.386 0.841 -0.505 502 HG3 PRO 64 HG1 PRO 64 -5.712 1.345 1.169 503 HD2 PRO 64 HD2 PRO 64 -7.113 -0.673 0.089 504 HD3 PRO 64 HD1 PRO 64 -7.919 0.520 1.123 505 H GLY 65 HN GLY 65 -7.279 4.013 -3.131 506 HA2 GLY 65 HA3 GLY 65 -5.299 2.758 -4.748 507 HA3 GLY 65 HA2 GLY 65 -6.891 2.616 -5.488 508 HA PRO 66 HA PRO 66 -6.087 7.417 -5.120 509 HB2 PRO 66 HB2 PRO 66 -3.116 7.362 -4.627 510 HB3 PRO 66 HB1 PRO 66 -4.345 8.463 -3.965 511 HG2 PRO 66 HG2 PRO 66 -3.318 6.560 -2.437 512 HG3 PRO 66 HG1 PRO 66 -5.059 6.905 -2.373 513 HD2 PRO 66 HD2 PRO 66 -3.647 4.647 -3.802 514 HD3 PRO 66 HD1 PRO 66 -5.130 4.604 -2.827 515 H ASN 67 HN ASN 67 -3.331 5.495 -6.276 516 HA ASN 67 HA ASN 67 -2.937 7.090 -8.654 517 HB2 ASN 67 HB2 ASN 67 -1.084 5.914 -7.489 518 HB3 ASN 67 HB1 ASN 67 -1.818 4.372 -7.926 519 HD21 ASN 67 HD21 ASN 67 0.467 4.242 -9.046 520 HD22 ASN 67 HD22 ASN 67 0.541 4.813 -10.642 521 H CYS 68 HN CYS 68 -4.783 4.292 -7.761 522 HA CYS 68 HA CYS 68 -5.316 3.582 -10.583 523 HB2 CYS 68 HB2 CYS 68 -6.820 1.831 -8.964 524 HB3 CYS 68 HB1 CYS 68 -5.262 1.478 -9.695 525 H GLY 69 HN GLY 69 -7.612 3.087 -11.124 526 HA2 GLY 69 HA3 GLY 69 -9.181 5.406 -10.901 527 HA3 GLY 69 HA2 GLY 69 -9.747 3.854 -11.509 528 H PHE 70 HN PHE 70 -11.131 5.803 -9.818 529 HA PHE 70 HA PHE 70 -11.296 4.727 -7.150 530 HB2 PHE 70 HB2 PHE 70 -13.140 6.308 -6.855 531 HB3 PHE 70 HB1 PHE 70 -11.762 7.101 -7.610 532 HD1 PHE 70 HD2 PHE 70 -11.760 7.547 -10.075 533 HD2 PHE 70 HD1 PHE 70 -15.249 6.077 -8.036 534 HE1 PHE 70 HE2 PHE 70 -13.172 8.218 -12.000 535 HE2 PHE 70 HE1 PHE 70 -16.655 6.745 -9.965 536 HZ PHE 70 HZ PHE 70 -15.618 7.817 -11.945 537 H GLY 71 HN GLY 71 -11.760 2.889 -9.395 538 HA2 GLY 71 HA3 GLY 71 -14.396 2.206 -9.880 539 HA3 GLY 71 HA2 GLY 71 -13.083 1.039 -9.782 540 H LYS 72 HN LYS 72 -13.054 -0.368 -8.117 541 HA LYS 72 HA LYS 72 -14.647 0.171 -5.682 542 HB2 LYS 72 HB2 LYS 72 -14.947 -2.270 -7.454 543 HB3 LYS 72 HB1 LYS 72 -15.594 -2.148 -5.828 544 HG2 LYS 72 HG2 LYS 72 -16.936 -0.179 -6.511 545 HG3 LYS 72 HG1 LYS 72 -16.293 -0.327 -8.144 546 HD2 LYS 72 HD2 LYS 72 -18.341 -1.469 -8.347 547 HD3 LYS 72 HD1 LYS 72 -17.226 -2.793 -8.031 548 HE2 LYS 72 HE2 LYS 72 -19.265 -2.986 -6.651 549 HE3 LYS 72 HE1 LYS 72 -17.851 -2.741 -5.631 550 HZ1 LYS 72 HZ1 LYS 72 -18.403 -0.492 -5.314 551 HZ2 LYS 72 HZ2 LYS 72 -19.858 -1.342 -5.110 552 HZ3 LYS 72 HZ3 LYS 72 -19.555 -0.505 -6.556 553 H THR 73 HN THR 73 -14.386 -2.298 -4.515 554 HA THR 73 HA THR 73 -11.502 -2.356 -3.901 555 HB THR 73 HB THR 73 -12.089 -3.416 -1.864 556 HG1 THR 73 HG1 THR 73 -13.479 -4.962 -2.271 557 HG21 THR 73 HG21 THR 73 -13.818 -1.962 -0.910 558 HG22 THR 73 HG22 THR 73 -14.350 -1.504 -2.522 559 HG23 THR 73 HG23 THR 73 -12.748 -1.030 -1.955 560 H GLY 74 HN GLY 74 -10.450 -4.423 -3.587 561 HA2 GLY 74 HA3 GLY 74 -9.748 -6.484 -4.343 562 HA3 GLY 74 HA2 GLY 74 -11.455 -6.892 -4.494 563 H ILE 75 HN ILE 75 -9.734 -7.944 -6.289 564 HA ILE 75 HA ILE 75 -9.120 -6.546 -8.613 565 HB ILE 75 HB ILE 75 -10.129 -9.407 -8.521 566 HG12 ILE 75 HG12 ILE 75 -7.280 -8.411 -8.193 567 HG13 ILE 75 HG11 ILE 75 -8.292 -8.899 -6.843 568 HG21 ILE 75 HG21 ILE 75 -8.276 -7.903 -10.402 569 HG22 ILE 75 HG22 ILE 75 -9.888 -8.500 -10.787 570 HG23 ILE 75 HG23 ILE 75 -8.581 -9.638 -10.479 571 HD11 ILE 75 HD11 ILE 75 -8.569 -11.141 -7.936 572 HD12 ILE 75 HD12 ILE 75 -6.905 -10.780 -7.472 573 HD13 ILE 75 HD13 ILE 75 -7.404 -10.633 -9.158 574 H ILE 76 HN ILE 76 -10.204 -6.109 -10.535 575 HA ILE 76 HA ILE 76 -13.043 -6.778 -10.825 576 HB ILE 76 HB ILE 76 -13.625 -4.359 -11.266 577 HG12 ILE 76 HG12 ILE 76 -10.892 -3.932 -9.999 578 HG13 ILE 76 HG11 ILE 76 -11.370 -3.482 -11.632 579 HG21 ILE 76 HG21 ILE 76 -14.098 -5.582 -9.095 580 HG22 ILE 76 HG22 ILE 76 -13.987 -3.835 -8.955 581 HG23 ILE 76 HG23 ILE 76 -12.641 -4.840 -8.455 582 HD11 ILE 76 HD11 ILE 76 -12.248 -2.262 -9.021 583 HD12 ILE 76 HD12 ILE 76 -13.199 -2.038 -10.492 584 HD13 ILE 76 HD13 ILE 76 -11.531 -1.467 -10.421 585 H ASP 77 HN ASP 77 -10.192 -5.162 -12.143 586 HA ASP 77 HA ASP 77 -11.241 -5.284 -14.866 587 HB2 ASP 77 HB2 ASP 77 -9.952 -3.348 -14.147 588 HB3 ASP 77 HB1 ASP 77 -8.566 -4.370 -13.805 589 H TYR 78 HN TYR 78 -11.042 -7.003 -16.082 590 HA TYR 78 HA TYR 78 -8.639 -8.677 -15.963 591 HB2 TYR 78 HB2 TYR 78 -10.004 -10.725 -15.905 592 HB3 TYR 78 HB1 TYR 78 -10.105 -9.797 -14.422 593 HD1 TYR 78 HD1 TYR 78 -11.889 -10.716 -17.546 594 HD2 TYR 78 HD2 TYR 78 -12.191 -8.771 -13.725 595 HE1 TYR 78 HE1 TYR 78 -14.357 -10.634 -17.781 596 HE2 TYR 78 HE2 TYR 78 -14.657 -8.686 -13.964 597 HH TYR 78 HH TYR 78 -16.382 -10.489 -15.810 598 H GLY 79 HN GLY 79 -9.286 -10.648 -17.659 599 HA2 GLY 79 HA3 GLY 79 -9.742 -11.197 -19.861 600 HA3 GLY 79 HA2 GLY 79 -10.656 -9.702 -20.015 601 H ILE 80 HN ILE 80 -9.347 -10.132 -22.161 602 HA ILE 80 HA ILE 80 -6.678 -8.840 -22.029 603 HB ILE 80 HB ILE 80 -8.002 -10.341 -24.307 604 HG12 ILE 80 HG12 ILE 80 -5.706 -11.200 -22.511 605 HG13 ILE 80 HG11 ILE 80 -7.373 -11.714 -22.262 606 HG21 ILE 80 HG21 ILE 80 -6.414 -8.727 -25.169 607 HG22 ILE 80 HG22 ILE 80 -5.626 -10.298 -25.209 608 HG23 ILE 80 HG23 ILE 80 -5.233 -9.151 -23.929 609 HD11 ILE 80 HD11 ILE 80 -7.418 -12.733 -24.494 610 HD12 ILE 80 HD12 ILE 80 -6.084 -13.394 -23.547 611 HD13 ILE 80 HD13 ILE 80 -5.769 -12.184 -24.791 612 H ARG 81 HN ARG 81 -6.677 -6.728 -22.349 613 HA ARG 81 HA ARG 81 -8.873 -5.317 -23.563 614 HB2 ARG 81 HB2 ARG 81 -6.111 -4.415 -22.680 615 HB3 ARG 81 HB1 ARG 81 -7.376 -3.327 -23.257 616 HG2 ARG 81 HG2 ARG 81 -8.857 -3.997 -21.456 617 HG3 ARG 81 HG1 ARG 81 -7.720 -5.229 -20.915 618 HD2 ARG 81 HD2 ARG 81 -7.506 -3.301 -19.460 619 HD3 ARG 81 HD1 ARG 81 -6.060 -3.388 -20.464 620 HE ARG 81 HE ARG 81 -6.667 -1.352 -21.388 621 HH11 ARG 81 HH21 ARG 81 -9.430 -2.902 -19.955 622 HH12 ARG 81 HH22 ARG 81 -10.472 -1.527 -20.129 623 HH21 ARG 81 HH11 ARG 81 -8.037 0.471 -21.622 624 HH22 ARG 81 HH12 ARG 81 -9.684 0.386 -21.088 625 H LEU 82 HN LEU 82 -8.801 -4.075 -25.484 626 HA LEU 82 HA LEU 82 -7.318 -5.358 -27.639 627 HB2 LEU 82 HB2 LEU 82 -9.681 -4.831 -27.946 628 HB3 LEU 82 HB1 LEU 82 -9.375 -3.130 -27.626 629 HG LEU 82 HG LEU 82 -8.065 -2.923 -29.674 630 HD11 LEU 82 HD11 LEU 82 -8.071 -4.979 -31.262 631 HD12 LEU 82 HD12 LEU 82 -8.423 -5.930 -29.820 632 HD13 LEU 82 HD13 LEU 82 -6.926 -4.999 -29.925 633 HD21 LEU 82 HD21 LEU 82 -10.481 -2.665 -29.878 634 HD22 LEU 82 HD22 LEU 82 -10.674 -4.405 -30.093 635 HD23 LEU 82 HD23 LEU 82 -9.848 -3.454 -31.326 636 H ASN 83 HN ASN 83 -6.740 -2.848 -25.524 637 HA ASN 83 HA ASN 83 -5.400 -1.006 -27.277 638 HB2 ASN 83 HB2 ASN 83 -4.812 0.186 -25.285 639 HB3 ASN 83 HB1 ASN 83 -6.460 -0.381 -25.090 640 HD21 ASN 83 HD21 ASN 83 -5.043 0.246 -22.785 641 HD22 ASN 83 HD22 ASN 83 -4.632 -1.174 -21.950 642 H ARG 84 HN ARG 84 -4.567 -3.884 -27.258 643 HA ARG 84 HA ARG 84 -2.112 -4.366 -26.044 644 HB2 ARG 84 HB2 ARG 84 -3.012 -5.226 -28.811 645 HB3 ARG 84 HB1 ARG 84 -1.696 -5.957 -27.889 646 HG2 ARG 84 HG2 ARG 84 -3.211 -6.678 -26.155 647 HG3 ARG 84 HG1 ARG 84 -4.539 -5.770 -26.865 648 HD2 ARG 84 HD2 ARG 84 -4.860 -8.069 -27.468 649 HD3 ARG 84 HD1 ARG 84 -4.337 -7.219 -28.914 650 HE ARG 84 HE ARG 84 -2.096 -8.328 -27.572 651 HH11 ARG 84 HH21 ARG 84 -4.866 -9.069 -29.531 652 HH12 ARG 84 HH22 ARG 84 -4.230 -10.567 -30.127 653 HH21 ARG 84 HH11 ARG 84 -1.252 -10.336 -28.350 654 HH22 ARG 84 HH12 ARG 84 -2.190 -11.278 -29.459 655 H SER 85 HN SER 85 -2.788 -1.860 -28.138 656 HA SER 85 HA SER 85 -0.071 -1.700 -29.296 657 HB2 SER 85 HB2 SER 85 -0.982 0.091 -30.673 658 HB3 SER 85 HB1 SER 85 -2.004 -1.340 -30.793 659 HG SER 85 HG SER 85 -3.571 -0.207 -29.992 660 H GLU 86 HN GLU 86 -1.426 -0.917 -26.460 661 HA GLU 86 HA GLU 86 -0.260 1.787 -26.215 662 HB2 GLU 86 HB2 GLU 86 -2.618 1.000 -25.350 663 HB3 GLU 86 HB1 GLU 86 -1.719 0.339 -23.996 664 HG2 GLU 86 HG2 GLU 86 -2.333 2.537 -23.296 665 HG3 GLU 86 HG1 GLU 86 -0.647 2.688 -23.781 666 H ARG 87 HN ARG 87 -0.073 1.095 -23.233 667 HA ARG 87 HA ARG 87 2.162 -0.731 -23.056 668 HB2 ARG 87 HB2 ARG 87 3.741 0.976 -22.179 669 HB3 ARG 87 HB1 ARG 87 3.371 1.188 -23.887 670 HG2 ARG 87 HG2 ARG 87 1.706 2.939 -23.292 671 HG3 ARG 87 HG1 ARG 87 2.131 2.743 -21.589 672 HD2 ARG 87 HD2 ARG 87 4.455 3.385 -22.075 673 HD3 ARG 87 HD1 ARG 87 4.062 3.525 -23.785 674 HE ARG 87 HE ARG 87 3.120 5.598 -23.347 675 HH11 ARG 87 HH21 ARG 87 3.375 3.778 -20.398 676 HH12 ARG 87 HH22 ARG 87 2.990 5.118 -19.374 677 HH21 ARG 87 HH11 ARG 87 2.586 7.361 -22.006 678 HH22 ARG 87 HH12 ARG 87 2.514 7.151 -20.286 679 H TRP 88 HN TRP 88 2.645 -1.341 -20.986 680 HA TRP 88 HA TRP 88 1.355 -0.053 -18.698 681 HB2 TRP 88 HB2 TRP 88 0.650 -2.883 -19.506 682 HB3 TRP 88 HB1 TRP 88 0.191 -2.105 -18.002 683 HD1 TRP 88 HD1 TRP 88 -0.677 -2.262 -21.675 684 HE1 TRP 88 HE1 TRP 88 -2.827 -0.899 -22.093 685 HE3 TRP 88 HE3 TRP 88 -1.184 -0.005 -17.128 686 HZ2 TRP 88 HZ2 TRP 88 -4.535 0.911 -20.680 687 HZ3 TRP 88 HZ3 TRP 88 -3.076 1.535 -16.688 688 HH2 TRP 88 HH2 TRP 88 -4.754 1.994 -18.457 689 H ASP 89 HN ASP 89 1.796 -1.518 -16.683 690 HA ASP 89 HA ASP 89 4.641 -1.881 -16.502 691 HB2 ASP 89 HB2 ASP 89 2.486 -2.684 -14.534 692 HB3 ASP 89 HB1 ASP 89 4.204 -2.513 -14.192 693 H ALA 90 HN ALA 90 4.922 -4.069 -14.883 694 HA ALA 90 HA ALA 90 3.794 -6.442 -16.108 695 HB1 ALA 90 HB1 ALA 90 5.553 -5.722 -17.757 696 HB2 ALA 90 HB2 ALA 90 5.811 -7.327 -17.074 697 HB3 ALA 90 HB3 ALA 90 6.758 -5.960 -16.489 698 H TYR 91 HN TYR 91 4.374 -8.374 -15.033 699 HA TYR 91 HA TYR 91 6.080 -8.192 -12.649 700 HB2 TYR 91 HB2 TYR 91 3.265 -9.257 -12.301 701 HB3 TYR 91 HB1 TYR 91 4.420 -8.771 -11.069 702 HD1 TYR 91 HD2 TYR 91 5.178 -6.238 -11.141 703 HD2 TYR 91 HD1 TYR 91 1.559 -7.716 -12.924 704 HE1 TYR 91 HE2 TYR 91 4.216 -3.963 -11.069 705 HE2 TYR 91 HE1 TYR 91 0.599 -5.433 -12.849 706 HH TYR 91 HH TYR 91 2.512 -2.672 -11.665 707 H CYS 92 HN CYS 92 6.590 -10.253 -11.759 708 HA CYS 92 HA CYS 92 6.070 -12.584 -13.550 709 HB2 CYS 92 HB2 CYS 92 8.640 -11.968 -12.063 710 HB3 CYS 92 HB1 CYS 92 8.324 -13.407 -13.021 711 H TYR 93 HN TYR 93 7.260 -14.512 -12.071 712 HA TYR 93 HA TYR 93 6.116 -14.456 -9.353 713 HB2 TYR 93 HB2 TYR 93 4.350 -15.285 -10.968 714 HB3 TYR 93 HB1 TYR 93 5.415 -16.637 -11.330 715 HD1 TYR 93 HD2 TYR 93 6.019 -18.286 -9.552 716 HD2 TYR 93 HD1 TYR 93 3.115 -15.189 -8.883 717 HE1 TYR 93 HE2 TYR 93 5.169 -19.505 -7.564 718 HE2 TYR 93 HE1 TYR 93 2.268 -16.409 -6.900 719 HH TYR 93 HH TYR 93 2.244 -18.557 -5.937 720 H ASN 94 HN ASN 94 7.514 -15.316 -7.997 721 HA ASN 94 HA ASN 94 9.670 -17.042 -9.057 722 HB2 ASN 94 HB2 ASN 94 9.458 -15.111 -6.779 723 HB3 ASN 94 HB1 ASN 94 10.607 -16.435 -6.626 724 HD21 ASN 94 HD21 ASN 94 9.750 -14.766 -9.686 725 HD22 ASN 94 HD22 ASN 94 11.300 -14.129 -9.948 726 HA PRO 95 HA PRO 95 8.405 -20.841 -7.171 727 HB2 PRO 95 HB2 PRO 95 10.940 -20.620 -5.533 728 HB3 PRO 95 HB1 PRO 95 10.295 -22.027 -6.408 729 HG2 PRO 95 HG2 PRO 95 12.293 -20.554 -7.417 730 HG3 PRO 95 HG1 PRO 95 11.042 -21.255 -8.462 731 HD2 PRO 95 HD2 PRO 95 11.453 -18.395 -7.707 732 HD3 PRO 95 HD1 PRO 95 10.623 -19.090 -9.119 733 H HIS 96 HN HIS 96 9.947 -18.611 -4.855 734 HA HIS 96 HA HIS 96 7.591 -18.729 -3.102 735 HB2 HIS 96 HB2 HIS 96 9.114 -19.226 -1.117 736 HB3 HIS 96 HB1 HIS 96 8.825 -20.579 -2.212 737 HD1 HIS 96 HD1 HIS 96 11.212 -21.401 -1.129 738 HD2 HIS 96 HD2 HIS 96 11.374 -18.160 -3.750 739 HE1 HIS 96 HE1 HIS 96 13.634 -21.165 -1.829 740 HE2 HIS 96 HE2 HIS 96 13.751 -19.191 -3.421 741 H ALA 97 HN ALA 97 10.503 -17.817 -1.605 742 HA ALA 97 HA ALA 97 10.388 -15.022 -2.461 743 HB1 ALA 97 HB1 ALA 97 10.068 -14.205 -0.150 744 HB2 ALA 97 HB2 ALA 97 9.791 -15.862 0.387 745 HB3 ALA 97 HB3 ALA 97 8.662 -15.098 -0.729 746 H LYS 98 HN LYS 98 12.200 -13.844 -1.853 747 HA LYS 98 HA LYS 98 14.511 -15.517 -0.960 748 HB2 LYS 98 HB2 LYS 98 14.333 -12.957 -2.567 749 HB3 LYS 98 HB1 LYS 98 15.847 -13.570 -1.909 750 HG2 LYS 98 HG2 LYS 98 15.494 -15.701 -3.136 751 HG3 LYS 98 HG1 LYS 98 14.020 -15.035 -3.841 752 HD2 LYS 98 HD2 LYS 98 15.321 -13.228 -4.885 753 HD3 LYS 98 HD1 LYS 98 16.798 -13.855 -4.157 754 HE2 LYS 98 HE2 LYS 98 16.496 -15.978 -5.381 755 HE3 LYS 98 HE1 LYS 98 15.035 -15.336 -6.130 756 HZ1 LYS 98 HZ1 LYS 98 17.715 -14.081 -6.358 757 HZ2 LYS 98 HZ2 LYS 98 16.302 -13.628 -7.184 758 HZ3 LYS 98 HZ3 LYS 98 17.047 -15.116 -7.526 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 3.677 -15.213 -5.207 2 H2 GLY 1 H2 GLY 1 4.148 -14.979 -3.592 3 H3 GLY 1 H3 GLY 1 3.953 -16.550 -4.202 4 HA2 GLY 1 HA3 GLY 1 6.318 -15.491 -3.973 5 HA3 GLY 1 HA2 GLY 1 5.916 -16.536 -5.335 6 H VAL 2 HN VAL 2 4.213 -13.605 -5.318 7 HA VAL 2 HA VAL 2 5.657 -12.650 -7.669 8 HB VAL 2 HB VAL 2 3.847 -10.897 -7.686 9 HG11 VAL 2 HG11 VAL 2 2.095 -12.431 -8.373 10 HG12 VAL 2 HG12 VAL 2 2.841 -13.747 -7.477 11 HG13 VAL 2 HG13 VAL 2 3.649 -13.079 -8.895 12 HG21 VAL 2 HG21 VAL 2 2.709 -12.554 -5.412 13 HG22 VAL 2 HG22 VAL 2 1.980 -11.130 -6.151 14 HG23 VAL 2 HG23 VAL 2 3.454 -10.970 -5.200 15 H TYR 3 HN TYR 3 6.490 -10.544 -7.884 16 HA TYR 3 HA TYR 3 7.075 -9.063 -5.392 17 HB2 TYR 3 HB2 TYR 3 9.450 -8.785 -6.151 18 HB3 TYR 3 HB1 TYR 3 9.034 -10.417 -5.642 19 HD1 TYR 3 HD2 TYR 3 8.819 -12.244 -7.286 20 HD2 TYR 3 HD1 TYR 3 9.893 -8.270 -8.508 21 HE1 TYR 3 HE2 TYR 3 9.579 -13.121 -9.477 22 HE2 TYR 3 HE1 TYR 3 10.654 -9.147 -10.698 23 HH TYR 3 HH TYR 3 11.031 -12.525 -11.290 24 H HIS 4 HN HIS 4 8.127 -6.939 -5.892 25 HA HIS 4 HA HIS 4 6.438 -5.533 -7.744 26 HB2 HIS 4 HB2 HIS 4 8.848 -4.521 -6.209 27 HB3 HIS 4 HB1 HIS 4 7.626 -3.530 -7.000 28 HD1 HIS 4 HD1 HIS 4 5.107 -3.782 -5.994 29 HD2 HIS 4 HD2 HIS 4 8.187 -5.297 -3.620 30 HE1 HIS 4 HE1 HIS 4 4.158 -4.036 -3.657 31 HE2 HIS 4 HE2 HIS 4 6.022 -4.957 -2.201 32 H ARG 5 HN ARG 5 6.837 -4.895 -9.770 33 HA ARG 5 HA ARG 5 9.599 -5.079 -10.859 34 HB2 ARG 5 HB2 ARG 5 8.358 -7.139 -11.486 35 HB3 ARG 5 HB1 ARG 5 7.131 -6.137 -12.261 36 HG2 ARG 5 HG2 ARG 5 8.868 -5.193 -13.766 37 HG3 ARG 5 HG1 ARG 5 10.075 -6.227 -12.994 38 HD2 ARG 5 HD2 ARG 5 7.569 -7.258 -14.326 39 HD3 ARG 5 HD1 ARG 5 9.125 -7.129 -15.134 40 HE ARG 5 HE ARG 5 8.367 -9.096 -13.148 41 HH11 ARG 5 HH21 ARG 5 10.985 -7.209 -14.386 42 HH12 ARG 5 HH22 ARG 5 12.145 -8.495 -14.314 43 HH21 ARG 5 HH11 ARG 5 9.881 -10.788 -13.002 44 HH22 ARG 5 HH12 ARG 5 11.511 -10.537 -13.536 45 H GLU 6 HN GLU 6 10.157 -3.359 -12.004 46 HA GLU 6 HA GLU 6 8.320 -1.832 -13.596 47 HB2 GLU 6 HB2 GLU 6 7.790 -1.004 -11.308 48 HB3 GLU 6 HB1 GLU 6 9.474 -0.523 -11.116 49 HG2 GLU 6 HG2 GLU 6 9.290 1.059 -12.948 50 HG3 GLU 6 HG1 GLU 6 7.667 0.490 -13.332 51 H ALA 7 HN ALA 7 9.398 -0.114 -14.751 52 HA ALA 7 HA ALA 7 11.909 -0.830 -15.763 53 HB1 ALA 7 HB1 ALA 7 10.574 1.884 -15.810 54 HB2 ALA 7 HB2 ALA 7 10.330 0.593 -16.985 55 HB3 ALA 7 HB3 ALA 7 11.903 1.375 -16.852 56 H ARG 8 HN ARG 8 13.965 -0.285 -15.283 57 HA ARG 8 HA ARG 8 14.576 0.717 -12.688 58 HB2 ARG 8 HB2 ARG 8 16.314 0.102 -15.092 59 HB3 ARG 8 HB1 ARG 8 16.970 0.578 -13.527 60 HG2 ARG 8 HG2 ARG 8 15.080 -1.792 -13.779 61 HG3 ARG 8 HG1 ARG 8 16.812 -1.969 -14.049 62 HD2 ARG 8 HD2 ARG 8 17.327 -1.205 -11.840 63 HD3 ARG 8 HD1 ARG 8 15.674 -0.751 -11.516 64 HE ARG 8 HE ARG 8 15.851 -3.533 -12.066 65 HH11 ARG 8 HH21 ARG 8 16.150 -1.002 -9.748 66 HH12 ARG 8 HH22 ARG 8 16.467 -2.038 -8.395 67 HH21 ARG 8 HH11 ARG 8 16.251 -4.969 -10.253 68 HH22 ARG 8 HH12 ARG 8 16.530 -4.286 -8.686 69 H SER 9 HN SER 9 14.729 2.068 -15.924 70 HA SER 9 HA SER 9 15.439 4.727 -14.772 71 HB2 SER 9 HB2 SER 9 15.792 3.827 -17.634 72 HB3 SER 9 HB1 SER 9 16.435 5.280 -16.875 73 HG SER 9 HG SER 9 17.824 3.284 -17.106 74 H GLY 10 HN GLY 10 13.237 2.968 -16.878 75 HA2 GLY 10 HA3 GLY 10 11.835 5.316 -17.796 76 HA3 GLY 10 HA2 GLY 10 11.331 3.643 -18.008 77 H LYS 11 HN LYS 11 9.303 3.593 -17.298 78 HA LYS 11 HA LYS 11 8.713 3.702 -14.536 79 HB2 LYS 11 HB2 LYS 11 7.120 5.629 -14.571 80 HB3 LYS 11 HB1 LYS 11 8.804 6.108 -14.751 81 HG2 LYS 11 HG2 LYS 11 8.504 6.268 -17.197 82 HG3 LYS 11 HG1 LYS 11 6.818 5.786 -17.024 83 HD2 LYS 11 HD2 LYS 11 6.439 7.768 -15.548 84 HD3 LYS 11 HD1 LYS 11 8.100 8.275 -15.856 85 HE2 LYS 11 HE2 LYS 11 5.966 7.895 -17.981 86 HE3 LYS 11 HE1 LYS 11 6.502 9.448 -17.342 87 HZ1 LYS 11 HZ1 LYS 11 7.584 8.791 -19.454 88 HZ2 LYS 11 HZ2 LYS 11 8.302 7.483 -18.643 89 HZ3 LYS 11 HZ3 LYS 11 8.677 9.076 -18.190 90 H TYR 12 HN TYR 12 7.515 3.835 -17.827 91 HA TYR 12 HA TYR 12 5.684 1.658 -17.324 92 HB2 TYR 12 HB2 TYR 12 4.630 4.420 -18.002 93 HB3 TYR 12 HB1 TYR 12 3.697 2.945 -18.229 94 HD1 TYR 12 HD2 TYR 12 3.208 1.460 -16.230 95 HD2 TYR 12 HD1 TYR 12 4.803 5.428 -15.821 96 HE1 TYR 12 HE2 TYR 12 2.474 1.517 -13.860 97 HE2 TYR 12 HE1 TYR 12 4.067 5.482 -13.457 98 HH TYR 12 HH TYR 12 3.457 4.033 -11.687 99 H LYS 13 HN LYS 13 7.198 0.805 -18.894 100 HA LYS 13 HA LYS 13 6.293 1.314 -21.640 101 HB2 LYS 13 HB2 LYS 13 9.187 1.524 -20.775 102 HB3 LYS 13 HB1 LYS 13 8.671 1.353 -22.454 103 HG2 LYS 13 HG2 LYS 13 7.291 3.423 -22.210 104 HG3 LYS 13 HG1 LYS 13 7.923 3.618 -20.577 105 HD2 LYS 13 HD2 LYS 13 10.197 3.795 -21.426 106 HD3 LYS 13 HD1 LYS 13 9.624 3.509 -23.070 107 HE2 LYS 13 HE2 LYS 13 9.946 5.917 -22.705 108 HE3 LYS 13 HE1 LYS 13 8.235 5.563 -22.928 109 HZ1 LYS 13 HZ1 LYS 13 7.957 5.569 -20.528 110 HZ2 LYS 13 HZ2 LYS 13 8.595 7.052 -21.060 111 HZ3 LYS 13 HZ3 LYS 13 9.606 5.906 -20.315 112 H LEU 14 HN LEU 14 5.700 -0.842 -19.984 113 HA LEU 14 HA LEU 14 7.304 -3.070 -21.180 114 HB2 LEU 14 HB2 LEU 14 5.682 -3.275 -18.634 115 HB3 LEU 14 HB1 LEU 14 6.876 -4.405 -19.257 116 HG LEU 14 HG LEU 14 7.485 -1.585 -18.319 117 HD11 LEU 14 HD11 LEU 14 8.595 -2.785 -16.414 118 HD12 LEU 14 HD12 LEU 14 7.902 -4.291 -17.012 119 HD13 LEU 14 HD13 LEU 14 6.844 -3.000 -16.444 120 HD21 LEU 14 HD21 LEU 14 9.866 -2.463 -18.387 121 HD22 LEU 14 HD22 LEU 14 9.125 -2.285 -19.972 122 HD23 LEU 14 HD23 LEU 14 9.252 -3.883 -19.235 123 H THR 15 HN THR 15 6.293 -4.336 -22.551 124 HA THR 15 HA THR 15 3.322 -4.251 -22.695 125 HB THR 15 HB THR 15 5.310 -5.203 -24.768 126 HG1 THR 15 HG1 THR 15 5.162 -3.257 -25.596 127 HG21 THR 15 HG21 THR 15 2.289 -4.982 -24.708 128 HG22 THR 15 HG22 THR 15 3.281 -6.345 -25.230 129 HG23 THR 15 HG23 THR 15 3.178 -4.899 -26.227 130 H TYR 16 HN TYR 16 2.251 -6.274 -23.320 131 HA TYR 16 HA TYR 16 2.639 -8.328 -21.481 132 HB2 TYR 16 HB2 TYR 16 0.536 -8.096 -22.581 133 HB3 TYR 16 HB1 TYR 16 1.248 -8.263 -24.162 134 HD1 TYR 16 HD1 TYR 16 0.325 -10.059 -21.051 135 HD2 TYR 16 HD2 TYR 16 1.752 -10.456 -25.084 136 HE1 TYR 16 HE1 TYR 16 -0.073 -12.503 -20.954 137 HE2 TYR 16 HE2 TYR 16 1.354 -12.901 -24.986 138 HH TYR 16 HH TYR 16 -0.559 -14.366 -22.938 139 H ALA 17 HN ALA 17 3.650 -8.202 -24.906 140 HA ALA 17 HA ALA 17 4.815 -10.731 -25.067 141 HB1 ALA 17 HB1 ALA 17 5.885 -8.246 -26.422 142 HB2 ALA 17 HB2 ALA 17 4.446 -9.104 -26.965 143 HB3 ALA 17 HB3 ALA 17 6.011 -9.915 -26.981 144 H GLU 18 HN GLU 18 6.290 -7.651 -24.037 145 HA GLU 18 HA GLU 18 8.888 -8.708 -23.591 146 HB2 GLU 18 HB2 GLU 18 7.412 -6.220 -22.775 147 HB3 GLU 18 HB1 GLU 18 8.898 -6.598 -21.912 148 HG2 GLU 18 HG2 GLU 18 9.386 -5.123 -23.792 149 HG3 GLU 18 HG1 GLU 18 10.115 -6.700 -24.072 150 H ALA 19 HN ALA 19 6.112 -8.212 -21.413 151 HA ALA 19 HA ALA 19 7.323 -9.001 -19.027 152 HB1 ALA 19 HB1 ALA 19 5.072 -9.384 -18.198 153 HB2 ALA 19 HB2 ALA 19 4.447 -9.414 -19.849 154 HB3 ALA 19 HB3 ALA 19 5.114 -7.921 -19.186 155 H LYS 20 HN LYS 20 5.916 -10.933 -21.621 156 HA LYS 20 HA LYS 20 5.962 -13.432 -20.243 157 HB2 LYS 20 HB2 LYS 20 4.557 -12.966 -22.240 158 HB3 LYS 20 HB1 LYS 20 6.019 -12.912 -23.225 159 HG2 LYS 20 HG2 LYS 20 6.533 -15.243 -22.628 160 HG3 LYS 20 HG1 LYS 20 5.112 -15.299 -21.582 161 HD2 LYS 20 HD2 LYS 20 3.668 -14.838 -23.522 162 HD3 LYS 20 HD1 LYS 20 5.087 -14.802 -24.565 163 HE2 LYS 20 HE2 LYS 20 5.589 -17.152 -23.992 164 HE3 LYS 20 HE1 LYS 20 4.195 -17.198 -22.919 165 HZ1 LYS 20 HZ1 LYS 20 2.971 -17.776 -24.656 166 HZ2 LYS 20 HZ2 LYS 20 4.293 -17.609 -25.707 167 HZ3 LYS 20 HZ3 LYS 20 3.292 -16.276 -25.378 168 H ALA 21 HN ALA 21 8.298 -11.611 -22.100 169 HA ALA 21 HA ALA 21 10.129 -13.756 -22.579 170 HB1 ALA 21 HB1 ALA 21 10.094 -11.597 -23.860 171 HB2 ALA 21 HB2 ALA 21 11.692 -11.999 -23.233 172 HB3 ALA 21 HB3 ALA 21 10.712 -10.776 -22.426 173 H VAL 22 HN VAL 22 10.146 -11.111 -20.158 174 HA VAL 22 HA VAL 22 12.482 -11.913 -18.807 175 HB VAL 22 HB VAL 22 11.475 -10.626 -16.854 176 HG11 VAL 22 HG11 VAL 22 12.829 -9.499 -18.583 177 HG12 VAL 22 HG12 VAL 22 11.515 -8.459 -18.028 178 HG13 VAL 22 HG13 VAL 22 11.384 -9.293 -19.578 179 HG21 VAL 22 HG21 VAL 22 9.235 -10.261 -18.852 180 HG22 VAL 22 HG22 VAL 22 9.360 -9.449 -17.297 181 HG23 VAL 22 HG23 VAL 22 9.123 -11.191 -17.367 182 H CYS 23 HN CYS 23 9.281 -13.216 -18.785 183 HA CYS 23 HA CYS 23 9.885 -14.909 -16.414 184 HB2 CYS 23 HB2 CYS 23 7.231 -14.531 -17.828 185 HB3 CYS 23 HB1 CYS 23 7.516 -15.385 -16.314 186 H GLU 24 HN GLU 24 8.755 -17.127 -16.678 187 HA GLU 24 HA GLU 24 8.592 -19.180 -17.740 188 HB2 GLU 24 HB2 GLU 24 9.126 -17.734 -20.359 189 HB3 GLU 24 HB1 GLU 24 8.486 -19.334 -20.160 190 HG2 GLU 24 HG2 GLU 24 7.113 -16.831 -19.168 191 HG3 GLU 24 HG1 GLU 24 6.719 -17.666 -20.663 192 H PHE 25 HN PHE 25 11.260 -17.033 -18.332 193 HA PHE 25 HA PHE 25 13.126 -18.806 -19.475 194 HB2 PHE 25 HB2 PHE 25 13.456 -16.384 -19.352 195 HB3 PHE 25 HB1 PHE 25 13.565 -16.469 -17.597 196 HD1 PHE 25 HD1 PHE 25 15.200 -17.527 -20.775 197 HD2 PHE 25 HD2 PHE 25 15.631 -17.084 -16.522 198 HE1 PHE 25 HE1 PHE 25 17.639 -17.939 -20.977 199 HE2 PHE 25 HE2 PHE 25 18.067 -17.500 -16.725 200 HZ PHE 25 HZ PHE 25 19.071 -17.925 -18.952 201 H GLU 26 HN GLU 26 12.539 -18.008 -16.047 202 HA GLU 26 HA GLU 26 14.289 -20.232 -15.210 203 HB2 GLU 26 HB2 GLU 26 14.074 -19.335 -12.961 204 HB3 GLU 26 HB1 GLU 26 14.550 -18.057 -14.074 205 HG2 GLU 26 HG2 GLU 26 12.162 -17.343 -14.217 206 HG3 GLU 26 HG1 GLU 26 11.753 -18.563 -13.010 207 H GLY 27 HN GLY 27 11.452 -20.383 -16.417 208 HA2 GLY 27 HA3 GLY 27 9.910 -22.129 -16.262 209 HA3 GLY 27 HA2 GLY 27 10.556 -22.555 -14.683 210 H GLY 28 HN GLY 28 10.007 -19.262 -14.786 211 HA2 GLY 28 HA3 GLY 28 7.742 -19.456 -12.994 212 HA3 GLY 28 HA2 GLY 28 8.553 -17.979 -13.510 213 H HIS 29 HN HIS 29 6.095 -17.489 -13.459 214 HA HIS 29 HA HIS 29 5.197 -17.383 -16.236 215 HB2 HIS 29 HB2 HIS 29 3.496 -18.699 -14.103 216 HB3 HIS 29 HB1 HIS 29 2.994 -18.350 -15.756 217 HD1 HIS 29 HD1 HIS 29 4.106 -19.765 -17.672 218 HD2 HIS 29 HD2 HIS 29 5.213 -20.936 -13.827 219 HE1 HIS 29 HE1 HIS 29 5.252 -22.014 -17.907 220 HE2 HIS 29 HE2 HIS 29 5.934 -22.740 -15.572 221 H LEU 30 HN LEU 30 3.417 -15.909 -16.541 222 HA LEU 30 HA LEU 30 3.654 -13.530 -15.025 223 HB2 LEU 30 HB2 LEU 30 1.434 -14.396 -16.895 224 HB3 LEU 30 HB1 LEU 30 1.716 -12.748 -16.342 225 HG LEU 30 HG LEU 30 3.713 -14.385 -17.946 226 HD11 LEU 30 HD11 LEU 30 1.718 -13.898 -19.279 227 HD12 LEU 30 HD12 LEU 30 3.052 -12.880 -19.822 228 HD13 LEU 30 HD13 LEU 30 1.785 -12.202 -18.801 229 HD21 LEU 30 HD21 LEU 30 4.648 -11.988 -18.343 230 HD22 LEU 30 HD22 LEU 30 4.945 -12.711 -16.768 231 HD23 LEU 30 HD23 LEU 30 3.664 -11.512 -16.958 232 H ALA 31 HN ALA 31 2.514 -12.731 -13.349 233 HA ALA 31 HA ALA 31 1.087 -14.440 -11.632 234 HB1 ALA 31 HB1 ALA 31 0.690 -12.501 -10.300 235 HB2 ALA 31 HB2 ALA 31 0.875 -11.422 -11.680 236 HB3 ALA 31 HB3 ALA 31 2.274 -12.282 -11.037 237 H THR 32 HN THR 32 -0.518 -15.438 -12.932 238 HA THR 32 HA THR 32 -2.577 -13.961 -14.263 239 HB THR 32 HB THR 32 -2.615 -16.845 -13.335 240 HG1 THR 32 HG1 THR 32 -1.230 -17.145 -14.850 241 HG21 THR 32 HG21 THR 32 -4.834 -16.364 -14.000 242 HG22 THR 32 HG22 THR 32 -4.104 -16.966 -15.483 243 HG23 THR 32 HG23 THR 32 -4.318 -15.233 -15.256 244 H TYR 33 HN TYR 33 -4.927 -14.361 -13.678 245 HA TYR 33 HA TYR 33 -5.583 -13.098 -11.284 246 HB2 TYR 33 HB2 TYR 33 -7.129 -13.154 -13.130 247 HB3 TYR 33 HB1 TYR 33 -7.206 -14.910 -13.083 248 HD1 TYR 33 HD2 TYR 33 -8.276 -16.065 -11.129 249 HD2 TYR 33 HD1 TYR 33 -8.506 -11.804 -11.655 250 HE1 TYR 33 HE2 TYR 33 -10.181 -15.971 -9.545 251 HE2 TYR 33 HE1 TYR 33 -10.416 -11.719 -10.073 252 HH TYR 33 HH TYR 33 -12.196 -14.321 -9.193 253 H LYS 34 HN LYS 34 -5.855 -16.582 -12.058 254 HA LYS 34 HA LYS 34 -6.693 -17.462 -9.530 255 HB2 LYS 34 HB2 LYS 34 -6.718 -18.829 -11.618 256 HB3 LYS 34 HB1 LYS 34 -4.962 -18.950 -11.530 257 HG2 LYS 34 HG2 LYS 34 -5.127 -20.097 -9.361 258 HG3 LYS 34 HG1 LYS 34 -6.885 -19.932 -9.392 259 HD2 LYS 34 HD2 LYS 34 -6.968 -21.280 -11.466 260 HD3 LYS 34 HD1 LYS 34 -5.214 -21.455 -11.420 261 HE2 LYS 34 HE2 LYS 34 -6.216 -23.453 -10.465 262 HE3 LYS 34 HE1 LYS 34 -5.437 -22.543 -9.170 263 HZ1 LYS 34 HZ1 LYS 34 -7.578 -21.595 -8.591 264 HZ2 LYS 34 HZ2 LYS 34 -7.643 -23.292 -8.533 265 HZ3 LYS 34 HZ3 LYS 34 -8.328 -22.455 -9.845 266 H GLN 35 HN GLN 35 -3.386 -17.268 -10.870 267 HA GLN 35 HA GLN 35 -2.085 -18.169 -8.512 268 HB2 GLN 35 HB2 GLN 35 -1.028 -16.484 -10.800 269 HB3 GLN 35 HB1 GLN 35 -0.030 -17.206 -9.536 270 HG2 GLN 35 HG2 GLN 35 -0.833 -19.449 -10.186 271 HG3 GLN 35 HG1 GLN 35 -1.813 -18.726 -11.461 272 HE21 GLN 35 HE21 GLN 35 -0.798 -18.891 -13.459 273 HE22 GLN 35 HE22 GLN 35 0.878 -18.817 -13.713 274 H LEU 36 HN LEU 36 -3.042 -14.986 -9.685 275 HA LEU 36 HA LEU 36 -1.607 -13.426 -7.820 276 HB2 LEU 36 HB2 LEU 36 -4.044 -12.996 -9.507 277 HB3 LEU 36 HB1 LEU 36 -3.692 -11.800 -8.292 278 HG LEU 36 HG LEU 36 -1.672 -12.649 -10.388 279 HD11 LEU 36 HD11 LEU 36 -2.310 -10.476 -11.493 280 HD12 LEU 36 HD12 LEU 36 -3.667 -10.360 -10.381 281 HD13 LEU 36 HD13 LEU 36 -3.589 -11.687 -11.540 282 HD21 LEU 36 HD21 LEU 36 -1.845 -10.315 -8.439 283 HD22 LEU 36 HD22 LEU 36 -0.723 -10.344 -9.797 284 HD23 LEU 36 HD23 LEU 36 -0.579 -11.536 -8.519 285 H GLU 37 HN GLU 37 -4.873 -14.827 -7.680 286 HA GLU 37 HA GLU 37 -5.824 -13.683 -5.358 287 HB2 GLU 37 HB2 GLU 37 -7.104 -15.209 -6.819 288 HB3 GLU 37 HB1 GLU 37 -6.165 -16.566 -6.199 289 HG2 GLU 37 HG2 GLU 37 -6.995 -16.154 -3.938 290 HG3 GLU 37 HG1 GLU 37 -7.859 -14.720 -4.489 291 H ALA 38 HN ALA 38 -3.709 -16.520 -5.661 292 HA ALA 38 HA ALA 38 -3.543 -17.224 -2.963 293 HB1 ALA 38 HB1 ALA 38 -1.325 -18.200 -3.561 294 HB2 ALA 38 HB2 ALA 38 -1.436 -17.396 -5.127 295 HB3 ALA 38 HB3 ALA 38 -2.604 -18.642 -4.692 296 H ALA 39 HN ALA 39 -1.903 -14.661 -4.745 297 HA ALA 39 HA ALA 39 -0.045 -14.037 -2.635 298 HB1 ALA 39 HB1 ALA 39 0.358 -13.467 -5.028 299 HB2 ALA 39 HB2 ALA 39 0.518 -12.082 -3.947 300 HB3 ALA 39 HB3 ALA 39 -0.936 -12.272 -4.928 301 H ARG 40 HN ARG 40 -3.105 -12.589 -3.746 302 HA ARG 40 HA ARG 40 -3.198 -10.446 -1.932 303 HB2 ARG 40 HB2 ARG 40 -5.689 -11.942 -2.745 304 HB3 ARG 40 HB1 ARG 40 -5.486 -10.217 -2.487 305 HG2 ARG 40 HG2 ARG 40 -4.469 -11.863 -4.806 306 HG3 ARG 40 HG1 ARG 40 -5.685 -10.613 -4.852 307 HD2 ARG 40 HD2 ARG 40 -2.741 -10.166 -4.247 308 HD3 ARG 40 HD1 ARG 40 -3.535 -9.839 -5.781 309 HE ARG 40 HE ARG 40 -4.763 -8.509 -3.523 310 HH11 ARG 40 HH21 ARG 40 -2.594 -8.240 -6.246 311 HH12 ARG 40 HH22 ARG 40 -2.247 -6.561 -5.930 312 HH21 ARG 40 HH11 ARG 40 -4.456 -6.337 -3.256 313 HH22 ARG 40 HH12 ARG 40 -3.353 -5.473 -4.270 314 H LYS 41 HN LYS 41 -3.925 -13.850 -1.492 315 HA LYS 41 HA LYS 41 -5.198 -13.483 1.094 316 HB2 LYS 41 HB2 LYS 41 -4.262 -15.943 -0.406 317 HB3 LYS 41 HB1 LYS 41 -4.961 -16.022 1.210 318 HG2 LYS 41 HG2 LYS 41 -7.006 -14.873 0.341 319 HG3 LYS 41 HG1 LYS 41 -6.309 -14.924 -1.279 320 HD2 LYS 41 HD2 LYS 41 -6.232 -17.370 -1.210 321 HD3 LYS 41 HD1 LYS 41 -6.829 -17.365 0.448 322 HE2 LYS 41 HE2 LYS 41 -8.931 -16.310 -0.307 323 HE3 LYS 41 HE1 LYS 41 -8.340 -16.316 -1.966 324 HZ1 LYS 41 HZ1 LYS 41 -9.837 -18.219 -1.259 325 HZ2 LYS 41 HZ2 LYS 41 -8.514 -18.798 -0.362 326 HZ3 LYS 41 HZ3 LYS 41 -8.397 -18.638 -2.050 327 H ILE 42 HN ILE 42 -2.035 -13.310 0.043 328 HA ILE 42 HA ILE 42 -0.897 -14.311 2.596 329 HB ILE 42 HB ILE 42 0.413 -13.660 -0.062 330 HG12 ILE 42 HG12 ILE 42 -0.967 -15.870 0.351 331 HG13 ILE 42 HG11 ILE 42 0.617 -15.987 -0.402 332 HG21 ILE 42 HG21 ILE 42 1.609 -14.298 2.644 333 HG22 ILE 42 HG22 ILE 42 2.141 -13.111 1.450 334 HG23 ILE 42 HG23 ILE 42 2.443 -14.821 1.180 335 HD11 ILE 42 HD11 ILE 42 1.617 -16.828 1.556 336 HD12 ILE 42 HD12 ILE 42 0.047 -17.622 1.534 337 HD13 ILE 42 HD13 ILE 42 0.322 -16.251 2.597 338 H GLY 43 HN GLY 43 -2.155 -11.537 1.526 339 HA2 GLY 43 HA3 GLY 43 -2.032 -9.539 2.825 340 HA3 GLY 43 HA2 GLY 43 -0.362 -9.907 3.228 341 H PHE 44 HN PHE 44 -0.857 -10.543 -0.028 342 HA PHE 44 HA PHE 44 0.795 -8.387 -0.862 343 HB2 PHE 44 HB2 PHE 44 0.524 -10.705 -1.945 344 HB3 PHE 44 HB1 PHE 44 -0.958 -10.093 -2.659 345 HD1 PHE 44 HD1 PHE 44 2.706 -9.480 -2.385 346 HD2 PHE 44 HD2 PHE 44 -0.878 -8.704 -4.627 347 HE1 PHE 44 HE1 PHE 44 4.056 -8.452 -4.192 348 HE2 PHE 44 HE2 PHE 44 0.476 -7.673 -6.431 349 HZ PHE 44 HZ PHE 44 2.944 -7.550 -6.213 350 H HIS 45 HN HIS 45 0.203 -6.354 -1.129 351 HA HIS 45 HA HIS 45 -2.508 -5.727 -2.157 352 HB2 HIS 45 HB2 HIS 45 -2.574 -5.407 0.240 353 HB3 HIS 45 HB1 HIS 45 -1.119 -4.420 0.183 354 HD1 HIS 45 HD1 HIS 45 -4.718 -4.392 -1.084 355 HD2 HIS 45 HD2 HIS 45 -1.605 -1.728 -0.317 356 HE1 HIS 45 HE1 HIS 45 -5.685 -2.064 -1.336 357 HE2 HIS 45 HE2 HIS 45 -3.798 -0.430 -0.879 358 H VAL 46 HN VAL 46 -1.995 -5.066 -4.152 359 HA VAL 46 HA VAL 46 -0.291 -2.660 -4.381 360 HB VAL 46 HB VAL 46 -0.028 -5.042 -6.237 361 HG11 VAL 46 HG11 VAL 46 1.359 -2.347 -6.065 362 HG12 VAL 46 HG12 VAL 46 0.396 -2.974 -7.402 363 HG13 VAL 46 HG13 VAL 46 1.964 -3.689 -7.033 364 HG21 VAL 46 HG21 VAL 46 0.989 -5.594 -4.099 365 HG22 VAL 46 HG22 VAL 46 1.775 -4.016 -4.018 366 HG23 VAL 46 HG23 VAL 46 2.278 -5.191 -5.233 367 H CYS 47 HN CYS 47 -1.140 -1.160 -5.658 368 HA CYS 47 HA CYS 47 -3.463 -1.881 -7.390 369 HB2 CYS 47 HB2 CYS 47 -3.799 -0.335 -5.332 370 HB3 CYS 47 HB1 CYS 47 -2.978 0.894 -6.289 371 H ALA 48 HN ALA 48 -2.295 -2.267 -9.262 372 HA ALA 48 HA ALA 48 -1.542 0.107 -10.748 373 HB1 ALA 48 HB1 ALA 48 0.536 -0.515 -9.445 374 HB2 ALA 48 HB2 ALA 48 0.737 -0.488 -11.195 375 HB3 ALA 48 HB3 ALA 48 0.570 -2.026 -10.351 376 H ALA 49 HN ALA 49 -2.187 -0.157 -12.766 377 HA ALA 49 HA ALA 49 -3.311 -2.590 -13.700 378 HB1 ALA 49 HB1 ALA 49 -3.635 -1.405 -15.800 379 HB2 ALA 49 HB2 ALA 49 -2.525 -0.138 -15.280 380 HB3 ALA 49 HB3 ALA 49 -4.064 -0.360 -14.448 381 H GLY 50 HN GLY 50 -2.027 -4.302 -13.970 382 HA2 GLY 50 HA3 GLY 50 0.397 -3.996 -15.684 383 HA3 GLY 50 HA2 GLY 50 0.322 -5.091 -14.315 384 H TRP 51 HN TRP 51 0.967 -5.778 -16.991 385 HA TRP 51 HA TRP 51 -1.301 -7.085 -18.234 386 HB2 TRP 51 HB2 TRP 51 1.674 -7.116 -18.770 387 HB3 TRP 51 HB1 TRP 51 0.546 -8.127 -19.666 388 HD1 TRP 51 HD1 TRP 51 1.695 -4.541 -19.283 389 HE1 TRP 51 HE1 TRP 51 0.614 -3.117 -21.142 390 HE3 TRP 51 HE3 TRP 51 -1.612 -7.923 -21.184 391 HZ2 TRP 51 HZ2 TRP 51 -1.361 -3.388 -23.192 392 HZ3 TRP 51 HZ3 TRP 51 -3.074 -7.326 -23.088 393 HH2 TRP 51 HH2 TRP 51 -2.956 -5.068 -24.093 394 H MET 52 HN MET 52 -1.744 -9.248 -18.284 395 HA MET 52 HA MET 52 -0.132 -11.100 -16.649 396 HB2 MET 52 HB2 MET 52 -3.122 -10.753 -16.275 397 HB3 MET 52 HB1 MET 52 -2.124 -11.975 -15.518 398 HG2 MET 52 HG2 MET 52 -2.006 -10.458 -13.791 399 HG3 MET 52 HG1 MET 52 -0.765 -9.706 -14.756 400 HE1 MET 52 HE1 MET 52 -4.966 -8.246 -13.799 401 HE2 MET 52 HE2 MET 52 -3.775 -8.939 -12.700 402 HE3 MET 52 HE3 MET 52 -4.497 -9.943 -13.956 403 H ALA 53 HN ALA 53 -1.059 -13.365 -16.859 404 HA ALA 53 HA ALA 53 -0.821 -14.378 -19.355 405 HB1 ALA 53 HB1 ALA 53 -1.064 -15.774 -17.348 406 HB2 ALA 53 HB2 ALA 53 -2.127 -16.323 -18.644 407 HB3 ALA 53 HB3 ALA 53 -2.787 -15.398 -17.296 408 H LYS 54 HN LYS 54 -2.156 -14.990 -21.061 409 HA LYS 54 HA LYS 54 -3.773 -14.647 -22.654 410 HB2 LYS 54 HB2 LYS 54 -5.524 -14.334 -20.194 411 HB3 LYS 54 HB1 LYS 54 -6.127 -14.456 -21.841 412 HG2 LYS 54 HG2 LYS 54 -5.105 -16.675 -22.075 413 HG3 LYS 54 HG1 LYS 54 -4.447 -16.559 -20.442 414 HD2 LYS 54 HD2 LYS 54 -6.726 -16.400 -19.520 415 HD3 LYS 54 HD1 LYS 54 -7.401 -16.481 -21.146 416 HE2 LYS 54 HE2 LYS 54 -6.412 -18.725 -21.446 417 HE3 LYS 54 HE1 LYS 54 -5.734 -18.645 -19.821 418 HZ1 LYS 54 HZ1 LYS 54 -8.612 -18.194 -20.158 419 HZ2 LYS 54 HZ2 LYS 54 -7.771 -18.883 -18.852 420 HZ3 LYS 54 HZ3 LYS 54 -8.033 -19.784 -20.269 421 H GLY 55 HN GLY 55 -2.204 -12.375 -21.798 422 HA2 GLY 55 HA3 GLY 55 -2.092 -10.101 -22.067 423 HA3 GLY 55 HA2 GLY 55 -3.456 -10.295 -23.161 424 H ARG 56 HN ARG 56 -4.264 -11.492 -20.132 425 HA ARG 56 HA ARG 56 -6.258 -9.538 -19.672 426 HB2 ARG 56 HB2 ARG 56 -6.320 -11.871 -18.773 427 HB3 ARG 56 HB1 ARG 56 -5.029 -11.442 -17.667 428 HG2 ARG 56 HG2 ARG 56 -6.466 -9.734 -16.621 429 HG3 ARG 56 HG1 ARG 56 -7.769 -10.151 -17.736 430 HD2 ARG 56 HD2 ARG 56 -7.681 -12.500 -16.861 431 HD3 ARG 56 HD1 ARG 56 -6.476 -11.965 -15.694 432 HE ARG 56 HE ARG 56 -8.156 -11.016 -14.439 433 HH11 ARG 56 HH21 ARG 56 -9.421 -11.300 -17.714 434 HH12 ARG 56 HH22 ARG 56 -11.071 -11.181 -17.164 435 HH21 ARG 56 HH11 ARG 56 -10.235 -10.739 -13.821 436 HH22 ARG 56 HH12 ARG 56 -11.524 -10.797 -14.975 437 H VAL 57 HN VAL 57 -6.227 -7.625 -18.682 438 HA VAL 57 HA VAL 57 -3.869 -6.891 -17.022 439 HB VAL 57 HB VAL 57 -5.227 -4.829 -18.756 440 HG11 VAL 57 HG11 VAL 57 -3.264 -3.569 -18.445 441 HG12 VAL 57 HG12 VAL 57 -2.334 -4.976 -17.965 442 HG13 VAL 57 HG13 VAL 57 -3.543 -4.312 -16.872 443 HG21 VAL 57 HG21 VAL 57 -4.675 -6.375 -20.450 444 HG22 VAL 57 HG22 VAL 57 -3.222 -6.907 -19.616 445 HG23 VAL 57 HG23 VAL 57 -3.261 -5.322 -20.390 446 H GLY 58 HN GLY 58 -4.343 -6.217 -15.078 447 HA2 GLY 58 HA3 GLY 58 -6.762 -4.676 -14.533 448 HA3 GLY 58 HA2 GLY 58 -6.726 -6.288 -13.821 449 H TYR 59 HN TYR 59 -6.943 -4.756 -11.920 450 HA TYR 59 HA TYR 59 -4.309 -4.557 -10.664 451 HB2 TYR 59 HB2 TYR 59 -4.788 -2.194 -9.878 452 HB3 TYR 59 HB1 TYR 59 -4.299 -2.381 -11.551 453 HD1 TYR 59 HD2 TYR 59 -6.075 -2.413 -13.375 454 HD2 TYR 59 HD1 TYR 59 -6.887 -1.188 -9.341 455 HE1 TYR 59 HE2 TYR 59 -8.102 -1.210 -14.145 456 HE2 TYR 59 HE1 TYR 59 -8.901 0.022 -10.113 457 HH TYR 59 HH TYR 59 -9.744 1.036 -12.202 458 HA PRO 60 HA PRO 60 -7.619 -6.239 -7.899 459 HB2 PRO 60 HB2 PRO 60 -5.104 -7.321 -6.665 460 HB3 PRO 60 HB1 PRO 60 -6.627 -8.150 -6.989 461 HG2 PRO 60 HG2 PRO 60 -4.508 -8.591 -8.521 462 HG3 PRO 60 HG1 PRO 60 -6.118 -8.452 -9.248 463 HD2 PRO 60 HD2 PRO 60 -3.910 -6.411 -9.192 464 HD3 PRO 60 HD1 PRO 60 -5.056 -6.799 -10.499 465 H ILE 61 HN ILE 61 -8.253 -5.512 -5.895 466 HA ILE 61 HA ILE 61 -6.379 -3.841 -4.308 467 HB ILE 61 HB ILE 61 -9.187 -3.006 -5.111 468 HG12 ILE 61 HG12 ILE 61 -6.500 -1.732 -5.730 469 HG13 ILE 61 HG11 ILE 61 -7.397 -2.737 -6.858 470 HG21 ILE 61 HG21 ILE 61 -8.788 -2.281 -2.849 471 HG22 ILE 61 HG22 ILE 61 -8.487 -0.877 -3.864 472 HG23 ILE 61 HG23 ILE 61 -7.134 -1.806 -3.224 473 HD11 ILE 61 HD11 ILE 61 -7.849 -0.384 -7.315 474 HD12 ILE 61 HD12 ILE 61 -8.371 -0.148 -5.650 475 HD13 ILE 61 HD13 ILE 61 -9.311 -1.180 -6.728 476 H VAL 62 HN VAL 62 -6.214 -5.114 -2.566 477 HA VAL 62 HA VAL 62 -8.432 -6.577 -1.458 478 HB VAL 62 HB VAL 62 -5.684 -5.957 -0.333 479 HG11 VAL 62 HG11 VAL 62 -7.146 -6.470 1.529 480 HG12 VAL 62 HG12 VAL 62 -6.224 -7.928 1.181 481 HG13 VAL 62 HG13 VAL 62 -7.898 -7.797 0.640 482 HG21 VAL 62 HG21 VAL 62 -5.146 -8.218 -1.049 483 HG22 VAL 62 HG22 VAL 62 -5.809 -7.346 -2.433 484 HG23 VAL 62 HG23 VAL 62 -6.814 -8.493 -1.550 485 H LYS 63 HN LYS 63 -6.540 -3.763 -0.312 486 HA LYS 63 HA LYS 63 -8.637 -3.192 1.645 487 HB2 LYS 63 HB2 LYS 63 -5.968 -1.835 1.249 488 HB3 LYS 63 HB1 LYS 63 -7.065 -1.586 2.601 489 HG2 LYS 63 HG2 LYS 63 -5.850 -4.278 1.897 490 HG3 LYS 63 HG1 LYS 63 -5.160 -3.174 3.083 491 HD2 LYS 63 HD2 LYS 63 -7.464 -3.242 4.255 492 HD3 LYS 63 HD1 LYS 63 -7.827 -4.617 3.214 493 HE2 LYS 63 HE2 LYS 63 -5.469 -4.449 5.101 494 HE3 LYS 63 HE1 LYS 63 -6.958 -5.346 5.400 495 HZ1 LYS 63 HZ1 LYS 63 -5.408 -6.874 4.534 496 HZ2 LYS 63 HZ2 LYS 63 -4.944 -5.826 3.280 497 HZ3 LYS 63 HZ3 LYS 63 -6.486 -6.542 3.266 498 HA PRO 64 HA PRO 64 -10.828 -0.051 -0.577 499 HB2 PRO 64 HB2 PRO 64 -10.091 1.698 1.778 500 HB3 PRO 64 HB1 PRO 64 -11.662 1.520 0.968 501 HG2 PRO 64 HG2 PRO 64 -11.127 0.290 3.299 502 HG3 PRO 64 HG1 PRO 64 -12.147 -0.463 2.059 503 HD2 PRO 64 HD2 PRO 64 -9.394 -1.210 2.896 504 HD3 PRO 64 HD1 PRO 64 -10.621 -2.177 2.046 505 H GLY 65 HN GLY 65 -10.277 1.474 -2.082 506 HA2 GLY 65 HA3 GLY 65 -7.857 3.097 -1.735 507 HA3 GLY 65 HA2 GLY 65 -7.843 1.948 -3.039 508 HA PRO 66 HA PRO 66 -11.032 5.364 -4.220 509 HB2 PRO 66 HB2 PRO 66 -10.473 7.888 -3.319 510 HB3 PRO 66 HB1 PRO 66 -11.450 6.739 -2.379 511 HG2 PRO 66 HG2 PRO 66 -8.561 7.464 -2.067 512 HG3 PRO 66 HG1 PRO 66 -9.793 7.192 -0.818 513 HD2 PRO 66 HD2 PRO 66 -7.922 5.304 -1.547 514 HD3 PRO 66 HD1 PRO 66 -9.504 4.879 -0.855 515 H ASN 67 HN ASN 67 -7.616 5.573 -4.066 516 HA ASN 67 HA ASN 67 -7.173 7.532 -6.095 517 HB2 ASN 67 HB2 ASN 67 -5.463 6.977 -4.445 518 HB3 ASN 67 HB1 ASN 67 -5.394 5.323 -5.045 519 HD21 ASN 67 HD21 ASN 67 -3.522 5.086 -6.252 520 HD22 ASN 67 HD22 ASN 67 -2.924 6.224 -7.361 521 H CYS 68 HN CYS 68 -7.614 4.047 -6.073 522 HA CYS 68 HA CYS 68 -7.972 4.081 -8.993 523 HB2 CYS 68 HB2 CYS 68 -6.544 1.904 -9.077 524 HB3 CYS 68 HB1 CYS 68 -5.693 3.445 -9.010 525 H GLY 69 HN GLY 69 -9.516 2.735 -9.672 526 HA2 GLY 69 HA3 GLY 69 -11.067 1.008 -9.669 527 HA3 GLY 69 HA2 GLY 69 -10.398 0.435 -8.144 528 H PHE 70 HN PHE 70 -10.869 3.641 -7.711 529 HA PHE 70 HA PHE 70 -12.346 4.823 -6.391 530 HB2 PHE 70 HB2 PHE 70 -14.286 3.348 -8.190 531 HB3 PHE 70 HB1 PHE 70 -14.708 4.720 -7.172 532 HD1 PHE 70 HD2 PHE 70 -13.793 6.980 -7.640 533 HD2 PHE 70 HD1 PHE 70 -12.991 3.650 -10.239 534 HE1 PHE 70 HE2 PHE 70 -13.053 8.544 -9.417 535 HE2 PHE 70 HE1 PHE 70 -12.255 5.219 -12.017 536 HZ PHE 70 HZ PHE 70 -12.286 7.663 -11.605 537 H GLY 71 HN GLY 71 -11.722 3.541 -4.508 538 HA2 GLY 71 HA3 GLY 71 -12.212 2.335 -2.606 539 HA3 GLY 71 HA2 GLY 71 -13.901 2.630 -3.005 540 H LYS 72 HN LYS 72 -15.027 0.817 -3.088 541 HA LYS 72 HA LYS 72 -15.626 -1.383 -3.421 542 HB2 LYS 72 HB2 LYS 72 -13.618 -1.099 -5.672 543 HB3 LYS 72 HB1 LYS 72 -14.698 -2.469 -5.467 544 HG2 LYS 72 HG2 LYS 72 -16.648 -1.058 -5.724 545 HG3 LYS 72 HG1 LYS 72 -15.650 0.395 -5.721 546 HD2 LYS 72 HD2 LYS 72 -16.175 -0.058 -8.024 547 HD3 LYS 72 HD1 LYS 72 -14.491 -0.513 -7.800 548 HE2 LYS 72 HE2 LYS 72 -15.034 -2.850 -7.744 549 HE3 LYS 72 HE1 LYS 72 -16.758 -2.519 -7.583 550 HZ1 LYS 72 HZ1 LYS 72 -16.568 -2.977 -9.801 551 HZ2 LYS 72 HZ2 LYS 72 -15.022 -2.286 -9.941 552 HZ3 LYS 72 HZ3 LYS 72 -16.394 -1.290 -9.823 553 H THR 73 HN THR 73 -14.829 -3.646 -3.357 554 HA THR 73 HA THR 73 -12.077 -3.972 -2.323 555 HB THR 73 HB THR 73 -14.550 -5.011 -0.911 556 HG1 THR 73 HG1 THR 73 -12.648 -3.333 0.240 557 HG21 THR 73 HG21 THR 73 -11.587 -5.450 -0.501 558 HG22 THR 73 HG22 THR 73 -12.875 -6.651 -0.550 559 HG23 THR 73 HG23 THR 73 -12.718 -5.582 0.841 560 H GLY 74 HN GLY 74 -11.447 -6.244 -2.172 561 HA2 GLY 74 HA3 GLY 74 -11.281 -8.401 -2.994 562 HA3 GLY 74 HA2 GLY 74 -12.944 -8.273 -3.556 563 H ILE 75 HN ILE 75 -10.709 -9.454 -4.941 564 HA ILE 75 HA ILE 75 -9.504 -7.876 -6.885 565 HB ILE 75 HB ILE 75 -10.541 -10.691 -7.349 566 HG12 ILE 75 HG12 ILE 75 -7.954 -9.799 -6.021 567 HG13 ILE 75 HG11 ILE 75 -9.307 -10.540 -5.192 568 HG21 ILE 75 HG21 ILE 75 -9.669 -9.571 -9.350 569 HG22 ILE 75 HG22 ILE 75 -8.522 -10.805 -8.836 570 HG23 ILE 75 HG23 ILE 75 -8.213 -9.110 -8.483 571 HD11 ILE 75 HD11 ILE 75 -7.465 -11.791 -7.223 572 HD12 ILE 75 HD12 ILE 75 -9.023 -12.513 -6.813 573 HD13 ILE 75 HD13 ILE 75 -7.788 -12.312 -5.570 574 H ILE 76 HN ILE 76 -10.261 -6.731 -8.539 575 HA ILE 76 HA ILE 76 -13.062 -7.153 -9.451 576 HB ILE 76 HB ILE 76 -11.312 -4.711 -9.835 577 HG12 ILE 76 HG12 ILE 76 -11.700 -4.974 -7.451 578 HG13 ILE 76 HG11 ILE 76 -12.736 -3.686 -8.053 579 HG21 ILE 76 HG21 ILE 76 -13.556 -3.650 -10.293 580 HG22 ILE 76 HG22 ILE 76 -14.263 -5.263 -10.263 581 HG23 ILE 76 HG23 ILE 76 -13.066 -4.848 -11.488 582 HD11 ILE 76 HD11 ILE 76 -14.558 -5.539 -8.275 583 HD12 ILE 76 HD12 ILE 76 -14.163 -4.948 -6.665 584 HD13 ILE 76 HD13 ILE 76 -13.504 -6.482 -7.220 585 H ASP 77 HN ASP 77 -13.275 -8.177 -11.299 586 HA ASP 77 HA ASP 77 -11.099 -8.589 -13.123 587 HB2 ASP 77 HB2 ASP 77 -14.054 -9.200 -13.288 588 HB3 ASP 77 HB1 ASP 77 -12.909 -9.624 -14.559 589 H TYR 78 HN TYR 78 -10.887 -7.827 -15.222 590 HA TYR 78 HA TYR 78 -12.486 -5.430 -15.978 591 HB2 TYR 78 HB2 TYR 78 -9.477 -5.722 -16.165 592 HB3 TYR 78 HB1 TYR 78 -10.416 -4.385 -16.821 593 HD1 TYR 78 HD2 TYR 78 -11.525 -2.755 -15.321 594 HD2 TYR 78 HD1 TYR 78 -9.098 -5.939 -13.754 595 HE1 TYR 78 HE2 TYR 78 -11.405 -1.590 -13.133 596 HE2 TYR 78 HE1 TYR 78 -8.976 -4.768 -11.572 597 HH TYR 78 HH TYR 78 -9.189 -2.430 -10.728 598 H GLY 79 HN GLY 79 -11.044 -8.415 -16.856 599 HA2 GLY 79 HA3 GLY 79 -11.568 -9.642 -18.801 600 HA3 GLY 79 HA2 GLY 79 -12.114 -8.166 -19.585 601 H ILE 80 HN ILE 80 -10.795 -9.221 -21.347 602 HA ILE 80 HA ILE 80 -7.892 -8.704 -21.102 603 HB ILE 80 HB ILE 80 -9.396 -10.237 -23.236 604 HG12 ILE 80 HG12 ILE 80 -7.636 -11.295 -20.993 605 HG13 ILE 80 HG11 ILE 80 -9.396 -11.275 -20.917 606 HG21 ILE 80 HG21 ILE 80 -7.031 -11.036 -23.759 607 HG22 ILE 80 HG22 ILE 80 -6.444 -9.777 -22.675 608 HG23 ILE 80 HG23 ILE 80 -7.338 -9.346 -24.132 609 HD11 ILE 80 HD11 ILE 80 -9.427 -12.614 -23.059 610 HD12 ILE 80 HD12 ILE 80 -8.724 -13.464 -21.683 611 HD13 ILE 80 HD13 ILE 80 -7.675 -12.766 -22.914 612 H ARG 81 HN ARG 81 -7.102 -6.931 -21.959 613 HA ARG 81 HA ARG 81 -8.704 -5.388 -23.910 614 HB2 ARG 81 HB2 ARG 81 -6.390 -4.688 -22.081 615 HB3 ARG 81 HB1 ARG 81 -6.910 -3.619 -23.382 616 HG2 ARG 81 HG2 ARG 81 -8.145 -2.783 -21.595 617 HG3 ARG 81 HG1 ARG 81 -9.315 -3.887 -22.282 618 HD2 ARG 81 HD2 ARG 81 -8.291 -5.629 -20.586 619 HD3 ARG 81 HD1 ARG 81 -7.685 -4.201 -19.760 620 HE ARG 81 HE ARG 81 -10.364 -5.124 -19.722 621 HH11 ARG 81 HH21 ARG 81 -8.480 -2.198 -20.043 622 HH12 ARG 81 HH22 ARG 81 -9.703 -1.198 -19.341 623 HH21 ARG 81 HH11 ARG 81 -11.906 -3.808 -18.746 624 HH22 ARG 81 HH12 ARG 81 -11.610 -2.111 -18.569 625 H LEU 82 HN LEU 82 -8.149 -5.237 -25.964 626 HA LEU 82 HA LEU 82 -5.849 -6.674 -26.994 627 HB2 LEU 82 HB2 LEU 82 -7.860 -5.032 -28.554 628 HB3 LEU 82 HB1 LEU 82 -6.830 -6.331 -29.149 629 HG LEU 82 HG LEU 82 -9.087 -6.636 -27.140 630 HD11 LEU 82 HD11 LEU 82 -8.815 -7.460 -30.046 631 HD12 LEU 82 HD12 LEU 82 -9.941 -6.275 -29.384 632 HD13 LEU 82 HD13 LEU 82 -10.121 -7.981 -28.982 633 HD21 LEU 82 HD21 LEU 82 -7.061 -8.596 -28.259 634 HD22 LEU 82 HD22 LEU 82 -8.618 -9.140 -27.630 635 HD23 LEU 82 HD23 LEU 82 -7.487 -8.308 -26.572 636 H ASN 83 HN ASN 83 -5.964 -3.857 -25.530 637 HA ASN 83 HA ASN 83 -4.757 -2.053 -27.405 638 HB2 ASN 83 HB2 ASN 83 -4.358 -0.617 -25.476 639 HB3 ASN 83 HB1 ASN 83 -6.006 -1.243 -25.447 640 HD21 ASN 83 HD21 ASN 83 -4.846 -0.341 -23.047 641 HD22 ASN 83 HD22 ASN 83 -4.541 -1.672 -22.040 642 H ARG 84 HN ARG 84 -3.527 -4.754 -26.919 643 HA ARG 84 HA ARG 84 -1.108 -4.706 -25.573 644 HB2 ARG 84 HB2 ARG 84 -2.120 -6.635 -26.885 645 HB3 ARG 84 HB1 ARG 84 -1.421 -5.914 -28.323 646 HG2 ARG 84 HG2 ARG 84 0.842 -6.108 -27.360 647 HG3 ARG 84 HG1 ARG 84 0.154 -6.783 -25.881 648 HD2 ARG 84 HD2 ARG 84 -0.707 -8.686 -27.058 649 HD3 ARG 84 HD1 ARG 84 -0.280 -8.014 -28.622 650 HE ARG 84 HE ARG 84 2.040 -8.351 -27.012 651 HH11 ARG 84 HH21 ARG 84 -0.280 -9.841 -29.075 652 HH12 ARG 84 HH22 ARG 84 0.544 -11.360 -29.190 653 HH21 ARG 84 HH11 ARG 84 3.186 -10.393 -27.155 654 HH22 ARG 84 HH12 ARG 84 2.502 -11.671 -28.102 655 H SER 85 HN SER 85 -2.017 -2.684 -28.151 656 HA SER 85 HA SER 85 0.509 -2.236 -29.366 657 HB2 SER 85 HB2 SER 85 -1.938 -0.460 -29.217 658 HB3 SER 85 HB1 SER 85 -0.556 -0.201 -30.276 659 HG SER 85 HG SER 85 -2.631 -2.007 -30.450 660 H GLU 86 HN GLU 86 -1.187 -0.788 -26.634 661 HA GLU 86 HA GLU 86 0.791 1.288 -26.213 662 HB2 GLU 86 HB2 GLU 86 -1.550 0.319 -24.547 663 HB3 GLU 86 HB1 GLU 86 -0.520 1.675 -24.097 664 HG2 GLU 86 HG2 GLU 86 -1.127 2.859 -26.151 665 HG3 GLU 86 HG1 GLU 86 -2.104 1.489 -26.674 666 H ARG 87 HN ARG 87 1.206 1.317 -23.546 667 HA ARG 87 HA ARG 87 2.485 -1.272 -22.826 668 HB2 ARG 87 HB2 ARG 87 3.809 1.442 -22.600 669 HB3 ARG 87 HB1 ARG 87 4.465 -0.102 -22.041 670 HG2 ARG 87 HG2 ARG 87 4.372 -0.984 -24.329 671 HG3 ARG 87 HG1 ARG 87 3.717 0.547 -24.898 672 HD2 ARG 87 HD2 ARG 87 5.781 1.689 -24.102 673 HD3 ARG 87 HD1 ARG 87 6.442 0.117 -23.643 674 HE ARG 87 HE ARG 87 6.212 1.165 -26.334 675 HH11 ARG 87 HH21 ARG 87 6.337 -1.686 -24.337 676 HH12 ARG 87 HH22 ARG 87 6.898 -2.701 -25.630 677 HH21 ARG 87 HH11 ARG 87 6.970 -0.134 -27.974 678 HH22 ARG 87 HH12 ARG 87 7.298 -1.806 -27.685 679 H TRP 88 HN TRP 88 2.556 -1.756 -20.704 680 HA TRP 88 HA TRP 88 1.631 0.177 -18.700 681 HB2 TRP 88 HB2 TRP 88 0.176 -2.440 -19.151 682 HB3 TRP 88 HB1 TRP 88 -0.150 -1.270 -17.887 683 HD1 TRP 88 HD1 TRP 88 -0.294 -1.575 -21.741 684 HE1 TRP 88 HE1 TRP 88 -2.111 0.047 -22.595 685 HE3 TRP 88 HE3 TRP 88 -1.556 0.705 -17.362 686 HZ2 TRP 88 HZ2 TRP 88 -3.877 2.044 -21.543 687 HZ3 TRP 88 HZ3 TRP 88 -3.305 2.456 -17.306 688 HH2 TRP 88 HH2 TRP 88 -4.469 3.128 -19.389 689 H ASP 89 HN ASP 89 1.524 -1.033 -16.499 690 HA ASP 89 HA ASP 89 4.090 -1.982 -15.876 691 HB2 ASP 89 HB2 ASP 89 2.445 -0.931 -14.292 692 HB3 ASP 89 HB1 ASP 89 1.553 -2.448 -14.291 693 H ALA 90 HN ALA 90 4.195 -4.145 -14.492 694 HA ALA 90 HA ALA 90 2.688 -6.376 -15.508 695 HB1 ALA 90 HB1 ALA 90 4.434 -7.494 -16.738 696 HB2 ALA 90 HB2 ALA 90 5.588 -6.214 -16.361 697 HB3 ALA 90 HB3 ALA 90 4.223 -5.887 -17.431 698 H TYR 91 HN TYR 91 3.369 -8.405 -14.585 699 HA TYR 91 HA TYR 91 5.192 -8.199 -12.251 700 HB2 TYR 91 HB2 TYR 91 2.379 -9.336 -12.241 701 HB3 TYR 91 HB1 TYR 91 3.550 -9.560 -10.944 702 HD1 TYR 91 HD2 TYR 91 4.412 -7.574 -9.665 703 HD2 TYR 91 HD1 TYR 91 1.166 -7.250 -12.468 704 HE1 TYR 91 HE2 TYR 91 3.746 -5.412 -8.647 705 HE2 TYR 91 HE1 TYR 91 0.500 -5.090 -11.443 706 HH TYR 91 HH TYR 91 2.419 -3.624 -8.834 707 H CYS 92 HN CYS 92 5.891 -10.269 -11.453 708 HA CYS 92 HA CYS 92 5.619 -12.559 -13.299 709 HB2 CYS 92 HB2 CYS 92 7.703 -11.055 -13.807 710 HB3 CYS 92 HB1 CYS 92 8.372 -11.767 -12.344 711 H TYR 93 HN TYR 93 5.970 -14.542 -12.344 712 HA TYR 93 HA TYR 93 6.158 -14.565 -9.369 713 HB2 TYR 93 HB2 TYR 93 3.957 -15.239 -10.073 714 HB3 TYR 93 HB1 TYR 93 4.612 -16.332 -11.277 715 HD1 TYR 93 HD2 TYR 93 5.729 -18.446 -10.595 716 HD2 TYR 93 HD1 TYR 93 3.877 -15.863 -7.709 717 HE1 TYR 93 HE2 TYR 93 5.751 -20.284 -8.929 718 HE2 TYR 93 HE1 TYR 93 3.895 -17.695 -6.049 719 HH TYR 93 HH TYR 93 4.691 -20.960 -6.927 720 H ASN 94 HN ASN 94 7.506 -15.959 -8.399 721 HA ASN 94 HA ASN 94 8.978 -17.914 -10.017 722 HB2 ASN 94 HB2 ASN 94 10.232 -15.555 -8.618 723 HB3 ASN 94 HB1 ASN 94 11.165 -17.012 -8.948 724 HD21 ASN 94 HD21 ASN 94 11.577 -14.332 -10.131 725 HD22 ASN 94 HD22 ASN 94 11.399 -14.528 -11.808 726 HA PRO 95 HA PRO 95 8.671 -20.219 -6.231 727 HB2 PRO 95 HB2 PRO 95 10.631 -22.091 -6.591 728 HB3 PRO 95 HB1 PRO 95 9.145 -22.088 -7.564 729 HG2 PRO 95 HG2 PRO 95 11.848 -20.972 -8.258 730 HG3 PRO 95 HG1 PRO 95 10.776 -21.995 -9.238 731 HD2 PRO 95 HD2 PRO 95 10.868 -19.299 -9.585 732 HD3 PRO 95 HD1 PRO 95 9.355 -20.217 -9.789 733 H HIS 96 HN HIS 96 9.698 -20.562 -4.222 734 HA HIS 96 HA HIS 96 10.997 -19.880 -2.439 735 HB2 HIS 96 HB2 HIS 96 13.219 -19.972 -4.490 736 HB3 HIS 96 HB1 HIS 96 13.391 -20.091 -2.738 737 HD1 HIS 96 HD1 HIS 96 12.576 -22.071 -5.761 738 HD2 HIS 96 HD2 HIS 96 12.341 -22.578 -1.628 739 HE1 HIS 96 HE1 HIS 96 12.181 -24.540 -5.364 740 HE2 HIS 96 HE2 HIS 96 12.036 -24.867 -2.849 741 H ALA 97 HN ALA 97 9.925 -17.840 -4.461 742 HA ALA 97 HA ALA 97 11.695 -15.648 -4.634 743 HB1 ALA 97 HB1 ALA 97 9.524 -14.309 -4.791 744 HB2 ALA 97 HB2 ALA 97 8.676 -15.832 -4.522 745 HB3 ALA 97 HB3 ALA 97 9.683 -15.627 -5.954 746 H LYS 98 HN LYS 98 8.887 -15.956 -2.537 747 HA LYS 98 HA LYS 98 10.333 -14.468 -0.402 748 HB2 LYS 98 HB2 LYS 98 7.374 -14.928 -0.976 749 HB3 LYS 98 HB1 LYS 98 7.970 -14.279 0.555 750 HG2 LYS 98 HG2 LYS 98 9.061 -12.413 -0.671 751 HG3 LYS 98 HG1 LYS 98 8.448 -13.056 -2.192 752 HD2 LYS 98 HD2 LYS 98 6.112 -12.796 -1.286 753 HD3 LYS 98 HD1 LYS 98 6.797 -12.003 0.129 754 HE2 LYS 98 HE2 LYS 98 7.221 -11.045 -2.716 755 HE3 LYS 98 HE1 LYS 98 5.987 -10.403 -1.637 756 HZ1 LYS 98 HZ1 LYS 98 7.549 -9.447 -0.269 757 HZ2 LYS 98 HZ2 LYS 98 8.269 -9.239 -1.794 758 HZ3 LYS 98 HZ3 LYS 98 8.798 -10.482 -0.766 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 3.610 -15.112 -3.967 2 H2 GLY 1 H2 GLY 1 4.065 -16.749 -3.985 3 H3 GLY 1 H3 GLY 1 3.595 -15.977 -5.423 4 HA2 GLY 1 HA3 GLY 1 5.976 -15.209 -3.828 5 HA3 GLY 1 HA2 GLY 1 6.029 -16.280 -5.229 6 H VAL 2 HN VAL 2 3.612 -13.872 -5.307 7 HA VAL 2 HA VAL 2 4.874 -12.552 -7.566 8 HB VAL 2 HB VAL 2 2.257 -11.855 -6.203 9 HG11 VAL 2 HG11 VAL 2 2.982 -10.150 -7.767 10 HG12 VAL 2 HG12 VAL 2 1.701 -11.076 -8.537 11 HG13 VAL 2 HG13 VAL 2 3.380 -11.364 -8.981 12 HG21 VAL 2 HG21 VAL 2 1.228 -13.338 -7.927 13 HG22 VAL 2 HG22 VAL 2 2.234 -14.228 -6.786 14 HG23 VAL 2 HG23 VAL 2 2.842 -13.864 -8.400 15 H TYR 3 HN TYR 3 5.140 -10.258 -7.713 16 HA TYR 3 HA TYR 3 5.063 -8.602 -5.364 17 HB2 TYR 3 HB2 TYR 3 7.447 -8.174 -5.156 18 HB3 TYR 3 HB1 TYR 3 7.117 -9.882 -4.896 19 HD1 TYR 3 HD2 TYR 3 7.627 -11.555 -6.681 20 HD2 TYR 3 HD1 TYR 3 8.772 -7.429 -7.047 21 HE1 TYR 3 HE2 TYR 3 9.226 -12.155 -8.477 22 HE2 TYR 3 HE1 TYR 3 10.373 -8.034 -8.840 23 HH TYR 3 HH TYR 3 10.906 -11.423 -9.765 24 H HIS 4 HN HIS 4 5.605 -6.416 -5.788 25 HA HIS 4 HA HIS 4 4.909 -5.617 -8.469 26 HB2 HIS 4 HB2 HIS 4 4.913 -3.366 -7.617 27 HB3 HIS 4 HB1 HIS 4 4.158 -4.406 -6.415 28 HD1 HIS 4 HD1 HIS 4 7.326 -2.482 -7.090 29 HD2 HIS 4 HD2 HIS 4 5.563 -4.615 -3.972 30 HE1 HIS 4 HE1 HIS 4 8.715 -2.011 -5.024 31 HE2 HIS 4 HE2 HIS 4 7.653 -3.303 -3.114 32 H ARG 5 HN ARG 5 6.182 -4.892 -10.071 33 HA ARG 5 HA ARG 5 9.017 -4.261 -9.523 34 HB2 ARG 5 HB2 ARG 5 9.855 -5.749 -11.210 35 HB3 ARG 5 HB1 ARG 5 8.861 -6.697 -10.114 36 HG2 ARG 5 HG2 ARG 5 6.962 -6.487 -11.737 37 HG3 ARG 5 HG1 ARG 5 8.060 -5.682 -12.858 38 HD2 ARG 5 HD2 ARG 5 9.568 -7.696 -12.730 39 HD3 ARG 5 HD1 ARG 5 8.331 -8.493 -11.767 40 HE ARG 5 HE ARG 5 6.961 -8.668 -13.673 41 HH11 ARG 5 HH21 ARG 5 9.911 -6.943 -14.323 42 HH12 ARG 5 HH22 ARG 5 9.659 -6.891 -16.035 43 HH21 ARG 5 HH11 ARG 5 6.632 -8.578 -15.921 44 HH22 ARG 5 HH12 ARG 5 7.809 -7.813 -16.936 45 H GLU 6 HN GLU 6 9.849 -2.726 -10.813 46 HA GLU 6 HA GLU 6 8.333 -1.803 -13.174 47 HB2 GLU 6 HB2 GLU 6 7.694 -0.538 -11.021 48 HB3 GLU 6 HB1 GLU 6 9.323 0.128 -11.055 49 HG2 GLU 6 HG2 GLU 6 7.919 1.720 -12.175 50 HG3 GLU 6 HG1 GLU 6 8.833 0.900 -13.437 51 H ALA 7 HN ALA 7 9.562 -0.599 -14.646 52 HA ALA 7 HA ALA 7 12.170 -1.457 -15.106 53 HB1 ALA 7 HB1 ALA 7 10.831 1.084 -16.062 54 HB2 ALA 7 HB2 ALA 7 10.781 -0.486 -16.865 55 HB3 ALA 7 HB3 ALA 7 12.304 0.395 -16.743 56 H ARG 8 HN ARG 8 14.170 -0.236 -15.114 57 HA ARG 8 HA ARG 8 14.574 1.190 -12.600 58 HB2 ARG 8 HB2 ARG 8 17.030 1.246 -13.560 59 HB3 ARG 8 HB1 ARG 8 16.359 -0.269 -12.970 60 HG2 ARG 8 HG2 ARG 8 15.834 0.284 -15.872 61 HG3 ARG 8 HG1 ARG 8 17.521 0.022 -15.456 62 HD2 ARG 8 HD2 ARG 8 16.923 -2.124 -14.374 63 HD3 ARG 8 HD1 ARG 8 15.233 -1.859 -14.796 64 HE ARG 8 HE ARG 8 15.733 -2.595 -16.928 65 HH11 ARG 8 HH21 ARG 8 18.623 -1.603 -15.292 66 HH12 ARG 8 HH22 ARG 8 19.672 -2.011 -16.610 67 HH21 ARG 8 HH11 ARG 8 17.108 -3.129 -18.656 68 HH22 ARG 8 HH12 ARG 8 18.813 -2.876 -18.509 69 H SER 9 HN SER 9 15.037 1.897 -16.058 70 HA SER 9 HA SER 9 15.112 4.810 -15.427 71 HB2 SER 9 HB2 SER 9 16.291 3.303 -17.771 72 HB3 SER 9 HB1 SER 9 16.317 5.052 -17.565 73 HG SER 9 HG SER 9 17.766 4.860 -16.009 74 H GLY 10 HN GLY 10 12.809 2.835 -16.025 75 HA2 GLY 10 HA3 GLY 10 11.550 4.456 -18.191 76 HA3 GLY 10 HA2 GLY 10 11.366 2.711 -18.093 77 H LYS 11 HN LYS 11 9.093 3.748 -18.176 78 HA LYS 11 HA LYS 11 7.994 3.606 -15.451 79 HB2 LYS 11 HB2 LYS 11 7.457 5.919 -17.343 80 HB3 LYS 11 HB1 LYS 11 6.536 5.587 -15.877 81 HG2 LYS 11 HG2 LYS 11 8.631 5.790 -14.544 82 HG3 LYS 11 HG1 LYS 11 9.498 6.217 -16.018 83 HD2 LYS 11 HD2 LYS 11 8.024 8.164 -16.337 84 HD3 LYS 11 HD1 LYS 11 7.162 7.750 -14.854 85 HE2 LYS 11 HE2 LYS 11 9.245 8.007 -13.559 86 HE3 LYS 11 HE1 LYS 11 10.115 8.416 -15.039 87 HZ1 LYS 11 HZ1 LYS 11 9.138 10.446 -15.168 88 HZ2 LYS 11 HZ2 LYS 11 9.097 10.254 -13.480 89 HZ3 LYS 11 HZ3 LYS 11 7.707 9.947 -14.408 90 H TYR 12 HN TYR 12 6.773 1.849 -15.717 91 HA TYR 12 HA TYR 12 5.141 0.430 -16.481 92 HB2 TYR 12 HB2 TYR 12 3.956 2.877 -17.822 93 HB3 TYR 12 HB1 TYR 12 3.116 1.425 -17.294 94 HD1 TYR 12 HD2 TYR 12 2.971 0.898 -14.819 95 HD2 TYR 12 HD1 TYR 12 4.352 4.688 -16.293 96 HE1 TYR 12 HE2 TYR 12 2.551 1.916 -12.597 97 HE2 TYR 12 HE1 TYR 12 3.927 5.706 -14.073 98 HH TYR 12 HH TYR 12 2.972 3.743 -11.302 99 H LYS 13 HN LYS 13 7.497 1.325 -18.277 100 HA LYS 13 HA LYS 13 6.502 0.966 -20.980 101 HB2 LYS 13 HB2 LYS 13 9.305 1.112 -19.847 102 HB3 LYS 13 HB1 LYS 13 8.930 0.999 -21.567 103 HG2 LYS 13 HG2 LYS 13 7.605 3.085 -21.407 104 HG3 LYS 13 HG1 LYS 13 8.014 3.205 -19.699 105 HD2 LYS 13 HD2 LYS 13 10.398 3.350 -20.263 106 HD3 LYS 13 HD1 LYS 13 10.010 3.186 -21.975 107 HE2 LYS 13 HE2 LYS 13 10.331 5.547 -21.475 108 HE3 LYS 13 HE1 LYS 13 8.625 5.268 -21.812 109 HZ1 LYS 13 HZ1 LYS 13 8.374 6.367 -19.881 110 HZ2 LYS 13 HZ2 LYS 13 9.934 5.993 -19.322 111 HZ3 LYS 13 HZ3 LYS 13 8.683 4.851 -19.188 112 H LEU 14 HN LEU 14 5.814 -1.174 -19.246 113 HA LEU 14 HA LEU 14 7.478 -3.426 -20.300 114 HB2 LEU 14 HB2 LEU 14 5.635 -3.541 -17.912 115 HB3 LEU 14 HB1 LEU 14 6.819 -4.735 -18.417 116 HG LEU 14 HG LEU 14 7.453 -1.930 -17.446 117 HD11 LEU 14 HD11 LEU 14 6.649 -3.535 -15.697 118 HD12 LEU 14 HD12 LEU 14 8.328 -3.047 -15.461 119 HD13 LEU 14 HD13 LEU 14 7.959 -4.627 -16.152 120 HD21 LEU 14 HD21 LEU 14 9.194 -4.209 -18.444 121 HD22 LEU 14 HD22 LEU 14 9.834 -2.938 -17.401 122 HD23 LEU 14 HD23 LEU 14 9.186 -2.529 -18.983 123 H THR 15 HN THR 15 6.582 -4.439 -21.935 124 HA THR 15 HA THR 15 3.624 -4.499 -22.201 125 HB THR 15 HB THR 15 5.754 -5.194 -24.240 126 HG1 THR 15 HG1 THR 15 4.745 -2.852 -23.364 127 HG21 THR 15 HG21 THR 15 2.728 -5.023 -24.333 128 HG22 THR 15 HG22 THR 15 3.771 -6.329 -24.898 129 HG23 THR 15 HG23 THR 15 3.707 -4.808 -25.782 130 H TYR 16 HN TYR 16 2.669 -6.505 -23.015 131 HA TYR 16 HA TYR 16 3.094 -8.685 -21.343 132 HB2 TYR 16 HB2 TYR 16 1.011 -8.449 -22.517 133 HB3 TYR 16 HB1 TYR 16 1.813 -8.472 -24.078 134 HD1 TYR 16 HD1 TYR 16 0.884 -10.542 -21.128 135 HD2 TYR 16 HD2 TYR 16 2.412 -10.561 -25.143 136 HE1 TYR 16 HE1 TYR 16 0.592 -12.999 -21.228 137 HE2 TYR 16 HE2 TYR 16 2.123 -13.020 -25.240 138 HH TYR 16 HH TYR 16 1.847 -14.940 -22.745 139 H ALA 17 HN ALA 17 4.183 -8.253 -24.713 140 HA ALA 17 HA ALA 17 5.520 -10.699 -24.982 141 HB1 ALA 17 HB1 ALA 17 6.716 -9.665 -26.826 142 HB2 ALA 17 HB2 ALA 17 6.288 -8.058 -26.242 143 HB3 ALA 17 HB3 ALA 17 5.032 -9.137 -26.853 144 H GLU 18 HN GLU 18 6.658 -7.594 -23.669 145 HA GLU 18 HA GLU 18 9.374 -8.374 -23.378 146 HB2 GLU 18 HB2 GLU 18 7.732 -6.314 -21.885 147 HB3 GLU 18 HB1 GLU 18 9.474 -6.504 -21.695 148 HG2 GLU 18 HG2 GLU 18 9.786 -6.079 -24.104 149 HG3 GLU 18 HG1 GLU 18 8.047 -5.889 -24.298 150 H ALA 19 HN ALA 19 6.662 -8.360 -21.063 151 HA ALA 19 HA ALA 19 8.000 -9.324 -18.826 152 HB1 ALA 19 HB1 ALA 19 5.174 -10.108 -19.573 153 HB2 ALA 19 HB2 ALA 19 5.598 -8.501 -18.984 154 HB3 ALA 19 HB3 ALA 19 5.853 -9.911 -17.957 155 H LYS 20 HN LYS 20 6.909 -11.045 -21.673 156 HA LYS 20 HA LYS 20 6.991 -13.680 -20.689 157 HB2 LYS 20 HB2 LYS 20 6.079 -12.887 -22.934 158 HB3 LYS 20 HB1 LYS 20 7.740 -12.808 -23.490 159 HG2 LYS 20 HG2 LYS 20 7.039 -14.952 -24.203 160 HG3 LYS 20 HG1 LYS 20 7.925 -15.290 -22.722 161 HD2 LYS 20 HD2 LYS 20 5.892 -15.565 -21.461 162 HD3 LYS 20 HD1 LYS 20 4.915 -14.902 -22.766 163 HE2 LYS 20 HE2 LYS 20 5.502 -16.827 -24.189 164 HE3 LYS 20 HE1 LYS 20 6.497 -17.486 -22.892 165 HZ1 LYS 20 HZ1 LYS 20 4.461 -17.470 -21.485 166 HZ2 LYS 20 HZ2 LYS 20 4.386 -18.542 -22.803 167 HZ3 LYS 20 HZ3 LYS 20 3.562 -17.058 -22.862 168 H ALA 21 HN ALA 21 9.516 -11.556 -21.950 169 HA ALA 21 HA ALA 21 11.561 -13.558 -22.032 170 HB1 ALA 21 HB1 ALA 21 13.100 -11.700 -22.330 171 HB2 ALA 21 HB2 ALA 21 11.862 -10.557 -21.804 172 HB3 ALA 21 HB3 ALA 21 11.661 -11.439 -23.319 173 H VAL 22 HN VAL 22 10.957 -10.882 -19.733 174 HA VAL 22 HA VAL 22 12.987 -11.561 -17.904 175 HB VAL 22 HB VAL 22 10.339 -10.166 -17.426 176 HG11 VAL 22 HG11 VAL 22 12.823 -10.421 -15.702 177 HG12 VAL 22 HG12 VAL 22 11.170 -10.860 -15.276 178 HG13 VAL 22 HG13 VAL 22 11.609 -9.165 -15.452 179 HG21 VAL 22 HG21 VAL 22 11.781 -8.122 -17.567 180 HG22 VAL 22 HG22 VAL 22 11.716 -9.026 -19.080 181 HG23 VAL 22 HG23 VAL 22 13.132 -9.154 -18.037 182 H CYS 23 HN CYS 23 9.582 -12.560 -18.048 183 HA CYS 23 HA CYS 23 10.012 -14.419 -15.762 184 HB2 CYS 23 HB2 CYS 23 7.456 -13.668 -17.204 185 HB3 CYS 23 HB1 CYS 23 7.586 -14.621 -15.727 186 H GLU 24 HN GLU 24 8.762 -16.542 -16.060 187 HA GLU 24 HA GLU 24 8.583 -18.581 -17.099 188 HB2 GLU 24 HB2 GLU 24 7.088 -17.280 -18.636 189 HB3 GLU 24 HB1 GLU 24 8.472 -17.012 -19.689 190 HG2 GLU 24 HG2 GLU 24 8.710 -19.356 -20.134 191 HG3 GLU 24 HG1 GLU 24 7.548 -19.777 -18.881 192 H PHE 25 HN PHE 25 11.168 -16.518 -17.587 193 HA PHE 25 HA PHE 25 12.791 -17.906 -19.427 194 HB2 PHE 25 HB2 PHE 25 13.249 -15.626 -18.659 195 HB3 PHE 25 HB1 PHE 25 13.570 -16.222 -17.034 196 HD1 PHE 25 HD1 PHE 25 14.736 -16.326 -20.572 197 HD2 PHE 25 HD2 PHE 25 15.711 -17.173 -16.471 198 HE1 PHE 25 HE1 PHE 25 17.099 -16.722 -21.212 199 HE2 PHE 25 HE2 PHE 25 18.072 -17.569 -17.116 200 HZ PHE 25 HZ PHE 25 18.765 -17.343 -19.486 201 H GLU 26 HN GLU 26 12.566 -18.133 -15.886 202 HA GLU 26 HA GLU 26 14.393 -20.422 -15.838 203 HB2 GLU 26 HB2 GLU 26 14.131 -20.309 -13.400 204 HB3 GLU 26 HB1 GLU 26 14.602 -18.751 -14.073 205 HG2 GLU 26 HG2 GLU 26 12.217 -18.042 -14.025 206 HG3 GLU 26 HG1 GLU 26 11.798 -19.578 -13.266 207 H GLY 27 HN GLY 27 11.609 -20.454 -17.069 208 HA2 GLY 27 HA3 GLY 27 10.230 -22.302 -17.449 209 HA3 GLY 27 HA2 GLY 27 10.846 -23.064 -15.989 210 H GLY 28 HN GLY 28 10.116 -19.984 -15.113 211 HA2 GLY 28 HA3 GLY 28 7.801 -20.755 -13.622 212 HA3 GLY 28 HA2 GLY 28 8.480 -19.134 -13.725 213 H HIS 29 HN HIS 29 6.402 -18.224 -13.887 214 HA HIS 29 HA HIS 29 5.442 -17.898 -16.566 215 HB2 HIS 29 HB2 HIS 29 4.438 -20.091 -16.076 216 HB3 HIS 29 HB1 HIS 29 3.677 -19.425 -14.634 217 HD1 HIS 29 HD1 HIS 29 1.840 -17.545 -15.032 218 HD2 HIS 29 HD2 HIS 29 3.074 -19.558 -18.466 219 HE1 HIS 29 HE1 HIS 29 0.121 -17.037 -16.814 220 HE2 HIS 29 HE2 HIS 29 0.854 -18.257 -18.917 221 H LEU 30 HN LEU 30 3.877 -16.230 -16.737 222 HA LEU 30 HA LEU 30 4.101 -14.147 -14.838 223 HB2 LEU 30 HB2 LEU 30 1.977 -14.556 -16.960 224 HB3 LEU 30 HB1 LEU 30 2.344 -13.033 -16.158 225 HG LEU 30 HG LEU 30 4.413 -14.568 -17.767 226 HD11 LEU 30 HD11 LEU 30 2.536 -12.353 -18.655 227 HD12 LEU 30 HD12 LEU 30 2.575 -14.003 -19.271 228 HD13 LEU 30 HD13 LEU 30 3.925 -12.916 -19.586 229 HD21 LEU 30 HD21 LEU 30 5.449 -12.261 -17.897 230 HD22 LEU 30 HD22 LEU 30 5.401 -12.917 -16.270 231 HD23 LEU 30 HD23 LEU 30 4.226 -11.701 -16.761 232 H ALA 31 HN ALA 31 2.817 -13.488 -13.190 233 HA ALA 31 HA ALA 31 1.120 -15.383 -11.921 234 HB1 ALA 31 HB1 ALA 31 0.761 -13.679 -10.259 235 HB2 ALA 31 HB2 ALA 31 1.293 -12.414 -11.366 236 HB3 ALA 31 HB3 ALA 31 2.449 -13.598 -10.758 237 H THR 32 HN THR 32 -0.704 -15.969 -12.945 238 HA THR 32 HA THR 32 -2.365 -14.109 -14.402 239 HB THR 32 HB THR 32 -2.327 -16.338 -15.246 240 HG1 THR 32 HG1 THR 32 -4.353 -15.515 -15.403 241 HG21 THR 32 HG21 THR 32 -1.610 -17.488 -13.183 242 HG22 THR 32 HG22 THR 32 -3.003 -18.281 -13.907 243 HG23 THR 32 HG23 THR 32 -3.215 -17.244 -12.507 244 H TYR 33 HN TYR 33 -4.856 -14.384 -13.897 245 HA TYR 33 HA TYR 33 -5.433 -12.890 -11.619 246 HB2 TYR 33 HB2 TYR 33 -7.007 -12.931 -13.402 247 HB3 TYR 33 HB1 TYR 33 -7.139 -14.683 -13.352 248 HD1 TYR 33 HD1 TYR 33 -8.032 -11.522 -11.605 249 HD2 TYR 33 HD2 TYR 33 -8.571 -15.786 -11.730 250 HE1 TYR 33 HE1 TYR 33 -9.936 -11.337 -10.024 251 HE2 TYR 33 HE2 TYR 33 -10.469 -15.594 -10.149 252 HH TYR 33 HH TYR 33 -11.419 -12.441 -8.790 253 H LYS 34 HN LYS 34 -5.943 -16.393 -12.095 254 HA LYS 34 HA LYS 34 -6.829 -16.982 -9.493 255 HB2 LYS 34 HB2 LYS 34 -7.005 -18.510 -11.450 256 HB3 LYS 34 HB1 LYS 34 -5.266 -18.775 -11.369 257 HG2 LYS 34 HG2 LYS 34 -5.494 -19.711 -9.106 258 HG3 LYS 34 HG1 LYS 34 -7.231 -19.396 -9.140 259 HD2 LYS 34 HD2 LYS 34 -7.464 -20.897 -11.088 260 HD3 LYS 34 HD1 LYS 34 -5.731 -21.219 -11.044 261 HE2 LYS 34 HE2 LYS 34 -6.899 -23.033 -9.914 262 HE3 LYS 34 HE1 LYS 34 -5.999 -22.100 -8.719 263 HZ1 LYS 34 HZ1 LYS 34 -8.299 -22.615 -8.042 264 HZ2 LYS 34 HZ2 LYS 34 -8.871 -21.692 -9.349 265 HZ3 LYS 34 HZ3 LYS 34 -7.985 -20.949 -8.104 266 H GLN 35 HN GLN 35 -3.547 -17.029 -10.868 267 HA GLN 35 HA GLN 35 -2.283 -17.882 -8.438 268 HB2 GLN 35 HB2 GLN 35 -1.178 -16.604 -10.953 269 HB3 GLN 35 HB1 GLN 35 -0.169 -17.140 -9.608 270 HG2 GLN 35 HG2 GLN 35 -1.060 -19.427 -9.845 271 HG3 GLN 35 HG1 GLN 35 -2.064 -18.897 -11.195 272 HE21 GLN 35 HE21 GLN 35 -1.090 -19.798 -13.031 273 HE22 GLN 35 HE22 GLN 35 0.561 -19.669 -13.401 274 H LEU 36 HN LEU 36 -3.141 -14.784 -9.819 275 HA LEU 36 HA LEU 36 -1.475 -13.144 -8.226 276 HB2 LEU 36 HB2 LEU 36 -3.954 -12.759 -9.847 277 HB3 LEU 36 HB1 LEU 36 -3.539 -11.466 -8.755 278 HG LEU 36 HG LEU 36 -1.508 -12.568 -10.723 279 HD11 LEU 36 HD11 LEU 36 -3.597 -10.401 -11.151 280 HD12 LEU 36 HD12 LEU 36 -3.352 -11.852 -12.117 281 HD13 LEU 36 HD13 LEU 36 -2.159 -10.561 -12.162 282 HD21 LEU 36 HD21 LEU 36 -1.825 -9.867 -9.348 283 HD22 LEU 36 HD22 LEU 36 -0.515 -10.308 -10.442 284 HD23 LEU 36 HD23 LEU 36 -0.663 -11.105 -8.884 285 H GLU 37 HN GLU 37 -4.760 -14.394 -7.723 286 HA GLU 37 HA GLU 37 -5.369 -12.948 -5.402 287 HB2 GLU 37 HB2 GLU 37 -7.271 -14.284 -5.271 288 HB3 GLU 37 HB1 GLU 37 -6.802 -14.577 -6.941 289 HG2 GLU 37 HG2 GLU 37 -7.172 -16.767 -6.145 290 HG3 GLU 37 HG1 GLU 37 -5.437 -16.594 -5.952 291 H ALA 38 HN ALA 38 -3.391 -15.774 -5.883 292 HA ALA 38 HA ALA 38 -3.281 -16.812 -3.299 293 HB1 ALA 38 HB1 ALA 38 -1.204 -17.841 -3.942 294 HB2 ALA 38 HB2 ALA 38 -0.933 -16.635 -5.203 295 HB3 ALA 38 HB3 ALA 38 -2.240 -17.806 -5.370 296 H ALA 39 HN ALA 39 -1.611 -14.041 -4.698 297 HA ALA 39 HA ALA 39 0.098 -13.615 -2.415 298 HB1 ALA 39 HB1 ALA 39 -0.601 -11.656 -4.606 299 HB2 ALA 39 HB2 ALA 39 0.647 -12.893 -4.754 300 HB3 ALA 39 HB3 ALA 39 0.809 -11.620 -3.545 301 H ARG 40 HN ARG 40 -2.912 -12.196 -3.626 302 HA ARG 40 HA ARG 40 -3.165 -10.105 -1.767 303 HB2 ARG 40 HB2 ARG 40 -5.522 -11.675 -2.829 304 HB3 ARG 40 HB1 ARG 40 -5.461 -9.969 -2.401 305 HG2 ARG 40 HG2 ARG 40 -3.908 -11.192 -4.704 306 HG3 ARG 40 HG1 ARG 40 -5.466 -10.415 -4.873 307 HD2 ARG 40 HD2 ARG 40 -3.055 -8.984 -3.721 308 HD3 ARG 40 HD1 ARG 40 -3.458 -8.975 -5.432 309 HE ARG 40 HE ARG 40 -5.700 -8.201 -3.823 310 HH11 ARG 40 HH21 ARG 40 -2.744 -7.175 -5.313 311 HH12 ARG 40 HH22 ARG 40 -3.127 -5.480 -5.221 312 HH21 ARG 40 HH11 ARG 40 -6.238 -5.999 -3.795 313 HH22 ARG 40 HH12 ARG 40 -5.118 -4.833 -4.403 314 H LYS 41 HN LYS 41 -3.795 -13.536 -1.441 315 HA LYS 41 HA LYS 41 -5.201 -13.290 1.071 316 HB2 LYS 41 HB2 LYS 41 -4.016 -15.614 -0.457 317 HB3 LYS 41 HB1 LYS 41 -4.620 -15.833 1.183 318 HG2 LYS 41 HG2 LYS 41 -6.831 -15.001 0.499 319 HG3 LYS 41 HG1 LYS 41 -6.238 -14.739 -1.140 320 HD2 LYS 41 HD2 LYS 41 -5.820 -17.117 -1.430 321 HD3 LYS 41 HD1 LYS 41 -6.220 -17.433 0.259 322 HE2 LYS 41 HE2 LYS 41 -8.532 -16.672 -0.140 323 HE3 LYS 41 HE1 LYS 41 -8.145 -16.352 -1.828 324 HZ1 LYS 41 HZ1 LYS 41 -7.498 -18.731 -2.009 325 HZ2 LYS 41 HZ2 LYS 41 -9.150 -18.485 -1.694 326 HZ3 LYS 41 HZ3 LYS 41 -8.109 -18.977 -0.443 327 H ILE 42 HN ILE 42 -1.951 -12.981 0.173 328 HA ILE 42 HA ILE 42 -0.916 -13.853 2.803 329 HB ILE 42 HB ILE 42 0.524 -12.965 0.282 330 HG12 ILE 42 HG12 ILE 42 0.342 -15.686 1.624 331 HG13 ILE 42 HG11 ILE 42 -0.640 -15.200 0.245 332 HG21 ILE 42 HG21 ILE 42 2.082 -12.374 1.950 333 HG22 ILE 42 HG22 ILE 42 2.516 -14.058 1.702 334 HG23 ILE 42 HG23 ILE 42 1.508 -13.607 3.072 335 HD11 ILE 42 HD11 ILE 42 2.354 -15.600 0.356 336 HD12 ILE 42 HD12 ILE 42 1.597 -14.697 -0.952 337 HD13 ILE 42 HD13 ILE 42 1.189 -16.393 -0.701 338 H GLY 43 HN GLY 43 -2.376 -11.182 1.678 339 HA2 GLY 43 HA3 GLY 43 -2.578 -9.190 2.937 340 HA3 GLY 43 HA2 GLY 43 -0.958 -9.422 3.578 341 H PHE 44 HN PHE 44 -1.073 -10.008 0.242 342 HA PHE 44 HA PHE 44 0.605 -7.807 -0.382 343 HB2 PHE 44 HB2 PHE 44 0.446 -10.054 -1.593 344 HB3 PHE 44 HB1 PHE 44 -1.005 -9.449 -2.358 345 HD1 PHE 44 HD1 PHE 44 2.598 -8.647 -1.797 346 HD2 PHE 44 HD2 PHE 44 -0.842 -8.085 -4.315 347 HE1 PHE 44 HE1 PHE 44 4.009 -7.497 -3.479 348 HE2 PHE 44 HE2 PHE 44 0.573 -6.935 -5.991 349 HZ PHE 44 HZ PHE 44 2.999 -6.642 -5.575 350 H HIS 45 HN HIS 45 0.083 -5.761 -0.810 351 HA HIS 45 HA HIS 45 -2.530 -5.105 -2.019 352 HB2 HIS 45 HB2 HIS 45 -2.911 -4.923 0.377 353 HB3 HIS 45 HB1 HIS 45 -1.463 -3.940 0.566 354 HD1 HIS 45 HD1 HIS 45 -4.078 -3.517 -2.161 355 HD2 HIS 45 HD2 HIS 45 -2.678 -1.516 1.218 356 HE1 HIS 45 HE1 HIS 45 -5.225 -1.257 -2.135 357 HE2 HIS 45 HE2 HIS 45 -4.383 -0.028 -0.082 358 H VAL 46 HN VAL 46 -1.776 -4.322 -3.878 359 HA VAL 46 HA VAL 46 -0.126 -1.870 -3.757 360 HB VAL 46 HB VAL 46 0.459 -4.177 -5.635 361 HG11 VAL 46 HG11 VAL 46 0.934 -2.055 -6.698 362 HG12 VAL 46 HG12 VAL 46 2.470 -2.729 -6.165 363 HG13 VAL 46 HG13 VAL 46 1.708 -1.436 -5.237 364 HG21 VAL 46 HG21 VAL 46 1.225 -4.729 -3.394 365 HG22 VAL 46 HG22 VAL 46 1.927 -3.124 -3.194 366 HG23 VAL 46 HG23 VAL 46 2.624 -4.255 -4.353 367 H CYS 47 HN CYS 47 -0.861 -0.327 -5.058 368 HA CYS 47 HA CYS 47 -3.158 -0.910 -6.806 369 HB2 CYS 47 HB2 CYS 47 -3.428 1.010 -5.386 370 HB3 CYS 47 HB1 CYS 47 -1.870 1.669 -5.880 371 H ALA 48 HN ALA 48 -2.189 -1.990 -8.514 372 HA ALA 48 HA ALA 48 -1.024 -0.285 -10.545 373 HB1 ALA 48 HB1 ALA 48 0.607 -2.648 -9.583 374 HB2 ALA 48 HB2 ALA 48 0.954 -0.974 -9.148 375 HB3 ALA 48 HB3 ALA 48 1.042 -1.485 -10.834 376 H ALA 49 HN ALA 49 -1.118 -1.185 -12.598 377 HA ALA 49 HA ALA 49 -2.504 -3.811 -12.845 378 HB1 ALA 49 HB1 ALA 49 -3.064 -1.239 -14.326 379 HB2 ALA 49 HB2 ALA 49 -4.129 -2.075 -13.200 380 HB3 ALA 49 HB3 ALA 49 -3.743 -2.807 -14.757 381 H GLY 50 HN GLY 50 -1.762 -5.163 -14.336 382 HA2 GLY 50 HA3 GLY 50 0.108 -4.208 -16.421 383 HA3 GLY 50 HA2 GLY 50 0.685 -5.410 -15.274 384 H TRP 51 HN TRP 51 0.911 -6.305 -17.628 385 HA TRP 51 HA TRP 51 -1.495 -7.566 -18.687 386 HB2 TRP 51 HB2 TRP 51 1.401 -7.928 -19.487 387 HB3 TRP 51 HB1 TRP 51 -0.015 -8.482 -20.371 388 HD1 TRP 51 HD1 TRP 51 2.296 -5.659 -20.215 389 HE1 TRP 51 HE1 TRP 51 1.356 -3.632 -21.493 390 HE3 TRP 51 HE3 TRP 51 -2.562 -7.131 -20.792 391 HZ2 TRP 51 HZ2 TRP 51 -1.106 -2.753 -22.618 392 HZ3 TRP 51 HZ3 TRP 51 -4.182 -5.671 -21.970 393 HH2 TRP 51 HH2 TRP 51 -3.454 -3.483 -22.879 394 H MET 52 HN MET 52 -1.710 -9.847 -18.925 395 HA MET 52 HA MET 52 0.033 -11.643 -17.464 396 HB2 MET 52 HB2 MET 52 -1.886 -12.509 -16.049 397 HB3 MET 52 HB1 MET 52 -1.253 -10.949 -15.568 398 HG2 MET 52 HG2 MET 52 -3.116 -9.776 -16.407 399 HG3 MET 52 HG1 MET 52 -3.602 -11.110 -17.460 400 HE1 MET 52 HE1 MET 52 -4.895 -9.358 -14.285 401 HE2 MET 52 HE2 MET 52 -6.312 -10.342 -14.636 402 HE3 MET 52 HE3 MET 52 -5.458 -9.544 -15.951 403 H ALA 53 HN ALA 53 -1.341 -13.855 -17.312 404 HA ALA 53 HA ALA 53 -1.365 -15.147 -19.637 405 HB1 ALA 53 HB1 ALA 53 -3.534 -15.406 -17.545 406 HB2 ALA 53 HB2 ALA 53 -2.002 -16.276 -17.599 407 HB3 ALA 53 HB3 ALA 53 -3.229 -16.585 -18.822 408 H LYS 54 HN LYS 54 -2.606 -15.492 -21.431 409 HA LYS 54 HA LYS 54 -3.921 -14.902 -23.191 410 HB2 LYS 54 HB2 LYS 54 -5.757 -14.562 -20.817 411 HB3 LYS 54 HB1 LYS 54 -6.322 -14.110 -22.420 412 HG2 LYS 54 HG2 LYS 54 -6.981 -16.404 -21.959 413 HG3 LYS 54 HG1 LYS 54 -5.764 -16.405 -23.232 414 HD2 LYS 54 HD2 LYS 54 -4.030 -17.054 -21.680 415 HD3 LYS 54 HD1 LYS 54 -5.107 -16.828 -20.301 416 HE2 LYS 54 HE2 LYS 54 -4.978 -19.197 -20.769 417 HE3 LYS 54 HE1 LYS 54 -6.577 -18.643 -21.255 418 HZ1 LYS 54 HZ1 LYS 54 -4.383 -18.647 -23.211 419 HZ2 LYS 54 HZ2 LYS 54 -6.057 -18.786 -23.470 420 HZ3 LYS 54 HZ3 LYS 54 -5.177 -20.099 -22.850 421 H GLY 55 HN GLY 55 -2.322 -12.790 -21.576 422 HA2 GLY 55 HA3 GLY 55 -1.765 -10.591 -21.882 423 HA3 GLY 55 HA2 GLY 55 -2.792 -10.613 -23.312 424 H ARG 56 HN ARG 56 -4.322 -11.583 -20.421 425 HA ARG 56 HA ARG 56 -6.188 -9.450 -20.533 426 HB2 ARG 56 HB2 ARG 56 -6.101 -11.981 -19.336 427 HB3 ARG 56 HB1 ARG 56 -5.991 -10.934 -17.956 428 HG2 ARG 56 HG2 ARG 56 -8.052 -9.816 -18.490 429 HG3 ARG 56 HG1 ARG 56 -8.151 -10.615 -20.060 430 HD2 ARG 56 HD2 ARG 56 -8.167 -12.074 -17.422 431 HD3 ARG 56 HD1 ARG 56 -9.614 -11.630 -18.297 432 HE ARG 56 HE ARG 56 -8.277 -12.989 -20.180 433 HH11 ARG 56 HH21 ARG 56 -8.768 -13.662 -16.814 434 HH12 ARG 56 HH22 ARG 56 -9.029 -15.364 -17.051 435 HH21 ARG 56 HH11 ARG 56 -8.562 -15.218 -20.486 436 HH22 ARG 56 HH12 ARG 56 -8.864 -16.247 -19.126 437 H VAL 57 HN VAL 57 -6.582 -7.806 -18.941 438 HA VAL 57 HA VAL 57 -4.212 -7.023 -17.308 439 HB VAL 57 HB VAL 57 -4.252 -5.668 -19.374 440 HG11 VAL 57 HG11 VAL 57 -6.868 -4.473 -18.452 441 HG12 VAL 57 HG12 VAL 57 -6.821 -5.828 -19.582 442 HG13 VAL 57 HG13 VAL 57 -6.049 -4.300 -20.004 443 HG21 VAL 57 HG21 VAL 57 -3.512 -4.741 -17.136 444 HG22 VAL 57 HG22 VAL 57 -5.121 -4.034 -16.967 445 HG23 VAL 57 HG23 VAL 57 -4.065 -3.521 -18.282 446 H GLY 58 HN GLY 58 -4.743 -6.968 -15.264 447 HA2 GLY 58 HA3 GLY 58 -7.522 -6.267 -14.450 448 HA3 GLY 58 HA2 GLY 58 -6.446 -7.344 -13.573 449 H TYR 59 HN TYR 59 -7.360 -5.669 -11.963 450 HA TYR 59 HA TYR 59 -5.202 -3.688 -11.504 451 HB2 TYR 59 HB2 TYR 59 -8.110 -2.965 -11.122 452 HB3 TYR 59 HB1 TYR 59 -6.715 -1.904 -11.009 453 HD1 TYR 59 HD1 TYR 59 -8.536 -4.125 -13.397 454 HD2 TYR 59 HD2 TYR 59 -6.036 -0.667 -12.944 455 HE1 TYR 59 HE1 TYR 59 -8.793 -3.627 -15.811 456 HE2 TYR 59 HE2 TYR 59 -6.282 -0.173 -15.362 457 HH TYR 59 HH TYR 59 -7.153 -2.218 -17.578 458 HA PRO 60 HA PRO 60 -6.309 -6.449 -7.849 459 HB2 PRO 60 HB2 PRO 60 -3.333 -6.040 -7.579 460 HB3 PRO 60 HB1 PRO 60 -4.292 -7.507 -7.278 461 HG2 PRO 60 HG2 PRO 60 -2.865 -7.313 -9.494 462 HG3 PRO 60 HG1 PRO 60 -4.512 -7.976 -9.563 463 HD2 PRO 60 HD2 PRO 60 -3.563 -5.228 -10.373 464 HD3 PRO 60 HD1 PRO 60 -4.762 -6.279 -11.161 465 H ILE 61 HN ILE 61 -7.270 -5.207 -6.339 466 HA ILE 61 HA ILE 61 -5.660 -3.231 -4.839 467 HB ILE 61 HB ILE 61 -8.313 -2.542 -6.153 468 HG12 ILE 61 HG12 ILE 61 -5.577 -1.239 -6.410 469 HG13 ILE 61 HG11 ILE 61 -6.228 -2.377 -7.574 470 HG21 ILE 61 HG21 ILE 61 -6.642 -1.096 -4.068 471 HG22 ILE 61 HG22 ILE 61 -8.331 -1.576 -3.938 472 HG23 ILE 61 HG23 ILE 61 -7.871 -0.278 -5.028 473 HD11 ILE 61 HD11 ILE 61 -7.479 0.266 -6.840 474 HD12 ILE 61 HD12 ILE 61 -8.140 -0.899 -7.989 475 HD13 ILE 61 HD13 ILE 61 -6.606 -0.099 -8.330 476 H VAL 62 HN VAL 62 -5.838 -3.789 -2.782 477 HA VAL 62 HA VAL 62 -7.966 -5.458 -1.793 478 HB VAL 62 HB VAL 62 -5.780 -3.988 -0.293 479 HG11 VAL 62 HG11 VAL 62 -6.290 -5.739 1.466 480 HG12 VAL 62 HG12 VAL 62 -7.734 -6.155 0.543 481 HG13 VAL 62 HG13 VAL 62 -7.566 -4.546 1.246 482 HG21 VAL 62 HG21 VAL 62 -4.828 -5.580 -1.838 483 HG22 VAL 62 HG22 VAL 62 -6.010 -6.807 -1.396 484 HG23 VAL 62 HG23 VAL 62 -4.773 -6.314 -0.238 485 H LYS 63 HN LYS 63 -7.423 -2.060 -2.050 486 HA LYS 63 HA LYS 63 -10.066 -1.512 -1.102 487 HB2 LYS 63 HB2 LYS 63 -9.282 0.067 0.751 488 HB3 LYS 63 HB1 LYS 63 -9.172 -1.659 1.093 489 HG2 LYS 63 HG2 LYS 63 -6.814 -1.698 0.760 490 HG3 LYS 63 HG1 LYS 63 -6.816 -0.143 -0.067 491 HD2 LYS 63 HD2 LYS 63 -5.943 0.037 2.251 492 HD3 LYS 63 HD1 LYS 63 -7.397 1.004 2.018 493 HE2 LYS 63 HE2 LYS 63 -8.756 -0.595 3.174 494 HE3 LYS 63 HE1 LYS 63 -7.479 -1.812 3.139 495 HZ1 LYS 63 HZ1 LYS 63 -7.968 0.058 5.117 496 HZ2 LYS 63 HZ2 LYS 63 -6.537 0.561 4.349 497 HZ3 LYS 63 HZ3 LYS 63 -6.649 -1.002 5.007 498 HA PRO 64 HA PRO 64 -9.849 1.935 -3.903 499 HB2 PRO 64 HB2 PRO 64 -10.702 3.581 -1.513 500 HB3 PRO 64 HB1 PRO 64 -11.325 3.623 -3.179 501 HG2 PRO 64 HG2 PRO 64 -12.639 2.344 -1.212 502 HG3 PRO 64 HG1 PRO 64 -12.630 1.736 -2.879 503 HD2 PRO 64 HD2 PRO 64 -11.269 0.601 -0.484 504 HD3 PRO 64 HD1 PRO 64 -11.692 -0.183 -2.023 505 H GLY 65 HN GLY 65 -8.341 3.469 -4.504 506 HA2 GLY 65 HA3 GLY 65 -6.491 4.545 -2.451 507 HA3 GLY 65 HA2 GLY 65 -5.828 3.646 -3.808 508 HA PRO 66 HA PRO 66 -6.486 8.223 -4.864 509 HB2 PRO 66 HB2 PRO 66 -3.927 9.158 -4.644 510 HB3 PRO 66 HB1 PRO 66 -5.020 9.071 -3.245 511 HG2 PRO 66 HG2 PRO 66 -2.883 7.131 -4.086 512 HG3 PRO 66 HG1 PRO 66 -3.204 7.811 -2.474 513 HD2 PRO 66 HD2 PRO 66 -4.092 5.326 -3.181 514 HD3 PRO 66 HD1 PRO 66 -5.019 6.377 -2.084 515 H ASN 67 HN ASN 67 -3.688 6.167 -5.644 516 HA ASN 67 HA ASN 67 -3.162 7.251 -8.202 517 HB2 ASN 67 HB2 ASN 67 -1.528 5.905 -6.954 518 HB3 ASN 67 HB1 ASN 67 -2.570 4.495 -7.097 519 HD21 ASN 67 HD21 ASN 67 -0.861 3.371 -8.324 520 HD22 ASN 67 HD22 ASN 67 -0.562 3.773 -9.946 521 H CYS 68 HN CYS 68 -5.293 4.688 -7.071 522 HA CYS 68 HA CYS 68 -6.303 4.297 -9.855 523 HB2 CYS 68 HB2 CYS 68 -7.303 2.137 -8.499 524 HB3 CYS 68 HB1 CYS 68 -5.769 2.118 -9.355 525 H GLY 69 HN GLY 69 -8.074 5.411 -10.201 526 HA2 GLY 69 HA3 GLY 69 -9.708 6.641 -8.330 527 HA3 GLY 69 HA2 GLY 69 -10.202 6.255 -9.976 528 H PHE 70 HN PHE 70 -11.658 6.142 -7.379 529 HA PHE 70 HA PHE 70 -13.075 4.750 -6.185 530 HB2 PHE 70 HB2 PHE 70 -13.277 3.615 -8.989 531 HB3 PHE 70 HB1 PHE 70 -14.375 3.190 -7.678 532 HD1 PHE 70 HD2 PHE 70 -15.897 4.894 -6.700 533 HD2 PHE 70 HD1 PHE 70 -13.404 5.782 -10.088 534 HE1 PHE 70 HE2 PHE 70 -17.269 6.900 -7.188 535 HE2 PHE 70 HE1 PHE 70 -14.781 7.785 -10.575 536 HZ PHE 70 HZ PHE 70 -16.713 8.343 -9.126 537 H GLY 71 HN GLY 71 -12.517 2.094 -8.307 538 HA2 GLY 71 HA3 GLY 71 -11.589 0.008 -8.009 539 HA3 GLY 71 HA2 GLY 71 -10.369 0.805 -7.021 540 H LYS 72 HN LYS 72 -13.093 -1.233 -7.031 541 HA LYS 72 HA LYS 72 -13.939 -0.908 -4.317 542 HB2 LYS 72 HB2 LYS 72 -14.292 -3.207 -6.264 543 HB3 LYS 72 HB1 LYS 72 -15.118 -3.069 -4.716 544 HG2 LYS 72 HG2 LYS 72 -16.146 -0.948 -5.445 545 HG3 LYS 72 HG1 LYS 72 -15.336 -1.100 -7.005 546 HD2 LYS 72 HD2 LYS 72 -16.495 -3.249 -7.397 547 HD3 LYS 72 HD1 LYS 72 -17.316 -3.085 -5.845 548 HE2 LYS 72 HE2 LYS 72 -18.383 -1.003 -6.618 549 HE3 LYS 72 HE1 LYS 72 -17.553 -1.152 -8.170 550 HZ1 LYS 72 HZ1 LYS 72 -19.857 -2.013 -8.185 551 HZ2 LYS 72 HZ2 LYS 72 -19.396 -3.199 -7.058 552 HZ3 LYS 72 HZ3 LYS 72 -18.705 -3.182 -8.609 553 H THR 73 HN THR 73 -14.000 -3.560 -3.425 554 HA THR 73 HA THR 73 -11.200 -3.889 -2.549 555 HB THR 73 HB THR 73 -12.049 -5.162 -0.740 556 HG1 THR 73 HG1 THR 73 -14.267 -5.798 -0.719 557 HG21 THR 73 HG21 THR 73 -14.086 -2.997 -1.324 558 HG22 THR 73 HG22 THR 73 -12.517 -2.747 -0.560 559 HG23 THR 73 HG23 THR 73 -13.753 -3.703 0.255 560 H GLY 74 HN GLY 74 -10.133 -5.859 -2.643 561 HA2 GLY 74 HA3 GLY 74 -9.530 -7.925 -3.490 562 HA3 GLY 74 HA2 GLY 74 -11.221 -8.196 -3.896 563 H ILE 75 HN ILE 75 -9.308 -9.085 -5.603 564 HA ILE 75 HA ILE 75 -8.509 -7.289 -7.633 565 HB ILE 75 HB ILE 75 -9.067 -10.260 -7.879 566 HG12 ILE 75 HG12 ILE 75 -6.428 -8.856 -7.319 567 HG13 ILE 75 HG11 ILE 75 -7.426 -9.571 -6.058 568 HG21 ILE 75 HG21 ILE 75 -7.363 -10.065 -9.730 569 HG22 ILE 75 HG22 ILE 75 -7.434 -8.314 -9.546 570 HG23 ILE 75 HG23 ILE 75 -8.863 -9.205 -10.069 571 HD11 ILE 75 HD11 ILE 75 -7.000 -11.748 -6.749 572 HD12 ILE 75 HD12 ILE 75 -5.473 -10.977 -7.170 573 HD13 ILE 75 HD13 ILE 75 -6.669 -11.287 -8.418 574 H ILE 76 HN ILE 76 -9.562 -6.414 -9.305 575 HA ILE 76 HA ILE 76 -12.433 -6.876 -9.581 576 HB ILE 76 HB ILE 76 -10.601 -4.973 -11.070 577 HG12 ILE 76 HG12 ILE 76 -12.515 -4.400 -8.776 578 HG13 ILE 76 HG11 ILE 76 -10.782 -4.633 -8.554 579 HG21 ILE 76 HG21 ILE 76 -12.621 -5.362 -12.348 580 HG22 ILE 76 HG22 ILE 76 -12.831 -3.816 -11.530 581 HG23 ILE 76 HG23 ILE 76 -13.623 -5.259 -10.902 582 HD11 ILE 76 HD11 ILE 76 -10.392 -2.764 -10.203 583 HD12 ILE 76 HD12 ILE 76 -11.183 -2.257 -8.712 584 HD13 ILE 76 HD13 ILE 76 -12.131 -2.466 -10.185 585 H ASP 77 HN ASP 77 -13.302 -8.197 -11.031 586 HA ASP 77 HA ASP 77 -11.738 -9.747 -12.827 587 HB2 ASP 77 HB2 ASP 77 -14.718 -9.306 -12.599 588 HB3 ASP 77 HB1 ASP 77 -13.997 -10.448 -13.728 589 H TYR 78 HN TYR 78 -11.204 -9.444 -14.895 590 HA TYR 78 HA TYR 78 -12.551 -7.400 -16.536 591 HB2 TYR 78 HB2 TYR 78 -9.695 -7.290 -15.601 592 HB3 TYR 78 HB1 TYR 78 -10.021 -6.789 -17.257 593 HD1 TYR 78 HD2 TYR 78 -11.760 -4.993 -17.686 594 HD2 TYR 78 HD1 TYR 78 -10.212 -5.823 -13.767 595 HE1 TYR 78 HE2 TYR 78 -12.517 -2.762 -16.915 596 HE2 TYR 78 HE1 TYR 78 -10.964 -3.590 -12.999 597 HH TYR 78 HH TYR 78 -12.655 -1.359 -15.209 598 H GLY 79 HN GLY 79 -12.131 -7.612 -18.787 599 HA2 GLY 79 HA3 GLY 79 -11.626 -10.395 -19.597 600 HA3 GLY 79 HA2 GLY 79 -12.397 -9.138 -20.557 601 H ILE 80 HN ILE 80 -10.948 -9.892 -22.258 602 HA ILE 80 HA ILE 80 -8.109 -9.118 -21.978 603 HB ILE 80 HB ILE 80 -9.550 -10.574 -24.210 604 HG12 ILE 80 HG12 ILE 80 -7.606 -11.657 -22.136 605 HG13 ILE 80 HG11 ILE 80 -9.355 -11.778 -21.967 606 HG21 ILE 80 HG21 ILE 80 -6.629 -9.896 -23.731 607 HG22 ILE 80 HG22 ILE 80 -7.618 -9.463 -25.124 608 HG23 ILE 80 HG23 ILE 80 -7.145 -11.137 -24.872 609 HD11 ILE 80 HD11 ILE 80 -7.618 -13.015 -24.118 610 HD12 ILE 80 HD12 ILE 80 -9.375 -12.934 -24.247 611 HD13 ILE 80 HD13 ILE 80 -8.629 -13.845 -22.939 612 H ARG 81 HN ARG 81 -8.128 -6.905 -22.128 613 HA ARG 81 HA ARG 81 -9.655 -5.469 -24.088 614 HB2 ARG 81 HB2 ARG 81 -7.349 -4.699 -22.279 615 HB3 ARG 81 HB1 ARG 81 -8.127 -3.555 -23.379 616 HG2 ARG 81 HG2 ARG 81 -10.285 -3.961 -22.314 617 HG3 ARG 81 HG1 ARG 81 -9.568 -5.161 -21.248 618 HD2 ARG 81 HD2 ARG 81 -8.216 -3.475 -20.177 619 HD3 ARG 81 HD1 ARG 81 -8.702 -2.260 -21.338 620 HE ARG 81 HE ARG 81 -10.151 -3.084 -19.008 621 HH11 ARG 81 HH21 ARG 81 -10.456 -1.987 -22.288 622 HH12 ARG 81 HH22 ARG 81 -12.029 -1.295 -22.052 623 HH21 ARG 81 HH11 ARG 81 -12.188 -2.134 -18.692 624 HH22 ARG 81 HH12 ARG 81 -12.997 -1.364 -20.016 625 H LEU 82 HN LEU 82 -9.047 -4.640 -26.030 626 HA LEU 82 HA LEU 82 -6.872 -5.973 -27.410 627 HB2 LEU 82 HB2 LEU 82 -9.185 -5.537 -28.369 628 HB3 LEU 82 HB1 LEU 82 -8.748 -3.839 -28.460 629 HG LEU 82 HG LEU 82 -6.846 -4.445 -29.978 630 HD11 LEU 82 HD11 LEU 82 -7.133 -6.838 -31.038 631 HD12 LEU 82 HD12 LEU 82 -7.915 -7.230 -29.509 632 HD13 LEU 82 HD13 LEU 82 -6.241 -6.676 -29.532 633 HD21 LEU 82 HD21 LEU 82 -9.071 -3.778 -30.847 634 HD22 LEU 82 HD22 LEU 82 -9.547 -5.477 -30.876 635 HD23 LEU 82 HD23 LEU 82 -8.251 -4.906 -31.926 636 H ASN 83 HN ASN 83 -6.867 -3.466 -25.370 637 HA ASN 83 HA ASN 83 -5.326 -1.515 -26.833 638 HB2 ASN 83 HB2 ASN 83 -5.098 -0.378 -24.702 639 HB3 ASN 83 HB1 ASN 83 -6.770 -0.882 -24.934 640 HD21 ASN 83 HD21 ASN 83 -5.601 -0.369 -22.335 641 HD22 ASN 83 HD22 ASN 83 -5.596 -1.836 -21.482 642 H ARG 84 HN ARG 84 -4.413 -4.399 -26.540 643 HA ARG 84 HA ARG 84 -2.147 -4.626 -24.926 644 HB2 ARG 84 HB2 ARG 84 -2.721 -5.844 -27.643 645 HB3 ARG 84 HB1 ARG 84 -1.409 -6.352 -26.580 646 HG2 ARG 84 HG2 ARG 84 -2.959 -7.019 -24.855 647 HG3 ARG 84 HG1 ARG 84 -4.318 -6.311 -25.726 648 HD2 ARG 84 HD2 ARG 84 -4.364 -8.700 -26.064 649 HD3 ARG 84 HD1 ARG 84 -3.902 -7.944 -27.580 650 HE ARG 84 HE ARG 84 -1.581 -8.662 -26.100 651 HH11 ARG 84 HH21 ARG 84 -4.181 -9.891 -28.029 652 HH12 ARG 84 HH22 ARG 84 -3.388 -11.382 -28.416 653 HH21 ARG 84 HH11 ARG 84 -0.523 -10.639 -26.604 654 HH22 ARG 84 HH12 ARG 84 -1.322 -11.804 -27.608 655 H SER 85 HN SER 85 -2.629 -2.323 -27.235 656 HA SER 85 HA SER 85 0.157 -2.175 -28.184 657 HB2 SER 85 HB2 SER 85 -0.649 -0.452 -29.677 658 HB3 SER 85 HB1 SER 85 -1.728 -1.839 -29.776 659 HG SER 85 HG SER 85 -3.222 -0.447 -29.295 660 H GLU 86 HN GLU 86 -1.603 -1.153 -25.552 661 HA GLU 86 HA GLU 86 -0.245 1.447 -25.240 662 HB2 GLU 86 HB2 GLU 86 -2.678 1.224 -24.711 663 HB3 GLU 86 HB1 GLU 86 -2.261 0.093 -23.426 664 HG2 GLU 86 HG2 GLU 86 -0.962 1.801 -22.275 665 HG3 GLU 86 HG1 GLU 86 -1.198 2.930 -23.607 666 H ARG 87 HN ARG 87 0.995 1.920 -23.379 667 HA ARG 87 HA ARG 87 2.628 -0.321 -22.451 668 HB2 ARG 87 HB2 ARG 87 2.834 2.661 -21.957 669 HB3 ARG 87 HB1 ARG 87 4.012 1.456 -21.433 670 HG2 ARG 87 HG2 ARG 87 4.419 0.794 -23.761 671 HG3 ARG 87 HG1 ARG 87 3.198 1.937 -24.318 672 HD2 ARG 87 HD2 ARG 87 5.646 2.759 -22.741 673 HD3 ARG 87 HD1 ARG 87 5.587 2.768 -24.496 674 HE ARG 87 HE ARG 87 3.403 4.234 -23.829 675 HH11 ARG 87 HH21 ARG 87 6.725 4.314 -22.829 676 HH12 ARG 87 HH22 ARG 87 6.760 6.035 -22.613 677 HH21 ARG 87 HH11 ARG 87 3.433 6.476 -23.495 678 HH22 ARG 87 HH12 ARG 87 4.885 7.253 -22.957 679 H TRP 88 HN TRP 88 2.638 -1.154 -20.450 680 HA TRP 88 HA TRP 88 1.288 0.158 -18.207 681 HB2 TRP 88 HB2 TRP 88 0.290 -2.415 -19.458 682 HB3 TRP 88 HB1 TRP 88 -0.059 -1.994 -17.784 683 HD1 TRP 88 HD1 TRP 88 -0.709 -0.778 -21.367 684 HE1 TRP 88 HE1 TRP 88 -2.812 0.714 -21.349 685 HE3 TRP 88 HE3 TRP 88 -1.548 -0.496 -16.337 686 HZ2 TRP 88 HZ2 TRP 88 -4.606 1.877 -19.454 687 HZ3 TRP 88 HZ3 TRP 88 -3.459 0.820 -15.457 688 HH2 TRP 88 HH2 TRP 88 -4.985 2.002 -17.007 689 H ASP 89 HN ASP 89 1.347 -1.466 -16.269 690 HA ASP 89 HA ASP 89 4.102 -2.127 -15.835 691 HB2 ASP 89 HB2 ASP 89 2.342 -1.287 -14.120 692 HB3 ASP 89 HB1 ASP 89 1.804 -2.956 -14.043 693 H ALA 90 HN ALA 90 4.112 -4.405 -14.375 694 HA ALA 90 HA ALA 90 2.823 -6.592 -15.781 695 HB1 ALA 90 HB1 ALA 90 5.799 -6.125 -16.079 696 HB2 ALA 90 HB2 ALA 90 4.594 -6.192 -17.366 697 HB3 ALA 90 HB3 ALA 90 4.996 -7.649 -16.459 698 H TYR 91 HN TYR 91 3.132 -8.606 -14.773 699 HA TYR 91 HA TYR 91 4.316 -8.503 -12.037 700 HB2 TYR 91 HB2 TYR 91 1.846 -9.958 -13.006 701 HB3 TYR 91 HB1 TYR 91 2.573 -10.172 -11.420 702 HD1 TYR 91 HD2 TYR 91 3.036 -7.923 -10.082 703 HD2 TYR 91 HD1 TYR 91 0.112 -8.332 -13.210 704 HE1 TYR 91 HE2 TYR 91 1.801 -5.966 -9.191 705 HE2 TYR 91 HE1 TYR 91 -1.124 -6.374 -12.309 706 HH TYR 91 HH TYR 91 -0.838 -5.226 -9.367 707 H CYS 92 HN CYS 92 5.122 -10.492 -11.231 708 HA CYS 92 HA CYS 92 5.745 -12.590 -13.237 709 HB2 CYS 92 HB2 CYS 92 7.612 -10.732 -12.773 710 HB3 CYS 92 HB1 CYS 92 7.943 -11.737 -11.368 711 H TYR 93 HN TYR 93 7.193 -14.291 -11.848 712 HA TYR 93 HA TYR 93 6.192 -14.725 -9.161 713 HB2 TYR 93 HB2 TYR 93 4.268 -15.468 -10.462 714 HB3 TYR 93 HB1 TYR 93 5.297 -16.504 -11.443 715 HD1 TYR 93 HD1 TYR 93 3.964 -15.953 -8.009 716 HD2 TYR 93 HD2 TYR 93 5.974 -18.680 -10.656 717 HE1 TYR 93 HE1 TYR 93 3.653 -17.784 -6.365 718 HE2 TYR 93 HE2 TYR 93 5.665 -20.505 -9.009 719 HH TYR 93 HH TYR 93 5.280 -20.384 -6.175 720 H ASN 94 HN ASN 94 7.996 -15.330 -8.193 721 HA ASN 94 HA ASN 94 9.454 -17.652 -9.196 722 HB2 ASN 94 HB2 ASN 94 11.677 -16.278 -8.918 723 HB3 ASN 94 HB1 ASN 94 10.748 -16.107 -10.402 724 HD21 ASN 94 HD21 ASN 94 10.264 -14.007 -10.992 725 HD22 ASN 94 HD22 ASN 94 10.263 -12.679 -9.936 726 HA PRO 95 HA PRO 95 9.911 -18.286 -4.842 727 HB2 PRO 95 HB2 PRO 95 12.056 -19.979 -4.733 728 HB3 PRO 95 HB1 PRO 95 10.490 -20.485 -5.408 729 HG2 PRO 95 HG2 PRO 95 12.928 -19.500 -6.865 730 HG3 PRO 95 HG1 PRO 95 11.930 -20.933 -7.202 731 HD2 PRO 95 HD2 PRO 95 11.575 -18.627 -8.588 732 HD3 PRO 95 HD1 PRO 95 10.195 -19.664 -8.158 733 H HIS 96 HN HIS 96 11.940 -16.357 -6.588 734 HA HIS 96 HA HIS 96 14.014 -15.937 -4.573 735 HB2 HIS 96 HB2 HIS 96 13.417 -14.534 -7.193 736 HB3 HIS 96 HB1 HIS 96 14.803 -14.193 -6.158 737 HD1 HIS 96 HD1 HIS 96 13.541 -16.585 -8.687 738 HD2 HIS 96 HD2 HIS 96 16.682 -16.409 -5.952 739 HE1 HIS 96 HE1 HIS 96 15.164 -18.414 -9.343 740 HE2 HIS 96 HE2 HIS 96 17.086 -18.319 -7.685 741 H ALA 97 HN ALA 97 14.428 -13.326 -4.467 742 HA ALA 97 HA ALA 97 13.796 -11.430 -3.351 743 HB1 ALA 97 HB1 ALA 97 12.364 -11.278 -5.447 744 HB2 ALA 97 HB2 ALA 97 11.753 -10.391 -4.054 745 HB3 ALA 97 HB3 ALA 97 11.033 -11.936 -4.496 746 H LYS 98 HN LYS 98 11.071 -10.941 -2.351 747 HA LYS 98 HA LYS 98 9.819 -11.377 -0.489 748 HB2 LYS 98 HB2 LYS 98 10.033 -13.775 -1.767 749 HB3 LYS 98 HB1 LYS 98 10.760 -14.222 -0.239 750 HG2 LYS 98 HG2 LYS 98 8.744 -13.528 0.961 751 HG3 LYS 98 HG1 LYS 98 8.029 -12.933 -0.540 752 HD2 LYS 98 HD2 LYS 98 8.116 -15.212 -1.491 753 HD3 LYS 98 HD1 LYS 98 8.811 -15.810 0.015 754 HE2 LYS 98 HE2 LYS 98 6.801 -15.127 1.238 755 HE3 LYS 98 HE1 LYS 98 6.107 -14.471 -0.245 756 HZ1 LYS 98 HZ1 LYS 98 5.930 -17.073 0.680 757 HZ2 LYS 98 HZ2 LYS 98 6.971 -17.130 -0.661 758 HZ3 LYS 98 HZ3 LYS 98 5.410 -16.478 -0.821 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 6.025 -16.638 -5.240 2 H2 GLY 1 H2 GLY 1 4.691 -17.375 -5.993 3 H3 GLY 1 H3 GLY 1 5.027 -17.689 -4.358 4 HA2 GLY 1 HA3 GLY 1 3.206 -16.180 -4.433 5 HA3 GLY 1 HA2 GLY 1 4.632 -15.305 -3.870 6 H VAL 2 HN VAL 2 4.764 -13.354 -4.755 7 HA VAL 2 HA VAL 2 4.477 -13.039 -7.667 8 HB VAL 2 HB VAL 2 2.927 -11.302 -5.724 9 HG11 VAL 2 HG11 VAL 2 3.623 -10.078 -7.705 10 HG12 VAL 2 HG12 VAL 2 1.911 -10.460 -7.867 11 HG13 VAL 2 HG13 VAL 2 3.110 -11.403 -8.753 12 HG21 VAL 2 HG21 VAL 2 2.042 -13.546 -7.574 13 HG22 VAL 2 HG22 VAL 2 0.928 -12.365 -6.883 14 HG23 VAL 2 HG23 VAL 2 1.823 -13.450 -5.825 15 H TYR 3 HN TYR 3 5.994 -11.756 -8.450 16 HA TYR 3 HA TYR 3 7.596 -10.095 -6.573 17 HB2 TYR 3 HB2 TYR 3 8.715 -11.932 -7.906 18 HB3 TYR 3 HB1 TYR 3 8.360 -11.003 -9.359 19 HD1 TYR 3 HD1 TYR 3 10.079 -10.841 -6.049 20 HD2 TYR 3 HD2 TYR 3 9.753 -9.148 -9.987 21 HE1 TYR 3 HE1 TYR 3 12.098 -9.466 -5.627 22 HE2 TYR 3 HE2 TYR 3 11.774 -7.774 -9.561 23 HH TYR 3 HH TYR 3 12.921 -6.849 -7.270 24 H HIS 4 HN HIS 4 7.568 -7.963 -6.731 25 HA HIS 4 HA HIS 4 5.872 -6.665 -8.695 26 HB2 HIS 4 HB2 HIS 4 6.403 -4.597 -7.499 27 HB3 HIS 4 HB1 HIS 4 5.894 -5.862 -6.385 28 HD1 HIS 4 HD1 HIS 4 7.943 -7.187 -5.171 29 HD2 HIS 4 HD2 HIS 4 8.875 -3.509 -6.897 30 HE1 HIS 4 HE1 HIS 4 10.124 -6.438 -4.126 31 HE2 HIS 4 HE2 HIS 4 10.706 -4.197 -5.170 32 H ARG 5 HN ARG 5 6.493 -5.119 -10.212 33 HA ARG 5 HA ARG 5 9.375 -5.059 -10.965 34 HB2 ARG 5 HB2 ARG 5 7.020 -5.314 -12.851 35 HB3 ARG 5 HB1 ARG 5 8.706 -5.157 -13.325 36 HG2 ARG 5 HG2 ARG 5 7.667 -7.432 -11.605 37 HG3 ARG 5 HG1 ARG 5 7.806 -7.531 -13.361 38 HD2 ARG 5 HD2 ARG 5 10.264 -6.945 -13.096 39 HD3 ARG 5 HD1 ARG 5 10.052 -7.136 -11.358 40 HE ARG 5 HE ARG 5 9.110 -9.461 -12.645 41 HH11 ARG 5 HH21 ARG 5 11.984 -7.661 -11.963 42 HH12 ARG 5 HH22 ARG 5 13.027 -9.044 -11.971 43 HH21 ARG 5 HH11 ARG 5 10.473 -11.291 -12.651 44 HH22 ARG 5 HH12 ARG 5 12.171 -11.099 -12.363 45 H GLU 6 HN GLU 6 10.059 -3.241 -12.097 46 HA GLU 6 HA GLU 6 8.330 -0.959 -12.462 47 HB2 GLU 6 HB2 GLU 6 8.739 -0.908 -10.017 48 HB3 GLU 6 HB1 GLU 6 10.474 -0.872 -10.321 49 HG2 GLU 6 HG2 GLU 6 10.254 1.261 -11.505 50 HG3 GLU 6 HG1 GLU 6 8.503 1.209 -11.315 51 H ALA 7 HN ALA 7 9.119 0.285 -14.027 52 HA ALA 7 HA ALA 7 11.495 -0.454 -15.423 53 HB1 ALA 7 HB1 ALA 7 9.684 1.951 -15.662 54 HB2 ALA 7 HB2 ALA 7 9.662 0.495 -16.655 55 HB3 ALA 7 HB3 ALA 7 11.015 1.622 -16.764 56 H ARG 8 HN ARG 8 13.528 0.161 -15.110 57 HA ARG 8 HA ARG 8 14.224 1.957 -12.989 58 HB2 ARG 8 HB2 ARG 8 15.555 -0.073 -13.538 59 HB3 ARG 8 HB1 ARG 8 15.988 0.650 -15.078 60 HG2 ARG 8 HG2 ARG 8 17.823 0.975 -13.503 61 HG3 ARG 8 HG1 ARG 8 17.090 2.540 -13.846 62 HD2 ARG 8 HD2 ARG 8 15.941 2.564 -11.737 63 HD3 ARG 8 HD1 ARG 8 16.282 0.859 -11.449 64 HE ARG 8 HE ARG 8 18.697 2.362 -11.676 65 HH11 ARG 8 HH21 ARG 8 16.020 1.582 -9.634 66 HH12 ARG 8 HH22 ARG 8 16.782 2.121 -8.175 67 HH21 ARG 8 HH11 ARG 8 19.708 3.103 -9.758 68 HH22 ARG 8 HH12 ARG 8 18.868 2.988 -8.247 69 H SER 9 HN SER 9 14.383 2.031 -16.507 70 HA SER 9 HA SER 9 15.183 4.900 -16.448 71 HB2 SER 9 HB2 SER 9 15.869 4.494 -18.814 72 HB3 SER 9 HB1 SER 9 16.768 3.528 -17.649 73 HG SER 9 HG SER 9 14.870 2.775 -19.540 74 H GLY 10 HN GLY 10 12.423 3.727 -16.123 75 HA2 GLY 10 HA3 GLY 10 11.089 5.556 -17.919 76 HA3 GLY 10 HA2 GLY 10 10.792 3.868 -18.319 77 H LYS 11 HN LYS 11 8.674 3.787 -17.799 78 HA LYS 11 HA LYS 11 7.986 3.499 -15.022 79 HB2 LYS 11 HB2 LYS 11 6.086 5.241 -15.220 80 HB3 LYS 11 HB1 LYS 11 7.715 5.853 -14.961 81 HG2 LYS 11 HG2 LYS 11 7.956 6.296 -17.369 82 HG3 LYS 11 HG1 LYS 11 6.339 5.661 -17.661 83 HD2 LYS 11 HD2 LYS 11 5.391 7.402 -16.185 84 HD3 LYS 11 HD1 LYS 11 7.011 8.048 -15.922 85 HE2 LYS 11 HE2 LYS 11 7.233 8.514 -18.322 86 HE3 LYS 11 HE1 LYS 11 5.633 7.834 -18.615 87 HZ1 LYS 11 HZ1 LYS 11 4.597 9.581 -17.571 88 HZ2 LYS 11 HZ2 LYS 11 5.905 10.373 -18.310 89 HZ3 LYS 11 HZ3 LYS 11 5.961 10.000 -16.654 90 H TYR 12 HN TYR 12 7.474 1.425 -15.763 91 HA TYR 12 HA TYR 12 5.962 -0.208 -16.298 92 HB2 TYR 12 HB2 TYR 12 3.933 1.824 -17.234 93 HB3 TYR 12 HB1 TYR 12 3.672 0.286 -16.431 94 HD1 TYR 12 HD2 TYR 12 5.337 0.326 -14.072 95 HD2 TYR 12 HD1 TYR 12 3.109 3.557 -15.842 96 HE1 TYR 12 HE2 TYR 12 5.201 1.450 -11.870 97 HE2 TYR 12 HE1 TYR 12 2.977 4.668 -13.635 98 HH TYR 12 HH TYR 12 3.592 3.143 -10.766 99 H LYS 13 HN LYS 13 7.783 1.240 -18.247 100 HA LYS 13 HA LYS 13 6.499 1.123 -20.812 101 HB2 LYS 13 HB2 LYS 13 8.784 1.376 -21.712 102 HB3 LYS 13 HB1 LYS 13 8.361 2.611 -20.530 103 HG2 LYS 13 HG2 LYS 13 9.660 1.557 -18.809 104 HG3 LYS 13 HG1 LYS 13 9.889 0.101 -19.772 105 HD2 LYS 13 HD2 LYS 13 11.157 1.387 -21.437 106 HD3 LYS 13 HD1 LYS 13 10.922 2.853 -20.487 107 HE2 LYS 13 HE2 LYS 13 13.174 1.621 -20.182 108 HE3 LYS 13 HE1 LYS 13 12.306 2.053 -18.713 109 HZ1 LYS 13 HZ1 LYS 13 11.671 -0.109 -18.343 110 HZ2 LYS 13 HZ2 LYS 13 13.213 -0.337 -19.018 111 HZ3 LYS 13 HZ3 LYS 13 11.824 -0.560 -19.971 112 H LEU 14 HN LEU 14 5.912 -1.266 -19.624 113 HA LEU 14 HA LEU 14 7.583 -3.223 -21.130 114 HB2 LEU 14 HB2 LEU 14 6.223 -3.638 -18.453 115 HB3 LEU 14 HB1 LEU 14 7.031 -4.882 -19.396 116 HG LEU 14 HG LEU 14 9.075 -3.098 -19.301 117 HD11 LEU 14 HD11 LEU 14 9.191 -1.994 -17.130 118 HD12 LEU 14 HD12 LEU 14 7.607 -2.632 -16.687 119 HD13 LEU 14 HD13 LEU 14 7.750 -1.446 -17.983 120 HD21 LEU 14 HD21 LEU 14 9.924 -4.336 -17.302 121 HD22 LEU 14 HD22 LEU 14 9.251 -5.405 -18.536 122 HD23 LEU 14 HD23 LEU 14 8.316 -5.030 -17.086 123 H THR 15 HN THR 15 6.564 -4.427 -22.545 124 HA THR 15 HA THR 15 3.605 -4.344 -22.659 125 HB THR 15 HB THR 15 3.829 -4.978 -24.971 126 HG1 THR 15 HG1 THR 15 5.515 -6.025 -25.586 127 HG21 THR 15 HG21 THR 15 4.212 -2.580 -24.317 128 HG22 THR 15 HG22 THR 15 4.986 -3.042 -25.833 129 HG23 THR 15 HG23 THR 15 5.947 -2.903 -24.360 130 H TYR 16 HN TYR 16 2.615 -6.367 -23.567 131 HA TYR 16 HA TYR 16 2.914 -8.498 -21.787 132 HB2 TYR 16 HB2 TYR 16 0.876 -8.194 -23.033 133 HB3 TYR 16 HB1 TYR 16 1.715 -8.370 -24.560 134 HD1 TYR 16 HD1 TYR 16 0.878 -10.199 -21.403 135 HD2 TYR 16 HD2 TYR 16 1.950 -10.535 -25.553 136 HE1 TYR 16 HE1 TYR 16 0.440 -12.634 -21.321 137 HE2 TYR 16 HE2 TYR 16 1.518 -12.972 -25.463 138 HH TYR 16 HH TYR 16 -0.166 -14.472 -23.716 139 H ALA 17 HN ALA 17 4.079 -8.231 -25.149 140 HA ALA 17 HA ALA 17 5.353 -10.732 -25.268 141 HB1 ALA 17 HB1 ALA 17 6.581 -9.841 -27.163 142 HB2 ALA 17 HB2 ALA 17 6.196 -8.190 -26.675 143 HB3 ALA 17 HB3 ALA 17 4.915 -9.266 -27.231 144 H GLU 18 HN GLU 18 6.561 -7.576 -24.163 145 HA GLU 18 HA GLU 18 9.255 -8.455 -23.764 146 HB2 GLU 18 HB2 GLU 18 7.699 -6.137 -22.587 147 HB3 GLU 18 HB1 GLU 18 9.421 -6.393 -22.313 148 HG2 GLU 18 HG2 GLU 18 9.855 -6.254 -24.716 149 HG3 GLU 18 HG1 GLU 18 8.132 -6.080 -25.038 150 H ALA 19 HN ALA 19 6.563 -7.923 -21.476 151 HA ALA 19 HA ALA 19 7.800 -8.697 -19.123 152 HB1 ALA 19 HB1 ALA 19 5.553 -9.289 -18.307 153 HB2 ALA 19 HB2 ALA 19 4.946 -9.262 -19.963 154 HB3 ALA 19 HB3 ALA 19 5.528 -7.774 -19.213 155 H LYS 20 HN LYS 20 6.653 -10.714 -21.748 156 HA LYS 20 HA LYS 20 6.720 -13.193 -20.354 157 HB2 LYS 20 HB2 LYS 20 5.629 -12.535 -22.635 158 HB3 LYS 20 HB1 LYS 20 7.200 -12.920 -23.324 159 HG2 LYS 20 HG2 LYS 20 7.084 -15.194 -22.430 160 HG3 LYS 20 HG1 LYS 20 5.580 -14.820 -21.592 161 HD2 LYS 20 HD2 LYS 20 4.869 -15.925 -23.566 162 HD3 LYS 20 HD1 LYS 20 4.613 -14.214 -23.900 163 HE2 LYS 20 HE2 LYS 20 6.585 -14.100 -25.270 164 HE3 LYS 20 HE1 LYS 20 7.141 -15.683 -24.727 165 HZ1 LYS 20 HZ1 LYS 20 4.929 -15.022 -26.549 166 HZ2 LYS 20 HZ2 LYS 20 4.913 -16.486 -25.686 167 HZ3 LYS 20 HZ3 LYS 20 6.188 -16.140 -26.755 168 H ALA 21 HN ALA 21 9.126 -11.284 -22.069 169 HA ALA 21 HA ALA 21 11.117 -13.282 -22.314 170 HB1 ALA 21 HB1 ALA 21 12.651 -11.470 -22.726 171 HB2 ALA 21 HB2 ALA 21 11.558 -10.312 -21.971 172 HB3 ALA 21 HB3 ALA 21 11.115 -11.077 -23.496 173 H VAL 22 HN VAL 22 10.710 -10.734 -19.841 174 HA VAL 22 HA VAL 22 12.890 -11.492 -18.223 175 HB VAL 22 HB VAL 22 10.301 -10.144 -17.406 176 HG11 VAL 22 HG11 VAL 22 13.030 -10.329 -16.089 177 HG12 VAL 22 HG12 VAL 22 11.493 -10.897 -15.437 178 HG13 VAL 22 HG13 VAL 22 11.791 -9.169 -15.606 179 HG21 VAL 22 HG21 VAL 22 12.961 -9.017 -18.342 180 HG22 VAL 22 HG22 VAL 22 11.608 -8.058 -17.741 181 HG23 VAL 22 HG23 VAL 22 11.445 -8.971 -19.240 182 H CYS 23 HN CYS 23 9.520 -12.535 -18.255 183 HA CYS 23 HA CYS 23 10.024 -14.429 -16.028 184 HB2 CYS 23 HB2 CYS 23 7.410 -13.708 -17.380 185 HB3 CYS 23 HB1 CYS 23 7.618 -14.640 -15.898 186 H GLU 24 HN GLU 24 8.606 -16.510 -16.400 187 HA GLU 24 HA GLU 24 8.227 -18.472 -17.560 188 HB2 GLU 24 HB2 GLU 24 7.279 -16.944 -19.353 189 HB3 GLU 24 HB1 GLU 24 8.862 -16.971 -20.117 190 HG2 GLU 24 HG2 GLU 24 8.773 -19.364 -20.375 191 HG3 GLU 24 HG1 GLU 24 7.241 -19.443 -19.508 192 H PHE 25 HN PHE 25 11.100 -16.594 -18.139 193 HA PHE 25 HA PHE 25 12.736 -18.536 -19.360 194 HB2 PHE 25 HB2 PHE 25 13.314 -16.153 -19.218 195 HB3 PHE 25 HB1 PHE 25 13.479 -16.288 -17.470 196 HD1 PHE 25 HD1 PHE 25 14.859 -17.461 -20.727 197 HD2 PHE 25 HD2 PHE 25 15.502 -17.148 -16.488 198 HE1 PHE 25 HE1 PHE 25 17.220 -18.155 -21.031 199 HE2 PHE 25 HE2 PHE 25 17.862 -17.847 -16.796 200 HZ PHE 25 HZ PHE 25 18.719 -18.349 -19.067 201 H GLU 26 HN GLU 26 12.235 -17.739 -15.930 202 HA GLU 26 HA GLU 26 13.901 -19.987 -15.069 203 HB2 GLU 26 HB2 GLU 26 13.375 -19.223 -12.782 204 HB3 GLU 26 HB1 GLU 26 14.067 -17.943 -13.771 205 HG2 GLU 26 HG2 GLU 26 11.067 -18.273 -13.422 206 HG3 GLU 26 HG1 GLU 26 12.041 -17.301 -12.329 207 H GLY 27 HN GLY 27 11.058 -20.039 -16.421 208 HA2 GLY 27 HA3 GLY 27 9.636 -21.919 -16.476 209 HA3 GLY 27 HA2 GLY 27 10.116 -22.339 -14.838 210 H GLY 28 HN GLY 28 9.675 -19.405 -14.089 211 HA2 GLY 28 HA3 GLY 28 6.925 -19.708 -13.254 212 HA3 GLY 28 HA2 GLY 28 7.992 -18.355 -12.889 213 H HIS 29 HN HIS 29 5.150 -18.800 -14.108 214 HA HIS 29 HA HIS 29 5.437 -17.203 -16.586 215 HB2 HIS 29 HB2 HIS 29 3.018 -18.594 -15.405 216 HB3 HIS 29 HB1 HIS 29 3.093 -17.796 -16.976 217 HD1 HIS 29 HD1 HIS 29 4.800 -18.873 -18.749 218 HD2 HIS 29 HD2 HIS 29 4.017 -21.204 -15.382 219 HE1 HIS 29 HE1 HIS 29 5.601 -21.214 -19.296 220 HE2 HIS 29 HE2 HIS 29 5.131 -22.645 -17.253 221 H LEU 30 HN LEU 30 3.571 -15.585 -16.883 222 HA LEU 30 HA LEU 30 3.845 -13.528 -14.937 223 HB2 LEU 30 HB2 LEU 30 1.723 -13.739 -17.094 224 HB3 LEU 30 HB1 LEU 30 2.308 -12.269 -16.321 225 HG LEU 30 HG LEU 30 4.060 -14.102 -18.000 226 HD11 LEU 30 HD11 LEU 30 2.613 -11.536 -18.731 227 HD12 LEU 30 HD12 LEU 30 2.315 -13.138 -19.408 228 HD13 LEU 30 HD13 LEU 30 3.840 -12.313 -19.735 229 HD21 LEU 30 HD21 LEU 30 4.437 -11.321 -16.836 230 HD22 LEU 30 HD22 LEU 30 5.493 -11.999 -18.073 231 HD23 LEU 30 HD23 LEU 30 5.396 -12.758 -16.491 232 H ALA 31 HN ALA 31 2.548 -12.917 -13.284 233 HA ALA 31 HA ALA 31 0.839 -14.732 -12.038 234 HB1 ALA 31 HB1 ALA 31 1.918 -12.756 -10.951 235 HB2 ALA 31 HB2 ALA 31 0.202 -12.922 -10.578 236 HB3 ALA 31 HB3 ALA 31 0.736 -11.723 -11.756 237 H THR 32 HN THR 32 -1.307 -15.094 -12.048 238 HA THR 32 HA THR 32 -2.988 -13.613 -14.016 239 HB THR 32 HB THR 32 -3.952 -15.608 -14.765 240 HG1 THR 32 HG1 THR 32 -3.232 -16.496 -12.226 241 HG21 THR 32 HG21 THR 32 -2.161 -17.073 -15.381 242 HG22 THR 32 HG22 THR 32 -1.212 -16.615 -13.967 243 HG23 THR 32 HG23 THR 32 -1.455 -15.459 -15.278 244 H TYR 33 HN TYR 33 -5.368 -14.099 -13.578 245 HA TYR 33 HA TYR 33 -6.105 -12.950 -11.127 246 HB2 TYR 33 HB2 TYR 33 -7.535 -12.810 -13.076 247 HB3 TYR 33 HB1 TYR 33 -7.698 -14.561 -13.135 248 HD1 TYR 33 HD2 TYR 33 -8.940 -15.769 -11.336 249 HD2 TYR 33 HD1 TYR 33 -8.898 -11.477 -11.563 250 HE1 TYR 33 HE2 TYR 33 -10.911 -15.670 -9.837 251 HE2 TYR 33 HE1 TYR 33 -10.877 -11.384 -10.068 252 HH TYR 33 HH TYR 33 -12.038 -12.687 -8.472 253 H LYS 34 HN LYS 34 -6.451 -16.333 -12.216 254 HA LYS 34 HA LYS 34 -7.456 -17.360 -9.794 255 HB2 LYS 34 HB2 LYS 34 -5.876 -18.683 -12.016 256 HB3 LYS 34 HB1 LYS 34 -6.630 -19.568 -10.689 257 HG2 LYS 34 HG2 LYS 34 -8.834 -18.676 -11.332 258 HG3 LYS 34 HG1 LYS 34 -8.090 -17.770 -12.652 259 HD2 LYS 34 HD2 LYS 34 -7.347 -19.846 -13.707 260 HD3 LYS 34 HD1 LYS 34 -7.983 -20.788 -12.357 261 HE2 LYS 34 HE2 LYS 34 -9.577 -20.844 -14.209 262 HE3 LYS 34 HE1 LYS 34 -10.263 -19.925 -12.870 263 HZ1 LYS 34 HZ1 LYS 34 -9.724 -17.895 -13.943 264 HZ2 LYS 34 HZ2 LYS 34 -10.509 -18.869 -15.093 265 HZ3 LYS 34 HZ3 LYS 34 -8.820 -18.683 -15.144 266 H GLN 35 HN GLN 35 -4.123 -17.142 -11.020 267 HA GLN 35 HA GLN 35 -2.926 -18.380 -8.747 268 HB2 GLN 35 HB2 GLN 35 -1.760 -16.565 -10.871 269 HB3 GLN 35 HB1 GLN 35 -0.803 -17.391 -9.642 270 HG2 GLN 35 HG2 GLN 35 -1.678 -19.569 -10.448 271 HG3 GLN 35 HG1 GLN 35 -2.575 -18.725 -11.711 272 HE21 GLN 35 HE21 GLN 35 -1.456 -19.131 -13.637 273 HE22 GLN 35 HE22 GLN 35 0.222 -18.959 -13.828 274 H LEU 36 HN LEU 36 -3.743 -15.064 -9.596 275 HA LEU 36 HA LEU 36 -2.261 -13.770 -7.571 276 HB2 LEU 36 HB2 LEU 36 -4.621 -13.050 -9.274 277 HB3 LEU 36 HB1 LEU 36 -4.292 -12.016 -7.917 278 HG LEU 36 HG LEU 36 -2.097 -12.710 -9.889 279 HD11 LEU 36 HD11 LEU 36 -3.869 -11.725 -11.230 280 HD12 LEU 36 HD12 LEU 36 -2.634 -10.493 -10.965 281 HD13 LEU 36 HD13 LEU 36 -4.129 -10.459 -10.031 282 HD21 LEU 36 HD21 LEU 36 -1.379 -11.659 -7.762 283 HD22 LEU 36 HD22 LEU 36 -2.559 -10.373 -7.988 284 HD23 LEU 36 HD23 LEU 36 -1.193 -10.519 -9.087 285 H GLU 37 HN GLU 37 -5.543 -15.118 -7.605 286 HA GLU 37 HA GLU 37 -6.465 -14.148 -5.166 287 HB2 GLU 37 HB2 GLU 37 -7.834 -15.411 -6.796 288 HB3 GLU 37 HB1 GLU 37 -6.973 -16.884 -6.358 289 HG2 GLU 37 HG2 GLU 37 -7.783 -16.718 -4.058 290 HG3 GLU 37 HG1 GLU 37 -8.559 -15.177 -4.418 291 H ALA 38 HN ALA 38 -4.422 -16.967 -5.825 292 HA ALA 38 HA ALA 38 -4.382 -18.008 -3.197 293 HB1 ALA 38 HB1 ALA 38 -2.438 -19.266 -3.890 294 HB2 ALA 38 HB2 ALA 38 -2.154 -18.163 -5.238 295 HB3 ALA 38 HB3 ALA 38 -3.573 -19.207 -5.240 296 H ALA 39 HN ALA 39 -2.332 -15.608 -4.801 297 HA ALA 39 HA ALA 39 -0.663 -15.241 -2.429 298 HB1 ALA 39 HB1 ALA 39 -0.711 -13.740 -5.055 299 HB2 ALA 39 HB2 ALA 39 0.342 -15.099 -4.661 300 HB3 ALA 39 HB3 ALA 39 0.507 -13.575 -3.788 301 H ARG 40 HN ARG 40 -3.457 -13.788 -3.892 302 HA ARG 40 HA ARG 40 -3.320 -11.188 -2.867 303 HB2 ARG 40 HB2 ARG 40 -5.023 -12.085 -4.507 304 HB3 ARG 40 HB1 ARG 40 -5.844 -12.831 -3.144 305 HG2 ARG 40 HG2 ARG 40 -6.918 -10.720 -3.607 306 HG3 ARG 40 HG1 ARG 40 -6.063 -10.584 -2.079 307 HD2 ARG 40 HD2 ARG 40 -4.626 -8.970 -2.903 308 HD3 ARG 40 HD1 ARG 40 -4.432 -9.779 -4.447 309 HE ARG 40 HE ARG 40 -5.986 -8.322 -5.281 310 HH11 ARG 40 HH21 ARG 40 -6.572 -8.842 -1.915 311 HH12 ARG 40 HH22 ARG 40 -7.957 -7.818 -1.863 312 HH21 ARG 40 HH11 ARG 40 -7.790 -6.985 -5.225 313 HH22 ARG 40 HH12 ARG 40 -8.654 -6.760 -3.741 314 H LYS 41 HN LYS 41 -3.985 -14.201 -1.281 315 HA LYS 41 HA LYS 41 -5.119 -13.005 1.115 316 HB2 LYS 41 HB2 LYS 41 -4.095 -15.825 0.706 317 HB3 LYS 41 HB1 LYS 41 -5.162 -15.261 1.987 318 HG2 LYS 41 HG2 LYS 41 -5.903 -15.119 -0.951 319 HG3 LYS 41 HG1 LYS 41 -6.307 -16.490 0.071 320 HD2 LYS 41 HD2 LYS 41 -7.524 -14.918 1.605 321 HD3 LYS 41 HD1 LYS 41 -7.220 -13.620 0.454 322 HE2 LYS 41 HE2 LYS 41 -8.659 -16.185 -0.258 323 HE3 LYS 41 HE1 LYS 41 -9.471 -14.681 0.172 324 HZ1 LYS 41 HZ1 LYS 41 -9.126 -15.090 -2.268 325 HZ2 LYS 41 HZ2 LYS 41 -7.467 -14.844 -1.999 326 HZ3 LYS 41 HZ3 LYS 41 -8.574 -13.595 -1.689 327 H ILE 42 HN ILE 42 -2.074 -13.042 -0.125 328 HA ILE 42 HA ILE 42 -0.683 -13.509 2.431 329 HB ILE 42 HB ILE 42 0.118 -14.209 -0.033 330 HG12 ILE 42 HG12 ILE 42 1.991 -13.109 2.099 331 HG13 ILE 42 HG11 ILE 42 1.327 -14.740 2.053 332 HG21 ILE 42 HG21 ILE 42 1.464 -12.661 -1.203 333 HG22 ILE 42 HG22 ILE 42 1.688 -11.627 0.207 334 HG23 ILE 42 HG23 ILE 42 0.156 -11.629 -0.642 335 HD11 ILE 42 HD11 ILE 42 3.541 -14.887 1.147 336 HD12 ILE 42 HD12 ILE 42 3.281 -13.490 0.105 337 HD13 ILE 42 HD13 ILE 42 2.439 -15.005 -0.224 338 H GLY 43 HN GLY 43 -2.413 -11.042 1.330 339 HA2 GLY 43 HA3 GLY 43 -2.538 -8.890 2.199 340 HA3 GLY 43 HA2 GLY 43 -0.920 -9.061 2.865 341 H PHE 44 HN PHE 44 -1.563 -9.828 -0.486 342 HA PHE 44 HA PHE 44 0.407 -7.991 -1.423 343 HB2 PHE 44 HB2 PHE 44 -0.384 -10.244 -2.468 344 HB3 PHE 44 HB1 PHE 44 -1.693 -9.314 -3.171 345 HD1 PHE 44 HD1 PHE 44 1.999 -9.691 -3.006 346 HD2 PHE 44 HD2 PHE 44 -1.291 -7.822 -5.047 347 HE1 PHE 44 HE1 PHE 44 3.532 -8.970 -4.817 348 HE2 PHE 44 HE2 PHE 44 0.246 -7.101 -6.855 349 HZ PHE 44 HZ PHE 44 2.655 -7.677 -6.740 350 H HIS 45 HN HIS 45 0.196 -5.938 -2.096 351 HA HIS 45 HA HIS 45 -2.345 -4.877 -3.048 352 HB2 HIS 45 HB2 HIS 45 -2.677 -4.696 -0.651 353 HB3 HIS 45 HB1 HIS 45 -1.097 -3.945 -0.448 354 HD1 HIS 45 HD1 HIS 45 -4.314 -3.251 -2.398 355 HD2 HIS 45 HD2 HIS 45 -1.249 -1.203 -0.456 356 HE1 HIS 45 HE1 HIS 45 -4.915 -0.796 -2.501 357 HE2 HIS 45 HE2 HIS 45 -3.060 0.467 -1.315 358 H VAL 46 HN VAL 46 -1.447 -4.180 -4.920 359 HA VAL 46 HA VAL 46 0.470 -1.939 -4.730 360 HB VAL 46 HB VAL 46 0.871 -4.276 -6.617 361 HG11 VAL 46 HG11 VAL 46 1.633 -2.190 -7.596 362 HG12 VAL 46 HG12 VAL 46 3.050 -3.077 -7.037 363 HG13 VAL 46 HG13 VAL 46 2.429 -1.725 -6.091 364 HG21 VAL 46 HG21 VAL 46 2.309 -3.460 -4.070 365 HG22 VAL 46 HG22 VAL 46 2.967 -4.609 -5.235 366 HG23 VAL 46 HG23 VAL 46 1.470 -4.981 -4.380 367 H CYS 47 HN CYS 47 -0.038 -0.313 -6.061 368 HA CYS 47 HA CYS 47 -2.323 -0.617 -7.887 369 HB2 CYS 47 HB2 CYS 47 -0.898 1.654 -6.557 370 HB3 CYS 47 HB1 CYS 47 -1.674 2.009 -8.092 371 H ALA 48 HN ALA 48 -1.082 -1.985 -9.381 372 HA ALA 48 HA ALA 48 0.037 -0.406 -11.537 373 HB1 ALA 48 HB1 ALA 48 2.055 -0.639 -10.208 374 HB2 ALA 48 HB2 ALA 48 2.180 -1.691 -11.619 375 HB3 ALA 48 HB3 ALA 48 1.788 -2.373 -10.041 376 H ALA 49 HN ALA 49 -1.641 -1.282 -12.739 377 HA ALA 49 HA ALA 49 -2.084 -4.124 -12.925 378 HB1 ALA 49 HB1 ALA 49 -3.851 -2.372 -13.289 379 HB2 ALA 49 HB2 ALA 49 -3.747 -3.581 -14.566 380 HB3 ALA 49 HB3 ALA 49 -3.062 -1.974 -14.814 381 H GLY 50 HN GLY 50 -1.196 -5.550 -14.281 382 HA2 GLY 50 HA3 GLY 50 0.494 -4.557 -16.542 383 HA3 GLY 50 HA2 GLY 50 1.018 -5.837 -15.458 384 H TRP 51 HN TRP 51 0.937 -6.217 -18.167 385 HA TRP 51 HA TRP 51 -1.497 -7.456 -19.052 386 HB2 TRP 51 HB2 TRP 51 1.287 -7.941 -20.134 387 HB3 TRP 51 HB1 TRP 51 -0.254 -8.169 -20.960 388 HD1 TRP 51 HD1 TRP 51 2.364 -5.608 -20.237 389 HE1 TRP 51 HE1 TRP 51 1.688 -3.355 -21.284 390 HE3 TRP 51 HE3 TRP 51 -2.485 -6.629 -21.471 391 HZ2 TRP 51 HZ2 TRP 51 -0.599 -2.158 -22.507 392 HZ3 TRP 51 HZ3 TRP 51 -3.889 -4.909 -22.572 393 HH2 TRP 51 HH2 TRP 51 -2.953 -2.671 -23.086 394 H MET 52 HN MET 52 -2.218 -9.159 -17.888 395 HA MET 52 HA MET 52 -0.342 -11.270 -17.012 396 HB2 MET 52 HB2 MET 52 -3.279 -10.889 -16.416 397 HB3 MET 52 HB1 MET 52 -2.246 -12.120 -15.736 398 HG2 MET 52 HG2 MET 52 -0.836 -10.423 -14.695 399 HG3 MET 52 HG1 MET 52 -1.786 -9.143 -15.439 400 HE1 MET 52 HE1 MET 52 -3.986 -8.471 -14.977 401 HE2 MET 52 HE2 MET 52 -4.992 -8.900 -13.597 402 HE3 MET 52 HE3 MET 52 -4.945 -9.958 -15.003 403 H ALA 53 HN ALA 53 -1.600 -13.509 -17.072 404 HA ALA 53 HA ALA 53 -1.418 -14.713 -19.451 405 HB1 ALA 53 HB1 ALA 53 -3.628 -15.167 -17.440 406 HB2 ALA 53 HB2 ALA 53 -2.069 -15.988 -17.523 407 HB3 ALA 53 HB3 ALA 53 -3.277 -16.265 -18.776 408 H LYS 54 HN LYS 54 -2.552 -15.053 -21.326 409 HA LYS 54 HA LYS 54 -3.836 -14.474 -23.130 410 HB2 LYS 54 HB2 LYS 54 -5.869 -14.054 -20.923 411 HB3 LYS 54 HB1 LYS 54 -6.260 -14.020 -22.638 412 HG2 LYS 54 HG2 LYS 54 -5.429 -16.329 -22.877 413 HG3 LYS 54 HG1 LYS 54 -5.041 -16.365 -21.154 414 HD2 LYS 54 HD2 LYS 54 -7.403 -15.996 -20.592 415 HD3 LYS 54 HD1 LYS 54 -7.810 -15.892 -22.304 416 HE2 LYS 54 HE2 LYS 54 -8.262 -18.145 -21.244 417 HE3 LYS 54 HE1 LYS 54 -7.220 -18.195 -22.666 418 HZ1 LYS 54 HZ1 LYS 54 -6.622 -19.301 -20.292 419 HZ2 LYS 54 HZ2 LYS 54 -5.824 -17.806 -20.172 420 HZ3 LYS 54 HZ3 LYS 54 -5.475 -18.856 -21.461 421 H GLY 55 HN GLY 55 -2.587 -12.305 -21.158 422 HA2 GLY 55 HA3 GLY 55 -2.072 -10.070 -21.585 423 HA3 GLY 55 HA2 GLY 55 -3.248 -10.067 -22.891 424 H ARG 56 HN ARG 56 -4.265 -11.229 -19.786 425 HA ARG 56 HA ARG 56 -6.309 -9.233 -19.590 426 HB2 ARG 56 HB2 ARG 56 -6.557 -11.559 -18.737 427 HB3 ARG 56 HB1 ARG 56 -5.358 -11.209 -17.506 428 HG2 ARG 56 HG2 ARG 56 -6.780 -9.459 -16.557 429 HG3 ARG 56 HG1 ARG 56 -7.969 -9.715 -17.838 430 HD2 ARG 56 HD2 ARG 56 -8.320 -12.022 -17.082 431 HD3 ARG 56 HD1 ARG 56 -7.089 -11.809 -15.833 432 HE ARG 56 HE ARG 56 -8.854 -9.813 -15.290 433 HH11 ARG 56 HH21 ARG 56 -9.250 -13.184 -15.961 434 HH12 ARG 56 HH22 ARG 56 -10.570 -13.385 -14.866 435 HH21 ARG 56 HH11 ARG 56 -10.570 -10.080 -13.836 436 HH22 ARG 56 HH12 ARG 56 -11.311 -11.633 -13.652 437 H VAL 57 HN VAL 57 -6.271 -7.305 -18.612 438 HA VAL 57 HA VAL 57 -3.941 -6.631 -16.860 439 HB VAL 57 HB VAL 57 -3.892 -5.397 -18.984 440 HG11 VAL 57 HG11 VAL 57 -5.663 -3.876 -19.589 441 HG12 VAL 57 HG12 VAL 57 -6.552 -4.224 -18.112 442 HG13 VAL 57 HG13 VAL 57 -6.382 -5.465 -19.355 443 HG21 VAL 57 HG21 VAL 57 -3.627 -3.202 -18.032 444 HG22 VAL 57 HG22 VAL 57 -3.181 -4.353 -16.775 445 HG23 VAL 57 HG23 VAL 57 -4.755 -3.556 -16.726 446 H GLY 58 HN GLY 58 -4.322 -5.923 -14.883 447 HA2 GLY 58 HA3 GLY 58 -6.727 -4.581 -14.087 448 HA3 GLY 58 HA2 GLY 58 -6.722 -6.264 -13.570 449 H TYR 59 HN TYR 59 -6.738 -3.990 -11.868 450 HA TYR 59 HA TYR 59 -4.052 -4.159 -10.595 451 HB2 TYR 59 HB2 TYR 59 -5.386 -1.992 -9.373 452 HB3 TYR 59 HB1 TYR 59 -4.073 -1.905 -10.536 453 HD1 TYR 59 HD1 TYR 59 -7.707 -2.805 -10.749 454 HD2 TYR 59 HD2 TYR 59 -4.537 -0.301 -12.209 455 HE1 TYR 59 HE1 TYR 59 -9.283 -1.726 -12.336 456 HE2 TYR 59 HE2 TYR 59 -6.105 0.767 -13.792 457 HH TYR 59 HH TYR 59 -9.013 0.983 -13.621 458 HA PRO 60 HA PRO 60 -6.662 -6.292 -7.531 459 HB2 PRO 60 HB2 PRO 60 -4.739 -7.792 -6.332 460 HB3 PRO 60 HB1 PRO 60 -5.374 -8.202 -7.939 461 HG2 PRO 60 HG2 PRO 60 -2.825 -6.809 -7.202 462 HG3 PRO 60 HG1 PRO 60 -3.109 -8.052 -8.437 463 HD2 PRO 60 HD2 PRO 60 -2.957 -5.333 -8.980 464 HD3 PRO 60 HD1 PRO 60 -3.821 -6.494 -10.016 465 H ILE 61 HN ILE 61 -7.313 -5.331 -5.696 466 HA ILE 61 HA ILE 61 -5.357 -4.312 -3.747 467 HB ILE 61 HB ILE 61 -6.709 -2.160 -3.563 468 HG12 ILE 61 HG12 ILE 61 -7.699 -3.054 -6.293 469 HG13 ILE 61 HG11 ILE 61 -8.679 -3.033 -4.831 470 HG21 ILE 61 HG21 ILE 61 -5.509 -1.070 -5.375 471 HG22 ILE 61 HG22 ILE 61 -5.311 -2.603 -6.222 472 HG23 ILE 61 HG23 ILE 61 -4.474 -2.323 -4.695 473 HD11 ILE 61 HD11 ILE 61 -8.304 -0.595 -4.622 474 HD12 ILE 61 HD12 ILE 61 -9.076 -1.000 -6.151 475 HD13 ILE 61 HD13 ILE 61 -7.355 -0.617 -6.110 476 H VAL 62 HN VAL 62 -5.986 -4.516 -1.701 477 HA VAL 62 HA VAL 62 -8.137 -6.215 -1.045 478 HB VAL 62 HB VAL 62 -6.744 -4.277 0.807 479 HG11 VAL 62 HG11 VAL 62 -7.259 -6.020 2.502 480 HG12 VAL 62 HG12 VAL 62 -8.159 -6.914 1.276 481 HG13 VAL 62 HG13 VAL 62 -8.716 -5.321 1.792 482 HG21 VAL 62 HG21 VAL 62 -5.069 -5.584 -0.400 483 HG22 VAL 62 HG22 VAL 62 -5.968 -7.070 -0.097 484 HG23 VAL 62 HG23 VAL 62 -5.206 -6.212 1.242 485 H LYS 63 HN LYS 63 -7.783 -2.693 -0.779 486 HA LYS 63 HA LYS 63 -10.554 -2.229 -1.218 487 HB2 LYS 63 HB2 LYS 63 -9.829 -2.848 1.465 488 HB3 LYS 63 HB1 LYS 63 -10.094 -1.112 1.458 489 HG2 LYS 63 HG2 LYS 63 -12.320 -1.523 0.349 490 HG3 LYS 63 HG1 LYS 63 -12.054 -3.253 0.566 491 HD2 LYS 63 HD2 LYS 63 -12.184 -1.177 2.778 492 HD3 LYS 63 HD1 LYS 63 -13.427 -2.369 2.401 493 HE2 LYS 63 HE2 LYS 63 -12.289 -3.447 4.149 494 HE3 LYS 63 HE1 LYS 63 -11.421 -4.098 2.765 495 HZ1 LYS 63 HZ1 LYS 63 -9.670 -3.341 3.936 496 HZ2 LYS 63 HZ2 LYS 63 -10.570 -2.163 4.766 497 HZ3 LYS 63 HZ3 LYS 63 -10.049 -1.874 3.174 498 HA PRO 64 HA PRO 64 -8.063 1.861 -0.257 499 HB2 PRO 64 HB2 PRO 64 -5.268 0.795 -0.558 500 HB3 PRO 64 HB1 PRO 64 -5.893 1.994 0.596 501 HG2 PRO 64 HG2 PRO 64 -5.315 -0.464 1.413 502 HG3 PRO 64 HG1 PRO 64 -6.778 0.353 2.008 503 HD2 PRO 64 HD2 PRO 64 -6.551 -1.732 -0.168 504 HD3 PRO 64 HD1 PRO 64 -7.721 -1.641 1.169 505 H GLY 65 HN GLY 65 -7.531 3.285 -1.916 506 HA2 GLY 65 HA3 GLY 65 -6.338 2.308 -4.391 507 HA3 GLY 65 HA2 GLY 65 -8.040 2.750 -4.511 508 HA PRO 66 HA PRO 66 -6.062 6.930 -3.295 509 HB2 PRO 66 HB2 PRO 66 -3.391 6.992 -2.595 510 HB3 PRO 66 HB1 PRO 66 -4.688 6.670 -1.422 511 HG2 PRO 66 HG2 PRO 66 -2.955 4.700 -2.890 512 HG3 PRO 66 HG1 PRO 66 -3.361 4.756 -1.162 513 HD2 PRO 66 HD2 PRO 66 -4.678 3.086 -2.832 514 HD3 PRO 66 HD1 PRO 66 -5.538 3.918 -1.515 515 H ASN 67 HN ASN 67 -3.394 4.987 -4.665 516 HA ASN 67 HA ASN 67 -2.826 6.978 -6.709 517 HB2 ASN 67 HB2 ASN 67 -1.015 5.707 -5.609 518 HB3 ASN 67 HB1 ASN 67 -1.674 4.212 -6.273 519 HD21 ASN 67 HD21 ASN 67 -0.402 3.589 -8.020 520 HD22 ASN 67 HD22 ASN 67 0.202 4.643 -9.205 521 H CYS 68 HN CYS 68 -4.683 4.072 -6.377 522 HA CYS 68 HA CYS 68 -5.660 4.357 -9.117 523 HB2 CYS 68 HB2 CYS 68 -5.107 2.191 -9.886 524 HB3 CYS 68 HB1 CYS 68 -3.630 2.786 -9.146 525 H GLY 69 HN GLY 69 -7.785 4.156 -9.091 526 HA2 GLY 69 HA3 GLY 69 -9.275 2.107 -7.932 527 HA3 GLY 69 HA2 GLY 69 -9.219 3.420 -6.761 528 H PHE 70 HN PHE 70 -10.822 2.187 -9.429 529 HA PHE 70 HA PHE 70 -12.480 4.613 -9.678 530 HB2 PHE 70 HB2 PHE 70 -10.795 4.738 -11.475 531 HB3 PHE 70 HB1 PHE 70 -11.260 3.131 -12.025 532 HD1 PHE 70 HD1 PHE 70 -12.323 6.664 -11.744 533 HD2 PHE 70 HD2 PHE 70 -13.371 2.758 -13.200 534 HE1 PHE 70 HE1 PHE 70 -14.133 7.658 -13.118 535 HE2 PHE 70 HE2 PHE 70 -15.180 3.754 -14.571 536 HZ PHE 70 HZ PHE 70 -15.560 6.204 -14.531 537 H GLY 71 HN GLY 71 -12.046 1.288 -10.891 538 HA2 GLY 71 HA3 GLY 71 -14.748 0.790 -11.483 539 HA3 GLY 71 HA2 GLY 71 -13.539 -0.445 -11.157 540 H LYS 72 HN LYS 72 -13.018 -0.780 -8.792 541 HA LYS 72 HA LYS 72 -14.837 0.042 -6.764 542 HB2 LYS 72 HB2 LYS 72 -16.026 -2.086 -6.405 543 HB3 LYS 72 HB1 LYS 72 -16.403 -1.418 -7.985 544 HG2 LYS 72 HG2 LYS 72 -14.697 -2.914 -9.007 545 HG3 LYS 72 HG1 LYS 72 -14.404 -3.632 -7.422 546 HD2 LYS 72 HD2 LYS 72 -16.749 -4.345 -7.287 547 HD3 LYS 72 HD1 LYS 72 -17.078 -3.601 -8.853 548 HE2 LYS 72 HE2 LYS 72 -16.713 -6.009 -9.135 549 HE3 LYS 72 HE1 LYS 72 -15.400 -5.110 -9.895 550 HZ1 LYS 72 HZ1 LYS 72 -13.915 -5.899 -8.442 551 HZ2 LYS 72 HZ2 LYS 72 -15.068 -7.105 -8.124 552 HZ3 LYS 72 HZ3 LYS 72 -14.960 -5.742 -7.116 553 H THR 73 HN THR 73 -14.730 -2.360 -5.212 554 HA THR 73 HA THR 73 -11.811 -2.557 -4.644 555 HB THR 73 HB THR 73 -12.564 -3.066 -2.284 556 HG1 THR 73 HG1 THR 73 -15.018 -2.040 -3.266 557 HG21 THR 73 HG21 THR 73 -13.112 -0.672 -1.768 558 HG22 THR 73 HG22 THR 73 -13.254 -0.379 -3.502 559 HG23 THR 73 HG23 THR 73 -11.702 -0.865 -2.813 560 H GLY 74 HN GLY 74 -11.206 -4.561 -3.505 561 HA2 GLY 74 HA3 GLY 74 -11.074 -6.869 -3.384 562 HA3 GLY 74 HA2 GLY 74 -12.807 -6.916 -3.694 563 H ILE 75 HN ILE 75 -9.742 -6.254 -5.377 564 HA ILE 75 HA ILE 75 -8.999 -6.765 -7.489 565 HB ILE 75 HB ILE 75 -10.950 -9.070 -7.250 566 HG12 ILE 75 HG12 ILE 75 -7.989 -8.974 -6.571 567 HG13 ILE 75 HG11 ILE 75 -9.269 -8.848 -5.368 568 HG21 ILE 75 HG21 ILE 75 -8.558 -8.538 -9.042 569 HG22 ILE 75 HG22 ILE 75 -10.222 -8.846 -9.532 570 HG23 ILE 75 HG23 ILE 75 -9.261 -10.141 -8.833 571 HD11 ILE 75 HD11 ILE 75 -8.708 -11.202 -7.185 572 HD12 ILE 75 HD12 ILE 75 -10.157 -11.062 -6.191 573 HD13 ILE 75 HD13 ILE 75 -8.570 -11.150 -5.428 574 H ILE 76 HN ILE 76 -9.434 -5.808 -9.384 575 HA ILE 76 HA ILE 76 -12.284 -5.406 -10.185 576 HB ILE 76 HB ILE 76 -9.888 -3.700 -10.910 577 HG12 ILE 76 HG12 ILE 76 -12.098 -3.107 -8.906 578 HG13 ILE 76 HG11 ILE 76 -10.487 -3.654 -8.445 579 HG21 ILE 76 HG21 ILE 76 -11.678 -2.104 -11.619 580 HG22 ILE 76 HG22 ILE 76 -12.885 -3.329 -11.239 581 HG23 ILE 76 HG23 ILE 76 -11.729 -3.604 -12.538 582 HD11 ILE 76 HD11 ILE 76 -9.549 -1.668 -9.714 583 HD12 ILE 76 HD12 ILE 76 -10.487 -1.254 -8.282 584 HD13 ILE 76 HD13 ILE 76 -11.206 -1.087 -9.881 585 H ASP 77 HN ASP 77 -12.859 -6.595 -11.862 586 HA ASP 77 HA ASP 77 -10.850 -7.644 -13.740 587 HB2 ASP 77 HB2 ASP 77 -13.801 -8.190 -13.364 588 HB3 ASP 77 HB1 ASP 77 -12.800 -8.950 -14.601 589 H TYR 78 HN TYR 78 -10.310 -6.254 -15.289 590 HA TYR 78 HA TYR 78 -12.335 -4.483 -16.516 591 HB2 TYR 78 HB2 TYR 78 -9.439 -4.342 -16.036 592 HB3 TYR 78 HB1 TYR 78 -9.796 -4.003 -17.724 593 HD1 TYR 78 HD1 TYR 78 -10.235 -2.861 -14.249 594 HD2 TYR 78 HD2 TYR 78 -11.173 -2.068 -18.364 595 HE1 TYR 78 HE1 TYR 78 -10.963 -0.570 -13.643 596 HE2 TYR 78 HE2 TYR 78 -11.896 0.223 -17.759 597 HH TYR 78 HH TYR 78 -11.230 1.615 -14.715 598 H GLY 79 HN GLY 79 -10.899 -7.505 -17.036 599 HA2 GLY 79 HA3 GLY 79 -11.421 -8.992 -18.769 600 HA3 GLY 79 HA2 GLY 79 -12.040 -7.654 -19.730 601 H ILE 80 HN ILE 80 -10.720 -9.036 -21.308 602 HA ILE 80 HA ILE 80 -7.828 -8.446 -21.255 603 HB ILE 80 HB ILE 80 -9.442 -10.193 -23.139 604 HG12 ILE 80 HG12 ILE 80 -8.223 -12.044 -21.874 605 HG13 ILE 80 HG11 ILE 80 -7.727 -10.829 -20.704 606 HG21 ILE 80 HG21 ILE 80 -7.120 -11.077 -23.685 607 HG22 ILE 80 HG22 ILE 80 -6.468 -9.694 -22.804 608 HG23 ILE 80 HG23 ILE 80 -7.447 -9.440 -24.251 609 HD11 ILE 80 HD11 ILE 80 -9.825 -10.684 -19.771 610 HD12 ILE 80 HD12 ILE 80 -9.946 -12.322 -20.394 611 HD13 ILE 80 HD13 ILE 80 -10.665 -10.991 -21.293 612 H ARG 81 HN ARG 81 -7.181 -6.638 -22.199 613 HA ARG 81 HA ARG 81 -8.810 -5.368 -24.305 614 HB2 ARG 81 HB2 ARG 81 -6.349 -4.394 -22.820 615 HB3 ARG 81 HB1 ARG 81 -7.251 -3.468 -24.017 616 HG2 ARG 81 HG2 ARG 81 -9.280 -3.609 -22.627 617 HG3 ARG 81 HG1 ARG 81 -8.402 -4.570 -21.441 618 HD2 ARG 81 HD2 ARG 81 -8.383 -2.344 -20.590 619 HD3 ARG 81 HD1 ARG 81 -6.768 -2.616 -21.239 620 HE ARG 81 HE ARG 81 -8.416 -1.465 -23.239 621 HH11 ARG 81 HH21 ARG 81 -6.787 -0.769 -20.261 622 HH12 ARG 81 HH22 ARG 81 -6.654 0.929 -20.572 623 HH21 ARG 81 HH11 ARG 81 -8.234 0.767 -23.651 624 HH22 ARG 81 HH12 ARG 81 -7.472 1.799 -22.486 625 H LEU 82 HN LEU 82 -8.259 -5.328 -26.394 626 HA LEU 82 HA LEU 82 -6.035 -6.953 -27.308 627 HB2 LEU 82 HB2 LEU 82 -8.334 -6.987 -28.340 628 HB3 LEU 82 HB1 LEU 82 -8.046 -5.357 -28.928 629 HG LEU 82 HG LEU 82 -6.142 -6.183 -30.287 630 HD11 LEU 82 HD11 LEU 82 -5.215 -8.052 -29.195 631 HD12 LEU 82 HD12 LEU 82 -6.082 -8.806 -30.525 632 HD13 LEU 82 HD13 LEU 82 -6.790 -8.794 -28.908 633 HD21 LEU 82 HD21 LEU 82 -8.423 -6.131 -31.223 634 HD22 LEU 82 HD22 LEU 82 -8.679 -7.785 -30.665 635 HD23 LEU 82 HD23 LEU 82 -7.474 -7.453 -31.908 636 H ASN 83 HN ASN 83 -6.117 -3.956 -26.155 637 HA ASN 83 HA ASN 83 -4.536 -2.580 -28.185 638 HB2 ASN 83 HB2 ASN 83 -4.583 -0.687 -26.663 639 HB3 ASN 83 HB1 ASN 83 -6.209 -1.331 -26.875 640 HD21 ASN 83 HD21 ASN 83 -6.168 0.072 -24.667 641 HD22 ASN 83 HD22 ASN 83 -5.948 -0.861 -23.267 642 H ARG 84 HN ARG 84 -3.563 -5.053 -26.770 643 HA ARG 84 HA ARG 84 -1.642 -4.686 -24.847 644 HB2 ARG 84 HB2 ARG 84 -0.363 -6.540 -25.955 645 HB3 ARG 84 HB1 ARG 84 -2.077 -6.899 -25.763 646 HG2 ARG 84 HG2 ARG 84 -2.472 -6.152 -28.107 647 HG3 ARG 84 HG1 ARG 84 -0.740 -5.884 -28.294 648 HD2 ARG 84 HD2 ARG 84 -1.898 -8.571 -27.505 649 HD3 ARG 84 HD1 ARG 84 -1.627 -8.109 -29.183 650 HE ARG 84 HE ARG 84 0.745 -7.750 -27.619 651 HH11 ARG 84 HH21 ARG 84 -1.265 -10.055 -29.241 652 HH12 ARG 84 HH22 ARG 84 -0.030 -11.264 -29.361 653 HH21 ARG 84 HH11 ARG 84 2.380 -9.344 -27.775 654 HH22 ARG 84 HH12 ARG 84 2.027 -10.864 -28.528 655 H SER 85 HN SER 85 -1.469 -3.715 -28.219 656 HA SER 85 HA SER 85 1.219 -3.248 -28.603 657 HB2 SER 85 HB2 SER 85 0.559 -1.555 -30.215 658 HB3 SER 85 HB1 SER 85 -0.573 -2.902 -30.299 659 HG SER 85 HG SER 85 -2.027 -1.428 -29.943 660 H GLU 86 HN GLU 86 -0.935 -1.639 -26.436 661 HA GLU 86 HA GLU 86 0.510 0.802 -26.116 662 HB2 GLU 86 HB2 GLU 86 -1.458 -0.626 -24.307 663 HB3 GLU 86 HB1 GLU 86 -0.841 0.994 -24.014 664 HG2 GLU 86 HG2 GLU 86 -2.329 0.171 -26.522 665 HG3 GLU 86 HG1 GLU 86 -3.076 0.972 -25.145 666 H ARG 87 HN ARG 87 0.944 1.138 -23.486 667 HA ARG 87 HA ARG 87 2.908 -0.948 -22.662 668 HB2 ARG 87 HB2 ARG 87 3.294 2.057 -22.700 669 HB3 ARG 87 HB1 ARG 87 4.359 0.936 -21.858 670 HG2 ARG 87 HG2 ARG 87 4.831 -0.222 -23.984 671 HG3 ARG 87 HG1 ARG 87 3.765 0.899 -24.832 672 HD2 ARG 87 HD2 ARG 87 5.194 2.783 -24.129 673 HD3 ARG 87 HD1 ARG 87 6.256 1.663 -23.283 674 HE ARG 87 HE ARG 87 7.165 1.021 -25.334 675 HH11 ARG 87 HH21 ARG 87 4.251 2.836 -25.770 676 HH12 ARG 87 HH22 ARG 87 4.479 3.060 -27.470 677 HH21 ARG 87 HH11 ARG 87 7.485 1.334 -27.567 678 HH22 ARG 87 HH12 ARG 87 6.315 2.219 -28.490 679 H TRP 88 HN TRP 88 2.688 -1.605 -20.655 680 HA TRP 88 HA TRP 88 1.605 0.137 -18.554 681 HB2 TRP 88 HB2 TRP 88 0.169 -2.259 -19.689 682 HB3 TRP 88 HB1 TRP 88 0.056 -1.974 -17.954 683 HD1 TRP 88 HD1 TRP 88 -0.686 -0.177 -21.292 684 HE1 TRP 88 HE1 TRP 88 -2.604 1.489 -20.901 685 HE3 TRP 88 HE3 TRP 88 -1.252 -0.668 -16.248 686 HZ2 TRP 88 HZ2 TRP 88 -4.178 2.484 -18.732 687 HZ3 TRP 88 HZ3 TRP 88 -2.969 0.647 -15.044 688 HH2 TRP 88 HH2 TRP 88 -4.432 2.223 -16.278 689 H ASP 89 HN ASP 89 1.508 -1.223 -16.446 690 HA ASP 89 HA ASP 89 4.101 -1.970 -15.759 691 HB2 ASP 89 HB2 ASP 89 1.691 -3.061 -14.294 692 HB3 ASP 89 HB1 ASP 89 3.235 -2.525 -13.635 693 H ALA 90 HN ALA 90 4.234 -4.279 -14.491 694 HA ALA 90 HA ALA 90 3.236 -6.490 -16.107 695 HB1 ALA 90 HB1 ALA 90 6.205 -5.905 -15.997 696 HB2 ALA 90 HB2 ALA 90 5.180 -5.731 -17.421 697 HB3 ALA 90 HB3 ALA 90 5.453 -7.325 -16.722 698 H TYR 91 HN TYR 91 3.276 -8.402 -15.050 699 HA TYR 91 HA TYR 91 4.387 -8.429 -12.281 700 HB2 TYR 91 HB2 TYR 91 1.876 -9.662 -13.435 701 HB3 TYR 91 HB1 TYR 91 2.571 -10.206 -11.914 702 HD1 TYR 91 HD2 TYR 91 3.043 -8.435 -10.102 703 HD2 TYR 91 HD1 TYR 91 0.417 -7.756 -13.438 704 HE1 TYR 91 HE2 TYR 91 1.940 -6.591 -8.863 705 HE2 TYR 91 HE1 TYR 91 -0.684 -5.919 -12.193 706 HH TYR 91 HH TYR 91 0.622 -4.526 -9.423 707 H CYS 92 HN CYS 92 5.043 -10.500 -11.494 708 HA CYS 92 HA CYS 92 5.737 -12.533 -13.522 709 HB2 CYS 92 HB2 CYS 92 7.621 -10.716 -12.997 710 HB3 CYS 92 HB1 CYS 92 7.905 -11.733 -11.590 711 H TYR 93 HN TYR 93 6.972 -14.369 -12.251 712 HA TYR 93 HA TYR 93 5.608 -14.883 -9.658 713 HB2 TYR 93 HB2 TYR 93 4.348 -15.978 -11.453 714 HB3 TYR 93 HB1 TYR 93 5.810 -16.775 -12.010 715 HD1 TYR 93 HD1 TYR 93 3.512 -16.432 -9.092 716 HD2 TYR 93 HD2 TYR 93 6.530 -18.833 -10.992 717 HE1 TYR 93 HE1 TYR 93 3.072 -18.267 -7.481 718 HE2 TYR 93 HE2 TYR 93 6.088 -20.662 -9.378 719 HH TYR 93 HH TYR 93 3.461 -20.997 -7.652 720 H ASN 94 HN ASN 94 7.098 -15.160 -8.192 721 HA ASN 94 HA ASN 94 9.403 -16.924 -8.703 722 HB2 ASN 94 HB2 ASN 94 9.723 -14.110 -7.665 723 HB3 ASN 94 HB1 ASN 94 11.003 -15.302 -7.892 724 HD21 ASN 94 HD21 ASN 94 8.624 -13.308 -9.667 725 HD22 ASN 94 HD22 ASN 94 9.434 -13.389 -11.157 726 HA PRO 95 HA PRO 95 7.761 -17.344 -4.424 727 HB2 PRO 95 HB2 PRO 95 7.528 -20.045 -4.312 728 HB3 PRO 95 HB1 PRO 95 6.327 -19.048 -5.155 729 HG2 PRO 95 HG2 PRO 95 8.556 -20.681 -6.297 730 HG3 PRO 95 HG1 PRO 95 6.908 -20.442 -6.911 731 HD2 PRO 95 HD2 PRO 95 9.172 -19.065 -7.839 732 HD3 PRO 95 HD1 PRO 95 7.503 -18.506 -8.061 733 H HIS 96 HN HIS 96 9.885 -16.535 -3.820 734 HA HIS 96 HA HIS 96 11.716 -18.672 -2.863 735 HB2 HIS 96 HB2 HIS 96 12.609 -17.553 -4.923 736 HB3 HIS 96 HB1 HIS 96 12.586 -16.022 -4.049 737 HD1 HIS 96 HD1 HIS 96 14.364 -15.658 -2.223 738 HD2 HIS 96 HD2 HIS 96 14.573 -19.427 -3.994 739 HE1 HIS 96 HE1 HIS 96 16.543 -16.693 -1.449 740 HE2 HIS 96 HE2 HIS 96 16.684 -18.991 -2.521 741 H ALA 97 HN ALA 97 10.679 -15.280 -2.567 742 HA ALA 97 HA ALA 97 11.965 -14.777 -0.092 743 HB1 ALA 97 HB1 ALA 97 11.076 -12.951 -1.465 744 HB2 ALA 97 HB2 ALA 97 10.315 -12.926 0.126 745 HB3 ALA 97 HB3 ALA 97 9.437 -13.572 -1.261 746 H LYS 98 HN LYS 98 8.487 -15.091 -0.606 747 HA LYS 98 HA LYS 98 8.247 -16.485 2.028 748 HB2 LYS 98 HB2 LYS 98 6.049 -15.323 0.296 749 HB3 LYS 98 HB1 LYS 98 5.930 -15.857 1.968 750 HG2 LYS 98 HG2 LYS 98 7.613 -13.529 1.010 751 HG3 LYS 98 HG1 LYS 98 6.028 -13.384 1.759 752 HD2 LYS 98 HD2 LYS 98 6.952 -14.551 3.791 753 HD3 LYS 98 HD1 LYS 98 8.548 -14.484 3.042 754 HE2 LYS 98 HE2 LYS 98 8.365 -12.029 2.883 755 HE3 LYS 98 HE1 LYS 98 6.809 -12.107 3.705 756 HZ1 LYS 98 HZ1 LYS 98 7.767 -12.587 5.682 757 HZ2 LYS 98 HZ2 LYS 98 9.084 -11.760 4.995 758 HZ3 LYS 98 HZ3 LYS 98 9.048 -13.458 4.989 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 7.468 -14.886 -3.218 2 H2 GLY 1 H2 GLY 1 6.617 -16.267 -2.717 3 H3 GLY 1 H3 GLY 1 5.798 -14.795 -2.941 4 HA2 GLY 1 HA3 GLY 1 7.170 -16.282 -5.113 5 HA3 GLY 1 HA2 GLY 1 5.442 -16.394 -4.774 6 H VAL 2 HN VAL 2 4.447 -14.076 -4.426 7 HA VAL 2 HA VAL 2 4.868 -12.636 -6.920 8 HB VAL 2 HB VAL 2 2.917 -12.121 -4.663 9 HG11 VAL 2 HG11 VAL 2 3.219 -10.142 -6.062 10 HG12 VAL 2 HG12 VAL 2 1.677 -10.892 -6.465 11 HG13 VAL 2 HG13 VAL 2 3.070 -11.118 -7.522 12 HG21 VAL 2 HG21 VAL 2 2.628 -14.348 -5.677 13 HG22 VAL 2 HG22 VAL 2 2.613 -13.621 -7.283 14 HG23 VAL 2 HG23 VAL 2 1.306 -13.280 -6.150 15 H TYR 3 HN TYR 3 5.778 -10.685 -7.172 16 HA TYR 3 HA TYR 3 6.416 -9.018 -4.832 17 HB2 TYR 3 HB2 TYR 3 8.768 -8.795 -5.456 18 HB3 TYR 3 HB1 TYR 3 8.376 -10.465 -5.070 19 HD1 TYR 3 HD2 TYR 3 8.129 -12.160 -6.878 20 HD2 TYR 3 HD1 TYR 3 9.415 -8.145 -7.708 21 HE1 TYR 3 HE2 TYR 3 8.975 -12.886 -9.093 22 HE2 TYR 3 HE1 TYR 3 10.262 -8.872 -9.922 23 HH TYR 3 HH TYR 3 10.679 -12.122 -10.746 24 H HIS 4 HN HIS 4 7.217 -6.888 -5.437 25 HA HIS 4 HA HIS 4 5.625 -5.794 -7.573 26 HB2 HIS 4 HB2 HIS 4 7.663 -4.496 -5.744 27 HB3 HIS 4 HB1 HIS 4 6.611 -3.627 -6.862 28 HD1 HIS 4 HD1 HIS 4 6.051 -2.754 -4.150 29 HD2 HIS 4 HD2 HIS 4 4.373 -6.303 -5.558 30 HE1 HIS 4 HE1 HIS 4 4.063 -3.247 -2.662 31 HE2 HIS 4 HE2 HIS 4 3.029 -5.406 -3.505 32 H ARG 5 HN ARG 5 6.190 -5.380 -9.597 33 HA ARG 5 HA ARG 5 9.066 -5.262 -10.358 34 HB2 ARG 5 HB2 ARG 5 8.162 -7.540 -10.780 35 HB3 ARG 5 HB1 ARG 5 6.920 -6.837 -11.809 36 HG2 ARG 5 HG2 ARG 5 8.591 -6.033 -13.379 37 HG3 ARG 5 HG1 ARG 5 9.899 -6.522 -12.299 38 HD2 ARG 5 HD2 ARG 5 9.230 -8.870 -12.511 39 HD3 ARG 5 HD1 ARG 5 7.867 -8.413 -13.523 40 HE ARG 5 HE ARG 5 9.316 -8.240 -15.308 41 HH11 ARG 5 HH21 ARG 5 11.052 -8.629 -12.353 42 HH12 ARG 5 HH22 ARG 5 12.616 -8.538 -13.090 43 HH21 ARG 5 HH11 ARG 5 11.388 -8.068 -16.289 44 HH22 ARG 5 HH12 ARG 5 12.805 -8.206 -15.303 45 H GLU 6 HN GLU 6 9.528 -3.648 -11.703 46 HA GLU 6 HA GLU 6 7.567 -2.490 -13.510 47 HB2 GLU 6 HB2 GLU 6 7.044 -1.369 -11.367 48 HB3 GLU 6 HB1 GLU 6 8.721 -0.843 -11.237 49 HG2 GLU 6 HG2 GLU 6 8.516 0.504 -13.242 50 HG3 GLU 6 HG1 GLU 6 6.903 -0.132 -13.558 51 H ALA 7 HN ALA 7 8.500 -0.984 -14.977 52 HA ALA 7 HA ALA 7 10.996 -1.700 -15.977 53 HB1 ALA 7 HB1 ALA 7 9.396 -0.549 -17.364 54 HB2 ALA 7 HB2 ALA 7 10.852 0.437 -17.285 55 HB3 ALA 7 HB3 ALA 7 9.440 0.869 -16.322 56 H ARG 8 HN ARG 8 13.003 -1.290 -15.359 57 HA ARG 8 HA ARG 8 13.539 0.492 -13.135 58 HB2 ARG 8 HB2 ARG 8 15.837 -0.333 -13.317 59 HB3 ARG 8 HB1 ARG 8 14.675 -1.652 -13.269 60 HG2 ARG 8 HG2 ARG 8 14.830 -1.868 -15.744 61 HG3 ARG 8 HG1 ARG 8 16.030 -0.570 -15.765 62 HD2 ARG 8 HD2 ARG 8 17.500 -1.864 -14.306 63 HD3 ARG 8 HD1 ARG 8 16.316 -3.153 -14.199 64 HE ARG 8 HE ARG 8 17.052 -2.696 -16.914 65 HH11 ARG 8 HH21 ARG 8 17.990 -4.115 -13.911 66 HH12 ARG 8 HH22 ARG 8 19.256 -5.082 -14.586 67 HH21 ARG 8 HH11 ARG 8 18.760 -3.963 -17.827 68 HH22 ARG 8 HH12 ARG 8 19.699 -4.987 -16.791 69 H SER 9 HN SER 9 14.142 0.442 -16.602 70 HA SER 9 HA SER 9 15.704 2.905 -16.536 71 HB2 SER 9 HB2 SER 9 14.654 1.244 -18.838 72 HB3 SER 9 HB1 SER 9 15.709 2.645 -19.002 73 HG SER 9 HG SER 9 16.283 0.081 -18.256 74 H GLY 10 HN GLY 10 12.451 2.182 -16.353 75 HA2 GLY 10 HA3 GLY 10 11.713 4.931 -17.080 76 HA3 GLY 10 HA2 GLY 10 10.938 3.647 -18.002 77 H LYS 11 HN LYS 11 9.009 3.120 -17.285 78 HA LYS 11 HA LYS 11 8.447 2.550 -14.542 79 HB2 LYS 11 HB2 LYS 11 8.424 5.115 -14.643 80 HB3 LYS 11 HB1 LYS 11 6.978 4.967 -15.641 81 HG2 LYS 11 HG2 LYS 11 5.846 3.727 -13.845 82 HG3 LYS 11 HG1 LYS 11 7.300 3.798 -12.855 83 HD2 LYS 11 HD2 LYS 11 7.176 6.266 -12.846 84 HD3 LYS 11 HD1 LYS 11 5.705 6.193 -13.819 85 HE2 LYS 11 HE2 LYS 11 4.586 4.911 -12.028 86 HE3 LYS 11 HE1 LYS 11 6.053 4.994 -11.054 87 HZ1 LYS 11 HZ1 LYS 11 4.425 6.708 -10.459 88 HZ2 LYS 11 HZ2 LYS 11 4.530 7.348 -12.028 89 HZ3 LYS 11 HZ3 LYS 11 5.886 7.377 -11.004 90 H TYR 12 HN TYR 12 7.137 3.345 -17.729 91 HA TYR 12 HA TYR 12 5.413 0.973 -17.616 92 HB2 TYR 12 HB2 TYR 12 4.332 3.715 -18.324 93 HB3 TYR 12 HB1 TYR 12 3.447 2.197 -18.397 94 HD1 TYR 12 HD2 TYR 12 3.612 0.761 -16.081 95 HD2 TYR 12 HD1 TYR 12 3.936 5.044 -16.396 96 HE1 TYR 12 HE2 TYR 12 2.942 1.000 -13.705 97 HE2 TYR 12 HE1 TYR 12 3.255 5.265 -14.027 98 HH TYR 12 HH TYR 12 2.521 2.389 -12.043 99 H LYS 13 HN LYS 13 7.385 0.598 -19.088 100 HA LYS 13 HA LYS 13 6.605 1.222 -21.888 101 HB2 LYS 13 HB2 LYS 13 9.380 1.357 -20.684 102 HB3 LYS 13 HB1 LYS 13 9.053 1.359 -22.419 103 HG2 LYS 13 HG2 LYS 13 7.665 3.387 -22.159 104 HG3 LYS 13 HG1 LYS 13 7.992 3.391 -20.426 105 HD2 LYS 13 HD2 LYS 13 10.406 3.625 -20.883 106 HD3 LYS 13 HD1 LYS 13 10.073 3.636 -22.614 107 HE2 LYS 13 HE2 LYS 13 8.706 5.669 -22.351 108 HE3 LYS 13 HE1 LYS 13 9.015 5.658 -20.616 109 HZ1 LYS 13 HZ1 LYS 13 10.698 7.003 -21.218 110 HZ2 LYS 13 HZ2 LYS 13 10.765 6.412 -22.809 111 HZ3 LYS 13 HZ3 LYS 13 11.496 5.542 -21.546 112 H LEU 14 HN LEU 14 6.068 -1.109 -20.234 113 HA LEU 14 HA LEU 14 7.623 -3.186 -21.726 114 HB2 LEU 14 HB2 LEU 14 6.282 -3.563 -19.035 115 HB3 LEU 14 HB1 LEU 14 7.370 -4.675 -19.863 116 HG LEU 14 HG LEU 14 8.153 -1.921 -18.860 117 HD11 LEU 14 HD11 LEU 14 7.687 -3.424 -16.993 118 HD12 LEU 14 HD12 LEU 14 9.431 -3.216 -17.146 119 HD13 LEU 14 HD13 LEU 14 8.666 -4.690 -17.734 120 HD21 LEU 14 HD21 LEU 14 10.493 -2.879 -19.228 121 HD22 LEU 14 HD22 LEU 14 9.593 -2.541 -20.700 122 HD23 LEU 14 HD23 LEU 14 9.725 -4.199 -20.111 123 H THR 15 HN THR 15 6.464 -4.144 -23.226 124 HA THR 15 HA THR 15 3.523 -4.133 -23.091 125 HB THR 15 HB THR 15 3.599 -4.968 -25.372 126 HG1 THR 15 HG1 THR 15 5.290 -5.964 -26.064 127 HG21 THR 15 HG21 THR 15 3.954 -2.514 -24.886 128 HG22 THR 15 HG22 THR 15 4.606 -3.058 -26.430 129 HG23 THR 15 HG23 THR 15 5.686 -2.799 -25.061 130 H TYR 16 HN TYR 16 2.400 -6.170 -23.772 131 HA TYR 16 HA TYR 16 2.738 -8.181 -21.899 132 HB2 TYR 16 HB2 TYR 16 1.234 -9.536 -23.271 133 HB3 TYR 16 HB1 TYR 16 0.685 -7.865 -23.234 134 HD1 TYR 16 HD2 TYR 16 1.199 -6.340 -25.194 135 HD2 TYR 16 HD1 TYR 16 1.854 -10.586 -25.354 136 HE1 TYR 16 HE2 TYR 16 1.291 -6.237 -27.671 137 HE2 TYR 16 HE1 TYR 16 1.944 -10.477 -27.830 138 HH TYR 16 HH TYR 16 2.081 -9.097 -29.608 139 H ALA 17 HN ALA 17 3.612 -8.458 -25.351 140 HA ALA 17 HA ALA 17 4.947 -10.894 -25.203 141 HB1 ALA 17 HB1 ALA 17 4.444 -9.903 -27.343 142 HB2 ALA 17 HB2 ALA 17 6.193 -10.107 -27.235 143 HB3 ALA 17 HB3 ALA 17 5.474 -8.515 -26.997 144 H GLU 18 HN GLU 18 6.190 -7.627 -24.578 145 HA GLU 18 HA GLU 18 8.907 -8.386 -24.251 146 HB2 GLU 18 HB2 GLU 18 8.107 -6.049 -24.642 147 HB3 GLU 18 HB1 GLU 18 7.448 -6.039 -23.010 148 HG2 GLU 18 HG2 GLU 18 9.597 -4.979 -22.908 149 HG3 GLU 18 HG1 GLU 18 9.778 -6.556 -22.164 150 H ALA 19 HN ALA 19 6.274 -7.854 -21.895 151 HA ALA 19 HA ALA 19 7.676 -8.306 -19.545 152 HB1 ALA 19 HB1 ALA 19 5.486 -8.990 -18.590 153 HB2 ALA 19 HB2 ALA 19 4.819 -9.021 -20.222 154 HB3 ALA 19 HB3 ALA 19 5.392 -7.502 -19.533 155 H LYS 20 HN LYS 20 6.350 -10.627 -21.840 156 HA LYS 20 HA LYS 20 6.758 -12.957 -20.244 157 HB2 LYS 20 HB2 LYS 20 6.438 -12.584 -23.233 158 HB3 LYS 20 HB1 LYS 20 6.549 -14.159 -22.445 159 HG2 LYS 20 HG2 LYS 20 4.553 -13.697 -21.129 160 HG3 LYS 20 HG1 LYS 20 4.479 -12.054 -21.760 161 HD2 LYS 20 HD2 LYS 20 2.880 -13.385 -22.994 162 HD3 LYS 20 HD1 LYS 20 4.220 -13.014 -24.072 163 HE2 LYS 20 HE2 LYS 20 5.097 -15.229 -23.914 164 HE3 LYS 20 HE1 LYS 20 4.123 -15.602 -22.490 165 HZ1 LYS 20 HZ1 LYS 20 2.422 -14.810 -24.570 166 HZ2 LYS 20 HZ2 LYS 20 2.530 -16.328 -23.815 167 HZ3 LYS 20 HZ3 LYS 20 3.483 -15.984 -25.179 168 H ALA 21 HN ALA 21 8.760 -11.092 -22.421 169 HA ALA 21 HA ALA 21 10.777 -13.065 -22.831 170 HB1 ALA 21 HB1 ALA 21 10.436 -11.010 -24.242 171 HB2 ALA 21 HB2 ALA 21 12.107 -11.263 -23.738 172 HB3 ALA 21 HB3 ALA 21 11.112 -10.056 -22.925 173 H VAL 22 HN VAL 22 10.678 -10.239 -20.638 174 HA VAL 22 HA VAL 22 13.155 -10.731 -19.382 175 HB VAL 22 HB VAL 22 12.182 -9.334 -17.506 176 HG11 VAL 22 HG11 VAL 22 13.328 -8.250 -19.360 177 HG12 VAL 22 HG12 VAL 22 11.909 -7.297 -18.926 178 HG13 VAL 22 HG13 VAL 22 11.872 -8.337 -20.352 179 HG21 VAL 22 HG21 VAL 22 9.955 -8.336 -17.909 180 HG22 VAL 22 HG22 VAL 22 9.837 -10.087 -17.750 181 HG23 VAL 22 HG23 VAL 22 9.771 -9.341 -19.344 182 H CYS 23 HN CYS 23 9.942 -12.010 -18.791 183 HA CYS 23 HA CYS 23 10.936 -13.614 -16.504 184 HB2 CYS 23 HB2 CYS 23 8.491 -12.153 -16.946 185 HB3 CYS 23 HB1 CYS 23 8.068 -13.858 -16.859 186 H GLU 24 HN GLU 24 9.491 -15.740 -16.443 187 HA GLU 24 HA GLU 24 9.077 -17.832 -17.332 188 HB2 GLU 24 HB2 GLU 24 9.081 -16.353 -19.988 189 HB3 GLU 24 HB1 GLU 24 8.705 -18.039 -19.809 190 HG2 GLU 24 HG2 GLU 24 6.830 -17.533 -18.367 191 HG3 GLU 24 HG1 GLU 24 7.248 -15.822 -18.364 192 H PHE 25 HN PHE 25 11.822 -15.995 -17.965 193 HA PHE 25 HA PHE 25 13.381 -17.676 -19.600 194 HB2 PHE 25 HB2 PHE 25 14.003 -15.376 -19.075 195 HB3 PHE 25 HB1 PHE 25 14.201 -15.788 -17.376 196 HD1 PHE 25 HD1 PHE 25 15.506 -16.458 -20.806 197 HD2 PHE 25 HD2 PHE 25 16.254 -16.757 -16.584 198 HE1 PHE 25 HE1 PHE 25 17.861 -17.088 -21.264 199 HE2 PHE 25 HE2 PHE 25 18.604 -17.392 -17.047 200 HZ PHE 25 HZ PHE 25 19.410 -17.555 -19.385 201 H GLU 26 HN GLU 26 13.081 -17.535 -16.050 202 HA GLU 26 HA GLU 26 14.746 -19.929 -15.743 203 HB2 GLU 26 HB2 GLU 26 14.483 -19.568 -13.344 204 HB3 GLU 26 HB1 GLU 26 14.998 -18.083 -14.138 205 HG2 GLU 26 HG2 GLU 26 12.634 -17.308 -14.156 206 HG3 GLU 26 HG1 GLU 26 12.168 -18.767 -13.282 207 H GLY 27 HN GLY 27 11.996 -19.907 -17.046 208 HA2 GLY 27 HA3 GLY 27 10.438 -21.617 -17.279 209 HA3 GLY 27 HA2 GLY 27 11.071 -22.378 -15.826 210 H GLY 28 HN GLY 28 10.358 -19.066 -15.463 211 HA2 GLY 28 HA3 GLY 28 8.220 -19.628 -13.595 212 HA3 GLY 28 HA2 GLY 28 8.879 -18.045 -13.998 213 H HIS 29 HN HIS 29 6.455 -17.658 -13.822 214 HA HIS 29 HA HIS 29 5.405 -17.309 -16.483 215 HB2 HIS 29 HB2 HIS 29 3.337 -18.587 -16.157 216 HB3 HIS 29 HB1 HIS 29 4.745 -19.645 -16.077 217 HD1 HIS 29 HD1 HIS 29 5.626 -20.127 -13.518 218 HD2 HIS 29 HD2 HIS 29 1.704 -18.776 -13.935 219 HE1 HIS 29 HE1 HIS 29 4.440 -20.690 -11.352 220 HE2 HIS 29 HE2 HIS 29 2.048 -19.874 -11.590 221 H LEU 30 HN LEU 30 4.545 -15.362 -16.459 222 HA LEU 30 HA LEU 30 4.215 -13.639 -14.372 223 HB2 LEU 30 HB2 LEU 30 2.229 -13.751 -16.659 224 HB3 LEU 30 HB1 LEU 30 2.736 -12.335 -15.744 225 HG LEU 30 HG LEU 30 4.521 -13.966 -17.582 226 HD11 LEU 30 HD11 LEU 30 2.750 -12.649 -18.734 227 HD12 LEU 30 HD12 LEU 30 4.370 -12.041 -19.078 228 HD13 LEU 30 HD13 LEU 30 3.338 -11.196 -17.923 229 HD21 LEU 30 HD21 LEU 30 6.042 -11.943 -17.291 230 HD22 LEU 30 HD22 LEU 30 5.889 -12.960 -15.863 231 HD23 LEU 30 HD23 LEU 30 4.996 -11.444 -15.964 232 H ALA 31 HN ALA 31 2.771 -13.256 -12.765 233 HA ALA 31 HA ALA 31 1.009 -15.316 -11.947 234 HB1 ALA 31 HB1 ALA 31 2.069 -13.824 -10.335 235 HB2 ALA 31 HB2 ALA 31 0.315 -13.716 -10.195 236 HB3 ALA 31 HB3 ALA 31 1.214 -12.444 -11.022 237 H THR 32 HN THR 32 -1.205 -15.454 -11.952 238 HA THR 32 HA THR 32 -2.689 -13.517 -13.668 239 HB THR 32 HB THR 32 -3.864 -15.265 -14.710 240 HG1 THR 32 HG1 THR 32 -2.798 -17.254 -13.076 241 HG21 THR 32 HG21 THR 32 -1.143 -16.503 -14.226 242 HG22 THR 32 HG22 THR 32 -1.417 -15.156 -15.333 243 HG23 THR 32 HG23 THR 32 -2.181 -16.717 -15.635 244 H TYR 33 HN TYR 33 -5.139 -13.939 -13.351 245 HA TYR 33 HA TYR 33 -5.932 -13.012 -10.872 246 HB2 TYR 33 HB2 TYR 33 -7.355 -12.847 -12.816 247 HB3 TYR 33 HB1 TYR 33 -7.478 -14.599 -12.925 248 HD1 TYR 33 HD2 TYR 33 -8.653 -15.883 -11.126 249 HD2 TYR 33 HD1 TYR 33 -8.774 -11.590 -11.293 250 HE1 TYR 33 HE2 TYR 33 -10.622 -15.880 -9.622 251 HE2 TYR 33 HE1 TYR 33 -10.755 -11.594 -9.789 252 HH TYR 33 HH TYR 33 -11.858 -12.964 -8.209 253 H LYS 34 HN LYS 34 -5.271 -16.273 -11.892 254 HA LYS 34 HA LYS 34 -6.630 -17.636 -9.773 255 HB2 LYS 34 HB2 LYS 34 -5.987 -18.706 -11.921 256 HB3 LYS 34 HB1 LYS 34 -4.292 -18.557 -11.466 257 HG2 LYS 34 HG2 LYS 34 -4.652 -19.996 -9.520 258 HG3 LYS 34 HG1 LYS 34 -6.379 -20.085 -9.878 259 HD2 LYS 34 HD2 LYS 34 -5.868 -21.150 -12.051 260 HD3 LYS 34 HD1 LYS 34 -4.146 -21.078 -11.680 261 HE2 LYS 34 HE2 LYS 34 -4.490 -22.516 -9.716 262 HE3 LYS 34 HE1 LYS 34 -6.222 -22.561 -10.038 263 HZ1 LYS 34 HZ1 LYS 34 -5.369 -24.506 -10.980 264 HZ2 LYS 34 HZ2 LYS 34 -4.027 -23.712 -11.652 265 HZ3 LYS 34 HZ3 LYS 34 -5.576 -23.460 -12.299 266 H GLN 35 HN GLN 35 -3.155 -16.995 -10.320 267 HA GLN 35 HA GLN 35 -2.380 -17.836 -7.700 268 HB2 GLN 35 HB2 GLN 35 -0.929 -16.219 -9.813 269 HB3 GLN 35 HB1 GLN 35 -0.190 -16.703 -8.285 270 HG2 GLN 35 HG2 GLN 35 -0.621 -19.075 -8.832 271 HG3 GLN 35 HG1 GLN 35 -1.346 -18.588 -10.363 272 HE21 GLN 35 HE21 GLN 35 1.587 -19.536 -8.933 273 HE22 GLN 35 HE22 GLN 35 2.637 -18.985 -10.147 274 H LEU 36 HN LEU 36 -3.210 -14.731 -9.140 275 HA LEU 36 HA LEU 36 -2.291 -13.049 -7.070 276 HB2 LEU 36 HB2 LEU 36 -4.425 -12.803 -9.161 277 HB3 LEU 36 HB1 LEU 36 -4.240 -11.526 -7.991 278 HG LEU 36 HG LEU 36 -1.971 -12.516 -9.748 279 HD11 LEU 36 HD11 LEU 36 -3.927 -10.224 -10.138 280 HD12 LEU 36 HD12 LEU 36 -3.684 -11.610 -11.203 281 HD13 LEU 36 HD13 LEU 36 -2.424 -10.388 -11.042 282 HD21 LEU 36 HD21 LEU 36 -1.115 -10.131 -9.166 283 HD22 LEU 36 HD22 LEU 36 -1.036 -11.324 -7.883 284 HD23 LEU 36 HD23 LEU 36 -2.334 -10.132 -7.893 285 H GLU 37 HN GLU 37 -5.381 -14.743 -7.516 286 HA GLU 37 HA GLU 37 -6.796 -13.586 -5.393 287 HB2 GLU 37 HB2 GLU 37 -7.760 -15.051 -7.174 288 HB3 GLU 37 HB1 GLU 37 -7.010 -16.439 -6.385 289 HG2 GLU 37 HG2 GLU 37 -8.289 -15.993 -4.338 290 HG3 GLU 37 HG1 GLU 37 -8.998 -14.560 -5.078 291 H ALA 38 HN ALA 38 -4.428 -16.184 -5.452 292 HA ALA 38 HA ALA 38 -4.849 -16.984 -2.711 293 HB1 ALA 38 HB1 ALA 38 -2.573 -17.547 -4.626 294 HB2 ALA 38 HB2 ALA 38 -3.965 -18.584 -4.317 295 HB3 ALA 38 HB3 ALA 38 -2.779 -18.298 -3.045 296 H ALA 39 HN ALA 39 -2.958 -14.582 -4.352 297 HA ALA 39 HA ALA 39 -1.033 -14.179 -2.268 298 HB1 ALA 39 HB1 ALA 39 -1.826 -12.183 -4.396 299 HB2 ALA 39 HB2 ALA 39 -0.734 -13.533 -4.701 300 HB3 ALA 39 HB3 ALA 39 -0.293 -12.292 -3.529 301 H ARG 40 HN ARG 40 -4.196 -12.851 -3.027 302 HA ARG 40 HA ARG 40 -4.147 -10.582 -1.377 303 HB2 ARG 40 HB2 ARG 40 -6.483 -12.422 -1.977 304 HB3 ARG 40 HB1 ARG 40 -6.626 -10.822 -1.260 305 HG2 ARG 40 HG2 ARG 40 -5.528 -11.454 -4.021 306 HG3 ARG 40 HG1 ARG 40 -7.089 -10.727 -3.667 307 HD2 ARG 40 HD2 ARG 40 -5.622 -8.909 -2.396 308 HD3 ARG 40 HD1 ARG 40 -4.350 -9.492 -3.474 309 HE ARG 40 HE ARG 40 -5.476 -8.515 -5.272 310 HH11 ARG 40 HH21 ARG 40 -7.489 -8.586 -2.440 311 HH12 ARG 40 HH22 ARG 40 -8.749 -7.652 -3.173 312 HH21 ARG 40 HH11 ARG 40 -7.188 -7.370 -6.239 313 HH22 ARG 40 HH12 ARG 40 -8.613 -7.027 -5.316 314 H LYS 41 HN LYS 41 -4.967 -13.951 -0.591 315 HA LYS 41 HA LYS 41 -5.708 -13.478 2.104 316 HB2 LYS 41 HB2 LYS 41 -4.591 -15.961 0.775 317 HB3 LYS 41 HB1 LYS 41 -5.219 -15.912 2.421 318 HG2 LYS 41 HG2 LYS 41 -7.415 -15.224 1.605 319 HG3 LYS 41 HG1 LYS 41 -6.802 -15.135 -0.043 320 HD2 LYS 41 HD2 LYS 41 -7.962 -17.245 0.185 321 HD3 LYS 41 HD1 LYS 41 -6.237 -17.587 0.097 322 HE2 LYS 41 HE2 LYS 41 -6.103 -18.068 2.427 323 HE3 LYS 41 HE1 LYS 41 -7.648 -17.286 2.767 324 HZ1 LYS 41 HZ1 LYS 41 -8.579 -19.262 2.534 325 HZ2 LYS 41 HZ2 LYS 41 -7.118 -19.962 2.023 326 HZ3 LYS 41 HZ3 LYS 41 -8.162 -19.246 0.889 327 H ILE 42 HN ILE 42 -2.690 -13.237 0.587 328 HA ILE 42 HA ILE 42 -1.160 -13.817 3.062 329 HB ILE 42 HB ILE 42 -0.158 -13.198 0.264 330 HG12 ILE 42 HG12 ILE 42 -0.268 -15.838 1.771 331 HG13 ILE 42 HG11 ILE 42 -1.424 -15.365 0.531 332 HG21 ILE 42 HG21 ILE 42 1.223 -13.769 2.896 333 HG22 ILE 42 HG22 ILE 42 1.670 -12.621 1.635 334 HG23 ILE 42 HG23 ILE 42 1.974 -14.330 1.407 335 HD11 ILE 42 HD11 ILE 42 0.083 -16.629 -0.719 336 HD12 ILE 42 HD12 ILE 42 1.470 -16.112 0.235 337 HD13 ILE 42 HD13 ILE 42 0.760 -15.017 -0.945 338 H GLY 43 HN GLY 43 -2.859 -11.304 2.004 339 HA2 GLY 43 HA3 GLY 43 -2.863 -9.133 2.844 340 HA3 GLY 43 HA2 GLY 43 -1.228 -9.366 3.449 341 H PHE 44 HN PHE 44 -1.910 -10.198 0.153 342 HA PHE 44 HA PHE 44 0.028 -8.363 -0.855 343 HB2 PHE 44 HB2 PHE 44 -0.597 -10.618 -1.832 344 HB3 PHE 44 HB1 PHE 44 -2.065 -9.878 -2.441 345 HD1 PHE 44 HD1 PHE 44 1.645 -9.282 -2.351 346 HD2 PHE 44 HD2 PHE 44 -1.987 -8.969 -4.641 347 HE1 PHE 44 HE1 PHE 44 2.939 -8.478 -4.303 348 HE2 PHE 44 HE2 PHE 44 -0.682 -8.168 -6.588 349 HZ PHE 44 HZ PHE 44 1.781 -7.927 -6.420 350 H HIS 45 HN HIS 45 -0.204 -6.366 -1.648 351 HA HIS 45 HA HIS 45 -2.804 -5.350 -2.527 352 HB2 HIS 45 HB2 HIS 45 -2.943 -4.979 -0.130 353 HB3 HIS 45 HB1 HIS 45 -1.346 -4.240 -0.110 354 HD1 HIS 45 HD1 HIS 45 -4.705 -3.640 -1.849 355 HD2 HIS 45 HD2 HIS 45 -1.460 -1.505 -0.336 356 HE1 HIS 45 HE1 HIS 45 -5.272 -1.185 -2.113 357 HE2 HIS 45 HE2 HIS 45 -3.310 0.129 -1.183 358 H VAL 46 HN VAL 46 -2.147 -4.709 -4.481 359 HA VAL 46 HA VAL 46 -0.093 -2.586 -4.622 360 HB VAL 46 HB VAL 46 1.052 -4.715 -5.160 361 HG11 VAL 46 HG11 VAL 46 -1.078 -5.794 -6.119 362 HG12 VAL 46 HG12 VAL 46 0.414 -6.076 -7.013 363 HG13 VAL 46 HG13 VAL 46 -0.745 -4.892 -7.601 364 HG21 VAL 46 HG21 VAL 46 2.071 -3.936 -7.213 365 HG22 VAL 46 HG22 VAL 46 1.644 -2.518 -6.259 366 HG23 VAL 46 HG23 VAL 46 0.637 -2.996 -7.627 367 H CYS 47 HN CYS 47 -0.801 -0.924 -5.755 368 HA CYS 47 HA CYS 47 -3.139 -1.268 -7.553 369 HB2 CYS 47 HB2 CYS 47 -3.148 0.360 -5.536 370 HB3 CYS 47 HB1 CYS 47 -2.120 1.387 -6.529 371 H ALA 48 HN ALA 48 -1.809 -2.067 -9.278 372 HA ALA 48 HA ALA 48 -0.875 0.058 -11.009 373 HB1 ALA 48 HB1 ALA 48 1.133 -0.349 -9.615 374 HB2 ALA 48 HB2 ALA 48 1.393 -0.789 -11.302 375 HB3 ALA 48 HB3 ALA 48 1.107 -2.043 -10.099 376 H ALA 49 HN ALA 49 -1.732 -0.462 -12.887 377 HA ALA 49 HA ALA 49 -2.632 -3.095 -13.527 378 HB1 ALA 49 HB1 ALA 49 -3.845 -1.272 -14.453 379 HB2 ALA 49 HB2 ALA 49 -3.048 -2.049 -15.811 380 HB3 ALA 49 HB3 ALA 49 -2.396 -0.556 -15.139 381 H GLY 50 HN GLY 50 -1.557 -4.729 -14.371 382 HA2 GLY 50 HA3 GLY 50 0.848 -4.210 -16.038 383 HA3 GLY 50 HA2 GLY 50 0.954 -5.313 -14.673 384 H TRP 51 HN TRP 51 1.383 -5.804 -17.511 385 HA TRP 51 HA TRP 51 -0.826 -7.302 -18.563 386 HB2 TRP 51 HB2 TRP 51 2.110 -7.261 -19.310 387 HB3 TRP 51 HB1 TRP 51 0.878 -8.150 -20.203 388 HD1 TRP 51 HD1 TRP 51 2.572 -4.936 -20.223 389 HE1 TRP 51 HE1 TRP 51 1.276 -3.202 -21.613 390 HE3 TRP 51 HE3 TRP 51 -1.930 -7.324 -20.671 391 HZ2 TRP 51 HZ2 TRP 51 -1.315 -2.861 -22.758 392 HZ3 TRP 51 HZ3 TRP 51 -3.790 -6.259 -21.909 393 HH2 TRP 51 HH2 TRP 51 -3.483 -4.029 -22.949 394 H MET 52 HN MET 52 -1.076 -9.521 -18.678 395 HA MET 52 HA MET 52 0.800 -11.285 -17.271 396 HB2 MET 52 HB2 MET 52 -2.120 -11.238 -16.455 397 HB3 MET 52 HB1 MET 52 -0.828 -12.200 -15.764 398 HG2 MET 52 HG2 MET 52 0.311 -10.070 -15.062 399 HG3 MET 52 HG1 MET 52 -1.112 -9.184 -15.607 400 HE1 MET 52 HE1 MET 52 -3.491 -9.997 -14.995 401 HE2 MET 52 HE2 MET 52 -3.107 -8.642 -13.940 402 HE3 MET 52 HE3 MET 52 -3.905 -10.067 -13.280 403 H ALA 53 HN ALA 53 -0.302 -13.592 -17.269 404 HA ALA 53 HA ALA 53 -0.256 -14.723 -19.700 405 HB1 ALA 53 HB1 ALA 53 -0.676 -15.913 -17.527 406 HB2 ALA 53 HB2 ALA 53 -1.606 -16.535 -18.890 407 HB3 ALA 53 HB3 ALA 53 -2.381 -15.496 -17.695 408 H LYS 54 HN LYS 54 -1.507 -15.054 -21.470 409 HA LYS 54 HA LYS 54 -3.027 -14.547 -23.106 410 HB2 LYS 54 HB2 LYS 54 -4.890 -14.403 -20.718 411 HB3 LYS 54 HB1 LYS 54 -5.409 -14.426 -22.399 412 HG2 LYS 54 HG2 LYS 54 -4.355 -16.622 -22.716 413 HG3 LYS 54 HG1 LYS 54 -3.793 -16.603 -21.041 414 HD2 LYS 54 HD2 LYS 54 -6.187 -16.396 -20.303 415 HD3 LYS 54 HD1 LYS 54 -6.675 -16.601 -21.986 416 HE2 LYS 54 HE2 LYS 54 -4.992 -18.602 -20.453 417 HE3 LYS 54 HE1 LYS 54 -6.738 -18.727 -20.654 418 HZ1 LYS 54 HZ1 LYS 54 -4.654 -18.823 -22.754 419 HZ2 LYS 54 HZ2 LYS 54 -6.298 -18.584 -23.110 420 HZ3 LYS 54 HZ3 LYS 54 -5.789 -20.017 -22.353 421 H GLY 55 HN GLY 55 -1.751 -12.348 -21.250 422 HA2 GLY 55 HA3 GLY 55 -1.536 -10.064 -21.514 423 HA3 GLY 55 HA2 GLY 55 -2.766 -10.131 -22.758 424 H ARG 56 HN ARG 56 -3.486 -11.508 -19.668 425 HA ARG 56 HA ARG 56 -5.688 -9.690 -19.288 426 HB2 ARG 56 HB2 ARG 56 -5.611 -12.160 -18.643 427 HB3 ARG 56 HB1 ARG 56 -4.620 -11.675 -17.275 428 HG2 ARG 56 HG2 ARG 56 -6.414 -10.175 -16.487 429 HG3 ARG 56 HG1 ARG 56 -7.398 -10.636 -17.878 430 HD2 ARG 56 HD2 ARG 56 -7.451 -12.950 -17.143 431 HD3 ARG 56 HD1 ARG 56 -6.368 -12.581 -15.807 432 HE ARG 56 HE ARG 56 -8.198 -11.812 -14.616 433 HH11 ARG 56 HH21 ARG 56 -8.940 -11.712 -18.017 434 HH12 ARG 56 HH22 ARG 56 -10.634 -11.462 -17.754 435 HH21 ARG 56 HH11 ARG 56 -10.437 -11.608 -14.306 436 HH22 ARG 56 HH12 ARG 56 -11.485 -11.470 -15.680 437 H VAL 57 HN VAL 57 -5.841 -7.947 -17.983 438 HA VAL 57 HA VAL 57 -3.713 -7.370 -16.013 439 HB VAL 57 HB VAL 57 -2.869 -6.233 -17.961 440 HG11 VAL 57 HG11 VAL 57 -5.609 -4.972 -18.223 441 HG12 VAL 57 HG12 VAL 57 -4.950 -6.224 -19.278 442 HG13 VAL 57 HG13 VAL 57 -4.208 -4.627 -19.236 443 HG21 VAL 57 HG21 VAL 57 -4.317 -4.090 -16.375 444 HG22 VAL 57 HG22 VAL 57 -2.736 -3.990 -17.151 445 HG23 VAL 57 HG23 VAL 57 -2.952 -4.989 -15.716 446 H GLY 58 HN GLY 58 -4.280 -5.758 -14.468 447 HA2 GLY 58 HA3 GLY 58 -6.839 -4.522 -14.389 448 HA3 GLY 58 HA2 GLY 58 -6.853 -6.009 -13.447 449 H TYR 59 HN TYR 59 -7.392 -4.053 -11.941 450 HA TYR 59 HA TYR 59 -4.864 -3.146 -10.630 451 HB2 TYR 59 HB2 TYR 59 -7.493 -1.770 -10.193 452 HB3 TYR 59 HB1 TYR 59 -5.866 -1.134 -10.031 453 HD1 TYR 59 HD1 TYR 59 -8.269 -2.494 -12.553 454 HD2 TYR 59 HD2 TYR 59 -4.959 0.155 -11.831 455 HE1 TYR 59 HE1 TYR 59 -8.478 -1.599 -14.853 456 HE2 TYR 59 HE2 TYR 59 -5.170 1.040 -14.139 457 HH TYR 59 HH TYR 59 -6.447 -0.296 -16.511 458 HA PRO 60 HA PRO 60 -7.245 -6.123 -7.838 459 HB2 PRO 60 HB2 PRO 60 -4.994 -7.548 -7.028 460 HB3 PRO 60 HB1 PRO 60 -5.985 -7.985 -8.436 461 HG2 PRO 60 HG2 PRO 60 -3.442 -6.388 -8.351 462 HG3 PRO 60 HG1 PRO 60 -3.888 -7.723 -9.439 463 HD2 PRO 60 HD2 PRO 60 -4.082 -5.204 -10.287 464 HD3 PRO 60 HD1 PRO 60 -5.358 -6.366 -10.704 465 H ILE 61 HN ILE 61 -7.754 -5.124 -6.000 466 HA ILE 61 HA ILE 61 -5.643 -4.340 -4.108 467 HB ILE 61 HB ILE 61 -6.780 -2.147 -3.711 468 HG12 ILE 61 HG12 ILE 61 -8.179 -2.725 -6.345 469 HG13 ILE 61 HG11 ILE 61 -8.969 -2.852 -4.775 470 HG21 ILE 61 HG21 ILE 61 -4.742 -2.413 -5.172 471 HG22 ILE 61 HG22 ILE 61 -5.743 -1.023 -5.584 472 HG23 ILE 61 HG23 ILE 61 -5.820 -2.484 -6.568 473 HD11 ILE 61 HD11 ILE 61 -7.634 -0.326 -5.790 474 HD12 ILE 61 HD12 ILE 61 -8.598 -0.501 -4.327 475 HD13 ILE 61 HD13 ILE 61 -9.361 -0.651 -5.906 476 H VAL 62 HN VAL 62 -6.269 -4.333 -1.984 477 HA VAL 62 HA VAL 62 -8.441 -6.071 -1.317 478 HB VAL 62 HB VAL 62 -6.977 -4.298 0.656 479 HG11 VAL 62 HG11 VAL 62 -8.899 -5.793 1.378 480 HG12 VAL 62 HG12 VAL 62 -7.364 -6.124 2.184 481 HG13 VAL 62 HG13 VAL 62 -7.922 -7.175 0.880 482 HG21 VAL 62 HG21 VAL 62 -5.265 -6.136 0.753 483 HG22 VAL 62 HG22 VAL 62 -5.246 -5.239 -0.763 484 HG23 VAL 62 HG23 VAL 62 -5.998 -6.834 -0.693 485 H LYS 63 HN LYS 63 -7.845 -2.728 -0.219 486 HA LYS 63 HA LYS 63 -10.648 -2.012 -0.697 487 HB2 LYS 63 HB2 LYS 63 -9.660 -1.144 1.997 488 HB3 LYS 63 HB1 LYS 63 -11.270 -1.641 1.497 489 HG2 LYS 63 HG2 LYS 63 -10.528 -4.005 1.474 490 HG3 LYS 63 HG1 LYS 63 -8.925 -3.497 2.007 491 HD2 LYS 63 HD2 LYS 63 -9.937 -2.510 4.045 492 HD3 LYS 63 HD1 LYS 63 -11.517 -3.100 3.525 493 HE2 LYS 63 HE2 LYS 63 -10.696 -5.409 3.568 494 HE3 LYS 63 HE1 LYS 63 -9.087 -4.845 4.023 495 HZ1 LYS 63 HZ1 LYS 63 -11.362 -4.017 5.666 496 HZ2 LYS 63 HZ2 LYS 63 -9.753 -4.328 6.119 497 HZ3 LYS 63 HZ3 LYS 63 -10.818 -5.616 5.814 498 HA PRO 64 HA PRO 64 -7.853 1.898 0.034 499 HB2 PRO 64 HB2 PRO 64 -5.134 0.744 -0.499 500 HB3 PRO 64 HB1 PRO 64 -5.632 1.912 0.742 501 HG2 PRO 64 HG2 PRO 64 -5.067 -0.596 1.415 502 HG3 PRO 64 HG1 PRO 64 -6.441 0.246 2.165 503 HD2 PRO 64 HD2 PRO 64 -6.486 -1.740 -0.111 504 HD3 PRO 64 HD1 PRO 64 -7.509 -1.693 1.338 505 H GLY 65 HN GLY 65 -7.311 3.320 -1.646 506 HA2 GLY 65 HA3 GLY 65 -6.276 2.439 -4.173 507 HA3 GLY 65 HA2 GLY 65 -8.020 2.681 -4.235 508 HA PRO 66 HA PRO 66 -6.538 7.089 -3.116 509 HB2 PRO 66 HB2 PRO 66 -3.891 7.487 -2.450 510 HB3 PRO 66 HB1 PRO 66 -5.124 7.022 -1.258 511 HG2 PRO 66 HG2 PRO 66 -3.175 5.265 -2.723 512 HG3 PRO 66 HG1 PRO 66 -3.569 5.292 -0.992 513 HD2 PRO 66 HD2 PRO 66 -4.684 3.449 -2.628 514 HD3 PRO 66 HD1 PRO 66 -5.625 4.185 -1.309 515 H ASN 67 HN ASN 67 -3.671 5.464 -4.492 516 HA ASN 67 HA ASN 67 -3.220 7.493 -6.473 517 HB2 ASN 67 HB2 ASN 67 -1.429 6.056 -5.488 518 HB3 ASN 67 HB1 ASN 67 -2.121 4.677 -6.341 519 HD21 ASN 67 HD21 ASN 67 -0.220 4.419 -7.704 520 HD22 ASN 67 HD22 ASN 67 0.143 5.531 -8.932 521 H CYS 68 HN CYS 68 -5.268 4.763 -6.247 522 HA CYS 68 HA CYS 68 -6.459 5.254 -8.783 523 HB2 CYS 68 HB2 CYS 68 -5.807 2.685 -9.476 524 HB3 CYS 68 HB1 CYS 68 -4.897 4.087 -10.029 525 H GLY 69 HN GLY 69 -8.509 4.575 -8.715 526 HA2 GLY 69 HA3 GLY 69 -9.557 2.207 -7.762 527 HA3 GLY 69 HA2 GLY 69 -9.523 3.289 -6.372 528 H PHE 70 HN PHE 70 -10.117 4.104 -9.769 529 HA PHE 70 HA PHE 70 -12.286 5.815 -9.230 530 HB2 PHE 70 HB2 PHE 70 -11.509 4.367 -11.775 531 HB3 PHE 70 HB1 PHE 70 -12.729 5.634 -11.691 532 HD1 PHE 70 HD2 PHE 70 -12.090 7.959 -11.024 533 HD2 PHE 70 HD1 PHE 70 -9.146 4.905 -11.713 534 HE1 PHE 70 HE2 PHE 70 -10.332 9.697 -11.224 535 HE2 PHE 70 HE1 PHE 70 -7.390 6.645 -11.915 536 HZ PHE 70 HZ PHE 70 -7.983 9.040 -11.671 537 H GLY 71 HN GLY 71 -12.151 2.424 -10.217 538 HA2 GLY 71 HA3 GLY 71 -14.951 2.063 -10.552 539 HA3 GLY 71 HA2 GLY 71 -13.765 0.781 -10.338 540 H LYS 72 HN LYS 72 -13.178 0.157 -8.192 541 HA LYS 72 HA LYS 72 -14.441 1.218 -5.867 542 HB2 LYS 72 HB2 LYS 72 -15.990 -0.633 -5.398 543 HB3 LYS 72 HB1 LYS 72 -16.444 0.198 -6.879 544 HG2 LYS 72 HG2 LYS 72 -15.137 -1.563 -8.155 545 HG3 LYS 72 HG1 LYS 72 -14.982 -2.448 -6.639 546 HD2 LYS 72 HD2 LYS 72 -17.631 -1.629 -7.886 547 HD3 LYS 72 HD1 LYS 72 -16.905 -3.225 -8.054 548 HE2 LYS 72 HE2 LYS 72 -16.887 -3.330 -5.486 549 HE3 LYS 72 HE1 LYS 72 -17.947 -1.920 -5.530 550 HZ1 LYS 72 HZ1 LYS 72 -19.615 -3.317 -5.819 551 HZ2 LYS 72 HZ2 LYS 72 -18.572 -4.641 -6.022 552 HZ3 LYS 72 HZ3 LYS 72 -18.997 -3.680 -7.356 553 H THR 73 HN THR 73 -14.616 -1.290 -4.458 554 HA THR 73 HA THR 73 -11.732 -1.813 -4.111 555 HB THR 73 HB THR 73 -12.444 -2.923 -2.001 556 HG1 THR 73 HG1 THR 73 -14.633 -3.285 -2.987 557 HG21 THR 73 HG21 THR 73 -13.609 -0.141 -2.268 558 HG22 THR 73 HG22 THR 73 -11.878 -0.467 -2.143 559 HG23 THR 73 HG23 THR 73 -12.954 -0.891 -0.814 560 H GLY 74 HN GLY 74 -11.037 -4.016 -3.690 561 HA2 GLY 74 HA3 GLY 74 -11.155 -6.357 -3.964 562 HA3 GLY 74 HA2 GLY 74 -12.667 -6.178 -4.846 563 H ILE 75 HN ILE 75 -11.991 -7.472 -6.549 564 HA ILE 75 HA ILE 75 -9.680 -6.549 -8.169 565 HB ILE 75 HB ILE 75 -11.254 -9.136 -8.317 566 HG12 ILE 75 HG12 ILE 75 -8.424 -8.662 -7.322 567 HG13 ILE 75 HG11 ILE 75 -9.812 -8.758 -6.239 568 HG21 ILE 75 HG21 ILE 75 -10.332 -8.659 -10.485 569 HG22 ILE 75 HG22 ILE 75 -9.216 -9.797 -9.738 570 HG23 ILE 75 HG23 ILE 75 -8.815 -8.085 -9.794 571 HD11 ILE 75 HD11 ILE 75 -8.758 -10.942 -6.356 572 HD12 ILE 75 HD12 ILE 75 -8.827 -10.921 -8.120 573 HD13 ILE 75 HD13 ILE 75 -10.315 -11.024 -7.178 574 H ILE 76 HN ILE 76 -10.055 -5.375 -9.909 575 HA ILE 76 HA ILE 76 -12.778 -5.152 -11.010 576 HB ILE 76 HB ILE 76 -10.262 -3.585 -11.667 577 HG12 ILE 76 HG12 ILE 76 -12.649 -2.734 -9.981 578 HG13 ILE 76 HG11 ILE 76 -11.159 -3.363 -9.283 579 HG21 ILE 76 HG21 ILE 76 -13.193 -3.230 -12.397 580 HG22 ILE 76 HG22 ILE 76 -11.848 -3.490 -13.499 581 HG23 ILE 76 HG23 ILE 76 -11.978 -1.973 -12.620 582 HD11 ILE 76 HD11 ILE 76 -11.193 -0.991 -11.171 583 HD12 ILE 76 HD12 ILE 76 -9.871 -1.539 -10.144 584 HD13 ILE 76 HD13 ILE 76 -11.309 -0.825 -9.419 585 H ASP 77 HN ASP 77 -13.372 -6.028 -12.892 586 HA ASP 77 HA ASP 77 -11.458 -7.672 -14.371 587 HB2 ASP 77 HB2 ASP 77 -13.828 -8.389 -13.806 588 HB3 ASP 77 HB1 ASP 77 -14.388 -7.215 -14.990 589 H TYR 78 HN TYR 78 -10.118 -6.338 -15.461 590 HA TYR 78 HA TYR 78 -11.255 -4.930 -17.778 591 HB2 TYR 78 HB2 TYR 78 -10.763 -3.419 -15.593 592 HB3 TYR 78 HB1 TYR 78 -9.143 -3.409 -16.262 593 HD1 TYR 78 HD1 TYR 78 -12.681 -2.537 -16.873 594 HD2 TYR 78 HD2 TYR 78 -8.655 -2.194 -18.331 595 HE1 TYR 78 HE1 TYR 78 -13.415 -0.808 -18.475 596 HE2 TYR 78 HE2 TYR 78 -9.391 -0.457 -19.944 597 HH TYR 78 HH TYR 78 -12.297 1.148 -19.711 598 H GLY 79 HN GLY 79 -9.877 -7.366 -17.703 599 HA2 GLY 79 HA3 GLY 79 -7.107 -6.808 -18.458 600 HA3 GLY 79 HA2 GLY 79 -7.848 -8.384 -18.280 601 H ILE 80 HN ILE 80 -7.140 -9.140 -20.225 602 HA ILE 80 HA ILE 80 -6.748 -8.969 -22.584 603 HB ILE 80 HB ILE 80 -9.734 -9.493 -22.430 604 HG12 ILE 80 HG12 ILE 80 -7.476 -11.392 -21.682 605 HG13 ILE 80 HG11 ILE 80 -8.626 -10.688 -20.548 606 HG21 ILE 80 HG21 ILE 80 -8.518 -9.484 -24.646 607 HG22 ILE 80 HG22 ILE 80 -9.270 -11.028 -24.250 608 HG23 ILE 80 HG23 ILE 80 -7.526 -10.816 -24.046 609 HD11 ILE 80 HD11 ILE 80 -9.247 -12.600 -22.816 610 HD12 ILE 80 HD12 ILE 80 -10.480 -11.752 -21.882 611 HD13 ILE 80 HD13 ILE 80 -9.408 -12.902 -21.086 612 H ARG 81 HN ARG 81 -6.611 -6.428 -22.224 613 HA ARG 81 HA ARG 81 -8.792 -4.832 -23.164 614 HB2 ARG 81 HB2 ARG 81 -5.837 -4.199 -22.896 615 HB3 ARG 81 HB1 ARG 81 -7.095 -3.008 -23.213 616 HG2 ARG 81 HG2 ARG 81 -8.183 -3.546 -21.080 617 HG3 ARG 81 HG1 ARG 81 -6.998 -4.813 -20.770 618 HD2 ARG 81 HD2 ARG 81 -6.344 -2.864 -19.501 619 HD3 ARG 81 HD1 ARG 81 -5.193 -3.045 -20.818 620 HE ARG 81 HE ARG 81 -7.322 -1.315 -21.597 621 HH11 ARG 81 HH21 ARG 81 -4.421 -1.473 -19.687 622 HH12 ARG 81 HH22 ARG 81 -4.218 0.248 -19.626 623 HH21 ARG 81 HH11 ARG 81 -7.013 0.934 -21.551 624 HH22 ARG 81 HH12 ARG 81 -5.668 1.601 -20.686 625 H LEU 82 HN LEU 82 -8.983 -3.744 -25.155 626 HA LEU 82 HA LEU 82 -8.125 -5.284 -27.444 627 HB2 LEU 82 HB2 LEU 82 -9.805 -2.809 -27.019 628 HB3 LEU 82 HB1 LEU 82 -9.318 -3.275 -28.647 629 HG LEU 82 HG LEU 82 -10.377 -5.478 -28.352 630 HD11 LEU 82 HD11 LEU 82 -11.041 -4.396 -25.595 631 HD12 LEU 82 HD12 LEU 82 -10.149 -5.867 -25.986 632 HD13 LEU 82 HD13 LEU 82 -11.877 -5.776 -26.312 633 HD21 LEU 82 HD21 LEU 82 -12.739 -4.662 -28.229 634 HD22 LEU 82 HD22 LEU 82 -11.726 -3.657 -29.267 635 HD23 LEU 82 HD23 LEU 82 -12.140 -3.111 -27.641 636 H ASN 83 HN ASN 83 -6.861 -2.671 -25.658 637 HA ASN 83 HA ASN 83 -5.244 -1.616 -27.859 638 HB2 ASN 83 HB2 ASN 83 -4.699 0.191 -26.436 639 HB3 ASN 83 HB1 ASN 83 -6.400 -0.142 -26.125 640 HD21 ASN 83 HD21 ASN 83 -6.957 -0.403 -23.969 641 HD22 ASN 83 HD22 ASN 83 -5.853 -0.709 -22.720 642 H ARG 84 HN ARG 84 -4.888 -4.362 -26.747 643 HA ARG 84 HA ARG 84 -2.629 -4.561 -25.116 644 HB2 ARG 84 HB2 ARG 84 -3.973 -6.373 -27.079 645 HB3 ARG 84 HB1 ARG 84 -2.307 -6.791 -26.680 646 HG2 ARG 84 HG2 ARG 84 -2.882 -6.751 -24.271 647 HG3 ARG 84 HG1 ARG 84 -4.549 -6.377 -24.673 648 HD2 ARG 84 HD2 ARG 84 -3.118 -8.850 -25.665 649 HD3 ARG 84 HD1 ARG 84 -4.035 -8.819 -24.172 650 HE ARG 84 HE ARG 84 -5.640 -7.942 -26.361 651 HH11 ARG 84 HH21 ARG 84 -4.299 -10.648 -24.685 652 HH12 ARG 84 HH22 ARG 84 -5.336 -11.820 -25.425 653 HH21 ARG 84 HH11 ARG 84 -7.035 -9.503 -27.356 654 HH22 ARG 84 HH12 ARG 84 -6.868 -11.177 -26.942 655 H SER 85 HN SER 85 -2.646 -2.791 -27.786 656 HA SER 85 HA SER 85 0.009 -3.522 -28.808 657 HB2 SER 85 HB2 SER 85 -1.731 -2.897 -30.422 658 HB3 SER 85 HB1 SER 85 -1.923 -1.338 -29.627 659 HG SER 85 HG SER 85 0.219 -0.863 -30.166 660 H GLU 86 HN GLU 86 -1.297 -1.633 -26.338 661 HA GLU 86 HA GLU 86 0.655 0.531 -26.433 662 HB2 GLU 86 HB2 GLU 86 -1.464 -0.202 -24.391 663 HB3 GLU 86 HB1 GLU 86 -0.434 1.223 -24.295 664 HG2 GLU 86 HG2 GLU 86 -1.310 2.033 -26.437 665 HG3 GLU 86 HG1 GLU 86 -2.329 0.601 -26.570 666 H ARG 87 HN ARG 87 1.238 0.850 -23.769 667 HA ARG 87 HA ARG 87 2.737 -1.592 -22.967 668 HB2 ARG 87 HB2 ARG 87 4.598 -0.012 -22.254 669 HB3 ARG 87 HB1 ARG 87 4.422 -0.261 -23.987 670 HG2 ARG 87 HG2 ARG 87 2.874 2.037 -22.799 671 HG3 ARG 87 HG1 ARG 87 4.620 2.222 -22.889 672 HD2 ARG 87 HD2 ARG 87 4.617 1.878 -25.269 673 HD3 ARG 87 HD1 ARG 87 2.918 1.427 -25.264 674 HE ARG 87 HE ARG 87 2.896 3.934 -24.185 675 HH11 ARG 87 HH21 ARG 87 4.236 2.512 -27.037 676 HH12 ARG 87 HH22 ARG 87 4.118 3.965 -27.975 677 HH21 ARG 87 HH11 ARG 87 2.668 5.821 -25.431 678 HH22 ARG 87 HH12 ARG 87 3.199 5.824 -27.079 679 H TRP 88 HN TRP 88 2.870 -1.997 -20.858 680 HA TRP 88 HA TRP 88 2.030 -0.054 -18.840 681 HB2 TRP 88 HB2 TRP 88 0.415 -2.526 -19.516 682 HB3 TRP 88 HB1 TRP 88 0.347 -1.791 -17.923 683 HD1 TRP 88 HD1 TRP 88 -0.436 -0.975 -21.611 684 HE1 TRP 88 HE1 TRP 88 -2.192 0.911 -21.652 685 HE3 TRP 88 HE3 TRP 88 -0.677 0.073 -16.642 686 HZ2 TRP 88 HZ2 TRP 88 -3.537 2.638 -19.794 687 HZ3 TRP 88 HZ3 TRP 88 -2.202 1.834 -15.789 688 HH2 TRP 88 HH2 TRP 88 -3.631 3.117 -17.359 689 H ASP 89 HN ASP 89 1.957 -1.288 -16.638 690 HA ASP 89 HA ASP 89 4.551 -2.229 -16.114 691 HB2 ASP 89 HB2 ASP 89 2.728 -1.220 -14.527 692 HB3 ASP 89 HB1 ASP 89 2.194 -2.882 -14.331 693 H ALA 90 HN ALA 90 4.222 -4.424 -14.455 694 HA ALA 90 HA ALA 90 2.872 -6.598 -15.716 695 HB1 ALA 90 HB1 ALA 90 4.867 -7.833 -16.510 696 HB2 ALA 90 HB2 ALA 90 5.857 -6.411 -16.184 697 HB3 ALA 90 HB3 ALA 90 4.601 -6.343 -17.419 698 H TYR 91 HN TYR 91 3.010 -8.503 -14.535 699 HA TYR 91 HA TYR 91 4.475 -8.335 -11.943 700 HB2 TYR 91 HB2 TYR 91 1.790 -9.590 -12.573 701 HB3 TYR 91 HB1 TYR 91 2.653 -9.814 -11.055 702 HD1 TYR 91 HD2 TYR 91 3.516 -7.532 -9.931 703 HD2 TYR 91 HD1 TYR 91 0.172 -7.839 -12.631 704 HE1 TYR 91 HE2 TYR 91 2.578 -5.428 -9.023 705 HE2 TYR 91 HE1 TYR 91 -0.766 -5.732 -11.701 706 HH TYR 91 HH TYR 91 -0.621 -4.293 -9.933 707 H CYS 92 HN CYS 92 5.752 -9.973 -11.409 708 HA CYS 92 HA CYS 92 5.844 -12.371 -13.184 709 HB2 CYS 92 HB2 CYS 92 7.991 -10.736 -11.888 710 HB3 CYS 92 HB1 CYS 92 8.280 -12.455 -12.105 711 H TYR 93 HN TYR 93 7.026 -14.192 -11.957 712 HA TYR 93 HA TYR 93 6.250 -14.420 -9.132 713 HB2 TYR 93 HB2 TYR 93 4.217 -15.110 -10.275 714 HB3 TYR 93 HB1 TYR 93 5.126 -16.196 -11.320 715 HD1 TYR 93 HD1 TYR 93 3.943 -15.619 -7.842 716 HD2 TYR 93 HD2 TYR 93 5.871 -18.371 -10.526 717 HE1 TYR 93 HE1 TYR 93 3.666 -17.442 -6.179 718 HE2 TYR 93 HE2 TYR 93 5.595 -20.187 -8.860 719 HH TYR 93 HH TYR 93 4.954 -19.716 -5.702 720 H ASN 94 HN ASN 94 7.272 -16.110 -8.054 721 HA ASN 94 HA ASN 94 9.264 -17.669 -9.567 722 HB2 ASN 94 HB2 ASN 94 10.349 -15.573 -8.812 723 HB3 ASN 94 HB1 ASN 94 9.988 -16.018 -7.144 724 HD21 ASN 94 HD21 ASN 94 12.482 -16.088 -9.322 725 HD22 ASN 94 HD22 ASN 94 13.312 -17.459 -8.761 726 HA PRO 95 HA PRO 95 7.725 -20.666 -6.558 727 HB2 PRO 95 HB2 PRO 95 9.209 -22.835 -7.258 728 HB3 PRO 95 HB1 PRO 95 7.932 -22.200 -8.322 729 HG2 PRO 95 HG2 PRO 95 10.896 -21.730 -8.456 730 HG3 PRO 95 HG1 PRO 95 9.770 -22.152 -9.765 731 HD2 PRO 95 HD2 PRO 95 10.585 -19.574 -9.311 732 HD3 PRO 95 HD1 PRO 95 8.975 -19.962 -9.969 733 H HIS 96 HN HIS 96 10.391 -18.945 -6.268 734 HA HIS 96 HA HIS 96 11.086 -20.025 -3.662 735 HB2 HIS 96 HB2 HIS 96 12.472 -21.417 -5.188 736 HB3 HIS 96 HB1 HIS 96 13.189 -19.946 -5.843 737 HD1 HIS 96 HD1 HIS 96 13.001 -21.974 -2.655 738 HD2 HIS 96 HD2 HIS 96 15.173 -18.774 -4.219 739 HE1 HIS 96 HE1 HIS 96 14.900 -21.535 -1.037 740 HE2 HIS 96 HE2 HIS 96 16.232 -19.588 -1.976 741 H ALA 97 HN ALA 97 10.182 -17.842 -3.296 742 HA ALA 97 HA ALA 97 11.436 -15.504 -4.247 743 HB1 ALA 97 HB1 ALA 97 9.886 -15.978 -1.690 744 HB2 ALA 97 HB2 ALA 97 9.219 -15.446 -3.234 745 HB3 ALA 97 HB3 ALA 97 10.313 -14.393 -2.335 746 H LYS 98 HN LYS 98 12.763 -14.025 -3.046 747 HA LYS 98 HA LYS 98 14.069 -14.841 -0.658 748 HB2 LYS 98 HB2 LYS 98 16.250 -15.347 -1.357 749 HB3 LYS 98 HB1 LYS 98 15.276 -16.204 -2.541 750 HG2 LYS 98 HG2 LYS 98 16.516 -13.464 -3.004 751 HG3 LYS 98 HG1 LYS 98 17.201 -14.982 -3.541 752 HD2 LYS 98 HD2 LYS 98 15.176 -15.442 -4.872 753 HD3 LYS 98 HD1 LYS 98 14.496 -13.894 -4.363 754 HE2 LYS 98 HE2 LYS 98 16.437 -12.726 -5.349 755 HE3 LYS 98 HE1 LYS 98 17.095 -14.274 -5.872 756 HZ1 LYS 98 HZ1 LYS 98 15.964 -13.374 -7.710 757 HZ2 LYS 98 HZ2 LYS 98 14.601 -12.962 -6.783 758 HZ3 LYS 98 HZ3 LYS 98 14.952 -14.593 -7.105 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 4.490 -13.077 -1.788 2 H2 GLY 1 H2 GLY 1 3.587 -14.246 -0.953 3 H3 GLY 1 H3 GLY 1 2.924 -13.467 -2.309 4 HA2 GLY 1 HA3 GLY 1 5.187 -15.388 -2.274 5 HA3 GLY 1 HA2 GLY 1 3.590 -15.638 -2.983 6 H VAL 2 HN VAL 2 3.344 -12.952 -4.019 7 HA VAL 2 HA VAL 2 4.872 -13.288 -6.484 8 HB VAL 2 HB VAL 2 2.747 -11.282 -5.676 9 HG11 VAL 2 HG11 VAL 2 4.173 -11.757 -8.312 10 HG12 VAL 2 HG12 VAL 2 4.113 -10.257 -7.386 11 HG13 VAL 2 HG13 VAL 2 2.659 -10.858 -8.175 12 HG21 VAL 2 HG21 VAL 2 2.647 -13.664 -7.555 13 HG22 VAL 2 HG22 VAL 2 1.293 -12.625 -7.105 14 HG23 VAL 2 HG23 VAL 2 2.039 -13.678 -5.901 15 H TYR 3 HN TYR 3 6.112 -11.625 -7.431 16 HA TYR 3 HA TYR 3 7.409 -9.775 -5.484 17 HB2 TYR 3 HB2 TYR 3 8.901 -11.581 -6.160 18 HB3 TYR 3 HB1 TYR 3 8.617 -11.212 -7.859 19 HD1 TYR 3 HD1 TYR 3 9.870 -9.720 -4.657 20 HD2 TYR 3 HD2 TYR 3 9.954 -9.555 -8.954 21 HE1 TYR 3 HE1 TYR 3 11.696 -8.041 -4.562 22 HE2 TYR 3 HE2 TYR 3 11.776 -7.879 -8.854 23 HH TYR 3 HH TYR 3 13.573 -7.279 -6.096 24 H HIS 4 HN HIS 4 7.332 -7.710 -5.920 25 HA HIS 4 HA HIS 4 5.932 -6.745 -8.242 26 HB2 HIS 4 HB2 HIS 4 6.359 -4.504 -7.303 27 HB3 HIS 4 HB1 HIS 4 5.711 -5.602 -6.088 28 HD1 HIS 4 HD1 HIS 4 8.645 -3.515 -6.881 29 HD2 HIS 4 HD2 HIS 4 7.717 -6.570 -4.202 30 HE1 HIS 4 HE1 HIS 4 10.476 -3.513 -5.133 31 HE2 HIS 4 HE2 HIS 4 9.926 -5.371 -3.491 32 H ARG 5 HN ARG 5 6.726 -6.184 -10.145 33 HA ARG 5 HA ARG 5 9.527 -5.319 -10.409 34 HB2 ARG 5 HB2 ARG 5 9.344 -7.895 -10.774 35 HB3 ARG 5 HB1 ARG 5 8.503 -7.494 -12.272 36 HG2 ARG 5 HG2 ARG 5 10.451 -6.011 -12.883 37 HG3 ARG 5 HG1 ARG 5 11.306 -6.634 -11.472 38 HD2 ARG 5 HD2 ARG 5 10.305 -8.258 -13.831 39 HD3 ARG 5 HD1 ARG 5 11.976 -7.841 -13.506 40 HE ARG 5 HE ARG 5 10.812 -9.269 -11.321 41 HH11 ARG 5 HH21 ARG 5 12.309 -9.538 -14.449 42 HH12 ARG 5 HH22 ARG 5 12.460 -11.265 -14.387 43 HH21 ARG 5 HH11 ARG 5 11.017 -11.555 -11.228 44 HH22 ARG 5 HH12 ARG 5 11.716 -12.409 -12.568 45 H GLU 6 HN GLU 6 9.664 -3.653 -11.756 46 HA GLU 6 HA GLU 6 7.772 -3.334 -13.988 47 HB2 GLU 6 HB2 GLU 6 7.212 -1.043 -13.327 48 HB3 GLU 6 HB1 GLU 6 6.714 -2.177 -12.076 49 HG2 GLU 6 HG2 GLU 6 9.299 -0.573 -11.999 50 HG3 GLU 6 HG1 GLU 6 7.820 -0.131 -11.164 51 H ALA 7 HN ALA 7 8.394 -1.033 -15.004 52 HA ALA 7 HA ALA 7 10.999 -1.384 -16.079 53 HB1 ALA 7 HB1 ALA 7 10.576 0.680 -17.288 54 HB2 ALA 7 HB2 ALA 7 9.247 1.075 -16.203 55 HB3 ALA 7 HB3 ALA 7 9.113 -0.306 -17.291 56 H ARG 8 HN ARG 8 12.905 -0.705 -15.368 57 HA ARG 8 HA ARG 8 13.140 0.818 -12.917 58 HB2 ARG 8 HB2 ARG 8 15.177 -0.355 -14.828 59 HB3 ARG 8 HB1 ARG 8 15.624 0.541 -13.372 60 HG2 ARG 8 HG2 ARG 8 14.357 -1.040 -11.978 61 HG3 ARG 8 HG1 ARG 8 13.851 -1.920 -13.418 62 HD2 ARG 8 HD2 ARG 8 16.164 -2.478 -13.931 63 HD3 ARG 8 HD1 ARG 8 16.732 -1.504 -12.598 64 HE ARG 8 HE ARG 8 15.587 -4.179 -12.462 65 HH11 ARG 8 HH21 ARG 8 15.948 -1.194 -10.726 66 HH12 ARG 8 HH22 ARG 8 16.408 -1.944 -9.228 67 HH21 ARG 8 HH11 ARG 8 16.142 -5.187 -10.500 68 HH22 ARG 8 HH12 ARG 8 16.536 -4.221 -9.114 69 H SER 9 HN SER 9 13.576 1.391 -16.346 70 HA SER 9 HA SER 9 14.875 3.947 -16.027 71 HB2 SER 9 HB2 SER 9 13.585 2.640 -18.432 72 HB3 SER 9 HB1 SER 9 14.500 4.145 -18.477 73 HG SER 9 HG SER 9 16.190 2.915 -18.621 74 H GLY 10 HN GLY 10 11.757 2.947 -15.482 75 HA2 GLY 10 HA3 GLY 10 10.774 5.645 -15.316 76 HA3 GLY 10 HA2 GLY 10 10.059 4.772 -16.667 77 H LYS 11 HN LYS 11 8.579 3.168 -16.285 78 HA LYS 11 HA LYS 11 8.033 2.030 -13.742 79 HB2 LYS 11 HB2 LYS 11 7.205 4.345 -13.309 80 HB3 LYS 11 HB1 LYS 11 6.075 4.164 -14.644 81 HG2 LYS 11 HG2 LYS 11 5.000 2.264 -13.501 82 HG3 LYS 11 HG1 LYS 11 6.160 2.398 -12.177 83 HD2 LYS 11 HD2 LYS 11 5.347 4.688 -11.702 84 HD3 LYS 11 HD1 LYS 11 4.177 4.539 -13.015 85 HE2 LYS 11 HE2 LYS 11 3.125 2.621 -11.866 86 HE3 LYS 11 HE1 LYS 11 4.291 2.768 -10.551 87 HZ1 LYS 11 HZ1 LYS 11 2.888 5.210 -11.210 88 HZ2 LYS 11 HZ2 LYS 11 3.227 4.526 -9.693 89 HZ3 LYS 11 HZ3 LYS 11 1.899 3.976 -10.597 90 H TYR 12 HN TYR 12 5.621 3.143 -16.069 91 HA TYR 12 HA TYR 12 4.941 0.339 -16.683 92 HB2 TYR 12 HB2 TYR 12 2.978 1.766 -17.934 93 HB3 TYR 12 HB1 TYR 12 2.885 1.266 -16.252 94 HD1 TYR 12 HD1 TYR 12 4.973 3.983 -17.826 95 HD2 TYR 12 HD2 TYR 12 1.728 3.025 -15.164 96 HE1 TYR 12 HE1 TYR 12 4.803 6.361 -17.166 97 HE2 TYR 12 HE2 TYR 12 1.577 5.402 -14.505 98 HH TYR 12 HH TYR 12 3.899 7.603 -14.980 99 H LYS 13 HN LYS 13 6.825 0.042 -18.019 100 HA LYS 13 HA LYS 13 6.360 0.939 -20.800 101 HB2 LYS 13 HB2 LYS 13 8.314 2.123 -19.299 102 HB3 LYS 13 HB1 LYS 13 9.227 0.758 -19.919 103 HG2 LYS 13 HG2 LYS 13 7.668 2.727 -21.635 104 HG3 LYS 13 HG1 LYS 13 9.407 2.780 -21.366 105 HD2 LYS 13 HD2 LYS 13 9.575 0.469 -22.323 106 HD3 LYS 13 HD1 LYS 13 7.852 0.547 -22.709 107 HE2 LYS 13 HE2 LYS 13 8.249 2.539 -24.103 108 HE3 LYS 13 HE1 LYS 13 9.967 2.473 -23.713 109 HZ1 LYS 13 HZ1 LYS 13 10.289 0.939 -25.259 110 HZ2 LYS 13 HZ2 LYS 13 8.689 1.184 -25.780 111 HZ3 LYS 13 HZ3 LYS 13 9.042 -0.039 -24.654 112 H LEU 14 HN LEU 14 5.721 -1.528 -19.469 113 HA LEU 14 HA LEU 14 7.481 -3.404 -20.984 114 HB2 LEU 14 HB2 LEU 14 5.989 -4.084 -18.437 115 HB3 LEU 14 HB1 LEU 14 7.175 -5.069 -19.289 116 HG LEU 14 HG LEU 14 7.789 -2.389 -18.001 117 HD11 LEU 14 HD11 LEU 14 7.213 -4.062 -16.306 118 HD12 LEU 14 HD12 LEU 14 8.953 -3.771 -16.281 119 HD13 LEU 14 HD13 LEU 14 8.314 -5.224 -17.049 120 HD21 LEU 14 HD21 LEU 14 9.392 -2.856 -19.767 121 HD22 LEU 14 HD22 LEU 14 9.541 -4.536 -19.257 122 HD23 LEU 14 HD23 LEU 14 10.178 -3.244 -18.241 123 H THR 15 HN THR 15 6.525 -4.589 -22.460 124 HA THR 15 HA THR 15 3.561 -4.560 -22.644 125 HB THR 15 HB THR 15 4.021 -5.492 -24.972 126 HG1 THR 15 HG1 THR 15 6.006 -6.168 -25.096 127 HG21 THR 15 HG21 THR 15 5.174 -2.782 -24.244 128 HG22 THR 15 HG22 THR 15 3.487 -3.130 -24.632 129 HG23 THR 15 HG23 THR 15 4.727 -3.292 -25.875 130 H TYR 16 HN TYR 16 2.579 -6.578 -23.523 131 HA TYR 16 HA TYR 16 2.840 -8.679 -21.727 132 HB2 TYR 16 HB2 TYR 16 1.411 -9.950 -23.219 133 HB3 TYR 16 HB1 TYR 16 0.877 -8.273 -23.201 134 HD1 TYR 16 HD2 TYR 16 1.623 -6.713 -25.073 135 HD2 TYR 16 HD1 TYR 16 2.091 -10.981 -25.280 136 HE1 TYR 16 HE2 TYR 16 1.887 -6.572 -27.544 137 HE2 TYR 16 HE1 TYR 16 2.346 -10.838 -27.745 138 HH TYR 16 HH TYR 16 3.181 -8.798 -29.401 139 H ALA 17 HN ALA 17 4.056 -8.553 -25.080 140 HA ALA 17 HA ALA 17 5.360 -11.020 -25.099 141 HB1 ALA 17 HB1 ALA 17 6.292 -8.500 -26.491 142 HB2 ALA 17 HB2 ALA 17 5.013 -9.554 -27.090 143 HB3 ALA 17 HB3 ALA 17 6.661 -10.162 -26.952 144 H GLU 18 HN GLU 18 6.625 -7.827 -24.113 145 HA GLU 18 HA GLU 18 9.253 -8.709 -23.524 146 HB2 GLU 18 HB2 GLU 18 7.642 -6.387 -22.428 147 HB3 GLU 18 HB1 GLU 18 9.352 -6.638 -22.080 148 HG2 GLU 18 HG2 GLU 18 9.892 -6.494 -24.458 149 HG3 GLU 18 HG1 GLU 18 8.186 -6.343 -24.863 150 H ALA 19 HN ALA 19 6.438 -8.201 -21.381 151 HA ALA 19 HA ALA 19 7.632 -9.020 -18.983 152 HB1 ALA 19 HB1 ALA 19 5.478 -7.896 -19.017 153 HB2 ALA 19 HB2 ALA 19 5.308 -9.464 -18.219 154 HB3 ALA 19 HB3 ALA 19 4.751 -9.253 -19.881 155 H LYS 20 HN LYS 20 6.171 -10.917 -21.574 156 HA LYS 20 HA LYS 20 6.226 -13.417 -20.161 157 HB2 LYS 20 HB2 LYS 20 5.900 -12.696 -23.083 158 HB3 LYS 20 HB1 LYS 20 5.939 -14.369 -22.528 159 HG2 LYS 20 HG2 LYS 20 4.019 -13.981 -21.076 160 HG3 LYS 20 HG1 LYS 20 3.992 -12.269 -21.519 161 HD2 LYS 20 HD2 LYS 20 3.585 -12.888 -23.876 162 HD3 LYS 20 HD1 LYS 20 3.608 -14.593 -23.433 163 HE2 LYS 20 HE2 LYS 20 1.656 -14.269 -21.986 164 HE3 LYS 20 HE1 LYS 20 1.647 -12.545 -22.353 165 HZ1 LYS 20 HZ1 LYS 20 0.060 -13.875 -23.691 166 HZ2 LYS 20 HZ2 LYS 20 1.377 -14.679 -24.402 167 HZ3 LYS 20 HZ3 LYS 20 1.175 -13.007 -24.629 168 H ALA 21 HN ALA 21 8.392 -11.770 -22.418 169 HA ALA 21 HA ALA 21 10.193 -13.924 -22.801 170 HB1 ALA 21 HB1 ALA 21 11.786 -12.137 -23.527 171 HB2 ALA 21 HB2 ALA 21 10.609 -10.935 -22.995 172 HB3 ALA 21 HB3 ALA 21 10.209 -12.042 -24.308 173 H VAL 22 HN VAL 22 10.265 -11.198 -20.507 174 HA VAL 22 HA VAL 22 12.735 -11.867 -19.291 175 HB VAL 22 HB VAL 22 10.355 -10.379 -18.151 176 HG11 VAL 22 HG11 VAL 22 13.239 -10.608 -17.231 177 HG12 VAL 22 HG12 VAL 22 11.791 -11.038 -16.320 178 HG13 VAL 22 HG13 VAL 22 12.141 -9.348 -16.668 179 HG21 VAL 22 HG21 VAL 22 11.352 -9.452 -20.261 180 HG22 VAL 22 HG22 VAL 22 12.906 -9.344 -19.432 181 HG23 VAL 22 HG23 VAL 22 11.539 -8.379 -18.875 182 H CYS 23 HN CYS 23 9.398 -12.741 -18.490 183 HA CYS 23 HA CYS 23 10.360 -14.565 -16.343 184 HB2 CYS 23 HB2 CYS 23 7.489 -13.867 -16.981 185 HB3 CYS 23 HB1 CYS 23 8.127 -14.573 -15.502 186 H GLU 24 HN GLU 24 8.788 -16.562 -16.214 187 HA GLU 24 HA GLU 24 8.073 -18.566 -17.111 188 HB2 GLU 24 HB2 GLU 24 6.692 -17.065 -18.644 189 HB3 GLU 24 HB1 GLU 24 7.987 -17.217 -19.828 190 HG2 GLU 24 HG2 GLU 24 7.735 -19.625 -19.884 191 HG3 GLU 24 HG1 GLU 24 6.508 -19.560 -18.620 192 H PHE 25 HN PHE 25 10.423 -16.867 -19.170 193 HA PHE 25 HA PHE 25 11.631 -19.154 -20.300 194 HB2 PHE 25 HB2 PHE 25 11.870 -16.829 -21.130 195 HB3 PHE 25 HB1 PHE 25 12.860 -16.448 -19.725 196 HD1 PHE 25 HD1 PHE 25 12.665 -18.542 -22.803 197 HD2 PHE 25 HD2 PHE 25 15.182 -17.106 -19.626 198 HE1 PHE 25 HE1 PHE 25 14.668 -19.379 -24.007 199 HE2 PHE 25 HE2 PHE 25 17.180 -17.948 -20.831 200 HZ PHE 25 HZ PHE 25 16.923 -19.081 -23.021 201 H GLU 26 HN GLU 26 12.531 -17.201 -17.459 202 HA GLU 26 HA GLU 26 14.604 -19.140 -16.707 203 HB2 GLU 26 HB2 GLU 26 15.130 -17.562 -14.895 204 HB3 GLU 26 HB1 GLU 26 15.142 -16.773 -16.470 205 HG2 GLU 26 HG2 GLU 26 12.865 -15.911 -16.056 206 HG3 GLU 26 HG1 GLU 26 12.855 -16.694 -14.478 207 H GLY 27 HN GLY 27 11.616 -19.678 -16.631 208 HA2 GLY 27 HA3 GLY 27 10.465 -21.249 -15.338 209 HA3 GLY 27 HA2 GLY 27 11.633 -21.037 -14.040 210 H GLY 28 HN GLY 28 10.734 -18.007 -15.021 211 HA2 GLY 28 HA3 GLY 28 9.254 -17.473 -12.642 212 HA3 GLY 28 HA2 GLY 28 9.518 -16.352 -13.972 213 H HIS 29 HN HIS 29 7.217 -15.859 -13.239 214 HA HIS 29 HA HIS 29 5.407 -16.867 -15.213 215 HB2 HIS 29 HB2 HIS 29 5.432 -18.720 -13.476 216 HB3 HIS 29 HB1 HIS 29 4.723 -17.571 -12.345 217 HD1 HIS 29 HD1 HIS 29 2.258 -16.892 -12.718 218 HD2 HIS 29 HD2 HIS 29 3.695 -19.547 -15.591 219 HE1 HIS 29 HE1 HIS 29 0.240 -17.696 -14.023 220 HE2 HIS 29 HE2 HIS 29 1.100 -19.315 -15.779 221 H LEU 30 HN LEU 30 3.804 -15.422 -15.579 222 HA LEU 30 HA LEU 30 3.876 -12.882 -14.228 223 HB2 LEU 30 HB2 LEU 30 2.224 -14.085 -16.453 224 HB3 LEU 30 HB1 LEU 30 1.739 -12.553 -15.742 225 HG LEU 30 HG LEU 30 3.904 -11.564 -16.295 226 HD11 LEU 30 HD11 LEU 30 5.464 -12.919 -17.772 227 HD12 LEU 30 HD12 LEU 30 4.519 -14.345 -17.336 228 HD13 LEU 30 HD13 LEU 30 5.379 -13.436 -16.088 229 HD21 LEU 30 HD21 LEU 30 3.668 -11.545 -18.730 230 HD22 LEU 30 HD22 LEU 30 2.069 -11.559 -17.986 231 HD23 LEU 30 HD23 LEU 30 2.732 -13.039 -18.677 232 H ALA 31 HN ALA 31 2.447 -12.020 -12.791 233 HA ALA 31 HA ALA 31 0.979 -13.772 -11.097 234 HB1 ALA 31 HB1 ALA 31 0.813 -10.754 -11.311 235 HB2 ALA 31 HB2 ALA 31 1.978 -11.642 -10.330 236 HB3 ALA 31 HB3 ALA 31 0.255 -11.739 -9.956 237 H THR 32 HN THR 32 -0.572 -14.872 -12.252 238 HA THR 32 HA THR 32 -2.569 -13.430 -13.830 239 HB THR 32 HB THR 32 -2.445 -16.378 -13.121 240 HG1 THR 32 HG1 THR 32 -0.618 -15.583 -14.275 241 HG21 THR 32 HG21 THR 32 -3.738 -16.415 -15.405 242 HG22 THR 32 HG22 THR 32 -4.121 -14.736 -15.040 243 HG23 THR 32 HG23 THR 32 -4.633 -16.019 -13.941 244 H TYR 33 HN TYR 33 -4.911 -14.104 -13.449 245 HA TYR 33 HA TYR 33 -5.837 -13.056 -11.042 246 HB2 TYR 33 HB2 TYR 33 -7.256 -13.127 -12.976 247 HB3 TYR 33 HB1 TYR 33 -7.151 -14.882 -13.061 248 HD1 TYR 33 HD1 TYR 33 -8.561 -12.019 -11.151 249 HD2 TYR 33 HD2 TYR 33 -8.514 -16.290 -11.628 250 HE1 TYR 33 HE1 TYR 33 -10.576 -12.214 -9.708 251 HE2 TYR 33 HE2 TYR 33 -10.520 -16.474 -10.181 252 HH TYR 33 HH TYR 33 -12.457 -13.844 -9.387 253 H LYS 34 HN LYS 34 -5.758 -16.495 -12.026 254 HA LYS 34 HA LYS 34 -6.665 -17.601 -9.623 255 HB2 LYS 34 HB2 LYS 34 -4.752 -18.716 -11.694 256 HB3 LYS 34 HB1 LYS 34 -5.477 -19.672 -10.403 257 HG2 LYS 34 HG2 LYS 34 -7.721 -19.178 -11.250 258 HG3 LYS 34 HG1 LYS 34 -7.045 -18.128 -12.495 259 HD2 LYS 34 HD2 LYS 34 -5.795 -20.081 -13.418 260 HD3 LYS 34 HD1 LYS 34 -6.582 -21.116 -12.226 261 HE2 LYS 34 HE2 LYS 34 -8.012 -19.470 -14.337 262 HE3 LYS 34 HE1 LYS 34 -7.751 -21.211 -14.403 263 HZ1 LYS 34 HZ1 LYS 34 -9.739 -21.280 -13.407 264 HZ2 LYS 34 HZ2 LYS 34 -9.642 -19.681 -12.838 265 HZ3 LYS 34 HZ3 LYS 34 -8.868 -20.935 -11.993 266 H GLN 35 HN GLN 35 -3.336 -16.891 -10.681 267 HA GLN 35 HA GLN 35 -2.095 -17.858 -8.290 268 HB2 GLN 35 HB2 GLN 35 -1.038 -15.898 -10.349 269 HB3 GLN 35 HB1 GLN 35 -0.078 -16.702 -9.105 270 HG2 GLN 35 HG2 GLN 35 -1.681 -18.180 -11.208 271 HG3 GLN 35 HG1 GLN 35 0.032 -17.808 -11.366 272 HE21 GLN 35 HE21 GLN 35 1.395 -18.611 -9.355 273 HE22 GLN 35 HE22 GLN 35 0.973 -20.136 -8.744 274 H LEU 36 HN LEU 36 -3.329 -14.730 -9.335 275 HA LEU 36 HA LEU 36 -2.186 -13.142 -7.292 276 HB2 LEU 36 HB2 LEU 36 -4.518 -12.852 -9.140 277 HB3 LEU 36 HB1 LEU 36 -4.366 -11.689 -7.857 278 HG LEU 36 HG LEU 36 -2.154 -12.253 -9.853 279 HD11 LEU 36 HD11 LEU 36 -2.883 -10.121 -10.916 280 HD12 LEU 36 HD12 LEU 36 -4.264 -10.071 -9.822 281 HD13 LEU 36 HD13 LEU 36 -4.127 -11.369 -11.014 282 HD21 LEU 36 HD21 LEU 36 -1.200 -11.191 -7.915 283 HD22 LEU 36 HD22 LEU 36 -2.584 -10.121 -7.731 284 HD23 LEU 36 HD23 LEU 36 -1.459 -9.889 -9.065 285 H GLU 37 HN GLU 37 -5.226 -14.945 -7.460 286 HA GLU 37 HA GLU 37 -6.359 -13.992 -5.071 287 HB2 GLU 37 HB2 GLU 37 -7.545 -15.296 -6.847 288 HB3 GLU 37 HB1 GLU 37 -6.698 -16.739 -6.296 289 HG2 GLU 37 HG2 GLU 37 -8.860 -16.740 -5.242 290 HG3 GLU 37 HG1 GLU 37 -7.690 -16.329 -3.995 291 H ALA 38 HN ALA 38 -4.078 -16.606 -5.700 292 HA ALA 38 HA ALA 38 -4.117 -17.737 -3.101 293 HB1 ALA 38 HB1 ALA 38 -1.906 -17.720 -5.171 294 HB2 ALA 38 HB2 ALA 38 -3.179 -18.931 -5.018 295 HB3 ALA 38 HB3 ALA 38 -1.967 -18.764 -3.749 296 H ALA 39 HN ALA 39 -2.189 -15.154 -4.555 297 HA ALA 39 HA ALA 39 -0.595 -14.779 -2.146 298 HB1 ALA 39 HB1 ALA 39 -0.748 -13.191 -4.713 299 HB2 ALA 39 HB2 ALA 39 0.459 -14.405 -4.288 300 HB3 ALA 39 HB3 ALA 39 0.390 -12.882 -3.399 301 H ARG 40 HN ARG 40 -3.474 -13.424 -3.564 302 HA ARG 40 HA ARG 40 -3.592 -10.937 -2.268 303 HB2 ARG 40 HB2 ARG 40 -5.149 -11.666 -4.050 304 HB3 ARG 40 HB1 ARG 40 -5.878 -12.814 -2.929 305 HG2 ARG 40 HG2 ARG 40 -7.241 -10.776 -3.077 306 HG3 ARG 40 HG1 ARG 40 -6.580 -10.939 -1.454 307 HD2 ARG 40 HD2 ARG 40 -5.175 -9.096 -1.696 308 HD3 ARG 40 HD1 ARG 40 -4.985 -9.330 -3.440 309 HE ARG 40 HE ARG 40 -6.639 -7.774 -3.712 310 HH11 ARG 40 HH21 ARG 40 -7.154 -9.337 -0.616 311 HH12 ARG 40 HH22 ARG 40 -8.707 -8.603 -0.397 312 HH21 ARG 40 HH11 ARG 40 -8.624 -6.816 -3.394 313 HH22 ARG 40 HH12 ARG 40 -9.556 -7.171 -1.986 314 H LYS 41 HN LYS 41 -4.027 -14.173 -1.032 315 HA LYS 41 HA LYS 41 -5.339 -13.323 1.430 316 HB2 LYS 41 HB2 LYS 41 -4.207 -15.999 0.560 317 HB3 LYS 41 HB1 LYS 41 -5.016 -15.719 2.100 318 HG2 LYS 41 HG2 LYS 41 -7.054 -14.996 0.898 319 HG3 LYS 41 HG1 LYS 41 -6.249 -15.310 -0.641 320 HD2 LYS 41 HD2 LYS 41 -5.949 -17.686 0.015 321 HD3 LYS 41 HD1 LYS 41 -6.802 -17.365 1.524 322 HE2 LYS 41 HE2 LYS 41 -7.994 -16.931 -1.231 323 HE3 LYS 41 HE1 LYS 41 -8.266 -18.367 -0.246 324 HZ1 LYS 41 HZ1 LYS 41 -9.182 -16.955 1.492 325 HZ2 LYS 41 HZ2 LYS 41 -10.046 -16.772 0.040 326 HZ3 LYS 41 HZ3 LYS 41 -8.938 -15.581 0.530 327 H ILE 42 HN ILE 42 -2.203 -13.207 0.272 328 HA ILE 42 HA ILE 42 -0.909 -13.704 2.880 329 HB ILE 42 HB ILE 42 0.321 -12.986 0.196 330 HG12 ILE 42 HG12 ILE 42 0.194 -15.667 1.639 331 HG13 ILE 42 HG11 ILE 42 -0.857 -15.217 0.302 332 HG21 ILE 42 HG21 ILE 42 1.979 -12.361 1.756 333 HG22 ILE 42 HG22 ILE 42 2.391 -14.045 1.514 334 HG23 ILE 42 HG23 ILE 42 1.477 -13.567 2.937 335 HD11 ILE 42 HD11 ILE 42 1.447 -14.732 -0.945 336 HD12 ILE 42 HD12 ILE 42 0.826 -16.373 -0.826 337 HD13 ILE 42 HD13 ILE 42 2.085 -15.827 0.280 338 H GLY 43 HN GLY 43 -2.568 -11.226 1.619 339 HA2 GLY 43 HA3 GLY 43 -2.731 -9.075 2.567 340 HA3 GLY 43 HA2 GLY 43 -1.105 -9.233 3.212 341 H PHE 44 HN PHE 44 -1.737 -10.016 -0.124 342 HA PHE 44 HA PHE 44 0.217 -8.196 -1.070 343 HB2 PHE 44 HB2 PHE 44 -0.858 -10.427 -2.092 344 HB3 PHE 44 HB1 PHE 44 -1.916 -9.289 -2.904 345 HD1 PHE 44 HD1 PHE 44 1.731 -9.762 -2.131 346 HD2 PHE 44 HD2 PHE 44 -1.172 -8.453 -5.009 347 HE1 PHE 44 HE1 PHE 44 3.539 -9.352 -3.777 348 HE2 PHE 44 HE2 PHE 44 0.630 -8.057 -6.656 349 HZ PHE 44 HZ PHE 44 2.990 -8.498 -6.040 350 H HIS 45 HN HIS 45 0.069 -6.107 -1.608 351 HA HIS 45 HA HIS 45 -2.502 -4.927 -2.417 352 HB2 HIS 45 HB2 HIS 45 -2.567 -4.714 -0.006 353 HB3 HIS 45 HB1 HIS 45 -0.941 -4.040 0.023 354 HD1 HIS 45 HD1 HIS 45 -3.135 -2.850 -2.728 355 HD2 HIS 45 HD2 HIS 45 -2.143 -1.643 1.135 356 HE1 HIS 45 HE1 HIS 45 -3.953 -0.463 -2.489 357 HE2 HIS 45 HE2 HIS 45 -3.356 0.285 -0.137 358 H VAL 46 HN VAL 46 -1.820 -4.267 -4.360 359 HA VAL 46 HA VAL 46 0.253 -2.170 -4.439 360 HB VAL 46 HB VAL 46 1.424 -4.258 -4.991 361 HG11 VAL 46 HG11 VAL 46 -0.296 -4.523 -7.474 362 HG12 VAL 46 HG12 VAL 46 -0.744 -5.334 -5.976 363 HG13 VAL 46 HG13 VAL 46 0.791 -5.701 -6.755 364 HG21 VAL 46 HG21 VAL 46 1.947 -2.035 -6.116 365 HG22 VAL 46 HG22 VAL 46 0.999 -2.597 -7.494 366 HG23 VAL 46 HG23 VAL 46 2.456 -3.463 -7.016 367 H CYS 47 HN CYS 47 -0.673 -0.462 -5.335 368 HA CYS 47 HA CYS 47 -2.922 -0.810 -7.207 369 HB2 CYS 47 HB2 CYS 47 -2.651 0.906 -5.145 370 HB3 CYS 47 HB1 CYS 47 -1.979 1.929 -6.401 371 H ALA 48 HN ALA 48 -1.825 -1.531 -9.058 372 HA ALA 48 HA ALA 48 -0.835 0.537 -10.767 373 HB1 ALA 48 HB1 ALA 48 1.157 -1.560 -9.867 374 HB2 ALA 48 HB2 ALA 48 1.205 0.149 -9.433 375 HB3 ALA 48 HB3 ALA 48 1.425 -0.341 -11.114 376 H ALA 49 HN ALA 49 -1.896 -0.006 -12.539 377 HA ALA 49 HA ALA 49 -2.699 -2.668 -13.180 378 HB1 ALA 49 HB1 ALA 49 -4.019 -0.769 -13.916 379 HB2 ALA 49 HB2 ALA 49 -3.445 -1.670 -15.324 380 HB3 ALA 49 HB3 ALA 49 -2.658 -0.158 -14.862 381 H GLY 50 HN GLY 50 -1.829 -4.160 -14.490 382 HA2 GLY 50 HA3 GLY 50 0.485 -3.477 -16.192 383 HA3 GLY 50 HA2 GLY 50 0.748 -4.639 -14.896 384 H TRP 51 HN TRP 51 1.352 -5.826 -16.974 385 HA TRP 51 HA TRP 51 -0.942 -7.023 -18.380 386 HB2 TRP 51 HB2 TRP 51 2.047 -7.099 -18.835 387 HB3 TRP 51 HB1 TRP 51 0.941 -8.161 -19.704 388 HD1 TRP 51 HD1 TRP 51 2.255 -4.648 -19.660 389 HE1 TRP 51 HE1 TRP 51 1.142 -3.291 -21.548 390 HE3 TRP 51 HE3 TRP 51 -1.418 -7.905 -21.049 391 HZ2 TRP 51 HZ2 TRP 51 -1.017 -3.551 -23.402 392 HZ3 TRP 51 HZ3 TRP 51 -2.993 -7.328 -22.870 393 HH2 TRP 51 HH2 TRP 51 -2.807 -5.159 -24.043 394 H MET 52 HN MET 52 -1.289 -9.252 -18.429 395 HA MET 52 HA MET 52 0.223 -10.956 -16.561 396 HB2 MET 52 HB2 MET 52 -2.803 -10.844 -16.464 397 HB3 MET 52 HB1 MET 52 -1.727 -11.759 -15.418 398 HG2 MET 52 HG2 MET 52 -0.732 -9.584 -14.646 399 HG3 MET 52 HG1 MET 52 -1.981 -8.743 -15.560 400 HE1 MET 52 HE1 MET 52 -4.314 -9.073 -15.418 401 HE2 MET 52 HE2 MET 52 -5.197 -9.258 -13.903 402 HE3 MET 52 HE3 MET 52 -4.802 -10.681 -14.864 403 H ALA 53 HN ALA 53 -0.499 -13.270 -16.768 404 HA ALA 53 HA ALA 53 -0.105 -14.281 -19.272 405 HB1 ALA 53 HB1 ALA 53 -1.896 -15.509 -17.165 406 HB2 ALA 53 HB2 ALA 53 -0.139 -15.651 -17.224 407 HB3 ALA 53 HB3 ALA 53 -1.125 -16.366 -18.500 408 H LYS 54 HN LYS 54 -1.472 -15.264 -20.852 409 HA LYS 54 HA LYS 54 -3.153 -15.172 -22.411 410 HB2 LYS 54 HB2 LYS 54 -4.822 -14.837 -19.900 411 HB3 LYS 54 HB1 LYS 54 -5.493 -15.114 -21.505 412 HG2 LYS 54 HG2 LYS 54 -4.279 -17.250 -21.664 413 HG3 LYS 54 HG1 LYS 54 -3.580 -16.978 -20.067 414 HD2 LYS 54 HD2 LYS 54 -5.847 -16.942 -19.075 415 HD3 LYS 54 HD1 LYS 54 -6.544 -17.223 -20.671 416 HE2 LYS 54 HE2 LYS 54 -5.358 -19.378 -20.821 417 HE3 LYS 54 HE1 LYS 54 -4.637 -19.097 -19.237 418 HZ1 LYS 54 HZ1 LYS 54 -7.299 -19.968 -19.922 419 HZ2 LYS 54 HZ2 LYS 54 -7.261 -18.735 -18.753 420 HZ3 LYS 54 HZ3 LYS 54 -6.420 -20.189 -18.486 421 H GLY 55 HN GLY 55 -1.774 -12.751 -21.997 422 HA2 GLY 55 HA3 GLY 55 -1.905 -10.480 -22.390 423 HA3 GLY 55 HA2 GLY 55 -3.293 -10.900 -23.387 424 H ARG 56 HN ARG 56 -3.822 -11.877 -20.212 425 HA ARG 56 HA ARG 56 -5.936 -9.983 -19.830 426 HB2 ARG 56 HB2 ARG 56 -5.820 -12.370 -18.933 427 HB3 ARG 56 HB1 ARG 56 -4.725 -11.762 -17.703 428 HG2 ARG 56 HG2 ARG 56 -6.428 -10.257 -16.843 429 HG3 ARG 56 HG1 ARG 56 -7.512 -10.684 -18.171 430 HD2 ARG 56 HD2 ARG 56 -7.594 -13.003 -17.396 431 HD3 ARG 56 HD1 ARG 56 -6.455 -12.643 -16.111 432 HE ARG 56 HE ARG 56 -8.421 -10.869 -15.616 433 HH11 ARG 56 HH21 ARG 56 -8.737 -14.239 -16.501 434 HH12 ARG 56 HH22 ARG 56 -10.017 -14.521 -15.365 435 HH21 ARG 56 HH11 ARG 56 -10.091 -11.261 -14.158 436 HH22 ARG 56 HH12 ARG 56 -10.770 -12.842 -14.022 437 H VAL 57 HN VAL 57 -6.101 -8.254 -18.442 438 HA VAL 57 HA VAL 57 -3.608 -7.328 -17.097 439 HB VAL 57 HB VAL 57 -3.896 -5.102 -17.907 440 HG11 VAL 57 HG11 VAL 57 -4.562 -6.822 -20.309 441 HG12 VAL 57 HG12 VAL 57 -2.992 -6.874 -19.515 442 HG13 VAL 57 HG13 VAL 57 -3.554 -5.373 -20.246 443 HG21 VAL 57 HG21 VAL 57 -5.871 -4.586 -19.459 444 HG22 VAL 57 HG22 VAL 57 -6.267 -4.761 -17.760 445 HG23 VAL 57 HG23 VAL 57 -6.602 -6.078 -18.887 446 H GLY 58 HN GLY 58 -3.862 -6.763 -15.061 447 HA2 GLY 58 HA3 GLY 58 -6.075 -5.409 -13.983 448 HA3 GLY 58 HA2 GLY 58 -6.310 -7.134 -13.715 449 H TYR 59 HN TYR 59 -6.185 -5.751 -11.509 450 HA TYR 59 HA TYR 59 -3.858 -6.776 -10.243 451 HB2 TYR 59 HB2 TYR 59 -2.827 -4.706 -9.480 452 HB3 TYR 59 HB1 TYR 59 -2.815 -4.809 -11.230 453 HD1 TYR 59 HD2 TYR 59 -4.845 -3.682 -12.474 454 HD2 TYR 59 HD1 TYR 59 -3.661 -2.726 -8.454 455 HE1 TYR 59 HE2 TYR 59 -5.982 -1.496 -12.660 456 HE2 TYR 59 HE1 TYR 59 -4.792 -0.530 -8.654 457 HH TYR 59 HH TYR 59 -6.725 0.421 -10.065 458 HA PRO 60 HA PRO 60 -6.778 -6.565 -6.901 459 HB2 PRO 60 HB2 PRO 60 -5.182 -7.162 -4.767 460 HB3 PRO 60 HB1 PRO 60 -5.588 -8.369 -6.007 461 HG2 PRO 60 HG2 PRO 60 -3.109 -6.689 -5.758 462 HG3 PRO 60 HG1 PRO 60 -3.261 -8.430 -6.080 463 HD2 PRO 60 HD2 PRO 60 -2.843 -6.641 -8.091 464 HD3 PRO 60 HD1 PRO 60 -3.816 -8.115 -8.327 465 H ILE 61 HN ILE 61 -7.560 -5.159 -5.367 466 HA ILE 61 HA ILE 61 -5.834 -2.953 -4.417 467 HB ILE 61 HB ILE 61 -8.568 -2.405 -5.621 468 HG12 ILE 61 HG12 ILE 61 -5.816 -2.095 -6.881 469 HG13 ILE 61 HG11 ILE 61 -7.079 -3.201 -7.411 470 HG21 ILE 61 HG21 ILE 61 -7.632 -0.826 -3.901 471 HG22 ILE 61 HG22 ILE 61 -7.845 -0.080 -5.477 472 HG23 ILE 61 HG23 ILE 61 -6.238 -0.576 -4.948 473 HD11 ILE 61 HD11 ILE 61 -7.383 -1.428 -8.889 474 HD12 ILE 61 HD12 ILE 61 -6.958 -0.214 -7.681 475 HD13 ILE 61 HD13 ILE 61 -8.531 -1.004 -7.619 476 H VAL 62 HN VAL 62 -5.943 -3.780 -2.349 477 HA VAL 62 HA VAL 62 -8.371 -4.529 -1.062 478 HB VAL 62 HB VAL 62 -7.067 -4.562 0.984 479 HG11 VAL 62 HG11 VAL 62 -6.758 -6.402 -0.571 480 HG12 VAL 62 HG12 VAL 62 -5.235 -6.061 0.241 481 HG13 VAL 62 HG13 VAL 62 -5.494 -5.521 -1.422 482 HG21 VAL 62 HG21 VAL 62 -5.801 -2.520 0.846 483 HG22 VAL 62 HG22 VAL 62 -5.048 -3.019 -0.667 484 HG23 VAL 62 HG23 VAL 62 -4.620 -3.830 0.842 485 H LYS 63 HN LYS 63 -6.531 -1.535 -1.289 486 HA LYS 63 HA LYS 63 -8.831 -0.117 -0.139 487 HB2 LYS 63 HB2 LYS 63 -5.985 0.017 0.802 488 HB3 LYS 63 HB1 LYS 63 -7.005 1.441 0.977 489 HG2 LYS 63 HG2 LYS 63 -8.036 -1.238 1.949 490 HG3 LYS 63 HG1 LYS 63 -6.890 -0.342 2.941 491 HD2 LYS 63 HD2 LYS 63 -8.388 1.607 2.962 492 HD3 LYS 63 HD1 LYS 63 -9.531 0.764 1.921 493 HE2 LYS 63 HE2 LYS 63 -9.730 -1.020 3.662 494 HE3 LYS 63 HE1 LYS 63 -8.703 -0.049 4.717 495 HZ1 LYS 63 HZ1 LYS 63 -10.565 1.725 3.922 496 HZ2 LYS 63 HZ2 LYS 63 -10.620 0.851 5.378 497 HZ3 LYS 63 HZ3 LYS 63 -11.478 0.299 4.020 498 HA PRO 64 HA PRO 64 -8.490 2.734 -3.501 499 HB2 PRO 64 HB2 PRO 64 -8.605 4.952 -1.458 500 HB3 PRO 64 HB1 PRO 64 -9.610 4.708 -2.901 501 HG2 PRO 64 HG2 PRO 64 -10.580 4.191 -0.487 502 HG3 PRO 64 HG1 PRO 64 -10.941 3.111 -1.850 503 HD2 PRO 64 HD2 PRO 64 -8.983 2.700 0.405 504 HD3 PRO 64 HD1 PRO 64 -10.066 1.541 -0.392 505 H GLY 65 HN GLY 65 -6.924 3.861 -4.592 506 HA2 GLY 65 HA3 GLY 65 -4.371 4.332 -3.144 507 HA3 GLY 65 HA2 GLY 65 -4.504 3.924 -4.845 508 HA PRO 66 HA PRO 66 -3.905 8.597 -4.140 509 HB2 PRO 66 HB2 PRO 66 -1.938 7.970 -6.342 510 HB3 PRO 66 HB1 PRO 66 -1.762 9.081 -4.966 511 HG2 PRO 66 HG2 PRO 66 -0.536 6.734 -4.943 512 HG3 PRO 66 HG1 PRO 66 -1.316 7.345 -3.468 513 HD2 PRO 66 HD2 PRO 66 -2.298 5.222 -5.374 514 HD3 PRO 66 HD1 PRO 66 -2.395 5.285 -3.602 515 H ASN 67 HN ASN 67 -3.806 6.749 -7.183 516 HA ASN 67 HA ASN 67 -5.944 8.465 -8.307 517 HB2 ASN 67 HB2 ASN 67 -4.750 8.689 -10.406 518 HB3 ASN 67 HB1 ASN 67 -3.746 9.312 -9.099 519 HD21 ASN 67 HD21 ASN 67 -1.636 8.502 -9.039 520 HD22 ASN 67 HD22 ASN 67 -1.127 7.073 -9.801 521 H CYS 68 HN CYS 68 -5.832 5.721 -7.201 522 HA CYS 68 HA CYS 68 -7.198 4.402 -9.426 523 HB2 CYS 68 HB2 CYS 68 -5.854 2.268 -9.013 524 HB3 CYS 68 HB1 CYS 68 -5.013 3.553 -9.878 525 H GLY 69 HN GLY 69 -8.588 2.764 -8.779 526 HA2 GLY 69 HA3 GLY 69 -9.796 1.422 -7.292 527 HA3 GLY 69 HA2 GLY 69 -8.820 2.036 -5.962 528 H PHE 70 HN PHE 70 -11.663 2.510 -7.884 529 HA PHE 70 HA PHE 70 -12.447 5.077 -7.043 530 HB2 PHE 70 HB2 PHE 70 -14.154 2.685 -7.782 531 HB3 PHE 70 HB1 PHE 70 -14.731 4.345 -7.659 532 HD1 PHE 70 HD2 PHE 70 -14.005 6.068 -9.287 533 HD2 PHE 70 HD1 PHE 70 -12.765 1.968 -9.663 534 HE1 PHE 70 HE2 PHE 70 -13.309 6.490 -11.630 535 HE2 PHE 70 HE1 PHE 70 -12.071 2.394 -12.006 536 HZ PHE 70 HZ PHE 70 -12.345 4.654 -12.989 537 H GLY 71 HN GLY 71 -13.121 1.868 -5.697 538 HA2 GLY 71 HA3 GLY 71 -13.091 2.551 -3.014 539 HA3 GLY 71 HA2 GLY 71 -14.751 2.823 -3.537 540 H LYS 72 HN LYS 72 -13.893 0.516 -5.560 541 HA LYS 72 HA LYS 72 -15.235 -1.573 -4.105 542 HB2 LYS 72 HB2 LYS 72 -13.805 -1.558 -6.772 543 HB3 LYS 72 HB1 LYS 72 -14.682 -2.947 -6.138 544 HG2 LYS 72 HG2 LYS 72 -16.752 -1.585 -6.043 545 HG3 LYS 72 HG1 LYS 72 -15.865 -0.206 -6.696 546 HD2 LYS 72 HD2 LYS 72 -15.355 -1.483 -8.741 547 HD3 LYS 72 HD1 LYS 72 -16.214 -2.880 -8.093 548 HE2 LYS 72 HE2 LYS 72 -18.306 -1.581 -8.034 549 HE3 LYS 72 HE1 LYS 72 -17.454 -0.168 -8.655 550 HZ1 LYS 72 HZ1 LYS 72 -18.125 -0.981 -10.623 551 HZ2 LYS 72 HZ2 LYS 72 -18.327 -2.563 -10.041 552 HZ3 LYS 72 HZ3 LYS 72 -16.782 -2.004 -10.466 553 H THR 73 HN THR 73 -14.346 -3.650 -3.597 554 HA THR 73 HA THR 73 -11.401 -3.836 -3.385 555 HB THR 73 HB THR 73 -11.559 -4.643 -1.071 556 HG1 THR 73 HG1 THR 73 -13.567 -5.374 -0.840 557 HG21 THR 73 HG21 THR 73 -11.832 -2.508 -0.021 558 HG22 THR 73 HG22 THR 73 -12.921 -1.950 -1.288 559 HG23 THR 73 HG23 THR 73 -11.208 -2.185 -1.639 560 H GLY 74 HN GLY 74 -10.664 -5.736 -3.924 561 HA2 GLY 74 HA3 GLY 74 -11.211 -8.247 -3.377 562 HA3 GLY 74 HA2 GLY 74 -12.583 -7.935 -4.439 563 H ILE 75 HN ILE 75 -11.451 -6.346 -6.369 564 HA ILE 75 HA ILE 75 -9.069 -6.788 -7.540 565 HB ILE 75 HB ILE 75 -10.604 -9.351 -7.593 566 HG12 ILE 75 HG12 ILE 75 -7.690 -9.068 -8.383 567 HG13 ILE 75 HG11 ILE 75 -8.113 -8.779 -6.711 568 HG21 ILE 75 HG21 ILE 75 -10.996 -8.883 -9.908 569 HG22 ILE 75 HG22 ILE 75 -9.672 -10.041 -9.824 570 HG23 ILE 75 HG23 ILE 75 -9.326 -8.347 -10.147 571 HD11 ILE 75 HD11 ILE 75 -9.015 -10.993 -6.454 572 HD12 ILE 75 HD12 ILE 75 -7.458 -11.167 -7.263 573 HD13 ILE 75 HD13 ILE 75 -8.950 -11.283 -8.196 574 H ILE 76 HN ILE 76 -8.986 -5.629 -9.343 575 HA ILE 76 HA ILE 76 -11.526 -5.054 -10.784 576 HB ILE 76 HB ILE 76 -9.011 -3.368 -10.842 577 HG12 ILE 76 HG12 ILE 76 -9.700 -3.507 -8.505 578 HG13 ILE 76 HG11 ILE 76 -10.109 -1.922 -9.151 579 HG21 ILE 76 HG21 ILE 76 -11.927 -2.849 -11.517 580 HG22 ILE 76 HG22 ILE 76 -10.575 -2.913 -12.643 581 HG23 ILE 76 HG23 ILE 76 -10.686 -1.601 -11.476 582 HD11 ILE 76 HD11 ILE 76 -11.985 -4.230 -8.605 583 HD12 ILE 76 HD12 ILE 76 -12.461 -2.844 -9.574 584 HD13 ILE 76 HD13 ILE 76 -12.002 -2.629 -7.890 585 H ASP 77 HN ASP 77 -10.729 -7.301 -11.735 586 HA ASP 77 HA ASP 77 -8.829 -6.864 -13.969 587 HB2 ASP 77 HB2 ASP 77 -8.927 -9.323 -14.240 588 HB3 ASP 77 HB1 ASP 77 -8.393 -8.843 -12.632 589 H TYR 78 HN TYR 78 -9.856 -5.899 -15.595 590 HA TYR 78 HA TYR 78 -12.605 -6.350 -16.275 591 HB2 TYR 78 HB2 TYR 78 -10.399 -5.115 -17.946 592 HB3 TYR 78 HB1 TYR 78 -12.125 -5.011 -18.271 593 HD1 TYR 78 HD2 TYR 78 -13.631 -3.751 -16.711 594 HD2 TYR 78 HD1 TYR 78 -9.354 -3.700 -16.274 595 HE1 TYR 78 HE2 TYR 78 -13.799 -1.735 -15.272 596 HE2 TYR 78 HE1 TYR 78 -9.527 -1.682 -14.842 597 HH TYR 78 HH TYR 78 -10.879 -0.126 -14.008 598 H GLY 79 HN GLY 79 -9.623 -7.080 -18.111 599 HA2 GLY 79 HA3 GLY 79 -9.997 -9.738 -18.672 600 HA3 GLY 79 HA2 GLY 79 -11.019 -8.924 -19.854 601 H ILE 80 HN ILE 80 -9.812 -9.541 -21.621 602 HA ILE 80 HA ILE 80 -6.976 -8.728 -21.776 603 HB ILE 80 HB ILE 80 -8.631 -10.318 -23.768 604 HG12 ILE 80 HG12 ILE 80 -6.651 -11.301 -21.682 605 HG13 ILE 80 HG11 ILE 80 -8.395 -11.433 -21.520 606 HG21 ILE 80 HG21 ILE 80 -6.700 -9.282 -24.807 607 HG22 ILE 80 HG22 ILE 80 -6.311 -10.984 -24.559 608 HG23 ILE 80 HG23 ILE 80 -5.655 -9.763 -23.469 609 HD11 ILE 80 HD11 ILE 80 -7.647 -13.546 -22.365 610 HD12 ILE 80 HD12 ILE 80 -6.628 -12.774 -23.580 611 HD13 ILE 80 HD13 ILE 80 -8.384 -12.709 -23.733 612 H ARG 81 HN ARG 81 -6.566 -6.759 -22.552 613 HA ARG 81 HA ARG 81 -8.526 -5.406 -24.304 614 HB2 ARG 81 HB2 ARG 81 -6.027 -4.336 -22.920 615 HB3 ARG 81 HB1 ARG 81 -7.150 -3.366 -23.880 616 HG2 ARG 81 HG2 ARG 81 -8.994 -3.905 -22.343 617 HG3 ARG 81 HG1 ARG 81 -7.943 -4.965 -21.415 618 HD2 ARG 81 HD2 ARG 81 -8.070 -2.931 -20.157 619 HD3 ARG 81 HD1 ARG 81 -6.492 -2.886 -20.948 620 HE ARG 81 HE ARG 81 -7.186 -0.981 -22.058 621 HH11 ARG 81 HH21 ARG 81 -9.988 -2.758 -20.973 622 HH12 ARG 81 HH22 ARG 81 -11.120 -1.659 -21.700 623 HH21 ARG 81 HH11 ARG 81 -8.682 0.511 -22.914 624 HH22 ARG 81 HH12 ARG 81 -10.377 0.199 -22.798 625 H LEU 82 HN LEU 82 -8.205 -5.070 -26.421 626 HA LEU 82 HA LEU 82 -5.962 -6.356 -27.759 627 HB2 LEU 82 HB2 LEU 82 -8.492 -4.977 -28.674 628 HB3 LEU 82 HB1 LEU 82 -7.228 -5.369 -29.834 629 HG LEU 82 HG LEU 82 -7.372 -7.744 -29.239 630 HD11 LEU 82 HD11 LEU 82 -9.322 -8.452 -27.746 631 HD12 LEU 82 HD12 LEU 82 -9.427 -6.765 -27.233 632 HD13 LEU 82 HD13 LEU 82 -7.963 -7.695 -26.913 633 HD21 LEU 82 HD21 LEU 82 -8.895 -6.750 -30.969 634 HD22 LEU 82 HD22 LEU 82 -10.128 -6.563 -29.721 635 HD23 LEU 82 HD23 LEU 82 -9.580 -8.174 -30.187 636 H ASN 83 HN ASN 83 -6.208 -3.530 -26.214 637 HA ASN 83 HA ASN 83 -4.977 -1.757 -28.148 638 HB2 ASN 83 HB2 ASN 83 -4.949 -0.121 -26.363 639 HB3 ASN 83 HB1 ASN 83 -6.538 -0.873 -26.469 640 HD21 ASN 83 HD21 ASN 83 -6.176 0.241 -24.084 641 HD22 ASN 83 HD22 ASN 83 -5.745 -0.886 -22.891 642 H ARG 84 HN ARG 84 -3.640 -4.281 -27.380 643 HA ARG 84 HA ARG 84 -1.521 -4.055 -25.651 644 HB2 ARG 84 HB2 ARG 84 -1.534 -5.267 -28.412 645 HB3 ARG 84 HB1 ARG 84 -0.226 -5.494 -27.259 646 HG2 ARG 84 HG2 ARG 84 -1.771 -6.574 -25.673 647 HG3 ARG 84 HG1 ARG 84 -3.120 -6.280 -26.773 648 HD2 ARG 84 HD2 ARG 84 -2.134 -7.673 -28.468 649 HD3 ARG 84 HD1 ARG 84 -0.657 -7.873 -27.555 650 HE ARG 84 HE ARG 84 -2.906 -8.862 -26.101 651 HH11 ARG 84 HH21 ARG 84 -0.615 -9.448 -28.615 652 HH12 ARG 84 HH22 ARG 84 -1.043 -11.110 -28.852 653 HH21 ARG 84 HH11 ARG 84 -3.492 -11.118 -26.376 654 HH22 ARG 84 HH12 ARG 84 -2.681 -12.051 -27.595 655 H SER 85 HN SER 85 -1.782 -2.579 -28.854 656 HA SER 85 HA SER 85 0.771 -1.733 -29.377 657 HB2 SER 85 HB2 SER 85 -0.233 0.213 -30.501 658 HB3 SER 85 HB1 SER 85 -1.135 -1.260 -30.844 659 HG SER 85 HG SER 85 -2.313 -0.457 -28.778 660 H GLU 86 HN GLU 86 -1.343 -0.626 -26.838 661 HA GLU 86 HA GLU 86 0.132 1.761 -26.187 662 HB2 GLU 86 HB2 GLU 86 -2.068 0.170 -24.867 663 HB3 GLU 86 HB1 GLU 86 -1.236 1.397 -23.941 664 HG2 GLU 86 HG2 GLU 86 -3.297 2.260 -25.025 665 HG3 GLU 86 HG1 GLU 86 -1.849 3.114 -25.548 666 H ARG 87 HN ARG 87 0.626 1.744 -23.599 667 HA ARG 87 HA ARG 87 2.499 -0.515 -23.057 668 HB2 ARG 87 HB2 ARG 87 3.025 2.442 -22.651 669 HB3 ARG 87 HB1 ARG 87 4.053 1.145 -22.050 670 HG2 ARG 87 HG2 ARG 87 4.451 0.380 -24.357 671 HG3 ARG 87 HG1 ARG 87 3.417 1.674 -24.971 672 HD2 ARG 87 HD2 ARG 87 4.928 3.337 -23.872 673 HD3 ARG 87 HD1 ARG 87 5.968 1.997 -23.382 674 HE ARG 87 HE ARG 87 6.799 1.900 -25.538 675 HH11 ARG 87 HH21 ARG 87 3.773 3.695 -25.600 676 HH12 ARG 87 HH22 ARG 87 3.946 4.104 -27.284 677 HH21 ARG 87 HH11 ARG 87 7.018 2.509 -27.680 678 HH22 ARG 87 HH12 ARG 87 5.791 3.444 -28.455 679 H TRP 88 HN TRP 88 2.712 -1.145 -20.979 680 HA TRP 88 HA TRP 88 1.364 0.264 -18.796 681 HB2 TRP 88 HB2 TRP 88 0.438 -2.478 -19.664 682 HB3 TRP 88 HB1 TRP 88 -0.026 -1.681 -18.175 683 HD1 TRP 88 HD1 TRP 88 -0.503 -1.456 -21.970 684 HE1 TRP 88 HE1 TRP 88 -2.574 0.011 -22.441 685 HE3 TRP 88 HE3 TRP 88 -1.490 0.200 -17.249 686 HZ2 TRP 88 HZ2 TRP 88 -4.414 1.670 -20.988 687 HZ3 TRP 88 HZ3 TRP 88 -3.401 1.715 -16.813 688 HH2 TRP 88 HH2 TRP 88 -4.864 2.452 -18.674 689 H ASP 89 HN ASP 89 1.505 -1.211 -16.751 690 HA ASP 89 HA ASP 89 4.291 -1.934 -16.434 691 HB2 ASP 89 HB2 ASP 89 2.735 -0.740 -14.724 692 HB3 ASP 89 HB1 ASP 89 2.128 -2.350 -14.362 693 H ALA 90 HN ALA 90 4.257 -3.978 -14.661 694 HA ALA 90 HA ALA 90 2.703 -6.227 -15.519 695 HB1 ALA 90 HB1 ALA 90 4.463 -7.521 -16.587 696 HB2 ALA 90 HB2 ALA 90 5.609 -6.195 -16.371 697 HB3 ALA 90 HB3 ALA 90 4.237 -6.007 -17.462 698 H TYR 91 HN TYR 91 3.441 -8.244 -14.497 699 HA TYR 91 HA TYR 91 5.081 -7.798 -12.048 700 HB2 TYR 91 HB2 TYR 91 2.459 -9.301 -12.253 701 HB3 TYR 91 HB1 TYR 91 3.509 -9.292 -10.838 702 HD1 TYR 91 HD1 TYR 91 1.244 -7.250 -12.947 703 HD2 TYR 91 HD2 TYR 91 3.670 -7.320 -9.398 704 HE1 TYR 91 HE1 TYR 91 0.149 -5.168 -12.153 705 HE2 TYR 91 HE2 TYR 91 2.577 -5.238 -8.611 706 HH TYR 91 HH TYR 91 0.741 -3.895 -8.927 707 H CYS 92 HN CYS 92 6.185 -9.587 -11.273 708 HA CYS 92 HA CYS 92 6.265 -12.007 -12.995 709 HB2 CYS 92 HB2 CYS 92 8.145 -10.235 -13.452 710 HB3 CYS 92 HB1 CYS 92 8.828 -10.809 -11.936 711 H TYR 93 HN TYR 93 6.631 -13.886 -11.938 712 HA TYR 93 HA TYR 93 7.189 -13.798 -9.028 713 HB2 TYR 93 HB2 TYR 93 4.803 -14.019 -9.134 714 HB3 TYR 93 HB1 TYR 93 4.901 -15.196 -10.433 715 HD1 TYR 93 HD1 TYR 93 6.747 -14.979 -7.132 716 HD2 TYR 93 HD2 TYR 93 4.019 -17.235 -9.589 717 HE1 TYR 93 HE1 TYR 93 6.740 -16.797 -5.466 718 HE2 TYR 93 HE2 TYR 93 4.016 -19.042 -7.905 719 HH TYR 93 HH TYR 93 5.437 -18.638 -4.769 720 H ASN 94 HN ASN 94 8.184 -15.605 -8.181 721 HA ASN 94 HA ASN 94 9.424 -17.449 -10.163 722 HB2 ASN 94 HB2 ASN 94 10.599 -16.448 -7.577 723 HB3 ASN 94 HB1 ASN 94 11.371 -17.534 -8.734 724 HD21 ASN 94 HD21 ASN 94 12.242 -16.614 -10.685 725 HD22 ASN 94 HD22 ASN 94 12.274 -14.941 -10.971 726 HA PRO 95 HA PRO 95 6.673 -20.120 -7.526 727 HB2 PRO 95 HB2 PRO 95 7.596 -21.962 -9.730 728 HB3 PRO 95 HB1 PRO 95 5.978 -21.799 -9.013 729 HG2 PRO 95 HG2 PRO 95 6.489 -20.735 -11.383 730 HG3 PRO 95 HG1 PRO 95 5.522 -19.834 -10.196 731 HD2 PRO 95 HD2 PRO 95 8.395 -19.412 -10.991 732 HD3 PRO 95 HD1 PRO 95 7.158 -18.203 -10.557 733 H HIS 96 HN HIS 96 7.388 -21.262 -5.805 734 HA HIS 96 HA HIS 96 8.940 -22.137 -4.319 735 HB2 HIS 96 HB2 HIS 96 8.043 -24.083 -5.609 736 HB3 HIS 96 HB1 HIS 96 9.420 -23.945 -6.699 737 HD1 HIS 96 HD1 HIS 96 11.115 -25.671 -6.110 738 HD2 HIS 96 HD2 HIS 96 9.287 -24.113 -2.702 739 HE1 HIS 96 HE1 HIS 96 12.177 -26.840 -4.130 740 HE2 HIS 96 HE2 HIS 96 11.074 -25.900 -2.044 741 H ALA 97 HN ALA 97 10.021 -19.901 -5.587 742 HA ALA 97 HA ALA 97 11.995 -18.880 -6.078 743 HB1 ALA 97 HB1 ALA 97 13.942 -19.656 -4.908 744 HB2 ALA 97 HB2 ALA 97 13.314 -21.303 -4.813 745 HB3 ALA 97 HB3 ALA 97 12.567 -20.018 -3.865 746 H LYS 98 HN LYS 98 14.382 -20.852 -6.356 747 HA LYS 98 HA LYS 98 13.858 -22.363 -8.689 748 HB2 LYS 98 HB2 LYS 98 13.918 -20.046 -9.697 749 HB3 LYS 98 HB1 LYS 98 15.559 -19.857 -9.094 750 HG2 LYS 98 HG2 LYS 98 16.331 -21.698 -10.508 751 HG3 LYS 98 HG1 LYS 98 14.677 -22.040 -11.027 752 HD2 LYS 98 HD2 LYS 98 14.536 -19.746 -12.011 753 HD3 LYS 98 HD1 LYS 98 16.211 -19.464 -11.545 754 HE2 LYS 98 HE2 LYS 98 15.279 -21.659 -13.410 755 HE3 LYS 98 HE1 LYS 98 15.996 -20.135 -13.926 756 HZ1 LYS 98 HZ1 LYS 98 17.281 -22.230 -12.266 757 HZ2 LYS 98 HZ2 LYS 98 17.967 -20.710 -12.592 758 HZ3 LYS 98 HZ3 LYS 98 17.684 -21.807 -13.859 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 5.624 -15.044 -1.232 2 H2 GLY 1 H2 GLY 1 5.476 -13.560 -2.046 3 H3 GLY 1 H3 GLY 1 6.962 -14.387 -2.041 4 HA2 GLY 1 HA3 GLY 1 6.112 -16.127 -3.395 5 HA3 GLY 1 HA2 GLY 1 4.482 -15.469 -3.255 6 H VAL 2 HN VAL 2 3.918 -13.619 -4.409 7 HA VAL 2 HA VAL 2 5.441 -13.155 -6.835 8 HB VAL 2 HB VAL 2 2.984 -13.326 -6.884 9 HG11 VAL 2 HG11 VAL 2 2.985 -10.706 -5.352 10 HG12 VAL 2 HG12 VAL 2 2.628 -12.275 -4.630 11 HG13 VAL 2 HG13 VAL 2 1.578 -11.624 -5.889 12 HG21 VAL 2 HG21 VAL 2 2.608 -11.523 -8.405 13 HG22 VAL 2 HG22 VAL 2 4.340 -11.830 -8.507 14 HG23 VAL 2 HG23 VAL 2 3.739 -10.463 -7.567 15 H TYR 3 HN TYR 3 5.869 -10.957 -7.601 16 HA TYR 3 HA TYR 3 6.310 -8.922 -5.530 17 HB2 TYR 3 HB2 TYR 3 8.692 -8.612 -6.301 18 HB3 TYR 3 HB1 TYR 3 8.391 -10.081 -5.379 19 HD1 TYR 3 HD2 TYR 3 8.237 -12.287 -6.523 20 HD2 TYR 3 HD1 TYR 3 9.338 -8.716 -8.648 21 HE1 TYR 3 HE2 TYR 3 9.141 -13.665 -8.376 22 HE2 TYR 3 HE1 TYR 3 10.247 -10.104 -10.492 23 HH TYR 3 HH TYR 3 10.630 -13.540 -10.202 24 H HIS 4 HN HIS 4 5.823 -6.998 -6.249 25 HA HIS 4 HA HIS 4 5.026 -6.607 -8.984 26 HB2 HIS 4 HB2 HIS 4 4.487 -4.322 -8.300 27 HB3 HIS 4 HB1 HIS 4 3.844 -5.489 -7.148 28 HD1 HIS 4 HD1 HIS 4 5.281 -5.801 -4.891 29 HD2 HIS 4 HD2 HIS 4 6.234 -2.461 -7.197 30 HE1 HIS 4 HE1 HIS 4 6.572 -4.230 -3.379 31 HE2 HIS 4 HE2 HIS 4 7.159 -2.190 -4.771 32 H ARG 5 HN ARG 5 6.022 -5.565 -10.603 33 HA ARG 5 HA ARG 5 8.570 -4.173 -10.131 34 HB2 ARG 5 HB2 ARG 5 9.745 -5.458 -11.862 35 HB3 ARG 5 HB1 ARG 5 9.267 -6.492 -10.518 36 HG2 ARG 5 HG2 ARG 5 7.319 -7.286 -11.809 37 HG3 ARG 5 HG1 ARG 5 7.774 -6.241 -13.154 38 HD2 ARG 5 HD2 ARG 5 9.911 -7.434 -13.368 39 HD3 ARG 5 HD1 ARG 5 9.481 -8.458 -12.011 40 HE ARG 5 HE ARG 5 7.957 -9.592 -13.367 41 HH11 ARG 5 HH21 ARG 5 9.368 -6.894 -15.015 42 HH12 ARG 5 HH22 ARG 5 8.726 -7.329 -16.562 43 HH21 ARG 5 HH11 ARG 5 7.096 -10.160 -15.392 44 HH22 ARG 5 HH12 ARG 5 7.432 -9.175 -16.774 45 H GLU 6 HN GLU 6 9.311 -3.010 -12.022 46 HA GLU 6 HA GLU 6 7.531 -2.623 -14.261 47 HB2 GLU 6 HB2 GLU 6 7.120 -0.213 -13.769 48 HB3 GLU 6 HB1 GLU 6 6.315 -1.294 -12.638 49 HG2 GLU 6 HG2 GLU 6 9.022 -0.040 -12.069 50 HG3 GLU 6 HG1 GLU 6 7.504 0.700 -11.585 51 H ALA 7 HN ALA 7 8.325 -0.416 -15.368 52 HA ALA 7 HA ALA 7 10.882 -0.891 -16.362 53 HB1 ALA 7 HB1 ALA 7 9.324 1.698 -16.260 54 HB2 ALA 7 HB2 ALA 7 9.263 0.488 -17.546 55 HB3 ALA 7 HB3 ALA 7 10.740 1.417 -17.273 56 H ARG 8 HN ARG 8 12.832 -0.609 -15.549 57 HA ARG 8 HA ARG 8 13.309 0.482 -12.968 58 HB2 ARG 8 HB2 ARG 8 15.201 -0.250 -15.221 59 HB3 ARG 8 HB1 ARG 8 15.729 0.217 -13.604 60 HG2 ARG 8 HG2 ARG 8 14.401 -1.632 -12.648 61 HG3 ARG 8 HG1 ARG 8 13.942 -2.137 -14.272 62 HD2 ARG 8 HD2 ARG 8 16.799 -1.930 -13.292 63 HD3 ARG 8 HD1 ARG 8 15.875 -3.424 -13.314 64 HE ARG 8 HE ARG 8 17.114 -2.126 -15.576 65 HH11 ARG 8 HH21 ARG 8 14.431 -4.085 -14.612 66 HH12 ARG 8 HH22 ARG 8 14.416 -5.021 -16.069 67 HH21 ARG 8 HH11 ARG 8 17.110 -3.364 -17.475 68 HH22 ARG 8 HH12 ARG 8 15.932 -4.617 -17.685 69 H SER 9 HN SER 9 13.768 1.736 -16.237 70 HA SER 9 HA SER 9 14.567 4.385 -15.133 71 HB2 SER 9 HB2 SER 9 14.981 3.192 -17.882 72 HB3 SER 9 HB1 SER 9 15.453 4.820 -17.396 73 HG SER 9 HG SER 9 16.497 2.332 -16.655 74 H GLY 10 HN GLY 10 11.806 3.415 -15.245 75 HA2 GLY 10 HA3 GLY 10 10.632 5.716 -16.511 76 HA3 GLY 10 HA2 GLY 10 10.288 4.231 -17.390 77 H LYS 11 HN LYS 11 8.229 3.815 -16.978 78 HA LYS 11 HA LYS 11 7.412 3.136 -14.264 79 HB2 LYS 11 HB2 LYS 11 6.022 5.358 -15.796 80 HB3 LYS 11 HB1 LYS 11 5.356 4.564 -14.371 81 HG2 LYS 11 HG2 LYS 11 7.440 5.264 -13.112 82 HG3 LYS 11 HG1 LYS 11 7.894 6.216 -14.522 83 HD2 LYS 11 HD2 LYS 11 5.763 7.459 -14.369 84 HD3 LYS 11 HD1 LYS 11 5.366 6.560 -12.903 85 HE2 LYS 11 HE2 LYS 11 7.809 8.318 -13.272 86 HE3 LYS 11 HE1 LYS 11 6.365 8.757 -12.359 87 HZ1 LYS 11 HZ1 LYS 11 8.579 7.318 -11.472 88 HZ2 LYS 11 HZ2 LYS 11 7.269 6.236 -11.503 89 HZ3 LYS 11 HZ3 LYS 11 7.161 7.680 -10.614 90 H TYR 12 HN TYR 12 5.339 4.046 -16.961 91 HA TYR 12 HA TYR 12 4.362 1.255 -17.132 92 HB2 TYR 12 HB2 TYR 12 3.109 3.856 -18.057 93 HB3 TYR 12 HB1 TYR 12 2.401 2.257 -18.272 94 HD1 TYR 12 HD1 TYR 12 3.248 4.886 -15.828 95 HD2 TYR 12 HD2 TYR 12 1.507 0.994 -16.363 96 HE1 TYR 12 HE1 TYR 12 2.257 5.016 -13.559 97 HE2 TYR 12 HE2 TYR 12 0.519 1.126 -14.091 98 HH TYR 12 HH TYR 12 0.317 2.326 -12.241 99 H LYS 13 HN LYS 13 6.842 2.290 -18.425 100 HA LYS 13 HA LYS 13 6.154 2.273 -21.282 101 HB2 LYS 13 HB2 LYS 13 8.759 2.750 -19.821 102 HB3 LYS 13 HB1 LYS 13 8.592 2.736 -21.578 103 HG2 LYS 13 HG2 LYS 13 6.918 4.551 -21.430 104 HG3 LYS 13 HG1 LYS 13 7.114 4.582 -19.677 105 HD2 LYS 13 HD2 LYS 13 9.529 5.095 -19.991 106 HD3 LYS 13 HD1 LYS 13 9.262 5.157 -21.732 107 HE2 LYS 13 HE2 LYS 13 7.906 6.928 -19.675 108 HE3 LYS 13 HE1 LYS 13 9.204 7.422 -20.762 109 HZ1 LYS 13 HZ1 LYS 13 6.390 6.921 -21.331 110 HZ2 LYS 13 HZ2 LYS 13 7.503 6.428 -22.516 111 HZ3 LYS 13 HZ3 LYS 13 7.453 8.051 -22.018 112 H LEU 14 HN LEU 14 5.751 -0.120 -19.697 113 HA LEU 14 HA LEU 14 7.762 -1.947 -20.936 114 HB2 LEU 14 HB2 LEU 14 7.728 -1.856 -18.405 115 HB3 LEU 14 HB1 LEU 14 6.114 -2.534 -18.479 116 HG LEU 14 HG LEU 14 7.232 -4.405 -19.946 117 HD11 LEU 14 HD11 LEU 14 9.604 -4.842 -19.306 118 HD12 LEU 14 HD12 LEU 14 9.651 -3.279 -18.496 119 HD13 LEU 14 HD13 LEU 14 9.440 -3.362 -20.242 120 HD21 LEU 14 HD21 LEU 14 7.771 -4.170 -16.972 121 HD22 LEU 14 HD22 LEU 14 7.859 -5.671 -17.896 122 HD23 LEU 14 HD23 LEU 14 6.317 -4.833 -17.722 123 H THR 15 HN THR 15 7.039 -3.213 -22.467 124 HA THR 15 HA THR 15 4.157 -3.459 -22.948 125 HB THR 15 HB THR 15 6.461 -4.602 -24.549 126 HG1 THR 15 HG1 THR 15 6.268 -2.216 -24.217 127 HG21 THR 15 HG21 THR 15 4.678 -4.430 -26.385 128 HG22 THR 15 HG22 THR 15 3.503 -4.216 -25.093 129 HG23 THR 15 HG23 THR 15 4.442 -5.705 -25.194 130 H TYR 16 HN TYR 16 3.201 -5.559 -23.412 131 HA TYR 16 HA TYR 16 3.543 -7.401 -21.325 132 HB2 TYR 16 HB2 TYR 16 1.424 -7.238 -22.443 133 HB3 TYR 16 HB1 TYR 16 2.142 -7.604 -23.994 134 HD1 TYR 16 HD1 TYR 16 2.180 -9.174 -20.558 135 HD2 TYR 16 HD2 TYR 16 1.603 -9.775 -24.781 136 HE1 TYR 16 HE1 TYR 16 1.709 -11.563 -20.160 137 HE2 TYR 16 HE2 TYR 16 1.144 -12.169 -24.368 138 HH TYR 16 HH TYR 16 0.239 -13.536 -22.295 139 H ALA 17 HN ALA 17 4.663 -7.467 -24.686 140 HA ALA 17 HA ALA 17 5.751 -10.033 -24.753 141 HB1 ALA 17 HB1 ALA 17 7.276 -9.146 -26.503 142 HB2 ALA 17 HB2 ALA 17 6.758 -7.511 -26.091 143 HB3 ALA 17 HB3 ALA 17 5.600 -8.663 -26.758 144 H GLU 18 HN GLU 18 7.104 -7.052 -23.395 145 HA GLU 18 HA GLU 18 9.727 -8.068 -22.967 146 HB2 GLU 18 HB2 GLU 18 8.203 -5.932 -21.464 147 HB3 GLU 18 HB1 GLU 18 9.930 -6.231 -21.306 148 HG2 GLU 18 HG2 GLU 18 8.571 -5.560 -23.931 149 HG3 GLU 18 HG1 GLU 18 9.343 -4.361 -22.895 150 H ALA 19 HN ALA 19 6.928 -7.782 -20.765 151 HA ALA 19 HA ALA 19 8.025 -8.897 -18.482 152 HB1 ALA 19 HB1 ALA 19 5.213 -9.196 -19.556 153 HB2 ALA 19 HB2 ALA 19 5.801 -7.918 -18.489 154 HB3 ALA 19 HB3 ALA 19 5.704 -9.580 -17.904 155 H LYS 20 HN LYS 20 6.932 -10.517 -21.400 156 HA LYS 20 HA LYS 20 6.974 -13.173 -20.322 157 HB2 LYS 20 HB2 LYS 20 6.990 -12.098 -23.151 158 HB3 LYS 20 HB1 LYS 20 7.094 -13.822 -22.803 159 HG2 LYS 20 HG2 LYS 20 4.966 -13.762 -21.623 160 HG3 LYS 20 HG1 LYS 20 4.874 -12.010 -21.805 161 HD2 LYS 20 HD2 LYS 20 3.470 -13.144 -23.482 162 HD3 LYS 20 HD1 LYS 20 4.780 -12.260 -24.256 163 HE2 LYS 20 HE2 LYS 20 5.193 -15.175 -23.583 164 HE3 LYS 20 HE1 LYS 20 4.247 -14.745 -25.009 165 HZ1 LYS 20 HZ1 LYS 20 6.368 -13.106 -25.219 166 HZ2 LYS 20 HZ2 LYS 20 6.217 -14.603 -26.005 167 HZ3 LYS 20 HZ3 LYS 20 7.078 -14.490 -24.544 168 H ALA 21 HN ALA 21 9.350 -11.066 -21.826 169 HA ALA 21 HA ALA 21 11.306 -13.033 -22.396 170 HB1 ALA 21 HB1 ALA 21 12.857 -11.208 -22.611 171 HB2 ALA 21 HB2 ALA 21 11.826 -10.151 -21.646 172 HB3 ALA 21 HB3 ALA 21 11.302 -10.673 -23.247 173 H VAL 22 HN VAL 22 10.932 -10.908 -19.555 174 HA VAL 22 HA VAL 22 13.182 -11.843 -18.127 175 HB VAL 22 HB VAL 22 10.569 -10.738 -17.063 176 HG11 VAL 22 HG11 VAL 22 12.055 -10.028 -15.132 177 HG12 VAL 22 HG12 VAL 22 13.305 -11.079 -15.800 178 HG13 VAL 22 HG13 VAL 22 11.777 -11.765 -15.243 179 HG21 VAL 22 HG21 VAL 22 11.670 -9.248 -18.685 180 HG22 VAL 22 HG22 VAL 22 13.187 -9.390 -17.797 181 HG23 VAL 22 HG23 VAL 22 11.802 -8.588 -17.056 182 H CYS 23 HN CYS 23 9.797 -12.914 -18.069 183 HA CYS 23 HA CYS 23 10.525 -15.214 -16.332 184 HB2 CYS 23 HB2 CYS 23 7.990 -13.710 -16.914 185 HB3 CYS 23 HB1 CYS 23 7.876 -15.385 -16.374 186 H GLU 24 HN GLU 24 9.012 -17.185 -16.910 187 HA GLU 24 HA GLU 24 8.510 -18.908 -18.353 188 HB2 GLU 24 HB2 GLU 24 7.198 -17.125 -19.576 189 HB3 GLU 24 HB1 GLU 24 8.608 -16.874 -20.600 190 HG2 GLU 24 HG2 GLU 24 8.547 -19.237 -21.291 191 HG3 GLU 24 HG1 GLU 24 7.132 -19.495 -20.271 192 H PHE 25 HN PHE 25 11.042 -16.691 -19.467 193 HA PHE 25 HA PHE 25 12.434 -18.435 -21.171 194 HB2 PHE 25 HB2 PHE 25 12.812 -15.999 -21.026 195 HB3 PHE 25 HB1 PHE 25 13.515 -16.206 -19.426 196 HD1 PHE 25 HD1 PHE 25 13.913 -17.095 -23.026 197 HD2 PHE 25 HD2 PHE 25 15.807 -16.894 -19.173 198 HE1 PHE 25 HE1 PHE 25 16.111 -17.540 -24.081 199 HE2 PHE 25 HE2 PHE 25 18.004 -17.341 -20.230 200 HZ PHE 25 HZ PHE 25 18.157 -17.662 -22.684 201 H GLU 26 HN GLU 26 12.853 -17.785 -17.700 202 HA GLU 26 HA GLU 26 14.802 -19.968 -17.466 203 HB2 GLU 26 HB2 GLU 26 15.054 -19.226 -15.145 204 HB3 GLU 26 HB1 GLU 26 15.278 -17.890 -16.270 205 HG2 GLU 26 HG2 GLU 26 12.953 -17.159 -15.865 206 HG3 GLU 26 HG1 GLU 26 12.736 -18.484 -14.723 207 H GLY 27 HN GLY 27 11.799 -20.271 -18.005 208 HA2 GLY 27 HA3 GLY 27 10.432 -22.114 -17.600 209 HA3 GLY 27 HA2 GLY 27 11.425 -22.545 -16.213 210 H GLY 28 HN GLY 28 10.608 -19.273 -16.152 211 HA2 GLY 28 HA3 GLY 28 8.902 -19.606 -13.854 212 HA3 GLY 28 HA2 GLY 28 9.367 -18.083 -14.604 213 H HIS 29 HN HIS 29 7.070 -17.600 -14.099 214 HA HIS 29 HA HIS 29 5.464 -17.789 -16.470 215 HB2 HIS 29 HB2 HIS 29 5.021 -20.020 -15.580 216 HB3 HIS 29 HB1 HIS 29 4.592 -19.337 -14.014 217 HD1 HIS 29 HD1 HIS 29 3.428 -19.184 -17.646 218 HD2 HIS 29 HD2 HIS 29 1.913 -18.684 -13.794 219 HE1 HIS 29 HE1 HIS 29 0.926 -18.873 -17.896 220 HE2 HIS 29 HE2 HIS 29 -0.012 -18.567 -15.553 221 H LEU 30 HN LEU 30 4.013 -16.147 -16.539 222 HA LEU 30 HA LEU 30 4.130 -14.094 -14.543 223 HB2 LEU 30 HB2 LEU 30 2.553 -14.503 -17.089 224 HB3 LEU 30 HB1 LEU 30 2.159 -13.161 -16.022 225 HG LEU 30 HG LEU 30 4.500 -12.363 -16.173 226 HD11 LEU 30 HD11 LEU 30 5.722 -14.381 -16.585 227 HD12 LEU 30 HD12 LEU 30 5.910 -13.396 -18.032 228 HD13 LEU 30 HD13 LEU 30 4.775 -14.746 -18.028 229 HD21 LEU 30 HD21 LEU 30 3.311 -12.832 -18.926 230 HD22 LEU 30 HD22 LEU 30 4.336 -11.487 -18.424 231 HD23 LEU 30 HD23 LEU 30 2.694 -11.628 -17.792 232 H ALA 31 HN ALA 31 2.733 -13.607 -12.937 233 HA ALA 31 HA ALA 31 0.952 -15.602 -11.962 234 HB1 ALA 31 HB1 ALA 31 2.165 -13.956 -10.530 235 HB2 ALA 31 HB2 ALA 31 0.433 -14.014 -10.209 236 HB3 ALA 31 HB3 ALA 31 1.110 -12.689 -11.156 237 H THR 32 HN THR 32 -1.227 -15.788 -12.086 238 HA THR 32 HA THR 32 -2.639 -14.033 -14.006 239 HB THR 32 HB THR 32 -4.152 -15.818 -14.352 240 HG1 THR 32 HG1 THR 32 -3.893 -17.711 -12.881 241 HG21 THR 32 HG21 THR 32 -2.735 -17.688 -14.929 242 HG22 THR 32 HG22 THR 32 -1.507 -17.177 -13.770 243 HG23 THR 32 HG23 THR 32 -1.817 -16.209 -15.212 244 H TYR 33 HN TYR 33 -4.894 -13.537 -13.531 245 HA TYR 33 HA TYR 33 -5.202 -12.091 -11.176 246 HB2 TYR 33 HB2 TYR 33 -7.459 -11.717 -11.858 247 HB3 TYR 33 HB1 TYR 33 -6.531 -11.887 -13.340 248 HD1 TYR 33 HD2 TYR 33 -6.525 -14.125 -14.554 249 HD2 TYR 33 HD1 TYR 33 -9.257 -13.235 -11.355 250 HE1 TYR 33 HE2 TYR 33 -7.991 -15.994 -15.278 251 HE2 TYR 33 HE1 TYR 33 -10.715 -15.105 -12.080 252 HH TYR 33 HH TYR 33 -9.759 -17.521 -14.067 253 H LYS 34 HN LYS 34 -6.643 -15.256 -11.961 254 HA LYS 34 HA LYS 34 -7.827 -15.708 -9.445 255 HB2 LYS 34 HB2 LYS 34 -8.368 -16.930 -11.537 256 HB3 LYS 34 HB1 LYS 34 -6.814 -17.748 -11.442 257 HG2 LYS 34 HG2 LYS 34 -7.445 -18.697 -9.242 258 HG3 LYS 34 HG1 LYS 34 -9.008 -17.893 -9.347 259 HD2 LYS 34 HD2 LYS 34 -8.040 -19.843 -11.463 260 HD3 LYS 34 HD1 LYS 34 -8.940 -20.371 -10.045 261 HE2 LYS 34 HE2 LYS 34 -10.753 -18.703 -10.723 262 HE3 LYS 34 HE1 LYS 34 -9.892 -18.521 -12.249 263 HZ1 LYS 34 HZ1 LYS 34 -11.720 -20.248 -12.148 264 HZ2 LYS 34 HZ2 LYS 34 -10.647 -21.178 -11.216 265 HZ3 LYS 34 HZ3 LYS 34 -10.235 -20.735 -12.802 266 H GLN 35 HN GLN 35 -4.671 -16.648 -10.769 267 HA GLN 35 HA GLN 35 -3.820 -18.101 -8.480 268 HB2 GLN 35 HB2 GLN 35 -2.808 -18.332 -10.753 269 HB3 GLN 35 HB1 GLN 35 -2.104 -16.729 -10.569 270 HG2 GLN 35 HG2 GLN 35 -0.429 -18.395 -9.992 271 HG3 GLN 35 HG1 GLN 35 -0.896 -17.543 -8.525 272 HE21 GLN 35 HE21 GLN 35 -0.584 -19.227 -6.998 273 HE22 GLN 35 HE22 GLN 35 -1.427 -20.696 -7.055 274 H LEU 36 HN LEU 36 -3.762 -14.716 -9.346 275 HA LEU 36 HA LEU 36 -1.812 -13.834 -7.509 276 HB2 LEU 36 HB2 LEU 36 -3.800 -12.633 -9.298 277 HB3 LEU 36 HB1 LEU 36 -3.713 -11.719 -7.825 278 HG LEU 36 HG LEU 36 -1.221 -12.468 -9.386 279 HD11 LEU 36 HD11 LEU 36 -2.923 -9.968 -9.590 280 HD12 LEU 36 HD12 LEU 36 -2.670 -11.168 -10.854 281 HD13 LEU 36 HD13 LEU 36 -1.325 -10.162 -10.315 282 HD21 LEU 36 HD21 LEU 36 -0.283 -10.510 -8.161 283 HD22 LEU 36 HD22 LEU 36 -0.847 -11.752 -7.051 284 HD23 LEU 36 HD23 LEU 36 -1.821 -10.310 -7.327 285 H GLU 37 HN GLU 37 -5.180 -14.678 -7.135 286 HA GLU 37 HA GLU 37 -5.852 -13.352 -4.799 287 HB2 GLU 37 HB2 GLU 37 -7.653 -14.849 -4.623 288 HB3 GLU 37 HB1 GLU 37 -7.239 -14.955 -6.331 289 HG2 GLU 37 HG2 GLU 37 -5.747 -16.965 -5.669 290 HG3 GLU 37 HG1 GLU 37 -6.584 -16.930 -4.125 291 H ALA 38 HN ALA 38 -3.980 -16.317 -5.191 292 HA ALA 38 HA ALA 38 -3.834 -17.172 -2.546 293 HB1 ALA 38 HB1 ALA 38 -1.803 -18.331 -3.173 294 HB2 ALA 38 HB2 ALA 38 -1.587 -17.274 -4.568 295 HB3 ALA 38 HB3 ALA 38 -2.936 -18.408 -4.523 296 H ALA 39 HN ALA 39 -1.983 -14.669 -4.206 297 HA ALA 39 HA ALA 39 -0.235 -14.174 -1.947 298 HB1 ALA 39 HB1 ALA 39 0.597 -13.745 -4.179 299 HB2 ALA 39 HB2 ALA 39 0.503 -12.217 -3.304 300 HB3 ALA 39 HB3 ALA 39 -0.727 -12.625 -4.502 301 H ARG 40 HN ARG 40 -3.088 -12.625 -3.376 302 HA ARG 40 HA ARG 40 -3.137 -10.316 -1.794 303 HB2 ARG 40 HB2 ARG 40 -4.580 -10.583 -3.736 304 HB3 ARG 40 HB1 ARG 40 -5.438 -11.897 -2.952 305 HG2 ARG 40 HG2 ARG 40 -6.690 -9.754 -2.858 306 HG3 ARG 40 HG1 ARG 40 -6.318 -10.381 -1.262 307 HD2 ARG 40 HD2 ARG 40 -4.854 -8.619 -0.779 308 HD3 ARG 40 HD1 ARG 40 -4.337 -8.451 -2.460 309 HE ARG 40 HE ARG 40 -5.919 -6.803 -2.653 310 HH11 ARG 40 HH21 ARG 40 -6.920 -9.060 -0.215 311 HH12 ARG 40 HH22 ARG 40 -8.462 -8.331 0.026 312 HH21 ARG 40 HH11 ARG 40 -7.926 -5.831 -2.323 313 HH22 ARG 40 HH12 ARG 40 -9.026 -6.479 -1.158 314 H LYS 41 HN LYS 41 -4.321 -13.570 -1.127 315 HA LYS 41 HA LYS 41 -5.730 -12.966 1.250 316 HB2 LYS 41 HB2 LYS 41 -4.392 -15.506 0.284 317 HB3 LYS 41 HB1 LYS 41 -5.339 -15.420 1.769 318 HG2 LYS 41 HG2 LYS 41 -7.316 -14.719 0.520 319 HG3 LYS 41 HG1 LYS 41 -6.388 -14.654 -0.970 320 HD2 LYS 41 HD2 LYS 41 -7.560 -16.744 -1.018 321 HD3 LYS 41 HD1 LYS 41 -5.881 -17.134 -0.648 322 HE2 LYS 41 HE2 LYS 41 -6.381 -17.504 1.667 323 HE3 LYS 41 HE1 LYS 41 -7.969 -16.749 1.526 324 HZ1 LYS 41 HZ1 LYS 41 -8.861 -18.604 0.698 325 HZ2 LYS 41 HZ2 LYS 41 -7.513 -19.382 1.382 326 HZ3 LYS 41 HZ3 LYS 41 -7.512 -18.967 -0.266 327 H ILE 42 HN ILE 42 -2.521 -12.513 0.621 328 HA ILE 42 HA ILE 42 -1.632 -13.121 3.390 329 HB ILE 42 HB ILE 42 0.108 -12.445 1.001 330 HG12 ILE 42 HG12 ILE 42 -1.134 -14.450 0.434 331 HG13 ILE 42 HG11 ILE 42 0.510 -14.915 0.855 332 HG21 ILE 42 HG21 ILE 42 1.420 -12.161 2.949 333 HG22 ILE 42 HG22 ILE 42 1.777 -13.809 2.460 334 HG23 ILE 42 HG23 ILE 42 0.652 -13.514 3.779 335 HD11 ILE 42 HD11 ILE 42 -0.810 -16.492 2.004 336 HD12 ILE 42 HD12 ILE 42 -2.021 -15.296 2.452 337 HD13 ILE 42 HD13 ILE 42 -0.453 -15.304 3.257 338 H GLY 43 HN GLY 43 -3.130 -10.684 2.065 339 HA2 GLY 43 HA3 GLY 43 -3.324 -8.499 2.817 340 HA3 GLY 43 HA2 GLY 43 -1.839 -8.692 3.736 341 H PHE 44 HN PHE 44 -1.722 -9.618 0.421 342 HA PHE 44 HA PHE 44 0.295 -7.704 -0.174 343 HB2 PHE 44 HB2 PHE 44 -0.360 -10.095 -1.225 344 HB3 PHE 44 HB1 PHE 44 -1.194 -9.094 -2.392 345 HD1 PHE 44 HD1 PHE 44 2.110 -9.205 -0.601 346 HD2 PHE 44 HD2 PHE 44 0.067 -8.458 -4.310 347 HE1 PHE 44 HE1 PHE 44 4.283 -8.814 -1.722 348 HE2 PHE 44 HE2 PHE 44 2.247 -8.071 -5.425 349 HZ PHE 44 HZ PHE 44 4.351 -8.246 -4.133 350 H HIS 45 HN HIS 45 0.118 -5.681 -0.876 351 HA HIS 45 HA HIS 45 -2.333 -4.795 -2.282 352 HB2 HIS 45 HB2 HIS 45 -2.731 -4.248 0.047 353 HB3 HIS 45 HB1 HIS 45 -1.139 -3.509 0.192 354 HD1 HIS 45 HD1 HIS 45 -2.147 -1.179 0.755 355 HD2 HIS 45 HD2 HIS 45 -3.324 -2.659 -2.960 356 HE1 HIS 45 HE1 HIS 45 -3.207 0.759 -0.484 357 HE2 HIS 45 HE2 HIS 45 -3.929 -0.127 -2.752 358 H VAL 46 HN VAL 46 -1.450 -4.331 -4.199 359 HA VAL 46 HA VAL 46 0.572 -2.179 -4.300 360 HB VAL 46 HB VAL 46 1.817 -3.388 -6.084 361 HG11 VAL 46 HG11 VAL 46 2.533 -3.402 -3.684 362 HG12 VAL 46 HG12 VAL 46 3.046 -4.841 -4.566 363 HG13 VAL 46 HG13 VAL 46 1.668 -4.924 -3.470 364 HG21 VAL 46 HG21 VAL 46 -0.054 -5.646 -5.285 365 HG22 VAL 46 HG22 VAL 46 1.471 -5.924 -6.126 366 HG23 VAL 46 HG23 VAL 46 0.206 -4.979 -6.895 367 H CYS 47 HN CYS 47 -0.066 -0.637 -5.635 368 HA CYS 47 HA CYS 47 -2.236 -1.174 -7.560 369 HB2 CYS 47 HB2 CYS 47 -2.654 0.760 -6.211 370 HB3 CYS 47 HB1 CYS 47 -1.029 1.384 -6.483 371 H ALA 48 HN ALA 48 -1.142 -2.263 -9.187 372 HA ALA 48 HA ALA 48 0.338 -0.540 -11.029 373 HB1 ALA 48 HB1 ALA 48 2.182 -1.397 -9.725 374 HB2 ALA 48 HB2 ALA 48 2.173 -2.243 -11.273 375 HB3 ALA 48 HB3 ALA 48 1.555 -3.041 -9.825 376 H ALA 49 HN ALA 49 -1.358 -0.807 -12.445 377 HA ALA 49 HA ALA 49 -2.452 -3.356 -13.142 378 HB1 ALA 49 HB1 ALA 49 -3.562 -1.052 -13.350 379 HB2 ALA 49 HB2 ALA 49 -3.775 -2.153 -14.715 380 HB3 ALA 49 HB3 ALA 49 -2.604 -0.839 -14.815 381 H GLY 50 HN GLY 50 -1.548 -4.856 -14.377 382 HA2 GLY 50 HA3 GLY 50 0.257 -4.062 -16.609 383 HA3 GLY 50 HA2 GLY 50 0.787 -5.252 -15.429 384 H TRP 51 HN TRP 51 0.644 -5.784 -18.145 385 HA TRP 51 HA TRP 51 -1.784 -7.220 -18.797 386 HB2 TRP 51 HB2 TRP 51 0.913 -7.230 -20.143 387 HB3 TRP 51 HB1 TRP 51 -0.582 -7.871 -20.821 388 HD1 TRP 51 HD1 TRP 51 1.471 -4.883 -20.885 389 HE1 TRP 51 HE1 TRP 51 0.157 -2.842 -21.715 390 HE3 TRP 51 HE3 TRP 51 -3.295 -6.699 -20.566 391 HZ2 TRP 51 HZ2 TRP 51 -2.556 -2.060 -22.178 392 HZ3 TRP 51 HZ3 TRP 51 -5.216 -5.284 -21.202 393 HH2 TRP 51 HH2 TRP 51 -4.857 -2.969 -22.005 394 H MET 52 HN MET 52 -2.182 -9.069 -17.694 395 HA MET 52 HA MET 52 0.056 -10.879 -17.008 396 HB2 MET 52 HB2 MET 52 -2.841 -11.214 -16.193 397 HB3 MET 52 HB1 MET 52 -1.409 -11.923 -15.456 398 HG2 MET 52 HG2 MET 52 -0.642 -9.583 -14.891 399 HG3 MET 52 HG1 MET 52 -2.215 -9.002 -15.436 400 HE1 MET 52 HE1 MET 52 -4.759 -10.282 -13.016 401 HE2 MET 52 HE2 MET 52 -4.310 -11.363 -14.330 402 HE3 MET 52 HE3 MET 52 -4.368 -9.623 -14.610 403 H ALA 53 HN ALA 53 -1.043 -13.288 -16.975 404 HA ALA 53 HA ALA 53 -0.791 -14.373 -19.442 405 HB1 ALA 53 HB1 ALA 53 -2.200 -16.254 -18.678 406 HB2 ALA 53 HB2 ALA 53 -2.757 -15.268 -17.325 407 HB3 ALA 53 HB3 ALA 53 -1.058 -15.732 -17.439 408 H LYS 54 HN LYS 54 -2.181 -15.085 -21.101 409 HA LYS 54 HA LYS 54 -3.684 -14.626 -22.777 410 HB2 LYS 54 HB2 LYS 54 -5.474 -14.629 -20.334 411 HB3 LYS 54 HB1 LYS 54 -6.085 -14.608 -21.989 412 HG2 LYS 54 HG2 LYS 54 -4.879 -16.718 -22.455 413 HG3 LYS 54 HG1 LYS 54 -4.300 -16.744 -20.786 414 HD2 LYS 54 HD2 LYS 54 -6.667 -16.745 -20.000 415 HD3 LYS 54 HD1 LYS 54 -7.197 -16.836 -21.679 416 HE2 LYS 54 HE2 LYS 54 -5.368 -18.869 -20.372 417 HE3 LYS 54 HE1 LYS 54 -7.112 -19.069 -20.537 418 HZ1 LYS 54 HZ1 LYS 54 -6.743 -19.856 -22.558 419 HZ2 LYS 54 HZ2 LYS 54 -5.083 -19.503 -22.459 420 HZ3 LYS 54 HZ3 LYS 54 -6.171 -18.331 -23.030 421 H GLY 55 HN GLY 55 -2.284 -12.327 -21.986 422 HA2 GLY 55 HA3 GLY 55 -2.356 -10.016 -22.050 423 HA3 GLY 55 HA2 GLY 55 -3.695 -10.260 -23.163 424 H ARG 56 HN ARG 56 -4.433 -11.676 -20.212 425 HA ARG 56 HA ARG 56 -6.531 -9.804 -19.683 426 HB2 ARG 56 HB2 ARG 56 -5.455 -12.188 -18.152 427 HB3 ARG 56 HB1 ARG 56 -6.740 -11.218 -17.538 428 HG2 ARG 56 HG2 ARG 56 -8.086 -11.635 -19.556 429 HG3 ARG 56 HG1 ARG 56 -6.793 -12.636 -20.198 430 HD2 ARG 56 HD2 ARG 56 -8.487 -14.063 -19.187 431 HD3 ARG 56 HD1 ARG 56 -7.010 -14.141 -18.238 432 HE ARG 56 HE ARG 56 -8.410 -12.162 -17.001 433 HH11 ARG 56 HH21 ARG 56 -9.264 -15.332 -18.057 434 HH12 ARG 56 HH22 ARG 56 -10.280 -15.675 -16.706 435 HH21 ARG 56 HH11 ARG 56 -9.758 -12.582 -15.209 436 HH22 ARG 56 HH12 ARG 56 -10.572 -14.107 -15.084 437 H VAL 57 HN VAL 57 -6.540 -8.020 -18.486 438 HA VAL 57 HA VAL 57 -4.163 -7.387 -16.809 439 HB VAL 57 HB VAL 57 -4.502 -5.808 -18.647 440 HG11 VAL 57 HG11 VAL 57 -7.190 -5.122 -17.429 441 HG12 VAL 57 HG12 VAL 57 -7.013 -6.214 -18.800 442 HG13 VAL 57 HG13 VAL 57 -6.499 -4.536 -18.940 443 HG21 VAL 57 HG21 VAL 57 -3.734 -5.043 -16.347 444 HG22 VAL 57 HG22 VAL 57 -5.390 -4.506 -16.053 445 HG23 VAL 57 HG23 VAL 57 -4.445 -3.781 -17.354 446 H GLY 58 HN GLY 58 -4.421 -7.450 -14.707 447 HA2 GLY 58 HA3 GLY 58 -6.652 -6.309 -13.354 448 HA3 GLY 58 HA2 GLY 58 -6.785 -8.065 -13.380 449 H TYR 59 HN TYR 59 -6.406 -6.257 -11.122 450 HA TYR 59 HA TYR 59 -4.290 -7.735 -9.854 451 HB2 TYR 59 HB2 TYR 59 -2.932 -5.785 -9.174 452 HB3 TYR 59 HB1 TYR 59 -2.908 -6.074 -10.909 453 HD1 TYR 59 HD2 TYR 59 -4.667 -4.747 -12.346 454 HD2 TYR 59 HD1 TYR 59 -3.460 -3.603 -8.383 455 HE1 TYR 59 HE2 TYR 59 -5.440 -2.439 -12.777 456 HE2 TYR 59 HE1 TYR 59 -4.236 -1.291 -8.827 457 HH TYR 59 HH TYR 59 -4.644 0.172 -10.725 458 HA PRO 60 HA PRO 60 -7.068 -6.889 -6.479 459 HB2 PRO 60 HB2 PRO 60 -5.656 -7.899 -4.387 460 HB3 PRO 60 HB1 PRO 60 -6.288 -8.950 -5.674 461 HG2 PRO 60 HG2 PRO 60 -3.524 -7.802 -5.379 462 HG3 PRO 60 HG1 PRO 60 -4.000 -9.481 -5.708 463 HD2 PRO 60 HD2 PRO 60 -3.247 -7.811 -7.714 464 HD3 PRO 60 HD1 PRO 60 -4.503 -9.053 -7.947 465 H ILE 61 HN ILE 61 -7.495 -5.282 -4.997 466 HA ILE 61 HA ILE 61 -5.334 -3.672 -3.844 467 HB ILE 61 HB ILE 61 -6.625 -1.543 -4.676 468 HG12 ILE 61 HG12 ILE 61 -7.447 -3.563 -6.799 469 HG13 ILE 61 HG11 ILE 61 -8.544 -2.848 -5.623 470 HG21 ILE 61 HG21 ILE 61 -4.321 -2.224 -5.400 471 HG22 ILE 61 HG22 ILE 61 -5.234 -1.406 -6.661 472 HG23 ILE 61 HG23 ILE 61 -5.056 -3.156 -6.701 473 HD11 ILE 61 HD11 ILE 61 -7.737 -0.561 -6.553 474 HD12 ILE 61 HD12 ILE 61 -8.821 -1.519 -7.560 475 HD13 ILE 61 HD13 ILE 61 -7.091 -1.501 -7.899 476 H VAL 62 HN VAL 62 -5.952 -4.229 -1.823 477 HA VAL 62 HA VAL 62 -8.614 -4.259 -0.850 478 HB VAL 62 HB VAL 62 -6.762 -5.433 0.270 479 HG11 VAL 62 HG11 VAL 62 -5.061 -4.237 1.500 480 HG12 VAL 62 HG12 VAL 62 -5.808 -2.689 1.117 481 HG13 VAL 62 HG13 VAL 62 -5.058 -3.640 -0.159 482 HG21 VAL 62 HG21 VAL 62 -7.908 -3.286 2.079 483 HG22 VAL 62 HG22 VAL 62 -7.391 -4.906 2.544 484 HG23 VAL 62 HG23 VAL 62 -8.820 -4.693 1.532 485 H LYS 63 HN LYS 63 -6.348 -1.703 -1.386 486 HA LYS 63 HA LYS 63 -8.326 0.268 -0.390 487 HB2 LYS 63 HB2 LYS 63 -5.427 0.019 0.416 488 HB3 LYS 63 HB1 LYS 63 -6.227 1.588 0.449 489 HG2 LYS 63 HG2 LYS 63 -7.999 0.621 1.922 490 HG3 LYS 63 HG1 LYS 63 -7.117 -0.897 1.961 491 HD2 LYS 63 HD2 LYS 63 -5.848 1.728 2.808 492 HD3 LYS 63 HD1 LYS 63 -6.739 0.716 3.938 493 HE2 LYS 63 HE2 LYS 63 -5.188 -1.193 3.306 494 HE3 LYS 63 HE1 LYS 63 -4.218 -0.015 2.425 495 HZ1 LYS 63 HZ1 LYS 63 -3.210 0.199 4.401 496 HZ2 LYS 63 HZ2 LYS 63 -4.540 -0.382 5.281 497 HZ3 LYS 63 HZ3 LYS 63 -4.509 1.230 4.750 498 HA PRO 64 HA PRO 64 -6.913 1.086 -4.770 499 HB2 PRO 64 HB2 PRO 64 -9.556 2.534 -4.560 500 HB3 PRO 64 HB1 PRO 64 -8.910 1.574 -5.910 501 HG2 PRO 64 HG2 PRO 64 -10.771 0.547 -4.319 502 HG3 PRO 64 HG1 PRO 64 -9.416 -0.458 -4.868 503 HD2 PRO 64 HD2 PRO 64 -9.845 0.801 -2.166 504 HD3 PRO 64 HD1 PRO 64 -9.118 -0.772 -2.570 505 H GLY 65 HN GLY 65 -5.622 2.778 -5.227 506 HA2 GLY 65 HA3 GLY 65 -5.644 5.137 -3.467 507 HA3 GLY 65 HA2 GLY 65 -4.366 4.660 -4.576 508 HA PRO 66 HA PRO 66 -7.181 8.025 -6.419 509 HB2 PRO 66 HB2 PRO 66 -5.424 10.141 -6.281 510 HB3 PRO 66 HB1 PRO 66 -6.536 9.731 -4.958 511 HG2 PRO 66 HG2 PRO 66 -3.639 8.994 -5.275 512 HG3 PRO 66 HG1 PRO 66 -4.474 9.652 -3.851 513 HD2 PRO 66 HD2 PRO 66 -3.967 6.996 -4.065 514 HD3 PRO 66 HD1 PRO 66 -5.471 7.583 -3.318 515 H ASN 67 HN ASN 67 -3.994 6.788 -6.860 516 HA ASN 67 HA ASN 67 -3.824 7.758 -9.655 517 HB2 ASN 67 HB2 ASN 67 -1.878 8.090 -8.105 518 HB3 ASN 67 HB1 ASN 67 -1.724 6.338 -8.000 519 HD21 ASN 67 HD21 ASN 67 0.322 6.235 -9.120 520 HD22 ASN 67 HD22 ASN 67 0.469 6.618 -10.768 521 H CYS 68 HN CYS 68 -5.671 5.637 -8.766 522 HA CYS 68 HA CYS 68 -4.762 3.523 -10.628 523 HB2 CYS 68 HB2 CYS 68 -6.133 2.739 -8.055 524 HB3 CYS 68 HB1 CYS 68 -5.182 1.744 -9.148 525 H GLY 69 HN GLY 69 -6.797 1.849 -10.635 526 HA2 GLY 69 HA3 GLY 69 -8.815 3.236 -12.055 527 HA3 GLY 69 HA2 GLY 69 -8.874 1.543 -11.581 528 H PHE 70 HN PHE 70 -10.766 3.997 -11.460 529 HA PHE 70 HA PHE 70 -11.379 4.386 -8.692 530 HB2 PHE 70 HB2 PHE 70 -11.932 6.086 -10.349 531 HB3 PHE 70 HB1 PHE 70 -12.965 4.950 -11.212 532 HD1 PHE 70 HD1 PHE 70 -12.558 6.864 -8.049 533 HD2 PHE 70 HD2 PHE 70 -15.215 4.483 -10.446 534 HE1 PHE 70 HE1 PHE 70 -14.458 7.518 -6.595 535 HE2 PHE 70 HE2 PHE 70 -17.114 5.138 -8.989 536 HZ PHE 70 HZ PHE 70 -16.736 6.655 -7.067 537 H GLY 71 HN GLY 71 -12.724 3.266 -7.407 538 HA2 GLY 71 HA3 GLY 71 -14.196 1.654 -6.673 539 HA3 GLY 71 HA2 GLY 71 -14.903 1.683 -8.284 540 H LYS 72 HN LYS 72 -15.174 -0.592 -8.172 541 HA LYS 72 HA LYS 72 -14.593 -2.793 -8.547 542 HB2 LYS 72 HB2 LYS 72 -12.267 -1.422 -9.928 543 HB3 LYS 72 HB1 LYS 72 -12.634 -3.140 -10.056 544 HG2 LYS 72 HG2 LYS 72 -14.779 -2.682 -11.067 545 HG3 LYS 72 HG1 LYS 72 -14.603 -0.954 -10.769 546 HD2 LYS 72 HD2 LYS 72 -14.075 -1.400 -13.103 547 HD3 LYS 72 HD1 LYS 72 -12.599 -0.937 -12.264 548 HE2 LYS 72 HE2 LYS 72 -11.783 -3.175 -12.237 549 HE3 LYS 72 HE1 LYS 72 -13.371 -3.847 -12.612 550 HZ1 LYS 72 HZ1 LYS 72 -11.481 -3.454 -14.426 551 HZ2 LYS 72 HZ2 LYS 72 -12.279 -1.958 -14.531 552 HZ3 LYS 72 HZ3 LYS 72 -13.137 -3.402 -14.791 553 H THR 73 HN THR 73 -14.086 -3.921 -6.758 554 HA THR 73 HA THR 73 -11.289 -3.897 -5.796 555 HB THR 73 HB THR 73 -11.943 -3.760 -3.497 556 HG1 THR 73 HG1 THR 73 -13.874 -4.268 -2.901 557 HG21 THR 73 HG21 THR 73 -11.770 -1.608 -4.713 558 HG22 THR 73 HG22 THR 73 -12.942 -1.527 -3.398 559 HG23 THR 73 HG23 THR 73 -13.496 -1.682 -5.064 560 H GLY 74 HN GLY 74 -10.955 -5.720 -4.212 561 HA2 GLY 74 HA3 GLY 74 -10.994 -7.981 -3.725 562 HA3 GLY 74 HA2 GLY 74 -12.677 -7.990 -4.240 563 H ILE 75 HN ILE 75 -9.396 -7.778 -5.598 564 HA ILE 75 HA ILE 75 -8.433 -8.712 -7.458 565 HB ILE 75 HB ILE 75 -10.666 -10.750 -7.225 566 HG12 ILE 75 HG12 ILE 75 -7.841 -10.876 -6.110 567 HG13 ILE 75 HG11 ILE 75 -9.236 -10.410 -5.143 568 HG21 ILE 75 HG21 ILE 75 -7.984 -10.755 -8.643 569 HG22 ILE 75 HG22 ILE 75 -9.580 -10.909 -9.377 570 HG23 ILE 75 HG23 ILE 75 -8.945 -12.209 -8.372 571 HD11 ILE 75 HD11 ILE 75 -8.729 -13.076 -6.481 572 HD12 ILE 75 HD12 ILE 75 -10.303 -12.626 -5.824 573 HD13 ILE 75 HD13 ILE 75 -8.907 -12.750 -4.758 574 H ILE 76 HN ILE 76 -8.549 -8.577 -9.685 575 HA ILE 76 HA ILE 76 -11.105 -7.564 -10.837 576 HB ILE 76 HB ILE 76 -8.276 -6.952 -11.720 577 HG12 ILE 76 HG12 ILE 76 -8.655 -5.920 -9.546 578 HG13 ILE 76 HG11 ILE 76 -8.716 -4.678 -10.788 579 HG21 ILE 76 HG21 ILE 76 -9.826 -6.772 -13.557 580 HG22 ILE 76 HG22 ILE 76 -9.468 -5.136 -13.011 581 HG23 ILE 76 HG23 ILE 76 -10.991 -5.901 -12.560 582 HD11 ILE 76 HD11 ILE 76 -10.980 -5.856 -9.186 583 HD12 ILE 76 HD12 ILE 76 -11.305 -5.086 -10.739 584 HD13 ILE 76 HD13 ILE 76 -10.562 -4.165 -9.436 585 H ASP 77 HN ASP 77 -11.889 -8.509 -12.606 586 HA ASP 77 HA ASP 77 -10.223 -10.474 -14.080 587 HB2 ASP 77 HB2 ASP 77 -12.111 -12.021 -14.171 588 HB3 ASP 77 HB1 ASP 77 -11.633 -11.717 -12.505 589 H TYR 78 HN TYR 78 -10.450 -10.467 -16.216 590 HA TYR 78 HA TYR 78 -12.690 -9.019 -17.478 591 HB2 TYR 78 HB2 TYR 78 -10.537 -7.553 -17.020 592 HB3 TYR 78 HB1 TYR 78 -9.867 -8.414 -18.399 593 HD1 TYR 78 HD1 TYR 78 -12.627 -6.214 -17.257 594 HD2 TYR 78 HD2 TYR 78 -10.628 -7.920 -20.656 595 HE1 TYR 78 HE1 TYR 78 -13.886 -4.698 -18.753 596 HE2 TYR 78 HE2 TYR 78 -11.890 -6.400 -22.156 597 HH TYR 78 HH TYR 78 -13.693 -5.001 -22.262 598 H GLY 79 HN GLY 79 -12.212 -9.141 -20.032 599 HA2 GLY 79 HA3 GLY 79 -12.023 -12.010 -20.621 600 HA3 GLY 79 HA2 GLY 79 -12.635 -10.751 -21.685 601 H ILE 80 HN ILE 80 -10.934 -9.124 -22.402 602 HA ILE 80 HA ILE 80 -8.207 -9.530 -22.400 603 HB ILE 80 HB ILE 80 -9.555 -11.541 -24.073 604 HG12 ILE 80 HG12 ILE 80 -6.570 -11.142 -23.708 605 HG13 ILE 80 HG11 ILE 80 -7.585 -11.814 -22.445 606 HG21 ILE 80 HG21 ILE 80 -8.110 -11.373 -26.085 607 HG22 ILE 80 HG22 ILE 80 -7.523 -9.811 -25.524 608 HG23 ILE 80 HG23 ILE 80 -9.223 -10.011 -25.966 609 HD11 ILE 80 HD11 ILE 80 -7.642 -13.013 -25.215 610 HD12 ILE 80 HD12 ILE 80 -8.068 -13.753 -23.675 611 HD13 ILE 80 HD13 ILE 80 -6.379 -13.451 -24.070 612 H ARG 81 HN ARG 81 -7.228 -7.845 -23.343 613 HA ARG 81 HA ARG 81 -8.858 -6.063 -25.083 614 HB2 ARG 81 HB2 ARG 81 -6.573 -5.441 -23.192 615 HB3 ARG 81 HB1 ARG 81 -7.415 -4.267 -24.208 616 HG2 ARG 81 HG2 ARG 81 -9.544 -4.820 -23.116 617 HG3 ARG 81 HG1 ARG 81 -8.729 -5.999 -22.090 618 HD2 ARG 81 HD2 ARG 81 -7.327 -4.179 -21.147 619 HD3 ARG 81 HD1 ARG 81 -8.173 -3.017 -22.152 620 HE ARG 81 HE ARG 81 -9.120 -4.141 -19.696 621 HH11 ARG 81 HH21 ARG 81 -10.093 -3.014 -22.816 622 HH12 ARG 81 HH22 ARG 81 -11.690 -2.584 -22.312 623 HH21 ARG 81 HH11 ARG 81 -11.208 -3.568 -19.024 624 HH22 ARG 81 HH12 ARG 81 -12.322 -2.893 -20.163 625 H LEU 82 HN LEU 82 -8.148 -5.595 -27.050 626 HA LEU 82 HA LEU 82 -5.799 -6.957 -28.089 627 HB2 LEU 82 HB2 LEU 82 -7.608 -5.025 -29.561 628 HB3 LEU 82 HB1 LEU 82 -6.573 -6.274 -30.247 629 HG LEU 82 HG LEU 82 -8.991 -6.774 -28.475 630 HD11 LEU 82 HD11 LEU 82 -9.599 -5.959 -30.703 631 HD12 LEU 82 HD12 LEU 82 -10.000 -7.670 -30.545 632 HD13 LEU 82 HD13 LEU 82 -8.565 -7.176 -31.449 633 HD21 LEU 82 HD21 LEU 82 -8.606 -9.177 -29.335 634 HD22 LEU 82 HD22 LEU 82 -7.475 -8.593 -28.120 635 HD23 LEU 82 HD23 LEU 82 -7.000 -8.631 -29.819 636 H ASN 83 HN ASN 83 -6.125 -4.240 -26.366 637 HA ASN 83 HA ASN 83 -4.384 -2.471 -27.889 638 HB2 ASN 83 HB2 ASN 83 -4.634 -0.938 -26.054 639 HB3 ASN 83 HB1 ASN 83 -6.217 -1.582 -26.477 640 HD21 ASN 83 HD21 ASN 83 -6.124 -0.575 -23.966 641 HD22 ASN 83 HD22 ASN 83 -6.019 -1.802 -22.799 642 H ARG 84 HN ARG 84 -3.515 -5.196 -26.881 643 HA ARG 84 HA ARG 84 -1.730 -5.083 -24.770 644 HB2 ARG 84 HB2 ARG 84 -1.534 -6.608 -27.385 645 HB3 ARG 84 HB1 ARG 84 -0.401 -6.840 -26.053 646 HG2 ARG 84 HG2 ARG 84 -2.277 -7.397 -24.555 647 HG3 ARG 84 HG1 ARG 84 -3.404 -7.219 -25.897 648 HD2 ARG 84 HD2 ARG 84 -1.066 -9.149 -25.913 649 HD3 ARG 84 HD1 ARG 84 -2.682 -9.606 -25.397 650 HE ARG 84 HE ARG 84 -1.777 -9.246 -28.109 651 HH11 ARG 84 HH21 ARG 84 -4.506 -8.881 -26.016 652 HH12 ARG 84 HH22 ARG 84 -5.667 -9.344 -27.216 653 HH21 ARG 84 HH11 ARG 84 -3.293 -9.882 -29.681 654 HH22 ARG 84 HH12 ARG 84 -4.978 -9.913 -29.287 655 H SER 85 HN SER 85 -1.262 -3.884 -28.061 656 HA SER 85 HA SER 85 1.445 -3.413 -28.151 657 HB2 SER 85 HB2 SER 85 -0.814 -1.655 -29.119 658 HB3 SER 85 HB1 SER 85 0.874 -1.436 -29.575 659 HG SER 85 HG SER 85 0.783 -3.669 -30.301 660 H GLU 86 HN GLU 86 -0.972 -1.731 -26.261 661 HA GLU 86 HA GLU 86 0.521 0.562 -25.558 662 HB2 GLU 86 HB2 GLU 86 -1.693 -0.909 -24.111 663 HB3 GLU 86 HB1 GLU 86 -1.036 0.630 -23.571 664 HG2 GLU 86 HG2 GLU 86 -1.660 1.665 -25.712 665 HG3 GLU 86 HG1 GLU 86 -2.298 0.122 -26.275 666 H ARG 87 HN ARG 87 1.776 1.018 -23.757 667 HA ARG 87 HA ARG 87 3.178 -1.293 -22.584 668 HB2 ARG 87 HB2 ARG 87 3.766 1.681 -22.477 669 HB3 ARG 87 HB1 ARG 87 4.765 0.417 -21.760 670 HG2 ARG 87 HG2 ARG 87 5.122 -0.592 -23.979 671 HG3 ARG 87 HG1 ARG 87 4.091 0.634 -24.714 672 HD2 ARG 87 HD2 ARG 87 5.648 2.389 -23.913 673 HD3 ARG 87 HD1 ARG 87 6.679 1.137 -23.245 674 HE ARG 87 HE ARG 87 7.474 0.698 -25.357 675 HH11 ARG 87 HH21 ARG 87 4.533 2.492 -25.520 676 HH12 ARG 87 HH22 ARG 87 4.668 2.851 -27.205 677 HH21 ARG 87 HH11 ARG 87 7.689 1.164 -27.587 678 HH22 ARG 87 HH12 ARG 87 6.463 2.090 -28.388 679 H TRP 88 HN TRP 88 2.976 -1.914 -20.533 680 HA TRP 88 HA TRP 88 1.877 -0.144 -18.463 681 HB2 TRP 88 HB2 TRP 88 0.486 -2.663 -19.391 682 HB3 TRP 88 HB1 TRP 88 0.200 -1.960 -17.810 683 HD1 TRP 88 HD1 TRP 88 -0.175 -1.073 -21.557 684 HE1 TRP 88 HE1 TRP 88 -2.028 0.702 -21.767 685 HE3 TRP 88 HE3 TRP 88 -1.154 -0.242 -16.624 686 HZ2 TRP 88 HZ2 TRP 88 -3.714 2.268 -20.062 687 HZ3 TRP 88 HZ3 TRP 88 -2.890 1.389 -15.940 688 HH2 TRP 88 HH2 TRP 88 -4.172 2.645 -17.652 689 H ASP 89 HN ASP 89 1.705 -1.485 -16.347 690 HA ASP 89 HA ASP 89 4.291 -2.419 -15.702 691 HB2 ASP 89 HB2 ASP 89 1.703 -2.845 -14.198 692 HB3 ASP 89 HB1 ASP 89 3.325 -3.028 -13.539 693 H ALA 90 HN ALA 90 4.043 -4.645 -14.187 694 HA ALA 90 HA ALA 90 2.688 -6.806 -15.477 695 HB1 ALA 90 HB1 ALA 90 4.364 -6.483 -17.207 696 HB2 ALA 90 HB2 ALA 90 4.708 -7.976 -16.332 697 HB3 ALA 90 HB3 ALA 90 5.656 -6.525 -16.005 698 H TYR 91 HN TYR 91 3.185 -8.877 -14.517 699 HA TYR 91 HA TYR 91 4.546 -8.715 -11.866 700 HB2 TYR 91 HB2 TYR 91 1.939 -10.088 -12.574 701 HB3 TYR 91 HB1 TYR 91 2.801 -10.314 -11.053 702 HD1 TYR 91 HD2 TYR 91 3.090 -8.411 -9.468 703 HD2 TYR 91 HD1 TYR 91 0.673 -8.058 -13.006 704 HE1 TYR 91 HE2 TYR 91 2.008 -6.390 -8.528 705 HE2 TYR 91 HE1 TYR 91 -0.409 -6.038 -12.061 706 HH TYR 91 HH TYR 91 -0.808 -4.986 -9.950 707 H CYS 92 HN CYS 92 5.371 -10.709 -11.079 708 HA CYS 92 HA CYS 92 5.571 -12.979 -12.934 709 HB2 CYS 92 HB2 CYS 92 7.788 -11.086 -12.372 710 HB3 CYS 92 HB1 CYS 92 8.227 -12.775 -12.171 711 H TYR 93 HN TYR 93 5.859 -14.888 -11.932 712 HA TYR 93 HA TYR 93 6.344 -14.934 -9.006 713 HB2 TYR 93 HB2 TYR 93 3.940 -15.053 -9.349 714 HB3 TYR 93 HB1 TYR 93 4.134 -16.341 -10.535 715 HD1 TYR 93 HD1 TYR 93 4.797 -15.461 -6.956 716 HD2 TYR 93 HD2 TYR 93 4.192 -18.620 -9.809 717 HE1 TYR 93 HE1 TYR 93 4.707 -17.118 -5.111 718 HE2 TYR 93 HE2 TYR 93 4.100 -20.264 -7.964 719 HH TYR 93 HH TYR 93 3.581 -20.281 -5.538 720 H ASN 94 HN ASN 94 8.125 -16.049 -8.732 721 HA ASN 94 HA ASN 94 8.822 -18.239 -10.587 722 HB2 ASN 94 HB2 ASN 94 10.450 -16.398 -10.161 723 HB3 ASN 94 HB1 ASN 94 10.561 -16.941 -8.488 724 HD21 ASN 94 HD21 ASN 94 10.640 -18.499 -11.758 725 HD22 ASN 94 HD22 ASN 94 11.966 -19.498 -11.401 726 HA PRO 95 HA PRO 95 7.623 -20.704 -6.920 727 HB2 PRO 95 HB2 PRO 95 7.106 -23.073 -8.145 728 HB3 PRO 95 HB1 PRO 95 5.981 -21.705 -8.248 729 HG2 PRO 95 HG2 PRO 95 7.998 -22.639 -10.255 730 HG3 PRO 95 HG1 PRO 95 6.328 -22.099 -10.514 731 HD2 PRO 95 HD2 PRO 95 8.540 -20.481 -10.906 732 HD3 PRO 95 HD1 PRO 95 6.926 -19.840 -10.508 733 H HIS 96 HN HIS 96 10.250 -21.013 -9.074 734 HA HIS 96 HA HIS 96 11.519 -23.231 -7.606 735 HB2 HIS 96 HB2 HIS 96 11.594 -23.227 -10.072 736 HB3 HIS 96 HB1 HIS 96 12.461 -21.692 -10.040 737 HD1 HIS 96 HD1 HIS 96 12.863 -25.137 -8.429 738 HD2 HIS 96 HD2 HIS 96 15.186 -22.072 -10.038 739 HE1 HIS 96 HE1 HIS 96 15.271 -25.909 -8.281 740 HE2 HIS 96 HE2 HIS 96 16.700 -24.050 -9.258 741 H ALA 97 HN ALA 97 11.120 -20.936 -6.079 742 HA ALA 97 HA ALA 97 13.836 -20.398 -5.230 743 HB1 ALA 97 HB1 ALA 97 12.126 -18.042 -6.088 744 HB2 ALA 97 HB2 ALA 97 13.452 -18.694 -7.054 745 HB3 ALA 97 HB3 ALA 97 13.777 -17.994 -5.468 746 H LYS 98 HN LYS 98 10.582 -18.999 -5.020 747 HA LYS 98 HA LYS 98 10.751 -19.113 -2.043 748 HB2 LYS 98 HB2 LYS 98 8.865 -17.725 -3.964 749 HB3 LYS 98 HB1 LYS 98 8.602 -17.789 -2.222 750 HG2 LYS 98 HG2 LYS 98 10.771 -16.692 -1.847 751 HG3 LYS 98 HG1 LYS 98 11.050 -16.638 -3.589 752 HD2 LYS 98 HD2 LYS 98 8.944 -15.306 -3.839 753 HD3 LYS 98 HD1 LYS 98 8.801 -15.279 -2.080 754 HE2 LYS 98 HE2 LYS 98 11.211 -14.243 -3.589 755 HE3 LYS 98 HE1 LYS 98 9.877 -13.226 -3.047 756 HZ1 LYS 98 HZ1 LYS 98 10.602 -14.742 -0.866 757 HZ2 LYS 98 HZ2 LYS 98 10.903 -13.089 -1.105 758 HZ3 LYS 98 HZ3 LYS 98 12.066 -14.241 -1.557 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 8.022 -15.013 -2.550 2 H2 GLY 1 H2 GLY 1 8.552 -16.317 -3.501 3 H3 GLY 1 H3 GLY 1 7.864 -16.600 -1.974 4 HA2 GLY 1 HA3 GLY 1 6.391 -17.043 -3.947 5 HA3 GLY 1 HA2 GLY 1 5.724 -16.010 -2.684 6 H VAL 2 HN VAL 2 4.414 -14.704 -3.863 7 HA VAL 2 HA VAL 2 5.306 -13.501 -6.357 8 HB VAL 2 HB VAL 2 2.972 -14.246 -6.077 9 HG11 VAL 2 HG11 VAL 2 2.831 -13.666 -3.633 10 HG12 VAL 2 HG12 VAL 2 1.460 -13.092 -4.583 11 HG13 VAL 2 HG13 VAL 2 2.724 -11.966 -4.093 12 HG21 VAL 2 HG21 VAL 2 3.149 -11.226 -6.320 13 HG22 VAL 2 HG22 VAL 2 1.937 -12.283 -7.043 14 HG23 VAL 2 HG23 VAL 2 3.607 -12.341 -7.607 15 H TYR 3 HN TYR 3 5.552 -11.308 -6.743 16 HA TYR 3 HA TYR 3 5.465 -9.388 -4.579 17 HB2 TYR 3 HB2 TYR 3 7.840 -8.805 -4.641 18 HB3 TYR 3 HB1 TYR 3 7.613 -10.468 -4.107 19 HD1 TYR 3 HD2 TYR 3 8.105 -12.372 -5.642 20 HD2 TYR 3 HD1 TYR 3 8.951 -8.304 -6.744 21 HE1 TYR 3 HE2 TYR 3 9.611 -13.170 -7.439 22 HE2 TYR 3 HE1 TYR 3 10.458 -9.109 -8.539 23 HH TYR 3 HH TYR 3 11.417 -12.426 -8.785 24 H HIS 4 HN HIS 4 5.790 -7.247 -5.265 25 HA HIS 4 HA HIS 4 5.012 -6.844 -8.046 26 HB2 HIS 4 HB2 HIS 4 4.746 -4.482 -7.405 27 HB3 HIS 4 HB1 HIS 4 3.868 -5.558 -6.326 28 HD1 HIS 4 HD1 HIS 4 5.273 -6.177 -4.025 29 HD2 HIS 4 HD2 HIS 4 6.395 -2.723 -6.074 30 HE1 HIS 4 HE1 HIS 4 6.564 -4.752 -2.375 31 HE2 HIS 4 HE2 HIS 4 7.254 -2.644 -3.609 32 H ARG 5 HN ARG 5 6.163 -5.832 -9.619 33 HA ARG 5 HA ARG 5 8.890 -4.847 -9.058 34 HB2 ARG 5 HB2 ARG 5 9.101 -7.292 -9.572 35 HB3 ARG 5 HB1 ARG 5 8.354 -6.988 -11.136 36 HG2 ARG 5 HG2 ARG 5 10.161 -5.471 -11.758 37 HG3 ARG 5 HG1 ARG 5 10.885 -5.632 -10.160 38 HD2 ARG 5 HD2 ARG 5 12.111 -7.100 -11.627 39 HD3 ARG 5 HD1 ARG 5 11.097 -8.115 -10.614 40 HE ARG 5 HE ARG 5 9.762 -8.631 -12.470 41 HH11 ARG 5 HH21 ARG 5 12.208 -6.296 -13.225 42 HH12 ARG 5 HH22 ARG 5 11.828 -6.262 -14.911 43 HH21 ARG 5 HH11 ARG 5 9.240 -8.528 -14.657 44 HH22 ARG 5 HH12 ARG 5 10.162 -7.511 -15.710 45 H GLU 6 HN GLU 6 9.391 -3.143 -10.285 46 HA GLU 6 HA GLU 6 7.831 -2.580 -12.748 47 HB2 GLU 6 HB2 GLU 6 6.912 -1.304 -10.785 48 HB3 GLU 6 HB1 GLU 6 8.485 -0.529 -10.611 49 HG2 GLU 6 HG2 GLU 6 8.301 0.484 -12.805 50 HG3 GLU 6 HG1 GLU 6 6.838 -0.432 -13.159 51 H ALA 7 HN ALA 7 8.865 -1.007 -14.141 52 HA ALA 7 HA ALA 7 11.500 -1.633 -14.762 53 HB1 ALA 7 HB1 ALA 7 9.837 -0.497 -16.266 54 HB2 ALA 7 HB2 ALA 7 11.445 0.224 -16.292 55 HB3 ALA 7 HB3 ALA 7 10.145 1.001 -15.387 56 H ARG 8 HN ARG 8 13.437 -0.957 -14.120 57 HA ARG 8 HA ARG 8 13.691 0.652 -11.747 58 HB2 ARG 8 HB2 ARG 8 15.813 -0.460 -13.607 59 HB3 ARG 8 HB1 ARG 8 16.111 0.225 -12.013 60 HG2 ARG 8 HG2 ARG 8 14.241 -2.138 -12.396 61 HG3 ARG 8 HG1 ARG 8 15.974 -2.360 -12.179 62 HD2 ARG 8 HD2 ARG 8 15.864 -1.140 -10.046 63 HD3 ARG 8 HD1 ARG 8 14.138 -0.927 -10.231 64 HE ARG 8 HE ARG 8 15.520 -3.326 -9.379 65 HH11 ARG 8 HH21 ARG 8 12.677 -2.115 -10.929 66 HH12 ARG 8 HH22 ARG 8 11.623 -3.298 -10.232 67 HH21 ARG 8 HH11 ARG 8 14.117 -4.846 -8.400 68 HH22 ARG 8 HH12 ARG 8 12.431 -4.832 -8.798 69 H SER 9 HN SER 9 14.368 1.069 -15.167 70 HA SER 9 HA SER 9 15.061 3.927 -14.690 71 HB2 SER 9 HB2 SER 9 15.763 2.294 -17.137 72 HB3 SER 9 HB1 SER 9 16.443 3.839 -16.621 73 HG SER 9 HG SER 9 17.229 1.369 -15.992 74 H GLY 10 HN GLY 10 13.040 1.680 -16.479 75 HA2 GLY 10 HA3 GLY 10 11.940 3.711 -18.232 76 HA3 GLY 10 HA2 GLY 10 11.432 2.032 -18.104 77 H LYS 11 HN LYS 11 9.336 3.238 -18.309 78 HA LYS 11 HA LYS 11 8.022 3.228 -15.768 79 HB2 LYS 11 HB2 LYS 11 9.056 5.477 -15.683 80 HB3 LYS 11 HB1 LYS 11 8.236 5.897 -17.187 81 HG2 LYS 11 HG2 LYS 11 6.058 5.605 -16.140 82 HG3 LYS 11 HG1 LYS 11 6.813 5.020 -14.654 83 HD2 LYS 11 HD2 LYS 11 7.923 7.205 -14.369 84 HD3 LYS 11 HD1 LYS 11 7.162 7.783 -15.852 85 HE2 LYS 11 HE2 LYS 11 5.846 8.553 -13.957 86 HE3 LYS 11 HE1 LYS 11 4.924 7.323 -14.821 87 HZ1 LYS 11 HZ1 LYS 11 6.584 6.117 -12.875 88 HZ2 LYS 11 HZ2 LYS 11 4.891 6.065 -13.018 89 HZ3 LYS 11 HZ3 LYS 11 5.635 7.320 -12.149 90 H TYR 12 HN TYR 12 6.551 1.849 -16.593 91 HA TYR 12 HA TYR 12 4.756 1.072 -17.787 92 HB2 TYR 12 HB2 TYR 12 4.314 4.067 -17.880 93 HB3 TYR 12 HB1 TYR 12 3.185 2.956 -18.640 94 HD1 TYR 12 HD1 TYR 12 4.900 3.664 -15.390 95 HD2 TYR 12 HD2 TYR 12 1.476 1.934 -17.328 96 HE1 TYR 12 HE1 TYR 12 3.824 3.321 -13.187 97 HE2 TYR 12 HE2 TYR 12 0.408 1.589 -15.121 98 HH TYR 12 HH TYR 12 0.750 1.593 -12.890 99 H LYS 13 HN LYS 13 6.801 0.609 -19.274 100 HA LYS 13 HA LYS 13 5.983 1.386 -21.989 101 HB2 LYS 13 HB2 LYS 13 8.766 1.729 -20.851 102 HB3 LYS 13 HB1 LYS 13 8.450 1.654 -22.587 103 HG2 LYS 13 HG2 LYS 13 6.891 3.568 -22.386 104 HG3 LYS 13 HG1 LYS 13 7.229 3.658 -20.659 105 HD2 LYS 13 HD2 LYS 13 9.575 4.130 -21.101 106 HD3 LYS 13 HD1 LYS 13 9.312 3.930 -22.833 107 HE2 LYS 13 HE2 LYS 13 9.307 6.313 -22.293 108 HE3 LYS 13 HE1 LYS 13 7.682 5.818 -22.767 109 HZ1 LYS 13 HZ1 LYS 13 7.044 5.681 -20.477 110 HZ2 LYS 13 HZ2 LYS 13 7.732 7.210 -20.751 111 HZ3 LYS 13 HZ3 LYS 13 8.627 6.002 -19.958 112 H LEU 14 HN LEU 14 5.443 -1.017 -20.713 113 HA LEU 14 HA LEU 14 7.192 -2.925 -22.200 114 HB2 LEU 14 HB2 LEU 14 5.843 -3.556 -19.569 115 HB3 LEU 14 HB1 LEU 14 7.002 -4.541 -20.444 116 HG LEU 14 HG LEU 14 7.653 -1.799 -19.317 117 HD11 LEU 14 HD11 LEU 14 8.837 -3.038 -17.525 118 HD12 LEU 14 HD12 LEU 14 8.212 -4.556 -18.173 119 HD13 LEU 14 HD13 LEU 14 7.103 -3.361 -17.498 120 HD21 LEU 14 HD21 LEU 14 9.182 -2.424 -21.100 121 HD22 LEU 14 HD22 LEU 14 9.340 -4.056 -20.461 122 HD23 LEU 14 HD23 LEU 14 10.019 -2.690 -19.579 123 H THR 15 HN THR 15 6.221 -4.418 -23.414 124 HA THR 15 HA THR 15 3.257 -4.333 -23.601 125 HB THR 15 HB THR 15 3.557 -5.387 -25.794 126 HG1 THR 15 HG1 THR 15 5.349 -6.474 -25.906 127 HG21 THR 15 HG21 THR 15 5.267 -2.930 -25.339 128 HG22 THR 15 HG22 THR 15 3.533 -2.949 -25.660 129 HG23 THR 15 HG23 THR 15 4.666 -3.468 -26.908 130 H TYR 16 HN TYR 16 2.198 -6.409 -24.168 131 HA TYR 16 HA TYR 16 2.477 -8.300 -22.162 132 HB2 TYR 16 HB2 TYR 16 1.129 -9.810 -23.619 133 HB3 TYR 16 HB1 TYR 16 0.458 -8.187 -23.495 134 HD1 TYR 16 HD2 TYR 16 0.803 -6.540 -25.354 135 HD2 TYR 16 HD1 TYR 16 1.889 -10.678 -25.750 136 HE1 TYR 16 HE2 TYR 16 0.896 -6.287 -27.824 137 HE2 TYR 16 HE1 TYR 16 1.973 -10.423 -28.216 138 HH TYR 16 HH TYR 16 2.074 -8.867 -29.901 139 H ALA 17 HN ALA 17 3.492 -8.771 -25.557 140 HA ALA 17 HA ALA 17 4.872 -11.170 -25.155 141 HB1 ALA 17 HB1 ALA 17 5.365 -8.975 -27.180 142 HB2 ALA 17 HB2 ALA 17 4.358 -10.406 -27.391 143 HB3 ALA 17 HB3 ALA 17 6.106 -10.574 -27.247 144 H GLU 18 HN GLU 18 5.944 -7.826 -24.741 145 HA GLU 18 HA GLU 18 8.704 -8.440 -24.385 146 HB2 GLU 18 HB2 GLU 18 7.826 -6.171 -24.927 147 HB3 GLU 18 HB1 GLU 18 7.149 -6.080 -23.301 148 HG2 GLU 18 HG2 GLU 18 9.347 -6.249 -22.307 149 HG3 GLU 18 HG1 GLU 18 10.083 -6.554 -23.877 150 H ALA 19 HN ALA 19 6.065 -7.839 -22.059 151 HA ALA 19 HA ALA 19 7.434 -8.053 -19.673 152 HB1 ALA 19 HB1 ALA 19 5.300 -8.913 -18.710 153 HB2 ALA 19 HB2 ALA 19 4.675 -9.091 -20.349 154 HB3 ALA 19 HB3 ALA 19 5.079 -7.491 -19.729 155 H LYS 20 HN LYS 20 6.551 -10.623 -21.894 156 HA LYS 20 HA LYS 20 7.008 -12.837 -20.166 157 HB2 LYS 20 HB2 LYS 20 7.116 -12.615 -23.181 158 HB3 LYS 20 HB1 LYS 20 7.326 -14.125 -22.312 159 HG2 LYS 20 HG2 LYS 20 5.116 -13.941 -21.333 160 HG3 LYS 20 HG1 LYS 20 4.899 -12.336 -22.029 161 HD2 LYS 20 HD2 LYS 20 3.706 -13.840 -23.467 162 HD3 LYS 20 HD1 LYS 20 5.183 -13.420 -24.328 163 HE2 LYS 20 HE2 LYS 20 6.198 -15.533 -23.786 164 HE3 LYS 20 HE1 LYS 20 4.935 -15.916 -22.618 165 HZ1 LYS 20 HZ1 LYS 20 3.963 -15.331 -25.264 166 HZ2 LYS 20 HZ2 LYS 20 3.569 -16.610 -24.218 167 HZ3 LYS 20 HZ3 LYS 20 4.961 -16.700 -25.191 168 H ALA 21 HN ALA 21 9.125 -10.712 -21.924 169 HA ALA 21 HA ALA 21 11.399 -12.418 -22.044 170 HB1 ALA 21 HB1 ALA 21 11.113 -10.338 -23.386 171 HB2 ALA 21 HB2 ALA 21 12.654 -10.406 -22.533 172 HB3 ALA 21 HB3 ALA 21 11.348 -9.396 -21.914 173 H VAL 22 HN VAL 22 10.597 -9.766 -19.779 174 HA VAL 22 HA VAL 22 12.826 -10.186 -18.079 175 HB VAL 22 HB VAL 22 11.442 -8.877 -16.405 176 HG11 VAL 22 HG11 VAL 22 11.446 -6.799 -17.764 177 HG12 VAL 22 HG12 VAL 22 11.706 -7.771 -19.214 178 HG13 VAL 22 HG13 VAL 22 12.937 -7.724 -17.950 179 HG21 VAL 22 HG21 VAL 22 9.480 -8.820 -18.718 180 HG22 VAL 22 HG22 VAL 22 9.318 -7.930 -17.211 181 HG23 VAL 22 HG23 VAL 22 9.226 -9.687 -17.206 182 H CYS 23 HN CYS 23 9.606 -11.595 -18.153 183 HA CYS 23 HA CYS 23 10.202 -13.173 -15.695 184 HB2 CYS 23 HB2 CYS 23 7.572 -12.982 -17.190 185 HB3 CYS 23 HB1 CYS 23 7.854 -13.723 -15.622 186 H GLU 24 HN GLU 24 9.151 -15.443 -15.857 187 HA GLU 24 HA GLU 24 9.208 -17.564 -16.758 188 HB2 GLU 24 HB2 GLU 24 7.784 -16.434 -18.544 189 HB3 GLU 24 HB1 GLU 24 9.260 -16.264 -19.489 190 HG2 GLU 24 HG2 GLU 24 9.604 -18.686 -19.436 191 HG3 GLU 24 HG1 GLU 24 8.150 -18.880 -18.461 192 H PHE 25 HN PHE 25 11.540 -15.217 -17.835 193 HA PHE 25 HA PHE 25 13.411 -16.903 -19.091 194 HB2 PHE 25 HB2 PHE 25 13.459 -14.443 -19.200 195 HB3 PHE 25 HB1 PHE 25 13.866 -14.373 -17.489 196 HD1 PHE 25 HD1 PHE 25 15.037 -15.655 -20.794 197 HD2 PHE 25 HD2 PHE 25 16.147 -14.590 -16.779 198 HE1 PHE 25 HE1 PHE 25 17.435 -15.874 -21.394 199 HE2 PHE 25 HE2 PHE 25 18.540 -14.815 -17.382 200 HZ PHE 25 HZ PHE 25 19.185 -15.454 -19.689 201 H GLU 26 HN GLU 26 13.152 -15.853 -15.698 202 HA GLU 26 HA GLU 26 15.260 -17.757 -14.910 203 HB2 GLU 26 HB2 GLU 26 15.170 -16.693 -12.731 204 HB3 GLU 26 HB1 GLU 26 15.327 -15.468 -13.986 205 HG2 GLU 26 HG2 GLU 26 12.863 -15.095 -13.882 206 HG3 GLU 26 HG1 GLU 26 12.769 -16.246 -12.552 207 H GLY 27 HN GLY 27 12.485 -18.534 -15.822 208 HA2 GLY 27 HA3 GLY 27 11.256 -20.448 -15.321 209 HA3 GLY 27 HA2 GLY 27 12.018 -20.520 -13.737 210 H GLY 28 HN GLY 28 11.094 -17.421 -13.948 211 HA2 GLY 28 HA3 GLY 28 8.886 -17.738 -12.166 212 HA3 GLY 28 HA2 GLY 28 9.455 -16.221 -12.850 213 H HIS 29 HN HIS 29 7.199 -15.662 -13.046 214 HA HIS 29 HA HIS 29 6.181 -16.086 -15.667 215 HB2 HIS 29 HB2 HIS 29 5.569 -18.284 -14.648 216 HB3 HIS 29 HB1 HIS 29 4.615 -17.422 -13.452 217 HD1 HIS 29 HD1 HIS 29 2.215 -17.560 -14.079 218 HD2 HIS 29 HD2 HIS 29 4.647 -17.096 -17.433 219 HE1 HIS 29 HE1 HIS 29 0.665 -17.450 -16.079 220 HE2 HIS 29 HE2 HIS 29 2.131 -17.167 -18.131 221 H LEU 30 HN LEU 30 4.119 -14.947 -16.010 222 HA LEU 30 HA LEU 30 4.034 -12.443 -14.658 223 HB2 LEU 30 HB2 LEU 30 1.872 -13.688 -16.382 224 HB3 LEU 30 HB1 LEU 30 2.079 -11.976 -16.024 225 HG LEU 30 HG LEU 30 4.087 -13.681 -17.535 226 HD11 LEU 30 HD11 LEU 30 3.292 -12.440 -19.521 227 HD12 LEU 30 HD12 LEU 30 2.086 -11.624 -18.528 228 HD13 LEU 30 HD13 LEU 30 1.984 -13.365 -18.786 229 HD21 LEU 30 HD21 LEU 30 4.929 -11.313 -18.180 230 HD22 LEU 30 HD22 LEU 30 5.280 -11.857 -16.544 231 HD23 LEU 30 HD23 LEU 30 3.955 -10.727 -16.829 232 H ALA 31 HN ALA 31 2.556 -11.618 -13.196 233 HA ALA 31 HA ALA 31 1.535 -13.387 -11.243 234 HB1 ALA 31 HB1 ALA 31 0.707 -11.444 -10.145 235 HB2 ALA 31 HB2 ALA 31 0.642 -10.527 -11.649 236 HB3 ALA 31 HB3 ALA 31 2.200 -10.948 -10.939 237 H THR 32 HN THR 32 0.281 -14.850 -12.524 238 HA THR 32 HA THR 32 -2.000 -14.118 -14.018 239 HB THR 32 HB THR 32 -1.585 -16.714 -12.518 240 HG1 THR 32 HG1 THR 32 -0.643 -17.332 -14.574 241 HG21 THR 32 HG21 THR 32 -2.877 -17.616 -14.480 242 HG22 THR 32 HG22 THR 32 -3.173 -15.953 -14.987 243 HG23 THR 32 HG23 THR 32 -3.810 -16.534 -13.447 244 H TYR 33 HN TYR 33 -4.216 -14.250 -13.496 245 HA TYR 33 HA TYR 33 -5.036 -13.042 -11.116 246 HB2 TYR 33 HB2 TYR 33 -6.410 -12.935 -13.084 247 HB3 TYR 33 HB1 TYR 33 -6.549 -14.686 -13.147 248 HD1 TYR 33 HD2 TYR 33 -7.913 -15.909 -11.486 249 HD2 TYR 33 HD1 TYR 33 -7.783 -11.613 -11.538 250 HE1 TYR 33 HE2 TYR 33 -9.941 -15.831 -10.068 251 HE2 TYR 33 HE1 TYR 33 -9.821 -11.544 -10.120 252 HH TYR 33 HH TYR 33 -11.145 -12.809 -8.738 253 H LYS 34 HN LYS 34 -5.360 -16.450 -12.105 254 HA LYS 34 HA LYS 34 -6.559 -17.493 -9.844 255 HB2 LYS 34 HB2 LYS 34 -6.086 -18.751 -11.954 256 HB3 LYS 34 HB1 LYS 34 -4.390 -18.817 -11.501 257 HG2 LYS 34 HG2 LYS 34 -5.329 -20.925 -10.868 258 HG3 LYS 34 HG1 LYS 34 -5.115 -20.033 -9.369 259 HD2 LYS 34 HD2 LYS 34 -7.464 -19.522 -9.234 260 HD3 LYS 34 HD1 LYS 34 -7.745 -20.070 -10.884 261 HE2 LYS 34 HE2 LYS 34 -6.765 -21.870 -8.652 262 HE3 LYS 34 HE1 LYS 34 -8.459 -21.710 -9.109 263 HZ1 LYS 34 HZ1 LYS 34 -8.047 -23.289 -10.595 264 HZ2 LYS 34 HZ2 LYS 34 -6.365 -23.173 -10.387 265 HZ3 LYS 34 HZ3 LYS 34 -7.162 -22.135 -11.470 266 H GLN 35 HN GLN 35 -3.060 -17.159 -10.446 267 HA GLN 35 HA GLN 35 -2.258 -18.150 -7.912 268 HB2 GLN 35 HB2 GLN 35 -0.781 -17.998 -9.926 269 HB3 GLN 35 HB1 GLN 35 -0.731 -16.250 -9.712 270 HG2 GLN 35 HG2 GLN 35 0.061 -18.139 -7.467 271 HG3 GLN 35 HG1 GLN 35 1.211 -17.632 -8.692 272 HE21 GLN 35 HE21 GLN 35 1.215 -15.079 -9.010 273 HE22 GLN 35 HE22 GLN 35 1.179 -14.178 -7.573 274 H LEU 36 HN LEU 36 -2.900 -14.893 -9.135 275 HA LEU 36 HA LEU 36 -2.025 -13.459 -6.870 276 HB2 LEU 36 HB2 LEU 36 -3.883 -12.943 -9.149 277 HB3 LEU 36 HB1 LEU 36 -3.865 -11.776 -7.864 278 HG LEU 36 HG LEU 36 -1.315 -12.655 -9.248 279 HD11 LEU 36 HD11 LEU 36 -2.837 -11.767 -10.953 280 HD12 LEU 36 HD12 LEU 36 -1.539 -10.612 -10.641 281 HD13 LEU 36 HD13 LEU 36 -3.144 -10.345 -9.964 282 HD21 LEU 36 HD21 LEU 36 -0.937 -11.455 -7.146 283 HD22 LEU 36 HD22 LEU 36 -2.095 -10.213 -7.606 284 HD23 LEU 36 HD23 LEU 36 -0.571 -10.357 -8.470 285 H GLU 37 HN GLU 37 -5.161 -14.903 -7.697 286 HA GLU 37 HA GLU 37 -6.612 -13.836 -5.527 287 HB2 GLU 37 HB2 GLU 37 -7.604 -14.887 -7.571 288 HB3 GLU 37 HB1 GLU 37 -7.096 -16.456 -6.955 289 HG2 GLU 37 HG2 GLU 37 -9.401 -16.154 -6.329 290 HG3 GLU 37 HG1 GLU 37 -8.448 -15.974 -4.863 291 H ALA 38 HN ALA 38 -4.539 -16.654 -5.842 292 HA ALA 38 HA ALA 38 -5.282 -17.844 -3.335 293 HB1 ALA 38 HB1 ALA 38 -3.229 -19.221 -3.690 294 HB2 ALA 38 HB2 ALA 38 -2.867 -18.249 -5.117 295 HB3 ALA 38 HB3 ALA 38 -4.329 -19.236 -5.068 296 H ALA 39 HN ALA 39 -2.952 -15.446 -4.357 297 HA ALA 39 HA ALA 39 -1.544 -15.473 -1.790 298 HB1 ALA 39 HB1 ALA 39 -0.198 -13.661 -2.788 299 HB2 ALA 39 HB2 ALA 39 -1.221 -13.706 -4.225 300 HB3 ALA 39 HB3 ALA 39 -0.232 -15.103 -3.802 301 H ARG 40 HN ARG 40 -3.981 -13.582 -3.468 302 HA ARG 40 HA ARG 40 -3.893 -11.222 -1.995 303 HB2 ARG 40 HB2 ARG 40 -5.905 -12.593 -3.646 304 HB3 ARG 40 HB1 ARG 40 -6.665 -11.640 -2.386 305 HG2 ARG 40 HG2 ARG 40 -4.548 -10.493 -4.230 306 HG3 ARG 40 HG1 ARG 40 -6.264 -10.454 -4.627 307 HD2 ARG 40 HD2 ARG 40 -5.074 -9.295 -2.087 308 HD3 ARG 40 HD1 ARG 40 -5.434 -8.356 -3.514 309 HE ARG 40 HE ARG 40 -7.340 -9.356 -1.563 310 HH11 ARG 40 HH21 ARG 40 -6.910 -8.340 -4.824 311 HH12 ARG 40 HH22 ARG 40 -8.497 -7.661 -4.946 312 HH21 ARG 40 HH11 ARG 40 -9.359 -8.362 -1.684 313 HH22 ARG 40 HH12 ARG 40 -9.857 -7.632 -3.171 314 H LYS 41 HN LYS 41 -4.760 -14.367 -0.937 315 HA LYS 41 HA LYS 41 -6.403 -13.544 1.297 316 HB2 LYS 41 HB2 LYS 41 -6.393 -15.856 1.950 317 HB3 LYS 41 HB1 LYS 41 -6.590 -15.774 0.205 318 HG2 LYS 41 HG2 LYS 41 -4.880 -17.313 0.137 319 HG3 LYS 41 HG1 LYS 41 -3.824 -15.928 0.403 320 HD2 LYS 41 HD2 LYS 41 -4.006 -16.359 2.876 321 HD3 LYS 41 HD1 LYS 41 -4.945 -17.804 2.515 322 HE2 LYS 41 HE2 LYS 41 -2.119 -17.259 1.555 323 HE3 LYS 41 HE1 LYS 41 -2.563 -18.360 2.858 324 HZ1 LYS 41 HZ1 LYS 41 -2.324 -19.668 0.934 325 HZ2 LYS 41 HZ2 LYS 41 -3.222 -18.589 -0.022 326 HZ3 LYS 41 HZ3 LYS 41 -3.996 -19.518 1.171 327 H ILE 42 HN ILE 42 -3.165 -13.198 0.696 328 HA ILE 42 HA ILE 42 -2.336 -13.572 3.522 329 HB ILE 42 HB ILE 42 -1.019 -14.503 1.421 330 HG12 ILE 42 HG12 ILE 42 0.348 -13.035 3.708 331 HG13 ILE 42 HG11 ILE 42 -0.238 -14.697 3.744 332 HG21 ILE 42 HG21 ILE 42 0.420 -11.843 1.585 333 HG22 ILE 42 HG22 ILE 42 -0.937 -12.017 0.488 334 HG23 ILE 42 HG23 ILE 42 0.470 -13.055 0.305 335 HD11 ILE 42 HD11 ILE 42 2.027 -13.583 2.066 336 HD12 ILE 42 HD12 ILE 42 1.330 -15.180 1.805 337 HD13 ILE 42 HD13 ILE 42 2.127 -14.805 3.330 338 H GLY 43 HN GLY 43 -3.876 -11.254 2.064 339 HA2 GLY 43 HA3 GLY 43 -4.141 -9.030 2.665 340 HA3 GLY 43 HA2 GLY 43 -2.681 -9.130 3.642 341 H PHE 44 HN PHE 44 -2.424 -10.238 0.382 342 HA PHE 44 HA PHE 44 -0.338 -8.540 -0.308 343 HB2 PHE 44 HB2 PHE 44 -1.301 -10.717 -1.456 344 HB3 PHE 44 HB1 PHE 44 -2.238 -9.590 -2.416 345 HD1 PHE 44 HD1 PHE 44 1.281 -10.134 -1.222 346 HD2 PHE 44 HD2 PHE 44 -1.253 -8.761 -4.416 347 HE1 PHE 44 HE1 PHE 44 3.273 -9.769 -2.654 348 HE2 PHE 44 HE2 PHE 44 0.741 -8.397 -5.839 349 HZ PHE 44 HZ PHE 44 3.003 -8.901 -4.959 350 H HIS 45 HN HIS 45 -0.188 -6.638 -1.468 351 HA HIS 45 HA HIS 45 -2.673 -5.202 -2.170 352 HB2 HIS 45 HB2 HIS 45 -2.310 -4.372 0.016 353 HB3 HIS 45 HB1 HIS 45 -0.565 -4.326 -0.187 354 HD1 HIS 45 HD1 HIS 45 -3.411 -2.829 -2.259 355 HD2 HIS 45 HD2 HIS 45 0.098 -1.640 -0.352 356 HE1 HIS 45 HE1 HIS 45 -3.126 -0.366 -2.762 357 HE2 HIS 45 HE2 HIS 45 -0.990 0.378 -1.605 358 H VAL 46 HN VAL 46 -2.544 -4.138 -4.006 359 HA VAL 46 HA VAL 46 0.115 -3.509 -5.189 360 HB VAL 46 HB VAL 46 -2.212 -4.717 -6.702 361 HG11 VAL 46 HG11 VAL 46 -0.935 -3.356 -8.195 362 HG12 VAL 46 HG12 VAL 46 -0.354 -4.995 -8.459 363 HG13 VAL 46 HG13 VAL 46 0.595 -3.872 -7.487 364 HG21 VAL 46 HG21 VAL 46 -0.777 -6.730 -6.859 365 HG22 VAL 46 HG22 VAL 46 -1.176 -6.360 -5.182 366 HG23 VAL 46 HG23 VAL 46 0.417 -5.952 -5.820 367 H CYS 47 HN CYS 47 0.044 -1.895 -6.850 368 HA CYS 47 HA CYS 47 -2.356 -0.290 -7.165 369 HB2 CYS 47 HB2 CYS 47 -0.882 0.325 -4.947 370 HB3 CYS 47 HB1 CYS 47 -0.096 1.372 -6.120 371 H ALA 48 HN ALA 48 -0.841 -1.721 -8.998 372 HA ALA 48 HA ALA 48 0.014 0.457 -10.792 373 HB1 ALA 48 HB1 ALA 48 2.042 -0.776 -11.438 374 HB2 ALA 48 HB2 ALA 48 1.709 -1.980 -10.194 375 HB3 ALA 48 HB3 ALA 48 2.088 -0.320 -9.734 376 H ALA 49 HN ALA 49 -0.343 0.051 -12.917 377 HA ALA 49 HA ALA 49 -1.981 -2.327 -13.542 378 HB1 ALA 49 HB1 ALA 49 -2.925 -0.116 -14.053 379 HB2 ALA 49 HB2 ALA 49 -2.670 -1.059 -15.520 380 HB3 ALA 49 HB3 ALA 49 -1.550 0.233 -15.094 381 H GLY 50 HN GLY 50 -1.026 -4.002 -14.456 382 HA2 GLY 50 HA3 GLY 50 1.187 -3.567 -16.402 383 HA3 GLY 50 HA2 GLY 50 1.320 -4.765 -15.128 384 H TRP 51 HN TRP 51 1.717 -6.025 -17.196 385 HA TRP 51 HA TRP 51 -0.775 -6.886 -18.527 386 HB2 TRP 51 HB2 TRP 51 2.154 -7.041 -19.209 387 HB3 TRP 51 HB1 TRP 51 1.069 -8.238 -19.907 388 HD1 TRP 51 HD1 TRP 51 2.506 -5.083 -20.789 389 HE1 TRP 51 HE1 TRP 51 1.063 -3.780 -22.484 390 HE3 TRP 51 HE3 TRP 51 -1.895 -7.671 -20.420 391 HZ2 TRP 51 HZ2 TRP 51 -1.574 -3.840 -23.561 392 HZ3 TRP 51 HZ3 TRP 51 -3.846 -7.025 -21.795 393 HH2 TRP 51 HH2 TRP 51 -3.693 -5.114 -23.363 394 H MET 52 HN MET 52 -1.369 -9.040 -18.615 395 HA MET 52 HA MET 52 -0.025 -10.921 -16.755 396 HB2 MET 52 HB2 MET 52 -2.066 -9.759 -15.749 397 HB3 MET 52 HB1 MET 52 -3.033 -10.642 -16.920 398 HG2 MET 52 HG2 MET 52 -2.064 -12.769 -16.014 399 HG3 MET 52 HG1 MET 52 -1.236 -11.816 -14.798 400 HE1 MET 52 HE1 MET 52 -3.799 -9.524 -14.120 401 HE2 MET 52 HE2 MET 52 -2.321 -10.146 -13.389 402 HE3 MET 52 HE3 MET 52 -3.865 -10.375 -12.573 403 H ALA 53 HN ALA 53 -0.609 -13.149 -17.131 404 HA ALA 53 HA ALA 53 -0.160 -14.082 -19.644 405 HB1 ALA 53 HB1 ALA 53 -0.263 -15.472 -17.585 406 HB2 ALA 53 HB2 ALA 53 -1.103 -16.201 -18.953 407 HB3 ALA 53 HB3 ALA 53 -2.024 -15.415 -17.671 408 H LYS 54 HN LYS 54 -1.237 -14.442 -21.481 409 HA LYS 54 HA LYS 54 -2.845 -14.222 -23.106 410 HB2 LYS 54 HB2 LYS 54 -4.642 -14.909 -20.765 411 HB3 LYS 54 HB1 LYS 54 -5.189 -14.820 -22.434 412 HG2 LYS 54 HG2 LYS 54 -3.583 -16.566 -23.070 413 HG3 LYS 54 HG1 LYS 54 -3.007 -16.651 -21.404 414 HD2 LYS 54 HD2 LYS 54 -5.224 -17.333 -20.634 415 HD3 LYS 54 HD1 LYS 54 -5.869 -17.164 -22.266 416 HE2 LYS 54 HE2 LYS 54 -5.388 -19.520 -21.797 417 HE3 LYS 54 HE1 LYS 54 -4.299 -18.920 -23.048 418 HZ1 LYS 54 HZ1 LYS 54 -3.519 -18.829 -20.206 419 HZ2 LYS 54 HZ2 LYS 54 -2.528 -18.837 -21.588 420 HZ3 LYS 54 HZ3 LYS 54 -3.328 -20.255 -21.103 421 H GLY 55 HN GLY 55 -1.979 -11.825 -21.843 422 HA2 GLY 55 HA3 GLY 55 -2.525 -9.603 -21.633 423 HA3 GLY 55 HA2 GLY 55 -3.724 -9.944 -22.869 424 H ARG 56 HN ARG 56 -4.083 -11.763 -19.989 425 HA ARG 56 HA ARG 56 -6.637 -10.531 -19.457 426 HB2 ARG 56 HB2 ARG 56 -5.974 -13.019 -19.139 427 HB3 ARG 56 HB1 ARG 56 -5.234 -12.506 -17.633 428 HG2 ARG 56 HG2 ARG 56 -7.331 -11.741 -16.746 429 HG3 ARG 56 HG1 ARG 56 -8.133 -11.898 -18.308 430 HD2 ARG 56 HD2 ARG 56 -8.755 -13.795 -16.933 431 HD3 ARG 56 HD1 ARG 56 -7.717 -14.357 -18.233 432 HE ARG 56 HE ARG 56 -6.039 -13.811 -16.079 433 HH11 ARG 56 HH21 ARG 56 -8.768 -15.844 -16.752 434 HH12 ARG 56 HH22 ARG 56 -8.200 -17.143 -15.756 435 HH21 ARG 56 HH11 ARG 56 -5.256 -15.572 -14.884 436 HH22 ARG 56 HH12 ARG 56 -6.207 -17.012 -14.754 437 H VAL 57 HN VAL 57 -4.920 -8.484 -19.237 438 HA VAL 57 HA VAL 57 -3.679 -7.997 -16.785 439 HB VAL 57 HB VAL 57 -3.231 -6.458 -18.556 440 HG11 VAL 57 HG11 VAL 57 -5.437 -6.826 -19.735 441 HG12 VAL 57 HG12 VAL 57 -4.898 -5.158 -19.693 442 HG13 VAL 57 HG13 VAL 57 -6.169 -5.694 -18.596 443 HG21 VAL 57 HG21 VAL 57 -3.516 -4.343 -17.486 444 HG22 VAL 57 HG22 VAL 57 -3.546 -5.495 -16.152 445 HG23 VAL 57 HG23 VAL 57 -5.052 -4.815 -16.757 446 H GLY 58 HN GLY 58 -4.343 -7.494 -14.805 447 HA2 GLY 58 HA3 GLY 58 -6.728 -6.177 -14.102 448 HA3 GLY 58 HA2 GLY 58 -7.013 -7.911 -14.009 449 H TYR 59 HN TYR 59 -4.696 -5.427 -12.937 450 HA TYR 59 HA TYR 59 -3.615 -7.046 -10.874 451 HB2 TYR 59 HB2 TYR 59 -2.387 -5.108 -10.173 452 HB3 TYR 59 HB1 TYR 59 -2.420 -5.142 -11.929 453 HD1 TYR 59 HD2 TYR 59 -4.185 -3.710 -13.145 454 HD2 TYR 59 HD1 TYR 59 -3.195 -3.183 -8.994 455 HE1 TYR 59 HE2 TYR 59 -5.129 -1.422 -13.208 456 HE2 TYR 59 HE1 TYR 59 -4.127 -0.884 -9.069 457 HH TYR 59 HH TYR 59 -5.502 0.445 -12.079 458 HA PRO 60 HA PRO 60 -6.758 -6.441 -7.798 459 HB2 PRO 60 HB2 PRO 60 -5.437 -7.120 -5.526 460 HB3 PRO 60 HB1 PRO 60 -5.810 -8.324 -6.778 461 HG2 PRO 60 HG2 PRO 60 -3.251 -6.819 -6.334 462 HG3 PRO 60 HG1 PRO 60 -3.490 -8.561 -6.582 463 HD2 PRO 60 HD2 PRO 60 -2.762 -6.934 -8.642 464 HD3 PRO 60 HD1 PRO 60 -3.853 -8.320 -8.893 465 H ILE 61 HN ILE 61 -7.424 -5.047 -6.090 466 HA ILE 61 HA ILE 61 -5.585 -2.884 -5.272 467 HB ILE 61 HB ILE 61 -8.333 -2.219 -6.374 468 HG12 ILE 61 HG12 ILE 61 -5.643 -2.184 -7.782 469 HG13 ILE 61 HG11 ILE 61 -7.042 -3.161 -8.214 470 HG21 ILE 61 HG21 ILE 61 -5.878 -0.480 -5.956 471 HG22 ILE 61 HG22 ILE 61 -7.146 -0.660 -4.746 472 HG23 ILE 61 HG23 ILE 61 -7.518 0.058 -6.310 473 HD11 ILE 61 HD11 ILE 61 -7.047 -1.305 -9.720 474 HD12 ILE 61 HD12 ILE 61 -6.766 -0.157 -8.415 475 HD13 ILE 61 HD13 ILE 61 -8.320 -0.982 -8.544 476 H VAL 62 HN VAL 62 -5.651 -3.594 -3.175 477 HA VAL 62 HA VAL 62 -8.244 -3.925 -1.828 478 HB VAL 62 HB VAL 62 -5.423 -4.198 -0.752 479 HG11 VAL 62 HG11 VAL 62 -6.643 -5.479 1.062 480 HG12 VAL 62 HG12 VAL 62 -8.156 -4.876 0.386 481 HG13 VAL 62 HG13 VAL 62 -6.974 -3.749 1.052 482 HG21 VAL 62 HG21 VAL 62 -6.062 -5.829 -2.563 483 HG22 VAL 62 HG22 VAL 62 -7.424 -6.336 -1.565 484 HG23 VAL 62 HG23 VAL 62 -5.774 -6.595 -1.002 485 H LYS 63 HN LYS 63 -5.273 -2.259 -0.766 486 HA LYS 63 HA LYS 63 -6.767 -0.370 0.767 487 HB2 LYS 63 HB2 LYS 63 -3.888 -0.868 0.137 488 HB3 LYS 63 HB1 LYS 63 -4.275 0.749 0.701 489 HG2 LYS 63 HG2 LYS 63 -5.448 -0.329 2.684 490 HG3 LYS 63 HG1 LYS 63 -4.777 -1.870 2.157 491 HD2 LYS 63 HD2 LYS 63 -3.208 0.617 2.916 492 HD3 LYS 63 HD1 LYS 63 -3.352 -0.854 3.877 493 HE2 LYS 63 HE2 LYS 63 -1.851 -0.437 1.284 494 HE3 LYS 63 HE1 LYS 63 -1.272 -1.140 2.792 495 HZ1 LYS 63 HZ1 LYS 63 -3.102 -2.349 0.807 496 HZ2 LYS 63 HZ2 LYS 63 -2.942 -2.962 2.380 497 HZ3 LYS 63 HZ3 LYS 63 -1.601 -2.926 1.337 498 HA PRO 64 HA PRO 64 -7.581 2.835 -2.168 499 HB2 PRO 64 HB2 PRO 64 -7.024 5.135 -0.715 500 HB3 PRO 64 HB1 PRO 64 -8.479 4.146 -0.463 501 HG2 PRO 64 HG2 PRO 64 -5.876 4.065 1.038 502 HG3 PRO 64 HG1 PRO 64 -7.533 4.117 1.680 503 HD2 PRO 64 HD2 PRO 64 -6.241 1.782 1.561 504 HD3 PRO 64 HD1 PRO 64 -7.958 1.855 1.106 505 H GLY 65 HN GLY 65 -6.567 4.046 -3.729 506 HA2 GLY 65 HA3 GLY 65 -3.663 4.638 -3.429 507 HA3 GLY 65 HA2 GLY 65 -4.250 3.717 -4.792 508 HA PRO 66 HA PRO 66 -6.019 8.344 -5.040 509 HB2 PRO 66 HB2 PRO 66 -3.448 9.509 -3.963 510 HB3 PRO 66 HB1 PRO 66 -5.107 10.137 -3.826 511 HG2 PRO 66 HG2 PRO 66 -3.973 8.946 -1.752 512 HG3 PRO 66 HG1 PRO 66 -5.675 8.617 -2.144 513 HD2 PRO 66 HD2 PRO 66 -3.259 6.883 -2.653 514 HD3 PRO 66 HD1 PRO 66 -4.902 6.404 -2.164 515 H ASN 67 HN ASN 67 -2.559 7.572 -5.350 516 HA ASN 67 HA ASN 67 -2.452 8.826 -8.024 517 HB2 ASN 67 HB2 ASN 67 -0.029 8.558 -7.813 518 HB3 ASN 67 HB1 ASN 67 -0.690 9.413 -6.420 519 HD21 ASN 67 HD21 ASN 67 0.903 6.464 -7.457 520 HD22 ASN 67 HD22 ASN 67 1.092 5.801 -5.906 521 H CYS 68 HN CYS 68 -3.788 6.200 -7.330 522 HA CYS 68 HA CYS 68 -3.124 4.794 -9.666 523 HB2 CYS 68 HB2 CYS 68 -2.163 2.702 -8.524 524 HB3 CYS 68 HB1 CYS 68 -1.063 4.059 -8.729 525 H GLY 69 HN GLY 69 -5.128 4.154 -10.115 526 HA2 GLY 69 HA3 GLY 69 -7.093 2.949 -9.968 527 HA3 GLY 69 HA2 GLY 69 -6.480 2.216 -8.492 528 H PHE 70 HN PHE 70 -6.415 5.626 -8.551 529 HA PHE 70 HA PHE 70 -7.501 7.199 -7.250 530 HB2 PHE 70 HB2 PHE 70 -9.820 5.545 -8.284 531 HB3 PHE 70 HB1 PHE 70 -10.038 7.051 -7.396 532 HD1 PHE 70 HD2 PHE 70 -9.329 9.207 -8.360 533 HD2 PHE 70 HD1 PHE 70 -8.935 5.541 -10.571 534 HE1 PHE 70 HE2 PHE 70 -8.994 10.500 -10.450 535 HE2 PHE 70 HE1 PHE 70 -8.603 6.838 -12.658 536 HZ PHE 70 HZ PHE 70 -8.632 9.317 -12.598 537 H GLY 71 HN GLY 71 -9.930 4.779 -6.578 538 HA2 GLY 71 HA3 GLY 71 -8.863 4.086 -3.955 539 HA3 GLY 71 HA2 GLY 71 -10.274 5.139 -3.911 540 H LYS 72 HN LYS 72 -10.094 2.972 -6.561 541 HA LYS 72 HA LYS 72 -12.501 1.626 -5.800 542 HB2 LYS 72 HB2 LYS 72 -10.532 0.830 -7.961 543 HB3 LYS 72 HB1 LYS 72 -12.233 0.392 -7.866 544 HG2 LYS 72 HG2 LYS 72 -11.254 3.254 -8.130 545 HG3 LYS 72 HG1 LYS 72 -11.712 2.254 -9.501 546 HD2 LYS 72 HD2 LYS 72 -13.988 1.984 -8.495 547 HD3 LYS 72 HD1 LYS 72 -13.520 3.099 -7.212 548 HE2 LYS 72 HE2 LYS 72 -14.685 4.378 -8.885 549 HE3 LYS 72 HE1 LYS 72 -12.978 4.807 -8.973 550 HZ1 LYS 72 HZ1 LYS 72 -12.924 4.119 -11.062 551 HZ2 LYS 72 HZ2 LYS 72 -14.590 3.799 -11.000 552 HZ3 LYS 72 HZ3 LYS 72 -13.473 2.578 -10.619 553 H THR 73 HN THR 73 -12.754 -0.116 -4.591 554 HA THR 73 HA THR 73 -10.390 -1.612 -3.673 555 HB THR 73 HB THR 73 -12.013 -2.623 -2.054 556 HG1 THR 73 HG1 THR 73 -13.719 -0.945 -3.512 557 HG21 THR 73 HG21 THR 73 -10.701 -0.737 -1.322 558 HG22 THR 73 HG22 THR 73 -12.355 -0.490 -0.759 559 HG23 THR 73 HG23 THR 73 -11.764 0.391 -2.168 560 H GLY 74 HN GLY 74 -10.831 -4.016 -3.305 561 HA2 GLY 74 HA3 GLY 74 -11.353 -6.120 -4.117 562 HA3 GLY 74 HA2 GLY 74 -12.577 -5.382 -5.144 563 H ILE 75 HN ILE 75 -11.637 -7.132 -6.577 564 HA ILE 75 HA ILE 75 -9.127 -6.339 -7.928 565 HB ILE 75 HB ILE 75 -10.830 -8.817 -8.295 566 HG12 ILE 75 HG12 ILE 75 -8.179 -8.507 -6.846 567 HG13 ILE 75 HG11 ILE 75 -9.734 -8.541 -6.022 568 HG21 ILE 75 HG21 ILE 75 -8.130 -7.946 -9.388 569 HG22 ILE 75 HG22 ILE 75 -9.558 -8.439 -10.295 570 HG23 ILE 75 HG23 ILE 75 -8.641 -9.630 -9.382 571 HD11 ILE 75 HD11 ILE 75 -10.186 -10.770 -7.057 572 HD12 ILE 75 HD12 ILE 75 -8.788 -10.777 -5.984 573 HD13 ILE 75 HD13 ILE 75 -8.557 -10.748 -7.733 574 H ILE 76 HN ILE 76 -9.191 -5.180 -9.722 575 HA ILE 76 HA ILE 76 -11.735 -4.848 -11.190 576 HB ILE 76 HB ILE 76 -9.123 -3.367 -11.608 577 HG12 ILE 76 HG12 ILE 76 -9.771 -2.994 -9.305 578 HG13 ILE 76 HG11 ILE 76 -10.185 -1.558 -10.231 579 HG21 ILE 76 HG21 ILE 76 -12.002 -2.765 -12.352 580 HG22 ILE 76 HG22 ILE 76 -10.698 -3.184 -13.461 581 HG23 ILE 76 HG23 ILE 76 -10.651 -1.655 -12.584 582 HD11 ILE 76 HD11 ILE 76 -12.025 -3.677 -9.124 583 HD12 ILE 76 HD12 ILE 76 -12.551 -2.635 -10.447 584 HD13 ILE 76 HD13 ILE 76 -12.093 -1.933 -8.899 585 H ASP 77 HN ASP 77 -11.477 -7.104 -12.024 586 HA ASP 77 HA ASP 77 -9.386 -7.657 -13.927 587 HB2 ASP 77 HB2 ASP 77 -10.548 -9.428 -12.629 588 HB3 ASP 77 HB1 ASP 77 -12.030 -9.073 -13.515 589 H TYR 78 HN TYR 78 -9.292 -6.537 -15.751 590 HA TYR 78 HA TYR 78 -11.595 -5.356 -17.027 591 HB2 TYR 78 HB2 TYR 78 -8.769 -5.705 -18.069 592 HB3 TYR 78 HB1 TYR 78 -10.014 -4.681 -18.776 593 HD1 TYR 78 HD2 TYR 78 -10.814 -2.647 -17.590 594 HD2 TYR 78 HD1 TYR 78 -7.578 -5.027 -16.056 595 HE1 TYR 78 HE2 TYR 78 -10.151 -0.784 -16.094 596 HE2 TYR 78 HE1 TYR 78 -6.916 -3.159 -14.564 597 HH TYR 78 HH TYR 78 -7.406 -1.121 -13.841 598 H GLY 79 HN GLY 79 -10.472 -8.480 -16.923 599 HA2 GLY 79 HA3 GLY 79 -10.754 -10.359 -18.231 600 HA3 GLY 79 HA2 GLY 79 -12.247 -9.574 -18.734 601 H ILE 80 HN ILE 80 -8.750 -9.497 -19.371 602 HA ILE 80 HA ILE 80 -7.537 -9.194 -21.295 603 HB ILE 80 HB ILE 80 -10.020 -10.341 -22.603 604 HG12 ILE 80 HG12 ILE 80 -7.499 -11.764 -21.666 605 HG13 ILE 80 HG11 ILE 80 -9.000 -11.730 -20.736 606 HG21 ILE 80 HG21 ILE 80 -8.317 -11.092 -24.328 607 HG22 ILE 80 HG22 ILE 80 -7.136 -10.069 -23.517 608 HG23 ILE 80 HG23 ILE 80 -8.560 -9.351 -24.269 609 HD11 ILE 80 HD11 ILE 80 -10.178 -12.733 -22.719 610 HD12 ILE 80 HD12 ILE 80 -8.943 -13.788 -22.031 611 HD13 ILE 80 HD13 ILE 80 -8.611 -12.892 -23.514 612 H ARG 81 HN ARG 81 -7.082 -7.261 -22.132 613 HA ARG 81 HA ARG 81 -9.295 -5.466 -22.997 614 HB2 ARG 81 HB2 ARG 81 -6.433 -4.854 -22.204 615 HB3 ARG 81 HB1 ARG 81 -7.582 -3.659 -22.807 616 HG2 ARG 81 HG2 ARG 81 -9.120 -4.227 -20.940 617 HG3 ARG 81 HG1 ARG 81 -7.923 -5.362 -20.318 618 HD2 ARG 81 HD2 ARG 81 -7.626 -3.343 -19.062 619 HD3 ARG 81 HD1 ARG 81 -6.299 -3.382 -20.209 620 HE ARG 81 HE ARG 81 -8.485 -1.953 -21.324 621 HH11 ARG 81 HH21 ARG 81 -5.923 -1.758 -19.008 622 HH12 ARG 81 HH22 ARG 81 -5.923 -0.027 -18.950 623 HH21 ARG 81 HH11 ARG 81 -8.455 0.316 -21.285 624 HH22 ARG 81 HH12 ARG 81 -7.344 1.144 -20.245 625 H LEU 82 HN LEU 82 -9.118 -4.320 -24.949 626 HA LEU 82 HA LEU 82 -7.815 -5.816 -27.082 627 HB2 LEU 82 HB2 LEU 82 -10.136 -5.084 -27.353 628 HB3 LEU 82 HB1 LEU 82 -9.659 -3.408 -27.130 629 HG LEU 82 HG LEU 82 -8.357 -3.465 -29.206 630 HD11 LEU 82 HD11 LEU 82 -9.104 -6.401 -29.188 631 HD12 LEU 82 HD12 LEU 82 -7.509 -5.676 -29.398 632 HD13 LEU 82 HD13 LEU 82 -8.692 -5.574 -30.693 633 HD21 LEU 82 HD21 LEU 82 -11.112 -4.662 -29.603 634 HD22 LEU 82 HD22 LEU 82 -10.220 -3.688 -30.771 635 HD23 LEU 82 HD23 LEU 82 -10.793 -2.960 -29.269 636 H ASN 83 HN ASN 83 -7.047 -3.228 -25.092 637 HA ASN 83 HA ASN 83 -5.545 -1.622 -26.936 638 HB2 ASN 83 HB2 ASN 83 -4.745 -0.450 -24.966 639 HB3 ASN 83 HB1 ASN 83 -6.485 -0.699 -24.849 640 HD21 ASN 83 HD21 ASN 83 -5.523 -0.257 -22.442 641 HD22 ASN 83 HD22 ASN 83 -5.248 -1.676 -21.553 642 H ARG 84 HN ARG 84 -4.980 -4.566 -26.719 643 HA ARG 84 HA ARG 84 -2.592 -5.198 -25.483 644 HB2 ARG 84 HB2 ARG 84 -3.626 -6.073 -28.187 645 HB3 ARG 84 HB1 ARG 84 -2.177 -6.754 -27.451 646 HG2 ARG 84 HG2 ARG 84 -3.486 -7.497 -25.506 647 HG3 ARG 84 HG1 ARG 84 -4.949 -6.808 -26.217 648 HD2 ARG 84 HD2 ARG 84 -4.714 -8.262 -28.167 649 HD3 ARG 84 HD1 ARG 84 -3.224 -8.930 -27.525 650 HE ARG 84 HE ARG 84 -5.372 -9.329 -25.692 651 HH11 ARG 84 HH21 ARG 84 -3.895 -10.406 -28.615 652 HH12 ARG 84 HH22 ARG 84 -4.694 -11.943 -28.628 653 HH21 ARG 84 HH11 ARG 84 -6.454 -11.357 -25.709 654 HH22 ARG 84 HH12 ARG 84 -6.145 -12.477 -26.993 655 H SER 85 HN SER 85 -3.063 -2.828 -27.877 656 HA SER 85 HA SER 85 -0.363 -2.890 -28.959 657 HB2 SER 85 HB2 SER 85 -2.325 -2.156 -30.309 658 HB3 SER 85 HB1 SER 85 -2.499 -0.766 -29.241 659 HG SER 85 HG SER 85 -1.244 -0.177 -30.998 660 H GLU 86 HN GLU 86 -2.165 -1.168 -26.496 661 HA GLU 86 HA GLU 86 -0.220 0.886 -26.049 662 HB2 GLU 86 HB2 GLU 86 -2.458 -0.162 -24.297 663 HB3 GLU 86 HB1 GLU 86 -1.502 1.274 -23.943 664 HG2 GLU 86 HG2 GLU 86 -3.178 0.883 -26.447 665 HG3 GLU 86 HG1 GLU 86 -3.680 1.810 -25.036 666 H ARG 87 HN ARG 87 1.257 1.070 -24.358 667 HA ARG 87 HA ARG 87 2.394 -1.458 -23.432 668 HB2 ARG 87 HB2 ARG 87 3.321 1.396 -23.005 669 HB3 ARG 87 HB1 ARG 87 4.215 -0.065 -22.579 670 HG2 ARG 87 HG2 ARG 87 4.243 -0.755 -24.948 671 HG3 ARG 87 HG1 ARG 87 3.347 0.699 -25.385 672 HD2 ARG 87 HD2 ARG 87 5.216 2.083 -24.443 673 HD3 ARG 87 HD1 ARG 87 6.105 0.599 -24.132 674 HE ARG 87 HE ARG 87 6.662 0.494 -26.373 675 HH11 ARG 87 HH21 ARG 87 4.029 2.674 -25.862 676 HH12 ARG 87 HH22 ARG 87 4.045 3.273 -27.486 677 HH21 ARG 87 HH11 ARG 87 6.724 1.324 -28.465 678 HH22 ARG 87 HH12 ARG 87 5.584 2.535 -28.945 679 H TRP 88 HN TRP 88 2.939 -1.811 -21.210 680 HA TRP 88 HA TRP 88 1.582 -0.276 -19.131 681 HB2 TRP 88 HB2 TRP 88 0.783 -3.130 -19.740 682 HB3 TRP 88 HB1 TRP 88 0.377 -2.287 -18.253 683 HD1 TRP 88 HD1 TRP 88 -0.434 -2.375 -21.975 684 HE1 TRP 88 HE1 TRP 88 -2.595 -1.026 -22.375 685 HE3 TRP 88 HE3 TRP 88 -1.049 -0.322 -17.354 686 HZ2 TRP 88 HZ2 TRP 88 -4.354 0.702 -20.918 687 HZ3 TRP 88 HZ3 TRP 88 -2.971 1.172 -16.878 688 HH2 TRP 88 HH2 TRP 88 -4.622 1.685 -18.655 689 H ASP 89 HN ASP 89 1.843 -1.639 -16.973 690 HA ASP 89 HA ASP 89 4.676 -1.990 -16.611 691 HB2 ASP 89 HB2 ASP 89 3.052 -1.016 -14.906 692 HB3 ASP 89 HB1 ASP 89 2.484 -2.657 -14.627 693 H ALA 90 HN ALA 90 5.164 -3.990 -15.011 694 HA ALA 90 HA ALA 90 3.916 -6.484 -15.832 695 HB1 ALA 90 HB1 ALA 90 5.875 -7.457 -16.882 696 HB2 ALA 90 HB2 ALA 90 6.788 -5.969 -16.634 697 HB3 ALA 90 HB3 ALA 90 5.421 -5.990 -17.749 698 H TYR 91 HN TYR 91 4.772 -8.326 -14.713 699 HA TYR 91 HA TYR 91 6.713 -7.894 -12.586 700 HB2 TYR 91 HB2 TYR 91 4.763 -9.036 -11.023 701 HB3 TYR 91 HB1 TYR 91 5.073 -7.304 -11.080 702 HD1 TYR 91 HD1 TYR 91 3.257 -9.852 -13.185 703 HD2 TYR 91 HD2 TYR 91 3.135 -5.971 -11.329 704 HE1 TYR 91 HE1 TYR 91 0.959 -9.500 -14.053 705 HE2 TYR 91 HE2 TYR 91 0.847 -5.628 -12.197 706 HH TYR 91 HH TYR 91 -0.939 -8.202 -13.761 707 H CYS 92 HN CYS 92 7.299 -9.859 -11.493 708 HA CYS 92 HA CYS 92 6.667 -12.348 -13.015 709 HB2 CYS 92 HB2 CYS 92 9.365 -11.732 -11.784 710 HB3 CYS 92 HB1 CYS 92 8.939 -13.085 -12.821 711 H TYR 93 HN TYR 93 6.546 -14.228 -11.829 712 HA TYR 93 HA TYR 93 6.842 -14.066 -8.883 713 HB2 TYR 93 HB2 TYR 93 4.608 -14.355 -8.441 714 HB3 TYR 93 HB1 TYR 93 4.339 -13.858 -10.101 715 HD1 TYR 93 HD1 TYR 93 4.748 -16.770 -7.847 716 HD2 TYR 93 HD2 TYR 93 3.557 -15.457 -11.761 717 HE1 TYR 93 HE1 TYR 93 3.813 -19.016 -8.313 718 HE2 TYR 93 HE2 TYR 93 2.609 -17.706 -12.220 719 HH TYR 93 HH TYR 93 3.184 -20.403 -10.103 720 H ASN 94 HN ASN 94 7.948 -15.721 -8.118 721 HA ASN 94 HA ASN 94 8.901 -17.792 -9.794 722 HB2 ASN 94 HB2 ASN 94 9.035 -17.276 -6.824 723 HB3 ASN 94 HB1 ASN 94 9.713 -18.749 -7.511 724 HD21 ASN 94 HD21 ASN 94 10.411 -15.469 -6.831 725 HD22 ASN 94 HD22 ASN 94 11.809 -15.334 -7.783 726 HA PRO 95 HA PRO 95 5.637 -20.772 -9.336 727 HB2 PRO 95 HB2 PRO 95 6.981 -23.136 -9.701 728 HB3 PRO 95 HB1 PRO 95 6.705 -21.987 -11.030 729 HG2 PRO 95 HG2 PRO 95 9.148 -22.315 -9.310 730 HG3 PRO 95 HG1 PRO 95 9.038 -22.184 -11.080 731 HD2 PRO 95 HD2 PRO 95 9.675 -20.032 -9.558 732 HD3 PRO 95 HD1 PRO 95 8.668 -19.857 -11.016 733 H HIS 96 HN HIS 96 8.383 -20.730 -7.237 734 HA HIS 96 HA HIS 96 7.901 -22.837 -5.494 735 HB2 HIS 96 HB2 HIS 96 8.953 -20.051 -4.920 736 HB3 HIS 96 HB1 HIS 96 8.976 -21.365 -3.743 737 HD1 HIS 96 HD1 HIS 96 10.372 -20.440 -7.136 738 HD2 HIS 96 HD2 HIS 96 11.022 -23.220 -4.102 739 HE1 HIS 96 HE1 HIS 96 12.503 -21.669 -7.737 740 HE2 HIS 96 HE2 HIS 96 12.914 -23.370 -5.896 741 H ALA 97 HN ALA 97 7.282 -19.653 -4.170 742 HA ALA 97 HA ALA 97 5.606 -18.926 -2.784 743 HB1 ALA 97 HB1 ALA 97 3.385 -19.040 -3.709 744 HB2 ALA 97 HB2 ALA 97 3.825 -20.412 -4.725 745 HB3 ALA 97 HB3 ALA 97 4.511 -18.819 -5.047 746 H LYS 98 HN LYS 98 3.216 -19.946 -2.018 747 HA LYS 98 HA LYS 98 3.598 -22.717 -1.157 748 HB2 LYS 98 HB2 LYS 98 3.396 -20.408 0.799 749 HB3 LYS 98 HB1 LYS 98 3.053 -22.084 1.228 750 HG2 LYS 98 HG2 LYS 98 5.352 -22.711 0.523 751 HG3 LYS 98 HG1 LYS 98 5.690 -21.013 0.179 752 HD2 LYS 98 HD2 LYS 98 5.220 -20.433 2.528 753 HD3 LYS 98 HD1 LYS 98 4.877 -22.128 2.881 754 HE2 LYS 98 HE2 LYS 98 7.181 -22.725 2.195 755 HE3 LYS 98 HE1 LYS 98 7.519 -21.023 1.888 756 HZ1 LYS 98 HZ1 LYS 98 8.280 -21.237 4.016 757 HZ2 LYS 98 HZ2 LYS 98 7.130 -22.412 4.444 758 HZ3 LYS 98 HZ3 LYS 98 6.680 -20.777 4.333 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 4.206 -15.366 -3.022 2 H2 GLY 1 H2 GLY 1 4.714 -16.170 -1.615 3 H3 GLY 1 H3 GLY 1 4.557 -17.024 -3.074 4 HA2 GLY 1 HA3 GLY 1 6.711 -15.313 -2.140 5 HA3 GLY 1 HA2 GLY 1 6.768 -16.719 -3.205 6 H VAL 2 HN VAL 2 4.411 -14.288 -3.851 7 HA VAL 2 HA VAL 2 5.625 -13.690 -6.425 8 HB VAL 2 HB VAL 2 3.569 -12.382 -6.808 9 HG11 VAL 2 HG11 VAL 2 3.092 -15.117 -5.583 10 HG12 VAL 2 HG12 VAL 2 3.591 -14.809 -7.245 11 HG13 VAL 2 HG13 VAL 2 2.001 -14.284 -6.693 12 HG21 VAL 2 HG21 VAL 2 2.893 -13.219 -3.966 13 HG22 VAL 2 HG22 VAL 2 1.789 -12.427 -5.086 14 HG23 VAL 2 HG23 VAL 2 3.208 -11.568 -4.502 15 H TYR 3 HN TYR 3 6.063 -11.573 -7.182 16 HA TYR 3 HA TYR 3 6.348 -9.426 -5.197 17 HB2 TYR 3 HB2 TYR 3 8.705 -9.026 -5.810 18 HB3 TYR 3 HB1 TYR 3 8.477 -10.575 -5.003 19 HD1 TYR 3 HD2 TYR 3 8.612 -12.695 -6.270 20 HD2 TYR 3 HD1 TYR 3 9.325 -8.910 -8.171 21 HE1 TYR 3 HE2 TYR 3 9.665 -13.858 -8.187 22 HE2 TYR 3 HE1 TYR 3 10.382 -10.074 -10.085 23 HH TYR 3 HH TYR 3 10.160 -12.509 -11.112 24 H HIS 4 HN HIS 4 6.483 -7.387 -6.056 25 HA HIS 4 HA HIS 4 5.511 -7.164 -8.831 26 HB2 HIS 4 HB2 HIS 4 4.837 -4.919 -8.237 27 HB3 HIS 4 HB1 HIS 4 4.247 -6.045 -7.016 28 HD1 HIS 4 HD1 HIS 4 7.198 -3.695 -7.570 29 HD2 HIS 4 HD2 HIS 4 5.008 -5.371 -4.445 30 HE1 HIS 4 HE1 HIS 4 8.045 -2.615 -5.443 31 HE2 HIS 4 HE2 HIS 4 6.720 -3.625 -3.528 32 H ARG 5 HN ARG 5 6.598 -6.199 -10.429 33 HA ARG 5 HA ARG 5 9.400 -5.365 -9.898 34 HB2 ARG 5 HB2 ARG 5 8.001 -6.221 -12.444 35 HB3 ARG 5 HB1 ARG 5 9.676 -5.676 -12.357 36 HG2 ARG 5 HG2 ARG 5 10.118 -7.503 -10.691 37 HG3 ARG 5 HG1 ARG 5 8.480 -8.090 -10.969 38 HD2 ARG 5 HD2 ARG 5 10.557 -7.762 -13.144 39 HD3 ARG 5 HD1 ARG 5 10.208 -9.281 -12.332 40 HE ARG 5 HE ARG 5 7.803 -8.213 -13.360 41 HH11 ARG 5 HH21 ARG 5 10.781 -9.705 -14.265 42 HH12 ARG 5 HH22 ARG 5 10.164 -10.364 -15.745 43 HH21 ARG 5 HH11 ARG 5 6.983 -9.036 -15.301 44 HH22 ARG 5 HH12 ARG 5 8.005 -9.975 -16.336 45 H GLU 6 HN GLU 6 10.225 -3.526 -11.050 46 HA GLU 6 HA GLU 6 8.246 -1.526 -11.960 47 HB2 GLU 6 HB2 GLU 6 8.677 -1.161 -9.536 48 HB3 GLU 6 HB1 GLU 6 10.392 -0.975 -9.892 49 HG2 GLU 6 HG2 GLU 6 9.920 0.954 -11.325 50 HG3 GLU 6 HG1 GLU 6 8.189 0.735 -11.079 51 H ALA 7 HN ALA 7 8.874 -1.038 -13.939 52 HA ALA 7 HA ALA 7 11.381 -1.492 -15.091 53 HB1 ALA 7 HB1 ALA 7 9.388 -1.149 -16.439 54 HB2 ALA 7 HB2 ALA 7 10.601 0.052 -16.880 55 HB3 ALA 7 HB3 ALA 7 9.242 0.507 -15.851 56 H ARG 8 HN ARG 8 12.666 0.374 -16.145 57 HA ARG 8 HA ARG 8 13.904 1.860 -14.061 58 HB2 ARG 8 HB2 ARG 8 15.212 2.919 -15.911 59 HB3 ARG 8 HB1 ARG 8 15.258 1.162 -15.917 60 HG2 ARG 8 HG2 ARG 8 13.062 2.319 -17.584 61 HG3 ARG 8 HG1 ARG 8 14.670 2.719 -18.148 62 HD2 ARG 8 HD2 ARG 8 13.847 -0.120 -17.508 63 HD3 ARG 8 HD1 ARG 8 13.638 0.593 -19.110 64 HE ARG 8 HE ARG 8 16.318 0.929 -18.152 65 HH11 ARG 8 HH21 ARG 8 14.081 -1.284 -19.606 66 HH12 ARG 8 HH22 ARG 8 15.314 -2.272 -20.319 67 HH21 ARG 8 HH11 ARG 8 17.928 -0.348 -19.090 68 HH22 ARG 8 HH12 ARG 8 17.495 -1.740 -20.027 69 H SER 9 HN SER 9 11.594 2.711 -16.584 70 HA SER 9 HA SER 9 11.631 5.540 -16.028 71 HB2 SER 9 HB2 SER 9 9.705 5.617 -17.548 72 HB3 SER 9 HB1 SER 9 11.012 4.658 -18.239 73 HG SER 9 HG SER 9 8.517 3.889 -17.288 74 H GLY 10 HN GLY 10 10.376 2.912 -14.377 75 HA2 GLY 10 HA3 GLY 10 8.653 2.622 -12.836 76 HA3 GLY 10 HA2 GLY 10 9.242 4.175 -12.261 77 H LYS 11 HN LYS 11 7.517 3.337 -15.243 78 HA LYS 11 HA LYS 11 5.091 4.691 -14.344 79 HB2 LYS 11 HB2 LYS 11 6.746 6.455 -15.259 80 HB3 LYS 11 HB1 LYS 11 6.445 5.749 -16.843 81 HG2 LYS 11 HG2 LYS 11 4.042 6.217 -16.622 82 HG3 LYS 11 HG1 LYS 11 4.293 6.837 -14.992 83 HD2 LYS 11 HD2 LYS 11 5.720 8.627 -15.870 84 HD3 LYS 11 HD1 LYS 11 5.523 7.997 -17.505 85 HE2 LYS 11 HE2 LYS 11 3.968 9.862 -17.130 86 HE3 LYS 11 HE1 LYS 11 3.075 8.356 -17.332 87 HZ1 LYS 11 HZ1 LYS 11 2.215 8.595 -15.324 88 HZ2 LYS 11 HZ2 LYS 11 2.985 10.103 -15.178 89 HZ3 LYS 11 HZ3 LYS 11 3.756 8.695 -14.620 90 H TYR 12 HN TYR 12 5.391 2.056 -14.940 91 HA TYR 12 HA TYR 12 4.703 0.332 -16.300 92 HB2 TYR 12 HB2 TYR 12 2.469 2.060 -17.345 93 HB3 TYR 12 HB1 TYR 12 2.415 0.428 -16.701 94 HD1 TYR 12 HD2 TYR 12 3.667 0.594 -14.099 95 HD2 TYR 12 HD1 TYR 12 1.034 3.403 -16.020 96 HE1 TYR 12 HE2 TYR 12 2.936 1.438 -11.884 97 HE2 TYR 12 HE1 TYR 12 0.310 4.239 -13.809 98 HH TYR 12 HH TYR 12 0.820 4.248 -11.594 99 H LYS 13 HN LYS 13 6.257 0.074 -17.884 100 HA LYS 13 HA LYS 13 5.649 1.208 -20.536 101 HB2 LYS 13 HB2 LYS 13 8.235 1.494 -18.998 102 HB3 LYS 13 HB1 LYS 13 8.255 1.504 -20.762 103 HG2 LYS 13 HG2 LYS 13 6.394 3.345 -19.233 104 HG3 LYS 13 HG1 LYS 13 8.069 3.793 -19.490 105 HD2 LYS 13 HD2 LYS 13 6.481 2.897 -21.903 106 HD3 LYS 13 HD1 LYS 13 6.166 4.500 -21.254 107 HE2 LYS 13 HE2 LYS 13 8.937 3.501 -21.974 108 HE3 LYS 13 HE1 LYS 13 7.917 4.444 -23.060 109 HZ1 LYS 13 HZ1 LYS 13 9.004 6.138 -22.069 110 HZ2 LYS 13 HZ2 LYS 13 9.320 5.267 -20.643 111 HZ3 LYS 13 HZ3 LYS 13 7.788 5.955 -20.901 112 H LEU 14 HN LEU 14 5.161 -1.397 -19.475 113 HA LEU 14 HA LEU 14 7.007 -3.053 -21.147 114 HB2 LEU 14 HB2 LEU 14 5.588 -3.961 -18.632 115 HB3 LEU 14 HB1 LEU 14 6.758 -4.869 -19.584 116 HG LEU 14 HG LEU 14 7.369 -2.268 -18.148 117 HD11 LEU 14 HD11 LEU 14 8.645 -3.741 -16.580 118 HD12 LEU 14 HD12 LEU 14 7.962 -5.148 -17.395 119 HD13 LEU 14 HD13 LEU 14 6.907 -4.031 -16.529 120 HD21 LEU 14 HD21 LEU 14 9.065 -4.253 -19.707 121 HD22 LEU 14 HD22 LEU 14 9.778 -3.141 -18.537 122 HD23 LEU 14 HD23 LEU 14 8.937 -2.511 -19.943 123 H THR 15 HN THR 15 6.116 -4.419 -22.565 124 HA THR 15 HA THR 15 3.159 -4.376 -22.833 125 HB THR 15 HB THR 15 5.290 -5.241 -24.806 126 HG1 THR 15 HG1 THR 15 5.388 -3.064 -24.566 127 HG21 THR 15 HG21 THR 15 3.316 -6.386 -25.446 128 HG22 THR 15 HG22 THR 15 3.257 -4.901 -26.390 129 HG23 THR 15 HG23 THR 15 2.269 -5.055 -24.941 130 H TYR 16 HN TYR 16 2.138 -6.393 -23.578 131 HA TYR 16 HA TYR 16 2.432 -8.487 -21.782 132 HB2 TYR 16 HB2 TYR 16 0.391 -8.347 -22.981 133 HB3 TYR 16 HB1 TYR 16 1.208 -8.307 -24.535 134 HD1 TYR 16 HD1 TYR 16 0.832 -10.546 -21.528 135 HD2 TYR 16 HD2 TYR 16 1.286 -10.318 -25.798 136 HE1 TYR 16 HE1 TYR 16 0.575 -13.001 -21.688 137 HE2 TYR 16 HE2 TYR 16 1.030 -12.773 -25.949 138 HH TYR 16 HH TYR 16 -0.288 -14.622 -23.821 139 H ALA 17 HN ALA 17 3.495 -8.520 -25.199 140 HA ALA 17 HA ALA 17 4.882 -10.952 -25.079 141 HB1 ALA 17 HB1 ALA 17 6.117 -10.101 -27.075 142 HB2 ALA 17 HB2 ALA 17 5.386 -8.520 -26.808 143 HB3 ALA 17 HB3 ALA 17 4.370 -9.905 -27.205 144 H GLU 18 HN GLU 18 6.062 -7.632 -24.532 145 HA GLU 18 HA GLU 18 8.775 -8.278 -24.132 146 HB2 GLU 18 HB2 GLU 18 7.092 -6.017 -23.021 147 HB3 GLU 18 HB1 GLU 18 8.844 -6.112 -22.836 148 HG2 GLU 18 HG2 GLU 18 9.141 -6.094 -25.255 149 HG3 GLU 18 HG1 GLU 18 7.397 -6.122 -25.501 150 H ALA 19 HN ALA 19 6.101 -7.977 -21.798 151 HA ALA 19 HA ALA 19 7.515 -8.410 -19.442 152 HB1 ALA 19 HB1 ALA 19 4.686 -9.150 -20.198 153 HB2 ALA 19 HB2 ALA 19 5.225 -7.695 -19.362 154 HB3 ALA 19 HB3 ALA 19 5.313 -9.261 -18.555 155 H LYS 20 HN LYS 20 6.481 -10.667 -21.897 156 HA LYS 20 HA LYS 20 6.818 -13.046 -20.357 157 HB2 LYS 20 HB2 LYS 20 5.501 -12.605 -22.570 158 HB3 LYS 20 HB1 LYS 20 7.036 -12.929 -23.367 159 HG2 LYS 20 HG2 LYS 20 7.154 -15.145 -22.346 160 HG3 LYS 20 HG1 LYS 20 5.713 -14.821 -21.388 161 HD2 LYS 20 HD2 LYS 20 4.931 -16.100 -23.232 162 HD3 LYS 20 HD1 LYS 20 4.476 -14.437 -23.589 163 HE2 LYS 20 HE2 LYS 20 7.105 -15.509 -24.643 164 HE3 LYS 20 HE1 LYS 20 5.600 -15.884 -25.477 165 HZ1 LYS 20 HZ1 LYS 20 5.920 -13.933 -26.465 166 HZ2 LYS 20 HZ2 LYS 20 7.018 -13.384 -25.289 167 HZ3 LYS 20 HZ3 LYS 20 5.344 -13.252 -25.023 168 H ALA 21 HN ALA 21 8.943 -11.036 -22.281 169 HA ALA 21 HA ALA 21 11.060 -12.904 -22.616 170 HB1 ALA 21 HB1 ALA 21 11.301 -9.892 -22.434 171 HB2 ALA 21 HB2 ALA 21 10.795 -10.756 -23.886 172 HB3 ALA 21 HB3 ALA 21 12.412 -11.008 -23.231 173 H VAL 22 HN VAL 22 10.557 -10.330 -20.203 174 HA VAL 22 HA VAL 22 12.938 -10.894 -18.729 175 HB VAL 22 HB VAL 22 11.843 -9.482 -16.954 176 HG11 VAL 22 HG11 VAL 22 11.774 -8.448 -19.808 177 HG12 VAL 22 HG12 VAL 22 13.167 -8.433 -18.729 178 HG13 VAL 22 HG13 VAL 22 11.763 -7.430 -18.367 179 HG21 VAL 22 HG21 VAL 22 9.686 -8.425 -17.526 180 HG22 VAL 22 HG22 VAL 22 9.505 -10.174 -17.416 181 HG23 VAL 22 HG23 VAL 22 9.597 -9.398 -18.991 182 H CYS 23 HN CYS 23 9.640 -12.070 -18.540 183 HA CYS 23 HA CYS 23 10.288 -13.717 -16.150 184 HB2 CYS 23 HB2 CYS 23 8.256 -12.176 -16.235 185 HB3 CYS 23 HB1 CYS 23 7.579 -13.281 -17.420 186 H GLU 24 HN GLU 24 8.988 -15.881 -16.252 187 HA GLU 24 HA GLU 24 8.807 -17.984 -17.153 188 HB2 GLU 24 HB2 GLU 24 7.305 -16.717 -18.762 189 HB3 GLU 24 HB1 GLU 24 8.682 -16.615 -19.854 190 HG2 GLU 24 HG2 GLU 24 8.805 -19.031 -20.019 191 HG3 GLU 24 HG1 GLU 24 7.564 -19.217 -18.790 192 H PHE 25 HN PHE 25 11.388 -15.980 -17.687 193 HA PHE 25 HA PHE 25 13.013 -17.316 -19.538 194 HB2 PHE 25 HB2 PHE 25 13.510 -15.092 -18.615 195 HB3 PHE 25 HB1 PHE 25 13.798 -15.804 -17.031 196 HD1 PHE 25 HD1 PHE 25 15.023 -15.640 -20.538 197 HD2 PHE 25 HD2 PHE 25 15.885 -16.916 -16.524 198 HE1 PHE 25 HE1 PHE 25 17.380 -16.065 -21.176 199 HE2 PHE 25 HE2 PHE 25 18.240 -17.342 -17.166 200 HZ PHE 25 HZ PHE 25 18.990 -16.917 -19.491 201 H GLU 26 HN GLU 26 12.697 -17.747 -16.027 202 HA GLU 26 HA GLU 26 14.525 -20.015 -16.019 203 HB2 GLU 26 HB2 GLU 26 13.920 -20.151 -13.593 204 HB3 GLU 26 HB1 GLU 26 14.601 -18.603 -14.077 205 HG2 GLU 26 HG2 GLU 26 11.600 -19.049 -13.988 206 HG3 GLU 26 HG1 GLU 26 12.500 -18.554 -12.560 207 H GLY 27 HN GLY 27 11.184 -19.492 -16.512 208 HA2 GLY 27 HA3 GLY 27 10.114 -21.554 -17.508 209 HA3 GLY 27 HA2 GLY 27 10.557 -22.370 -16.015 210 H GLY 28 HN GLY 28 9.922 -19.586 -14.719 211 HA2 GLY 28 HA3 GLY 28 7.399 -20.274 -13.693 212 HA3 GLY 28 HA2 GLY 28 8.142 -18.683 -13.570 213 H HIS 29 HN HIS 29 5.905 -17.934 -13.791 214 HA HIS 29 HA HIS 29 5.306 -17.250 -16.557 215 HB2 HIS 29 HB2 HIS 29 3.348 -18.859 -14.892 216 HB3 HIS 29 HB1 HIS 29 2.968 -18.073 -16.425 217 HD1 HIS 29 HD1 HIS 29 4.599 -18.859 -18.500 218 HD2 HIS 29 HD2 HIS 29 4.385 -21.410 -15.208 219 HE1 HIS 29 HE1 HIS 29 5.478 -21.103 -19.275 220 HE2 HIS 29 HE2 HIS 29 5.357 -22.670 -17.281 221 H LEU 30 HN LEU 30 3.962 -15.466 -16.752 222 HA LEU 30 HA LEU 30 4.096 -13.482 -14.813 223 HB2 LEU 30 HB2 LEU 30 1.867 -13.775 -16.846 224 HB3 LEU 30 HB1 LEU 30 2.427 -12.280 -16.104 225 HG LEU 30 HG LEU 30 4.172 -14.038 -17.867 226 HD11 LEU 30 HD11 LEU 30 2.263 -13.126 -19.141 227 HD12 LEU 30 HD12 LEU 30 3.773 -12.353 -19.624 228 HD13 LEU 30 HD13 LEU 30 2.649 -11.508 -18.559 229 HD21 LEU 30 HD21 LEU 30 5.502 -11.874 -18.015 230 HD22 LEU 30 HD22 LEU 30 5.515 -12.626 -16.428 231 HD23 LEU 30 HD23 LEU 30 4.475 -11.237 -16.732 232 H ALA 31 HN ALA 31 2.908 -12.891 -13.088 233 HA ALA 31 HA ALA 31 1.360 -14.694 -11.664 234 HB1 ALA 31 HB1 ALA 31 0.688 -12.830 -10.279 235 HB2 ALA 31 HB2 ALA 31 1.095 -11.682 -11.553 236 HB3 ALA 31 HB3 ALA 31 2.369 -12.601 -10.753 237 H THR 32 HN THR 32 -0.341 -15.695 -12.568 238 HA THR 32 HA THR 32 -2.269 -14.300 -14.231 239 HB THR 32 HB THR 32 -1.864 -16.546 -14.879 240 HG1 THR 32 HG1 THR 32 -4.082 -15.939 -14.799 241 HG21 THR 32 HG21 THR 32 -0.827 -17.424 -12.890 242 HG22 THR 32 HG22 THR 32 -2.209 -18.446 -13.280 243 HG23 THR 32 HG23 THR 32 -2.329 -17.260 -11.991 244 H TYR 33 HN TYR 33 -4.636 -14.657 -13.747 245 HA TYR 33 HA TYR 33 -5.410 -13.211 -11.493 246 HB2 TYR 33 HB2 TYR 33 -6.806 -13.499 -13.493 247 HB3 TYR 33 HB1 TYR 33 -7.004 -15.206 -13.117 248 HD1 TYR 33 HD2 TYR 33 -8.209 -15.896 -11.015 249 HD2 TYR 33 HD1 TYR 33 -8.143 -11.824 -12.388 250 HE1 TYR 33 HE2 TYR 33 -10.153 -15.374 -9.569 251 HE2 TYR 33 HE1 TYR 33 -10.093 -11.307 -10.946 252 HH TYR 33 HH TYR 33 -11.991 -12.577 -9.899 253 H LYS 34 HN LYS 34 -5.652 -16.729 -12.006 254 HA LYS 34 HA LYS 34 -6.667 -17.410 -9.483 255 HB2 LYS 34 HB2 LYS 34 -4.868 -18.966 -11.357 256 HB3 LYS 34 HB1 LYS 34 -5.662 -19.667 -9.947 257 HG2 LYS 34 HG2 LYS 34 -7.859 -19.085 -10.857 258 HG3 LYS 34 HG1 LYS 34 -7.096 -18.307 -12.246 259 HD2 LYS 34 HD2 LYS 34 -6.055 -20.479 -12.863 260 HD3 LYS 34 HD1 LYS 34 -6.894 -21.244 -11.513 261 HE2 LYS 34 HE2 LYS 34 -8.304 -19.763 -13.754 262 HE3 LYS 34 HE1 LYS 34 -8.071 -21.512 -13.721 263 HZ1 LYS 34 HZ1 LYS 34 -9.173 -21.435 -11.471 264 HZ2 LYS 34 HZ2 LYS 34 -10.178 -21.134 -12.806 265 HZ3 LYS 34 HZ3 LYS 34 -9.634 -19.846 -11.840 266 H GLN 35 HN GLN 35 -3.311 -17.069 -10.579 267 HA GLN 35 HA GLN 35 -2.136 -17.868 -8.109 268 HB2 GLN 35 HB2 GLN 35 -0.892 -17.959 -10.234 269 HB3 GLN 35 HB1 GLN 35 -0.966 -16.203 -10.358 270 HG2 GLN 35 HG2 GLN 35 1.214 -16.930 -9.488 271 HG3 GLN 35 HG1 GLN 35 0.348 -16.002 -8.273 272 HE21 GLN 35 HE21 GLN 35 1.367 -19.288 -9.176 273 HE22 GLN 35 HE22 GLN 35 1.106 -19.968 -7.643 274 H LEU 36 HN LEU 36 -3.011 -14.738 -9.517 275 HA LEU 36 HA LEU 36 -1.838 -13.139 -7.507 276 HB2 LEU 36 HB2 LEU 36 -3.542 -12.736 -9.833 277 HB3 LEU 36 HB1 LEU 36 -4.158 -11.759 -8.530 278 HG LEU 36 HG LEU 36 -1.228 -11.736 -9.349 279 HD11 LEU 36 HD11 LEU 36 -2.582 -11.010 -11.259 280 HD12 LEU 36 HD12 LEU 36 -1.764 -9.626 -10.546 281 HD13 LEU 36 HD13 LEU 36 -3.476 -9.897 -10.229 282 HD21 LEU 36 HD21 LEU 36 -2.966 -9.846 -7.721 283 HD22 LEU 36 HD22 LEU 36 -1.301 -9.507 -8.189 284 HD23 LEU 36 HD23 LEU 36 -1.655 -10.845 -7.102 285 H GLU 37 HN GLU 37 -5.104 -14.497 -7.842 286 HA GLU 37 HA GLU 37 -6.304 -13.285 -5.635 287 HB2 GLU 37 HB2 GLU 37 -7.490 -14.628 -7.354 288 HB3 GLU 37 HB1 GLU 37 -6.779 -16.089 -6.670 289 HG2 GLU 37 HG2 GLU 37 -7.887 -15.672 -4.537 290 HG3 GLU 37 HG1 GLU 37 -8.528 -14.145 -5.136 291 H ALA 38 HN ALA 38 -4.261 -16.162 -5.819 292 HA ALA 38 HA ALA 38 -4.621 -17.056 -3.164 293 HB1 ALA 38 HB1 ALA 38 -3.569 -18.398 -4.982 294 HB2 ALA 38 HB2 ALA 38 -2.598 -18.354 -3.509 295 HB3 ALA 38 HB3 ALA 38 -2.153 -17.351 -4.889 296 H ALA 39 HN ALA 39 -2.542 -14.612 -4.571 297 HA ALA 39 HA ALA 39 -0.912 -14.257 -2.209 298 HB1 ALA 39 HB1 ALA 39 -0.132 -13.739 -4.520 299 HB2 ALA 39 HB2 ALA 39 0.055 -12.390 -3.397 300 HB3 ALA 39 HB3 ALA 39 -1.270 -12.391 -4.563 301 H ARG 40 HN ARG 40 -3.633 -12.519 -3.684 302 HA ARG 40 HA ARG 40 -3.725 -10.327 -1.929 303 HB2 ARG 40 HB2 ARG 40 -6.082 -11.739 -3.190 304 HB3 ARG 40 HB1 ARG 40 -6.093 -10.114 -2.531 305 HG2 ARG 40 HG2 ARG 40 -4.320 -11.008 -4.814 306 HG3 ARG 40 HG1 ARG 40 -5.857 -10.195 -5.036 307 HD2 ARG 40 HD2 ARG 40 -3.323 -9.090 -3.790 308 HD3 ARG 40 HD1 ARG 40 -4.172 -8.520 -5.209 309 HE ARG 40 HE ARG 40 -5.858 -8.387 -2.910 310 HH11 ARG 40 HH21 ARG 40 -3.228 -6.894 -4.574 311 HH12 ARG 40 HH22 ARG 40 -3.477 -5.325 -3.856 312 HH21 ARG 40 HH11 ARG 40 -6.239 -6.358 -1.999 313 HH22 ARG 40 HH12 ARG 40 -5.210 -5.019 -2.398 314 H LYS 41 HN LYS 41 -4.746 -13.636 -1.451 315 HA LYS 41 HA LYS 41 -6.323 -13.140 0.890 316 HB2 LYS 41 HB2 LYS 41 -4.988 -15.637 -0.184 317 HB3 LYS 41 HB1 LYS 41 -5.964 -15.630 1.285 318 HG2 LYS 41 HG2 LYS 41 -7.885 -14.751 -0.008 319 HG3 LYS 41 HG1 LYS 41 -6.911 -14.811 -1.479 320 HD2 LYS 41 HD2 LYS 41 -6.643 -17.230 -1.246 321 HD3 LYS 41 HD1 LYS 41 -7.521 -17.205 0.282 322 HE2 LYS 41 HE2 LYS 41 -9.532 -16.371 -0.885 323 HE3 LYS 41 HE1 LYS 41 -8.656 -16.413 -2.414 324 HZ1 LYS 41 HZ1 LYS 41 -9.815 -18.415 -2.340 325 HZ2 LYS 41 HZ2 LYS 41 -9.460 -18.680 -0.699 326 HZ3 LYS 41 HZ3 LYS 41 -8.240 -18.841 -1.872 327 H ILE 42 HN ILE 42 -3.002 -12.956 0.315 328 HA ILE 42 HA ILE 42 -2.285 -13.542 3.135 329 HB ILE 42 HB ILE 42 -0.391 -13.089 0.812 330 HG12 ILE 42 HG12 ILE 42 -1.803 -14.966 0.213 331 HG13 ILE 42 HG11 ILE 42 -0.234 -15.586 0.710 332 HG21 ILE 42 HG21 ILE 42 1.078 -14.579 2.348 333 HG22 ILE 42 HG22 ILE 42 -0.091 -14.215 3.614 334 HG23 ILE 42 HG23 ILE 42 0.827 -12.916 2.857 335 HD11 ILE 42 HD11 ILE 42 -2.852 -15.678 2.211 336 HD12 ILE 42 HD12 ILE 42 -1.323 -15.861 3.066 337 HD13 ILE 42 HD13 ILE 42 -1.772 -17.005 1.805 338 H GLY 43 HN GLY 43 -3.497 -11.021 1.683 339 HA2 GLY 43 HA3 GLY 43 -3.529 -8.811 2.409 340 HA3 GLY 43 HA2 GLY 43 -2.062 -9.093 3.336 341 H PHE 44 HN PHE 44 -1.795 -10.222 0.146 342 HA PHE 44 HA PHE 44 0.301 -8.493 -0.522 343 HB2 PHE 44 HB2 PHE 44 -0.322 -10.768 -1.547 344 HB3 PHE 44 HB1 PHE 44 -1.475 -9.898 -2.536 345 HD1 PHE 44 HD1 PHE 44 2.123 -9.707 -1.488 346 HD2 PHE 44 HD2 PHE 44 -0.725 -9.120 -4.660 347 HE1 PHE 44 HE1 PHE 44 3.965 -9.145 -3.044 348 HE2 PHE 44 HE2 PHE 44 1.126 -8.558 -6.208 349 HZ PHE 44 HZ PHE 44 3.468 -8.570 -5.402 350 H HIS 45 HN HIS 45 -0.014 -6.341 -0.515 351 HA HIS 45 HA HIS 45 -2.419 -5.140 -1.666 352 HB2 HIS 45 HB2 HIS 45 -1.679 -4.195 0.398 353 HB3 HIS 45 HB1 HIS 45 -0.022 -4.061 -0.170 354 HD1 HIS 45 HD1 HIS 45 -3.443 -2.772 -1.312 355 HD2 HIS 45 HD2 HIS 45 0.504 -1.476 -1.009 356 HE1 HIS 45 HE1 HIS 45 -3.420 -0.372 -2.108 357 HE2 HIS 45 HE2 HIS 45 -1.018 0.434 -1.935 358 H VAL 46 HN VAL 46 -2.567 -4.321 -3.634 359 HA VAL 46 HA VAL 46 -0.112 -3.651 -5.171 360 HB VAL 46 HB VAL 46 -2.431 -5.269 -6.262 361 HG11 VAL 46 HG11 VAL 46 -1.425 -3.959 -8.013 362 HG12 VAL 46 HG12 VAL 46 -0.779 -5.587 -8.175 363 HG13 VAL 46 HG13 VAL 46 0.203 -4.319 -7.440 364 HG21 VAL 46 HG21 VAL 46 -0.793 -7.129 -6.332 365 HG22 VAL 46 HG22 VAL 46 -1.089 -6.595 -4.681 366 HG23 VAL 46 HG23 VAL 46 0.389 -6.108 -5.511 367 H CYS 47 HN CYS 47 -0.479 -2.232 -6.945 368 HA CYS 47 HA CYS 47 -3.061 -0.966 -7.300 369 HB2 CYS 47 HB2 CYS 47 -1.892 0.061 -5.195 370 HB3 CYS 47 HB1 CYS 47 -0.874 0.894 -6.367 371 H ALA 48 HN ALA 48 -1.571 -2.341 -9.121 372 HA ALA 48 HA ALA 48 -0.975 -0.245 -11.092 373 HB1 ALA 48 HB1 ALA 48 1.218 -0.599 -10.168 374 HB2 ALA 48 HB2 ALA 48 1.163 -1.422 -11.727 375 HB3 ALA 48 HB3 ALA 48 1.023 -2.349 -10.232 376 H ALA 49 HN ALA 49 -1.276 -0.890 -13.188 377 HA ALA 49 HA ALA 49 -2.664 -3.474 -13.570 378 HB1 ALA 49 HB1 ALA 49 -3.953 -1.546 -14.233 379 HB2 ALA 49 HB2 ALA 49 -3.441 -2.389 -15.694 380 HB3 ALA 49 HB3 ALA 49 -2.612 -0.917 -15.190 381 H GLY 50 HN GLY 50 -1.457 -5.072 -14.314 382 HA2 GLY 50 HA3 GLY 50 0.637 -4.500 -16.365 383 HA3 GLY 50 HA2 GLY 50 0.874 -5.648 -15.052 384 H TRP 51 HN TRP 51 1.135 -6.257 -17.772 385 HA TRP 51 HA TRP 51 -1.228 -7.616 -18.739 386 HB2 TRP 51 HB2 TRP 51 1.673 -7.647 -19.625 387 HB3 TRP 51 HB1 TRP 51 0.384 -8.512 -20.454 388 HD1 TRP 51 HD1 TRP 51 1.791 -5.053 -19.908 389 HE1 TRP 51 HE1 TRP 51 0.575 -3.397 -21.458 390 HE3 TRP 51 HE3 TRP 51 -1.929 -8.059 -21.674 391 HZ2 TRP 51 HZ2 TRP 51 -1.674 -3.350 -23.227 392 HZ3 TRP 51 HZ3 TRP 51 -3.592 -7.193 -23.290 393 HH2 TRP 51 HH2 TRP 51 -3.470 -4.846 -24.071 394 H MET 52 HN MET 52 -1.902 -9.343 -17.599 395 HA MET 52 HA MET 52 0.064 -11.262 -16.499 396 HB2 MET 52 HB2 MET 52 -2.939 -11.217 -16.121 397 HB3 MET 52 HB1 MET 52 -1.772 -12.197 -15.259 398 HG2 MET 52 HG2 MET 52 -1.058 -10.425 -13.917 399 HG3 MET 52 HG1 MET 52 -1.351 -9.219 -15.159 400 HE1 MET 52 HE1 MET 52 -4.489 -11.735 -14.395 401 HE2 MET 52 HE2 MET 52 -4.578 -11.329 -12.687 402 HE3 MET 52 HE3 MET 52 -3.098 -12.009 -13.341 403 H ALA 53 HN ALA 53 -0.858 -13.599 -16.590 404 HA ALA 53 HA ALA 53 -0.491 -14.764 -18.985 405 HB1 ALA 53 HB1 ALA 53 -2.575 -15.580 -16.952 406 HB2 ALA 53 HB2 ALA 53 -0.883 -16.080 -16.995 407 HB3 ALA 53 HB3 ALA 53 -1.991 -16.612 -18.258 408 H LYS 54 HN LYS 54 -1.610 -15.307 -20.820 409 HA LYS 54 HA LYS 54 -3.067 -15.045 -22.550 410 HB2 LYS 54 HB2 LYS 54 -4.591 -16.068 -20.703 411 HB3 LYS 54 HB1 LYS 54 -5.243 -14.444 -20.525 412 HG2 LYS 54 HG2 LYS 54 -5.911 -14.423 -22.890 413 HG3 LYS 54 HG1 LYS 54 -5.167 -15.999 -23.138 414 HD2 LYS 54 HD2 LYS 54 -6.727 -16.985 -21.492 415 HD3 LYS 54 HD1 LYS 54 -7.482 -15.406 -21.274 416 HE2 LYS 54 HE2 LYS 54 -8.104 -15.356 -23.655 417 HE3 LYS 54 HE1 LYS 54 -7.324 -16.918 -23.899 418 HZ1 LYS 54 HZ1 LYS 54 -9.837 -16.854 -23.481 419 HZ2 LYS 54 HZ2 LYS 54 -9.422 -16.594 -21.854 420 HZ3 LYS 54 HZ3 LYS 54 -8.912 -18.006 -22.650 421 H GLY 55 HN GLY 55 -1.895 -12.643 -20.893 422 HA2 GLY 55 HA3 GLY 55 -1.662 -10.408 -21.358 423 HA3 GLY 55 HA2 GLY 55 -2.784 -10.608 -22.695 424 H ARG 56 HN ARG 56 -3.921 -11.732 -19.664 425 HA ARG 56 HA ARG 56 -6.042 -9.785 -19.623 426 HB2 ARG 56 HB2 ARG 56 -6.308 -12.154 -18.863 427 HB3 ARG 56 HB1 ARG 56 -5.261 -11.796 -17.501 428 HG2 ARG 56 HG2 ARG 56 -6.814 -10.218 -16.583 429 HG3 ARG 56 HG1 ARG 56 -7.796 -10.234 -18.044 430 HD2 ARG 56 HD2 ARG 56 -8.442 -12.531 -17.669 431 HD3 ARG 56 HD1 ARG 56 -7.336 -12.669 -16.301 432 HE ARG 56 HE ARG 56 -8.936 -10.648 -15.503 433 HH11 ARG 56 HH21 ARG 56 -9.637 -13.711 -16.959 434 HH12 ARG 56 HH22 ARG 56 -11.103 -13.959 -16.057 435 HH21 ARG 56 HH11 ARG 56 -10.861 -10.947 -14.342 436 HH22 ARG 56 HH12 ARG 56 -11.804 -12.383 -14.588 437 H VAL 57 HN VAL 57 -6.248 -7.970 -18.423 438 HA VAL 57 HA VAL 57 -3.886 -7.069 -16.891 439 HB VAL 57 HB VAL 57 -4.771 -5.554 -18.616 440 HG11 VAL 57 HG11 VAL 57 -7.279 -5.543 -16.897 441 HG12 VAL 57 HG12 VAL 57 -7.145 -6.229 -18.515 442 HG13 VAL 57 HG13 VAL 57 -6.983 -4.490 -18.272 443 HG21 VAL 57 HG21 VAL 57 -5.356 -4.463 -15.841 444 HG22 VAL 57 HG22 VAL 57 -4.819 -3.565 -17.259 445 HG23 VAL 57 HG23 VAL 57 -3.724 -4.700 -16.474 446 H GLY 58 HN GLY 58 -4.095 -6.154 -14.795 447 HA2 GLY 58 HA3 GLY 58 -6.553 -6.370 -13.302 448 HA3 GLY 58 HA2 GLY 58 -5.406 -7.646 -12.910 449 H TYR 59 HN TYR 59 -6.503 -5.172 -11.492 450 HA TYR 59 HA TYR 59 -3.943 -4.419 -10.260 451 HB2 TYR 59 HB2 TYR 59 -4.429 -2.010 -10.350 452 HB3 TYR 59 HB1 TYR 59 -4.202 -2.689 -11.953 453 HD1 TYR 59 HD2 TYR 59 -6.281 -3.351 -13.309 454 HD2 TYR 59 HD1 TYR 59 -6.453 -0.845 -9.821 455 HE1 TYR 59 HE2 TYR 59 -8.492 -2.488 -14.032 456 HE2 TYR 59 HE1 TYR 59 -8.658 0.018 -10.550 457 HH TYR 59 HH TYR 59 -10.120 -1.033 -13.622 458 HA PRO 60 HA PRO 60 -7.506 -5.165 -7.345 459 HB2 PRO 60 HB2 PRO 60 -5.301 -6.582 -5.894 460 HB3 PRO 60 HB1 PRO 60 -6.963 -7.124 -6.190 461 HG2 PRO 60 HG2 PRO 60 -4.949 -8.197 -7.551 462 HG3 PRO 60 HG1 PRO 60 -6.479 -7.818 -8.370 463 HD2 PRO 60 HD2 PRO 60 -3.896 -6.248 -8.409 464 HD3 PRO 60 HD1 PRO 60 -4.990 -6.642 -9.756 465 H ILE 61 HN ILE 61 -7.935 -3.959 -5.565 466 HA ILE 61 HA ILE 61 -5.705 -2.505 -4.231 467 HB ILE 61 HB ILE 61 -8.312 -1.279 -5.164 468 HG12 ILE 61 HG12 ILE 61 -5.478 -0.648 -6.054 469 HG13 ILE 61 HG11 ILE 61 -6.552 -1.720 -6.944 470 HG21 ILE 61 HG21 ILE 61 -7.199 0.842 -4.353 471 HG22 ILE 61 HG22 ILE 61 -5.953 -0.164 -3.619 472 HG23 ILE 61 HG23 ILE 61 -7.621 -0.278 -3.064 473 HD11 ILE 61 HD11 ILE 61 -7.219 1.145 -6.258 474 HD12 ILE 61 HD12 ILE 61 -8.170 0.051 -7.265 475 HD13 ILE 61 HD13 ILE 61 -6.591 0.610 -7.816 476 H VAL 62 HN VAL 62 -5.786 -2.640 -2.105 477 HA VAL 62 HA VAL 62 -7.781 -4.120 -0.742 478 HB VAL 62 HB VAL 62 -5.715 -2.206 0.363 479 HG11 VAL 62 HG11 VAL 62 -7.383 -2.592 2.064 480 HG12 VAL 62 HG12 VAL 62 -6.015 -3.628 2.450 481 HG13 VAL 62 HG13 VAL 62 -7.450 -4.310 1.687 482 HG21 VAL 62 HG21 VAL 62 -4.701 -4.013 -0.922 483 HG22 VAL 62 HG22 VAL 62 -5.690 -5.204 -0.083 484 HG23 VAL 62 HG23 VAL 62 -4.448 -4.315 0.796 485 H LYS 63 HN LYS 63 -7.172 -0.638 -1.031 486 HA LYS 63 HA LYS 63 -9.854 0.122 -0.867 487 HB2 LYS 63 HB2 LYS 63 -10.107 -0.351 1.402 488 HB3 LYS 63 HB1 LYS 63 -8.414 -0.061 1.761 489 HG2 LYS 63 HG2 LYS 63 -8.716 2.331 1.711 490 HG3 LYS 63 HG1 LYS 63 -10.315 2.176 0.992 491 HD2 LYS 63 HD2 LYS 63 -10.560 2.697 3.352 492 HD3 LYS 63 HD1 LYS 63 -11.097 1.042 3.082 493 HE2 LYS 63 HE2 LYS 63 -9.110 0.133 4.044 494 HE3 LYS 63 HE1 LYS 63 -8.261 1.677 3.952 495 HZ1 LYS 63 HZ1 LYS 63 -9.388 0.826 6.164 496 HZ2 LYS 63 HZ2 LYS 63 -10.739 1.604 5.488 497 HZ3 LYS 63 HZ3 LYS 63 -9.307 2.474 5.771 498 HA PRO 64 HA PRO 64 -7.085 4.046 -0.551 499 HB2 PRO 64 HB2 PRO 64 -4.353 3.719 -0.524 500 HB3 PRO 64 HB1 PRO 64 -5.331 3.761 0.961 501 HG2 PRO 64 HG2 PRO 64 -4.387 1.363 -0.587 502 HG3 PRO 64 HG1 PRO 64 -4.236 1.690 1.153 503 HD2 PRO 64 HD2 PRO 64 -6.200 0.125 0.282 504 HD3 PRO 64 HD1 PRO 64 -6.539 1.316 1.550 505 H GLY 65 HN GLY 65 -6.542 5.196 -2.368 506 HA2 GLY 65 HA3 GLY 65 -5.112 4.029 -4.583 507 HA3 GLY 65 HA2 GLY 65 -6.844 4.149 -4.879 508 HA PRO 66 HA PRO 66 -5.661 8.744 -4.290 509 HB2 PRO 66 HB2 PRO 66 -3.113 9.384 -3.456 510 HB3 PRO 66 HB1 PRO 66 -4.432 9.012 -2.321 511 HG2 PRO 66 HG2 PRO 66 -2.274 7.191 -3.352 512 HG3 PRO 66 HG1 PRO 66 -2.826 7.433 -1.679 513 HD2 PRO 66 HD2 PRO 66 -3.698 5.320 -3.129 514 HD3 PRO 66 HD1 PRO 66 -4.789 6.166 -2.005 515 H ASN 67 HN ASN 67 -2.681 7.007 -5.215 516 HA ASN 67 HA ASN 67 -2.263 8.757 -7.529 517 HB2 ASN 67 HB2 ASN 67 -0.206 7.465 -7.839 518 HB3 ASN 67 HB1 ASN 67 -0.336 8.050 -6.182 519 HD21 ASN 67 HD21 ASN 67 1.176 5.663 -7.124 520 HD22 ASN 67 HD22 ASN 67 0.510 4.337 -6.301 521 H CYS 68 HN CYS 68 -3.502 5.584 -6.796 522 HA CYS 68 HA CYS 68 -4.212 5.202 -9.648 523 HB2 CYS 68 HB2 CYS 68 -3.654 2.653 -9.129 524 HB3 CYS 68 HB1 CYS 68 -2.371 3.752 -9.628 525 H GLY 69 HN GLY 69 -6.145 4.194 -9.984 526 HA2 GLY 69 HA3 GLY 69 -8.164 3.159 -9.512 527 HA3 GLY 69 HA2 GLY 69 -7.607 2.868 -7.870 528 H PHE 70 HN PHE 70 -10.199 3.776 -8.605 529 HA PHE 70 HA PHE 70 -10.398 6.131 -6.910 530 HB2 PHE 70 HB2 PHE 70 -11.235 6.226 -9.823 531 HB3 PHE 70 HB1 PHE 70 -11.727 7.409 -8.612 532 HD1 PHE 70 HD2 PHE 70 -10.014 8.818 -7.459 533 HD2 PHE 70 HD1 PHE 70 -9.005 6.271 -10.770 534 HE1 PHE 70 HE2 PHE 70 -7.890 10.059 -7.767 535 HE2 PHE 70 HE1 PHE 70 -6.882 7.513 -11.076 536 HZ PHE 70 HZ PHE 70 -6.324 9.406 -9.578 537 H GLY 71 HN GLY 71 -11.815 5.240 -5.516 538 HA2 GLY 71 HA3 GLY 71 -13.908 4.668 -4.718 539 HA3 GLY 71 HA2 GLY 71 -14.537 4.778 -6.360 540 H LYS 72 HN LYS 72 -12.828 2.963 -7.623 541 HA LYS 72 HA LYS 72 -14.112 0.487 -6.992 542 HB2 LYS 72 HB2 LYS 72 -11.683 0.956 -8.738 543 HB3 LYS 72 HB1 LYS 72 -12.745 -0.444 -8.776 544 HG2 LYS 72 HG2 LYS 72 -13.673 2.380 -9.369 545 HG3 LYS 72 HG1 LYS 72 -13.166 1.242 -10.611 546 HD2 LYS 72 HD2 LYS 72 -14.954 -0.340 -9.798 547 HD3 LYS 72 HD1 LYS 72 -15.515 0.928 -8.712 548 HE2 LYS 72 HE2 LYS 72 -15.950 2.417 -10.585 549 HE3 LYS 72 HE1 LYS 72 -15.308 1.225 -11.714 550 HZ1 LYS 72 HZ1 LYS 72 -17.079 -0.219 -11.308 551 HZ2 LYS 72 HZ2 LYS 72 -17.811 1.311 -11.409 552 HZ3 LYS 72 HZ3 LYS 72 -17.550 0.589 -9.894 553 H THR 73 HN THR 73 -13.363 -1.309 -5.983 554 HA THR 73 HA THR 73 -10.632 -1.355 -4.903 555 HB THR 73 HB THR 73 -11.397 -1.879 -2.642 556 HG1 THR 73 HG1 THR 73 -13.963 -0.997 -3.168 557 HG21 THR 73 HG21 THR 73 -10.941 0.493 -3.338 558 HG22 THR 73 HG22 THR 73 -12.065 0.345 -1.989 559 HG23 THR 73 HG23 THR 73 -12.674 0.690 -3.607 560 H GLY 74 HN GLY 74 -10.199 -3.463 -3.791 561 HA2 GLY 74 HA3 GLY 74 -10.060 -5.762 -3.895 562 HA3 GLY 74 HA2 GLY 74 -11.790 -5.752 -4.215 563 H ILE 75 HN ILE 75 -9.779 -7.487 -5.363 564 HA ILE 75 HA ILE 75 -8.713 -7.126 -7.800 565 HB ILE 75 HB ILE 75 -10.657 -9.368 -7.198 566 HG12 ILE 75 HG12 ILE 75 -7.631 -9.322 -6.893 567 HG13 ILE 75 HG11 ILE 75 -8.731 -8.996 -5.556 568 HG21 ILE 75 HG21 ILE 75 -10.183 -9.349 -9.567 569 HG22 ILE 75 HG22 ILE 75 -9.161 -10.596 -8.862 570 HG23 ILE 75 HG23 ILE 75 -8.471 -9.031 -9.282 571 HD11 ILE 75 HD11 ILE 75 -7.905 -11.409 -5.769 572 HD12 ILE 75 HD12 ILE 75 -8.918 -11.532 -7.206 573 HD13 ILE 75 HD13 ILE 75 -9.649 -11.195 -5.636 574 H ILE 76 HN ILE 76 -9.243 -6.257 -9.696 575 HA ILE 76 HA ILE 76 -12.114 -5.842 -10.371 576 HB ILE 76 HB ILE 76 -9.686 -4.318 -11.334 577 HG12 ILE 76 HG12 ILE 76 -10.084 -3.947 -8.920 578 HG13 ILE 76 HG11 ILE 76 -10.435 -2.505 -9.857 579 HG21 ILE 76 HG21 ILE 76 -11.458 -4.206 -12.958 580 HG22 ILE 76 HG22 ILE 76 -11.466 -2.681 -12.076 581 HG23 ILE 76 HG23 ILE 76 -12.665 -3.920 -11.706 582 HD11 ILE 76 HD11 ILE 76 -12.207 -2.715 -8.270 583 HD12 ILE 76 HD12 ILE 76 -12.423 -4.422 -8.603 584 HD13 ILE 76 HD13 ILE 76 -12.902 -3.226 -9.801 585 H ASP 77 HN ASP 77 -12.902 -6.894 -12.043 586 HA ASP 77 HA ASP 77 -11.091 -8.340 -13.859 587 HB2 ASP 77 HB2 ASP 77 -13.027 -9.479 -12.714 588 HB3 ASP 77 HB1 ASP 77 -14.109 -8.490 -13.688 589 H TYR 78 HN TYR 78 -10.413 -7.123 -15.481 590 HA TYR 78 HA TYR 78 -12.217 -5.177 -16.772 591 HB2 TYR 78 HB2 TYR 78 -9.502 -5.088 -16.129 592 HB3 TYR 78 HB1 TYR 78 -9.454 -5.447 -17.850 593 HD1 TYR 78 HD1 TYR 78 -10.487 -3.001 -15.287 594 HD2 TYR 78 HD2 TYR 78 -10.307 -3.834 -19.498 595 HE1 TYR 78 HE1 TYR 78 -10.991 -0.629 -15.775 596 HE2 TYR 78 HE2 TYR 78 -10.808 -1.455 -19.987 597 HH TYR 78 HH TYR 78 -11.986 0.464 -18.752 598 H GLY 79 HN GLY 79 -11.090 -8.369 -17.171 599 HA2 GLY 79 HA3 GLY 79 -11.878 -9.896 -18.771 600 HA3 GLY 79 HA2 GLY 79 -12.390 -8.559 -19.793 601 H ILE 80 HN ILE 80 -10.872 -7.563 -21.165 602 HA ILE 80 HA ILE 80 -8.123 -8.521 -21.269 603 HB ILE 80 HB ILE 80 -9.979 -9.064 -23.622 604 HG12 ILE 80 HG12 ILE 80 -8.610 -10.978 -21.677 605 HG13 ILE 80 HG11 ILE 80 -10.343 -10.733 -21.853 606 HG21 ILE 80 HG21 ILE 80 -7.953 -10.096 -24.629 607 HG22 ILE 80 HG22 ILE 80 -7.021 -9.643 -23.208 608 HG23 ILE 80 HG23 ILE 80 -7.670 -8.403 -24.272 609 HD11 ILE 80 HD11 ILE 80 -8.481 -11.970 -23.873 610 HD12 ILE 80 HD12 ILE 80 -10.134 -11.484 -24.247 611 HD13 ILE 80 HD13 ILE 80 -9.833 -12.732 -23.040 612 H ARG 81 HN ARG 81 -6.790 -7.095 -22.251 613 HA ARG 81 HA ARG 81 -8.011 -4.572 -23.254 614 HB2 ARG 81 HB2 ARG 81 -5.198 -5.121 -22.276 615 HB3 ARG 81 HB1 ARG 81 -5.791 -3.565 -22.845 616 HG2 ARG 81 HG2 ARG 81 -7.205 -4.998 -20.582 617 HG3 ARG 81 HG1 ARG 81 -5.764 -4.035 -20.262 618 HD2 ARG 81 HD2 ARG 81 -8.197 -2.920 -21.700 619 HD3 ARG 81 HD1 ARG 81 -7.962 -2.807 -19.965 620 HE ARG 81 HE ARG 81 -5.666 -1.809 -21.283 621 HH11 ARG 81 HH21 ARG 81 -9.001 -1.124 -20.676 622 HH12 ARG 81 HH22 ARG 81 -8.811 0.594 -20.758 623 HH21 ARG 81 HH11 ARG 81 -5.409 0.450 -21.422 624 HH22 ARG 81 HH12 ARG 81 -6.774 1.487 -21.183 625 H LEU 82 HN LEU 82 -8.122 -4.321 -25.341 626 HA LEU 82 HA LEU 82 -6.544 -5.927 -27.174 627 HB2 LEU 82 HB2 LEU 82 -7.947 -5.075 -28.888 628 HB3 LEU 82 HB1 LEU 82 -8.995 -5.298 -27.495 629 HG LEU 82 HG LEU 82 -7.819 -2.662 -28.463 630 HD11 LEU 82 HD11 LEU 82 -9.689 -3.541 -29.799 631 HD12 LEU 82 HD12 LEU 82 -10.171 -2.105 -28.898 632 HD13 LEU 82 HD13 LEU 82 -10.660 -3.702 -28.337 633 HD21 LEU 82 HD21 LEU 82 -9.359 -1.710 -26.660 634 HD22 LEU 82 HD22 LEU 82 -7.927 -2.532 -26.054 635 HD23 LEU 82 HD23 LEU 82 -9.493 -3.347 -26.022 636 H ASN 83 HN ASN 83 -5.981 -3.104 -25.511 637 HA ASN 83 HA ASN 83 -4.604 -1.602 -27.547 638 HB2 ASN 83 HB2 ASN 83 -3.913 -0.140 -25.720 639 HB3 ASN 83 HB1 ASN 83 -5.639 -0.478 -25.622 640 HD21 ASN 83 HD21 ASN 83 -5.434 0.089 -23.273 641 HD22 ASN 83 HD22 ASN 83 -4.833 -1.072 -22.191 642 H ARG 84 HN ARG 84 -3.804 -4.451 -26.950 643 HA ARG 84 HA ARG 84 -1.393 -4.719 -25.627 644 HB2 ARG 84 HB2 ARG 84 -0.857 -6.526 -27.313 645 HB3 ARG 84 HB1 ARG 84 -2.443 -6.676 -26.562 646 HG2 ARG 84 HG2 ARG 84 -3.445 -5.510 -28.535 647 HG3 ARG 84 HG1 ARG 84 -1.855 -5.487 -29.291 648 HD2 ARG 84 HD2 ARG 84 -3.268 -8.013 -28.404 649 HD3 ARG 84 HD1 ARG 84 -3.349 -7.380 -30.045 650 HE ARG 84 HE ARG 84 -1.146 -8.808 -28.858 651 HH11 ARG 84 HH21 ARG 84 -1.988 -6.329 -31.115 652 HH12 ARG 84 HH22 ARG 84 -0.675 -6.674 -32.196 653 HH21 ARG 84 HH11 ARG 84 0.556 -9.290 -30.282 654 HH22 ARG 84 HH12 ARG 84 0.760 -8.352 -31.722 655 H SER 85 HN SER 85 -1.998 -2.705 -28.281 656 HA SER 85 HA SER 85 0.677 -2.731 -29.406 657 HB2 SER 85 HB2 SER 85 -0.136 -0.903 -30.799 658 HB3 SER 85 HB1 SER 85 -1.323 -2.204 -30.775 659 HG SER 85 HG SER 85 -1.859 -0.645 -28.728 660 H GLU 86 HN GLU 86 -0.697 -1.457 -26.640 661 HA GLU 86 HA GLU 86 1.061 0.907 -26.525 662 HB2 GLU 86 HB2 GLU 86 -1.534 0.713 -25.856 663 HB3 GLU 86 HB1 GLU 86 -0.859 0.200 -24.316 664 HG2 GLU 86 HG2 GLU 86 -1.089 2.564 -24.119 665 HG3 GLU 86 HG1 GLU 86 0.621 2.322 -24.451 666 H ARG 87 HN ARG 87 1.055 0.834 -23.605 667 HA ARG 87 HA ARG 87 2.692 -1.530 -22.934 668 HB2 ARG 87 HB2 ARG 87 3.705 1.315 -22.634 669 HB3 ARG 87 HB1 ARG 87 4.495 -0.137 -22.031 670 HG2 ARG 87 HG2 ARG 87 4.681 -0.997 -24.349 671 HG3 ARG 87 HG1 ARG 87 3.947 0.490 -24.941 672 HD2 ARG 87 HD2 ARG 87 5.784 1.800 -23.964 673 HD3 ARG 87 HD1 ARG 87 6.523 0.320 -23.368 674 HE ARG 87 HE ARG 87 7.253 -0.158 -25.534 675 HH11 ARG 87 HH21 ARG 87 4.900 2.371 -25.528 676 HH12 ARG 87 HH22 ARG 87 5.208 2.859 -27.161 677 HH21 ARG 87 HH11 ARG 87 7.658 0.454 -27.692 678 HH22 ARG 87 HH12 ARG 87 6.766 1.767 -28.394 679 H TRP 88 HN TRP 88 2.806 -1.984 -20.764 680 HA TRP 88 HA TRP 88 1.603 -0.201 -18.786 681 HB2 TRP 88 HB2 TRP 88 0.356 -2.877 -19.430 682 HB3 TRP 88 HB1 TRP 88 -0.015 -1.925 -18.006 683 HD1 TRP 88 HD1 TRP 88 -0.351 -1.835 -21.828 684 HE1 TRP 88 HE1 TRP 88 -2.223 -0.169 -22.440 685 HE3 TRP 88 HE3 TRP 88 -1.371 0.083 -17.208 686 HZ2 TRP 88 HZ2 TRP 88 -3.930 1.723 -21.138 687 HZ3 TRP 88 HZ3 TRP 88 -3.125 1.810 -16.921 688 HH2 TRP 88 HH2 TRP 88 -4.405 2.631 -18.879 689 H ASP 89 HN ASP 89 1.462 -1.550 -16.604 690 HA ASP 89 HA ASP 89 4.086 -2.208 -15.869 691 HB2 ASP 89 HB2 ASP 89 2.120 -1.482 -14.386 692 HB3 ASP 89 HB1 ASP 89 1.609 -3.164 -14.409 693 H ALA 90 HN ALA 90 4.097 -4.501 -14.433 694 HA ALA 90 HA ALA 90 3.093 -6.777 -15.862 695 HB1 ALA 90 HB1 ALA 90 5.162 -7.628 -16.771 696 HB2 ALA 90 HB2 ALA 90 6.063 -6.258 -16.119 697 HB3 ALA 90 HB3 ALA 90 4.895 -6.010 -17.418 698 H TYR 91 HN TYR 91 3.536 -8.735 -14.817 699 HA TYR 91 HA TYR 91 4.960 -8.569 -12.205 700 HB2 TYR 91 HB2 TYR 91 2.345 -9.974 -12.814 701 HB3 TYR 91 HB1 TYR 91 3.226 -10.075 -11.292 702 HD1 TYR 91 HD1 TYR 91 1.269 -7.862 -13.519 703 HD2 TYR 91 HD2 TYR 91 3.257 -8.200 -9.723 704 HE1 TYR 91 HE1 TYR 91 0.152 -5.788 -12.746 705 HE2 TYR 91 HE2 TYR 91 2.138 -6.125 -8.954 706 HH TYR 91 HH TYR 91 -0.465 -4.890 -10.167 707 H CYS 92 HN CYS 92 5.726 -10.598 -11.415 708 HA CYS 92 HA CYS 92 5.800 -12.886 -13.228 709 HB2 CYS 92 HB2 CYS 92 7.611 -11.476 -14.081 710 HB3 CYS 92 HB1 CYS 92 8.364 -11.451 -12.493 711 H TYR 93 HN TYR 93 6.453 -14.782 -12.265 712 HA TYR 93 HA TYR 93 7.033 -14.752 -9.364 713 HB2 TYR 93 HB2 TYR 93 4.655 -14.896 -9.383 714 HB3 TYR 93 HB1 TYR 93 4.654 -16.022 -10.729 715 HD1 TYR 93 HD1 TYR 93 6.281 -15.792 -7.342 716 HD2 TYR 93 HD2 TYR 93 4.115 -18.250 -10.128 717 HE1 TYR 93 HE1 TYR 93 6.309 -17.663 -5.719 718 HE2 TYR 93 HE2 TYR 93 4.147 -20.115 -8.503 719 HH TYR 93 HH TYR 93 4.833 -19.749 -5.291 720 H ASN 94 HN ASN 94 8.023 -16.603 -8.590 721 HA ASN 94 HA ASN 94 8.666 -18.781 -10.445 722 HB2 ASN 94 HB2 ASN 94 10.704 -16.819 -9.380 723 HB3 ASN 94 HB1 ASN 94 11.176 -18.441 -9.886 724 HD21 ASN 94 HD21 ASN 94 11.101 -15.357 -11.048 725 HD22 ASN 94 HD22 ASN 94 10.858 -15.675 -12.698 726 HA PRO 95 HA PRO 95 8.580 -21.056 -6.615 727 HB2 PRO 95 HB2 PRO 95 9.940 -23.327 -7.291 728 HB3 PRO 95 HB1 PRO 95 8.349 -22.944 -7.986 729 HG2 PRO 95 HG2 PRO 95 11.073 -22.452 -9.158 730 HG3 PRO 95 HG1 PRO 95 9.653 -23.204 -9.920 731 HD2 PRO 95 HD2 PRO 95 10.251 -20.591 -10.351 732 HD3 PRO 95 HD1 PRO 95 8.563 -21.143 -10.233 733 H HIS 96 HN HIS 96 11.447 -19.820 -7.940 734 HA HIS 96 HA HIS 96 12.784 -19.878 -5.332 735 HB2 HIS 96 HB2 HIS 96 14.887 -20.777 -6.273 736 HB3 HIS 96 HB1 HIS 96 13.580 -21.958 -6.359 737 HD1 HIS 96 HD1 HIS 96 12.903 -22.784 -8.656 738 HD2 HIS 96 HD2 HIS 96 15.459 -19.496 -8.840 739 HE1 HIS 96 HE1 HIS 96 13.512 -22.485 -11.097 740 HE2 HIS 96 HE2 HIS 96 15.070 -20.485 -11.224 741 H ALA 97 HN ALA 97 14.779 -18.537 -5.363 742 HA ALA 97 HA ALA 97 15.726 -16.471 -5.697 743 HB1 ALA 97 HB1 ALA 97 16.540 -17.666 -7.709 744 HB2 ALA 97 HB2 ALA 97 16.312 -15.942 -8.006 745 HB3 ALA 97 HB3 ALA 97 15.123 -17.102 -8.597 746 H LYS 98 HN LYS 98 15.310 -14.351 -7.241 747 HA LYS 98 HA LYS 98 12.434 -13.786 -7.474 748 HB2 LYS 98 HB2 LYS 98 14.219 -12.318 -5.505 749 HB3 LYS 98 HB1 LYS 98 12.708 -11.654 -6.114 750 HG2 LYS 98 HG2 LYS 98 11.507 -13.665 -5.238 751 HG3 LYS 98 HG1 LYS 98 13.029 -14.245 -4.570 752 HD2 LYS 98 HD2 LYS 98 12.107 -13.151 -2.703 753 HD3 LYS 98 HD1 LYS 98 13.118 -11.880 -3.383 754 HE2 LYS 98 HE2 LYS 98 10.921 -10.969 -2.835 755 HE3 LYS 98 HE1 LYS 98 11.099 -10.987 -4.585 756 HZ1 LYS 98 HZ1 LYS 98 9.805 -12.954 -4.731 757 HZ2 LYS 98 HZ2 LYS 98 8.945 -11.862 -3.754 758 HZ3 LYS 98 HZ3 LYS 98 9.790 -13.155 -3.049 Start of MODEL 11 1 H1 GLY 1 H1 GLY 1 5.420 -18.184 -4.313 2 H2 GLY 1 H2 GLY 1 6.492 -17.586 -3.138 3 H3 GLY 1 H3 GLY 1 6.658 -17.113 -4.761 4 HA2 GLY 1 HA3 GLY 1 4.054 -16.564 -3.658 5 HA3 GLY 1 HA2 GLY 1 5.371 -15.696 -2.864 6 H VAL 2 HN VAL 2 3.451 -14.351 -4.343 7 HA VAL 2 HA VAL 2 4.449 -13.812 -7.019 8 HB VAL 2 HB VAL 2 2.347 -12.278 -5.466 9 HG11 VAL 2 HG11 VAL 2 1.496 -11.827 -7.771 10 HG12 VAL 2 HG12 VAL 2 2.901 -12.664 -8.429 11 HG13 VAL 2 HG13 VAL 2 3.113 -11.171 -7.511 12 HG21 VAL 2 HG21 VAL 2 1.741 -14.641 -5.447 13 HG22 VAL 2 HG22 VAL 2 2.094 -14.774 -7.170 14 HG23 VAL 2 HG23 VAL 2 0.729 -13.800 -6.622 15 H TYR 3 HN TYR 3 5.363 -11.910 -7.737 16 HA TYR 3 HA TYR 3 6.320 -9.966 -5.700 17 HB2 TYR 3 HB2 TYR 3 8.103 -11.629 -6.134 18 HB3 TYR 3 HB1 TYR 3 8.040 -11.230 -7.849 19 HD1 TYR 3 HD1 TYR 3 8.741 -9.859 -4.455 20 HD2 TYR 3 HD2 TYR 3 9.130 -9.246 -8.695 21 HE1 TYR 3 HE1 TYR 3 10.290 -7.966 -4.042 22 HE2 TYR 3 HE2 TYR 3 10.676 -7.354 -8.277 23 HH TYR 3 HH TYR 3 11.189 -5.759 -6.473 24 H HIS 4 HN HIS 4 6.210 -7.913 -6.314 25 HA HIS 4 HA HIS 4 4.905 -7.255 -8.795 26 HB2 HIS 4 HB2 HIS 4 5.067 -4.927 -8.029 27 HB3 HIS 4 HB1 HIS 4 4.417 -5.980 -6.780 28 HD1 HIS 4 HD1 HIS 4 6.159 -6.727 -4.870 29 HD2 HIS 4 HD2 HIS 4 7.382 -3.568 -7.300 30 HE1 HIS 4 HE1 HIS 4 8.051 -5.573 -3.645 31 HE2 HIS 4 HE2 HIS 4 8.807 -3.644 -5.114 32 H ARG 5 HN ARG 5 5.716 -6.385 -10.614 33 HA ARG 5 HA ARG 5 8.677 -6.065 -10.805 34 HB2 ARG 5 HB2 ARG 5 7.594 -8.050 -12.026 35 HB3 ARG 5 HB1 ARG 5 6.835 -6.861 -13.077 36 HG2 ARG 5 HG2 ARG 5 8.793 -7.316 -14.284 37 HG3 ARG 5 HG1 ARG 5 9.322 -5.927 -13.340 38 HD2 ARG 5 HD2 ARG 5 10.360 -7.447 -11.684 39 HD3 ARG 5 HD1 ARG 5 9.783 -8.842 -12.593 40 HE ARG 5 HE ARG 5 11.430 -8.448 -14.193 41 HH11 ARG 5 HH21 ARG 5 11.349 -5.928 -11.786 42 HH12 ARG 5 HH22 ARG 5 12.740 -5.104 -12.400 43 HH21 ARG 5 HH11 ARG 5 13.261 -7.341 -15.011 44 HH22 ARG 5 HH12 ARG 5 13.813 -5.900 -14.224 45 H GLU 6 HN GLU 6 9.406 -4.176 -11.483 46 HA GLU 6 HA GLU 6 7.639 -2.321 -12.961 47 HB2 GLU 6 HB2 GLU 6 7.569 -1.804 -10.500 48 HB3 GLU 6 HB1 GLU 6 9.306 -1.506 -10.563 49 HG2 GLU 6 HG2 GLU 6 8.915 0.245 -12.296 50 HG3 GLU 6 HG1 GLU 6 7.180 -0.032 -12.151 51 H ALA 7 HN ALA 7 8.690 -0.940 -14.330 52 HA ALA 7 HA ALA 7 11.198 -1.792 -15.356 53 HB1 ALA 7 HB1 ALA 7 11.039 0.214 -16.802 54 HB2 ALA 7 HB2 ALA 7 9.656 0.767 -15.856 55 HB3 ALA 7 HB3 ALA 7 9.545 -0.722 -16.794 56 H ARG 8 HN ARG 8 13.177 -1.327 -14.703 57 HA ARG 8 HA ARG 8 13.697 0.453 -12.516 58 HB2 ARG 8 HB2 ARG 8 15.497 -1.122 -14.374 59 HB3 ARG 8 HB1 ARG 8 16.119 -0.132 -13.049 60 HG2 ARG 8 HG2 ARG 8 14.772 -1.433 -11.425 61 HG3 ARG 8 HG1 ARG 8 14.135 -2.422 -12.748 62 HD2 ARG 8 HD2 ARG 8 16.402 -3.180 -13.312 63 HD3 ARG 8 HD1 ARG 8 17.082 -2.149 -12.055 64 HE ARG 8 HE ARG 8 15.798 -4.729 -11.695 65 HH11 ARG 8 HH21 ARG 8 16.434 -1.659 -10.197 66 HH12 ARG 8 HH22 ARG 8 16.720 -2.321 -8.621 67 HH21 ARG 8 HH11 ARG 8 16.182 -5.609 -9.626 68 HH22 ARG 8 HH12 ARG 8 16.585 -4.558 -8.310 69 H SER 9 HN SER 9 14.011 0.625 -16.003 70 HA SER 9 HA SER 9 15.145 3.373 -15.817 71 HB2 SER 9 HB2 SER 9 15.864 3.010 -18.150 72 HB3 SER 9 HB1 SER 9 16.548 1.804 -17.066 73 HG SER 9 HG SER 9 15.590 0.368 -18.241 74 H GLY 10 HN GLY 10 12.311 2.708 -15.448 75 HA2 GLY 10 HA3 GLY 10 11.210 4.691 -17.179 76 HA3 GLY 10 HA2 GLY 10 10.720 3.081 -17.687 77 H LYS 11 HN LYS 11 8.641 2.987 -17.121 78 HA LYS 11 HA LYS 11 7.907 2.648 -14.404 79 HB2 LYS 11 HB2 LYS 11 8.107 5.243 -14.693 80 HB3 LYS 11 HB1 LYS 11 6.610 5.115 -15.606 81 HG2 LYS 11 HG2 LYS 11 5.487 4.099 -13.686 82 HG3 LYS 11 HG1 LYS 11 6.993 4.093 -12.770 83 HD2 LYS 11 HD2 LYS 11 7.073 6.592 -12.998 84 HD3 LYS 11 HD1 LYS 11 5.476 6.530 -13.745 85 HE2 LYS 11 HE2 LYS 11 6.164 5.530 -10.966 86 HE3 LYS 11 HE1 LYS 11 5.296 7.020 -11.336 87 HZ1 LYS 11 HZ1 LYS 11 3.877 5.058 -10.764 88 HZ2 LYS 11 HZ2 LYS 11 4.371 4.348 -12.226 89 HZ3 LYS 11 HZ3 LYS 11 3.502 5.808 -12.238 90 H TYR 12 HN TYR 12 6.987 3.166 -17.729 91 HA TYR 12 HA TYR 12 4.953 1.089 -17.552 92 HB2 TYR 12 HB2 TYR 12 4.274 3.933 -18.352 93 HB3 TYR 12 HB1 TYR 12 3.243 2.544 -18.689 94 HD1 TYR 12 HD2 TYR 12 2.467 1.092 -16.724 95 HD2 TYR 12 HD1 TYR 12 4.157 5.013 -16.213 96 HE1 TYR 12 HE2 TYR 12 1.442 1.244 -14.471 97 HE2 TYR 12 HE1 TYR 12 3.126 5.161 -13.963 98 HH TYR 12 HH TYR 12 2.016 2.605 -12.272 99 H LYS 13 HN LYS 13 7.092 0.533 -18.848 100 HA LYS 13 HA LYS 13 6.452 0.886 -21.727 101 HB2 LYS 13 HB2 LYS 13 9.182 1.145 -20.446 102 HB3 LYS 13 HB1 LYS 13 8.894 1.031 -22.183 103 HG2 LYS 13 HG2 LYS 13 7.477 3.059 -22.079 104 HG3 LYS 13 HG1 LYS 13 7.794 3.184 -20.347 105 HD2 LYS 13 HD2 LYS 13 10.224 3.363 -20.834 106 HD3 LYS 13 HD1 LYS 13 9.860 3.324 -22.557 107 HE2 LYS 13 HE2 LYS 13 8.844 5.410 -20.603 108 HE3 LYS 13 HE1 LYS 13 10.157 5.648 -21.755 109 HZ1 LYS 13 HZ1 LYS 13 7.337 5.731 -22.182 110 HZ2 LYS 13 HZ2 LYS 13 8.100 4.656 -23.253 111 HZ3 LYS 13 HZ3 LYS 13 8.595 6.281 -23.178 112 H LEU 14 HN LEU 14 5.871 -1.272 -19.864 113 HA LEU 14 HA LEU 14 7.546 -3.463 -21.027 114 HB2 LEU 14 HB2 LEU 14 5.946 -3.608 -18.464 115 HB3 LEU 14 HB1 LEU 14 7.117 -4.770 -19.071 116 HG LEU 14 HG LEU 14 7.737 -1.933 -18.188 117 HD11 LEU 14 HD11 LEU 14 8.394 -4.620 -16.934 118 HD12 LEU 14 HD12 LEU 14 7.192 -3.475 -16.335 119 HD13 LEU 14 HD13 LEU 14 8.903 -3.046 -16.319 120 HD21 LEU 14 HD21 LEU 14 10.150 -2.835 -18.364 121 HD22 LEU 14 HD22 LEU 14 9.338 -2.491 -19.885 122 HD23 LEU 14 HD23 LEU 14 9.474 -4.156 -19.321 123 H THR 15 HN THR 15 6.509 -4.361 -22.658 124 HA THR 15 HA THR 15 3.552 -4.644 -22.573 125 HB THR 15 HB THR 15 3.672 -5.094 -24.940 126 HG1 THR 15 HG1 THR 15 5.798 -4.941 -25.920 127 HG21 THR 15 HG21 THR 15 4.680 -2.962 -25.719 128 HG22 THR 15 HG22 THR 15 5.424 -2.761 -24.132 129 HG23 THR 15 HG23 THR 15 3.667 -2.743 -24.290 130 H TYR 16 HN TYR 16 2.791 -6.718 -23.717 131 HA TYR 16 HA TYR 16 3.293 -8.907 -22.096 132 HB2 TYR 16 HB2 TYR 16 2.334 -10.268 -24.062 133 HB3 TYR 16 HB1 TYR 16 1.329 -8.968 -23.426 134 HD1 TYR 16 HD2 TYR 16 1.153 -6.793 -24.619 135 HD2 TYR 16 HD1 TYR 16 3.264 -10.138 -26.314 136 HE1 TYR 16 HE2 TYR 16 1.081 -5.714 -26.854 137 HE2 TYR 16 HE1 TYR 16 3.186 -9.055 -28.546 138 HH TYR 16 HH TYR 16 2.437 -7.336 -29.731 139 H ALA 17 HN ALA 17 4.650 -8.340 -25.354 140 HA ALA 17 HA ALA 17 6.275 -10.606 -25.487 141 HB1 ALA 17 HB1 ALA 17 5.919 -9.174 -27.420 142 HB2 ALA 17 HB2 ALA 17 7.647 -9.307 -27.096 143 HB3 ALA 17 HB3 ALA 17 6.772 -7.850 -26.628 144 H GLU 18 HN GLU 18 7.109 -7.357 -24.263 145 HA GLU 18 HA GLU 18 9.757 -8.055 -23.481 146 HB2 GLU 18 HB2 GLU 18 7.899 -5.752 -22.897 147 HB3 GLU 18 HB1 GLU 18 9.362 -5.918 -21.934 148 HG2 GLU 18 HG2 GLU 18 9.921 -4.459 -23.740 149 HG3 GLU 18 HG1 GLU 18 10.662 -6.002 -24.136 150 H ALA 19 HN ALA 19 6.631 -8.238 -21.883 151 HA ALA 19 HA ALA 19 7.614 -8.672 -19.246 152 HB1 ALA 19 HB1 ALA 19 4.985 -9.578 -20.440 153 HB2 ALA 19 HB2 ALA 19 5.290 -7.970 -19.776 154 HB3 ALA 19 HB3 ALA 19 5.358 -9.387 -18.725 155 H LYS 20 HN LYS 20 6.780 -10.843 -21.911 156 HA LYS 20 HA LYS 20 7.158 -13.263 -20.427 157 HB2 LYS 20 HB2 LYS 20 6.997 -12.671 -23.391 158 HB3 LYS 20 HB1 LYS 20 7.216 -14.300 -22.754 159 HG2 LYS 20 HG2 LYS 20 5.128 -14.108 -21.478 160 HG3 LYS 20 HG1 LYS 20 4.905 -12.457 -22.065 161 HD2 LYS 20 HD2 LYS 20 4.797 -13.280 -24.379 162 HD3 LYS 20 HD1 LYS 20 5.057 -14.930 -23.817 163 HE2 LYS 20 HE2 LYS 20 2.959 -14.822 -22.525 164 HE3 LYS 20 HE1 LYS 20 2.701 -13.166 -23.073 165 HZ1 LYS 20 HZ1 LYS 20 2.815 -14.087 -25.391 166 HZ2 LYS 20 HZ2 LYS 20 1.451 -14.551 -24.491 167 HZ3 LYS 20 HZ3 LYS 20 2.737 -15.638 -24.709 168 H ALA 21 HN ALA 21 9.223 -11.144 -22.295 169 HA ALA 21 HA ALA 21 11.384 -12.919 -22.707 170 HB1 ALA 21 HB1 ALA 21 12.698 -10.937 -23.173 171 HB2 ALA 21 HB2 ALA 21 11.508 -9.917 -22.365 172 HB3 ALA 21 HB3 ALA 21 11.090 -10.738 -23.870 173 H VAL 22 HN VAL 22 10.804 -10.524 -20.122 174 HA VAL 22 HA VAL 22 13.193 -11.293 -18.670 175 HB VAL 22 HB VAL 22 12.309 -8.992 -18.599 176 HG11 VAL 22 HG11 VAL 22 10.049 -10.119 -16.942 177 HG12 VAL 22 HG12 VAL 22 9.879 -9.722 -18.646 178 HG13 VAL 22 HG13 VAL 22 10.256 -8.457 -17.475 179 HG21 VAL 22 HG21 VAL 22 12.576 -8.666 -16.204 180 HG22 VAL 22 HG22 VAL 22 13.667 -9.952 -16.716 181 HG23 VAL 22 HG23 VAL 22 12.165 -10.350 -15.886 182 H CYS 23 HN CYS 23 9.872 -12.290 -18.735 183 HA CYS 23 HA CYS 23 10.190 -13.845 -16.220 184 HB2 CYS 23 HB2 CYS 23 7.676 -13.283 -17.816 185 HB3 CYS 23 HB1 CYS 23 7.768 -14.117 -16.266 186 H GLU 24 HN GLU 24 8.852 -15.970 -16.387 187 HA GLU 24 HA GLU 24 8.632 -18.103 -17.265 188 HB2 GLU 24 HB2 GLU 24 7.535 -16.926 -19.194 189 HB3 GLU 24 HB1 GLU 24 9.103 -16.846 -19.984 190 HG2 GLU 24 HG2 GLU 24 9.288 -19.265 -19.983 191 HG3 GLU 24 HG1 GLU 24 7.777 -19.407 -19.099 192 H PHE 25 HN PHE 25 11.377 -16.157 -18.224 193 HA PHE 25 HA PHE 25 13.081 -18.163 -19.225 194 HB2 PHE 25 HB2 PHE 25 13.498 -15.739 -19.426 195 HB3 PHE 25 HB1 PHE 25 13.778 -15.644 -17.691 196 HD1 PHE 25 HD1 PHE 25 15.045 -17.070 -20.885 197 HD2 PHE 25 HD2 PHE 25 15.891 -16.334 -16.735 198 HE1 PHE 25 HE1 PHE 25 17.425 -17.661 -21.262 199 HE2 PHE 25 HE2 PHE 25 18.269 -16.928 -17.115 200 HZ PHE 25 HZ PHE 25 19.034 -17.588 -19.379 201 H GLU 26 HN GLU 26 12.728 -16.875 -15.922 202 HA GLU 26 HA GLU 26 14.575 -18.811 -14.809 203 HB2 GLU 26 HB2 GLU 26 13.989 -17.839 -12.641 204 HB3 GLU 26 HB1 GLU 26 14.387 -16.581 -13.803 205 HG2 GLU 26 HG2 GLU 26 11.531 -17.431 -13.186 206 HG3 GLU 26 HG1 GLU 26 12.350 -16.109 -12.371 207 H GLY 27 HN GLY 27 11.795 -19.426 -16.140 208 HA2 GLY 27 HA3 GLY 27 10.627 -21.461 -15.972 209 HA3 GLY 27 HA2 GLY 27 11.161 -21.638 -14.307 210 H GLY 28 HN GLY 28 10.335 -18.753 -13.810 211 HA2 GLY 28 HA3 GLY 28 7.575 -19.336 -13.061 212 HA3 GLY 28 HA2 GLY 28 8.519 -17.923 -12.601 213 H HIS 29 HN HIS 29 5.804 -18.553 -14.020 214 HA HIS 29 HA HIS 29 6.115 -16.875 -16.437 215 HB2 HIS 29 HB2 HIS 29 3.623 -18.301 -15.461 216 HB3 HIS 29 HB1 HIS 29 3.960 -17.688 -17.082 217 HD1 HIS 29 HD1 HIS 29 5.585 -19.072 -18.575 218 HD2 HIS 29 HD2 HIS 29 4.912 -20.758 -14.822 219 HE1 HIS 29 HE1 HIS 29 6.517 -21.428 -18.667 220 HE2 HIS 29 HE2 HIS 29 6.115 -22.466 -16.384 221 H LEU 30 HN LEU 30 4.057 -15.442 -16.786 222 HA LEU 30 HA LEU 30 4.147 -13.335 -14.898 223 HB2 LEU 30 HB2 LEU 30 1.943 -13.818 -16.926 224 HB3 LEU 30 HB1 LEU 30 2.460 -12.276 -16.248 225 HG LEU 30 HG LEU 30 4.234 -14.040 -17.979 226 HD11 LEU 30 HD11 LEU 30 2.590 -11.596 -18.704 227 HD12 LEU 30 HD12 LEU 30 2.307 -13.242 -19.268 228 HD13 LEU 30 HD13 LEU 30 3.765 -12.381 -19.764 229 HD21 LEU 30 HD21 LEU 30 4.474 -11.186 -16.969 230 HD22 LEU 30 HD22 LEU 30 5.516 -11.873 -18.211 231 HD23 LEU 30 HD23 LEU 30 5.540 -12.536 -16.585 232 H ALA 31 HN ALA 31 2.609 -12.617 -13.410 233 HA ALA 31 HA ALA 31 1.342 -14.523 -11.822 234 HB1 ALA 31 HB1 ALA 31 0.180 -12.616 -10.773 235 HB2 ALA 31 HB2 ALA 31 0.702 -11.580 -12.103 236 HB3 ALA 31 HB3 ALA 31 1.898 -12.285 -11.015 237 H THR 32 HN THR 32 -0.695 -15.326 -11.677 238 HA THR 32 HA THR 32 -2.626 -14.628 -13.845 239 HB THR 32 HB THR 32 -3.080 -16.872 -14.267 240 HG1 THR 32 HG1 THR 32 -2.314 -17.192 -11.593 241 HG21 THR 32 HG21 THR 32 -1.009 -18.041 -14.551 242 HG22 THR 32 HG22 THR 32 -0.265 -17.191 -13.197 243 HG23 THR 32 HG23 THR 32 -0.610 -16.328 -14.694 244 H TYR 33 HN TYR 33 -4.847 -14.984 -13.350 245 HA TYR 33 HA TYR 33 -5.733 -13.886 -10.956 246 HB2 TYR 33 HB2 TYR 33 -7.119 -13.883 -12.920 247 HB3 TYR 33 HB1 TYR 33 -7.157 -15.643 -12.958 248 HD1 TYR 33 HD1 TYR 33 -8.150 -12.674 -10.905 249 HD2 TYR 33 HD2 TYR 33 -8.804 -16.843 -11.693 250 HE1 TYR 33 HE1 TYR 33 -10.174 -12.624 -9.482 251 HE2 TYR 33 HE2 TYR 33 -10.815 -16.797 -10.247 252 HH TYR 33 HH TYR 33 -11.532 -14.202 -8.169 253 H LYS 34 HN LYS 34 -4.974 -17.188 -11.778 254 HA LYS 34 HA LYS 34 -6.334 -18.455 -9.613 255 HB2 LYS 34 HB2 LYS 34 -3.991 -19.317 -11.332 256 HB3 LYS 34 HB1 LYS 34 -4.749 -20.357 -10.125 257 HG2 LYS 34 HG2 LYS 34 -6.881 -20.252 -11.281 258 HG3 LYS 34 HG1 LYS 34 -6.261 -19.045 -12.402 259 HD2 LYS 34 HD2 LYS 34 -6.203 -21.131 -13.579 260 HD3 LYS 34 HD1 LYS 34 -4.537 -20.774 -13.143 261 HE2 LYS 34 HE2 LYS 34 -4.590 -22.355 -11.327 262 HE3 LYS 34 HE1 LYS 34 -6.336 -22.555 -11.470 263 HZ1 LYS 34 HZ1 LYS 34 -4.715 -24.261 -12.540 264 HZ2 LYS 34 HZ2 LYS 34 -4.637 -23.117 -13.793 265 HZ3 LYS 34 HZ3 LYS 34 -6.129 -23.800 -13.355 266 H GLN 35 HN GLN 35 -2.897 -17.603 -10.083 267 HA GLN 35 HA GLN 35 -2.129 -18.328 -7.431 268 HB2 GLN 35 HB2 GLN 35 -0.745 -16.598 -9.497 269 HB3 GLN 35 HB1 GLN 35 -0.015 -17.123 -7.980 270 HG2 GLN 35 HG2 GLN 35 -0.350 -19.482 -8.635 271 HG3 GLN 35 HG1 GLN 35 -1.058 -18.954 -10.159 272 HE21 GLN 35 HE21 GLN 35 0.504 -19.382 -11.743 273 HE22 GLN 35 HE22 GLN 35 2.139 -18.940 -11.621 274 H LEU 36 HN LEU 36 -3.089 -15.319 -9.000 275 HA LEU 36 HA LEU 36 -2.409 -13.543 -6.914 276 HB2 LEU 36 HB2 LEU 36 -4.483 -13.421 -9.091 277 HB3 LEU 36 HB1 LEU 36 -4.202 -12.077 -8.024 278 HG LEU 36 HG LEU 36 -1.994 -13.313 -9.694 279 HD11 LEU 36 HD11 LEU 36 -2.356 -11.398 -11.247 280 HD12 LEU 36 HD12 LEU 36 -3.775 -10.927 -10.312 281 HD13 LEU 36 HD13 LEU 36 -3.763 -12.459 -11.184 282 HD21 LEU 36 HD21 LEU 36 -1.010 -10.967 -9.346 283 HD22 LEU 36 HD22 LEU 36 -1.071 -11.970 -7.908 284 HD23 LEU 36 HD23 LEU 36 -2.276 -10.706 -8.146 285 H GLU 37 HN GLU 37 -5.340 -15.434 -7.564 286 HA GLU 37 HA GLU 37 -7.036 -14.304 -5.662 287 HB2 GLU 37 HB2 GLU 37 -7.707 -15.965 -7.394 288 HB3 GLU 37 HB1 GLU 37 -6.908 -17.221 -6.455 289 HG2 GLU 37 HG2 GLU 37 -9.251 -17.290 -5.904 290 HG3 GLU 37 HG1 GLU 37 -8.423 -16.608 -4.513 291 H ALA 38 HN ALA 38 -4.573 -16.819 -5.300 292 HA ALA 38 HA ALA 38 -5.159 -17.298 -2.508 293 HB1 ALA 38 HB1 ALA 38 -2.842 -18.144 -4.258 294 HB2 ALA 38 HB2 ALA 38 -4.251 -19.109 -3.825 295 HB3 ALA 38 HB3 ALA 38 -3.074 -18.665 -2.589 296 H ALA 39 HN ALA 39 -3.173 -15.115 -4.309 297 HA ALA 39 HA ALA 39 -1.319 -14.506 -2.198 298 HB1 ALA 39 HB1 ALA 39 -0.903 -14.147 -4.668 299 HB2 ALA 39 HB2 ALA 39 -0.512 -12.774 -3.639 300 HB3 ALA 39 HB3 ALA 39 -2.001 -12.771 -4.580 301 H ARG 40 HN ARG 40 -4.552 -13.571 -2.912 302 HA ARG 40 HA ARG 40 -4.601 -10.977 -1.778 303 HB2 ARG 40 HB2 ARG 40 -6.860 -12.993 -1.674 304 HB3 ARG 40 HB1 ARG 40 -6.994 -11.240 -1.574 305 HG2 ARG 40 HG2 ARG 40 -6.235 -12.913 -3.970 306 HG3 ARG 40 HG1 ARG 40 -7.609 -11.833 -3.806 307 HD2 ARG 40 HD2 ARG 40 -4.691 -11.109 -4.170 308 HD3 ARG 40 HD1 ARG 40 -6.070 -10.653 -5.165 309 HE ARG 40 HE ARG 40 -6.228 -9.688 -2.443 310 HH11 ARG 40 HH21 ARG 40 -5.285 -9.101 -5.711 311 HH12 ARG 40 HH22 ARG 40 -4.909 -7.442 -5.444 312 HH21 ARG 40 HH11 ARG 40 -5.756 -7.480 -2.072 313 HH22 ARG 40 HH12 ARG 40 -5.193 -6.502 -3.389 314 H LYS 41 HN LYS 41 -5.017 -14.178 -0.299 315 HA LYS 41 HA LYS 41 -5.546 -13.111 2.328 316 HB2 LYS 41 HB2 LYS 41 -5.157 -15.492 3.071 317 HB3 LYS 41 HB1 LYS 41 -6.426 -15.285 1.867 318 HG2 LYS 41 HG2 LYS 41 -5.055 -16.105 0.105 319 HG3 LYS 41 HG1 LYS 41 -3.582 -15.952 1.061 320 HD2 LYS 41 HD2 LYS 41 -4.230 -18.303 0.946 321 HD3 LYS 41 HD1 LYS 41 -4.431 -17.723 2.598 322 HE2 LYS 41 HE2 LYS 41 -6.764 -17.669 0.669 323 HE3 LYS 41 HE1 LYS 41 -6.358 -19.135 1.557 324 HZ1 LYS 41 HZ1 LYS 41 -7.556 -16.708 2.503 325 HZ2 LYS 41 HZ2 LYS 41 -6.253 -17.221 3.462 326 HZ3 LYS 41 HZ3 LYS 41 -7.567 -18.260 3.184 327 H ILE 42 HN ILE 42 -2.778 -13.193 0.495 328 HA ILE 42 HA ILE 42 -0.938 -13.590 2.775 329 HB ILE 42 HB ILE 42 -0.309 -13.098 -0.151 330 HG12 ILE 42 HG12 ILE 42 -1.521 -15.191 0.103 331 HG13 ILE 42 HG11 ILE 42 0.170 -15.537 -0.221 332 HG21 ILE 42 HG21 ILE 42 1.394 -13.748 2.265 333 HG22 ILE 42 HG22 ILE 42 1.659 -12.523 1.027 334 HG23 ILE 42 HG23 ILE 42 1.918 -14.219 0.649 335 HD11 ILE 42 HD11 ILE 42 0.359 -15.646 2.421 336 HD12 ILE 42 HD12 ILE 42 -0.293 -17.016 1.528 337 HD13 ILE 42 HD13 ILE 42 -1.385 -15.894 2.330 338 H GLY 43 HN GLY 43 -2.725 -11.117 1.579 339 HA2 GLY 43 HA3 GLY 43 -2.655 -8.903 2.344 340 HA3 GLY 43 HA2 GLY 43 -0.966 -9.109 2.792 341 H PHE 44 HN PHE 44 -1.893 -10.188 -0.355 342 HA PHE 44 HA PHE 44 -0.065 -8.528 -1.706 343 HB2 PHE 44 HB2 PHE 44 -0.978 -10.703 -2.535 344 HB3 PHE 44 HB1 PHE 44 -2.515 -9.904 -2.843 345 HD1 PHE 44 HD1 PHE 44 1.120 -9.844 -3.694 346 HD2 PHE 44 HD2 PHE 44 -2.834 -8.649 -4.860 347 HE1 PHE 44 HE1 PHE 44 1.986 -9.119 -5.904 348 HE2 PHE 44 HE2 PHE 44 -1.974 -7.922 -7.063 349 HZ PHE 44 HZ PHE 44 0.438 -8.163 -7.590 350 H HIS 45 HN HIS 45 -0.181 -6.432 -2.130 351 HA HIS 45 HA HIS 45 -2.674 -5.192 -3.022 352 HB2 HIS 45 HB2 HIS 45 -2.989 -4.981 -0.647 353 HB3 HIS 45 HB1 HIS 45 -1.327 -4.459 -0.409 354 HD1 HIS 45 HD1 HIS 45 -3.879 -3.160 -2.940 355 HD2 HIS 45 HD2 HIS 45 -1.638 -1.808 0.304 356 HE1 HIS 45 HE1 HIS 45 -4.306 -0.664 -2.763 357 HE2 HIS 45 HE2 HIS 45 -2.936 0.171 -0.794 358 H VAL 46 HN VAL 46 -1.835 -4.488 -4.887 359 HA VAL 46 HA VAL 46 0.284 -2.429 -4.739 360 HB VAL 46 HB VAL 46 1.424 -3.382 -6.707 361 HG11 VAL 46 HG11 VAL 46 1.202 -5.368 -4.422 362 HG12 VAL 46 HG12 VAL 46 2.158 -3.885 -4.366 363 HG13 VAL 46 HG13 VAL 46 2.571 -5.161 -5.510 364 HG21 VAL 46 HG21 VAL 46 -0.268 -4.691 -7.784 365 HG22 VAL 46 HG22 VAL 46 -0.605 -5.606 -6.317 366 HG23 VAL 46 HG23 VAL 46 0.906 -5.858 -7.188 367 H CYS 47 HN CYS 47 -0.306 -0.676 -5.800 368 HA CYS 47 HA CYS 47 -2.563 -0.806 -7.708 369 HB2 CYS 47 HB2 CYS 47 -2.864 0.814 -5.951 370 HB3 CYS 47 HB1 CYS 47 -1.264 1.497 -6.240 371 H ALA 48 HN ALA 48 -1.090 -1.812 -9.302 372 HA ALA 48 HA ALA 48 0.154 0.275 -10.976 373 HB1 ALA 48 HB1 ALA 48 2.156 -1.137 -11.345 374 HB2 ALA 48 HB2 ALA 48 1.585 -2.248 -10.101 375 HB3 ALA 48 HB3 ALA 48 2.025 -0.597 -9.670 376 H ALA 49 HN ALA 49 -1.479 0.010 -12.457 377 HA ALA 49 HA ALA 49 -2.562 -2.366 -13.407 378 HB1 ALA 49 HB1 ALA 49 -3.262 -1.074 -15.364 379 HB2 ALA 49 HB2 ALA 49 -2.110 0.197 -14.950 380 HB3 ALA 49 HB3 ALA 49 -3.483 -0.127 -13.890 381 H GLY 50 HN GLY 50 -1.360 -4.040 -14.025 382 HA2 GLY 50 HA3 GLY 50 0.639 -3.630 -16.203 383 HA3 GLY 50 HA2 GLY 50 1.009 -4.629 -14.802 384 H TRP 51 HN TRP 51 0.938 -5.341 -17.614 385 HA TRP 51 HA TRP 51 -1.376 -6.819 -18.284 386 HB2 TRP 51 HB2 TRP 51 1.488 -7.253 -19.162 387 HB3 TRP 51 HB1 TRP 51 0.073 -7.975 -19.918 388 HD1 TRP 51 HD1 TRP 51 2.282 -5.108 -20.277 389 HE1 TRP 51 HE1 TRP 51 1.211 -3.268 -21.734 390 HE3 TRP 51 HE3 TRP 51 -2.567 -6.723 -20.325 391 HZ2 TRP 51 HZ2 TRP 51 -1.362 -2.572 -22.767 392 HZ3 TRP 51 HZ3 TRP 51 -4.300 -5.450 -21.540 393 HH2 TRP 51 HH2 TRP 51 -3.708 -3.377 -22.765 394 H MET 52 HN MET 52 -1.712 -9.092 -18.249 395 HA MET 52 HA MET 52 0.053 -10.803 -16.686 396 HB2 MET 52 HB2 MET 52 -1.765 -11.477 -15.108 397 HB3 MET 52 HB1 MET 52 -1.223 -9.827 -14.880 398 HG2 MET 52 HG2 MET 52 -3.149 -8.927 -15.978 399 HG3 MET 52 HG1 MET 52 -3.639 -10.517 -16.557 400 HE1 MET 52 HE1 MET 52 -3.042 -8.169 -13.715 401 HE2 MET 52 HE2 MET 52 -2.340 -9.501 -12.799 402 HE3 MET 52 HE3 MET 52 -3.892 -8.829 -12.312 403 H ALA 53 HN ALA 53 -1.405 -12.950 -16.271 404 HA ALA 53 HA ALA 53 -1.521 -14.440 -18.495 405 HB1 ALA 53 HB1 ALA 53 -3.696 -14.553 -16.399 406 HB2 ALA 53 HB2 ALA 53 -2.090 -15.250 -16.213 407 HB3 ALA 53 HB3 ALA 53 -3.178 -15.866 -17.454 408 H LYS 54 HN LYS 54 -2.493 -14.417 -20.387 409 HA LYS 54 HA LYS 54 -3.904 -13.873 -22.107 410 HB2 LYS 54 HB2 LYS 54 -5.939 -13.886 -19.859 411 HB3 LYS 54 HB1 LYS 54 -6.343 -13.784 -21.568 412 HG2 LYS 54 HG2 LYS 54 -5.244 -15.941 -21.979 413 HG3 LYS 54 HG1 LYS 54 -4.799 -16.048 -20.274 414 HD2 LYS 54 HD2 LYS 54 -7.166 -16.037 -19.629 415 HD3 LYS 54 HD1 LYS 54 -7.640 -15.861 -21.319 416 HE2 LYS 54 HE2 LYS 54 -7.849 -18.199 -20.684 417 HE3 LYS 54 HE1 LYS 54 -6.505 -18.033 -21.815 418 HZ1 LYS 54 HZ1 LYS 54 -6.139 -19.401 -19.709 419 HZ2 LYS 54 HZ2 LYS 54 -6.073 -17.910 -18.897 420 HZ3 LYS 54 HZ3 LYS 54 -4.952 -18.262 -20.124 421 H GLY 55 HN GLY 55 -2.510 -11.725 -20.700 422 HA2 GLY 55 HA3 GLY 55 -2.425 -9.423 -20.651 423 HA3 GLY 55 HA2 GLY 55 -3.556 -9.495 -21.995 424 H ARG 56 HN ARG 56 -4.514 -10.916 -18.981 425 HA ARG 56 HA ARG 56 -6.784 -9.161 -18.818 426 HB2 ARG 56 HB2 ARG 56 -6.410 -11.716 -18.053 427 HB3 ARG 56 HB1 ARG 56 -6.043 -10.973 -16.519 428 HG2 ARG 56 HG2 ARG 56 -8.213 -9.770 -16.570 429 HG3 ARG 56 HG1 ARG 56 -8.594 -10.511 -18.120 430 HD2 ARG 56 HD2 ARG 56 -9.731 -11.801 -16.478 431 HD3 ARG 56 HD1 ARG 56 -8.334 -12.763 -16.970 432 HE ARG 56 HE ARG 56 -7.480 -12.531 -14.821 433 HH11 ARG 56 HH21 ARG 56 -9.861 -10.073 -15.386 434 HH12 ARG 56 HH22 ARG 56 -10.034 -9.681 -13.710 435 HH21 ARG 56 HH11 ARG 56 -7.717 -12.025 -12.620 436 HH22 ARG 56 HH12 ARG 56 -8.826 -10.778 -12.142 437 H VAL 57 HN VAL 57 -4.993 -7.317 -18.734 438 HA VAL 57 HA VAL 57 -3.529 -6.630 -16.536 439 HB VAL 57 HB VAL 57 -3.650 -5.242 -18.551 440 HG11 VAL 57 HG11 VAL 57 -6.372 -4.416 -17.493 441 HG12 VAL 57 HG12 VAL 57 -6.077 -5.385 -18.935 442 HG13 VAL 57 HG13 VAL 57 -5.542 -3.709 -18.871 443 HG21 VAL 57 HG21 VAL 57 -2.877 -4.296 -16.336 444 HG22 VAL 57 HG22 VAL 57 -4.493 -3.627 -16.121 445 HG23 VAL 57 HG23 VAL 57 -3.490 -3.090 -17.465 446 H GLY 58 HN GLY 58 -3.888 -5.432 -14.618 447 HA2 GLY 58 HA3 GLY 58 -6.530 -4.777 -13.708 448 HA3 GLY 58 HA2 GLY 58 -5.941 -6.274 -12.992 449 H TYR 59 HN TYR 59 -6.528 -4.251 -11.348 450 HA TYR 59 HA TYR 59 -3.963 -3.701 -10.111 451 HB2 TYR 59 HB2 TYR 59 -4.205 -1.287 -10.008 452 HB3 TYR 59 HB1 TYR 59 -4.089 -1.835 -11.670 453 HD1 TYR 59 HD2 TYR 59 -6.294 -2.207 -12.982 454 HD2 TYR 59 HD1 TYR 59 -6.049 0.073 -9.350 455 HE1 TYR 59 HE2 TYR 59 -8.415 -1.053 -13.557 456 HE2 TYR 59 HE1 TYR 59 -8.160 1.226 -9.926 457 HH TYR 59 HH TYR 59 -9.724 1.526 -11.469 458 HA PRO 60 HA PRO 60 -7.540 -4.607 -7.259 459 HB2 PRO 60 HB2 PRO 60 -5.185 -5.811 -5.826 460 HB3 PRO 60 HB1 PRO 60 -6.822 -6.473 -6.034 461 HG2 PRO 60 HG2 PRO 60 -4.821 -7.443 -7.466 462 HG3 PRO 60 HG1 PRO 60 -6.392 -7.144 -8.240 463 HD2 PRO 60 HD2 PRO 60 -3.881 -5.471 -8.385 464 HD3 PRO 60 HD1 PRO 60 -5.031 -5.881 -9.679 465 H ILE 61 HN ILE 61 -8.084 -3.475 -5.431 466 HA ILE 61 HA ILE 61 -5.998 -1.910 -4.016 467 HB ILE 61 HB ILE 61 -8.584 -0.745 -5.109 468 HG12 ILE 61 HG12 ILE 61 -5.686 -0.025 -5.693 469 HG13 ILE 61 HG11 ILE 61 -6.679 -1.028 -6.740 470 HG21 ILE 61 HG21 ILE 61 -6.449 0.367 -3.258 471 HG22 ILE 61 HG22 ILE 61 -8.177 0.224 -2.937 472 HG23 ILE 61 HG23 ILE 61 -7.598 1.394 -4.110 473 HD11 ILE 61 HD11 ILE 61 -6.605 1.369 -7.445 474 HD12 ILE 61 HD12 ILE 61 -7.414 1.790 -5.944 475 HD13 ILE 61 HD13 ILE 61 -8.233 0.776 -7.131 476 H VAL 62 HN VAL 62 -6.152 -3.141 -2.185 477 HA VAL 62 HA VAL 62 -8.566 -3.994 -0.984 478 HB VAL 62 HB VAL 62 -7.205 -4.450 0.994 479 HG11 VAL 62 HG11 VAL 62 -5.492 -5.885 -0.092 480 HG12 VAL 62 HG12 VAL 62 -5.779 -5.047 -1.617 481 HG13 VAL 62 HG13 VAL 62 -7.064 -6.015 -0.887 482 HG21 VAL 62 HG21 VAL 62 -5.146 -2.759 -0.465 483 HG22 VAL 62 HG22 VAL 62 -4.733 -3.824 0.879 484 HG23 VAL 62 HG23 VAL 62 -5.829 -2.470 1.133 485 H LYS 63 HN LYS 63 -6.779 -1.002 -0.869 486 HA LYS 63 HA LYS 63 -8.986 0.228 0.588 487 HB2 LYS 63 HB2 LYS 63 -6.169 0.136 1.669 488 HB3 LYS 63 HB1 LYS 63 -7.318 1.376 2.170 489 HG2 LYS 63 HG2 LYS 63 -8.910 -0.503 2.810 490 HG3 LYS 63 HG1 LYS 63 -7.582 -1.624 2.528 491 HD2 LYS 63 HD2 LYS 63 -6.218 -0.421 4.203 492 HD3 LYS 63 HD1 LYS 63 -7.561 0.688 4.489 493 HE2 LYS 63 HE2 LYS 63 -7.509 -1.113 6.185 494 HE3 LYS 63 HE1 LYS 63 -8.977 -1.193 5.210 495 HZ1 LYS 63 HZ1 LYS 63 -7.666 -3.335 5.600 496 HZ2 LYS 63 HZ2 LYS 63 -6.569 -2.723 4.456 497 HZ3 LYS 63 HZ3 LYS 63 -8.188 -3.001 4.022 498 HA PRO 64 HA PRO 64 -8.428 3.650 -2.183 499 HB2 PRO 64 HB2 PRO 64 -8.313 5.329 0.329 500 HB3 PRO 64 HB1 PRO 64 -9.255 5.599 -1.153 501 HG2 PRO 64 HG2 PRO 64 -10.372 4.600 1.089 502 HG3 PRO 64 HG1 PRO 64 -10.907 4.112 -0.525 503 HD2 PRO 64 HD2 PRO 64 -9.388 2.520 1.474 504 HD3 PRO 64 HD1 PRO 64 -10.344 1.971 0.080 505 H GLY 65 HN GLY 65 -6.784 5.021 -2.961 506 HA2 GLY 65 HA3 GLY 65 -4.358 5.378 -1.337 507 HA3 GLY 65 HA2 GLY 65 -4.187 4.432 -2.807 508 HA PRO 66 HA PRO 66 -4.020 9.131 -3.652 509 HB2 PRO 66 HB2 PRO 66 -1.328 9.620 -3.623 510 HB3 PRO 66 HB1 PRO 66 -2.314 9.685 -2.144 511 HG2 PRO 66 HG2 PRO 66 -0.612 7.428 -3.166 512 HG3 PRO 66 HG1 PRO 66 -0.682 8.121 -1.532 513 HD2 PRO 66 HD2 PRO 66 -2.036 5.842 -2.166 514 HD3 PRO 66 HD1 PRO 66 -2.691 7.026 -1.009 515 H ASN 67 HN ASN 67 -1.799 6.564 -4.678 516 HA ASN 67 HA ASN 67 -1.212 7.634 -7.244 517 HB2 ASN 67 HB2 ASN 67 -0.477 5.270 -7.742 518 HB3 ASN 67 HB1 ASN 67 0.256 5.982 -6.304 519 HD21 ASN 67 HD21 ASN 67 0.572 3.703 -5.524 520 HD22 ASN 67 HD22 ASN 67 -0.738 2.884 -4.820 521 H CYS 68 HN CYS 68 -3.939 5.949 -5.969 522 HA CYS 68 HA CYS 68 -5.399 6.283 -8.429 523 HB2 CYS 68 HB2 CYS 68 -5.957 3.829 -8.670 524 HB3 CYS 68 HB1 CYS 68 -4.299 4.249 -9.080 525 H GLY 69 HN GLY 69 -7.498 6.558 -8.000 526 HA2 GLY 69 HA3 GLY 69 -8.457 6.835 -5.400 527 HA3 GLY 69 HA2 GLY 69 -9.470 6.726 -6.837 528 H PHE 70 HN PHE 70 -10.628 5.674 -4.767 529 HA PHE 70 HA PHE 70 -9.992 3.070 -3.966 530 HB2 PHE 70 HB2 PHE 70 -12.409 2.901 -3.354 531 HB3 PHE 70 HB1 PHE 70 -11.634 4.363 -2.758 532 HD1 PHE 70 HD2 PHE 70 -12.075 6.560 -3.809 533 HD2 PHE 70 HD1 PHE 70 -14.130 3.010 -5.097 534 HE1 PHE 70 HE2 PHE 70 -13.749 7.956 -4.988 535 HE2 PHE 70 HE1 PHE 70 -15.804 4.412 -6.273 536 HZ PHE 70 HZ PHE 70 -15.614 6.883 -6.219 537 H GLY 71 HN GLY 71 -12.267 4.137 -6.484 538 HA2 GLY 71 HA3 GLY 71 -13.280 2.949 -8.202 539 HA3 GLY 71 HA2 GLY 71 -11.634 2.405 -8.495 540 H LYS 72 HN LYS 72 -14.506 1.692 -6.527 541 HA LYS 72 HA LYS 72 -15.343 -0.293 -5.695 542 HB2 LYS 72 HB2 LYS 72 -13.974 -1.334 -8.191 543 HB3 LYS 72 HB1 LYS 72 -15.090 -2.265 -7.196 544 HG2 LYS 72 HG2 LYS 72 -16.903 -0.749 -7.664 545 HG3 LYS 72 HG1 LYS 72 -15.816 0.392 -8.452 546 HD2 LYS 72 HD2 LYS 72 -17.000 -0.854 -10.170 547 HD3 LYS 72 HD1 LYS 72 -15.311 -1.350 -10.184 548 HE2 LYS 72 HE2 LYS 72 -15.808 -3.421 -9.095 549 HE3 LYS 72 HE1 LYS 72 -17.422 -2.878 -8.630 550 HZ1 LYS 72 HZ1 LYS 72 -16.515 -3.232 -11.434 551 HZ2 LYS 72 HZ2 LYS 72 -18.094 -2.894 -10.904 552 HZ3 LYS 72 HZ3 LYS 72 -17.384 -4.398 -10.557 553 H THR 73 HN THR 73 -14.552 -2.774 -5.377 554 HA THR 73 HA THR 73 -11.733 -2.927 -4.580 555 HB THR 73 HB THR 73 -12.213 -3.578 -2.294 556 HG1 THR 73 HG1 THR 73 -14.902 -2.858 -2.711 557 HG21 THR 73 HG21 THR 73 -13.726 -1.015 -2.851 558 HG22 THR 73 HG22 THR 73 -11.966 -1.126 -2.887 559 HG23 THR 73 HG23 THR 73 -12.838 -1.443 -1.389 560 H GLY 74 HN GLY 74 -11.308 -5.145 -3.581 561 HA2 GLY 74 HA3 GLY 74 -11.415 -7.459 -3.693 562 HA3 GLY 74 HA2 GLY 74 -13.069 -7.315 -4.276 563 H ILE 75 HN ILE 75 -9.684 -7.031 -5.263 564 HA ILE 75 HA ILE 75 -8.638 -7.308 -7.306 565 HB ILE 75 HB ILE 75 -10.859 -9.334 -7.687 566 HG12 ILE 75 HG12 ILE 75 -8.058 -9.715 -6.564 567 HG13 ILE 75 HG11 ILE 75 -9.496 -9.554 -5.558 568 HG21 ILE 75 HG21 ILE 75 -9.726 -8.940 -9.785 569 HG22 ILE 75 HG22 ILE 75 -9.070 -10.435 -9.135 570 HG23 ILE 75 HG23 ILE 75 -8.145 -8.940 -9.004 571 HD11 ILE 75 HD11 ILE 75 -10.489 -11.526 -6.712 572 HD12 ILE 75 HD12 ILE 75 -8.987 -11.922 -5.878 573 HD13 ILE 75 HD13 ILE 75 -8.993 -11.710 -7.627 574 H ILE 76 HN ILE 76 -8.824 -5.490 -8.506 575 HA ILE 76 HA ILE 76 -11.319 -5.018 -10.049 576 HB ILE 76 HB ILE 76 -9.000 -3.124 -9.587 577 HG12 ILE 76 HG12 ILE 76 -9.965 -3.593 -7.418 578 HG13 ILE 76 HG11 ILE 76 -10.553 -2.019 -7.940 579 HG21 ILE 76 HG21 ILE 76 -10.739 -1.429 -10.235 580 HG22 ILE 76 HG22 ILE 76 -11.820 -2.761 -10.639 581 HG23 ILE 76 HG23 ILE 76 -10.317 -2.544 -11.535 582 HD11 ILE 76 HD11 ILE 76 -12.611 -3.345 -8.866 583 HD12 ILE 76 HD12 ILE 76 -12.489 -3.074 -7.133 584 HD13 ILE 76 HD13 ILE 76 -12.043 -4.636 -7.806 585 H ASP 77 HN ASP 77 -11.337 -5.489 -12.121 586 HA ASP 77 HA ASP 77 -8.851 -5.311 -13.715 587 HB2 ASP 77 HB2 ASP 77 -10.807 -7.608 -13.913 588 HB3 ASP 77 HB1 ASP 77 -9.292 -7.417 -14.788 589 H TYR 78 HN TYR 78 -9.101 -4.634 -15.764 590 HA TYR 78 HA TYR 78 -11.620 -3.324 -16.437 591 HB2 TYR 78 HB2 TYR 78 -8.793 -3.216 -17.366 592 HB3 TYR 78 HB1 TYR 78 -9.972 -2.973 -18.647 593 HD1 TYR 78 HD1 TYR 78 -10.143 -1.983 -15.027 594 HD2 TYR 78 HD2 TYR 78 -9.903 -0.645 -19.108 595 HE1 TYR 78 HE1 TYR 78 -10.465 0.363 -14.289 596 HE2 TYR 78 HE2 TYR 78 -10.223 1.691 -18.363 597 HH TYR 78 HH TYR 78 -10.495 3.045 -16.644 598 H GLY 79 HN GLY 79 -10.880 -6.424 -16.552 599 HA2 GLY 79 HA3 GLY 79 -12.033 -8.114 -17.671 600 HA3 GLY 79 HA2 GLY 79 -12.596 -6.943 -18.860 601 H ILE 80 HN ILE 80 -11.295 -6.458 -20.640 602 HA ILE 80 HA ILE 80 -8.684 -7.690 -20.983 603 HB ILE 80 HB ILE 80 -10.981 -8.594 -22.769 604 HG12 ILE 80 HG12 ILE 80 -9.376 -10.107 -20.658 605 HG13 ILE 80 HG11 ILE 80 -11.105 -9.782 -20.624 606 HG21 ILE 80 HG21 ILE 80 -9.311 -9.968 -23.897 607 HG22 ILE 80 HG22 ILE 80 -8.072 -9.484 -22.745 608 HG23 ILE 80 HG23 ILE 80 -8.723 -8.317 -23.889 609 HD11 ILE 80 HD11 ILE 80 -9.612 -11.646 -22.448 610 HD12 ILE 80 HD12 ILE 80 -11.253 -11.099 -22.812 611 HD13 ILE 80 HD13 ILE 80 -10.931 -12.018 -21.339 612 H ARG 81 HN ARG 81 -7.502 -6.298 -22.101 613 HA ARG 81 HA ARG 81 -8.852 -4.273 -23.828 614 HB2 ARG 81 HB2 ARG 81 -6.085 -4.282 -22.590 615 HB3 ARG 81 HB1 ARG 81 -6.714 -3.020 -23.641 616 HG2 ARG 81 HG2 ARG 81 -8.557 -2.619 -22.050 617 HG3 ARG 81 HG1 ARG 81 -7.903 -3.854 -20.979 618 HD2 ARG 81 HD2 ARG 81 -7.153 -1.726 -20.166 619 HD3 ARG 81 HD1 ARG 81 -5.762 -2.522 -20.896 620 HE ARG 81 HE ARG 81 -7.064 -0.887 -22.816 621 HH11 ARG 81 HH21 ARG 81 -5.067 -0.761 -19.958 622 HH12 ARG 81 HH22 ARG 81 -4.433 0.808 -20.326 623 HH21 ARG 81 HH11 ARG 81 -6.214 1.180 -23.282 624 HH22 ARG 81 HH12 ARG 81 -5.080 1.904 -22.191 625 H LEU 82 HN LEU 82 -8.681 -4.412 -25.957 626 HA LEU 82 HA LEU 82 -6.952 -6.433 -27.190 627 HB2 LEU 82 HB2 LEU 82 -9.197 -4.676 -28.182 628 HB3 LEU 82 HB1 LEU 82 -8.182 -5.552 -29.321 629 HG LEU 82 HG LEU 82 -10.310 -6.751 -28.671 630 HD11 LEU 82 HD11 LEU 82 -9.359 -8.873 -28.744 631 HD12 LEU 82 HD12 LEU 82 -8.011 -8.451 -27.698 632 HD13 LEU 82 HD13 LEU 82 -8.037 -7.898 -29.372 633 HD21 LEU 82 HD21 LEU 82 -8.954 -7.207 -26.003 634 HD22 LEU 82 HD22 LEU 82 -10.584 -7.674 -26.479 635 HD23 LEU 82 HD23 LEU 82 -10.191 -5.972 -26.248 636 H ASN 83 HN ASN 83 -6.414 -3.421 -26.162 637 HA ASN 83 HA ASN 83 -4.806 -2.532 -28.471 638 HB2 ASN 83 HB2 ASN 83 -4.720 -0.380 -27.387 639 HB3 ASN 83 HB1 ASN 83 -6.391 -0.919 -27.491 640 HD21 ASN 83 HD21 ASN 83 -3.651 -1.282 -25.163 641 HD22 ASN 83 HD22 ASN 83 -4.607 -0.999 -23.790 642 H ARG 84 HN ARG 84 -4.078 -4.769 -26.660 643 HA ARG 84 HA ARG 84 -2.170 -4.268 -24.744 644 HB2 ARG 84 HB2 ARG 84 -2.148 -6.376 -26.924 645 HB3 ARG 84 HB1 ARG 84 -1.027 -6.375 -25.564 646 HG2 ARG 84 HG2 ARG 84 -2.814 -6.597 -23.984 647 HG3 ARG 84 HG1 ARG 84 -4.025 -6.319 -25.223 648 HD2 ARG 84 HD2 ARG 84 -3.918 -8.685 -24.711 649 HD3 ARG 84 HD1 ARG 84 -3.350 -8.420 -26.354 650 HE ARG 84 HE ARG 84 -1.171 -8.440 -24.504 651 HH11 ARG 84 HH21 ARG 84 -3.452 -10.396 -26.241 652 HH12 ARG 84 HH22 ARG 84 -2.571 -11.874 -26.032 653 HH21 ARG 84 HH11 ARG 84 0.013 -10.414 -24.226 654 HH22 ARG 84 HH12 ARG 84 -0.622 -11.882 -24.891 655 H SER 85 HN SER 85 -1.901 -3.645 -28.164 656 HA SER 85 HA SER 85 0.866 -3.482 -28.489 657 HB2 SER 85 HB2 SER 85 0.352 -1.924 -30.337 658 HB3 SER 85 HB1 SER 85 -0.710 -3.328 -30.358 659 HG SER 85 HG SER 85 -1.377 -0.776 -30.234 660 H GLU 86 HN GLU 86 -1.176 -1.601 -26.522 661 HA GLU 86 HA GLU 86 0.296 0.868 -26.556 662 HB2 GLU 86 HB2 GLU 86 -1.747 -0.290 -24.643 663 HB3 GLU 86 HB1 GLU 86 -1.033 1.308 -24.432 664 HG2 GLU 86 HG2 GLU 86 -1.894 2.019 -26.605 665 HG3 GLU 86 HG1 GLU 86 -2.528 0.404 -26.910 666 H ARG 87 HN ARG 87 1.316 1.719 -24.544 667 HA ARG 87 HA ARG 87 3.179 -0.286 -23.424 668 HB2 ARG 87 HB2 ARG 87 3.231 2.743 -23.493 669 HB3 ARG 87 HB1 ARG 87 4.421 1.762 -22.646 670 HG2 ARG 87 HG2 ARG 87 5.031 0.656 -24.752 671 HG3 ARG 87 HG1 ARG 87 3.824 1.613 -25.616 672 HD2 ARG 87 HD2 ARG 87 4.988 3.679 -24.935 673 HD3 ARG 87 HD1 ARG 87 6.193 2.717 -24.087 674 HE ARG 87 HE ARG 87 7.194 2.225 -26.126 675 HH11 ARG 87 HH21 ARG 87 3.990 3.461 -26.612 676 HH12 ARG 87 HH22 ARG 87 4.170 3.627 -28.325 677 HH21 ARG 87 HH11 ARG 87 7.447 2.464 -28.379 678 HH22 ARG 87 HH12 ARG 87 6.126 3.057 -29.334 679 H TRP 88 HN TRP 88 3.015 -0.979 -21.428 680 HA TRP 88 HA TRP 88 1.888 0.641 -19.277 681 HB2 TRP 88 HB2 TRP 88 0.546 -1.890 -20.245 682 HB3 TRP 88 HB1 TRP 88 0.274 -1.221 -18.642 683 HD1 TRP 88 HD1 TRP 88 -0.315 -0.459 -22.353 684 HE1 TRP 88 HE1 TRP 88 -2.179 1.314 -22.530 685 HE3 TRP 88 HE3 TRP 88 -0.908 0.686 -17.416 686 HZ2 TRP 88 HZ2 TRP 88 -3.720 2.996 -20.799 687 HZ3 TRP 88 HZ3 TRP 88 -2.580 2.372 -16.705 688 HH2 TRP 88 HH2 TRP 88 -3.984 3.527 -18.389 689 H ASP 89 HN ASP 89 1.771 -0.874 -17.235 690 HA ASP 89 HA ASP 89 4.446 -1.842 -16.811 691 HB2 ASP 89 HB2 ASP 89 2.919 -0.646 -15.125 692 HB3 ASP 89 HB1 ASP 89 2.097 -2.187 -14.932 693 H ALA 90 HN ALA 90 4.245 -3.991 -15.209 694 HA ALA 90 HA ALA 90 2.585 -6.082 -16.272 695 HB1 ALA 90 HB1 ALA 90 4.153 -5.935 -18.136 696 HB2 ALA 90 HB2 ALA 90 4.401 -7.440 -17.252 697 HB3 ALA 90 HB3 ALA 90 5.516 -6.091 -17.028 698 H TYR 91 HN TYR 91 2.987 -8.145 -15.259 699 HA TYR 91 HA TYR 91 4.367 -7.899 -12.628 700 HB2 TYR 91 HB2 TYR 91 2.007 -9.609 -13.457 701 HB3 TYR 91 HB1 TYR 91 2.812 -9.704 -11.896 702 HD1 TYR 91 HD2 TYR 91 2.874 -7.670 -10.396 703 HD2 TYR 91 HD1 TYR 91 0.384 -7.876 -13.893 704 HE1 TYR 91 HE2 TYR 91 1.488 -5.807 -9.521 705 HE2 TYR 91 HE1 TYR 91 -1.004 -6.018 -13.012 706 HH TYR 91 HH TYR 91 -1.382 -4.662 -11.295 707 H CYS 92 HN CYS 92 5.296 -9.863 -11.786 708 HA CYS 92 HA CYS 92 5.979 -11.960 -13.738 709 HB2 CYS 92 HB2 CYS 92 7.723 -9.970 -13.651 710 HB3 CYS 92 HB1 CYS 92 8.262 -10.758 -12.172 711 H TYR 93 HN TYR 93 7.483 -13.594 -12.546 712 HA TYR 93 HA TYR 93 6.796 -13.903 -9.698 713 HB2 TYR 93 HB2 TYR 93 4.967 -14.974 -11.034 714 HB3 TYR 93 HB1 TYR 93 6.173 -16.017 -11.775 715 HD1 TYR 93 HD2 TYR 93 7.466 -17.650 -10.376 716 HD2 TYR 93 HD1 TYR 93 4.163 -15.401 -8.787 717 HE1 TYR 93 HE2 TYR 93 7.299 -19.230 -8.472 718 HE2 TYR 93 HE1 TYR 93 4.000 -16.985 -6.886 719 HH TYR 93 HH TYR 93 4.646 -19.066 -6.166 720 H ASN 94 HN ASN 94 8.453 -14.679 -8.597 721 HA ASN 94 HA ASN 94 10.383 -16.447 -9.912 722 HB2 ASN 94 HB2 ASN 94 11.516 -14.066 -8.448 723 HB3 ASN 94 HB1 ASN 94 12.291 -15.091 -9.655 724 HD21 ASN 94 HD21 ASN 94 9.618 -12.704 -9.313 725 HD22 ASN 94 HD22 ASN 94 9.764 -12.097 -10.893 726 HA PRO 95 HA PRO 95 10.620 -18.406 -5.941 727 HB2 PRO 95 HB2 PRO 95 13.619 -18.480 -6.202 728 HB3 PRO 95 HB1 PRO 95 12.480 -19.823 -5.949 729 HG2 PRO 95 HG2 PRO 95 13.614 -19.460 -8.319 730 HG3 PRO 95 HG1 PRO 95 11.899 -19.918 -8.206 731 HD2 PRO 95 HD2 PRO 95 13.081 -17.186 -8.749 732 HD3 PRO 95 HD1 PRO 95 11.713 -18.008 -9.525 733 H HIS 96 HN HIS 96 11.656 -15.341 -6.445 734 HA HIS 96 HA HIS 96 12.706 -14.931 -3.688 735 HB2 HIS 96 HB2 HIS 96 14.201 -14.180 -5.504 736 HB3 HIS 96 HB1 HIS 96 12.914 -13.145 -6.126 737 HD1 HIS 96 HD1 HIS 96 14.991 -13.625 -2.971 738 HD2 HIS 96 HD2 HIS 96 12.727 -10.675 -4.856 739 HE1 HIS 96 HE1 HIS 96 15.305 -11.504 -1.619 740 HE2 HIS 96 HE2 HIS 96 13.931 -9.697 -2.756 741 H ALA 97 HN ALA 97 10.799 -14.824 -2.585 742 HA ALA 97 HA ALA 97 9.433 -12.291 -2.681 743 HB1 ALA 97 HB1 ALA 97 8.208 -13.458 -4.469 744 HB2 ALA 97 HB2 ALA 97 7.173 -13.243 -3.059 745 HB3 ALA 97 HB3 ALA 97 7.900 -14.819 -3.389 746 H LYS 98 HN LYS 98 7.269 -14.511 -1.557 747 HA LYS 98 HA LYS 98 8.485 -15.346 0.850 748 HB2 LYS 98 HB2 LYS 98 7.279 -13.997 2.485 749 HB3 LYS 98 HB1 LYS 98 8.314 -12.983 1.497 750 HG2 LYS 98 HG2 LYS 98 6.379 -12.283 0.142 751 HG3 LYS 98 HG1 LYS 98 5.330 -13.341 1.075 752 HD2 LYS 98 HD2 LYS 98 5.011 -11.205 2.070 753 HD3 LYS 98 HD1 LYS 98 6.115 -12.029 3.163 754 HE2 LYS 98 HE2 LYS 98 8.005 -10.811 2.310 755 HE3 LYS 98 HE1 LYS 98 7.073 -10.184 0.951 756 HZ1 LYS 98 HZ1 LYS 98 5.812 -8.829 2.370 757 HZ2 LYS 98 HZ2 LYS 98 7.417 -8.635 2.888 758 HZ3 LYS 98 HZ3 LYS 98 6.351 -9.624 3.768 Start of MODEL 12 1 H1 GLY 1 H1 GLY 1 5.099 -18.062 -6.028 2 H2 GLY 1 H2 GLY 1 6.580 -17.866 -5.222 3 H3 GLY 1 H3 GLY 1 6.250 -16.972 -6.628 4 HA2 GLY 1 HA3 GLY 1 4.254 -16.592 -4.619 5 HA3 GLY 1 HA2 GLY 1 5.864 -16.126 -4.070 6 H VAL 2 HN VAL 2 3.315 -14.667 -5.055 7 HA VAL 2 HA VAL 2 4.221 -13.171 -7.365 8 HB VAL 2 HB VAL 2 1.890 -12.521 -5.535 9 HG11 VAL 2 HG11 VAL 2 2.598 -10.802 -7.208 10 HG12 VAL 2 HG12 VAL 2 0.987 -11.443 -7.531 11 HG13 VAL 2 HG13 VAL 2 2.364 -11.995 -8.486 12 HG21 VAL 2 HG21 VAL 2 0.503 -13.885 -7.018 13 HG22 VAL 2 HG22 VAL 2 1.763 -14.893 -6.312 14 HG23 VAL 2 HG23 VAL 2 1.912 -14.327 -7.979 15 H TYR 3 HN TYR 3 5.010 -11.122 -7.414 16 HA TYR 3 HA TYR 3 5.231 -9.550 -4.946 17 HB2 TYR 3 HB2 TYR 3 7.638 -9.286 -5.082 18 HB3 TYR 3 HB1 TYR 3 7.240 -10.992 -4.918 19 HD1 TYR 3 HD2 TYR 3 7.528 -12.554 -6.808 20 HD2 TYR 3 HD1 TYR 3 8.545 -8.393 -7.176 21 HE1 TYR 3 HE2 TYR 3 8.800 -13.045 -8.879 22 HE2 TYR 3 HE1 TYR 3 9.820 -8.890 -9.244 23 HH TYR 3 HH TYR 3 9.992 -12.205 -10.543 24 H HIS 4 HN HIS 4 5.826 -7.374 -5.290 25 HA HIS 4 HA HIS 4 4.844 -6.351 -7.814 26 HB2 HIS 4 HB2 HIS 4 5.236 -4.116 -6.776 27 HB3 HIS 4 HB1 HIS 4 4.201 -5.172 -5.817 28 HD1 HIS 4 HD1 HIS 4 5.269 -6.247 -3.663 29 HD2 HIS 4 HD2 HIS 4 7.660 -3.397 -5.543 30 HE1 HIS 4 HE1 HIS 4 7.051 -5.594 -1.991 31 HE2 HIS 4 HE2 HIS 4 8.519 -3.856 -3.122 32 H ARG 5 HN ARG 5 5.963 -5.553 -9.470 33 HA ARG 5 HA ARG 5 8.935 -5.394 -9.246 34 HB2 ARG 5 HB2 ARG 5 8.274 -7.320 -10.573 35 HB3 ARG 5 HB1 ARG 5 7.239 -6.314 -11.581 36 HG2 ARG 5 HG2 ARG 5 9.113 -5.129 -12.478 37 HG3 ARG 5 HG1 ARG 5 10.215 -5.836 -11.298 38 HD2 ARG 5 HD2 ARG 5 10.422 -6.919 -13.502 39 HD3 ARG 5 HD1 ARG 5 9.869 -8.059 -12.283 40 HE ARG 5 HE ARG 5 7.596 -6.991 -13.529 41 HH11 ARG 5 HH21 ARG 5 10.326 -8.997 -14.221 42 HH12 ARG 5 HH22 ARG 5 9.576 -9.746 -15.590 43 HH21 ARG 5 HH11 ARG 5 6.632 -7.953 -15.306 44 HH22 ARG 5 HH12 ARG 5 7.492 -9.158 -16.205 45 H GLU 6 HN GLU 6 9.733 -3.460 -9.597 46 HA GLU 6 HA GLU 6 8.142 -1.426 -11.069 47 HB2 GLU 6 HB2 GLU 6 8.558 -0.959 -8.654 48 HB3 GLU 6 HB1 GLU 6 10.290 -1.007 -8.972 49 HG2 GLU 6 HG2 GLU 6 10.088 0.871 -10.537 50 HG3 GLU 6 HG1 GLU 6 8.337 0.884 -10.322 51 H ALA 7 HN ALA 7 9.007 -0.461 -12.783 52 HA ALA 7 HA ALA 7 11.292 -1.542 -14.068 53 HB1 ALA 7 HB1 ALA 7 9.715 0.976 -14.584 54 HB2 ALA 7 HB2 ALA 7 9.537 -0.576 -15.394 55 HB3 ALA 7 HB3 ALA 7 10.992 0.392 -15.650 56 H ARG 8 HN ARG 8 13.331 -0.725 -14.378 57 HA ARG 8 HA ARG 8 14.383 0.961 -12.262 58 HB2 ARG 8 HB2 ARG 8 15.775 -0.299 -14.642 59 HB3 ARG 8 HB1 ARG 8 16.562 0.399 -13.226 60 HG2 ARG 8 HG2 ARG 8 14.609 -1.930 -13.063 61 HG3 ARG 8 HG1 ARG 8 16.352 -2.149 -13.178 62 HD2 ARG 8 HD2 ARG 8 16.570 -0.716 -11.118 63 HD3 ARG 8 HD1 ARG 8 14.824 -0.768 -10.952 64 HE ARG 8 HE ARG 8 15.927 -3.392 -11.130 65 HH11 ARG 8 HH21 ARG 8 15.412 -0.643 -9.115 66 HH12 ARG 8 HH22 ARG 8 15.587 -1.520 -7.631 67 HH21 ARG 8 HH11 ARG 8 16.148 -4.566 -9.169 68 HH22 ARG 8 HH12 ARG 8 16.005 -3.731 -7.655 69 H SER 9 HN SER 9 14.262 1.100 -15.804 70 HA SER 9 HA SER 9 14.785 4.030 -15.662 71 HB2 SER 9 HB2 SER 9 15.544 3.770 -18.019 72 HB3 SER 9 HB1 SER 9 16.531 2.869 -16.875 73 HG SER 9 HG SER 9 15.728 1.784 -18.886 74 H GLY 10 HN GLY 10 12.163 2.808 -15.278 75 HA2 GLY 10 HA3 GLY 10 10.704 4.362 -17.232 76 HA3 GLY 10 HA2 GLY 10 10.487 2.624 -17.424 77 H LYS 11 HN LYS 11 8.350 2.607 -16.872 78 HA LYS 11 HA LYS 11 7.703 2.303 -14.161 79 HB2 LYS 11 HB2 LYS 11 7.645 5.047 -15.057 80 HB3 LYS 11 HB1 LYS 11 5.981 4.569 -14.773 81 HG2 LYS 11 HG2 LYS 11 8.190 4.130 -12.731 82 HG3 LYS 11 HG1 LYS 11 7.189 5.578 -12.773 83 HD2 LYS 11 HD2 LYS 11 5.162 4.205 -12.500 84 HD3 LYS 11 HD1 LYS 11 6.142 2.741 -12.468 85 HE2 LYS 11 HE2 LYS 11 7.311 3.557 -10.459 86 HE3 LYS 11 HE1 LYS 11 6.342 5.031 -10.494 87 HZ1 LYS 11 HZ1 LYS 11 5.548 2.298 -9.807 88 HZ2 LYS 11 HZ2 LYS 11 4.393 3.309 -10.535 89 HZ3 LYS 11 HZ3 LYS 11 5.123 3.762 -9.068 90 H TYR 12 HN TYR 12 6.179 3.456 -17.170 91 HA TYR 12 HA TYR 12 4.323 1.145 -17.086 92 HB2 TYR 12 HB2 TYR 12 3.575 4.023 -17.680 93 HB3 TYR 12 HB1 TYR 12 2.516 2.634 -17.908 94 HD1 TYR 12 HD2 TYR 12 1.986 1.151 -15.879 95 HD2 TYR 12 HD1 TYR 12 3.749 5.058 -15.528 96 HE1 TYR 12 HE2 TYR 12 1.271 1.266 -13.506 97 HE2 TYR 12 HE1 TYR 12 3.029 5.166 -13.158 98 HH TYR 12 HH TYR 12 1.289 2.454 -11.635 99 H LYS 13 HN LYS 13 6.808 2.267 -18.678 100 HA LYS 13 HA LYS 13 5.695 2.202 -21.404 101 HB2 LYS 13 HB2 LYS 13 7.470 3.885 -20.555 102 HB3 LYS 13 HB1 LYS 13 8.612 2.551 -20.672 103 HG2 LYS 13 HG2 LYS 13 8.146 2.306 -23.062 104 HG3 LYS 13 HG1 LYS 13 6.872 3.520 -22.974 105 HD2 LYS 13 HD2 LYS 13 8.548 5.202 -22.270 106 HD3 LYS 13 HD1 LYS 13 9.817 3.989 -22.440 107 HE2 LYS 13 HE2 LYS 13 7.974 4.913 -24.666 108 HE3 LYS 13 HE1 LYS 13 9.652 5.416 -24.461 109 HZ1 LYS 13 HZ1 LYS 13 10.089 2.883 -24.434 110 HZ2 LYS 13 HZ2 LYS 13 9.846 3.671 -25.919 111 HZ3 LYS 13 HZ3 LYS 13 8.586 2.780 -25.209 112 H LEU 14 HN LEU 14 5.521 -0.187 -19.894 113 HA LEU 14 HA LEU 14 7.415 -1.969 -21.356 114 HB2 LEU 14 HB2 LEU 14 6.202 -2.316 -18.595 115 HB3 LEU 14 HB1 LEU 14 7.032 -3.596 -19.475 116 HG LEU 14 HG LEU 14 8.996 -1.767 -19.648 117 HD11 LEU 14 HD11 LEU 14 7.642 -0.968 -17.055 118 HD12 LEU 14 HD12 LEU 14 7.600 0.005 -18.518 119 HD13 LEU 14 HD13 LEU 14 9.134 -0.315 -17.726 120 HD21 LEU 14 HD21 LEU 14 9.959 -2.674 -17.551 121 HD22 LEU 14 HD22 LEU 14 9.221 -3.943 -18.533 122 HD23 LEU 14 HD23 LEU 14 8.374 -3.317 -17.116 123 H THR 15 HN THR 15 6.584 -3.440 -22.646 124 HA THR 15 HA THR 15 3.648 -3.668 -22.850 125 HB THR 15 HB THR 15 4.098 -4.757 -25.002 126 HG1 THR 15 HG1 THR 15 6.822 -4.197 -24.526 127 HG21 THR 15 HG21 THR 15 4.975 -2.817 -26.160 128 HG22 THR 15 HG22 THR 15 5.731 -2.228 -24.680 129 HG23 THR 15 HG23 THR 15 3.973 -2.268 -24.819 130 H TYR 16 HN TYR 16 2.807 -5.869 -23.403 131 HA TYR 16 HA TYR 16 3.290 -7.652 -21.288 132 HB2 TYR 16 HB2 TYR 16 1.804 -9.184 -22.432 133 HB3 TYR 16 HB1 TYR 16 1.174 -7.547 -22.592 134 HD1 TYR 16 HD2 TYR 16 1.397 -6.306 -24.741 135 HD2 TYR 16 HD1 TYR 16 2.611 -10.413 -24.368 136 HE1 TYR 16 HE2 TYR 16 1.434 -6.523 -27.211 137 HE2 TYR 16 HE1 TYR 16 2.645 -10.626 -26.836 138 HH TYR 16 HH TYR 16 1.242 -8.343 -28.898 139 H ALA 17 HN ALA 17 4.460 -7.637 -24.625 140 HA ALA 17 HA ALA 17 5.686 -10.135 -24.712 141 HB1 ALA 17 HB1 ALA 17 7.081 -9.249 -26.472 142 HB2 ALA 17 HB2 ALA 17 6.788 -7.596 -25.935 143 HB3 ALA 17 HB3 ALA 17 5.474 -8.542 -26.634 144 H GLU 18 HN GLU 18 6.917 -7.086 -23.371 145 HA GLU 18 HA GLU 18 9.548 -7.951 -22.840 146 HB2 GLU 18 HB2 GLU 18 7.838 -5.952 -21.330 147 HB3 GLU 18 HB1 GLU 18 9.571 -6.160 -21.093 148 HG2 GLU 18 HG2 GLU 18 8.285 -5.433 -23.741 149 HG3 GLU 18 HG1 GLU 18 9.003 -4.271 -22.630 150 H ALA 19 HN ALA 19 6.665 -7.976 -20.741 151 HA ALA 19 HA ALA 19 7.851 -9.100 -18.473 152 HB1 ALA 19 HB1 ALA 19 5.633 -8.169 -18.349 153 HB2 ALA 19 HB2 ALA 19 5.532 -9.874 -17.910 154 HB3 ALA 19 HB3 ALA 19 5.022 -9.344 -19.515 155 H LYS 20 HN LYS 20 6.783 -10.610 -21.444 156 HA LYS 20 HA LYS 20 6.801 -13.307 -20.487 157 HB2 LYS 20 HB2 LYS 20 5.607 -12.546 -22.528 158 HB3 LYS 20 HB1 LYS 20 7.163 -12.302 -23.311 159 HG2 LYS 20 HG2 LYS 20 7.712 -14.668 -23.054 160 HG3 LYS 20 HG1 LYS 20 6.203 -14.939 -22.174 161 HD2 LYS 20 HD2 LYS 20 4.920 -14.218 -24.136 162 HD3 LYS 20 HD1 LYS 20 6.416 -13.923 -25.016 163 HE2 LYS 20 HE2 LYS 20 5.674 -16.091 -25.722 164 HE3 LYS 20 HE1 LYS 20 6.987 -16.399 -24.586 165 HZ1 LYS 20 HZ1 LYS 20 5.160 -17.809 -24.042 166 HZ2 LYS 20 HZ2 LYS 20 4.073 -16.505 -24.029 167 HZ3 LYS 20 HZ3 LYS 20 5.275 -16.626 -22.834 168 H ALA 21 HN ALA 21 9.203 -11.189 -21.991 169 HA ALA 21 HA ALA 21 11.183 -13.155 -22.450 170 HB1 ALA 21 HB1 ALA 21 11.325 -10.984 -23.512 171 HB2 ALA 21 HB2 ALA 21 12.754 -11.219 -22.506 172 HB3 ALA 21 HB3 ALA 21 11.441 -10.185 -21.944 173 H VAL 22 HN VAL 22 10.733 -10.911 -19.706 174 HA VAL 22 HA VAL 22 12.972 -11.791 -18.213 175 HB VAL 22 HB VAL 22 10.392 -10.546 -17.225 176 HG11 VAL 22 HG11 VAL 22 11.602 -11.489 -15.356 177 HG12 VAL 22 HG12 VAL 22 11.904 -9.753 -15.353 178 HG13 VAL 22 HG13 VAL 22 13.133 -10.862 -15.966 179 HG21 VAL 22 HG21 VAL 22 11.684 -8.432 -17.362 180 HG22 VAL 22 HG22 VAL 22 11.519 -9.190 -18.945 181 HG23 VAL 22 HG23 VAL 22 13.040 -9.317 -18.061 182 H CYS 23 HN CYS 23 9.586 -12.807 -18.218 183 HA CYS 23 HA CYS 23 10.182 -14.940 -16.235 184 HB2 CYS 23 HB2 CYS 23 7.450 -14.278 -17.349 185 HB3 CYS 23 HB1 CYS 23 7.866 -15.014 -15.801 186 H GLU 24 HN GLU 24 8.752 -16.983 -16.753 187 HA GLU 24 HA GLU 24 8.456 -18.854 -18.054 188 HB2 GLU 24 HB2 GLU 24 7.079 -17.267 -19.447 189 HB3 GLU 24 HB1 GLU 24 8.507 -16.972 -20.430 190 HG2 GLU 24 HG2 GLU 24 8.623 -19.291 -21.085 191 HG3 GLU 24 HG1 GLU 24 7.320 -19.714 -19.978 192 H PHE 25 HN PHE 25 11.125 -16.778 -18.454 193 HA PHE 25 HA PHE 25 12.675 -18.175 -20.357 194 HB2 PHE 25 HB2 PHE 25 13.148 -15.882 -19.542 195 HB3 PHE 25 HB1 PHE 25 13.595 -16.546 -17.973 196 HD1 PHE 25 HD1 PHE 25 14.534 -16.329 -21.555 197 HD2 PHE 25 HD2 PHE 25 15.718 -17.697 -17.654 198 HE1 PHE 25 HE1 PHE 25 16.842 -16.705 -22.384 199 HE2 PHE 25 HE2 PHE 25 18.022 -18.074 -18.488 200 HZ PHE 25 HZ PHE 25 18.586 -17.576 -20.850 201 H GLU 26 HN GLU 26 12.643 -18.361 -16.801 202 HA GLU 26 HA GLU 26 14.426 -20.670 -16.809 203 HB2 GLU 26 HB2 GLU 26 14.121 -20.601 -14.346 204 HB3 GLU 26 HB1 GLU 26 14.685 -19.072 -15.013 205 HG2 GLU 26 HG2 GLU 26 12.386 -18.193 -14.965 206 HG3 GLU 26 HG1 GLU 26 11.807 -19.727 -14.314 207 H GLY 27 HN GLY 27 11.733 -20.807 -18.094 208 HA2 GLY 27 HA3 GLY 27 10.304 -22.597 -18.446 209 HA3 GLY 27 HA2 GLY 27 10.983 -23.400 -17.038 210 H GLY 28 HN GLY 28 10.177 -20.296 -16.156 211 HA2 GLY 28 HA3 GLY 28 7.963 -21.163 -14.542 212 HA3 GLY 28 HA2 GLY 28 8.595 -19.524 -14.658 213 H HIS 29 HN HIS 29 6.497 -18.668 -14.723 214 HA HIS 29 HA HIS 29 5.406 -18.347 -17.354 215 HB2 HIS 29 HB2 HIS 29 4.499 -20.579 -16.804 216 HB3 HIS 29 HB1 HIS 29 3.757 -19.912 -15.353 217 HD1 HIS 29 HD1 HIS 29 3.775 -18.992 -19.071 218 HD2 HIS 29 HD2 HIS 29 1.138 -19.264 -15.852 219 HE1 HIS 29 HE1 HIS 29 1.481 -18.402 -19.970 220 HE2 HIS 29 HE2 HIS 29 -0.138 -18.563 -18.021 221 H LEU 30 HN LEU 30 3.967 -16.621 -17.468 222 HA LEU 30 HA LEU 30 4.170 -14.618 -15.510 223 HB2 LEU 30 HB2 LEU 30 2.118 -15.006 -17.692 224 HB3 LEU 30 HB1 LEU 30 2.278 -13.525 -16.760 225 HG LEU 30 HG LEU 30 4.542 -14.714 -18.400 226 HD11 LEU 30 HD11 LEU 30 3.981 -12.983 -20.088 227 HD12 LEU 30 HD12 LEU 30 2.576 -12.514 -19.130 228 HD13 LEU 30 HD13 LEU 30 2.646 -14.115 -19.864 229 HD21 LEU 30 HD21 LEU 30 5.321 -12.254 -18.255 230 HD22 LEU 30 HD22 LEU 30 5.436 -13.184 -16.774 231 HD23 LEU 30 HD23 LEU 30 4.107 -12.051 -16.995 232 H ALA 31 HN ALA 31 2.693 -13.800 -14.031 233 HA ALA 31 HA ALA 31 1.210 -15.733 -12.580 234 HB1 ALA 31 HB1 ALA 31 2.354 -13.533 -11.790 235 HB2 ALA 31 HB2 ALA 31 0.848 -14.018 -11.021 236 HB3 ALA 31 HB3 ALA 31 0.848 -12.758 -12.262 237 H THR 32 HN THR 32 -0.998 -15.977 -12.309 238 HA THR 32 HA THR 32 -2.773 -14.664 -14.310 239 HB THR 32 HB THR 32 -2.380 -16.958 -15.008 240 HG1 THR 32 HG1 THR 32 -4.869 -17.144 -13.785 241 HG21 THR 32 HG21 THR 32 -1.703 -17.865 -12.815 242 HG22 THR 32 HG22 THR 32 -2.966 -18.845 -13.556 243 HG23 THR 32 HG23 THR 32 -3.365 -17.732 -12.249 244 H TYR 33 HN TYR 33 -5.145 -15.188 -13.671 245 HA TYR 33 HA TYR 33 -5.771 -13.761 -11.349 246 HB2 TYR 33 HB2 TYR 33 -7.336 -13.951 -13.177 247 HB3 TYR 33 HB1 TYR 33 -7.417 -15.697 -12.989 248 HD1 TYR 33 HD1 TYR 33 -8.320 -12.438 -11.447 249 HD2 TYR 33 HD2 TYR 33 -8.783 -16.709 -11.260 250 HE1 TYR 33 HE1 TYR 33 -10.179 -12.169 -9.826 251 HE2 TYR 33 HE2 TYR 33 -10.638 -16.435 -9.639 252 HH TYR 33 HH TYR 33 -11.263 -13.564 -8.021 253 H LYS 34 HN LYS 34 -5.978 -17.272 -11.942 254 HA LYS 34 HA LYS 34 -6.862 -18.138 -9.470 255 HB2 LYS 34 HB2 LYS 34 -4.834 -19.416 -11.324 256 HB3 LYS 34 HB1 LYS 34 -5.559 -20.246 -9.947 257 HG2 LYS 34 HG2 LYS 34 -7.803 -19.894 -10.908 258 HG3 LYS 34 HG1 LYS 34 -7.088 -19.054 -12.283 259 HD2 LYS 34 HD2 LYS 34 -5.865 -21.070 -12.928 260 HD3 LYS 34 HD1 LYS 34 -6.473 -21.922 -11.509 261 HE2 LYS 34 HE2 LYS 34 -7.823 -22.561 -13.423 262 HE3 LYS 34 HE1 LYS 34 -8.805 -21.557 -12.358 263 HZ1 LYS 34 HZ1 LYS 34 -9.061 -20.082 -13.968 264 HZ2 LYS 34 HZ2 LYS 34 -8.255 -21.130 -15.033 265 HZ3 LYS 34 HZ3 LYS 34 -7.386 -19.940 -14.189 266 H GLN 35 HN GLN 35 -3.474 -17.527 -10.422 267 HA GLN 35 HA GLN 35 -2.374 -18.175 -7.867 268 HB2 GLN 35 HB2 GLN 35 -1.265 -16.553 -10.173 269 HB3 GLN 35 HB1 GLN 35 -0.335 -16.968 -8.733 270 HG2 GLN 35 HG2 GLN 35 -0.683 -19.362 -9.178 271 HG3 GLN 35 HG1 GLN 35 -1.643 -18.967 -10.604 272 HE21 GLN 35 HE21 GLN 35 1.496 -19.741 -9.602 273 HE22 GLN 35 HE22 GLN 35 2.342 -19.156 -10.953 274 H LEU 36 HN LEU 36 -3.270 -15.129 -9.440 275 HA LEU 36 HA LEU 36 -2.393 -13.406 -7.378 276 HB2 LEU 36 HB2 LEU 36 -4.135 -13.228 -9.772 277 HB3 LEU 36 HB1 LEU 36 -4.447 -12.002 -8.574 278 HG LEU 36 HG LEU 36 -2.771 -11.439 -10.441 279 HD11 LEU 36 HD11 LEU 36 -1.903 -11.120 -7.548 280 HD12 LEU 36 HD12 LEU 36 -2.989 -10.059 -8.437 281 HD13 LEU 36 HD13 LEU 36 -1.293 -10.174 -8.904 282 HD21 LEU 36 HD21 LEU 36 -0.656 -12.816 -8.806 283 HD22 LEU 36 HD22 LEU 36 -0.651 -12.314 -10.486 284 HD23 LEU 36 HD23 LEU 36 -1.543 -13.750 -10.008 285 H GLU 37 HN GLU 37 -5.526 -14.989 -7.954 286 HA GLU 37 HA GLU 37 -6.967 -13.730 -5.896 287 HB2 GLU 37 HB2 GLU 37 -7.936 -15.139 -7.738 288 HB3 GLU 37 HB1 GLU 37 -7.341 -16.566 -6.895 289 HG2 GLU 37 HG2 GLU 37 -9.647 -16.276 -6.265 290 HG3 GLU 37 HG1 GLU 37 -8.679 -15.816 -4.871 291 H ALA 38 HN ALA 38 -4.682 -16.366 -5.858 292 HA ALA 38 HA ALA 38 -5.318 -17.256 -3.183 293 HB1 ALA 38 HB1 ALA 38 -3.382 -18.681 -3.412 294 HB2 ALA 38 HB2 ALA 38 -2.824 -17.764 -4.812 295 HB3 ALA 38 HB3 ALA 38 -4.299 -18.725 -4.919 296 H ALA 39 HN ALA 39 -3.215 -14.879 -4.612 297 HA ALA 39 HA ALA 39 -1.525 -14.564 -2.294 298 HB1 ALA 39 HB1 ALA 39 -0.398 -12.915 -3.539 299 HB2 ALA 39 HB2 ALA 39 -1.837 -12.489 -4.468 300 HB3 ALA 39 HB3 ALA 39 -1.000 -14.007 -4.785 301 H ARG 40 HN ARG 40 -4.532 -13.175 -3.425 302 HA ARG 40 HA ARG 40 -4.606 -10.788 -1.956 303 HB2 ARG 40 HB2 ARG 40 -6.885 -12.684 -2.575 304 HB3 ARG 40 HB1 ARG 40 -7.101 -11.043 -1.961 305 HG2 ARG 40 HG2 ARG 40 -5.743 -11.801 -4.554 306 HG3 ARG 40 HG1 ARG 40 -7.375 -11.182 -4.417 307 HD2 ARG 40 HD2 ARG 40 -4.743 -9.731 -4.089 308 HD3 ARG 40 HD1 ARG 40 -6.186 -9.224 -4.965 309 HE ARG 40 HE ARG 40 -5.574 -8.605 -2.243 310 HH11 ARG 40 HH21 ARG 40 -8.184 -9.584 -4.247 311 HH12 ARG 40 HH22 ARG 40 -9.352 -8.637 -3.396 312 HH21 ARG 40 HH11 ARG 40 -7.115 -7.320 -1.160 313 HH22 ARG 40 HH12 ARG 40 -8.765 -7.389 -1.671 314 H LYS 41 HN LYS 41 -5.064 -14.108 -0.919 315 HA LYS 41 HA LYS 41 -6.070 -13.377 1.709 316 HB2 LYS 41 HB2 LYS 41 -5.194 -16.023 0.529 317 HB3 LYS 41 HB1 LYS 41 -5.863 -15.830 2.150 318 HG2 LYS 41 HG2 LYS 41 -7.925 -14.863 1.174 319 HG3 LYS 41 HG1 LYS 41 -7.259 -15.099 -0.444 320 HD2 LYS 41 HD2 LYS 41 -7.070 -17.541 0.023 321 HD3 LYS 41 HD1 LYS 41 -7.840 -17.275 1.588 322 HE2 LYS 41 HE2 LYS 41 -9.100 -16.555 -1.076 323 HE3 LYS 41 HE1 LYS 41 -9.444 -18.034 -0.179 324 HZ1 LYS 41 HZ1 LYS 41 -10.939 -15.968 0.143 325 HZ2 LYS 41 HZ2 LYS 41 -9.692 -15.429 1.162 326 HZ3 LYS 41 HZ3 LYS 41 -10.492 -16.890 1.494 327 H ILE 42 HN ILE 42 -3.073 -13.251 0.297 328 HA ILE 42 HA ILE 42 -1.601 -13.943 2.791 329 HB ILE 42 HB ILE 42 -0.473 -13.466 0.017 330 HG12 ILE 42 HG12 ILE 42 -1.955 -15.387 -0.083 331 HG13 ILE 42 HG11 ILE 42 -0.292 -15.961 -0.089 332 HG21 ILE 42 HG21 ILE 42 1.319 -13.224 1.561 333 HG22 ILE 42 HG22 ILE 42 1.425 -14.908 1.081 334 HG23 ILE 42 HG23 ILE 42 0.695 -14.480 2.627 335 HD11 ILE 42 HD11 ILE 42 -2.338 -16.119 2.115 336 HD12 ILE 42 HD12 ILE 42 -0.622 -16.171 2.513 337 HD13 ILE 42 HD13 ILE 42 -1.319 -17.394 1.458 338 H GLY 43 HN GLY 43 -3.063 -11.340 1.565 339 HA2 GLY 43 HA3 GLY 43 -2.889 -9.156 2.377 340 HA3 GLY 43 HA2 GLY 43 -1.249 -9.481 2.922 341 H PHE 44 HN PHE 44 -2.007 -10.449 -0.292 342 HA PHE 44 HA PHE 44 -0.006 -8.937 -1.506 343 HB2 PHE 44 HB2 PHE 44 -1.186 -10.962 -2.439 344 HB3 PHE 44 HB1 PHE 44 -2.545 -9.925 -2.828 345 HD1 PHE 44 HD1 PHE 44 1.207 -9.936 -3.241 346 HD2 PHE 44 HD2 PHE 44 -2.613 -9.109 -5.050 347 HE1 PHE 44 HE1 PHE 44 2.333 -9.318 -5.354 348 HE2 PHE 44 HE2 PHE 44 -1.476 -8.502 -7.163 349 HZ PHE 44 HZ PHE 44 0.998 -8.603 -7.316 350 H HIS 45 HN HIS 45 0.163 -6.866 -2.033 351 HA HIS 45 HA HIS 45 -2.287 -5.207 -2.371 352 HB2 HIS 45 HB2 HIS 45 -1.438 -4.749 -0.170 353 HB3 HIS 45 HB1 HIS 45 0.205 -4.602 -0.764 354 HD1 HIS 45 HD1 HIS 45 -2.393 -3.035 -2.887 355 HD2 HIS 45 HD2 HIS 45 0.124 -1.850 0.216 356 HE1 HIS 45 HE1 HIS 45 -2.429 -0.502 -2.863 357 HE2 HIS 45 HE2 HIS 45 -0.888 0.237 -0.983 358 H VAL 46 HN VAL 46 -2.328 -4.085 -4.180 359 HA VAL 46 HA VAL 46 0.185 -3.304 -5.537 360 HB VAL 46 HB VAL 46 -2.110 -4.780 -6.861 361 HG11 VAL 46 HG11 VAL 46 -1.347 -3.140 -8.435 362 HG12 VAL 46 HG12 VAL 46 -0.520 -4.628 -8.880 363 HG13 VAL 46 HG13 VAL 46 0.340 -3.377 -7.981 364 HG21 VAL 46 HG21 VAL 46 -0.587 -6.256 -5.640 365 HG22 VAL 46 HG22 VAL 46 0.808 -5.476 -6.387 366 HG23 VAL 46 HG23 VAL 46 -0.302 -6.426 -7.372 367 H CYS 47 HN CYS 47 -0.121 -1.661 -7.151 368 HA CYS 47 HA CYS 47 -2.640 -0.227 -7.279 369 HB2 CYS 47 HB2 CYS 47 -1.538 0.474 -5.090 370 HB3 CYS 47 HB1 CYS 47 -0.286 1.242 -6.068 371 H ALA 48 HN ALA 48 -0.820 -1.494 -9.141 372 HA ALA 48 HA ALA 48 -0.396 0.803 -10.943 373 HB1 ALA 48 HB1 ALA 48 1.849 -0.083 -11.578 374 HB2 ALA 48 HB2 ALA 48 1.748 -1.217 -10.231 375 HB3 ALA 48 HB3 ALA 48 1.785 0.518 -9.923 376 H ALA 49 HN ALA 49 -1.129 0.369 -12.896 377 HA ALA 49 HA ALA 49 -2.272 -2.162 -13.539 378 HB1 ALA 49 HB1 ALA 49 -1.705 0.101 -15.459 379 HB2 ALA 49 HB2 ALA 49 -3.054 0.124 -14.320 380 HB3 ALA 49 HB3 ALA 49 -2.975 -1.123 -15.569 381 H GLY 50 HN GLY 50 -1.439 -3.856 -14.597 382 HA2 GLY 50 HA3 GLY 50 0.858 -3.572 -16.382 383 HA3 GLY 50 HA2 GLY 50 1.190 -4.450 -14.893 384 H TRP 51 HN TRP 51 1.098 -5.241 -17.776 385 HA TRP 51 HA TRP 51 -1.125 -6.941 -18.252 386 HB2 TRP 51 HB2 TRP 51 1.658 -7.396 -19.364 387 HB3 TRP 51 HB1 TRP 51 0.109 -7.769 -20.113 388 HD1 TRP 51 HD1 TRP 51 2.339 -4.813 -19.156 389 HE1 TRP 51 HE1 TRP 51 1.729 -2.827 -20.661 390 HE3 TRP 51 HE3 TRP 51 -1.708 -6.734 -21.618 391 HZ2 TRP 51 HZ2 TRP 51 -0.176 -2.120 -22.645 392 HZ3 TRP 51 HZ3 TRP 51 -2.896 -5.369 -23.310 393 HH2 TRP 51 HH2 TRP 51 -2.132 -3.070 -23.825 394 H MET 52 HN MET 52 -1.123 -9.280 -18.276 395 HA MET 52 HA MET 52 0.893 -10.692 -16.687 396 HB2 MET 52 HB2 MET 52 -2.020 -10.798 -15.841 397 HB3 MET 52 HB1 MET 52 -0.666 -11.618 -15.099 398 HG2 MET 52 HG2 MET 52 0.353 -9.370 -14.607 399 HG3 MET 52 HG1 MET 52 -1.152 -8.636 -15.158 400 HE1 MET 52 HE1 MET 52 -3.769 -9.440 -12.650 401 HE2 MET 52 HE2 MET 52 -3.523 -10.636 -13.921 402 HE3 MET 52 HE3 MET 52 -3.326 -8.923 -14.281 403 H ALA 53 HN ALA 53 -0.062 -13.081 -16.398 404 HA ALA 53 HA ALA 53 0.094 -14.408 -18.764 405 HB1 ALA 53 HB1 ALA 53 0.040 -15.528 -16.584 406 HB2 ALA 53 HB2 ALA 53 -1.088 -16.282 -17.707 407 HB3 ALA 53 HB3 ALA 53 -1.684 -15.193 -16.453 408 H LYS 54 HN LYS 54 -1.055 -14.646 -20.540 409 HA LYS 54 HA LYS 54 -2.752 -14.577 -22.046 410 HB2 LYS 54 HB2 LYS 54 -3.882 -15.919 -20.082 411 HB3 LYS 54 HB1 LYS 54 -4.786 -14.435 -19.804 412 HG2 LYS 54 HG2 LYS 54 -5.610 -14.482 -22.122 413 HG3 LYS 54 HG1 LYS 54 -4.656 -15.927 -22.451 414 HD2 LYS 54 HD2 LYS 54 -5.916 -17.131 -20.676 415 HD3 LYS 54 HD1 LYS 54 -6.914 -15.695 -20.447 416 HE2 LYS 54 HE2 LYS 54 -7.648 -15.822 -22.799 417 HE3 LYS 54 HE1 LYS 54 -6.646 -17.253 -23.034 418 HZ1 LYS 54 HZ1 LYS 54 -8.279 -18.490 -22.242 419 HZ2 LYS 54 HZ2 LYS 54 -9.246 -17.112 -22.012 420 HZ3 LYS 54 HZ3 LYS 54 -8.227 -17.655 -20.767 421 H GLY 55 HN GLY 55 -1.518 -12.172 -21.179 422 HA2 GLY 55 HA3 GLY 55 -1.740 -9.890 -21.259 423 HA3 GLY 55 HA2 GLY 55 -3.023 -10.242 -22.406 424 H ARG 56 HN ARG 56 -3.751 -11.671 -19.486 425 HA ARG 56 HA ARG 56 -5.992 -9.964 -18.996 426 HB2 ARG 56 HB2 ARG 56 -5.722 -12.440 -18.377 427 HB3 ARG 56 HB1 ARG 56 -4.770 -11.891 -17.011 428 HG2 ARG 56 HG2 ARG 56 -6.649 -10.583 -16.157 429 HG3 ARG 56 HG1 ARG 56 -7.613 -11.020 -17.569 430 HD2 ARG 56 HD2 ARG 56 -7.379 -13.422 -16.935 431 HD3 ARG 56 HD1 ARG 56 -6.538 -12.921 -15.465 432 HE ARG 56 HE ARG 56 -9.385 -12.795 -15.956 433 HH11 ARG 56 HH21 ARG 56 -6.663 -11.428 -14.291 434 HH12 ARG 56 HH22 ARG 56 -7.629 -10.789 -13.002 435 HH21 ARG 56 HH11 ARG 56 -10.619 -11.946 -14.210 436 HH22 ARG 56 HH12 ARG 56 -9.809 -11.098 -12.939 437 H VAL 57 HN VAL 57 -5.182 -7.857 -18.766 438 HA VAL 57 HA VAL 57 -3.186 -7.135 -16.859 439 HB VAL 57 HB VAL 57 -3.738 -5.723 -18.817 440 HG11 VAL 57 HG11 VAL 57 -6.246 -6.170 -18.642 441 HG12 VAL 57 HG12 VAL 57 -5.803 -4.488 -18.930 442 HG13 VAL 57 HG13 VAL 57 -6.283 -5.005 -17.314 443 HG21 VAL 57 HG21 VAL 57 -2.709 -4.766 -16.731 444 HG22 VAL 57 HG22 VAL 57 -4.321 -4.295 -16.200 445 HG23 VAL 57 HG23 VAL 57 -3.635 -3.593 -17.663 446 H GLY 58 HN GLY 58 -3.334 -6.637 -14.760 447 HA2 GLY 58 HA3 GLY 58 -5.897 -6.007 -13.510 448 HA3 GLY 58 HA2 GLY 58 -5.201 -7.557 -13.048 449 H TYR 59 HN TYR 59 -5.712 -5.318 -11.352 450 HA TYR 59 HA TYR 59 -3.145 -5.158 -10.047 451 HB2 TYR 59 HB2 TYR 59 -3.051 -2.653 -10.035 452 HB3 TYR 59 HB1 TYR 59 -2.692 -3.402 -11.581 453 HD1 TYR 59 HD2 TYR 59 -4.472 -3.448 -13.395 454 HD2 TYR 59 HD1 TYR 59 -4.895 -1.123 -9.801 455 HE1 TYR 59 HE2 TYR 59 -6.220 -2.075 -14.485 456 HE2 TYR 59 HE1 TYR 59 -6.637 0.253 -10.901 457 HH TYR 59 HH TYR 59 -8.176 -0.648 -13.730 458 HA PRO 60 HA PRO 60 -6.892 -5.167 -7.303 459 HB2 PRO 60 HB2 PRO 60 -4.831 -6.517 -5.574 460 HB3 PRO 60 HB1 PRO 60 -6.527 -6.969 -5.860 461 HG2 PRO 60 HG2 PRO 60 -4.566 -8.342 -7.010 462 HG3 PRO 60 HG1 PRO 60 -6.037 -7.960 -7.920 463 HD2 PRO 60 HD2 PRO 60 -3.337 -6.639 -8.097 464 HD3 PRO 60 HD1 PRO 60 -4.476 -7.048 -9.402 465 H ILE 61 HN ILE 61 -7.370 -3.545 -5.938 466 HA ILE 61 HA ILE 61 -5.145 -2.033 -4.631 467 HB ILE 61 HB ILE 61 -7.808 -0.966 -5.619 468 HG12 ILE 61 HG12 ILE 61 -5.003 -0.421 -6.661 469 HG13 ILE 61 HG11 ILE 61 -6.104 -1.583 -7.397 470 HG21 ILE 61 HG21 ILE 61 -7.072 0.277 -3.674 471 HG22 ILE 61 HG22 ILE 61 -6.677 1.253 -5.085 472 HG23 ILE 61 HG23 ILE 61 -5.413 0.331 -4.271 473 HD11 ILE 61 HD11 ILE 61 -6.221 0.592 -8.553 474 HD12 ILE 61 HD12 ILE 61 -6.667 1.373 -7.036 475 HD13 ILE 61 HD13 ILE 61 -7.757 0.203 -7.778 476 H VAL 62 HN VAL 62 -5.124 -2.628 -2.568 477 HA VAL 62 HA VAL 62 -7.571 -3.298 -1.119 478 HB VAL 62 HB VAL 62 -5.808 -3.515 0.822 479 HG11 VAL 62 HG11 VAL 62 -6.832 -5.450 -0.311 480 HG12 VAL 62 HG12 VAL 62 -5.113 -5.738 -0.022 481 HG13 VAL 62 HG13 VAL 62 -5.672 -5.300 -1.638 482 HG21 VAL 62 HG21 VAL 62 -3.523 -3.674 0.176 483 HG22 VAL 62 HG22 VAL 62 -4.095 -2.184 -0.565 484 HG23 VAL 62 HG23 VAL 62 -3.918 -3.639 -1.542 485 H LYS 63 HN LYS 63 -5.730 -0.506 -1.751 486 HA LYS 63 HA LYS 63 -7.485 1.097 -0.178 487 HB2 LYS 63 HB2 LYS 63 -5.915 2.000 1.441 488 HB3 LYS 63 HB1 LYS 63 -6.042 0.250 1.626 489 HG2 LYS 63 HG2 LYS 63 -3.973 0.079 0.118 490 HG3 LYS 63 HG1 LYS 63 -3.804 1.824 0.307 491 HD2 LYS 63 HD2 LYS 63 -3.578 1.602 2.713 492 HD3 LYS 63 HD1 LYS 63 -3.939 -0.120 2.634 493 HE2 LYS 63 HE2 LYS 63 -1.900 -0.489 1.287 494 HE3 LYS 63 HE1 LYS 63 -1.526 1.230 1.400 495 HZ1 LYS 63 HZ1 LYS 63 -0.434 -0.314 3.080 496 HZ2 LYS 63 HZ2 LYS 63 -1.964 -0.422 3.811 497 HZ3 LYS 63 HZ3 LYS 63 -1.182 1.081 3.689 498 HA PRO 64 HA PRO 64 -6.337 4.041 -3.335 499 HB2 PRO 64 HB2 PRO 64 -6.346 6.059 -1.089 500 HB3 PRO 64 HB1 PRO 64 -7.112 6.161 -2.689 501 HG2 PRO 64 HG2 PRO 64 -8.544 5.612 -0.497 502 HG3 PRO 64 HG1 PRO 64 -8.915 4.851 -2.057 503 HD2 PRO 64 HD2 PRO 64 -7.646 3.624 0.369 504 HD3 PRO 64 HD1 PRO 64 -8.607 2.868 -0.926 505 H GLY 65 HN GLY 65 -4.493 5.100 -4.104 506 HA2 GLY 65 HA3 GLY 65 -2.088 5.038 -2.344 507 HA3 GLY 65 HA2 GLY 65 -2.062 4.598 -4.036 508 HA PRO 66 HA PRO 66 -1.470 9.276 -3.590 509 HB2 PRO 66 HB2 PRO 66 1.161 9.645 -3.105 510 HB3 PRO 66 HB1 PRO 66 0.030 9.285 -1.780 511 HG2 PRO 66 HG2 PRO 66 1.872 7.413 -3.242 512 HG3 PRO 66 HG1 PRO 66 1.608 7.578 -1.493 513 HD2 PRO 66 HD2 PRO 66 0.352 5.635 -3.006 514 HD3 PRO 66 HD1 PRO 66 -0.366 6.336 -1.535 515 H ASN 67 HN ASN 67 0.928 6.999 -4.898 516 HA ASN 67 HA ASN 67 1.628 8.668 -7.147 517 HB2 ASN 67 HB2 ASN 67 2.898 6.690 -7.909 518 HB3 ASN 67 HB1 ASN 67 3.243 7.083 -6.224 519 HD21 ASN 67 HD21 ASN 67 3.552 4.420 -7.431 520 HD22 ASN 67 HD22 ASN 67 2.478 3.390 -6.616 521 H CYS 68 HN CYS 68 -0.833 6.351 -6.480 522 HA CYS 68 HA CYS 68 -1.709 6.413 -9.338 523 HB2 CYS 68 HB2 CYS 68 -2.809 4.075 -8.543 524 HB3 CYS 68 HB1 CYS 68 -1.178 4.156 -9.200 525 H GLY 69 HN GLY 69 -3.843 6.728 -9.726 526 HA2 GLY 69 HA3 GLY 69 -5.323 8.197 -7.818 527 HA3 GLY 69 HA2 GLY 69 -5.934 7.619 -9.364 528 H PHE 70 HN PHE 70 -7.869 7.444 -7.819 529 HA PHE 70 HA PHE 70 -8.184 4.640 -7.103 530 HB2 PHE 70 HB2 PHE 70 -8.968 5.116 -4.822 531 HB3 PHE 70 HB1 PHE 70 -7.280 5.576 -5.027 532 HD1 PHE 70 HD2 PHE 70 -6.617 7.953 -5.151 533 HD2 PHE 70 HD1 PHE 70 -10.716 6.810 -4.534 534 HE1 PHE 70 HE2 PHE 70 -7.159 10.269 -4.448 535 HE2 PHE 70 HE1 PHE 70 -11.251 9.125 -3.829 536 HZ PHE 70 HZ PHE 70 -9.476 10.854 -3.786 537 H GLY 71 HN GLY 71 -10.463 4.228 -6.342 538 HA2 GLY 71 HA3 GLY 71 -12.588 5.996 -6.718 539 HA3 GLY 71 HA2 GLY 71 -12.279 5.246 -8.279 540 H LYS 72 HN LYS 72 -11.320 2.766 -6.870 541 HA LYS 72 HA LYS 72 -13.845 1.706 -5.743 542 HB2 LYS 72 HB2 LYS 72 -12.320 0.536 -8.090 543 HB3 LYS 72 HB1 LYS 72 -13.559 -0.336 -7.185 544 HG2 LYS 72 HG2 LYS 72 -15.207 1.419 -7.755 545 HG3 LYS 72 HG1 LYS 72 -13.971 2.275 -8.676 546 HD2 LYS 72 HD2 LYS 72 -13.706 0.312 -10.154 547 HD3 LYS 72 HD1 LYS 72 -14.946 -0.543 -9.237 548 HE2 LYS 72 HE2 LYS 72 -16.592 1.200 -9.840 549 HE3 LYS 72 HE1 LYS 72 -15.354 2.045 -10.768 550 HZ1 LYS 72 HZ1 LYS 72 -16.528 0.749 -12.307 551 HZ2 LYS 72 HZ2 LYS 72 -16.532 -0.619 -11.299 552 HZ3 LYS 72 HZ3 LYS 72 -15.087 -0.103 -12.031 553 H THR 73 HN THR 73 -13.324 -0.767 -5.230 554 HA THR 73 HA THR 73 -10.628 -1.020 -4.024 555 HB THR 73 HB THR 73 -11.553 -1.757 -1.913 556 HG1 THR 73 HG1 THR 73 -14.047 -1.107 -2.001 557 HG21 THR 73 HG21 THR 73 -11.208 0.685 -2.291 558 HG22 THR 73 HG22 THR 73 -12.481 0.346 -1.120 559 HG23 THR 73 HG23 THR 73 -12.900 0.818 -2.766 560 H GLY 74 HN GLY 74 -10.036 -3.168 -3.500 561 HA2 GLY 74 HA3 GLY 74 -9.891 -5.437 -3.865 562 HA3 GLY 74 HA2 GLY 74 -11.637 -5.435 -4.094 563 H ILE 75 HN ILE 75 -10.009 -7.074 -5.594 564 HA ILE 75 HA ILE 75 -8.905 -6.442 -7.968 565 HB ILE 75 HB ILE 75 -11.125 -8.484 -7.687 566 HG12 ILE 75 HG12 ILE 75 -8.129 -8.859 -7.378 567 HG13 ILE 75 HG11 ILE 75 -9.215 -8.651 -6.014 568 HG21 ILE 75 HG21 ILE 75 -8.901 -8.103 -9.724 569 HG22 ILE 75 HG22 ILE 75 -10.641 -8.172 -10.021 570 HG23 ILE 75 HG23 ILE 75 -9.776 -9.625 -9.538 571 HD11 ILE 75 HD11 ILE 75 -9.114 -10.930 -7.990 572 HD12 ILE 75 HD12 ILE 75 -10.528 -10.658 -6.970 573 HD13 ILE 75 HD13 ILE 75 -8.959 -10.995 -6.236 574 H ILE 76 HN ILE 76 -9.454 -5.610 -9.956 575 HA ILE 76 HA ILE 76 -12.262 -4.984 -10.595 576 HB ILE 76 HB ILE 76 -11.348 -2.593 -11.289 577 HG12 ILE 76 HG12 ILE 76 -9.481 -3.274 -8.995 578 HG13 ILE 76 HG11 ILE 76 -8.976 -3.248 -10.680 579 HG21 ILE 76 HG21 ILE 76 -11.946 -3.384 -8.437 580 HG22 ILE 76 HG22 ILE 76 -13.102 -2.869 -9.649 581 HG23 ILE 76 HG23 ILE 76 -11.925 -1.728 -9.012 582 HD11 ILE 76 HD11 ILE 76 -10.046 -0.919 -9.061 583 HD12 ILE 76 HD12 ILE 76 -9.787 -0.858 -10.804 584 HD13 ILE 76 HD13 ILE 76 -8.420 -1.102 -9.718 585 H ASP 77 HN ASP 77 -9.825 -6.616 -11.589 586 HA ASP 77 HA ASP 77 -9.035 -5.576 -14.082 587 HB2 ASP 77 HB2 ASP 77 -8.432 -7.926 -14.626 588 HB3 ASP 77 HB1 ASP 77 -7.832 -7.409 -13.051 589 H TYR 78 HN TYR 78 -10.080 -5.341 -15.926 590 HA TYR 78 HA TYR 78 -12.848 -5.988 -16.195 591 HB2 TYR 78 HB2 TYR 78 -10.820 -5.110 -18.266 592 HB3 TYR 78 HB1 TYR 78 -12.560 -5.200 -18.538 593 HD1 TYR 78 HD1 TYR 78 -9.855 -3.399 -16.775 594 HD2 TYR 78 HD2 TYR 78 -14.092 -3.595 -17.484 595 HE1 TYR 78 HE1 TYR 78 -10.123 -1.127 -15.819 596 HE2 TYR 78 HE2 TYR 78 -14.354 -1.322 -16.525 597 HH TYR 78 HH TYR 78 -11.717 0.748 -15.961 598 H GLY 79 HN GLY 79 -9.867 -7.365 -17.546 599 HA2 GLY 79 HA3 GLY 79 -10.173 -9.959 -17.612 600 HA3 GLY 79 HA2 GLY 79 -11.410 -9.570 -18.802 601 H ILE 80 HN ILE 80 -10.675 -10.024 -20.757 602 HA ILE 80 HA ILE 80 -7.823 -9.671 -21.421 603 HB ILE 80 HB ILE 80 -10.064 -10.970 -22.997 604 HG12 ILE 80 HG12 ILE 80 -7.781 -12.274 -21.465 605 HG13 ILE 80 HG11 ILE 80 -9.412 -12.110 -20.816 606 HG21 ILE 80 HG21 ILE 80 -7.062 -10.780 -23.417 607 HG22 ILE 80 HG22 ILE 80 -8.336 -10.216 -24.502 608 HG23 ILE 80 HG23 ILE 80 -8.076 -11.940 -24.270 609 HD11 ILE 80 HD11 ILE 80 -8.596 -13.630 -23.311 610 HD12 ILE 80 HD12 ILE 80 -10.271 -13.349 -22.834 611 HD13 ILE 80 HD13 ILE 80 -9.214 -14.314 -21.808 612 H ARG 81 HN ARG 81 -7.361 -7.677 -22.023 613 HA ARG 81 HA ARG 81 -9.242 -6.017 -23.524 614 HB2 ARG 81 HB2 ARG 81 -7.652 -4.258 -23.183 615 HB3 ARG 81 HB1 ARG 81 -7.828 -5.112 -21.665 616 HG2 ARG 81 HG2 ARG 81 -5.536 -5.528 -23.629 617 HG3 ARG 81 HG1 ARG 81 -5.467 -4.551 -22.186 618 HD2 ARG 81 HD2 ARG 81 -4.577 -6.550 -21.356 619 HD3 ARG 81 HD1 ARG 81 -6.273 -6.790 -20.966 620 HE ARG 81 HE ARG 81 -6.438 -8.397 -22.735 621 HH11 ARG 81 HH21 ARG 81 -3.289 -6.938 -22.545 622 HH12 ARG 81 HH22 ARG 81 -2.572 -8.129 -23.580 623 HH21 ARG 81 HH11 ARG 81 -5.547 -9.829 -24.111 624 HH22 ARG 81 HH12 ARG 81 -3.858 -9.760 -24.479 625 H LEU 82 HN LEU 82 -8.959 -5.355 -25.636 626 HA LEU 82 HA LEU 82 -7.166 -6.972 -27.305 627 HB2 LEU 82 HB2 LEU 82 -9.262 -4.945 -28.115 628 HB3 LEU 82 HB1 LEU 82 -8.458 -6.110 -29.166 629 HG LEU 82 HG LEU 82 -10.255 -6.815 -26.813 630 HD11 LEU 82 HD11 LEU 82 -11.868 -7.514 -28.522 631 HD12 LEU 82 HD12 LEU 82 -10.746 -7.043 -29.800 632 HD13 LEU 82 HD13 LEU 82 -11.453 -5.816 -28.748 633 HD21 LEU 82 HD21 LEU 82 -8.679 -8.487 -28.793 634 HD22 LEU 82 HD22 LEU 82 -10.134 -9.132 -28.034 635 HD23 LEU 82 HD23 LEU 82 -8.768 -8.652 -27.039 636 H ASN 83 HN ASN 83 -6.909 -4.143 -25.642 637 HA ASN 83 HA ASN 83 -5.559 -2.518 -27.609 638 HB2 ASN 83 HB2 ASN 83 -5.131 -0.980 -25.766 639 HB3 ASN 83 HB1 ASN 83 -6.823 -1.464 -25.799 640 HD21 ASN 83 HD21 ASN 83 -3.841 -2.921 -24.398 641 HD22 ASN 83 HD22 ASN 83 -4.501 -3.132 -22.853 642 H ARG 84 HN ARG 84 -4.522 -5.214 -27.126 643 HA ARG 84 HA ARG 84 -2.205 -5.346 -25.588 644 HB2 ARG 84 HB2 ARG 84 -2.663 -6.550 -28.323 645 HB3 ARG 84 HB1 ARG 84 -1.384 -7.014 -27.199 646 HG2 ARG 84 HG2 ARG 84 -3.032 -7.746 -25.554 647 HG3 ARG 84 HG1 ARG 84 -4.357 -7.215 -26.592 648 HD2 ARG 84 HD2 ARG 84 -3.625 -8.760 -28.338 649 HD3 ARG 84 HD1 ARG 84 -2.298 -9.319 -27.334 650 HE ARG 84 HE ARG 84 -4.790 -9.675 -25.998 651 HH11 ARG 84 HH21 ARG 84 -2.817 -10.848 -28.574 652 HH12 ARG 84 HH22 ARG 84 -3.536 -12.423 -28.598 653 HH21 ARG 84 HH11 ARG 84 -5.741 -11.772 -26.020 654 HH22 ARG 84 HH12 ARG 84 -5.180 -12.949 -27.163 655 H SER 85 HN SER 85 -2.772 -3.052 -27.889 656 HA SER 85 HA SER 85 0.017 -2.831 -28.835 657 HB2 SER 85 HB2 SER 85 -2.345 -1.094 -29.579 658 HB3 SER 85 HB1 SER 85 -0.802 -1.243 -30.420 659 HG SER 85 HG SER 85 -1.353 -3.258 -31.077 660 H GLU 86 HN GLU 86 -1.629 -1.951 -26.156 661 HA GLU 86 HA GLU 86 -0.698 0.808 -25.944 662 HB2 GLU 86 HB2 GLU 86 -2.900 -0.424 -24.957 663 HB3 GLU 86 HB1 GLU 86 -1.841 -0.645 -23.573 664 HG2 GLU 86 HG2 GLU 86 -2.918 1.435 -23.155 665 HG3 GLU 86 HG1 GLU 86 -1.336 1.892 -23.774 666 H ARG 87 HN ARG 87 -0.112 0.772 -23.167 667 HA ARG 87 HA ARG 87 2.126 -1.031 -22.721 668 HB2 ARG 87 HB2 ARG 87 3.803 0.738 -22.537 669 HB3 ARG 87 HB1 ARG 87 3.129 0.684 -24.167 670 HG2 ARG 87 HG2 ARG 87 1.515 2.507 -23.474 671 HG3 ARG 87 HG1 ARG 87 2.415 2.629 -21.958 672 HD2 ARG 87 HD2 ARG 87 4.490 3.083 -23.261 673 HD3 ARG 87 HD1 ARG 87 3.525 3.081 -24.738 674 HE ARG 87 HE ARG 87 3.666 5.194 -22.784 675 HH11 ARG 87 HH21 ARG 87 1.715 3.594 -25.177 676 HH12 ARG 87 HH22 ARG 87 0.662 4.960 -25.395 677 HH21 ARG 87 HH11 ARG 87 2.287 6.988 -23.139 678 HH22 ARG 87 HH12 ARG 87 0.997 6.847 -24.283 679 H TRP 88 HN TRP 88 2.444 -1.393 -20.642 680 HA TRP 88 HA TRP 88 1.594 0.497 -18.579 681 HB2 TRP 88 HB2 TRP 88 0.453 -2.310 -18.767 682 HB3 TRP 88 HB1 TRP 88 0.295 -1.246 -17.379 683 HD1 TRP 88 HD1 TRP 88 -0.450 1.476 -18.785 684 HE1 TRP 88 HE1 TRP 88 -2.696 1.738 -20.005 685 HE3 TRP 88 HE3 TRP 88 -1.620 -3.425 -19.543 686 HZ2 TRP 88 HZ2 TRP 88 -4.742 0.102 -21.116 687 HZ3 TRP 88 HZ3 TRP 88 -3.735 -4.048 -20.669 688 HH2 TRP 88 HH2 TRP 88 -5.298 -2.287 -21.449 689 H ASP 89 HN ASP 89 1.843 -0.943 -16.377 690 HA ASP 89 HA ASP 89 4.607 -1.097 -15.972 691 HB2 ASP 89 HB2 ASP 89 2.721 -0.814 -14.252 692 HB3 ASP 89 HB1 ASP 89 2.562 -2.566 -14.290 693 H ALA 90 HN ALA 90 4.557 -3.640 -14.430 694 HA ALA 90 HA ALA 90 4.202 -5.804 -16.252 695 HB1 ALA 90 HB1 ALA 90 6.162 -4.747 -17.331 696 HB2 ALA 90 HB2 ALA 90 6.544 -6.343 -16.686 697 HB3 ALA 90 HB3 ALA 90 7.061 -4.897 -15.820 698 H TYR 91 HN TYR 91 4.019 -7.601 -15.122 699 HA TYR 91 HA TYR 91 5.229 -7.766 -12.401 700 HB2 TYR 91 HB2 TYR 91 2.507 -8.702 -13.355 701 HB3 TYR 91 HB1 TYR 91 3.218 -9.152 -11.808 702 HD1 TYR 91 HD2 TYR 91 3.820 -7.350 -10.145 703 HD2 TYR 91 HD1 TYR 91 1.439 -6.556 -13.633 704 HE1 TYR 91 HE2 TYR 91 2.989 -5.260 -9.103 705 HE2 TYR 91 HE1 TYR 91 0.605 -4.469 -12.582 706 HH TYR 91 HH TYR 91 0.323 -3.559 -10.289 707 H CYS 92 HN CYS 92 5.687 -9.893 -11.662 708 HA CYS 92 HA CYS 92 5.844 -12.018 -13.706 709 HB2 CYS 92 HB2 CYS 92 8.030 -10.667 -13.563 710 HB3 CYS 92 HB1 CYS 92 8.262 -11.417 -11.989 711 H TYR 93 HN TYR 93 7.082 -13.939 -12.425 712 HA TYR 93 HA TYR 93 6.146 -14.239 -9.682 713 HB2 TYR 93 HB2 TYR 93 4.103 -14.780 -10.811 714 HB3 TYR 93 HB1 TYR 93 4.936 -15.762 -12.006 715 HD1 TYR 93 HD1 TYR 93 3.929 -15.546 -8.436 716 HD2 TYR 93 HD2 TYR 93 5.512 -18.058 -11.540 717 HE1 TYR 93 HE1 TYR 93 3.610 -17.534 -6.991 718 HE2 TYR 93 HE2 TYR 93 5.196 -20.046 -10.095 719 HH TYR 93 HH TYR 93 4.551 -20.787 -8.112 720 H ASN 94 HN ASN 94 7.719 -15.239 -8.666 721 HA ASN 94 HA ASN 94 9.016 -17.578 -9.857 722 HB2 ASN 94 HB2 ASN 94 10.497 -15.021 -9.208 723 HB3 ASN 94 HB1 ASN 94 11.320 -16.576 -9.316 724 HD21 ASN 94 HD21 ASN 94 11.330 -14.055 -11.152 725 HD22 ASN 94 HD22 ASN 94 11.050 -14.703 -12.695 726 HA PRO 95 HA PRO 95 8.988 -18.748 -5.554 727 HB2 PRO 95 HB2 PRO 95 10.725 -20.843 -5.556 728 HB3 PRO 95 HB1 PRO 95 9.159 -20.933 -6.396 729 HG2 PRO 95 HG2 PRO 95 11.863 -20.290 -7.541 730 HG3 PRO 95 HG1 PRO 95 10.656 -21.452 -8.129 731 HD2 PRO 95 HD2 PRO 95 10.862 -18.966 -9.216 732 HD3 PRO 95 HD1 PRO 95 9.283 -19.772 -9.034 733 H HIS 96 HN HIS 96 11.484 -17.136 -6.994 734 HA HIS 96 HA HIS 96 12.705 -16.420 -4.472 735 HB2 HIS 96 HB2 HIS 96 15.015 -17.084 -5.224 736 HB3 HIS 96 HB1 HIS 96 13.959 -18.449 -4.870 737 HD1 HIS 96 HD1 HIS 96 12.499 -17.531 -7.816 738 HD2 HIS 96 HD2 HIS 96 16.279 -19.105 -7.040 739 HE1 HIS 96 HE1 HIS 96 13.291 -18.575 -9.977 740 HE2 HIS 96 HE2 HIS 96 15.598 -19.539 -9.525 741 H ALA 97 HN ALA 97 14.946 -16.116 -6.952 742 HA ALA 97 HA ALA 97 15.752 -14.218 -8.009 743 HB1 ALA 97 HB1 ALA 97 12.807 -14.102 -8.699 744 HB2 ALA 97 HB2 ALA 97 14.095 -14.845 -9.649 745 HB3 ALA 97 HB3 ALA 97 14.034 -13.090 -9.463 746 H LYS 98 HN LYS 98 12.822 -12.437 -7.727 747 HA LYS 98 HA LYS 98 13.141 -11.340 -5.178 748 HB2 LYS 98 HB2 LYS 98 13.918 -9.060 -5.730 749 HB3 LYS 98 HB1 LYS 98 15.185 -10.277 -5.865 750 HG2 LYS 98 HG2 LYS 98 14.618 -10.365 -8.375 751 HG3 LYS 98 HG1 LYS 98 13.672 -8.904 -8.112 752 HD2 LYS 98 HD2 LYS 98 16.629 -9.227 -7.529 753 HD3 LYS 98 HD1 LYS 98 15.931 -8.322 -8.868 754 HE2 LYS 98 HE2 LYS 98 14.700 -6.926 -7.102 755 HE3 LYS 98 HE1 LYS 98 15.763 -7.684 -5.913 756 HZ1 LYS 98 HZ1 LYS 98 16.634 -6.131 -8.279 757 HZ2 LYS 98 HZ2 LYS 98 17.664 -6.895 -7.162 758 HZ3 LYS 98 HZ3 LYS 98 16.674 -5.606 -6.667 Start of MODEL 13 1 H1 GLY 1 H1 GLY 1 3.830 -14.705 -1.139 2 H2 GLY 1 H2 GLY 1 2.490 -14.421 -2.143 3 H3 GLY 1 H3 GLY 1 3.927 -13.540 -2.368 4 HA2 GLY 1 HA3 GLY 1 4.811 -16.072 -2.586 5 HA3 GLY 1 HA2 GLY 1 3.205 -16.169 -3.308 6 H VAL 2 HN VAL 2 2.960 -13.615 -4.360 7 HA VAL 2 HA VAL 2 4.647 -13.826 -6.722 8 HB VAL 2 HB VAL 2 2.440 -11.867 -6.022 9 HG11 VAL 2 HG11 VAL 2 3.938 -12.434 -8.601 10 HG12 VAL 2 HG12 VAL 2 3.864 -10.904 -7.727 11 HG13 VAL 2 HG13 VAL 2 2.427 -11.527 -8.532 12 HG21 VAL 2 HG21 VAL 2 1.063 -13.281 -7.486 13 HG22 VAL 2 HG22 VAL 2 1.725 -14.250 -6.167 14 HG23 VAL 2 HG23 VAL 2 2.440 -14.345 -7.778 15 H TYR 3 HN TYR 3 5.892 -12.117 -7.564 16 HA TYR 3 HA TYR 3 6.965 -10.216 -5.526 17 HB2 TYR 3 HB2 TYR 3 8.549 -12.014 -6.123 18 HB3 TYR 3 HB1 TYR 3 8.436 -11.544 -7.816 19 HD1 TYR 3 HD1 TYR 3 9.560 -10.465 -4.442 20 HD2 TYR 3 HD2 TYR 3 9.565 -9.558 -8.644 21 HE1 TYR 3 HE1 TYR 3 11.310 -8.747 -4.072 22 HE2 TYR 3 HE2 TYR 3 11.315 -7.843 -8.268 23 HH TYR 3 HH TYR 3 12.250 -6.512 -6.558 24 H HIS 4 HN HIS 4 7.183 -8.136 -6.069 25 HA HIS 4 HA HIS 4 5.747 -7.182 -8.378 26 HB2 HIS 4 HB2 HIS 4 6.416 -4.928 -7.573 27 HB3 HIS 4 HB1 HIS 4 5.624 -5.901 -6.337 28 HD1 HIS 4 HD1 HIS 4 7.272 -7.078 -4.560 29 HD2 HIS 4 HD2 HIS 4 8.969 -4.066 -6.890 30 HE1 HIS 4 HE1 HIS 4 9.398 -6.371 -3.379 31 HE2 HIS 4 HE2 HIS 4 10.445 -4.537 -4.788 32 H ARG 5 HN ARG 5 6.487 -6.626 -10.308 33 HA ARG 5 HA ARG 5 9.370 -6.121 -10.716 34 HB2 ARG 5 HB2 ARG 5 8.841 -8.581 -11.152 35 HB3 ARG 5 HB1 ARG 5 7.815 -8.040 -12.474 36 HG2 ARG 5 HG2 ARG 5 9.833 -8.462 -13.599 37 HG3 ARG 5 HG1 ARG 5 9.975 -6.739 -13.277 38 HD2 ARG 5 HD2 ARG 5 12.084 -7.765 -12.687 39 HD3 ARG 5 HD1 ARG 5 11.286 -7.339 -11.185 40 HE ARG 5 HE ARG 5 10.973 -9.618 -10.723 41 HH11 ARG 5 HH21 ARG 5 12.358 -9.121 -13.871 42 HH12 ARG 5 HH22 ARG 5 12.536 -10.810 -14.198 43 HH21 ARG 5 HH11 ARG 5 11.216 -11.822 -11.164 44 HH22 ARG 5 HH12 ARG 5 11.885 -12.332 -12.678 45 H GLU 6 HN GLU 6 9.780 -4.583 -12.163 46 HA GLU 6 HA GLU 6 8.006 -3.839 -14.284 47 HB2 GLU 6 HB2 GLU 6 7.336 -1.652 -13.463 48 HB3 GLU 6 HB1 GLU 6 6.794 -2.881 -12.321 49 HG2 GLU 6 HG2 GLU 6 8.867 -2.427 -10.960 50 HG3 GLU 6 HG1 GLU 6 9.221 -1.080 -12.040 51 H ALA 7 HN ALA 7 8.757 -1.571 -15.132 52 HA ALA 7 HA ALA 7 11.401 -1.802 -15.979 53 HB1 ALA 7 HB1 ALA 7 11.174 0.561 -16.716 54 HB2 ALA 7 HB2 ALA 7 9.676 0.681 -15.796 55 HB3 ALA 7 HB3 ALA 7 9.782 -0.424 -17.169 56 H ARG 8 HN ARG 8 13.298 -1.411 -15.037 57 HA ARG 8 HA ARG 8 13.507 -0.496 -12.338 58 HB2 ARG 8 HB2 ARG 8 15.605 -0.972 -14.474 59 HB3 ARG 8 HB1 ARG 8 15.988 -0.562 -12.806 60 HG2 ARG 8 HG2 ARG 8 14.880 -2.610 -12.023 61 HG3 ARG 8 HG1 ARG 8 14.414 -3.012 -13.678 62 HD2 ARG 8 HD2 ARG 8 16.823 -3.069 -14.316 63 HD3 ARG 8 HD1 ARG 8 17.254 -2.719 -12.649 64 HE ARG 8 HE ARG 8 16.920 -4.954 -12.171 65 HH11 ARG 8 HH21 ARG 8 15.312 -4.114 -15.132 66 HH12 ARG 8 HH22 ARG 8 14.714 -5.719 -15.410 67 HH21 ARG 8 HH11 ARG 8 16.149 -7.049 -12.554 68 HH22 ARG 8 HH12 ARG 8 15.179 -7.368 -13.953 69 H SER 9 HN SER 9 14.127 0.950 -15.499 70 HA SER 9 HA SER 9 14.676 3.593 -14.223 71 HB2 SER 9 HB2 SER 9 15.831 4.167 -16.316 72 HB3 SER 9 HB1 SER 9 16.552 2.756 -15.548 73 HG SER 9 HG SER 9 15.643 2.939 -17.987 74 H GLY 10 HN GLY 10 12.022 2.383 -14.822 75 HA2 GLY 10 HA3 GLY 10 10.895 4.706 -16.182 76 HA3 GLY 10 HA2 GLY 10 10.702 3.187 -17.047 77 H LYS 11 HN LYS 11 8.573 2.872 -16.866 78 HA LYS 11 HA LYS 11 7.515 1.769 -14.508 79 HB2 LYS 11 HB2 LYS 11 7.528 4.489 -14.203 80 HB3 LYS 11 HB1 LYS 11 5.982 4.312 -15.006 81 HG2 LYS 11 HG2 LYS 11 6.835 2.855 -12.479 82 HG3 LYS 11 HG1 LYS 11 5.746 4.238 -12.548 83 HD2 LYS 11 HD2 LYS 11 4.200 2.908 -13.986 84 HD3 LYS 11 HD1 LYS 11 5.265 1.514 -13.798 85 HE2 LYS 11 HE2 LYS 11 4.975 1.648 -11.333 86 HE3 LYS 11 HE1 LYS 11 3.840 2.979 -11.563 87 HZ1 LYS 11 HZ1 LYS 11 3.549 0.167 -12.435 88 HZ2 LYS 11 HZ2 LYS 11 2.576 1.415 -13.053 89 HZ3 LYS 11 HZ3 LYS 11 2.543 1.049 -11.394 90 H TYR 12 HN TYR 12 6.122 3.872 -17.030 91 HA TYR 12 HA TYR 12 4.313 1.673 -17.848 92 HB2 TYR 12 HB2 TYR 12 4.112 4.635 -18.448 93 HB3 TYR 12 HB1 TYR 12 2.925 3.398 -18.845 94 HD1 TYR 12 HD2 TYR 12 1.724 2.164 -16.988 95 HD2 TYR 12 HD1 TYR 12 4.183 5.612 -16.244 96 HE1 TYR 12 HE2 TYR 12 0.636 2.469 -14.778 97 HE2 TYR 12 HE1 TYR 12 3.089 5.914 -14.040 98 HH TYR 12 HH TYR 12 1.827 4.758 -12.436 99 H LYS 13 HN LYS 13 6.889 1.388 -18.737 100 HA LYS 13 HA LYS 13 6.630 1.944 -21.646 101 HB2 LYS 13 HB2 LYS 13 8.335 3.424 -20.310 102 HB3 LYS 13 HB1 LYS 13 9.329 1.973 -20.272 103 HG2 LYS 13 HG2 LYS 13 9.300 1.858 -22.723 104 HG3 LYS 13 HG1 LYS 13 8.219 3.247 -22.798 105 HD2 LYS 13 HD2 LYS 13 9.933 4.648 -21.731 106 HD3 LYS 13 HD1 LYS 13 11.024 3.261 -21.659 107 HE2 LYS 13 HE2 LYS 13 10.953 3.075 -24.121 108 HE3 LYS 13 HE1 LYS 13 9.869 4.463 -24.195 109 HZ1 LYS 13 HZ1 LYS 13 11.982 5.297 -22.665 110 HZ2 LYS 13 HZ2 LYS 13 11.688 5.703 -24.288 111 HZ3 LYS 13 HZ3 LYS 13 12.703 4.395 -23.907 112 H LEU 14 HN LEU 14 5.964 -0.403 -20.040 113 HA LEU 14 HA LEU 14 7.895 -2.366 -21.197 114 HB2 LEU 14 HB2 LEU 14 7.721 -2.197 -18.641 115 HB3 LEU 14 HB1 LEU 14 6.115 -2.885 -18.811 116 HG LEU 14 HG LEU 14 7.424 -4.719 -20.272 117 HD11 LEU 14 HD11 LEU 14 9.614 -3.445 -20.019 118 HD12 LEU 14 HD12 LEU 14 9.681 -5.137 -19.549 119 HD13 LEU 14 HD13 LEU 14 9.588 -3.881 -18.315 120 HD21 LEU 14 HD21 LEU 14 7.691 -6.095 -18.242 121 HD22 LEU 14 HD22 LEU 14 6.176 -5.196 -18.201 122 HD23 LEU 14 HD23 LEU 14 7.550 -4.651 -17.240 123 H THR 15 HN THR 15 7.141 -3.638 -22.710 124 HA THR 15 HA THR 15 4.210 -3.780 -23.170 125 HB THR 15 HB THR 15 6.470 -4.651 -24.989 126 HG1 THR 15 HG1 THR 15 5.597 -2.657 -26.083 127 HG21 THR 15 HG21 THR 15 4.565 -4.392 -26.702 128 HG22 THR 15 HG22 THR 15 3.465 -4.397 -25.328 129 HG23 THR 15 HG23 THR 15 4.485 -5.799 -25.649 130 H TYR 16 HN TYR 16 3.278 -5.828 -23.790 131 HA TYR 16 HA TYR 16 3.674 -7.857 -21.938 132 HB2 TYR 16 HB2 TYR 16 2.349 -9.292 -23.504 133 HB3 TYR 16 HB1 TYR 16 1.609 -7.729 -23.173 134 HD1 TYR 16 HD1 TYR 16 3.421 -9.748 -25.692 135 HD2 TYR 16 HD2 TYR 16 1.440 -6.015 -24.903 136 HE1 TYR 16 HE1 TYR 16 3.379 -9.255 -28.125 137 HE2 TYR 16 HE2 TYR 16 1.402 -5.524 -27.337 138 HH TYR 16 HH TYR 16 1.445 -6.985 -29.506 139 H ALA 17 HN ALA 17 4.982 -7.549 -25.214 140 HA ALA 17 HA ALA 17 6.208 -10.048 -25.428 141 HB1 ALA 17 HB1 ALA 17 7.650 -9.050 -27.095 142 HB2 ALA 17 HB2 ALA 17 7.302 -7.433 -26.485 143 HB3 ALA 17 HB3 ALA 17 6.031 -8.373 -27.268 144 H GLU 18 HN GLU 18 7.443 -7.052 -23.943 145 HA GLU 18 HA GLU 18 10.014 -8.153 -23.312 146 HB2 GLU 18 HB2 GLU 18 8.510 -5.777 -22.181 147 HB3 GLU 18 HB1 GLU 18 10.179 -6.177 -21.768 148 HG2 GLU 18 HG2 GLU 18 10.847 -5.960 -24.108 149 HG3 GLU 18 HG1 GLU 18 9.178 -5.660 -24.585 150 H ALA 19 HN ALA 19 7.080 -7.562 -21.372 151 HA ALA 19 HA ALA 19 7.969 -8.510 -18.918 152 HB1 ALA 19 HB1 ALA 19 5.530 -9.077 -18.516 153 HB2 ALA 19 HB2 ALA 19 5.232 -8.622 -20.194 154 HB3 ALA 19 HB3 ALA 19 5.840 -7.426 -19.051 155 H LYS 20 HN LYS 20 6.760 -10.343 -21.699 156 HA LYS 20 HA LYS 20 6.708 -12.867 -20.351 157 HB2 LYS 20 HB2 LYS 20 5.447 -12.197 -22.480 158 HB3 LYS 20 HB1 LYS 20 6.958 -12.472 -23.341 159 HG2 LYS 20 HG2 LYS 20 7.023 -14.793 -22.585 160 HG3 LYS 20 HG1 LYS 20 5.589 -14.543 -21.587 161 HD2 LYS 20 HD2 LYS 20 4.311 -13.944 -23.633 162 HD3 LYS 20 HD1 LYS 20 5.733 -14.330 -24.598 163 HE2 LYS 20 HE2 LYS 20 4.274 -16.261 -22.765 164 HE3 LYS 20 HE1 LYS 20 4.164 -16.246 -24.523 165 HZ1 LYS 20 HZ1 LYS 20 6.234 -17.291 -22.826 166 HZ2 LYS 20 HZ2 LYS 20 6.830 -16.311 -24.078 167 HZ3 LYS 20 HZ3 LYS 20 5.864 -17.661 -24.440 168 H ALA 21 HN ALA 21 9.116 -11.054 -22.132 169 HA ALA 21 HA ALA 21 10.945 -13.203 -22.544 170 HB1 ALA 21 HB1 ALA 21 11.475 -10.231 -22.369 171 HB2 ALA 21 HB2 ALA 21 11.039 -11.109 -23.832 172 HB3 ALA 21 HB3 ALA 21 12.576 -11.437 -23.034 173 H VAL 22 HN VAL 22 10.968 -10.541 -20.148 174 HA VAL 22 HA VAL 22 13.207 -11.448 -18.694 175 HB VAL 22 HB VAL 22 12.347 -10.007 -16.865 176 HG11 VAL 22 HG11 VAL 22 12.315 -7.903 -18.170 177 HG12 VAL 22 HG12 VAL 22 12.080 -8.831 -19.650 178 HG13 VAL 22 HG13 VAL 22 13.580 -8.993 -18.736 179 HG21 VAL 22 HG21 VAL 22 10.211 -8.743 -17.341 180 HG22 VAL 22 HG22 VAL 22 9.970 -10.456 -17.013 181 HG23 VAL 22 HG23 VAL 22 9.916 -9.860 -18.671 182 H CYS 23 HN CYS 23 9.781 -12.235 -18.421 183 HA CYS 23 HA CYS 23 10.346 -14.104 -16.178 184 HB2 CYS 23 HB2 CYS 23 8.435 -12.252 -16.253 185 HB3 CYS 23 HB1 CYS 23 7.570 -13.489 -17.151 186 H GLU 24 HN GLU 24 8.806 -16.089 -16.318 187 HA GLU 24 HA GLU 24 8.281 -18.086 -17.340 188 HB2 GLU 24 HB2 GLU 24 6.921 -16.582 -18.856 189 HB3 GLU 24 HB1 GLU 24 8.286 -16.577 -19.965 190 HG2 GLU 24 HG2 GLU 24 8.159 -18.980 -20.236 191 HG3 GLU 24 HG1 GLU 24 6.892 -19.088 -19.016 192 H PHE 25 HN PHE 25 11.033 -16.280 -18.213 193 HA PHE 25 HA PHE 25 12.346 -18.021 -19.999 194 HB2 PHE 25 HB2 PHE 25 13.063 -15.718 -19.579 195 HB3 PHE 25 HB1 PHE 25 13.477 -16.133 -17.919 196 HD1 PHE 25 HD1 PHE 25 14.369 -16.653 -21.487 197 HD2 PHE 25 HD2 PHE 25 15.522 -17.329 -17.402 198 HE1 PHE 25 HE1 PHE 25 16.634 -17.340 -22.235 199 HE2 PHE 25 HE2 PHE 25 17.782 -18.018 -18.153 200 HZ PHE 25 HZ PHE 25 18.337 -18.023 -20.568 201 H GLU 26 HN GLU 26 12.492 -17.797 -16.446 202 HA GLU 26 HA GLU 26 14.165 -20.166 -16.243 203 HB2 GLU 26 HB2 GLU 26 14.013 -19.818 -13.829 204 HB3 GLU 26 HB1 GLU 26 14.448 -18.322 -14.648 205 HG2 GLU 26 HG2 GLU 26 12.068 -17.606 -14.551 206 HG3 GLU 26 HG1 GLU 26 11.680 -19.074 -13.656 207 H GLY 27 HN GLY 27 11.338 -20.214 -17.384 208 HA2 GLY 27 HA3 GLY 27 9.872 -22.024 -17.557 209 HA3 GLY 27 HA2 GLY 27 10.541 -22.704 -16.077 210 H GLY 28 HN GLY 28 9.992 -19.596 -15.289 211 HA2 GLY 28 HA3 GLY 28 7.710 -20.178 -13.685 212 HA3 GLY 28 HA2 GLY 28 8.444 -18.595 -13.902 213 H HIS 29 HN HIS 29 6.336 -17.678 -13.972 214 HA HIS 29 HA HIS 29 5.301 -17.352 -16.614 215 HB2 HIS 29 HB2 HIS 29 4.311 -19.544 -16.157 216 HB3 HIS 29 HB1 HIS 29 3.611 -18.935 -14.660 217 HD1 HIS 29 HD1 HIS 29 1.155 -19.000 -15.240 218 HD2 HIS 29 HD2 HIS 29 3.413 -17.032 -18.143 219 HE1 HIS 29 HE1 HIS 29 -0.498 -17.964 -16.854 220 HE2 HIS 29 HE2 HIS 29 0.860 -16.753 -18.625 221 H LEU 30 HN LEU 30 3.944 -15.572 -16.763 222 HA LEU 30 HA LEU 30 4.124 -13.547 -14.857 223 HB2 LEU 30 HB2 LEU 30 1.853 -13.916 -16.831 224 HB3 LEU 30 HB1 LEU 30 2.377 -12.400 -16.104 225 HG LEU 30 HG LEU 30 4.124 -14.107 -17.915 226 HD11 LEU 30 HD11 LEU 30 2.198 -13.233 -19.160 227 HD12 LEU 30 HD12 LEU 30 3.653 -12.348 -19.620 228 HD13 LEU 30 HD13 LEU 30 2.488 -11.618 -18.513 229 HD21 LEU 30 HD21 LEU 30 5.407 -11.914 -18.075 230 HD22 LEU 30 HD22 LEU 30 5.471 -12.676 -16.495 231 HD23 LEU 30 HD23 LEU 30 4.397 -11.307 -16.765 232 H ALA 31 HN ALA 31 2.891 -12.860 -13.181 233 HA ALA 31 HA ALA 31 1.364 -14.754 -11.749 234 HB1 ALA 31 HB1 ALA 31 1.295 -11.753 -11.389 235 HB2 ALA 31 HB2 ALA 31 2.571 -12.789 -10.753 236 HB3 ALA 31 HB3 ALA 31 0.912 -12.983 -10.186 237 H THR 32 HN THR 32 -0.487 -15.545 -12.543 238 HA THR 32 HA THR 32 -2.293 -14.088 -14.205 239 HB THR 32 HB THR 32 -2.812 -16.628 -12.646 240 HG1 THR 32 HG1 THR 32 -2.320 -17.389 -14.942 241 HG21 THR 32 HG21 THR 32 -4.415 -17.018 -14.554 242 HG22 THR 32 HG22 THR 32 -4.127 -15.356 -15.062 243 HG23 THR 32 HG23 THR 32 -4.862 -15.683 -13.495 244 H TYR 33 HN TYR 33 -4.308 -13.259 -13.743 245 HA TYR 33 HA TYR 33 -4.637 -11.829 -11.386 246 HB2 TYR 33 HB2 TYR 33 -6.717 -11.147 -12.254 247 HB3 TYR 33 HB1 TYR 33 -5.829 -11.608 -13.696 248 HD1 TYR 33 HD1 TYR 33 -8.449 -12.654 -11.291 249 HD2 TYR 33 HD2 TYR 33 -6.517 -13.527 -15.028 250 HE1 TYR 33 HE1 TYR 33 -10.234 -14.285 -11.831 251 HE2 TYR 33 HE2 TYR 33 -8.305 -15.159 -15.568 252 HH TYR 33 HH TYR 33 -10.393 -15.855 -14.986 253 H LYS 34 HN LYS 34 -6.233 -14.877 -12.305 254 HA LYS 34 HA LYS 34 -7.666 -15.267 -9.912 255 HB2 LYS 34 HB2 LYS 34 -8.075 -16.488 -12.039 256 HB3 LYS 34 HB1 LYS 34 -6.567 -17.368 -11.802 257 HG2 LYS 34 HG2 LYS 34 -7.427 -18.328 -9.714 258 HG3 LYS 34 HG1 LYS 34 -8.917 -17.396 -9.881 259 HD2 LYS 34 HD2 LYS 34 -9.421 -18.556 -11.994 260 HD3 LYS 34 HD1 LYS 34 -7.923 -19.475 -11.855 261 HE2 LYS 34 HE2 LYS 34 -9.819 -20.818 -11.061 262 HE3 LYS 34 HE1 LYS 34 -8.728 -20.451 -9.726 263 HZ1 LYS 34 HZ1 LYS 34 -10.972 -18.641 -10.290 264 HZ2 LYS 34 HZ2 LYS 34 -10.188 -18.961 -8.816 265 HZ3 LYS 34 HZ3 LYS 34 -11.271 -20.094 -9.468 266 H GLN 35 HN GLN 35 -4.453 -16.410 -10.907 267 HA GLN 35 HA GLN 35 -3.926 -17.853 -8.511 268 HB2 GLN 35 HB2 GLN 35 -2.756 -18.194 -10.719 269 HB3 GLN 35 HB1 GLN 35 -1.886 -16.691 -10.428 270 HG2 GLN 35 HG2 GLN 35 -1.855 -18.951 -8.392 271 HG3 GLN 35 HG1 GLN 35 -0.717 -18.905 -9.731 272 HE21 GLN 35 HE21 GLN 35 0.195 -16.396 -9.936 273 HE22 GLN 35 HE22 GLN 35 0.810 -15.810 -8.466 274 H LEU 36 HN LEU 36 -3.618 -14.510 -9.438 275 HA LEU 36 HA LEU 36 -1.714 -13.659 -7.568 276 HB2 LEU 36 HB2 LEU 36 -3.302 -12.432 -9.523 277 HB3 LEU 36 HB1 LEU 36 -3.880 -11.682 -8.066 278 HG LEU 36 HG LEU 36 -0.977 -11.826 -8.933 279 HD11 LEU 36 HD11 LEU 36 -1.254 -9.399 -9.371 280 HD12 LEU 36 HD12 LEU 36 -2.966 -9.535 -8.969 281 HD13 LEU 36 HD13 LEU 36 -2.323 -10.367 -10.384 282 HD21 LEU 36 HD21 LEU 36 -2.349 -10.375 -6.634 283 HD22 LEU 36 HD22 LEU 36 -0.677 -10.100 -7.123 284 HD23 LEU 36 HD23 LEU 36 -1.160 -11.667 -6.490 285 H GLU 37 HN GLU 37 -5.078 -14.497 -7.214 286 HA GLU 37 HA GLU 37 -5.811 -13.167 -4.906 287 HB2 GLU 37 HB2 GLU 37 -7.229 -14.702 -6.351 288 HB3 GLU 37 HB1 GLU 37 -6.513 -16.052 -5.477 289 HG2 GLU 37 HG2 GLU 37 -8.561 -15.556 -4.335 290 HG3 GLU 37 HG1 GLU 37 -7.278 -14.895 -3.325 291 H ALA 38 HN ALA 38 -3.669 -15.901 -5.292 292 HA ALA 38 HA ALA 38 -3.581 -16.870 -2.667 293 HB1 ALA 38 HB1 ALA 38 -2.481 -17.928 -4.649 294 HB2 ALA 38 HB2 ALA 38 -1.425 -17.805 -3.243 295 HB3 ALA 38 HB3 ALA 38 -1.247 -16.671 -4.583 296 H ALA 39 HN ALA 39 -1.878 -14.149 -4.154 297 HA ALA 39 HA ALA 39 -0.291 -13.587 -1.811 298 HB1 ALA 39 HB1 ALA 39 0.295 -13.004 -4.233 299 HB2 ALA 39 HB2 ALA 39 0.565 -11.739 -3.039 300 HB3 ALA 39 HB3 ALA 39 -0.850 -11.673 -4.086 301 H ARG 40 HN ARG 40 -3.258 -12.265 -3.242 302 HA ARG 40 HA ARG 40 -3.613 -10.063 -1.530 303 HB2 ARG 40 HB2 ARG 40 -5.904 -11.771 -2.543 304 HB3 ARG 40 HB1 ARG 40 -5.910 -10.041 -2.204 305 HG2 ARG 40 HG2 ARG 40 -4.353 -11.404 -4.408 306 HG3 ARG 40 HG1 ARG 40 -5.839 -10.506 -4.621 307 HD2 ARG 40 HD2 ARG 40 -3.155 -9.448 -3.734 308 HD3 ARG 40 HD1 ARG 40 -3.988 -9.098 -5.228 309 HE ARG 40 HE ARG 40 -4.328 -7.734 -2.769 310 HH11 ARG 40 HH21 ARG 40 -6.256 -8.966 -5.391 311 HH12 ARG 40 HH22 ARG 40 -7.389 -7.661 -5.280 312 HH21 ARG 40 HH11 ARG 40 -5.751 -6.001 -2.768 313 HH22 ARG 40 HH12 ARG 40 -7.079 -5.979 -3.877 314 H LYS 41 HN LYS 41 -4.226 -13.487 -1.018 315 HA LYS 41 HA LYS 41 -5.744 -13.120 1.409 316 HB2 LYS 41 HB2 LYS 41 -4.396 -15.540 0.186 317 HB3 LYS 41 HB1 LYS 41 -5.274 -15.606 1.712 318 HG2 LYS 41 HG2 LYS 41 -7.303 -14.740 0.546 319 HG3 LYS 41 HG1 LYS 41 -6.416 -14.789 -0.978 320 HD2 LYS 41 HD2 LYS 41 -6.091 -17.201 -0.760 321 HD3 LYS 41 HD1 LYS 41 -6.866 -17.190 0.822 322 HE2 LYS 41 HE2 LYS 41 -8.970 -16.414 -0.214 323 HE3 LYS 41 HE1 LYS 41 -8.199 -16.439 -1.795 324 HZ1 LYS 41 HZ1 LYS 41 -8.901 -18.531 -1.907 325 HZ2 LYS 41 HZ2 LYS 41 -9.246 -18.608 -0.244 326 HZ3 LYS 41 HZ3 LYS 41 -7.668 -18.901 -0.801 327 H ILE 42 HN ILE 42 -2.473 -12.794 0.655 328 HA ILE 42 HA ILE 42 -1.561 -13.466 3.400 329 HB ILE 42 HB ILE 42 0.017 -12.880 0.876 330 HG12 ILE 42 HG12 ILE 42 -0.326 -15.468 2.437 331 HG13 ILE 42 HG11 ILE 42 -1.248 -15.070 0.989 332 HG21 ILE 42 HG21 ILE 42 1.534 -12.217 2.546 333 HG22 ILE 42 HG22 ILE 42 1.878 -13.938 2.509 334 HG23 ILE 42 HG23 ILE 42 0.831 -13.282 3.762 335 HD11 ILE 42 HD11 ILE 42 0.578 -16.413 0.241 336 HD12 ILE 42 HD12 ILE 42 1.735 -15.520 1.224 337 HD13 ILE 42 HD13 ILE 42 1.009 -14.761 -0.192 338 H GLY 43 HN GLY 43 -2.894 -10.899 1.942 339 HA2 GLY 43 HA3 GLY 43 -3.075 -8.767 2.946 340 HA3 GLY 43 HA2 GLY 43 -1.505 -8.987 3.707 341 H PHE 44 HN PHE 44 -1.599 -9.879 0.408 342 HA PHE 44 HA PHE 44 0.257 -7.848 -0.343 343 HB2 PHE 44 HB2 PHE 44 0.068 -10.193 -1.299 344 HB3 PHE 44 HB1 PHE 44 -1.342 -9.644 -2.185 345 HD1 PHE 44 HD1 PHE 44 2.208 -8.619 -1.505 346 HD2 PHE 44 HD2 PHE 44 -0.985 -8.782 -4.380 347 HE1 PHE 44 HE1 PHE 44 3.721 -7.716 -3.249 348 HE2 PHE 44 HE2 PHE 44 0.526 -7.881 -6.113 349 HZ PHE 44 HZ PHE 44 2.882 -7.346 -5.551 350 H HIS 45 HN HIS 45 -0.103 -5.874 -1.099 351 HA HIS 45 HA HIS 45 -2.611 -5.203 -2.487 352 HB2 HIS 45 HB2 HIS 45 -3.185 -4.802 -0.165 353 HB3 HIS 45 HB1 HIS 45 -1.702 -3.891 0.090 354 HD1 HIS 45 HD1 HIS 45 -5.032 -3.673 -1.702 355 HD2 HIS 45 HD2 HIS 45 -1.818 -1.205 -0.725 356 HE1 HIS 45 HE1 HIS 45 -5.755 -1.305 -2.234 357 HE2 HIS 45 HE2 HIS 45 -3.806 0.210 -1.647 358 H VAL 46 HN VAL 46 -1.704 -4.551 -4.338 359 HA VAL 46 HA VAL 46 0.084 -2.195 -4.238 360 HB VAL 46 HB VAL 46 1.534 -3.136 -5.977 361 HG11 VAL 46 HG11 VAL 46 1.319 -5.007 -3.602 362 HG12 VAL 46 HG12 VAL 46 2.057 -3.406 -3.535 363 HG13 VAL 46 HG13 VAL 46 2.764 -4.661 -4.551 364 HG21 VAL 46 HG21 VAL 46 -0.222 -5.585 -5.609 365 HG22 VAL 46 HG22 VAL 46 1.377 -5.660 -6.352 366 HG23 VAL 46 HG23 VAL 46 0.107 -4.706 -7.103 367 H CYS 47 HN CYS 47 -0.546 -0.659 -5.582 368 HA CYS 47 HA CYS 47 -2.689 -1.215 -7.530 369 HB2 CYS 47 HB2 CYS 47 -2.962 0.663 -5.950 370 HB3 CYS 47 HB1 CYS 47 -1.508 1.416 -6.609 371 H ALA 48 HN ALA 48 -1.669 -2.138 -9.264 372 HA ALA 48 HA ALA 48 -0.322 -0.364 -11.076 373 HB1 ALA 48 HB1 ALA 48 1.272 -2.591 -9.785 374 HB2 ALA 48 HB2 ALA 48 1.622 -0.863 -9.729 375 HB3 ALA 48 HB3 ALA 48 1.768 -1.742 -11.249 376 H ALA 49 HN ALA 49 -1.893 -0.948 -12.532 377 HA ALA 49 HA ALA 49 -2.604 -3.654 -13.099 378 HB1 ALA 49 HB1 ALA 49 -4.033 -1.594 -13.514 379 HB2 ALA 49 HB2 ALA 49 -3.965 -2.752 -14.845 380 HB3 ALA 49 HB3 ALA 49 -3.011 -1.268 -14.914 381 H GLY 50 HN GLY 50 -1.721 -5.085 -14.453 382 HA2 GLY 50 HA3 GLY 50 0.165 -4.171 -16.551 383 HA3 GLY 50 HA2 GLY 50 0.738 -5.311 -15.341 384 H TRP 51 HN TRP 51 0.689 -5.802 -18.112 385 HA TRP 51 HA TRP 51 -1.591 -7.353 -18.884 386 HB2 TRP 51 HB2 TRP 51 1.246 -7.342 -19.952 387 HB3 TRP 51 HB1 TRP 51 -0.115 -8.159 -20.719 388 HD1 TRP 51 HD1 TRP 51 1.678 -4.974 -20.803 389 HE1 TRP 51 HE1 TRP 51 0.296 -3.163 -22.009 390 HE3 TRP 51 HE3 TRP 51 -2.876 -7.263 -20.902 391 HZ2 TRP 51 HZ2 TRP 51 -2.395 -2.741 -22.893 392 HZ3 TRP 51 HZ3 TRP 51 -4.823 -6.147 -21.922 393 HH2 TRP 51 HH2 TRP 51 -4.595 -3.889 -22.918 394 H MET 52 HN MET 52 -2.101 -9.073 -17.613 395 HA MET 52 HA MET 52 0.024 -10.916 -16.694 396 HB2 MET 52 HB2 MET 52 -2.928 -10.818 -16.022 397 HB3 MET 52 HB1 MET 52 -1.778 -11.970 -15.365 398 HG2 MET 52 HG2 MET 52 -0.438 -10.093 -14.444 399 HG3 MET 52 HG1 MET 52 -1.653 -8.958 -15.030 400 HE1 MET 52 HE1 MET 52 -4.124 -9.331 -14.657 401 HE2 MET 52 HE2 MET 52 -3.707 -8.197 -13.378 402 HE3 MET 52 HE3 MET 52 -4.763 -9.562 -13.026 403 H ALA 53 HN ALA 53 -1.058 -13.286 -16.604 404 HA ALA 53 HA ALA 53 -0.776 -14.439 -19.064 405 HB1 ALA 53 HB1 ALA 53 -1.832 -16.403 -18.191 406 HB2 ALA 53 HB2 ALA 53 -2.751 -15.460 -17.016 407 HB3 ALA 53 HB3 ALA 53 -1.004 -15.620 -16.844 408 H LYS 54 HN LYS 54 -2.284 -15.420 -20.546 409 HA LYS 54 HA LYS 54 -3.900 -15.192 -22.155 410 HB2 LYS 54 HB2 LYS 54 -5.512 -14.713 -19.635 411 HB3 LYS 54 HB1 LYS 54 -6.242 -14.896 -21.231 412 HG2 LYS 54 HG2 LYS 54 -5.228 -17.127 -21.457 413 HG3 LYS 54 HG1 LYS 54 -4.473 -16.953 -19.870 414 HD2 LYS 54 HD2 LYS 54 -6.664 -16.788 -18.803 415 HD3 LYS 54 HD1 LYS 54 -7.462 -16.838 -20.374 416 HE2 LYS 54 HE2 LYS 54 -7.540 -19.049 -19.319 417 HE3 LYS 54 HE1 LYS 54 -6.527 -19.102 -20.761 418 HZ1 LYS 54 HZ1 LYS 54 -5.604 -18.892 -17.948 419 HZ2 LYS 54 HZ2 LYS 54 -4.585 -18.787 -19.304 420 HZ3 LYS 54 HZ3 LYS 54 -5.424 -20.228 -18.980 421 H GLY 55 HN GLY 55 -2.342 -12.853 -21.715 422 HA2 GLY 55 HA3 GLY 55 -2.298 -10.586 -22.162 423 HA3 GLY 55 HA2 GLY 55 -3.672 -10.929 -23.206 424 H ARG 56 HN ARG 56 -4.561 -11.863 -20.170 425 HA ARG 56 HA ARG 56 -6.420 -9.717 -19.872 426 HB2 ARG 56 HB2 ARG 56 -6.026 -12.369 -18.795 427 HB3 ARG 56 HB1 ARG 56 -6.211 -11.284 -17.449 428 HG2 ARG 56 HG2 ARG 56 -8.334 -10.466 -18.317 429 HG3 ARG 56 HG1 ARG 56 -8.128 -11.418 -19.787 430 HD2 ARG 56 HD2 ARG 56 -8.216 -13.487 -18.500 431 HD3 ARG 56 HD1 ARG 56 -8.315 -12.579 -16.994 432 HE ARG 56 HE ARG 56 -10.454 -11.626 -18.306 433 HH11 ARG 56 HH21 ARG 56 -9.290 -14.881 -18.005 434 HH12 ARG 56 HH22 ARG 56 -10.880 -15.568 -17.911 435 HH21 ARG 56 HH11 ARG 56 -12.515 -12.520 -18.082 436 HH22 ARG 56 HH12 ARG 56 -12.695 -14.231 -17.891 437 H VAL 57 HN VAL 57 -6.551 -8.156 -18.245 438 HA VAL 57 HA VAL 57 -4.093 -7.643 -16.661 439 HB VAL 57 HB VAL 57 -3.893 -6.195 -18.575 440 HG11 VAL 57 HG11 VAL 57 -6.748 -5.409 -17.982 441 HG12 VAL 57 HG12 VAL 57 -6.142 -6.228 -19.422 442 HG13 VAL 57 HG13 VAL 57 -5.694 -4.553 -19.105 443 HG21 VAL 57 HG21 VAL 57 -3.744 -4.067 -17.483 444 HG22 VAL 57 HG22 VAL 57 -3.508 -5.254 -16.204 445 HG23 VAL 57 HG23 VAL 57 -5.066 -4.452 -16.379 446 H GLY 58 HN GLY 58 -4.391 -6.822 -14.687 447 HA2 GLY 58 HA3 GLY 58 -7.053 -5.906 -13.827 448 HA3 GLY 58 HA2 GLY 58 -6.420 -7.368 -13.077 449 H TYR 59 HN TYR 59 -7.032 -5.206 -11.561 450 HA TYR 59 HA TYR 59 -4.346 -4.281 -10.695 451 HB2 TYR 59 HB2 TYR 59 -5.508 -2.160 -9.885 452 HB3 TYR 59 HB1 TYR 59 -5.209 -2.323 -11.605 453 HD1 TYR 59 HD2 TYR 59 -7.067 -3.030 -13.147 454 HD2 TYR 59 HD1 TYR 59 -7.746 -1.981 -9.040 455 HE1 TYR 59 HE2 TYR 59 -9.468 -2.654 -13.638 456 HE2 TYR 59 HE1 TYR 59 -10.144 -1.597 -9.531 457 HH TYR 59 HH TYR 59 -11.417 -1.959 -12.841 458 HA PRO 60 HA PRO 60 -6.133 -6.246 -7.013 459 HB2 PRO 60 HB2 PRO 60 -3.815 -6.851 -5.732 460 HB3 PRO 60 HB1 PRO 60 -4.377 -7.778 -7.145 461 HG2 PRO 60 HG2 PRO 60 -2.300 -5.627 -6.994 462 HG3 PRO 60 HG1 PRO 60 -2.269 -7.155 -7.897 463 HD2 PRO 60 HD2 PRO 60 -2.909 -4.713 -9.030 464 HD3 PRO 60 HD1 PRO 60 -3.476 -6.272 -9.680 465 H ILE 61 HN ILE 61 -7.039 -4.970 -5.536 466 HA ILE 61 HA ILE 61 -5.400 -3.232 -3.845 467 HB ILE 61 HB ILE 61 -7.228 -1.374 -4.233 468 HG12 ILE 61 HG12 ILE 61 -7.403 -2.887 -6.858 469 HG13 ILE 61 HG11 ILE 61 -8.662 -2.878 -5.629 470 HG21 ILE 61 HG21 ILE 61 -4.821 -1.189 -4.882 471 HG22 ILE 61 HG22 ILE 61 -5.898 -0.376 -6.010 472 HG23 ILE 61 HG23 ILE 61 -5.213 -1.945 -6.425 473 HD11 ILE 61 HD11 ILE 61 -8.762 -0.389 -5.818 474 HD12 ILE 61 HD12 ILE 61 -9.207 -1.223 -7.309 475 HD13 ILE 61 HD13 ILE 61 -7.610 -0.491 -7.149 476 H VAL 62 HN VAL 62 -5.893 -4.543 -2.126 477 HA VAL 62 HA VAL 62 -8.305 -5.638 -1.372 478 HB VAL 62 HB VAL 62 -6.265 -4.374 0.453 479 HG11 VAL 62 HG11 VAL 62 -7.089 -6.120 2.064 480 HG12 VAL 62 HG12 VAL 62 -8.378 -6.497 0.923 481 HG13 VAL 62 HG13 VAL 62 -8.305 -4.905 1.677 482 HG21 VAL 62 HG21 VAL 62 -6.447 -7.134 -0.782 483 HG22 VAL 62 HG22 VAL 62 -5.365 -6.733 0.552 484 HG23 VAL 62 HG23 VAL 62 -5.164 -5.945 -1.012 485 H LYS 63 HN LYS 63 -7.396 -2.307 -1.434 486 HA LYS 63 HA LYS 63 -10.066 -1.585 -0.449 487 HB2 LYS 63 HB2 LYS 63 -9.063 0.293 0.897 488 HB3 LYS 63 HB1 LYS 63 -8.764 -1.321 1.534 489 HG2 LYS 63 HG2 LYS 63 -6.524 -1.327 0.521 490 HG3 LYS 63 HG1 LYS 63 -6.820 0.274 -0.165 491 HD2 LYS 63 HD2 LYS 63 -7.087 1.217 2.082 492 HD3 LYS 63 HD1 LYS 63 -6.874 -0.378 2.799 493 HE2 LYS 63 HE2 LYS 63 -4.778 0.954 1.064 494 HE3 LYS 63 HE1 LYS 63 -4.802 1.070 2.822 495 HZ1 LYS 63 HZ1 LYS 63 -4.904 -1.457 2.763 496 HZ2 LYS 63 HZ2 LYS 63 -3.419 -0.726 2.381 497 HZ3 LYS 63 HZ3 LYS 63 -4.417 -1.329 1.145 498 HA PRO 64 HA PRO 64 -10.236 1.155 -3.952 499 HB2 PRO 64 HB2 PRO 64 -11.122 3.237 -1.952 500 HB3 PRO 64 HB1 PRO 64 -11.846 2.808 -3.517 501 HG2 PRO 64 HG2 PRO 64 -12.923 1.977 -1.216 502 HG3 PRO 64 HG1 PRO 64 -12.910 0.948 -2.659 503 HD2 PRO 64 HD2 PRO 64 -11.274 0.681 -0.171 504 HD3 PRO 64 HD1 PRO 64 -11.798 -0.551 -1.321 505 H GLY 65 HN GLY 65 -9.106 2.932 -4.885 506 HA2 GLY 65 HA3 GLY 65 -7.177 4.379 -3.192 507 HA3 GLY 65 HA2 GLY 65 -6.526 3.383 -4.481 508 HA PRO 66 HA PRO 66 -8.005 7.651 -6.086 509 HB2 PRO 66 HB2 PRO 66 -5.802 9.237 -5.780 510 HB3 PRO 66 HB1 PRO 66 -6.995 9.033 -4.480 511 HG2 PRO 66 HG2 PRO 66 -4.364 7.628 -4.855 512 HG3 PRO 66 HG1 PRO 66 -5.023 8.390 -3.390 513 HD2 PRO 66 HD2 PRO 66 -5.191 5.695 -3.794 514 HD3 PRO 66 HD1 PRO 66 -6.468 6.600 -2.944 515 H ASN 67 HN ASN 67 -4.745 6.258 -6.293 516 HA ASN 67 HA ASN 67 -4.144 7.153 -8.912 517 HB2 ASN 67 HB2 ASN 67 -2.493 6.310 -7.212 518 HB3 ASN 67 HB1 ASN 67 -3.085 4.681 -7.522 519 HD21 ASN 67 HD21 ASN 67 -0.979 4.038 -8.405 520 HD22 ASN 67 HD22 ASN 67 -0.480 4.569 -9.938 521 H CYS 68 HN CYS 68 -5.601 4.181 -7.661 522 HA CYS 68 HA CYS 68 -5.904 3.074 -10.367 523 HB2 CYS 68 HB2 CYS 68 -7.280 1.602 -8.213 524 HB3 CYS 68 HB1 CYS 68 -6.028 1.044 -9.310 525 H GLY 69 HN GLY 69 -7.851 2.767 -11.397 526 HA2 GLY 69 HA3 GLY 69 -9.783 4.710 -11.308 527 HA3 GLY 69 HA2 GLY 69 -10.069 3.101 -11.958 528 H PHE 70 HN PHE 70 -12.228 4.155 -10.951 529 HA PHE 70 HA PHE 70 -12.620 3.868 -8.135 530 HB2 PHE 70 HB2 PHE 70 -14.562 4.018 -10.459 531 HB3 PHE 70 HB1 PHE 70 -15.070 3.978 -8.770 532 HD1 PHE 70 HD2 PHE 70 -14.602 5.869 -7.257 533 HD2 PHE 70 HD1 PHE 70 -13.449 5.991 -11.397 534 HE1 PHE 70 HE2 PHE 70 -14.251 8.318 -7.091 535 HE2 PHE 70 HE1 PHE 70 -13.102 8.441 -11.227 536 HZ PHE 70 HZ PHE 70 -13.503 9.604 -9.075 537 H GLY 71 HN GLY 71 -13.397 2.166 -6.969 538 HA2 GLY 71 HA3 GLY 71 -14.813 -0.049 -7.806 539 HA3 GLY 71 HA2 GLY 71 -13.124 -0.480 -8.057 540 H LYS 72 HN LYS 72 -15.400 -1.218 -6.072 541 HA LYS 72 HA LYS 72 -14.597 -0.497 -3.468 542 HB2 LYS 72 HB2 LYS 72 -16.784 -1.546 -4.086 543 HB3 LYS 72 HB1 LYS 72 -15.933 -3.072 -4.324 544 HG2 LYS 72 HG2 LYS 72 -15.210 -3.059 -1.973 545 HG3 LYS 72 HG1 LYS 72 -15.990 -1.498 -1.726 546 HD2 LYS 72 HD2 LYS 72 -18.177 -2.489 -2.276 547 HD3 LYS 72 HD1 LYS 72 -17.411 -4.052 -2.547 548 HE2 LYS 72 HE2 LYS 72 -18.366 -4.034 -0.312 549 HE3 LYS 72 HE1 LYS 72 -16.609 -4.013 -0.172 550 HZ1 LYS 72 HZ1 LYS 72 -16.657 -2.025 0.792 551 HZ2 LYS 72 HZ2 LYS 72 -18.329 -2.252 0.985 552 HZ3 LYS 72 HZ3 LYS 72 -17.734 -1.387 -0.350 553 H THR 73 HN THR 73 -13.813 -3.336 -5.449 554 HA THR 73 HA THR 73 -11.364 -3.757 -3.810 555 HB THR 73 HB THR 73 -11.673 -6.162 -3.913 556 HG1 THR 73 HG1 THR 73 -14.172 -6.435 -4.583 557 HG21 THR 73 HG21 THR 73 -13.342 -6.343 -2.232 558 HG22 THR 73 HG22 THR 73 -14.280 -5.019 -2.913 559 HG23 THR 73 HG23 THR 73 -12.762 -4.678 -2.075 560 H GLY 74 HN GLY 74 -9.781 -5.132 -4.889 561 HA2 GLY 74 HA3 GLY 74 -9.443 -4.240 -7.653 562 HA3 GLY 74 HA2 GLY 74 -8.269 -5.105 -6.679 563 H ILE 75 HN ILE 75 -7.842 -6.435 -8.471 564 HA ILE 75 HA ILE 75 -7.948 -8.443 -9.559 565 HB ILE 75 HB ILE 75 -10.414 -9.077 -7.894 566 HG12 ILE 75 HG12 ILE 75 -7.509 -9.678 -7.245 567 HG13 ILE 75 HG11 ILE 75 -8.423 -8.372 -6.517 568 HG21 ILE 75 HG21 ILE 75 -8.434 -10.745 -9.470 569 HG22 ILE 75 HG22 ILE 75 -10.188 -10.680 -9.643 570 HG23 ILE 75 HG23 ILE 75 -9.478 -11.444 -8.235 571 HD11 ILE 75 HD11 ILE 75 -9.008 -11.320 -6.287 572 HD12 ILE 75 HD12 ILE 75 -10.110 -10.060 -5.729 573 HD13 ILE 75 HD13 ILE 75 -8.512 -10.227 -4.998 574 H ILE 76 HN ILE 76 -10.298 -6.096 -9.647 575 HA ILE 76 HA ILE 76 -12.261 -7.210 -11.322 576 HB ILE 76 HB ILE 76 -11.385 -4.313 -11.298 577 HG12 ILE 76 HG12 ILE 76 -13.473 -5.602 -9.500 578 HG13 ILE 76 HG11 ILE 76 -11.824 -5.287 -8.978 579 HG21 ILE 76 HG21 ILE 76 -13.820 -3.953 -11.800 580 HG22 ILE 76 HG22 ILE 76 -14.013 -5.700 -11.924 581 HG23 ILE 76 HG23 ILE 76 -12.986 -4.845 -13.070 582 HD11 ILE 76 HD11 ILE 76 -13.501 -3.059 -10.138 583 HD12 ILE 76 HD12 ILE 76 -12.078 -2.953 -9.102 584 HD13 ILE 76 HD13 ILE 76 -13.615 -3.498 -8.436 585 H ASP 77 HN ASP 77 -10.524 -8.447 -12.637 586 HA ASP 77 HA ASP 77 -9.209 -6.895 -14.732 587 HB2 ASP 77 HB2 ASP 77 -8.220 -8.972 -15.418 588 HB3 ASP 77 HB1 ASP 77 -8.146 -8.905 -13.663 589 H TYR 78 HN TYR 78 -9.631 -7.120 -16.938 590 HA TYR 78 HA TYR 78 -12.456 -7.608 -17.573 591 HB2 TYR 78 HB2 TYR 78 -10.214 -6.532 -19.314 592 HB3 TYR 78 HB1 TYR 78 -11.922 -6.572 -19.734 593 HD1 TYR 78 HD1 TYR 78 -9.394 -5.007 -17.533 594 HD2 TYR 78 HD2 TYR 78 -13.504 -4.985 -18.791 595 HE1 TYR 78 HE1 TYR 78 -9.713 -2.793 -16.462 596 HE2 TYR 78 HE2 TYR 78 -13.822 -2.775 -17.713 597 HH TYR 78 HH TYR 78 -12.902 -1.275 -16.285 598 H GLY 79 HN GLY 79 -11.442 -8.091 -20.433 599 HA2 GLY 79 HA3 GLY 79 -10.529 -10.900 -20.235 600 HA3 GLY 79 HA2 GLY 79 -12.064 -10.568 -21.030 601 H ILE 80 HN ILE 80 -8.626 -10.388 -21.241 602 HA ILE 80 HA ILE 80 -7.172 -9.813 -22.933 603 HB ILE 80 HB ILE 80 -9.421 -11.009 -24.582 604 HG12 ILE 80 HG12 ILE 80 -6.977 -12.390 -23.430 605 HG13 ILE 80 HG11 ILE 80 -8.534 -12.401 -22.610 606 HG21 ILE 80 HG21 ILE 80 -6.461 -10.580 -25.112 607 HG22 ILE 80 HG22 ILE 80 -7.817 -9.925 -26.033 608 HG23 ILE 80 HG23 ILE 80 -7.472 -11.652 -26.083 609 HD11 ILE 80 HD11 ILE 80 -8.016 -13.426 -25.417 610 HD12 ILE 80 HD12 ILE 80 -9.565 -13.461 -24.575 611 HD13 ILE 80 HD13 ILE 80 -8.216 -14.429 -23.981 612 H ARG 81 HN ARG 81 -7.074 -7.575 -22.950 613 HA ARG 81 HA ARG 81 -9.102 -6.054 -24.464 614 HB2 ARG 81 HB2 ARG 81 -6.756 -5.091 -22.799 615 HB3 ARG 81 HB1 ARG 81 -7.972 -4.063 -23.549 616 HG2 ARG 81 HG2 ARG 81 -9.732 -5.200 -22.220 617 HG3 ARG 81 HG1 ARG 81 -8.500 -6.193 -21.451 618 HD2 ARG 81 HD2 ARG 81 -9.014 -4.364 -19.958 619 HD3 ARG 81 HD1 ARG 81 -7.418 -4.072 -20.628 620 HE ARG 81 HE ARG 81 -9.351 -2.787 -22.242 621 HH11 ARG 81 HH21 ARG 81 -7.739 -2.571 -19.172 622 HH12 ARG 81 HH22 ARG 81 -8.095 -0.890 -18.957 623 HH21 ARG 81 HH11 ARG 81 -9.763 -0.576 -21.977 624 HH22 ARG 81 HH12 ARG 81 -9.225 0.237 -20.546 625 H LEU 82 HN LEU 82 -8.674 -4.972 -26.333 626 HA LEU 82 HA LEU 82 -6.401 -5.868 -27.897 627 HB2 LEU 82 HB2 LEU 82 -7.521 -4.222 -29.623 628 HB3 LEU 82 HB1 LEU 82 -8.334 -5.728 -29.212 629 HG LEU 82 HG LEU 82 -9.814 -4.592 -27.662 630 HD11 LEU 82 HD11 LEU 82 -8.063 -2.182 -28.230 631 HD12 LEU 82 HD12 LEU 82 -8.440 -2.911 -26.667 632 HD13 LEU 82 HD13 LEU 82 -9.682 -2.028 -27.545 633 HD21 LEU 82 HD21 LEU 82 -10.392 -4.564 -30.076 634 HD22 LEU 82 HD22 LEU 82 -9.570 -3.012 -30.243 635 HD23 LEU 82 HD23 LEU 82 -11.013 -3.142 -29.238 636 H ASN 83 HN ASN 83 -6.573 -3.673 -25.562 637 HA ASN 83 HA ASN 83 -5.227 -1.427 -26.818 638 HB2 ASN 83 HB2 ASN 83 -6.718 -1.023 -24.950 639 HB3 ASN 83 HB1 ASN 83 -5.774 -2.091 -23.918 640 HD21 ASN 83 HD21 ASN 83 -4.901 -0.620 -22.429 641 HD22 ASN 83 HD22 ASN 83 -3.953 0.720 -22.860 642 H ARG 84 HN ARG 84 -4.118 -4.329 -26.594 643 HA ARG 84 HA ARG 84 -1.809 -4.258 -24.993 644 HB2 ARG 84 HB2 ARG 84 -2.505 -5.819 -27.485 645 HB3 ARG 84 HB1 ARG 84 -0.922 -5.990 -26.719 646 HG2 ARG 84 HG2 ARG 84 -2.056 -6.582 -24.578 647 HG3 ARG 84 HG1 ARG 84 -3.614 -6.481 -25.399 648 HD2 ARG 84 HD2 ARG 84 -1.371 -8.303 -26.295 649 HD3 ARG 84 HD1 ARG 84 -2.631 -8.815 -25.190 650 HE ARG 84 HE ARG 84 -2.869 -8.473 -28.047 651 HH11 ARG 84 HH21 ARG 84 -4.600 -8.200 -25.071 652 HH12 ARG 84 HH22 ARG 84 -6.071 -8.862 -25.699 653 HH21 ARG 84 HH11 ARG 84 -4.792 -9.382 -28.880 654 HH22 ARG 84 HH12 ARG 84 -6.175 -9.549 -27.853 655 H SER 85 HN SER 85 -2.548 -2.283 -27.554 656 HA SER 85 HA SER 85 0.041 -2.043 -28.763 657 HB2 SER 85 HB2 SER 85 -0.901 -0.008 -29.788 658 HB3 SER 85 HB1 SER 85 -1.964 -1.399 -29.978 659 HG SER 85 HG SER 85 -2.929 -0.563 -27.919 660 H GLU 86 HN GLU 86 -1.649 -0.454 -26.119 661 HA GLU 86 HA GLU 86 0.403 1.565 -25.732 662 HB2 GLU 86 HB2 GLU 86 -1.975 0.754 -24.034 663 HB3 GLU 86 HB1 GLU 86 -0.918 2.122 -23.690 664 HG2 GLU 86 HG2 GLU 86 -2.511 1.790 -26.250 665 HG3 GLU 86 HG1 GLU 86 -3.014 2.777 -24.881 666 H ARG 87 HN ARG 87 1.615 1.768 -23.765 667 HA ARG 87 HA ARG 87 2.704 -0.802 -22.862 668 HB2 ARG 87 HB2 ARG 87 3.570 2.009 -22.148 669 HB3 ARG 87 HB1 ARG 87 4.467 0.524 -21.845 670 HG2 ARG 87 HG2 ARG 87 3.731 1.575 -24.600 671 HG3 ARG 87 HG1 ARG 87 5.310 1.750 -23.845 672 HD2 ARG 87 HD2 ARG 87 5.403 -0.798 -23.693 673 HD3 ARG 87 HD1 ARG 87 3.960 -0.823 -24.699 674 HE ARG 87 HE ARG 87 5.233 -0.247 -26.535 675 HH11 ARG 87 HH21 ARG 87 7.036 0.292 -23.609 676 HH12 ARG 87 HH22 ARG 87 8.523 0.602 -24.448 677 HH21 ARG 87 HH11 ARG 87 7.180 0.079 -27.597 678 HH22 ARG 87 HH12 ARG 87 8.609 0.443 -26.696 679 H TRP 88 HN TRP 88 2.847 -1.469 -20.763 680 HA TRP 88 HA TRP 88 1.437 -0.051 -18.634 681 HB2 TRP 88 HB2 TRP 88 0.453 -2.693 -19.733 682 HB3 TRP 88 HB1 TRP 88 -0.022 -2.054 -18.166 683 HD1 TRP 88 HD1 TRP 88 -0.468 -1.461 -21.909 684 HE1 TRP 88 HE1 TRP 88 -2.446 0.157 -22.256 685 HE3 TRP 88 HE3 TRP 88 -1.367 -0.136 -17.069 686 HZ2 TRP 88 HZ2 TRP 88 -4.187 1.799 -20.675 687 HZ3 TRP 88 HZ3 TRP 88 -3.186 1.450 -16.510 688 HH2 TRP 88 HH2 TRP 88 -4.597 2.418 -18.306 689 H ASP 89 HN ASP 89 1.369 -1.611 -16.646 690 HA ASP 89 HA ASP 89 4.095 -2.365 -16.102 691 HB2 ASP 89 HB2 ASP 89 1.713 -2.957 -14.331 692 HB3 ASP 89 HB1 ASP 89 3.385 -2.673 -13.858 693 H ALA 90 HN ALA 90 4.053 -4.543 -14.578 694 HA ALA 90 HA ALA 90 2.592 -6.754 -15.680 695 HB1 ALA 90 HB1 ALA 90 4.410 -7.917 -16.761 696 HB2 ALA 90 HB2 ALA 90 5.527 -6.608 -16.382 697 HB3 ALA 90 HB3 ALA 90 4.203 -6.341 -17.520 698 H TYR 91 HN TYR 91 3.393 -8.848 -14.821 699 HA TYR 91 HA TYR 91 4.902 -8.580 -12.277 700 HB2 TYR 91 HB2 TYR 91 2.278 -10.029 -12.705 701 HB3 TYR 91 HB1 TYR 91 3.282 -10.189 -11.265 702 HD1 TYR 91 HD2 TYR 91 3.572 -8.284 -9.703 703 HD2 TYR 91 HD1 TYR 91 0.990 -7.997 -13.130 704 HE1 TYR 91 HE2 TYR 91 2.499 -6.273 -8.728 705 HE2 TYR 91 HE1 TYR 91 -0.081 -5.990 -12.149 706 HH TYR 91 HH TYR 91 -0.414 -5.010 -9.877 707 H CYS 92 HN CYS 92 5.826 -10.533 -11.533 708 HA CYS 92 HA CYS 92 6.223 -12.624 -13.607 709 HB2 CYS 92 HB2 CYS 92 8.165 -10.973 -13.231 710 HB3 CYS 92 HB1 CYS 92 8.353 -11.726 -11.660 711 H TYR 93 HN TYR 93 7.726 -14.369 -12.187 712 HA TYR 93 HA TYR 93 6.509 -14.953 -9.610 713 HB2 TYR 93 HB2 TYR 93 4.816 -15.697 -11.344 714 HB3 TYR 93 HB1 TYR 93 6.007 -16.858 -11.916 715 HD1 TYR 93 HD1 TYR 93 3.744 -15.950 -9.141 716 HD2 TYR 93 HD2 TYR 93 6.636 -18.805 -10.548 717 HE1 TYR 93 HE1 TYR 93 3.026 -17.547 -7.382 718 HE2 TYR 93 HE2 TYR 93 5.917 -20.395 -8.786 719 HH TYR 93 HH TYR 93 3.858 -20.810 -7.416 720 H ASN 94 HN ASN 94 7.660 -16.461 -8.454 721 HA ASN 94 HA ASN 94 9.826 -17.920 -9.789 722 HB2 ASN 94 HB2 ASN 94 10.370 -15.957 -7.560 723 HB3 ASN 94 HB1 ASN 94 11.549 -17.048 -8.284 724 HD21 ASN 94 HD21 ASN 94 12.439 -16.477 -10.343 725 HD22 ASN 94 HD22 ASN 94 12.066 -15.022 -11.132 726 HA PRO 95 HA PRO 95 8.675 -20.776 -6.560 727 HB2 PRO 95 HB2 PRO 95 10.648 -22.633 -6.784 728 HB3 PRO 95 HB1 PRO 95 9.440 -22.405 -8.068 729 HG2 PRO 95 HG2 PRO 95 12.237 -21.315 -7.904 730 HG3 PRO 95 HG1 PRO 95 11.426 -22.115 -9.271 731 HD2 PRO 95 HD2 PRO 95 11.606 -19.381 -9.087 732 HD3 PRO 95 HD1 PRO 95 10.223 -20.203 -9.856 733 H HIS 96 HN HIS 96 11.036 -18.541 -6.252 734 HA HIS 96 HA HIS 96 12.773 -19.404 -4.242 735 HB2 HIS 96 HB2 HIS 96 12.989 -17.277 -5.498 736 HB3 HIS 96 HB1 HIS 96 11.600 -16.641 -4.621 737 HD1 HIS 96 HD1 HIS 96 11.960 -15.888 -2.203 738 HD2 HIS 96 HD2 HIS 96 15.346 -17.655 -3.871 739 HE1 HIS 96 HE1 HIS 96 13.869 -15.419 -0.609 740 HE2 HIS 96 HE2 HIS 96 15.942 -16.490 -1.612 741 H ALA 97 HN ALA 97 9.563 -17.888 -3.979 742 HA ALA 97 HA ALA 97 9.476 -17.780 -1.154 743 HB1 ALA 97 HB1 ALA 97 7.835 -16.579 -2.502 744 HB2 ALA 97 HB2 ALA 97 6.997 -17.735 -1.468 745 HB3 ALA 97 HB3 ALA 97 7.242 -18.096 -3.175 746 H LYS 98 HN LYS 98 7.736 -20.013 -3.272 747 HA LYS 98 HA LYS 98 8.745 -22.342 -2.103 748 HB2 LYS 98 HB2 LYS 98 6.788 -23.211 -0.936 749 HB3 LYS 98 HB1 LYS 98 7.386 -21.767 -0.132 750 HG2 LYS 98 HG2 LYS 98 5.604 -20.446 -1.306 751 HG3 LYS 98 HG1 LYS 98 4.979 -21.958 -1.974 752 HD2 LYS 98 HD2 LYS 98 4.783 -22.837 0.391 753 HD3 LYS 98 HD1 LYS 98 5.207 -21.226 0.964 754 HE2 LYS 98 HE2 LYS 98 2.832 -21.868 -0.800 755 HE3 LYS 98 HE1 LYS 98 2.758 -21.612 0.942 756 HZ1 LYS 98 HZ1 LYS 98 4.142 -19.461 -0.057 757 HZ2 LYS 98 HZ2 LYS 98 2.538 -19.469 0.505 758 HZ3 LYS 98 HZ3 LYS 98 2.863 -19.694 -1.148 Start of MODEL 14 1 H1 GLY 1 H1 GLY 1 7.424 -15.159 -3.686 2 H2 GLY 1 H2 GLY 1 7.696 -16.824 -3.483 3 H3 GLY 1 H3 GLY 1 6.455 -16.051 -2.617 4 HA2 GLY 1 HA3 GLY 1 6.379 -17.207 -5.206 5 HA3 GLY 1 HA2 GLY 1 5.048 -16.614 -4.213 6 H VAL 2 HN VAL 2 4.179 -14.635 -4.610 7 HA VAL 2 HA VAL 2 4.872 -13.354 -7.132 8 HB VAL 2 HB VAL 2 2.736 -12.541 -5.140 9 HG11 VAL 2 HG11 VAL 2 2.962 -12.161 -8.144 10 HG12 VAL 2 HG12 VAL 2 3.324 -10.915 -6.952 11 HG13 VAL 2 HG13 VAL 2 1.682 -11.535 -7.106 12 HG21 VAL 2 HG21 VAL 2 1.206 -13.932 -6.497 13 HG22 VAL 2 HG22 VAL 2 2.465 -14.919 -5.759 14 HG23 VAL 2 HG23 VAL 2 2.572 -14.486 -7.465 15 H TYR 3 HN TYR 3 5.836 -11.430 -7.400 16 HA TYR 3 HA TYR 3 6.251 -9.631 -5.116 17 HB2 TYR 3 HB2 TYR 3 8.655 -9.509 -5.418 18 HB3 TYR 3 HB1 TYR 3 8.179 -11.157 -5.038 19 HD1 TYR 3 HD2 TYR 3 7.810 -12.791 -7.015 20 HD2 TYR 3 HD1 TYR 3 9.940 -9.075 -7.377 21 HE1 TYR 3 HE2 TYR 3 8.928 -13.626 -9.066 22 HE2 TYR 3 HE1 TYR 3 11.061 -9.916 -9.410 23 HH TYR 3 HH TYR 3 10.096 -12.922 -10.933 24 H HIS 4 HN HIS 4 7.071 -7.547 -5.734 25 HA HIS 4 HA HIS 4 5.831 -6.616 -8.159 26 HB2 HIS 4 HB2 HIS 4 5.772 -5.231 -6.162 27 HB3 HIS 4 HB1 HIS 4 7.533 -5.170 -6.114 28 HD1 HIS 4 HD1 HIS 4 4.668 -4.169 -8.426 29 HD2 HIS 4 HD2 HIS 4 8.616 -3.100 -7.621 30 HE1 HIS 4 HE1 HIS 4 5.159 -2.124 -9.837 31 HE2 HIS 4 HE2 HIS 4 7.562 -1.459 -9.358 32 H ARG 5 HN ARG 5 6.815 -5.649 -9.937 33 HA ARG 5 HA ARG 5 9.703 -6.233 -10.325 34 HB2 ARG 5 HB2 ARG 5 7.334 -6.771 -12.101 35 HB3 ARG 5 HB1 ARG 5 8.892 -6.449 -12.849 36 HG2 ARG 5 HG2 ARG 5 8.535 -8.582 -10.715 37 HG3 ARG 5 HG1 ARG 5 8.310 -8.915 -12.432 38 HD2 ARG 5 HD2 ARG 5 10.619 -8.077 -12.871 39 HD3 ARG 5 HD1 ARG 5 10.867 -7.891 -11.145 40 HE ARG 5 HE ARG 5 10.041 -10.527 -11.624 41 HH11 ARG 5 HH21 ARG 5 12.680 -8.313 -11.996 42 HH12 ARG 5 HH22 ARG 5 13.865 -9.539 -12.294 43 HH21 ARG 5 HH11 ARG 5 11.610 -12.165 -11.996 44 HH22 ARG 5 HH12 ARG 5 13.256 -11.723 -12.305 45 H GLU 6 HN GLU 6 10.800 -4.885 -11.805 46 HA GLU 6 HA GLU 6 9.589 -2.411 -12.702 47 HB2 GLU 6 HB2 GLU 6 10.056 -1.896 -10.346 48 HB3 GLU 6 HB1 GLU 6 11.729 -2.405 -10.553 49 HG2 GLU 6 HG2 GLU 6 12.100 -0.610 -12.193 50 HG3 GLU 6 HG1 GLU 6 10.408 -0.140 -12.080 51 H ALA 7 HN ALA 7 10.415 -2.099 -14.621 52 HA ALA 7 HA ALA 7 13.004 -3.274 -15.385 53 HB1 ALA 7 HB1 ALA 7 10.765 -1.964 -16.928 54 HB2 ALA 7 HB2 ALA 7 11.261 -3.659 -16.957 55 HB3 ALA 7 HB3 ALA 7 12.295 -2.426 -17.680 56 H ARG 8 HN ARG 8 14.448 -1.946 -16.766 57 HA ARG 8 HA ARG 8 15.278 0.398 -15.392 58 HB2 ARG 8 HB2 ARG 8 16.095 -0.780 -18.055 59 HB3 ARG 8 HB1 ARG 8 16.865 0.638 -17.353 60 HG2 ARG 8 HG2 ARG 8 17.488 -0.717 -15.349 61 HG3 ARG 8 HG1 ARG 8 16.752 -2.135 -16.112 62 HD2 ARG 8 HD2 ARG 8 18.264 -1.955 -18.013 63 HD3 ARG 8 HD1 ARG 8 18.974 -0.487 -17.362 64 HE ARG 8 HE ARG 8 19.279 -2.668 -15.533 65 HH11 ARG 8 HH21 ARG 8 20.485 -1.055 -18.342 66 HH12 ARG 8 HH22 ARG 8 21.927 -2.006 -18.475 67 HH21 ARG 8 HH11 ARG 8 21.211 -3.972 -15.702 68 HH22 ARG 8 HH12 ARG 8 22.326 -3.666 -16.992 69 H SER 9 HN SER 9 13.437 -0.173 -18.345 70 HA SER 9 HA SER 9 13.464 2.479 -19.345 71 HB2 SER 9 HB2 SER 9 11.300 0.403 -19.742 72 HB3 SER 9 HB1 SER 9 11.638 1.788 -20.777 73 HG SER 9 HG SER 9 13.808 0.174 -20.284 74 H GLY 10 HN GLY 10 11.452 0.833 -16.981 75 HA2 GLY 10 HA3 GLY 10 10.670 2.789 -15.379 76 HA3 GLY 10 HA2 GLY 10 9.639 3.147 -16.753 77 H LYS 11 HN LYS 11 8.248 2.716 -14.653 78 HA LYS 11 HA LYS 11 7.679 0.013 -13.965 79 HB2 LYS 11 HB2 LYS 11 6.024 2.532 -13.627 80 HB3 LYS 11 HB1 LYS 11 5.636 0.980 -12.897 81 HG2 LYS 11 HG2 LYS 11 8.336 2.271 -12.410 82 HG3 LYS 11 HG1 LYS 11 6.933 2.758 -11.465 83 HD2 LYS 11 HD2 LYS 11 6.595 0.382 -10.784 84 HD3 LYS 11 HD1 LYS 11 8.061 -0.058 -11.657 85 HE2 LYS 11 HE2 LYS 11 8.710 0.244 -9.369 86 HE3 LYS 11 HE1 LYS 11 9.284 1.670 -10.232 87 HZ1 LYS 11 HZ1 LYS 11 8.165 2.832 -8.727 88 HZ2 LYS 11 HZ2 LYS 11 7.329 1.468 -8.156 89 HZ3 LYS 11 HZ3 LYS 11 6.747 2.322 -9.503 90 H TYR 12 HN TYR 12 4.841 1.722 -14.761 91 HA TYR 12 HA TYR 12 3.943 -0.333 -16.507 92 HB2 TYR 12 HB2 TYR 12 1.980 1.288 -16.882 93 HB3 TYR 12 HB1 TYR 12 2.239 0.711 -15.239 94 HD1 TYR 12 HD2 TYR 12 3.399 2.164 -13.561 95 HD2 TYR 12 HD1 TYR 12 2.211 3.649 -17.417 96 HE1 TYR 12 HE2 TYR 12 3.596 4.488 -12.730 97 HE2 TYR 12 HE1 TYR 12 2.413 5.972 -16.581 98 HH TYR 12 HH TYR 12 3.191 6.644 -13.178 99 H LYS 13 HN LYS 13 5.898 -0.097 -17.929 100 HA LYS 13 HA LYS 13 5.165 1.493 -20.283 101 HB2 LYS 13 HB2 LYS 13 7.795 1.698 -18.804 102 HB3 LYS 13 HB1 LYS 13 7.651 2.125 -20.514 103 HG2 LYS 13 HG2 LYS 13 5.780 3.714 -19.857 104 HG3 LYS 13 HG1 LYS 13 6.171 3.370 -18.171 105 HD2 LYS 13 HD2 LYS 13 8.439 4.205 -18.495 106 HD3 LYS 13 HD1 LYS 13 8.133 4.447 -20.211 107 HE2 LYS 13 HE2 LYS 13 7.903 6.582 -19.088 108 HE3 LYS 13 HE1 LYS 13 6.303 6.047 -19.605 109 HZ1 LYS 13 HZ1 LYS 13 7.065 6.733 -17.059 110 HZ2 LYS 13 HZ2 LYS 13 6.945 5.037 -17.027 111 HZ3 LYS 13 HZ3 LYS 13 5.615 5.979 -17.514 112 H LEU 14 HN LEU 14 5.111 -1.357 -19.547 113 HA LEU 14 HA LEU 14 6.903 -2.426 -21.692 114 HB2 LEU 14 HB2 LEU 14 5.966 -4.008 -19.286 115 HB3 LEU 14 HB1 LEU 14 7.200 -4.449 -20.461 116 HG LEU 14 HG LEU 14 7.444 -2.077 -18.579 117 HD11 LEU 14 HD11 LEU 14 8.730 -4.813 -18.364 118 HD12 LEU 14 HD12 LEU 14 7.365 -4.272 -17.386 119 HD13 LEU 14 HD13 LEU 14 8.923 -3.465 -17.246 120 HD21 LEU 14 HD21 LEU 14 9.412 -3.492 -20.414 121 HD22 LEU 14 HD22 LEU 14 9.880 -2.297 -19.205 122 HD23 LEU 14 HD23 LEU 14 8.855 -1.827 -20.555 123 H THR 15 HN THR 15 6.046 -3.843 -23.136 124 HA THR 15 HA THR 15 3.090 -4.024 -23.196 125 HB THR 15 HB THR 15 3.366 -4.723 -25.516 126 HG1 THR 15 HG1 THR 15 6.075 -4.706 -24.764 127 HG21 THR 15 HG21 THR 15 4.237 -2.632 -26.393 128 HG22 THR 15 HG22 THR 15 5.098 -2.320 -24.886 129 HG23 THR 15 HG23 THR 15 3.335 -2.307 -24.915 130 H TYR 16 HN TYR 16 2.186 -6.094 -24.070 131 HA TYR 16 HA TYR 16 2.522 -8.196 -22.339 132 HB2 TYR 16 HB2 TYR 16 1.505 -9.636 -24.166 133 HB3 TYR 16 HB1 TYR 16 0.616 -8.173 -23.779 134 HD1 TYR 16 HD2 TYR 16 0.610 -6.235 -25.276 135 HD2 TYR 16 HD1 TYR 16 2.667 -9.862 -26.314 136 HE1 TYR 16 HE2 TYR 16 0.756 -5.488 -27.652 137 HE2 TYR 16 HE1 TYR 16 2.806 -9.117 -28.677 138 HH TYR 16 HH TYR 16 1.113 -7.212 -30.102 139 H ALA 17 HN ALA 17 3.933 -8.036 -25.614 140 HA ALA 17 HA ALA 17 5.443 -10.370 -25.506 141 HB1 ALA 17 HB1 ALA 17 6.154 -7.762 -26.864 142 HB2 ALA 17 HB2 ALA 17 5.182 -9.059 -27.555 143 HB3 ALA 17 HB3 ALA 17 6.892 -9.326 -27.210 144 H GLU 18 HN GLU 18 6.312 -7.111 -24.361 145 HA GLU 18 HA GLU 18 8.970 -7.746 -23.596 146 HB2 GLU 18 HB2 GLU 18 7.115 -5.576 -22.583 147 HB3 GLU 18 HB1 GLU 18 8.827 -5.682 -22.189 148 HG2 GLU 18 HG2 GLU 18 7.754 -5.497 -25.020 149 HG3 GLU 18 HG1 GLU 18 8.301 -4.114 -24.081 150 H ALA 19 HN ALA 19 5.878 -8.254 -22.095 151 HA ALA 19 HA ALA 19 6.846 -8.627 -19.417 152 HB1 ALA 19 HB1 ALA 19 4.268 -9.717 -20.563 153 HB2 ALA 19 HB2 ALA 19 4.473 -8.029 -20.093 154 HB3 ALA 19 HB3 ALA 19 4.623 -9.306 -18.885 155 H LYS 20 HN LYS 20 6.224 -10.756 -22.153 156 HA LYS 20 HA LYS 20 6.606 -13.203 -20.722 157 HB2 LYS 20 HB2 LYS 20 6.860 -12.676 -23.694 158 HB3 LYS 20 HB1 LYS 20 6.647 -14.246 -22.925 159 HG2 LYS 20 HG2 LYS 20 4.622 -12.005 -22.610 160 HG3 LYS 20 HG1 LYS 20 4.530 -13.177 -23.918 161 HD2 LYS 20 HD2 LYS 20 4.454 -15.014 -22.227 162 HD3 LYS 20 HD1 LYS 20 4.437 -13.805 -20.947 163 HE2 LYS 20 HE2 LYS 20 2.156 -14.479 -21.379 164 HE3 LYS 20 HE1 LYS 20 2.370 -12.824 -21.951 165 HZ1 LYS 20 HZ1 LYS 20 2.203 -13.448 -24.104 166 HZ2 LYS 20 HZ2 LYS 20 1.278 -14.704 -23.430 167 HZ3 LYS 20 HZ3 LYS 20 2.902 -14.972 -23.851 168 H ALA 21 HN ALA 21 8.702 -10.940 -22.339 169 HA ALA 21 HA ALA 21 10.956 -12.617 -22.677 170 HB1 ALA 21 HB1 ALA 21 12.230 -10.506 -22.857 171 HB2 ALA 21 HB2 ALA 21 10.835 -9.617 -22.246 172 HB3 ALA 21 HB3 ALA 21 10.742 -10.445 -23.800 173 H VAL 22 HN VAL 22 10.137 -10.355 -20.030 174 HA VAL 22 HA VAL 22 12.441 -10.890 -18.466 175 HB VAL 22 HB VAL 22 11.026 -9.954 -16.573 176 HG11 VAL 22 HG11 VAL 22 10.856 -7.702 -17.590 177 HG12 VAL 22 HG12 VAL 22 11.077 -8.415 -19.188 178 HG13 VAL 22 HG13 VAL 22 12.382 -8.484 -18.002 179 HG21 VAL 22 HG21 VAL 22 8.861 -10.833 -17.521 180 HG22 VAL 22 HG22 VAL 22 8.986 -9.613 -18.791 181 HG23 VAL 22 HG23 VAL 22 8.812 -9.121 -17.107 182 H CYS 23 HN CYS 23 9.411 -12.564 -18.835 183 HA CYS 23 HA CYS 23 10.081 -14.441 -16.627 184 HB2 CYS 23 HB2 CYS 23 7.492 -13.970 -18.105 185 HB3 CYS 23 HB1 CYS 23 7.731 -15.192 -16.860 186 H GLU 24 HN GLU 24 9.100 -16.709 -17.214 187 HA GLU 24 HA GLU 24 9.346 -18.659 -18.413 188 HB2 GLU 24 HB2 GLU 24 8.929 -16.653 -20.633 189 HB3 GLU 24 HB1 GLU 24 9.504 -18.241 -21.080 190 HG2 GLU 24 HG2 GLU 24 7.107 -18.247 -21.220 191 HG3 GLU 24 HG1 GLU 24 7.541 -19.214 -19.816 192 H PHE 25 HN PHE 25 11.600 -16.065 -18.989 193 HA PHE 25 HA PHE 25 13.637 -17.488 -20.322 194 HB2 PHE 25 HB2 PHE 25 13.488 -15.015 -20.103 195 HB3 PHE 25 HB1 PHE 25 13.906 -15.164 -18.399 196 HD1 PHE 25 HD1 PHE 25 15.142 -15.523 -21.870 197 HD2 PHE 25 HD2 PHE 25 16.171 -15.750 -17.703 198 HE1 PHE 25 HE1 PHE 25 17.549 -15.528 -22.463 199 HE2 PHE 25 HE2 PHE 25 18.576 -15.758 -18.300 200 HZ PHE 25 HZ PHE 25 19.267 -15.644 -20.679 201 H GLU 26 HN GLU 26 13.039 -16.924 -16.864 202 HA GLU 26 HA GLU 26 15.231 -18.768 -16.147 203 HB2 GLU 26 HB2 GLU 26 14.904 -17.981 -13.861 204 HB3 GLU 26 HB1 GLU 26 15.134 -16.623 -14.957 205 HG2 GLU 26 HG2 GLU 26 12.662 -16.325 -15.052 206 HG3 GLU 26 HG1 GLU 26 12.485 -17.618 -13.866 207 H GLY 27 HN GLY 27 12.244 -19.253 -17.136 208 HA2 GLY 27 HA3 GLY 27 11.139 -21.340 -17.025 209 HA3 GLY 27 HA2 GLY 27 11.891 -21.663 -15.469 210 H GLY 28 HN GLY 28 10.889 -18.572 -15.215 211 HA2 GLY 28 HA3 GLY 28 8.616 -19.263 -13.568 212 HA3 GLY 28 HA2 GLY 28 9.252 -17.647 -13.859 213 H HIS 29 HN HIS 29 6.750 -17.457 -13.845 214 HA HIS 29 HA HIS 29 5.926 -17.092 -16.621 215 HB2 HIS 29 HB2 HIS 29 3.843 -18.348 -16.395 216 HB3 HIS 29 HB1 HIS 29 5.228 -19.409 -16.153 217 HD1 HIS 29 HD1 HIS 29 2.164 -18.211 -14.529 218 HD2 HIS 29 HD2 HIS 29 5.721 -20.004 -13.294 219 HE1 HIS 29 HE1 HIS 29 1.741 -19.112 -12.201 220 HE2 HIS 29 HE2 HIS 29 3.899 -20.208 -11.435 221 H LEU 30 HN LEU 30 3.889 -15.888 -16.786 222 HA LEU 30 HA LEU 30 3.852 -13.687 -14.954 223 HB2 LEU 30 HB2 LEU 30 2.150 -14.486 -17.328 224 HB3 LEU 30 HB1 LEU 30 1.733 -13.083 -16.348 225 HG LEU 30 HG LEU 30 3.940 -12.092 -16.798 226 HD11 LEU 30 HD11 LEU 30 5.365 -13.983 -17.072 227 HD12 LEU 30 HD12 LEU 30 5.322 -13.198 -18.647 228 HD13 LEU 30 HD13 LEU 30 4.366 -14.653 -18.363 229 HD21 LEU 30 HD21 LEU 30 1.967 -11.747 -18.350 230 HD22 LEU 30 HD22 LEU 30 2.640 -13.003 -19.386 231 HD23 LEU 30 HD23 LEU 30 3.538 -11.510 -19.112 232 H ALA 31 HN ALA 31 2.257 -13.098 -13.491 233 HA ALA 31 HA ALA 31 1.034 -15.155 -12.013 234 HB1 ALA 31 HB1 ALA 31 0.072 -13.402 -10.688 235 HB2 ALA 31 HB2 ALA 31 0.261 -12.230 -11.991 236 HB3 ALA 31 HB3 ALA 31 1.683 -12.871 -11.167 237 H THR 32 HN THR 32 -1.162 -15.666 -11.724 238 HA THR 32 HA THR 32 -2.972 -14.915 -13.973 239 HB THR 32 HB THR 32 -2.843 -17.636 -12.644 240 HG1 THR 32 HG1 THR 32 -1.326 -18.079 -14.001 241 HG21 THR 32 HG21 THR 32 -5.021 -17.220 -13.589 242 HG22 THR 32 HG22 THR 32 -4.154 -18.253 -14.726 243 HG23 THR 32 HG23 THR 32 -4.320 -16.529 -15.053 244 H TYR 33 HN TYR 33 -5.212 -14.986 -13.518 245 HA TYR 33 HA TYR 33 -6.030 -13.732 -11.185 246 HB2 TYR 33 HB2 TYR 33 -7.371 -13.632 -13.174 247 HB3 TYR 33 HB1 TYR 33 -7.582 -15.379 -13.189 248 HD1 TYR 33 HD1 TYR 33 -8.530 -12.219 -11.486 249 HD2 TYR 33 HD2 TYR 33 -9.165 -16.464 -11.691 250 HE1 TYR 33 HE1 TYR 33 -10.567 -11.986 -10.086 251 HE2 TYR 33 HE2 TYR 33 -11.197 -16.230 -10.293 252 HH TYR 33 HH TYR 33 -12.545 -13.112 -9.520 253 H LYS 34 HN LYS 34 -5.367 -17.058 -11.766 254 HA LYS 34 HA LYS 34 -6.962 -18.151 -9.623 255 HB2 LYS 34 HB2 LYS 34 -6.276 -19.466 -11.621 256 HB3 LYS 34 HB1 LYS 34 -4.600 -19.363 -11.089 257 HG2 LYS 34 HG2 LYS 34 -5.179 -20.554 -9.005 258 HG3 LYS 34 HG1 LYS 34 -6.867 -20.624 -9.511 259 HD2 LYS 34 HD2 LYS 34 -6.208 -21.928 -11.511 260 HD3 LYS 34 HD1 LYS 34 -4.529 -21.879 -10.978 261 HE2 LYS 34 HE2 LYS 34 -6.817 -23.107 -9.411 262 HE3 LYS 34 HE1 LYS 34 -5.630 -24.011 -10.349 263 HZ1 LYS 34 HZ1 LYS 34 -4.029 -22.520 -8.844 264 HZ2 LYS 34 HZ2 LYS 34 -4.565 -24.066 -8.385 265 HZ3 LYS 34 HZ3 LYS 34 -5.342 -22.681 -7.784 266 H GLN 35 HN GLN 35 -3.437 -17.770 -10.066 267 HA GLN 35 HA GLN 35 -2.816 -18.379 -7.353 268 HB2 GLN 35 HB2 GLN 35 -1.175 -16.975 -9.478 269 HB3 GLN 35 HB1 GLN 35 -0.555 -17.494 -7.912 270 HG2 GLN 35 HG2 GLN 35 -1.168 -19.830 -8.448 271 HG3 GLN 35 HG1 GLN 35 -1.755 -19.306 -10.027 272 HE21 GLN 35 HE21 GLN 35 0.764 -17.273 -9.618 273 HE22 GLN 35 HE22 GLN 35 2.029 -18.209 -10.257 274 H LEU 36 HN LEU 36 -3.501 -15.407 -9.097 275 HA LEU 36 HA LEU 36 -2.541 -13.549 -7.206 276 HB2 LEU 36 HB2 LEU 36 -4.664 -13.473 -9.325 277 HB3 LEU 36 HB1 LEU 36 -4.475 -12.087 -8.284 278 HG LEU 36 HG LEU 36 -2.182 -13.265 -9.880 279 HD11 LEU 36 HD11 LEU 36 -3.946 -12.519 -11.418 280 HD12 LEU 36 HD12 LEU 36 -2.589 -11.394 -11.467 281 HD13 LEU 36 HD13 LEU 36 -4.050 -10.974 -10.573 282 HD21 LEU 36 HD21 LEU 36 -1.313 -10.858 -9.563 283 HD22 LEU 36 HD22 LEU 36 -1.337 -11.842 -8.112 284 HD23 LEU 36 HD23 LEU 36 -2.602 -10.648 -8.380 285 H GLU 37 HN GLU 37 -5.704 -15.148 -7.500 286 HA GLU 37 HA GLU 37 -6.928 -13.744 -5.352 287 HB2 GLU 37 HB2 GLU 37 -8.149 -14.968 -7.160 288 HB3 GLU 37 HB1 GLU 37 -7.623 -16.485 -6.437 289 HG2 GLU 37 HG2 GLU 37 -9.844 -16.034 -5.622 290 HG3 GLU 37 HG1 GLU 37 -8.742 -15.746 -4.283 291 H ALA 38 HN ALA 38 -5.011 -16.687 -5.550 292 HA ALA 38 HA ALA 38 -5.517 -17.585 -2.888 293 HB1 ALA 38 HB1 ALA 38 -3.148 -18.183 -4.677 294 HB2 ALA 38 HB2 ALA 38 -4.675 -19.069 -4.678 295 HB3 ALA 38 HB3 ALA 38 -3.641 -19.096 -3.250 296 H ALA 39 HN ALA 39 -3.166 -15.410 -4.330 297 HA ALA 39 HA ALA 39 -1.619 -15.176 -1.868 298 HB1 ALA 39 HB1 ALA 39 -0.410 -15.082 -3.949 299 HB2 ALA 39 HB2 ALA 39 -0.310 -13.509 -3.161 300 HB3 ALA 39 HB3 ALA 39 -1.406 -13.746 -4.522 301 H ARG 40 HN ARG 40 -4.273 -13.575 -3.411 302 HA ARG 40 HA ARG 40 -4.041 -10.994 -2.283 303 HB2 ARG 40 HB2 ARG 40 -5.589 -11.520 -4.114 304 HB3 ARG 40 HB1 ARG 40 -6.537 -12.533 -3.034 305 HG2 ARG 40 HG2 ARG 40 -7.595 -10.329 -3.287 306 HG3 ARG 40 HG1 ARG 40 -7.061 -10.545 -1.629 307 HD2 ARG 40 HD2 ARG 40 -5.402 -8.903 -1.823 308 HD3 ARG 40 HD1 ARG 40 -5.135 -9.231 -3.527 309 HE ARG 40 HE ARG 40 -6.574 -7.506 -3.955 310 HH11 ARG 40 HH21 ARG 40 -7.479 -8.868 -0.897 311 HH12 ARG 40 HH22 ARG 40 -8.892 -7.889 -0.738 312 HH21 ARG 40 HH11 ARG 40 -8.424 -6.263 -3.792 313 HH22 ARG 40 HH12 ARG 40 -9.470 -6.438 -2.420 314 H LYS 41 HN LYS 41 -5.587 -13.952 -1.068 315 HA LYS 41 HA LYS 41 -6.740 -12.820 1.242 316 HB2 LYS 41 HB2 LYS 41 -6.594 -15.224 2.148 317 HB3 LYS 41 HB1 LYS 41 -7.506 -14.985 0.658 318 HG2 LYS 41 HG2 LYS 41 -5.769 -15.875 -0.696 319 HG3 LYS 41 HG1 LYS 41 -4.568 -15.729 0.585 320 HD2 LYS 41 HD2 LYS 41 -5.219 -18.075 0.339 321 HD3 LYS 41 HD1 LYS 41 -5.792 -17.471 1.891 322 HE2 LYS 41 HE2 LYS 41 -8.039 -17.245 1.070 323 HE3 LYS 41 HE1 LYS 41 -7.526 -17.522 -0.595 324 HZ1 LYS 41 HZ1 LYS 41 -6.689 -19.752 0.316 325 HZ2 LYS 41 HZ2 LYS 41 -8.359 -19.557 0.068 326 HZ3 LYS 41 HZ3 LYS 41 -7.711 -19.442 1.634 327 H ILE 42 HN ILE 42 -3.546 -12.898 0.447 328 HA ILE 42 HA ILE 42 -2.578 -13.234 3.233 329 HB ILE 42 HB ILE 42 -0.866 -12.885 0.758 330 HG12 ILE 42 HG12 ILE 42 -2.330 -14.797 0.357 331 HG13 ILE 42 HG11 ILE 42 -0.707 -15.371 0.713 332 HG21 ILE 42 HG21 ILE 42 -0.367 -13.940 3.559 333 HG22 ILE 42 HG22 ILE 42 0.453 -12.613 2.743 334 HG23 ILE 42 HG23 ILE 42 0.733 -14.266 2.224 335 HD11 ILE 42 HD11 ILE 42 -2.126 -16.776 1.985 336 HD12 ILE 42 HD12 ILE 42 -3.150 -15.435 2.490 337 HD13 ILE 42 HD13 ILE 42 -1.533 -15.610 3.163 338 H GLY 43 HN GLY 43 -4.012 -10.846 1.863 339 HA2 GLY 43 HA3 GLY 43 -4.006 -8.576 2.295 340 HA3 GLY 43 HA2 GLY 43 -2.570 -8.808 3.284 341 H PHE 44 HN PHE 44 -2.449 -10.023 0.054 342 HA PHE 44 HA PHE 44 -0.188 -8.530 -0.650 343 HB2 PHE 44 HB2 PHE 44 -1.160 -10.713 -1.674 344 HB3 PHE 44 HB1 PHE 44 -2.134 -9.659 -2.677 345 HD1 PHE 44 HD1 PHE 44 1.406 -10.332 -1.654 346 HD2 PHE 44 HD2 PHE 44 -1.205 -8.718 -4.667 347 HE1 PHE 44 HE1 PHE 44 3.341 -10.038 -3.180 348 HE2 PHE 44 HE2 PHE 44 0.732 -8.429 -6.185 349 HZ PHE 44 HZ PHE 44 3.002 -9.086 -5.441 350 H HIS 45 HN HIS 45 -0.248 -6.355 -0.646 351 HA HIS 45 HA HIS 45 -2.534 -4.920 -1.825 352 HB2 HIS 45 HB2 HIS 45 -1.827 -4.146 0.340 353 HB3 HIS 45 HB1 HIS 45 -0.152 -4.030 -0.183 354 HD1 HIS 45 HD1 HIS 45 -3.511 -2.599 -1.356 355 HD2 HIS 45 HD2 HIS 45 0.465 -1.436 -0.883 356 HE1 HIS 45 HE1 HIS 45 -3.399 -0.151 -1.999 357 HE2 HIS 45 HE2 HIS 45 -0.980 0.572 -1.711 358 H VAL 46 HN VAL 46 -2.464 -3.889 -3.705 359 HA VAL 46 HA VAL 46 0.137 -3.453 -5.067 360 HB VAL 46 HB VAL 46 -2.275 -4.635 -6.474 361 HG11 VAL 46 HG11 VAL 46 -0.481 -5.139 -8.216 362 HG12 VAL 46 HG12 VAL 46 0.597 -4.094 -7.293 363 HG13 VAL 46 HG13 VAL 46 -0.871 -3.434 -8.011 364 HG21 VAL 46 HG21 VAL 46 -1.020 -6.757 -6.503 365 HG22 VAL 46 HG22 VAL 46 -1.342 -6.257 -4.844 366 HG23 VAL 46 HG23 VAL 46 0.261 -6.024 -5.540 367 H CYS 47 HN CYS 47 0.023 -1.926 -6.813 368 HA CYS 47 HA CYS 47 -2.352 -0.274 -7.099 369 HB2 CYS 47 HB2 CYS 47 -0.956 0.468 -4.986 370 HB3 CYS 47 HB1 CYS 47 0.106 1.214 -6.177 371 H ALA 48 HN ALA 48 -0.972 -1.844 -8.946 372 HA ALA 48 HA ALA 48 -0.391 0.134 -10.972 373 HB1 ALA 48 HB1 ALA 48 1.791 0.021 -9.842 374 HB2 ALA 48 HB2 ALA 48 1.880 -0.655 -11.470 375 HB3 ALA 48 HB3 ALA 48 1.821 -1.730 -10.070 376 H ALA 49 HN ALA 49 -1.216 -0.615 -12.792 377 HA ALA 49 HA ALA 49 -2.135 -3.319 -13.046 378 HB1 ALA 49 HB1 ALA 49 -1.986 -1.156 -15.138 379 HB2 ALA 49 HB2 ALA 49 -3.323 -1.380 -14.021 380 HB3 ALA 49 HB3 ALA 49 -2.957 -2.622 -15.217 381 H GLY 50 HN GLY 50 -1.317 -4.991 -14.185 382 HA2 GLY 50 HA3 GLY 50 1.090 -4.581 -15.867 383 HA3 GLY 50 HA2 GLY 50 1.216 -5.662 -14.486 384 H TRP 51 HN TRP 51 1.541 -6.263 -17.300 385 HA TRP 51 HA TRP 51 -0.738 -7.645 -18.326 386 HB2 TRP 51 HB2 TRP 51 2.218 -7.678 -18.927 387 HB3 TRP 51 HB1 TRP 51 1.143 -8.833 -19.711 388 HD1 TRP 51 HD1 TRP 51 2.045 -5.143 -19.648 389 HE1 TRP 51 HE1 TRP 51 0.887 -3.990 -21.648 390 HE3 TRP 51 HE3 TRP 51 -0.986 -8.925 -21.193 391 HZ2 TRP 51 HZ2 TRP 51 -1.068 -4.615 -23.654 392 HZ3 TRP 51 HZ3 TRP 51 -2.479 -8.638 -23.147 393 HH2 TRP 51 HH2 TRP 51 -2.511 -6.497 -24.367 394 H MET 52 HN MET 52 -1.619 -9.140 -16.983 395 HA MET 52 HA MET 52 0.080 -11.113 -15.612 396 HB2 MET 52 HB2 MET 52 -2.945 -10.917 -15.603 397 HB3 MET 52 HB1 MET 52 -1.941 -11.827 -14.507 398 HG2 MET 52 HG2 MET 52 -1.605 -10.016 -13.149 399 HG3 MET 52 HG1 MET 52 -1.160 -8.991 -14.500 400 HE1 MET 52 HE1 MET 52 -5.083 -9.990 -12.620 401 HE2 MET 52 HE2 MET 52 -3.977 -11.123 -13.381 402 HE3 MET 52 HE3 MET 52 -5.285 -10.417 -14.320 403 H ALA 53 HN ALA 53 -0.602 -13.402 -15.734 404 HA ALA 53 HA ALA 53 -0.205 -14.594 -18.134 405 HB1 ALA 53 HB1 ALA 53 -2.173 -15.684 -16.112 406 HB2 ALA 53 HB2 ALA 53 -0.422 -15.760 -15.922 407 HB3 ALA 53 HB3 ALA 53 -1.200 -16.603 -17.261 408 H LYS 54 HN LYS 54 -1.670 -15.839 -19.557 409 HA LYS 54 HA LYS 54 -3.301 -15.909 -21.143 410 HB2 LYS 54 HB2 LYS 54 -4.651 -16.191 -18.926 411 HB3 LYS 54 HB1 LYS 54 -5.140 -14.522 -19.181 412 HG2 LYS 54 HG2 LYS 54 -6.129 -15.092 -21.344 413 HG3 LYS 54 HG1 LYS 54 -5.515 -16.737 -21.227 414 HD2 LYS 54 HD2 LYS 54 -7.852 -16.759 -20.604 415 HD3 LYS 54 HD1 LYS 54 -6.892 -17.055 -19.158 416 HE2 LYS 54 HE2 LYS 54 -7.274 -14.851 -18.325 417 HE3 LYS 54 HE1 LYS 54 -7.831 -14.265 -19.893 418 HZ1 LYS 54 HZ1 LYS 54 -9.763 -15.671 -19.707 419 HZ2 LYS 54 HZ2 LYS 54 -9.653 -14.661 -18.345 420 HZ3 LYS 54 HZ3 LYS 54 -9.209 -16.297 -18.230 421 H GLY 55 HN GLY 55 -1.854 -13.199 -20.218 422 HA2 GLY 55 HA3 GLY 55 -1.498 -11.232 -21.358 423 HA3 GLY 55 HA2 GLY 55 -2.771 -11.674 -22.483 424 H ARG 56 HN ARG 56 -3.836 -11.933 -19.285 425 HA ARG 56 HA ARG 56 -5.629 -9.689 -19.588 426 HB2 ARG 56 HB2 ARG 56 -6.273 -11.835 -18.491 427 HB3 ARG 56 HB1 ARG 56 -5.176 -11.457 -17.183 428 HG2 ARG 56 HG2 ARG 56 -6.423 -9.531 -16.527 429 HG3 ARG 56 HG1 ARG 56 -7.406 -9.594 -17.985 430 HD2 ARG 56 HD2 ARG 56 -8.284 -11.830 -17.233 431 HD3 ARG 56 HD1 ARG 56 -7.384 -11.621 -15.727 432 HE ARG 56 HE ARG 56 -8.843 -9.357 -15.817 433 HH11 ARG 56 HH21 ARG 56 -9.801 -12.644 -16.460 434 HH12 ARG 56 HH22 ARG 56 -11.339 -12.483 -15.689 435 HH21 ARG 56 HH11 ARG 56 -10.822 -9.167 -14.752 436 HH22 ARG 56 HH12 ARG 56 -11.898 -10.524 -14.659 437 H VAL 57 HN VAL 57 -5.422 -7.677 -18.807 438 HA VAL 57 HA VAL 57 -3.065 -7.093 -17.082 439 HB VAL 57 HB VAL 57 -4.498 -4.957 -18.656 440 HG11 VAL 57 HG11 VAL 57 -2.331 -3.894 -18.608 441 HG12 VAL 57 HG12 VAL 57 -1.579 -5.351 -17.966 442 HG13 VAL 57 HG13 VAL 57 -2.710 -4.433 -16.972 443 HG21 VAL 57 HG21 VAL 57 -2.490 -6.948 -19.738 444 HG22 VAL 57 HG22 VAL 57 -2.875 -5.422 -20.527 445 HG23 VAL 57 HG23 VAL 57 -4.120 -6.655 -20.332 446 H GLY 58 HN GLY 58 -3.596 -6.880 -15.037 447 HA2 GLY 58 HA3 GLY 58 -5.579 -4.954 -14.206 448 HA3 GLY 58 HA2 GLY 58 -6.077 -6.619 -13.918 449 H TYR 59 HN TYR 59 -5.964 -5.248 -11.738 450 HA TYR 59 HA TYR 59 -3.895 -6.511 -10.259 451 HB2 TYR 59 HB2 TYR 59 -2.680 -4.585 -9.432 452 HB3 TYR 59 HB1 TYR 59 -2.554 -4.692 -11.178 453 HD1 TYR 59 HD2 TYR 59 -4.467 -3.349 -12.521 454 HD2 TYR 59 HD1 TYR 59 -3.212 -2.468 -8.497 455 HE1 TYR 59 HE2 TYR 59 -5.322 -1.041 -12.752 456 HE2 TYR 59 HE1 TYR 59 -4.064 -0.158 -8.751 457 HH TYR 59 HH TYR 59 -5.376 1.191 -10.026 458 HA PRO 60 HA PRO 60 -7.061 -5.877 -7.207 459 HB2 PRO 60 HB2 PRO 60 -5.738 -6.629 -4.942 460 HB3 PRO 60 HB1 PRO 60 -6.207 -7.801 -6.190 461 HG2 PRO 60 HG2 PRO 60 -3.556 -6.484 -5.730 462 HG3 PRO 60 HG1 PRO 60 -3.912 -8.190 -6.064 463 HD2 PRO 60 HD2 PRO 60 -3.076 -6.487 -8.026 464 HD3 PRO 60 HD1 PRO 60 -4.207 -7.823 -8.352 465 H ILE 61 HN ILE 61 -7.780 -4.354 -5.733 466 HA ILE 61 HA ILE 61 -5.862 -2.367 -4.665 467 HB ILE 61 HB ILE 61 -8.441 -1.529 -6.023 468 HG12 ILE 61 HG12 ILE 61 -5.604 -1.526 -7.120 469 HG13 ILE 61 HG11 ILE 61 -6.942 -2.505 -7.715 470 HG21 ILE 61 HG21 ILE 61 -7.520 0.704 -5.827 471 HG22 ILE 61 HG22 ILE 61 -5.970 0.072 -5.274 472 HG23 ILE 61 HG23 ILE 61 -7.394 -0.053 -4.241 473 HD11 ILE 61 HD11 ILE 61 -8.175 -0.256 -8.090 474 HD12 ILE 61 HD12 ILE 61 -6.882 -0.681 -9.204 475 HD13 ILE 61 HD13 ILE 61 -6.581 0.481 -7.915 476 H VAL 62 HN VAL 62 -6.168 -3.141 -2.600 477 HA VAL 62 HA VAL 62 -8.712 -3.633 -1.425 478 HB VAL 62 HB VAL 62 -6.154 -2.918 0.031 479 HG11 VAL 62 HG11 VAL 62 -8.529 -4.654 0.786 480 HG12 VAL 62 HG12 VAL 62 -8.238 -3.023 1.388 481 HG13 VAL 62 HG13 VAL 62 -7.123 -4.326 1.799 482 HG21 VAL 62 HG21 VAL 62 -7.116 -5.567 -1.060 483 HG22 VAL 62 HG22 VAL 62 -5.749 -5.385 0.029 484 HG23 VAL 62 HG23 VAL 62 -5.687 -4.693 -1.593 485 H LYS 63 HN LYS 63 -6.549 -0.831 -1.438 486 HA LYS 63 HA LYS 63 -8.805 0.859 -0.528 487 HB2 LYS 63 HB2 LYS 63 -6.008 0.899 0.600 488 HB3 LYS 63 HB1 LYS 63 -7.210 2.158 0.877 489 HG2 LYS 63 HG2 LYS 63 -8.766 0.363 1.767 490 HG3 LYS 63 HG1 LYS 63 -7.413 -0.763 1.672 491 HD2 LYS 63 HD2 LYS 63 -6.116 0.613 3.215 492 HD3 LYS 63 HD1 LYS 63 -7.397 1.824 3.249 493 HE2 LYS 63 HE2 LYS 63 -7.663 -1.050 4.183 494 HE3 LYS 63 HE1 LYS 63 -7.519 0.359 5.231 495 HZ1 LYS 63 HZ1 LYS 63 -9.743 0.311 5.158 496 HZ2 LYS 63 HZ2 LYS 63 -9.798 -0.604 3.727 497 HZ3 LYS 63 HZ3 LYS 63 -9.557 1.077 3.657 498 HA PRO 64 HA PRO 64 -7.313 2.679 -4.479 499 HB2 PRO 64 HB2 PRO 64 -9.430 4.637 -3.570 500 HB3 PRO 64 HB1 PRO 64 -9.132 3.989 -5.199 501 HG2 PRO 64 HG2 PRO 64 -11.129 3.046 -3.717 502 HG3 PRO 64 HG1 PRO 64 -10.146 1.950 -4.710 503 HD2 PRO 64 HD2 PRO 64 -10.113 2.333 -1.737 504 HD3 PRO 64 HD1 PRO 64 -9.778 0.865 -2.686 505 H GLY 65 HN GLY 65 -5.611 4.007 -4.658 506 HA2 GLY 65 HA3 GLY 65 -5.013 5.929 -2.476 507 HA3 GLY 65 HA2 GLY 65 -3.847 5.177 -3.557 508 HA PRO 66 HA PRO 66 -5.091 9.450 -5.118 509 HB2 PRO 66 HB2 PRO 66 -2.697 10.734 -4.717 510 HB3 PRO 66 HB1 PRO 66 -3.941 10.617 -3.452 511 HG2 PRO 66 HG2 PRO 66 -1.488 8.927 -3.841 512 HG3 PRO 66 HG1 PRO 66 -2.117 9.660 -2.350 513 HD2 PRO 66 HD2 PRO 66 -2.558 7.041 -2.949 514 HD3 PRO 66 HD1 PRO 66 -3.763 8.010 -2.073 515 H ASN 67 HN ASN 67 -1.841 8.019 -5.442 516 HA ASN 67 HA ASN 67 -1.419 8.904 -8.106 517 HB2 ASN 67 HB2 ASN 67 0.401 8.306 -6.551 518 HB3 ASN 67 HB1 ASN 67 -0.118 6.625 -6.602 519 HD21 ASN 67 HD21 ASN 67 1.443 5.560 -7.837 520 HD22 ASN 67 HD22 ASN 67 1.991 6.086 -9.354 521 H CYS 68 HN CYS 68 -2.713 5.944 -6.694 522 HA CYS 68 HA CYS 68 -3.936 5.233 -9.252 523 HB2 CYS 68 HB2 CYS 68 -2.990 2.797 -8.916 524 HB3 CYS 68 HB1 CYS 68 -1.973 4.008 -9.690 525 H GLY 69 HN GLY 69 -5.946 4.662 -8.830 526 HA2 GLY 69 HA3 GLY 69 -6.752 2.727 -6.955 527 HA3 GLY 69 HA2 GLY 69 -6.986 4.319 -6.242 528 H PHE 70 HN PHE 70 -7.490 5.476 -8.951 529 HA PHE 70 HA PHE 70 -9.345 6.071 -10.187 530 HB2 PHE 70 HB2 PHE 70 -8.839 3.977 -11.304 531 HB3 PHE 70 HB1 PHE 70 -9.691 3.061 -10.066 532 HD1 PHE 70 HD1 PHE 70 -10.142 5.619 -12.748 533 HD2 PHE 70 HD2 PHE 70 -12.068 2.719 -10.226 534 HE1 PHE 70 HE1 PHE 70 -12.237 5.873 -14.048 535 HE2 PHE 70 HE2 PHE 70 -14.161 2.980 -11.526 536 HZ PHE 70 HZ PHE 70 -14.245 4.557 -13.439 537 H GLY 71 HN GLY 71 -10.954 3.318 -8.721 538 HA2 GLY 71 HA3 GLY 71 -12.277 4.741 -6.640 539 HA3 GLY 71 HA2 GLY 71 -13.307 4.648 -8.062 540 H LYS 72 HN LYS 72 -14.568 3.469 -6.290 541 HA LYS 72 HA LYS 72 -15.446 1.515 -5.444 542 HB2 LYS 72 HB2 LYS 72 -14.088 0.410 -7.918 543 HB3 LYS 72 HB1 LYS 72 -15.232 -0.486 -6.925 544 HG2 LYS 72 HG2 LYS 72 -16.972 1.190 -7.386 545 HG3 LYS 72 HG1 LYS 72 -15.830 2.124 -8.354 546 HD2 LYS 72 HD2 LYS 72 -15.560 0.199 -9.890 547 HD3 LYS 72 HD1 LYS 72 -16.718 -0.722 -8.931 548 HE2 LYS 72 HE2 LYS 72 -18.464 0.948 -9.420 549 HE3 LYS 72 HE1 LYS 72 -17.308 1.887 -10.364 550 HZ1 LYS 72 HZ1 LYS 72 -17.270 -0.786 -11.240 551 HZ2 LYS 72 HZ2 LYS 72 -17.703 0.608 -12.108 552 HZ3 LYS 72 HZ3 LYS 72 -18.878 -0.242 -11.224 553 H THR 73 HN THR 73 -14.631 -1.024 -5.204 554 HA THR 73 HA THR 73 -11.845 -1.078 -4.250 555 HB THR 73 HB THR 73 -14.164 -1.836 -2.446 556 HG1 THR 73 HG1 THR 73 -12.512 0.442 -2.604 557 HG21 THR 73 HG21 THR 73 -11.146 -1.934 -2.164 558 HG22 THR 73 HG22 THR 73 -12.335 -3.179 -1.768 559 HG23 THR 73 HG23 THR 73 -12.177 -1.753 -0.747 560 H GLY 74 HN GLY 74 -11.230 -3.289 -3.526 561 HA2 GLY 74 HA3 GLY 74 -11.410 -5.641 -3.644 562 HA3 GLY 74 HA2 GLY 74 -12.814 -5.485 -4.695 563 H ILE 75 HN ILE 75 -11.974 -6.941 -6.193 564 HA ILE 75 HA ILE 75 -9.479 -6.191 -7.607 565 HB ILE 75 HB ILE 75 -11.131 -8.723 -7.838 566 HG12 ILE 75 HG12 ILE 75 -8.535 -8.215 -6.340 567 HG13 ILE 75 HG11 ILE 75 -10.109 -8.360 -5.569 568 HG21 ILE 75 HG21 ILE 75 -9.817 -8.336 -9.836 569 HG22 ILE 75 HG22 ILE 75 -8.969 -9.555 -8.893 570 HG23 ILE 75 HG23 ILE 75 -8.402 -7.886 -8.888 571 HD11 ILE 75 HD11 ILE 75 -10.283 -10.662 -6.709 572 HD12 ILE 75 HD12 ILE 75 -9.133 -10.518 -5.381 573 HD13 ILE 75 HD13 ILE 75 -8.560 -10.492 -7.047 574 H ILE 76 HN ILE 76 -9.551 -5.277 -9.543 575 HA ILE 76 HA ILE 76 -12.017 -5.496 -11.197 576 HB ILE 76 HB ILE 76 -10.389 -2.951 -10.902 577 HG12 ILE 76 HG12 ILE 76 -13.075 -3.627 -9.647 578 HG13 ILE 76 HG11 ILE 76 -11.554 -3.564 -8.762 579 HG21 ILE 76 HG21 ILE 76 -12.354 -1.956 -12.047 580 HG22 ILE 76 HG22 ILE 76 -13.120 -3.541 -12.106 581 HG23 ILE 76 HG23 ILE 76 -11.649 -3.237 -13.026 582 HD11 ILE 76 HD11 ILE 76 -12.985 -1.283 -10.140 583 HD12 ILE 76 HD12 ILE 76 -11.307 -1.163 -9.608 584 HD13 ILE 76 HD13 ILE 76 -12.589 -1.436 -8.429 585 H ASP 77 HN ASP 77 -10.528 -7.223 -12.095 586 HA ASP 77 HA ASP 77 -8.390 -6.178 -13.822 587 HB2 ASP 77 HB2 ASP 77 -9.303 -9.035 -13.411 588 HB3 ASP 77 HB1 ASP 77 -7.842 -8.504 -14.243 589 H TYR 78 HN TYR 78 -8.547 -5.976 -15.957 590 HA TYR 78 HA TYR 78 -11.176 -6.442 -17.226 591 HB2 TYR 78 HB2 TYR 78 -8.734 -4.926 -18.170 592 HB3 TYR 78 HB1 TYR 78 -10.232 -5.079 -19.077 593 HD1 TYR 78 HD2 TYR 78 -12.365 -4.095 -18.162 594 HD2 TYR 78 HD1 TYR 78 -8.540 -3.360 -16.342 595 HE1 TYR 78 HE2 TYR 78 -13.307 -2.135 -16.963 596 HE2 TYR 78 HE1 TYR 78 -9.483 -1.400 -15.153 597 HH TYR 78 HH TYR 78 -11.248 0.029 -15.075 598 H GLY 79 HN GLY 79 -11.402 -8.424 -18.078 599 HA2 GLY 79 HA3 GLY 79 -9.491 -10.296 -18.733 600 HA3 GLY 79 HA2 GLY 79 -11.073 -10.210 -19.484 601 H ILE 80 HN ILE 80 -7.705 -9.511 -19.842 602 HA ILE 80 HA ILE 80 -6.423 -8.760 -21.610 603 HB ILE 80 HB ILE 80 -8.635 -10.069 -23.212 604 HG12 ILE 80 HG12 ILE 80 -6.040 -11.264 -22.167 605 HG13 ILE 80 HG11 ILE 80 -7.605 -11.509 -21.392 606 HG21 ILE 80 HG21 ILE 80 -7.192 -8.764 -24.651 607 HG22 ILE 80 HG22 ILE 80 -6.712 -10.448 -24.831 608 HG23 ILE 80 HG23 ILE 80 -5.748 -9.361 -23.834 609 HD11 ILE 80 HD11 ILE 80 -8.417 -12.393 -23.677 610 HD12 ILE 80 HD12 ILE 80 -7.291 -13.415 -22.787 611 HD13 ILE 80 HD13 ILE 80 -6.713 -12.435 -24.132 612 H ARG 81 HN ARG 81 -6.457 -6.553 -21.621 613 HA ARG 81 HA ARG 81 -8.712 -4.984 -22.396 614 HB2 ARG 81 HB2 ARG 81 -5.778 -4.228 -22.221 615 HB3 ARG 81 HB1 ARG 81 -7.118 -3.092 -22.368 616 HG2 ARG 81 HG2 ARG 81 -8.078 -4.010 -20.259 617 HG3 ARG 81 HG1 ARG 81 -6.663 -5.042 -20.092 618 HD2 ARG 81 HD2 ARG 81 -6.269 -3.108 -18.718 619 HD3 ARG 81 HD1 ARG 81 -5.247 -2.942 -20.145 620 HE ARG 81 HE ARG 81 -7.884 -1.650 -20.227 621 HH11 ARG 81 HH21 ARG 81 -4.409 -1.341 -20.021 622 HH12 ARG 81 HH22 ARG 81 -4.444 0.382 -20.129 623 HH21 ARG 81 HH11 ARG 81 -7.899 0.567 -20.427 624 HH22 ARG 81 HH12 ARG 81 -6.423 1.473 -20.354 625 H LEU 82 HN LEU 82 -9.087 -3.848 -24.311 626 HA LEU 82 HA LEU 82 -8.232 -5.157 -26.733 627 HB2 LEU 82 HB2 LEU 82 -10.045 -2.836 -26.076 628 HB3 LEU 82 HB1 LEU 82 -9.573 -3.122 -27.748 629 HG LEU 82 HG LEU 82 -10.474 -5.418 -27.618 630 HD11 LEU 82 HD11 LEU 82 -11.906 -5.986 -25.607 631 HD12 LEU 82 HD12 LEU 82 -11.203 -4.589 -24.791 632 HD13 LEU 82 HD13 LEU 82 -10.177 -5.939 -25.275 633 HD21 LEU 82 HD21 LEU 82 -11.904 -3.481 -28.302 634 HD22 LEU 82 HD22 LEU 82 -12.455 -3.340 -26.633 635 HD23 LEU 82 HD23 LEU 82 -12.834 -4.787 -27.566 636 H ASN 83 HN ASN 83 -7.305 -2.314 -24.972 637 HA ASN 83 HA ASN 83 -5.845 -1.041 -27.083 638 HB2 ASN 83 HB2 ASN 83 -5.065 0.487 -25.391 639 HB3 ASN 83 HB1 ASN 83 -6.792 0.197 -25.171 640 HD21 ASN 83 HD21 ASN 83 -7.422 -0.385 -23.155 641 HD22 ASN 83 HD22 ASN 83 -6.411 -1.031 -21.968 642 H ARG 84 HN ARG 84 -5.175 -3.806 -26.715 643 HA ARG 84 HA ARG 84 -2.869 -4.368 -25.290 644 HB2 ARG 84 HB2 ARG 84 -3.331 -5.372 -28.116 645 HB3 ARG 84 HB1 ARG 84 -2.412 -6.169 -26.824 646 HG2 ARG 84 HG2 ARG 84 -4.481 -6.473 -25.523 647 HG3 ARG 84 HG1 ARG 84 -5.389 -5.559 -26.704 648 HD2 ARG 84 HD2 ARG 84 -5.791 -7.908 -27.026 649 HD3 ARG 84 HD1 ARG 84 -4.920 -7.262 -28.409 650 HE ARG 84 HE ARG 84 -3.107 -8.382 -26.506 651 HH11 ARG 84 HH21 ARG 84 -5.330 -9.015 -29.076 652 HH12 ARG 84 HH22 ARG 84 -4.885 -10.678 -29.273 653 HH21 ARG 84 HH11 ARG 84 -2.503 -10.620 -26.742 654 HH22 ARG 84 HH12 ARG 84 -3.298 -11.589 -27.941 655 H SER 85 HN SER 85 -3.162 -1.968 -27.589 656 HA SER 85 HA SER 85 -0.413 -2.063 -28.583 657 HB2 SER 85 HB2 SER 85 -2.272 -1.321 -30.037 658 HB3 SER 85 HB1 SER 85 -2.568 0.032 -28.949 659 HG SER 85 HG SER 85 -0.664 -0.297 -30.865 660 H GLU 86 HN GLU 86 -1.959 -0.976 -25.804 661 HA GLU 86 HA GLU 86 -0.220 1.342 -25.331 662 HB2 GLU 86 HB2 GLU 86 -2.623 1.410 -24.670 663 HB3 GLU 86 HB1 GLU 86 -2.320 0.100 -23.530 664 HG2 GLU 86 HG2 GLU 86 -0.691 1.491 -22.324 665 HG3 GLU 86 HG1 GLU 86 -0.913 2.789 -23.495 666 H ARG 87 HN ARG 87 1.297 1.441 -23.686 667 HA ARG 87 HA ARG 87 2.530 -1.099 -22.956 668 HB2 ARG 87 HB2 ARG 87 3.394 1.724 -22.253 669 HB3 ARG 87 HB1 ARG 87 4.341 0.247 -22.081 670 HG2 ARG 87 HG2 ARG 87 4.205 -0.119 -24.531 671 HG3 ARG 87 HG1 ARG 87 3.331 1.400 -24.692 672 HD2 ARG 87 HD2 ARG 87 6.111 1.182 -23.483 673 HD3 ARG 87 HD1 ARG 87 5.803 1.570 -25.176 674 HE ARG 87 HE ARG 87 4.301 3.415 -23.884 675 HH11 ARG 87 HH21 ARG 87 7.628 2.429 -23.550 676 HH12 ARG 87 HH22 ARG 87 8.162 3.975 -22.991 677 HH21 ARG 87 HH11 ARG 87 5.030 5.460 -23.231 678 HH22 ARG 87 HH12 ARG 87 6.705 5.706 -22.852 679 H TRP 88 HN TRP 88 2.978 -1.761 -20.830 680 HA TRP 88 HA TRP 88 1.711 -0.450 -18.551 681 HB2 TRP 88 HB2 TRP 88 0.650 -3.036 -19.716 682 HB3 TRP 88 HB1 TRP 88 0.482 -2.690 -17.998 683 HD1 TRP 88 HD1 TRP 88 -1.208 -2.098 -21.222 684 HE1 TRP 88 HE1 TRP 88 -3.089 -0.353 -20.938 685 HE3 TRP 88 HE3 TRP 88 -0.011 -0.262 -16.620 686 HZ2 TRP 88 HZ2 TRP 88 -3.963 1.585 -18.990 687 HZ3 TRP 88 HZ3 TRP 88 -1.372 1.526 -15.574 688 HH2 TRP 88 HH2 TRP 88 -3.348 2.444 -16.754 689 H ASP 89 HN ASP 89 1.898 -2.093 -16.597 690 HA ASP 89 HA ASP 89 4.713 -2.641 -16.325 691 HB2 ASP 89 HB2 ASP 89 2.976 -1.826 -14.526 692 HB3 ASP 89 HB1 ASP 89 2.616 -3.536 -14.336 693 H ALA 90 HN ALA 90 4.644 -4.902 -14.688 694 HA ALA 90 HA ALA 90 3.387 -7.130 -15.981 695 HB1 ALA 90 HB1 ALA 90 5.072 -6.659 -17.697 696 HB2 ALA 90 HB2 ALA 90 5.425 -8.182 -16.882 697 HB3 ALA 90 HB3 ALA 90 6.348 -6.733 -16.481 698 H TYR 91 HN TYR 91 3.777 -9.099 -14.922 699 HA TYR 91 HA TYR 91 5.365 -8.962 -12.407 700 HB2 TYR 91 HB2 TYR 91 2.570 -10.079 -12.753 701 HB3 TYR 91 HB1 TYR 91 3.571 -10.319 -11.326 702 HD1 TYR 91 HD2 TYR 91 4.274 -8.349 -9.930 703 HD2 TYR 91 HD1 TYR 91 1.407 -7.981 -13.114 704 HE1 TYR 91 HE2 TYR 91 3.496 -6.191 -8.983 705 HE2 TYR 91 HE1 TYR 91 0.631 -5.827 -12.161 706 HH TYR 91 HH TYR 91 0.613 -4.679 -9.989 707 H CYS 92 HN CYS 92 6.001 -11.019 -11.583 708 HA CYS 92 HA CYS 92 6.018 -13.254 -13.547 709 HB2 CYS 92 HB2 CYS 92 8.231 -11.637 -13.122 710 HB3 CYS 92 HB1 CYS 92 8.529 -12.937 -11.978 711 H TYR 93 HN TYR 93 7.333 -15.125 -12.248 712 HA TYR 93 HA TYR 93 6.482 -15.342 -9.463 713 HB2 TYR 93 HB2 TYR 93 4.468 -15.940 -10.841 714 HB3 TYR 93 HB1 TYR 93 5.392 -17.269 -11.531 715 HD1 TYR 93 HD1 TYR 93 4.412 -15.814 -8.212 716 HD2 TYR 93 HD2 TYR 93 5.315 -19.387 -10.426 717 HE1 TYR 93 HE1 TYR 93 3.756 -17.195 -6.258 718 HE2 TYR 93 HE2 TYR 93 4.655 -20.760 -8.473 719 HH TYR 93 HH TYR 93 4.278 -19.519 -5.386 720 H ASN 94 HN ASN 94 8.264 -16.055 -8.564 721 HA ASN 94 HA ASN 94 9.874 -18.166 -9.920 722 HB2 ASN 94 HB2 ASN 94 10.845 -16.103 -7.953 723 HB3 ASN 94 HB1 ASN 94 11.817 -17.272 -8.841 724 HD21 ASN 94 HD21 ASN 94 10.396 -17.008 -11.387 725 HD22 ASN 94 HD22 ASN 94 10.772 -15.473 -12.005 726 HA PRO 95 HA PRO 95 8.407 -20.018 -5.948 727 HB2 PRO 95 HB2 PRO 95 7.554 -22.412 -6.891 728 HB3 PRO 95 HB1 PRO 95 6.578 -20.940 -7.079 729 HG2 PRO 95 HG2 PRO 95 8.330 -22.315 -9.085 730 HG3 PRO 95 HG1 PRO 95 6.734 -21.578 -9.312 731 HD2 PRO 95 HD2 PRO 95 9.137 -20.327 -9.957 732 HD3 PRO 95 HD1 PRO 95 7.625 -19.452 -9.633 733 H HIS 96 HN HIS 96 11.032 -20.290 -7.774 734 HA HIS 96 HA HIS 96 12.280 -22.304 -6.009 735 HB2 HIS 96 HB2 HIS 96 13.418 -23.328 -7.975 736 HB3 HIS 96 HB1 HIS 96 11.677 -23.596 -7.964 737 HD1 HIS 96 HD1 HIS 96 10.787 -20.801 -9.054 738 HD2 HIS 96 HD2 HIS 96 13.829 -23.111 -10.725 739 HE1 HIS 96 HE1 HIS 96 10.988 -20.080 -11.475 740 HE2 HIS 96 HE2 HIS 96 12.837 -21.480 -12.506 741 H ALA 97 HN ALA 97 13.093 -20.356 -8.890 742 HA ALA 97 HA ALA 97 15.705 -19.773 -8.020 743 HB1 ALA 97 HB1 ALA 97 13.914 -18.162 -9.861 744 HB2 ALA 97 HB2 ALA 97 14.978 -19.475 -10.366 745 HB3 ALA 97 HB3 ALA 97 15.662 -17.985 -9.710 746 H LYS 98 HN LYS 98 12.586 -18.348 -7.434 747 HA LYS 98 HA LYS 98 11.917 -16.759 -5.945 748 HB2 LYS 98 HB2 LYS 98 13.363 -18.335 -4.502 749 HB3 LYS 98 HB1 LYS 98 14.609 -17.106 -4.586 750 HG2 LYS 98 HG2 LYS 98 13.160 -15.484 -3.499 751 HG3 LYS 98 HG1 LYS 98 11.813 -16.627 -3.518 752 HD2 LYS 98 HD2 LYS 98 13.081 -18.179 -2.084 753 HD3 LYS 98 HD1 LYS 98 14.469 -17.094 -2.111 754 HE2 LYS 98 HE2 LYS 98 13.259 -16.772 -0.031 755 HE3 LYS 98 HE1 LYS 98 13.056 -15.339 -1.037 756 HZ1 LYS 98 HZ1 LYS 98 11.078 -17.430 -1.396 757 HZ2 LYS 98 HZ2 LYS 98 10.880 -15.744 -1.334 758 HZ3 LYS 98 HZ3 LYS 98 11.037 -16.637 0.103 Start of MODEL 15 1 H1 GLY 1 H1 GLY 1 7.582 -15.909 -4.496 2 H2 GLY 1 H2 GLY 1 6.601 -17.091 -5.223 3 H3 GLY 1 H3 GLY 1 6.940 -17.170 -3.562 4 HA2 GLY 1 HA3 GLY 1 4.668 -16.323 -4.152 5 HA3 GLY 1 HA2 GLY 1 5.623 -15.296 -3.081 6 H VAL 2 HN VAL 2 3.713 -13.987 -4.308 7 HA VAL 2 HA VAL 2 4.555 -12.909 -6.881 8 HB VAL 2 HB VAL 2 2.287 -11.979 -5.095 9 HG11 VAL 2 HG11 VAL 2 2.829 -11.755 -8.076 10 HG12 VAL 2 HG12 VAL 2 2.879 -10.434 -6.907 11 HG13 VAL 2 HG13 VAL 2 1.349 -11.228 -7.276 12 HG21 VAL 2 HG21 VAL 2 2.335 -14.116 -7.252 13 HG22 VAL 2 HG22 VAL 2 0.877 -13.484 -6.490 14 HG23 VAL 2 HG23 VAL 2 2.050 -14.381 -5.531 15 H TYR 3 HN TYR 3 5.240 -10.832 -7.274 16 HA TYR 3 HA TYR 3 5.504 -8.872 -5.176 17 HB2 TYR 3 HB2 TYR 3 7.946 -8.734 -5.184 18 HB3 TYR 3 HB1 TYR 3 7.407 -10.310 -4.614 19 HD1 TYR 3 HD2 TYR 3 7.559 -12.309 -6.088 20 HD2 TYR 3 HD1 TYR 3 9.176 -8.507 -7.265 21 HE1 TYR 3 HE2 TYR 3 8.906 -13.423 -7.842 22 HE2 TYR 3 HE1 TYR 3 10.525 -9.624 -9.017 23 HH TYR 3 HH TYR 3 11.246 -12.719 -9.079 24 H HIS 4 HN HIS 4 6.319 -6.848 -5.924 25 HA HIS 4 HA HIS 4 5.671 -6.406 -8.746 26 HB2 HIS 4 HB2 HIS 4 5.764 -4.023 -8.179 27 HB3 HIS 4 HB1 HIS 4 4.705 -4.903 -7.081 28 HD1 HIS 4 HD1 HIS 4 5.709 -5.454 -4.670 29 HD2 HIS 4 HD2 HIS 4 7.912 -2.742 -6.942 30 HE1 HIS 4 HE1 HIS 4 7.261 -4.267 -3.058 31 HE2 HIS 4 HE2 HIS 4 8.611 -2.609 -4.428 32 H ARG 5 HN ARG 5 7.172 -6.533 -10.236 33 HA ARG 5 HA ARG 5 10.019 -5.978 -9.542 34 HB2 ARG 5 HB2 ARG 5 9.379 -8.210 -10.588 35 HB3 ARG 5 HB1 ARG 5 8.964 -7.323 -12.054 36 HG2 ARG 5 HG2 ARG 5 11.300 -6.346 -12.026 37 HG3 ARG 5 HG1 ARG 5 11.676 -7.433 -10.694 38 HD2 ARG 5 HD2 ARG 5 10.676 -8.345 -13.401 39 HD3 ARG 5 HD1 ARG 5 12.375 -8.303 -12.936 40 HE ARG 5 HE ARG 5 10.837 -9.794 -11.048 41 HH11 ARG 5 HH21 ARG 5 12.266 -9.858 -14.195 42 HH12 ARG 5 HH22 ARG 5 12.392 -11.583 -14.260 43 HH21 ARG 5 HH11 ARG 5 10.998 -12.068 -11.131 44 HH22 ARG 5 HH12 ARG 5 11.675 -12.832 -12.526 45 H GLU 6 HN GLU 6 10.811 -4.083 -10.139 46 HA GLU 6 HA GLU 6 9.492 -2.515 -12.277 47 HB2 GLU 6 HB2 GLU 6 9.771 -1.538 -9.952 48 HB3 GLU 6 HB1 GLU 6 11.510 -1.551 -10.231 49 HG2 GLU 6 HG2 GLU 6 10.739 0.647 -10.826 50 HG3 GLU 6 HG1 GLU 6 11.074 -0.187 -12.341 51 H ALA 7 HN ALA 7 10.492 -2.139 -14.132 52 HA ALA 7 HA ALA 7 13.054 -3.355 -14.709 53 HB1 ALA 7 HB1 ALA 7 11.328 -3.453 -16.388 54 HB2 ALA 7 HB2 ALA 7 12.625 -2.427 -17.001 55 HB3 ALA 7 HB3 ALA 7 11.144 -1.700 -16.370 56 H ARG 8 HN ARG 8 14.628 -2.008 -16.075 57 HA ARG 8 HA ARG 8 15.781 -0.009 -14.466 58 HB2 ARG 8 HB2 ARG 8 17.263 0.415 -16.408 59 HB3 ARG 8 HB1 ARG 8 17.113 -1.304 -16.050 60 HG2 ARG 8 HG2 ARG 8 15.363 -1.491 -17.814 61 HG3 ARG 8 HG1 ARG 8 15.611 0.208 -18.211 62 HD2 ARG 8 HD2 ARG 8 17.815 -1.862 -18.295 63 HD3 ARG 8 HD1 ARG 8 16.860 -1.393 -19.700 64 HE ARG 8 HE ARG 8 18.989 0.126 -18.483 65 HH11 ARG 8 HH21 ARG 8 15.991 0.325 -20.191 66 HH12 ARG 8 HH22 ARG 8 16.390 1.798 -21.009 67 HH21 ARG 8 HH11 ARG 8 19.532 2.059 -19.569 68 HH22 ARG 8 HH12 ARG 8 18.394 2.777 -20.659 69 H SER 9 HN SER 9 13.577 0.177 -17.195 70 HA SER 9 HA SER 9 13.758 3.069 -17.428 71 HB2 SER 9 HB2 SER 9 11.892 1.040 -18.679 72 HB3 SER 9 HB1 SER 9 11.895 2.761 -19.062 73 HG SER 9 HG SER 9 13.596 0.770 -19.847 74 H GLY 10 HN GLY 10 11.941 0.783 -15.596 75 HA2 GLY 10 HA3 GLY 10 9.755 1.039 -14.607 76 HA3 GLY 10 HA2 GLY 10 10.830 2.016 -13.614 77 H LYS 11 HN LYS 11 8.505 2.125 -16.265 78 HA LYS 11 HA LYS 11 7.380 4.589 -15.428 79 HB2 LYS 11 HB2 LYS 11 9.647 5.292 -16.498 80 HB3 LYS 11 HB1 LYS 11 8.908 4.878 -18.036 81 HG2 LYS 11 HG2 LYS 11 7.142 6.526 -17.676 82 HG3 LYS 11 HG1 LYS 11 7.734 6.856 -16.050 83 HD2 LYS 11 HD2 LYS 11 9.895 7.622 -17.020 84 HD3 LYS 11 HD1 LYS 11 9.237 7.365 -18.634 85 HE2 LYS 11 HE2 LYS 11 8.067 9.236 -16.557 86 HE3 LYS 11 HE1 LYS 11 9.045 9.734 -17.937 87 HZ1 LYS 11 HZ1 LYS 11 7.283 9.632 -19.249 88 HZ2 LYS 11 HZ2 LYS 11 6.316 9.344 -17.883 89 HZ3 LYS 11 HZ3 LYS 11 6.939 8.041 -18.774 90 H TYR 12 HN TYR 12 6.474 2.007 -16.176 91 HA TYR 12 HA TYR 12 4.860 0.949 -17.442 92 HB2 TYR 12 HB2 TYR 12 4.018 3.812 -17.968 93 HB3 TYR 12 HB1 TYR 12 3.021 2.381 -18.216 94 HD1 TYR 12 HD2 TYR 12 2.170 1.076 -16.302 95 HD2 TYR 12 HD1 TYR 12 4.502 4.639 -15.716 96 HE1 TYR 12 HE2 TYR 12 1.456 1.157 -13.930 97 HE2 TYR 12 HE1 TYR 12 3.784 4.718 -13.346 98 HH TYR 12 HH TYR 12 1.215 2.982 -12.145 99 H LYS 13 HN LYS 13 6.990 0.679 -18.863 100 HA LYS 13 HA LYS 13 6.300 1.465 -21.639 101 HB2 LYS 13 HB2 LYS 13 8.998 1.603 -20.287 102 HB3 LYS 13 HB1 LYS 13 8.811 1.596 -22.041 103 HG2 LYS 13 HG2 LYS 13 7.344 3.598 -21.873 104 HG3 LYS 13 HG1 LYS 13 7.607 3.620 -20.128 105 HD2 LYS 13 HD2 LYS 13 10.003 3.943 -20.461 106 HD3 LYS 13 HD1 LYS 13 9.797 3.818 -22.208 107 HE2 LYS 13 HE2 LYS 13 8.346 5.812 -22.187 108 HE3 LYS 13 HE1 LYS 13 8.555 5.945 -20.441 109 HZ1 LYS 13 HZ1 LYS 13 10.574 6.835 -20.678 110 HZ2 LYS 13 HZ2 LYS 13 10.122 7.133 -22.289 111 HZ3 LYS 13 HZ3 LYS 13 11.028 5.750 -21.900 112 H LEU 14 HN LEU 14 5.747 -0.976 -20.134 113 HA LEU 14 HA LEU 14 7.328 -2.923 -21.763 114 HB2 LEU 14 HB2 LEU 14 6.069 -3.524 -19.072 115 HB3 LEU 14 HB1 LEU 14 7.178 -4.524 -19.993 116 HG LEU 14 HG LEU 14 7.881 -1.800 -18.852 117 HD11 LEU 14 HD11 LEU 14 8.710 -4.540 -17.856 118 HD12 LEU 14 HD12 LEU 14 7.433 -3.571 -17.117 119 HD13 LEU 14 HD13 LEU 14 9.094 -2.985 -17.123 120 HD21 LEU 14 HD21 LEU 14 10.253 -2.712 -19.293 121 HD22 LEU 14 HD22 LEU 14 9.328 -2.257 -20.711 122 HD23 LEU 14 HD23 LEU 14 9.483 -3.955 -20.276 123 H THR 15 HN THR 15 6.200 -4.108 -23.132 124 HA THR 15 HA THR 15 3.245 -4.055 -23.017 125 HB THR 15 HB THR 15 3.278 -4.605 -25.324 126 HG1 THR 15 HG1 THR 15 6.046 -5.019 -25.322 127 HG21 THR 15 HG21 THR 15 4.693 -2.902 -26.305 128 HG22 THR 15 HG22 THR 15 5.743 -2.900 -24.888 129 HG23 THR 15 HG23 THR 15 4.089 -2.301 -24.762 130 H TYR 16 HN TYR 16 2.194 -6.118 -23.807 131 HA TYR 16 HA TYR 16 2.548 -8.168 -21.980 132 HB2 TYR 16 HB2 TYR 16 1.223 -9.580 -23.568 133 HB3 TYR 16 HB1 TYR 16 0.506 -8.003 -23.247 134 HD1 TYR 16 HD2 TYR 16 0.730 -6.148 -24.917 135 HD2 TYR 16 HD1 TYR 16 1.988 -10.165 -25.798 136 HE1 TYR 16 HE2 TYR 16 0.759 -5.612 -27.336 137 HE2 TYR 16 HE1 TYR 16 2.013 -9.623 -28.218 138 HH TYR 16 HH TYR 16 1.588 -8.091 -29.762 139 H ALA 17 HN ALA 17 3.534 -8.318 -25.414 140 HA ALA 17 HA ALA 17 4.941 -10.708 -25.315 141 HB1 ALA 17 HB1 ALA 17 6.237 -9.796 -27.263 142 HB2 ALA 17 HB2 ALA 17 5.464 -8.236 -26.979 143 HB3 ALA 17 HB3 ALA 17 4.488 -9.634 -27.428 144 H GLU 18 HN GLU 18 6.017 -7.456 -24.425 145 HA GLU 18 HA GLU 18 8.760 -8.127 -24.062 146 HB2 GLU 18 HB2 GLU 18 7.860 -5.807 -24.353 147 HB3 GLU 18 HB1 GLU 18 7.170 -5.915 -22.738 148 HG2 GLU 18 HG2 GLU 18 9.267 -4.775 -22.534 149 HG3 GLU 18 HG1 GLU 18 9.495 -6.384 -21.867 150 H ALA 19 HN ALA 19 6.051 -7.779 -21.755 151 HA ALA 19 HA ALA 19 7.405 -8.366 -19.402 152 HB1 ALA 19 HB1 ALA 19 5.268 -8.931 -18.457 153 HB2 ALA 19 HB2 ALA 19 4.595 -9.283 -20.048 154 HB3 ALA 19 HB3 ALA 19 5.009 -7.627 -19.612 155 H LYS 20 HN LYS 20 6.206 -10.561 -21.879 156 HA LYS 20 HA LYS 20 6.498 -12.981 -20.463 157 HB2 LYS 20 HB2 LYS 20 6.741 -12.424 -23.425 158 HB3 LYS 20 HB1 LYS 20 6.626 -14.036 -22.725 159 HG2 LYS 20 HG2 LYS 20 4.502 -11.937 -22.195 160 HG3 LYS 20 HG1 LYS 20 4.440 -12.956 -23.626 161 HD2 LYS 20 HD2 LYS 20 4.464 -14.974 -22.174 162 HD3 LYS 20 HD1 LYS 20 4.449 -13.939 -20.752 163 HE2 LYS 20 HE2 LYS 20 2.320 -12.944 -21.477 164 HE3 LYS 20 HE1 LYS 20 2.323 -13.981 -22.902 165 HZ1 LYS 20 HZ1 LYS 20 0.989 -15.048 -21.303 166 HZ2 LYS 20 HZ2 LYS 20 2.122 -14.796 -20.062 167 HZ3 LYS 20 HZ3 LYS 20 2.457 -15.897 -21.311 168 H ALA 21 HN ALA 21 8.762 -11.141 -22.450 169 HA ALA 21 HA ALA 21 10.848 -13.040 -22.428 170 HB1 ALA 21 HB1 ALA 21 12.339 -11.128 -22.950 171 HB2 ALA 21 HB2 ALA 21 11.023 -10.017 -22.571 172 HB3 ALA 21 HB3 ALA 21 10.878 -11.120 -23.940 173 H VAL 22 HN VAL 22 10.300 -10.260 -20.230 174 HA VAL 22 HA VAL 22 12.552 -10.628 -18.600 175 HB VAL 22 HB VAL 22 9.809 -9.560 -17.875 176 HG11 VAL 22 HG11 VAL 22 12.484 -9.404 -16.449 177 HG12 VAL 22 HG12 VAL 22 10.965 -10.044 -15.822 178 HG13 VAL 22 HG13 VAL 22 11.140 -8.315 -16.096 179 HG21 VAL 22 HG21 VAL 22 12.358 -8.153 -18.735 180 HG22 VAL 22 HG22 VAL 22 10.829 -7.372 -18.323 181 HG23 VAL 22 HG23 VAL 22 10.936 -8.396 -19.753 182 H CYS 23 HN CYS 23 9.360 -12.138 -18.486 183 HA CYS 23 HA CYS 23 10.199 -13.800 -16.171 184 HB2 CYS 23 HB2 CYS 23 7.432 -13.860 -17.378 185 HB3 CYS 23 HB1 CYS 23 7.929 -14.220 -15.729 186 H GLU 24 HN GLU 24 9.031 -16.074 -16.411 187 HA GLU 24 HA GLU 24 8.944 -18.133 -17.446 188 HB2 GLU 24 HB2 GLU 24 9.210 -16.569 -20.039 189 HB3 GLU 24 HB1 GLU 24 8.879 -18.272 -19.918 190 HG2 GLU 24 HG2 GLU 24 6.799 -17.830 -18.714 191 HG3 GLU 24 HG1 GLU 24 7.140 -16.103 -18.730 192 H PHE 25 HN PHE 25 11.530 -15.931 -17.899 193 HA PHE 25 HA PHE 25 13.431 -17.516 -19.232 194 HB2 PHE 25 HB2 PHE 25 13.687 -15.101 -18.811 195 HB3 PHE 25 HB1 PHE 25 13.856 -15.418 -17.088 196 HD1 PHE 25 HD1 PHE 25 15.413 -15.927 -20.421 197 HD2 PHE 25 HD2 PHE 25 15.937 -16.248 -16.167 198 HE1 PHE 25 HE1 PHE 25 17.841 -16.312 -20.747 199 HE2 PHE 25 HE2 PHE 25 18.364 -16.634 -16.497 200 HZ PHE 25 HZ PHE 25 19.316 -16.663 -18.786 201 H GLU 26 HN GLU 26 12.727 -17.155 -15.770 202 HA GLU 26 HA GLU 26 14.658 -19.239 -15.062 203 HB2 GLU 26 HB2 GLU 26 13.630 -18.748 -12.692 204 HB3 GLU 26 HB1 GLU 26 14.674 -17.545 -13.440 205 HG2 GLU 26 HG2 GLU 26 12.620 -16.542 -12.480 206 HG3 GLU 26 HG1 GLU 26 12.735 -16.278 -14.215 207 H GLY 27 HN GLY 27 11.980 -19.613 -16.604 208 HA2 GLY 27 HA3 GLY 27 10.691 -21.521 -16.890 209 HA3 GLY 27 HA2 GLY 27 11.362 -22.183 -15.404 210 H GLY 28 HN GLY 28 10.266 -19.056 -14.890 211 HA2 GLY 28 HA3 GLY 28 7.973 -20.002 -13.351 212 HA3 GLY 28 HA2 GLY 28 8.634 -18.371 -13.368 213 H HIS 29 HN HIS 29 6.425 -17.663 -13.511 214 HA HIS 29 HA HIS 29 5.598 -17.177 -16.241 215 HB2 HIS 29 HB2 HIS 29 4.654 -19.426 -15.841 216 HB3 HIS 29 HB1 HIS 29 3.810 -18.815 -14.422 217 HD1 HIS 29 HD1 HIS 29 4.107 -17.668 -18.064 218 HD2 HIS 29 HD2 HIS 29 1.221 -18.212 -15.107 219 HE1 HIS 29 HE1 HIS 29 1.886 -17.030 -19.104 220 HE2 HIS 29 HE2 HIS 29 0.117 -17.358 -17.313 221 H LEU 30 HN LEU 30 3.889 -15.616 -16.372 222 HA LEU 30 HA LEU 30 4.018 -13.628 -14.328 223 HB2 LEU 30 HB2 LEU 30 2.221 -13.907 -16.756 224 HB3 LEU 30 HB1 LEU 30 2.198 -12.508 -15.688 225 HG LEU 30 HG LEU 30 4.761 -12.346 -16.159 226 HD11 LEU 30 HD11 LEU 30 3.879 -14.153 -18.430 227 HD12 LEU 30 HD12 LEU 30 5.135 -14.483 -17.242 228 HD13 LEU 30 HD13 LEU 30 5.369 -13.219 -18.430 229 HD21 LEU 30 HD21 LEU 30 3.198 -10.698 -17.012 230 HD22 LEU 30 HD22 LEU 30 2.687 -11.788 -18.301 231 HD23 LEU 30 HD23 LEU 30 4.319 -11.120 -18.308 232 H ALA 31 HN ALA 31 2.652 -13.178 -12.686 233 HA ALA 31 HA ALA 31 0.904 -15.169 -11.727 234 HB1 ALA 31 HB1 ALA 31 1.116 -12.245 -10.976 235 HB2 ALA 31 HB2 ALA 31 1.985 -13.583 -10.225 236 HB3 ALA 31 HB3 ALA 31 0.234 -13.465 -10.055 237 H THR 32 HN THR 32 -1.103 -15.643 -12.345 238 HA THR 32 HA THR 32 -2.675 -13.664 -13.908 239 HB THR 32 HB THR 32 -2.221 -15.839 -14.990 240 HG1 THR 32 HG1 THR 32 -4.092 -14.907 -15.609 241 HG21 THR 32 HG21 THR 32 -2.185 -17.150 -12.824 242 HG22 THR 32 HG22 THR 32 -3.130 -17.888 -14.116 243 HG23 THR 32 HG23 THR 32 -3.945 -17.037 -12.806 244 H TYR 33 HN TYR 33 -5.146 -14.179 -13.637 245 HA TYR 33 HA TYR 33 -6.018 -13.189 -11.206 246 HB2 TYR 33 HB2 TYR 33 -7.412 -13.155 -13.175 247 HB3 TYR 33 HB1 TYR 33 -7.452 -14.914 -13.233 248 HD1 TYR 33 HD1 TYR 33 -8.570 -11.925 -11.327 249 HD2 TYR 33 HD2 TYR 33 -8.952 -16.179 -11.814 250 HE1 TYR 33 HE1 TYR 33 -10.567 -11.922 -9.853 251 HE2 TYR 33 HE2 TYR 33 -10.945 -16.169 -10.341 252 HH TYR 33 HH TYR 33 -11.766 -14.501 -8.373 253 H LYS 34 HN LYS 34 -6.109 -16.593 -12.283 254 HA LYS 34 HA LYS 34 -7.113 -17.710 -9.916 255 HB2 LYS 34 HB2 LYS 34 -5.237 -18.884 -11.985 256 HB3 LYS 34 HB1 LYS 34 -6.025 -19.823 -10.720 257 HG2 LYS 34 HG2 LYS 34 -8.229 -19.157 -11.568 258 HG3 LYS 34 HG1 LYS 34 -7.466 -18.169 -12.814 259 HD2 LYS 34 HD2 LYS 34 -6.423 -20.150 -13.794 260 HD3 LYS 34 HD1 LYS 34 -7.093 -21.164 -12.514 261 HE2 LYS 34 HE2 LYS 34 -8.486 -21.337 -14.521 262 HE3 LYS 34 HE1 LYS 34 -9.383 -20.524 -13.239 263 HZ1 LYS 34 HZ1 LYS 34 -9.144 -19.560 -15.706 264 HZ2 LYS 34 HZ2 LYS 34 -7.815 -18.803 -14.969 265 HZ3 LYS 34 HZ3 LYS 34 -9.378 -18.582 -14.340 266 H GLN 35 HN GLN 35 -3.744 -17.157 -10.919 267 HA GLN 35 HA GLN 35 -2.581 -18.249 -8.555 268 HB2 GLN 35 HB2 GLN 35 -1.361 -18.066 -10.699 269 HB3 GLN 35 HB1 GLN 35 -1.419 -16.312 -10.581 270 HG2 GLN 35 HG2 GLN 35 0.758 -17.133 -9.823 271 HG3 GLN 35 HG1 GLN 35 -0.108 -16.429 -8.465 272 HE21 GLN 35 HE21 GLN 35 0.660 -17.712 -6.741 273 HE22 GLN 35 HE22 GLN 35 0.515 -19.400 -6.690 274 H LEU 36 HN LEU 36 -3.539 -15.012 -9.570 275 HA LEU 36 HA LEU 36 -2.354 -13.573 -7.443 276 HB2 LEU 36 HB2 LEU 36 -4.596 -13.054 -9.372 277 HB3 LEU 36 HB1 LEU 36 -4.260 -11.880 -8.127 278 HG LEU 36 HG LEU 36 -2.113 -12.873 -10.027 279 HD11 LEU 36 HD11 LEU 36 -2.514 -10.813 -11.342 280 HD12 LEU 36 HD12 LEU 36 -3.895 -10.431 -10.314 281 HD13 LEU 36 HD13 LEU 36 -3.934 -11.860 -11.348 282 HD21 LEU 36 HD21 LEU 36 -1.144 -10.563 -9.416 283 HD22 LEU 36 HD22 LEU 36 -1.124 -11.761 -8.135 284 HD23 LEU 36 HD23 LEU 36 -2.355 -10.503 -8.141 285 H GLU 37 HN GLU 37 -5.574 -15.001 -7.867 286 HA GLU 37 HA GLU 37 -6.804 -14.017 -5.565 287 HB2 GLU 37 HB2 GLU 37 -7.970 -15.246 -7.363 288 HB3 GLU 37 HB1 GLU 37 -7.179 -16.735 -6.846 289 HG2 GLU 37 HG2 GLU 37 -8.270 -16.595 -4.659 290 HG3 GLU 37 HG1 GLU 37 -8.989 -15.046 -5.093 291 H ALA 38 HN ALA 38 -4.900 -17.001 -5.979 292 HA ALA 38 HA ALA 38 -5.134 -17.939 -3.336 293 HB1 ALA 38 HB1 ALA 38 -3.110 -19.265 -3.841 294 HB2 ALA 38 HB2 ALA 38 -2.867 -18.315 -5.306 295 HB3 ALA 38 HB3 ALA 38 -4.288 -19.347 -5.150 296 H ALA 39 HN ALA 39 -3.015 -15.553 -4.784 297 HA ALA 39 HA ALA 39 -1.317 -15.325 -2.420 298 HB1 ALA 39 HB1 ALA 39 -1.438 -13.626 -4.922 299 HB2 ALA 39 HB2 ALA 39 -0.385 -15.020 -4.689 300 HB3 ALA 39 HB3 ALA 39 -0.177 -13.582 -3.690 301 H ARG 40 HN ARG 40 -4.093 -13.746 -3.829 302 HA ARG 40 HA ARG 40 -3.950 -11.276 -2.487 303 HB2 ARG 40 HB2 ARG 40 -5.532 -12.139 -4.418 304 HB3 ARG 40 HB1 ARG 40 -6.601 -12.582 -3.094 305 HG2 ARG 40 HG2 ARG 40 -5.489 -9.804 -3.634 306 HG3 ARG 40 HG1 ARG 40 -7.134 -10.331 -3.958 307 HD2 ARG 40 HD2 ARG 40 -7.051 -10.965 -1.340 308 HD3 ARG 40 HD1 ARG 40 -5.837 -9.681 -1.334 309 HE ARG 40 HE ARG 40 -8.327 -9.021 -2.688 310 HH11 ARG 40 HH21 ARG 40 -6.479 -8.977 0.241 311 HH12 ARG 40 HH22 ARG 40 -7.551 -7.889 1.061 312 HH21 ARG 40 HH11 ARG 40 -9.756 -7.635 -1.608 313 HH22 ARG 40 HH12 ARG 40 -9.422 -7.153 0.022 314 H LYS 41 HN LYS 41 -5.343 -14.391 -1.550 315 HA LYS 41 HA LYS 41 -6.672 -13.537 0.782 316 HB2 LYS 41 HB2 LYS 41 -5.422 -16.213 0.111 317 HB3 LYS 41 HB1 LYS 41 -6.473 -15.929 1.499 318 HG2 LYS 41 HG2 LYS 41 -8.279 -15.195 -0.014 319 HG3 LYS 41 HG1 LYS 41 -7.231 -15.487 -1.404 320 HD2 LYS 41 HD2 LYS 41 -7.038 -17.875 -0.722 321 HD3 LYS 41 HD1 LYS 41 -8.172 -17.564 0.595 322 HE2 LYS 41 HE2 LYS 41 -8.798 -17.072 -2.331 323 HE3 LYS 41 HE1 LYS 41 -9.263 -18.527 -1.450 324 HZ1 LYS 41 HZ1 LYS 41 -10.113 -16.558 0.180 325 HZ2 LYS 41 HZ2 LYS 41 -11.089 -17.375 -0.947 326 HZ3 LYS 41 HZ3 LYS 41 -10.392 -15.880 -1.350 327 H ILE 42 HN ILE 42 -3.430 -13.352 0.110 328 HA ILE 42 HA ILE 42 -2.530 -13.821 2.883 329 HB ILE 42 HB ILE 42 -0.816 -13.137 0.478 330 HG12 ILE 42 HG12 ILE 42 -2.095 -15.104 -0.145 331 HG13 ILE 42 HG11 ILE 42 -0.462 -15.614 0.267 332 HG21 ILE 42 HG21 ILE 42 0.485 -12.942 2.466 333 HG22 ILE 42 HG22 ILE 42 0.854 -14.547 1.860 334 HG23 ILE 42 HG23 ILE 42 -0.271 -14.354 3.202 335 HD11 ILE 42 HD11 ILE 42 -2.989 -15.943 1.891 336 HD12 ILE 42 HD12 ILE 42 -1.398 -16.077 2.641 337 HD13 ILE 42 HD13 ILE 42 -1.863 -17.186 1.354 338 H GLY 43 HN GLY 43 -4.169 -11.462 1.865 339 HA2 GLY 43 HA3 GLY 43 -4.324 -9.239 2.444 340 HA3 GLY 43 HA2 GLY 43 -2.870 -9.445 3.405 341 H PHE 44 HN PHE 44 -2.942 -10.197 -0.009 342 HA PHE 44 HA PHE 44 -0.730 -8.477 -0.549 343 HB2 PHE 44 HB2 PHE 44 -1.695 -10.696 -1.752 344 HB3 PHE 44 HB1 PHE 44 -2.453 -9.502 -2.790 345 HD1 PHE 44 HD1 PHE 44 0.775 -10.864 -1.620 346 HD2 PHE 44 HD2 PHE 44 -1.131 -8.069 -4.270 347 HE1 PHE 44 HE1 PHE 44 2.914 -10.557 -2.836 348 HE2 PHE 44 HE2 PHE 44 1.011 -7.764 -5.486 349 HZ PHE 44 HZ PHE 44 3.032 -9.009 -4.768 350 H HIS 45 HN HIS 45 -0.737 -6.371 -1.037 351 HA HIS 45 HA HIS 45 -3.007 -5.157 -2.455 352 HB2 HIS 45 HB2 HIS 45 -3.704 -4.913 -0.160 353 HB3 HIS 45 HB1 HIS 45 -2.125 -4.332 0.325 354 HD1 HIS 45 HD1 HIS 45 -2.997 -2.889 -2.881 355 HD2 HIS 45 HD2 HIS 45 -3.833 -1.984 1.103 356 HE1 HIS 45 HE1 HIS 45 -3.773 -0.477 -2.838 357 HE2 HIS 45 HE2 HIS 45 -4.295 0.086 -0.420 358 H VAL 46 HN VAL 46 -1.862 -4.492 -4.162 359 HA VAL 46 HA VAL 46 0.265 -2.478 -3.707 360 HB VAL 46 HB VAL 46 0.495 -4.787 -5.657 361 HG11 VAL 46 HG11 VAL 46 1.568 -2.807 -6.545 362 HG12 VAL 46 HG12 VAL 46 2.833 -3.855 -5.909 363 HG13 VAL 46 HG13 VAL 46 2.308 -2.448 -4.985 364 HG21 VAL 46 HG21 VAL 46 1.894 -4.192 -3.029 365 HG22 VAL 46 HG22 VAL 46 2.428 -5.424 -4.174 366 HG23 VAL 46 HG23 VAL 46 0.857 -5.574 -3.387 367 H CYS 47 HN CYS 47 -0.023 -0.728 -4.916 368 HA CYS 47 HA CYS 47 -2.130 -0.700 -6.969 369 HB2 CYS 47 HB2 CYS 47 -2.224 1.100 -5.378 370 HB3 CYS 47 HB1 CYS 47 -0.516 1.469 -5.602 371 H ALA 48 HN ALA 48 -0.616 -2.153 -8.253 372 HA ALA 48 HA ALA 48 0.815 -0.478 -10.200 373 HB1 ALA 48 HB1 ALA 48 2.887 -1.600 -10.048 374 HB2 ALA 48 HB2 ALA 48 2.204 -2.941 -9.125 375 HB3 ALA 48 HB3 ALA 48 2.423 -1.366 -8.365 376 H ALA 49 HN ALA 49 -0.709 -0.978 -11.732 377 HA ALA 49 HA ALA 49 -1.583 -3.669 -12.274 378 HB1 ALA 49 HB1 ALA 49 -1.860 -1.215 -14.023 379 HB2 ALA 49 HB2 ALA 49 -2.962 -1.620 -12.705 380 HB3 ALA 49 HB3 ALA 49 -2.819 -2.695 -14.098 381 H GLY 50 HN GLY 50 -1.167 -4.880 -14.181 382 HA2 GLY 50 HA3 GLY 50 0.953 -4.075 -16.008 383 HA3 GLY 50 HA2 GLY 50 1.422 -5.355 -14.898 384 H TRP 51 HN TRP 51 1.552 -5.950 -17.478 385 HA TRP 51 HA TRP 51 -0.936 -7.165 -18.419 386 HB2 TRP 51 HB2 TRP 51 1.871 -7.146 -19.562 387 HB3 TRP 51 HB1 TRP 51 0.510 -7.959 -20.327 388 HD1 TRP 51 HD1 TRP 51 2.279 -4.815 -20.478 389 HE1 TRP 51 HE1 TRP 51 0.853 -2.965 -21.561 390 HE3 TRP 51 HE3 TRP 51 -2.324 -7.017 -20.261 391 HZ2 TRP 51 HZ2 TRP 51 -1.912 -2.494 -22.248 392 HZ3 TRP 51 HZ3 TRP 51 -4.320 -5.851 -21.118 393 HH2 TRP 51 HH2 TRP 51 -4.123 -3.594 -22.110 394 H MET 52 HN MET 52 -1.526 -8.932 -17.293 395 HA MET 52 HA MET 52 0.482 -10.939 -16.491 396 HB2 MET 52 HB2 MET 52 -2.511 -10.935 -16.022 397 HB3 MET 52 HB1 MET 52 -1.327 -12.006 -15.284 398 HG2 MET 52 HG2 MET 52 -1.505 -10.437 -13.570 399 HG3 MET 52 HG1 MET 52 -0.238 -9.655 -14.511 400 HE1 MET 52 HE1 MET 52 -3.659 -9.364 -12.930 401 HE2 MET 52 HE2 MET 52 -4.078 -10.177 -14.432 402 HE3 MET 52 HE3 MET 52 -4.664 -8.547 -14.131 403 H ALA 53 HN ALA 53 -0.413 -13.278 -16.738 404 HA ALA 53 HA ALA 53 -0.135 -14.253 -19.226 405 HB1 ALA 53 HB1 ALA 53 -2.243 -15.319 -17.340 406 HB2 ALA 53 HB2 ALA 53 -0.512 -15.606 -17.155 407 HB3 ALA 53 HB3 ALA 53 -1.362 -16.220 -18.573 408 H LYS 54 HN LYS 54 -1.489 -14.930 -20.954 409 HA LYS 54 HA LYS 54 -3.014 -14.556 -22.609 410 HB2 LYS 54 HB2 LYS 54 -4.835 -14.119 -20.232 411 HB3 LYS 54 HB1 LYS 54 -5.387 -14.300 -21.893 412 HG2 LYS 54 HG2 LYS 54 -4.216 -16.539 -21.947 413 HG3 LYS 54 HG1 LYS 54 -3.923 -16.361 -20.219 414 HD2 LYS 54 HD2 LYS 54 -6.678 -16.278 -21.500 415 HD3 LYS 54 HD1 LYS 54 -5.976 -17.712 -20.761 416 HE2 LYS 54 HE2 LYS 54 -5.702 -16.289 -18.627 417 HE3 LYS 54 HE1 LYS 54 -6.775 -15.125 -19.407 418 HZ1 LYS 54 HZ1 LYS 54 -8.539 -16.505 -19.268 419 HZ2 LYS 54 HZ2 LYS 54 -7.681 -17.080 -17.919 420 HZ3 LYS 54 HZ3 LYS 54 -7.610 -17.918 -19.395 421 H GLY 55 HN GLY 55 -1.736 -12.196 -20.891 422 HA2 GLY 55 HA3 GLY 55 -1.491 -9.943 -21.350 423 HA3 GLY 55 HA2 GLY 55 -2.636 -10.132 -22.664 424 H ARG 56 HN ARG 56 -3.597 -11.218 -19.528 425 HA ARG 56 HA ARG 56 -5.769 -9.312 -19.441 426 HB2 ARG 56 HB2 ARG 56 -5.985 -11.673 -18.701 427 HB3 ARG 56 HB1 ARG 56 -4.876 -11.336 -17.376 428 HG2 ARG 56 HG2 ARG 56 -6.398 -9.714 -16.421 429 HG3 ARG 56 HG1 ARG 56 -7.471 -9.830 -17.819 430 HD2 ARG 56 HD2 ARG 56 -7.821 -12.253 -17.288 431 HD3 ARG 56 HD1 ARG 56 -6.860 -12.032 -15.825 432 HE ARG 56 HE ARG 56 -8.756 -10.124 -15.555 433 HH11 ARG 56 HH21 ARG 56 -8.929 -13.466 -16.426 434 HH12 ARG 56 HH22 ARG 56 -10.455 -13.729 -15.650 435 HH21 ARG 56 HH11 ARG 56 -10.743 -10.463 -14.520 436 HH22 ARG 56 HH12 ARG 56 -11.480 -12.030 -14.566 437 H VAL 57 HN VAL 57 -6.013 -7.560 -18.121 438 HA VAL 57 HA VAL 57 -3.705 -6.792 -16.390 439 HB VAL 57 HB VAL 57 -3.938 -5.450 -18.521 440 HG11 VAL 57 HG11 VAL 57 -6.398 -4.304 -17.161 441 HG12 VAL 57 HG12 VAL 57 -6.459 -5.426 -18.520 442 HG13 VAL 57 HG13 VAL 57 -5.723 -3.837 -18.717 443 HG21 VAL 57 HG21 VAL 57 -4.278 -4.025 -15.863 444 HG22 VAL 57 HG22 VAL 57 -3.701 -3.260 -17.344 445 HG23 VAL 57 HG23 VAL 57 -2.756 -4.543 -16.588 446 H GLY 58 HN GLY 58 -4.124 -6.208 -14.362 447 HA2 GLY 58 HA3 GLY 58 -6.075 -4.889 -13.128 448 HA3 GLY 58 HA2 GLY 58 -6.888 -6.425 -13.399 449 H TYR 59 HN TYR 59 -5.035 -4.690 -11.267 450 HA TYR 59 HA TYR 59 -3.990 -7.131 -9.930 451 HB2 TYR 59 HB2 TYR 59 -2.892 -4.445 -10.362 452 HB3 TYR 59 HB1 TYR 59 -2.860 -4.861 -8.653 453 HD1 TYR 59 HD1 TYR 59 -2.383 -6.777 -11.852 454 HD2 TYR 59 HD2 TYR 59 -0.740 -5.732 -8.018 455 HE1 TYR 59 HE1 TYR 59 -0.440 -8.254 -12.278 456 HE2 TYR 59 HE2 TYR 59 1.202 -7.206 -8.452 457 HH TYR 59 HH TYR 59 2.371 -8.220 -10.281 458 HA PRO 60 HA PRO 60 -6.856 -6.612 -6.644 459 HB2 PRO 60 HB2 PRO 60 -5.498 -7.557 -4.476 460 HB3 PRO 60 HB1 PRO 60 -5.975 -8.621 -5.818 461 HG2 PRO 60 HG2 PRO 60 -3.325 -7.282 -5.343 462 HG3 PRO 60 HG1 PRO 60 -3.657 -8.984 -5.731 463 HD2 PRO 60 HD2 PRO 60 -2.917 -7.228 -7.668 464 HD3 PRO 60 HD1 PRO 60 -4.094 -8.520 -7.998 465 H ILE 61 HN ILE 61 -7.553 -4.920 -5.479 466 HA ILE 61 HA ILE 61 -5.641 -3.267 -3.952 467 HB ILE 61 HB ILE 61 -7.657 -1.864 -5.732 468 HG12 ILE 61 HG12 ILE 61 -4.851 -2.748 -6.494 469 HG13 ILE 61 HG11 ILE 61 -6.360 -3.213 -7.269 470 HG21 ILE 61 HG21 ILE 61 -6.383 0.067 -5.258 471 HG22 ILE 61 HG22 ILE 61 -4.924 -0.853 -4.897 472 HG23 ILE 61 HG23 ILE 61 -6.251 -0.825 -3.745 473 HD11 ILE 61 HD11 ILE 61 -6.734 -0.732 -7.755 474 HD12 ILE 61 HD12 ILE 61 -5.430 -1.506 -8.653 475 HD13 ILE 61 HD13 ILE 61 -5.057 -0.487 -7.265 476 H VAL 62 HN VAL 62 -6.551 -3.892 -2.037 477 HA VAL 62 HA VAL 62 -9.207 -4.266 -1.395 478 HB VAL 62 HB VAL 62 -8.432 -3.227 0.947 479 HG11 VAL 62 HG11 VAL 62 -8.795 -5.600 0.640 480 HG12 VAL 62 HG12 VAL 62 -7.246 -5.382 1.445 481 HG13 VAL 62 HG13 VAL 62 -7.300 -5.759 -0.279 482 HG21 VAL 62 HG21 VAL 62 -6.045 -3.170 1.244 483 HG22 VAL 62 HG22 VAL 62 -6.407 -2.163 -0.156 484 HG23 VAL 62 HG23 VAL 62 -5.769 -3.783 -0.383 485 H LYS 63 HN LYS 63 -7.485 -1.183 -1.638 486 HA LYS 63 HA LYS 63 -10.085 0.171 -1.836 487 HB2 LYS 63 HB2 LYS 63 -9.465 1.871 -0.148 488 HB3 LYS 63 HB1 LYS 63 -9.590 0.257 0.550 489 HG2 LYS 63 HG2 LYS 63 -7.012 0.107 0.106 490 HG3 LYS 63 HG1 LYS 63 -7.089 1.855 -0.071 491 HD2 LYS 63 HD2 LYS 63 -7.956 0.263 2.362 492 HD3 LYS 63 HD1 LYS 63 -6.507 1.260 2.233 493 HE2 LYS 63 HE2 LYS 63 -8.080 2.650 3.345 494 HE3 LYS 63 HE1 LYS 63 -8.131 3.201 1.672 495 HZ1 LYS 63 HZ1 LYS 63 -9.931 1.030 2.243 496 HZ2 LYS 63 HZ2 LYS 63 -10.215 2.493 1.427 497 HZ3 LYS 63 HZ3 LYS 63 -10.270 2.440 3.123 498 HA PRO 64 HA PRO 64 -8.060 2.475 -5.009 499 HB2 PRO 64 HB2 PRO 64 -9.097 5.062 -4.540 500 HB3 PRO 64 HB1 PRO 64 -9.902 3.793 -5.474 501 HG2 PRO 64 HG2 PRO 64 -10.260 4.519 -2.586 502 HG3 PRO 64 HG1 PRO 64 -11.495 4.144 -3.806 503 HD2 PRO 64 HD2 PRO 64 -10.838 2.286 -2.037 504 HD3 PRO 64 HD1 PRO 64 -11.021 1.814 -3.739 505 H GLY 65 HN GLY 65 -6.140 3.475 -5.260 506 HA2 GLY 65 HA3 GLY 65 -4.831 4.633 -2.862 507 HA3 GLY 65 HA2 GLY 65 -4.023 3.890 -4.233 508 HA PRO 66 HA PRO 66 -4.236 8.543 -4.759 509 HB2 PRO 66 HB2 PRO 66 -1.602 9.167 -4.433 510 HB3 PRO 66 HB1 PRO 66 -2.701 8.983 -3.048 511 HG2 PRO 66 HG2 PRO 66 -0.764 6.988 -4.187 512 HG3 PRO 66 HG1 PRO 66 -1.030 7.445 -2.491 513 HD2 PRO 66 HD2 PRO 66 -2.156 5.197 -3.580 514 HD3 PRO 66 HD1 PRO 66 -2.967 6.129 -2.300 515 H ASN 67 HN ASN 67 -1.498 6.501 -5.811 516 HA ASN 67 HA ASN 67 -1.087 7.844 -8.279 517 HB2 ASN 67 HB2 ASN 67 0.653 6.480 -7.196 518 HB3 ASN 67 HB1 ASN 67 -0.317 5.034 -7.452 519 HD21 ASN 67 HD21 ASN 67 1.137 4.000 -8.940 520 HD22 ASN 67 HD22 ASN 67 1.468 4.633 -10.478 521 H CYS 68 HN CYS 68 -3.225 5.283 -7.264 522 HA CYS 68 HA CYS 68 -4.021 4.701 -10.061 523 HB2 CYS 68 HB2 CYS 68 -5.530 3.009 -8.392 524 HB3 CYS 68 HB1 CYS 68 -4.048 2.569 -9.230 525 H GLY 69 HN GLY 69 -6.184 4.830 -10.711 526 HA2 GLY 69 HA3 GLY 69 -8.231 5.964 -9.020 527 HA3 GLY 69 HA2 GLY 69 -7.577 7.112 -10.185 528 H PHE 70 HN PHE 70 -7.190 4.305 -11.714 529 HA PHE 70 HA PHE 70 -9.338 4.707 -13.530 530 HB2 PHE 70 HB2 PHE 70 -7.072 3.710 -14.049 531 HB3 PHE 70 HB1 PHE 70 -7.603 2.240 -13.239 532 HD1 PHE 70 HD1 PHE 70 -8.763 4.674 -15.854 533 HD2 PHE 70 HD2 PHE 70 -8.639 0.567 -14.582 534 HE1 PHE 70 HE1 PHE 70 -9.871 3.984 -17.959 535 HE2 PHE 70 HE2 PHE 70 -9.749 -0.114 -16.691 536 HZ PHE 70 HZ PHE 70 -10.366 1.592 -18.376 537 H GLY 71 HN GLY 71 -9.373 3.477 -10.496 538 HA2 GLY 71 HA3 GLY 71 -12.011 2.371 -10.775 539 HA3 GLY 71 HA2 GLY 71 -10.809 1.115 -10.501 540 H LYS 72 HN LYS 72 -12.167 0.794 -8.551 541 HA LYS 72 HA LYS 72 -10.873 1.810 -6.256 542 HB2 LYS 72 HB2 LYS 72 -12.954 3.007 -5.315 543 HB3 LYS 72 HB1 LYS 72 -12.017 3.876 -6.525 544 HG2 LYS 72 HG2 LYS 72 -13.595 3.149 -8.283 545 HG3 LYS 72 HG1 LYS 72 -14.552 2.296 -7.079 546 HD2 LYS 72 HD2 LYS 72 -13.970 5.273 -7.037 547 HD3 LYS 72 HD1 LYS 72 -15.469 4.553 -7.618 548 HE2 LYS 72 HE2 LYS 72 -16.095 5.025 -5.421 549 HE3 LYS 72 HE1 LYS 72 -15.425 3.416 -5.164 550 HZ1 LYS 72 HZ1 LYS 72 -13.438 5.486 -5.115 551 HZ2 LYS 72 HZ2 LYS 72 -13.743 4.247 -3.992 552 HZ3 LYS 72 HZ3 LYS 72 -14.628 5.696 -3.924 553 H THR 73 HN THR 73 -10.839 -0.517 -6.097 554 HA THR 73 HA THR 73 -12.575 -1.543 -4.217 555 HB THR 73 HB THR 73 -13.481 -3.307 -6.292 556 HG1 THR 73 HG1 THR 73 -14.459 -0.835 -6.990 557 HG21 THR 73 HG21 THR 73 -14.818 -2.915 -4.343 558 HG22 THR 73 HG22 THR 73 -15.734 -2.286 -5.713 559 HG23 THR 73 HG23 THR 73 -14.878 -1.179 -4.641 560 H GLY 74 HN GLY 74 -12.469 -4.040 -4.152 561 HA2 GLY 74 HA3 GLY 74 -9.884 -4.884 -3.761 562 HA3 GLY 74 HA2 GLY 74 -11.215 -5.974 -4.118 563 H ILE 75 HN ILE 75 -11.445 -6.827 -6.168 564 HA ILE 75 HA ILE 75 -9.106 -6.494 -7.960 565 HB ILE 75 HB ILE 75 -11.262 -8.627 -7.971 566 HG12 ILE 75 HG12 ILE 75 -8.376 -8.810 -7.025 567 HG13 ILE 75 HG11 ILE 75 -9.736 -8.584 -5.930 568 HG21 ILE 75 HG21 ILE 75 -10.257 -8.364 -10.171 569 HG22 ILE 75 HG22 ILE 75 -9.557 -9.798 -9.431 570 HG23 ILE 75 HG23 ILE 75 -8.641 -8.295 -9.473 571 HD11 ILE 75 HD11 ILE 75 -9.264 -10.943 -7.775 572 HD12 ILE 75 HD12 ILE 75 -10.755 -10.688 -6.869 573 HD13 ILE 75 HD13 ILE 75 -9.236 -10.950 -6.012 574 H ILE 76 HN ILE 76 -9.413 -4.921 -9.385 575 HA ILE 76 HA ILE 76 -12.058 -4.585 -10.702 576 HB ILE 76 HB ILE 76 -11.143 -2.362 -11.385 577 HG12 ILE 76 HG12 ILE 76 -8.884 -3.034 -9.469 578 HG13 ILE 76 HG11 ILE 76 -8.716 -3.054 -11.222 579 HG21 ILE 76 HG21 ILE 76 -12.517 -2.685 -9.323 580 HG22 ILE 76 HG22 ILE 76 -11.379 -1.346 -9.182 581 HG23 ILE 76 HG23 ILE 76 -11.027 -2.888 -8.402 582 HD11 ILE 76 HD11 ILE 76 -9.491 -0.653 -9.531 583 HD12 ILE 76 HD12 ILE 76 -9.418 -0.668 -11.295 584 HD13 ILE 76 HD13 ILE 76 -7.947 -0.901 -10.350 585 H ASP 77 HN ASP 77 -10.612 -6.763 -11.561 586 HA ASP 77 HA ASP 77 -9.144 -6.011 -13.977 587 HB2 ASP 77 HB2 ASP 77 -8.483 -7.912 -12.396 588 HB3 ASP 77 HB1 ASP 77 -9.852 -8.806 -13.052 589 H TYR 78 HN TYR 78 -10.150 -5.660 -15.811 590 HA TYR 78 HA TYR 78 -12.920 -6.163 -16.256 591 HB2 TYR 78 HB2 TYR 78 -10.633 -5.364 -18.074 592 HB3 TYR 78 HB1 TYR 78 -12.277 -5.556 -18.678 593 HD1 TYR 78 HD1 TYR 78 -10.360 -3.845 -15.935 594 HD2 TYR 78 HD2 TYR 78 -13.735 -3.677 -18.598 595 HE1 TYR 78 HE1 TYR 78 -10.874 -1.557 -15.146 596 HE2 TYR 78 HE2 TYR 78 -14.242 -1.388 -17.805 597 HH TYR 78 HH TYR 78 -12.364 0.568 -16.518 598 H GLY 79 HN GLY 79 -10.107 -7.474 -18.029 599 HA2 GLY 79 HA3 GLY 79 -9.989 -10.011 -18.054 600 HA3 GLY 79 HA2 GLY 79 -11.663 -9.961 -18.584 601 H ILE 80 HN ILE 80 -8.362 -9.589 -19.479 602 HA ILE 80 HA ILE 80 -7.283 -9.433 -21.494 603 HB ILE 80 HB ILE 80 -9.907 -10.479 -22.592 604 HG12 ILE 80 HG12 ILE 80 -7.430 -12.018 -21.729 605 HG13 ILE 80 HG11 ILE 80 -8.863 -11.844 -20.720 606 HG21 ILE 80 HG21 ILE 80 -8.363 -11.407 -24.370 607 HG22 ILE 80 HG22 ILE 80 -7.068 -10.444 -23.668 608 HG23 ILE 80 HG23 ILE 80 -8.477 -9.649 -24.373 609 HD11 ILE 80 HD11 ILE 80 -8.678 -13.208 -23.416 610 HD12 ILE 80 HD12 ILE 80 -10.210 -12.841 -22.624 611 HD13 ILE 80 HD13 ILE 80 -9.069 -13.947 -21.864 612 H ARG 81 HN ARG 81 -6.801 -7.740 -22.723 613 HA ARG 81 HA ARG 81 -8.932 -5.748 -23.366 614 HB2 ARG 81 HB2 ARG 81 -5.961 -5.211 -23.204 615 HB3 ARG 81 HB1 ARG 81 -7.281 -4.047 -23.196 616 HG2 ARG 81 HG2 ARG 81 -6.688 -6.070 -21.010 617 HG3 ARG 81 HG1 ARG 81 -6.349 -4.346 -20.942 618 HD2 ARG 81 HD2 ARG 81 -9.056 -5.692 -21.019 619 HD3 ARG 81 HD1 ARG 81 -8.397 -4.669 -19.752 620 HE ARG 81 HE ARG 81 -9.721 -3.777 -22.133 621 HH11 ARG 81 HH21 ARG 81 -7.202 -3.057 -19.871 622 HH12 ARG 81 HH22 ARG 81 -7.316 -1.342 -20.082 623 HH21 ARG 81 HH11 ARG 81 -9.877 -1.529 -22.413 624 HH22 ARG 81 HH12 ARG 81 -8.829 -0.477 -21.519 625 H LEU 82 HN LEU 82 -9.124 -4.975 -25.405 626 HA LEU 82 HA LEU 82 -7.872 -6.547 -27.531 627 HB2 LEU 82 HB2 LEU 82 -10.091 -4.501 -27.432 628 HB3 LEU 82 HB1 LEU 82 -9.425 -5.036 -28.968 629 HG LEU 82 HG LEU 82 -11.495 -6.290 -28.195 630 HD11 LEU 82 HD11 LEU 82 -9.603 -7.242 -29.750 631 HD12 LEU 82 HD12 LEU 82 -10.814 -8.333 -29.092 632 HD13 LEU 82 HD13 LEU 82 -9.213 -8.265 -28.367 633 HD21 LEU 82 HD21 LEU 82 -9.638 -7.609 -26.196 634 HD22 LEU 82 HD22 LEU 82 -11.377 -7.840 -26.375 635 HD23 LEU 82 HD23 LEU 82 -10.750 -6.312 -25.755 636 H ASN 83 HN ASN 83 -7.133 -3.751 -25.846 637 HA ASN 83 HA ASN 83 -5.629 -2.526 -28.081 638 HB2 ASN 83 HB2 ASN 83 -5.675 -0.478 -26.812 639 HB3 ASN 83 HB1 ASN 83 -7.317 -1.101 -26.926 640 HD21 ASN 83 HD21 ASN 83 -4.498 -1.007 -24.697 641 HD22 ASN 83 HD22 ASN 83 -5.430 -1.119 -23.282 642 H ARG 84 HN ARG 84 -4.844 -4.881 -26.353 643 HA ARG 84 HA ARG 84 -3.006 -4.331 -24.381 644 HB2 ARG 84 HB2 ARG 84 -2.993 -6.458 -26.535 645 HB3 ARG 84 HB1 ARG 84 -1.708 -6.390 -25.327 646 HG2 ARG 84 HG2 ARG 84 -3.335 -6.557 -23.532 647 HG3 ARG 84 HG1 ARG 84 -4.648 -6.513 -24.679 648 HD2 ARG 84 HD2 ARG 84 -2.541 -8.669 -24.590 649 HD3 ARG 84 HD1 ARG 84 -4.133 -8.797 -23.850 650 HE ARG 84 HE ARG 84 -4.369 -8.151 -26.614 651 HH11 ARG 84 HH21 ARG 84 -3.608 -10.685 -24.383 652 HH12 ARG 84 HH22 ARG 84 -4.117 -11.962 -25.437 653 HH21 ARG 84 HH11 ARG 84 -5.045 -9.833 -28.009 654 HH22 ARG 84 HH12 ARG 84 -4.928 -11.480 -27.485 655 H SER 85 HN SER 85 -2.644 -3.676 -27.791 656 HA SER 85 HA SER 85 0.066 -3.415 -28.131 657 HB2 SER 85 HB2 SER 85 -0.442 -1.623 -29.745 658 HB3 SER 85 HB1 SER 85 -1.553 -2.981 -29.912 659 HG SER 85 HG SER 85 -2.257 -0.961 -28.131 660 H GLU 86 HN GLU 86 -1.902 -1.674 -25.933 661 HA GLU 86 HA GLU 86 -0.492 0.747 -25.684 662 HB2 GLU 86 HB2 GLU 86 -2.458 -0.803 -24.075 663 HB3 GLU 86 HB1 GLU 86 -1.453 0.273 -23.119 664 HG2 GLU 86 HG2 GLU 86 -3.437 1.480 -23.746 665 HG3 GLU 86 HG1 GLU 86 -2.104 2.151 -24.677 666 H ARG 87 HN ARG 87 0.489 1.143 -23.279 667 HA ARG 87 HA ARG 87 2.658 -0.857 -22.864 668 HB2 ARG 87 HB2 ARG 87 2.848 2.161 -22.789 669 HB3 ARG 87 HB1 ARG 87 4.141 1.036 -22.394 670 HG2 ARG 87 HG2 ARG 87 4.026 0.093 -24.672 671 HG3 ARG 87 HG1 ARG 87 2.737 1.227 -25.071 672 HD2 ARG 87 HD2 ARG 87 4.722 2.233 -25.920 673 HD3 ARG 87 HD1 ARG 87 4.395 3.086 -24.414 674 HE ARG 87 HE ARG 87 6.313 2.126 -23.495 675 HH11 ARG 87 HH21 ARG 87 5.418 0.559 -26.452 676 HH12 ARG 87 HH22 ARG 87 6.881 -0.360 -26.571 677 HH21 ARG 87 HH11 ARG 87 8.236 0.919 -23.646 678 HH22 ARG 87 HH12 ARG 87 8.480 -0.157 -24.985 679 H TRP 88 HN TRP 88 3.078 -1.424 -20.837 680 HA TRP 88 HA TRP 88 2.169 0.134 -18.537 681 HB2 TRP 88 HB2 TRP 88 1.052 -2.604 -19.193 682 HB3 TRP 88 HB1 TRP 88 0.995 -1.910 -17.578 683 HD1 TRP 88 HD1 TRP 88 -0.284 -1.249 -21.137 684 HE1 TRP 88 HE1 TRP 88 -2.410 0.200 -20.979 685 HE3 TRP 88 HE3 TRP 88 -0.340 -0.335 -16.120 686 HZ2 TRP 88 HZ2 TRP 88 -3.937 1.562 -18.977 687 HZ3 TRP 88 HZ3 TRP 88 -2.142 1.035 -15.110 688 HH2 TRP 88 HH2 TRP 88 -3.938 1.984 -16.532 689 H ASP 89 HN ASP 89 2.560 -1.449 -16.519 690 HA ASP 89 HA ASP 89 5.401 -1.883 -16.482 691 HB2 ASP 89 HB2 ASP 89 3.233 -2.475 -14.457 692 HB3 ASP 89 HB1 ASP 89 4.950 -2.688 -14.144 693 H ALA 90 HN ALA 90 5.764 -4.110 -14.957 694 HA ALA 90 HA ALA 90 4.538 -6.427 -16.267 695 HB1 ALA 90 HB1 ALA 90 6.435 -5.680 -17.769 696 HB2 ALA 90 HB2 ALA 90 6.562 -7.333 -17.171 697 HB3 ALA 90 HB3 ALA 90 7.537 -6.055 -16.445 698 H TYR 91 HN TYR 91 4.778 -8.322 -15.133 699 HA TYR 91 HA TYR 91 6.416 -8.327 -12.679 700 HB2 TYR 91 HB2 TYR 91 3.530 -9.247 -12.634 701 HB3 TYR 91 HB1 TYR 91 4.615 -8.993 -11.269 702 HD1 TYR 91 HD2 TYR 91 5.748 -6.446 -11.413 703 HD2 TYR 91 HD1 TYR 91 1.837 -7.604 -12.786 704 HE1 TYR 91 HE2 TYR 91 4.974 -4.107 -11.203 705 HE2 TYR 91 HE1 TYR 91 1.072 -5.268 -12.552 706 HH TYR 91 HH TYR 91 3.055 -2.699 -12.365 707 H CYS 92 HN CYS 92 6.655 -10.454 -11.768 708 HA CYS 92 HA CYS 92 6.105 -12.713 -13.608 709 HB2 CYS 92 HB2 CYS 92 8.793 -12.378 -12.252 710 HB3 CYS 92 HB1 CYS 92 8.329 -13.571 -13.458 711 H TYR 93 HN TYR 93 7.389 -14.658 -12.217 712 HA TYR 93 HA TYR 93 6.350 -14.598 -9.444 713 HB2 TYR 93 HB2 TYR 93 4.618 -15.584 -10.968 714 HB3 TYR 93 HB1 TYR 93 5.782 -16.826 -11.417 715 HD1 TYR 93 HD1 TYR 93 3.994 -15.325 -8.507 716 HD2 TYR 93 HD2 TYR 93 6.095 -18.754 -10.025 717 HE1 TYR 93 HE1 TYR 93 3.336 -16.621 -6.498 718 HE2 TYR 93 HE2 TYR 93 5.438 -20.044 -8.016 719 HH TYR 93 HH TYR 93 4.323 -18.686 -5.237 720 H ASN 94 HN ASN 94 7.355 -16.057 -8.059 721 HA ASN 94 HA ASN 94 9.713 -17.509 -9.123 722 HB2 ASN 94 HB2 ASN 94 9.623 -15.509 -6.866 723 HB3 ASN 94 HB1 ASN 94 10.888 -16.734 -6.943 724 HD21 ASN 94 HD21 ASN 94 12.741 -15.857 -7.851 725 HD22 ASN 94 HD22 ASN 94 12.769 -14.754 -9.142 726 HA PRO 95 HA PRO 95 8.170 -20.766 -6.566 727 HB2 PRO 95 HB2 PRO 95 10.369 -22.335 -6.261 728 HB3 PRO 95 HB1 PRO 95 9.598 -22.122 -7.850 729 HG2 PRO 95 HG2 PRO 95 11.977 -20.676 -6.719 730 HG3 PRO 95 HG1 PRO 95 11.807 -21.469 -8.301 731 HD2 PRO 95 HD2 PRO 95 11.462 -18.784 -8.028 732 HD3 PRO 95 HD1 PRO 95 10.485 -19.732 -9.177 733 H HIS 96 HN HIS 96 9.365 -18.242 -5.291 734 HA HIS 96 HA HIS 96 10.641 -19.147 -2.858 735 HB2 HIS 96 HB2 HIS 96 9.521 -16.433 -3.616 736 HB3 HIS 96 HB1 HIS 96 10.552 -16.772 -2.229 737 HD1 HIS 96 HD1 HIS 96 12.238 -18.900 -4.155 738 HD2 HIS 96 HD2 HIS 96 11.693 -14.796 -4.655 739 HE1 HIS 96 HE1 HIS 96 14.157 -18.092 -5.598 740 HE2 HIS 96 HE2 HIS 96 13.839 -15.593 -5.912 741 H ALA 97 HN ALA 97 9.356 -17.401 -1.033 742 HA ALA 97 HA ALA 97 7.714 -17.517 0.573 743 HB1 ALA 97 HB1 ALA 97 6.070 -17.790 -1.952 744 HB2 ALA 97 HB2 ALA 97 6.415 -16.315 -1.055 745 HB3 ALA 97 HB3 ALA 97 5.366 -17.545 -0.353 746 H LYS 98 HN LYS 98 8.644 -19.534 1.318 747 HA LYS 98 HA LYS 98 6.605 -21.651 1.308 748 HB2 LYS 98 HB2 LYS 98 9.447 -22.123 0.360 749 HB3 LYS 98 HB1 LYS 98 8.401 -23.417 0.939 750 HG2 LYS 98 HG2 LYS 98 6.747 -22.846 -0.812 751 HG3 LYS 98 HG1 LYS 98 7.830 -21.589 -1.411 752 HD2 LYS 98 HD2 LYS 98 9.585 -23.302 -1.778 753 HD3 LYS 98 HD1 LYS 98 8.448 -24.548 -1.267 754 HE2 LYS 98 HE2 LYS 98 7.972 -22.648 -3.575 755 HE3 LYS 98 HE1 LYS 98 8.581 -24.293 -3.750 756 HZ1 LYS 98 HZ1 LYS 98 6.497 -24.870 -2.340 757 HZ2 LYS 98 HZ2 LYS 98 6.340 -24.603 -4.010 758 HZ3 LYS 98 HZ3 LYS 98 5.920 -23.380 -2.910 Start of MODEL 16 1 H1 GLY 1 H1 GLY 1 3.640 -13.696 -2.650 2 H2 GLY 1 H2 GLY 1 2.470 -14.762 -3.268 3 H3 GLY 1 H3 GLY 1 3.005 -13.448 -4.202 4 HA2 GLY 1 HA3 GLY 1 5.102 -15.232 -3.322 5 HA3 GLY 1 HA2 GLY 1 3.944 -15.942 -4.446 6 H VAL 2 HN VAL 2 3.839 -12.699 -4.959 7 HA VAL 2 HA VAL 2 5.970 -12.730 -7.045 8 HB VAL 2 HB VAL 2 4.467 -11.443 -8.484 9 HG11 VAL 2 HG11 VAL 2 4.487 -13.884 -8.674 10 HG12 VAL 2 HG12 VAL 2 2.866 -13.269 -8.975 11 HG13 VAL 2 HG13 VAL 2 3.254 -14.011 -7.424 12 HG21 VAL 2 HG21 VAL 2 3.073 -10.293 -6.893 13 HG22 VAL 2 HG22 VAL 2 2.521 -11.812 -6.184 14 HG23 VAL 2 HG23 VAL 2 2.016 -11.358 -7.809 15 H TYR 3 HN TYR 3 7.298 -11.061 -7.071 16 HA TYR 3 HA TYR 3 6.780 -8.812 -5.204 17 HB2 TYR 3 HB2 TYR 3 9.138 -8.476 -5.118 18 HB3 TYR 3 HB1 TYR 3 8.836 -10.193 -4.898 19 HD1 TYR 3 HD2 TYR 3 9.100 -11.765 -6.899 20 HD2 TYR 3 HD1 TYR 3 10.519 -7.703 -6.919 21 HE1 TYR 3 HE2 TYR 3 10.663 -12.313 -8.740 22 HE2 TYR 3 HE1 TYR 3 12.081 -8.261 -8.759 23 HH TYR 3 HH TYR 3 12.506 -11.587 -9.848 24 H HIS 4 HN HIS 4 7.292 -6.679 -5.825 25 HA HIS 4 HA HIS 4 6.328 -6.014 -8.441 26 HB2 HIS 4 HB2 HIS 4 5.859 -4.643 -6.440 27 HB3 HIS 4 HB1 HIS 4 7.570 -4.239 -6.329 28 HD1 HIS 4 HD1 HIS 4 8.523 -2.569 -8.052 29 HD2 HIS 4 HD2 HIS 4 4.479 -3.408 -8.628 30 HE1 HIS 4 HE1 HIS 4 7.661 -0.848 -9.696 31 HE2 HIS 4 HE2 HIS 4 5.197 -1.345 -10.059 32 H ARG 5 HN ARG 5 7.433 -5.754 -10.241 33 HA ARG 5 HA ARG 5 10.402 -5.696 -10.157 34 HB2 ARG 5 HB2 ARG 5 8.399 -6.468 -12.286 35 HB3 ARG 5 HB1 ARG 5 10.108 -6.237 -12.642 36 HG2 ARG 5 HG2 ARG 5 10.699 -7.967 -10.999 37 HG3 ARG 5 HG1 ARG 5 8.991 -8.194 -10.614 38 HD2 ARG 5 HD2 ARG 5 8.512 -8.933 -12.857 39 HD3 ARG 5 HD1 ARG 5 10.128 -8.518 -13.409 40 HE ARG 5 HE ARG 5 9.346 -10.904 -11.971 41 HH11 ARG 5 HH21 ARG 5 11.913 -8.687 -12.645 42 HH12 ARG 5 HH22 ARG 5 13.164 -9.878 -12.504 43 HH21 ARG 5 HH11 ARG 5 10.993 -12.483 -11.810 44 HH22 ARG 5 HH12 ARG 5 12.645 -12.017 -12.036 45 H GLU 6 HN GLU 6 11.422 -4.413 -11.905 46 HA GLU 6 HA GLU 6 10.033 -2.149 -13.008 47 HB2 GLU 6 HB2 GLU 6 10.314 -1.445 -10.649 48 HB3 GLU 6 HB1 GLU 6 12.054 -1.684 -10.802 49 HG2 GLU 6 HG2 GLU 6 12.186 0.030 -12.530 50 HG3 GLU 6 HG1 GLU 6 10.432 0.200 -12.538 51 H ALA 7 HN ALA 7 10.949 -1.900 -14.911 52 HA ALA 7 HA ALA 7 13.526 -3.017 -15.557 53 HB1 ALA 7 HB1 ALA 7 13.111 -2.078 -17.797 54 HB2 ALA 7 HB2 ALA 7 11.698 -1.237 -17.170 55 HB3 ALA 7 HB3 ALA 7 11.729 -2.997 -17.205 56 H ARG 8 HN ARG 8 15.136 -1.652 -16.796 57 HA ARG 8 HA ARG 8 16.148 0.387 -15.096 58 HB2 ARG 8 HB2 ARG 8 16.930 -0.646 -17.835 59 HB3 ARG 8 HB1 ARG 8 17.796 0.679 -17.063 60 HG2 ARG 8 HG2 ARG 8 19.043 -1.253 -16.482 61 HG3 ARG 8 HG1 ARG 8 18.095 -0.910 -15.043 62 HD2 ARG 8 HD2 ARG 8 18.072 -3.306 -15.569 63 HD3 ARG 8 HD1 ARG 8 16.460 -2.644 -15.711 64 HE ARG 8 HE ARG 8 17.778 -2.594 -18.237 65 HH11 ARG 8 HH21 ARG 8 16.148 -4.608 -15.943 66 HH12 ARG 8 HH22 ARG 8 15.864 -5.898 -17.064 67 HH21 ARG 8 HH11 ARG 8 17.428 -4.305 -19.713 68 HH22 ARG 8 HH12 ARG 8 16.594 -5.729 -19.190 69 H SER 9 HN SER 9 14.496 0.403 -18.219 70 HA SER 9 HA SER 9 14.750 3.217 -18.669 71 HB2 SER 9 HB2 SER 9 14.339 1.617 -20.496 72 HB3 SER 9 HB1 SER 9 12.758 1.242 -19.811 73 HG SER 9 HG SER 9 12.169 3.397 -20.140 74 H GLY 10 HN GLY 10 12.578 1.243 -16.821 75 HA2 GLY 10 HA3 GLY 10 11.466 2.721 -15.046 76 HA3 GLY 10 HA2 GLY 10 10.709 3.525 -16.414 77 H LYS 11 HN LYS 11 8.806 2.831 -15.108 78 HA LYS 11 HA LYS 11 7.978 0.041 -15.668 79 HB2 LYS 11 HB2 LYS 11 6.334 0.337 -13.888 80 HB3 LYS 11 HB1 LYS 11 7.959 0.654 -13.291 81 HG2 LYS 11 HG2 LYS 11 7.561 3.094 -13.570 82 HG3 LYS 11 HG1 LYS 11 5.909 2.747 -14.088 83 HD2 LYS 11 HD2 LYS 11 5.507 1.578 -11.925 84 HD3 LYS 11 HD1 LYS 11 7.126 2.043 -11.403 85 HE2 LYS 11 HE2 LYS 11 4.986 4.016 -12.247 86 HE3 LYS 11 HE1 LYS 11 5.328 3.581 -10.571 87 HZ1 LYS 11 HZ1 LYS 11 6.931 5.144 -12.451 88 HZ2 LYS 11 HZ2 LYS 11 7.759 4.176 -11.329 89 HZ3 LYS 11 HZ3 LYS 11 6.683 5.373 -10.790 90 H TYR 12 HN TYR 12 5.351 0.161 -15.580 91 HA TYR 12 HA TYR 12 3.604 0.406 -17.100 92 HB2 TYR 12 HB2 TYR 12 4.361 3.155 -16.130 93 HB3 TYR 12 HB1 TYR 12 3.090 3.017 -17.337 94 HD1 TYR 12 HD1 TYR 12 4.089 1.156 -14.212 95 HD2 TYR 12 HD2 TYR 12 0.910 3.046 -16.413 96 HE1 TYR 12 HE1 TYR 12 2.492 0.590 -12.407 97 HE2 TYR 12 HE2 TYR 12 -0.676 2.478 -14.604 98 HH TYR 12 HH TYR 12 -0.912 0.933 -12.786 99 H LYS 13 HN LYS 13 6.361 0.301 -18.281 100 HA LYS 13 HA LYS 13 5.746 1.481 -20.931 101 HB2 LYS 13 HB2 LYS 13 8.278 1.709 -19.293 102 HB3 LYS 13 HB1 LYS 13 8.317 1.852 -21.057 103 HG2 LYS 13 HG2 LYS 13 6.696 3.697 -20.959 104 HG3 LYS 13 HG1 LYS 13 6.592 3.538 -19.209 105 HD2 LYS 13 HD2 LYS 13 9.052 3.992 -19.080 106 HD3 LYS 13 HD1 LYS 13 9.041 4.297 -20.815 107 HE2 LYS 13 HE2 LYS 13 7.383 5.804 -18.771 108 HE3 LYS 13 HE1 LYS 13 8.860 6.406 -19.522 109 HZ1 LYS 13 HZ1 LYS 13 6.212 5.973 -20.715 110 HZ2 LYS 13 HZ2 LYS 13 7.591 5.850 -21.699 111 HZ3 LYS 13 HZ3 LYS 13 7.260 7.296 -20.873 112 H LEU 14 HN LEU 14 5.439 -1.240 -19.790 113 HA LEU 14 HA LEU 14 7.196 -2.723 -21.698 114 HB2 LEU 14 HB2 LEU 14 6.156 -3.810 -19.071 115 HB3 LEU 14 HB1 LEU 14 7.280 -4.585 -20.177 116 HG LEU 14 HG LEU 14 7.873 -1.956 -18.778 117 HD11 LEU 14 HD11 LEU 14 9.328 -3.337 -17.289 118 HD12 LEU 14 HD12 LEU 14 8.650 -4.790 -18.025 119 HD13 LEU 14 HD13 LEU 14 7.614 -3.707 -17.097 120 HD21 LEU 14 HD21 LEU 14 9.255 -2.261 -20.755 121 HD22 LEU 14 HD22 LEU 14 9.572 -3.942 -20.333 122 HD23 LEU 14 HD23 LEU 14 10.251 -2.643 -19.357 123 H THR 15 HN THR 15 6.237 -4.055 -23.082 124 HA THR 15 HA THR 15 3.295 -4.134 -23.102 125 HB THR 15 HB THR 15 5.297 -5.177 -25.128 126 HG1 THR 15 HG1 THR 15 3.809 -2.782 -24.895 127 HG21 THR 15 HG21 THR 15 3.195 -4.989 -26.613 128 HG22 THR 15 HG22 THR 15 2.274 -4.934 -25.114 129 HG23 THR 15 HG23 THR 15 3.254 -6.350 -25.495 130 H TYR 16 HN TYR 16 2.174 -6.161 -23.519 131 HA TYR 16 HA TYR 16 2.587 -8.118 -21.615 132 HB2 TYR 16 HB2 TYR 16 0.476 -7.939 -22.751 133 HB3 TYR 16 HB1 TYR 16 1.218 -8.252 -24.308 134 HD1 TYR 16 HD2 TYR 16 2.035 -10.533 -24.891 135 HD2 TYR 16 HD1 TYR 16 -0.073 -9.762 -21.227 136 HE1 TYR 16 HE2 TYR 16 1.642 -12.960 -24.604 137 HE2 TYR 16 HE1 TYR 16 -0.463 -12.193 -20.944 138 HH TYR 16 HH TYR 16 0.230 -14.470 -23.473 139 H ALA 17 HN ALA 17 3.356 -8.473 -25.091 140 HA ALA 17 HA ALA 17 4.710 -10.907 -24.911 141 HB1 ALA 17 HB1 ALA 17 5.721 -10.328 -27.057 142 HB2 ALA 17 HB2 ALA 17 5.296 -8.633 -26.821 143 HB3 ALA 17 HB3 ALA 17 4.027 -9.838 -27.039 144 H GLU 18 HN GLU 18 6.030 -7.601 -24.688 145 HA GLU 18 HA GLU 18 8.741 -8.342 -24.409 146 HB2 GLU 18 HB2 GLU 18 7.949 -6.037 -24.915 147 HB3 GLU 18 HB1 GLU 18 7.344 -5.908 -23.263 148 HG2 GLU 18 HG2 GLU 18 9.608 -6.226 -22.383 149 HG3 GLU 18 HG1 GLU 18 10.228 -6.448 -24.016 150 H ALA 19 HN ALA 19 6.276 -7.581 -21.949 151 HA ALA 19 HA ALA 19 7.781 -7.863 -19.646 152 HB1 ALA 19 HB1 ALA 19 4.900 -8.629 -20.158 153 HB2 ALA 19 HB2 ALA 19 5.495 -7.073 -19.583 154 HB3 ALA 19 HB3 ALA 19 5.624 -8.497 -18.554 155 H LYS 20 HN LYS 20 6.432 -10.357 -21.719 156 HA LYS 20 HA LYS 20 6.693 -12.573 -20.027 157 HB2 LYS 20 HB2 LYS 20 5.608 -12.379 -22.382 158 HB3 LYS 20 HB1 LYS 20 7.222 -12.684 -23.008 159 HG2 LYS 20 HG2 LYS 20 6.401 -14.879 -22.897 160 HG3 LYS 20 HG1 LYS 20 7.161 -14.753 -21.312 161 HD2 LYS 20 HD2 LYS 20 4.982 -14.183 -20.304 162 HD3 LYS 20 HD1 LYS 20 4.217 -14.247 -21.890 163 HE2 LYS 20 HE2 LYS 20 3.768 -16.361 -20.870 164 HE3 LYS 20 HE1 LYS 20 5.059 -16.669 -22.033 165 HZ1 LYS 20 HZ1 LYS 20 6.582 -16.161 -20.032 166 HZ2 LYS 20 HZ2 LYS 20 5.832 -17.684 -20.134 167 HZ3 LYS 20 HZ3 LYS 20 5.206 -16.491 -19.097 168 H ALA 21 HN ALA 21 9.028 -11.000 -22.163 169 HA ALA 21 HA ALA 21 11.104 -12.876 -22.013 170 HB1 ALA 21 HB1 ALA 21 12.579 -11.071 -22.687 171 HB2 ALA 21 HB2 ALA 21 11.413 -9.863 -22.144 172 HB3 ALA 21 HB3 ALA 21 11.044 -10.886 -23.534 173 H VAL 22 HN VAL 22 10.495 -10.045 -19.902 174 HA VAL 22 HA VAL 22 12.718 -10.336 -18.226 175 HB VAL 22 HB VAL 22 9.946 -9.375 -17.463 176 HG11 VAL 22 HG11 VAL 22 12.700 -8.909 -16.275 177 HG12 VAL 22 HG12 VAL 22 11.328 -9.701 -15.499 178 HG13 VAL 22 HG13 VAL 22 11.272 -7.972 -15.836 179 HG21 VAL 22 HG21 VAL 22 10.776 -7.150 -18.096 180 HG22 VAL 22 HG22 VAL 22 10.849 -8.240 -19.478 181 HG23 VAL 22 HG23 VAL 22 12.318 -7.847 -18.585 182 H CYS 23 HN CYS 23 9.835 -12.211 -18.476 183 HA CYS 23 HA CYS 23 10.389 -13.611 -15.911 184 HB2 CYS 23 HB2 CYS 23 7.961 -13.903 -17.698 185 HB3 CYS 23 HB1 CYS 23 8.184 -14.559 -16.082 186 H GLU 24 HN GLU 24 9.650 -16.023 -16.183 187 HA GLU 24 HA GLU 24 10.065 -18.127 -17.044 188 HB2 GLU 24 HB2 GLU 24 10.521 -16.663 -19.671 189 HB3 GLU 24 HB1 GLU 24 10.504 -18.394 -19.490 190 HG2 GLU 24 HG2 GLU 24 8.204 -18.349 -18.718 191 HG3 GLU 24 HG1 GLU 24 8.197 -16.587 -18.742 192 H PHE 25 HN PHE 25 12.333 -15.564 -17.245 193 HA PHE 25 HA PHE 25 14.654 -16.917 -18.092 194 HB2 PHE 25 HB2 PHE 25 14.474 -14.474 -17.907 195 HB3 PHE 25 HB1 PHE 25 14.362 -14.606 -16.156 196 HD1 PHE 25 HD1 PHE 25 16.568 -15.259 -19.090 197 HD2 PHE 25 HD2 PHE 25 16.347 -14.845 -14.817 198 HE1 PHE 25 HE1 PHE 25 19.044 -15.229 -18.961 199 HE2 PHE 25 HE2 PHE 25 18.821 -14.817 -14.693 200 HZ PHE 25 HZ PHE 25 20.170 -15.007 -16.764 201 H GLU 26 HN GLU 26 13.316 -16.412 -14.838 202 HA GLU 26 HA GLU 26 15.372 -18.148 -13.653 203 HB2 GLU 26 HB2 GLU 26 14.302 -17.574 -11.505 204 HB3 GLU 26 HB1 GLU 26 14.777 -16.143 -12.417 205 HG2 GLU 26 HG2 GLU 26 12.463 -15.876 -13.219 206 HG3 GLU 26 HG1 GLU 26 11.979 -17.312 -12.318 207 H GLY 27 HN GLY 27 12.721 -18.789 -15.367 208 HA2 GLY 27 HA3 GLY 27 11.767 -20.925 -15.652 209 HA3 GLY 27 HA2 GLY 27 12.321 -21.389 -14.049 210 H GLY 28 HN GLY 28 10.271 -18.732 -15.272 211 HA2 GLY 28 HA3 GLY 28 7.994 -19.750 -13.672 212 HA3 GLY 28 HA2 GLY 28 8.590 -18.122 -13.370 213 H HIS 29 HN HIS 29 6.568 -17.271 -13.969 214 HA HIS 29 HA HIS 29 6.350 -16.631 -16.774 215 HB2 HIS 29 HB2 HIS 29 4.123 -17.571 -17.128 216 HB3 HIS 29 HB1 HIS 29 5.265 -18.851 -16.729 217 HD1 HIS 29 HD1 HIS 29 5.360 -19.203 -13.893 218 HD2 HIS 29 HD2 HIS 29 1.825 -17.858 -15.646 219 HE1 HIS 29 HE1 HIS 29 3.507 -19.697 -12.239 220 HE2 HIS 29 HE2 HIS 29 1.345 -18.885 -13.293 221 H LEU 30 HN LEU 30 4.108 -15.425 -17.079 222 HA LEU 30 HA LEU 30 4.174 -13.185 -15.301 223 HB2 LEU 30 HB2 LEU 30 2.258 -13.975 -17.507 224 HB3 LEU 30 HB1 LEU 30 2.149 -12.445 -16.644 225 HG LEU 30 HG LEU 30 4.678 -13.317 -18.089 226 HD11 LEU 30 HD11 LEU 30 2.357 -11.646 -19.121 227 HD12 LEU 30 HD12 LEU 30 2.866 -13.218 -19.736 228 HD13 LEU 30 HD13 LEU 30 3.914 -11.812 -19.936 229 HD21 LEU 30 HD21 LEU 30 3.641 -10.662 -17.016 230 HD22 LEU 30 HD22 LEU 30 5.001 -10.771 -18.130 231 HD23 LEU 30 HD23 LEU 30 5.109 -11.506 -16.542 232 H ALA 31 HN ALA 31 2.755 -12.574 -13.724 233 HA ALA 31 HA ALA 31 1.407 -14.571 -12.270 234 HB1 ALA 31 HB1 ALA 31 2.227 -12.570 -11.181 235 HB2 ALA 31 HB2 ALA 31 0.482 -12.662 -10.970 236 HB3 ALA 31 HB3 ALA 31 1.170 -11.560 -12.161 237 H THR 32 HN THR 32 -0.772 -14.978 -11.965 238 HA THR 32 HA THR 32 -2.629 -13.957 -14.058 239 HB THR 32 HB THR 32 -2.734 -16.744 -12.892 240 HG1 THR 32 HG1 THR 32 -1.276 -15.690 -15.043 241 HG21 THR 32 HG21 THR 32 -4.111 -17.189 -14.863 242 HG22 THR 32 HG22 THR 32 -3.855 -15.542 -15.438 243 HG23 THR 32 HG23 THR 32 -4.783 -15.825 -13.968 244 H TYR 33 HN TYR 33 -4.757 -13.680 -13.496 245 HA TYR 33 HA TYR 33 -5.316 -12.749 -10.907 246 HB2 TYR 33 HB2 TYR 33 -6.694 -11.760 -12.492 247 HB3 TYR 33 HB1 TYR 33 -6.856 -13.249 -13.411 248 HD1 TYR 33 HD2 TYR 33 -8.439 -15.007 -12.705 249 HD2 TYR 33 HD1 TYR 33 -8.246 -11.231 -10.660 250 HE1 TYR 33 HE2 TYR 33 -10.629 -15.470 -11.647 251 HE2 TYR 33 HE1 TYR 33 -10.446 -11.703 -9.604 252 HH TYR 33 HH TYR 33 -12.512 -13.192 -10.247 253 H LYS 34 HN LYS 34 -5.371 -15.913 -12.245 254 HA LYS 34 HA LYS 34 -7.281 -17.070 -10.433 255 HB2 LYS 34 HB2 LYS 34 -6.693 -17.952 -12.721 256 HB3 LYS 34 HB1 LYS 34 -5.148 -18.479 -12.060 257 HG2 LYS 34 HG2 LYS 34 -6.434 -19.791 -10.324 258 HG3 LYS 34 HG1 LYS 34 -7.910 -19.389 -11.198 259 HD2 LYS 34 HD2 LYS 34 -5.535 -20.815 -12.442 260 HD3 LYS 34 HD1 LYS 34 -6.948 -21.639 -11.792 261 HE2 LYS 34 HE2 LYS 34 -8.345 -20.186 -13.401 262 HE3 LYS 34 HE1 LYS 34 -6.812 -19.787 -14.184 263 HZ1 LYS 34 HZ1 LYS 34 -8.035 -21.739 -15.126 264 HZ2 LYS 34 HZ2 LYS 34 -7.683 -22.572 -13.688 265 HZ3 LYS 34 HZ3 LYS 34 -6.423 -22.032 -14.693 266 H GLN 35 HN GLN 35 -3.739 -17.401 -10.756 267 HA GLN 35 HA GLN 35 -3.437 -18.734 -8.254 268 HB2 GLN 35 HB2 GLN 35 -1.051 -18.503 -8.603 269 HB3 GLN 35 HB1 GLN 35 -1.815 -18.940 -10.129 270 HG2 GLN 35 HG2 GLN 35 -1.842 -16.487 -10.718 271 HG3 GLN 35 HG1 GLN 35 -0.880 -16.182 -9.278 272 HE21 GLN 35 HE21 GLN 35 -0.795 -17.551 -12.532 273 HE22 GLN 35 HE22 GLN 35 0.885 -17.788 -12.577 274 H LEU 36 HN LEU 36 -3.380 -15.379 -9.248 275 HA LEU 36 HA LEU 36 -2.147 -14.254 -6.976 276 HB2 LEU 36 HB2 LEU 36 -4.056 -13.246 -9.054 277 HB3 LEU 36 HB1 LEU 36 -3.643 -12.195 -7.729 278 HG LEU 36 HG LEU 36 -1.556 -13.497 -9.511 279 HD11 LEU 36 HD11 LEU 36 -2.813 -10.738 -9.708 280 HD12 LEU 36 HD12 LEU 36 -3.008 -12.041 -10.874 281 HD13 LEU 36 HD13 LEU 36 -1.434 -11.290 -10.650 282 HD21 LEU 36 HD21 LEU 36 -1.496 -11.237 -7.473 283 HD22 LEU 36 HD22 LEU 36 -0.210 -11.477 -8.653 284 HD23 LEU 36 HD23 LEU 36 -0.541 -12.718 -7.460 285 H GLU 37 HN GLU 37 -5.487 -15.214 -7.609 286 HA GLU 37 HA GLU 37 -6.824 -13.959 -5.543 287 HB2 GLU 37 HB2 GLU 37 -8.568 -15.470 -5.943 288 HB3 GLU 37 HB1 GLU 37 -7.644 -15.597 -7.434 289 HG2 GLU 37 HG2 GLU 37 -7.978 -17.869 -6.883 290 HG3 GLU 37 HG1 GLU 37 -6.385 -17.559 -6.199 291 H ALA 38 HN ALA 38 -4.592 -16.629 -5.384 292 HA ALA 38 HA ALA 38 -5.226 -17.334 -2.638 293 HB1 ALA 38 HB1 ALA 38 -2.927 -18.186 -4.413 294 HB2 ALA 38 HB2 ALA 38 -4.457 -19.044 -4.226 295 HB3 ALA 38 HB3 ALA 38 -3.353 -18.898 -2.857 296 H ALA 39 HN ALA 39 -3.071 -15.204 -4.315 297 HA ALA 39 HA ALA 39 -1.240 -14.875 -2.076 298 HB1 ALA 39 HB1 ALA 39 -1.467 -13.201 -4.587 299 HB2 ALA 39 HB2 ALA 39 -0.533 -14.694 -4.478 300 HB3 ALA 39 HB3 ALA 39 -0.092 -13.303 -3.486 301 H ARG 40 HN ARG 40 -3.846 -13.010 -3.616 302 HA ARG 40 HA ARG 40 -3.579 -10.656 -2.150 303 HB2 ARG 40 HB2 ARG 40 -5.358 -11.619 -4.081 304 HB3 ARG 40 HB1 ARG 40 -6.410 -11.388 -2.694 305 HG2 ARG 40 HG2 ARG 40 -4.567 -9.283 -3.881 306 HG3 ARG 40 HG1 ARG 40 -6.301 -9.374 -4.142 307 HD2 ARG 40 HD2 ARG 40 -4.939 -8.927 -1.464 308 HD3 ARG 40 HD1 ARG 40 -5.719 -7.690 -2.432 309 HE ARG 40 HE ARG 40 -7.009 -9.572 -0.679 310 HH11 ARG 40 HH21 ARG 40 -7.381 -7.793 -3.607 311 HH12 ARG 40 HH22 ARG 40 -9.084 -7.540 -3.396 312 HH21 ARG 40 HH11 ARG 40 -9.222 -9.167 -0.347 313 HH22 ARG 40 HH12 ARG 40 -10.115 -8.290 -1.543 314 H LYS 41 HN LYS 41 -5.091 -13.712 -1.308 315 HA LYS 41 HA LYS 41 -6.540 -12.919 0.964 316 HB2 LYS 41 HB2 LYS 41 -5.195 -15.535 0.243 317 HB3 LYS 41 HB1 LYS 41 -6.150 -15.344 1.713 318 HG2 LYS 41 HG2 LYS 41 -8.114 -14.714 0.382 319 HG3 LYS 41 HG1 LYS 41 -7.169 -14.839 -1.099 320 HD2 LYS 41 HD2 LYS 41 -6.736 -17.236 -0.600 321 HD3 LYS 41 HD1 LYS 41 -7.743 -17.098 0.840 322 HE2 LYS 41 HE2 LYS 41 -8.685 -16.572 -1.994 323 HE3 LYS 41 HE1 LYS 41 -8.999 -18.046 -1.081 324 HZ1 LYS 41 HZ1 LYS 41 -9.897 -16.357 0.668 325 HZ2 LYS 41 HZ2 LYS 41 -10.872 -16.846 -0.633 326 HZ3 LYS 41 HZ3 LYS 41 -10.075 -15.346 -0.682 327 H ILE 42 HN ILE 42 -3.125 -13.251 0.457 328 HA ILE 42 HA ILE 42 -2.462 -13.427 3.287 329 HB ILE 42 HB ILE 42 -0.551 -12.783 1.021 330 HG12 ILE 42 HG12 ILE 42 -1.782 -14.728 0.276 331 HG13 ILE 42 HG11 ILE 42 -0.211 -15.273 0.854 332 HG21 ILE 42 HG21 ILE 42 0.511 -12.610 3.178 333 HG22 ILE 42 HG22 ILE 42 1.002 -14.155 2.506 334 HG23 ILE 42 HG23 ILE 42 -0.248 -14.096 3.745 335 HD11 ILE 42 HD11 ILE 42 -1.385 -15.718 3.115 336 HD12 ILE 42 HD12 ILE 42 -1.766 -16.808 1.783 337 HD13 ILE 42 HD13 ILE 42 -2.895 -15.527 2.222 338 H GLY 43 HN GLY 43 -4.026 -11.101 2.153 339 HA2 GLY 43 HA3 GLY 43 -4.209 -8.864 2.654 340 HA3 GLY 43 HA2 GLY 43 -2.826 -9.057 3.719 341 H PHE 44 HN PHE 44 -2.518 -9.962 0.387 342 HA PHE 44 HA PHE 44 -0.348 -8.153 -0.009 343 HB2 PHE 44 HB2 PHE 44 -1.159 -10.516 -1.175 344 HB3 PHE 44 HB1 PHE 44 -1.636 -9.371 -2.413 345 HD1 PHE 44 HD1 PHE 44 1.212 -10.737 -0.501 346 HD2 PHE 44 HD2 PHE 44 0.036 -8.121 -3.701 347 HE1 PHE 44 HE1 PHE 44 3.567 -10.606 -1.260 348 HE2 PHE 44 HE2 PHE 44 2.395 -7.994 -4.459 349 HZ PHE 44 HZ PHE 44 4.158 -9.233 -3.236 350 H HIS 45 HN HIS 45 -0.360 -6.124 -0.729 351 HA HIS 45 HA HIS 45 -2.725 -5.083 -2.202 352 HB2 HIS 45 HB2 HIS 45 -3.105 -4.392 0.058 353 HB3 HIS 45 HB1 HIS 45 -1.424 -3.921 0.273 354 HD1 HIS 45 HD1 HIS 45 -4.282 -2.979 -2.099 355 HD2 HIS 45 HD2 HIS 45 -1.121 -1.199 -0.044 356 HE1 HIS 45 HE1 HIS 45 -4.413 -0.497 -2.591 357 HE2 HIS 45 HE2 HIS 45 -2.491 0.601 -1.348 358 H VAL 46 HN VAL 46 -1.949 -4.584 -4.130 359 HA VAL 46 HA VAL 46 0.388 -2.777 -4.309 360 HB VAL 46 HB VAL 46 1.116 -4.139 -6.381 361 HG11 VAL 46 HG11 VAL 46 1.384 -5.419 -3.645 362 HG12 VAL 46 HG12 VAL 46 2.380 -4.097 -4.257 363 HG13 VAL 46 HG13 VAL 46 2.453 -5.679 -5.024 364 HG21 VAL 46 HG21 VAL 46 -0.861 -5.571 -6.613 365 HG22 VAL 46 HG22 VAL 46 -0.625 -6.211 -4.992 366 HG23 VAL 46 HG23 VAL 46 0.544 -6.567 -6.257 367 H CYS 47 HN CYS 47 -0.397 -1.013 -5.194 368 HA CYS 47 HA CYS 47 -2.580 -1.134 -7.171 369 HB2 CYS 47 HB2 CYS 47 -2.742 0.490 -5.320 370 HB3 CYS 47 HB1 CYS 47 -1.240 1.246 -5.857 371 H ALA 48 HN ALA 48 -1.024 -2.189 -8.697 372 HA ALA 48 HA ALA 48 0.214 -0.123 -10.396 373 HB1 ALA 48 HB1 ALA 48 1.681 -2.600 -9.451 374 HB2 ALA 48 HB2 ALA 48 2.055 -0.938 -8.994 375 HB3 ALA 48 HB3 ALA 48 2.264 -1.461 -10.665 376 H ALA 49 HN ALA 49 -0.619 -0.383 -12.336 377 HA ALA 49 HA ALA 49 -1.880 -2.850 -13.173 378 HB1 ALA 49 HB1 ALA 49 -1.480 -0.181 -14.529 379 HB2 ALA 49 HB2 ALA 49 -2.947 -0.776 -13.755 380 HB3 ALA 49 HB3 ALA 49 -2.370 -1.528 -15.243 381 H GLY 50 HN GLY 50 -1.099 -4.365 -14.504 382 HA2 GLY 50 HA3 GLY 50 1.377 -3.837 -16.059 383 HA3 GLY 50 HA2 GLY 50 1.346 -5.176 -14.923 384 H TRP 51 HN TRP 51 1.567 -6.801 -16.392 385 HA TRP 51 HA TRP 51 -0.746 -7.309 -18.194 386 HB2 TRP 51 HB2 TRP 51 2.209 -7.375 -18.798 387 HB3 TRP 51 HB1 TRP 51 1.148 -8.499 -19.638 388 HD1 TRP 51 HD1 TRP 51 2.572 -5.238 -20.116 389 HE1 TRP 51 HE1 TRP 51 1.181 -3.799 -21.726 390 HE3 TRP 51 HE3 TRP 51 -1.777 -7.939 -20.239 391 HZ2 TRP 51 HZ2 TRP 51 -1.405 -3.777 -22.925 392 HZ3 TRP 51 HZ3 TRP 51 -3.679 -7.171 -21.625 393 HH2 TRP 51 HH2 TRP 51 -3.499 -5.100 -22.969 394 H MET 52 HN MET 52 -1.753 -8.895 -17.134 395 HA MET 52 HA MET 52 -0.244 -11.057 -15.839 396 HB2 MET 52 HB2 MET 52 -3.237 -10.658 -16.041 397 HB3 MET 52 HB1 MET 52 -2.401 -11.778 -14.994 398 HG2 MET 52 HG2 MET 52 -1.902 -8.800 -14.832 399 HG3 MET 52 HG1 MET 52 -3.181 -9.587 -13.914 400 HE1 MET 52 HE1 MET 52 -1.462 -8.003 -12.419 401 HE2 MET 52 HE2 MET 52 -0.693 -8.955 -11.154 402 HE3 MET 52 HE3 MET 52 -2.402 -9.191 -11.507 403 H ALA 53 HN ALA 53 -0.674 -13.263 -16.330 404 HA ALA 53 HA ALA 53 -0.343 -14.015 -18.942 405 HB1 ALA 53 HB1 ALA 53 -1.044 -16.258 -18.300 406 HB2 ALA 53 HB2 ALA 53 -1.834 -15.620 -16.857 407 HB3 ALA 53 HB3 ALA 53 -0.081 -15.535 -17.013 408 H LYS 54 HN LYS 54 -1.842 -15.386 -20.281 409 HA LYS 54 HA LYS 54 -3.635 -15.478 -21.703 410 HB2 LYS 54 HB2 LYS 54 -5.090 -14.836 -19.124 411 HB3 LYS 54 HB1 LYS 54 -5.894 -15.300 -20.622 412 HG2 LYS 54 HG2 LYS 54 -4.676 -17.434 -20.637 413 HG3 LYS 54 HG1 LYS 54 -3.835 -16.972 -19.154 414 HD2 LYS 54 HD2 LYS 54 -6.004 -16.815 -17.978 415 HD3 LYS 54 HD1 LYS 54 -6.835 -17.298 -19.457 416 HE2 LYS 54 HE2 LYS 54 -5.646 -19.448 -19.445 417 HE3 LYS 54 HE1 LYS 54 -4.771 -18.967 -17.988 418 HZ1 LYS 54 HZ1 LYS 54 -7.081 -18.614 -17.003 419 HZ2 LYS 54 HZ2 LYS 54 -6.546 -20.215 -17.198 420 HZ3 LYS 54 HZ3 LYS 54 -7.650 -19.545 -18.302 421 H GLY 55 HN GLY 55 -2.236 -13.015 -21.659 422 HA2 GLY 55 HA3 GLY 55 -2.406 -10.818 -22.336 423 HA3 GLY 55 HA2 GLY 55 -3.857 -11.358 -23.170 424 H ARG 56 HN ARG 56 -4.153 -11.956 -19.897 425 HA ARG 56 HA ARG 56 -6.095 -9.803 -19.584 426 HB2 ARG 56 HB2 ARG 56 -5.464 -12.407 -18.273 427 HB3 ARG 56 HB1 ARG 56 -6.127 -11.194 -17.222 428 HG2 ARG 56 HG2 ARG 56 -8.055 -10.937 -18.647 429 HG3 ARG 56 HG1 ARG 56 -7.375 -12.048 -19.834 430 HD2 ARG 56 HD2 ARG 56 -9.021 -13.216 -18.461 431 HD3 ARG 56 HD1 ARG 56 -7.415 -13.841 -18.109 432 HE ARG 56 HE ARG 56 -7.762 -11.868 -16.244 433 HH11 ARG 56 HH21 ARG 56 -9.609 -14.612 -17.273 434 HH12 ARG 56 HH22 ARG 56 -10.212 -14.970 -15.690 435 HH21 ARG 56 HH11 ARG 56 -8.519 -12.376 -14.156 436 HH22 ARG 56 HH12 ARG 56 -9.590 -13.719 -13.935 437 H VAL 57 HN VAL 57 -6.140 -8.531 -17.580 438 HA VAL 57 HA VAL 57 -3.503 -8.008 -16.349 439 HB VAL 57 HB VAL 57 -3.516 -6.424 -18.179 440 HG11 VAL 57 HG11 VAL 57 -6.228 -5.542 -17.144 441 HG12 VAL 57 HG12 VAL 57 -5.958 -6.498 -18.604 442 HG13 VAL 57 HG13 VAL 57 -5.344 -4.851 -18.501 443 HG21 VAL 57 HG21 VAL 57 -2.832 -5.649 -15.831 444 HG22 VAL 57 HG22 VAL 57 -4.410 -4.869 -15.720 445 HG23 VAL 57 HG23 VAL 57 -3.265 -4.372 -16.965 446 H GLY 58 HN GLY 58 -3.610 -7.523 -14.252 447 HA2 GLY 58 HA3 GLY 58 -6.177 -6.643 -13.061 448 HA3 GLY 58 HA2 GLY 58 -5.420 -8.120 -12.474 449 H TYR 59 HN TYR 59 -5.989 -5.793 -10.954 450 HA TYR 59 HA TYR 59 -3.447 -5.438 -9.677 451 HB2 TYR 59 HB2 TYR 59 -3.353 -2.957 -9.912 452 HB3 TYR 59 HB1 TYR 59 -3.013 -3.839 -11.387 453 HD1 TYR 59 HD2 TYR 59 -4.791 -4.024 -13.185 454 HD2 TYR 59 HD1 TYR 59 -5.211 -1.417 -9.790 455 HE1 TYR 59 HE2 TYR 59 -6.547 -2.754 -14.376 456 HE2 TYR 59 HE1 TYR 59 -6.968 -0.148 -10.990 457 HH TYR 59 HH TYR 59 -7.548 0.251 -13.512 458 HA PRO 60 HA PRO 60 -7.230 -5.246 -6.983 459 HB2 PRO 60 HB2 PRO 60 -5.135 -6.335 -5.112 460 HB3 PRO 60 HB1 PRO 60 -6.821 -6.853 -5.330 461 HG2 PRO 60 HG2 PRO 60 -4.833 -8.304 -6.330 462 HG3 PRO 60 HG1 PRO 60 -6.324 -8.064 -7.259 463 HD2 PRO 60 HD2 PRO 60 -3.649 -6.732 -7.639 464 HD3 PRO 60 HD1 PRO 60 -4.812 -7.288 -8.867 465 H ILE 61 HN ILE 61 -7.760 -3.690 -5.494 466 HA ILE 61 HA ILE 61 -5.600 -1.954 -4.394 467 HB ILE 61 HB ILE 61 -8.185 -0.992 -5.665 468 HG12 ILE 61 HG12 ILE 61 -5.309 -0.519 -6.531 469 HG13 ILE 61 HG11 ILE 61 -6.348 -1.746 -7.242 470 HG21 ILE 61 HG21 ILE 61 -7.101 1.276 -5.261 471 HG22 ILE 61 HG22 ILE 61 -5.916 0.451 -4.252 472 HG23 ILE 61 HG23 ILE 61 -7.620 0.440 -3.800 473 HD11 ILE 61 HD11 ILE 61 -7.969 -0.016 -7.906 474 HD12 ILE 61 HD12 ILE 61 -6.379 0.311 -8.594 475 HD13 ILE 61 HD13 ILE 61 -6.938 1.223 -7.192 476 H VAL 62 HN VAL 62 -5.810 -2.908 -2.379 477 HA VAL 62 HA VAL 62 -8.369 -3.045 -1.018 478 HB VAL 62 HB VAL 62 -5.571 -3.406 0.085 479 HG11 VAL 62 HG11 VAL 62 -7.192 -3.044 1.856 480 HG12 VAL 62 HG12 VAL 62 -6.823 -4.765 1.799 481 HG13 VAL 62 HG13 VAL 62 -8.328 -4.163 1.105 482 HG21 VAL 62 HG21 VAL 62 -6.024 -4.957 -1.769 483 HG22 VAL 62 HG22 VAL 62 -7.564 -5.406 -1.037 484 HG23 VAL 62 HG23 VAL 62 -6.051 -5.827 -0.236 485 H LYS 63 HN LYS 63 -5.873 -0.722 -1.433 486 HA LYS 63 HA LYS 63 -7.228 1.118 0.458 487 HB2 LYS 63 HB2 LYS 63 -4.240 0.636 0.358 488 HB3 LYS 63 HB1 LYS 63 -5.053 1.882 1.307 489 HG2 LYS 63 HG2 LYS 63 -6.385 0.010 2.415 490 HG3 LYS 63 HG1 LYS 63 -5.299 -1.124 1.615 491 HD2 LYS 63 HD2 LYS 63 -3.366 -0.056 2.728 492 HD3 LYS 63 HD1 LYS 63 -4.459 1.069 3.534 493 HE2 LYS 63 HE2 LYS 63 -3.938 -0.759 5.061 494 HE3 LYS 63 HE1 LYS 63 -5.629 -0.880 4.572 495 HZ1 LYS 63 HZ1 LYS 63 -4.317 -2.293 2.667 496 HZ2 LYS 63 HZ2 LYS 63 -5.125 -2.957 4.004 497 HZ3 LYS 63 HZ3 LYS 63 -3.452 -2.679 4.075 498 HA PRO 64 HA PRO 64 -6.621 3.036 -3.741 499 HB2 PRO 64 HB2 PRO 64 -8.726 4.793 -2.483 500 HB3 PRO 64 HB1 PRO 64 -8.645 4.155 -4.140 501 HG2 PRO 64 HG2 PRO 64 -10.304 3.069 -2.379 502 HG3 PRO 64 HG1 PRO 64 -9.383 2.036 -3.494 503 HD2 PRO 64 HD2 PRO 64 -8.883 2.551 -0.566 504 HD3 PRO 64 HD1 PRO 64 -8.697 1.041 -1.489 505 H GLY 65 HN GLY 65 -5.229 4.661 -4.200 506 HA2 GLY 65 HA3 GLY 65 -4.458 6.554 -2.024 507 HA3 GLY 65 HA2 GLY 65 -3.338 5.845 -3.178 508 HA PRO 66 HA PRO 66 -5.008 10.024 -4.657 509 HB2 PRO 66 HB2 PRO 66 -2.636 11.427 -4.524 510 HB3 PRO 66 HB1 PRO 66 -3.770 11.318 -3.161 511 HG2 PRO 66 HG2 PRO 66 -1.302 9.684 -3.688 512 HG3 PRO 66 HG1 PRO 66 -1.815 10.479 -2.183 513 HD2 PRO 66 HD2 PRO 66 -2.230 7.837 -2.557 514 HD3 PRO 66 HD1 PRO 66 -3.439 8.833 -1.714 515 H ASN 67 HN ASN 67 -1.802 8.600 -5.289 516 HA ASN 67 HA ASN 67 -1.601 9.521 -7.969 517 HB2 ASN 67 HB2 ASN 67 0.255 7.937 -8.159 518 HB3 ASN 67 HB1 ASN 67 0.350 8.816 -6.634 519 HD21 ASN 67 HD21 ASN 67 1.574 6.218 -7.032 520 HD22 ASN 67 HD22 ASN 67 0.783 5.118 -6.010 521 H CYS 68 HN CYS 68 -2.883 6.577 -6.509 522 HA CYS 68 HA CYS 68 -4.364 5.984 -8.950 523 HB2 CYS 68 HB2 CYS 68 -3.527 3.745 -9.245 524 HB3 CYS 68 HB1 CYS 68 -2.152 4.844 -9.280 525 H GLY 69 HN GLY 69 -6.348 5.577 -8.288 526 HA2 GLY 69 HA3 GLY 69 -6.958 3.613 -6.289 527 HA3 GLY 69 HA2 GLY 69 -7.223 5.253 -5.706 528 H PHE 70 HN PHE 70 -8.233 2.836 -8.019 529 HA PHE 70 HA PHE 70 -10.201 4.349 -9.363 530 HB2 PHE 70 HB2 PHE 70 -9.119 2.011 -9.908 531 HB3 PHE 70 HB1 PHE 70 -10.438 1.360 -8.944 532 HD1 PHE 70 HD1 PHE 70 -9.686 3.590 -11.849 533 HD2 PHE 70 HD2 PHE 70 -12.608 1.098 -9.933 534 HE1 PHE 70 HE1 PHE 70 -11.170 3.803 -13.825 535 HE2 PHE 70 HE2 PHE 70 -14.092 1.314 -11.902 536 HZ PHE 70 HZ PHE 70 -13.373 2.666 -13.852 537 H GLY 71 HN GLY 71 -12.546 4.014 -9.197 538 HA2 GLY 71 HA3 GLY 71 -13.530 4.597 -6.621 539 HA3 GLY 71 HA2 GLY 71 -14.522 4.150 -8.005 540 H LYS 72 HN LYS 72 -13.548 1.578 -8.480 541 HA LYS 72 HA LYS 72 -15.022 0.066 -6.550 542 HB2 LYS 72 HB2 LYS 72 -13.149 -0.882 -8.735 543 HB3 LYS 72 HB1 LYS 72 -14.288 -1.890 -7.854 544 HG2 LYS 72 HG2 LYS 72 -15.326 0.572 -9.282 545 HG3 LYS 72 HG1 LYS 72 -14.958 -0.860 -10.234 546 HD2 LYS 72 HD2 LYS 72 -16.681 -1.150 -7.757 547 HD3 LYS 72 HD1 LYS 72 -17.401 -0.531 -9.240 548 HE2 LYS 72 HE2 LYS 72 -16.700 -2.542 -10.457 549 HE3 LYS 72 HE1 LYS 72 -15.902 -3.166 -9.016 550 HZ1 LYS 72 HZ1 LYS 72 -17.917 -4.190 -8.865 551 HZ2 LYS 72 HZ2 LYS 72 -18.763 -2.914 -9.600 552 HZ3 LYS 72 HZ3 LYS 72 -18.255 -2.783 -7.984 553 H THR 73 HN THR 73 -14.077 -1.894 -5.487 554 HA THR 73 HA THR 73 -11.273 -1.567 -4.603 555 HB THR 73 HB THR 73 -11.921 -1.873 -2.261 556 HG1 THR 73 HG1 THR 73 -14.081 -1.844 -1.702 557 HG21 THR 73 HG21 THR 73 -12.873 0.346 -1.886 558 HG22 THR 73 HG22 THR 73 -13.420 0.418 -3.559 559 HG23 THR 73 HG23 THR 73 -11.695 0.415 -3.194 560 H GLY 74 HN GLY 74 -10.416 -3.454 -3.545 561 HA2 GLY 74 HA3 GLY 74 -10.420 -5.758 -2.992 562 HA3 GLY 74 HA2 GLY 74 -11.894 -5.984 -3.926 563 H ILE 75 HN ILE 75 -11.285 -7.554 -5.308 564 HA ILE 75 HA ILE 75 -8.731 -7.400 -6.752 565 HB ILE 75 HB ILE 75 -10.948 -9.464 -6.880 566 HG12 ILE 75 HG12 ILE 75 -8.261 -9.560 -5.468 567 HG13 ILE 75 HG11 ILE 75 -9.778 -9.210 -4.647 568 HG21 ILE 75 HG21 ILE 75 -9.042 -10.849 -7.884 569 HG22 ILE 75 HG22 ILE 75 -8.140 -9.348 -8.035 570 HG23 ILE 75 HG23 ILE 75 -9.651 -9.556 -8.910 571 HD11 ILE 75 HD11 ILE 75 -10.635 -11.438 -5.577 572 HD12 ILE 75 HD12 ILE 75 -9.398 -11.542 -4.328 573 HD13 ILE 75 HD13 ILE 75 -8.962 -11.776 -6.022 574 H ILE 76 HN ILE 76 -8.586 -6.306 -8.584 575 HA ILE 76 HA ILE 76 -11.008 -5.692 -10.158 576 HB ILE 76 HB ILE 76 -8.174 -4.714 -10.614 577 HG12 ILE 76 HG12 ILE 76 -8.780 -4.041 -8.368 578 HG13 ILE 76 HG11 ILE 76 -8.940 -2.638 -9.419 579 HG21 ILE 76 HG21 ILE 76 -9.346 -2.879 -11.797 580 HG22 ILE 76 HG22 ILE 76 -10.890 -3.664 -11.465 581 HG23 ILE 76 HG23 ILE 76 -9.709 -4.450 -12.511 582 HD11 ILE 76 HD11 ILE 76 -10.898 -2.587 -8.104 583 HD12 ILE 76 HD12 ILE 76 -11.122 -4.330 -8.202 584 HD13 ILE 76 HD13 ILE 76 -11.445 -3.320 -9.610 585 H ASP 77 HN ASP 77 -11.488 -7.502 -11.320 586 HA ASP 77 HA ASP 77 -9.383 -8.775 -12.954 587 HB2 ASP 77 HB2 ASP 77 -10.945 -10.171 -11.551 588 HB3 ASP 77 HB1 ASP 77 -12.263 -9.639 -12.593 589 H TYR 78 HN TYR 78 -9.421 -8.783 -15.137 590 HA TYR 78 HA TYR 78 -11.563 -7.275 -16.552 591 HB2 TYR 78 HB2 TYR 78 -8.567 -6.901 -16.681 592 HB3 TYR 78 HB1 TYR 78 -9.542 -6.563 -18.106 593 HD1 TYR 78 HD2 TYR 78 -11.627 -5.036 -17.769 594 HD2 TYR 78 HD1 TYR 78 -8.309 -5.179 -15.037 595 HE1 TYR 78 HE2 TYR 78 -12.242 -2.797 -16.902 596 HE2 TYR 78 HE1 TYR 78 -8.928 -2.936 -14.179 597 HH TYR 78 HH TYR 78 -11.922 -1.422 -14.974 598 H GLY 79 HN GLY 79 -12.050 -7.972 -18.607 599 HA2 GLY 79 HA3 GLY 79 -11.633 -10.746 -19.138 600 HA3 GLY 79 HA2 GLY 79 -12.472 -9.595 -20.175 601 H ILE 80 HN ILE 80 -11.133 -8.167 -21.516 602 HA ILE 80 HA ILE 80 -8.335 -8.834 -21.927 603 HB ILE 80 HB ILE 80 -10.317 -9.465 -24.155 604 HG12 ILE 80 HG12 ILE 80 -8.574 -11.288 -22.441 605 HG13 ILE 80 HG11 ILE 80 -10.333 -11.279 -22.511 606 HG21 ILE 80 HG21 ILE 80 -8.328 -10.148 -25.437 607 HG22 ILE 80 HG22 ILE 80 -7.290 -9.770 -24.068 608 HG23 ILE 80 HG23 ILE 80 -8.131 -8.484 -24.922 609 HD11 ILE 80 HD11 ILE 80 -9.649 -13.119 -23.819 610 HD12 ILE 80 HD12 ILE 80 -8.419 -12.168 -24.651 611 HD13 ILE 80 HD13 ILE 80 -10.130 -11.866 -24.962 612 H ARG 81 HN ARG 81 -7.586 -6.807 -21.967 613 HA ARG 81 HA ARG 81 -9.088 -4.583 -22.962 614 HB2 ARG 81 HB2 ARG 81 -6.110 -4.782 -22.416 615 HB3 ARG 81 HB1 ARG 81 -7.009 -3.290 -22.691 616 HG2 ARG 81 HG2 ARG 81 -8.508 -4.079 -20.690 617 HG3 ARG 81 HG1 ARG 81 -7.185 -5.189 -20.333 618 HD2 ARG 81 HD2 ARG 81 -6.862 -3.170 -19.031 619 HD3 ARG 81 HD1 ARG 81 -5.628 -3.205 -20.292 620 HE ARG 81 HE ARG 81 -7.814 -1.802 -21.314 621 HH11 ARG 81 HH21 ARG 81 -5.482 -1.563 -18.765 622 HH12 ARG 81 HH22 ARG 81 -5.585 0.163 -18.651 623 HH21 ARG 81 HH11 ARG 81 -7.943 0.455 -21.176 624 HH22 ARG 81 HH12 ARG 81 -6.975 1.304 -20.018 625 H LEU 82 HN LEU 82 -9.004 -3.526 -24.900 626 HA LEU 82 HA LEU 82 -7.937 -5.026 -27.180 627 HB2 LEU 82 HB2 LEU 82 -9.398 -2.374 -27.221 628 HB3 LEU 82 HB1 LEU 82 -9.214 -3.526 -28.545 629 HG LEU 82 HG LEU 82 -10.760 -3.981 -25.973 630 HD11 LEU 82 HD11 LEU 82 -11.841 -2.471 -27.618 631 HD12 LEU 82 HD12 LEU 82 -12.722 -3.989 -27.440 632 HD13 LEU 82 HD13 LEU 82 -11.690 -3.727 -28.848 633 HD21 LEU 82 HD21 LEU 82 -11.513 -6.090 -27.296 634 HD22 LEU 82 HD22 LEU 82 -9.916 -6.124 -26.565 635 HD23 LEU 82 HD23 LEU 82 -10.084 -5.814 -28.294 636 H ASN 83 HN ASN 83 -6.823 -2.625 -25.121 637 HA ASN 83 HA ASN 83 -5.195 -1.204 -27.073 638 HB2 ASN 83 HB2 ASN 83 -4.462 0.152 -25.253 639 HB3 ASN 83 HB1 ASN 83 -6.190 -0.093 -25.052 640 HD21 ASN 83 HD21 ASN 83 -6.600 -0.302 -22.864 641 HD22 ASN 83 HD22 ASN 83 -5.667 -1.221 -21.785 642 H ARG 84 HN ARG 84 -4.894 -4.161 -26.559 643 HA ARG 84 HA ARG 84 -2.561 -4.744 -25.149 644 HB2 ARG 84 HB2 ARG 84 -3.951 -6.057 -27.473 645 HB3 ARG 84 HB1 ARG 84 -2.335 -6.625 -27.052 646 HG2 ARG 84 HG2 ARG 84 -3.114 -6.984 -24.701 647 HG3 ARG 84 HG1 ARG 84 -4.731 -6.510 -25.192 648 HD2 ARG 84 HD2 ARG 84 -3.251 -8.771 -26.538 649 HD3 ARG 84 HD1 ARG 84 -4.231 -9.033 -25.104 650 HE ARG 84 HE ARG 84 -5.709 -7.675 -27.154 651 HH11 ARG 84 HH21 ARG 84 -4.549 -10.715 -25.977 652 HH12 ARG 84 HH22 ARG 84 -5.645 -11.669 -26.922 653 HH21 ARG 84 HH11 ARG 84 -7.163 -8.938 -28.415 654 HH22 ARG 84 HH12 ARG 84 -7.114 -10.665 -28.301 655 H SER 85 HN SER 85 -2.781 -2.639 -27.705 656 HA SER 85 HA SER 85 -0.081 -3.135 -28.765 657 HB2 SER 85 HB2 SER 85 -2.239 -1.146 -29.481 658 HB3 SER 85 HB1 SER 85 -0.649 -1.177 -30.240 659 HG SER 85 HG SER 85 -1.077 -3.272 -30.939 660 H GLU 86 HN GLU 86 -1.418 -1.563 -26.154 661 HA GLU 86 HA GLU 86 0.325 0.771 -26.141 662 HB2 GLU 86 HB2 GLU 86 -2.124 0.394 -25.105 663 HB3 GLU 86 HB1 GLU 86 -1.196 -0.081 -23.693 664 HG2 GLU 86 HG2 GLU 86 -1.553 2.261 -23.417 665 HG3 GLU 86 HG1 GLU 86 0.101 2.139 -24.011 666 H ARG 87 HN ARG 87 0.741 0.675 -23.266 667 HA ARG 87 HA ARG 87 2.593 -1.587 -22.867 668 HB2 ARG 87 HB2 ARG 87 3.413 1.327 -22.683 669 HB3 ARG 87 HB1 ARG 87 4.368 -0.032 -22.094 670 HG2 ARG 87 HG2 ARG 87 4.458 -0.979 -24.367 671 HG3 ARG 87 HG1 ARG 87 3.500 0.375 -24.968 672 HD2 ARG 87 HD2 ARG 87 5.246 1.953 -24.250 673 HD3 ARG 87 HD1 ARG 87 6.209 0.612 -23.636 674 HE ARG 87 HE ARG 87 6.849 0.124 -25.828 675 HH11 ARG 87 HH21 ARG 87 4.117 2.227 -25.751 676 HH12 ARG 87 HH22 ARG 87 4.163 2.593 -27.442 677 HH21 ARG 87 HH11 ARG 87 6.944 0.620 -28.059 678 HH22 ARG 87 HH12 ARG 87 5.769 1.692 -28.745 679 H TRP 88 HN TRP 88 3.092 -2.007 -20.730 680 HA TRP 88 HA TRP 88 1.932 -0.401 -18.580 681 HB2 TRP 88 HB2 TRP 88 0.968 -3.218 -19.123 682 HB3 TRP 88 HB1 TRP 88 0.615 -2.287 -17.677 683 HD1 TRP 88 HD1 TRP 88 -0.153 -2.394 -21.422 684 HE1 TRP 88 HE1 TRP 88 -2.259 -0.981 -21.865 685 HE3 TRP 88 HE3 TRP 88 -0.815 -0.347 -16.806 686 HZ2 TRP 88 HZ2 TRP 88 -3.999 0.788 -20.445 687 HZ3 TRP 88 HZ3 TRP 88 -2.702 1.202 -16.370 688 HH2 TRP 88 HH2 TRP 88 -4.294 1.770 -18.185 689 H ASP 89 HN ASP 89 2.257 -1.722 -16.428 690 HA ASP 89 HA ASP 89 5.016 -2.118 -16.077 691 HB2 ASP 89 HB2 ASP 89 3.234 -1.539 -14.326 692 HB3 ASP 89 HB1 ASP 89 2.876 -3.262 -14.267 693 H ALA 90 HN ALA 90 5.016 -4.497 -14.451 694 HA ALA 90 HA ALA 90 4.246 -6.776 -16.014 695 HB1 ALA 90 HB1 ALA 90 6.563 -7.514 -16.586 696 HB2 ALA 90 HB2 ALA 90 7.151 -5.927 -16.092 697 HB3 ALA 90 HB3 ALA 90 6.056 -6.072 -17.465 698 H TYR 91 HN TYR 91 4.411 -8.643 -14.863 699 HA TYR 91 HA TYR 91 5.999 -8.679 -12.367 700 HB2 TYR 91 HB2 TYR 91 3.127 -9.640 -12.375 701 HB3 TYR 91 HB1 TYR 91 4.175 -9.317 -10.997 702 HD1 TYR 91 HD2 TYR 91 5.162 -6.798 -10.967 703 HD2 TYR 91 HD1 TYR 91 1.482 -8.002 -12.848 704 HE1 TYR 91 HE2 TYR 91 4.316 -4.470 -10.823 705 HE2 TYR 91 HE1 TYR 91 0.646 -5.679 -12.693 706 HH TYR 91 HH TYR 91 1.195 -3.556 -12.248 707 H CYS 92 HN CYS 92 6.764 -10.669 -11.819 708 HA CYS 92 HA CYS 92 6.113 -12.955 -13.629 709 HB2 CYS 92 HB2 CYS 92 8.714 -12.563 -12.134 710 HB3 CYS 92 HB1 CYS 92 8.333 -13.819 -13.298 711 H TYR 93 HN TYR 93 7.315 -14.950 -12.261 712 HA TYR 93 HA TYR 93 6.411 -15.007 -9.491 713 HB2 TYR 93 HB2 TYR 93 4.288 -15.442 -10.497 714 HB3 TYR 93 HB1 TYR 93 4.992 -16.519 -11.695 715 HD1 TYR 93 HD1 TYR 93 4.039 -16.166 -8.128 716 HD2 TYR 93 HD2 TYR 93 5.508 -18.838 -11.154 717 HE1 TYR 93 HE1 TYR 93 3.623 -18.093 -6.628 718 HE2 TYR 93 HE2 TYR 93 5.091 -20.765 -9.651 719 HH TYR 93 HH TYR 93 4.246 -21.430 -7.709 720 H ASN 94 HN ASN 94 7.355 -16.607 -8.310 721 HA ASN 94 HA ASN 94 8.831 -18.731 -9.665 722 HB2 ASN 94 HB2 ASN 94 10.964 -18.067 -8.404 723 HB3 ASN 94 HB1 ASN 94 10.521 -17.076 -9.791 724 HD21 ASN 94 HD21 ASN 94 9.973 -14.866 -9.416 725 HD22 ASN 94 HD22 ASN 94 10.030 -14.153 -7.877 726 HA PRO 95 HA PRO 95 7.754 -21.308 -6.196 727 HB2 PRO 95 HB2 PRO 95 10.737 -21.773 -5.983 728 HB3 PRO 95 HB1 PRO 95 9.415 -22.958 -5.919 729 HG2 PRO 95 HG2 PRO 95 10.866 -22.603 -8.146 730 HG3 PRO 95 HG1 PRO 95 9.131 -22.963 -8.217 731 HD2 PRO 95 HD2 PRO 95 10.522 -20.401 -8.844 732 HD3 PRO 95 HD1 PRO 95 8.923 -20.978 -9.363 733 H HIS 96 HN HIS 96 7.818 -21.337 -3.881 734 HA HIS 96 HA HIS 96 8.261 -18.896 -2.589 735 HB2 HIS 96 HB2 HIS 96 8.133 -21.674 -1.388 736 HB3 HIS 96 HB1 HIS 96 7.988 -20.168 -0.488 737 HD1 HIS 96 HD1 HIS 96 5.866 -18.649 -1.065 738 HD2 HIS 96 HD2 HIS 96 5.784 -22.500 -2.657 739 HE1 HIS 96 HE1 HIS 96 3.462 -19.100 -1.729 740 HE2 HIS 96 HE2 HIS 96 3.396 -21.445 -2.700 741 H ALA 97 HN ALA 97 10.170 -17.943 -2.491 742 HA ALA 97 HA ALA 97 12.285 -19.047 -0.910 743 HB1 ALA 97 HB1 ALA 97 12.840 -20.286 -2.922 744 HB2 ALA 97 HB2 ALA 97 14.011 -18.981 -2.742 745 HB3 ALA 97 HB3 ALA 97 12.698 -18.832 -3.909 746 H LYS 98 HN LYS 98 11.117 -16.719 -3.230 747 HA LYS 98 HA LYS 98 12.164 -14.540 -1.565 748 HB2 LYS 98 HB2 LYS 98 12.932 -14.936 -4.467 749 HB3 LYS 98 HB1 LYS 98 12.950 -13.348 -3.702 750 HG2 LYS 98 HG2 LYS 98 14.529 -14.170 -2.001 751 HG3 LYS 98 HG1 LYS 98 14.487 -15.774 -2.720 752 HD2 LYS 98 HD2 LYS 98 16.456 -14.796 -3.622 753 HD3 LYS 98 HD1 LYS 98 15.270 -14.651 -4.912 754 HE2 LYS 98 HE2 LYS 98 14.924 -12.318 -4.453 755 HE3 LYS 98 HE1 LYS 98 15.793 -12.420 -2.921 756 HZ1 LYS 98 HZ1 LYS 98 17.817 -12.825 -4.068 757 HZ2 LYS 98 HZ2 LYS 98 17.095 -11.459 -4.777 758 HZ3 LYS 98 HZ3 LYS 98 17.025 -12.964 -5.561 Start of MODEL 17 1 H1 GLY 1 H1 GLY 1 8.089 -14.953 -4.031 2 H2 GLY 1 H2 GLY 1 8.139 -16.639 -3.828 3 H3 GLY 1 H3 GLY 1 6.956 -15.718 -3.026 4 HA2 GLY 1 HA3 GLY 1 6.914 -16.827 -5.649 5 HA3 GLY 1 HA2 GLY 1 5.591 -16.140 -4.705 6 H VAL 2 HN VAL 2 4.789 -14.222 -5.311 7 HA VAL 2 HA VAL 2 5.925 -12.868 -7.619 8 HB VAL 2 HB VAL 2 3.492 -13.195 -7.430 9 HG11 VAL 2 HG11 VAL 2 2.188 -12.051 -5.753 10 HG12 VAL 2 HG12 VAL 2 3.616 -11.233 -5.122 11 HG13 VAL 2 HG13 VAL 2 3.435 -12.976 -4.920 12 HG21 VAL 2 HG21 VAL 2 2.841 -10.967 -8.085 13 HG22 VAL 2 HG22 VAL 2 4.490 -11.213 -8.650 14 HG23 VAL 2 HG23 VAL 2 4.188 -10.249 -7.205 15 H TYR 3 HN TYR 3 6.609 -10.741 -7.705 16 HA TYR 3 HA TYR 3 6.971 -9.269 -5.181 17 HB2 TYR 3 HB2 TYR 3 9.338 -8.898 -5.565 18 HB3 TYR 3 HB1 TYR 3 9.012 -10.622 -5.436 19 HD1 TYR 3 HD2 TYR 3 8.694 -11.964 -7.616 20 HD2 TYR 3 HD1 TYR 3 10.446 -8.036 -7.506 21 HE1 TYR 3 HE2 TYR 3 9.758 -12.361 -9.821 22 HE2 TYR 3 HE1 TYR 3 11.508 -8.452 -9.705 23 HH TYR 3 HH TYR 3 11.770 -9.872 -11.380 24 H HIS 4 HN HIS 4 7.700 -7.060 -5.525 25 HA HIS 4 HA HIS 4 6.185 -5.835 -7.635 26 HB2 HIS 4 HB2 HIS 4 8.170 -4.505 -5.776 27 HB3 HIS 4 HB1 HIS 4 6.860 -3.735 -6.670 28 HD1 HIS 4 HD1 HIS 4 4.671 -5.934 -6.027 29 HD2 HIS 4 HD2 HIS 4 7.122 -4.072 -3.214 30 HE1 HIS 4 HE1 HIS 4 3.478 -6.119 -3.796 31 HE2 HIS 4 HE2 HIS 4 4.958 -4.983 -2.076 32 H ARG 5 HN ARG 5 6.843 -5.113 -9.568 33 HA ARG 5 HA ARG 5 9.762 -5.185 -10.214 34 HB2 ARG 5 HB2 ARG 5 7.384 -5.809 -11.992 35 HB3 ARG 5 HB1 ARG 5 9.052 -5.688 -12.553 36 HG2 ARG 5 HG2 ARG 5 9.607 -7.483 -10.782 37 HG3 ARG 5 HG1 ARG 5 7.874 -7.724 -10.632 38 HD2 ARG 5 HD2 ARG 5 9.387 -7.939 -13.254 39 HD3 ARG 5 HD1 ARG 5 9.026 -9.325 -12.226 40 HE ARG 5 HE ARG 5 6.606 -8.045 -12.693 41 HH11 ARG 5 HH21 ARG 5 9.124 -9.645 -14.454 42 HH12 ARG 5 HH22 ARG 5 8.107 -10.067 -15.790 43 HH21 ARG 5 HH11 ARG 5 5.266 -8.591 -14.466 44 HH22 ARG 5 HH12 ARG 5 5.932 -9.475 -15.796 45 H GLU 6 HN GLU 6 10.579 -3.574 -11.534 46 HA GLU 6 HA GLU 6 8.890 -1.373 -12.429 47 HB2 GLU 6 HB2 GLU 6 9.402 -0.940 -9.986 48 HB3 GLU 6 HB1 GLU 6 11.103 -0.843 -10.428 49 HG2 GLU 6 HG2 GLU 6 10.270 1.411 -10.412 50 HG3 GLU 6 HG1 GLU 6 10.462 0.961 -12.100 51 H ALA 7 HN ALA 7 9.638 -0.717 -14.312 52 HA ALA 7 HA ALA 7 12.025 -1.698 -15.486 53 HB1 ALA 7 HB1 ALA 7 11.508 -0.107 -17.321 54 HB2 ALA 7 HB2 ALA 7 10.257 0.620 -16.309 55 HB3 ALA 7 HB3 ALA 7 10.101 -1.054 -16.841 56 H ARG 8 HN ARG 8 13.507 0.044 -16.653 57 HA ARG 8 HA ARG 8 15.160 1.177 -14.657 58 HB2 ARG 8 HB2 ARG 8 15.958 0.542 -16.938 59 HB3 ARG 8 HB1 ARG 8 15.077 1.915 -17.607 60 HG2 ARG 8 HG2 ARG 8 16.445 3.428 -16.072 61 HG3 ARG 8 HG1 ARG 8 17.390 2.011 -15.632 62 HD2 ARG 8 HD2 ARG 8 17.055 2.942 -18.491 63 HD3 ARG 8 HD1 ARG 8 18.388 3.476 -17.473 64 HE ARG 8 HE ARG 8 18.177 0.617 -17.575 65 HH11 ARG 8 HH21 ARG 8 19.265 3.477 -19.195 66 HH12 ARG 8 HH22 ARG 8 20.380 2.644 -20.227 67 HH21 ARG 8 HH11 ARG 8 19.677 -0.496 -18.940 68 HH22 ARG 8 HH12 ARG 8 20.612 0.407 -20.084 69 H SER 9 HN SER 9 12.887 2.729 -16.923 70 HA SER 9 HA SER 9 13.212 5.333 -15.621 71 HB2 SER 9 HB2 SER 9 11.800 6.181 -17.372 72 HB3 SER 9 HB1 SER 9 12.955 5.076 -18.112 73 HG SER 9 HG SER 9 10.219 4.875 -17.807 74 H GLY 10 HN GLY 10 11.486 2.588 -14.955 75 HA2 GLY 10 HA3 GLY 10 9.469 2.131 -13.898 76 HA3 GLY 10 HA2 GLY 10 10.030 3.413 -12.830 77 H LYS 11 HN LYS 11 8.417 2.993 -15.968 78 HA LYS 11 HA LYS 11 6.379 4.956 -15.172 79 HB2 LYS 11 HB2 LYS 11 8.327 6.070 -16.471 80 HB3 LYS 11 HB1 LYS 11 7.723 5.197 -17.875 81 HG2 LYS 11 HG2 LYS 11 6.546 7.219 -18.090 82 HG3 LYS 11 HG1 LYS 11 5.382 6.273 -17.166 83 HD2 LYS 11 HD2 LYS 11 6.214 7.301 -15.071 84 HD3 LYS 11 HD1 LYS 11 7.387 8.234 -15.998 85 HE2 LYS 11 HE2 LYS 11 4.392 8.383 -16.442 86 HE3 LYS 11 HE1 LYS 11 5.292 9.506 -15.422 87 HZ1 LYS 11 HZ1 LYS 11 5.499 9.101 -18.340 88 HZ2 LYS 11 HZ2 LYS 11 6.755 9.837 -17.462 89 HZ3 LYS 11 HZ3 LYS 11 5.207 10.539 -17.487 90 H TYR 12 HN TYR 12 6.132 2.193 -15.358 91 HA TYR 12 HA TYR 12 4.947 0.496 -16.368 92 HB2 TYR 12 HB2 TYR 12 3.061 2.615 -17.403 93 HB3 TYR 12 HB1 TYR 12 2.692 1.027 -16.748 94 HD1 TYR 12 HD2 TYR 12 3.923 0.794 -14.225 95 HD2 TYR 12 HD1 TYR 12 2.243 4.336 -16.001 96 HE1 TYR 12 HE2 TYR 12 3.541 1.753 -11.971 97 HE2 TYR 12 HE1 TYR 12 1.861 5.283 -13.746 98 HH TYR 12 HH TYR 12 1.729 3.634 -11.060 99 H LYS 13 HN LYS 13 7.027 1.783 -18.022 100 HA LYS 13 HA LYS 13 5.974 1.798 -20.735 101 HB2 LYS 13 HB2 LYS 13 8.186 2.453 -21.396 102 HB3 LYS 13 HB1 LYS 13 7.681 3.421 -20.022 103 HG2 LYS 13 HG2 LYS 13 9.506 2.748 -18.813 104 HG3 LYS 13 HG1 LYS 13 9.025 1.069 -18.964 105 HD2 LYS 13 HD2 LYS 13 11.195 1.171 -19.920 106 HD3 LYS 13 HD1 LYS 13 10.107 1.127 -21.302 107 HE2 LYS 13 HE2 LYS 13 10.227 3.672 -21.333 108 HE3 LYS 13 HE1 LYS 13 11.525 3.543 -20.146 109 HZ1 LYS 13 HZ1 LYS 13 12.772 2.187 -21.688 110 HZ2 LYS 13 HZ2 LYS 13 12.370 3.670 -22.413 111 HZ3 LYS 13 HZ3 LYS 13 11.516 2.261 -22.824 112 H LEU 14 HN LEU 14 5.608 -0.643 -19.417 113 HA LEU 14 HA LEU 14 7.472 -2.432 -20.913 114 HB2 LEU 14 HB2 LEU 14 7.560 -2.453 -18.338 115 HB3 LEU 14 HB1 LEU 14 5.991 -3.232 -18.406 116 HG LEU 14 HG LEU 14 7.235 -4.865 -20.112 117 HD11 LEU 14 HD11 LEU 14 9.600 -5.188 -19.588 118 HD12 LEU 14 HD12 LEU 14 9.539 -3.904 -18.383 119 HD13 LEU 14 HD13 LEU 14 9.362 -3.519 -20.091 120 HD21 LEU 14 HD21 LEU 14 7.908 -6.306 -18.180 121 HD22 LEU 14 HD22 LEU 14 6.293 -5.628 -18.015 122 HD23 LEU 14 HD23 LEU 14 7.631 -4.930 -17.110 123 H THR 15 HN THR 15 6.596 -3.660 -22.413 124 HA THR 15 HA THR 15 3.667 -3.755 -22.676 125 HB THR 15 HB THR 15 4.084 -4.672 -24.885 126 HG1 THR 15 HG1 THR 15 6.053 -5.300 -25.510 127 HG21 THR 15 HG21 THR 15 5.885 -2.338 -24.186 128 HG22 THR 15 HG22 THR 15 4.200 -2.255 -24.696 129 HG23 THR 15 HG23 THR 15 5.437 -2.794 -25.830 130 H TYR 16 HN TYR 16 2.711 -5.853 -23.378 131 HA TYR 16 HA TYR 16 3.056 -7.804 -21.385 132 HB2 TYR 16 HB2 TYR 16 0.928 -7.634 -22.441 133 HB3 TYR 16 HB1 TYR 16 1.624 -7.811 -24.040 134 HD1 TYR 16 HD1 TYR 16 1.821 -9.746 -20.803 135 HD2 TYR 16 HD2 TYR 16 1.070 -9.887 -25.039 136 HE1 TYR 16 HE1 TYR 16 1.391 -12.174 -20.650 137 HE2 TYR 16 HE2 TYR 16 0.654 -12.323 -24.876 138 HH TYR 16 HH TYR 16 1.028 -14.162 -23.491 139 H ALA 17 HN ALA 17 4.089 -7.776 -24.790 140 HA ALA 17 HA ALA 17 5.261 -10.311 -24.863 141 HB1 ALA 17 HB1 ALA 17 6.285 -7.861 -26.309 142 HB2 ALA 17 HB2 ALA 17 4.887 -8.798 -26.832 143 HB3 ALA 17 HB3 ALA 17 6.482 -9.545 -26.790 144 H GLU 18 HN GLU 18 6.599 -7.218 -23.739 145 HA GLU 18 HA GLU 18 9.257 -8.185 -23.368 146 HB2 GLU 18 HB2 GLU 18 7.742 -5.864 -22.171 147 HB3 GLU 18 HB1 GLU 18 9.433 -6.178 -21.789 148 HG2 GLU 18 HG2 GLU 18 10.035 -5.961 -24.142 149 HG3 GLU 18 HG1 GLU 18 8.344 -5.774 -24.592 150 H ALA 19 HN ALA 19 6.547 -7.744 -21.086 151 HA ALA 19 HA ALA 19 7.777 -8.626 -18.760 152 HB1 ALA 19 HB1 ALA 19 5.454 -7.674 -18.963 153 HB2 ALA 19 HB2 ALA 19 5.576 -9.074 -17.902 154 HB3 ALA 19 HB3 ALA 19 4.919 -9.255 -19.529 155 H LYS 20 HN LYS 20 6.583 -10.521 -21.466 156 HA LYS 20 HA LYS 20 6.599 -13.067 -20.194 157 HB2 LYS 20 HB2 LYS 20 6.917 -12.305 -23.107 158 HB3 LYS 20 HB1 LYS 20 6.812 -13.967 -22.544 159 HG2 LYS 20 HG2 LYS 20 4.609 -13.556 -21.585 160 HG3 LYS 20 HG1 LYS 20 4.713 -11.853 -22.007 161 HD2 LYS 20 HD2 LYS 20 3.409 -12.732 -23.773 162 HD3 LYS 20 HD1 LYS 20 5.019 -12.705 -24.475 163 HE2 LYS 20 HE2 LYS 20 3.860 -14.847 -24.915 164 HE3 LYS 20 HE1 LYS 20 5.299 -15.099 -23.936 165 HZ1 LYS 20 HZ1 LYS 20 2.681 -14.669 -22.655 166 HZ2 LYS 20 HZ2 LYS 20 4.055 -15.459 -22.042 167 HZ3 LYS 20 HZ3 LYS 20 3.103 -16.205 -23.237 168 H ALA 21 HN ALA 21 9.103 -11.140 -21.760 169 HA ALA 21 HA ALA 21 11.062 -13.175 -21.969 170 HB1 ALA 21 HB1 ALA 21 11.173 -10.967 -23.115 171 HB2 ALA 21 HB2 ALA 21 12.656 -11.374 -22.251 172 HB3 ALA 21 HB3 ALA 21 11.520 -10.214 -21.558 173 H VAL 22 HN VAL 22 10.606 -10.671 -19.458 174 HA VAL 22 HA VAL 22 12.710 -11.527 -17.771 175 HB VAL 22 HB VAL 22 10.155 -10.054 -17.073 176 HG11 VAL 22 HG11 VAL 22 12.755 -10.454 -15.559 177 HG12 VAL 22 HG12 VAL 22 11.131 -10.894 -15.031 178 HG13 VAL 22 HG13 VAL 22 11.587 -9.196 -15.154 179 HG21 VAL 22 HG21 VAL 22 12.933 -9.117 -17.847 180 HG22 VAL 22 HG22 VAL 22 11.664 -8.059 -17.232 181 HG23 VAL 22 HG23 VAL 22 11.449 -8.887 -18.774 182 H CYS 23 HN CYS 23 9.282 -12.397 -17.873 183 HA CYS 23 HA CYS 23 9.653 -14.351 -15.666 184 HB2 CYS 23 HB2 CYS 23 7.736 -12.569 -15.876 185 HB3 CYS 23 HB1 CYS 23 7.022 -13.712 -17.004 186 H GLU 24 HN GLU 24 8.234 -16.400 -16.058 187 HA GLU 24 HA GLU 24 7.944 -18.382 -17.196 188 HB2 GLU 24 HB2 GLU 24 6.619 -16.881 -18.742 189 HB3 GLU 24 HB1 GLU 24 8.062 -16.733 -19.733 190 HG2 GLU 24 HG2 GLU 24 8.105 -19.127 -20.134 191 HG3 GLU 24 HG1 GLU 24 6.753 -19.368 -19.032 192 H PHE 25 HN PHE 25 10.645 -16.380 -17.767 193 HA PHE 25 HA PHE 25 12.194 -17.958 -19.514 194 HB2 PHE 25 HB2 PHE 25 12.747 -15.642 -18.962 195 HB3 PHE 25 HB1 PHE 25 13.033 -16.088 -17.284 196 HD1 PHE 25 HD1 PHE 25 14.284 -16.421 -20.762 197 HD2 PHE 25 HD2 PHE 25 15.083 -17.200 -16.610 198 HE1 PHE 25 HE1 PHE 25 16.643 -16.955 -21.313 199 HE2 PHE 25 HE2 PHE 25 17.441 -17.735 -17.166 200 HZ PHE 25 HZ PHE 25 18.221 -17.611 -19.517 201 H GLU 26 HN GLU 26 12.079 -17.865 -15.959 202 HA GLU 26 HA GLU 26 13.884 -20.113 -15.698 203 HB2 GLU 26 HB2 GLU 26 13.529 -19.877 -13.309 204 HB3 GLU 26 HB1 GLU 26 13.811 -18.292 -14.023 205 HG2 GLU 26 HG2 GLU 26 11.328 -17.951 -14.113 206 HG3 GLU 26 HG1 GLU 26 11.127 -19.471 -13.241 207 H GLY 27 HN GLY 27 11.235 -20.361 -17.144 208 HA2 GLY 27 HA3 GLY 27 9.887 -22.207 -17.532 209 HA3 GLY 27 HA2 GLY 27 10.546 -22.973 -16.092 210 H GLY 28 HN GLY 28 9.623 -19.938 -15.186 211 HA2 GLY 28 HA3 GLY 28 7.296 -20.905 -13.763 212 HA3 GLY 28 HA2 GLY 28 7.976 -19.283 -13.688 213 H HIS 29 HN HIS 29 5.970 -18.285 -13.860 214 HA HIS 29 HA HIS 29 5.061 -17.806 -16.544 215 HB2 HIS 29 HB2 HIS 29 2.717 -18.541 -16.168 216 HB3 HIS 29 HB1 HIS 29 3.857 -19.882 -16.199 217 HD1 HIS 29 HD1 HIS 29 2.118 -17.650 -13.644 218 HD2 HIS 29 HD2 HIS 29 3.724 -21.487 -13.950 219 HE1 HIS 29 HE1 HIS 29 1.554 -18.841 -11.480 220 HE2 HIS 29 HE2 HIS 29 2.533 -21.176 -11.648 221 H LEU 30 HN LEU 30 3.612 -16.047 -16.693 222 HA LEU 30 HA LEU 30 4.001 -14.008 -14.780 223 HB2 LEU 30 HB2 LEU 30 1.943 -14.291 -16.985 224 HB3 LEU 30 HB1 LEU 30 2.182 -12.812 -16.064 225 HG LEU 30 HG LEU 30 4.444 -14.143 -17.596 226 HD11 LEU 30 HD11 LEU 30 2.647 -13.600 -19.185 227 HD12 LEU 30 HD12 LEU 30 3.993 -12.478 -19.387 228 HD13 LEU 30 HD13 LEU 30 2.540 -11.966 -18.530 229 HD21 LEU 30 HD21 LEU 30 5.249 -12.515 -15.977 230 HD22 LEU 30 HD22 LEU 30 4.008 -11.357 -16.441 231 HD23 LEU 30 HD23 LEU 30 5.316 -11.742 -17.554 232 H ALA 31 HN ALA 31 2.680 -13.147 -13.219 233 HA ALA 31 HA ALA 31 1.010 -14.927 -11.798 234 HB1 ALA 31 HB1 ALA 31 0.601 -13.097 -10.306 235 HB2 ALA 31 HB2 ALA 31 1.024 -11.911 -11.543 236 HB3 ALA 31 HB3 ALA 31 2.271 -12.945 -10.853 237 H THR 32 HN THR 32 -0.832 -15.667 -12.637 238 HA THR 32 HA THR 32 -2.565 -13.965 -14.271 239 HB THR 32 HB THR 32 -3.735 -15.936 -14.839 240 HG1 THR 32 HG1 THR 32 -3.910 -17.611 -13.533 241 HG21 THR 32 HG21 THR 32 -1.295 -15.836 -15.582 242 HG22 THR 32 HG22 THR 32 -2.027 -17.440 -15.584 243 HG23 THR 32 HG23 THR 32 -0.945 -16.968 -14.274 244 H TYR 33 HN TYR 33 -4.927 -14.031 -13.822 245 HA TYR 33 HA TYR 33 -5.540 -12.805 -11.395 246 HB2 TYR 33 HB2 TYR 33 -6.968 -12.541 -13.286 247 HB3 TYR 33 HB1 TYR 33 -7.300 -14.266 -13.366 248 HD1 TYR 33 HD1 TYR 33 -7.916 -11.136 -11.472 249 HD2 TYR 33 HD2 TYR 33 -8.942 -15.292 -11.882 250 HE1 TYR 33 HE1 TYR 33 -9.885 -10.800 -10.002 251 HE2 TYR 33 HE2 TYR 33 -10.904 -14.949 -10.406 252 HH TYR 33 HH TYR 33 -11.782 -13.477 -8.819 253 H LYS 34 HN LYS 34 -6.278 -16.168 -12.339 254 HA LYS 34 HA LYS 34 -7.369 -17.011 -9.920 255 HB2 LYS 34 HB2 LYS 34 -7.371 -18.294 -12.077 256 HB3 LYS 34 HB1 LYS 34 -5.668 -18.644 -11.822 257 HG2 LYS 34 HG2 LYS 34 -6.822 -20.578 -11.039 258 HG3 LYS 34 HG1 LYS 34 -6.363 -19.708 -9.582 259 HD2 LYS 34 HD2 LYS 34 -8.605 -18.836 -9.305 260 HD3 LYS 34 HD1 LYS 34 -9.087 -19.419 -10.896 261 HE2 LYS 34 HE2 LYS 34 -8.737 -21.745 -10.132 262 HE3 LYS 34 HE1 LYS 34 -8.274 -21.144 -8.540 263 HZ1 LYS 34 HZ1 LYS 34 -10.792 -21.768 -9.299 264 HZ2 LYS 34 HZ2 LYS 34 -10.769 -20.081 -9.491 265 HZ3 LYS 34 HZ3 LYS 34 -10.387 -20.774 -7.988 266 H GLN 35 HN GLN 35 -3.983 -17.000 -10.980 267 HA GLN 35 HA GLN 35 -2.962 -18.185 -8.583 268 HB2 GLN 35 HB2 GLN 35 -1.556 -16.542 -10.706 269 HB3 GLN 35 HB1 GLN 35 -0.753 -17.462 -9.437 270 HG2 GLN 35 HG2 GLN 35 -2.625 -18.674 -11.488 271 HG3 GLN 35 HG1 GLN 35 -0.870 -18.675 -11.629 272 HE21 GLN 35 HE21 GLN 35 0.331 -20.156 -10.298 273 HE22 GLN 35 HE22 GLN 35 -0.426 -21.322 -9.324 274 H LEU 36 HN LEU 36 -3.605 -14.908 -9.643 275 HA LEU 36 HA LEU 36 -2.072 -13.541 -7.717 276 HB2 LEU 36 HB2 LEU 36 -3.846 -12.834 -9.807 277 HB3 LEU 36 HB1 LEU 36 -4.563 -12.110 -8.396 278 HG LEU 36 HG LEU 36 -1.664 -11.742 -9.216 279 HD11 LEU 36 HD11 LEU 36 -2.445 -9.451 -9.899 280 HD12 LEU 36 HD12 LEU 36 -4.105 -9.993 -9.655 281 HD13 LEU 36 HD13 LEU 36 -3.111 -10.743 -10.900 282 HD21 LEU 36 HD21 LEU 36 -2.065 -11.378 -6.815 283 HD22 LEU 36 HD22 LEU 36 -3.445 -10.348 -7.181 284 HD23 LEU 36 HD23 LEU 36 -1.818 -9.827 -7.610 285 H GLU 37 HN GLU 37 -5.385 -14.792 -7.628 286 HA GLU 37 HA GLU 37 -6.323 -13.657 -5.287 287 HB2 GLU 37 HB2 GLU 37 -7.640 -15.107 -6.817 288 HB3 GLU 37 HB1 GLU 37 -6.765 -16.508 -6.201 289 HG2 GLU 37 HG2 GLU 37 -7.623 -16.083 -3.943 290 HG3 GLU 37 HG1 GLU 37 -8.442 -14.628 -4.508 291 H ALA 38 HN ALA 38 -4.467 -16.683 -5.619 292 HA ALA 38 HA ALA 38 -4.343 -17.392 -2.927 293 HB1 ALA 38 HB1 ALA 38 -3.559 -18.893 -4.669 294 HB2 ALA 38 HB2 ALA 38 -2.242 -18.591 -3.536 295 HB3 ALA 38 HB3 ALA 38 -2.267 -17.773 -5.099 296 H ALA 39 HN ALA 39 -2.412 -15.070 -4.744 297 HA ALA 39 HA ALA 39 -0.594 -14.563 -2.544 298 HB1 ALA 39 HB1 ALA 39 -1.007 -12.999 -5.098 299 HB2 ALA 39 HB2 ALA 39 0.117 -14.344 -4.909 300 HB3 ALA 39 HB3 ALA 39 0.356 -12.861 -3.987 301 H ARG 40 HN ARG 40 -3.453 -13.031 -3.951 302 HA ARG 40 HA ARG 40 -3.346 -10.582 -2.600 303 HB2 ARG 40 HB2 ARG 40 -4.933 -11.127 -4.447 304 HB3 ARG 40 HB1 ARG 40 -5.838 -12.134 -3.324 305 HG2 ARG 40 HG2 ARG 40 -6.897 -9.951 -3.487 306 HG3 ARG 40 HG1 ARG 40 -6.233 -10.157 -1.876 307 HD2 ARG 40 HD2 ARG 40 -4.706 -8.440 -2.172 308 HD3 ARG 40 HD1 ARG 40 -4.399 -8.856 -3.849 309 HE ARG 40 HE ARG 40 -5.954 -7.237 -4.412 310 HH11 ARG 40 HH21 ARG 40 -6.620 -8.470 -1.218 311 HH12 ARG 40 HH22 ARG 40 -8.015 -7.481 -1.027 312 HH21 ARG 40 HH11 ARG 40 -7.787 -5.924 -4.089 313 HH22 ARG 40 HH12 ARG 40 -8.656 -6.043 -2.588 314 H LYS 41 HN LYS 41 -4.207 -13.763 -1.482 315 HA LYS 41 HA LYS 41 -5.491 -12.870 0.957 316 HB2 LYS 41 HB2 LYS 41 -4.459 -15.584 0.088 317 HB3 LYS 41 HB1 LYS 41 -5.319 -15.278 1.595 318 HG2 LYS 41 HG2 LYS 41 -7.277 -14.494 0.376 319 HG3 LYS 41 HG1 LYS 41 -6.418 -14.646 -1.156 320 HD2 LYS 41 HD2 LYS 41 -7.832 -16.595 -0.908 321 HD3 LYS 41 HD1 LYS 41 -6.158 -17.107 -0.706 322 HE2 LYS 41 HE2 LYS 41 -6.401 -17.335 1.656 323 HE3 LYS 41 HE1 LYS 41 -7.891 -16.390 1.679 324 HZ1 LYS 41 HZ1 LYS 41 -7.614 -19.138 1.427 325 HZ2 LYS 41 HZ2 LYS 41 -8.184 -18.571 -0.071 326 HZ3 LYS 41 HZ3 LYS 41 -9.043 -18.229 1.356 327 H ILE 42 HN ILE 42 -2.316 -12.852 -0.064 328 HA ILE 42 HA ILE 42 -1.161 -13.490 2.584 329 HB ILE 42 HB ILE 42 0.229 -12.799 -0.025 330 HG12 ILE 42 HG12 ILE 42 -0.134 -15.484 1.360 331 HG13 ILE 42 HG11 ILE 42 -1.088 -14.950 -0.019 332 HG21 ILE 42 HG21 ILE 42 1.215 -13.405 2.766 333 HG22 ILE 42 HG22 ILE 42 1.891 -12.315 1.557 334 HG23 ILE 42 HG23 ILE 42 2.147 -14.047 1.416 335 HD11 ILE 42 HD11 ILE 42 0.556 -16.181 -1.101 336 HD12 ILE 42 HD12 ILE 42 1.791 -15.777 0.086 337 HD13 ILE 42 HD13 ILE 42 1.318 -14.591 -1.128 338 H GLY 43 HN GLY 43 -2.676 -10.925 1.418 339 HA2 GLY 43 HA3 GLY 43 -2.752 -8.795 2.376 340 HA3 GLY 43 HA2 GLY 43 -1.157 -9.045 3.068 341 H PHE 44 HN PHE 44 -1.609 -9.779 -0.286 342 HA PHE 44 HA PHE 44 0.369 -7.899 -1.100 343 HB2 PHE 44 HB2 PHE 44 -0.457 -10.190 -2.171 344 HB3 PHE 44 HB1 PHE 44 -1.556 -9.154 -3.062 345 HD1 PHE 44 HD1 PHE 44 2.047 -9.716 -2.276 346 HD2 PHE 44 HD2 PHE 44 -0.781 -7.871 -4.935 347 HE1 PHE 44 HE1 PHE 44 3.886 -9.149 -3.840 348 HE2 PHE 44 HE2 PHE 44 1.058 -7.305 -6.498 349 HZ PHE 44 HZ PHE 44 3.391 -7.944 -5.951 350 H HIS 45 HN HIS 45 0.175 -5.855 -1.798 351 HA HIS 45 HA HIS 45 -2.405 -4.814 -2.753 352 HB2 HIS 45 HB2 HIS 45 -2.562 -4.481 -0.355 353 HB3 HIS 45 HB1 HIS 45 -0.962 -3.755 -0.304 354 HD1 HIS 45 HD1 HIS 45 -3.598 -2.974 -2.916 355 HD2 HIS 45 HD2 HIS 45 -1.766 -1.151 0.354 356 HE1 HIS 45 HE1 HIS 45 -4.355 -0.555 -2.925 357 HE2 HIS 45 HE2 HIS 45 -3.247 0.569 -0.936 358 H VAL 46 HN VAL 46 -1.719 -4.162 -4.691 359 HA VAL 46 HA VAL 46 0.382 -2.073 -4.792 360 HB VAL 46 HB VAL 46 0.260 -4.382 -6.751 361 HG11 VAL 46 HG11 VAL 46 2.482 -3.445 -7.431 362 HG12 VAL 46 HG12 VAL 46 2.217 -2.098 -6.326 363 HG13 VAL 46 HG13 VAL 46 1.151 -2.321 -7.715 364 HG21 VAL 46 HG21 VAL 46 2.113 -3.859 -4.405 365 HG22 VAL 46 HG22 VAL 46 2.423 -5.056 -5.662 366 HG23 VAL 46 HG23 VAL 46 1.022 -5.230 -4.605 367 H CYS 47 HN CYS 47 -0.505 -0.346 -5.662 368 HA CYS 47 HA CYS 47 -2.834 -0.578 -7.450 369 HB2 CYS 47 HB2 CYS 47 -3.028 1.052 -5.678 370 HB3 CYS 47 HB1 CYS 47 -1.499 1.802 -6.133 371 H ALA 48 HN ALA 48 -1.685 -1.463 -9.246 372 HA ALA 48 HA ALA 48 -0.776 0.533 -11.096 373 HB1 ALA 48 HB1 ALA 48 1.494 -0.220 -11.409 374 HB2 ALA 48 HB2 ALA 48 1.277 -1.513 -10.230 375 HB3 ALA 48 HB3 ALA 48 1.281 0.169 -9.703 376 H ALA 49 HN ALA 49 -2.345 -0.293 -12.448 377 HA ALA 49 HA ALA 49 -2.870 -2.972 -12.998 378 HB1 ALA 49 HB1 ALA 49 -3.093 -0.670 -14.947 379 HB2 ALA 49 HB2 ALA 49 -4.297 -1.068 -13.723 380 HB3 ALA 49 HB3 ALA 49 -3.960 -2.204 -15.026 381 H GLY 50 HN GLY 50 -2.044 -4.483 -14.327 382 HA2 GLY 50 HA3 GLY 50 0.166 -3.756 -16.159 383 HA3 GLY 50 HA2 GLY 50 0.467 -4.959 -14.909 384 H TRP 51 HN TRP 51 0.991 -6.108 -17.023 385 HA TRP 51 HA TRP 51 -1.390 -7.291 -18.325 386 HB2 TRP 51 HB2 TRP 51 1.534 -7.244 -19.106 387 HB3 TRP 51 HB1 TRP 51 0.311 -8.194 -19.943 388 HD1 TRP 51 HD1 TRP 51 1.609 -4.687 -19.567 389 HE1 TRP 51 HE1 TRP 51 0.335 -3.136 -21.179 390 HE3 TRP 51 HE3 TRP 51 -2.072 -7.854 -21.162 391 HZ2 TRP 51 HZ2 TRP 51 -1.908 -3.212 -22.918 392 HZ3 TRP 51 HZ3 TRP 51 -3.761 -7.081 -22.807 393 HH2 TRP 51 HH2 TRP 51 -3.677 -4.764 -23.689 394 H MET 52 HN MET 52 -1.477 -9.556 -18.638 395 HA MET 52 HA MET 52 0.250 -11.268 -16.981 396 HB2 MET 52 HB2 MET 52 -2.768 -11.290 -16.671 397 HB3 MET 52 HB1 MET 52 -1.609 -12.305 -15.822 398 HG2 MET 52 HG2 MET 52 -0.582 -10.207 -14.869 399 HG3 MET 52 HG1 MET 52 -1.916 -9.301 -15.573 400 HE1 MET 52 HE1 MET 52 -4.720 -11.364 -14.754 401 HE2 MET 52 HE2 MET 52 -4.212 -9.797 -15.369 402 HE3 MET 52 HE3 MET 52 -4.929 -9.916 -13.768 403 H ALA 53 HN ALA 53 -0.537 -13.619 -17.250 404 HA ALA 53 HA ALA 53 -0.166 -14.497 -19.805 405 HB1 ALA 53 HB1 ALA 53 -1.126 -16.612 -19.150 406 HB2 ALA 53 HB2 ALA 53 -2.047 -15.847 -17.855 407 HB3 ALA 53 HB3 ALA 53 -0.287 -15.935 -17.756 408 H LYS 54 HN LYS 54 -1.419 -15.110 -21.545 409 HA LYS 54 HA LYS 54 -3.075 -14.883 -23.109 410 HB2 LYS 54 HB2 LYS 54 -4.848 -14.932 -20.653 411 HB3 LYS 54 HB1 LYS 54 -5.425 -15.058 -22.309 412 HG2 LYS 54 HG2 LYS 54 -4.008 -17.078 -22.621 413 HG3 LYS 54 HG1 LYS 54 -3.529 -16.979 -20.925 414 HD2 LYS 54 HD2 LYS 54 -6.393 -17.253 -21.907 415 HD3 LYS 54 HD1 LYS 54 -5.410 -18.585 -21.303 416 HE2 LYS 54 HE2 LYS 54 -6.558 -17.997 -19.348 417 HE3 LYS 54 HE1 LYS 54 -5.146 -16.956 -19.176 418 HZ1 LYS 54 HZ1 LYS 54 -6.352 -15.122 -19.582 419 HZ2 LYS 54 HZ2 LYS 54 -7.664 -16.090 -19.102 420 HZ3 LYS 54 HZ3 LYS 54 -7.324 -15.869 -20.753 421 H GLY 55 HN GLY 55 -1.796 -12.496 -22.327 422 HA2 GLY 55 HA3 GLY 55 -2.001 -10.203 -22.446 423 HA3 GLY 55 HA2 GLY 55 -3.379 -10.537 -23.486 424 H ARG 56 HN ARG 56 -3.834 -11.934 -20.466 425 HA ARG 56 HA ARG 56 -6.025 -10.207 -19.844 426 HB2 ARG 56 HB2 ARG 56 -5.947 -12.602 -19.226 427 HB3 ARG 56 HB1 ARG 56 -4.662 -12.244 -18.084 428 HG2 ARG 56 HG2 ARG 56 -6.101 -10.921 -16.702 429 HG3 ARG 56 HG1 ARG 56 -7.355 -10.895 -17.941 430 HD2 ARG 56 HD2 ARG 56 -7.890 -13.196 -17.619 431 HD3 ARG 56 HD1 ARG 56 -6.388 -13.519 -16.764 432 HE ARG 56 HE ARG 56 -7.512 -13.014 -14.829 433 HH11 ARG 56 HH21 ARG 56 -8.992 -11.321 -17.446 434 HH12 ARG 56 HH22 ARG 56 -10.311 -10.775 -16.493 435 HH21 ARG 56 HH11 ARG 56 -9.282 -12.313 -13.582 436 HH22 ARG 56 HH12 ARG 56 -10.480 -11.297 -14.328 437 H VAL 57 HN VAL 57 -6.278 -8.707 -18.210 438 HA VAL 57 HA VAL 57 -3.788 -7.721 -16.894 439 HB VAL 57 HB VAL 57 -4.316 -5.468 -17.407 440 HG11 VAL 57 HG11 VAL 57 -5.175 -6.984 -19.887 441 HG12 VAL 57 HG12 VAL 57 -3.507 -6.905 -19.331 442 HG13 VAL 57 HG13 VAL 57 -4.345 -5.431 -19.806 443 HG21 VAL 57 HG21 VAL 57 -6.508 -4.905 -18.629 444 HG22 VAL 57 HG22 VAL 57 -6.678 -5.344 -16.933 445 HG23 VAL 57 HG23 VAL 57 -7.060 -6.522 -18.187 446 H GLY 58 HN GLY 58 -4.171 -6.418 -14.977 447 HA2 GLY 58 HA3 GLY 58 -6.753 -6.518 -13.673 448 HA3 GLY 58 HA2 GLY 58 -5.601 -7.677 -13.020 449 H TYR 59 HN TYR 59 -6.579 -5.802 -11.375 450 HA TYR 59 HA TYR 59 -4.170 -4.338 -10.634 451 HB2 TYR 59 HB2 TYR 59 -5.601 -2.171 -10.355 452 HB3 TYR 59 HB1 TYR 59 -4.959 -2.564 -11.941 453 HD1 TYR 59 HD2 TYR 59 -6.431 -3.578 -13.693 454 HD2 TYR 59 HD1 TYR 59 -7.994 -2.146 -9.952 455 HE1 TYR 59 HE2 TYR 59 -8.708 -3.510 -14.669 456 HE2 TYR 59 HE1 TYR 59 -10.269 -2.070 -10.937 457 HH TYR 59 HH TYR 59 -11.525 -2.570 -12.704 458 HA PRO 60 HA PRO 60 -6.578 -6.188 -7.118 459 HB2 PRO 60 HB2 PRO 60 -3.749 -6.263 -6.094 460 HB3 PRO 60 HB1 PRO 60 -5.014 -7.508 -5.984 461 HG2 PRO 60 HG2 PRO 60 -3.041 -7.782 -7.725 462 HG3 PRO 60 HG1 PRO 60 -4.705 -8.191 -8.197 463 HD2 PRO 60 HD2 PRO 60 -3.113 -5.715 -8.881 464 HD3 PRO 60 HD1 PRO 60 -4.204 -6.668 -9.916 465 H ILE 61 HN ILE 61 -7.491 -4.913 -5.634 466 HA ILE 61 HA ILE 61 -5.921 -2.735 -4.363 467 HB ILE 61 HB ILE 61 -8.649 -2.388 -5.659 468 HG12 ILE 61 HG12 ILE 61 -6.056 -0.880 -6.165 469 HG13 ILE 61 HG11 ILE 61 -6.563 -2.253 -7.130 470 HG21 ILE 61 HG21 ILE 61 -8.324 0.028 -4.839 471 HG22 ILE 61 HG22 ILE 61 -7.048 -0.599 -3.799 472 HG23 ILE 61 HG23 ILE 61 -8.706 -1.158 -3.595 473 HD11 ILE 61 HD11 ILE 61 -7.260 -0.211 -8.247 474 HD12 ILE 61 HD12 ILE 61 -8.083 0.337 -6.788 475 HD13 ILE 61 HD13 ILE 61 -8.687 -1.070 -7.667 476 H VAL 62 HN VAL 62 -5.866 -3.546 -2.353 477 HA VAL 62 HA VAL 62 -8.041 -4.934 -1.119 478 HB VAL 62 HB VAL 62 -5.667 -5.253 -0.465 479 HG11 VAL 62 HG11 VAL 62 -4.484 -3.609 0.814 480 HG12 VAL 62 HG12 VAL 62 -5.910 -2.594 0.944 481 HG13 VAL 62 HG13 VAL 62 -5.103 -2.778 -0.611 482 HG21 VAL 62 HG21 VAL 62 -6.089 -5.413 1.924 483 HG22 VAL 62 HG22 VAL 62 -7.574 -5.817 1.064 484 HG23 VAL 62 HG23 VAL 62 -7.391 -4.228 1.809 485 H LYS 63 HN LYS 63 -7.182 -1.602 -1.462 486 HA LYS 63 HA LYS 63 -9.678 -0.802 -0.258 487 HB2 LYS 63 HB2 LYS 63 -8.761 0.601 1.506 488 HB3 LYS 63 HB1 LYS 63 -8.290 -1.083 1.733 489 HG2 LYS 63 HG2 LYS 63 -6.129 -0.339 0.336 490 HG3 LYS 63 HG1 LYS 63 -6.589 1.270 0.881 491 HD2 LYS 63 HD2 LYS 63 -6.448 0.603 3.209 492 HD3 LYS 63 HD1 LYS 63 -6.198 -1.082 2.767 493 HE2 LYS 63 HE2 LYS 63 -4.034 -0.229 3.291 494 HE3 LYS 63 HE1 LYS 63 -4.089 -0.304 1.533 495 HZ1 LYS 63 HZ1 LYS 63 -3.287 1.843 2.716 496 HZ2 LYS 63 HZ2 LYS 63 -4.948 2.156 2.893 497 HZ3 LYS 63 HZ3 LYS 63 -4.278 1.959 1.346 498 HA PRO 64 HA PRO 64 -9.456 2.442 -3.315 499 HB2 PRO 64 HB2 PRO 64 -10.195 4.240 -0.998 500 HB3 PRO 64 HB1 PRO 64 -10.867 4.203 -2.642 501 HG2 PRO 64 HG2 PRO 64 -12.161 3.081 -0.579 502 HG3 PRO 64 HG1 PRO 64 -12.196 2.360 -2.202 503 HD2 PRO 64 HD2 PRO 64 -10.778 1.381 0.239 504 HD3 PRO 64 HD1 PRO 64 -11.296 0.486 -1.209 505 H GLY 65 HN GLY 65 -8.324 4.528 -3.744 506 HA2 GLY 65 HA3 GLY 65 -6.376 5.549 -1.918 507 HA3 GLY 65 HA2 GLY 65 -5.622 4.465 -3.079 508 HA PRO 66 HA PRO 66 -6.198 8.901 -4.754 509 HB2 PRO 66 HB2 PRO 66 -3.546 9.666 -4.740 510 HB3 PRO 66 HB1 PRO 66 -4.633 9.928 -3.359 511 HG2 PRO 66 HG2 PRO 66 -2.673 7.693 -3.809 512 HG3 PRO 66 HG1 PRO 66 -2.926 8.684 -2.353 513 HD2 PRO 66 HD2 PRO 66 -4.011 6.215 -2.538 514 HD3 PRO 66 HD1 PRO 66 -4.908 7.543 -1.763 515 H ASN 67 HN ASN 67 -3.592 6.557 -5.335 516 HA ASN 67 HA ASN 67 -3.104 7.268 -8.038 517 HB2 ASN 67 HB2 ASN 67 -2.574 4.727 -6.475 518 HB3 ASN 67 HB1 ASN 67 -2.029 4.971 -8.136 519 HD21 ASN 67 HD21 ASN 67 -0.280 6.472 -8.507 520 HD22 ASN 67 HD22 ASN 67 0.619 7.138 -7.232 521 H CYS 68 HN CYS 68 -5.316 5.009 -6.486 522 HA CYS 68 HA CYS 68 -6.935 4.869 -8.900 523 HB2 CYS 68 HB2 CYS 68 -6.903 2.359 -8.927 524 HB3 CYS 68 HB1 CYS 68 -5.379 3.098 -9.418 525 H GLY 69 HN GLY 69 -9.034 4.249 -8.497 526 HA2 GLY 69 HA3 GLY 69 -9.843 3.171 -5.924 527 HA3 GLY 69 HA2 GLY 69 -10.277 4.861 -6.176 528 H PHE 70 HN PHE 70 -10.192 2.183 -8.501 529 HA PHE 70 HA PHE 70 -12.754 2.880 -9.589 530 HB2 PHE 70 HB2 PHE 70 -11.065 0.403 -10.016 531 HB3 PHE 70 HB1 PHE 70 -12.454 0.880 -10.988 532 HD1 PHE 70 HD2 PHE 70 -12.358 2.883 -12.442 533 HD2 PHE 70 HD1 PHE 70 -8.922 1.558 -10.226 534 HE1 PHE 70 HE2 PHE 70 -10.899 4.315 -13.846 535 HE2 PHE 70 HE1 PHE 70 -7.466 2.991 -11.634 536 HZ PHE 70 HZ PHE 70 -8.453 4.369 -13.442 537 H GLY 71 HN GLY 71 -14.700 1.859 -9.344 538 HA2 GLY 71 HA3 GLY 71 -16.356 0.595 -8.360 539 HA3 GLY 71 HA2 GLY 71 -15.120 -0.623 -8.059 540 H LYS 72 HN LYS 72 -14.406 -0.923 -6.024 541 HA LYS 72 HA LYS 72 -14.531 1.126 -3.990 542 HB2 LYS 72 HB2 LYS 72 -16.924 0.207 -4.242 543 HB3 LYS 72 HB1 LYS 72 -16.310 -1.292 -3.551 544 HG2 LYS 72 HG2 LYS 72 -15.432 0.116 -1.608 545 HG3 LYS 72 HG1 LYS 72 -16.360 1.454 -2.262 546 HD2 LYS 72 HD2 LYS 72 -17.520 -1.240 -1.470 547 HD3 LYS 72 HD1 LYS 72 -17.582 0.210 -0.473 548 HE2 LYS 72 HE2 LYS 72 -18.958 -0.290 -3.124 549 HE3 LYS 72 HE1 LYS 72 -19.690 0.138 -1.581 550 HZ1 LYS 72 HZ1 LYS 72 -18.223 2.244 -1.833 551 HZ2 LYS 72 HZ2 LYS 72 -19.698 2.133 -2.669 552 HZ3 LYS 72 HZ3 LYS 72 -18.233 1.839 -3.480 553 H THR 73 HN THR 73 -14.711 -2.436 -4.126 554 HA THR 73 HA THR 73 -11.981 -2.651 -3.052 555 HB THR 73 HB THR 73 -12.787 -4.325 -1.336 556 HG1 THR 73 HG1 THR 73 -14.805 -4.800 -1.393 557 HG21 THR 73 HG21 THR 73 -13.855 -1.517 -0.981 558 HG22 THR 73 HG22 THR 73 -12.171 -1.975 -0.763 559 HG23 THR 73 HG23 THR 73 -13.411 -2.639 0.302 560 H GLY 74 HN GLY 74 -11.350 -5.004 -2.901 561 HA2 GLY 74 HA3 GLY 74 -11.453 -7.221 -3.726 562 HA3 GLY 74 HA2 GLY 74 -12.680 -6.737 -4.892 563 H ILE 75 HN ILE 75 -11.537 -7.714 -6.583 564 HA ILE 75 HA ILE 75 -8.892 -6.588 -7.283 565 HB ILE 75 HB ILE 75 -10.380 -8.948 -8.467 566 HG12 ILE 75 HG12 ILE 75 -7.945 -8.907 -6.645 567 HG13 ILE 75 HG11 ILE 75 -9.585 -9.180 -6.060 568 HG21 ILE 75 HG21 ILE 75 -8.890 -8.034 -10.125 569 HG22 ILE 75 HG22 ILE 75 -8.048 -9.409 -9.421 570 HG23 ILE 75 HG23 ILE 75 -7.616 -7.774 -8.935 571 HD11 ILE 75 HD11 ILE 75 -9.803 -11.170 -7.443 572 HD12 ILE 75 HD12 ILE 75 -8.334 -11.303 -6.479 573 HD13 ILE 75 HD13 ILE 75 -8.231 -10.868 -8.183 574 H ILE 76 HN ILE 76 -11.887 -7.474 -9.010 575 HA ILE 76 HA ILE 76 -12.925 -6.548 -10.829 576 HB ILE 76 HB ILE 76 -11.661 -3.956 -9.893 577 HG12 ILE 76 HG12 ILE 76 -14.335 -5.153 -9.078 578 HG13 ILE 76 HG11 ILE 76 -12.893 -5.200 -8.069 579 HG21 ILE 76 HG21 ILE 76 -12.721 -3.868 -12.124 580 HG22 ILE 76 HG22 ILE 76 -13.675 -2.961 -10.957 581 HG23 ILE 76 HG23 ILE 76 -14.194 -4.569 -11.457 582 HD11 ILE 76 HD11 ILE 76 -12.786 -2.719 -8.135 583 HD12 ILE 76 HD12 ILE 76 -14.288 -3.300 -7.416 584 HD13 ILE 76 HD13 ILE 76 -14.280 -2.700 -9.072 585 H ASP 77 HN ASP 77 -12.037 -7.305 -12.666 586 HA ASP 77 HA ASP 77 -9.815 -5.772 -13.886 587 HB2 ASP 77 HB2 ASP 77 -8.858 -7.909 -14.716 588 HB3 ASP 77 HB1 ASP 77 -8.770 -7.746 -12.966 589 H TYR 78 HN TYR 78 -9.813 -5.690 -16.104 590 HA TYR 78 HA TYR 78 -12.397 -5.839 -17.355 591 HB2 TYR 78 HB2 TYR 78 -9.669 -5.346 -18.586 592 HB3 TYR 78 HB1 TYR 78 -11.219 -5.082 -19.378 593 HD1 TYR 78 HD2 TYR 78 -12.840 -3.382 -18.418 594 HD2 TYR 78 HD1 TYR 78 -8.759 -3.687 -17.101 595 HE1 TYR 78 HE2 TYR 78 -12.974 -1.098 -17.456 596 HE2 TYR 78 HE1 TYR 78 -8.897 -1.404 -16.145 597 HH TYR 78 HH TYR 78 -10.481 0.190 -15.415 598 H GLY 79 HN GLY 79 -9.342 -7.229 -18.545 599 HA2 GLY 79 HA3 GLY 79 -9.645 -9.875 -18.571 600 HA3 GLY 79 HA2 GLY 79 -10.834 -9.436 -19.794 601 H ILE 80 HN ILE 80 -9.960 -10.062 -21.652 602 HA ILE 80 HA ILE 80 -7.114 -9.680 -22.230 603 HB ILE 80 HB ILE 80 -9.334 -10.857 -23.932 604 HG12 ILE 80 HG12 ILE 80 -7.187 -12.272 -22.315 605 HG13 ILE 80 HG11 ILE 80 -8.841 -12.065 -21.754 606 HG21 ILE 80 HG21 ILE 80 -7.336 -11.873 -25.139 607 HG22 ILE 80 HG22 ILE 80 -6.308 -10.789 -24.207 608 HG23 ILE 80 HG23 ILE 80 -7.499 -10.129 -25.328 609 HD11 ILE 80 HD11 ILE 80 -9.682 -13.300 -23.701 610 HD12 ILE 80 HD12 ILE 80 -8.506 -14.279 -22.823 611 HD13 ILE 80 HD13 ILE 80 -8.039 -13.472 -24.319 612 H ARG 81 HN ARG 81 -6.594 -7.643 -22.752 613 HA ARG 81 HA ARG 81 -8.396 -5.992 -24.409 614 HB2 ARG 81 HB2 ARG 81 -5.828 -5.395 -22.922 615 HB3 ARG 81 HB1 ARG 81 -6.702 -4.211 -23.888 616 HG2 ARG 81 HG2 ARG 81 -8.666 -4.449 -22.468 617 HG3 ARG 81 HG1 ARG 81 -7.890 -5.731 -21.544 618 HD2 ARG 81 HD2 ARG 81 -7.698 -3.672 -20.302 619 HD3 ARG 81 HD1 ARG 81 -6.093 -4.085 -20.908 620 HE ARG 81 HE ARG 81 -7.456 -2.358 -22.736 621 HH11 ARG 81 HH21 ARG 81 -5.858 -2.467 -19.654 622 HH12 ARG 81 HH22 ARG 81 -5.397 -0.800 -19.684 623 HH21 ARG 81 HH11 ARG 81 -6.854 -0.141 -22.763 624 HH22 ARG 81 HH12 ARG 81 -5.969 0.512 -21.422 625 H LEU 82 HN LEU 82 -8.075 -5.674 -26.521 626 HA LEU 82 HA LEU 82 -5.822 -6.956 -27.869 627 HB2 LEU 82 HB2 LEU 82 -7.031 -6.514 -29.911 628 HB3 LEU 82 HB1 LEU 82 -8.127 -7.195 -28.717 629 HG LEU 82 HG LEU 82 -8.453 -4.480 -28.218 630 HD11 LEU 82 HD11 LEU 82 -8.711 -3.352 -30.393 631 HD12 LEU 82 HD12 LEU 82 -8.097 -4.781 -31.220 632 HD13 LEU 82 HD13 LEU 82 -7.040 -3.853 -30.161 633 HD21 LEU 82 HD21 LEU 82 -9.962 -6.202 -30.215 634 HD22 LEU 82 HD22 LEU 82 -10.559 -4.674 -29.565 635 HD23 LEU 82 HD23 LEU 82 -10.301 -6.049 -28.491 636 H ASN 83 HN ASN 83 -6.207 -4.082 -26.385 637 HA ASN 83 HA ASN 83 -4.862 -2.392 -28.355 638 HB2 ASN 83 HB2 ASN 83 -5.075 -0.629 -26.662 639 HB3 ASN 83 HB1 ASN 83 -6.624 -1.393 -26.989 640 HD21 ASN 83 HD21 ASN 83 -3.837 -2.075 -24.792 641 HD22 ASN 83 HD22 ASN 83 -4.806 -2.324 -23.421 642 H ARG 84 HN ARG 84 -3.586 -4.809 -27.121 643 HA ARG 84 HA ARG 84 -1.700 -4.304 -25.196 644 HB2 ARG 84 HB2 ARG 84 -0.258 -5.973 -26.302 645 HB3 ARG 84 HB1 ARG 84 -1.929 -6.503 -26.171 646 HG2 ARG 84 HG2 ARG 84 -2.318 -5.863 -28.532 647 HG3 ARG 84 HG1 ARG 84 -0.635 -5.329 -28.655 648 HD2 ARG 84 HD2 ARG 84 0.146 -7.585 -28.093 649 HD3 ARG 84 HD1 ARG 84 -1.516 -8.151 -27.951 650 HE ARG 84 HE ARG 84 -1.036 -7.025 -30.528 651 HH11 ARG 84 HH21 ARG 84 -0.457 -9.771 -28.490 652 HH12 ARG 84 HH22 ARG 84 -0.154 -10.861 -29.800 653 HH21 ARG 84 HH11 ARG 84 -0.644 -8.490 -32.279 654 HH22 ARG 84 HH12 ARG 84 -0.261 -10.141 -31.931 655 H SER 85 HN SER 85 -1.800 -2.976 -28.394 656 HA SER 85 HA SER 85 0.819 -2.247 -28.875 657 HB2 SER 85 HB2 SER 85 -1.650 -0.562 -29.366 658 HB3 SER 85 HB1 SER 85 -0.090 -0.365 -30.160 659 HG SER 85 HG SER 85 -0.341 -2.456 -31.014 660 H GLU 86 HN GLU 86 -1.312 -1.118 -26.403 661 HA GLU 86 HA GLU 86 0.057 1.346 -25.823 662 HB2 GLU 86 HB2 GLU 86 -1.854 -0.316 -24.159 663 HB3 GLU 86 HB1 GLU 86 -1.308 1.303 -23.752 664 HG2 GLU 86 HG2 GLU 86 -2.790 0.592 -26.293 665 HG3 GLU 86 HG1 GLU 86 -3.544 1.277 -24.857 666 H ARG 87 HN ARG 87 0.431 1.341 -23.145 667 HA ARG 87 HA ARG 87 2.393 -0.803 -22.539 668 HB2 ARG 87 HB2 ARG 87 2.867 2.181 -22.302 669 HB3 ARG 87 HB1 ARG 87 3.927 0.931 -21.644 670 HG2 ARG 87 HG2 ARG 87 4.268 -0.005 -23.900 671 HG3 ARG 87 HG1 ARG 87 3.186 1.209 -24.582 672 HD2 ARG 87 HD2 ARG 87 5.702 1.874 -23.046 673 HD3 ARG 87 HD1 ARG 87 5.658 1.754 -24.805 674 HE ARG 87 HE ARG 87 3.727 3.549 -24.451 675 HH11 ARG 87 HH21 ARG 87 6.797 3.278 -22.792 676 HH12 ARG 87 HH22 ARG 87 6.934 4.977 -22.541 677 HH21 ARG 87 HH11 ARG 87 3.938 5.768 -24.089 678 HH22 ARG 87 HH12 ARG 87 5.324 6.374 -23.243 679 H TRP 88 HN TRP 88 2.447 -1.457 -20.480 680 HA TRP 88 HA TRP 88 1.232 0.103 -18.326 681 HB2 TRP 88 HB2 TRP 88 0.102 -2.575 -19.127 682 HB3 TRP 88 HB1 TRP 88 -0.298 -1.714 -17.654 683 HD1 TRP 88 HD1 TRP 88 -0.761 -1.556 -21.444 684 HE1 TRP 88 HE1 TRP 88 -2.686 0.076 -21.970 685 HE3 TRP 88 HE3 TRP 88 -1.626 0.322 -16.777 686 HZ2 TRP 88 HZ2 TRP 88 -4.369 1.931 -20.595 687 HZ3 TRP 88 HZ3 TRP 88 -3.397 2.018 -16.412 688 HH2 TRP 88 HH2 TRP 88 -4.768 2.822 -18.313 689 H ASP 89 HN ASP 89 1.267 -1.337 -16.247 690 HA ASP 89 HA ASP 89 3.976 -2.156 -15.824 691 HB2 ASP 89 HB2 ASP 89 2.356 -1.103 -14.132 692 HB3 ASP 89 HB1 ASP 89 1.636 -2.701 -13.976 693 H ALA 90 HN ALA 90 3.906 -4.349 -14.235 694 HA ALA 90 HA ALA 90 2.428 -6.544 -15.318 695 HB1 ALA 90 HB1 ALA 90 5.364 -6.546 -16.043 696 HB2 ALA 90 HB2 ALA 90 4.097 -6.057 -17.167 697 HB3 ALA 90 HB3 ALA 90 4.126 -7.703 -16.536 698 H TYR 91 HN TYR 91 3.063 -8.604 -14.380 699 HA TYR 91 HA TYR 91 4.841 -8.443 -12.016 700 HB2 TYR 91 HB2 TYR 91 1.993 -9.485 -12.010 701 HB3 TYR 91 HB1 TYR 91 3.142 -9.669 -10.686 702 HD1 TYR 91 HD1 TYR 91 1.093 -7.259 -12.603 703 HD2 TYR 91 HD2 TYR 91 3.767 -7.775 -9.277 704 HE1 TYR 91 HE1 TYR 91 0.461 -5.022 -11.743 705 HE2 TYR 91 HE2 TYR 91 3.133 -5.536 -8.421 706 HH TYR 91 HH TYR 91 0.781 -4.016 -8.824 707 H CYS 92 HN CYS 92 5.636 -10.436 -11.324 708 HA CYS 92 HA CYS 92 5.246 -12.752 -13.157 709 HB2 CYS 92 HB2 CYS 92 7.332 -11.629 -13.734 710 HB3 CYS 92 HB1 CYS 92 7.863 -11.694 -12.061 711 H TYR 93 HN TYR 93 5.269 -14.734 -12.215 712 HA TYR 93 HA TYR 93 5.403 -14.859 -9.238 713 HB2 TYR 93 HB2 TYR 93 3.117 -15.122 -10.022 714 HB3 TYR 93 HB1 TYR 93 3.613 -16.358 -11.173 715 HD1 TYR 93 HD1 TYR 93 3.253 -15.565 -7.550 716 HD2 TYR 93 HD2 TYR 93 3.974 -18.642 -10.462 717 HE1 TYR 93 HE1 TYR 93 2.948 -17.294 -5.800 718 HE2 TYR 93 HE2 TYR 93 3.668 -20.369 -8.709 719 HH TYR 93 HH TYR 93 2.193 -19.914 -5.914 720 H ASN 94 HN ASN 94 6.997 -16.041 -8.500 721 HA ASN 94 HA ASN 94 8.204 -18.125 -10.236 722 HB2 ASN 94 HB2 ASN 94 9.847 -17.388 -7.912 723 HB3 ASN 94 HB1 ASN 94 10.260 -17.334 -9.622 724 HD21 ASN 94 HD21 ASN 94 8.633 -15.390 -10.677 725 HD22 ASN 94 HD22 ASN 94 8.852 -13.914 -9.871 726 HA PRO 95 HA PRO 95 7.328 -21.523 -7.556 727 HB2 PRO 95 HB2 PRO 95 10.256 -21.828 -6.900 728 HB3 PRO 95 HB1 PRO 95 9.112 -23.043 -7.517 729 HG2 PRO 95 HG2 PRO 95 10.919 -21.961 -9.129 730 HG3 PRO 95 HG1 PRO 95 9.264 -22.252 -9.704 731 HD2 PRO 95 HD2 PRO 95 10.533 -19.644 -8.872 732 HD3 PRO 95 HD1 PRO 95 9.396 -19.981 -10.195 733 H HIS 96 HN HIS 96 6.737 -21.799 -5.436 734 HA HIS 96 HA HIS 96 6.873 -19.800 -3.553 735 HB2 HIS 96 HB2 HIS 96 6.771 -22.777 -3.019 736 HB3 HIS 96 HB1 HIS 96 6.370 -21.520 -1.850 737 HD1 HIS 96 HD1 HIS 96 4.250 -20.020 -2.401 738 HD2 HIS 96 HD2 HIS 96 4.731 -23.366 -4.842 739 HE1 HIS 96 HE1 HIS 96 2.033 -20.379 -3.573 740 HE2 HIS 96 HE2 HIS 96 2.310 -22.415 -5.065 741 H ALA 97 HN ALA 97 8.464 -18.911 -2.435 742 HA ALA 97 HA ALA 97 10.494 -20.429 -1.113 743 HB1 ALA 97 HB1 ALA 97 12.424 -19.403 -2.374 744 HB2 ALA 97 HB2 ALA 97 11.268 -18.874 -3.596 745 HB3 ALA 97 HB3 ALA 97 11.509 -20.596 -3.298 746 H LYS 98 HN LYS 98 8.496 -18.457 -0.528 747 HA LYS 98 HA LYS 98 10.165 -16.104 0.294 748 HB2 LYS 98 HB2 LYS 98 8.099 -14.949 0.721 749 HB3 LYS 98 HB1 LYS 98 8.118 -15.509 -0.945 750 HG2 LYS 98 HG2 LYS 98 6.792 -17.540 -0.131 751 HG3 LYS 98 HG1 LYS 98 6.592 -16.690 1.400 752 HD2 LYS 98 HD2 LYS 98 5.696 -15.682 -1.325 753 HD3 LYS 98 HD1 LYS 98 4.643 -16.299 -0.057 754 HE2 LYS 98 HE2 LYS 98 5.598 -14.438 1.439 755 HE3 LYS 98 HE1 LYS 98 6.277 -13.749 -0.036 756 HZ1 LYS 98 HZ1 LYS 98 3.792 -13.286 0.890 757 HZ2 LYS 98 HZ2 LYS 98 3.514 -14.486 -0.282 758 HZ3 LYS 98 HZ3 LYS 98 4.302 -13.042 -0.708 Start of MODEL 18 1 H1 GLY 1 H1 GLY 1 3.422 -14.670 -2.589 2 H2 GLY 1 H2 GLY 1 3.324 -16.205 -1.867 3 H3 GLY 1 H3 GLY 1 2.689 -15.952 -3.424 4 HA2 GLY 1 HA3 GLY 1 5.553 -15.879 -2.637 5 HA3 GLY 1 HA2 GLY 1 4.764 -17.104 -3.633 6 H VAL 2 HN VAL 2 3.383 -14.128 -4.223 7 HA VAL 2 HA VAL 2 4.646 -13.933 -6.839 8 HB VAL 2 HB VAL 2 2.189 -13.658 -6.527 9 HG11 VAL 2 HG11 VAL 2 1.296 -11.672 -5.511 10 HG12 VAL 2 HG12 VAL 2 2.903 -11.002 -5.260 11 HG13 VAL 2 HG13 VAL 2 2.386 -12.416 -4.345 12 HG21 VAL 2 HG21 VAL 2 3.571 -11.165 -7.558 13 HG22 VAL 2 HG22 VAL 2 1.976 -11.749 -8.022 14 HG23 VAL 2 HG23 VAL 2 3.410 -12.667 -8.463 15 H TYR 3 HN TYR 3 5.666 -12.103 -7.663 16 HA TYR 3 HA TYR 3 6.788 -10.219 -5.639 17 HB2 TYR 3 HB2 TYR 3 8.396 -12.028 -6.409 18 HB3 TYR 3 HB1 TYR 3 8.298 -11.328 -8.023 19 HD1 TYR 3 HD2 TYR 3 9.235 -9.092 -8.489 20 HD2 TYR 3 HD1 TYR 3 9.493 -10.832 -4.566 21 HE1 TYR 3 HE2 TYR 3 10.935 -7.400 -7.838 22 HE2 TYR 3 HE1 TYR 3 11.188 -9.139 -3.928 23 HH TYR 3 HH TYR 3 11.709 -6.353 -5.555 24 H HIS 4 HN HIS 4 6.462 -8.175 -6.090 25 HA HIS 4 HA HIS 4 5.165 -7.361 -8.534 26 HB2 HIS 4 HB2 HIS 4 4.591 -6.308 -6.400 27 HB3 HIS 4 HB1 HIS 4 6.241 -5.711 -6.234 28 HD1 HIS 4 HD1 HIS 4 3.581 -5.578 -8.993 29 HD2 HIS 4 HD2 HIS 4 6.373 -3.112 -7.122 30 HE1 HIS 4 HE1 HIS 4 3.368 -3.298 -10.078 31 HE2 HIS 4 HE2 HIS 4 5.067 -1.786 -8.949 32 H ARG 5 HN ARG 5 5.953 -5.972 -10.123 33 HA ARG 5 HA ARG 5 8.877 -5.477 -10.186 34 HB2 ARG 5 HB2 ARG 5 7.207 -6.591 -12.453 35 HB3 ARG 5 HB1 ARG 5 8.881 -6.084 -12.592 36 HG2 ARG 5 HG2 ARG 5 7.947 -8.258 -10.696 37 HG3 ARG 5 HG1 ARG 5 8.560 -8.574 -12.317 38 HD2 ARG 5 HD2 ARG 5 10.674 -7.373 -11.697 39 HD3 ARG 5 HD1 ARG 5 10.090 -7.289 -10.050 40 HE ARG 5 HE ARG 5 9.998 -9.965 -10.885 41 HH11 ARG 5 HH21 ARG 5 12.088 -7.391 -9.910 42 HH12 ARG 5 HH22 ARG 5 13.409 -8.424 -9.485 43 HH21 ARG 5 HH11 ARG 5 11.740 -11.342 -10.328 44 HH22 ARG 5 HH12 ARG 5 13.211 -10.666 -9.728 45 H GLU 6 HN GLU 6 9.524 -3.641 -11.126 46 HA GLU 6 HA GLU 6 7.586 -1.898 -12.469 47 HB2 GLU 6 HB2 GLU 6 7.488 -1.453 -9.976 48 HB3 GLU 6 HB1 GLU 6 9.174 -0.956 -10.066 49 HG2 GLU 6 HG2 GLU 6 7.836 1.039 -10.230 50 HG3 GLU 6 HG1 GLU 6 8.492 0.727 -11.833 51 H ALA 7 HN ALA 7 8.516 -0.395 -13.797 52 HA ALA 7 HA ALA 7 10.955 -1.008 -15.003 53 HB1 ALA 7 HB1 ALA 7 10.793 1.215 -16.073 54 HB2 ALA 7 HB2 ALA 7 9.509 1.649 -14.942 55 HB3 ALA 7 HB3 ALA 7 9.254 0.352 -16.110 56 H ARG 8 HN ARG 8 13.025 -0.535 -14.595 57 HA ARG 8 HA ARG 8 13.737 0.791 -12.108 58 HB2 ARG 8 HB2 ARG 8 15.462 -0.398 -14.301 59 HB3 ARG 8 HB1 ARG 8 16.056 0.171 -12.750 60 HG2 ARG 8 HG2 ARG 8 13.929 -1.988 -12.977 61 HG3 ARG 8 HG1 ARG 8 15.645 -2.356 -12.969 62 HD2 ARG 8 HD2 ARG 8 15.820 -1.122 -10.756 63 HD3 ARG 8 HD1 ARG 8 14.063 -1.021 -10.757 64 HE ARG 8 HE ARG 8 14.001 -3.211 -10.076 65 HH11 ARG 8 HH21 ARG 8 17.078 -2.536 -11.537 66 HH12 ARG 8 HH22 ARG 8 17.677 -4.144 -11.321 67 HH21 ARG 8 HH11 ARG 8 14.800 -5.304 -9.789 68 HH22 ARG 8 HH12 ARG 8 16.388 -5.712 -10.334 69 H SER 9 HN SER 9 14.378 1.331 -15.558 70 HA SER 9 HA SER 9 15.153 4.143 -14.949 71 HB2 SER 9 HB2 SER 9 15.855 2.478 -17.373 72 HB3 SER 9 HB1 SER 9 16.422 4.107 -17.012 73 HG SER 9 HG SER 9 17.361 1.733 -16.150 74 H GLY 10 HN GLY 10 13.151 2.052 -16.955 75 HA2 GLY 10 HA3 GLY 10 12.089 4.246 -18.534 76 HA3 GLY 10 HA2 GLY 10 11.576 2.566 -18.586 77 H LYS 11 HN LYS 11 9.580 4.199 -18.722 78 HA LYS 11 HA LYS 11 8.291 4.124 -16.049 79 HB2 LYS 11 HB2 LYS 11 7.981 6.380 -18.046 80 HB3 LYS 11 HB1 LYS 11 7.224 6.266 -16.461 81 HG2 LYS 11 HG2 LYS 11 10.231 6.356 -16.864 82 HG3 LYS 11 HG1 LYS 11 9.255 7.788 -16.578 83 HD2 LYS 11 HD2 LYS 11 8.471 6.781 -14.425 84 HD3 LYS 11 HD1 LYS 11 9.559 5.424 -14.696 85 HE2 LYS 11 HE2 LYS 11 11.483 6.953 -14.752 86 HE3 LYS 11 HE1 LYS 11 10.405 8.319 -14.474 87 HZ1 LYS 11 HZ1 LYS 11 10.733 6.002 -12.646 88 HZ2 LYS 11 HZ2 LYS 11 9.750 7.360 -12.375 89 HZ3 LYS 11 HZ3 LYS 11 11.440 7.525 -12.423 90 H TYR 12 HN TYR 12 7.113 2.333 -16.507 91 HA TYR 12 HA TYR 12 5.417 1.052 -17.385 92 HB2 TYR 12 HB2 TYR 12 4.322 3.792 -18.069 93 HB3 TYR 12 HB1 TYR 12 3.401 2.296 -18.112 94 HD1 TYR 12 HD2 TYR 12 2.903 1.051 -16.011 95 HD2 TYR 12 HD1 TYR 12 4.870 4.873 -15.956 96 HE1 TYR 12 HE2 TYR 12 2.384 1.286 -13.598 97 HE2 TYR 12 HE1 TYR 12 4.344 5.108 -13.546 98 HH TYR 12 HH TYR 12 3.772 3.002 -11.569 99 H LYS 13 HN LYS 13 7.153 0.472 -19.026 100 HA LYS 13 HA LYS 13 6.108 0.952 -21.747 101 HB2 LYS 13 HB2 LYS 13 8.979 1.330 -20.876 102 HB3 LYS 13 HB1 LYS 13 8.486 1.151 -22.561 103 HG2 LYS 13 HG2 LYS 13 6.994 3.113 -22.336 104 HG3 LYS 13 HG1 LYS 13 7.503 3.303 -20.658 105 HD2 LYS 13 HD2 LYS 13 9.824 3.641 -21.390 106 HD3 LYS 13 HD1 LYS 13 9.329 3.437 -23.068 107 HE2 LYS 13 HE2 LYS 13 7.851 5.396 -22.886 108 HE3 LYS 13 HE1 LYS 13 8.312 5.599 -21.197 109 HZ1 LYS 13 HZ1 LYS 13 10.275 6.492 -21.752 110 HZ2 LYS 13 HZ2 LYS 13 9.537 6.802 -23.251 111 HZ3 LYS 13 HZ3 LYS 13 10.523 5.432 -23.055 112 H LEU 14 HN LEU 14 5.711 -1.293 -20.097 113 HA LEU 14 HA LEU 14 7.385 -3.377 -21.433 114 HB2 LEU 14 HB2 LEU 14 5.939 -3.679 -18.796 115 HB3 LEU 14 HB1 LEU 14 7.086 -4.795 -19.525 116 HG LEU 14 HG LEU 14 7.723 -1.987 -18.556 117 HD11 LEU 14 HD11 LEU 14 8.529 -4.696 -17.447 118 HD12 LEU 14 HD12 LEU 14 7.276 -3.663 -16.762 119 HD13 LEU 14 HD13 LEU 14 8.953 -3.124 -16.772 120 HD21 LEU 14 HD21 LEU 14 9.236 -2.469 -20.357 121 HD22 LEU 14 HD22 LEU 14 9.425 -4.147 -19.850 122 HD23 LEU 14 HD23 LEU 14 10.131 -2.848 -18.892 123 H THR 15 HN THR 15 6.358 -4.564 -22.873 124 HA THR 15 HA THR 15 3.391 -4.703 -22.809 125 HB THR 15 HB THR 15 3.572 -5.484 -25.126 126 HG1 THR 15 HG1 THR 15 6.091 -5.915 -24.387 127 HG21 THR 15 HG21 THR 15 3.441 -3.069 -24.664 128 HG22 THR 15 HG22 THR 15 4.402 -3.388 -26.103 129 HG23 THR 15 HG23 THR 15 5.199 -2.986 -24.583 130 H TYR 16 HN TYR 16 2.430 -6.780 -23.494 131 HA TYR 16 HA TYR 16 2.951 -8.846 -21.749 132 HB2 TYR 16 HB2 TYR 16 0.878 -8.713 -22.964 133 HB3 TYR 16 HB1 TYR 16 1.699 -8.901 -24.501 134 HD1 TYR 16 HD1 TYR 16 1.034 -10.623 -21.258 135 HD2 TYR 16 HD2 TYR 16 2.042 -11.095 -25.411 136 HE1 TYR 16 HE1 TYR 16 0.758 -13.078 -21.049 137 HE2 TYR 16 HE2 TYR 16 1.774 -13.554 -25.193 138 HH TYR 16 HH TYR 16 1.158 -15.068 -22.057 139 H ALA 17 HN ALA 17 3.886 -8.843 -25.208 140 HA ALA 17 HA ALA 17 5.411 -11.154 -25.223 141 HB1 ALA 17 HB1 ALA 17 4.902 -9.962 -27.272 142 HB2 ALA 17 HB2 ALA 17 6.652 -10.128 -27.120 143 HB3 ALA 17 HB3 ALA 17 5.878 -8.588 -26.751 144 H GLU 18 HN GLU 18 6.430 -7.872 -24.313 145 HA GLU 18 HA GLU 18 9.158 -8.520 -23.873 146 HB2 GLU 18 HB2 GLU 18 8.355 -6.204 -24.234 147 HB3 GLU 18 HB1 GLU 18 7.533 -6.261 -22.675 148 HG2 GLU 18 HG2 GLU 18 9.623 -6.540 -21.503 149 HG3 GLU 18 HG1 GLU 18 10.506 -6.741 -23.013 150 H ALA 19 HN ALA 19 6.269 -8.886 -21.977 151 HA ALA 19 HA ALA 19 7.523 -9.094 -19.417 152 HB1 ALA 19 HB1 ALA 19 5.055 -8.652 -19.893 153 HB2 ALA 19 HB2 ALA 19 5.401 -9.805 -18.611 154 HB3 ALA 19 HB3 ALA 19 4.898 -10.378 -20.197 155 H LYS 20 HN LYS 20 6.627 -11.462 -21.895 156 HA LYS 20 HA LYS 20 7.290 -13.777 -20.391 157 HB2 LYS 20 HB2 LYS 20 7.189 -13.386 -23.386 158 HB3 LYS 20 HB1 LYS 20 7.246 -14.939 -22.553 159 HG2 LYS 20 HG2 LYS 20 5.116 -14.182 -21.312 160 HG3 LYS 20 HG1 LYS 20 5.020 -12.883 -22.497 161 HD2 LYS 20 HD2 LYS 20 5.140 -15.825 -23.204 162 HD3 LYS 20 HD1 LYS 20 3.655 -14.895 -23.085 163 HE2 LYS 20 HE2 LYS 20 4.600 -13.327 -24.819 164 HE3 LYS 20 HE1 LYS 20 5.925 -14.466 -25.041 165 HZ1 LYS 20 HZ1 LYS 20 4.544 -16.044 -25.922 166 HZ2 LYS 20 HZ2 LYS 20 3.826 -14.624 -26.519 167 HZ3 LYS 20 HZ3 LYS 20 3.152 -15.423 -25.179 168 H ALA 21 HN ALA 21 9.152 -11.447 -22.135 169 HA ALA 21 HA ALA 21 11.432 -13.093 -22.668 170 HB1 ALA 21 HB1 ALA 21 11.303 -10.085 -22.364 171 HB2 ALA 21 HB2 ALA 21 10.940 -10.961 -23.851 172 HB3 ALA 21 HB3 ALA 21 12.568 -11.009 -23.174 173 H VAL 22 HN VAL 22 10.887 -10.550 -20.194 174 HA VAL 22 HA VAL 22 13.304 -11.117 -18.785 175 HB VAL 22 HB VAL 22 12.189 -8.944 -18.626 176 HG11 VAL 22 HG11 VAL 22 10.037 -10.299 -16.972 177 HG12 VAL 22 HG12 VAL 22 9.840 -9.950 -18.689 178 HG13 VAL 22 HG13 VAL 22 10.078 -8.633 -17.543 179 HG21 VAL 22 HG21 VAL 22 12.132 -10.307 -15.913 180 HG22 VAL 22 HG22 VAL 22 12.461 -8.609 -16.252 181 HG23 VAL 22 HG23 VAL 22 13.624 -9.844 -16.735 182 H CYS 23 HN CYS 23 9.923 -12.062 -18.237 183 HA CYS 23 HA CYS 23 10.829 -14.061 -16.216 184 HB2 CYS 23 HB2 CYS 23 8.396 -12.318 -16.445 185 HB3 CYS 23 HB1 CYS 23 8.214 -13.892 -15.675 186 H GLU 24 HN GLU 24 9.596 -16.047 -16.192 187 HA GLU 24 HA GLU 24 8.420 -17.818 -17.137 188 HB2 GLU 24 HB2 GLU 24 7.076 -15.977 -18.410 189 HB3 GLU 24 HB1 GLU 24 8.128 -16.360 -19.769 190 HG2 GLU 24 HG2 GLU 24 7.438 -18.710 -19.673 191 HG3 GLU 24 HG1 GLU 24 6.395 -18.360 -18.294 192 H PHE 25 HN PHE 25 10.651 -16.108 -19.310 193 HA PHE 25 HA PHE 25 11.515 -18.360 -20.780 194 HB2 PHE 25 HB2 PHE 25 11.869 -16.036 -21.491 195 HB3 PHE 25 HB1 PHE 25 12.964 -15.778 -20.139 196 HD1 PHE 25 HD1 PHE 25 12.501 -17.561 -23.363 197 HD2 PHE 25 HD2 PHE 25 15.229 -16.657 -20.166 198 HE1 PHE 25 HE1 PHE 25 14.392 -18.415 -24.727 199 HE2 PHE 25 HE2 PHE 25 17.112 -17.512 -21.530 200 HZ PHE 25 HZ PHE 25 16.694 -18.391 -23.810 201 H GLU 26 HN GLU 26 12.855 -16.782 -17.890 202 HA GLU 26 HA GLU 26 14.988 -18.723 -17.627 203 HB2 GLU 26 HB2 GLU 26 15.456 -17.568 -15.486 204 HB3 GLU 26 HB1 GLU 26 15.393 -16.466 -16.857 205 HG2 GLU 26 HG2 GLU 26 13.133 -15.783 -16.261 206 HG3 GLU 26 HG1 GLU 26 13.078 -16.966 -14.958 207 H GLY 27 HN GLY 27 11.978 -19.414 -17.478 208 HA2 GLY 27 HA3 GLY 27 11.116 -21.421 -16.567 209 HA3 GLY 27 HA2 GLY 27 12.263 -21.316 -15.239 210 H GLY 28 HN GLY 28 11.377 -18.317 -15.156 211 HA2 GLY 28 HA3 GLY 28 9.645 -18.539 -12.952 212 HA3 GLY 28 HA2 GLY 28 9.941 -17.063 -13.866 213 H HIS 29 HN HIS 29 7.747 -16.472 -13.652 214 HA HIS 29 HA HIS 29 6.078 -17.267 -15.816 215 HB2 HIS 29 HB2 HIS 29 5.720 -19.265 -14.439 216 HB3 HIS 29 HB1 HIS 29 5.286 -18.262 -13.062 217 HD1 HIS 29 HD1 HIS 29 4.013 -19.431 -16.409 218 HD2 HIS 29 HD2 HIS 29 2.667 -17.214 -13.147 219 HE1 HIS 29 HE1 HIS 29 1.511 -19.162 -16.710 220 HE2 HIS 29 HE2 HIS 29 0.675 -17.810 -14.730 221 H LEU 30 HN LEU 30 4.410 -15.806 -16.125 222 HA LEU 30 HA LEU 30 4.510 -13.341 -14.600 223 HB2 LEU 30 HB2 LEU 30 2.594 -14.167 -16.797 224 HB3 LEU 30 HB1 LEU 30 2.858 -12.531 -16.204 225 HG LEU 30 HG LEU 30 4.972 -14.254 -17.544 226 HD11 LEU 30 HD11 LEU 30 3.366 -11.899 -18.588 227 HD12 LEU 30 HD12 LEU 30 3.171 -13.577 -19.090 228 HD13 LEU 30 HD13 LEU 30 4.663 -12.717 -19.456 229 HD21 LEU 30 HD21 LEU 30 4.952 -11.397 -16.506 230 HD22 LEU 30 HD22 LEU 30 6.116 -11.942 -17.715 231 HD23 LEU 30 HD23 LEU 30 6.092 -12.686 -16.125 232 H ALA 31 HN ALA 31 3.108 -12.622 -13.104 233 HA ALA 31 HA ALA 31 1.395 -14.454 -11.779 234 HB1 ALA 31 HB1 ALA 31 2.495 -12.509 -10.678 235 HB2 ALA 31 HB2 ALA 31 0.758 -12.578 -10.385 236 HB3 ALA 31 HB3 ALA 31 1.406 -11.444 -11.564 237 H THR 32 HN THR 32 -0.694 -14.907 -12.016 238 HA THR 32 HA THR 32 -2.353 -13.238 -13.850 239 HB THR 32 HB THR 32 -1.920 -15.207 -15.089 240 HG1 THR 32 HG1 THR 32 -4.268 -15.898 -13.690 241 HG21 THR 32 HG21 THR 32 -2.345 -17.491 -13.987 242 HG22 THR 32 HG22 THR 32 -2.265 -16.640 -12.448 243 HG23 THR 32 HG23 THR 32 -0.868 -16.651 -13.520 244 H TYR 33 HN TYR 33 -4.692 -13.599 -13.542 245 HA TYR 33 HA TYR 33 -5.577 -12.872 -11.032 246 HB2 TYR 33 HB2 TYR 33 -6.907 -12.635 -13.072 247 HB3 TYR 33 HB1 TYR 33 -7.082 -14.383 -13.179 248 HD1 TYR 33 HD2 TYR 33 -8.422 -15.625 -11.491 249 HD2 TYR 33 HD1 TYR 33 -8.233 -11.330 -11.495 250 HE1 TYR 33 HE2 TYR 33 -10.427 -15.533 -10.037 251 HE2 TYR 33 HE1 TYR 33 -10.243 -11.244 -10.042 252 HH TYR 33 HH TYR 33 -12.337 -13.117 -9.693 253 H LYS 34 HN LYS 34 -4.729 -16.011 -12.186 254 HA LYS 34 HA LYS 34 -6.179 -17.544 -10.221 255 HB2 LYS 34 HB2 LYS 34 -5.420 -18.401 -12.450 256 HB3 LYS 34 HB1 LYS 34 -3.766 -18.363 -11.856 257 HG2 LYS 34 HG2 LYS 34 -4.428 -19.892 -9.998 258 HG3 LYS 34 HG1 LYS 34 -6.045 -19.988 -10.689 259 HD2 LYS 34 HD2 LYS 34 -3.523 -20.737 -12.204 260 HD3 LYS 34 HD1 LYS 34 -4.508 -21.900 -11.327 261 HE2 LYS 34 HE2 LYS 34 -6.486 -21.054 -12.765 262 HE3 LYS 34 HE1 LYS 34 -5.261 -20.297 -13.782 263 HZ1 LYS 34 HZ1 LYS 34 -4.492 -22.273 -14.506 264 HZ2 LYS 34 HZ2 LYS 34 -6.086 -22.754 -14.174 265 HZ3 LYS 34 HZ3 LYS 34 -4.846 -23.087 -13.062 266 H GLN 35 HN GLN 35 -2.693 -16.878 -10.656 267 HA GLN 35 HA GLN 35 -1.984 -17.839 -8.055 268 HB2 GLN 35 HB2 GLN 35 -0.460 -16.187 -10.087 269 HB3 GLN 35 HB1 GLN 35 0.241 -16.744 -8.569 270 HG2 GLN 35 HG2 GLN 35 -0.234 -19.080 -9.199 271 HG3 GLN 35 HG1 GLN 35 -0.937 -18.532 -10.718 272 HE21 GLN 35 HE21 GLN 35 0.592 -19.175 -12.276 273 HE22 GLN 35 HE22 GLN 35 2.243 -18.787 -12.209 274 H LEU 36 HN LEU 36 -2.737 -14.677 -9.402 275 HA LEU 36 HA LEU 36 -1.814 -13.067 -7.277 276 HB2 LEU 36 HB2 LEU 36 -4.046 -12.679 -9.271 277 HB3 LEU 36 HB1 LEU 36 -3.571 -11.423 -8.151 278 HG LEU 36 HG LEU 36 -1.627 -12.717 -10.096 279 HD11 LEU 36 HD11 LEU 36 -3.467 -11.591 -11.325 280 HD12 LEU 36 HD12 LEU 36 -1.953 -10.709 -11.501 281 HD13 LEU 36 HD13 LEU 36 -3.186 -10.125 -10.390 282 HD21 LEU 36 HD21 LEU 36 -0.426 -10.467 -9.682 283 HD22 LEU 36 HD22 LEU 36 -0.410 -11.603 -8.345 284 HD23 LEU 36 HD23 LEU 36 -1.532 -10.245 -8.327 285 H GLU 37 HN GLU 37 -4.904 -14.732 -7.797 286 HA GLU 37 HA GLU 37 -6.355 -13.615 -5.681 287 HB2 GLU 37 HB2 GLU 37 -7.299 -15.054 -7.486 288 HB3 GLU 37 HB1 GLU 37 -6.536 -16.451 -6.732 289 HG2 GLU 37 HG2 GLU 37 -8.842 -16.373 -6.006 290 HG3 GLU 37 HG1 GLU 37 -7.838 -15.937 -4.630 291 H ALA 38 HN ALA 38 -3.899 -16.108 -5.708 292 HA ALA 38 HA ALA 38 -4.383 -16.994 -2.998 293 HB1 ALA 38 HB1 ALA 38 -2.244 -18.227 -3.307 294 HB2 ALA 38 HB2 ALA 38 -2.062 -17.459 -4.886 295 HB3 ALA 38 HB3 ALA 38 -3.416 -18.547 -4.584 296 H ALA 39 HN ALA 39 -2.557 -14.487 -4.526 297 HA ALA 39 HA ALA 39 -0.702 -14.073 -2.359 298 HB1 ALA 39 HB1 ALA 39 -0.079 -13.415 -4.605 299 HB2 ALA 39 HB2 ALA 39 -0.144 -11.985 -3.574 300 HB3 ALA 39 HB3 ALA 39 -1.456 -12.319 -4.703 301 H ARG 40 HN ARG 40 -3.677 -12.469 -3.467 302 HA ARG 40 HA ARG 40 -3.751 -10.344 -1.659 303 HB2 ARG 40 HB2 ARG 40 -5.918 -11.978 -2.973 304 HB3 ARG 40 HB1 ARG 40 -6.357 -10.714 -1.840 305 HG2 ARG 40 HG2 ARG 40 -4.601 -10.258 -4.274 306 HG3 ARG 40 HG1 ARG 40 -6.343 -10.021 -4.271 307 HD2 ARG 40 HD2 ARG 40 -4.214 -8.417 -2.845 308 HD3 ARG 40 HD1 ARG 40 -5.554 -7.847 -3.839 309 HE ARG 40 HE ARG 40 -5.578 -8.241 -1.011 310 HH11 ARG 40 HH21 ARG 40 -7.591 -8.777 -3.794 311 HH12 ARG 40 HH22 ARG 40 -9.069 -8.395 -2.976 312 HH21 ARG 40 HH11 ARG 40 -7.514 -7.760 0.049 313 HH22 ARG 40 HH12 ARG 40 -9.022 -7.803 -0.812 314 H LYS 41 HN LYS 41 -4.480 -13.744 -1.152 315 HA LYS 41 HA LYS 41 -5.773 -13.451 1.373 316 HB2 LYS 41 HB2 LYS 41 -4.284 -15.826 0.222 317 HB3 LYS 41 HB1 LYS 41 -5.379 -15.874 1.601 318 HG2 LYS 41 HG2 LYS 41 -6.371 -14.774 -1.044 319 HG3 LYS 41 HG1 LYS 41 -6.274 -16.515 -0.824 320 HD2 LYS 41 HD2 LYS 41 -7.662 -14.871 1.307 321 HD3 LYS 41 HD1 LYS 41 -8.514 -15.206 -0.195 322 HE2 LYS 41 HE2 LYS 41 -8.310 -17.589 0.135 323 HE3 LYS 41 HE1 LYS 41 -7.239 -17.361 1.516 324 HZ1 LYS 41 HZ1 LYS 41 -9.866 -17.707 1.729 325 HZ2 LYS 41 HZ2 LYS 41 -9.805 -16.011 1.661 326 HZ3 LYS 41 HZ3 LYS 41 -8.945 -16.846 2.865 327 H ILE 42 HN ILE 42 -2.642 -12.804 0.482 328 HA ILE 42 HA ILE 42 -1.508 -13.510 3.142 329 HB ILE 42 HB ILE 42 -0.058 -12.847 0.559 330 HG12 ILE 42 HG12 ILE 42 -0.359 -15.519 1.979 331 HG13 ILE 42 HG11 ILE 42 -1.322 -15.039 0.586 332 HG21 ILE 42 HG21 ILE 42 1.834 -14.039 2.106 333 HG22 ILE 42 HG22 ILE 42 0.853 -13.354 3.394 334 HG23 ILE 42 HG23 ILE 42 1.557 -12.304 2.168 335 HD11 ILE 42 HD11 ILE 42 1.676 -15.448 0.695 336 HD12 ILE 42 HD12 ILE 42 0.865 -14.675 -0.665 337 HD13 ILE 42 HD13 ILE 42 0.502 -16.351 -0.260 338 H GLY 43 HN GLY 43 -3.153 -11.071 2.074 339 HA2 GLY 43 HA3 GLY 43 -3.303 -8.911 2.917 340 HA3 GLY 43 HA2 GLY 43 -1.717 -9.098 3.651 341 H PHE 44 HN PHE 44 -1.902 -9.942 0.332 342 HA PHE 44 HA PHE 44 -0.017 -7.980 -0.436 343 HB2 PHE 44 HB2 PHE 44 -0.780 -10.326 -1.494 344 HB3 PHE 44 HB1 PHE 44 -1.766 -9.296 -2.506 345 HD1 PHE 44 HD1 PHE 44 1.734 -9.535 -1.175 346 HD2 PHE 44 HD2 PHE 44 -0.765 -8.462 -4.506 347 HE1 PHE 44 HE1 PHE 44 3.748 -9.075 -2.542 348 HE2 PHE 44 HE2 PHE 44 1.256 -8.005 -5.865 349 HZ PHE 44 HZ PHE 44 3.508 -8.308 -4.885 350 H HIS 45 HN HIS 45 -0.229 -6.076 -1.556 351 HA HIS 45 HA HIS 45 -2.844 -5.121 -2.434 352 HB2 HIS 45 HB2 HIS 45 -3.034 -4.558 -0.115 353 HB3 HIS 45 HB1 HIS 45 -1.387 -3.946 -0.055 354 HD1 HIS 45 HD1 HIS 45 -3.380 -2.990 -3.036 355 HD2 HIS 45 HD2 HIS 45 -2.523 -1.379 0.712 356 HE1 HIS 45 HE1 HIS 45 -4.082 -0.556 -3.123 357 HE2 HIS 45 HE2 HIS 45 -3.566 0.438 -0.845 358 H VAL 46 HN VAL 46 -2.286 -4.535 -4.420 359 HA VAL 46 HA VAL 46 -0.148 -2.510 -4.759 360 HB VAL 46 HB VAL 46 0.583 -3.686 -6.860 361 HG11 VAL 46 HG11 VAL 46 0.908 -5.213 -4.256 362 HG12 VAL 46 HG12 VAL 46 1.885 -3.844 -4.782 363 HG13 VAL 46 HG13 VAL 46 1.954 -5.367 -5.668 364 HG21 VAL 46 HG21 VAL 46 -1.246 -5.167 -7.358 365 HG22 VAL 46 HG22 VAL 46 -1.224 -5.862 -5.742 366 HG23 VAL 46 HG23 VAL 46 0.080 -6.208 -6.872 367 H CYS 47 HN CYS 47 -1.188 -0.795 -5.486 368 HA CYS 47 HA CYS 47 -3.547 -1.060 -7.220 369 HB2 CYS 47 HB2 CYS 47 -3.202 0.561 -5.163 370 HB3 CYS 47 HB1 CYS 47 -2.396 1.591 -6.338 371 H ALA 48 HN ALA 48 -2.161 -1.964 -8.954 372 HA ALA 48 HA ALA 48 -1.403 0.137 -10.822 373 HB1 ALA 48 HB1 ALA 48 0.639 -1.940 -9.992 374 HB2 ALA 48 HB2 ALA 48 0.682 -0.243 -9.513 375 HB3 ALA 48 HB3 ALA 48 0.850 -0.685 -11.212 376 H ALA 49 HN ALA 49 -1.814 -0.452 -12.855 377 HA ALA 49 HA ALA 49 -2.799 -3.186 -13.345 378 HB1 ALA 49 HB1 ALA 49 -2.996 -0.676 -15.016 379 HB2 ALA 49 HB2 ALA 49 -4.262 -1.348 -13.996 380 HB3 ALA 49 HB3 ALA 49 -3.719 -2.231 -15.419 381 H GLY 50 HN GLY 50 -1.903 -4.579 -14.766 382 HA2 GLY 50 HA3 GLY 50 0.303 -3.709 -16.520 383 HA3 GLY 50 HA2 GLY 50 0.695 -4.877 -15.265 384 H TRP 51 HN TRP 51 1.295 -5.953 -17.429 385 HA TRP 51 HA TRP 51 -0.976 -7.283 -18.760 386 HB2 TRP 51 HB2 TRP 51 1.999 -7.218 -19.331 387 HB3 TRP 51 HB1 TRP 51 0.856 -8.212 -20.230 388 HD1 TRP 51 HD1 TRP 51 2.162 -4.716 -19.957 389 HE1 TRP 51 HE1 TRP 51 0.964 -3.207 -21.665 390 HE3 TRP 51 HE3 TRP 51 -1.582 -7.849 -21.462 391 HZ2 TRP 51 HZ2 TRP 51 -1.254 -3.304 -23.447 392 HZ3 TRP 51 HZ3 TRP 51 -3.222 -7.111 -23.170 393 HH2 TRP 51 HH2 TRP 51 -3.064 -4.845 -24.163 394 H MET 52 HN MET 52 -1.334 -9.448 -18.669 395 HA MET 52 HA MET 52 0.471 -11.185 -17.118 396 HB2 MET 52 HB2 MET 52 -2.482 -10.896 -16.473 397 HB3 MET 52 HB1 MET 52 -1.381 -12.070 -15.773 398 HG2 MET 52 HG2 MET 52 -1.398 -10.379 -14.142 399 HG3 MET 52 HG1 MET 52 0.033 -9.958 -15.078 400 HE1 MET 52 HE1 MET 52 -3.198 -8.656 -13.581 401 HE2 MET 52 HE2 MET 52 -2.725 -6.986 -13.844 402 HE3 MET 52 HE3 MET 52 -1.580 -8.110 -13.128 403 H ALA 53 HN ALA 53 -0.452 -13.481 -17.156 404 HA ALA 53 HA ALA 53 -0.366 -14.636 -19.571 405 HB1 ALA 53 HB1 ALA 53 -0.631 -15.910 -17.482 406 HB2 ALA 53 HB2 ALA 53 -1.733 -16.485 -18.731 407 HB3 ALA 53 HB3 ALA 53 -2.336 -15.462 -17.429 408 H LYS 54 HN LYS 54 -1.637 -15.108 -21.302 409 HA LYS 54 HA LYS 54 -3.267 -14.822 -22.883 410 HB2 LYS 54 HB2 LYS 54 -5.135 -14.224 -20.571 411 HB3 LYS 54 HB1 LYS 54 -5.573 -14.748 -22.190 412 HG2 LYS 54 HG2 LYS 54 -4.387 -16.884 -21.825 413 HG3 LYS 54 HG1 LYS 54 -3.974 -16.367 -20.188 414 HD2 LYS 54 HD2 LYS 54 -6.350 -16.206 -19.612 415 HD3 LYS 54 HD1 LYS 54 -6.799 -16.647 -21.257 416 HE2 LYS 54 HE2 LYS 54 -6.954 -18.613 -19.814 417 HE3 LYS 54 HE1 LYS 54 -5.630 -18.826 -20.958 418 HZ1 LYS 54 HZ1 LYS 54 -5.067 -19.421 -18.636 419 HZ2 LYS 54 HZ2 LYS 54 -5.286 -17.794 -18.199 420 HZ3 LYS 54 HZ3 LYS 54 -4.059 -18.225 -19.292 421 H GLY 55 HN GLY 55 -1.814 -12.472 -21.441 422 HA2 GLY 55 HA3 GLY 55 -1.597 -10.220 -21.854 423 HA3 GLY 55 HA2 GLY 55 -2.784 -10.412 -23.134 424 H ARG 56 HN ARG 56 -3.777 -11.490 -20.037 425 HA ARG 56 HA ARG 56 -5.903 -9.571 -19.922 426 HB2 ARG 56 HB2 ARG 56 -5.930 -11.968 -19.031 427 HB3 ARG 56 HB1 ARG 56 -4.994 -11.377 -17.666 428 HG2 ARG 56 HG2 ARG 56 -6.780 -9.782 -17.102 429 HG3 ARG 56 HG1 ARG 56 -7.705 -10.294 -18.508 430 HD2 ARG 56 HD2 ARG 56 -7.671 -12.631 -17.529 431 HD3 ARG 56 HD1 ARG 56 -7.008 -11.931 -16.060 432 HE ARG 56 HE ARG 56 -9.721 -11.842 -16.865 433 HH11 ARG 56 HH21 ARG 56 -7.252 -9.982 -15.301 434 HH12 ARG 56 HH22 ARG 56 -8.367 -9.011 -14.397 435 HH21 ARG 56 HH11 ARG 56 -11.166 -10.593 -15.705 436 HH22 ARG 56 HH12 ARG 56 -10.582 -9.366 -14.618 437 H VAL 57 HN VAL 57 -6.311 -8.144 -18.065 438 HA VAL 57 HA VAL 57 -3.859 -7.106 -16.744 439 HB VAL 57 HB VAL 57 -4.253 -5.603 -18.618 440 HG11 VAL 57 HG11 VAL 57 -6.572 -6.134 -19.092 441 HG12 VAL 57 HG12 VAL 57 -6.442 -4.405 -18.783 442 HG13 VAL 57 HG13 VAL 57 -7.091 -5.471 -17.547 443 HG21 VAL 57 HG21 VAL 57 -4.421 -3.531 -17.424 444 HG22 VAL 57 HG22 VAL 57 -3.714 -4.670 -16.282 445 HG23 VAL 57 HG23 VAL 57 -5.419 -4.246 -16.157 446 H GLY 58 HN GLY 58 -4.141 -6.194 -14.746 447 HA2 GLY 58 HA3 GLY 58 -6.725 -5.843 -13.539 448 HA3 GLY 58 HA2 GLY 58 -5.938 -7.328 -13.012 449 H TYR 59 HN TYR 59 -6.532 -5.457 -11.180 450 HA TYR 59 HA TYR 59 -3.886 -4.773 -10.169 451 HB2 TYR 59 HB2 TYR 59 -4.539 -2.383 -9.702 452 HB3 TYR 59 HB1 TYR 59 -4.228 -2.758 -11.391 453 HD1 TYR 59 HD2 TYR 59 -6.174 -3.166 -12.957 454 HD2 TYR 59 HD1 TYR 59 -6.692 -1.560 -9.003 455 HE1 TYR 59 HE2 TYR 59 -8.407 -2.296 -13.599 456 HE2 TYR 59 HE1 TYR 59 -8.919 -0.691 -9.648 457 HH TYR 59 HH TYR 59 -10.056 -0.833 -12.976 458 HA PRO 60 HA PRO 60 -6.977 -6.241 -7.026 459 HB2 PRO 60 HB2 PRO 60 -4.452 -7.517 -6.011 460 HB3 PRO 60 HB1 PRO 60 -6.068 -8.229 -6.195 461 HG2 PRO 60 HG2 PRO 60 -4.144 -8.865 -7.902 462 HG3 PRO 60 HG1 PRO 60 -5.797 -8.572 -8.489 463 HD2 PRO 60 HD2 PRO 60 -3.417 -6.707 -8.579 464 HD3 PRO 60 HD1 PRO 60 -4.615 -7.054 -9.850 465 H ILE 61 HN ILE 61 -7.427 -5.086 -5.233 466 HA ILE 61 HA ILE 61 -5.271 -3.926 -3.602 467 HB ILE 61 HB ILE 61 -6.145 -1.690 -3.647 468 HG12 ILE 61 HG12 ILE 61 -8.534 -2.059 -3.913 469 HG13 ILE 61 HG11 ILE 61 -7.982 -1.040 -5.232 470 HG21 ILE 61 HG21 ILE 61 -5.566 -1.045 -5.884 471 HG22 ILE 61 HG22 ILE 61 -5.949 -2.636 -6.500 472 HG23 ILE 61 HG23 ILE 61 -4.559 -2.419 -5.449 473 HD11 ILE 61 HD11 ILE 61 -9.357 -2.589 -6.318 474 HD12 ILE 61 HD12 ILE 61 -8.818 -3.931 -5.316 475 HD13 ILE 61 HD13 ILE 61 -7.757 -3.277 -6.567 476 H VAL 62 HN VAL 62 -5.824 -3.571 -1.491 477 HA VAL 62 HA VAL 62 -8.215 -4.920 -0.542 478 HB VAL 62 HB VAL 62 -7.311 -4.503 1.680 479 HG11 VAL 62 HG11 VAL 62 -6.452 -6.430 0.481 480 HG12 VAL 62 HG12 VAL 62 -5.133 -5.706 1.379 481 HG13 VAL 62 HG13 VAL 62 -5.269 -5.439 -0.355 482 HG21 VAL 62 HG21 VAL 62 -5.249 -2.857 0.173 483 HG22 VAL 62 HG22 VAL 62 -5.045 -3.377 1.846 484 HG23 VAL 62 HG23 VAL 62 -6.359 -2.287 1.419 485 H LYS 63 HN LYS 63 -7.061 -1.641 -0.944 486 HA LYS 63 HA LYS 63 -9.748 -0.660 -0.406 487 HB2 LYS 63 HB2 LYS 63 -7.373 0.070 1.311 488 HB3 LYS 63 HB1 LYS 63 -8.753 1.156 1.163 489 HG2 LYS 63 HG2 LYS 63 -10.217 -0.842 1.857 490 HG3 LYS 63 HG1 LYS 63 -8.718 -1.664 2.281 491 HD2 LYS 63 HD2 LYS 63 -9.692 0.978 3.409 492 HD3 LYS 63 HD1 LYS 63 -9.689 -0.569 4.253 493 HE2 LYS 63 HE2 LYS 63 -7.717 0.450 5.050 494 HE3 LYS 63 HE1 LYS 63 -7.105 -0.553 3.733 495 HZ1 LYS 63 HZ1 LYS 63 -7.016 2.250 4.013 496 HZ2 LYS 63 HZ2 LYS 63 -7.906 1.864 2.620 497 HZ3 LYS 63 HZ3 LYS 63 -6.321 1.283 2.805 498 HA PRO 64 HA PRO 64 -8.950 2.233 -3.678 499 HB2 PRO 64 HB2 PRO 64 -9.841 4.363 -1.724 500 HB3 PRO 64 HB1 PRO 64 -10.357 4.108 -3.401 501 HG2 PRO 64 HG2 PRO 64 -11.915 3.373 -1.382 502 HG3 PRO 64 HG1 PRO 64 -11.779 2.366 -2.840 503 HD2 PRO 64 HD2 PRO 64 -10.616 1.892 -0.116 504 HD3 PRO 64 HD1 PRO 64 -11.153 0.727 -1.348 505 H GLY 65 HN GLY 65 -7.382 3.739 -4.344 506 HA2 GLY 65 HA3 GLY 65 -5.602 4.885 -2.292 507 HA3 GLY 65 HA2 GLY 65 -4.885 3.813 -3.478 508 HA PRO 66 HA PRO 66 -5.099 8.425 -4.852 509 HB2 PRO 66 HB2 PRO 66 -2.115 7.984 -4.890 510 HB3 PRO 66 HB1 PRO 66 -3.030 9.433 -4.410 511 HG2 PRO 66 HG2 PRO 66 -1.930 7.884 -2.563 512 HG3 PRO 66 HG1 PRO 66 -3.556 8.554 -2.315 513 HD2 PRO 66 HD2 PRO 66 -2.785 5.750 -3.130 514 HD3 PRO 66 HD1 PRO 66 -4.033 6.299 -1.991 515 H ASN 67 HN ASN 67 -2.791 5.906 -5.861 516 HA ASN 67 HA ASN 67 -2.605 6.705 -8.569 517 HB2 ASN 67 HB2 ASN 67 -2.189 3.928 -7.440 518 HB3 ASN 67 HB1 ASN 67 -1.518 4.575 -8.934 519 HD21 ASN 67 HD21 ASN 67 -0.241 3.631 -6.256 520 HD22 ASN 67 HD22 ASN 67 0.808 4.905 -5.855 521 H CYS 68 HN CYS 68 -4.903 4.761 -6.821 522 HA CYS 68 HA CYS 68 -6.803 4.851 -8.927 523 HB2 CYS 68 HB2 CYS 68 -6.742 2.099 -8.958 524 HB3 CYS 68 HB1 CYS 68 -5.949 3.097 -10.170 525 H GLY 69 HN GLY 69 -8.838 4.258 -8.234 526 HA2 GLY 69 HA3 GLY 69 -9.501 2.624 -6.072 527 HA3 GLY 69 HA2 GLY 69 -9.276 4.254 -5.451 528 H PHE 70 HN PHE 70 -10.189 5.024 -8.356 529 HA PHE 70 HA PHE 70 -12.770 5.864 -7.718 530 HB2 PHE 70 HB2 PHE 70 -13.051 6.297 -10.113 531 HB3 PHE 70 HB1 PHE 70 -11.457 6.809 -9.570 532 HD1 PHE 70 HD2 PHE 70 -9.433 5.549 -10.196 533 HD2 PHE 70 HD1 PHE 70 -13.321 4.342 -11.579 534 HE1 PHE 70 HE2 PHE 70 -8.378 4.074 -11.886 535 HE2 PHE 70 HE1 PHE 70 -12.261 2.869 -13.267 536 HZ PHE 70 HZ PHE 70 -9.789 2.734 -13.422 537 H GLY 71 HN GLY 71 -11.658 2.889 -9.227 538 HA2 GLY 71 HA3 GLY 71 -14.244 1.914 -9.962 539 HA3 GLY 71 HA2 GLY 71 -12.768 0.963 -9.856 540 H LYS 72 HN LYS 72 -14.355 -0.641 -9.025 541 HA LYS 72 HA LYS 72 -15.538 -0.296 -6.430 542 HB2 LYS 72 HB2 LYS 72 -15.000 -2.791 -8.069 543 HB3 LYS 72 HB1 LYS 72 -15.968 -2.747 -6.601 544 HG2 LYS 72 HG2 LYS 72 -17.535 -1.167 -7.658 545 HG3 LYS 72 HG1 LYS 72 -16.562 -1.185 -9.132 546 HD2 LYS 72 HD2 LYS 72 -16.924 -3.645 -9.306 547 HD3 LYS 72 HD1 LYS 72 -17.969 -3.572 -7.889 548 HE2 LYS 72 HE2 LYS 72 -18.443 -2.063 -10.478 549 HE3 LYS 72 HE1 LYS 72 -19.273 -3.543 -10.001 550 HZ1 LYS 72 HZ1 LYS 72 -20.705 -1.883 -9.319 551 HZ2 LYS 72 HZ2 LYS 72 -19.455 -0.852 -8.808 552 HZ3 LYS 72 HZ3 LYS 72 -19.853 -2.230 -7.894 553 H THR 73 HN THR 73 -14.888 -2.713 -5.172 554 HA THR 73 HA THR 73 -11.980 -2.530 -4.588 555 HB THR 73 HB THR 73 -12.299 -2.380 -2.265 556 HG1 THR 73 HG1 THR 73 -13.794 -3.729 -1.654 557 HG21 THR 73 HG21 THR 73 -13.698 -0.437 -1.909 558 HG22 THR 73 HG22 THR 73 -14.613 -0.772 -3.380 559 HG23 THR 73 HG23 THR 73 -12.923 -0.279 -3.485 560 H GLY 74 HN GLY 74 -11.233 -4.385 -3.267 561 HA2 GLY 74 HA3 GLY 74 -11.001 -6.663 -2.923 562 HA3 GLY 74 HA2 GLY 74 -12.745 -6.799 -3.114 563 H ILE 75 HN ILE 75 -9.835 -6.189 -5.068 564 HA ILE 75 HA ILE 75 -9.241 -6.831 -7.188 565 HB ILE 75 HB ILE 75 -10.911 -9.322 -6.796 566 HG12 ILE 75 HG12 ILE 75 -8.290 -8.592 -5.454 567 HG13 ILE 75 HG11 ILE 75 -9.812 -8.962 -4.660 568 HG21 ILE 75 HG21 ILE 75 -9.589 -8.879 -8.934 569 HG22 ILE 75 HG22 ILE 75 -9.166 -10.367 -8.100 570 HG23 ILE 75 HG23 ILE 75 -8.124 -8.955 -7.960 571 HD11 ILE 75 HD11 ILE 75 -9.649 -11.269 -5.836 572 HD12 ILE 75 HD12 ILE 75 -8.568 -10.966 -4.477 573 HD13 ILE 75 HD13 ILE 75 -7.962 -10.844 -6.127 574 H ILE 76 HN ILE 76 -9.928 -6.104 -9.094 575 HA ILE 76 HA ILE 76 -12.834 -6.247 -9.739 576 HB ILE 76 HB ILE 76 -10.905 -4.115 -10.697 577 HG12 ILE 76 HG12 ILE 76 -12.872 -3.932 -8.386 578 HG13 ILE 76 HG11 ILE 76 -11.130 -4.069 -8.189 579 HG21 ILE 76 HG21 ILE 76 -13.019 -2.925 -11.203 580 HG22 ILE 76 HG22 ILE 76 -13.935 -4.295 -10.588 581 HG23 ILE 76 HG23 ILE 76 -12.948 -4.475 -12.036 582 HD11 ILE 76 HD11 ILE 76 -12.726 -1.762 -9.280 583 HD12 ILE 76 HD12 ILE 76 -11.032 -1.953 -9.743 584 HD13 ILE 76 HD13 ILE 76 -11.466 -1.759 -8.050 585 H ASP 77 HN ASP 77 -12.647 -8.165 -10.916 586 HA ASP 77 HA ASP 77 -10.723 -8.583 -12.961 587 HB2 ASP 77 HB2 ASP 77 -12.203 -10.430 -13.668 588 HB3 ASP 77 HB1 ASP 77 -11.910 -10.451 -11.933 589 H TYR 78 HN TYR 78 -10.834 -8.295 -15.146 590 HA TYR 78 HA TYR 78 -13.153 -6.812 -16.273 591 HB2 TYR 78 HB2 TYR 78 -10.211 -6.108 -16.476 592 HB3 TYR 78 HB1 TYR 78 -11.398 -5.516 -17.634 593 HD1 TYR 78 HD2 TYR 78 -13.417 -4.222 -16.767 594 HD2 TYR 78 HD1 TYR 78 -9.942 -5.001 -14.361 595 HE1 TYR 78 HE2 TYR 78 -14.043 -2.357 -15.259 596 HE2 TYR 78 HE1 TYR 78 -10.569 -3.132 -12.860 597 HH TYR 78 HH TYR 78 -12.990 -0.846 -13.682 598 H GLY 79 HN GLY 79 -10.216 -7.290 -18.045 599 HA2 GLY 79 HA3 GLY 79 -10.660 -9.822 -19.169 600 HA3 GLY 79 HA2 GLY 79 -11.516 -8.645 -20.158 601 H ILE 80 HN ILE 80 -10.116 -9.161 -21.905 602 HA ILE 80 HA ILE 80 -7.294 -8.308 -21.654 603 HB ILE 80 HB ILE 80 -8.691 -9.780 -23.909 604 HG12 ILE 80 HG12 ILE 80 -6.714 -10.847 -21.859 605 HG13 ILE 80 HG11 ILE 80 -8.457 -11.036 -21.702 606 HG21 ILE 80 HG21 ILE 80 -6.274 -10.221 -24.587 607 HG22 ILE 80 HG22 ILE 80 -5.795 -9.022 -23.396 608 HG23 ILE 80 HG23 ILE 80 -6.794 -8.552 -24.767 609 HD11 ILE 80 HD11 ILE 80 -7.237 -13.003 -22.768 610 HD12 ILE 80 HD12 ILE 80 -6.930 -11.963 -24.156 611 HD13 ILE 80 HD13 ILE 80 -8.587 -12.358 -23.699 612 H ARG 81 HN ARG 81 -6.749 -6.364 -22.317 613 HA ARG 81 HA ARG 81 -8.636 -4.690 -23.771 614 HB2 ARG 81 HB2 ARG 81 -5.777 -4.001 -23.086 615 HB3 ARG 81 HB1 ARG 81 -7.118 -2.893 -23.365 616 HG2 ARG 81 HG2 ARG 81 -6.860 -4.837 -21.055 617 HG3 ARG 81 HG1 ARG 81 -6.572 -3.108 -20.959 618 HD2 ARG 81 HD2 ARG 81 -9.201 -4.516 -21.487 619 HD3 ARG 81 HD1 ARG 81 -8.780 -3.530 -20.095 620 HE ARG 81 HE ARG 81 -8.560 -1.974 -22.461 621 HH11 ARG 81 HH21 ARG 81 -10.832 -3.374 -20.237 622 HH12 ARG 81 HH22 ARG 81 -12.137 -2.334 -20.692 623 HH21 ARG 81 HH11 ARG 81 -10.285 -0.605 -23.054 624 HH22 ARG 81 HH12 ARG 81 -11.830 -0.772 -22.286 625 H LEU 82 HN LEU 82 -8.476 -3.963 -25.844 626 HA LEU 82 HA LEU 82 -6.905 -5.585 -27.685 627 HB2 LEU 82 HB2 LEU 82 -8.270 -4.689 -29.403 628 HB3 LEU 82 HB1 LEU 82 -9.346 -4.850 -28.024 629 HG LEU 82 HG LEU 82 -8.018 -2.281 -28.978 630 HD11 LEU 82 HD11 LEU 82 -9.872 -2.942 -30.379 631 HD12 LEU 82 HD12 LEU 82 -10.381 -1.598 -29.360 632 HD13 LEU 82 HD13 LEU 82 -10.885 -3.242 -28.969 633 HD21 LEU 82 HD21 LEU 82 -9.764 -2.881 -26.566 634 HD22 LEU 82 HD22 LEU 82 -9.517 -1.252 -27.190 635 HD23 LEU 82 HD23 LEU 82 -8.151 -2.170 -26.570 636 H ASN 83 HN ASN 83 -6.224 -2.910 -25.903 637 HA ASN 83 HA ASN 83 -4.822 -1.328 -27.865 638 HB2 ASN 83 HB2 ASN 83 -4.190 0.089 -26.042 639 HB3 ASN 83 HB1 ASN 83 -5.878 -0.357 -25.819 640 HD21 ASN 83 HD21 ASN 83 -4.330 -3.148 -25.081 641 HD22 ASN 83 HD22 ASN 83 -4.086 -2.922 -23.417 642 H ARG 84 HN ARG 84 -4.091 -4.180 -27.517 643 HA ARG 84 HA ARG 84 -1.715 -4.609 -26.168 644 HB2 ARG 84 HB2 ARG 84 -2.530 -5.715 -28.861 645 HB3 ARG 84 HB1 ARG 84 -1.226 -6.352 -27.859 646 HG2 ARG 84 HG2 ARG 84 -2.843 -6.767 -26.019 647 HG3 ARG 84 HG1 ARG 84 -4.142 -6.160 -27.057 648 HD2 ARG 84 HD2 ARG 84 -4.078 -8.601 -27.126 649 HD3 ARG 84 HD1 ARG 84 -3.632 -7.944 -28.701 650 HE ARG 84 HE ARG 84 -1.810 -9.227 -26.770 651 HH11 ARG 84 HH21 ARG 84 -2.189 -7.532 -29.758 652 HH12 ARG 84 HH22 ARG 84 -0.877 -8.341 -30.542 653 HH21 ARG 84 HH11 ARG 84 -0.093 -10.304 -27.803 654 HH22 ARG 84 HH12 ARG 84 0.307 -9.918 -29.439 655 H SER 85 HN SER 85 -2.184 -2.263 -28.464 656 HA SER 85 HA SER 85 0.462 -2.302 -29.667 657 HB2 SER 85 HB2 SER 85 -0.269 -0.173 -30.688 658 HB3 SER 85 HB1 SER 85 -1.415 -1.477 -30.974 659 HG SER 85 HG SER 85 -2.004 0.808 -30.006 660 H GLU 86 HN GLU 86 -1.196 -0.704 -27.020 661 HA GLU 86 HA GLU 86 0.848 1.273 -26.536 662 HB2 GLU 86 HB2 GLU 86 -1.473 0.296 -24.843 663 HB3 GLU 86 HB1 GLU 86 -0.440 1.658 -24.422 664 HG2 GLU 86 HG2 GLU 86 -1.086 2.802 -26.510 665 HG3 GLU 86 HG1 GLU 86 -2.128 1.444 -26.927 666 H ARG 87 HN ARG 87 1.136 1.139 -23.787 667 HA ARG 87 HA ARG 87 2.407 -1.472 -23.198 668 HB2 ARG 87 HB2 ARG 87 3.840 1.146 -22.678 669 HB3 ARG 87 HB1 ARG 87 4.464 -0.496 -22.526 670 HG2 ARG 87 HG2 ARG 87 4.242 -0.813 -24.972 671 HG3 ARG 87 HG1 ARG 87 3.649 0.845 -25.119 672 HD2 ARG 87 HD2 ARG 87 5.775 1.672 -24.123 673 HD3 ARG 87 HD1 ARG 87 6.360 0.015 -24.053 674 HE ARG 87 HE ARG 87 6.801 0.132 -26.323 675 HH11 ARG 87 HH21 ARG 87 4.665 2.695 -25.391 676 HH12 ARG 87 HH22 ARG 87 4.750 3.512 -26.914 677 HH21 ARG 87 HH11 ARG 87 6.933 1.207 -28.317 678 HH22 ARG 87 HH12 ARG 87 6.034 2.671 -28.570 679 H TRP 88 HN TRP 88 2.738 -1.884 -20.989 680 HA TRP 88 HA TRP 88 1.692 -0.023 -18.981 681 HB2 TRP 88 HB2 TRP 88 0.337 -2.674 -19.548 682 HB3 TRP 88 HB1 TRP 88 0.076 -1.723 -18.097 683 HD1 TRP 88 HD1 TRP 88 -0.465 -1.560 -21.904 684 HE1 TRP 88 HE1 TRP 88 -2.352 0.135 -22.374 685 HE3 TRP 88 HE3 TRP 88 -1.210 0.248 -17.193 686 HZ2 TRP 88 HZ2 TRP 88 -3.970 2.007 -20.931 687 HZ3 TRP 88 HZ3 TRP 88 -2.929 1.979 -16.765 688 HH2 TRP 88 HH2 TRP 88 -4.309 2.860 -18.626 689 H ASP 89 HN ASP 89 1.712 -1.204 -16.766 690 HA ASP 89 HA ASP 89 4.341 -2.043 -16.225 691 HB2 ASP 89 HB2 ASP 89 2.650 -1.026 -14.609 692 HB3 ASP 89 HB1 ASP 89 1.922 -2.622 -14.496 693 H ALA 90 HN ALA 90 4.461 -4.185 -14.723 694 HA ALA 90 HA ALA 90 3.081 -6.473 -15.882 695 HB1 ALA 90 HB1 ALA 90 5.151 -7.592 -16.632 696 HB2 ALA 90 HB2 ALA 90 6.063 -6.123 -16.290 697 HB3 ALA 90 HB3 ALA 90 4.833 -6.122 -17.553 698 H TYR 91 HN TYR 91 3.353 -8.370 -14.710 699 HA TYR 91 HA TYR 91 4.705 -8.085 -12.065 700 HB2 TYR 91 HB2 TYR 91 2.132 -9.507 -12.784 701 HB3 TYR 91 HB1 TYR 91 2.952 -9.669 -11.235 702 HD1 TYR 91 HD1 TYR 91 1.126 -7.331 -13.462 703 HD2 TYR 91 HD2 TYR 91 2.914 -7.878 -9.590 704 HE1 TYR 91 HE1 TYR 91 -0.015 -5.286 -12.642 705 HE2 TYR 91 HE2 TYR 91 1.774 -5.833 -8.776 706 HH TYR 91 HH TYR 91 -0.299 -4.521 -9.392 707 H CYS 92 HN CYS 92 5.447 -10.067 -11.120 708 HA CYS 92 HA CYS 92 5.984 -12.301 -13.010 709 HB2 CYS 92 HB2 CYS 92 8.001 -10.699 -11.442 710 HB3 CYS 92 HB1 CYS 92 8.325 -12.383 -11.837 711 H TYR 93 HN TYR 93 7.035 -14.145 -11.730 712 HA TYR 93 HA TYR 93 6.284 -14.384 -8.940 713 HB2 TYR 93 HB2 TYR 93 4.094 -14.804 -9.766 714 HB3 TYR 93 HB1 TYR 93 4.691 -15.740 -11.121 715 HD1 TYR 93 HD2 TYR 93 5.779 -18.005 -10.682 716 HD2 TYR 93 HD1 TYR 93 3.575 -15.875 -7.671 717 HE1 TYR 93 HE2 TYR 93 5.541 -20.096 -9.373 718 HE2 TYR 93 HE1 TYR 93 3.341 -17.964 -6.363 719 HH TYR 93 HH TYR 93 3.773 -20.132 -6.272 720 H ASN 94 HN ASN 94 7.549 -15.812 -7.947 721 HA ASN 94 HA ASN 94 8.857 -17.949 -9.499 722 HB2 ASN 94 HB2 ASN 94 10.298 -15.710 -8.068 723 HB3 ASN 94 HB1 ASN 94 11.081 -17.262 -8.362 724 HD21 ASN 94 HD21 ASN 94 9.712 -14.402 -9.980 725 HD22 ASN 94 HD22 ASN 94 10.434 -14.708 -11.486 726 HA PRO 95 HA PRO 95 8.167 -20.146 -5.697 727 HB2 PRO 95 HB2 PRO 95 9.875 -22.254 -5.975 728 HB3 PRO 95 HB1 PRO 95 8.445 -22.067 -7.018 729 HG2 PRO 95 HG2 PRO 95 11.292 -21.292 -7.585 730 HG3 PRO 95 HG1 PRO 95 10.163 -22.206 -8.608 731 HD2 PRO 95 HD2 PRO 95 10.565 -19.541 -8.988 732 HD3 PRO 95 HD1 PRO 95 8.967 -20.286 -9.237 733 H HIS 96 HN HIS 96 10.589 -18.111 -6.093 734 HA HIS 96 HA HIS 96 11.789 -18.676 -3.449 735 HB2 HIS 96 HB2 HIS 96 13.387 -17.949 -5.913 736 HB3 HIS 96 HB1 HIS 96 14.017 -18.152 -4.280 737 HD1 HIS 96 HD1 HIS 96 13.157 -20.693 -3.250 738 HD2 HIS 96 HD2 HIS 96 13.776 -20.249 -7.347 739 HE1 HIS 96 HE1 HIS 96 13.524 -23.022 -4.175 740 HE2 HIS 96 HE2 HIS 96 13.906 -22.767 -6.673 741 H ALA 97 HN ALA 97 9.824 -16.742 -4.750 742 HA ALA 97 HA ALA 97 11.015 -14.179 -4.847 743 HB1 ALA 97 HB1 ALA 97 8.201 -15.028 -4.098 744 HB2 ALA 97 HB2 ALA 97 8.756 -14.514 -5.689 745 HB3 ALA 97 HB3 ALA 97 8.689 -13.353 -4.361 746 H LYS 98 HN LYS 98 8.942 -15.497 -2.311 747 HA LYS 98 HA LYS 98 10.816 -14.902 -0.224 748 HB2 LYS 98 HB2 LYS 98 9.887 -12.644 -0.670 749 HB3 LYS 98 HB1 LYS 98 8.270 -13.250 -0.342 750 HG2 LYS 98 HG2 LYS 98 8.990 -13.856 1.963 751 HG3 LYS 98 HG1 LYS 98 10.597 -13.231 1.619 752 HD2 LYS 98 HD2 LYS 98 8.037 -11.599 1.469 753 HD3 LYS 98 HD1 LYS 98 9.132 -11.608 2.850 754 HE2 LYS 98 HE2 LYS 98 9.898 -9.721 1.680 755 HE3 LYS 98 HE1 LYS 98 10.957 -10.964 1.011 756 HZ1 LYS 98 HZ1 LYS 98 8.404 -10.677 -0.325 757 HZ2 LYS 98 HZ2 LYS 98 9.966 -10.834 -0.979 758 HZ3 LYS 98 HZ3 LYS 98 9.415 -9.319 -0.443 Start of MODEL 19 1 H1 GLY 1 H1 GLY 1 3.985 -15.930 -2.664 2 H2 GLY 1 H2 GLY 1 2.608 -16.885 -2.947 3 H3 GLY 1 H3 GLY 1 2.779 -15.384 -3.722 4 HA2 GLY 1 HA3 GLY 1 5.018 -17.055 -4.253 5 HA3 GLY 1 HA2 GLY 1 3.507 -17.834 -4.722 6 H VAL 2 HN VAL 2 4.678 -14.464 -4.732 7 HA VAL 2 HA VAL 2 4.532 -14.320 -7.641 8 HB VAL 2 HB VAL 2 2.977 -12.346 -7.582 9 HG11 VAL 2 HG11 VAL 2 0.972 -13.648 -7.570 10 HG12 VAL 2 HG12 VAL 2 1.648 -14.829 -6.453 11 HG13 VAL 2 HG13 VAL 2 2.246 -14.739 -8.109 12 HG21 VAL 2 HG21 VAL 2 3.221 -11.739 -5.234 13 HG22 VAL 2 HG22 VAL 2 2.568 -13.297 -4.729 14 HG23 VAL 2 HG23 VAL 2 1.534 -12.134 -5.556 15 H TYR 3 HN TYR 3 5.878 -12.844 -8.462 16 HA TYR 3 HA TYR 3 7.172 -10.919 -6.584 17 HB2 TYR 3 HB2 TYR 3 8.517 -13.010 -7.440 18 HB3 TYR 3 HB1 TYR 3 8.637 -12.112 -8.951 19 HD1 TYR 3 HD1 TYR 3 9.438 -12.062 -5.324 20 HD2 TYR 3 HD2 TYR 3 10.067 -10.148 -9.114 21 HE1 TYR 3 HE1 TYR 3 11.269 -10.714 -4.339 22 HE2 TYR 3 HE2 TYR 3 11.901 -8.799 -8.131 23 HH TYR 3 HH TYR 3 13.289 -9.510 -5.120 24 H HIS 4 HN HIS 4 6.919 -8.890 -7.122 25 HA HIS 4 HA HIS 4 5.845 -8.156 -9.742 26 HB2 HIS 4 HB2 HIS 4 5.506 -5.958 -8.796 27 HB3 HIS 4 HB1 HIS 4 4.906 -7.171 -7.668 28 HD1 HIS 4 HD1 HIS 4 8.345 -5.578 -8.235 29 HD2 HIS 4 HD2 HIS 4 5.695 -6.454 -5.141 30 HE1 HIS 4 HE1 HIS 4 9.440 -4.765 -6.100 31 HE2 HIS 4 HE2 HIS 4 7.834 -5.293 -4.204 32 H ARG 5 HN ARG 5 6.801 -6.692 -11.166 33 HA ARG 5 HA ARG 5 9.612 -5.906 -10.730 34 HB2 ARG 5 HB2 ARG 5 8.599 -7.676 -12.972 35 HB3 ARG 5 HB1 ARG 5 10.054 -6.701 -13.158 36 HG2 ARG 5 HG2 ARG 5 11.057 -7.820 -11.198 37 HG3 ARG 5 HG1 ARG 5 9.597 -8.794 -11.012 38 HD2 ARG 5 HD2 ARG 5 9.957 -9.888 -13.129 39 HD3 ARG 5 HD1 ARG 5 11.233 -8.756 -13.566 40 HE ARG 5 HE ARG 5 12.699 -10.007 -12.293 41 HH11 ARG 5 HH21 ARG 5 9.463 -10.965 -11.604 42 HH12 ARG 5 HH22 ARG 5 9.933 -12.268 -10.570 43 HH21 ARG 5 HH11 ARG 5 13.325 -11.684 -10.947 44 HH22 ARG 5 HH12 ARG 5 12.120 -12.672 -10.187 45 H GLU 6 HN GLU 6 10.225 -4.114 -11.897 46 HA GLU 6 HA GLU 6 8.340 -2.871 -13.782 47 HB2 GLU 6 HB2 GLU 6 7.769 -2.070 -11.464 48 HB3 GLU 6 HB1 GLU 6 9.395 -1.400 -11.352 49 HG2 GLU 6 HG2 GLU 6 8.979 0.079 -13.232 50 HG3 GLU 6 HG1 GLU 6 7.414 -0.676 -13.532 51 H ALA 7 HN ALA 7 9.297 -1.123 -14.974 52 HA ALA 7 HA ALA 7 11.877 -1.687 -15.925 53 HB1 ALA 7 HB1 ALA 7 11.732 0.520 -17.059 54 HB2 ALA 7 HB2 ALA 7 10.290 0.885 -16.109 55 HB3 ALA 7 HB3 ALA 7 10.270 -0.447 -17.267 56 H ARG 8 HN ARG 8 13.839 -1.254 -15.167 57 HA ARG 8 HA ARG 8 14.256 0.166 -12.714 58 HB2 ARG 8 HB2 ARG 8 16.005 -1.244 -14.721 59 HB3 ARG 8 HB1 ARG 8 16.781 -0.163 -13.565 60 HG2 ARG 8 HG2 ARG 8 16.813 -2.388 -12.633 61 HG3 ARG 8 HG1 ARG 8 15.643 -1.452 -11.707 62 HD2 ARG 8 HD2 ARG 8 13.814 -2.423 -13.020 63 HD3 ARG 8 HD1 ARG 8 14.971 -3.316 -14.001 64 HE ARG 8 HE ARG 8 15.108 -4.869 -12.299 65 HH11 ARG 8 HH21 ARG 8 13.805 -1.879 -11.112 66 HH12 ARG 8 HH22 ARG 8 13.480 -2.494 -9.525 67 HH21 ARG 8 HH11 ARG 8 14.675 -5.676 -10.217 68 HH22 ARG 8 HH12 ARG 8 13.980 -4.638 -9.017 69 H SER 9 HN SER 9 14.657 0.929 -16.116 70 HA SER 9 HA SER 9 15.595 3.673 -15.435 71 HB2 SER 9 HB2 SER 9 16.374 3.699 -17.814 72 HB3 SER 9 HB1 SER 9 17.180 2.496 -16.812 73 HG SER 9 HG SER 9 15.285 2.177 -18.848 74 H GLY 10 HN GLY 10 12.766 2.441 -15.626 75 HA2 GLY 10 HA3 GLY 10 11.629 4.669 -17.182 76 HA3 GLY 10 HA2 GLY 10 11.181 3.034 -17.659 77 H LYS 11 HN LYS 11 9.103 2.957 -17.099 78 HA LYS 11 HA LYS 11 8.379 2.605 -14.384 79 HB2 LYS 11 HB2 LYS 11 8.582 5.165 -14.567 80 HB3 LYS 11 HB1 LYS 11 7.181 5.096 -15.624 81 HG2 LYS 11 HG2 LYS 11 6.175 5.469 -13.532 82 HG3 LYS 11 HG1 LYS 11 6.080 3.716 -13.650 83 HD2 LYS 11 HD2 LYS 11 8.121 3.517 -12.260 84 HD3 LYS 11 HD1 LYS 11 8.248 5.271 -12.191 85 HE2 LYS 11 HE2 LYS 11 6.067 5.394 -11.063 86 HE3 LYS 11 HE1 LYS 11 5.914 3.638 -11.153 87 HZ1 LYS 11 HZ1 LYS 11 6.912 4.844 -9.047 88 HZ2 LYS 11 HZ2 LYS 11 8.345 4.725 -9.951 89 HZ3 LYS 11 HZ3 LYS 11 7.469 3.324 -9.552 90 H TYR 12 HN TYR 12 7.216 3.468 -17.610 91 HA TYR 12 HA TYR 12 5.257 1.269 -17.488 92 HB2 TYR 12 HB2 TYR 12 4.571 4.107 -18.312 93 HB3 TYR 12 HB1 TYR 12 3.508 2.708 -18.449 94 HD1 TYR 12 HD2 TYR 12 2.951 1.395 -16.302 95 HD2 TYR 12 HD1 TYR 12 4.634 5.352 -16.264 96 HE1 TYR 12 HE2 TYR 12 2.165 1.718 -13.972 97 HE2 TYR 12 HE1 TYR 12 3.837 5.665 -13.939 98 HH TYR 12 HH TYR 12 2.412 3.018 -12.110 99 H LYS 13 HN LYS 13 7.246 0.608 -18.862 100 HA LYS 13 HA LYS 13 6.614 1.149 -21.706 101 HB2 LYS 13 HB2 LYS 13 9.342 1.249 -20.402 102 HB3 LYS 13 HB1 LYS 13 9.107 1.074 -22.143 103 HG2 LYS 13 HG2 LYS 13 7.881 3.180 -22.239 104 HG3 LYS 13 HG1 LYS 13 7.953 3.336 -20.488 105 HD2 LYS 13 HD2 LYS 13 9.681 4.749 -21.322 106 HD3 LYS 13 HD1 LYS 13 10.495 3.317 -20.709 107 HE2 LYS 13 HE2 LYS 13 10.825 2.452 -22.931 108 HE3 LYS 13 HE1 LYS 13 9.735 3.649 -23.629 109 HZ1 LYS 13 HZ1 LYS 13 11.271 5.383 -22.978 110 HZ2 LYS 13 HZ2 LYS 13 12.059 4.238 -23.953 111 HZ3 LYS 13 HZ3 LYS 13 12.308 4.241 -22.274 112 H LEU 14 HN LEU 14 5.823 -1.051 -20.059 113 HA LEU 14 HA LEU 14 7.380 -3.279 -21.304 114 HB2 LEU 14 HB2 LEU 14 5.824 -3.455 -18.716 115 HB3 LEU 14 HB1 LEU 14 6.900 -4.657 -19.405 116 HG LEU 14 HG LEU 14 7.763 -1.900 -18.475 117 HD11 LEU 14 HD11 LEU 14 8.792 -3.113 -16.584 118 HD12 LEU 14 HD12 LEU 14 8.107 -4.624 -17.183 119 HD13 LEU 14 HD13 LEU 14 7.042 -3.343 -16.608 120 HD21 LEU 14 HD21 LEU 14 9.316 -2.635 -20.142 121 HD22 LEU 14 HD22 LEU 14 9.265 -4.302 -19.571 122 HD23 LEU 14 HD23 LEU 14 10.071 -3.063 -18.611 123 H THR 15 HN THR 15 6.307 -4.400 -22.741 124 HA THR 15 HA THR 15 3.347 -4.224 -22.840 125 HB THR 15 HB THR 15 5.289 -5.260 -24.925 126 HG1 THR 15 HG1 THR 15 5.378 -3.279 -25.639 127 HG21 THR 15 HG21 THR 15 3.225 -4.763 -26.402 128 HG22 THR 15 HG22 THR 15 2.297 -4.749 -24.905 129 HG23 THR 15 HG23 THR 15 3.157 -6.210 -25.399 130 H TYR 16 HN TYR 16 2.172 -6.190 -23.444 131 HA TYR 16 HA TYR 16 2.487 -8.267 -21.642 132 HB2 TYR 16 HB2 TYR 16 0.379 -8.029 -22.713 133 HB3 TYR 16 HB1 TYR 16 1.097 -8.084 -24.316 134 HD1 TYR 16 HD1 TYR 16 1.277 -10.287 -21.254 135 HD2 TYR 16 HD2 TYR 16 0.484 -10.058 -25.474 136 HE1 TYR 16 HE1 TYR 16 0.875 -12.725 -21.313 137 HE2 TYR 16 HE2 TYR 16 0.087 -12.501 -25.525 138 HH TYR 16 HH TYR 16 -0.569 -14.290 -23.958 139 H ALA 17 HN ALA 17 3.455 -8.272 -25.087 140 HA ALA 17 HA ALA 17 4.630 -10.813 -25.110 141 HB1 ALA 17 HB1 ALA 17 5.346 -8.343 -26.708 142 HB2 ALA 17 HB2 ALA 17 4.195 -9.596 -27.170 143 HB3 ALA 17 HB3 ALA 17 5.914 -9.973 -27.070 144 H GLU 18 HN GLU 18 6.030 -7.646 -24.298 145 HA GLU 18 HA GLU 18 8.696 -8.583 -23.973 146 HB2 GLU 18 HB2 GLU 18 7.268 -6.197 -22.774 147 HB3 GLU 18 HB1 GLU 18 9.001 -6.483 -22.623 148 HG2 GLU 18 HG2 GLU 18 9.249 -6.432 -25.060 149 HG3 GLU 18 HG1 GLU 18 7.509 -6.219 -25.250 150 H ALA 19 HN ALA 19 6.137 -7.917 -21.569 151 HA ALA 19 HA ALA 19 7.468 -8.622 -19.254 152 HB1 ALA 19 HB1 ALA 19 5.216 -7.663 -19.264 153 HB2 ALA 19 HB2 ALA 19 5.250 -9.154 -18.316 154 HB3 ALA 19 HB3 ALA 19 4.570 -9.158 -19.946 155 H LYS 20 HN LYS 20 6.146 -10.710 -21.736 156 HA LYS 20 HA LYS 20 6.270 -13.146 -20.253 157 HB2 LYS 20 HB2 LYS 20 4.870 -12.771 -22.283 158 HB3 LYS 20 HB1 LYS 20 6.348 -12.755 -23.246 159 HG2 LYS 20 HG2 LYS 20 6.877 -15.034 -22.540 160 HG3 LYS 20 HG1 LYS 20 5.461 -15.056 -21.485 161 HD2 LYS 20 HD2 LYS 20 4.005 -14.709 -23.435 162 HD3 LYS 20 HD1 LYS 20 5.417 -14.708 -24.487 163 HE2 LYS 20 HE2 LYS 20 5.960 -17.011 -23.783 164 HE3 LYS 20 HE1 LYS 20 4.560 -17.015 -22.711 165 HZ1 LYS 20 HZ1 LYS 20 4.551 -16.818 -25.670 166 HZ2 LYS 20 HZ2 LYS 20 3.172 -16.585 -24.704 167 HZ3 LYS 20 HZ3 LYS 20 3.953 -18.092 -24.725 168 H ALA 21 HN ALA 21 8.522 -11.353 -22.248 169 HA ALA 21 HA ALA 21 10.428 -13.464 -22.564 170 HB1 ALA 21 HB1 ALA 21 10.880 -10.468 -22.682 171 HB2 ALA 21 HB2 ALA 21 10.353 -11.470 -24.035 172 HB3 ALA 21 HB3 ALA 21 11.952 -11.711 -23.330 173 H VAL 22 HN VAL 22 10.450 -10.606 -20.392 174 HA VAL 22 HA VAL 22 12.794 -11.296 -19.006 175 HB VAL 22 HB VAL 22 11.769 -9.075 -18.850 176 HG11 VAL 22 HG11 VAL 22 9.716 -8.710 -17.614 177 HG12 VAL 22 HG12 VAL 22 9.617 -10.420 -17.194 178 HG13 VAL 22 HG13 VAL 22 9.417 -9.908 -18.868 179 HG21 VAL 22 HG21 VAL 22 12.110 -8.705 -16.488 180 HG22 VAL 22 HG22 VAL 22 13.222 -9.981 -16.976 181 HG23 VAL 22 HG23 VAL 22 11.740 -10.386 -16.110 182 H CYS 23 HN CYS 23 9.549 -12.500 -18.761 183 HA CYS 23 HA CYS 23 10.226 -14.064 -16.336 184 HB2 CYS 23 HB2 CYS 23 7.894 -12.602 -17.076 185 HB3 CYS 23 HB1 CYS 23 7.433 -14.294 -17.169 186 H GLU 24 HN GLU 24 8.940 -16.228 -16.399 187 HA GLU 24 HA GLU 24 8.751 -18.354 -17.260 188 HB2 GLU 24 HB2 GLU 24 8.751 -16.904 -19.928 189 HB3 GLU 24 HB1 GLU 24 8.508 -18.617 -19.754 190 HG2 GLU 24 HG2 GLU 24 6.544 -18.214 -18.332 191 HG3 GLU 24 HG1 GLU 24 6.811 -16.476 -18.460 192 H PHE 25 HN PHE 25 11.383 -16.333 -17.818 193 HA PHE 25 HA PHE 25 13.128 -17.962 -19.321 194 HB2 PHE 25 HB2 PHE 25 13.517 -15.575 -18.870 195 HB3 PHE 25 HB1 PHE 25 13.747 -15.931 -17.160 196 HD1 PHE 25 HD1 PHE 25 15.126 -16.467 -20.569 197 HD2 PHE 25 HD2 PHE 25 15.834 -16.844 -16.347 198 HE1 PHE 25 HE1 PHE 25 17.517 -16.948 -21.011 199 HE2 PHE 25 HE2 PHE 25 18.225 -17.326 -16.791 200 HZ PHE 25 HZ PHE 25 19.068 -17.376 -19.122 201 H GLU 26 HN GLU 26 12.681 -17.629 -15.806 202 HA GLU 26 HA GLU 26 14.467 -19.915 -15.307 203 HB2 GLU 26 HB2 GLU 26 14.079 -19.360 -12.897 204 HB3 GLU 26 HB1 GLU 26 14.814 -18.057 -13.825 205 HG2 GLU 26 HG2 GLU 26 11.815 -18.206 -13.391 206 HG3 GLU 26 HG1 GLU 26 12.880 -17.417 -12.234 207 H GLY 27 HN GLY 27 11.464 -19.776 -16.351 208 HA2 GLY 27 HA3 GLY 27 10.077 -21.708 -16.463 209 HA3 GLY 27 HA2 GLY 27 10.633 -22.202 -14.869 210 H GLY 28 HN GLY 28 10.222 -19.191 -14.141 211 HA2 GLY 28 HA3 GLY 28 7.533 -19.551 -13.100 212 HA3 GLY 28 HA2 GLY 28 8.615 -18.198 -12.784 213 H HIS 29 HN HIS 29 5.725 -18.824 -14.007 214 HA HIS 29 HA HIS 29 5.885 -17.009 -16.334 215 HB2 HIS 29 HB2 HIS 29 3.603 -17.773 -16.824 216 HB3 HIS 29 HB1 HIS 29 4.721 -19.130 -16.693 217 HD1 HIS 29 HD1 HIS 29 1.757 -17.570 -15.053 218 HD2 HIS 29 HD2 HIS 29 4.369 -20.737 -14.334 219 HE1 HIS 29 HE1 HIS 29 0.688 -18.979 -13.242 220 HE2 HIS 29 HE2 HIS 29 2.270 -20.915 -12.790 221 H LEU 30 HN LEU 30 3.868 -15.581 -16.548 222 HA LEU 30 HA LEU 30 3.947 -13.677 -14.448 223 HB2 LEU 30 HB2 LEU 30 1.793 -13.855 -16.569 224 HB3 LEU 30 HB1 LEU 30 2.325 -12.430 -15.687 225 HG LEU 30 HG LEU 30 4.720 -13.284 -16.858 226 HD11 LEU 30 HD11 LEU 30 2.531 -13.667 -18.927 227 HD12 LEU 30 HD12 LEU 30 3.443 -14.983 -18.192 228 HD13 LEU 30 HD13 LEU 30 4.267 -13.793 -19.192 229 HD21 LEU 30 HD21 LEU 30 2.697 -11.380 -18.087 230 HD22 LEU 30 HD22 LEU 30 4.427 -11.409 -18.417 231 HD23 LEU 30 HD23 LEU 30 3.847 -10.961 -16.815 232 H ALA 31 HN ALA 31 2.658 -13.349 -12.725 233 HA ALA 31 HA ALA 31 1.011 -15.439 -11.769 234 HB1 ALA 31 HB1 ALA 31 1.073 -12.563 -10.842 235 HB2 ALA 31 HB2 ALA 31 2.215 -13.803 -10.325 236 HB3 ALA 31 HB3 ALA 31 0.504 -13.959 -9.924 237 H THR 32 HN THR 32 -0.743 -15.956 -12.954 238 HA THR 32 HA THR 32 -2.427 -14.021 -14.240 239 HB THR 32 HB THR 32 -2.358 -16.179 -15.243 240 HG1 THR 32 HG1 THR 32 -4.590 -16.862 -14.938 241 HG21 THR 32 HG21 THR 32 -3.108 -18.211 -13.957 242 HG22 THR 32 HG22 THR 32 -3.063 -17.229 -12.498 243 HG23 THR 32 HG23 THR 32 -1.582 -17.525 -13.403 244 H TYR 33 HN TYR 33 -4.927 -14.387 -13.794 245 HA TYR 33 HA TYR 33 -5.568 -13.034 -11.448 246 HB2 TYR 33 HB2 TYR 33 -7.031 -13.101 -13.389 247 HB3 TYR 33 HB1 TYR 33 -7.280 -14.829 -13.176 248 HD1 TYR 33 HD2 TYR 33 -8.666 -15.693 -11.324 249 HD2 TYR 33 HD1 TYR 33 -8.085 -11.471 -11.892 250 HE1 TYR 33 HE2 TYR 33 -10.554 -15.223 -9.788 251 HE2 TYR 33 HE1 TYR 33 -9.974 -11.008 -10.357 252 HH TYR 33 HH TYR 33 -11.128 -12.944 -8.219 253 H LYS 34 HN LYS 34 -6.082 -16.484 -12.175 254 HA LYS 34 HA LYS 34 -7.060 -17.319 -9.708 255 HB2 LYS 34 HB2 LYS 34 -6.955 -18.688 -11.787 256 HB3 LYS 34 HB1 LYS 34 -5.221 -18.867 -11.551 257 HG2 LYS 34 HG2 LYS 34 -5.592 -19.985 -9.404 258 HG3 LYS 34 HG1 LYS 34 -7.331 -19.751 -9.552 259 HD2 LYS 34 HD2 LYS 34 -5.855 -21.210 -11.762 260 HD3 LYS 34 HD1 LYS 34 -6.230 -22.070 -10.273 261 HE2 LYS 34 HE2 LYS 34 -8.272 -20.647 -12.013 262 HE3 LYS 34 HE1 LYS 34 -7.996 -22.386 -11.973 263 HZ1 LYS 34 HZ1 LYS 34 -9.475 -20.753 -10.168 264 HZ2 LYS 34 HZ2 LYS 34 -8.296 -21.662 -9.351 265 HZ3 LYS 34 HZ3 LYS 34 -9.453 -22.442 -10.321 266 H GLN 35 HN GLN 35 -3.660 -17.288 -10.805 267 HA GLN 35 HA GLN 35 -2.574 -18.173 -8.331 268 HB2 GLN 35 HB2 GLN 35 -1.428 -16.844 -10.790 269 HB3 GLN 35 HB1 GLN 35 -0.418 -17.044 -9.359 270 HG2 GLN 35 HG2 GLN 35 -0.165 -18.928 -10.956 271 HG3 GLN 35 HG1 GLN 35 -0.782 -19.459 -9.393 272 HE21 GLN 35 HE21 GLN 35 -3.269 -19.645 -9.287 273 HE22 GLN 35 HE22 GLN 35 -4.066 -20.184 -10.684 274 H LEU 36 HN LEU 36 -3.215 -14.972 -9.688 275 HA LEU 36 HA LEU 36 -1.888 -13.445 -7.722 276 HB2 LEU 36 HB2 LEU 36 -4.121 -12.943 -9.656 277 HB3 LEU 36 HB1 LEU 36 -3.750 -11.699 -8.497 278 HG LEU 36 HG LEU 36 -1.613 -12.891 -10.287 279 HD11 LEU 36 HD11 LEU 36 -3.394 -10.481 -10.796 280 HD12 LEU 36 HD12 LEU 36 -3.357 -11.965 -11.747 281 HD13 LEU 36 HD13 LEU 36 -1.962 -10.886 -11.744 282 HD21 LEU 36 HD21 LEU 36 -0.559 -10.620 -9.864 283 HD22 LEU 36 HD22 LEU 36 -0.703 -11.606 -8.420 284 HD23 LEU 36 HD23 LEU 36 -1.845 -10.300 -8.706 285 H GLU 37 HN GLU 37 -5.225 -14.673 -7.891 286 HA GLU 37 HA GLU 37 -6.233 -13.384 -5.612 287 HB2 GLU 37 HB2 GLU 37 -7.596 -14.597 -7.303 288 HB3 GLU 37 HB1 GLU 37 -6.974 -16.121 -6.669 289 HG2 GLU 37 HG2 GLU 37 -7.951 -15.644 -4.473 290 HG3 GLU 37 HG1 GLU 37 -8.502 -14.068 -5.038 291 H ALA 38 HN ALA 38 -4.803 -16.634 -5.931 292 HA ALA 38 HA ALA 38 -4.988 -17.448 -3.276 293 HB1 ALA 38 HB1 ALA 38 -2.679 -18.046 -5.140 294 HB2 ALA 38 HB2 ALA 38 -4.237 -18.869 -5.195 295 HB3 ALA 38 HB3 ALA 38 -3.214 -19.014 -3.768 296 H ALA 39 HN ALA 39 -2.683 -15.284 -4.803 297 HA ALA 39 HA ALA 39 -0.963 -15.131 -2.451 298 HB1 ALA 39 HB1 ALA 39 -0.971 -13.519 -5.015 299 HB2 ALA 39 HB2 ALA 39 0.007 -14.952 -4.696 300 HB3 ALA 39 HB3 ALA 39 0.281 -13.475 -3.771 301 H ARG 40 HN ARG 40 -3.395 -13.135 -4.072 302 HA ARG 40 HA ARG 40 -3.081 -10.753 -2.689 303 HB2 ARG 40 HB2 ARG 40 -4.930 -11.747 -4.504 304 HB3 ARG 40 HB1 ARG 40 -5.937 -11.495 -3.089 305 HG2 ARG 40 HG2 ARG 40 -4.160 -9.396 -4.385 306 HG3 ARG 40 HG1 ARG 40 -5.905 -9.526 -4.583 307 HD2 ARG 40 HD2 ARG 40 -4.432 -8.967 -1.993 308 HD3 ARG 40 HD1 ARG 40 -5.394 -7.824 -2.911 309 HE ARG 40 HE ARG 40 -6.364 -9.780 -1.068 310 HH11 ARG 40 HH21 ARG 40 -7.135 -8.176 -4.052 311 HH12 ARG 40 HH22 ARG 40 -8.841 -8.192 -3.762 312 HH21 ARG 40 HH11 ARG 40 -8.567 -9.704 -0.655 313 HH22 ARG 40 HH12 ARG 40 -9.644 -8.994 -1.805 314 H LYS 41 HN LYS 41 -4.481 -13.759 -1.604 315 HA LYS 41 HA LYS 41 -5.789 -12.742 0.724 316 HB2 LYS 41 HB2 LYS 41 -4.756 -15.530 0.135 317 HB3 LYS 41 HB1 LYS 41 -5.863 -15.112 1.437 318 HG2 LYS 41 HG2 LYS 41 -6.517 -14.532 -1.469 319 HG3 LYS 41 HG1 LYS 41 -6.917 -16.071 -0.714 320 HD2 LYS 41 HD2 LYS 41 -8.242 -14.852 1.011 321 HD3 LYS 41 HD1 LYS 41 -7.900 -13.338 0.181 322 HE2 LYS 41 HE2 LYS 41 -8.974 -14.200 -1.862 323 HE3 LYS 41 HE1 LYS 41 -9.344 -15.706 -1.023 324 HZ1 LYS 41 HZ1 LYS 41 -11.215 -14.150 -1.011 325 HZ2 LYS 41 HZ2 LYS 41 -10.265 -13.014 -0.175 326 HZ3 LYS 41 HZ3 LYS 41 -10.671 -14.490 0.560 327 H ILE 42 HN ILE 42 -2.580 -12.780 -0.026 328 HA ILE 42 HA ILE 42 -1.617 -13.413 2.680 329 HB ILE 42 HB ILE 42 -0.480 -14.054 0.357 330 HG12 ILE 42 HG12 ILE 42 1.790 -13.967 1.508 331 HG13 ILE 42 HG11 ILE 42 1.031 -13.051 2.803 332 HG21 ILE 42 HG21 ILE 42 1.024 -11.474 0.867 333 HG22 ILE 42 HG22 ILE 42 -0.361 -11.498 -0.208 334 HG23 ILE 42 HG23 ILE 42 1.040 -12.498 -0.570 335 HD11 ILE 42 HD11 ILE 42 -0.036 -14.897 3.660 336 HD12 ILE 42 HD12 ILE 42 1.283 -15.740 2.861 337 HD13 ILE 42 HD13 ILE 42 -0.291 -15.640 2.081 338 H GLY 43 HN GLY 43 -3.138 -10.871 1.532 339 HA2 GLY 43 HA3 GLY 43 -3.338 -8.763 2.506 340 HA3 GLY 43 HA2 GLY 43 -1.808 -8.998 3.334 341 H PHE 44 HN PHE 44 -2.082 -9.546 -0.110 342 HA PHE 44 HA PHE 44 -0.030 -7.597 -0.655 343 HB2 PHE 44 HB2 PHE 44 -0.615 -9.885 -1.873 344 HB3 PHE 44 HB1 PHE 44 -1.682 -8.881 -2.834 345 HD1 PHE 44 HD1 PHE 44 1.845 -9.207 -1.656 346 HD2 PHE 44 HD2 PHE 44 -0.787 -7.582 -4.639 347 HE1 PHE 44 HE1 PHE 44 3.804 -8.514 -3.008 348 HE2 PHE 44 HE2 PHE 44 1.173 -6.889 -5.987 349 HZ PHE 44 HZ PHE 44 3.468 -7.356 -5.175 350 H HIS 45 HN HIS 45 -0.228 -5.583 -1.464 351 HA HIS 45 HA HIS 45 -2.745 -4.646 -2.624 352 HB2 HIS 45 HB2 HIS 45 -3.197 -4.356 -0.264 353 HB3 HIS 45 HB1 HIS 45 -1.641 -3.572 -0.010 354 HD1 HIS 45 HD1 HIS 45 -4.610 -3.004 -2.370 355 HD2 HIS 45 HD2 HIS 45 -1.992 -0.845 0.052 356 HE1 HIS 45 HE1 HIS 45 -5.292 -0.571 -2.566 357 HE2 HIS 45 HE2 HIS 45 -3.705 0.757 -1.095 358 H VAL 46 HN VAL 46 -1.835 -3.993 -4.475 359 HA VAL 46 HA VAL 46 0.114 -1.767 -4.345 360 HB VAL 46 HB VAL 46 0.407 -4.158 -6.184 361 HG11 VAL 46 HG11 VAL 46 2.610 -3.027 -6.688 362 HG12 VAL 46 HG12 VAL 46 2.036 -1.628 -5.781 363 HG13 VAL 46 HG13 VAL 46 1.201 -2.131 -7.252 364 HG21 VAL 46 HG21 VAL 46 2.509 -4.528 -4.849 365 HG22 VAL 46 HG22 VAL 46 1.031 -4.781 -3.919 366 HG23 VAL 46 HG23 VAL 46 1.955 -3.289 -3.719 367 H CYS 47 HN CYS 47 -0.478 -0.133 -5.596 368 HA CYS 47 HA CYS 47 -2.703 -0.488 -7.506 369 HB2 CYS 47 HB2 CYS 47 -2.933 1.336 -5.918 370 HB3 CYS 47 HB1 CYS 47 -1.369 1.996 -6.398 371 H ALA 48 HN ALA 48 -1.445 -1.603 -9.109 372 HA ALA 48 HA ALA 48 -0.275 0.197 -11.048 373 HB1 ALA 48 HB1 ALA 48 1.472 -1.876 -9.698 374 HB2 ALA 48 HB2 ALA 48 1.694 -0.127 -9.659 375 HB3 ALA 48 HB3 ALA 48 1.903 -1.009 -11.173 376 H ALA 49 HN ALA 49 -1.796 -0.565 -12.478 377 HA ALA 49 HA ALA 49 -2.412 -3.298 -12.883 378 HB1 ALA 49 HB1 ALA 49 -3.884 -1.442 -13.602 379 HB2 ALA 49 HB2 ALA 49 -3.531 -2.560 -14.922 380 HB3 ALA 49 HB3 ALA 49 -2.702 -1.004 -14.834 381 H GLY 50 HN GLY 50 -1.516 -4.840 -14.121 382 HA2 GLY 50 HA3 GLY 50 0.616 -4.110 -16.061 383 HA3 GLY 50 HA2 GLY 50 0.967 -5.265 -14.781 384 H TRP 51 HN TRP 51 1.333 -6.071 -17.299 385 HA TRP 51 HA TRP 51 -1.009 -7.406 -18.385 386 HB2 TRP 51 HB2 TRP 51 1.931 -7.476 -19.120 387 HB3 TRP 51 HB1 TRP 51 0.693 -8.393 -19.968 388 HD1 TRP 51 HD1 TRP 51 2.388 -5.158 -20.093 389 HE1 TRP 51 HE1 TRP 51 1.113 -3.508 -21.608 390 HE3 TRP 51 HE3 TRP 51 -2.050 -7.640 -20.554 391 HZ2 TRP 51 HZ2 TRP 51 -1.457 -3.272 -22.848 392 HZ3 TRP 51 HZ3 TRP 51 -3.892 -6.677 -21.904 393 HH2 TRP 51 HH2 TRP 51 -3.600 -4.507 -23.047 394 H MET 52 HN MET 52 -1.154 -9.700 -18.650 395 HA MET 52 HA MET 52 0.543 -11.435 -17.024 396 HB2 MET 52 HB2 MET 52 -2.408 -11.047 -16.431 397 HB3 MET 52 HB1 MET 52 -1.498 -12.454 -15.898 398 HG2 MET 52 HG2 MET 52 -1.289 -11.086 -14.019 399 HG3 MET 52 HG1 MET 52 0.153 -10.607 -14.886 400 HE1 MET 52 HE1 MET 52 -3.650 -8.293 -14.023 401 HE2 MET 52 HE2 MET 52 -3.308 -9.995 -13.754 402 HE3 MET 52 HE3 MET 52 -3.841 -9.453 -15.343 403 H ALA 53 HN ALA 53 -0.434 -13.746 -17.141 404 HA ALA 53 HA ALA 53 -0.168 -14.781 -19.634 405 HB1 ALA 53 HB1 ALA 53 -0.409 -16.117 -17.553 406 HB2 ALA 53 HB2 ALA 53 -1.374 -16.749 -18.889 407 HB3 ALA 53 HB3 ALA 53 -2.148 -15.825 -17.603 408 H LYS 54 HN LYS 54 -1.395 -15.226 -21.404 409 HA LYS 54 HA LYS 54 -3.021 -14.908 -22.990 410 HB2 LYS 54 HB2 LYS 54 -4.961 -14.678 -20.672 411 HB3 LYS 54 HB1 LYS 54 -5.320 -15.155 -22.325 412 HG2 LYS 54 HG2 LYS 54 -3.483 -16.739 -20.503 413 HG3 LYS 54 HG1 LYS 54 -5.204 -17.065 -20.665 414 HD2 LYS 54 HD2 LYS 54 -4.862 -17.386 -23.129 415 HD3 LYS 54 HD1 LYS 54 -3.127 -17.204 -22.873 416 HE2 LYS 54 HE2 LYS 54 -3.633 -19.566 -22.887 417 HE3 LYS 54 HE1 LYS 54 -3.214 -19.100 -21.240 418 HZ1 LYS 54 HZ1 LYS 54 -5.987 -18.742 -21.715 419 HZ2 LYS 54 HZ2 LYS 54 -5.215 -19.696 -20.541 420 HZ3 LYS 54 HZ3 LYS 54 -5.533 -20.335 -22.083 421 H GLY 55 HN GLY 55 -1.596 -12.637 -22.210 422 HA2 GLY 55 HA3 GLY 55 -1.637 -10.332 -22.312 423 HA3 GLY 55 HA2 GLY 55 -2.995 -10.575 -23.402 424 H ARG 56 HN ARG 56 -3.523 -11.872 -20.294 425 HA ARG 56 HA ARG 56 -5.703 -10.094 -19.796 426 HB2 ARG 56 HB2 ARG 56 -5.481 -12.518 -19.025 427 HB3 ARG 56 HB1 ARG 56 -4.409 -11.923 -17.764 428 HG2 ARG 56 HG2 ARG 56 -6.165 -10.505 -16.857 429 HG3 ARG 56 HG1 ARG 56 -7.244 -10.956 -18.182 430 HD2 ARG 56 HD2 ARG 56 -7.204 -13.292 -17.461 431 HD3 ARG 56 HD1 ARG 56 -6.061 -12.905 -16.183 432 HE ARG 56 HE ARG 56 -8.123 -11.263 -15.597 433 HH11 ARG 56 HH21 ARG 56 -7.964 -14.633 -16.412 434 HH12 ARG 56 HH22 ARG 56 -9.329 -15.071 -15.443 435 HH21 ARG 56 HH11 ARG 56 -9.842 -11.858 -14.238 436 HH22 ARG 56 HH12 ARG 56 -10.345 -13.511 -14.154 437 H VAL 57 HN VAL 57 -5.928 -8.433 -18.351 438 HA VAL 57 HA VAL 57 -3.560 -7.522 -16.826 439 HB VAL 57 HB VAL 57 -3.336 -6.260 -18.836 440 HG11 VAL 57 HG11 VAL 57 -5.147 -5.064 -19.899 441 HG12 VAL 57 HG12 VAL 57 -6.265 -5.530 -18.617 442 HG13 VAL 57 HG13 VAL 57 -5.621 -6.748 -19.719 443 HG21 VAL 57 HG21 VAL 57 -3.543 -4.004 -18.065 444 HG22 VAL 57 HG22 VAL 57 -3.313 -4.962 -16.608 445 HG23 VAL 57 HG23 VAL 57 -4.920 -4.393 -17.035 446 H GLY 58 HN GLY 58 -3.990 -6.480 -14.966 447 HA2 GLY 58 HA3 GLY 58 -6.588 -5.455 -14.279 448 HA3 GLY 58 HA2 GLY 58 -6.282 -7.028 -13.550 449 H TYR 59 HN TYR 59 -6.680 -5.319 -11.726 450 HA TYR 59 HA TYR 59 -4.028 -4.792 -10.585 451 HB2 TYR 59 HB2 TYR 59 -4.694 -2.493 -9.853 452 HB3 TYR 59 HB1 TYR 59 -4.398 -2.673 -11.576 453 HD1 TYR 59 HD2 TYR 59 -6.297 -2.777 -13.182 454 HD2 TYR 59 HD1 TYR 59 -6.902 -1.942 -9.010 455 HE1 TYR 59 HE2 TYR 59 -8.543 -1.865 -13.688 456 HE2 TYR 59 HE1 TYR 59 -9.146 -1.024 -9.522 457 HH TYR 59 HH TYR 59 -10.269 0.030 -11.580 458 HA PRO 60 HA PRO 60 -6.823 -6.358 -7.350 459 HB2 PRO 60 HB2 PRO 60 -5.020 -7.712 -5.856 460 HB3 PRO 60 HB1 PRO 60 -5.585 -8.342 -7.416 461 HG2 PRO 60 HG2 PRO 60 -3.031 -6.916 -6.770 462 HG3 PRO 60 HG1 PRO 60 -3.296 -8.330 -7.809 463 HD2 PRO 60 HD2 PRO 60 -3.033 -5.735 -8.765 464 HD3 PRO 60 HD1 PRO 60 -3.887 -7.024 -9.648 465 H ILE 61 HN ILE 61 -7.500 -5.195 -5.660 466 HA ILE 61 HA ILE 61 -5.581 -3.886 -3.859 467 HB ILE 61 HB ILE 61 -6.813 -1.728 -4.020 468 HG12 ILE 61 HG12 ILE 61 -8.093 -3.027 -6.454 469 HG13 ILE 61 HG11 ILE 61 -8.929 -2.618 -4.962 470 HG21 ILE 61 HG21 ILE 61 -4.692 -2.233 -5.315 471 HG22 ILE 61 HG22 ILE 61 -5.701 -0.970 -6.014 472 HG23 ILE 61 HG23 ILE 61 -5.710 -2.591 -6.710 473 HD11 ILE 61 HD11 ILE 61 -9.366 -0.829 -6.494 474 HD12 ILE 61 HD12 ILE 61 -7.661 -0.707 -6.931 475 HD13 ILE 61 HD13 ILE 61 -8.197 -0.215 -5.323 476 H VAL 62 HN VAL 62 -6.244 -3.842 -1.810 477 HA VAL 62 HA VAL 62 -8.742 -5.173 -1.123 478 HB VAL 62 HB VAL 62 -6.635 -3.974 0.679 479 HG11 VAL 62 HG11 VAL 62 -8.732 -4.357 1.847 480 HG12 VAL 62 HG12 VAL 62 -7.597 -5.629 2.308 481 HG13 VAL 62 HG13 VAL 62 -8.874 -5.967 1.136 482 HG21 VAL 62 HG21 VAL 62 -6.962 -6.782 -0.422 483 HG22 VAL 62 HG22 VAL 62 -5.815 -6.329 0.837 484 HG23 VAL 62 HG23 VAL 62 -5.648 -5.667 -0.789 485 H LYS 63 HN LYS 63 -7.468 -1.930 -1.245 486 HA LYS 63 HA LYS 63 -10.114 -0.880 -0.680 487 HB2 LYS 63 HB2 LYS 63 -9.106 0.720 1.103 488 HB3 LYS 63 HB1 LYS 63 -9.457 -0.938 1.583 489 HG2 LYS 63 HG2 LYS 63 -7.130 -1.578 1.279 490 HG3 LYS 63 HG1 LYS 63 -6.737 0.022 0.647 491 HD2 LYS 63 HD2 LYS 63 -7.269 1.054 2.781 492 HD3 LYS 63 HD1 LYS 63 -7.847 -0.483 3.424 493 HE2 LYS 63 HE2 LYS 63 -5.571 -0.045 4.224 494 HE3 LYS 63 HE1 LYS 63 -5.574 -1.437 3.141 495 HZ1 LYS 63 HZ1 LYS 63 -4.877 1.345 2.371 496 HZ2 LYS 63 HZ2 LYS 63 -4.870 -0.001 1.338 497 HZ3 LYS 63 HZ3 LYS 63 -3.770 0.086 2.628 498 HA PRO 64 HA PRO 64 -9.121 2.234 -3.677 499 HB2 PRO 64 HB2 PRO 64 -9.827 4.215 -1.502 500 HB3 PRO 64 HB1 PRO 64 -10.326 4.206 -3.207 501 HG2 PRO 64 HG2 PRO 64 -11.982 3.368 -1.289 502 HG3 PRO 64 HG1 PRO 64 -11.924 2.559 -2.868 503 HD2 PRO 64 HD2 PRO 64 -10.906 1.577 -0.231 504 HD3 PRO 64 HD1 PRO 64 -11.427 0.663 -1.661 505 H GLY 65 HN GLY 65 -7.162 2.990 -4.268 506 HA2 GLY 65 HA3 GLY 65 -5.177 3.685 -2.173 507 HA3 GLY 65 HA2 GLY 65 -4.813 3.130 -3.799 508 HA PRO 66 HA PRO 66 -4.822 7.871 -3.472 509 HB2 PRO 66 HB2 PRO 66 -2.112 8.327 -3.551 510 HB3 PRO 66 HB1 PRO 66 -2.988 8.043 -2.031 511 HG2 PRO 66 HG2 PRO 66 -1.426 6.083 -3.689 512 HG3 PRO 66 HG1 PRO 66 -1.365 6.358 -1.934 513 HD2 PRO 66 HD2 PRO 66 -2.814 4.314 -2.982 514 HD3 PRO 66 HD1 PRO 66 -3.384 5.203 -1.551 515 H ASN 67 HN ASN 67 -2.878 5.603 -5.353 516 HA ASN 67 HA ASN 67 -2.737 7.395 -7.669 517 HB2 ASN 67 HB2 ASN 67 -1.718 4.588 -7.158 518 HB3 ASN 67 HB1 ASN 67 -1.507 5.443 -8.686 519 HD21 ASN 67 HD21 ASN 67 0.710 4.630 -7.004 520 HD22 ASN 67 HD22 ASN 67 1.475 6.040 -6.451 521 H CYS 68 HN CYS 68 -4.914 5.153 -6.396 522 HA CYS 68 HA CYS 68 -6.644 5.314 -8.655 523 HB2 CYS 68 HB2 CYS 68 -6.671 2.930 -9.275 524 HB3 CYS 68 HB1 CYS 68 -5.096 3.655 -9.588 525 H GLY 69 HN GLY 69 -8.716 4.779 -8.107 526 HA2 GLY 69 HA3 GLY 69 -9.555 2.977 -6.146 527 HA3 GLY 69 HA2 GLY 69 -9.365 4.544 -5.370 528 H PHE 70 HN PHE 70 -10.121 4.904 -8.617 529 HA PHE 70 HA PHE 70 -12.610 6.133 -8.123 530 HB2 PHE 70 HB2 PHE 70 -12.841 6.250 -10.547 531 HB3 PHE 70 HB1 PHE 70 -11.189 6.656 -10.081 532 HD1 PHE 70 HD2 PHE 70 -9.332 5.085 -10.495 533 HD2 PHE 70 HD1 PHE 70 -13.346 4.159 -11.718 534 HE1 PHE 70 HE2 PHE 70 -8.474 3.258 -11.934 535 HE2 PHE 70 HE1 PHE 70 -12.486 2.332 -13.156 536 HZ PHE 70 HZ PHE 70 -10.049 1.882 -13.265 537 H GLY 71 HN GLY 71 -11.791 2.940 -9.425 538 HA2 GLY 71 HA3 GLY 71 -14.407 2.061 -9.970 539 HA3 GLY 71 HA2 GLY 71 -13.028 1.014 -9.655 540 H LYS 72 HN LYS 72 -12.912 -0.049 -7.754 541 HA LYS 72 HA LYS 72 -14.243 0.826 -5.362 542 HB2 LYS 72 HB2 LYS 72 -15.986 -0.340 -7.087 543 HB3 LYS 72 HB1 LYS 72 -15.388 -1.798 -6.305 544 HG2 LYS 72 HG2 LYS 72 -16.039 -0.905 -4.105 545 HG3 LYS 72 HG1 LYS 72 -16.549 0.609 -4.846 546 HD2 LYS 72 HD2 LYS 72 -18.269 -0.559 -6.132 547 HD3 LYS 72 HD1 LYS 72 -17.728 -2.109 -5.486 548 HE2 LYS 72 HE2 LYS 72 -19.668 -1.380 -4.216 549 HE3 LYS 72 HE1 LYS 72 -18.245 -1.269 -3.183 550 HZ1 LYS 72 HZ1 LYS 72 -19.004 0.800 -2.835 551 HZ2 LYS 72 HZ2 LYS 72 -19.916 0.835 -4.268 552 HZ3 LYS 72 HZ3 LYS 72 -18.245 1.144 -4.313 553 H THR 73 HN THR 73 -14.582 -1.921 -4.381 554 HA THR 73 HA THR 73 -11.747 -2.496 -3.799 555 HB THR 73 HB THR 73 -12.483 -3.606 -1.861 556 HG1 THR 73 HG1 THR 73 -15.165 -3.602 -2.284 557 HG21 THR 73 HG21 THR 73 -13.912 -2.039 -0.741 558 HG22 THR 73 HG22 THR 73 -14.665 -1.543 -2.253 559 HG23 THR 73 HG23 THR 73 -12.992 -1.105 -1.919 560 H GLY 74 HN GLY 74 -11.242 -4.864 -3.493 561 HA2 GLY 74 HA3 GLY 74 -11.009 -6.992 -4.370 562 HA3 GLY 74 HA2 GLY 74 -12.663 -6.850 -4.956 563 H ILE 75 HN ILE 75 -10.186 -7.933 -6.202 564 HA ILE 75 HA ILE 75 -9.044 -6.379 -8.163 565 HB ILE 75 HB ILE 75 -9.996 -9.186 -8.797 566 HG12 ILE 75 HG12 ILE 75 -7.563 -9.667 -7.646 567 HG13 ILE 75 HG11 ILE 75 -8.062 -8.302 -6.653 568 HG21 ILE 75 HG21 ILE 75 -7.858 -9.291 -10.003 569 HG22 ILE 75 HG22 ILE 75 -7.447 -7.669 -9.445 570 HG23 ILE 75 HG23 ILE 75 -8.808 -7.904 -10.543 571 HD11 ILE 75 HD11 ILE 75 -10.330 -9.683 -6.452 572 HD12 ILE 75 HD12 ILE 75 -8.938 -10.102 -5.454 573 HD13 ILE 75 HD13 ILE 75 -9.290 -11.033 -6.907 574 H ILE 76 HN ILE 76 -9.699 -5.350 -9.952 575 HA ILE 76 HA ILE 76 -12.439 -5.881 -11.011 576 HB ILE 76 HB ILE 76 -11.014 -3.213 -11.227 577 HG12 ILE 76 HG12 ILE 76 -12.818 -4.184 -8.982 578 HG13 ILE 76 HG11 ILE 76 -11.124 -3.715 -8.840 579 HG21 ILE 76 HG21 ILE 76 -13.221 -2.369 -11.680 580 HG22 ILE 76 HG22 ILE 76 -13.979 -3.875 -11.163 581 HG23 ILE 76 HG23 ILE 76 -13.046 -3.823 -12.657 582 HD11 ILE 76 HD11 ILE 76 -13.489 -1.937 -9.459 583 HD12 ILE 76 HD12 ILE 76 -11.825 -1.420 -9.736 584 HD13 ILE 76 HD13 ILE 76 -12.365 -1.819 -8.105 585 H ASP 77 HN ASP 77 -10.597 -7.454 -12.103 586 HA ASP 77 HA ASP 77 -9.088 -6.390 -14.236 587 HB2 ASP 77 HB2 ASP 77 -8.831 -8.677 -13.195 588 HB3 ASP 77 HB1 ASP 77 -10.277 -9.170 -14.072 589 H TYR 78 HN TYR 78 -9.549 -6.064 -16.361 590 HA TYR 78 HA TYR 78 -12.396 -5.873 -17.105 591 HB2 TYR 78 HB2 TYR 78 -9.823 -4.784 -18.275 592 HB3 TYR 78 HB1 TYR 78 -11.326 -4.743 -19.192 593 HD1 TYR 78 HD2 TYR 78 -13.326 -3.537 -18.260 594 HD2 TYR 78 HD1 TYR 78 -9.424 -3.205 -16.490 595 HE1 TYR 78 HE2 TYR 78 -14.037 -1.478 -17.075 596 HE2 TYR 78 HE1 TYR 78 -10.138 -1.143 -15.309 597 HH TYR 78 HH TYR 78 -11.750 0.517 -15.327 598 H GLY 79 HN GLY 79 -10.214 -8.284 -17.168 599 HA2 GLY 79 HA3 GLY 79 -9.983 -10.216 -18.396 600 HA3 GLY 79 HA2 GLY 79 -11.593 -9.869 -19.020 601 H ILE 80 HN ILE 80 -8.161 -9.325 -19.495 602 HA ILE 80 HA ILE 80 -6.920 -8.713 -21.339 603 HB ILE 80 HB ILE 80 -9.185 -10.092 -22.805 604 HG12 ILE 80 HG12 ILE 80 -6.593 -11.254 -21.727 605 HG13 ILE 80 HG11 ILE 80 -8.145 -11.423 -20.917 606 HG21 ILE 80 HG21 ILE 80 -7.723 -8.881 -24.331 607 HG22 ILE 80 HG22 ILE 80 -7.331 -10.594 -24.444 608 HG23 ILE 80 HG23 ILE 80 -6.288 -9.511 -23.519 609 HD11 ILE 80 HD11 ILE 80 -7.789 -13.417 -22.225 610 HD12 ILE 80 HD12 ILE 80 -7.403 -12.467 -23.661 611 HD13 ILE 80 HD13 ILE 80 -9.047 -12.473 -23.025 612 H ARG 81 HN ARG 81 -6.874 -6.546 -21.603 613 HA ARG 81 HA ARG 81 -9.201 -5.089 -22.640 614 HB2 ARG 81 HB2 ARG 81 -6.466 -4.211 -21.681 615 HB3 ARG 81 HB1 ARG 81 -7.669 -3.097 -22.324 616 HG2 ARG 81 HG2 ARG 81 -9.246 -3.718 -20.583 617 HG3 ARG 81 HG1 ARG 81 -8.142 -4.949 -19.975 618 HD2 ARG 81 HD2 ARG 81 -7.968 -2.978 -18.571 619 HD3 ARG 81 HD1 ARG 81 -6.478 -3.151 -19.482 620 HE ARG 81 HE ARG 81 -8.262 -1.467 -20.901 621 HH11 ARG 81 HH21 ARG 81 -6.255 -1.612 -18.067 622 HH12 ARG 81 HH22 ARG 81 -5.990 0.101 -17.999 623 HH21 ARG 81 HH11 ARG 81 -7.852 0.779 -20.850 624 HH22 ARG 81 HH12 ARG 81 -6.873 1.448 -19.588 625 H LEU 82 HN LEU 82 -9.021 -3.685 -24.476 626 HA LEU 82 HA LEU 82 -7.619 -4.949 -26.702 627 HB2 LEU 82 HB2 LEU 82 -9.693 -2.766 -26.429 628 HB3 LEU 82 HB1 LEU 82 -8.860 -3.015 -27.963 629 HG LEU 82 HG LEU 82 -9.620 -5.357 -28.014 630 HD11 LEU 82 HD11 LEU 82 -10.870 -4.631 -25.347 631 HD12 LEU 82 HD12 LEU 82 -9.758 -5.955 -25.702 632 HD13 LEU 82 HD13 LEU 82 -11.412 -6.013 -26.301 633 HD21 LEU 82 HD21 LEU 82 -11.035 -3.562 -28.992 634 HD22 LEU 82 HD22 LEU 82 -11.885 -3.416 -27.454 635 HD23 LEU 82 HD23 LEU 82 -12.006 -4.905 -28.390 636 H ASN 83 HN ASN 83 -6.854 -2.629 -24.434 637 HA ASN 83 HA ASN 83 -5.414 -0.774 -26.104 638 HB2 ASN 83 HB2 ASN 83 -4.618 0.200 -24.042 639 HB3 ASN 83 HB1 ASN 83 -6.336 -0.143 -23.880 640 HD21 ASN 83 HD21 ASN 83 -4.790 0.115 -21.549 641 HD22 ASN 83 HD22 ASN 83 -4.615 -1.407 -20.819 642 H ARG 84 HN ARG 84 -4.810 -3.749 -26.179 643 HA ARG 84 HA ARG 84 -2.348 -4.398 -25.078 644 HB2 ARG 84 HB2 ARG 84 -3.508 -5.154 -27.764 645 HB3 ARG 84 HB1 ARG 84 -1.977 -5.812 -27.189 646 HG2 ARG 84 HG2 ARG 84 -3.140 -6.701 -25.178 647 HG3 ARG 84 HG1 ARG 84 -4.671 -6.094 -25.818 648 HD2 ARG 84 HD2 ARG 84 -4.387 -7.472 -27.839 649 HD3 ARG 84 HD1 ARG 84 -2.845 -8.057 -27.231 650 HE ARG 84 HE ARG 84 -5.001 -8.579 -25.398 651 HH11 ARG 84 HH21 ARG 84 -3.429 -9.583 -28.330 652 HH12 ARG 84 HH22 ARG 84 -3.939 -11.234 -28.210 653 HH21 ARG 84 HH11 ARG 84 -5.674 -10.770 -25.240 654 HH22 ARG 84 HH12 ARG 84 -5.214 -11.900 -26.471 655 H SER 85 HN SER 85 -2.973 -1.859 -27.216 656 HA SER 85 HA SER 85 -0.362 -1.809 -28.497 657 HB2 SER 85 HB2 SER 85 -2.425 -0.970 -29.615 658 HB3 SER 85 HB1 SER 85 -2.512 0.317 -28.418 659 HG SER 85 HG SER 85 -0.681 -0.110 -30.494 660 H GLU 86 HN GLU 86 -2.023 -0.223 -25.827 661 HA GLU 86 HA GLU 86 0.054 1.696 -25.313 662 HB2 GLU 86 HB2 GLU 86 -2.335 2.048 -24.694 663 HB3 GLU 86 HB1 GLU 86 -2.189 0.747 -23.510 664 HG2 GLU 86 HG2 GLU 86 -0.478 1.978 -22.294 665 HG3 GLU 86 HG1 GLU 86 -0.462 3.240 -23.526 666 H ARG 87 HN ARG 87 1.445 1.720 -23.516 667 HA ARG 87 HA ARG 87 2.438 -0.928 -22.744 668 HB2 ARG 87 HB2 ARG 87 3.528 1.826 -22.120 669 HB3 ARG 87 HB1 ARG 87 4.343 0.295 -21.810 670 HG2 ARG 87 HG2 ARG 87 3.498 1.247 -24.569 671 HG3 ARG 87 HG1 ARG 87 5.118 1.445 -23.912 672 HD2 ARG 87 HD2 ARG 87 5.146 -1.099 -23.595 673 HD3 ARG 87 HD1 ARG 87 3.701 -1.138 -24.598 674 HE ARG 87 HE ARG 87 4.980 -0.661 -26.454 675 HH11 ARG 87 HH21 ARG 87 6.806 -0.094 -23.558 676 HH12 ARG 87 HH22 ARG 87 8.309 0.127 -24.396 677 HH21 ARG 87 HH11 ARG 87 6.949 -0.469 -27.528 678 HH22 ARG 87 HH12 ARG 87 8.396 -0.141 -26.640 679 H TRP 88 HN TRP 88 2.838 -1.554 -20.620 680 HA TRP 88 HA TRP 88 1.565 -0.109 -18.416 681 HB2 TRP 88 HB2 TRP 88 0.552 -2.790 -19.401 682 HB3 TRP 88 HB1 TRP 88 0.200 -2.153 -17.797 683 HD1 TRP 88 HD1 TRP 88 -0.508 -1.513 -21.503 684 HE1 TRP 88 HE1 TRP 88 -2.562 0.036 -21.687 685 HE3 TRP 88 HE3 TRP 88 -1.180 -0.362 -16.580 686 HZ2 TRP 88 HZ2 TRP 88 -4.269 1.562 -19.963 687 HZ3 TRP 88 HZ3 TRP 88 -3.023 1.135 -15.875 688 HH2 TRP 88 HH2 TRP 88 -4.567 2.097 -17.557 689 H ASP 89 HN ASP 89 1.727 -1.547 -16.381 690 HA ASP 89 HA ASP 89 4.456 -2.131 -15.938 691 HB2 ASP 89 HB2 ASP 89 2.100 -3.054 -14.285 692 HB3 ASP 89 HB1 ASP 89 3.769 -2.885 -13.747 693 H ALA 90 HN ALA 90 4.396 -4.480 -14.430 694 HA ALA 90 HA ALA 90 3.460 -6.686 -16.073 695 HB1 ALA 90 HB1 ALA 90 5.740 -7.594 -16.494 696 HB2 ALA 90 HB2 ALA 90 6.420 -6.081 -15.895 697 HB3 ALA 90 HB3 ALA 90 5.433 -6.087 -17.356 698 H TYR 91 HN TYR 91 3.380 -8.573 -14.969 699 HA TYR 91 HA TYR 91 4.396 -8.592 -12.165 700 HB2 TYR 91 HB2 TYR 91 1.901 -9.795 -13.394 701 HB3 TYR 91 HB1 TYR 91 2.508 -10.284 -11.816 702 HD1 TYR 91 HD2 TYR 91 2.630 -8.664 -9.944 703 HD2 TYR 91 HD1 TYR 91 0.814 -7.626 -13.699 704 HE1 TYR 91 HE2 TYR 91 1.526 -6.723 -8.874 705 HE2 TYR 91 HE1 TYR 91 -0.292 -5.683 -12.620 706 HH TYR 91 HH TYR 91 -1.021 -5.122 -10.148 707 H CYS 92 HN CYS 92 5.236 -10.492 -11.366 708 HA CYS 92 HA CYS 92 5.731 -12.732 -13.223 709 HB2 CYS 92 HB2 CYS 92 7.772 -10.847 -12.143 710 HB3 CYS 92 HB1 CYS 92 8.213 -12.554 -12.147 711 H TYR 93 HN TYR 93 7.297 -14.304 -11.793 712 HA TYR 93 HA TYR 93 6.504 -14.487 -9.025 713 HB2 TYR 93 HB2 TYR 93 4.454 -15.372 -9.788 714 HB3 TYR 93 HB1 TYR 93 5.206 -16.185 -11.148 715 HD1 TYR 93 HD1 TYR 93 6.023 -16.206 -7.471 716 HD2 TYR 93 HD2 TYR 93 4.804 -18.517 -10.891 717 HE1 TYR 93 HE1 TYR 93 6.150 -18.279 -6.124 718 HE2 TYR 93 HE2 TYR 93 4.935 -20.583 -9.534 719 HH TYR 93 HH TYR 93 4.854 -20.743 -6.412 720 H ASN 94 HN ASN 94 8.277 -15.148 -8.070 721 HA ASN 94 HA ASN 94 10.174 -16.886 -9.531 722 HB2 ASN 94 HB2 ASN 94 10.488 -15.004 -7.197 723 HB3 ASN 94 HB1 ASN 94 11.749 -16.152 -7.641 724 HD21 ASN 94 HD21 ASN 94 13.320 -14.890 -8.678 725 HD22 ASN 94 HD22 ASN 94 13.001 -13.817 -9.954 726 HA PRO 95 HA PRO 95 9.322 -20.484 -7.028 727 HB2 PRO 95 HB2 PRO 95 12.295 -20.597 -6.515 728 HB3 PRO 95 HB1 PRO 95 11.203 -21.890 -7.059 729 HG2 PRO 95 HG2 PRO 95 12.841 -20.673 -8.773 730 HG3 PRO 95 HG1 PRO 95 11.196 -21.132 -9.254 731 HD2 PRO 95 HD2 PRO 95 12.272 -18.395 -8.625 732 HD3 PRO 95 HD1 PRO 95 11.006 -18.890 -9.770 733 H HIS 96 HN HIS 96 8.785 -20.798 -4.925 734 HA HIS 96 HA HIS 96 8.297 -19.998 -2.763 735 HB2 HIS 96 HB2 HIS 96 11.252 -20.663 -2.704 736 HB3 HIS 96 HB1 HIS 96 10.260 -20.444 -1.264 737 HD1 HIS 96 HD1 HIS 96 7.923 -22.044 -1.418 738 HD2 HIS 96 HD2 HIS 96 11.344 -23.304 -3.442 739 HE1 HIS 96 HE1 HIS 96 7.654 -24.534 -1.797 740 HE2 HIS 96 HE2 HIS 96 9.732 -25.317 -3.031 741 H ALA 97 HN ALA 97 11.598 -18.863 -2.602 742 HA ALA 97 HA ALA 97 12.500 -16.822 -2.088 743 HB1 ALA 97 HB1 ALA 97 10.252 -15.883 -3.888 744 HB2 ALA 97 HB2 ALA 97 11.888 -16.310 -4.388 745 HB3 ALA 97 HB3 ALA 97 11.619 -14.895 -3.372 746 H LYS 98 HN LYS 98 11.330 -17.593 0.030 747 HA LYS 98 HA LYS 98 10.527 -15.212 1.291 748 HB2 LYS 98 HB2 LYS 98 8.225 -15.812 1.975 749 HB3 LYS 98 HB1 LYS 98 8.361 -15.485 0.255 750 HG2 LYS 98 HG2 LYS 98 8.439 -17.929 -0.189 751 HG3 LYS 98 HG1 LYS 98 8.249 -18.234 1.536 752 HD2 LYS 98 HD2 LYS 98 6.121 -16.833 1.445 753 HD3 LYS 98 HD1 LYS 98 6.282 -16.857 -0.310 754 HE2 LYS 98 HE2 LYS 98 6.135 -19.339 1.416 755 HE3 LYS 98 HE1 LYS 98 4.753 -18.625 0.590 756 HZ1 LYS 98 HZ1 LYS 98 7.034 -20.069 -0.510 757 HZ2 LYS 98 HZ2 LYS 98 6.426 -18.777 -1.431 758 HZ3 LYS 98 HZ3 LYS 98 5.410 -20.069 -1.001 Start of MODEL 20 1 H1 GLY 1 H1 GLY 1 1.911 -14.413 -2.519 2 H2 GLY 1 H2 GLY 1 2.201 -16.015 -2.999 3 H3 GLY 1 H3 GLY 1 2.107 -14.781 -4.163 4 HA2 GLY 1 HA3 GLY 1 4.074 -14.126 -2.240 5 HA3 GLY 1 HA2 GLY 1 4.383 -15.731 -2.911 6 H VAL 2 HN VAL 2 2.947 -12.792 -4.312 7 HA VAL 2 HA VAL 2 4.478 -13.128 -6.758 8 HB VAL 2 HB VAL 2 2.643 -10.846 -5.987 9 HG11 VAL 2 HG11 VAL 2 2.376 -10.695 -8.463 10 HG12 VAL 2 HG12 VAL 2 3.600 -11.952 -8.644 11 HG13 VAL 2 HG13 VAL 2 4.034 -10.393 -7.941 12 HG21 VAL 2 HG21 VAL 2 0.875 -12.117 -7.151 13 HG22 VAL 2 HG22 VAL 2 1.479 -13.017 -5.762 14 HG23 VAL 2 HG23 VAL 2 1.995 -13.459 -7.387 15 H TYR 3 HN TYR 3 5.957 -11.673 -7.602 16 HA TYR 3 HA TYR 3 7.330 -9.936 -5.607 17 HB2 TYR 3 HB2 TYR 3 8.689 -11.817 -6.357 18 HB3 TYR 3 HB1 TYR 3 8.432 -11.367 -8.041 19 HD1 TYR 3 HD1 TYR 3 9.925 -10.233 -4.810 20 HD2 TYR 3 HD2 TYR 3 9.758 -9.636 -9.064 21 HE1 TYR 3 HE1 TYR 3 11.870 -8.698 -4.675 22 HE2 TYR 3 HE2 TYR 3 11.700 -8.102 -8.924 23 HH TYR 3 HH TYR 3 13.032 -6.945 -7.530 24 H HIS 4 HN HIS 4 7.454 -7.848 -5.972 25 HA HIS 4 HA HIS 4 6.115 -6.676 -8.233 26 HB2 HIS 4 HB2 HIS 4 6.654 -4.541 -7.218 27 HB3 HIS 4 HB1 HIS 4 6.077 -5.651 -5.977 28 HD1 HIS 4 HD1 HIS 4 9.007 -3.638 -6.985 29 HD2 HIS 4 HD2 HIS 4 8.207 -6.709 -4.283 30 HE1 HIS 4 HE1 HIS 4 10.979 -3.725 -5.399 31 HE2 HIS 4 HE2 HIS 4 10.505 -5.594 -3.746 32 H ARG 5 HN ARG 5 6.931 -6.035 -10.111 33 HA ARG 5 HA ARG 5 9.819 -5.488 -10.400 34 HB2 ARG 5 HB2 ARG 5 9.504 -7.897 -10.961 35 HB3 ARG 5 HB1 ARG 5 8.328 -7.428 -12.185 36 HG2 ARG 5 HG2 ARG 5 10.050 -6.099 -13.351 37 HG3 ARG 5 HG1 ARG 5 11.234 -6.554 -12.129 38 HD2 ARG 5 HD2 ARG 5 9.708 -8.533 -13.842 39 HD3 ARG 5 HD1 ARG 5 11.336 -7.939 -14.229 40 HE ARG 5 HE ARG 5 10.628 -9.871 -12.179 41 HH11 ARG 5 HH21 ARG 5 12.819 -7.358 -13.019 42 HH12 ARG 5 HH22 ARG 5 14.215 -8.142 -12.354 43 HH21 ARG 5 HH11 ARG 5 12.424 -10.919 -11.274 44 HH22 ARG 5 HH12 ARG 5 13.986 -10.181 -11.367 45 H GLU 6 HN GLU 6 10.308 -4.126 -12.086 46 HA GLU 6 HA GLU 6 8.279 -3.249 -13.961 47 HB2 GLU 6 HB2 GLU 6 8.146 -0.984 -13.229 48 HB3 GLU 6 HB1 GLU 6 7.921 -1.959 -11.777 49 HG2 GLU 6 HG2 GLU 6 10.451 -1.704 -11.388 50 HG3 GLU 6 HG1 GLU 6 10.415 -0.470 -12.651 51 H ALA 7 HN ALA 7 9.207 -1.426 -15.323 52 HA ALA 7 HA ALA 7 11.912 -2.206 -16.164 53 HB1 ALA 7 HB1 ALA 7 9.843 -0.373 -17.379 54 HB2 ALA 7 HB2 ALA 7 10.222 -2.023 -17.878 55 HB3 ALA 7 HB3 ALA 7 11.408 -0.737 -18.107 56 H ARG 8 HN ARG 8 13.502 -0.563 -16.701 57 HA ARG 8 HA ARG 8 13.815 1.381 -14.572 58 HB2 ARG 8 HB2 ARG 8 15.547 0.688 -16.970 59 HB3 ARG 8 HB1 ARG 8 15.963 1.939 -15.815 60 HG2 ARG 8 HG2 ARG 8 17.139 0.033 -15.016 61 HG3 ARG 8 HG1 ARG 8 15.712 0.105 -13.981 62 HD2 ARG 8 HD2 ARG 8 14.612 -1.630 -15.247 63 HD3 ARG 8 HD1 ARG 8 15.831 -1.565 -16.514 64 HE ARG 8 HE ARG 8 17.022 -2.286 -14.010 65 HH11 ARG 8 HH21 ARG 8 15.303 -3.334 -16.794 66 HH12 ARG 8 HH22 ARG 8 15.397 -5.028 -16.436 67 HH21 ARG 8 HH11 ARG 8 17.150 -4.552 -13.481 68 HH22 ARG 8 HH12 ARG 8 16.435 -5.712 -14.548 69 H SER 9 HN SER 9 12.794 1.397 -17.900 70 HA SER 9 HA SER 9 13.170 4.199 -18.374 71 HB2 SER 9 HB2 SER 9 11.768 3.802 -20.369 72 HB3 SER 9 HB1 SER 9 13.067 2.621 -20.228 73 HG SER 9 HG SER 9 11.045 1.644 -20.688 74 H GLY 10 HN GLY 10 10.581 2.225 -17.060 75 HA2 GLY 10 HA3 GLY 10 9.318 4.174 -15.606 76 HA3 GLY 10 HA2 GLY 10 8.572 4.297 -17.196 77 H LYS 11 HN LYS 11 7.172 3.613 -14.878 78 HA LYS 11 HA LYS 11 6.819 0.810 -14.557 79 HB2 LYS 11 HB2 LYS 11 5.016 3.149 -13.875 80 HB3 LYS 11 HB1 LYS 11 4.670 1.481 -13.422 81 HG2 LYS 11 HG2 LYS 11 6.800 1.374 -12.172 82 HG3 LYS 11 HG1 LYS 11 7.141 3.049 -12.615 83 HD2 LYS 11 HD2 LYS 11 5.135 3.805 -11.444 84 HD3 LYS 11 HD1 LYS 11 4.698 2.141 -11.064 85 HE2 LYS 11 HE2 LYS 11 5.769 3.176 -9.121 86 HE3 LYS 11 HE1 LYS 11 6.813 1.912 -9.770 87 HZ1 LYS 11 HZ1 LYS 11 7.414 4.603 -9.399 88 HZ2 LYS 11 HZ2 LYS 11 7.371 4.337 -11.076 89 HZ3 LYS 11 HZ3 LYS 11 8.394 3.405 -10.091 90 H TYR 12 HN TYR 12 4.961 3.261 -16.345 91 HA TYR 12 HA TYR 12 3.411 1.143 -17.701 92 HB2 TYR 12 HB2 TYR 12 3.069 4.153 -17.791 93 HB3 TYR 12 HB1 TYR 12 1.999 2.959 -18.514 94 HD1 TYR 12 HD2 TYR 12 0.641 1.434 -17.079 95 HD2 TYR 12 HD1 TYR 12 3.013 4.604 -15.408 96 HE1 TYR 12 HE2 TYR 12 -0.625 1.263 -14.952 97 HE2 TYR 12 HE1 TYR 12 1.745 4.434 -13.286 98 HH TYR 12 HH TYR 12 -0.420 3.641 -12.500 99 H LYS 13 HN LYS 13 6.016 1.099 -18.472 100 HA LYS 13 HA LYS 13 5.875 2.111 -21.244 101 HB2 LYS 13 HB2 LYS 13 7.415 3.426 -19.449 102 HB3 LYS 13 HB1 LYS 13 8.551 2.151 -19.874 103 HG2 LYS 13 HG2 LYS 13 9.079 3.795 -21.489 104 HG3 LYS 13 HG1 LYS 13 7.937 2.791 -22.381 105 HD2 LYS 13 HD2 LYS 13 6.113 4.364 -21.852 106 HD3 LYS 13 HD1 LYS 13 7.216 5.335 -20.881 107 HE2 LYS 13 HE2 LYS 13 8.592 5.779 -22.878 108 HE3 LYS 13 HE1 LYS 13 7.498 4.796 -23.851 109 HZ1 LYS 13 HZ1 LYS 13 5.836 6.530 -22.591 110 HZ2 LYS 13 HZ2 LYS 13 6.398 6.685 -24.188 111 HZ3 LYS 13 HZ3 LYS 13 7.192 7.494 -22.921 112 H LEU 14 HN LEU 14 5.487 -0.515 -19.863 113 HA LEU 14 HA LEU 14 7.536 -2.076 -21.377 114 HB2 LEU 14 HB2 LEU 14 7.684 -2.252 -18.863 115 HB3 LEU 14 HB1 LEU 14 6.109 -3.019 -18.889 116 HG LEU 14 HG LEU 14 7.067 -4.743 -20.473 117 HD11 LEU 14 HD11 LEU 14 9.577 -3.139 -19.934 118 HD12 LEU 14 HD12 LEU 14 9.015 -3.852 -21.441 119 HD13 LEU 14 HD13 LEU 14 9.705 -4.877 -20.195 120 HD21 LEU 14 HD21 LEU 14 8.391 -4.452 -17.755 121 HD22 LEU 14 HD22 LEU 14 8.278 -5.951 -18.673 122 HD23 LEU 14 HD23 LEU 14 6.814 -5.182 -18.059 123 H THR 15 HN THR 15 6.821 -3.388 -22.896 124 HA THR 15 HA THR 15 3.940 -3.614 -23.368 125 HB THR 15 HB THR 15 4.578 -4.704 -25.461 126 HG1 THR 15 HG1 THR 15 6.341 -5.854 -24.981 127 HG21 THR 15 HG21 THR 15 6.043 -2.840 -26.387 128 HG22 THR 15 HG22 THR 15 6.119 -2.195 -24.746 129 HG23 THR 15 HG23 THR 15 4.568 -2.311 -25.578 130 H TYR 16 HN TYR 16 2.954 -5.696 -23.851 131 HA TYR 16 HA TYR 16 3.261 -7.541 -21.758 132 HB2 TYR 16 HB2 TYR 16 1.650 -8.906 -22.928 133 HB3 TYR 16 HB1 TYR 16 1.183 -7.218 -23.097 134 HD1 TYR 16 HD2 TYR 16 1.488 -6.023 -25.250 135 HD2 TYR 16 HD1 TYR 16 2.407 -10.203 -24.852 136 HE1 TYR 16 HE2 TYR 16 1.515 -6.257 -27.723 137 HE2 TYR 16 HE1 TYR 16 2.430 -10.432 -27.322 138 HH TYR 16 HH TYR 16 1.972 -7.611 -29.439 139 H ALA 17 HN ALA 17 4.335 -7.691 -25.138 140 HA ALA 17 HA ALA 17 5.434 -10.264 -25.079 141 HB1 ALA 17 HB1 ALA 17 6.851 -9.489 -26.974 142 HB2 ALA 17 HB2 ALA 17 6.312 -7.838 -26.664 143 HB3 ALA 17 HB3 ALA 17 5.151 -9.064 -27.172 144 H GLU 18 HN GLU 18 6.871 -7.146 -24.150 145 HA GLU 18 HA GLU 18 9.492 -8.169 -23.700 146 HB2 GLU 18 HB2 GLU 18 8.031 -5.735 -22.647 147 HB3 GLU 18 HB1 GLU 18 9.712 -6.074 -22.245 148 HG2 GLU 18 HG2 GLU 18 10.383 -5.941 -24.548 149 HG3 GLU 18 HG1 GLU 18 8.714 -5.888 -25.101 150 H ALA 19 HN ALA 19 6.841 -7.431 -21.416 151 HA ALA 19 HA ALA 19 8.074 -8.298 -19.072 152 HB1 ALA 19 HB1 ALA 19 5.866 -8.439 -18.130 153 HB2 ALA 19 HB2 ALA 19 5.141 -8.610 -19.728 154 HB3 ALA 19 HB3 ALA 19 5.884 -7.082 -19.256 155 H LYS 20 HN LYS 20 6.555 -10.167 -21.620 156 HA LYS 20 HA LYS 20 6.371 -12.631 -20.199 157 HB2 LYS 20 HB2 LYS 20 6.452 -11.963 -23.149 158 HB3 LYS 20 HB1 LYS 20 6.245 -13.609 -22.557 159 HG2 LYS 20 HG2 LYS 20 4.426 -11.432 -21.500 160 HG3 LYS 20 HG1 LYS 20 4.108 -12.100 -23.096 161 HD2 LYS 20 HD2 LYS 20 4.540 -14.010 -20.788 162 HD3 LYS 20 HD1 LYS 20 2.988 -13.195 -20.937 163 HE2 LYS 20 HE2 LYS 20 2.593 -14.140 -23.107 164 HE3 LYS 20 HE1 LYS 20 4.252 -14.722 -23.232 165 HZ1 LYS 20 HZ1 LYS 20 2.574 -15.615 -20.993 166 HZ2 LYS 20 HZ2 LYS 20 3.877 -16.404 -21.743 167 HZ3 LYS 20 HZ3 LYS 20 2.366 -16.327 -22.518 168 H ALA 21 HN ALA 21 8.812 -11.229 -22.341 169 HA ALA 21 HA ALA 21 10.507 -13.487 -22.468 170 HB1 ALA 21 HB1 ALA 21 10.669 -11.533 -23.996 171 HB2 ALA 21 HB2 ALA 21 12.220 -11.902 -23.243 172 HB3 ALA 21 HB3 ALA 21 11.256 -10.547 -22.656 173 H VAL 22 HN VAL 22 10.639 -10.625 -20.321 174 HA VAL 22 HA VAL 22 12.924 -11.395 -18.869 175 HB VAL 22 HB VAL 22 10.520 -9.800 -17.932 176 HG11 VAL 22 HG11 VAL 22 12.252 -8.772 -16.384 177 HG12 VAL 22 HG12 VAL 22 13.337 -10.086 -16.845 178 HG13 VAL 22 HG13 VAL 22 11.822 -10.440 -16.010 179 HG21 VAL 22 HG21 VAL 22 11.831 -7.844 -18.615 180 HG22 VAL 22 HG22 VAL 22 11.601 -8.922 -19.993 181 HG23 VAL 22 HG23 VAL 22 13.148 -8.889 -19.145 182 H CYS 23 HN CYS 23 9.626 -12.478 -18.717 183 HA CYS 23 HA CYS 23 10.186 -14.051 -16.259 184 HB2 CYS 23 HB2 CYS 23 7.896 -12.533 -17.077 185 HB3 CYS 23 HB1 CYS 23 7.407 -14.221 -17.107 186 H GLU 24 HN GLU 24 8.919 -16.176 -16.300 187 HA GLU 24 HA GLU 24 8.493 -18.259 -17.197 188 HB2 GLU 24 HB2 GLU 24 9.058 -17.059 -19.934 189 HB3 GLU 24 HB1 GLU 24 8.324 -18.597 -19.606 190 HG2 GLU 24 HG2 GLU 24 6.450 -17.468 -18.441 191 HG3 GLU 24 HG1 GLU 24 7.167 -15.910 -18.839 192 H PHE 25 HN PHE 25 11.287 -16.698 -16.968 193 HA PHE 25 HA PHE 25 13.079 -18.382 -18.444 194 HB2 PHE 25 HB2 PHE 25 14.810 -17.136 -17.403 195 HB3 PHE 25 HB1 PHE 25 13.511 -15.995 -17.679 196 HD1 PHE 25 HD1 PHE 25 15.272 -18.023 -15.121 197 HD2 PHE 25 HD2 PHE 25 12.320 -14.986 -15.819 198 HE1 PHE 25 HE1 PHE 25 15.260 -17.479 -12.703 199 HE2 PHE 25 HE2 PHE 25 12.302 -14.444 -13.400 200 HZ PHE 25 HZ PHE 25 13.774 -15.689 -11.842 201 H GLU 26 HN GLU 26 11.848 -18.334 -15.139 202 HA GLU 26 HA GLU 26 13.481 -20.674 -14.402 203 HB2 GLU 26 HB2 GLU 26 12.173 -20.315 -12.146 204 HB3 GLU 26 HB1 GLU 26 13.448 -19.188 -12.588 205 HG2 GLU 26 HG2 GLU 26 11.438 -18.004 -11.803 206 HG3 GLU 26 HG1 GLU 26 11.786 -17.615 -13.481 207 H GLY 27 HN GLY 27 10.963 -20.486 -16.273 208 HA2 GLY 27 HA3 GLY 27 9.560 -22.215 -16.963 209 HA3 GLY 27 HA2 GLY 27 9.913 -23.088 -15.476 210 H GLY 28 HN GLY 28 9.114 -19.893 -14.806 211 HA2 GLY 28 HA3 GLY 28 6.455 -20.679 -13.818 212 HA3 GLY 28 HA2 GLY 28 7.354 -19.229 -13.384 213 H HIS 29 HN HIS 29 5.395 -18.059 -13.755 214 HA HIS 29 HA HIS 29 5.242 -16.974 -16.424 215 HB2 HIS 29 HB2 HIS 29 2.888 -17.516 -16.828 216 HB3 HIS 29 HB1 HIS 29 3.854 -18.982 -16.710 217 HD1 HIS 29 HD1 HIS 29 1.847 -16.792 -14.292 218 HD2 HIS 29 HD2 HIS 29 2.681 -20.811 -15.026 219 HE1 HIS 29 HE1 HIS 29 0.480 -18.124 -12.628 220 HE2 HIS 29 HE2 HIS 29 0.979 -20.575 -13.060 221 H LEU 30 HN LEU 30 3.859 -15.109 -16.554 222 HA LEU 30 HA LEU 30 4.071 -13.321 -14.451 223 HB2 LEU 30 HB2 LEU 30 1.825 -13.318 -16.486 224 HB3 LEU 30 HB1 LEU 30 2.463 -11.929 -15.612 225 HG LEU 30 HG LEU 30 4.020 -13.599 -17.617 226 HD11 LEU 30 HD11 LEU 30 3.796 -11.611 -19.066 227 HD12 LEU 30 HD12 LEU 30 2.825 -10.816 -17.826 228 HD13 LEU 30 HD13 LEU 30 2.212 -12.258 -18.637 229 HD21 LEU 30 HD21 LEU 30 5.607 -12.652 -16.091 230 HD22 LEU 30 HD22 LEU 30 4.714 -11.135 -15.980 231 HD23 LEU 30 HD23 LEU 30 5.583 -11.544 -17.459 232 H ALA 31 HN ALA 31 2.682 -12.576 -12.847 233 HA ALA 31 HA ALA 31 1.151 -14.483 -11.478 234 HB1 ALA 31 HB1 ALA 31 0.604 -12.727 -9.958 235 HB2 ALA 31 HB2 ALA 31 0.851 -11.490 -11.192 236 HB3 ALA 31 HB3 ALA 31 2.227 -12.380 -10.548 237 H THR 32 HN THR 32 -0.391 -15.406 -12.810 238 HA THR 32 HA THR 32 -2.334 -13.847 -14.251 239 HB THR 32 HB THR 32 -1.579 -16.168 -14.887 240 HG1 THR 32 HG1 THR 32 -3.349 -15.755 -15.953 241 HG21 THR 32 HG21 THR 32 -1.796 -17.055 -12.501 242 HG22 THR 32 HG22 THR 32 -2.453 -18.085 -13.767 243 HG23 THR 32 HG23 THR 32 -3.534 -17.103 -12.779 244 H TYR 33 HN TYR 33 -4.741 -14.608 -13.858 245 HA TYR 33 HA TYR 33 -5.646 -13.354 -11.526 246 HB2 TYR 33 HB2 TYR 33 -7.039 -13.566 -13.474 247 HB3 TYR 33 HB1 TYR 33 -7.010 -15.316 -13.379 248 HD1 TYR 33 HD1 TYR 33 -8.267 -12.213 -11.749 249 HD2 TYR 33 HD2 TYR 33 -8.455 -16.506 -11.848 250 HE1 TYR 33 HE1 TYR 33 -10.277 -12.161 -10.295 251 HE2 TYR 33 HE2 TYR 33 -10.460 -16.452 -10.394 252 HH TYR 33 HH TYR 33 -12.032 -13.416 -9.543 253 H LYS 34 HN LYS 34 -5.588 -16.836 -12.295 254 HA LYS 34 HA LYS 34 -6.521 -17.797 -9.849 255 HB2 LYS 34 HB2 LYS 34 -6.154 -19.106 -11.999 256 HB3 LYS 34 HB1 LYS 34 -4.443 -19.137 -11.599 257 HG2 LYS 34 HG2 LYS 34 -5.169 -21.190 -10.700 258 HG3 LYS 34 HG1 LYS 34 -5.264 -20.143 -9.287 259 HD2 LYS 34 HD2 LYS 34 -7.679 -19.828 -9.661 260 HD3 LYS 34 HD1 LYS 34 -7.590 -20.798 -11.130 261 HE2 LYS 34 HE2 LYS 34 -6.869 -22.744 -9.809 262 HE3 LYS 34 HE1 LYS 34 -6.939 -21.776 -8.335 263 HZ1 LYS 34 HZ1 LYS 34 -8.960 -23.005 -8.546 264 HZ2 LYS 34 HZ2 LYS 34 -9.202 -22.451 -10.135 265 HZ3 LYS 34 HZ3 LYS 34 -9.309 -21.368 -8.829 266 H GLN 35 HN GLN 35 -3.162 -17.222 -10.891 267 HA GLN 35 HA GLN 35 -2.000 -18.013 -8.408 268 HB2 GLN 35 HB2 GLN 35 -0.753 -17.968 -10.570 269 HB3 GLN 35 HB1 GLN 35 -0.798 -16.205 -10.520 270 HG2 GLN 35 HG2 GLN 35 0.491 -16.163 -8.480 271 HG3 GLN 35 HG1 GLN 35 0.381 -17.912 -8.320 272 HE21 GLN 35 HE21 GLN 35 2.583 -18.497 -8.564 273 HE22 GLN 35 HE22 GLN 35 3.496 -18.141 -9.948 274 H LEU 36 HN LEU 36 -3.060 -14.925 -9.747 275 HA LEU 36 HA LEU 36 -1.969 -13.239 -7.758 276 HB2 LEU 36 HB2 LEU 36 -4.239 -13.014 -9.705 277 HB3 LEU 36 HB1 LEU 36 -4.048 -11.754 -8.520 278 HG LEU 36 HG LEU 36 -1.750 -12.596 -10.314 279 HD11 LEU 36 HD11 LEU 36 -3.610 -11.907 -11.761 280 HD12 LEU 36 HD12 LEU 36 -2.379 -10.642 -11.744 281 HD13 LEU 36 HD13 LEU 36 -3.850 -10.456 -10.792 282 HD21 LEU 36 HD21 LEU 36 -2.367 -10.086 -8.706 283 HD22 LEU 36 HD22 LEU 36 -1.025 -10.219 -9.837 284 HD23 LEU 36 HD23 LEU 36 -1.066 -11.231 -8.402 285 H GLU 37 HN GLU 37 -5.102 -14.908 -7.975 286 HA GLU 37 HA GLU 37 -6.259 -13.776 -5.664 287 HB2 GLU 37 HB2 GLU 37 -7.535 -14.981 -7.401 288 HB3 GLU 37 HB1 GLU 37 -6.765 -16.489 -6.914 289 HG2 GLU 37 HG2 GLU 37 -7.761 -16.325 -4.690 290 HG3 GLU 37 HG1 GLU 37 -8.440 -14.746 -5.081 291 H ALA 38 HN ALA 38 -4.296 -16.686 -6.139 292 HA ALA 38 HA ALA 38 -4.500 -17.782 -3.580 293 HB1 ALA 38 HB1 ALA 38 -3.415 -18.912 -5.498 294 HB2 ALA 38 HB2 ALA 38 -2.386 -18.907 -4.065 295 HB3 ALA 38 HB3 ALA 38 -2.066 -17.779 -5.383 296 H ALA 39 HN ALA 39 -2.447 -15.175 -4.785 297 HA ALA 39 HA ALA 39 -1.006 -14.927 -2.268 298 HB1 ALA 39 HB1 ALA 39 -1.001 -13.152 -4.718 299 HB2 ALA 39 HB2 ALA 39 0.144 -14.447 -4.373 300 HB3 ALA 39 HB3 ALA 39 0.099 -13.015 -3.346 301 H ARG 40 HN ARG 40 -3.848 -13.583 -3.729 302 HA ARG 40 HA ARG 40 -4.034 -11.139 -2.377 303 HB2 ARG 40 HB2 ARG 40 -5.514 -11.934 -4.254 304 HB3 ARG 40 HB1 ARG 40 -6.340 -12.957 -3.087 305 HG2 ARG 40 HG2 ARG 40 -7.588 -10.867 -3.408 306 HG3 ARG 40 HG1 ARG 40 -6.973 -10.958 -1.762 307 HD2 ARG 40 HD2 ARG 40 -5.443 -9.208 -2.106 308 HD3 ARG 40 HD1 ARG 40 -5.245 -9.581 -3.806 309 HE ARG 40 HE ARG 40 -6.811 -7.970 -4.212 310 HH11 ARG 40 HH21 ARG 40 -7.450 -9.311 -1.067 311 HH12 ARG 40 HH22 ARG 40 -8.936 -8.454 -0.855 312 HH21 ARG 40 HH11 ARG 40 -8.744 -6.879 -3.940 313 HH22 ARG 40 HH12 ARG 40 -9.685 -7.105 -2.498 314 H LYS 41 HN LYS 41 -4.634 -14.408 -1.286 315 HA LYS 41 HA LYS 41 -5.966 -13.622 1.168 316 HB2 LYS 41 HB2 LYS 41 -4.795 -16.267 0.264 317 HB3 LYS 41 HB1 LYS 41 -5.678 -16.033 1.770 318 HG2 LYS 41 HG2 LYS 41 -7.661 -15.292 0.502 319 HG3 LYS 41 HG1 LYS 41 -6.780 -15.518 -1.011 320 HD2 LYS 41 HD2 LYS 41 -6.524 -17.908 -0.540 321 HD3 LYS 41 HD1 LYS 41 -7.321 -17.708 1.018 322 HE2 LYS 41 HE2 LYS 41 -8.927 -18.577 -0.600 323 HE3 LYS 41 HE1 LYS 41 -9.371 -16.924 -0.169 324 HZ1 LYS 41 HZ1 LYS 41 -7.596 -17.344 -2.463 325 HZ2 LYS 41 HZ2 LYS 41 -8.752 -16.128 -2.195 326 HZ3 LYS 41 HZ3 LYS 41 -9.247 -17.686 -2.654 327 H ILE 42 HN ILE 42 -2.784 -13.489 0.122 328 HA ILE 42 HA ILE 42 -1.582 -14.063 2.761 329 HB ILE 42 HB ILE 42 -0.257 -13.277 0.146 330 HG12 ILE 42 HG12 ILE 42 -0.441 -15.985 1.517 331 HG13 ILE 42 HG11 ILE 42 -1.440 -15.503 0.151 332 HG21 ILE 42 HG21 ILE 42 1.772 -14.334 1.478 333 HG22 ILE 42 HG22 ILE 42 0.808 -13.961 2.899 334 HG23 ILE 42 HG23 ILE 42 1.312 -12.675 1.807 335 HD11 ILE 42 HD11 ILE 42 0.263 -16.610 -0.972 336 HD12 ILE 42 HD12 ILE 42 1.478 -16.182 0.229 337 HD13 ILE 42 HD13 ILE 42 0.957 -14.988 -0.959 338 H GLY 43 HN GLY 43 -3.134 -11.520 1.414 339 HA2 GLY 43 HA3 GLY 43 -3.351 -9.397 2.424 340 HA3 GLY 43 HA2 GLY 43 -1.773 -9.593 3.176 341 H PHE 44 HN PHE 44 -2.343 -10.194 -0.238 342 HA PHE 44 HA PHE 44 -0.257 -8.408 -1.024 343 HB2 PHE 44 HB2 PHE 44 -1.080 -10.557 -2.203 344 HB3 PHE 44 HB1 PHE 44 -2.368 -9.566 -2.861 345 HD1 PHE 44 HD1 PHE 44 1.355 -9.781 -2.576 346 HD2 PHE 44 HD2 PHE 44 -1.978 -8.215 -4.796 347 HE1 PHE 44 HE1 PHE 44 2.899 -8.993 -4.349 348 HE2 PHE 44 HE2 PHE 44 -0.429 -7.428 -6.561 349 HZ PHE 44 HZ PHE 44 2.008 -7.817 -6.338 350 H HIS 45 HN HIS 45 -0.354 -6.345 -1.729 351 HA HIS 45 HA HIS 45 -2.869 -5.123 -2.569 352 HB2 HIS 45 HB2 HIS 45 -3.049 -4.930 -0.149 353 HB3 HIS 45 HB1 HIS 45 -1.428 -4.251 -0.050 354 HD1 HIS 45 HD1 HIS 45 -4.648 -3.406 -1.955 355 HD2 HIS 45 HD2 HIS 45 -1.544 -1.515 0.088 356 HE1 HIS 45 HE1 HIS 45 -5.177 -0.926 -1.980 357 HE2 HIS 45 HE2 HIS 45 -3.298 0.236 -0.729 358 H VAL 46 HN VAL 46 -2.072 -4.465 -4.471 359 HA VAL 46 HA VAL 46 0.025 -2.382 -4.420 360 HB VAL 46 HB VAL 46 0.092 -4.692 -6.381 361 HG11 VAL 46 HG11 VAL 46 0.987 -2.625 -7.310 362 HG12 VAL 46 HG12 VAL 46 2.335 -3.687 -6.908 363 HG13 VAL 46 HG13 VAL 46 1.932 -2.335 -5.851 364 HG21 VAL 46 HG21 VAL 46 2.212 -5.286 -5.145 365 HG22 VAL 46 HG22 VAL 46 0.747 -5.522 -4.195 366 HG23 VAL 46 HG23 VAL 46 1.764 -4.108 -3.912 367 H CYS 47 HN CYS 47 -0.832 -0.659 -5.347 368 HA CYS 47 HA CYS 47 -3.011 -0.936 -7.308 369 HB2 CYS 47 HB2 CYS 47 -2.870 0.743 -5.265 370 HB3 CYS 47 HB1 CYS 47 -1.937 1.732 -6.385 371 H ALA 48 HN ALA 48 -2.014 -1.602 -9.182 372 HA ALA 48 HA ALA 48 -0.868 0.394 -10.836 373 HB1 ALA 48 HB1 ALA 48 1.174 0.103 -9.610 374 HB2 ALA 48 HB2 ALA 48 1.384 -0.742 -11.143 375 HB3 ALA 48 HB3 ALA 48 1.034 -1.652 -9.674 376 H ALA 49 HN ALA 49 -1.809 -0.130 -12.681 377 HA ALA 49 HA ALA 49 -2.695 -2.768 -13.320 378 HB1 ALA 49 HB1 ALA 49 -3.907 -0.851 -14.159 379 HB2 ALA 49 HB2 ALA 49 -3.269 -1.762 -15.527 380 HB3 ALA 49 HB3 ALA 49 -2.476 -0.276 -15.009 381 H GLY 50 HN GLY 50 -1.884 -4.268 -14.716 382 HA2 GLY 50 HA3 GLY 50 0.518 -3.719 -16.292 383 HA3 GLY 50 HA2 GLY 50 0.756 -4.814 -14.938 384 H TRP 51 HN TRP 51 1.306 -5.761 -17.375 385 HA TRP 51 HA TRP 51 -0.980 -7.143 -18.540 386 HB2 TRP 51 HB2 TRP 51 1.993 -7.185 -19.136 387 HB3 TRP 51 HB1 TRP 51 0.834 -8.213 -19.976 388 HD1 TRP 51 HD1 TRP 51 2.432 -4.954 -20.291 389 HE1 TRP 51 HE1 TRP 51 1.157 -3.453 -21.957 390 HE3 TRP 51 HE3 TRP 51 -1.939 -7.571 -20.694 391 HZ2 TRP 51 HZ2 TRP 51 -1.363 -3.375 -23.288 392 HZ3 TRP 51 HZ3 TRP 51 -3.756 -6.757 -22.169 393 HH2 TRP 51 HH2 TRP 51 -3.474 -4.665 -23.467 394 H MET 52 HN MET 52 -1.067 -9.449 -18.731 395 HA MET 52 HA MET 52 0.541 -11.090 -16.925 396 HB2 MET 52 HB2 MET 52 -2.452 -10.766 -16.510 397 HB3 MET 52 HB1 MET 52 -1.505 -12.073 -15.828 398 HG2 MET 52 HG2 MET 52 -1.516 -10.557 -14.053 399 HG3 MET 52 HG1 MET 52 -0.020 -10.100 -14.846 400 HE1 MET 52 HE1 MET 52 -3.373 -7.419 -13.777 401 HE2 MET 52 HE2 MET 52 -2.276 -8.446 -12.857 402 HE3 MET 52 HE3 MET 52 -3.564 -9.177 -13.810 403 H ALA 53 HN ALA 53 -0.437 -13.421 -16.982 404 HA ALA 53 HA ALA 53 -0.068 -14.517 -19.459 405 HB1 ALA 53 HB1 ALA 53 -1.960 -15.556 -17.340 406 HB2 ALA 53 HB2 ALA 53 -0.221 -15.844 -17.396 407 HB3 ALA 53 HB3 ALA 53 -1.264 -16.500 -18.657 408 H LYS 54 HN LYS 54 -1.304 -15.132 -21.176 409 HA LYS 54 HA LYS 54 -2.927 -14.904 -22.778 410 HB2 LYS 54 HB2 LYS 54 -4.724 -14.889 -20.333 411 HB3 LYS 54 HB1 LYS 54 -5.298 -15.002 -21.992 412 HG2 LYS 54 HG2 LYS 54 -4.049 -17.089 -22.312 413 HG3 LYS 54 HG1 LYS 54 -3.405 -16.972 -20.673 414 HD2 LYS 54 HD2 LYS 54 -5.732 -17.030 -19.783 415 HD3 LYS 54 HD1 LYS 54 -6.334 -17.240 -21.428 416 HE2 LYS 54 HE2 LYS 54 -4.451 -19.131 -19.982 417 HE3 LYS 54 HE1 LYS 54 -6.169 -19.407 -20.266 418 HZ1 LYS 54 HZ1 LYS 54 -5.244 -20.502 -22.026 419 HZ2 LYS 54 HZ2 LYS 54 -3.942 -19.421 -22.177 420 HZ3 LYS 54 HZ3 LYS 54 -5.487 -18.976 -22.724 421 H GLY 55 HN GLY 55 -1.614 -12.541 -22.095 422 HA2 GLY 55 HA3 GLY 55 -1.756 -10.253 -22.244 423 HA3 GLY 55 HA2 GLY 55 -3.112 -10.569 -23.278 424 H ARG 56 HN ARG 56 -3.594 -11.848 -20.208 425 HA ARG 56 HA ARG 56 -5.819 -10.164 -19.711 426 HB2 ARG 56 HB2 ARG 56 -5.414 -12.537 -18.847 427 HB3 ARG 56 HB1 ARG 56 -4.366 -11.811 -17.637 428 HG2 ARG 56 HG2 ARG 56 -6.204 -10.464 -16.776 429 HG3 ARG 56 HG1 ARG 56 -7.275 -11.085 -18.036 430 HD2 ARG 56 HD2 ARG 56 -6.928 -13.384 -17.188 431 HD3 ARG 56 HD1 ARG 56 -5.928 -12.745 -15.879 432 HE ARG 56 HE ARG 56 -8.788 -12.757 -16.025 433 HH11 ARG 56 HH21 ARG 56 -6.028 -11.032 -14.774 434 HH12 ARG 56 HH22 ARG 56 -6.927 -10.248 -13.522 435 HH21 ARG 56 HH11 ARG 56 -9.919 -11.750 -14.413 436 HH22 ARG 56 HH12 ARG 56 -9.121 -10.674 -13.318 437 H VAL 57 HN VAL 57 -6.100 -8.436 -18.330 438 HA VAL 57 HA VAL 57 -3.732 -7.349 -16.917 439 HB VAL 57 HB VAL 57 -3.699 -6.110 -18.964 440 HG11 VAL 57 HG11 VAL 57 -5.927 -6.730 -19.782 441 HG12 VAL 57 HG12 VAL 57 -5.687 -4.990 -19.848 442 HG13 VAL 57 HG13 VAL 57 -6.672 -5.691 -18.565 443 HG21 VAL 57 HG21 VAL 57 -3.991 -3.870 -18.185 444 HG22 VAL 57 HG22 VAL 57 -3.658 -4.799 -16.728 445 HG23 VAL 57 HG23 VAL 57 -5.308 -4.323 -17.102 446 H GLY 58 HN GLY 58 -4.157 -6.105 -15.156 447 HA2 GLY 58 HA3 GLY 58 -6.767 -5.311 -14.342 448 HA3 GLY 58 HA2 GLY 58 -6.324 -6.833 -13.577 449 H TYR 59 HN TYR 59 -6.679 -5.263 -11.715 450 HA TYR 59 HA TYR 59 -4.039 -4.522 -10.760 451 HB2 TYR 59 HB2 TYR 59 -4.610 -2.228 -10.137 452 HB3 TYR 59 HB1 TYR 59 -4.589 -2.481 -11.877 453 HD1 TYR 59 HD2 TYR 59 -6.740 -2.724 -13.140 454 HD2 TYR 59 HD1 TYR 59 -6.628 -1.549 -9.008 455 HE1 TYR 59 HE2 TYR 59 -9.039 -1.819 -13.328 456 HE2 TYR 59 HE1 TYR 59 -8.923 -0.639 -9.205 457 HH TYR 59 HH TYR 59 -10.651 -0.677 -12.320 458 HA PRO 60 HA PRO 60 -6.619 -6.068 -7.336 459 HB2 PRO 60 HB2 PRO 60 -4.662 -7.263 -5.871 460 HB3 PRO 60 HB1 PRO 60 -5.294 -7.998 -7.363 461 HG2 PRO 60 HG2 PRO 60 -2.777 -6.422 -6.955 462 HG3 PRO 60 HG1 PRO 60 -3.035 -7.904 -7.900 463 HD2 PRO 60 HD2 PRO 60 -2.950 -5.377 -9.009 464 HD3 PRO 60 HD1 PRO 60 -3.827 -6.733 -9.753 465 H ILE 61 HN ILE 61 -7.252 -4.930 -5.604 466 HA ILE 61 HA ILE 61 -5.315 -3.414 -3.996 467 HB ILE 61 HB ILE 61 -6.759 -1.385 -4.085 468 HG12 ILE 61 HG12 ILE 61 -8.080 -2.808 -6.421 469 HG13 ILE 61 HG11 ILE 61 -8.834 -2.572 -4.848 470 HG21 ILE 61 HG21 ILE 61 -5.780 -2.215 -6.826 471 HG22 ILE 61 HG22 ILE 61 -4.713 -1.687 -5.524 472 HG23 ILE 61 HG23 ILE 61 -5.912 -0.579 -6.186 473 HD11 ILE 61 HD11 ILE 61 -8.591 -0.117 -5.114 474 HD12 ILE 61 HD12 ILE 61 -9.583 -0.829 -6.388 475 HD13 ILE 61 HD13 ILE 61 -7.914 -0.373 -6.722 476 H VAL 62 HN VAL 62 -5.955 -3.026 -1.925 477 HA VAL 62 HA VAL 62 -8.474 -4.363 -1.047 478 HB VAL 62 HB VAL 62 -5.958 -4.007 0.597 479 HG11 VAL 62 HG11 VAL 62 -8.480 -5.669 0.923 480 HG12 VAL 62 HG12 VAL 62 -7.946 -4.346 1.952 481 HG13 VAL 62 HG13 VAL 62 -7.046 -5.855 1.930 482 HG21 VAL 62 HG21 VAL 62 -6.892 -6.354 -1.066 483 HG22 VAL 62 HG22 VAL 62 -5.612 -6.457 0.137 484 HG23 VAL 62 HG23 VAL 62 -5.406 -5.438 -1.289 485 H LYS 63 HN LYS 63 -6.806 -1.419 -1.271 486 HA LYS 63 HA LYS 63 -8.836 -0.157 0.422 487 HB2 LYS 63 HB2 LYS 63 -5.918 -0.250 0.991 488 HB3 LYS 63 HB1 LYS 63 -6.634 1.350 1.160 489 HG2 LYS 63 HG2 LYS 63 -8.404 0.264 2.654 490 HG3 LYS 63 HG1 LYS 63 -7.412 -1.194 2.623 491 HD2 LYS 63 HD2 LYS 63 -6.523 1.543 3.578 492 HD3 LYS 63 HD1 LYS 63 -6.921 0.173 4.613 493 HE2 LYS 63 HE2 LYS 63 -4.576 0.021 4.486 494 HE3 LYS 63 HE1 LYS 63 -5.063 -1.077 3.194 495 HZ1 LYS 63 HZ1 LYS 63 -3.897 0.186 1.819 496 HZ2 LYS 63 HZ2 LYS 63 -3.590 1.334 3.032 497 HZ3 LYS 63 HZ3 LYS 63 -4.993 1.455 2.080 498 HA PRO 64 HA PRO 64 -9.369 3.049 -2.526 499 HB2 PRO 64 HB2 PRO 64 -8.171 4.913 -0.469 500 HB3 PRO 64 HB1 PRO 64 -9.629 5.133 -1.460 501 HG2 PRO 64 HG2 PRO 64 -9.749 4.369 1.131 502 HG3 PRO 64 HG1 PRO 64 -10.930 3.825 -0.075 503 HD2 PRO 64 HD2 PRO 64 -8.827 2.243 1.282 504 HD3 PRO 64 HD1 PRO 64 -10.249 1.681 0.383 505 H GLY 65 HN GLY 65 -8.186 4.092 -4.122 506 HA2 GLY 65 HA3 GLY 65 -5.219 4.227 -3.807 507 HA3 GLY 65 HA2 GLY 65 -5.983 3.509 -5.216 508 HA PRO 66 HA PRO 66 -6.976 8.353 -5.189 509 HB2 PRO 66 HB2 PRO 66 -4.351 9.076 -3.877 510 HB3 PRO 66 HB1 PRO 66 -5.919 9.908 -3.775 511 HG2 PRO 66 HG2 PRO 66 -5.076 8.419 -1.751 512 HG3 PRO 66 HG1 PRO 66 -6.780 8.357 -2.250 513 HD2 PRO 66 HD2 PRO 66 -4.591 6.354 -2.786 514 HD3 PRO 66 HD1 PRO 66 -6.306 6.069 -2.411 515 H ASN 67 HN ASN 67 -3.562 7.315 -5.264 516 HA ASN 67 HA ASN 67 -3.014 8.758 -7.722 517 HB2 ASN 67 HB2 ASN 67 -0.769 7.842 -7.492 518 HB3 ASN 67 HB1 ASN 67 -1.307 8.516 -5.955 519 HD21 ASN 67 HD21 ASN 67 0.212 5.839 -7.246 520 HD22 ASN 67 HD22 ASN 67 -0.165 4.707 -6.038 521 H CYS 68 HN CYS 68 -5.090 6.673 -7.760 522 HA CYS 68 HA CYS 68 -4.513 5.499 -10.240 523 HB2 CYS 68 HB2 CYS 68 -4.376 3.062 -9.490 524 HB3 CYS 68 HB1 CYS 68 -2.938 4.020 -9.200 525 H GLY 69 HN GLY 69 -6.028 3.188 -10.167 526 HA2 GLY 69 HA3 GLY 69 -8.619 4.054 -10.471 527 HA3 GLY 69 HA2 GLY 69 -8.200 2.389 -10.091 528 H PHE 70 HN PHE 70 -9.116 5.492 -8.740 529 HA PHE 70 HA PHE 70 -9.340 4.494 -6.018 530 HB2 PHE 70 HB2 PHE 70 -10.151 6.739 -5.495 531 HB3 PHE 70 HB1 PHE 70 -8.658 6.816 -6.424 532 HD1 PHE 70 HD2 PHE 70 -8.692 7.453 -8.827 533 HD2 PHE 70 HD1 PHE 70 -12.262 7.529 -6.434 534 HE1 PHE 70 HE2 PHE 70 -9.814 8.848 -10.540 535 HE2 PHE 70 HE1 PHE 70 -13.382 8.922 -8.151 536 HZ PHE 70 HZ PHE 70 -12.157 9.582 -10.202 537 H GLY 71 HN GLY 71 -10.948 3.366 -8.294 538 HA2 GLY 71 HA3 GLY 71 -13.653 4.108 -8.081 539 HA3 GLY 71 HA2 GLY 71 -13.069 2.541 -8.630 540 H LYS 72 HN LYS 72 -14.190 1.055 -7.559 541 HA LYS 72 HA LYS 72 -15.102 1.428 -4.830 542 HB2 LYS 72 HB2 LYS 72 -15.171 -1.135 -6.447 543 HB3 LYS 72 HB1 LYS 72 -16.220 -0.666 -5.113 544 HG2 LYS 72 HG2 LYS 72 -16.127 0.716 -7.817 545 HG3 LYS 72 HG1 LYS 72 -17.343 -0.455 -7.322 546 HD2 LYS 72 HD2 LYS 72 -17.926 1.070 -5.401 547 HD3 LYS 72 HD1 LYS 72 -16.834 2.268 -6.090 548 HE2 LYS 72 HE2 LYS 72 -18.129 2.328 -8.154 549 HE3 LYS 72 HE1 LYS 72 -19.205 1.073 -7.539 550 HZ1 LYS 72 HZ1 LYS 72 -19.180 3.881 -6.984 551 HZ2 LYS 72 HZ2 LYS 72 -19.188 2.944 -5.567 552 HZ3 LYS 72 HZ3 LYS 72 -20.409 2.740 -6.731 553 H THR 73 HN THR 73 -14.685 -1.524 -4.366 554 HA THR 73 HA THR 73 -11.810 -1.496 -3.591 555 HB THR 73 HB THR 73 -12.274 -2.263 -1.427 556 HG1 THR 73 HG1 THR 73 -13.771 -3.863 -2.145 557 HG21 THR 73 HG21 THR 73 -13.803 -0.686 -0.454 558 HG22 THR 73 HG22 THR 73 -14.692 -0.522 -1.969 559 HG23 THR 73 HG23 THR 73 -13.052 0.116 -1.834 560 H GLY 74 HN GLY 74 -11.129 -3.730 -2.894 561 HA2 GLY 74 HA3 GLY 74 -10.800 -5.948 -3.400 562 HA3 GLY 74 HA2 GLY 74 -12.466 -6.020 -3.936 563 H ILE 75 HN ILE 75 -10.221 -7.310 -5.174 564 HA ILE 75 HA ILE 75 -8.991 -6.174 -7.326 565 HB ILE 75 HB ILE 75 -10.414 -8.854 -7.388 566 HG12 ILE 75 HG12 ILE 75 -7.547 -8.194 -6.634 567 HG13 ILE 75 HG11 ILE 75 -8.823 -8.480 -5.460 568 HG21 ILE 75 HG21 ILE 75 -8.187 -7.649 -9.066 569 HG22 ILE 75 HG22 ILE 75 -9.748 -8.240 -9.628 570 HG23 ILE 75 HG23 ILE 75 -8.539 -9.375 -9.042 571 HD11 ILE 75 HD11 ILE 75 -9.144 -10.749 -6.267 572 HD12 ILE 75 HD12 ILE 75 -7.431 -10.514 -5.926 573 HD13 ILE 75 HD13 ILE 75 -8.008 -10.483 -7.590 574 H ILE 76 HN ILE 76 -9.483 -5.634 -9.454 575 HA ILE 76 HA ILE 76 -12.304 -5.746 -10.325 576 HB ILE 76 HB ILE 76 -10.737 -3.177 -10.664 577 HG12 ILE 76 HG12 ILE 76 -12.462 -3.973 -8.298 578 HG13 ILE 76 HG11 ILE 76 -10.751 -3.547 -8.275 579 HG21 ILE 76 HG21 ILE 76 -12.911 -2.223 -11.061 580 HG22 ILE 76 HG22 ILE 76 -13.723 -3.675 -10.474 581 HG23 ILE 76 HG23 ILE 76 -12.835 -3.714 -11.998 582 HD11 ILE 76 HD11 ILE 76 -13.093 -1.721 -8.859 583 HD12 ILE 76 HD12 ILE 76 -11.421 -1.271 -9.203 584 HD13 ILE 76 HD13 ILE 76 -11.924 -1.594 -7.545 585 H ASP 77 HN ASP 77 -10.490 -7.434 -11.326 586 HA ASP 77 HA ASP 77 -8.929 -6.540 -13.483 587 HB2 ASP 77 HB2 ASP 77 -9.064 -8.871 -14.274 588 HB3 ASP 77 HB1 ASP 77 -8.679 -8.769 -12.554 589 H TYR 78 HN TYR 78 -9.319 -6.590 -15.717 590 HA TYR 78 HA TYR 78 -12.058 -5.850 -16.466 591 HB2 TYR 78 HB2 TYR 78 -9.495 -5.858 -18.079 592 HB3 TYR 78 HB1 TYR 78 -11.049 -5.228 -18.621 593 HD1 TYR 78 HD2 TYR 78 -11.987 -3.160 -17.650 594 HD2 TYR 78 HD1 TYR 78 -8.157 -4.668 -16.407 595 HE1 TYR 78 HE2 TYR 78 -11.453 -0.965 -16.625 596 HE2 TYR 78 HE1 TYR 78 -7.626 -2.472 -15.387 597 HH TYR 78 HH TYR 78 -9.968 0.219 -15.483 598 H GLY 79 HN GLY 79 -9.708 -7.639 -18.432 599 HA2 GLY 79 HA3 GLY 79 -10.365 -10.188 -18.543 600 HA3 GLY 79 HA2 GLY 79 -11.853 -9.530 -19.208 601 H ILE 80 HN ILE 80 -8.329 -9.429 -19.678 602 HA ILE 80 HA ILE 80 -7.040 -9.292 -21.576 603 HB ILE 80 HB ILE 80 -9.428 -10.681 -22.821 604 HG12 ILE 80 HG12 ILE 80 -6.911 -11.893 -21.620 605 HG13 ILE 80 HG11 ILE 80 -8.440 -11.781 -20.753 606 HG21 ILE 80 HG21 ILE 80 -7.943 -9.867 -24.546 607 HG22 ILE 80 HG22 ILE 80 -7.612 -11.582 -24.359 608 HG23 ILE 80 HG23 ILE 80 -6.520 -10.395 -23.650 609 HD11 ILE 80 HD11 ILE 80 -8.091 -13.185 -23.421 610 HD12 ILE 80 HD12 ILE 80 -9.549 -13.157 -22.430 611 HD13 ILE 80 HD13 ILE 80 -8.111 -13.999 -21.857 612 H ARG 81 HN ARG 81 -7.036 -7.050 -21.820 613 HA ARG 81 HA ARG 81 -9.121 -5.751 -23.428 614 HB2 ARG 81 HB2 ARG 81 -6.672 -4.759 -21.964 615 HB3 ARG 81 HB1 ARG 81 -7.646 -3.710 -22.987 616 HG2 ARG 81 HG2 ARG 81 -9.633 -4.172 -21.648 617 HG3 ARG 81 HG1 ARG 81 -8.754 -5.335 -20.672 618 HD2 ARG 81 HD2 ARG 81 -7.593 -3.678 -19.505 619 HD3 ARG 81 HD1 ARG 81 -7.701 -2.522 -20.821 620 HE ARG 81 HE ARG 81 -9.561 -2.857 -18.692 621 HH11 ARG 81 HH21 ARG 81 -9.309 -2.162 -22.051 622 HH12 ARG 81 HH22 ARG 81 -10.715 -1.154 -22.098 623 HH21 ARG 81 HH11 ARG 81 -11.443 -1.584 -18.734 624 HH22 ARG 81 HH12 ARG 81 -11.938 -0.827 -20.214 625 H LEU 82 HN LEU 82 -8.650 -4.555 -25.324 626 HA LEU 82 HA LEU 82 -6.820 -5.936 -27.119 627 HB2 LEU 82 HB2 LEU 82 -8.635 -3.574 -27.681 628 HB3 LEU 82 HB1 LEU 82 -7.910 -4.663 -28.861 629 HG LEU 82 HG LEU 82 -9.951 -5.452 -26.750 630 HD11 LEU 82 HD11 LEU 82 -10.161 -5.030 -29.747 631 HD12 LEU 82 HD12 LEU 82 -11.017 -4.150 -28.481 632 HD13 LEU 82 HD13 LEU 82 -11.398 -5.844 -28.789 633 HD21 LEU 82 HD21 LEU 82 -10.004 -7.593 -28.226 634 HD22 LEU 82 HD22 LEU 82 -8.642 -7.398 -27.132 635 HD23 LEU 82 HD23 LEU 82 -8.446 -7.043 -28.850 636 H ASN 83 HN ASN 83 -6.350 -3.631 -24.894 637 HA ASN 83 HA ASN 83 -4.860 -1.660 -26.373 638 HB2 ASN 83 HB2 ASN 83 -5.346 -2.286 -23.473 639 HB3 ASN 83 HB1 ASN 83 -3.992 -1.241 -23.869 640 HD21 ASN 83 HD21 ASN 83 -6.724 -1.143 -26.036 641 HD22 ASN 83 HD22 ASN 83 -7.326 0.356 -25.513 642 H ARG 84 HN ARG 84 -4.191 -4.642 -26.486 643 HA ARG 84 HA ARG 84 -1.733 -5.236 -25.347 644 HB2 ARG 84 HB2 ARG 84 -2.841 -5.960 -28.068 645 HB3 ARG 84 HB1 ARG 84 -1.352 -6.653 -27.413 646 HG2 ARG 84 HG2 ARG 84 -2.545 -7.539 -25.491 647 HG3 ARG 84 HG1 ARG 84 -4.044 -6.765 -26.022 648 HD2 ARG 84 HD2 ARG 84 -4.092 -8.103 -28.046 649 HD3 ARG 84 HD1 ARG 84 -2.513 -8.813 -27.664 650 HE ARG 84 HE ARG 84 -5.083 -9.543 -26.501 651 HH11 ARG 84 HH21 ARG 84 -1.717 -9.318 -25.848 652 HH12 ARG 84 HH22 ARG 84 -1.614 -10.852 -25.051 653 HH21 ARG 84 HH11 ARG 84 -4.994 -11.548 -25.443 654 HH22 ARG 84 HH12 ARG 84 -3.483 -12.129 -24.828 655 H SER 85 HN SER 85 -2.404 -2.706 -27.485 656 HA SER 85 HA SER 85 0.276 -2.547 -28.636 657 HB2 SER 85 HB2 SER 85 -2.098 -0.680 -28.818 658 HB3 SER 85 HB1 SER 85 -0.586 -0.504 -29.707 659 HG SER 85 HG SER 85 -2.697 -1.967 -30.339 660 H GLU 86 HN GLU 86 -1.718 -0.809 -26.269 661 HA GLU 86 HA GLU 86 0.178 1.218 -25.683 662 HB2 GLU 86 HB2 GLU 86 -2.098 0.102 -24.042 663 HB3 GLU 86 HB1 GLU 86 -1.176 1.528 -23.593 664 HG2 GLU 86 HG2 GLU 86 -1.856 2.658 -25.649 665 HG3 GLU 86 HG1 GLU 86 -2.708 1.214 -26.192 666 H ARG 87 HN ARG 87 1.459 1.446 -23.774 667 HA ARG 87 HA ARG 87 2.697 -1.086 -22.918 668 HB2 ARG 87 HB2 ARG 87 3.500 1.793 -22.393 669 HB3 ARG 87 HB1 ARG 87 4.402 0.367 -21.888 670 HG2 ARG 87 HG2 ARG 87 4.678 -0.319 -24.242 671 HG3 ARG 87 HG1 ARG 87 3.753 1.090 -24.767 672 HD2 ARG 87 HD2 ARG 87 5.459 2.553 -23.678 673 HD3 ARG 87 HD1 ARG 87 6.383 1.115 -23.281 674 HE ARG 87 HE ARG 87 7.134 1.030 -25.426 675 HH11 ARG 87 HH21 ARG 87 4.350 3.122 -25.289 676 HH12 ARG 87 HH22 ARG 87 4.510 3.646 -26.929 677 HH21 ARG 87 HH11 ARG 87 7.363 1.764 -27.523 678 HH22 ARG 87 HH12 ARG 87 6.229 2.894 -28.192 679 H TRP 88 HN TRP 88 2.918 -1.702 -20.776 680 HA TRP 88 HA TRP 88 1.603 -0.195 -18.638 681 HB2 TRP 88 HB2 TRP 88 0.596 -2.921 -19.486 682 HB3 TRP 88 HB1 TRP 88 0.154 -2.104 -17.995 683 HD1 TRP 88 HD1 TRP 88 -0.283 -1.851 -21.789 684 HE1 TRP 88 HE1 TRP 88 -2.319 -0.343 -22.269 685 HE3 TRP 88 HE3 TRP 88 -1.286 -0.214 -17.071 686 HZ2 TRP 88 HZ2 TRP 88 -4.141 1.341 -20.827 687 HZ3 TRP 88 HZ3 TRP 88 -3.173 1.335 -16.643 688 HH2 TRP 88 HH2 TRP 88 -4.600 2.116 -18.514 689 H ASP 89 HN ASP 89 1.682 -1.616 -16.560 690 HA ASP 89 HA ASP 89 4.441 -2.415 -16.191 691 HB2 ASP 89 HB2 ASP 89 2.918 -1.131 -14.526 692 HB3 ASP 89 HB1 ASP 89 2.226 -2.701 -14.143 693 H ALA 90 HN ALA 90 4.359 -4.420 -14.389 694 HA ALA 90 HA ALA 90 2.727 -6.640 -15.155 695 HB1 ALA 90 HB1 ALA 90 5.580 -6.623 -16.167 696 HB2 ALA 90 HB2 ALA 90 4.123 -6.595 -17.159 697 HB3 ALA 90 HB3 ALA 90 4.500 -8.018 -16.187 698 H TYR 91 HN TYR 91 3.559 -8.699 -14.178 699 HA TYR 91 HA TYR 91 5.282 -8.252 -11.798 700 HB2 TYR 91 HB2 TYR 91 2.594 -9.652 -11.788 701 HB3 TYR 91 HB1 TYR 91 3.712 -9.561 -10.432 702 HD1 TYR 91 HD2 TYR 91 4.072 -7.444 -9.222 703 HD2 TYR 91 HD1 TYR 91 1.310 -7.679 -12.508 704 HE1 TYR 91 HE2 TYR 91 3.078 -5.276 -8.544 705 HE2 TYR 91 HE1 TYR 91 0.316 -5.514 -11.824 706 HH TYR 91 HH TYR 91 1.750 -3.377 -9.816 707 H CYS 92 HN CYS 92 6.541 -9.941 -11.239 708 HA CYS 92 HA CYS 92 6.394 -12.413 -12.917 709 HB2 CYS 92 HB2 CYS 92 8.668 -10.644 -12.142 710 HB3 CYS 92 HB1 CYS 92 9.001 -12.371 -12.059 711 H TYR 93 HN TYR 93 6.568 -14.347 -11.929 712 HA TYR 93 HA TYR 93 6.520 -14.403 -8.948 713 HB2 TYR 93 HB2 TYR 93 4.380 -15.033 -9.932 714 HB3 TYR 93 HB1 TYR 93 5.169 -16.218 -10.966 715 HD1 TYR 93 HD1 TYR 93 4.206 -15.398 -7.480 716 HD2 TYR 93 HD2 TYR 93 5.948 -18.351 -10.071 717 HE1 TYR 93 HE1 TYR 93 3.992 -17.098 -5.689 718 HE2 TYR 93 HE2 TYR 93 5.734 -20.047 -8.278 719 HH TYR 93 HH TYR 93 5.581 -19.757 -5.466 720 H ASN 94 HN ASN 94 7.587 -16.060 -7.902 721 HA ASN 94 HA ASN 94 9.408 -17.742 -9.518 722 HB2 ASN 94 HB2 ASN 94 10.171 -15.655 -7.493 723 HB3 ASN 94 HB1 ASN 94 11.159 -17.109 -7.574 724 HD21 ASN 94 HD21 ASN 94 9.737 -14.676 -9.843 725 HD22 ASN 94 HD22 ASN 94 11.095 -14.633 -10.862 726 HA PRO 95 HA PRO 95 8.288 -20.916 -6.643 727 HB2 PRO 95 HB2 PRO 95 10.534 -22.506 -6.665 728 HB3 PRO 95 HB1 PRO 95 9.430 -22.391 -8.054 729 HG2 PRO 95 HG2 PRO 95 12.010 -20.922 -7.581 730 HG3 PRO 95 HG1 PRO 95 11.467 -21.784 -9.036 731 HD2 PRO 95 HD2 PRO 95 11.244 -19.105 -8.865 732 HD3 PRO 95 HD1 PRO 95 9.978 -20.071 -9.656 733 H HIS 96 HN HIS 96 8.776 -21.835 -4.531 734 HA HIS 96 HA HIS 96 9.491 -20.056 -2.562 735 HB2 HIS 96 HB2 HIS 96 8.340 -22.203 -2.155 736 HB3 HIS 96 HB1 HIS 96 9.851 -23.059 -2.471 737 HD1 HIS 96 HD1 HIS 96 8.430 -20.468 -0.069 738 HD2 HIS 96 HD2 HIS 96 11.552 -23.219 -0.283 739 HE1 HIS 96 HE1 HIS 96 9.531 -20.479 2.212 740 HE2 HIS 96 HE2 HIS 96 11.438 -22.153 2.095 741 H ALA 97 HN ALA 97 11.313 -18.900 -2.910 742 HA ALA 97 HA ALA 97 13.800 -20.094 -2.076 743 HB1 ALA 97 HB1 ALA 97 13.631 -18.996 -4.905 744 HB2 ALA 97 HB2 ALA 97 13.734 -20.711 -4.506 745 HB3 ALA 97 HB3 ALA 97 15.067 -19.631 -4.102 746 H LYS 98 HN LYS 98 12.488 -17.410 -3.985 747 HA LYS 98 HA LYS 98 12.736 -15.555 -1.927 748 HB2 LYS 98 HB2 LYS 98 14.588 -14.204 -2.472 749 HB3 LYS 98 HB1 LYS 98 15.232 -15.830 -2.609 750 HG2 LYS 98 HG2 LYS 98 14.280 -14.152 -4.956 751 HG3 LYS 98 HG1 LYS 98 15.947 -14.341 -4.450 752 HD2 LYS 98 HD2 LYS 98 15.763 -16.795 -4.796 753 HD3 LYS 98 HD1 LYS 98 14.119 -16.560 -5.396 754 HE2 LYS 98 HE2 LYS 98 14.985 -15.071 -7.172 755 HE3 LYS 98 HE1 LYS 98 16.622 -15.322 -6.572 756 HZ1 LYS 98 HZ1 LYS 98 15.682 -17.840 -6.877 757 HZ2 LYS 98 HZ2 LYS 98 16.679 -17.024 -7.984 758 HZ3 LYS 98 HZ3 LYS 98 14.994 -17.034 -8.202
Contact the webmaster for help, if required. Wednesday, June 5, 2024 9:30:05 AM GMT (wattos1)