NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
570025 | 2m41 | 18982 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 VAL 34 HT1 VAL 34 -19.130 -3.860 -5.671 2 H2 VAL 34 HT2 VAL 34 -19.645 -4.989 -4.528 3 H3 VAL 34 HT3 VAL 34 -18.858 -5.504 -5.933 4 HA VAL 34 HA VAL 34 -17.649 -3.861 -3.785 5 HB VAL 34 HB VAL 34 -16.169 -5.854 -3.472 6 HG11 VAL 34 HG11 VAL 34 -17.848 -7.187 -2.211 7 HG12 VAL 34 HG12 VAL 34 -19.090 -6.108 -2.848 8 HG13 VAL 34 HG13 VAL 34 -17.802 -5.470 -1.823 9 HG21 VAL 34 HG21 VAL 34 -16.596 -6.976 -5.584 10 HG22 VAL 34 HG22 VAL 34 -18.275 -7.243 -5.118 11 HG23 VAL 34 HG23 VAL 34 -16.976 -8.037 -4.227 12 H PHE 35 HN PHE 35 -15.223 -4.053 -3.978 13 HA PHE 35 HA PHE 35 -14.370 -4.033 -6.789 14 HB2 PHE 35 HB2 PHE 35 -13.729 -2.195 -4.528 15 HB3 PHE 35 HB1 PHE 35 -12.462 -2.536 -5.705 16 HD1 PHE 35 HD2 PHE 35 -16.096 -1.706 -5.705 17 HD2 PHE 35 HD1 PHE 35 -12.268 -1.072 -7.432 18 HE1 PHE 35 HE2 PHE 35 -17.070 -0.050 -7.237 19 HE2 PHE 35 HE1 PHE 35 -13.230 0.585 -8.972 20 HZ PHE 35 HZ PHE 35 -15.635 1.095 -8.880 21 HA PRO 36 HA PRO 36 -11.645 -7.413 -5.724 22 HB2 PRO 36 HB2 PRO 36 -9.826 -6.010 -7.622 23 HB3 PRO 36 HB1 PRO 36 -10.335 -7.702 -7.599 24 HG2 PRO 36 HG2 PRO 36 -11.336 -5.989 -9.382 25 HG3 PRO 36 HG1 PRO 36 -12.339 -7.255 -8.654 26 HD2 PRO 36 HD2 PRO 36 -12.284 -4.329 -8.102 27 HD3 PRO 36 HD1 PRO 36 -13.649 -5.463 -8.060 28 H TRP 37 HN TRP 37 -10.289 -7.511 -4.023 29 HA TRP 37 HA TRP 37 -9.905 -5.312 -2.491 30 HB2 TRP 37 HB2 TRP 37 -8.288 -6.702 -1.157 31 HB3 TRP 37 HB1 TRP 37 -9.876 -7.399 -1.441 32 HD1 TRP 37 HD1 TRP 37 -9.958 -9.357 -3.415 33 HE1 TRP 37 HE1 TRP 37 -8.188 -11.127 -3.999 34 HE3 TRP 37 HE3 TRP 37 -5.909 -7.186 -1.197 35 HZ2 TRP 37 HZ2 TRP 37 -5.439 -11.551 -3.539 36 HZ3 TRP 37 HZ3 TRP 37 -3.748 -8.350 -1.307 37 HH2 TRP 37 HH2 TRP 37 -3.520 -10.484 -2.462 38 H HIS 38 HN HIS 38 -7.635 -6.483 -4.935 39 HA HIS 38 HA HIS 38 -5.538 -4.733 -4.157 40 HB2 HIS 38 HB2 HIS 38 -4.588 -5.156 -6.379 41 HB3 HIS 38 HB1 HIS 38 -5.089 -6.647 -5.603 42 HD1 HIS 38 HD1 HIS 38 -5.514 -4.668 -8.661 43 HD2 HIS 38 HD2 HIS 38 -7.499 -7.777 -6.751 44 HE1 HIS 38 HE1 HIS 38 -7.012 -5.687 -10.405 45 HE2 HIS 38 HE2 HIS 38 -8.079 -7.668 -9.267 46 H SER 39 HN SER 39 -7.070 -2.928 -3.707 47 HA SER 39 HA SER 39 -7.477 -1.284 -6.120 48 HB2 SER 39 HB2 SER 39 -9.620 -2.071 -5.251 49 HB3 SER 39 HB1 SER 39 -9.211 -1.493 -3.641 50 HG SER 39 HG SER 39 -9.229 0.636 -4.489 51 H LEU 40 HN LEU 40 -5.998 -1.573 -3.104 52 HA LEU 40 HA LEU 40 -5.380 1.309 -2.970 53 HB2 LEU 40 HB2 LEU 40 -5.533 0.485 -0.323 54 HB3 LEU 40 HB1 LEU 40 -6.675 1.509 -1.176 55 HG LEU 40 HG LEU 40 -7.044 -1.432 -1.436 56 HD11 LEU 40 HD11 LEU 40 -7.653 0.139 1.048 57 HD12 LEU 40 HD12 LEU 40 -6.682 -1.325 0.901 58 HD13 LEU 40 HD13 LEU 40 -8.426 -1.393 0.637 59 HD21 LEU 40 HD21 LEU 40 -9.393 -0.792 -1.438 60 HD22 LEU 40 HD22 LEU 40 -8.496 0.148 -2.632 61 HD23 LEU 40 HD23 LEU 40 -8.950 0.878 -1.093 62 H VAL 41 HN VAL 41 -4.217 -1.778 -3.176 63 HA VAL 41 HA VAL 41 -1.908 -1.317 -1.478 64 HB VAL 41 HB VAL 41 -2.837 -3.511 -1.241 65 HG11 VAL 41 HG11 VAL 41 -4.063 -3.683 -3.333 66 HG12 VAL 41 HG12 VAL 41 -3.034 -5.096 -3.102 67 HG13 VAL 41 HG13 VAL 41 -2.550 -3.828 -4.227 68 HG21 VAL 41 HG21 VAL 41 -0.941 -4.926 -1.880 69 HG22 VAL 41 HG22 VAL 41 -0.427 -3.392 -1.171 70 HG23 VAL 41 HG23 VAL 41 -0.348 -3.626 -2.916 71 HA PRO 42 HA PRO 42 0.093 0.007 -5.272 72 HB2 PRO 42 HB2 PRO 42 1.948 1.548 -4.138 73 HB3 PRO 42 HB1 PRO 42 0.251 2.043 -4.156 74 HG2 PRO 42 HG2 PRO 42 1.866 0.895 -1.931 75 HG3 PRO 42 HG1 PRO 42 0.602 2.136 -1.879 76 HD2 PRO 42 HD2 PRO 42 0.269 -0.584 -1.281 77 HD3 PRO 42 HD1 PRO 42 -1.030 0.581 -1.601 78 H PHE 43 HN PHE 43 2.366 -0.078 -6.046 79 HA PHE 43 HA PHE 43 3.798 -2.334 -4.806 80 HB2 PHE 43 HB2 PHE 43 4.117 -1.586 -7.698 81 HB3 PHE 43 HB1 PHE 43 4.393 -3.139 -6.923 82 HD1 PHE 43 HD1 PHE 43 2.020 -3.919 -5.647 83 HD2 PHE 43 HD2 PHE 43 2.432 -1.647 -9.227 84 HE1 PHE 43 HE1 PHE 43 -0.217 -4.646 -6.368 85 HE2 PHE 43 HE2 PHE 43 0.200 -2.377 -9.951 86 HZ PHE 43 HZ PHE 43 -1.129 -3.875 -8.521 87 H LEU 44 HN LEU 44 5.929 -2.017 -4.330 88 HA LEU 44 HA LEU 44 6.881 0.693 -4.482 89 HB2 LEU 44 HB2 LEU 44 8.660 0.036 -3.031 90 HB3 LEU 44 HB1 LEU 44 7.173 -0.641 -2.425 91 HG LEU 44 HG LEU 44 8.597 -2.356 -2.009 92 HD11 LEU 44 HD11 LEU 44 8.336 -4.170 -3.509 93 HD12 LEU 44 HD12 LEU 44 8.008 -3.074 -4.856 94 HD13 LEU 44 HD13 LEU 44 6.858 -3.208 -3.527 95 HD21 LEU 44 HD21 LEU 44 10.538 -2.995 -3.374 96 HD22 LEU 44 HD22 LEU 44 10.602 -1.320 -2.823 97 HD23 LEU 44 HD23 LEU 44 10.158 -1.683 -4.490 98 H ALA 45 HN ALA 45 6.533 -0.187 -6.976 99 HA ALA 45 HA ALA 45 7.451 -0.451 -9.029 100 HB1 ALA 45 HB1 ALA 45 10.120 -0.133 -7.648 101 HB2 ALA 45 HB2 ALA 45 9.154 1.173 -8.332 102 HB3 ALA 45 HB3 ALA 45 9.836 -0.064 -9.387 103 HA PRO 46 HA PRO 46 8.185 -4.793 -9.552 104 HB2 PRO 46 HB2 PRO 46 10.321 -4.695 -11.378 105 HB3 PRO 46 HB1 PRO 46 8.605 -4.780 -11.777 106 HG2 PRO 46 HG2 PRO 46 10.415 -2.420 -11.677 107 HG3 PRO 46 HG1 PRO 46 9.050 -2.748 -12.761 108 HD2 PRO 46 HD2 PRO 46 8.832 -0.999 -10.755 109 HD3 PRO 46 HD1 PRO 46 7.482 -2.064 -11.190 110 H SER 47 HN SER 47 8.996 -5.485 -7.651 111 HA SER 47 HA SER 47 11.574 -4.821 -6.677 112 HB2 SER 47 HB2 SER 47 11.019 -6.725 -5.035 113 HB3 SER 47 HB1 SER 47 9.953 -5.320 -5.041 114 HG SER 47 HG SER 47 9.263 -7.820 -5.373 115 H GLN 48 HN GLN 48 13.225 -6.458 -6.145 116 HA GLN 48 HA GLN 48 13.636 -8.188 -8.437 117 HB2 GLN 48 HB2 GLN 48 16.049 -8.193 -7.593 118 HB3 GLN 48 HB1 GLN 48 15.434 -6.701 -8.285 119 HG2 GLN 48 HG2 GLN 48 14.970 -5.921 -5.948 120 HG3 GLN 48 HG1 GLN 48 15.842 -7.344 -5.378 121 HE21 GLN 48 HE21 GLN 48 16.435 -4.494 -5.070 122 HE22 GLN 48 HE22 GLN 48 18.015 -4.262 -5.731 123 H ALA 567 HT1 ALA 567 -22.509 16.595 -8.994 124 HA ALA 567 HA ALA 567 -20.091 15.590 -7.621 125 HB1 ALA 567 HB1 ALA 567 -21.273 16.077 -5.551 126 HB2 ALA 567 HB2 ALA 567 -22.626 16.745 -6.464 127 HB3 ALA 567 HB3 ALA 567 -21.055 17.545 -6.503 128 HA PRO 568 HA PRO 568 -22.461 11.812 -7.873 129 HB2 PRO 568 HB2 PRO 568 -20.614 10.185 -6.798 130 HB3 PRO 568 HB1 PRO 568 -20.420 10.874 -8.411 131 HG2 PRO 568 HG2 PRO 568 -19.083 11.606 -5.867 132 HG3 PRO 568 HG1 PRO 568 -18.472 11.697 -7.525 133 HD2 PRO 568 HD2 PRO 568 -19.517 13.818 -5.986 134 HD3 PRO 568 HD1 PRO 568 -19.141 13.850 -7.717 135 HA PRO 569 HA PRO 569 -24.456 11.049 -3.974 136 HB2 PRO 569 HB2 PRO 569 -23.956 8.298 -3.662 137 HB3 PRO 569 HB1 PRO 569 -25.362 9.024 -4.444 138 HG2 PRO 569 HG2 PRO 569 -22.897 7.886 -5.654 139 HG3 PRO 569 HG1 PRO 569 -24.554 7.908 -6.281 140 HD2 PRO 569 HD2 PRO 569 -22.645 9.530 -7.256 141 HD3 PRO 569 HD1 PRO 569 -24.335 10.056 -7.128 142 H THR 570 HN THR 570 -21.633 8.897 -4.128 143 HA THR 570 HA THR 570 -20.508 10.330 -1.827 144 HB THR 570 HB THR 570 -19.348 8.145 -1.242 145 HG1 THR 570 HG1 THR 570 -20.105 7.226 -3.402 146 HG21 THR 570 HG21 THR 570 -21.287 7.241 -0.028 147 HG22 THR 570 HG22 THR 570 -22.357 8.245 -1.005 148 HG23 THR 570 HG23 THR 570 -21.199 8.999 0.092 149 H LEU 571 HN LEU 571 -17.989 9.532 -1.779 150 HA LEU 571 HA LEU 571 -16.791 10.598 -4.062 151 HB2 LEU 571 HB2 LEU 571 -14.747 9.415 -2.911 152 HB3 LEU 571 HB1 LEU 571 -15.467 10.854 -2.228 153 HG LEU 571 HG LEU 571 -16.749 9.453 -0.669 154 HD11 LEU 571 HD11 LEU 571 -16.840 7.498 -2.200 155 HD12 LEU 571 HD12 LEU 571 -16.431 7.101 -0.528 156 HD13 LEU 571 HD13 LEU 571 -15.170 7.143 -1.759 157 HD21 LEU 571 HD21 LEU 571 -13.791 8.889 -0.663 158 HD22 LEU 571 HD22 LEU 571 -14.876 8.727 0.714 159 HD23 LEU 571 HD23 LEU 571 -14.577 10.315 0.009 160 HA PRO 572 HA PRO 572 -16.000 7.295 -6.959 161 HB2 PRO 572 HB2 PRO 572 -13.123 7.269 -6.193 162 HB3 PRO 572 HB1 PRO 572 -13.866 7.383 -7.787 163 HG2 PRO 572 HG2 PRO 572 -12.799 9.521 -6.589 164 HG3 PRO 572 HG1 PRO 572 -14.238 9.638 -7.617 165 HD2 PRO 572 HD2 PRO 572 -14.004 9.802 -4.667 166 HD3 PRO 572 HD1 PRO 572 -15.191 10.541 -5.755 167 HA PRO 573 HA PRO 573 -16.191 3.728 -4.398 168 HB2 PRO 573 HB2 PRO 573 -16.535 1.850 -6.261 169 HB3 PRO 573 HB1 PRO 573 -17.756 3.093 -5.962 170 HG2 PRO 573 HG2 PRO 573 -15.666 2.975 -8.103 171 HG3 PRO 573 HG1 PRO 573 -17.376 3.393 -8.233 172 HD2 PRO 573 HD2 PRO 573 -15.397 5.251 -8.105 173 HD3 PRO 573 HD1 PRO 573 -17.044 5.539 -7.521 174 H TYR 574 HN TYR 574 -13.566 4.197 -6.529 175 HA TYR 574 HA TYR 574 -12.260 1.690 -5.796 176 HB2 TYR 574 HB2 TYR 574 -12.120 2.571 -8.090 177 HB3 TYR 574 HB1 TYR 574 -11.261 3.964 -7.479 178 HD1 TYR 574 HD2 TYR 574 -11.047 0.340 -8.080 179 HD2 TYR 574 HD1 TYR 574 -8.916 3.875 -7.068 180 HE1 TYR 574 HE2 TYR 574 -8.925 -0.837 -8.467 181 HE2 TYR 574 HE1 TYR 574 -6.786 2.712 -7.459 182 HH TYR 574 HH TYR 574 -6.575 -0.233 -9.069 183 H PHE 575 HN PHE 575 -11.653 1.750 -3.727 184 HA PHE 575 HA PHE 575 -10.229 1.957 -2.034 185 HB2 PHE 575 HB2 PHE 575 -8.085 2.193 -2.554 186 HB3 PHE 575 HB1 PHE 575 -8.655 2.380 -4.201 187 HD1 PHE 575 HD2 PHE 575 -7.271 4.061 -1.271 188 HD2 PHE 575 HD1 PHE 575 -8.536 4.520 -5.302 189 HE1 PHE 575 HE2 PHE 575 -6.103 6.219 -1.389 190 HE2 PHE 575 HE1 PHE 575 -7.358 6.670 -5.433 191 HZ PHE 575 HZ PHE 575 -6.151 7.525 -3.472 192 H MET 576 HN MET 576 -11.570 4.838 -3.312 193 HA MET 576 HA MET 576 -10.837 6.644 -1.294 194 HB2 MET 576 HB2 MET 576 -13.533 6.550 -2.641 195 HB3 MET 576 HB1 MET 576 -12.715 7.956 -1.974 196 HG2 MET 576 HG2 MET 576 -11.841 6.383 -4.382 197 HG3 MET 576 HG1 MET 576 -12.664 7.937 -4.400 198 HE1 MET 576 HE1 MET 576 -9.927 7.194 -5.901 199 HE2 MET 576 HE2 MET 576 -8.986 8.659 -5.628 200 HE3 MET 576 HE3 MET 576 -10.694 8.777 -6.049 201 H LYS 577 HN LYS 577 -12.195 7.412 0.498 202 HA LYS 577 HA LYS 577 -12.595 5.374 2.344 203 HB2 LYS 577 HB2 LYS 577 -12.168 7.730 2.943 204 HB3 LYS 577 HB1 LYS 577 -13.798 8.143 2.414 205 HG2 LYS 577 HG2 LYS 577 -14.669 6.544 4.124 206 HG3 LYS 577 HG1 LYS 577 -13.019 6.377 4.723 207 HD2 LYS 577 HD2 LYS 577 -12.957 8.811 5.127 208 HD3 LYS 577 HD1 LYS 577 -14.640 8.916 4.605 209 HE2 LYS 577 HE2 LYS 577 -15.298 7.418 6.417 210 HE3 LYS 577 HE1 LYS 577 -13.616 7.295 6.933 211 HZ1 LYS 577 HZ1 LYS 577 -15.230 9.784 6.894 212 HZ2 LYS 577 HZ2 LYS 577 -13.623 9.663 7.400 213 HZ3 LYS 577 HZ3 LYS 577 -14.845 8.883 8.269 214 H GLY 578 HN GLY 578 -14.167 3.962 2.656 215 HA2 GLY 578 HA2 GLY 578 -16.465 3.623 3.277 216 HA3 GLY 578 HA1 GLY 578 -16.921 4.802 2.067 217 H SER 579 HN SER 579 -14.769 3.346 0.329 218 HA SER 579 HA SER 579 -16.515 1.730 -1.137 219 HB2 SER 579 HB2 SER 579 -14.476 2.561 -2.146 220 HB3 SER 579 HB1 SER 579 -13.494 1.662 -0.994 221 HG SER 579 HG SER 579 -14.470 0.857 -3.337 222 H ILE 580 HN ILE 580 -17.019 -0.382 -1.094 223 HA ILE 580 HA ILE 580 -16.157 -1.890 1.249 224 HB ILE 580 HB ILE 580 -18.336 -2.425 -0.769 225 HG12 ILE 580 HG12 ILE 580 -18.898 -0.713 0.861 226 HG13 ILE 580 HG11 ILE 580 -19.808 -2.178 1.214 227 HG21 ILE 580 HG21 ILE 580 -17.510 -4.126 1.579 228 HG22 ILE 580 HG22 ILE 580 -17.309 -4.536 -0.125 229 HG23 ILE 580 HG23 ILE 580 -18.928 -4.387 0.562 230 HD11 ILE 580 HD11 ILE 580 -18.143 -2.725 2.966 231 HD12 ILE 580 HD12 ILE 580 -19.021 -1.225 3.265 232 HD13 ILE 580 HD13 ILE 580 -17.365 -1.172 2.659 233 H ILE 581 HN ILE 581 -14.284 -2.766 0.959 234 HA ILE 581 HA ILE 581 -13.418 -3.655 -1.665 235 HB ILE 581 HB ILE 581 -11.876 -3.670 0.931 236 HG12 ILE 581 HG12 ILE 581 -12.734 -1.399 0.406 237 HG13 ILE 581 HG11 ILE 581 -10.986 -1.494 0.344 238 HG21 ILE 581 HG21 ILE 581 -10.893 -5.017 -0.797 239 HG22 ILE 581 HG22 ILE 581 -9.928 -3.559 -0.556 240 HG23 ILE 581 HG23 ILE 581 -11.012 -3.680 -1.942 241 HD11 ILE 581 HD11 ILE 581 -11.765 -0.146 -1.456 242 HD12 ILE 581 HD12 ILE 581 -12.871 -1.411 -1.994 243 HD13 ILE 581 HD13 ILE 581 -11.126 -1.652 -2.111 244 H GLN 582 HN GLN 582 -13.402 -5.747 -2.269 245 HA GLN 582 HA GLN 582 -14.154 -7.728 -0.240 246 HB2 GLN 582 HB2 GLN 582 -15.669 -7.661 -2.076 247 HB3 GLN 582 HB1 GLN 582 -14.387 -7.779 -3.242 248 HG2 GLN 582 HG2 GLN 582 -13.852 -10.043 -2.139 249 HG3 GLN 582 HG1 GLN 582 -15.453 -9.903 -1.419 250 HE21 GLN 582 HE21 GLN 582 -16.298 -11.643 -2.513 251 HE22 GLN 582 HE22 GLN 582 -16.597 -11.627 -4.215 252 H LEU 583 HN LEU 583 -12.721 -9.052 0.490 253 HA LEU 583 HA LEU 583 -10.082 -9.167 -0.653 254 HB2 LEU 583 HB2 LEU 583 -11.250 -10.690 1.664 255 HB3 LEU 583 HB1 LEU 583 -9.547 -10.516 1.282 256 HG LEU 583 HG LEU 583 -11.402 -8.300 2.135 257 HD11 LEU 583 HD11 LEU 583 -10.210 -8.328 4.197 258 HD12 LEU 583 HD12 LEU 583 -9.059 -9.515 3.580 259 HD13 LEU 583 HD13 LEU 583 -10.741 -9.981 3.867 260 HD21 LEU 583 HD21 LEU 583 -8.439 -8.259 1.547 261 HD22 LEU 583 HD22 LEU 583 -9.393 -6.912 2.168 262 HD23 LEU 583 HD23 LEU 583 -9.697 -7.534 0.543 263 H ALA 584 HN ALA 584 -9.010 -11.409 -0.728 264 HA ALA 584 HA ALA 584 -10.311 -12.841 -2.793 265 HB1 ALA 584 HB1 ALA 584 -7.908 -13.710 -1.196 266 HB2 ALA 584 HB2 ALA 584 -7.856 -12.656 -2.610 267 HB3 ALA 584 HB3 ALA 584 -8.407 -14.323 -2.772 268 H ASN 585 HN ASN 585 -10.218 -13.166 0.649 269 HA ASN 585 HA ASN 585 -11.209 -15.878 0.646 270 HB2 ASN 585 HB2 ASN 585 -11.217 -15.694 3.052 271 HB3 ASN 585 HB1 ASN 585 -9.711 -15.030 2.445 272 HD21 ASN 585 HD21 ASN 585 -10.871 -14.544 4.980 273 HD22 ASN 585 HD22 ASN 585 -11.205 -12.846 5.080 274 H GLY 586 HN GLY 586 -12.548 -12.901 0.035 275 HA2 GLY 586 HA2 GLY 586 -14.797 -12.825 -0.730 276 HA3 GLY 586 HA1 GLY 586 -15.215 -14.044 0.460 277 H GLU 587 HN GLU 587 -13.287 -11.897 2.069 278 HA GLU 587 HA GLU 587 -15.479 -10.916 3.552 279 HB2 GLU 587 HB2 GLU 587 -12.584 -10.219 3.606 280 HB3 GLU 587 HB1 GLU 587 -13.753 -9.471 4.682 281 HG2 GLU 587 HG2 GLU 587 -14.400 -11.865 5.274 282 HG3 GLU 587 HG1 GLU 587 -12.854 -12.301 4.538 283 H LEU 588 HN LEU 588 -16.269 -8.942 3.844 284 HA LEU 588 HA LEU 588 -15.780 -7.010 1.669 285 HB2 LEU 588 HB2 LEU 588 -18.396 -7.547 3.070 286 HB3 LEU 588 HB1 LEU 588 -18.137 -6.505 1.681 287 HG LEU 588 HG LEU 588 -17.788 -9.502 1.700 288 HD11 LEU 588 HD11 LEU 588 -19.955 -7.780 0.503 289 HD12 LEU 588 HD12 LEU 588 -20.123 -8.853 1.894 290 HD13 LEU 588 HD13 LEU 588 -19.788 -9.524 0.298 291 HD21 LEU 588 HD21 LEU 588 -17.487 -7.424 -0.448 292 HD22 LEU 588 HD22 LEU 588 -17.686 -9.140 -0.793 293 HD23 LEU 588 HD23 LEU 588 -16.282 -8.577 0.119 294 H LYS 589 HN LYS 589 -14.541 -5.532 2.700 295 HA LYS 589 HA LYS 589 -15.499 -4.520 5.290 296 HB2 LYS 589 HB2 LYS 589 -12.609 -5.072 4.584 297 HB3 LYS 589 HB1 LYS 589 -13.235 -4.543 6.134 298 HG2 LYS 589 HG2 LYS 589 -14.328 -6.632 6.493 299 HG3 LYS 589 HG1 LYS 589 -13.960 -7.160 4.854 300 HD2 LYS 589 HD2 LYS 589 -12.404 -8.280 6.200 301 HD3 LYS 589 HD1 LYS 589 -11.505 -6.927 5.518 302 HE2 LYS 589 HE2 LYS 589 -12.846 -6.610 8.161 303 HE3 LYS 589 HE1 LYS 589 -11.334 -7.508 8.063 304 HZ1 LYS 589 HZ1 LYS 589 -11.641 -4.774 6.979 305 HZ2 LYS 589 HZ2 LYS 589 -10.204 -5.630 7.267 306 HZ3 LYS 589 HZ3 LYS 589 -11.145 -5.074 8.566 307 H LYS 590 HN LYS 590 -15.090 -2.364 5.715 308 HA LYS 590 HA LYS 590 -14.960 -0.581 3.549 309 HB2 LYS 590 HB2 LYS 590 -14.639 -0.244 6.519 310 HB3 LYS 590 HB1 LYS 590 -14.453 1.114 5.424 311 HG2 LYS 590 HG2 LYS 590 -16.912 -0.558 5.291 312 HG3 LYS 590 HG1 LYS 590 -16.733 0.646 6.570 313 HD2 LYS 590 HD2 LYS 590 -15.948 1.933 4.216 314 HD3 LYS 590 HD1 LYS 590 -17.393 1.015 3.790 315 HE2 LYS 590 HE2 LYS 590 -18.002 3.235 4.560 316 HE3 LYS 590 HE1 LYS 590 -18.573 2.013 5.692 317 HZ1 LYS 590 HZ1 LYS 590 -16.077 3.595 6.049 318 HZ2 LYS 590 HZ2 LYS 590 -16.760 2.509 7.157 319 HZ3 LYS 590 HZ3 LYS 590 -17.560 3.950 6.789 320 H VAL 591 HN VAL 591 -13.302 0.642 2.693 321 HA VAL 591 HA VAL 591 -10.773 -0.342 2.434 322 HB VAL 591 HB VAL 591 -11.210 2.629 2.576 323 HG11 VAL 591 HG11 VAL 591 -9.537 2.648 0.789 324 HG12 VAL 591 HG12 VAL 591 -9.428 0.891 0.889 325 HG13 VAL 591 HG13 VAL 591 -8.936 1.886 2.263 326 HG21 VAL 591 HG21 VAL 591 -13.057 1.727 1.288 327 HG22 VAL 591 HG22 VAL 591 -11.929 0.817 0.283 328 HG23 VAL 591 HG23 VAL 591 -11.921 2.583 0.246 329 H GLU 592 HN GLU 592 -11.903 2.000 4.773 330 HA GLU 592 HA GLU 592 -9.394 2.718 5.836 331 HB2 GLU 592 HB2 GLU 592 -10.793 3.865 7.542 332 HB3 GLU 592 HB1 GLU 592 -11.306 4.204 5.892 333 HG2 GLU 592 HG2 GLU 592 -12.914 2.184 6.293 334 HG3 GLU 592 HG1 GLU 592 -12.634 2.555 7.989 335 H ASP 593 HN ASP 593 -11.243 -0.068 6.326 336 HA ASP 593 HA ASP 593 -10.221 -0.411 9.068 337 HB2 ASP 593 HB2 ASP 593 -12.632 -0.455 9.054 338 HB3 ASP 593 HB1 ASP 593 -12.660 -1.571 7.695 339 H LEU 594 HN LEU 594 -9.861 -1.472 5.910 340 HA LEU 594 HA LEU 594 -9.309 -4.186 6.203 341 HB2 LEU 594 HB2 LEU 594 -8.033 -2.179 4.352 342 HB3 LEU 594 HB1 LEU 594 -7.927 -3.922 4.182 343 HG LEU 594 HG LEU 594 -10.587 -2.522 4.192 344 HD11 LEU 594 HD11 LEU 594 -8.834 -3.079 1.816 345 HD12 LEU 594 HD12 LEU 594 -9.183 -1.484 2.487 346 HD13 LEU 594 HD13 LEU 594 -10.479 -2.454 1.784 347 HD21 LEU 594 HD21 LEU 594 -11.293 -4.480 2.947 348 HD22 LEU 594 HD22 LEU 594 -10.539 -4.970 4.468 349 HD23 LEU 594 HD23 LEU 594 -9.643 -5.101 2.955 350 H LYS 595 HN LYS 595 -7.888 -5.153 7.407 351 HA LYS 595 HA LYS 595 -5.598 -3.704 8.449 352 HB2 LYS 595 HB2 LYS 595 -6.443 -6.563 8.947 353 HB3 LYS 595 HB1 LYS 595 -5.226 -5.669 9.843 354 HG2 LYS 595 HG2 LYS 595 -8.174 -5.065 9.773 355 HG3 LYS 595 HG1 LYS 595 -7.299 -5.831 11.098 356 HD2 LYS 595 HD2 LYS 595 -5.934 -3.783 11.329 357 HD3 LYS 595 HD1 LYS 595 -6.902 -3.030 10.062 358 HE2 LYS 595 HE2 LYS 595 -7.887 -3.999 12.738 359 HE3 LYS 595 HE1 LYS 595 -7.693 -2.322 12.236 360 HZ1 LYS 595 HZ1 LYS 595 -9.637 -4.301 11.196 361 HZ2 LYS 595 HZ2 LYS 595 -9.345 -2.817 10.445 362 HZ3 LYS 595 HZ3 LYS 595 -9.970 -2.860 12.016 363 H THR 596 HN THR 596 -3.421 -4.621 8.244 364 HA THR 596 HA THR 596 -2.774 -5.278 5.603 365 HB THR 596 HB THR 596 -1.133 -4.299 7.112 366 HG1 THR 596 HG1 THR 596 0.313 -6.507 6.734 367 HG21 THR 596 HG21 THR 596 -0.039 -5.666 8.836 368 HG22 THR 596 HG22 THR 596 -1.181 -6.972 8.512 369 HG23 THR 596 HG23 THR 596 -1.756 -5.442 9.178 370 H GLU 597 HN GLU 597 -3.417 -7.271 8.400 371 HA GLU 597 HA GLU 597 -2.637 -9.761 7.415 372 HB2 GLU 597 HB2 GLU 597 -4.856 -9.116 9.345 373 HB3 GLU 597 HB1 GLU 597 -4.113 -10.694 9.132 374 HG2 GLU 597 HG2 GLU 597 -1.965 -9.766 9.872 375 HG3 GLU 597 HG1 GLU 597 -2.739 -8.202 10.119 376 H ASP 598 HN ASP 598 -5.434 -7.822 6.780 377 HA ASP 598 HA ASP 598 -7.124 -9.834 5.736 378 HB2 ASP 598 HB2 ASP 598 -7.015 -6.864 5.194 379 HB3 ASP 598 HB1 ASP 598 -8.271 -7.921 4.571 380 H PHE 599 HN PHE 599 -4.817 -7.606 4.211 381 HA PHE 599 HA PHE 599 -5.252 -8.691 1.604 382 HB2 PHE 599 HB2 PHE 599 -3.174 -6.805 2.706 383 HB3 PHE 599 HB1 PHE 599 -3.043 -7.461 1.082 384 HD1 PHE 599 HD1 PHE 599 -6.149 -6.463 2.850 385 HD2 PHE 599 HD2 PHE 599 -3.377 -5.597 -0.257 386 HE1 PHE 599 HE1 PHE 599 -7.682 -4.758 1.966 387 HE2 PHE 599 HE2 PHE 599 -4.906 -3.885 -1.146 388 HZ PHE 599 HZ PHE 599 -7.062 -3.466 -0.036 389 H ILE 600 HN ILE 600 -2.843 -9.169 4.160 390 HA ILE 600 HA ILE 600 -1.092 -10.867 2.892 391 HB ILE 600 HB ILE 600 -2.189 -10.970 5.691 392 HG12 ILE 600 HG12 ILE 600 0.439 -9.973 4.580 393 HG13 ILE 600 HG11 ILE 600 -0.919 -8.964 5.048 394 HG21 ILE 600 HG21 ILE 600 -0.128 -12.339 6.181 395 HG22 ILE 600 HG22 ILE 600 0.020 -12.587 4.439 396 HG23 ILE 600 HG23 ILE 600 -1.412 -13.167 5.298 397 HD11 ILE 600 HD11 ILE 600 0.822 -9.001 6.748 398 HD12 ILE 600 HD12 ILE 600 0.633 -10.748 6.900 399 HD13 ILE 600 HD13 ILE 600 -0.692 -9.675 7.344 400 H GLN 601 HN GLN 601 -3.986 -11.872 4.698 401 HA GLN 601 HA GLN 601 -3.912 -14.559 4.039 402 HB2 GLN 601 HB2 GLN 601 -6.284 -12.776 4.600 403 HB3 GLN 601 HB1 GLN 601 -6.382 -14.529 4.495 404 HG2 GLN 601 HG2 GLN 601 -4.880 -14.756 6.359 405 HG3 GLN 601 HG1 GLN 601 -4.675 -13.008 6.448 406 HE21 GLN 601 HE21 GLN 601 -6.376 -11.736 7.199 407 HE22 GLN 601 HE22 GLN 601 -7.683 -12.402 8.114 408 H SER 602 HN SER 602 -5.619 -11.921 2.386 409 HA SER 602 HA SER 602 -6.922 -13.485 0.493 410 HB2 SER 602 HB2 SER 602 -5.934 -10.645 0.200 411 HB3 SER 602 HB1 SER 602 -7.169 -11.419 -0.801 412 HG SER 602 HG SER 602 -7.286 -10.617 1.894 413 H ALA 603 HN ALA 603 -3.671 -12.102 0.411 414 HA ALA 603 HA ALA 603 -3.182 -12.895 -2.301 415 HB1 ALA 603 HB1 ALA 603 -1.235 -12.098 -0.147 416 HB2 ALA 603 HB2 ALA 603 -2.021 -10.995 -1.274 417 HB3 ALA 603 HB3 ALA 603 -0.887 -12.207 -1.872 418 H GLU 604 HN GLU 604 -2.655 -14.283 0.865 419 HA GLU 604 HA GLU 604 -0.823 -16.287 -0.019 420 HB2 GLU 604 HB2 GLU 604 -2.383 -15.997 2.543 421 HB3 GLU 604 HB1 GLU 604 -1.148 -17.223 2.261 422 HG2 GLU 604 HG2 GLU 604 0.422 -15.297 1.754 423 HG3 GLU 604 HG1 GLU 604 -0.825 -14.246 2.421 424 H ILE 605 HN ILE 605 -4.253 -16.188 0.717 425 HA ILE 605 HA ILE 605 -4.841 -18.918 0.343 426 HB ILE 605 HB ILE 605 -6.624 -16.512 -0.111 427 HG12 ILE 605 HG12 ILE 605 -6.346 -18.225 2.363 428 HG13 ILE 605 HG11 ILE 605 -5.524 -16.687 2.145 429 HG21 ILE 605 HG21 ILE 605 -7.361 -19.384 0.445 430 HG22 ILE 605 HG22 ILE 605 -7.539 -18.553 -1.100 431 HG23 ILE 605 HG23 ILE 605 -8.486 -18.033 0.294 432 HD11 ILE 605 HD11 ILE 605 -7.757 -15.616 1.879 433 HD12 ILE 605 HD12 ILE 605 -7.449 -16.306 3.476 434 HD13 ILE 605 HD13 ILE 605 -8.487 -17.160 2.326 435 H SER 606 HN SER 606 -4.180 -16.352 -1.839 436 HA SER 606 HA SER 606 -5.207 -17.819 -4.148 437 HB2 SER 606 HB2 SER 606 -4.010 -15.046 -3.986 438 HB3 SER 606 HB1 SER 606 -4.852 -15.746 -5.368 439 HG SER 606 HG SER 606 -5.860 -14.728 -2.981 440 H ASN 607 HN ASN 607 -3.803 -18.050 -6.044 441 HA ASN 607 HA ASN 607 -0.993 -18.429 -5.247 442 HB2 ASN 607 HB2 ASN 607 -2.689 -20.018 -7.175 443 HB3 ASN 607 HB1 ASN 607 -0.943 -20.201 -7.040 444 HD21 ASN 607 HD21 ASN 607 -0.068 -21.127 -5.196 445 HD22 ASN 607 HD22 ASN 607 -1.028 -22.029 -4.077 446 H ASP 608 HN ASP 608 -3.101 -16.808 -7.354 447 HA ASP 608 HA ASP 608 -0.985 -16.147 -9.265 448 HB2 ASP 608 HB2 ASP 608 -3.850 -15.160 -9.139 449 HB3 ASP 608 HB1 ASP 608 -2.715 -14.872 -10.451 450 H LEU 609 HN LEU 609 -1.823 -15.265 -6.274 451 HA LEU 609 HA LEU 609 -0.944 -12.476 -6.625 452 HB2 LEU 609 HB2 LEU 609 -2.948 -13.362 -4.554 453 HB3 LEU 609 HB1 LEU 609 -2.553 -11.726 -5.043 454 HG LEU 609 HG LEU 609 -3.931 -13.729 -6.836 455 HD11 LEU 609 HD11 LEU 609 -5.978 -12.580 -6.413 456 HD12 LEU 609 HD12 LEU 609 -5.164 -11.401 -5.389 457 HD13 LEU 609 HD13 LEU 609 -5.301 -13.082 -4.863 458 HD21 LEU 609 HD21 LEU 609 -2.682 -12.016 -8.018 459 HD22 LEU 609 HD22 LEU 609 -3.502 -10.765 -7.085 460 HD23 LEU 609 HD23 LEU 609 -4.420 -11.773 -8.203 461 H LYS 610 HN LYS 610 0.344 -11.671 -4.864 462 HA LYS 610 HA LYS 610 0.939 -13.404 -2.638 463 HB2 LYS 610 HB2 LYS 610 3.353 -13.626 -3.146 464 HB3 LYS 610 HB1 LYS 610 2.329 -14.483 -4.288 465 HG2 LYS 610 HG2 LYS 610 2.618 -12.741 -5.920 466 HG3 LYS 610 HG1 LYS 610 3.554 -11.780 -4.774 467 HD2 LYS 610 HD2 LYS 610 5.269 -13.510 -4.709 468 HD3 LYS 610 HD1 LYS 610 4.321 -14.505 -5.818 469 HE2 LYS 610 HE2 LYS 610 4.505 -12.779 -7.533 470 HE3 LYS 610 HE1 LYS 610 5.437 -11.771 -6.425 471 HZ1 LYS 610 HZ1 LYS 610 7.169 -13.430 -6.390 472 HZ2 LYS 610 HZ2 LYS 610 6.844 -12.989 -7.990 473 HZ3 LYS 610 HZ3 LYS 610 6.263 -14.455 -7.383 474 H ILE 611 HN ILE 611 2.064 -12.439 -0.992 475 HA ILE 611 HA ILE 611 2.298 -9.529 -1.074 476 HB ILE 611 HB ILE 611 2.640 -11.478 1.212 477 HG12 ILE 611 HG12 ILE 611 0.326 -11.111 0.041 478 HG13 ILE 611 HG11 ILE 611 0.431 -11.193 1.787 479 HG21 ILE 611 HG21 ILE 611 2.332 -8.496 1.321 480 HG22 ILE 611 HG22 ILE 611 3.849 -9.370 1.542 481 HG23 ILE 611 HG23 ILE 611 2.525 -9.587 2.691 482 HD11 ILE 611 HD11 ILE 611 0.273 -8.671 0.142 483 HD12 ILE 611 HD12 ILE 611 0.347 -8.750 1.903 484 HD13 ILE 611 HD13 ILE 611 -1.054 -9.399 1.050 485 H ASP 612 HN ASP 612 4.266 -8.472 -0.425 486 HA ASP 612 HA ASP 612 6.655 -10.178 -0.360 487 HB2 ASP 612 HB2 ASP 612 6.326 -8.823 -2.547 488 HB3 ASP 612 HB1 ASP 612 6.754 -7.417 -1.567 489 H SER 613 HN SER 613 8.407 -9.360 0.858 490 HA SER 613 HA SER 613 7.590 -7.372 2.854 491 HB2 SER 613 HB2 SER 613 9.398 -8.498 4.276 492 HB3 SER 613 HB1 SER 613 7.928 -9.426 3.984 493 HG SER 613 HG SER 613 10.462 -10.040 3.353 494 H SER 614 HN SER 614 8.350 -5.490 2.104 495 HA SER 614 HA SER 614 11.234 -5.344 1.511 496 HB2 SER 614 HB2 SER 614 9.033 -3.609 0.357 497 HB3 SER 614 HB1 SER 614 10.747 -3.522 -0.040 498 HG SER 614 HG SER 614 9.682 -6.033 -0.354 499 H THR 615 HN THR 615 12.130 -4.544 3.333 500 HA THR 615 HA THR 615 10.699 -2.730 5.061 501 HB THR 615 HB THR 615 13.586 -3.610 5.217 502 HG1 THR 615 HG1 THR 615 12.521 -4.964 6.973 503 HG21 THR 615 HG21 THR 615 13.148 -1.601 6.524 504 HG22 THR 615 HG22 THR 615 13.386 -2.981 7.595 505 HG23 THR 615 HG23 THR 615 11.759 -2.376 7.289 506 H VAL 616 HN VAL 616 10.480 -0.646 4.353 507 HA VAL 616 HA VAL 616 12.359 0.780 2.874 508 HB VAL 616 HB VAL 616 10.269 1.801 3.016 509 HG11 VAL 616 HG11 VAL 616 10.460 1.704 6.010 510 HG12 VAL 616 HG12 VAL 616 9.449 0.669 5.008 511 HG13 VAL 616 HG13 VAL 616 9.138 2.404 5.084 512 HG21 VAL 616 HG21 VAL 616 11.936 3.499 3.079 513 HG22 VAL 616 HG22 VAL 616 12.176 3.275 4.811 514 HG23 VAL 616 HG23 VAL 616 10.669 3.975 4.215 515 H GLU 617 HN GLU 617 14.357 1.242 3.335 516 HA GLU 617 HA GLU 617 15.224 1.346 6.116 517 HB2 GLU 617 HB2 GLU 617 16.808 1.171 3.567 518 HB3 GLU 617 HB1 GLU 617 17.516 1.238 5.173 519 HG2 GLU 617 HG2 GLU 617 15.960 -0.826 5.582 520 HG3 GLU 617 HG1 GLU 617 16.041 -0.961 3.829 521 H ARG 618 HN ARG 618 14.540 3.386 3.454 522 HA ARG 618 HA ARG 618 15.275 5.689 5.026 523 HB2 ARG 618 HB2 ARG 618 17.390 4.948 3.820 524 HB3 ARG 618 HB1 ARG 618 16.583 5.392 2.323 525 HG2 ARG 618 HG2 ARG 618 16.265 7.689 3.364 526 HG3 ARG 618 HG1 ARG 618 17.427 7.170 4.586 527 HD2 ARG 618 HD2 ARG 618 17.871 7.372 1.614 528 HD3 ARG 618 HD1 ARG 618 18.583 8.386 2.864 529 HE ARG 618 HE ARG 618 19.519 6.024 3.599 530 HH11 ARG 618 HH11 ARG 618 19.258 7.422 0.395 531 HH12 ARG 618 HH12 ARG 618 20.648 6.578 -0.221 532 HH21 ARG 618 HH21 ARG 618 21.346 4.907 2.789 533 HH22 ARG 618 HH22 ARG 618 21.830 5.139 1.137 534 H ILE 619 HN ILE 619 14.466 7.669 4.108 535 HA ILE 619 HA ILE 619 12.612 7.402 1.863 536 HB ILE 619 HB ILE 619 11.869 8.369 4.629 537 HG12 ILE 619 HG12 ILE 619 10.519 6.378 2.811 538 HG13 ILE 619 HG11 ILE 619 11.678 5.936 4.060 539 HG21 ILE 619 HG21 ILE 619 10.333 8.732 2.054 540 HG22 ILE 619 HG22 ILE 619 11.064 10.011 3.022 541 HG23 ILE 619 HG23 ILE 619 9.715 9.077 3.669 542 HD11 ILE 619 HD11 ILE 619 9.071 7.361 4.539 543 HD12 ILE 619 HD12 ILE 619 10.209 6.803 5.770 544 HD13 ILE 619 HD13 ILE 619 9.348 5.634 4.764 545 H GLU 620 HN GLU 620 13.014 9.002 0.499 546 HA GLU 620 HA GLU 620 14.160 11.484 1.595 547 HB2 GLU 620 HB2 GLU 620 14.991 10.205 -1.007 548 HB3 GLU 620 HB1 GLU 620 15.722 11.594 -0.216 549 HG2 GLU 620 HG2 GLU 620 16.421 10.151 1.639 550 HG3 GLU 620 HG1 GLU 620 15.719 8.762 0.803 551 H ASP 621 HN ASP 621 13.307 13.319 0.878 552 HA ASP 621 HA ASP 621 11.085 13.281 -0.928 553 HB2 ASP 621 HB2 ASP 621 10.927 14.915 0.742 554 HB3 ASP 621 HB1 ASP 621 12.574 15.481 0.497 555 H SER 622 HN SER 622 11.000 14.040 -3.003 556 HA SER 622 HA SER 622 13.639 13.991 -4.309 557 HB2 SER 622 HB2 SER 622 11.821 12.217 -4.808 558 HB3 SER 622 HB1 SER 622 11.034 13.498 -5.729 559 HG SER 622 HG SER 622 12.405 12.270 -7.069 560 H HIS 623 HN HIS 623 11.770 16.260 -3.225 561 HA HIS 623 HA HIS 623 11.538 18.471 -3.641 562 HB2 HIS 623 HB2 HIS 623 13.839 18.261 -4.640 563 HB3 HIS 623 HB1 HIS 623 13.073 18.061 -6.209 564 HD1 HIS 623 HD1 HIS 623 12.158 20.163 -7.352 565 HD2 HIS 623 HD2 HIS 623 13.668 20.857 -3.541 566 HE1 HIS 623 HE1 HIS 623 12.314 22.664 -7.130 567 HE2 HIS 623 HE2 HIS 623 13.354 23.051 -4.868 568 H SER 624 HN SER 624 11.024 16.417 -6.449 569 HA SER 624 HA SER 624 9.209 17.960 -7.876 570 HB2 SER 624 HB2 SER 624 9.265 14.949 -7.572 571 HB3 SER 624 HB1 SER 624 8.533 15.846 -8.900 572 HG SER 624 HG SER 624 10.998 16.719 -8.727 573 HA PRO 625 HA PRO 625 5.502 18.475 -5.606 574 HB2 PRO 625 HB2 PRO 625 4.122 17.347 -7.965 575 HB3 PRO 625 HB1 PRO 625 3.816 18.855 -7.106 576 HG2 PRO 625 HG2 PRO 625 5.077 18.834 -9.466 577 HG3 PRO 625 HG1 PRO 625 5.519 19.977 -8.187 578 HD2 PRO 625 HD2 PRO 625 6.956 17.568 -9.149 579 HD3 PRO 625 HD1 PRO 625 7.591 19.049 -8.412 580 H GLY 626 HN GLY 626 5.252 17.148 -3.995 581 HA2 GLY 626 HA2 GLY 626 4.484 15.403 -2.742 582 HA3 GLY 626 HA1 GLY 626 3.409 15.058 -4.085 583 H VAL 627 HN VAL 627 6.913 14.967 -4.388 584 HA VAL 627 HA VAL 627 6.653 12.062 -4.806 585 HB VAL 627 HB VAL 627 8.756 13.886 -5.981 586 HG11 VAL 627 HG11 VAL 627 9.314 11.965 -7.381 587 HG12 VAL 627 HG12 VAL 627 8.091 10.997 -6.558 588 HG13 VAL 627 HG13 VAL 627 9.504 11.573 -5.673 589 HG21 VAL 627 HG21 VAL 627 7.533 13.423 -8.118 590 HG22 VAL 627 HG22 VAL 627 6.665 14.443 -6.968 591 HG23 VAL 627 HG23 VAL 627 6.230 12.738 -7.138 592 H ALA 628 HN ALA 628 7.624 10.776 -3.453 593 HA ALA 628 HA ALA 628 10.186 11.588 -2.288 594 HB1 ALA 628 HB1 ALA 628 9.567 10.676 -0.110 595 HB2 ALA 628 HB2 ALA 628 7.939 10.337 -0.701 596 HB3 ALA 628 HB3 ALA 628 8.496 12.004 -0.557 597 H VAL 629 HN VAL 629 11.654 10.037 -2.405 598 HA VAL 629 HA VAL 629 10.818 7.501 -3.549 599 HB VAL 629 HB VAL 629 12.629 8.220 -4.785 600 HG11 VAL 629 HG11 VAL 629 13.128 10.141 -3.366 601 HG12 VAL 629 HG12 VAL 629 14.594 9.313 -3.895 602 HG13 VAL 629 HG13 VAL 629 13.998 9.087 -2.248 603 HG21 VAL 629 HG21 VAL 629 13.945 6.604 -2.595 604 HG22 VAL 629 HG22 VAL 629 14.548 6.819 -4.239 605 HG23 VAL 629 HG23 VAL 629 13.045 5.934 -3.959 606 H ILE 630 HN ILE 630 10.360 5.912 -2.312 607 HA ILE 630 HA ILE 630 11.435 5.757 0.377 608 HB ILE 630 HB ILE 630 9.613 3.745 -0.906 609 HG12 ILE 630 HG12 ILE 630 8.615 5.973 -1.263 610 HG13 ILE 630 HG11 ILE 630 7.691 5.015 -0.114 611 HG21 ILE 630 HG21 ILE 630 10.597 3.167 1.234 612 HG22 ILE 630 HG22 ILE 630 8.860 3.425 1.396 613 HG23 ILE 630 HG23 ILE 630 9.989 4.668 1.930 614 HD11 ILE 630 HD11 ILE 630 7.865 7.309 0.615 615 HD12 ILE 630 HD12 ILE 630 9.625 7.207 0.562 616 HD13 ILE 630 HD13 ILE 630 8.718 6.236 1.725 617 H GLN 631 HN GLN 631 13.340 4.762 0.660 618 HA GLN 631 HA GLN 631 14.340 2.937 -1.369 619 HB2 GLN 631 HB2 GLN 631 15.867 4.610 -0.431 620 HB3 GLN 631 HB1 GLN 631 15.611 3.955 1.181 621 HG2 GLN 631 HG2 GLN 631 16.599 1.831 0.463 622 HG3 GLN 631 HG1 GLN 631 16.890 2.522 -1.134 623 HE21 GLN 631 HE21 GLN 631 17.832 2.503 2.198 624 HE22 GLN 631 HE22 GLN 631 19.308 3.379 2.003 625 H PHE 632 HN PHE 632 13.764 0.894 -1.276 626 HA PHE 632 HA PHE 632 13.045 -0.277 1.324 627 HB2 PHE 632 HB2 PHE 632 12.369 -1.164 -1.480 628 HB3 PHE 632 HB1 PHE 632 11.879 -1.996 -0.013 629 HD1 PHE 632 HD2 PHE 632 10.225 -1.000 1.481 630 HD2 PHE 632 HD1 PHE 632 11.254 0.792 -2.234 631 HE1 PHE 632 HE2 PHE 632 8.170 0.342 1.562 632 HE2 PHE 632 HE1 PHE 632 9.195 2.136 -2.163 633 HZ PHE 632 HZ PHE 632 7.648 1.909 -0.262 634 H ALA 633 HN ALA 633 14.080 -1.971 2.138 635 HA ALA 633 HA ALA 633 16.119 -3.326 0.537 636 HB1 ALA 633 HB1 ALA 633 15.408 -3.537 3.463 637 HB2 ALA 633 HB2 ALA 633 16.776 -2.658 2.779 638 HB3 ALA 633 HB3 ALA 633 16.714 -4.418 2.671 639 H VAL 634 HN VAL 634 15.088 -4.704 -0.803 640 HA VAL 634 HA VAL 634 12.646 -6.014 -0.043 641 HB VAL 634 HB VAL 634 14.353 -6.404 -2.508 642 HG11 VAL 634 HG11 VAL 634 12.349 -7.385 -3.504 643 HG12 VAL 634 HG12 VAL 634 11.494 -7.209 -1.972 644 HG13 VAL 634 HG13 VAL 634 12.871 -8.304 -2.092 645 HG21 VAL 634 HG21 VAL 634 11.931 -4.671 -2.029 646 HG22 VAL 634 HG22 VAL 634 12.683 -4.953 -3.600 647 HG23 VAL 634 HG23 VAL 634 13.579 -4.118 -2.330 648 H GLY 635 HN GLY 635 12.539 -7.782 1.128 649 HA2 GLY 635 HA2 GLY 635 12.841 -10.023 1.614 650 HA3 GLY 635 HA1 GLY 635 14.134 -10.078 0.427 651 H GLU 636 HN GLU 636 14.641 -11.487 2.540 652 HA GLU 636 HA GLU 636 15.820 -10.050 4.700 653 HB2 GLU 636 HB2 GLU 636 16.050 -12.932 3.872 654 HB3 GLU 636 HB1 GLU 636 16.664 -12.277 5.379 655 HG2 GLU 636 HG2 GLU 636 14.415 -11.661 6.052 656 HG3 GLU 636 HG1 GLU 636 13.781 -12.268 4.522 657 H HIS 637 HN HIS 637 16.857 -10.989 1.583 658 HA HIS 637 HA HIS 637 19.684 -10.751 2.139 659 HB2 HIS 637 HB2 HIS 637 18.539 -12.106 0.237 660 HB3 HIS 637 HB1 HIS 637 18.431 -10.561 -0.595 661 HD1 HIS 637 HD1 HIS 637 20.796 -13.255 0.326 662 HD2 HIS 637 HD2 HIS 637 20.937 -9.494 -1.437 663 HE1 HIS 637 HE1 HIS 637 23.064 -13.092 -0.742 664 HE2 HIS 637 HE2 HIS 637 23.082 -10.858 -1.905 665 H ARG 638 HN ARG 638 17.186 -8.674 2.054 666 HA ARG 638 HA ARG 638 16.897 -6.453 1.855 667 HB2 ARG 638 HB2 ARG 638 18.759 -5.150 3.038 668 HB3 ARG 638 HB1 ARG 638 17.855 -6.354 3.941 669 HG2 ARG 638 HG2 ARG 638 19.644 -7.922 3.765 670 HG3 ARG 638 HG1 ARG 638 20.516 -6.853 2.671 671 HD2 ARG 638 HD2 ARG 638 20.799 -5.223 4.441 672 HD3 ARG 638 HD1 ARG 638 19.820 -6.203 5.530 673 HE ARG 638 HE ARG 638 21.977 -7.744 4.606 674 HH11 ARG 638 HH11 ARG 638 21.339 -4.995 6.675 675 HH12 ARG 638 HH12 ARG 638 22.712 -5.281 7.695 676 HH21 ARG 638 HH21 ARG 638 23.779 -8.138 5.956 677 HH22 ARG 638 HH22 ARG 638 24.085 -7.084 7.302 678 H ALA 639 HN ALA 639 17.207 -6.961 -0.520 679 HA ALA 639 HA ALA 639 19.412 -5.528 -1.732 680 HB1 ALA 639 HB1 ALA 639 18.532 -7.533 -2.806 681 HB2 ALA 639 HB2 ALA 639 18.339 -6.118 -3.844 682 HB3 ALA 639 HB3 ALA 639 16.953 -6.763 -2.962 683 H GLN 640 HN GLN 640 19.380 -3.401 -2.047 684 HA GLN 640 HA GLN 640 17.020 -1.992 -1.170 685 HB2 GLN 640 HB2 GLN 640 19.806 -1.062 -1.819 686 HB3 GLN 640 HB1 GLN 640 18.512 0.030 -1.343 687 HG2 GLN 640 HG2 GLN 640 18.264 -1.219 0.756 688 HG3 GLN 640 HG1 GLN 640 19.622 -2.239 0.289 689 HE21 GLN 640 HE21 GLN 640 19.333 -0.533 2.602 690 HE22 GLN 640 HE22 GLN 640 20.646 0.602 2.518 691 H VAL 641 HN VAL 641 15.628 -0.969 -2.316 692 HA VAL 641 HA VAL 641 16.224 -0.320 -5.129 693 HB VAL 641 HB VAL 641 13.562 -1.199 -3.979 694 HG11 VAL 641 HG11 VAL 641 12.740 -1.087 -6.287 695 HG12 VAL 641 HG12 VAL 641 14.291 -0.424 -6.803 696 HG13 VAL 641 HG13 VAL 641 13.262 0.493 -5.702 697 HG21 VAL 641 HG21 VAL 641 15.425 -2.565 -5.915 698 HG22 VAL 641 HG22 VAL 641 13.807 -3.126 -5.492 699 HG23 VAL 641 HG23 VAL 641 15.070 -3.071 -4.262 700 H SER 642 HN SER 642 16.179 1.784 -5.494 701 HA SER 642 HA SER 642 14.741 3.528 -3.630 702 HB2 SER 642 HB2 SER 642 16.780 4.218 -5.767 703 HB3 SER 642 HB1 SER 642 16.076 5.349 -4.612 704 HG SER 642 HG SER 642 17.452 4.693 -3.175 705 H VAL 643 HN VAL 643 12.670 3.729 -4.243 706 HA VAL 643 HA VAL 643 12.129 4.203 -7.086 707 HB VAL 643 HB VAL 643 11.211 2.088 -6.498 708 HG11 VAL 643 HG11 VAL 643 9.915 3.441 -4.136 709 HG12 VAL 643 HG12 VAL 643 11.249 2.288 -4.079 710 HG13 VAL 643 HG13 VAL 643 9.656 1.768 -4.630 711 HG21 VAL 643 HG21 VAL 643 8.762 2.499 -6.707 712 HG22 VAL 643 HG22 VAL 643 9.758 3.333 -7.899 713 HG23 VAL 643 HG23 VAL 643 9.102 4.220 -6.525 714 H GLU 644 HN GLU 644 11.403 6.167 -7.541 715 HA GLU 644 HA GLU 644 10.513 7.978 -5.489 716 HB2 GLU 644 HB2 GLU 644 10.727 8.209 -8.489 717 HB3 GLU 644 HB1 GLU 644 10.071 9.495 -7.485 718 HG2 GLU 644 HG2 GLU 644 12.183 9.634 -6.276 719 HG3 GLU 644 HG1 GLU 644 12.843 8.345 -7.285 720 H VAL 645 HN VAL 645 8.516 7.855 -4.682 721 HA VAL 645 HA VAL 645 6.294 7.169 -6.463 722 HB VAL 645 HB VAL 645 6.878 6.425 -3.599 723 HG11 VAL 645 HG11 VAL 645 4.275 6.049 -5.033 724 HG12 VAL 645 HG12 VAL 645 4.601 7.284 -3.817 725 HG13 VAL 645 HG13 VAL 645 4.663 5.573 -3.377 726 HG21 VAL 645 HG21 VAL 645 7.784 4.924 -5.274 727 HG22 VAL 645 HG22 VAL 645 6.203 4.785 -6.040 728 HG23 VAL 645 HG23 VAL 645 6.457 4.142 -4.419 729 H LEU 646 HN LEU 646 4.328 8.356 -6.086 730 HA LEU 646 HA LEU 646 4.658 10.934 -4.916 731 HB2 LEU 646 HB2 LEU 646 2.159 9.521 -5.826 732 HB3 LEU 646 HB1 LEU 646 2.170 11.147 -5.174 733 HG LEU 646 HG LEU 646 3.003 10.169 -7.822 734 HD11 LEU 646 HD11 LEU 646 0.951 11.480 -7.431 735 HD12 LEU 646 HD12 LEU 646 2.071 12.281 -8.534 736 HD13 LEU 646 HD13 LEU 646 1.950 12.820 -6.858 737 HD21 LEU 646 HD21 LEU 646 5.136 10.934 -6.996 738 HD22 LEU 646 HD22 LEU 646 4.405 12.453 -6.474 739 HD23 LEU 646 HD23 LEU 646 4.500 12.064 -8.192 740 H VAL 647 HN VAL 647 3.897 11.708 -2.998 741 HA VAL 647 HA VAL 647 4.021 9.872 -0.843 742 HB VAL 647 HB VAL 647 3.633 11.807 0.610 743 HG11 VAL 647 HG11 VAL 647 5.876 11.383 -0.220 744 HG12 VAL 647 HG12 VAL 647 5.589 13.116 -0.060 745 HG13 VAL 647 HG13 VAL 647 5.546 12.358 -1.653 746 HG21 VAL 647 HG21 VAL 647 3.361 14.049 -0.402 747 HG22 VAL 647 HG22 VAL 647 1.975 12.993 -0.666 748 HG23 VAL 647 HG23 VAL 647 3.125 13.278 -1.973 749 H GLU 648 HN GLU 648 1.406 10.737 -2.776 750 HA GLU 648 HA GLU 648 -0.575 10.506 -0.672 751 HB2 GLU 648 HB2 GLU 648 -2.227 10.802 -2.500 752 HB3 GLU 648 HB1 GLU 648 -1.062 12.108 -2.390 753 HG2 GLU 648 HG2 GLU 648 0.120 11.315 -4.295 754 HG3 GLU 648 HG1 GLU 648 -0.835 9.833 -4.340 755 H TYR 649 HN TYR 649 1.254 8.345 -2.345 756 HA TYR 649 HA TYR 649 -0.723 6.339 -2.866 757 HB2 TYR 649 HB2 TYR 649 2.273 6.426 -2.846 758 HB3 TYR 649 HB1 TYR 649 1.436 4.888 -2.931 759 HD1 TYR 649 HD2 TYR 649 0.669 8.158 -4.567 760 HD2 TYR 649 HD1 TYR 649 1.757 4.076 -5.075 761 HE1 TYR 649 HE2 TYR 649 0.477 8.415 -7.004 762 HE2 TYR 649 HE1 TYR 649 1.570 4.323 -7.514 763 HH TYR 649 HH TYR 649 0.550 5.716 -9.153 764 HA PRO 650 HA PRO 650 -0.711 5.086 1.445 765 HB2 PRO 650 HB2 PRO 650 -2.961 3.424 0.974 766 HB3 PRO 650 HB1 PRO 650 -2.948 5.032 1.690 767 HG2 PRO 650 HG2 PRO 650 -4.066 4.347 -0.773 768 HG3 PRO 650 HG1 PRO 650 -3.709 5.988 -0.212 769 HD2 PRO 650 HD2 PRO 650 -2.181 4.244 -2.068 770 HD3 PRO 650 HD1 PRO 650 -2.344 6.012 -2.048 771 H PHE 651 HN PHE 651 0.852 3.676 1.893 772 HA PHE 651 HA PHE 651 1.098 1.220 0.353 773 HB2 PHE 651 HB2 PHE 651 2.910 2.675 2.250 774 HB3 PHE 651 HB1 PHE 651 3.221 0.999 1.818 775 HD1 PHE 651 HD1 PHE 651 3.002 4.438 0.529 776 HD2 PHE 651 HD2 PHE 651 4.086 0.411 -0.307 777 HE1 PHE 651 HE1 PHE 651 4.164 5.176 -1.506 778 HE2 PHE 651 HE2 PHE 651 5.249 1.141 -2.347 779 HZ PHE 651 HZ PHE 651 5.288 3.526 -2.948 780 H PHE 652 HN PHE 652 0.122 -0.535 1.040 781 HA PHE 652 HA PHE 652 -0.642 -0.998 3.738 782 HB2 PHE 652 HB2 PHE 652 -0.972 -2.297 1.204 783 HB3 PHE 652 HB1 PHE 652 -0.358 -3.471 2.364 784 HD1 PHE 652 HD1 PHE 652 -1.553 -3.439 4.696 785 HD2 PHE 652 HD2 PHE 652 -3.240 -1.951 1.089 786 HE1 PHE 652 HE1 PHE 652 -3.798 -3.675 5.654 787 HE2 PHE 652 HE2 PHE 652 -5.490 -2.188 2.049 788 HZ PHE 652 HZ PHE 652 -5.775 -3.044 4.334 789 H VAL 653 HN VAL 653 0.578 -1.794 5.385 790 HA VAL 653 HA VAL 653 3.312 -2.577 4.635 791 HB VAL 653 HB VAL 653 2.696 -1.555 7.374 792 HG11 VAL 653 HG11 VAL 653 4.934 -2.488 6.327 793 HG12 VAL 653 HG12 VAL 653 4.937 -1.170 7.493 794 HG13 VAL 653 HG13 VAL 653 5.075 -0.824 5.766 795 HG21 VAL 653 HG21 VAL 653 2.934 0.128 4.899 796 HG22 VAL 653 HG22 VAL 653 3.353 0.741 6.500 797 HG23 VAL 653 HG23 VAL 653 1.700 0.200 6.161 798 H PHE 654 HN PHE 654 3.973 -4.519 5.099 799 HA PHE 654 HA PHE 654 2.373 -6.629 5.305 800 HB2 PHE 654 HB2 PHE 654 4.692 -6.788 4.687 801 HB3 PHE 654 HB1 PHE 654 5.194 -6.445 6.333 802 HD1 PHE 654 HD2 PHE 654 3.033 -8.873 4.503 803 HD2 PHE 654 HD1 PHE 654 5.857 -8.227 7.617 804 HE1 PHE 654 HE2 PHE 654 3.042 -11.285 4.991 805 HE2 PHE 654 HE1 PHE 654 5.872 -10.637 8.111 806 HZ PHE 654 HZ PHE 654 4.462 -12.170 6.797 807 H GLY 655 HN GLY 655 4.291 -5.842 8.237 808 HA2 GLY 655 HA2 GLY 655 1.977 -6.837 9.786 809 HA3 GLY 655 HA1 GLY 655 3.646 -7.147 10.259 810 H GLN 656 HN GLN 656 2.450 -4.170 8.909 811 HA GLN 656 HA GLN 656 3.257 -2.851 11.404 812 HB2 GLN 656 HB2 GLN 656 3.935 -2.137 8.571 813 HB3 GLN 656 HB1 GLN 656 4.185 -1.027 9.901 814 HG2 GLN 656 HG2 GLN 656 6.265 -1.964 9.618 815 HG3 GLN 656 HG1 GLN 656 5.586 -2.924 10.912 816 HE21 GLN 656 HE21 GLN 656 4.618 -3.331 7.618 817 HE22 GLN 656 HE22 GLN 656 5.397 -4.846 7.325 818 H GLY 657 HN GLY 657 1.067 -2.805 8.604 819 HA2 GLY 657 HA2 GLY 657 -1.219 -2.262 9.628 820 HA3 GLY 657 HA1 GLY 657 -0.470 -0.736 10.046 821 H TRP 658 HN TRP 658 -2.495 -0.111 8.852 822 HA TRP 658 HA TRP 658 -2.233 -0.096 5.937 823 HB2 TRP 658 HB2 TRP 658 -4.430 -0.616 7.103 824 HB3 TRP 658 HB1 TRP 658 -4.451 1.037 7.678 825 HD1 TRP 658 HD1 TRP 658 -6.858 1.068 6.434 826 HE1 TRP 658 HE1 TRP 658 -7.478 1.658 4.017 827 HE3 TRP 658 HE3 TRP 658 -2.246 0.542 4.226 828 HZ2 TRP 658 HZ2 TRP 658 -6.212 1.889 1.528 829 HZ3 TRP 658 HZ3 TRP 658 -2.069 0.970 1.813 830 HH2 TRP 658 HH2 TRP 658 -4.002 1.631 0.499 831 H SER 659 HN SER 659 -0.803 1.482 5.256 832 HA SER 659 HA SER 659 -0.811 4.021 6.737 833 HB2 SER 659 HB2 SER 659 1.618 2.406 5.937 834 HB3 SER 659 HB1 SER 659 1.658 3.994 6.705 835 HG SER 659 HG SER 659 1.879 2.194 8.176 836 H SER 660 HN SER 660 0.478 5.728 5.640 837 HA SER 660 HA SER 660 0.884 5.435 2.778 838 HB2 SER 660 HB2 SER 660 -1.409 6.282 2.878 839 HB3 SER 660 HB1 SER 660 -0.915 7.553 3.993 840 HG SER 660 HG SER 660 -1.099 8.247 1.781 841 H CYS 661 HN CYS 661 2.262 7.059 1.924 842 HA CYS 661 HA CYS 661 4.311 7.881 3.699 843 HB2 CYS 661 HB2 CYS 661 3.771 8.803 0.869 844 HB3 CYS 661 HB1 CYS 661 5.291 8.969 1.741 845 HG CYS 661 HG CYS 661 4.125 6.400 0.003 846 H CYS 662 HN CYS 662 1.313 9.210 2.872 847 HA CYS 662 HA CYS 662 1.801 11.458 4.582 848 HB2 CYS 662 HB2 CYS 662 2.589 12.290 2.353 849 HB3 CYS 662 HB1 CYS 662 0.969 12.008 1.725 850 HG CYS 662 HG CYS 662 1.819 14.243 4.172 851 HA PRO 663 HA PRO 663 -2.316 9.420 4.954 852 HB2 PRO 663 HB2 PRO 663 -1.961 10.694 7.617 853 HB3 PRO 663 HB1 PRO 663 -2.505 9.062 7.209 854 HG2 PRO 663 HG2 PRO 663 -0.058 9.456 8.164 855 HG3 PRO 663 HG1 PRO 663 -0.338 8.290 6.857 856 HD2 PRO 663 HD2 PRO 663 0.781 11.063 6.717 857 HD3 PRO 663 HD1 PRO 663 1.281 9.600 5.842 858 H GLU 664 HN GLU 664 -1.209 12.636 5.827 859 HA GLU 664 HA GLU 664 -3.625 13.932 6.143 860 HB2 GLU 664 HB2 GLU 664 -1.398 14.847 6.672 861 HB3 GLU 664 HB1 GLU 664 -1.032 14.925 4.955 862 HG2 GLU 664 HG2 GLU 664 -1.626 17.069 5.500 863 HG3 GLU 664 HG1 GLU 664 -3.078 16.393 4.772 864 H ARG 665 HN ARG 665 -1.601 13.540 3.247 865 HA ARG 665 HA ARG 665 -3.413 14.908 1.527 866 HB2 ARG 665 HB2 ARG 665 -0.998 14.823 1.109 867 HB3 ARG 665 HB1 ARG 665 -1.082 13.082 0.892 868 HG2 ARG 665 HG2 ARG 665 -2.349 13.325 -1.114 869 HG3 ARG 665 HG1 ARG 665 -2.529 15.060 -0.850 870 HD2 ARG 665 HD2 ARG 665 -0.212 15.443 -1.217 871 HD3 ARG 665 HD1 ARG 665 0.147 13.720 -1.166 872 HE ARG 665 HE ARG 665 -1.461 13.781 -3.258 873 HH11 ARG 665 HH11 ARG 665 1.119 16.019 -2.437 874 HH12 ARG 665 HH12 ARG 665 1.487 16.375 -4.095 875 HH21 ARG 665 HH21 ARG 665 -0.951 14.218 -5.406 876 HH22 ARG 665 HH22 ARG 665 0.330 15.339 -5.786 877 H THR 666 HN THR 666 -2.739 11.440 2.108 878 HA THR 666 HA THR 666 -4.488 10.472 0.132 879 HB THR 666 HB THR 666 -3.787 9.112 2.747 880 HG1 THR 666 HG1 THR 666 -2.471 8.747 0.254 881 HG21 THR 666 HG21 THR 666 -4.216 7.028 1.579 882 HG22 THR 666 HG22 THR 666 -4.546 7.890 0.079 883 HG23 THR 666 HG23 THR 666 -5.644 8.054 1.446 884 H SER 667 HN SER 667 -5.044 11.314 3.549 885 HA SER 667 HA SER 667 -7.803 10.563 3.461 886 HB2 SER 667 HB2 SER 667 -6.419 10.650 5.554 887 HB3 SER 667 HB1 SER 667 -6.480 12.401 5.437 888 HG SER 667 HG SER 667 -8.828 12.153 5.460 889 H GLN 668 HN GLN 668 -6.012 13.563 2.958 890 HA GLN 668 HA GLN 668 -8.161 15.330 2.887 891 HB2 GLN 668 HB2 GLN 668 -5.385 15.281 2.130 892 HB3 GLN 668 HB1 GLN 668 -6.356 16.325 1.105 893 HG2 GLN 668 HG2 GLN 668 -6.165 16.394 4.095 894 HG3 GLN 668 HG1 GLN 668 -5.524 17.533 2.944 895 HE21 GLN 668 HE21 GLN 668 -8.390 16.386 4.503 896 HE22 GLN 668 HE22 GLN 668 -9.423 17.688 4.021 897 H LEU 669 HN LEU 669 -6.583 13.578 0.222 898 HA LEU 669 HA LEU 669 -8.399 14.834 -1.657 899 HB2 LEU 669 HB2 LEU 669 -6.271 12.803 -2.278 900 HB3 LEU 669 HB1 LEU 669 -6.986 13.982 -3.358 901 HG LEU 669 HG LEU 669 -5.077 14.519 -1.091 902 HD11 LEU 669 HD11 LEU 669 -4.056 13.648 -3.118 903 HD12 LEU 669 HD12 LEU 669 -3.610 15.333 -2.850 904 HD13 LEU 669 HD13 LEU 669 -4.824 14.925 -4.061 905 HD21 LEU 669 HD21 LEU 669 -6.563 16.474 -2.839 906 HD22 LEU 669 HD22 LEU 669 -5.168 16.887 -1.840 907 HD23 LEU 669 HD23 LEU 669 -6.654 16.318 -1.081 908 H PHE 670 HN PHE 670 -7.793 11.675 -0.279 909 HA PHE 670 HA PHE 670 -9.864 10.525 -2.022 910 HB2 PHE 670 HB2 PHE 670 -7.804 9.044 -0.386 911 HB3 PHE 670 HB1 PHE 670 -8.822 8.389 -1.661 912 HD1 PHE 670 HD1 PHE 670 -8.582 9.959 -3.923 913 HD2 PHE 670 HD2 PHE 670 -5.609 9.249 -0.968 914 HE1 PHE 670 HE1 PHE 670 -6.832 10.456 -5.572 915 HE2 PHE 670 HE2 PHE 670 -3.851 9.750 -2.612 916 HZ PHE 670 HZ PHE 670 -4.460 10.354 -4.918 917 H ASP 671 HN ASP 671 -9.619 11.840 0.913 918 HA ASP 671 HA ASP 671 -10.824 11.808 2.832 919 HB2 ASP 671 HB2 ASP 671 -12.594 10.069 1.133 920 HB3 ASP 671 HB1 ASP 671 -12.990 10.437 2.804 921 H LEU 672 HN LEU 672 -8.836 9.540 2.035 922 HA LEU 672 HA LEU 672 -9.922 7.379 3.685 923 HB2 LEU 672 HB2 LEU 672 -9.340 6.821 1.359 924 HB3 LEU 672 HB1 LEU 672 -7.682 7.308 1.656 925 HG LEU 672 HG LEU 672 -7.586 5.514 3.433 926 HD11 LEU 672 HD11 LEU 672 -10.064 5.346 3.666 927 HD12 LEU 672 HD12 LEU 672 -9.242 3.802 3.463 928 HD13 LEU 672 HD13 LEU 672 -10.101 4.528 2.105 929 HD21 LEU 672 HD21 LEU 672 -8.147 4.558 0.624 930 HD22 LEU 672 HD22 LEU 672 -7.206 3.720 1.862 931 HD23 LEU 672 HD23 LEU 672 -6.615 5.237 1.182 932 HA PRO 673 HA PRO 673 -6.908 8.647 6.706 933 HB2 PRO 673 HB2 PRO 673 -7.551 6.798 8.582 934 HB3 PRO 673 HB1 PRO 673 -8.508 8.255 8.300 935 HG2 PRO 673 HG2 PRO 673 -9.009 5.455 7.409 936 HG3 PRO 673 HG1 PRO 673 -10.160 6.683 7.962 937 HD2 PRO 673 HD2 PRO 673 -9.731 6.048 5.334 938 HD3 PRO 673 HD1 PRO 673 -10.341 7.616 5.881 939 H CYS 674 HN CYS 674 -4.923 7.953 7.337 940 HA CYS 674 HA CYS 674 -4.092 5.210 6.789 941 HB2 CYS 674 HB2 CYS 674 -3.032 7.650 5.386 942 HB3 CYS 674 HB1 CYS 674 -2.064 6.191 5.509 943 HG CYS 674 HG CYS 674 -5.098 5.493 4.390 944 H SER 675 HN SER 675 -2.209 4.606 7.851 945 HA SER 675 HA SER 675 -1.336 6.313 10.037 946 HB2 SER 675 HB2 SER 675 -0.366 3.548 9.246 947 HB3 SER 675 HB1 SER 675 -0.088 4.360 10.788 948 HG SER 675 HG SER 675 -2.720 3.920 9.877 949 H LYS 676 HN LYS 676 1.099 6.673 10.293 950 HA LYS 676 HA LYS 676 2.029 7.709 7.791 951 HB2 LYS 676 HB2 LYS 676 2.454 8.918 9.883 952 HB3 LYS 676 HB1 LYS 676 3.470 7.598 10.441 953 HG2 LYS 676 HG2 LYS 676 4.800 9.447 9.582 954 HG3 LYS 676 HG1 LYS 676 5.016 7.986 8.610 955 HD2 LYS 676 HD2 LYS 676 3.488 8.852 6.929 956 HD3 LYS 676 HD1 LYS 676 3.175 10.280 7.916 957 HE2 LYS 676 HE2 LYS 676 5.846 9.503 6.748 958 HE3 LYS 676 HE1 LYS 676 4.765 10.731 6.096 959 HZ1 LYS 676 HZ1 LYS 676 4.988 11.933 8.221 960 HZ2 LYS 676 HZ2 LYS 676 6.457 11.778 7.399 961 HZ3 LYS 676 HZ3 LYS 676 6.128 10.793 8.732 962 H LEU 677 HN LEU 677 3.037 6.624 6.307 963 HA LEU 677 HA LEU 677 4.472 4.186 6.889 964 HB2 LEU 677 HB2 LEU 677 3.112 4.477 4.833 965 HB3 LEU 677 HB1 LEU 677 4.188 5.746 4.302 966 HG LEU 677 HG LEU 677 4.465 3.466 3.219 967 HD11 LEU 677 HD11 LEU 677 6.176 5.167 3.000 968 HD12 LEU 677 HD12 LEU 677 6.908 3.572 3.179 969 HD13 LEU 677 HD13 LEU 677 6.877 4.685 4.545 970 HD21 LEU 677 HD21 LEU 677 5.759 1.805 4.431 971 HD22 LEU 677 HD22 LEU 677 4.225 2.129 5.238 972 HD23 LEU 677 HD23 LEU 677 5.719 2.816 5.875 973 H SER 678 HN SER 678 6.375 4.376 7.848 974 HA SER 678 HA SER 678 8.239 6.435 6.880 975 HB2 SER 678 HB2 SER 678 7.894 5.557 9.758 976 HB3 SER 678 HB1 SER 678 9.047 6.755 9.170 977 HG SER 678 HG SER 678 6.577 7.168 9.955 978 H VAL 679 HN VAL 679 10.522 5.942 7.608 979 HA VAL 679 HA VAL 679 11.400 3.539 6.569 980 HB VAL 679 HB VAL 679 12.922 5.297 6.575 981 HG11 VAL 679 HG11 VAL 679 12.446 5.577 9.530 982 HG12 VAL 679 HG12 VAL 679 11.980 6.701 8.248 983 HG13 VAL 679 HG13 VAL 679 13.685 6.454 8.632 984 HG21 VAL 679 HG21 VAL 679 14.880 4.510 7.758 985 HG22 VAL 679 HG22 VAL 679 13.983 3.141 7.099 986 HG23 VAL 679 HG23 VAL 679 13.872 3.522 8.819 987 H GLY 680 HN GLY 680 11.730 1.563 7.335 988 HA2 GLY 680 HA2 GLY 680 12.130 0.010 9.146 989 HA3 GLY 680 HA1 GLY 680 11.200 1.068 10.191 990 H ASP 681 HN ASP 681 9.299 1.368 7.753 991 HA ASP 681 HA ASP 681 7.581 -0.783 8.677 992 HB2 ASP 681 HB2 ASP 681 7.054 1.558 6.842 993 HB3 ASP 681 HB1 ASP 681 5.873 0.318 7.165 994 H VAL 682 HN VAL 682 7.676 -2.708 7.759 995 HA VAL 682 HA VAL 682 8.876 -3.153 5.212 996 HB VAL 682 HB VAL 682 7.219 -5.034 6.901 997 HG11 VAL 682 HG11 VAL 682 9.063 -5.600 4.587 998 HG12 VAL 682 HG12 VAL 682 7.308 -5.792 4.611 999 HG13 VAL 682 HG13 VAL 682 8.323 -6.822 5.621 1000 HG21 VAL 682 HG21 VAL 682 9.370 -5.954 7.633 1001 HG22 VAL 682 HG22 VAL 682 9.182 -4.262 8.098 1002 HG23 VAL 682 HG23 VAL 682 10.208 -4.693 6.729 1003 H CYS 683 HN CYS 683 7.869 -2.508 3.391 1004 HA CYS 683 HA CYS 683 5.003 -2.198 3.404 1005 HB2 CYS 683 HB2 CYS 683 7.082 -1.565 1.320 1006 HB3 CYS 683 HB1 CYS 683 5.372 -1.200 1.137 1007 HG CYS 683 HG CYS 683 7.064 -0.013 3.843 1008 H ILE 684 HN ILE 684 3.538 -3.211 2.216 1009 HA ILE 684 HA ILE 684 4.137 -5.874 1.345 1010 HB ILE 684 HB ILE 684 1.622 -4.225 1.502 1011 HG12 ILE 684 HG12 ILE 684 2.402 -6.805 2.854 1012 HG13 ILE 684 HG11 ILE 684 2.561 -5.211 3.581 1013 HG21 ILE 684 HG21 ILE 684 1.268 -5.512 -0.462 1014 HG22 ILE 684 HG22 ILE 684 0.374 -6.295 0.846 1015 HG23 ILE 684 HG23 ILE 684 1.913 -6.964 0.298 1016 HD11 ILE 684 HD11 ILE 684 0.181 -4.907 3.551 1017 HD12 ILE 684 HD12 ILE 684 0.548 -6.452 4.315 1018 HD13 ILE 684 HD13 ILE 684 -0.043 -6.407 2.652 1019 H SER 685 HN SER 685 5.143 -6.031 -0.655 1020 HA SER 685 HA SER 685 3.937 -4.576 -2.888 1021 HB2 SER 685 HB2 SER 685 6.453 -4.949 -2.750 1022 HB3 SER 685 HB1 SER 685 6.129 -6.652 -3.041 1023 HG SER 685 HG SER 685 6.618 -5.286 -4.933 1024 H LEU 686 HN LEU 686 2.211 -5.456 -3.847 1025 HA LEU 686 HA LEU 686 1.840 -8.329 -3.483 1026 HB2 LEU 686 HB2 LEU 686 0.216 -6.268 -2.704 1027 HB3 LEU 686 HB1 LEU 686 -0.512 -6.766 -4.221 1028 HG LEU 686 HG LEU 686 0.185 -8.839 -2.207 1029 HD11 LEU 686 HD11 LEU 686 -1.876 -8.584 -1.062 1030 HD12 LEU 686 HD12 LEU 686 -2.360 -7.258 -2.130 1031 HD13 LEU 686 HD13 LEU 686 -1.017 -7.043 -1.007 1032 HD21 LEU 686 HD21 LEU 686 -2.071 -8.559 -4.176 1033 HD22 LEU 686 HD22 LEU 686 -1.679 -9.989 -3.221 1034 HD23 LEU 686 HD23 LEU 686 -0.567 -9.431 -4.472 1035 H THR 687 HN THR 687 1.655 -9.587 -5.195 1036 HA THR 687 HA THR 687 1.986 -8.294 -7.785 1037 HB THR 687 HB THR 687 2.411 -11.169 -6.975 1038 HG1 THR 687 HG1 THR 687 4.039 -8.896 -6.968 1039 HG21 THR 687 HG21 THR 687 3.177 -9.716 -9.500 1040 HG22 THR 687 HG22 THR 687 1.890 -10.911 -9.347 1041 HG23 THR 687 HG23 THR 687 3.571 -11.388 -9.105 1042 H LEU 688 HN LEU 688 0.266 -8.059 -8.996 1043 HA LEU 688 HA LEU 688 -1.913 -10.013 -8.860 1044 HB2 LEU 688 HB2 LEU 688 -1.659 -7.184 -9.594 1045 HB3 LEU 688 HB1 LEU 688 -2.578 -8.110 -10.760 1046 HG LEU 688 HG LEU 688 -3.972 -6.964 -9.061 1047 HD11 LEU 688 HD11 LEU 688 -5.392 -8.904 -8.559 1048 HD12 LEU 688 HD12 LEU 688 -4.087 -9.970 -9.078 1049 HD13 LEU 688 HD13 LEU 688 -4.844 -8.877 -10.234 1050 HD21 LEU 688 HD21 LEU 688 -2.678 -8.902 -7.146 1051 HD22 LEU 688 HD22 LEU 688 -4.083 -7.893 -6.789 1052 HD23 LEU 688 HD23 LEU 688 -2.520 -7.145 -7.128 1053 H LYS 689 HN LYS 689 -1.196 -11.759 -10.025 1054 HA LYS 689 HA LYS 689 0.456 -11.533 -12.304 1055 HB2 LYS 689 HB2 LYS 689 -1.025 -13.758 -10.977 1056 HB3 LYS 689 HB1 LYS 689 -0.321 -14.011 -12.560 1057 HG2 LYS 689 HG2 LYS 689 1.183 -13.086 -10.129 1058 HG3 LYS 689 HG1 LYS 689 1.149 -14.743 -10.733 1059 HD2 LYS 689 HD2 LYS 689 2.174 -12.349 -12.263 1060 HD3 LYS 689 HD1 LYS 689 3.179 -13.522 -11.421 1061 HE2 LYS 689 HE2 LYS 689 2.304 -15.299 -12.866 1062 HE3 LYS 689 HE1 LYS 689 1.318 -14.112 -13.718 1063 HZ1 LYS 689 HZ1 LYS 689 3.317 -12.998 -14.444 1064 HZ2 LYS 689 HZ2 LYS 689 3.370 -14.624 -14.900 1065 HZ3 LYS 689 HZ3 LYS 689 4.281 -14.088 -13.584 Start of MODEL 2 1 H1 VAL 34 HT1 VAL 34 -18.362 -4.801 -6.388 2 H2 VAL 34 HT2 VAL 34 -18.521 -3.131 -6.220 3 H3 VAL 34 HT3 VAL 34 -19.108 -4.156 -5.012 4 HA VAL 34 HA VAL 34 -17.057 -3.154 -4.303 5 HB VAL 34 HB VAL 34 -15.672 -5.212 -3.958 6 HG11 VAL 34 HG11 VAL 34 -17.386 -4.651 -2.374 7 HG12 VAL 34 HG12 VAL 34 -17.302 -6.397 -2.604 8 HG13 VAL 34 HG13 VAL 34 -18.600 -5.471 -3.356 9 HG21 VAL 34 HG21 VAL 34 -17.837 -6.513 -5.600 10 HG22 VAL 34 HG22 VAL 34 -16.590 -7.364 -4.689 11 HG23 VAL 34 HG23 VAL 34 -16.141 -6.342 -6.053 12 H PHE 35 HN PHE 35 -14.653 -3.434 -4.500 13 HA PHE 35 HA PHE 35 -13.782 -3.579 -7.300 14 HB2 PHE 35 HB2 PHE 35 -12.994 -1.639 -5.140 15 HB3 PHE 35 HB1 PHE 35 -11.919 -1.977 -6.495 16 HD1 PHE 35 HD1 PHE 35 -15.456 -1.065 -5.825 17 HD2 PHE 35 HD2 PHE 35 -12.089 -0.674 -8.369 18 HE1 PHE 35 HE1 PHE 35 -16.699 0.549 -7.201 19 HE2 PHE 35 HE2 PHE 35 -13.311 0.947 -9.757 20 HZ PHE 35 HZ PHE 35 -15.624 1.558 -9.179 21 HA PRO 36 HA PRO 36 -11.171 -6.974 -6.036 22 HB2 PRO 36 HB2 PRO 36 -9.278 -5.555 -7.871 23 HB3 PRO 36 HB1 PRO 36 -9.688 -7.273 -7.799 24 HG2 PRO 36 HG2 PRO 36 -10.726 -5.732 -9.692 25 HG3 PRO 36 HG1 PRO 36 -11.717 -6.969 -8.894 26 HD2 PRO 36 HD2 PRO 36 -11.738 -4.010 -8.553 27 HD3 PRO 36 HD1 PRO 36 -13.074 -5.172 -8.441 28 H TRP 37 HN TRP 37 -9.782 -7.178 -4.362 29 HA TRP 37 HA TRP 37 -9.484 -5.018 -2.726 30 HB2 TRP 37 HB2 TRP 37 -7.905 -6.493 -1.393 31 HB3 TRP 37 HB1 TRP 37 -9.526 -7.094 -1.698 32 HD1 TRP 37 HD1 TRP 37 -9.685 -8.987 -3.762 33 HE1 TRP 37 HE1 TRP 37 -8.034 -10.878 -4.303 34 HE3 TRP 37 HE3 TRP 37 -5.563 -7.172 -1.349 35 HZ2 TRP 37 HZ2 TRP 37 -5.361 -11.528 -3.746 36 HZ3 TRP 37 HZ3 TRP 37 -3.492 -8.496 -1.409 37 HH2 TRP 37 HH2 TRP 37 -3.397 -10.631 -2.587 38 H HIS 38 HN HIS 38 -7.176 -6.038 -5.186 39 HA HIS 38 HA HIS 38 -5.008 -4.525 -4.128 40 HB2 HIS 38 HB2 HIS 38 -3.855 -4.993 -6.162 41 HB3 HIS 38 HB1 HIS 38 -4.782 -6.427 -5.751 42 HD1 HIS 38 HD1 HIS 38 -3.950 -4.400 -8.540 43 HD2 HIS 38 HD2 HIS 38 -7.391 -6.387 -7.321 44 HE1 HIS 38 HE1 HIS 38 -5.354 -4.651 -10.610 45 HE2 HIS 38 HE2 HIS 38 -7.487 -5.729 -9.825 46 H SER 39 HN SER 39 -6.956 -2.805 -3.843 47 HA SER 39 HA SER 39 -7.058 -1.030 -6.185 48 HB2 SER 39 HB2 SER 39 -9.228 -1.804 -5.447 49 HB3 SER 39 HB1 SER 39 -8.880 -1.340 -3.784 50 HG SER 39 HG SER 39 -10.125 0.263 -4.642 51 H LEU 40 HN LEU 40 -5.930 -1.308 -2.970 52 HA LEU 40 HA LEU 40 -5.265 1.570 -2.850 53 HB2 LEU 40 HB2 LEU 40 -5.340 0.603 -0.227 54 HB3 LEU 40 HB1 LEU 40 -6.499 1.671 -1.001 55 HG LEU 40 HG LEU 40 -6.831 -1.270 -1.391 56 HD11 LEU 40 HD11 LEU 40 -8.235 -1.331 0.650 57 HD12 LEU 40 HD12 LEU 40 -7.548 0.230 1.110 58 HD13 LEU 40 HD13 LEU 40 -6.504 -1.183 0.967 59 HD21 LEU 40 HD21 LEU 40 -8.776 1.013 -1.049 60 HD22 LEU 40 HD22 LEU 40 -9.191 -0.655 -1.436 61 HD23 LEU 40 HD23 LEU 40 -8.274 0.317 -2.589 62 H VAL 41 HN VAL 41 -4.159 -1.636 -2.818 63 HA VAL 41 HA VAL 41 -1.728 -1.039 -1.377 64 HB VAL 41 HB VAL 41 -2.793 -3.210 -1.012 65 HG11 VAL 41 HG11 VAL 41 -3.798 -3.472 -3.243 66 HG12 VAL 41 HG12 VAL 41 -2.910 -4.906 -2.731 67 HG13 VAL 41 HG13 VAL 41 -2.200 -3.802 -3.911 68 HG21 VAL 41 HG21 VAL 41 -0.168 -3.405 -2.456 69 HG22 VAL 41 HG22 VAL 41 -0.841 -4.632 -1.382 70 HG23 VAL 41 HG23 VAL 41 -0.402 -3.046 -0.747 71 HA PRO 42 HA PRO 42 0.275 -0.015 -5.239 72 HB2 PRO 42 HB2 PRO 42 2.627 0.737 -4.220 73 HB3 PRO 42 HB1 PRO 42 1.176 1.715 -3.963 74 HG2 PRO 42 HG2 PRO 42 2.497 -0.235 -2.114 75 HG3 PRO 42 HG1 PRO 42 1.839 1.374 -1.758 76 HD2 PRO 42 HD2 PRO 42 0.500 -0.976 -1.275 77 HD3 PRO 42 HD1 PRO 42 -0.300 0.584 -1.555 78 H PHE 43 HN PHE 43 2.545 -0.567 -6.164 79 HA PHE 43 HA PHE 43 3.168 -3.340 -5.417 80 HB2 PHE 43 HB2 PHE 43 2.100 -3.203 -7.626 81 HB3 PHE 43 HB1 PHE 43 3.351 -2.087 -8.163 82 HD1 PHE 43 HD2 PHE 43 3.318 -5.373 -6.376 83 HD2 PHE 43 HD1 PHE 43 4.837 -3.049 -9.607 84 HE1 PHE 43 HE2 PHE 43 4.724 -7.262 -7.076 85 HE2 PHE 43 HE1 PHE 43 6.248 -4.938 -10.308 86 HZ PHE 43 HZ PHE 43 6.191 -7.050 -9.042 87 H LEU 44 HN LEU 44 4.827 -2.983 -4.072 88 HA LEU 44 HA LEU 44 7.030 -1.304 -4.511 89 HB2 LEU 44 HB2 LEU 44 6.609 -2.212 -2.319 90 HB3 LEU 44 HB1 LEU 44 6.664 -3.850 -2.928 91 HG LEU 44 HG LEU 44 8.636 -2.891 -1.518 92 HD11 LEU 44 HD11 LEU 44 10.203 -4.367 -2.681 93 HD12 LEU 44 HD12 LEU 44 9.087 -4.466 -4.043 94 HD13 LEU 44 HD13 LEU 44 8.617 -5.113 -2.469 95 HD21 LEU 44 HD21 LEU 44 9.366 -1.901 -4.269 96 HD22 LEU 44 HD22 LEU 44 10.440 -1.953 -2.870 97 HD23 LEU 44 HD23 LEU 44 9.025 -0.901 -2.857 98 H ALA 45 HN ALA 45 8.524 -1.391 -6.007 99 HA ALA 45 HA ALA 45 8.583 -3.161 -8.122 100 HB1 ALA 45 HB1 ALA 45 10.728 -2.141 -8.704 101 HB2 ALA 45 HB2 ALA 45 10.838 -1.442 -7.089 102 HB3 ALA 45 HB3 ALA 45 9.560 -0.925 -8.189 103 HA PRO 46 HA PRO 46 10.357 -6.918 -6.557 104 HB2 PRO 46 HB2 PRO 46 11.495 -7.029 -9.312 105 HB3 PRO 46 HB1 PRO 46 10.588 -8.257 -8.421 106 HG2 PRO 46 HG2 PRO 46 9.428 -6.850 -10.361 107 HG3 PRO 46 HG1 PRO 46 8.542 -7.271 -8.883 108 HD2 PRO 46 HD2 PRO 46 9.713 -4.658 -9.714 109 HD3 PRO 46 HD1 PRO 46 8.240 -4.994 -8.782 110 H SER 47 HN SER 47 12.168 -7.178 -5.438 111 HA SER 47 HA SER 47 14.135 -5.231 -5.324 112 HB2 SER 47 HB2 SER 47 15.345 -6.850 -3.875 113 HB3 SER 47 HB1 SER 47 13.641 -6.666 -3.448 114 HG SER 47 HG SER 47 14.458 -8.689 -5.234 115 H GLN 48 HN GLN 48 15.767 -4.773 -6.607 116 HA GLN 48 HA GLN 48 16.672 -6.479 -8.676 117 HB2 GLN 48 HB2 GLN 48 17.996 -4.017 -7.516 118 HB3 GLN 48 HB1 GLN 48 18.457 -4.805 -9.015 119 HG2 GLN 48 HG2 GLN 48 17.199 -3.043 -9.769 120 HG3 GLN 48 HG1 GLN 48 16.006 -4.338 -9.717 121 HE21 GLN 48 HE21 GLN 48 17.103 -1.389 -8.251 122 HE22 GLN 48 HE22 GLN 48 15.686 -1.098 -7.304 123 H ALA 567 HT1 ALA 567 -25.691 5.581 4.224 124 HA ALA 567 HA ALA 567 -25.274 6.018 1.886 125 HB1 ALA 567 HB1 ALA 567 -26.516 7.636 3.250 126 HB2 ALA 567 HB2 ALA 567 -25.591 8.422 1.972 127 HB3 ALA 567 HB3 ALA 567 -25.005 8.459 3.636 128 HA PRO 568 HA PRO 568 -21.037 6.568 0.752 129 HB2 PRO 568 HB2 PRO 568 -21.401 7.350 -1.826 130 HB3 PRO 568 HB1 PRO 568 -21.572 5.680 -1.286 131 HG2 PRO 568 HG2 PRO 568 -23.668 7.704 -1.892 132 HG3 PRO 568 HG1 PRO 568 -23.682 5.955 -2.169 133 HD2 PRO 568 HD2 PRO 568 -24.975 7.215 -0.094 134 HD3 PRO 568 HD1 PRO 568 -24.469 5.518 -0.074 135 HA PRO 569 HA PRO 569 -20.368 10.903 1.268 136 HB2 PRO 569 HB2 PRO 569 -17.707 10.941 1.116 137 HB3 PRO 569 HB1 PRO 569 -18.534 10.105 2.436 138 HG2 PRO 569 HG2 PRO 569 -17.313 8.974 -0.053 139 HG3 PRO 569 HG1 PRO 569 -17.225 8.366 1.611 140 HD2 PRO 569 HD2 PRO 569 -18.962 7.407 -0.306 141 HD3 PRO 569 HD1 PRO 569 -19.234 7.289 1.443 142 H THR 570 HN THR 570 -20.590 9.672 -1.652 143 HA THR 570 HA THR 570 -20.601 10.549 -3.751 144 HB THR 570 HB THR 570 -19.490 13.073 -2.628 145 HG1 THR 570 HG1 THR 570 -21.995 11.911 -2.374 146 HG21 THR 570 HG21 THR 570 -21.241 12.555 -5.030 147 HG22 THR 570 HG22 THR 570 -19.524 12.956 -5.075 148 HG23 THR 570 HG23 THR 570 -20.690 14.140 -4.486 149 H LEU 571 HN LEU 571 -17.983 10.126 -1.915 150 HA LEU 571 HA LEU 571 -15.889 10.849 -3.732 151 HB2 LEU 571 HB2 LEU 571 -15.967 10.496 -1.101 152 HB3 LEU 571 HB1 LEU 571 -15.562 8.855 -1.549 153 HG LEU 571 HG LEU 571 -13.502 9.598 -2.588 154 HD11 LEU 571 HD11 LEU 571 -12.766 11.930 -2.370 155 HD12 LEU 571 HD12 LEU 571 -14.354 12.363 -1.739 156 HD13 LEU 571 HD13 LEU 571 -14.192 11.783 -3.396 157 HD21 LEU 571 HD21 LEU 571 -12.343 10.307 -0.579 158 HD22 LEU 571 HD22 LEU 571 -13.541 9.068 -0.199 159 HD23 LEU 571 HD23 LEU 571 -13.878 10.759 0.162 160 HA PRO 572 HA PRO 572 -16.008 7.430 -6.502 161 HB2 PRO 572 HB2 PRO 572 -13.064 7.260 -6.141 162 HB3 PRO 572 HB1 PRO 572 -14.010 7.403 -7.624 163 HG2 PRO 572 HG2 PRO 572 -12.712 9.512 -6.668 164 HG3 PRO 572 HG1 PRO 572 -14.336 9.689 -7.355 165 HD2 PRO 572 HD2 PRO 572 -13.486 9.649 -4.493 166 HD3 PRO 572 HD1 PRO 572 -14.724 10.638 -5.278 167 HA PRO 573 HA PRO 573 -16.103 3.854 -4.008 168 HB2 PRO 573 HB2 PRO 573 -16.763 2.045 -5.817 169 HB3 PRO 573 HB1 PRO 573 -17.828 3.419 -5.486 170 HG2 PRO 573 HG2 PRO 573 -15.836 3.075 -7.703 171 HG3 PRO 573 HG1 PRO 573 -17.511 3.615 -7.789 172 HD2 PRO 573 HD2 PRO 573 -15.399 5.327 -7.748 173 HD3 PRO 573 HD1 PRO 573 -17.006 5.741 -7.122 174 H TYR 574 HN TYR 574 -13.557 4.282 -6.161 175 HA TYR 574 HA TYR 574 -12.478 1.710 -6.325 176 HB2 TYR 574 HB2 TYR 574 -11.785 3.611 -7.706 177 HB3 TYR 574 HB1 TYR 574 -10.924 4.280 -6.340 178 HD1 TYR 574 HD1 TYR 574 -11.142 0.943 -8.009 179 HD2 TYR 574 HD2 TYR 574 -8.634 4.048 -6.560 180 HE1 TYR 574 HE1 TYR 574 -9.166 -0.326 -8.732 181 HE2 TYR 574 HE2 TYR 574 -6.650 2.786 -7.264 182 HH TYR 574 HH TYR 574 -6.836 0.089 -9.327 183 H PHE 575 HN PHE 575 -10.597 4.089 -4.535 184 HA PHE 575 HA PHE 575 -10.329 2.099 -2.371 185 HB2 PHE 575 HB2 PHE 575 -8.028 2.519 -2.222 186 HB3 PHE 575 HB1 PHE 575 -8.314 2.497 -3.958 187 HD1 PHE 575 HD1 PHE 575 -8.913 4.895 -4.956 188 HD2 PHE 575 HD2 PHE 575 -6.759 4.186 -1.361 189 HE1 PHE 575 HE1 PHE 575 -7.924 7.136 -5.113 190 HE2 PHE 575 HE2 PHE 575 -5.768 6.429 -1.509 191 HZ PHE 575 HZ PHE 575 -6.366 7.905 -3.377 192 H MET 576 HN MET 576 -11.667 4.891 -3.128 193 HA MET 576 HA MET 576 -10.740 6.686 -1.117 194 HB2 MET 576 HB2 MET 576 -13.426 6.732 -2.484 195 HB3 MET 576 HB1 MET 576 -12.590 8.080 -1.729 196 HG2 MET 576 HG2 MET 576 -11.483 6.616 -4.098 197 HG3 MET 576 HG1 MET 576 -12.575 7.985 -4.246 198 HE1 MET 576 HE1 MET 576 -9.215 9.612 -5.280 199 HE2 MET 576 HE2 MET 576 -10.927 9.439 -5.665 200 HE3 MET 576 HE3 MET 576 -9.868 8.030 -5.704 201 H LYS 577 HN LYS 577 -12.229 7.567 0.590 202 HA LYS 577 HA LYS 577 -12.751 5.628 2.492 203 HB2 LYS 577 HB2 LYS 577 -12.441 8.067 2.927 204 HB3 LYS 577 HB1 LYS 577 -14.080 8.335 2.340 205 HG2 LYS 577 HG2 LYS 577 -14.886 6.789 4.128 206 HG3 LYS 577 HG1 LYS 577 -13.242 6.765 4.767 207 HD2 LYS 577 HD2 LYS 577 -13.354 9.236 4.989 208 HD3 LYS 577 HD1 LYS 577 -15.044 9.165 4.483 209 HE2 LYS 577 HE2 LYS 577 -14.973 9.270 6.874 210 HE3 LYS 577 HE1 LYS 577 -15.492 7.653 6.404 211 HZ1 LYS 577 HZ1 LYS 577 -13.866 7.587 8.185 212 HZ2 LYS 577 HZ2 LYS 577 -12.746 8.413 7.231 213 HZ3 LYS 577 HZ3 LYS 577 -13.240 6.853 6.792 214 H GLY 578 HN GLY 578 -14.400 4.345 2.988 215 HA2 GLY 578 HA2 GLY 578 -16.661 3.819 3.314 216 HA3 GLY 578 HA1 GLY 578 -17.098 5.010 2.111 217 H SER 579 HN SER 579 -14.708 3.482 0.613 218 HA SER 579 HA SER 579 -16.396 1.937 -1.036 219 HB2 SER 579 HB2 SER 579 -14.353 2.832 -1.954 220 HB3 SER 579 HB1 SER 579 -13.386 1.962 -0.770 221 HG SER 579 HG SER 579 -13.727 1.074 -3.039 222 H ILE 580 HN ILE 580 -16.776 -0.210 -1.134 223 HA ILE 580 HA ILE 580 -15.937 -1.814 1.157 224 HB ILE 580 HB ILE 580 -18.040 -2.280 -0.958 225 HG12 ILE 580 HG12 ILE 580 -18.688 -0.739 0.815 226 HG13 ILE 580 HG11 ILE 580 -19.566 -2.254 0.989 227 HG21 ILE 580 HG21 ILE 580 -16.944 -4.397 -0.479 228 HG22 ILE 580 HG22 ILE 580 -18.576 -4.372 0.192 229 HG23 ILE 580 HG23 ILE 580 -17.184 -4.144 1.251 230 HD11 ILE 580 HD11 ILE 580 -17.207 -1.325 2.612 231 HD12 ILE 580 HD12 ILE 580 -17.922 -2.934 2.723 232 HD13 ILE 580 HD13 ILE 580 -18.877 -1.514 3.152 233 H ILE 581 HN ILE 581 -14.040 -2.691 0.884 234 HA ILE 581 HA ILE 581 -13.101 -3.390 -1.779 235 HB ILE 581 HB ILE 581 -11.614 -3.614 0.837 236 HG12 ILE 581 HG12 ILE 581 -12.392 -1.314 0.549 237 HG13 ILE 581 HG11 ILE 581 -10.653 -1.405 0.333 238 HG21 ILE 581 HG21 ILE 581 -9.632 -3.447 -0.581 239 HG22 ILE 581 HG22 ILE 581 -10.666 -3.388 -2.008 240 HG23 ILE 581 HG23 ILE 581 -10.626 -4.840 -1.005 241 HD11 ILE 581 HD11 ILE 581 -11.607 0.082 -1.286 242 HD12 ILE 581 HD12 ILE 581 -12.718 -1.171 -1.839 243 HD13 ILE 581 HD13 ILE 581 -10.981 -1.353 -2.097 244 H GLN 582 HN GLN 582 -13.083 -5.414 -2.535 245 HA GLN 582 HA GLN 582 -13.949 -7.535 -0.706 246 HB2 GLN 582 HB2 GLN 582 -15.357 -7.191 -2.635 247 HB3 GLN 582 HB1 GLN 582 -14.013 -7.394 -3.714 248 HG2 GLN 582 HG2 GLN 582 -13.769 -9.731 -2.682 249 HG3 GLN 582 HG1 GLN 582 -15.387 -9.464 -2.044 250 HE21 GLN 582 HE21 GLN 582 -16.358 -11.054 -3.252 251 HE22 GLN 582 HE22 GLN 582 -16.530 -10.969 -4.969 252 H LEU 583 HN LEU 583 -12.533 -8.927 -0.002 253 HA LEU 583 HA LEU 583 -9.876 -8.999 -1.137 254 HB2 LEU 583 HB2 LEU 583 -11.010 -10.686 1.082 255 HB3 LEU 583 HB1 LEU 583 -9.316 -10.407 0.726 256 HG LEU 583 HG LEU 583 -11.258 -8.308 1.678 257 HD11 LEU 583 HD11 LEU 583 -10.147 -8.457 3.791 258 HD12 LEU 583 HD12 LEU 583 -8.984 -9.620 3.150 259 HD13 LEU 583 HD13 LEU 583 -10.680 -10.079 3.335 260 HD21 LEU 583 HD21 LEU 583 -8.270 -8.189 1.264 261 HD22 LEU 583 HD22 LEU 583 -9.287 -6.897 1.898 262 HD23 LEU 583 HD23 LEU 583 -9.477 -7.429 0.224 263 H ALA 584 HN ALA 584 -8.829 -11.268 -1.349 264 HA ALA 584 HA ALA 584 -10.022 -12.536 -3.524 265 HB1 ALA 584 HB1 ALA 584 -8.319 -14.237 -3.317 266 HB2 ALA 584 HB2 ALA 584 -7.975 -13.730 -1.663 267 HB3 ALA 584 HB3 ALA 584 -7.618 -12.647 -3.011 268 H ASN 585 HN ASN 585 -10.211 -13.240 -0.094 269 HA ASN 585 HA ASN 585 -11.467 -15.789 -0.431 270 HB2 ASN 585 HB2 ASN 585 -11.753 -15.737 2.000 271 HB3 ASN 585 HB1 ASN 585 -10.107 -15.345 1.535 272 HD21 ASN 585 HD21 ASN 585 -11.247 -14.780 4.014 273 HD22 ASN 585 HD22 ASN 585 -11.294 -13.054 4.207 274 H GLY 586 HN GLY 586 -12.542 -12.580 -0.617 275 HA2 GLY 586 HA2 GLY 586 -14.732 -12.267 -1.585 276 HA3 GLY 586 HA1 GLY 586 -15.313 -13.574 -0.570 277 H GLU 587 HN GLU 587 -13.314 -11.792 1.351 278 HA GLU 587 HA GLU 587 -15.412 -10.790 2.910 279 HB2 GLU 587 HB2 GLU 587 -12.493 -10.193 2.919 280 HB3 GLU 587 HB1 GLU 587 -13.600 -9.476 4.075 281 HG2 GLU 587 HG2 GLU 587 -14.306 -11.833 4.599 282 HG3 GLU 587 HG1 GLU 587 -12.874 -12.340 3.703 283 H LEU 588 HN LEU 588 -16.133 -8.818 3.353 284 HA LEU 588 HA LEU 588 -15.557 -6.726 1.362 285 HB2 LEU 588 HB2 LEU 588 -18.231 -7.352 2.611 286 HB3 LEU 588 HB1 LEU 588 -17.910 -6.159 1.367 287 HG LEU 588 HG LEU 588 -17.583 -9.141 1.029 288 HD11 LEU 588 HD11 LEU 588 -19.729 -7.275 0.021 289 HD12 LEU 588 HD12 LEU 588 -19.922 -8.511 1.263 290 HD13 LEU 588 HD13 LEU 588 -19.563 -8.980 -0.399 291 HD21 LEU 588 HD21 LEU 588 -16.056 -8.064 -0.421 292 HD22 LEU 588 HD22 LEU 588 -17.216 -6.800 -0.819 293 HD23 LEU 588 HD23 LEU 588 -17.468 -8.440 -1.413 294 H LYS 589 HN LYS 589 -14.326 -5.374 2.543 295 HA LYS 589 HA LYS 589 -15.363 -4.483 5.146 296 HB2 LYS 589 HB2 LYS 589 -12.450 -4.962 4.505 297 HB3 LYS 589 HB1 LYS 589 -13.138 -4.556 6.064 298 HG2 LYS 589 HG2 LYS 589 -14.164 -6.680 6.268 299 HG3 LYS 589 HG1 LYS 589 -13.819 -7.076 4.588 300 HD2 LYS 589 HD2 LYS 589 -12.201 -8.277 5.709 301 HD3 LYS 589 HD1 LYS 589 -11.337 -6.797 5.300 302 HE2 LYS 589 HE2 LYS 589 -12.759 -6.904 7.902 303 HE3 LYS 589 HE1 LYS 589 -11.286 -7.851 7.731 304 HZ1 LYS 589 HZ1 LYS 589 -10.751 -5.721 8.615 305 HZ2 LYS 589 HZ2 LYS 589 -11.565 -4.918 7.373 306 HZ3 LYS 589 HZ3 LYS 589 -10.149 -5.798 7.032 307 H LYS 590 HN LYS 590 -14.938 -2.321 5.674 308 HA LYS 590 HA LYS 590 -14.752 -0.512 3.503 309 HB2 LYS 590 HB2 LYS 590 -14.640 -0.127 6.489 310 HB3 LYS 590 HB1 LYS 590 -14.501 1.215 5.368 311 HG2 LYS 590 HG2 LYS 590 -16.817 -0.647 5.198 312 HG3 LYS 590 HG1 LYS 590 -16.791 0.632 6.409 313 HD2 LYS 590 HD2 LYS 590 -16.513 2.295 4.653 314 HD3 LYS 590 HD1 LYS 590 -16.487 1.027 3.429 315 HE2 LYS 590 HE2 LYS 590 -18.681 2.011 3.500 316 HE3 LYS 590 HE1 LYS 590 -18.758 0.367 4.129 317 HZ1 LYS 590 HZ1 LYS 590 -20.041 1.946 5.465 318 HZ2 LYS 590 HZ2 LYS 590 -18.630 2.813 5.805 319 HZ3 LYS 590 HZ3 LYS 590 -18.800 1.227 6.361 320 H VAL 591 HN VAL 591 -13.108 0.919 2.944 321 HA VAL 591 HA VAL 591 -10.686 -0.254 2.479 322 HB VAL 591 HB VAL 591 -10.905 2.725 2.777 323 HG11 VAL 591 HG11 VAL 591 -8.719 1.906 2.219 324 HG12 VAL 591 HG12 VAL 591 -9.422 2.699 0.804 325 HG13 VAL 591 HG13 VAL 591 -9.382 0.940 0.898 326 HG21 VAL 591 HG21 VAL 591 -12.909 2.048 1.625 327 HG22 VAL 591 HG22 VAL 591 -11.967 1.055 0.513 328 HG23 VAL 591 HG23 VAL 591 -11.792 2.812 0.495 329 H GLU 592 HN GLU 592 -11.410 2.065 5.062 330 HA GLU 592 HA GLU 592 -8.685 2.275 5.888 331 HB2 GLU 592 HB2 GLU 592 -9.620 3.647 7.730 332 HB3 GLU 592 HB1 GLU 592 -10.177 4.153 6.141 333 HG2 GLU 592 HG2 GLU 592 -12.247 2.773 6.569 334 HG3 GLU 592 HG1 GLU 592 -11.696 2.635 8.235 335 H ASP 593 HN ASP 593 -11.004 -0.064 6.430 336 HA ASP 593 HA ASP 593 -10.076 -0.681 9.139 337 HB2 ASP 593 HB2 ASP 593 -12.407 -0.673 9.144 338 HB3 ASP 593 HB1 ASP 593 -12.515 -1.373 7.535 339 H LEU 594 HN LEU 594 -9.622 -1.628 5.936 340 HA LEU 594 HA LEU 594 -9.131 -4.361 6.158 341 HB2 LEU 594 HB2 LEU 594 -7.772 -2.326 4.396 342 HB3 LEU 594 HB1 LEU 594 -7.719 -4.063 4.165 343 HG LEU 594 HG LEU 594 -10.338 -2.589 4.183 344 HD11 LEU 594 HD11 LEU 594 -8.938 -1.491 2.547 345 HD12 LEU 594 HD12 LEU 594 -10.173 -2.473 1.759 346 HD13 LEU 594 HD13 LEU 594 -8.511 -3.051 1.843 347 HD21 LEU 594 HD21 LEU 594 -10.381 -5.034 4.353 348 HD22 LEU 594 HD22 LEU 594 -9.418 -5.146 2.882 349 HD23 LEU 594 HD23 LEU 594 -11.048 -4.476 2.817 350 H LYS 595 HN LYS 595 -7.642 -5.465 7.158 351 HA LYS 595 HA LYS 595 -5.318 -4.043 8.267 352 HB2 LYS 595 HB2 LYS 595 -6.393 -6.748 9.067 353 HB3 LYS 595 HB1 LYS 595 -5.163 -5.815 9.903 354 HG2 LYS 595 HG2 LYS 595 -8.060 -5.055 9.607 355 HG3 LYS 595 HG1 LYS 595 -7.302 -5.711 11.056 356 HD2 LYS 595 HD2 LYS 595 -5.893 -3.751 11.245 357 HD3 LYS 595 HD1 LYS 595 -6.539 -3.112 9.732 358 HE2 LYS 595 HE2 LYS 595 -8.786 -3.057 10.767 359 HE3 LYS 595 HE1 LYS 595 -8.068 -3.588 12.285 360 HZ1 LYS 595 HZ1 LYS 595 -7.353 -1.087 10.860 361 HZ2 LYS 595 HZ2 LYS 595 -6.770 -1.582 12.369 362 HZ3 LYS 595 HZ3 LYS 595 -8.402 -1.177 12.182 363 H THR 596 HN THR 596 -3.290 -5.469 8.412 364 HA THR 596 HA THR 596 -2.524 -6.131 5.810 365 HB THR 596 HB THR 596 -0.890 -5.527 7.525 366 HG1 THR 596 HG1 THR 596 0.346 -7.773 7.118 367 HG21 THR 596 HG21 THR 596 -1.852 -6.689 9.434 368 HG22 THR 596 HG22 THR 596 -0.167 -7.166 9.191 369 HG23 THR 596 HG23 THR 596 -1.472 -8.244 8.690 370 H GLU 597 HN GLU 597 -3.688 -8.185 8.441 371 HA GLU 597 HA GLU 597 -3.137 -10.686 7.355 372 HB2 GLU 597 HB2 GLU 597 -5.446 -9.842 9.081 373 HB3 GLU 597 HB1 GLU 597 -5.002 -11.509 8.761 374 HG2 GLU 597 HG2 GLU 597 -2.916 -11.228 9.896 375 HG3 GLU 597 HG1 GLU 597 -3.203 -9.497 10.082 376 H ASP 598 HN ASP 598 -5.660 -8.416 6.611 377 HA ASP 598 HA ASP 598 -7.436 -10.126 5.263 378 HB2 ASP 598 HB2 ASP 598 -6.873 -7.179 4.893 379 HB3 ASP 598 HB1 ASP 598 -8.186 -8.026 4.090 380 H PHE 599 HN PHE 599 -4.812 -8.070 4.044 381 HA PHE 599 HA PHE 599 -5.069 -9.045 1.371 382 HB2 PHE 599 HB2 PHE 599 -3.017 -7.306 2.735 383 HB3 PHE 599 HB1 PHE 599 -2.818 -7.845 1.071 384 HD1 PHE 599 HD2 PHE 599 -5.822 -6.666 2.952 385 HD2 PHE 599 HD1 PHE 599 -3.181 -6.059 -0.328 386 HE1 PHE 599 HE2 PHE 599 -7.251 -4.835 2.146 387 HE2 PHE 599 HE1 PHE 599 -4.609 -4.230 -1.140 388 HZ PHE 599 HZ PHE 599 -6.646 -3.614 0.095 389 H ILE 600 HN ILE 600 -2.988 -9.765 4.120 390 HA ILE 600 HA ILE 600 -1.195 -11.506 2.947 391 HB ILE 600 HB ILE 600 -2.457 -11.504 5.674 392 HG12 ILE 600 HG12 ILE 600 0.302 -10.738 4.709 393 HG13 ILE 600 HG11 ILE 600 -1.004 -9.613 5.023 394 HG21 ILE 600 HG21 ILE 600 -1.798 -13.779 5.289 395 HG22 ILE 600 HG22 ILE 600 -0.613 -13.027 6.362 396 HG23 ILE 600 HG23 ILE 600 -0.232 -13.263 4.657 397 HD11 ILE 600 HD11 ILE 600 0.608 -9.669 6.846 398 HD12 ILE 600 HD12 ILE 600 0.281 -11.389 7.074 399 HD13 ILE 600 HD13 ILE 600 -0.992 -10.203 7.364 400 H GLN 601 HN GLN 601 -4.287 -12.378 4.503 401 HA GLN 601 HA GLN 601 -4.201 -15.081 3.818 402 HB2 GLN 601 HB2 GLN 601 -6.497 -13.247 4.461 403 HB3 GLN 601 HB1 GLN 601 -6.733 -14.957 4.123 404 HG2 GLN 601 HG2 GLN 601 -5.255 -15.523 5.971 405 HG3 GLN 601 HG1 GLN 601 -5.039 -13.808 6.325 406 HE21 GLN 601 HE21 GLN 601 -6.757 -12.634 7.178 407 HE22 GLN 601 HE22 GLN 601 -8.120 -13.402 7.913 408 H SER 602 HN SER 602 -5.815 -12.373 2.167 409 HA SER 602 HA SER 602 -7.130 -13.850 0.222 410 HB2 SER 602 HB2 SER 602 -6.941 -11.710 -1.161 411 HB3 SER 602 HB1 SER 602 -7.686 -11.574 0.418 412 HG SER 602 HG SER 602 -5.983 -10.530 1.188 413 H ALA 603 HN ALA 603 -3.928 -12.363 0.035 414 HA ALA 603 HA ALA 603 -3.251 -13.305 -2.517 415 HB1 ALA 603 HB1 ALA 603 -1.449 -12.642 -0.196 416 HB2 ALA 603 HB2 ALA 603 -1.989 -11.537 -1.463 417 HB3 ALA 603 HB3 ALA 603 -0.913 -12.876 -1.859 418 H GLU 604 HN GLU 604 -2.888 -14.812 0.659 419 HA GLU 604 HA GLU 604 -1.344 -17.023 -0.222 420 HB2 GLU 604 HB2 GLU 604 -3.044 -16.551 2.220 421 HB3 GLU 604 HB1 GLU 604 -2.052 -17.991 1.990 422 HG2 GLU 604 HG2 GLU 604 -0.915 -15.228 1.825 423 HG3 GLU 604 HG1 GLU 604 -1.080 -16.085 3.350 424 H ILE 605 HN ILE 605 -4.802 -16.535 0.251 425 HA ILE 605 HA ILE 605 -5.603 -19.207 -0.268 426 HB ILE 605 HB ILE 605 -7.202 -16.659 -0.615 427 HG12 ILE 605 HG12 ILE 605 -7.086 -18.443 1.814 428 HG13 ILE 605 HG11 ILE 605 -6.087 -17.008 1.638 429 HG21 ILE 605 HG21 ILE 605 -8.108 -19.497 -0.133 430 HG22 ILE 605 HG22 ILE 605 -8.266 -18.601 -1.645 431 HG23 ILE 605 HG23 ILE 605 -9.155 -18.081 -0.213 432 HD11 ILE 605 HD11 ILE 605 -9.090 -17.109 1.733 433 HD12 ILE 605 HD12 ILE 605 -8.136 -15.657 1.426 434 HD13 ILE 605 HD13 ILE 605 -7.998 -16.490 2.980 435 H SER 606 HN SER 606 -4.438 -16.746 -2.263 436 HA SER 606 HA SER 606 -5.629 -17.946 -4.667 437 HB2 SER 606 HB2 SER 606 -4.318 -15.239 -4.389 438 HB3 SER 606 HB1 SER 606 -5.233 -15.841 -5.774 439 HG SER 606 HG SER 606 -6.156 -15.102 -3.210 440 H ASN 607 HN ASN 607 -4.174 -17.818 -6.603 441 HA ASN 607 HA ASN 607 -1.448 -18.643 -5.855 442 HB2 ASN 607 HB2 ASN 607 -3.011 -19.339 -8.350 443 HB3 ASN 607 HB1 ASN 607 -1.425 -19.963 -7.912 444 HD21 ASN 607 HD21 ASN 607 -4.832 -20.144 -7.363 445 HD22 ASN 607 HD22 ASN 607 -4.810 -21.563 -6.374 446 H ASP 608 HN ASP 608 -3.395 -16.517 -7.763 447 HA ASP 608 HA ASP 608 -1.203 -15.651 -9.429 448 HB2 ASP 608 HB2 ASP 608 -2.833 -14.104 -10.425 449 HB3 ASP 608 HB1 ASP 608 -3.445 -15.753 -10.392 450 H LEU 609 HN LEU 609 -2.659 -14.693 -6.428 451 HA LEU 609 HA LEU 609 -1.072 -12.230 -6.456 452 HB2 LEU 609 HB2 LEU 609 -3.035 -13.207 -4.401 453 HB3 LEU 609 HB1 LEU 609 -2.218 -11.663 -4.380 454 HG LEU 609 HG LEU 609 -4.216 -11.029 -5.201 455 HD11 LEU 609 HD11 LEU 609 -2.572 -10.390 -6.845 456 HD12 LEU 609 HD12 LEU 609 -4.143 -10.688 -7.589 457 HD13 LEU 609 HD13 LEU 609 -2.860 -11.892 -7.724 458 HD21 LEU 609 HD21 LEU 609 -4.474 -13.630 -6.666 459 HD22 LEU 609 HD22 LEU 609 -5.680 -12.344 -6.636 460 HD23 LEU 609 HD23 LEU 609 -5.265 -13.198 -5.150 461 H LYS 610 HN LYS 610 0.414 -11.767 -4.810 462 HA LYS 610 HA LYS 610 1.146 -13.846 -2.912 463 HB2 LYS 610 HB2 LYS 610 3.142 -12.747 -4.902 464 HB3 LYS 610 HB1 LYS 610 3.538 -13.777 -3.536 465 HG2 LYS 610 HG2 LYS 610 2.193 -15.575 -4.527 466 HG3 LYS 610 HG1 LYS 610 1.845 -14.539 -5.909 467 HD2 LYS 610 HD2 LYS 610 4.572 -15.490 -5.038 468 HD3 LYS 610 HD1 LYS 610 3.651 -16.104 -6.409 469 HE2 LYS 610 HE2 LYS 610 3.736 -13.876 -7.442 470 HE3 LYS 610 HE1 LYS 610 4.691 -13.291 -6.081 471 HZ1 LYS 610 HZ1 LYS 610 6.109 -13.846 -7.932 472 HZ2 LYS 610 HZ2 LYS 610 5.490 -15.417 -7.992 473 HZ3 LYS 610 HZ3 LYS 610 6.402 -14.918 -6.657 474 H ILE 611 HN ILE 611 2.076 -13.029 -1.063 475 HA ILE 611 HA ILE 611 2.227 -10.119 -0.827 476 HB ILE 611 HB ILE 611 2.384 -12.273 1.266 477 HG12 ILE 611 HG12 ILE 611 0.188 -11.717 -0.052 478 HG13 ILE 611 HG11 ILE 611 0.150 -11.971 1.680 479 HG21 ILE 611 HG21 ILE 611 2.157 -9.305 1.647 480 HG22 ILE 611 HG22 ILE 611 3.599 -10.271 1.955 481 HG23 ILE 611 HG23 ILE 611 2.144 -10.520 2.920 482 HD11 ILE 611 HD11 ILE 611 0.226 -9.296 0.305 483 HD12 ILE 611 HD12 ILE 611 0.132 -9.561 2.047 484 HD13 ILE 611 HD13 ILE 611 -1.206 -10.053 1.005 485 H ASP 612 HN ASP 612 4.064 -9.062 -0.096 486 HA ASP 612 HA ASP 612 6.477 -10.648 0.437 487 HB2 ASP 612 HB2 ASP 612 6.379 -9.607 -1.969 488 HB3 ASP 612 HB1 ASP 612 6.724 -8.097 -1.122 489 H SER 613 HN SER 613 8.145 -9.353 1.584 490 HA SER 613 HA SER 613 7.014 -7.051 3.020 491 HB2 SER 613 HB2 SER 613 8.619 -9.296 4.275 492 HB3 SER 613 HB1 SER 613 7.998 -7.871 5.111 493 HG SER 613 HG SER 613 5.929 -8.906 3.917 494 H SER 614 HN SER 614 8.255 -5.327 2.648 495 HA SER 614 HA SER 614 11.171 -5.712 2.521 496 HB2 SER 614 HB2 SER 614 9.628 -3.858 0.691 497 HB3 SER 614 HB1 SER 614 11.353 -4.197 0.652 498 HG SER 614 HG SER 614 9.903 -6.481 0.509 499 H THR 615 HN THR 615 12.232 -4.426 3.898 500 HA THR 615 HA THR 615 10.714 -2.497 5.437 501 HB THR 615 HB THR 615 13.629 -3.222 5.746 502 HG1 THR 615 HG1 THR 615 12.809 -4.741 7.325 503 HG21 THR 615 HG21 THR 615 11.589 -2.108 7.682 504 HG22 THR 615 HG22 THR 615 12.935 -1.223 6.964 505 HG23 THR 615 HG23 THR 615 13.248 -2.547 8.086 506 H VAL 616 HN VAL 616 10.537 -0.447 4.676 507 HA VAL 616 HA VAL 616 12.346 0.787 2.936 508 HB VAL 616 HB VAL 616 10.267 1.800 2.990 509 HG11 VAL 616 HG11 VAL 616 9.436 0.883 5.061 510 HG12 VAL 616 HG12 VAL 616 9.149 2.621 5.008 511 HG13 VAL 616 HG13 VAL 616 10.464 1.976 5.981 512 HG21 VAL 616 HG21 VAL 616 12.198 3.478 4.562 513 HG22 VAL 616 HG22 VAL 616 10.639 4.096 4.015 514 HG23 VAL 616 HG23 VAL 616 11.836 3.552 2.836 515 H GLU 617 HN GLU 617 14.312 1.450 3.236 516 HA GLU 617 HA GLU 617 15.387 1.746 5.922 517 HB2 GLU 617 HB2 GLU 617 16.693 1.608 3.219 518 HB3 GLU 617 HB1 GLU 617 17.560 1.713 4.744 519 HG2 GLU 617 HG2 GLU 617 15.584 -0.469 4.344 520 HG3 GLU 617 HG1 GLU 617 17.167 -0.579 3.582 521 H ARG 618 HN ARG 618 14.405 3.684 3.256 522 HA ARG 618 HA ARG 618 15.155 6.094 4.609 523 HB2 ARG 618 HB2 ARG 618 17.317 5.398 3.593 524 HB3 ARG 618 HB1 ARG 618 16.561 5.439 2.009 525 HG2 ARG 618 HG2 ARG 618 16.175 7.834 2.245 526 HG3 ARG 618 HG1 ARG 618 16.915 7.798 3.847 527 HD2 ARG 618 HD2 ARG 618 18.276 7.097 1.246 528 HD3 ARG 618 HD1 ARG 618 18.491 8.591 2.156 529 HE ARG 618 HE ARG 618 19.158 6.717 3.967 530 HH11 ARG 618 HH11 ARG 618 20.171 7.279 0.664 531 HH12 ARG 618 HH12 ARG 618 21.738 6.567 0.888 532 HH21 ARG 618 HH21 ARG 618 21.238 5.803 4.275 533 HH22 ARG 618 HH22 ARG 618 22.347 5.731 2.943 534 H ILE 619 HN ILE 619 14.162 7.917 3.712 535 HA ILE 619 HA ILE 619 12.451 7.443 1.368 536 HB ILE 619 HB ILE 619 11.668 8.710 3.995 537 HG12 ILE 619 HG12 ILE 619 10.369 6.514 2.379 538 HG13 ILE 619 HG11 ILE 619 11.501 6.228 3.697 539 HG21 ILE 619 HG21 ILE 619 10.881 10.156 2.187 540 HG22 ILE 619 HG22 ILE 619 9.531 9.311 2.945 541 HG23 ILE 619 HG23 ILE 619 10.146 8.769 1.384 542 HD11 ILE 619 HD11 ILE 619 8.882 7.685 3.964 543 HD12 ILE 619 HD12 ILE 619 9.987 7.237 5.267 544 HD13 ILE 619 HD13 ILE 619 9.142 5.986 4.353 545 H GLU 620 HN GLU 620 12.763 8.889 -0.176 546 HA GLU 620 HA GLU 620 13.968 11.480 0.568 547 HB2 GLU 620 HB2 GLU 620 14.459 10.043 -2.035 548 HB3 GLU 620 HB1 GLU 620 15.315 11.435 -1.395 549 HG2 GLU 620 HG2 GLU 620 16.148 9.972 0.449 550 HG3 GLU 620 HG1 GLU 620 15.426 8.604 -0.401 551 H ASP 621 HN ASP 621 13.049 13.275 -0.289 552 HA ASP 621 HA ASP 621 10.683 12.942 -1.946 553 HB2 ASP 621 HB2 ASP 621 10.391 15.376 -1.653 554 HB3 ASP 621 HB1 ASP 621 10.560 14.549 -0.109 555 H SER 622 HN SER 622 10.457 13.819 -4.020 556 HA SER 622 HA SER 622 13.012 13.848 -5.447 557 HB2 SER 622 HB2 SER 622 11.203 12.220 -6.062 558 HB3 SER 622 HB1 SER 622 10.220 13.588 -6.582 559 HG SER 622 HG SER 622 12.206 14.086 -7.927 560 H HIS 623 HN HIS 623 11.290 16.160 -4.091 561 HA HIS 623 HA HIS 623 10.829 18.356 -4.430 562 HB2 HIS 623 HB2 HIS 623 13.071 18.014 -6.417 563 HB3 HIS 623 HB1 HIS 623 12.322 19.573 -6.093 564 HD1 HIS 623 HD1 HIS 623 15.215 17.849 -5.223 565 HD2 HIS 623 HD2 HIS 623 12.365 19.893 -2.992 566 HE1 HIS 623 HE1 HIS 623 16.350 18.447 -3.060 567 HE2 HIS 623 HE2 HIS 623 14.554 19.529 -1.663 568 H SER 624 HN SER 624 9.476 16.272 -5.993 569 HA SER 624 HA SER 624 8.359 17.961 -8.129 570 HB2 SER 624 HB2 SER 624 8.371 14.933 -7.951 571 HB3 SER 624 HB1 SER 624 7.734 15.894 -9.281 572 HG SER 624 HG SER 624 10.351 16.440 -8.610 573 HA PRO 625 HA PRO 625 4.622 18.392 -5.946 574 HB2 PRO 625 HB2 PRO 625 3.241 17.180 -8.266 575 HB3 PRO 625 HB1 PRO 625 2.907 18.699 -7.438 576 HG2 PRO 625 HG2 PRO 625 4.157 18.632 -9.816 577 HG3 PRO 625 HG1 PRO 625 4.539 19.845 -8.583 578 HD2 PRO 625 HD2 PRO 625 6.118 17.512 -9.480 579 HD3 PRO 625 HD1 PRO 625 6.655 19.019 -8.721 580 H GLY 626 HN GLY 626 4.532 17.081 -4.321 581 HA2 GLY 626 HA2 GLY 626 3.917 15.336 -2.995 582 HA3 GLY 626 HA1 GLY 626 2.730 14.970 -4.236 583 H VAL 627 HN VAL 627 6.237 14.879 -4.768 584 HA VAL 627 HA VAL 627 5.917 11.973 -5.197 585 HB VAL 627 HB VAL 627 7.966 13.776 -6.486 586 HG11 VAL 627 HG11 VAL 627 8.716 11.466 -6.273 587 HG12 VAL 627 HG12 VAL 627 8.372 11.854 -7.959 588 HG13 VAL 627 HG13 VAL 627 7.224 10.899 -7.021 589 HG21 VAL 627 HG21 VAL 627 6.602 13.365 -8.545 590 HG22 VAL 627 HG22 VAL 627 5.831 14.385 -7.328 591 HG23 VAL 627 HG23 VAL 627 5.352 12.693 -7.492 592 H ALA 628 HN ALA 628 7.085 10.595 -4.077 593 HA ALA 628 HA ALA 628 9.686 11.386 -3.031 594 HB1 ALA 628 HB1 ALA 628 8.116 11.887 -1.199 595 HB2 ALA 628 HB2 ALA 628 9.213 10.570 -0.786 596 HB3 ALA 628 HB3 ALA 628 7.546 10.219 -1.244 597 H VAL 629 HN VAL 629 11.110 9.746 -2.994 598 HA VAL 629 HA VAL 629 10.147 7.167 -3.980 599 HB VAL 629 HB VAL 629 11.820 7.762 -5.436 600 HG11 VAL 629 HG11 VAL 629 13.863 8.919 -4.845 601 HG12 VAL 629 HG12 VAL 629 13.429 8.839 -3.137 602 HG13 VAL 629 HG13 VAL 629 12.449 9.795 -4.254 603 HG21 VAL 629 HG21 VAL 629 13.336 6.310 -3.264 604 HG22 VAL 629 HG22 VAL 629 13.819 6.430 -4.957 605 HG23 VAL 629 HG23 VAL 629 12.350 5.556 -4.520 606 H ILE 630 HN ILE 630 9.990 5.530 -2.707 607 HA ILE 630 HA ILE 630 11.129 5.662 -0.035 608 HB ILE 630 HB ILE 630 9.353 3.485 -1.102 609 HG12 ILE 630 HG12 ILE 630 8.246 5.649 -1.534 610 HG13 ILE 630 HG11 ILE 630 7.418 4.720 -0.292 611 HG21 ILE 630 HG21 ILE 630 8.721 3.267 1.247 612 HG22 ILE 630 HG22 ILE 630 9.820 4.583 1.657 613 HG23 ILE 630 HG23 ILE 630 10.458 3.070 1.016 614 HD11 ILE 630 HD11 ILE 630 7.527 7.066 0.292 615 HD12 ILE 630 HD12 ILE 630 9.287 7.021 0.181 616 HD13 ILE 630 HD13 ILE 630 8.458 6.089 1.428 617 H GLN 631 HN GLN 631 13.077 4.789 0.272 618 HA GLN 631 HA GLN 631 14.098 2.797 -1.597 619 HB2 GLN 631 HB2 GLN 631 15.530 4.702 -0.943 620 HB3 GLN 631 HB1 GLN 631 15.456 4.174 0.732 621 HG2 GLN 631 HG2 GLN 631 16.556 2.068 0.086 622 HG3 GLN 631 HG1 GLN 631 16.689 2.671 -1.565 623 HE21 GLN 631 HE21 GLN 631 17.853 2.932 1.686 624 HE22 GLN 631 HE22 GLN 631 19.238 3.902 1.332 625 H PHE 632 HN PHE 632 13.897 0.712 -1.201 626 HA PHE 632 HA PHE 632 13.252 -0.148 1.541 627 HB2 PHE 632 HB2 PHE 632 12.550 -1.354 -1.131 628 HB3 PHE 632 HB1 PHE 632 12.262 -2.159 0.404 629 HD1 PHE 632 HD1 PHE 632 10.610 -1.273 1.971 630 HD2 PHE 632 HD2 PHE 632 11.147 0.401 -1.900 631 HE1 PHE 632 HE1 PHE 632 8.419 -0.177 2.144 632 HE2 PHE 632 HE2 PHE 632 8.956 1.502 -1.734 633 HZ PHE 632 HZ PHE 632 7.587 1.213 0.293 634 H ALA 633 HN ALA 633 14.076 -2.037 2.361 635 HA ALA 633 HA ALA 633 16.271 -3.322 0.875 636 HB1 ALA 633 HB1 ALA 633 15.789 -3.088 3.845 637 HB2 ALA 633 HB2 ALA 633 17.114 -2.387 2.917 638 HB3 ALA 633 HB3 ALA 633 17.012 -4.133 3.126 639 H VAL 634 HN VAL 634 15.239 -4.913 -0.184 640 HA VAL 634 HA VAL 634 12.974 -6.278 1.006 641 HB VAL 634 HB VAL 634 14.302 -6.752 -1.658 642 HG11 VAL 634 HG11 VAL 634 12.193 -7.796 -2.288 643 HG12 VAL 634 HG12 VAL 634 11.553 -7.500 -0.672 644 HG13 VAL 634 HG13 VAL 634 12.907 -8.609 -0.894 645 HG21 VAL 634 HG21 VAL 634 12.532 -5.344 -2.608 646 HG22 VAL 634 HG22 VAL 634 13.548 -4.444 -1.484 647 HG23 VAL 634 HG23 VAL 634 11.950 -4.992 -0.984 648 H GLY 635 HN GLY 635 12.941 -8.326 1.768 649 HA2 GLY 635 HA2 GLY 635 13.602 -10.489 2.178 650 HA3 GLY 635 HA1 GLY 635 14.919 -10.261 1.044 651 H GLU 636 HN GLU 636 15.956 -11.627 2.743 652 HA GLU 636 HA GLU 636 16.593 -10.309 5.231 653 HB2 GLU 636 HB2 GLU 636 17.449 -12.981 4.144 654 HB3 GLU 636 HB1 GLU 636 17.728 -12.411 5.779 655 HG2 GLU 636 HG2 GLU 636 15.284 -12.276 6.112 656 HG3 GLU 636 HG1 GLU 636 15.059 -12.956 4.502 657 H HIS 637 HN HIS 637 17.908 -10.418 2.121 658 HA HIS 637 HA HIS 637 20.640 -9.955 3.062 659 HB2 HIS 637 HB2 HIS 637 19.527 -10.183 0.261 660 HB3 HIS 637 HB1 HIS 637 21.212 -9.842 0.626 661 HD1 HIS 637 HD1 HIS 637 22.703 -11.806 0.996 662 HD2 HIS 637 HD2 HIS 637 18.676 -12.824 1.151 663 HE1 HIS 637 HE1 HIS 637 22.646 -14.316 1.123 664 HE2 HIS 637 HE2 HIS 637 20.200 -14.912 1.063 665 H ARG 638 HN ARG 638 17.927 -8.229 2.710 666 HA ARG 638 HA ARG 638 17.362 -6.055 2.549 667 HB2 ARG 638 HB2 ARG 638 20.278 -5.649 3.224 668 HB3 ARG 638 HB1 ARG 638 19.085 -4.360 3.191 669 HG2 ARG 638 HG2 ARG 638 17.796 -5.704 4.911 670 HG3 ARG 638 HG1 ARG 638 19.247 -6.697 5.068 671 HD2 ARG 638 HD2 ARG 638 20.536 -4.642 5.592 672 HD3 ARG 638 HD1 ARG 638 19.030 -3.727 5.550 673 HE ARG 638 HE ARG 638 19.450 -5.947 7.445 674 HH11 ARG 638 HH11 ARG 638 18.535 -2.613 6.797 675 HH12 ARG 638 HH12 ARG 638 18.042 -2.314 8.432 676 HH21 ARG 638 HH21 ARG 638 18.817 -5.534 9.587 677 HH22 ARG 638 HH22 ARG 638 18.205 -3.967 10.018 678 H ALA 639 HN ALA 639 17.462 -7.069 0.153 679 HA ALA 639 HA ALA 639 19.236 -5.805 -1.671 680 HB1 ALA 639 HB1 ALA 639 16.508 -6.996 -2.156 681 HB2 ALA 639 HB2 ALA 639 18.050 -7.844 -2.269 682 HB3 ALA 639 HB3 ALA 639 17.670 -6.548 -3.403 683 H GLN 640 HN GLN 640 19.256 -3.761 -2.285 684 HA GLN 640 HA GLN 640 17.251 -2.016 -1.174 685 HB2 GLN 640 HB2 GLN 640 19.830 -1.431 -2.620 686 HB3 GLN 640 HB1 GLN 640 18.774 -0.199 -1.941 687 HG2 GLN 640 HG2 GLN 640 19.049 -1.197 0.276 688 HG3 GLN 640 HG1 GLN 640 20.150 -2.389 -0.409 689 HE21 GLN 640 HE21 GLN 640 19.736 0.888 0.567 690 HE22 GLN 640 HE22 GLN 640 21.391 1.361 0.424 691 H VAL 641 HN VAL 641 15.784 -0.878 -2.158 692 HA VAL 641 HA VAL 641 15.667 -0.800 -5.101 693 HB VAL 641 HB VAL 641 13.326 -1.449 -3.287 694 HG11 VAL 641 HG11 VAL 641 13.449 -1.270 -6.294 695 HG12 VAL 641 HG12 VAL 641 12.669 -0.110 -5.220 696 HG13 VAL 641 HG13 VAL 641 12.047 -1.756 -5.341 697 HG21 VAL 641 HG21 VAL 641 13.311 -3.637 -4.374 698 HG22 VAL 641 HG22 VAL 641 14.827 -3.350 -3.518 699 HG23 VAL 641 HG23 VAL 641 14.763 -3.199 -5.275 700 H SER 642 HN SER 642 14.825 1.113 -5.927 701 HA SER 642 HA SER 642 13.887 3.076 -3.948 702 HB2 SER 642 HB2 SER 642 15.741 3.629 -6.277 703 HB3 SER 642 HB1 SER 642 15.096 4.836 -5.165 704 HG SER 642 HG SER 642 16.724 2.627 -4.422 705 H VAL 643 HN VAL 643 11.769 3.226 -4.398 706 HA VAL 643 HA VAL 643 10.979 3.444 -7.215 707 HB VAL 643 HB VAL 643 10.049 1.447 -6.331 708 HG11 VAL 643 HG11 VAL 643 10.358 1.873 -3.964 709 HG12 VAL 643 HG12 VAL 643 8.699 1.369 -4.284 710 HG13 VAL 643 HG13 VAL 643 9.063 3.070 -3.989 711 HG21 VAL 643 HG21 VAL 643 7.959 3.603 -6.264 712 HG22 VAL 643 HG22 VAL 643 7.631 1.876 -6.401 713 HG23 VAL 643 HG23 VAL 643 8.505 2.716 -7.684 714 H GLU 644 HN GLU 644 10.196 5.313 -7.849 715 HA GLU 644 HA GLU 644 9.670 7.419 -5.897 716 HB2 GLU 644 HB2 GLU 644 9.782 7.512 -8.921 717 HB3 GLU 644 HB1 GLU 644 9.695 8.903 -7.850 718 HG2 GLU 644 HG2 GLU 644 11.875 8.643 -7.121 719 HG3 GLU 644 HG1 GLU 644 11.945 6.950 -7.612 720 H VAL 645 HN VAL 645 7.624 7.510 -5.138 721 HA VAL 645 HA VAL 645 5.423 7.248 -7.083 722 HB VAL 645 HB VAL 645 4.011 6.321 -5.252 723 HG11 VAL 645 HG11 VAL 645 4.979 4.053 -5.298 724 HG12 VAL 645 HG12 VAL 645 6.464 4.729 -5.968 725 HG13 VAL 645 HG13 VAL 645 4.962 4.820 -6.886 726 HG21 VAL 645 HG21 VAL 645 5.091 5.397 -3.259 727 HG22 VAL 645 HG22 VAL 645 5.290 7.147 -3.346 728 HG23 VAL 645 HG23 VAL 645 6.631 6.085 -3.773 729 H LEU 646 HN LEU 646 3.384 8.349 -6.302 730 HA LEU 646 HA LEU 646 3.999 10.926 -5.208 731 HB2 LEU 646 HB2 LEU 646 1.335 9.625 -5.780 732 HB3 LEU 646 HB1 LEU 646 1.521 11.262 -5.186 733 HG LEU 646 HG LEU 646 2.053 10.154 -7.892 734 HD11 LEU 646 HD11 LEU 646 0.944 12.176 -8.591 735 HD12 LEU 646 HD12 LEU 646 0.977 12.805 -6.945 736 HD13 LEU 646 HD13 LEU 646 -0.015 11.396 -7.333 737 HD21 LEU 646 HD21 LEU 646 3.469 12.542 -6.740 738 HD22 LEU 646 HD22 LEU 646 3.411 12.120 -8.453 739 HD23 LEU 646 HD23 LEU 646 4.213 11.045 -7.307 740 H VAL 647 HN VAL 647 3.454 11.715 -3.196 741 HA VAL 647 HA VAL 647 3.697 9.869 -1.057 742 HB VAL 647 HB VAL 647 3.544 11.783 0.426 743 HG11 VAL 647 HG11 VAL 647 5.380 13.134 -0.482 744 HG12 VAL 647 HG12 VAL 647 5.136 12.385 -2.060 745 HG13 VAL 647 HG13 VAL 647 5.657 11.405 -0.691 746 HG21 VAL 647 HG21 VAL 647 3.176 14.062 -0.542 747 HG22 VAL 647 HG22 VAL 647 1.746 13.032 -0.507 748 HG23 VAL 647 HG23 VAL 647 2.621 13.277 -2.023 749 H GLU 648 HN GLU 648 1.022 10.859 -2.806 750 HA GLU 648 HA GLU 648 -0.904 10.695 -0.663 751 HB2 GLU 648 HB2 GLU 648 -2.569 10.994 -2.442 752 HB3 GLU 648 HB1 GLU 648 -1.307 12.208 -2.532 753 HG2 GLU 648 HG2 GLU 648 -0.260 11.067 -4.362 754 HG3 GLU 648 HG1 GLU 648 -1.393 9.726 -4.225 755 H TYR 649 HN TYR 649 0.820 8.482 -2.459 756 HA TYR 649 HA TYR 649 -1.230 6.542 -2.883 757 HB2 TYR 649 HB2 TYR 649 1.708 6.676 -3.293 758 HB3 TYR 649 HB1 TYR 649 0.977 5.082 -3.162 759 HD1 TYR 649 HD2 TYR 649 0.276 8.321 -4.881 760 HD2 TYR 649 HD1 TYR 649 0.359 4.079 -5.145 761 HE1 TYR 649 HE2 TYR 649 -0.435 8.462 -7.229 762 HE2 TYR 649 HE1 TYR 649 -0.356 4.206 -7.493 763 HH TYR 649 HH TYR 649 -0.300 7.077 -9.274 764 HA PRO 650 HA PRO 650 -1.148 4.875 1.264 765 HB2 PRO 650 HB2 PRO 650 -2.835 2.797 0.050 766 HB3 PRO 650 HB1 PRO 650 -3.199 3.897 1.381 767 HG2 PRO 650 HG2 PRO 650 -4.352 4.164 -1.026 768 HG3 PRO 650 HG1 PRO 650 -3.933 5.569 -0.026 769 HD2 PRO 650 HD2 PRO 650 -2.488 4.421 -2.386 770 HD3 PRO 650 HD1 PRO 650 -2.799 6.120 -1.969 771 H PHE 651 HN PHE 651 -0.052 3.216 2.207 772 HA PHE 651 HA PHE 651 1.062 1.130 0.468 773 HB2 PHE 651 HB2 PHE 651 2.510 3.055 2.215 774 HB3 PHE 651 HB1 PHE 651 3.096 1.395 2.186 775 HD1 PHE 651 HD2 PHE 651 2.179 4.194 -0.096 776 HD2 PHE 651 HD1 PHE 651 4.570 0.733 0.544 777 HE1 PHE 651 HE2 PHE 651 3.402 4.658 -2.180 778 HE2 PHE 651 HE1 PHE 651 5.797 1.190 -1.539 779 HZ PHE 651 HZ PHE 651 5.215 3.155 -2.904 780 H PHE 652 HN PHE 652 0.332 -0.742 1.179 781 HA PHE 652 HA PHE 652 -0.590 -1.104 3.859 782 HB2 PHE 652 HB2 PHE 652 -0.929 -2.453 1.409 783 HB3 PHE 652 HB1 PHE 652 -0.140 -3.598 2.488 784 HD1 PHE 652 HD1 PHE 652 -1.167 -3.925 4.802 785 HD2 PHE 652 HD2 PHE 652 -3.211 -2.078 1.563 786 HE1 PHE 652 HE1 PHE 652 -3.311 -4.358 5.916 787 HE2 PHE 652 HE2 PHE 652 -5.363 -2.507 2.672 788 HZ PHE 652 HZ PHE 652 -5.415 -3.645 4.854 789 H VAL 653 HN VAL 653 0.678 -1.463 5.547 790 HA VAL 653 HA VAL 653 3.386 -2.472 5.029 791 HB VAL 653 HB VAL 653 2.555 -1.119 7.581 792 HG11 VAL 653 HG11 VAL 653 4.804 -0.719 7.884 793 HG12 VAL 653 HG12 VAL 653 5.165 -0.859 6.165 794 HG13 VAL 653 HG13 VAL 653 4.804 -2.301 7.106 795 HG21 VAL 653 HG21 VAL 653 1.833 0.447 5.926 796 HG22 VAL 653 HG22 VAL 653 3.324 0.236 5.007 797 HG23 VAL 653 HG23 VAL 653 3.370 1.019 6.587 798 H PHE 654 HN PHE 654 3.845 -4.463 5.683 799 HA PHE 654 HA PHE 654 1.915 -6.307 6.231 800 HB2 PHE 654 HB2 PHE 654 4.217 -6.685 5.349 801 HB3 PHE 654 HB1 PHE 654 4.826 -6.583 6.984 802 HD1 PHE 654 HD2 PHE 654 4.274 -8.407 8.611 803 HD2 PHE 654 HD1 PHE 654 3.187 -8.632 4.505 804 HE1 PHE 654 HE2 PHE 654 3.947 -10.832 8.833 805 HE2 PHE 654 HE1 PHE 654 2.866 -11.059 4.721 806 HZ PHE 654 HZ PHE 654 3.245 -12.160 6.887 807 H GLY 655 HN GLY 655 4.294 -6.676 8.753 808 HA2 GLY 655 HA2 GLY 655 2.181 -6.795 10.713 809 HA3 GLY 655 HA1 GLY 655 3.884 -7.137 10.991 810 H GLN 656 HN GLN 656 2.339 -4.247 9.673 811 HA GLN 656 HA GLN 656 3.462 -2.713 11.903 812 HB2 GLN 656 HB2 GLN 656 3.764 -2.157 8.957 813 HB3 GLN 656 HB1 GLN 656 4.075 -0.942 10.185 814 HG2 GLN 656 HG2 GLN 656 6.176 -1.767 9.693 815 HG3 GLN 656 HG1 GLN 656 5.730 -2.620 11.158 816 HE21 GLN 656 HE21 GLN 656 4.383 -3.456 8.079 817 HE22 GLN 656 HE22 GLN 656 5.211 -4.963 7.864 818 H GLY 657 HN GLY 657 1.368 -2.284 8.975 819 HA2 GLY 657 HA2 GLY 657 -1.019 -1.916 10.155 820 HA3 GLY 657 HA1 GLY 657 -0.245 -0.372 10.458 821 H TRP 658 HN TRP 658 -2.368 0.062 9.228 822 HA TRP 658 HA TRP 658 -2.074 -0.098 6.330 823 HB2 TRP 658 HB2 TRP 658 -4.258 -0.617 7.464 824 HB3 TRP 658 HB1 TRP 658 -4.339 1.049 7.999 825 HD1 TRP 658 HD1 TRP 658 -6.702 1.126 6.748 826 HE1 TRP 658 HE1 TRP 658 -7.317 1.587 4.301 827 HE3 TRP 658 HE3 TRP 658 -2.123 0.333 4.554 828 HZ2 TRP 658 HZ2 TRP 658 -6.064 1.636 1.803 829 HZ3 TRP 658 HZ3 TRP 658 -1.950 0.615 2.117 830 HH2 TRP 658 HH2 TRP 658 -3.871 1.252 0.781 831 H SER 659 HN SER 659 -0.629 1.411 5.610 832 HA SER 659 HA SER 659 -0.732 4.080 6.853 833 HB2 SER 659 HB2 SER 659 1.721 2.537 5.981 834 HB3 SER 659 HB1 SER 659 1.720 4.149 6.695 835 HG SER 659 HG SER 659 2.102 2.690 8.333 836 H SER 660 HN SER 660 0.321 5.799 5.543 837 HA SER 660 HA SER 660 0.672 5.191 2.711 838 HB2 SER 660 HB2 SER 660 -0.990 7.525 3.689 839 HB3 SER 660 HB1 SER 660 -0.590 7.169 2.007 840 HG SER 660 HG SER 660 -1.715 5.041 3.289 841 H CYS 661 HN CYS 661 2.052 6.738 1.610 842 HA CYS 661 HA CYS 661 4.307 7.411 3.069 843 HB2 CYS 661 HB2 CYS 661 3.335 8.705 0.517 844 HB3 CYS 661 HB1 CYS 661 4.984 8.762 1.132 845 HG CYS 661 HG CYS 661 3.660 6.578 -0.858 846 H CYS 662 HN CYS 662 1.427 9.283 2.451 847 HA CYS 662 HA CYS 662 2.251 11.190 4.451 848 HB2 CYS 662 HB2 CYS 662 1.764 11.931 1.575 849 HB3 CYS 662 HB1 CYS 662 1.510 13.097 2.865 850 HG CYS 662 HG CYS 662 4.468 11.609 3.122 851 HA PRO 663 HA PRO 663 -2.017 9.665 5.053 852 HB2 PRO 663 HB2 PRO 663 -1.336 11.027 7.621 853 HB3 PRO 663 HB1 PRO 663 -2.126 9.469 7.347 854 HG2 PRO 663 HG2 PRO 663 0.412 9.556 8.094 855 HG3 PRO 663 HG1 PRO 663 -0.126 8.390 6.872 856 HD2 PRO 663 HD2 PRO 663 1.388 10.936 6.524 857 HD3 PRO 663 HD1 PRO 663 1.547 9.400 5.650 858 H GLU 664 HN GLU 664 -0.631 12.817 5.791 859 HA GLU 664 HA GLU 664 -2.951 14.284 6.186 860 HB2 GLU 664 HB2 GLU 664 -0.435 15.214 4.794 861 HB3 GLU 664 HB1 GLU 664 -1.642 16.241 5.558 862 HG2 GLU 664 HG2 GLU 664 -1.109 15.227 7.726 863 HG3 GLU 664 HG1 GLU 664 0.124 14.240 6.942 864 H ARG 665 HN ARG 665 -1.244 13.534 3.167 865 HA ARG 665 HA ARG 665 -3.127 15.015 1.580 866 HB2 ARG 665 HB2 ARG 665 -0.782 14.869 0.903 867 HB3 ARG 665 HB1 ARG 665 -0.926 13.125 0.731 868 HG2 ARG 665 HG2 ARG 665 -2.422 13.354 -1.109 869 HG3 ARG 665 HG1 ARG 665 -2.553 15.094 -0.854 870 HD2 ARG 665 HD2 ARG 665 -0.268 15.422 -1.487 871 HD3 ARG 665 HD1 ARG 665 0.017 13.685 -1.546 872 HE ARG 665 HE ARG 665 -1.651 13.692 -3.438 873 HH11 ARG 665 HH11 ARG 665 0.253 16.545 -2.693 874 HH12 ARG 665 HH12 ARG 665 0.227 17.127 -4.326 875 HH21 ARG 665 HH21 ARG 665 -1.682 14.438 -5.552 876 HH22 ARG 665 HH22 ARG 665 -0.869 15.925 -5.963 877 H THR 666 HN THR 666 -2.473 11.540 2.116 878 HA THR 666 HA THR 666 -4.365 10.570 0.293 879 HB THR 666 HB THR 666 -3.600 9.212 2.886 880 HG1 THR 666 HG1 THR 666 -2.229 8.704 0.494 881 HG21 THR 666 HG21 THR 666 -4.313 8.045 0.182 882 HG22 THR 666 HG22 THR 666 -5.423 8.155 1.547 883 HG23 THR 666 HG23 THR 666 -3.983 7.145 1.661 884 H SER 667 HN SER 667 -4.706 11.423 3.737 885 HA SER 667 HA SER 667 -7.479 10.830 3.833 886 HB2 SER 667 HB2 SER 667 -5.684 12.486 5.601 887 HB3 SER 667 HB1 SER 667 -7.367 12.150 5.960 888 HG SER 667 HG SER 667 -6.317 9.831 5.417 889 H GLN 668 HN GLN 668 -5.614 13.797 3.214 890 HA GLN 668 HA GLN 668 -7.639 15.667 3.213 891 HB2 GLN 668 HB2 GLN 668 -4.979 15.454 2.202 892 HB3 GLN 668 HB1 GLN 668 -5.997 16.369 1.099 893 HG2 GLN 668 HG2 GLN 668 -6.049 16.935 4.014 894 HG3 GLN 668 HG1 GLN 668 -4.771 17.538 2.999 895 HE21 GLN 668 HE21 GLN 668 -8.052 17.165 1.875 896 HE22 GLN 668 HE22 GLN 668 -8.402 18.850 1.742 897 H LEU 669 HN LEU 669 -6.516 13.691 0.478 898 HA LEU 669 HA LEU 669 -8.486 14.986 -1.225 899 HB2 LEU 669 HB2 LEU 669 -6.580 12.841 -2.089 900 HB3 LEU 669 HB1 LEU 669 -7.307 14.110 -3.051 901 HG LEU 669 HG LEU 669 -5.118 14.423 -1.008 902 HD11 LEU 669 HD11 LEU 669 -3.787 15.134 -2.936 903 HD12 LEU 669 HD12 LEU 669 -5.152 14.782 -3.997 904 HD13 LEU 669 HD13 LEU 669 -4.369 13.478 -3.104 905 HD21 LEU 669 HD21 LEU 669 -5.052 16.789 -1.692 906 HD22 LEU 669 HD22 LEU 669 -6.550 16.360 -0.869 907 HD23 LEU 669 HD23 LEU 669 -6.529 16.539 -2.626 908 H PHE 670 HN PHE 670 -7.754 11.813 0.089 909 HA PHE 670 HA PHE 670 -9.974 10.669 -1.453 910 HB2 PHE 670 HB2 PHE 670 -7.827 9.144 0.016 911 HB3 PHE 670 HB1 PHE 670 -8.881 8.561 -1.262 912 HD1 PHE 670 HD2 PHE 670 -8.679 10.421 -3.389 913 HD2 PHE 670 HD1 PHE 670 -5.663 9.204 -0.656 914 HE1 PHE 670 HE2 PHE 670 -6.954 11.009 -5.040 915 HE2 PHE 670 HE1 PHE 670 -3.933 9.786 -2.294 916 HZ PHE 670 HZ PHE 670 -4.574 10.694 -4.491 917 H ASP 671 HN ASP 671 -9.502 11.967 1.468 918 HA ASP 671 HA ASP 671 -10.430 11.842 3.529 919 HB2 ASP 671 HB2 ASP 671 -12.572 10.597 1.835 920 HB3 ASP 671 HB1 ASP 671 -12.771 10.732 3.577 921 H LEU 672 HN LEU 672 -8.824 9.475 2.429 922 HA LEU 672 HA LEU 672 -9.879 7.315 4.072 923 HB2 LEU 672 HB2 LEU 672 -9.273 6.749 1.794 924 HB3 LEU 672 HB1 LEU 672 -7.653 7.384 2.027 925 HG LEU 672 HG LEU 672 -7.332 5.608 3.802 926 HD11 LEU 672 HD11 LEU 672 -9.858 4.496 2.588 927 HD12 LEU 672 HD12 LEU 672 -9.707 5.175 4.209 928 HD13 LEU 672 HD13 LEU 672 -8.831 3.705 3.786 929 HD21 LEU 672 HD21 LEU 672 -6.407 5.401 1.540 930 HD22 LEU 672 HD22 LEU 672 -7.902 4.631 1.005 931 HD23 LEU 672 HD23 LEU 672 -6.879 3.839 2.207 932 HA PRO 673 HA PRO 673 -7.017 8.489 7.367 933 HB2 PRO 673 HB2 PRO 673 -8.051 5.827 8.215 934 HB3 PRO 673 HB1 PRO 673 -7.864 7.304 9.169 935 HG2 PRO 673 HG2 PRO 673 -10.254 6.596 8.374 936 HG3 PRO 673 HG1 PRO 673 -9.751 8.280 8.136 937 HD2 PRO 673 HD2 PRO 673 -9.784 6.039 6.164 938 HD3 PRO 673 HD1 PRO 673 -10.378 7.683 5.995 939 H CYS 674 HN CYS 674 -4.928 8.010 7.567 940 HA CYS 674 HA CYS 674 -3.944 5.370 6.804 941 HB2 CYS 674 HB2 CYS 674 -2.093 7.030 5.589 942 HB3 CYS 674 HB1 CYS 674 -3.375 6.138 4.765 943 HG CYS 674 HG CYS 674 -5.147 8.221 4.620 944 H SER 675 HN SER 675 -2.330 4.700 8.069 945 HA SER 675 HA SER 675 -1.187 6.407 10.066 946 HB2 SER 675 HB2 SER 675 -0.290 3.653 9.172 947 HB3 SER 675 HB1 SER 675 0.108 4.445 10.698 948 HG SER 675 HG SER 675 -1.871 2.853 10.328 949 H LYS 676 HN LYS 676 1.231 6.730 10.218 950 HA LYS 676 HA LYS 676 2.068 7.867 7.723 951 HB2 LYS 676 HB2 LYS 676 2.528 9.065 9.786 952 HB3 LYS 676 HB1 LYS 676 3.503 7.724 10.375 953 HG2 LYS 676 HG2 LYS 676 4.862 9.590 9.519 954 HG3 LYS 676 HG1 LYS 676 5.137 8.082 8.636 955 HD2 LYS 676 HD2 LYS 676 3.777 8.833 6.811 956 HD3 LYS 676 HD1 LYS 676 3.257 10.254 7.712 957 HE2 LYS 676 HE2 LYS 676 4.946 10.838 6.056 958 HE3 LYS 676 HE1 LYS 676 5.546 11.108 7.691 959 HZ1 LYS 676 HZ1 LYS 676 7.164 10.030 6.192 960 HZ2 LYS 676 HZ2 LYS 676 6.143 8.684 6.081 961 HZ3 LYS 676 HZ3 LYS 676 6.823 9.117 7.571 962 H LEU 677 HN LEU 677 2.786 6.576 6.187 963 HA LEU 677 HA LEU 677 4.449 4.299 6.720 964 HB2 LEU 677 HB2 LEU 677 2.968 4.453 4.732 965 HB3 LEU 677 HB1 LEU 677 3.936 5.774 4.122 966 HG LEU 677 HG LEU 677 4.291 3.459 3.100 967 HD11 LEU 677 HD11 LEU 677 5.825 5.302 2.695 968 HD12 LEU 677 HD12 LEU 677 6.696 3.776 2.852 969 HD13 LEU 677 HD13 LEU 677 6.684 4.927 4.189 970 HD21 LEU 677 HD21 LEU 677 5.814 3.054 5.658 971 HD22 LEU 677 HD22 LEU 677 5.777 1.960 4.275 972 HD23 LEU 677 HD23 LEU 677 4.313 2.241 5.220 973 H SER 678 HN SER 678 6.410 4.562 7.484 974 HA SER 678 HA SER 678 8.093 6.674 6.349 975 HB2 SER 678 HB2 SER 678 8.986 7.014 8.710 976 HB3 SER 678 HB1 SER 678 7.369 7.630 8.390 977 HG SER 678 HG SER 678 7.076 5.132 9.185 978 H VAL 679 HN VAL 679 10.416 6.354 7.019 979 HA VAL 679 HA VAL 679 11.409 3.905 6.269 980 HB VAL 679 HB VAL 679 12.868 5.716 6.160 981 HG11 VAL 679 HG11 VAL 679 12.273 6.235 9.059 982 HG12 VAL 679 HG12 VAL 679 11.847 7.236 7.665 983 HG13 VAL 679 HG13 VAL 679 13.536 7.060 8.144 984 HG21 VAL 679 HG21 VAL 679 14.814 5.099 7.446 985 HG22 VAL 679 HG22 VAL 679 13.977 3.647 6.899 986 HG23 VAL 679 HG23 VAL 679 13.814 4.180 8.573 987 H GLY 680 HN GLY 680 11.790 2.024 7.245 988 HA2 GLY 680 HA2 GLY 680 12.145 0.655 9.194 989 HA3 GLY 680 HA1 GLY 680 11.195 1.804 10.118 990 H ASP 681 HN ASP 681 9.236 1.892 7.753 991 HA ASP 681 HA ASP 681 7.577 -0.207 8.873 992 HB2 ASP 681 HB2 ASP 681 7.003 1.953 6.848 993 HB3 ASP 681 HB1 ASP 681 5.829 0.747 7.311 994 H VAL 682 HN VAL 682 7.614 -2.203 8.127 995 HA VAL 682 HA VAL 682 8.804 -2.878 5.626 996 HB VAL 682 HB VAL 682 7.222 -4.599 7.535 997 HG11 VAL 682 HG11 VAL 682 8.991 -5.374 5.225 998 HG12 VAL 682 HG12 VAL 682 7.242 -5.593 5.337 999 HG13 VAL 682 HG13 VAL 682 8.317 -6.490 6.412 1000 HG21 VAL 682 HG21 VAL 682 9.415 -5.419 8.266 1001 HG22 VAL 682 HG22 VAL 682 9.214 -3.693 8.576 1002 HG23 VAL 682 HG23 VAL 682 10.195 -4.237 7.214 1003 H CYS 683 HN CYS 683 7.780 -2.431 3.759 1004 HA CYS 683 HA CYS 683 4.897 -2.295 3.708 1005 HB2 CYS 683 HB2 CYS 683 6.949 -1.761 1.558 1006 HB3 CYS 683 HB1 CYS 683 5.219 -1.509 1.368 1007 HG CYS 683 HG CYS 683 6.807 0.042 3.938 1008 H ILE 684 HN ILE 684 3.531 -3.496 2.547 1009 HA ILE 684 HA ILE 684 4.344 -6.175 1.846 1010 HB ILE 684 HB ILE 684 1.683 -4.735 1.737 1011 HG12 ILE 684 HG12 ILE 684 2.587 -7.007 3.507 1012 HG13 ILE 684 HG11 ILE 684 2.574 -5.314 3.992 1013 HG21 ILE 684 HG21 ILE 684 1.598 -6.318 -0.022 1014 HG22 ILE 684 HG22 ILE 684 0.706 -7.011 1.335 1015 HG23 ILE 684 HG23 ILE 684 2.342 -7.565 0.975 1016 HD11 ILE 684 HD11 ILE 684 0.167 -6.926 3.175 1017 HD12 ILE 684 HD12 ILE 684 0.162 -5.238 3.684 1018 HD13 ILE 684 HD13 ILE 684 0.617 -6.502 4.827 1019 H SER 685 HN SER 685 5.129 -6.602 -0.193 1020 HA SER 685 HA SER 685 4.132 -4.978 -2.410 1021 HB2 SER 685 HB2 SER 685 6.595 -5.640 -2.243 1022 HB3 SER 685 HB1 SER 685 6.079 -7.281 -2.618 1023 HG SER 685 HG SER 685 6.709 -5.631 -4.391 1024 H LEU 686 HN LEU 686 2.335 -5.597 -3.372 1025 HA LEU 686 HA LEU 686 1.501 -8.388 -3.129 1026 HB2 LEU 686 HB2 LEU 686 0.118 -6.172 -2.534 1027 HB3 LEU 686 HB1 LEU 686 -0.276 -6.264 -4.236 1028 HG LEU 686 HG LEU 686 -2.011 -7.273 -2.890 1029 HD11 LEU 686 HD11 LEU 686 -1.699 -8.233 -5.073 1030 HD12 LEU 686 HD12 LEU 686 -2.112 -9.505 -3.919 1031 HD13 LEU 686 HD13 LEU 686 -0.443 -9.306 -4.455 1032 HD21 LEU 686 HD21 LEU 686 -1.598 -9.292 -1.589 1033 HD22 LEU 686 HD22 LEU 686 -0.686 -7.915 -0.972 1034 HD23 LEU 686 HD23 LEU 686 0.125 -9.153 -1.929 1035 H THR 687 HN THR 687 1.710 -9.649 -4.885 1036 HA THR 687 HA THR 687 2.386 -8.348 -7.416 1037 HB THR 687 HB THR 687 3.149 -10.579 -8.133 1038 HG1 THR 687 HG1 THR 687 1.617 -11.738 -6.788 1039 HG21 THR 687 HG21 THR 687 4.787 -9.189 -7.033 1040 HG22 THR 687 HG22 THR 687 5.008 -10.854 -6.500 1041 HG23 THR 687 HG23 THR 687 4.204 -9.690 -5.448 1042 H LEU 688 HN LEU 688 0.838 -8.061 -8.841 1043 HA LEU 688 HA LEU 688 -1.517 -9.792 -8.834 1044 HB2 LEU 688 HB2 LEU 688 -0.924 -7.031 -9.660 1045 HB3 LEU 688 HB1 LEU 688 -1.923 -7.911 -10.793 1046 HG LEU 688 HG LEU 688 -3.221 -6.547 -9.195 1047 HD11 LEU 688 HD11 LEU 688 -4.802 -8.332 -8.539 1048 HD12 LEU 688 HD12 LEU 688 -3.605 -9.525 -9.047 1049 HD13 LEU 688 HD13 LEU 688 -4.295 -8.413 -10.225 1050 HD21 LEU 688 HD21 LEU 688 -3.443 -7.296 -6.866 1051 HD22 LEU 688 HD22 LEU 688 -1.811 -6.725 -7.230 1052 HD23 LEU 688 HD23 LEU 688 -2.135 -8.456 -7.128 1053 H LYS 689 HN LYS 689 -0.931 -11.636 -9.902 1054 HA LYS 689 HA LYS 689 0.618 -11.476 -12.328 1055 HB2 LYS 689 HB2 LYS 689 -0.498 -13.767 -10.775 1056 HB3 LYS 689 HB1 LYS 689 0.332 -13.978 -12.304 1057 HG2 LYS 689 HG2 LYS 689 1.495 -12.683 -9.860 1058 HG3 LYS 689 HG1 LYS 689 1.807 -14.341 -10.380 1059 HD2 LYS 689 HD2 LYS 689 2.452 -11.849 -11.957 1060 HD3 LYS 689 HD1 LYS 689 3.608 -12.794 -11.027 1061 HE2 LYS 689 HE2 LYS 689 3.131 -14.744 -12.453 1062 HE3 LYS 689 HE1 LYS 689 2.020 -13.757 -13.401 1063 HZ1 LYS 689 HZ1 LYS 689 4.939 -13.312 -13.108 1064 HZ2 LYS 689 HZ2 LYS 689 3.889 -12.304 -13.966 1065 HZ3 LYS 689 HZ3 LYS 689 4.150 -13.892 -14.486 Start of MODEL 3 1 H1 VAL 34 HT1 VAL 34 -18.932 -3.898 -6.372 2 H2 VAL 34 HT2 VAL 34 -18.429 -2.292 -6.257 3 H3 VAL 34 HT3 VAL 34 -19.482 -2.932 -5.098 4 HA VAL 34 HA VAL 34 -17.261 -2.753 -4.223 5 HB VAL 34 HB VAL 34 -18.508 -4.492 -3.264 6 HG11 VAL 34 HG11 VAL 34 -17.859 -6.186 -5.669 7 HG12 VAL 34 HG12 VAL 34 -19.434 -5.498 -5.275 8 HG13 VAL 34 HG13 VAL 34 -18.728 -6.737 -4.237 9 HG21 VAL 34 HG21 VAL 34 -16.162 -4.605 -2.718 10 HG22 VAL 34 HG22 VAL 34 -15.865 -5.634 -4.120 11 HG23 VAL 34 HG23 VAL 34 -16.852 -6.226 -2.785 12 H PHE 35 HN PHE 35 -15.123 -3.171 -4.319 13 HA PHE 35 HA PHE 35 -14.174 -3.716 -7.053 14 HB2 PHE 35 HB2 PHE 35 -13.232 -1.785 -4.955 15 HB3 PHE 35 HB1 PHE 35 -12.156 -2.302 -6.250 16 HD1 PHE 35 HD1 PHE 35 -15.711 -1.227 -5.983 17 HD2 PHE 35 HD2 PHE 35 -11.981 -0.795 -7.962 18 HE1 PHE 35 HE1 PHE 35 -16.694 0.478 -7.450 19 HE2 PHE 35 HE2 PHE 35 -12.956 0.904 -9.446 20 HZ PHE 35 HZ PHE 35 -15.318 1.544 -9.191 21 HA PRO 36 HA PRO 36 -11.582 -7.074 -5.608 22 HB2 PRO 36 HB2 PRO 36 -9.643 -5.965 -7.571 23 HB3 PRO 36 HB1 PRO 36 -10.285 -7.605 -7.433 24 HG2 PRO 36 HG2 PRO 36 -11.099 -5.969 -9.377 25 HG3 PRO 36 HG1 PRO 36 -12.225 -7.085 -8.584 26 HD2 PRO 36 HD2 PRO 36 -11.900 -4.139 -8.220 27 HD3 PRO 36 HD1 PRO 36 -13.377 -5.123 -8.213 28 H TRP 37 HN TRP 37 -9.919 -7.241 -4.149 29 HA TRP 37 HA TRP 37 -9.583 -4.989 -2.598 30 HB2 TRP 37 HB2 TRP 37 -7.945 -6.369 -1.280 31 HB3 TRP 37 HB1 TRP 37 -9.547 -7.052 -1.508 32 HD1 TRP 37 HD1 TRP 37 -9.671 -8.990 -3.545 33 HE1 TRP 37 HE1 TRP 37 -7.963 -10.848 -4.043 34 HE3 TRP 37 HE3 TRP 37 -5.607 -6.979 -1.206 35 HZ2 TRP 37 HZ2 TRP 37 -5.250 -11.388 -3.495 36 HZ3 TRP 37 HZ3 TRP 37 -3.493 -8.230 -1.239 37 HH2 TRP 37 HH2 TRP 37 -3.321 -10.390 -2.364 38 H HIS 38 HN HIS 38 -7.392 -6.209 -5.107 39 HA HIS 38 HA HIS 38 -5.348 -4.334 -4.458 40 HB2 HIS 38 HB2 HIS 38 -4.814 -6.232 -5.881 41 HB3 HIS 38 HB1 HIS 38 -5.990 -5.708 -7.079 42 HD1 HIS 38 HD1 HIS 38 -5.001 -4.503 -8.993 43 HD2 HIS 38 HD2 HIS 38 -2.691 -4.096 -5.564 44 HE1 HIS 38 HE1 HIS 38 -2.998 -3.155 -9.682 45 HE2 HIS 38 HE2 HIS 38 -1.771 -2.698 -7.534 46 H SER 39 HN SER 39 -6.975 -2.650 -3.990 47 HA SER 39 HA SER 39 -7.439 -1.005 -6.387 48 HB2 SER 39 HB2 SER 39 -9.563 -1.894 -5.532 49 HB3 SER 39 HB1 SER 39 -9.194 -1.273 -3.925 50 HG SER 39 HG SER 39 -10.418 0.290 -4.752 51 H LEU 40 HN LEU 40 -6.230 -1.321 -3.225 52 HA LEU 40 HA LEU 40 -5.533 1.545 -3.080 53 HB2 LEU 40 HB2 LEU 40 -5.487 0.504 -0.477 54 HB3 LEU 40 HB1 LEU 40 -6.645 1.636 -1.153 55 HG LEU 40 HG LEU 40 -7.092 -1.294 -1.562 56 HD11 LEU 40 HD11 LEU 40 -6.684 -1.193 0.792 57 HD12 LEU 40 HD12 LEU 40 -8.427 -1.310 0.525 58 HD13 LEU 40 HD13 LEU 40 -7.699 0.241 0.951 59 HD21 LEU 40 HD21 LEU 40 -8.949 1.053 -1.170 60 HD22 LEU 40 HD22 LEU 40 -9.430 -0.601 -1.538 61 HD23 LEU 40 HD23 LEU 40 -8.516 0.334 -2.721 62 H VAL 41 HN VAL 41 -4.665 -1.781 -2.209 63 HA VAL 41 HA VAL 41 -2.090 -1.218 -1.259 64 HB VAL 41 HB VAL 41 -3.263 -3.288 -0.710 65 HG11 VAL 41 HG11 VAL 41 -2.817 -4.101 -3.584 66 HG12 VAL 41 HG12 VAL 41 -4.371 -3.681 -2.866 67 HG13 VAL 41 HG13 VAL 41 -3.499 -5.107 -2.306 68 HG21 VAL 41 HG21 VAL 41 -0.707 -3.752 -2.216 69 HG22 VAL 41 HG22 VAL 41 -1.399 -4.827 -1.002 70 HG23 VAL 41 HG23 VAL 41 -0.849 -3.216 -0.546 71 HA PRO 42 HA PRO 42 -0.134 -0.938 -5.286 72 HB2 PRO 42 HB2 PRO 42 1.960 0.524 -4.506 73 HB3 PRO 42 HB1 PRO 42 0.350 1.240 -4.636 74 HG2 PRO 42 HG2 PRO 42 1.893 0.488 -2.221 75 HG3 PRO 42 HG1 PRO 42 0.668 1.749 -2.428 76 HD2 PRO 42 HD2 PRO 42 0.313 -0.863 -1.331 77 HD3 PRO 42 HD1 PRO 42 -0.933 0.364 -1.631 78 H PHE 43 HN PHE 43 2.416 -1.118 -5.734 79 HA PHE 43 HA PHE 43 3.673 -3.074 -3.992 80 HB2 PHE 43 HB2 PHE 43 4.383 -4.337 -6.153 81 HB3 PHE 43 HB1 PHE 43 2.800 -4.652 -5.461 82 HD1 PHE 43 HD1 PHE 43 4.607 -3.074 -8.240 83 HD2 PHE 43 HD2 PHE 43 0.800 -4.038 -6.599 84 HE1 PHE 43 HE1 PHE 43 3.551 -2.573 -10.406 85 HE2 PHE 43 HE2 PHE 43 -0.263 -3.535 -8.761 86 HZ PHE 43 HZ PHE 43 1.114 -2.802 -10.668 87 H LEU 44 HN LEU 44 5.715 -2.511 -3.638 88 HA LEU 44 HA LEU 44 6.722 -0.192 -4.943 89 HB2 LEU 44 HB2 LEU 44 8.413 -0.144 -3.355 90 HB3 LEU 44 HB1 LEU 44 7.094 -0.897 -2.486 91 HG LEU 44 HG LEU 44 8.965 -2.054 -1.789 92 HD11 LEU 44 HD11 LEU 44 8.817 -4.303 -2.669 93 HD12 LEU 44 HD12 LEU 44 7.907 -3.706 -4.058 94 HD13 LEU 44 HD13 LEU 44 7.224 -3.586 -2.436 95 HD21 LEU 44 HD21 LEU 44 10.570 -1.139 -3.346 96 HD22 LEU 44 HD22 LEU 44 9.946 -2.177 -4.629 97 HD23 LEU 44 HD23 LEU 44 10.747 -2.892 -3.228 98 H ALA 45 HN ALA 45 8.964 -0.156 -5.946 99 HA ALA 45 HA ALA 45 8.904 -1.417 -8.365 100 HB1 ALA 45 HB1 ALA 45 10.347 0.472 -7.917 101 HB2 ALA 45 HB2 ALA 45 11.287 -0.855 -8.595 102 HB3 ALA 45 HB3 ALA 45 11.360 -0.517 -6.866 103 HA PRO 46 HA PRO 46 9.399 -5.707 -8.529 104 HB2 PRO 46 HB2 PRO 46 12.049 -5.002 -9.752 105 HB3 PRO 46 HB1 PRO 46 10.886 -6.239 -10.245 106 HG2 PRO 46 HG2 PRO 46 11.012 -3.765 -11.387 107 HG3 PRO 46 HG1 PRO 46 9.533 -4.736 -11.307 108 HD2 PRO 46 HD2 PRO 46 10.103 -2.232 -9.992 109 HD3 PRO 46 HD1 PRO 46 8.602 -3.176 -9.956 110 H SER 47 HN SER 47 9.598 -6.298 -6.422 111 HA SER 47 HA SER 47 11.903 -5.775 -4.851 112 HB2 SER 47 HB2 SER 47 10.635 -7.405 -3.268 113 HB3 SER 47 HB1 SER 47 9.894 -5.851 -3.654 114 HG SER 47 HG SER 47 8.837 -8.225 -3.997 115 H GLN 48 HN GLN 48 10.435 -8.919 -5.655 116 HA GLN 48 HA GLN 48 13.047 -10.024 -6.190 117 HB2 GLN 48 HB2 GLN 48 12.537 -11.962 -4.595 118 HB3 GLN 48 HB1 GLN 48 13.070 -10.447 -3.882 119 HG2 GLN 48 HG2 GLN 48 10.746 -9.887 -3.350 120 HG3 GLN 48 HG1 GLN 48 10.226 -11.420 -4.047 121 HE21 GLN 48 HE21 GLN 48 9.961 -10.343 -1.326 122 HE22 GLN 48 HE22 GLN 48 10.686 -11.534 -0.291 123 H ALA 567 HT1 ALA 567 -18.364 18.224 2.338 124 HA ALA 567 HA ALA 567 -16.512 16.635 0.671 125 HB1 ALA 567 HB1 ALA 567 -16.596 15.875 2.998 126 HB2 ALA 567 HB2 ALA 567 -17.348 14.713 1.905 127 HB3 ALA 567 HB3 ALA 567 -18.353 15.769 2.897 128 HA PRO 568 HA PRO 568 -20.087 16.335 -1.954 129 HB2 PRO 568 HB2 PRO 568 -19.218 14.413 -3.620 130 HB3 PRO 568 HB1 PRO 568 -18.543 16.045 -3.652 131 HG2 PRO 568 HG2 PRO 568 -17.430 13.554 -2.439 132 HG3 PRO 568 HG1 PRO 568 -16.590 14.853 -3.305 133 HD2 PRO 568 HD2 PRO 568 -16.677 14.596 -0.560 134 HD3 PRO 568 HD1 PRO 568 -16.367 16.115 -1.417 135 HA PRO 569 HA PRO 569 -22.775 13.202 -0.396 136 HB2 PRO 569 HB2 PRO 569 -23.699 12.210 -2.887 137 HB3 PRO 569 HB1 PRO 569 -24.475 13.421 -1.866 138 HG2 PRO 569 HG2 PRO 569 -22.778 13.780 -4.265 139 HG3 PRO 569 HG1 PRO 569 -24.073 14.811 -3.637 140 HD2 PRO 569 HD2 PRO 569 -21.477 15.491 -3.430 141 HD3 PRO 569 HD1 PRO 569 -22.658 15.905 -2.171 142 H THR 570 HN THR 570 -21.371 11.997 -3.452 143 HA THR 570 HA THR 570 -20.341 9.696 -1.943 144 HB THR 570 HB THR 570 -20.738 8.357 -4.082 145 HG1 THR 570 HG1 THR 570 -22.929 9.696 -4.830 146 HG21 THR 570 HG21 THR 570 -22.031 7.976 -2.055 147 HG22 THR 570 HG22 THR 570 -23.073 7.855 -3.473 148 HG23 THR 570 HG23 THR 570 -23.110 9.306 -2.471 149 H LEU 571 HN LEU 571 -18.246 9.403 -2.180 150 HA LEU 571 HA LEU 571 -16.866 10.646 -4.400 151 HB2 LEU 571 HB2 LEU 571 -14.920 10.613 -3.132 152 HB3 LEU 571 HB1 LEU 571 -16.169 11.019 -1.991 153 HG LEU 571 HG LEU 571 -14.778 8.362 -2.283 154 HD11 LEU 571 HD11 LEU 571 -13.479 10.101 -1.167 155 HD12 LEU 571 HD12 LEU 571 -13.970 8.839 -0.036 156 HD13 LEU 571 HD13 LEU 571 -14.815 10.386 -0.052 157 HD21 LEU 571 HD21 LEU 571 -17.089 7.972 -1.764 158 HD22 LEU 571 HD22 LEU 571 -17.033 9.167 -0.468 159 HD23 LEU 571 HD23 LEU 571 -16.102 7.675 -0.332 160 HA PRO 572 HA PRO 572 -15.972 7.112 -6.792 161 HB2 PRO 572 HB2 PRO 572 -13.104 7.080 -6.037 162 HB3 PRO 572 HB1 PRO 572 -13.852 7.108 -7.630 163 HG2 PRO 572 HG2 PRO 572 -12.727 9.297 -6.573 164 HG3 PRO 572 HG1 PRO 572 -14.152 9.376 -7.620 165 HD2 PRO 572 HD2 PRO 572 -13.939 9.749 -4.690 166 HD3 PRO 572 HD1 PRO 572 -15.095 10.435 -5.841 167 HA PRO 573 HA PRO 573 -16.189 3.742 -3.926 168 HB2 PRO 573 HB2 PRO 573 -16.913 1.847 -5.634 169 HB3 PRO 573 HB1 PRO 573 -17.981 3.219 -5.300 170 HG2 PRO 573 HG2 PRO 573 -16.097 2.812 -7.600 171 HG3 PRO 573 HG1 PRO 573 -17.780 3.334 -7.620 172 HD2 PRO 573 HD2 PRO 573 -15.700 5.072 -7.761 173 HD3 PRO 573 HD1 PRO 573 -17.269 5.488 -7.044 174 H TYR 574 HN TYR 574 -13.777 4.151 -6.165 175 HA TYR 574 HA TYR 574 -12.592 1.637 -6.351 176 HB2 TYR 574 HB2 TYR 574 -12.053 3.554 -7.775 177 HB3 TYR 574 HB1 TYR 574 -11.195 4.293 -6.443 178 HD1 TYR 574 HD2 TYR 574 -11.243 1.019 -8.249 179 HD2 TYR 574 HD1 TYR 574 -8.895 4.123 -6.550 180 HE1 TYR 574 HE2 TYR 574 -9.203 -0.125 -8.995 181 HE2 TYR 574 HE1 TYR 574 -6.847 2.994 -7.297 182 HH TYR 574 HH TYR 574 -6.119 0.697 -7.889 183 H PHE 575 HN PHE 575 -10.767 4.114 -4.640 184 HA PHE 575 HA PHE 575 -10.379 2.156 -2.472 185 HB2 PHE 575 HB2 PHE 575 -8.089 2.554 -2.431 186 HB3 PHE 575 HB1 PHE 575 -8.432 2.595 -4.154 187 HD1 PHE 575 HD2 PHE 575 -9.123 5.062 -4.993 188 HD2 PHE 575 HD1 PHE 575 -6.714 4.156 -1.609 189 HE1 PHE 575 HE2 PHE 575 -8.132 7.304 -5.107 190 HE2 PHE 575 HE1 PHE 575 -5.725 6.404 -1.711 191 HZ PHE 575 HZ PHE 575 -6.448 7.977 -3.453 192 H MET 576 HN MET 576 -11.747 4.945 -3.238 193 HA MET 576 HA MET 576 -10.802 6.756 -1.253 194 HB2 MET 576 HB2 MET 576 -13.505 6.718 -2.595 195 HB3 MET 576 HB1 MET 576 -12.767 8.082 -1.771 196 HG2 MET 576 HG2 MET 576 -11.626 6.782 -4.226 197 HG3 MET 576 HG1 MET 576 -12.692 8.182 -4.250 198 HE1 MET 576 HE1 MET 576 -10.990 9.707 -5.573 199 HE2 MET 576 HE2 MET 576 -10.000 8.256 -5.719 200 HE3 MET 576 HE3 MET 576 -9.270 9.768 -5.187 201 H LYS 577 HN LYS 577 -12.365 7.645 0.465 202 HA LYS 577 HA LYS 577 -12.720 5.709 2.416 203 HB2 LYS 577 HB2 LYS 577 -12.577 8.160 2.829 204 HB3 LYS 577 HB1 LYS 577 -14.225 8.324 2.227 205 HG2 LYS 577 HG2 LYS 577 -14.891 6.673 4.038 206 HG3 LYS 577 HG1 LYS 577 -13.280 6.926 4.713 207 HD2 LYS 577 HD2 LYS 577 -13.721 9.290 4.966 208 HD3 LYS 577 HD1 LYS 577 -15.295 9.107 4.186 209 HE2 LYS 577 HE2 LYS 577 -15.607 9.210 6.571 210 HE3 LYS 577 HE1 LYS 577 -15.977 7.582 6.009 211 HZ1 LYS 577 HZ1 LYS 577 -14.681 7.498 8.017 212 HZ2 LYS 577 HZ2 LYS 577 -13.467 8.450 7.333 213 HZ3 LYS 577 HZ3 LYS 577 -13.750 6.890 6.740 214 H GLY 578 HN GLY 578 -14.334 4.423 3.081 215 HA2 GLY 578 HA2 GLY 578 -16.522 3.750 3.453 216 HA3 GLY 578 HA1 GLY 578 -17.070 4.957 2.309 217 H SER 579 HN SER 579 -14.836 3.642 0.526 218 HA SER 579 HA SER 579 -16.599 2.167 -1.080 219 HB2 SER 579 HB2 SER 579 -13.581 2.023 -1.044 220 HB3 SER 579 HB1 SER 579 -14.641 1.594 -2.386 221 HG SER 579 HG SER 579 -13.788 4.066 -1.516 222 H ILE 580 HN ILE 580 -16.952 0.002 -1.340 223 HA ILE 580 HA ILE 580 -16.162 -1.669 0.905 224 HB ILE 580 HB ILE 580 -18.132 -2.153 -1.333 225 HG12 ILE 580 HG12 ILE 580 -18.901 -0.500 0.270 226 HG13 ILE 580 HG11 ILE 580 -19.795 -1.997 0.510 227 HG21 ILE 580 HG21 ILE 580 -17.503 -3.882 1.055 228 HG22 ILE 580 HG22 ILE 580 -17.103 -4.249 -0.623 229 HG23 ILE 580 HG23 ILE 580 -18.791 -4.165 -0.117 230 HD11 ILE 580 HD11 ILE 580 -17.516 -0.971 2.192 231 HD12 ILE 580 HD12 ILE 580 -18.304 -2.534 2.406 232 HD13 ILE 580 HD13 ILE 580 -19.222 -1.047 2.640 233 H ILE 581 HN ILE 581 -14.453 -2.867 0.788 234 HA ILE 581 HA ILE 581 -13.299 -3.472 -1.848 235 HB ILE 581 HB ILE 581 -11.908 -3.598 0.827 236 HG12 ILE 581 HG12 ILE 581 -12.748 -1.322 0.480 237 HG13 ILE 581 HG11 ILE 581 -10.998 -1.372 0.359 238 HG21 ILE 581 HG21 ILE 581 -10.883 -3.390 -1.991 239 HG22 ILE 581 HG22 ILE 581 -10.813 -4.811 -0.947 240 HG23 ILE 581 HG23 ILE 581 -9.886 -3.367 -0.537 241 HD11 ILE 581 HD11 ILE 581 -11.869 0.079 -1.325 242 HD12 ILE 581 HD12 ILE 581 -12.965 -1.175 -1.907 243 HD13 ILE 581 HD13 ILE 581 -11.220 -1.365 -2.101 244 H GLN 582 HN GLN 582 -13.249 -5.541 -2.519 245 HA GLN 582 HA GLN 582 -14.039 -7.607 -0.593 246 HB2 GLN 582 HB2 GLN 582 -15.298 -7.355 -2.735 247 HB3 GLN 582 HB1 GLN 582 -13.855 -7.848 -3.586 248 HG2 GLN 582 HG2 GLN 582 -13.877 -9.992 -2.436 249 HG3 GLN 582 HG1 GLN 582 -15.322 -9.513 -1.552 250 HE21 GLN 582 HE21 GLN 582 -14.023 -10.584 -4.547 251 HE22 GLN 582 HE22 GLN 582 -15.526 -10.865 -5.354 252 H LEU 583 HN LEU 583 -12.579 -8.821 0.267 253 HA LEU 583 HA LEU 583 -9.894 -8.882 -0.770 254 HB2 LEU 583 HB2 LEU 583 -11.142 -10.326 1.560 255 HB3 LEU 583 HB1 LEU 583 -9.424 -10.220 1.224 256 HG LEU 583 HG LEU 583 -11.229 -7.891 1.869 257 HD11 LEU 583 HD11 LEU 583 -9.109 -9.263 3.502 258 HD12 LEU 583 HD12 LEU 583 -10.849 -9.310 3.790 259 HD13 LEU 583 HD13 LEU 583 -9.969 -7.790 3.958 260 HD21 LEU 583 HD21 LEU 583 -9.462 -7.223 0.361 261 HD22 LEU 583 HD22 LEU 583 -8.258 -8.029 1.368 262 HD23 LEU 583 HD23 LEU 583 -9.116 -6.618 1.982 263 H ALA 584 HN ALA 584 -8.762 -11.149 -0.775 264 HA ALA 584 HA ALA 584 -9.788 -12.436 -3.040 265 HB1 ALA 584 HB1 ALA 584 -7.809 -13.582 -1.090 266 HB2 ALA 584 HB2 ALA 584 -7.415 -12.458 -2.391 267 HB3 ALA 584 HB3 ALA 584 -8.042 -14.062 -2.770 268 H ASN 585 HN ASN 585 -10.064 -13.231 0.362 269 HA ASN 585 HA ASN 585 -11.127 -15.829 0.015 270 HB2 ASN 585 HB2 ASN 585 -11.709 -15.702 2.380 271 HB3 ASN 585 HB1 ASN 585 -10.079 -15.106 2.111 272 HD21 ASN 585 HD21 ASN 585 -11.722 -14.604 4.350 273 HD22 ASN 585 HD22 ASN 585 -11.976 -12.891 4.435 274 H GLY 586 HN GLY 586 -12.497 -12.668 -0.232 275 HA2 GLY 586 HA2 GLY 586 -14.528 -12.485 -1.512 276 HA3 GLY 586 HA1 GLY 586 -15.095 -13.955 -0.737 277 H GLU 587 HN GLU 587 -13.556 -11.759 1.400 278 HA GLU 587 HA GLU 587 -16.203 -11.151 2.491 279 HB2 GLU 587 HB2 GLU 587 -15.185 -10.743 4.595 280 HB3 GLU 587 HB1 GLU 587 -14.450 -12.203 3.962 281 HG2 GLU 587 HG2 GLU 587 -12.471 -11.024 3.364 282 HG3 GLU 587 HG1 GLU 587 -13.199 -9.480 3.811 283 H LEU 588 HN LEU 588 -16.696 -9.022 3.243 284 HA LEU 588 HA LEU 588 -15.495 -6.999 1.473 285 HB2 LEU 588 HB2 LEU 588 -18.327 -7.172 2.496 286 HB3 LEU 588 HB1 LEU 588 -17.703 -5.979 1.373 287 HG LEU 588 HG LEU 588 -17.883 -8.939 0.821 288 HD11 LEU 588 HD11 LEU 588 -20.086 -7.902 0.985 289 HD12 LEU 588 HD12 LEU 588 -19.710 -8.353 -0.678 290 HD13 LEU 588 HD13 LEU 588 -19.596 -6.667 -0.174 291 HD21 LEU 588 HD21 LEU 588 -17.413 -8.228 -1.505 292 HD22 LEU 588 HD22 LEU 588 -16.071 -7.930 -0.399 293 HD23 LEU 588 HD23 LEU 588 -17.110 -6.597 -0.907 294 H LYS 589 HN LYS 589 -14.532 -5.353 2.454 295 HA LYS 589 HA LYS 589 -15.443 -4.565 5.137 296 HB2 LYS 589 HB2 LYS 589 -12.599 -4.897 4.189 297 HB3 LYS 589 HB1 LYS 589 -13.051 -4.110 5.688 298 HG2 LYS 589 HG2 LYS 589 -14.007 -6.181 6.516 299 HG3 LYS 589 HG1 LYS 589 -13.629 -6.972 4.990 300 HD2 LYS 589 HD2 LYS 589 -11.975 -7.518 6.700 301 HD3 LYS 589 HD1 LYS 589 -11.252 -6.615 5.370 302 HE2 LYS 589 HE2 LYS 589 -10.410 -5.759 7.449 303 HE3 LYS 589 HE1 LYS 589 -11.460 -4.559 6.702 304 HZ1 LYS 589 HZ1 LYS 589 -12.163 -6.356 8.957 305 HZ2 LYS 589 HZ2 LYS 589 -13.255 -5.324 8.185 306 HZ3 LYS 589 HZ3 LYS 589 -11.942 -4.676 9.035 307 H LYS 590 HN LYS 590 -14.728 -2.367 5.737 308 HA LYS 590 HA LYS 590 -14.912 -0.518 3.518 309 HB2 LYS 590 HB2 LYS 590 -14.653 -0.112 6.499 310 HB3 LYS 590 HB1 LYS 590 -14.676 1.213 5.350 311 HG2 LYS 590 HG2 LYS 590 -16.879 -0.776 5.334 312 HG3 LYS 590 HG1 LYS 590 -16.848 0.480 6.570 313 HD2 LYS 590 HD2 LYS 590 -16.690 2.169 4.767 314 HD3 LYS 590 HD1 LYS 590 -16.856 0.877 3.578 315 HE2 LYS 590 HE2 LYS 590 -19.027 0.306 4.449 316 HE3 LYS 590 HE1 LYS 590 -18.850 1.483 5.746 317 HZ1 LYS 590 HZ1 LYS 590 -18.992 2.118 2.844 318 HZ2 LYS 590 HZ2 LYS 590 -18.829 3.248 4.095 319 HZ3 LYS 590 HZ3 LYS 590 -20.243 2.334 3.966 320 H VAL 591 HN VAL 591 -13.306 0.960 2.922 321 HA VAL 591 HA VAL 591 -10.867 -0.186 2.427 322 HB VAL 591 HB VAL 591 -11.119 2.796 2.677 323 HG11 VAL 591 HG11 VAL 591 -9.595 0.994 0.807 324 HG12 VAL 591 HG12 VAL 591 -8.927 1.982 2.109 325 HG13 VAL 591 HG13 VAL 591 -9.649 2.753 0.693 326 HG21 VAL 591 HG21 VAL 591 -12.163 1.086 0.432 327 HG22 VAL 591 HG22 VAL 591 -12.052 2.847 0.426 328 HG23 VAL 591 HG23 VAL 591 -13.130 2.036 1.560 329 H GLU 592 HN GLU 592 -11.601 2.132 5.022 330 HA GLU 592 HA GLU 592 -8.839 2.366 5.738 331 HB2 GLU 592 HB2 GLU 592 -9.613 3.866 7.491 332 HB3 GLU 592 HB1 GLU 592 -10.362 4.261 5.951 333 HG2 GLU 592 HG2 GLU 592 -12.374 2.990 6.689 334 HG3 GLU 592 HG1 GLU 592 -11.616 2.820 8.271 335 H ASP 593 HN ASP 593 -11.160 0.061 6.460 336 HA ASP 593 HA ASP 593 -10.070 -0.447 9.137 337 HB2 ASP 593 HB2 ASP 593 -12.589 -0.370 8.688 338 HB3 ASP 593 HB1 ASP 593 -12.377 -1.901 7.843 339 H LEU 594 HN LEU 594 -9.604 -1.339 5.990 340 HA LEU 594 HA LEU 594 -9.015 -4.080 6.209 341 HB2 LEU 594 HB2 LEU 594 -7.898 -1.964 4.371 342 HB3 LEU 594 HB1 LEU 594 -7.677 -3.690 4.165 343 HG LEU 594 HG LEU 594 -10.411 -2.430 4.223 344 HD11 LEU 594 HD11 LEU 594 -10.358 -2.478 1.797 345 HD12 LEU 594 HD12 LEU 594 -8.670 -2.986 1.835 346 HD13 LEU 594 HD13 LEU 594 -9.127 -1.392 2.442 347 HD21 LEU 594 HD21 LEU 594 -10.993 -4.476 2.978 348 HD22 LEU 594 HD22 LEU 594 -10.365 -4.816 4.592 349 HD23 LEU 594 HD23 LEU 594 -9.336 -5.041 3.179 350 H LYS 595 HN LYS 595 -7.460 -5.024 7.309 351 HA LYS 595 HA LYS 595 -5.107 -3.429 8.047 352 HB2 LYS 595 HB2 LYS 595 -6.352 -5.818 9.409 353 HB3 LYS 595 HB1 LYS 595 -4.834 -5.084 9.898 354 HG2 LYS 595 HG2 LYS 595 -7.490 -3.674 9.837 355 HG3 LYS 595 HG1 LYS 595 -6.732 -4.357 11.275 356 HD2 LYS 595 HD2 LYS 595 -4.856 -2.839 11.045 357 HD3 LYS 595 HD1 LYS 595 -5.525 -2.202 9.542 358 HE2 LYS 595 HE2 LYS 595 -5.965 -0.709 11.430 359 HE3 LYS 595 HE1 LYS 595 -7.456 -1.348 10.741 360 HZ1 LYS 595 HZ1 LYS 595 -7.463 -1.370 13.168 361 HZ2 LYS 595 HZ2 LYS 595 -6.121 -2.401 13.175 362 HZ3 LYS 595 HZ3 LYS 595 -7.592 -2.931 12.533 363 H THR 596 HN THR 596 -3.114 -4.946 8.448 364 HA THR 596 HA THR 596 -2.411 -5.677 5.840 365 HB THR 596 HB THR 596 -0.749 -4.895 7.433 366 HG1 THR 596 HG1 THR 596 0.691 -6.933 7.090 367 HG21 THR 596 HG21 THR 596 -1.597 -6.017 9.445 368 HG22 THR 596 HG22 THR 596 0.115 -6.348 9.188 369 HG23 THR 596 HG23 THR 596 -1.093 -7.571 8.785 370 H GLU 597 HN GLU 597 -3.338 -7.688 8.600 371 HA GLU 597 HA GLU 597 -2.607 -10.159 7.508 372 HB2 GLU 597 HB2 GLU 597 -4.744 -9.507 9.516 373 HB3 GLU 597 HB1 GLU 597 -4.164 -11.129 9.170 374 HG2 GLU 597 HG2 GLU 597 -1.940 -10.510 9.916 375 HG3 GLU 597 HG1 GLU 597 -2.487 -8.863 10.223 376 H ASP 598 HN ASP 598 -5.392 -8.154 7.002 377 HA ASP 598 HA ASP 598 -7.120 -10.073 5.877 378 HB2 ASP 598 HB2 ASP 598 -6.915 -7.106 5.310 379 HB3 ASP 598 HB1 ASP 598 -8.232 -8.136 4.782 380 H PHE 599 HN PHE 599 -4.760 -7.866 4.414 381 HA PHE 599 HA PHE 599 -5.159 -8.910 1.783 382 HB2 PHE 599 HB2 PHE 599 -3.082 -7.053 2.941 383 HB3 PHE 599 HB1 PHE 599 -3.003 -7.628 1.281 384 HD1 PHE 599 HD1 PHE 599 -5.910 -6.554 3.358 385 HD2 PHE 599 HD2 PHE 599 -3.539 -5.881 -0.106 386 HE1 PHE 599 HE1 PHE 599 -7.487 -4.820 2.619 387 HE2 PHE 599 HE2 PHE 599 -5.115 -4.142 -0.846 388 HZ PHE 599 HZ PHE 599 -7.092 -3.610 0.515 389 H ILE 600 HN ILE 600 -2.788 -9.447 4.357 390 HA ILE 600 HA ILE 600 -1.006 -11.106 3.080 391 HB ILE 600 HB ILE 600 -2.106 -11.200 5.876 392 HG12 ILE 600 HG12 ILE 600 0.541 -10.273 4.751 393 HG13 ILE 600 HG11 ILE 600 -0.797 -9.228 5.192 394 HG21 ILE 600 HG21 ILE 600 0.164 -12.820 4.730 395 HG22 ILE 600 HG22 ILE 600 -1.351 -13.439 5.399 396 HG23 ILE 600 HG23 ILE 600 -0.177 -12.642 6.451 397 HD11 ILE 600 HD11 ILE 600 -0.582 -9.886 7.506 398 HD12 ILE 600 HD12 ILE 600 0.943 -9.247 6.892 399 HD13 ILE 600 HD13 ILE 600 0.730 -10.988 7.088 400 H GLN 601 HN GLN 601 -3.928 -12.159 4.819 401 HA GLN 601 HA GLN 601 -3.810 -14.834 4.040 402 HB2 GLN 601 HB2 GLN 601 -6.134 -13.093 4.854 403 HB3 GLN 601 HB1 GLN 601 -6.287 -14.823 4.565 404 HG2 GLN 601 HG2 GLN 601 -4.701 -15.291 6.301 405 HG3 GLN 601 HG1 GLN 601 -4.434 -13.570 6.573 406 HE21 GLN 601 HE21 GLN 601 -6.570 -16.250 7.037 407 HE22 GLN 601 HE22 GLN 601 -7.637 -15.477 8.158 408 H SER 602 HN SER 602 -5.469 -12.073 2.552 409 HA SER 602 HA SER 602 -6.888 -13.438 0.609 410 HB2 SER 602 HB2 SER 602 -5.623 -10.696 0.470 411 HB3 SER 602 HB1 SER 602 -6.782 -11.314 -0.709 412 HG SER 602 HG SER 602 -7.182 -10.757 2.040 413 H ALA 603 HN ALA 603 -3.579 -12.133 0.366 414 HA ALA 603 HA ALA 603 -3.187 -12.981 -2.308 415 HB1 ALA 603 HB1 ALA 603 -1.866 -11.203 -1.259 416 HB2 ALA 603 HB2 ALA 603 -0.841 -12.475 -1.923 417 HB3 ALA 603 HB3 ALA 603 -1.137 -12.399 -0.187 418 H GLU 604 HN GLU 604 -2.686 -14.522 0.799 419 HA GLU 604 HA GLU 604 -1.132 -16.699 -0.160 420 HB2 GLU 604 HB2 GLU 604 -2.742 -16.264 2.353 421 HB3 GLU 604 HB1 GLU 604 -1.718 -17.677 2.078 422 HG2 GLU 604 HG2 GLU 604 -0.682 -14.872 1.880 423 HG3 GLU 604 HG1 GLU 604 -0.726 -15.760 3.396 424 H ILE 605 HN ILE 605 -4.570 -16.253 0.501 425 HA ILE 605 HA ILE 605 -5.360 -18.912 -0.116 426 HB ILE 605 HB ILE 605 -7.018 -16.379 -0.235 427 HG12 ILE 605 HG12 ILE 605 -6.717 -18.291 2.083 428 HG13 ILE 605 HG11 ILE 605 -5.777 -16.816 1.932 429 HG21 ILE 605 HG21 ILE 605 -7.843 -19.258 0.130 430 HG22 ILE 605 HG22 ILE 605 -8.104 -18.279 -1.312 431 HG23 ILE 605 HG23 ILE 605 -8.921 -17.864 0.194 432 HD11 ILE 605 HD11 ILE 605 -7.593 -16.405 3.416 433 HD12 ILE 605 HD12 ILE 605 -8.761 -17.044 2.249 434 HD13 ILE 605 HD13 ILE 605 -7.910 -15.537 1.910 435 H SER 606 HN SER 606 -4.319 -16.323 -2.010 436 HA SER 606 HA SER 606 -5.674 -17.247 -4.431 437 HB2 SER 606 HB2 SER 606 -3.896 -14.847 -3.965 438 HB3 SER 606 HB1 SER 606 -4.789 -15.194 -5.445 439 HG SER 606 HG SER 606 -5.826 -14.581 -2.877 440 H ASN 607 HN ASN 607 -4.437 -17.632 -6.365 441 HA ASN 607 HA ASN 607 -1.749 -18.692 -5.795 442 HB2 ASN 607 HB2 ASN 607 -3.871 -19.642 -7.716 443 HB3 ASN 607 HB1 ASN 607 -2.209 -20.218 -7.765 444 HD21 ASN 607 HD21 ASN 607 -4.719 -21.639 -7.221 445 HD22 ASN 607 HD22 ASN 607 -4.502 -22.391 -5.678 446 H ASP 608 HN ASP 608 -3.518 -16.410 -7.571 447 HA ASP 608 HA ASP 608 -1.255 -15.971 -9.405 448 HB2 ASP 608 HB2 ASP 608 -4.113 -15.006 -9.482 449 HB3 ASP 608 HB1 ASP 608 -2.857 -14.326 -10.511 450 H LEU 609 HN LEU 609 -1.925 -15.201 -6.436 451 HA LEU 609 HA LEU 609 -0.928 -12.448 -6.680 452 HB2 LEU 609 HB2 LEU 609 -3.072 -13.269 -4.721 453 HB3 LEU 609 HB1 LEU 609 -2.486 -11.652 -5.045 454 HG LEU 609 HG LEU 609 -3.958 -13.321 -7.080 455 HD11 LEU 609 HD11 LEU 609 -5.375 -12.800 -5.122 456 HD12 LEU 609 HD12 LEU 609 -5.912 -12.023 -6.610 457 HD13 LEU 609 HD13 LEU 609 -5.050 -11.086 -5.390 458 HD21 LEU 609 HD21 LEU 609 -2.520 -11.598 -8.007 459 HD22 LEU 609 HD22 LEU 609 -3.285 -10.394 -6.970 460 HD23 LEU 609 HD23 LEU 609 -4.222 -11.197 -8.230 461 H LYS 610 HN LYS 610 0.299 -11.752 -4.829 462 HA LYS 610 HA LYS 610 0.704 -13.544 -2.620 463 HB2 LYS 610 HB2 LYS 610 3.125 -13.858 -2.981 464 HB3 LYS 610 HB1 LYS 610 2.152 -14.647 -4.212 465 HG2 LYS 610 HG2 LYS 610 2.666 -12.971 -5.809 466 HG3 LYS 610 HG1 LYS 610 3.431 -11.957 -4.583 467 HD2 LYS 610 HD2 LYS 610 5.178 -13.610 -4.273 468 HD3 LYS 610 HD1 LYS 610 4.389 -14.686 -5.427 469 HE2 LYS 610 HE2 LYS 610 4.764 -13.130 -7.215 470 HE3 LYS 610 HE1 LYS 610 5.394 -11.928 -6.091 471 HZ1 LYS 610 HZ1 LYS 610 6.637 -14.574 -6.601 472 HZ2 LYS 610 HZ2 LYS 610 7.261 -13.340 -5.627 473 HZ3 LYS 610 HZ3 LYS 610 7.146 -13.120 -7.300 474 H ILE 611 HN ILE 611 1.971 -12.672 -0.953 475 HA ILE 611 HA ILE 611 2.174 -9.757 -0.950 476 HB ILE 611 HB ILE 611 2.564 -11.767 1.270 477 HG12 ILE 611 HG12 ILE 611 0.240 -11.357 0.141 478 HG13 ILE 611 HG11 ILE 611 0.365 -11.511 1.882 479 HG21 ILE 611 HG21 ILE 611 2.244 -8.794 1.478 480 HG22 ILE 611 HG22 ILE 611 3.773 -9.660 1.633 481 HG23 ILE 611 HG23 ILE 611 2.480 -9.924 2.807 482 HD11 ILE 611 HD11 ILE 611 -1.124 -9.689 1.236 483 HD12 ILE 611 HD12 ILE 611 0.188 -8.932 0.329 484 HD13 ILE 611 HD13 ILE 611 0.296 -9.070 2.084 485 H ASP 612 HN ASP 612 4.094 -8.705 -0.439 486 HA ASP 612 HA ASP 612 6.533 -10.345 -0.349 487 HB2 ASP 612 HB2 ASP 612 6.004 -8.915 -2.524 488 HB3 ASP 612 HB1 ASP 612 6.635 -7.606 -1.525 489 H SER 613 HN SER 613 8.408 -8.974 0.517 490 HA SER 613 HA SER 613 7.449 -7.203 2.656 491 HB2 SER 613 HB2 SER 613 9.467 -9.429 3.031 492 HB3 SER 613 HB1 SER 613 8.877 -8.330 4.273 493 HG SER 613 HG SER 613 6.807 -9.516 3.035 494 H SER 614 HN SER 614 8.480 -5.316 2.516 495 HA SER 614 HA SER 614 11.313 -5.303 1.766 496 HB2 SER 614 HB2 SER 614 10.764 -3.247 0.331 497 HB3 SER 614 HB1 SER 614 10.305 -4.820 -0.314 498 HG SER 614 HG SER 614 8.183 -4.359 0.678 499 H THR 615 HN THR 615 12.190 -4.571 3.631 500 HA THR 615 HA THR 615 10.884 -2.664 5.322 501 HB THR 615 HB THR 615 13.700 -3.745 5.376 502 HG1 THR 615 HG1 THR 615 11.662 -4.313 7.252 503 HG21 THR 615 HG21 THR 615 13.791 -2.853 7.687 504 HG22 THR 615 HG22 THR 615 12.256 -2.026 7.409 505 HG23 THR 615 HG23 THR 615 13.684 -1.583 6.469 506 H VAL 616 HN VAL 616 10.626 -0.630 4.532 507 HA VAL 616 HA VAL 616 12.491 0.792 3.029 508 HB VAL 616 HB VAL 616 10.360 1.754 3.144 509 HG11 VAL 616 HG11 VAL 616 9.548 0.718 5.170 510 HG12 VAL 616 HG12 VAL 616 9.268 2.458 5.227 511 HG13 VAL 616 HG13 VAL 616 10.595 1.748 6.140 512 HG21 VAL 616 HG21 VAL 616 12.247 3.366 4.845 513 HG22 VAL 616 HG22 VAL 616 10.730 3.994 4.203 514 HG23 VAL 616 HG23 VAL 616 12.009 3.476 3.100 515 H GLU 617 HN GLU 617 14.465 1.413 3.490 516 HA GLU 617 HA GLU 617 15.288 1.562 6.295 517 HB2 GLU 617 HB2 GLU 617 17.000 1.413 3.829 518 HB3 GLU 617 HB1 GLU 617 17.579 1.370 5.484 519 HG2 GLU 617 HG2 GLU 617 16.068 -0.696 5.709 520 HG3 GLU 617 HG1 GLU 617 16.076 -0.703 3.951 521 H ARG 618 HN ARG 618 14.612 3.482 3.561 522 HA ARG 618 HA ARG 618 15.311 5.865 5.017 523 HB2 ARG 618 HB2 ARG 618 17.469 5.320 4.031 524 HB3 ARG 618 HB1 ARG 618 16.740 5.183 2.437 525 HG2 ARG 618 HG2 ARG 618 16.169 7.581 2.525 526 HG3 ARG 618 HG1 ARG 618 16.982 7.693 4.087 527 HD2 ARG 618 HD2 ARG 618 19.071 6.959 3.036 528 HD3 ARG 618 HD1 ARG 618 18.249 6.880 1.481 529 HE ARG 618 HE ARG 618 17.813 9.418 2.163 530 HH11 ARG 618 HH11 ARG 618 20.729 7.498 2.266 531 HH12 ARG 618 HH12 ARG 618 21.782 8.844 1.974 532 HH21 ARG 618 HH21 ARG 618 19.190 11.194 1.765 533 HH22 ARG 618 HH22 ARG 618 20.906 10.952 1.704 534 H ILE 619 HN ILE 619 14.314 7.704 4.197 535 HA ILE 619 HA ILE 619 12.621 7.346 1.821 536 HB ILE 619 HB ILE 619 11.804 8.474 4.501 537 HG12 ILE 619 HG12 ILE 619 10.513 6.377 2.753 538 HG13 ILE 619 HG11 ILE 619 11.635 6.010 4.061 539 HG21 ILE 619 HG21 ILE 619 11.047 10.025 2.776 540 HG22 ILE 619 HG22 ILE 619 9.681 9.138 3.452 541 HG23 ILE 619 HG23 ILE 619 10.326 8.694 1.871 542 HD11 ILE 619 HD11 ILE 619 9.294 5.732 4.719 543 HD12 ILE 619 HD12 ILE 619 8.999 7.436 4.368 544 HD13 ILE 619 HD13 ILE 619 10.104 6.980 5.668 545 H GLU 620 HN GLU 620 12.859 8.925 0.375 546 HA GLU 620 HA GLU 620 14.101 11.438 1.288 547 HB2 GLU 620 HB2 GLU 620 14.530 10.205 -1.428 548 HB3 GLU 620 HB1 GLU 620 15.386 11.562 -0.718 549 HG2 GLU 620 HG2 GLU 620 16.333 10.025 0.971 550 HG3 GLU 620 HG1 GLU 620 15.548 8.683 0.135 551 H ASP 621 HN ASP 621 13.163 13.284 0.630 552 HA ASP 621 HA ASP 621 10.659 13.132 -0.781 553 HB2 ASP 621 HB2 ASP 621 10.479 15.522 -0.373 554 HB3 ASP 621 HB1 ASP 621 10.986 14.715 1.106 555 H SER 622 HN SER 622 10.268 13.644 -2.851 556 HA SER 622 HA SER 622 12.597 14.093 -4.559 557 HB2 SER 622 HB2 SER 622 11.070 12.197 -5.072 558 HB3 SER 622 HB1 SER 622 9.753 13.346 -5.296 559 HG SER 622 HG SER 622 12.028 12.899 -6.886 560 H HIS 623 HN HIS 623 12.210 15.539 -6.468 561 HA HIS 623 HA HIS 623 11.124 18.057 -5.480 562 HB2 HIS 623 HB2 HIS 623 12.835 17.441 -7.899 563 HB3 HIS 623 HB1 HIS 623 12.319 19.054 -7.420 564 HD1 HIS 623 HD1 HIS 623 15.019 16.706 -6.999 565 HD2 HIS 623 HD2 HIS 623 13.339 19.740 -4.711 566 HE1 HIS 623 HE1 HIS 623 16.740 17.268 -5.257 567 HE2 HIS 623 HE2 HIS 623 15.608 18.945 -3.755 568 H SER 624 HN SER 624 10.049 15.488 -7.204 569 HA SER 624 HA SER 624 8.355 16.922 -9.045 570 HB2 SER 624 HB2 SER 624 8.307 14.020 -8.172 571 HB3 SER 624 HB1 SER 624 7.434 14.702 -9.543 572 HG SER 624 HG SER 624 9.705 13.637 -9.733 573 HA PRO 625 HA PRO 625 5.189 18.173 -6.302 574 HB2 PRO 625 HB2 PRO 625 3.270 17.137 -8.291 575 HB3 PRO 625 HB1 PRO 625 3.397 18.751 -7.592 576 HG2 PRO 625 HG2 PRO 625 4.199 18.219 -10.105 577 HG3 PRO 625 HG1 PRO 625 5.005 19.422 -9.086 578 HD2 PRO 625 HD2 PRO 625 5.914 16.722 -9.896 579 HD3 PRO 625 HD1 PRO 625 6.861 18.156 -9.465 580 H GLY 626 HN GLY 626 4.964 17.026 -4.550 581 HA2 GLY 626 HA2 GLY 626 4.122 15.502 -3.066 582 HA3 GLY 626 HA1 GLY 626 2.882 15.168 -4.264 583 H VAL 627 HN VAL 627 6.371 14.697 -4.642 584 HA VAL 627 HA VAL 627 5.845 11.797 -4.771 585 HB VAL 627 HB VAL 627 7.866 13.376 -6.371 586 HG11 VAL 627 HG11 VAL 627 8.734 11.170 -5.774 587 HG12 VAL 627 HG12 VAL 627 8.372 11.265 -7.498 588 HG13 VAL 627 HG13 VAL 627 7.271 10.417 -6.411 589 HG21 VAL 627 HG21 VAL 627 6.544 12.781 -8.303 590 HG22 VAL 627 HG22 VAL 627 5.521 13.605 -7.125 591 HG23 VAL 627 HG23 VAL 627 5.438 11.852 -7.295 592 H ALA 628 HN ALA 628 7.120 10.448 -3.653 593 HA ALA 628 HA ALA 628 9.652 11.420 -2.542 594 HB1 ALA 628 HB1 ALA 628 9.129 10.402 -0.346 595 HB2 ALA 628 HB2 ALA 628 7.479 10.103 -0.902 596 HB3 ALA 628 HB3 ALA 628 8.066 11.757 -0.732 597 H VAL 629 HN VAL 629 11.207 9.896 -2.550 598 HA VAL 629 HA VAL 629 10.456 7.321 -3.698 599 HB VAL 629 HB VAL 629 12.145 8.172 -5.031 600 HG11 VAL 629 HG11 VAL 629 12.651 10.077 -3.590 601 HG12 VAL 629 HG12 VAL 629 14.113 9.325 -4.237 602 HG13 VAL 629 HG13 VAL 629 13.632 9.027 -2.566 603 HG21 VAL 629 HG21 VAL 629 12.702 5.892 -4.319 604 HG22 VAL 629 HG22 VAL 629 13.628 6.541 -2.964 605 HG23 VAL 629 HG23 VAL 629 14.157 6.845 -4.619 606 H ILE 630 HN ILE 630 10.271 5.646 -2.487 607 HA ILE 630 HA ILE 630 11.342 5.689 0.213 608 HB ILE 630 HB ILE 630 9.642 3.519 -0.991 609 HG12 ILE 630 HG12 ILE 630 8.485 5.673 -1.334 610 HG13 ILE 630 HG11 ILE 630 7.664 4.666 -0.148 611 HG21 ILE 630 HG21 ILE 630 8.982 3.164 1.331 612 HG22 ILE 630 HG22 ILE 630 10.030 4.493 1.828 613 HG23 ILE 630 HG23 ILE 630 10.728 3.034 1.125 614 HD11 ILE 630 HD11 ILE 630 9.455 6.999 0.439 615 HD12 ILE 630 HD12 ILE 630 8.683 5.970 1.647 616 HD13 ILE 630 HD13 ILE 630 7.697 6.962 0.571 617 H GLN 631 HN GLN 631 13.162 4.672 0.701 618 HA GLN 631 HA GLN 631 14.370 2.872 -1.257 619 HB2 GLN 631 HB2 GLN 631 15.689 4.763 -0.358 620 HB3 GLN 631 HB1 GLN 631 15.503 4.113 1.260 621 HG2 GLN 631 HG2 GLN 631 16.734 2.385 -0.814 622 HG3 GLN 631 HG1 GLN 631 17.677 3.726 -0.167 623 HE21 GLN 631 HE21 GLN 631 16.363 0.600 0.446 624 HE22 GLN 631 HE22 GLN 631 17.085 0.373 2.000 625 H PHE 632 HN PHE 632 13.999 0.790 -1.039 626 HA PHE 632 HA PHE 632 13.238 -0.269 1.602 627 HB2 PHE 632 HB2 PHE 632 12.743 -1.408 -1.150 628 HB3 PHE 632 HB1 PHE 632 12.184 -2.096 0.366 629 HD1 PHE 632 HD2 PHE 632 10.378 -1.046 1.612 630 HD2 PHE 632 HD1 PHE 632 11.649 0.457 -2.156 631 HE1 PHE 632 HE2 PHE 632 8.287 0.225 1.415 632 HE2 PHE 632 HE1 PHE 632 9.555 1.731 -2.358 633 HZ PHE 632 HZ PHE 632 7.870 1.612 -0.572 634 H ALA 633 HN ALA 633 14.065 -2.201 2.333 635 HA ALA 633 HA ALA 633 16.320 -3.360 0.837 636 HB1 ALA 633 HB1 ALA 633 15.638 -3.525 3.773 637 HB2 ALA 633 HB2 ALA 633 16.954 -2.598 3.053 638 HB3 ALA 633 HB3 ALA 633 16.981 -4.361 2.995 639 H VAL 634 HN VAL 634 15.452 -4.901 -0.420 640 HA VAL 634 HA VAL 634 13.065 -6.306 0.401 641 HB VAL 634 HB VAL 634 14.719 -6.622 -2.106 642 HG11 VAL 634 HG11 VAL 634 13.351 -8.584 -1.624 643 HG12 VAL 634 HG12 VAL 634 12.733 -7.710 -3.026 644 HG13 VAL 634 HG13 VAL 634 11.924 -7.559 -1.466 645 HG21 VAL 634 HG21 VAL 634 13.813 -4.362 -1.869 646 HG22 VAL 634 HG22 VAL 634 12.200 -5.030 -1.620 647 HG23 VAL 634 HG23 VAL 634 13.011 -5.237 -3.172 648 H GLY 635 HN GLY 635 12.991 -8.187 1.381 649 HA2 GLY 635 HA2 GLY 635 13.433 -10.384 1.874 650 HA3 GLY 635 HA1 GLY 635 14.666 -10.365 0.625 651 H GLU 636 HN GLU 636 15.598 -11.804 2.357 652 HA GLU 636 HA GLU 636 16.716 -10.557 4.681 653 HB2 GLU 636 HB2 GLU 636 17.336 -13.196 3.376 654 HB3 GLU 636 HB1 GLU 636 17.852 -12.706 4.979 655 HG2 GLU 636 HG2 GLU 636 15.649 -12.756 5.811 656 HG3 GLU 636 HG1 GLU 636 14.964 -12.873 4.190 657 H HIS 637 HN HIS 637 17.596 -10.929 1.394 658 HA HIS 637 HA HIS 637 20.410 -10.470 1.756 659 HB2 HIS 637 HB2 HIS 637 19.559 -11.690 -0.208 660 HB3 HIS 637 HB1 HIS 637 18.684 -10.255 -0.728 661 HD1 HIS 637 HD1 HIS 637 22.294 -11.270 -0.054 662 HD2 HIS 637 HD2 HIS 637 20.071 -8.753 -2.501 663 HE1 HIS 637 HE1 HIS 637 23.953 -10.203 -1.614 664 HE2 HIS 637 HE2 HIS 637 22.556 -8.840 -3.207 665 H ARG 638 HN ARG 638 17.770 -8.648 2.165 666 HA ARG 638 HA ARG 638 17.189 -6.481 2.235 667 HB2 ARG 638 HB2 ARG 638 18.788 -5.068 3.464 668 HB3 ARG 638 HB1 ARG 638 18.552 -6.642 4.193 669 HG2 ARG 638 HG2 ARG 638 20.651 -7.386 3.592 670 HG3 ARG 638 HG1 ARG 638 20.824 -6.149 2.351 671 HD2 ARG 638 HD2 ARG 638 20.888 -5.778 5.340 672 HD3 ARG 638 HD1 ARG 638 22.219 -5.564 4.211 673 HE ARG 638 HE ARG 638 19.826 -3.843 4.189 674 HH11 ARG 638 HH11 ARG 638 23.312 -4.222 4.114 675 HH12 ARG 638 HH12 ARG 638 23.607 -2.533 3.863 676 HH21 ARG 638 HH21 ARG 638 20.209 -1.638 3.849 677 HH22 ARG 638 HH22 ARG 638 21.848 -1.065 3.714 678 H ALA 639 HN ALA 639 17.632 -7.024 -0.293 679 HA ALA 639 HA ALA 639 19.555 -5.413 -1.606 680 HB1 ALA 639 HB1 ALA 639 18.293 -5.877 -3.632 681 HB2 ALA 639 HB2 ALA 639 16.948 -6.490 -2.669 682 HB3 ALA 639 HB3 ALA 639 18.490 -7.345 -2.674 683 H GLN 640 HN GLN 640 19.581 -3.277 -1.824 684 HA GLN 640 HA GLN 640 17.298 -1.798 -0.872 685 HB2 GLN 640 HB2 GLN 640 20.070 -0.950 -1.660 686 HB3 GLN 640 HB1 GLN 640 18.811 0.207 -1.245 687 HG2 GLN 640 HG2 GLN 640 18.549 -1.053 0.923 688 HG3 GLN 640 HG1 GLN 640 20.036 -1.901 0.506 689 HE21 GLN 640 HE21 GLN 640 19.425 -0.114 2.734 690 HE22 GLN 640 HE22 GLN 640 20.603 1.160 2.634 691 H VAL 641 HN VAL 641 15.762 -1.088 -2.026 692 HA VAL 641 HA VAL 641 16.203 -0.445 -4.872 693 HB VAL 641 HB VAL 641 13.703 -1.622 -3.630 694 HG11 VAL 641 HG11 VAL 641 12.870 -1.758 -5.933 695 HG12 VAL 641 HG12 VAL 641 14.313 -0.914 -6.496 696 HG13 VAL 641 HG13 VAL 641 13.167 -0.091 -5.438 697 HG21 VAL 641 HG21 VAL 641 15.699 -2.842 -5.527 698 HG22 VAL 641 HG22 VAL 641 14.194 -3.593 -5.001 699 HG23 VAL 641 HG23 VAL 641 15.477 -3.274 -3.833 700 H SER 642 HN SER 642 15.820 1.618 -5.332 701 HA SER 642 HA SER 642 14.174 3.177 -3.453 702 HB2 SER 642 HB2 SER 642 16.279 4.158 -5.399 703 HB3 SER 642 HB1 SER 642 15.405 5.146 -4.226 704 HG SER 642 HG SER 642 16.947 2.899 -3.458 705 H VAL 643 HN VAL 643 12.157 3.457 -4.178 706 HA VAL 643 HA VAL 643 11.787 3.891 -7.055 707 HB VAL 643 HB VAL 643 10.850 1.766 -6.444 708 HG11 VAL 643 HG11 VAL 643 9.071 1.541 -4.775 709 HG12 VAL 643 HG12 VAL 643 9.274 3.239 -4.341 710 HG13 VAL 643 HG13 VAL 643 10.585 2.093 -4.058 711 HG21 VAL 643 HG21 VAL 643 9.611 3.013 -8.078 712 HG22 VAL 643 HG22 VAL 643 8.727 3.856 -6.809 713 HG23 VAL 643 HG23 VAL 643 8.489 2.126 -7.048 714 H GLU 644 HN GLU 644 11.023 5.787 -7.612 715 HA GLU 644 HA GLU 644 10.134 7.698 -5.633 716 HB2 GLU 644 HB2 GLU 644 10.346 7.917 -8.645 717 HB3 GLU 644 HB1 GLU 644 10.062 9.253 -7.539 718 HG2 GLU 644 HG2 GLU 644 12.226 9.158 -6.680 719 HG3 GLU 644 HG1 GLU 644 12.506 7.536 -7.311 720 H VAL 645 HN VAL 645 8.065 7.561 -4.931 721 HA VAL 645 HA VAL 645 5.954 7.204 -6.962 722 HB VAL 645 HB VAL 645 4.572 6.028 -5.296 723 HG11 VAL 645 HG11 VAL 645 5.743 3.888 -5.337 724 HG12 VAL 645 HG12 VAL 645 7.245 4.714 -5.746 725 HG13 VAL 645 HG13 VAL 645 5.896 4.729 -6.880 726 HG21 VAL 645 HG21 VAL 645 7.053 6.072 -3.579 727 HG22 VAL 645 HG22 VAL 645 5.577 5.170 -3.230 728 HG23 VAL 645 HG23 VAL 645 5.546 6.933 -3.260 729 H LEU 646 HN LEU 646 4.054 8.434 -6.643 730 HA LEU 646 HA LEU 646 4.299 10.819 -5.244 731 HB2 LEU 646 HB2 LEU 646 1.925 9.431 -6.422 732 HB3 LEU 646 HB1 LEU 646 1.767 10.934 -5.545 733 HG LEU 646 HG LEU 646 3.534 11.844 -7.115 734 HD11 LEU 646 HD11 LEU 646 4.306 9.777 -7.940 735 HD12 LEU 646 HD12 LEU 646 3.655 10.734 -9.275 736 HD13 LEU 646 HD13 LEU 646 2.718 9.399 -8.600 737 HD21 LEU 646 HD21 LEU 646 1.190 12.523 -7.209 738 HD22 LEU 646 HD22 LEU 646 0.828 11.130 -8.230 739 HD23 LEU 646 HD23 LEU 646 1.891 12.408 -8.822 740 H VAL 647 HN VAL 647 3.475 11.547 -3.371 741 HA VAL 647 HA VAL 647 3.540 9.660 -1.239 742 HB VAL 647 HB VAL 647 3.160 11.619 0.223 743 HG11 VAL 647 HG11 VAL 647 5.232 12.803 -0.372 744 HG12 VAL 647 HG12 VAL 647 5.222 11.999 -1.941 745 HG13 VAL 647 HG13 VAL 647 5.413 11.051 -0.467 746 HG21 VAL 647 HG21 VAL 647 1.653 12.883 -1.208 747 HG22 VAL 647 HG22 VAL 647 2.940 13.116 -2.391 748 HG23 VAL 647 HG23 VAL 647 3.062 13.861 -0.795 749 H GLU 648 HN GLU 648 1.051 10.570 -3.255 750 HA GLU 648 HA GLU 648 -1.064 10.322 -1.288 751 HB2 GLU 648 HB2 GLU 648 -2.562 10.449 -3.326 752 HB3 GLU 648 HB1 GLU 648 -1.567 11.862 -3.019 753 HG2 GLU 648 HG2 GLU 648 -0.133 11.374 -4.790 754 HG3 GLU 648 HG1 GLU 648 -0.715 9.715 -4.928 755 H TYR 649 HN TYR 649 0.964 8.203 -2.660 756 HA TYR 649 HA TYR 649 -0.923 6.061 -3.126 757 HB2 TYR 649 HB2 TYR 649 2.038 6.391 -3.333 758 HB3 TYR 649 HB1 TYR 649 1.381 4.772 -3.173 759 HD1 TYR 649 HD1 TYR 649 0.033 3.793 -4.960 760 HD2 TYR 649 HD2 TYR 649 1.681 7.695 -5.339 761 HE1 TYR 649 HE1 TYR 649 -0.413 3.738 -7.377 762 HE2 TYR 649 HE2 TYR 649 1.239 7.653 -7.758 763 HH TYR 649 HH TYR 649 -0.714 5.247 -9.232 764 HA PRO 650 HA PRO 650 -0.595 5.040 1.252 765 HB2 PRO 650 HB2 PRO 650 -2.910 3.386 0.946 766 HB3 PRO 650 HB1 PRO 650 -2.802 4.961 1.728 767 HG2 PRO 650 HG2 PRO 650 -4.185 4.452 -0.607 768 HG3 PRO 650 HG1 PRO 650 -3.616 6.048 -0.093 769 HD2 PRO 650 HD2 PRO 650 -2.419 4.153 -2.063 770 HD3 PRO 650 HD1 PRO 650 -2.505 5.927 -2.108 771 H PHE 651 HN PHE 651 0.817 3.528 1.817 772 HA PHE 651 HA PHE 651 0.995 1.091 0.216 773 HB2 PHE 651 HB2 PHE 651 2.950 2.599 1.910 774 HB3 PHE 651 HB1 PHE 651 3.214 0.888 1.595 775 HD1 PHE 651 HD1 PHE 651 2.730 4.168 -0.065 776 HD2 PHE 651 HD2 PHE 651 4.153 0.174 -0.415 777 HE1 PHE 651 HE1 PHE 651 3.757 4.727 -2.228 778 HE2 PHE 651 HE2 PHE 651 5.183 0.724 -2.581 779 HZ PHE 651 HZ PHE 651 4.985 3.005 -3.489 780 H PHE 652 HN PHE 652 0.174 -0.707 0.987 781 HA PHE 652 HA PHE 652 -0.534 -1.067 3.722 782 HB2 PHE 652 HB2 PHE 652 -0.985 -2.440 1.272 783 HB3 PHE 652 HB1 PHE 652 -0.245 -3.583 2.389 784 HD1 PHE 652 HD1 PHE 652 -1.242 -3.707 4.737 785 HD2 PHE 652 HD2 PHE 652 -3.257 -2.004 1.405 786 HE1 PHE 652 HE1 PHE 652 -3.379 -3.991 5.896 787 HE2 PHE 652 HE2 PHE 652 -5.411 -2.283 2.560 788 HZ PHE 652 HZ PHE 652 -5.474 -3.277 4.812 789 H VAL 653 HN VAL 653 0.655 -2.016 5.357 790 HA VAL 653 HA VAL 653 3.411 -2.659 4.552 791 HB VAL 653 HB VAL 653 2.834 -1.538 7.252 792 HG11 VAL 653 HG11 VAL 653 5.101 -2.330 5.858 793 HG12 VAL 653 HG12 VAL 653 5.056 -1.431 7.370 794 HG13 VAL 653 HG13 VAL 653 5.149 -0.568 5.833 795 HG21 VAL 653 HG21 VAL 653 3.351 0.731 6.342 796 HG22 VAL 653 HG22 VAL 653 1.750 0.100 5.926 797 HG23 VAL 653 HG23 VAL 653 3.049 0.074 4.731 798 H PHE 654 HN PHE 654 4.341 -4.417 5.317 799 HA PHE 654 HA PHE 654 2.965 -6.687 5.508 800 HB2 PHE 654 HB2 PHE 654 5.283 -6.673 5.020 801 HB3 PHE 654 HB1 PHE 654 5.722 -6.094 6.617 802 HD1 PHE 654 HD2 PHE 654 4.312 -8.974 4.757 803 HD2 PHE 654 HD1 PHE 654 6.128 -7.626 8.363 804 HE1 PHE 654 HE2 PHE 654 4.606 -11.308 5.479 805 HE2 PHE 654 HE1 PHE 654 6.427 -9.957 9.089 806 HZ PHE 654 HZ PHE 654 5.664 -11.802 7.646 807 H GLY 655 HN GLY 655 4.364 -5.314 8.528 808 HA2 GLY 655 HA2 GLY 655 2.090 -6.579 9.917 809 HA3 GLY 655 HA1 GLY 655 3.726 -6.714 10.553 810 H GLN 656 HN GLN 656 2.897 -3.840 8.949 811 HA GLN 656 HA GLN 656 3.147 -2.420 11.475 812 HB2 GLN 656 HB2 GLN 656 3.776 -1.656 8.639 813 HB3 GLN 656 HB1 GLN 656 3.867 -0.550 9.969 814 HG2 GLN 656 HG2 GLN 656 6.060 -1.274 9.542 815 HG3 GLN 656 HG1 GLN 656 5.548 -2.109 10.990 816 HE21 GLN 656 HE21 GLN 656 4.521 -2.969 7.784 817 HE22 GLN 656 HE22 GLN 656 5.374 -4.471 7.643 818 H GLY 657 HN GLY 657 1.126 -2.819 8.621 819 HA2 GLY 657 HA2 GLY 657 -1.267 -2.643 9.255 820 HA3 GLY 657 HA1 GLY 657 -0.864 -1.089 9.960 821 H TRP 658 HN TRP 658 -2.571 -0.268 8.681 822 HA TRP 658 HA TRP 658 -2.235 -0.193 5.783 823 HB2 TRP 658 HB2 TRP 658 -4.448 -0.689 6.905 824 HB3 TRP 658 HB1 TRP 658 -4.438 0.950 7.521 825 HD1 TRP 658 HD1 TRP 658 -6.820 1.125 6.263 826 HE1 TRP 658 HE1 TRP 658 -7.398 1.777 3.852 827 HE3 TRP 658 HE3 TRP 658 -2.230 0.413 4.063 828 HZ2 TRP 658 HZ2 TRP 658 -6.113 1.980 1.372 829 HZ3 TRP 658 HZ3 TRP 658 -2.019 0.861 1.658 830 HH2 TRP 658 HH2 TRP 658 -3.916 1.630 0.345 831 H SER 659 HN SER 659 -0.705 1.327 5.220 832 HA SER 659 HA SER 659 -0.758 3.875 6.697 833 HB2 SER 659 HB2 SER 659 1.690 2.328 5.794 834 HB3 SER 659 HB1 SER 659 1.703 3.872 6.643 835 HG SER 659 HG SER 659 2.007 2.231 8.134 836 H SER 660 HN SER 660 0.476 5.621 5.577 837 HA SER 660 HA SER 660 0.726 5.300 2.684 838 HB2 SER 660 HB2 SER 660 -1.520 6.224 2.971 839 HB3 SER 660 HB1 SER 660 -0.884 7.496 4.013 840 HG SER 660 HG SER 660 -1.237 8.154 1.811 841 H CYS 661 HN CYS 661 2.110 6.807 1.708 842 HA CYS 661 HA CYS 661 4.305 7.665 3.272 843 HB2 CYS 661 HB2 CYS 661 3.517 8.467 0.463 844 HB3 CYS 661 HB1 CYS 661 5.105 8.695 1.188 845 HG CYS 661 HG CYS 661 3.992 6.144 -0.489 846 H CYS 662 HN CYS 662 1.278 9.033 2.567 847 HA CYS 662 HA CYS 662 1.883 11.290 4.233 848 HB2 CYS 662 HB2 CYS 662 2.561 12.140 2.013 849 HB3 CYS 662 HB1 CYS 662 0.962 11.765 1.386 850 HG CYS 662 HG CYS 662 1.307 13.913 4.012 851 HA PRO 663 HA PRO 663 -2.274 9.352 4.875 852 HB2 PRO 663 HB2 PRO 663 -1.696 10.592 7.509 853 HB3 PRO 663 HB1 PRO 663 -2.316 8.983 7.131 854 HG2 PRO 663 HG2 PRO 663 0.207 9.341 7.940 855 HG3 PRO 663 HG1 PRO 663 -0.208 8.122 6.721 856 HD2 PRO 663 HD2 PRO 663 1.071 10.796 6.376 857 HD3 PRO 663 HD1 PRO 663 1.356 9.283 5.491 858 H GLU 664 HN GLU 664 -0.905 12.487 5.646 859 HA GLU 664 HA GLU 664 -3.147 14.038 6.043 860 HB2 GLU 664 HB2 GLU 664 -0.794 14.824 4.312 861 HB3 GLU 664 HB1 GLU 664 -1.896 15.916 5.133 862 HG2 GLU 664 HG2 GLU 664 -0.017 15.960 6.458 863 HG3 GLU 664 HG1 GLU 664 -1.055 14.804 7.286 864 H ARG 665 HN ARG 665 -1.506 13.779 2.915 865 HA ARG 665 HA ARG 665 -3.594 14.806 1.374 866 HB2 ARG 665 HB2 ARG 665 -1.176 13.163 0.784 867 HB3 ARG 665 HB1 ARG 665 -2.393 13.325 -0.473 868 HG2 ARG 665 HG2 ARG 665 -2.131 15.686 -0.535 869 HG3 ARG 665 HG1 ARG 665 -1.126 15.672 0.913 870 HD2 ARG 665 HD2 ARG 665 0.602 14.449 -0.258 871 HD3 ARG 665 HD1 ARG 665 -0.416 14.331 -1.690 872 HE ARG 665 HE ARG 665 -0.156 16.716 -1.983 873 HH11 ARG 665 HH11 ARG 665 1.943 15.299 0.434 874 HH12 ARG 665 HH12 ARG 665 3.207 16.463 0.207 875 HH21 ARG 665 HH21 ARG 665 1.512 18.254 -2.291 876 HH22 ARG 665 HH22 ARG 665 2.956 18.155 -1.331 877 H THR 666 HN THR 666 -2.898 11.380 2.172 878 HA THR 666 HA THR 666 -4.828 10.353 0.400 879 HB THR 666 HB THR 666 -3.963 9.019 2.969 880 HG1 THR 666 HG1 THR 666 -2.710 8.911 0.401 881 HG21 THR 666 HG21 THR 666 -5.843 7.987 1.672 882 HG22 THR 666 HG22 THR 666 -4.419 6.957 1.796 883 HG23 THR 666 HG23 THR 666 -4.748 7.825 0.299 884 H SER 667 HN SER 667 -5.053 11.326 3.801 885 HA SER 667 HA SER 667 -7.841 10.653 3.966 886 HB2 SER 667 HB2 SER 667 -6.338 10.613 5.935 887 HB3 SER 667 HB1 SER 667 -6.183 12.358 5.811 888 HG SER 667 HG SER 667 -7.857 12.364 7.072 889 H GLN 668 HN GLN 668 -5.967 13.506 3.206 890 HA GLN 668 HA GLN 668 -8.035 15.414 3.416 891 HB2 GLN 668 HB2 GLN 668 -5.348 15.276 2.257 892 HB3 GLN 668 HB1 GLN 668 -6.397 16.564 1.697 893 HG2 GLN 668 HG2 GLN 668 -5.667 15.976 4.548 894 HG3 GLN 668 HG1 GLN 668 -5.040 17.245 3.535 895 HE21 GLN 668 HE21 GLN 668 -5.677 18.873 4.920 896 HE22 GLN 668 HE22 GLN 668 -7.335 19.327 5.107 897 H LEU 669 HN LEU 669 -6.657 13.716 0.623 898 HA LEU 669 HA LEU 669 -8.474 15.114 -1.160 899 HB2 LEU 669 HB2 LEU 669 -6.517 13.009 -2.010 900 HB3 LEU 669 HB1 LEU 669 -7.093 14.398 -2.906 901 HG LEU 669 HG LEU 669 -5.173 14.463 -0.581 902 HD11 LEU 669 HD11 LEU 669 -4.167 13.560 -2.606 903 HD12 LEU 669 HD12 LEU 669 -3.517 15.156 -2.230 904 HD13 LEU 669 HD13 LEU 669 -4.712 14.971 -3.515 905 HD21 LEU 669 HD21 LEU 669 -6.218 16.716 -2.290 906 HD22 LEU 669 HD22 LEU 669 -4.891 16.845 -1.132 907 HD23 LEU 669 HD23 LEU 669 -6.518 16.465 -0.568 908 H PHE 670 HN PHE 670 -7.827 11.881 0.018 909 HA PHE 670 HA PHE 670 -9.977 10.801 -1.663 910 HB2 PHE 670 HB2 PHE 670 -7.938 9.217 -0.100 911 HB3 PHE 670 HB1 PHE 670 -8.925 8.672 -1.448 912 HD1 PHE 670 HD1 PHE 670 -8.552 10.656 -3.493 913 HD2 PHE 670 HD2 PHE 670 -5.748 9.144 -0.685 914 HE1 PHE 670 HE1 PHE 670 -6.715 11.226 -5.026 915 HE2 PHE 670 HE2 PHE 670 -3.906 9.711 -2.203 916 HZ PHE 670 HZ PHE 670 -4.386 10.756 -4.382 917 H ASP 671 HN ASP 671 -9.564 11.995 1.330 918 HA ASP 671 HA ASP 671 -10.659 11.905 3.304 919 HB2 ASP 671 HB2 ASP 671 -12.661 10.398 1.632 920 HB3 ASP 671 HB1 ASP 671 -12.952 10.854 3.306 921 H LEU 672 HN LEU 672 -8.781 9.705 2.464 922 HA LEU 672 HA LEU 672 -9.885 7.483 4.045 923 HB2 LEU 672 HB2 LEU 672 -9.496 6.937 1.696 924 HB3 LEU 672 HB1 LEU 672 -7.821 7.436 1.838 925 HG LEU 672 HG LEU 672 -7.553 5.615 3.581 926 HD11 LEU 672 HD11 LEU 672 -9.962 5.370 4.054 927 HD12 LEU 672 HD12 LEU 672 -9.184 3.844 3.635 928 HD13 LEU 672 HD13 LEU 672 -10.184 4.677 2.444 929 HD21 LEU 672 HD21 LEU 672 -8.293 4.782 0.778 930 HD22 LEU 672 HD22 LEU 672 -7.326 3.844 1.918 931 HD23 LEU 672 HD23 LEU 672 -6.718 5.380 1.301 932 HA PRO 673 HA PRO 673 -6.598 8.703 6.802 933 HB2 PRO 673 HB2 PRO 673 -7.339 7.131 8.885 934 HB3 PRO 673 HB1 PRO 673 -8.135 8.657 8.493 935 HG2 PRO 673 HG2 PRO 673 -9.036 5.874 8.014 936 HG3 PRO 673 HG1 PRO 673 -9.992 7.326 8.344 937 HD2 PRO 673 HD2 PRO 673 -9.604 6.153 5.844 938 HD3 PRO 673 HD1 PRO 673 -10.202 7.793 6.129 939 H CYS 674 HN CYS 674 -4.617 7.904 7.258 940 HA CYS 674 HA CYS 674 -4.122 5.019 6.949 941 HB2 CYS 674 HB2 CYS 674 -2.407 7.128 5.602 942 HB3 CYS 674 HB1 CYS 674 -2.278 5.380 5.450 943 HG CYS 674 HG CYS 674 -5.197 6.786 4.482 944 H SER 675 HN SER 675 -2.317 4.264 8.070 945 HA SER 675 HA SER 675 -1.231 5.904 10.148 946 HB2 SER 675 HB2 SER 675 -0.203 3.258 9.078 947 HB3 SER 675 HB1 SER 675 0.150 3.965 10.653 948 HG SER 675 HG SER 675 -2.459 3.863 10.494 949 H LYS 676 HN LYS 676 1.085 6.525 10.255 950 HA LYS 676 HA LYS 676 1.889 7.570 7.706 951 HB2 LYS 676 HB2 LYS 676 2.257 8.951 9.645 952 HB3 LYS 676 HB1 LYS 676 3.230 7.701 10.404 953 HG2 LYS 676 HG2 LYS 676 4.612 9.486 9.483 954 HG3 LYS 676 HG1 LYS 676 4.924 7.941 8.684 955 HD2 LYS 676 HD2 LYS 676 3.535 8.613 6.797 956 HD3 LYS 676 HD1 LYS 676 3.140 10.127 7.610 957 HE2 LYS 676 HE2 LYS 676 4.876 10.457 5.918 958 HE3 LYS 676 HE1 LYS 676 5.474 10.812 7.536 959 HZ1 LYS 676 HZ1 LYS 676 5.988 8.337 5.968 960 HZ2 LYS 676 HZ2 LYS 676 6.502 8.588 7.563 961 HZ3 LYS 676 HZ3 LYS 676 7.103 9.562 6.316 962 H LEU 677 HN LEU 677 2.829 6.369 6.255 963 HA LEU 677 HA LEU 677 4.389 4.052 6.913 964 HB2 LEU 677 HB2 LEU 677 3.019 4.172 4.869 965 HB3 LEU 677 HB1 LEU 677 3.987 5.502 4.279 966 HG LEU 677 HG LEU 677 4.388 3.168 3.293 967 HD11 LEU 677 HD11 LEU 677 5.887 5.020 2.856 968 HD12 LEU 677 HD12 LEU 677 6.799 3.528 3.085 969 HD13 LEU 677 HD13 LEU 677 6.725 4.724 4.379 970 HD21 LEU 677 HD21 LEU 677 4.420 1.980 5.431 971 HD22 LEU 677 HD22 LEU 677 5.901 2.828 5.871 972 HD23 LEU 677 HD23 LEU 677 5.893 1.717 4.500 973 H SER 678 HN SER 678 6.300 4.359 7.860 974 HA SER 678 HA SER 678 8.090 6.387 6.705 975 HB2 SER 678 HB2 SER 678 7.741 5.771 9.649 976 HB3 SER 678 HB1 SER 678 8.952 6.860 8.974 977 HG SER 678 HG SER 678 6.993 7.878 9.767 978 H VAL 679 HN VAL 679 10.387 6.023 7.451 979 HA VAL 679 HA VAL 679 11.360 3.620 6.559 980 HB VAL 679 HB VAL 679 12.820 5.428 6.545 981 HG11 VAL 679 HG11 VAL 679 12.250 5.778 9.474 982 HG12 VAL 679 HG12 VAL 679 11.812 6.856 8.144 983 HG13 VAL 679 HG13 VAL 679 13.505 6.654 8.597 984 HG21 VAL 679 HG21 VAL 679 13.913 3.297 7.180 985 HG22 VAL 679 HG22 VAL 679 13.815 3.793 8.872 986 HG23 VAL 679 HG23 VAL 679 14.783 4.729 7.728 987 H GLY 680 HN GLY 680 11.939 1.722 7.427 988 HA2 GLY 680 HA2 GLY 680 12.402 0.230 9.228 989 HA3 GLY 680 HA1 GLY 680 11.461 1.260 10.284 990 H ASP 681 HN ASP 681 9.549 1.263 7.743 991 HA ASP 681 HA ASP 681 7.978 -0.951 8.831 992 HB2 ASP 681 HB2 ASP 681 7.141 1.237 6.897 993 HB3 ASP 681 HB1 ASP 681 6.101 0.004 7.549 994 H VAL 682 HN VAL 682 8.124 -2.894 7.860 995 HA VAL 682 HA VAL 682 9.162 -3.145 5.235 996 HB VAL 682 HB VAL 682 9.646 -5.007 6.535 997 HG11 VAL 682 HG11 VAL 682 7.784 -6.360 7.595 998 HG12 VAL 682 HG12 VAL 682 6.846 -4.879 7.404 999 HG13 VAL 682 HG13 VAL 682 8.315 -4.866 8.361 1000 HG21 VAL 682 HG21 VAL 682 7.335 -5.802 4.811 1001 HG22 VAL 682 HG22 VAL 682 8.498 -6.921 5.522 1002 HG23 VAL 682 HG23 VAL 682 9.033 -5.729 4.337 1003 H CYS 683 HN CYS 683 8.098 -2.507 3.503 1004 HA CYS 683 HA CYS 683 5.246 -2.228 3.582 1005 HB2 CYS 683 HB2 CYS 683 7.239 -1.717 1.370 1006 HB3 CYS 683 HB1 CYS 683 5.529 -1.327 1.264 1007 HG CYS 683 HG CYS 683 7.309 -0.060 3.864 1008 H ILE 684 HN ILE 684 3.730 -3.301 2.513 1009 HA ILE 684 HA ILE 684 4.316 -5.968 1.637 1010 HB ILE 684 HB ILE 684 1.783 -4.343 1.864 1011 HG12 ILE 684 HG12 ILE 684 2.620 -6.911 3.203 1012 HG13 ILE 684 HG11 ILE 684 2.802 -5.312 3.920 1013 HG21 ILE 684 HG21 ILE 684 2.070 -7.095 0.679 1014 HG22 ILE 684 HG22 ILE 684 1.406 -5.654 -0.088 1015 HG23 ILE 684 HG23 ILE 684 0.538 -6.423 1.245 1016 HD11 ILE 684 HD11 ILE 684 0.819 -6.473 4.754 1017 HD12 ILE 684 HD12 ILE 684 0.190 -6.582 3.108 1018 HD13 ILE 684 HD13 ILE 684 0.392 -5.006 3.874 1019 H SER 685 HN SER 685 4.989 -6.327 -0.450 1020 HA SER 685 HA SER 685 3.898 -4.589 -2.540 1021 HB2 SER 685 HB2 SER 685 6.393 -5.281 -2.438 1022 HB3 SER 685 HB1 SER 685 5.835 -6.849 -3.007 1023 HG SER 685 HG SER 685 6.464 -5.455 -4.720 1024 H LEU 686 HN LEU 686 2.058 -5.220 -3.436 1025 HA LEU 686 HA LEU 686 1.272 -8.010 -3.140 1026 HB2 LEU 686 HB2 LEU 686 -0.135 -5.783 -2.657 1027 HB3 LEU 686 HB1 LEU 686 -0.552 -6.004 -4.345 1028 HG LEU 686 HG LEU 686 -2.217 -6.987 -2.860 1029 HD11 LEU 686 HD11 LEU 686 -1.951 -8.011 -5.026 1030 HD12 LEU 686 HD12 LEU 686 -2.287 -9.253 -3.815 1031 HD13 LEU 686 HD13 LEU 686 -0.643 -9.024 -4.413 1032 HD21 LEU 686 HD21 LEU 686 -1.684 -8.943 -1.505 1033 HD22 LEU 686 HD22 LEU 686 -0.786 -7.521 -0.978 1034 HD23 LEU 686 HD23 LEU 686 0.016 -8.770 -1.928 1035 H THR 687 HN THR 687 1.467 -9.360 -4.784 1036 HA THR 687 HA THR 687 2.152 -8.214 -7.378 1037 HB THR 687 HB THR 687 2.411 -11.057 -6.394 1038 HG1 THR 687 HG1 THR 687 3.780 -9.040 -5.603 1039 HG21 THR 687 HG21 THR 687 2.263 -10.900 -8.823 1040 HG22 THR 687 HG22 THR 687 3.896 -11.339 -8.323 1041 HG23 THR 687 HG23 THR 687 3.543 -9.688 -8.831 1042 H LEU 688 HN LEU 688 0.604 -7.998 -8.776 1043 HA LEU 688 HA LEU 688 -1.657 -9.857 -8.849 1044 HB2 LEU 688 HB2 LEU 688 -1.157 -7.068 -9.716 1045 HB3 LEU 688 HB1 LEU 688 -2.128 -8.022 -10.813 1046 HG LEU 688 HG LEU 688 -3.415 -6.604 -9.194 1047 HD11 LEU 688 HD11 LEU 688 -5.029 -8.406 -8.624 1048 HD12 LEU 688 HD12 LEU 688 -3.843 -9.576 -9.200 1049 HD13 LEU 688 HD13 LEU 688 -4.518 -8.387 -10.311 1050 HD21 LEU 688 HD21 LEU 688 -2.382 -8.599 -7.177 1051 HD22 LEU 688 HD22 LEU 688 -3.711 -7.469 -6.896 1052 HD23 LEU 688 HD23 LEU 688 -2.080 -6.861 -7.193 1053 H LYS 689 HN LYS 689 -0.943 -11.663 -9.914 1054 HA LYS 689 HA LYS 689 0.958 -11.489 -12.037 1055 HB2 LYS 689 HB2 LYS 689 -0.579 -13.779 -10.890 1056 HB3 LYS 689 HB1 LYS 689 0.567 -13.963 -12.200 1057 HG2 LYS 689 HG2 LYS 689 1.198 -12.850 -9.487 1058 HG3 LYS 689 HG1 LYS 689 1.532 -14.502 -10.004 1059 HD2 LYS 689 HD2 LYS 689 2.651 -12.024 -11.313 1060 HD3 LYS 689 HD1 LYS 689 3.502 -12.988 -10.116 1061 HE2 LYS 689 HE2 LYS 689 3.334 -14.942 -11.625 1062 HE3 LYS 689 HE1 LYS 689 2.572 -13.908 -12.832 1063 HZ1 LYS 689 HZ1 LYS 689 4.933 -14.173 -13.257 1064 HZ2 LYS 689 HZ2 LYS 689 5.308 -13.550 -11.731 1065 HZ3 LYS 689 HZ3 LYS 689 4.577 -12.561 -12.892 Start of MODEL 4 1 H1 VAL 34 HT1 VAL 34 -18.762 -2.159 -4.690 2 H2 VAL 34 HT2 VAL 34 -18.457 -2.780 -6.230 3 H3 VAL 34 HT3 VAL 34 -17.659 -1.386 -5.706 4 HA VAL 34 HA VAL 34 -16.458 -2.574 -4.073 5 HB VAL 34 HB VAL 34 -18.164 -4.178 -3.464 6 HG11 VAL 34 HG11 VAL 34 -17.597 -5.513 -6.099 7 HG12 VAL 34 HG12 VAL 34 -19.087 -4.685 -5.645 8 HG13 VAL 34 HG13 VAL 34 -18.618 -6.172 -4.820 9 HG21 VAL 34 HG21 VAL 34 -15.612 -5.480 -4.356 10 HG22 VAL 34 HG22 VAL 34 -16.789 -6.223 -3.275 11 HG23 VAL 34 HG23 VAL 34 -15.952 -4.750 -2.786 12 H PHE 35 HN PHE 35 -14.557 -3.691 -4.503 13 HA PHE 35 HA PHE 35 -13.955 -4.244 -7.323 14 HB2 PHE 35 HB2 PHE 35 -12.560 -2.217 -5.584 15 HB3 PHE 35 HB1 PHE 35 -11.769 -2.948 -6.973 16 HD1 PHE 35 HD1 PHE 35 -12.485 -2.436 -9.221 17 HD2 PHE 35 HD2 PHE 35 -14.340 -0.634 -5.847 18 HE1 PHE 35 HE1 PHE 35 -13.485 -0.732 -10.690 19 HE2 PHE 35 HE2 PHE 35 -15.337 1.073 -7.307 20 HZ PHE 35 HZ PHE 35 -14.916 1.027 -9.729 21 HA PRO 36 HA PRO 36 -11.234 -7.471 -5.718 22 HB2 PRO 36 HB2 PRO 36 -9.262 -6.364 -7.655 23 HB3 PRO 36 HB1 PRO 36 -9.819 -8.029 -7.452 24 HG2 PRO 36 HG2 PRO 36 -10.652 -6.561 -9.511 25 HG3 PRO 36 HG1 PRO 36 -11.755 -7.670 -8.676 26 HD2 PRO 36 HD2 PRO 36 -11.559 -4.695 -8.493 27 HD3 PRO 36 HD1 PRO 36 -12.997 -5.736 -8.462 28 H TRP 37 HN TRP 37 -9.428 -7.563 -4.332 29 HA TRP 37 HA TRP 37 -9.281 -5.280 -2.773 30 HB2 TRP 37 HB2 TRP 37 -7.470 -6.561 -1.504 31 HB3 TRP 37 HB1 TRP 37 -9.089 -7.230 -1.585 32 HD1 TRP 37 HD1 TRP 37 -9.372 -9.237 -3.565 33 HE1 TRP 37 HE1 TRP 37 -7.737 -11.157 -4.062 34 HE3 TRP 37 HE3 TRP 37 -5.155 -7.252 -1.486 35 HZ2 TRP 37 HZ2 TRP 37 -5.026 -11.758 -3.605 36 HZ3 TRP 37 HZ3 TRP 37 -3.081 -8.567 -1.554 37 HH2 TRP 37 HH2 TRP 37 -3.023 -10.783 -2.586 38 H HIS 38 HN HIS 38 -7.242 -6.092 -5.462 39 HA HIS 38 HA HIS 38 -5.248 -4.209 -4.663 40 HB2 HIS 38 HB2 HIS 38 -4.644 -5.897 -6.295 41 HB3 HIS 38 HB1 HIS 38 -5.906 -5.346 -7.389 42 HD1 HIS 38 HD1 HIS 38 -2.432 -4.536 -6.238 43 HD2 HIS 38 HD2 HIS 38 -5.275 -3.030 -8.873 44 HE1 HIS 38 HE1 HIS 38 -1.207 -2.893 -7.688 45 HE2 HIS 38 HE2 HIS 38 -2.966 -1.914 -9.199 46 H SER 39 HN SER 39 -6.575 -2.484 -3.983 47 HA SER 39 HA SER 39 -7.248 -0.695 -6.207 48 HB2 SER 39 HB2 SER 39 -9.373 -1.603 -5.448 49 HB3 SER 39 HB1 SER 39 -8.971 -1.242 -3.771 50 HG SER 39 HG SER 39 -8.736 1.036 -4.903 51 H LEU 40 HN LEU 40 -5.686 -1.295 -3.344 52 HA LEU 40 HA LEU 40 -4.859 1.464 -2.899 53 HB2 LEU 40 HB2 LEU 40 -5.444 0.798 -0.333 54 HB3 LEU 40 HB1 LEU 40 -6.477 1.770 -1.367 55 HG LEU 40 HG LEU 40 -6.951 -1.103 -1.658 56 HD11 LEU 40 HD11 LEU 40 -7.452 0.227 0.992 57 HD12 LEU 40 HD12 LEU 40 -6.459 -1.197 0.679 58 HD13 LEU 40 HD13 LEU 40 -8.210 -1.278 0.466 59 HD21 LEU 40 HD21 LEU 40 -8.398 0.565 -2.661 60 HD22 LEU 40 HD22 LEU 40 -8.709 1.277 -1.078 61 HD23 LEU 40 HD23 LEU 40 -9.286 -0.347 -1.441 62 H VAL 41 HN VAL 41 -4.185 -1.731 -3.175 63 HA VAL 41 HA VAL 41 -2.159 -1.893 -1.124 64 HB VAL 41 HB VAL 41 -3.638 -3.843 -1.661 65 HG11 VAL 41 HG11 VAL 41 -3.276 -5.187 -3.608 66 HG12 VAL 41 HG12 VAL 41 -1.988 -4.117 -4.161 67 HG13 VAL 41 HG13 VAL 41 -3.651 -3.542 -4.125 68 HG21 VAL 41 HG21 VAL 41 -0.692 -4.251 -2.014 69 HG22 VAL 41 HG22 VAL 41 -1.854 -5.503 -1.579 70 HG23 VAL 41 HG23 VAL 41 -1.566 -4.147 -0.489 71 HA PRO 42 HA PRO 42 0.867 -0.437 -3.994 72 HB2 PRO 42 HB2 PRO 42 2.999 -0.547 -2.399 73 HB3 PRO 42 HB1 PRO 42 1.674 0.576 -2.067 74 HG2 PRO 42 HG2 PRO 42 2.271 -2.070 -0.813 75 HG3 PRO 42 HG1 PRO 42 1.752 -0.560 -0.044 76 HD2 PRO 42 HD2 PRO 42 0.067 -2.647 -0.675 77 HD3 PRO 42 HD1 PRO 42 -0.453 -0.962 -0.482 78 H PHE 43 HN PHE 43 2.870 -1.060 -4.970 79 HA PHE 43 HA PHE 43 3.601 -3.891 -4.703 80 HB2 PHE 43 HB2 PHE 43 2.412 -3.428 -6.852 81 HB3 PHE 43 HB1 PHE 43 3.647 -2.240 -7.246 82 HD1 PHE 43 HD1 PHE 43 3.114 -5.847 -6.574 83 HD2 PHE 43 HD2 PHE 43 5.621 -2.880 -8.311 84 HE1 PHE 43 HE1 PHE 43 4.450 -7.607 -7.654 85 HE2 PHE 43 HE2 PHE 43 6.961 -4.637 -9.391 86 HZ PHE 43 HZ PHE 43 6.375 -7.005 -9.065 87 H LEU 44 HN LEU 44 4.381 -0.693 -4.502 88 HA LEU 44 HA LEU 44 6.164 0.588 -4.221 89 HB2 LEU 44 HB2 LEU 44 7.991 -0.154 -2.921 90 HB3 LEU 44 HB1 LEU 44 6.564 -0.968 -2.323 91 HG LEU 44 HG LEU 44 7.609 -2.807 -4.093 92 HD11 LEU 44 HD11 LEU 44 9.905 -1.517 -2.623 93 HD12 LEU 44 HD12 LEU 44 9.620 -1.406 -4.358 94 HD13 LEU 44 HD13 LEU 44 9.977 -2.970 -3.622 95 HD21 LEU 44 HD21 LEU 44 8.183 -2.570 -1.141 96 HD22 LEU 44 HD22 LEU 44 8.226 -4.049 -2.105 97 HD23 LEU 44 HD23 LEU 44 6.697 -3.211 -1.841 98 H ALA 45 HN ALA 45 7.499 -2.303 -5.647 99 HA ALA 45 HA ALA 45 8.166 -1.196 -8.127 100 HB1 ALA 45 HB1 ALA 45 9.753 0.170 -6.838 101 HB2 ALA 45 HB2 ALA 45 10.600 -0.958 -7.896 102 HB3 ALA 45 HB3 ALA 45 10.473 -1.294 -6.171 103 HA PRO 46 HA PRO 46 8.965 -5.502 -8.996 104 HB2 PRO 46 HB2 PRO 46 11.512 -4.743 -10.326 105 HB3 PRO 46 HB1 PRO 46 10.136 -5.649 -10.964 106 HG2 PRO 46 HG2 PRO 46 10.567 -3.132 -11.713 107 HG3 PRO 46 HG1 PRO 46 8.922 -3.731 -11.432 108 HD2 PRO 46 HD2 PRO 46 10.639 -2.018 -9.684 109 HD3 PRO 46 HD1 PRO 46 8.896 -1.910 -10.004 110 H SER 47 HN SER 47 9.385 -6.146 -6.873 111 HA SER 47 HA SER 47 11.848 -5.858 -5.542 112 HB2 SER 47 HB2 SER 47 9.784 -8.031 -5.123 113 HB3 SER 47 HB1 SER 47 10.962 -7.444 -3.952 114 HG SER 47 HG SER 47 9.562 -5.992 -3.410 115 H GLN 48 HN GLN 48 13.719 -6.736 -6.114 116 HA GLN 48 HA GLN 48 13.737 -9.252 -7.573 117 HB2 GLN 48 HB2 GLN 48 16.065 -7.408 -7.031 118 HB3 GLN 48 HB1 GLN 48 16.015 -8.739 -8.174 119 HG2 GLN 48 HG2 GLN 48 14.413 -6.197 -8.354 120 HG3 GLN 48 HG1 GLN 48 15.850 -6.590 -9.297 121 HE21 GLN 48 HE21 GLN 48 13.110 -5.980 -10.134 122 HE22 GLN 48 HE22 GLN 48 12.601 -7.325 -11.095 123 H ALA 567 HT1 ALA 567 -26.166 1.760 2.971 124 HA ALA 567 HA ALA 567 -25.813 4.087 2.485 125 HB1 ALA 567 HB1 ALA 567 -24.258 2.902 3.977 126 HB2 ALA 567 HB2 ALA 567 -23.471 4.207 3.092 127 HB3 ALA 567 HB3 ALA 567 -23.232 2.533 2.592 128 HA PRO 568 HA PRO 568 -24.887 4.851 -1.763 129 HB2 PRO 568 HB2 PRO 568 -24.899 7.535 -1.712 130 HB3 PRO 568 HB1 PRO 568 -26.374 6.580 -1.564 131 HG2 PRO 568 HG2 PRO 568 -24.805 7.992 0.537 132 HG3 PRO 568 HG1 PRO 568 -26.556 7.776 0.401 133 HD2 PRO 568 HD2 PRO 568 -24.878 6.285 2.040 134 HD3 PRO 568 HD1 PRO 568 -26.499 5.796 1.520 135 HA PRO 569 HA PRO 569 -20.509 5.670 -1.837 136 HB2 PRO 569 HB2 PRO 569 -20.181 5.546 -4.510 137 HB3 PRO 569 HB1 PRO 569 -20.475 4.099 -3.538 138 HG2 PRO 569 HG2 PRO 569 -22.374 5.662 -5.237 139 HG3 PRO 569 HG1 PRO 569 -22.237 3.907 -5.032 140 HD2 PRO 569 HD2 PRO 569 -24.112 5.479 -3.754 141 HD3 PRO 569 HD1 PRO 569 -23.541 3.910 -3.155 142 H THR 570 HN THR 570 -20.938 7.882 -1.051 143 HA THR 570 HA THR 570 -21.579 9.990 -2.789 144 HB THR 570 HB THR 570 -19.985 10.257 -0.291 145 HG1 THR 570 HG1 THR 570 -22.818 10.087 -0.576 146 HG21 THR 570 HG21 THR 570 -21.957 12.109 -1.619 147 HG22 THR 570 HG22 THR 570 -20.204 12.296 -1.628 148 HG23 THR 570 HG23 THR 570 -21.098 12.430 -0.114 149 H LEU 571 HN LEU 571 -18.688 8.474 -1.873 150 HA LEU 571 HA LEU 571 -17.090 10.197 -3.616 151 HB2 LEU 571 HB2 LEU 571 -16.318 8.250 -1.455 152 HB3 LEU 571 HB1 LEU 571 -15.172 9.079 -2.461 153 HG LEU 571 HG LEU 571 -17.104 10.417 -0.580 154 HD11 LEU 571 HD11 LEU 571 -14.139 9.925 -0.321 155 HD12 LEU 571 HD12 LEU 571 -15.403 9.133 0.619 156 HD13 LEU 571 HD13 LEU 571 -15.133 10.869 0.789 157 HD21 LEU 571 HD21 LEU 571 -16.553 11.789 -2.464 158 HD22 LEU 571 HD22 LEU 571 -14.842 11.435 -2.260 159 HD23 LEU 571 HD23 LEU 571 -15.694 12.383 -1.043 160 HA PRO 572 HA PRO 572 -16.421 7.056 -6.726 161 HB2 PRO 572 HB2 PRO 572 -13.530 7.184 -5.992 162 HB3 PRO 572 HB1 PRO 572 -14.290 7.275 -7.584 163 HG2 PRO 572 HG2 PRO 572 -13.372 9.471 -6.393 164 HG3 PRO 572 HG1 PRO 572 -14.880 9.498 -7.326 165 HD2 PRO 572 HD2 PRO 572 -14.476 9.535 -4.378 166 HD3 PRO 572 HD1 PRO 572 -15.744 10.298 -5.354 167 HA PRO 573 HA PRO 573 -16.455 3.448 -4.233 168 HB2 PRO 573 HB2 PRO 573 -16.781 1.597 -6.124 169 HB3 PRO 573 HB1 PRO 573 -18.030 2.803 -5.792 170 HG2 PRO 573 HG2 PRO 573 -15.951 2.792 -7.953 171 HG3 PRO 573 HG1 PRO 573 -17.676 3.139 -8.064 172 HD2 PRO 573 HD2 PRO 573 -15.796 5.082 -7.925 173 HD3 PRO 573 HD1 PRO 573 -17.442 5.279 -7.293 174 H TYR 574 HN TYR 574 -13.916 4.203 -6.247 175 HA TYR 574 HA TYR 574 -12.391 1.787 -5.596 176 HB2 TYR 574 HB2 TYR 574 -12.447 2.551 -7.927 177 HB3 TYR 574 HB1 TYR 574 -11.723 4.067 -7.439 178 HD1 TYR 574 HD1 TYR 574 -9.352 4.187 -6.886 179 HD2 TYR 574 HD2 TYR 574 -11.146 0.526 -8.103 180 HE1 TYR 574 HE1 TYR 574 -7.124 3.245 -7.314 181 HE2 TYR 574 HE2 TYR 574 -8.920 -0.429 -8.529 182 HH TYR 574 HH TYR 574 -6.038 1.084 -7.482 183 H PHE 575 HN PHE 575 -11.694 2.008 -3.550 184 HA PHE 575 HA PHE 575 -10.144 2.385 -1.991 185 HB2 PHE 575 HB2 PHE 575 -8.102 2.725 -2.762 186 HB3 PHE 575 HB1 PHE 575 -8.833 3.007 -4.334 187 HD1 PHE 575 HD2 PHE 575 -9.045 5.278 -5.199 188 HD2 PHE 575 HD1 PHE 575 -7.198 4.495 -1.449 189 HE1 PHE 575 HE2 PHE 575 -8.047 7.520 -5.227 190 HE2 PHE 575 HE1 PHE 575 -6.190 6.737 -1.476 191 HZ PHE 575 HZ PHE 575 -6.623 8.252 -3.363 192 H MET 576 HN MET 576 -11.802 5.138 -3.251 193 HA MET 576 HA MET 576 -11.086 7.016 -1.258 194 HB2 MET 576 HB2 MET 576 -13.737 6.757 -2.698 195 HB3 MET 576 HB1 MET 576 -13.137 8.191 -1.876 196 HG2 MET 576 HG2 MET 576 -11.787 6.931 -4.246 197 HG3 MET 576 HG1 MET 576 -12.959 8.239 -4.356 198 HE1 MET 576 HE1 MET 576 -10.080 8.388 -5.632 199 HE2 MET 576 HE2 MET 576 -9.576 10.014 -5.176 200 HE3 MET 576 HE3 MET 576 -11.231 9.721 -5.711 201 H LYS 577 HN LYS 577 -12.698 7.798 0.449 202 HA LYS 577 HA LYS 577 -13.176 5.682 2.253 203 HB2 LYS 577 HB2 LYS 577 -12.774 8.103 2.842 204 HB3 LYS 577 HB1 LYS 577 -14.434 8.424 2.361 205 HG2 LYS 577 HG2 LYS 577 -15.170 6.766 4.073 206 HG3 LYS 577 HG1 LYS 577 -13.494 6.675 4.620 207 HD2 LYS 577 HD2 LYS 577 -13.531 9.105 5.038 208 HD3 LYS 577 HD1 LYS 577 -15.231 9.139 4.569 209 HE2 LYS 577 HE2 LYS 577 -15.747 7.582 6.398 210 HE3 LYS 577 HE1 LYS 577 -14.051 7.595 6.877 211 HZ1 LYS 577 HZ1 LYS 577 -15.850 9.957 6.842 212 HZ2 LYS 577 HZ2 LYS 577 -14.227 9.962 7.320 213 HZ3 LYS 577 HZ3 LYS 577 -15.372 9.106 8.222 214 H GLY 578 HN GLY 578 -14.776 4.302 2.362 215 HA2 GLY 578 HA2 GLY 578 -17.115 3.781 2.511 216 HA3 GLY 578 HA1 GLY 578 -17.430 5.025 1.331 217 H SER 579 HN SER 579 -14.811 3.732 0.085 218 HA SER 579 HA SER 579 -16.119 2.055 -1.769 219 HB2 SER 579 HB2 SER 579 -13.169 2.187 -1.133 220 HB3 SER 579 HB1 SER 579 -13.898 1.553 -2.608 221 HG SER 579 HG SER 579 -13.626 4.202 -1.738 222 H ILE 580 HN ILE 580 -16.474 -0.097 -1.731 223 HA ILE 580 HA ILE 580 -15.621 -1.514 0.673 224 HB ILE 580 HB ILE 580 -17.721 -2.242 -1.366 225 HG12 ILE 580 HG12 ILE 580 -18.488 -0.391 -0.076 226 HG13 ILE 580 HG11 ILE 580 -19.254 -1.823 0.602 227 HG21 ILE 580 HG21 ILE 580 -16.709 -4.228 -0.416 228 HG22 ILE 580 HG22 ILE 580 -18.347 -4.016 0.205 229 HG23 ILE 580 HG23 ILE 580 -16.961 -3.600 1.214 230 HD11 ILE 580 HD11 ILE 580 -18.568 -0.447 2.412 231 HD12 ILE 580 HD12 ILE 580 -16.950 -0.247 1.743 232 HD13 ILE 580 HD13 ILE 580 -17.462 -1.820 2.364 233 H ILE 581 HN ILE 581 -13.992 -2.813 0.574 234 HA ILE 581 HA ILE 581 -12.909 -3.519 -2.058 235 HB ILE 581 HB ILE 581 -11.509 -3.725 0.606 236 HG12 ILE 581 HG12 ILE 581 -12.194 -1.416 0.347 237 HG13 ILE 581 HG11 ILE 581 -10.467 -1.540 0.070 238 HG21 ILE 581 HG21 ILE 581 -10.485 -4.972 -1.191 239 HG22 ILE 581 HG22 ILE 581 -9.487 -3.582 -0.761 240 HG23 ILE 581 HG23 ILE 581 -10.486 -3.533 -2.214 241 HD11 ILE 581 HD11 ILE 581 -12.597 -1.256 -2.030 242 HD12 ILE 581 HD12 ILE 581 -10.871 -1.459 -2.344 243 HD13 ILE 581 HD13 ILE 581 -11.452 -0.024 -1.499 244 H GLN 582 HN GLN 582 -12.780 -5.598 -2.719 245 HA GLN 582 HA GLN 582 -13.785 -7.641 -0.867 246 HB2 GLN 582 HB2 GLN 582 -15.010 -7.353 -2.978 247 HB3 GLN 582 HB1 GLN 582 -13.551 -7.720 -3.872 248 HG2 GLN 582 HG2 GLN 582 -13.512 -9.962 -2.995 249 HG3 GLN 582 HG1 GLN 582 -14.896 -9.618 -1.964 250 HE21 GLN 582 HE21 GLN 582 -14.574 -11.630 -4.040 251 HE22 GLN 582 HE22 GLN 582 -15.838 -11.348 -5.184 252 H LEU 583 HN LEU 583 -12.373 -8.880 0.054 253 HA LEU 583 HA LEU 583 -9.664 -9.018 -0.905 254 HB2 LEU 583 HB2 LEU 583 -11.005 -10.369 1.425 255 HB3 LEU 583 HB1 LEU 583 -9.278 -10.296 1.142 256 HG LEU 583 HG LEU 583 -11.070 -7.925 1.656 257 HD11 LEU 583 HD11 LEU 583 -10.822 -9.261 3.634 258 HD12 LEU 583 HD12 LEU 583 -9.851 -7.795 3.790 259 HD13 LEU 583 HD13 LEU 583 -9.074 -9.336 3.407 260 HD21 LEU 583 HD21 LEU 583 -9.247 -7.288 0.221 261 HD22 LEU 583 HD22 LEU 583 -8.087 -8.128 1.249 262 HD23 LEU 583 HD23 LEU 583 -8.919 -6.694 1.850 263 H ALA 584 HN ALA 584 -8.590 -11.325 -0.747 264 HA ALA 584 HA ALA 584 -9.627 -12.707 -2.974 265 HB1 ALA 584 HB1 ALA 584 -7.600 -13.734 -0.993 266 HB2 ALA 584 HB2 ALA 584 -7.236 -12.690 -2.369 267 HB3 ALA 584 HB3 ALA 584 -7.862 -14.316 -2.638 268 H ASN 585 HN ASN 585 -9.821 -13.297 0.480 269 HA ASN 585 HA ASN 585 -10.959 -15.884 0.318 270 HB2 ASN 585 HB2 ASN 585 -11.441 -15.628 2.678 271 HB3 ASN 585 HB1 ASN 585 -9.831 -15.019 2.337 272 HD21 ASN 585 HD21 ASN 585 -11.435 -14.431 4.588 273 HD22 ASN 585 HD22 ASN 585 -11.710 -12.718 4.588 274 H GLY 586 HN GLY 586 -12.227 -12.721 -0.162 275 HA2 GLY 586 HA2 GLY 586 -14.208 -12.569 -1.493 276 HA3 GLY 586 HA1 GLY 586 -14.839 -13.967 -0.650 277 H GLU 587 HN GLU 587 -13.400 -11.886 1.571 278 HA GLU 587 HA GLU 587 -16.052 -11.075 2.441 279 HB2 GLU 587 HB2 GLU 587 -15.055 -10.459 4.525 280 HB3 GLU 587 HB1 GLU 587 -14.368 -12.003 4.051 281 HG2 GLU 587 HG2 GLU 587 -12.356 -10.942 3.322 282 HG3 GLU 587 HG1 GLU 587 -13.032 -9.348 3.670 283 H LEU 588 HN LEU 588 -16.551 -8.906 3.009 284 HA LEU 588 HA LEU 588 -15.237 -6.986 1.205 285 HB2 LEU 588 HB2 LEU 588 -18.125 -7.043 2.080 286 HB3 LEU 588 HB1 LEU 588 -17.408 -5.945 0.916 287 HG LEU 588 HG LEU 588 -17.685 -8.929 0.549 288 HD11 LEU 588 HD11 LEU 588 -19.393 -8.358 -1.092 289 HD12 LEU 588 HD12 LEU 588 -19.210 -6.648 -0.702 290 HD13 LEU 588 HD13 LEU 588 -19.835 -7.767 0.509 291 HD21 LEU 588 HD21 LEU 588 -15.762 -8.087 -0.635 292 HD22 LEU 588 HD22 LEU 588 -16.708 -6.755 -1.296 293 HD23 LEU 588 HD23 LEU 588 -17.054 -8.412 -1.790 294 H LYS 589 HN LYS 589 -14.380 -5.241 2.158 295 HA LYS 589 HA LYS 589 -15.424 -4.407 4.770 296 HB2 LYS 589 HB2 LYS 589 -12.529 -4.835 4.070 297 HB3 LYS 589 HB1 LYS 589 -13.083 -4.009 5.507 298 HG2 LYS 589 HG2 LYS 589 -14.081 -6.018 6.353 299 HG3 LYS 589 HG1 LYS 589 -13.737 -6.864 4.846 300 HD2 LYS 589 HD2 LYS 589 -12.128 -7.456 6.592 301 HD3 LYS 589 HD1 LYS 589 -11.345 -6.638 5.240 302 HE2 LYS 589 HE2 LYS 589 -10.426 -5.704 7.207 303 HE3 LYS 589 HE1 LYS 589 -11.547 -4.511 6.560 304 HZ1 LYS 589 HZ1 LYS 589 -13.214 -5.547 8.161 305 HZ2 LYS 589 HZ2 LYS 589 -12.013 -4.557 8.822 306 HZ3 LYS 589 HZ3 LYS 589 -11.874 -6.244 8.923 307 H LYS 590 HN LYS 590 -15.065 -2.290 5.329 308 HA LYS 590 HA LYS 590 -14.926 -0.365 3.258 309 HB2 LYS 590 HB2 LYS 590 -15.130 -0.399 6.215 310 HB3 LYS 590 HB1 LYS 590 -14.513 1.076 5.495 311 HG2 LYS 590 HG2 LYS 590 -17.085 -0.196 4.610 312 HG3 LYS 590 HG1 LYS 590 -17.002 0.967 5.933 313 HD2 LYS 590 HD2 LYS 590 -16.158 1.426 3.072 314 HD3 LYS 590 HD1 LYS 590 -17.581 2.113 3.859 315 HE2 LYS 590 HE2 LYS 590 -14.711 2.625 4.603 316 HE3 LYS 590 HE1 LYS 590 -15.769 3.728 3.747 317 HZ1 LYS 590 HZ1 LYS 590 -15.519 4.188 6.167 318 HZ2 LYS 590 HZ2 LYS 590 -16.335 2.736 6.482 319 HZ3 LYS 590 HZ3 LYS 590 -17.124 3.985 5.656 320 H VAL 591 HN VAL 591 -13.232 0.895 2.579 321 HA VAL 591 HA VAL 591 -10.749 -0.181 2.345 322 HB VAL 591 HB VAL 591 -11.014 2.800 2.564 323 HG11 VAL 591 HG11 VAL 591 -9.370 0.983 0.821 324 HG12 VAL 591 HG12 VAL 591 -8.799 1.960 2.175 325 HG13 VAL 591 HG13 VAL 591 -9.395 2.743 0.710 326 HG21 VAL 591 HG21 VAL 591 -11.917 1.104 0.253 327 HG22 VAL 591 HG22 VAL 591 -11.746 2.863 0.239 328 HG23 VAL 591 HG23 VAL 591 -12.936 2.101 1.295 329 H GLU 592 HN GLU 592 -11.750 2.147 4.786 330 HA GLU 592 HA GLU 592 -9.141 2.692 5.740 331 HB2 GLU 592 HB2 GLU 592 -10.355 3.932 7.517 332 HB3 GLU 592 HB1 GLU 592 -10.876 4.348 5.891 333 HG2 GLU 592 HG2 GLU 592 -12.793 2.786 6.178 334 HG3 GLU 592 HG1 GLU 592 -12.302 2.575 7.858 335 H ASP 593 HN ASP 593 -11.333 0.155 6.418 336 HA ASP 593 HA ASP 593 -10.174 -0.250 9.087 337 HB2 ASP 593 HB2 ASP 593 -12.626 -0.065 9.017 338 HB3 ASP 593 HB1 ASP 593 -12.706 -1.378 7.852 339 H LEU 594 HN LEU 594 -9.826 -1.293 5.978 340 HA LEU 594 HA LEU 594 -9.352 -4.023 6.199 341 HB2 LEU 594 HB2 LEU 594 -8.004 -1.922 4.511 342 HB3 LEU 594 HB1 LEU 594 -7.755 -3.646 4.313 343 HG LEU 594 HG LEU 594 -10.488 -2.414 4.109 344 HD11 LEU 594 HD11 LEU 594 -8.497 -2.893 1.904 345 HD12 LEU 594 HD12 LEU 594 -9.030 -1.318 2.493 346 HD13 LEU 594 HD13 LEU 594 -10.176 -2.400 1.701 347 HD21 LEU 594 HD21 LEU 594 -9.268 -4.969 3.091 348 HD22 LEU 594 HD22 LEU 594 -10.921 -4.436 2.798 349 HD23 LEU 594 HD23 LEU 594 -10.394 -4.815 4.439 350 H LYS 595 HN LYS 595 -7.890 -5.142 7.265 351 HA LYS 595 HA LYS 595 -5.602 -3.705 8.398 352 HB2 LYS 595 HB2 LYS 595 -6.736 -6.420 9.096 353 HB3 LYS 595 HB1 LYS 595 -5.353 -5.669 9.882 354 HG2 LYS 595 HG2 LYS 595 -8.191 -4.661 9.889 355 HG3 LYS 595 HG1 LYS 595 -7.319 -5.385 11.244 356 HD2 LYS 595 HD2 LYS 595 -5.766 -3.536 11.286 357 HD3 LYS 595 HD1 LYS 595 -6.505 -2.841 9.845 358 HE2 LYS 595 HE2 LYS 595 -8.616 -2.580 11.093 359 HE3 LYS 595 HE1 LYS 595 -7.807 -3.189 12.537 360 HZ1 LYS 595 HZ1 LYS 595 -6.282 -1.326 12.435 361 HZ2 LYS 595 HZ2 LYS 595 -7.877 -0.771 12.499 362 HZ3 LYS 595 HZ3 LYS 595 -7.037 -0.749 11.033 363 H THR 596 HN THR 596 -3.505 -4.673 8.286 364 HA THR 596 HA THR 596 -2.844 -5.449 5.680 365 HB THR 596 HB THR 596 -1.276 -4.298 7.178 366 HG1 THR 596 HG1 THR 596 0.292 -6.428 6.771 367 HG21 THR 596 HG21 THR 596 -1.807 -5.514 9.256 368 HG22 THR 596 HG22 THR 596 -0.078 -5.518 8.909 369 HG23 THR 596 HG23 THR 596 -1.046 -6.959 8.589 370 H GLU 597 HN GLU 597 -3.542 -7.300 8.544 371 HA GLU 597 HA GLU 597 -2.574 -9.800 7.728 372 HB2 GLU 597 HB2 GLU 597 -4.934 -9.185 9.488 373 HB3 GLU 597 HB1 GLU 597 -4.095 -10.723 9.397 374 HG2 GLU 597 HG2 GLU 597 -2.062 -9.662 10.239 375 HG3 GLU 597 HG1 GLU 597 -2.919 -8.124 10.348 376 H ASP 598 HN ASP 598 -5.436 -8.028 6.927 377 HA ASP 598 HA ASP 598 -6.973 -10.183 5.919 378 HB2 ASP 598 HB2 ASP 598 -7.102 -7.220 5.334 379 HB3 ASP 598 HB1 ASP 598 -8.288 -8.389 4.785 380 H PHE 599 HN PHE 599 -4.774 -7.845 4.424 381 HA PHE 599 HA PHE 599 -5.073 -8.951 1.806 382 HB2 PHE 599 HB2 PHE 599 -3.078 -7.016 2.976 383 HB3 PHE 599 HB1 PHE 599 -2.944 -7.617 1.329 384 HD1 PHE 599 HD1 PHE 599 -5.708 -6.312 3.485 385 HD2 PHE 599 HD2 PHE 599 -3.707 -6.188 -0.266 386 HE1 PHE 599 HE1 PHE 599 -7.318 -4.637 2.684 387 HE2 PHE 599 HE2 PHE 599 -5.316 -4.509 -1.070 388 HZ PHE 599 HZ PHE 599 -7.123 -3.731 0.404 389 H ILE 600 HN ILE 600 -2.722 -9.330 4.435 390 HA ILE 600 HA ILE 600 -0.922 -11.045 3.254 391 HB ILE 600 HB ILE 600 -2.068 -11.044 6.035 392 HG12 ILE 600 HG12 ILE 600 0.599 -10.133 4.944 393 HG13 ILE 600 HG11 ILE 600 -0.752 -9.084 5.342 394 HG21 ILE 600 HG21 ILE 600 -0.071 -12.430 6.645 395 HG22 ILE 600 HG22 ILE 600 0.165 -12.726 4.921 396 HG23 ILE 600 HG23 ILE 600 -1.315 -13.271 5.718 397 HD11 ILE 600 HD11 ILE 600 0.724 -10.822 7.295 398 HD12 ILE 600 HD12 ILE 600 -0.596 -9.711 7.665 399 HD13 ILE 600 HD13 ILE 600 0.946 -9.085 7.084 400 H GLN 601 HN GLN 601 -3.854 -12.011 5.032 401 HA GLN 601 HA GLN 601 -3.746 -14.716 4.405 402 HB2 GLN 601 HB2 GLN 601 -6.095 -12.927 5.010 403 HB3 GLN 601 HB1 GLN 601 -6.249 -14.667 4.808 404 HG2 GLN 601 HG2 GLN 601 -4.715 -15.026 6.646 405 HG3 GLN 601 HG1 GLN 601 -4.539 -13.284 6.859 406 HE21 GLN 601 HE21 GLN 601 -5.348 -13.275 8.940 407 HE22 GLN 601 HE22 GLN 601 -7.017 -13.556 9.290 408 H SER 602 HN SER 602 -5.400 -12.079 2.692 409 HA SER 602 HA SER 602 -6.713 -13.597 0.790 410 HB2 SER 602 HB2 SER 602 -5.504 -10.840 0.516 411 HB3 SER 602 HB1 SER 602 -6.616 -11.558 -0.654 412 HG SER 602 HG SER 602 -7.108 -10.857 2.051 413 H ALA 603 HN ALA 603 -3.374 -12.426 0.747 414 HA ALA 603 HA ALA 603 -2.873 -13.450 -1.884 415 HB1 ALA 603 HB1 ALA 603 -0.850 -12.640 0.186 416 HB2 ALA 603 HB2 ALA 603 -1.697 -11.498 -0.855 417 HB3 ALA 603 HB3 ALA 603 -0.634 -12.711 -1.562 418 H GLU 604 HN GLU 604 -2.466 -14.611 1.395 419 HA GLU 604 HA GLU 604 -0.693 -16.746 0.729 420 HB2 GLU 604 HB2 GLU 604 -2.392 -16.291 3.180 421 HB3 GLU 604 HB1 GLU 604 -1.195 -17.571 3.022 422 HG2 GLU 604 HG2 GLU 604 0.472 -15.699 2.542 423 HG3 GLU 604 HG1 GLU 604 -0.773 -14.611 3.150 424 H ILE 605 HN ILE 605 -4.156 -16.492 1.272 425 HA ILE 605 HA ILE 605 -4.831 -19.214 0.992 426 HB ILE 605 HB ILE 605 -6.503 -16.796 0.268 427 HG12 ILE 605 HG12 ILE 605 -6.459 -18.290 2.891 428 HG13 ILE 605 HG11 ILE 605 -5.536 -16.822 2.604 429 HG21 ILE 605 HG21 ILE 605 -8.423 -18.239 0.682 430 HG22 ILE 605 HG22 ILE 605 -7.343 -19.592 1.017 431 HG23 ILE 605 HG23 ILE 605 -7.404 -18.894 -0.601 432 HD11 ILE 605 HD11 ILE 605 -7.664 -15.649 2.103 433 HD12 ILE 605 HD12 ILE 605 -7.534 -16.246 3.762 434 HD13 ILE 605 HD13 ILE 605 -8.531 -17.112 2.582 435 H SER 606 HN SER 606 -4.114 -16.703 -1.276 436 HA SER 606 HA SER 606 -5.113 -18.223 -3.549 437 HB2 SER 606 HB2 SER 606 -3.842 -15.484 -3.416 438 HB3 SER 606 HB1 SER 606 -4.633 -16.193 -4.822 439 HG SER 606 HG SER 606 -5.739 -15.179 -2.461 440 H ASN 607 HN ASN 607 -3.652 -18.184 -5.525 441 HA ASN 607 HA ASN 607 -0.882 -18.810 -4.743 442 HB2 ASN 607 HB2 ASN 607 -2.136 -20.818 -5.428 443 HB3 ASN 607 HB1 ASN 607 -2.524 -20.049 -6.963 444 HD21 ASN 607 HD21 ASN 607 -0.071 -21.584 -5.065 445 HD22 ASN 607 HD22 ASN 607 1.079 -21.779 -6.337 446 H ASP 608 HN ASP 608 -3.025 -17.314 -7.076 447 HA ASP 608 HA ASP 608 -0.942 -16.456 -8.834 448 HB2 ASP 608 HB2 ASP 608 -3.806 -15.538 -8.523 449 HB3 ASP 608 HB1 ASP 608 -2.713 -14.920 -9.757 450 H LEU 609 HN LEU 609 -2.521 -15.146 -6.003 451 HA LEU 609 HA LEU 609 -0.907 -12.714 -6.220 452 HB2 LEU 609 HB2 LEU 609 -2.958 -13.350 -4.120 453 HB3 LEU 609 HB1 LEU 609 -2.241 -11.796 -4.473 454 HG LEU 609 HG LEU 609 -4.237 -11.482 -5.448 455 HD11 LEU 609 HD11 LEU 609 -2.639 -11.269 -7.249 456 HD12 LEU 609 HD12 LEU 609 -4.217 -11.789 -7.835 457 HD13 LEU 609 HD13 LEU 609 -2.901 -12.956 -7.684 458 HD21 LEU 609 HD21 LEU 609 -5.148 -13.618 -4.767 459 HD22 LEU 609 HD22 LEU 609 -4.405 -14.385 -6.173 460 HD23 LEU 609 HD23 LEU 609 -5.674 -13.180 -6.392 461 H LYS 610 HN LYS 610 0.519 -12.107 -4.537 462 HA LYS 610 HA LYS 610 0.806 -13.702 -2.191 463 HB2 LYS 610 HB2 LYS 610 3.265 -14.237 -2.686 464 HB3 LYS 610 HB1 LYS 610 2.030 -15.251 -3.408 465 HG2 LYS 610 HG2 LYS 610 2.270 -13.909 -5.500 466 HG3 LYS 610 HG1 LYS 610 3.654 -13.112 -4.747 467 HD2 LYS 610 HD2 LYS 610 4.831 -15.191 -4.558 468 HD3 LYS 610 HD1 LYS 610 3.413 -16.096 -5.088 469 HE2 LYS 610 HE2 LYS 610 3.549 -15.004 -7.284 470 HE3 LYS 610 HE1 LYS 610 4.982 -14.124 -6.747 471 HZ1 LYS 610 HZ1 LYS 610 4.758 -17.082 -6.935 472 HZ2 LYS 610 HZ2 LYS 610 6.137 -16.218 -6.472 473 HZ3 LYS 610 HZ3 LYS 610 5.551 -16.088 -8.050 474 H ILE 611 HN ILE 611 2.113 -12.805 -0.629 475 HA ILE 611 HA ILE 611 2.403 -9.916 -0.878 476 HB ILE 611 HB ILE 611 2.720 -11.729 1.522 477 HG12 ILE 611 HG12 ILE 611 0.393 -11.286 0.272 478 HG13 ILE 611 HG11 ILE 611 0.508 -11.506 2.009 479 HG21 ILE 611 HG21 ILE 611 2.617 -9.753 2.890 480 HG22 ILE 611 HG22 ILE 611 2.452 -8.745 1.457 481 HG23 ILE 611 HG23 ILE 611 3.953 -9.628 1.741 482 HD11 ILE 611 HD11 ILE 611 0.440 -8.839 0.607 483 HD12 ILE 611 HD12 ILE 611 0.398 -9.113 2.351 484 HD13 ILE 611 HD13 ILE 611 -0.957 -9.632 1.341 485 H ASP 612 HN ASP 612 4.317 -8.815 -0.352 486 HA ASP 612 HA ASP 612 6.758 -10.455 -0.152 487 HB2 ASP 612 HB2 ASP 612 6.555 -9.164 -2.317 488 HB3 ASP 612 HB1 ASP 612 6.620 -7.687 -1.351 489 H SER 613 HN SER 613 8.507 -9.502 1.096 490 HA SER 613 HA SER 613 7.578 -7.487 3.030 491 HB2 SER 613 HB2 SER 613 9.677 -9.604 3.531 492 HB3 SER 613 HB1 SER 613 8.962 -8.513 4.713 493 HG SER 613 HG SER 613 7.041 -9.898 3.426 494 H SER 614 HN SER 614 8.374 -5.670 2.028 495 HA SER 614 HA SER 614 11.296 -5.581 1.634 496 HB2 SER 614 HB2 SER 614 9.113 -3.995 0.261 497 HB3 SER 614 HB1 SER 614 10.835 -3.690 0.061 498 HG SER 614 HG SER 614 9.636 -6.212 -0.482 499 H THR 615 HN THR 615 12.171 -4.675 3.412 500 HA THR 615 HA THR 615 10.619 -2.851 5.040 501 HB THR 615 HB THR 615 13.436 -3.834 5.483 502 HG1 THR 615 HG1 THR 615 12.253 -5.652 5.657 503 HG21 THR 615 HG21 THR 615 13.024 -3.212 7.821 504 HG22 THR 615 HG22 THR 615 11.427 -2.606 7.384 505 HG23 THR 615 HG23 THR 615 12.873 -1.814 6.757 506 H VAL 616 HN VAL 616 10.526 -0.754 4.469 507 HA VAL 616 HA VAL 616 12.366 0.648 2.949 508 HB VAL 616 HB VAL 616 10.317 1.719 3.192 509 HG11 VAL 616 HG11 VAL 616 9.304 2.317 5.333 510 HG12 VAL 616 HG12 VAL 616 10.644 1.542 6.170 511 HG13 VAL 616 HG13 VAL 616 9.550 0.577 5.185 512 HG21 VAL 616 HG21 VAL 616 12.114 3.348 3.266 513 HG22 VAL 616 HG22 VAL 616 12.230 3.164 5.018 514 HG23 VAL 616 HG23 VAL 616 10.785 3.881 4.302 515 H GLU 617 HN GLU 617 14.376 1.102 3.282 516 HA GLU 617 HA GLU 617 15.457 1.216 5.983 517 HB2 GLU 617 HB2 GLU 617 16.784 1.165 3.283 518 HB3 GLU 617 HB1 GLU 617 17.627 1.101 4.824 519 HG2 GLU 617 HG2 GLU 617 15.530 -0.919 4.219 520 HG3 GLU 617 HG1 GLU 617 17.125 -1.074 3.490 521 H ARG 618 HN ARG 618 14.543 3.274 3.388 522 HA ARG 618 HA ARG 618 15.434 5.622 4.771 523 HB2 ARG 618 HB2 ARG 618 17.561 5.014 3.840 524 HB3 ARG 618 HB1 ARG 618 16.853 4.762 2.251 525 HG2 ARG 618 HG2 ARG 618 16.496 7.082 1.951 526 HG3 ARG 618 HG1 ARG 618 16.874 7.426 3.637 527 HD2 ARG 618 HD2 ARG 618 18.701 7.992 2.037 528 HD3 ARG 618 HD1 ARG 618 19.169 6.879 3.317 529 HE ARG 618 HE ARG 618 18.590 5.171 1.367 530 HH11 ARG 618 HH11 ARG 618 20.346 8.188 1.213 531 HH12 ARG 618 HH12 ARG 618 21.443 7.644 -0.011 532 HH21 ARG 618 HH21 ARG 618 20.061 4.426 -0.241 533 HH22 ARG 618 HH22 ARG 618 21.283 5.506 -0.837 534 H ILE 619 HN ILE 619 14.379 7.425 4.120 535 HA ILE 619 HA ILE 619 12.671 7.212 1.731 536 HB ILE 619 HB ILE 619 11.974 8.407 4.418 537 HG12 ILE 619 HG12 ILE 619 10.587 6.268 2.808 538 HG13 ILE 619 HG11 ILE 619 11.758 5.928 4.078 539 HG21 ILE 619 HG21 ILE 619 11.190 9.888 2.650 540 HG22 ILE 619 HG22 ILE 619 9.835 9.065 3.422 541 HG23 ILE 619 HG23 ILE 619 10.408 8.529 1.843 542 HD11 ILE 619 HD11 ILE 619 9.131 7.365 4.420 543 HD12 ILE 619 HD12 ILE 619 10.298 7.034 5.700 544 HD13 ILE 619 HD13 ILE 619 9.479 5.701 4.886 545 H GLU 620 HN GLU 620 13.218 8.680 0.282 546 HA GLU 620 HA GLU 620 14.473 11.168 1.241 547 HB2 GLU 620 HB2 GLU 620 14.988 9.881 -1.435 548 HB3 GLU 620 HB1 GLU 620 15.870 11.208 -0.696 549 HG2 GLU 620 HG2 GLU 620 16.599 9.633 1.090 550 HG3 GLU 620 HG1 GLU 620 15.843 8.331 0.169 551 H ASP 621 HN ASP 621 13.791 13.062 0.391 552 HA ASP 621 HA ASP 621 11.271 12.984 -1.044 553 HB2 ASP 621 HB2 ASP 621 11.134 15.369 -0.570 554 HB3 ASP 621 HB1 ASP 621 11.528 14.489 0.902 555 H SER 622 HN SER 622 10.947 13.694 -3.079 556 HA SER 622 HA SER 622 13.352 14.267 -4.673 557 HB2 SER 622 HB2 SER 622 11.835 12.271 -5.216 558 HB3 SER 622 HB1 SER 622 10.619 13.451 -5.687 559 HG SER 622 HG SER 622 12.202 12.510 -7.329 560 H HIS 623 HN HIS 623 13.353 16.114 -6.054 561 HA HIS 623 HA HIS 623 11.572 18.199 -5.178 562 HB2 HIS 623 HB2 HIS 623 12.796 19.649 -6.815 563 HB3 HIS 623 HB1 HIS 623 13.781 18.952 -5.545 564 HD1 HIS 623 HD1 HIS 623 13.191 18.793 -9.250 565 HD2 HIS 623 HD2 HIS 623 15.834 17.304 -6.407 566 HE1 HIS 623 HE1 HIS 623 15.112 17.826 -10.551 567 HE2 HIS 623 HE2 HIS 623 16.594 16.757 -8.818 568 H SER 624 HN SER 624 9.767 16.992 -5.798 569 HA SER 624 HA SER 624 8.614 17.915 -8.262 570 HB2 SER 624 HB2 SER 624 8.980 14.949 -7.744 571 HB3 SER 624 HB1 SER 624 7.925 15.620 -8.984 572 HG SER 624 HG SER 624 10.448 16.642 -9.113 573 HA PRO 625 HA PRO 625 5.177 18.429 -5.613 574 HB2 PRO 625 HB2 PRO 625 3.551 17.249 -7.786 575 HB3 PRO 625 HB1 PRO 625 3.333 18.775 -6.928 576 HG2 PRO 625 HG2 PRO 625 4.321 18.704 -9.417 577 HG3 PRO 625 HG1 PRO 625 4.893 19.880 -8.221 578 HD2 PRO 625 HD2 PRO 625 6.236 17.456 -9.279 579 HD3 PRO 625 HD1 PRO 625 6.937 18.960 -8.657 580 H GLY 626 HN GLY 626 5.182 17.114 -3.964 581 HA2 GLY 626 HA2 GLY 626 4.541 15.409 -2.595 582 HA3 GLY 626 HA1 GLY 626 3.332 15.026 -3.807 583 H VAL 627 HN VAL 627 6.818 14.927 -4.405 584 HA VAL 627 HA VAL 627 6.474 12.026 -4.810 585 HB VAL 627 HB VAL 627 8.582 13.785 -6.065 586 HG11 VAL 627 HG11 VAL 627 9.239 11.439 -5.851 587 HG12 VAL 627 HG12 VAL 627 8.958 11.869 -7.537 588 HG13 VAL 627 HG13 VAL 627 7.747 10.944 -6.650 589 HG21 VAL 627 HG21 VAL 627 7.218 13.427 -8.140 590 HG22 VAL 627 HG22 VAL 627 6.471 14.467 -6.925 591 HG23 VAL 627 HG23 VAL 627 5.938 12.794 -7.099 592 H ALA 628 HN ALA 628 7.515 10.662 -3.593 593 HA ALA 628 HA ALA 628 10.105 11.405 -2.441 594 HB1 ALA 628 HB1 ALA 628 7.850 10.155 -0.865 595 HB2 ALA 628 HB2 ALA 628 8.476 11.791 -0.660 596 HB3 ALA 628 HB3 ALA 628 9.499 10.403 -0.285 597 H VAL 629 HN VAL 629 11.549 9.793 -2.484 598 HA VAL 629 HA VAL 629 10.645 7.298 -3.704 599 HB VAL 629 HB VAL 629 12.349 8.104 -5.043 600 HG11 VAL 629 HG11 VAL 629 14.410 9.090 -4.247 601 HG12 VAL 629 HG12 VAL 629 13.925 8.785 -2.579 602 HG13 VAL 629 HG13 VAL 629 13.009 9.924 -3.569 603 HG21 VAL 629 HG21 VAL 629 14.291 6.652 -4.692 604 HG22 VAL 629 HG22 VAL 629 12.772 5.785 -4.455 605 HG23 VAL 629 HG23 VAL 629 13.723 6.298 -3.061 606 H ILE 630 HN ILE 630 10.266 5.706 -2.432 607 HA ILE 630 HA ILE 630 11.485 5.581 0.198 608 HB ILE 630 HB ILE 630 9.521 3.591 -0.888 609 HG12 ILE 630 HG12 ILE 630 8.557 5.812 -1.319 610 HG13 ILE 630 HG11 ILE 630 7.689 4.971 -0.043 611 HG21 ILE 630 HG21 ILE 630 10.604 3.093 1.224 612 HG22 ILE 630 HG22 ILE 630 8.889 3.421 1.469 613 HG23 ILE 630 HG23 ILE 630 10.086 4.649 1.869 614 HD11 ILE 630 HD11 ILE 630 9.746 7.120 0.362 615 HD12 ILE 630 HD12 ILE 630 8.839 6.295 1.630 616 HD13 ILE 630 HD13 ILE 630 7.998 7.325 0.472 617 H GLN 631 HN GLN 631 13.327 4.504 0.424 618 HA GLN 631 HA GLN 631 14.093 2.541 -1.597 619 HB2 GLN 631 HB2 GLN 631 15.666 4.342 -1.033 620 HB3 GLN 631 HB1 GLN 631 15.692 3.803 0.636 621 HG2 GLN 631 HG2 GLN 631 16.877 1.864 0.114 622 HG3 GLN 631 HG1 GLN 631 16.495 1.987 -1.604 623 HE21 GLN 631 HE21 GLN 631 17.070 4.822 -1.761 624 HE22 GLN 631 HE22 GLN 631 18.791 4.976 -1.702 625 H PHE 632 HN PHE 632 13.579 0.523 -1.244 626 HA PHE 632 HA PHE 632 13.109 -0.379 1.512 627 HB2 PHE 632 HB2 PHE 632 12.158 -1.536 -1.109 628 HB3 PHE 632 HB1 PHE 632 11.802 -2.194 0.478 629 HD1 PHE 632 HD1 PHE 632 10.334 -0.947 2.027 630 HD2 PHE 632 HD2 PHE 632 10.934 0.276 -2.002 631 HE1 PHE 632 HE1 PHE 632 8.286 0.407 2.139 632 HE2 PHE 632 HE2 PHE 632 8.889 1.637 -1.897 633 HZ PHE 632 HZ PHE 632 7.560 1.703 0.173 634 H ALA 633 HN ALA 633 13.912 -2.269 2.285 635 HA ALA 633 HA ALA 633 16.109 -3.535 0.850 636 HB1 ALA 633 HB1 ALA 633 16.413 -2.965 3.217 637 HB2 ALA 633 HB2 ALA 633 16.511 -4.706 2.957 638 HB3 ALA 633 HB3 ALA 633 15.047 -3.998 3.639 639 H VAL 634 HN VAL 634 15.394 -4.940 -0.632 640 HA VAL 634 HA VAL 634 12.995 -6.514 -0.127 641 HB VAL 634 HB VAL 634 14.723 -6.235 -2.585 642 HG11 VAL 634 HG11 VAL 634 12.965 -7.453 -3.770 643 HG12 VAL 634 HG12 VAL 634 12.111 -7.706 -2.247 644 HG13 VAL 634 HG13 VAL 634 13.691 -8.444 -2.505 645 HG21 VAL 634 HG21 VAL 634 11.973 -5.162 -1.943 646 HG22 VAL 634 HG22 VAL 634 12.800 -5.000 -3.492 647 HG23 VAL 634 HG23 VAL 634 13.460 -4.222 -2.055 648 H GLY 635 HN GLY 635 13.082 -8.500 0.645 649 HA2 GLY 635 HA2 GLY 635 13.670 -10.755 0.574 650 HA3 GLY 635 HA1 GLY 635 15.122 -10.327 -0.315 651 H GLU 636 HN GLU 636 15.628 -12.100 1.425 652 HA GLU 636 HA GLU 636 16.017 -11.195 4.099 653 HB2 GLU 636 HB2 GLU 636 17.144 -13.609 2.700 654 HB3 GLU 636 HB1 GLU 636 17.103 -13.351 4.433 655 HG2 GLU 636 HG2 GLU 636 14.676 -13.588 2.669 656 HG3 GLU 636 HG1 GLU 636 15.355 -14.893 3.639 657 H HIS 637 HN HIS 637 17.724 -10.766 1.222 658 HA HIS 637 HA HIS 637 20.299 -10.413 2.563 659 HB2 HIS 637 HB2 HIS 637 19.513 -10.321 -0.350 660 HB3 HIS 637 HB1 HIS 637 21.126 -9.919 0.225 661 HD1 HIS 637 HD1 HIS 637 19.247 -12.667 -1.064 662 HD2 HIS 637 HD2 HIS 637 22.266 -12.236 1.759 663 HE1 HIS 637 HE1 HIS 637 20.267 -14.947 -0.810 664 HE2 HIS 637 HE2 HIS 637 22.158 -14.644 0.825 665 H ARG 638 HN ARG 638 17.611 -8.648 2.115 666 HA ARG 638 HA ARG 638 17.039 -6.468 2.107 667 HB2 ARG 638 HB2 ARG 638 19.792 -6.220 3.315 668 HB3 ARG 638 HB1 ARG 638 18.669 -4.875 3.192 669 HG2 ARG 638 HG2 ARG 638 17.031 -6.281 4.497 670 HG3 ARG 638 HG1 ARG 638 18.367 -7.394 4.796 671 HD2 ARG 638 HD2 ARG 638 19.640 -5.602 5.849 672 HD3 ARG 638 HD1 ARG 638 18.332 -4.466 5.519 673 HE ARG 638 HE ARG 638 17.908 -6.829 7.224 674 HH11 ARG 638 HH11 ARG 638 17.756 -3.354 6.723 675 HH12 ARG 638 HH12 ARG 638 16.939 -3.060 8.225 676 HH21 ARG 638 HH21 ARG 638 16.825 -6.420 9.193 677 HH22 ARG 638 HH22 ARG 638 16.412 -4.792 9.620 678 H ALA 639 HN ALA 639 17.571 -7.167 -0.375 679 HA ALA 639 HA ALA 639 19.612 -5.578 -1.609 680 HB1 ALA 639 HB1 ALA 639 18.579 -6.265 -3.721 681 HB2 ALA 639 HB2 ALA 639 17.225 -6.963 -2.832 682 HB3 ALA 639 HB3 ALA 639 18.843 -7.644 -2.654 683 H GLN 640 HN GLN 640 19.507 -3.481 -2.061 684 HA GLN 640 HA GLN 640 17.235 -2.011 -1.173 685 HB2 GLN 640 HB2 GLN 640 19.873 -1.245 -2.316 686 HB3 GLN 640 HB1 GLN 640 18.594 -0.047 -2.176 687 HG2 GLN 640 HG2 GLN 640 20.200 -1.359 -0.079 688 HG3 GLN 640 HG1 GLN 640 19.583 0.278 -0.213 689 HE21 GLN 640 HE21 GLN 640 18.904 -2.927 0.861 690 HE22 GLN 640 HE22 GLN 640 17.488 -2.517 1.762 691 H VAL 641 HN VAL 641 15.970 -0.612 -2.243 692 HA VAL 641 HA VAL 641 15.895 -0.568 -5.150 693 HB VAL 641 HB VAL 641 13.566 -1.644 -3.531 694 HG11 VAL 641 HG11 VAL 641 13.704 -0.914 -6.455 695 HG12 VAL 641 HG12 VAL 641 12.751 -0.099 -5.213 696 HG13 VAL 641 HG13 VAL 641 12.367 -1.758 -5.676 697 HG21 VAL 641 HG21 VAL 641 13.762 -3.602 -5.011 698 HG22 VAL 641 HG22 VAL 641 15.214 -3.349 -4.042 699 HG23 VAL 641 HG23 VAL 641 15.198 -2.885 -5.742 700 H SER 642 HN SER 642 15.728 1.533 -5.562 701 HA SER 642 HA SER 642 14.230 3.225 -3.687 702 HB2 SER 642 HB2 SER 642 15.492 5.088 -4.936 703 HB3 SER 642 HB1 SER 642 16.437 4.031 -3.887 704 HG SER 642 HG SER 642 16.478 4.301 -6.639 705 H VAL 643 HN VAL 643 12.195 3.644 -4.282 706 HA VAL 643 HA VAL 643 11.650 4.070 -7.137 707 HB VAL 643 HB VAL 643 10.648 1.996 -6.545 708 HG11 VAL 643 HG11 VAL 643 9.405 3.407 -4.184 709 HG12 VAL 643 HG12 VAL 643 10.692 2.202 -4.122 710 HG13 VAL 643 HG13 VAL 643 9.081 1.742 -4.672 711 HG21 VAL 643 HG21 VAL 643 8.235 2.495 -6.791 712 HG22 VAL 643 HG22 VAL 643 9.262 3.356 -7.940 713 HG23 VAL 643 HG23 VAL 643 8.610 4.201 -6.537 714 H GLU 644 HN GLU 644 10.938 6.035 -7.616 715 HA GLU 644 HA GLU 644 10.125 7.889 -5.538 716 HB2 GLU 644 HB2 GLU 644 10.485 8.163 -8.525 717 HB3 GLU 644 HB1 GLU 644 9.902 9.472 -7.508 718 HG2 GLU 644 HG2 GLU 644 11.969 9.478 -6.270 719 HG3 GLU 644 HG1 GLU 644 12.555 8.091 -7.191 720 H VAL 645 HN VAL 645 8.051 7.575 -4.817 721 HA VAL 645 HA VAL 645 5.933 7.414 -6.849 722 HB VAL 645 HB VAL 645 5.708 6.549 -3.964 723 HG11 VAL 645 HG11 VAL 645 3.656 7.186 -5.063 724 HG12 VAL 645 HG12 VAL 645 3.690 5.456 -4.689 725 HG13 VAL 645 HG13 VAL 645 3.971 6.008 -6.341 726 HG21 VAL 645 HG21 VAL 645 6.229 4.826 -6.386 727 HG22 VAL 645 HG22 VAL 645 5.840 4.230 -4.772 728 HG23 VAL 645 HG23 VAL 645 7.344 5.111 -5.048 729 H LEU 646 HN LEU 646 3.932 8.566 -6.262 730 HA LEU 646 HA LEU 646 4.366 11.036 -4.943 731 HB2 LEU 646 HB2 LEU 646 1.794 9.700 -5.767 732 HB3 LEU 646 HB1 LEU 646 1.867 11.282 -5.019 733 HG LEU 646 HG LEU 646 2.623 10.454 -7.761 734 HD11 LEU 646 HD11 LEU 646 0.459 11.521 -7.277 735 HD12 LEU 646 HD12 LEU 646 1.463 12.485 -8.360 736 HD13 LEU 646 HD13 LEU 646 1.321 12.934 -6.660 737 HD21 LEU 646 HD21 LEU 646 3.832 12.792 -6.318 738 HD22 LEU 646 HD22 LEU 646 3.898 12.529 -8.061 739 HD23 LEU 646 HD23 LEU 646 4.684 11.390 -6.967 740 H VAL 647 HN VAL 647 3.713 11.687 -2.945 741 HA VAL 647 HA VAL 647 3.925 9.707 -0.930 742 HB VAL 647 HB VAL 647 3.549 11.557 0.678 743 HG11 VAL 647 HG11 VAL 647 5.784 11.105 -0.143 744 HG12 VAL 647 HG12 VAL 647 5.558 12.838 0.088 745 HG13 VAL 647 HG13 VAL 647 5.507 12.150 -1.535 746 HG21 VAL 647 HG21 VAL 647 3.083 13.181 -1.822 747 HG22 VAL 647 HG22 VAL 647 3.434 13.879 -0.241 748 HG23 VAL 647 HG23 VAL 647 1.966 12.931 -0.475 749 H GLU 648 HN GLU 648 1.274 10.975 -2.634 750 HA GLU 648 HA GLU 648 -0.700 10.470 -0.600 751 HB2 GLU 648 HB2 GLU 648 -2.323 10.994 -2.442 752 HB3 GLU 648 HB1 GLU 648 -1.176 12.273 -2.084 753 HG2 GLU 648 HG2 GLU 648 -0.909 12.345 -4.302 754 HG3 GLU 648 HG1 GLU 648 0.125 10.941 -4.055 755 H TYR 649 HN TYR 649 1.055 8.516 -2.594 756 HA TYR 649 HA TYR 649 -0.952 6.657 -3.380 757 HB2 TYR 649 HB2 TYR 649 1.259 6.883 -4.514 758 HB3 TYR 649 HB1 TYR 649 2.028 6.181 -3.090 759 HD1 TYR 649 HD2 TYR 649 -0.399 5.497 -5.810 760 HD2 TYR 649 HD1 TYR 649 2.112 3.833 -2.808 761 HE1 TYR 649 HE2 TYR 649 -0.799 3.255 -6.731 762 HE2 TYR 649 HE1 TYR 649 1.722 1.587 -3.725 763 HH TYR 649 HH TYR 649 -0.133 0.454 -5.100 764 HA PRO 650 HA PRO 650 -1.471 4.813 0.644 765 HB2 PRO 650 HB2 PRO 650 -2.845 2.660 -0.807 766 HB3 PRO 650 HB1 PRO 650 -3.480 3.778 0.402 767 HG2 PRO 650 HG2 PRO 650 -4.175 3.945 -2.183 768 HG3 PRO 650 HG1 PRO 650 -3.996 5.386 -1.164 769 HD2 PRO 650 HD2 PRO 650 -2.096 4.242 -3.176 770 HD3 PRO 650 HD1 PRO 650 -2.547 5.934 -2.882 771 H PHE 651 HN PHE 651 -0.149 3.505 1.747 772 HA PHE 651 HA PHE 651 1.119 1.281 0.301 773 HB2 PHE 651 HB2 PHE 651 2.324 3.183 2.303 774 HB3 PHE 651 HB1 PHE 651 3.046 1.615 1.958 775 HD1 PHE 651 HD1 PHE 651 3.972 1.140 -0.270 776 HD2 PHE 651 HD2 PHE 651 2.513 4.999 0.771 777 HE1 PHE 651 HE1 PHE 651 5.175 2.106 -2.186 778 HE2 PHE 651 HE2 PHE 651 3.712 5.972 -1.145 779 HZ PHE 651 HZ PHE 651 5.044 4.526 -2.626 780 H PHE 652 HN PHE 652 -0.038 -0.407 0.990 781 HA PHE 652 HA PHE 652 -0.774 -0.857 3.702 782 HB2 PHE 652 HB2 PHE 652 -1.221 -2.128 1.188 783 HB3 PHE 652 HB1 PHE 652 -0.542 -3.327 2.284 784 HD1 PHE 652 HD2 PHE 652 -1.644 -3.653 4.527 785 HD2 PHE 652 HD1 PHE 652 -3.457 -1.489 1.347 786 HE1 PHE 652 HE2 PHE 652 -3.834 -3.914 5.600 787 HE2 PHE 652 HE1 PHE 652 -5.651 -1.746 2.423 788 HZ PHE 652 HZ PHE 652 -5.842 -2.956 4.555 789 H VAL 653 HN VAL 653 0.458 -1.656 5.324 790 HA VAL 653 HA VAL 653 3.199 -2.355 4.547 791 HB VAL 653 HB VAL 653 2.314 -1.258 7.213 792 HG11 VAL 653 HG11 VAL 653 4.645 -0.825 7.535 793 HG12 VAL 653 HG12 VAL 653 5.013 -1.399 5.908 794 HG13 VAL 653 HG13 VAL 653 4.407 -2.520 7.127 795 HG21 VAL 653 HG21 VAL 653 3.333 0.167 4.766 796 HG22 VAL 653 HG22 VAL 653 3.392 0.865 6.384 797 HG23 VAL 653 HG23 VAL 653 1.832 0.466 5.647 798 H PHE 654 HN PHE 654 4.043 -4.216 5.082 799 HA PHE 654 HA PHE 654 2.647 -6.453 5.083 800 HB2 PHE 654 HB2 PHE 654 4.963 -6.497 4.681 801 HB3 PHE 654 HB1 PHE 654 5.352 -5.988 6.314 802 HD1 PHE 654 HD2 PHE 654 3.960 -8.773 4.312 803 HD2 PHE 654 HD1 PHE 654 5.721 -7.588 8.000 804 HE1 PHE 654 HE2 PHE 654 4.218 -11.136 4.943 805 HE2 PHE 654 HE1 PHE 654 5.982 -9.949 8.638 806 HZ PHE 654 HZ PHE 654 5.230 -11.725 7.108 807 H GLY 655 HN GLY 655 3.980 -5.433 8.265 808 HA2 GLY 655 HA2 GLY 655 1.543 -6.599 9.443 809 HA3 GLY 655 HA1 GLY 655 3.121 -7.065 10.070 810 H GLN 656 HN GLN 656 2.575 -3.897 8.872 811 HA GLN 656 HA GLN 656 3.150 -2.898 11.571 812 HB2 GLN 656 HB2 GLN 656 3.814 -1.715 8.878 813 HB3 GLN 656 HB1 GLN 656 4.166 -0.935 10.402 814 HG2 GLN 656 HG2 GLN 656 6.160 -1.926 9.512 815 HG3 GLN 656 HG1 GLN 656 5.691 -2.762 10.971 816 HE21 GLN 656 HE21 GLN 656 5.798 -2.951 7.511 817 HE22 GLN 656 HE22 GLN 656 5.692 -4.674 7.367 818 H GLY 657 HN GLY 657 1.119 -2.436 8.697 819 HA2 GLY 657 HA2 GLY 657 -1.217 -1.958 9.746 820 HA3 GLY 657 HA1 GLY 657 -0.447 -0.448 10.187 821 H TRP 658 HN TRP 658 -2.508 0.082 8.934 822 HA TRP 658 HA TRP 658 -2.216 0.120 6.042 823 HB2 TRP 658 HB2 TRP 658 -4.398 -0.324 7.276 824 HB3 TRP 658 HB1 TRP 658 -4.385 1.352 7.779 825 HD1 TRP 658 HD1 TRP 658 -6.832 1.255 6.560 826 HE1 TRP 658 HE1 TRP 658 -7.478 1.793 4.139 827 HE3 TRP 658 HE3 TRP 658 -2.217 0.837 4.347 828 HZ2 TRP 658 HZ2 TRP 658 -6.229 2.020 1.643 829 HZ3 TRP 658 HZ3 TRP 658 -2.059 1.231 1.929 830 HH2 TRP 658 HH2 TRP 658 -4.018 1.811 0.614 831 H SER 659 HN SER 659 -0.744 1.641 5.322 832 HA SER 659 HA SER 659 -0.726 4.240 6.698 833 HB2 SER 659 HB2 SER 659 1.687 2.630 5.828 834 HB3 SER 659 HB1 SER 659 1.740 4.223 6.585 835 HG SER 659 HG SER 659 2.052 2.582 8.121 836 H SER 660 HN SER 660 0.434 5.940 5.525 837 HA SER 660 HA SER 660 0.917 5.596 2.689 838 HB2 SER 660 HB2 SER 660 -1.040 7.667 3.724 839 HB3 SER 660 HB1 SER 660 -0.449 7.562 2.066 840 HG SER 660 HG SER 660 -1.484 5.204 3.001 841 H CYS 661 HN CYS 661 2.137 7.440 1.819 842 HA CYS 661 HA CYS 661 4.084 8.271 3.740 843 HB2 CYS 661 HB2 CYS 661 3.760 8.942 0.816 844 HB3 CYS 661 HB1 CYS 661 5.142 9.423 1.795 845 HG CYS 661 HG CYS 661 5.021 6.863 -0.003 846 H CYS 662 HN CYS 662 1.144 9.587 2.689 847 HA CYS 662 HA CYS 662 1.671 11.877 4.349 848 HB2 CYS 662 HB2 CYS 662 0.957 13.546 2.753 849 HB3 CYS 662 HB1 CYS 662 2.278 12.634 2.048 850 HG CYS 662 HG CYS 662 -0.768 11.478 1.279 851 HA PRO 663 HA PRO 663 -2.311 9.618 5.062 852 HB2 PRO 663 HB2 PRO 663 -1.760 10.938 7.677 853 HB3 PRO 663 HB1 PRO 663 -2.338 9.302 7.334 854 HG2 PRO 663 HG2 PRO 663 0.184 9.702 8.056 855 HG3 PRO 663 HG1 PRO 663 -0.212 8.531 6.784 856 HD2 PRO 663 HD2 PRO 663 0.916 11.287 6.538 857 HD3 PRO 663 HD1 PRO 663 1.287 9.828 5.598 858 H GLU 664 HN GLU 664 -1.313 12.851 6.015 859 HA GLU 664 HA GLU 664 -3.783 14.016 6.472 860 HB2 GLU 664 HB2 GLU 664 -1.312 15.266 5.267 861 HB3 GLU 664 HB1 GLU 664 -2.651 16.146 6.000 862 HG2 GLU 664 HG2 GLU 664 -2.185 15.180 8.142 863 HG3 GLU 664 HG1 GLU 664 -0.954 14.133 7.442 864 H ARG 665 HN ARG 665 -1.922 13.957 3.442 865 HA ARG 665 HA ARG 665 -3.961 15.239 1.926 866 HB2 ARG 665 HB2 ARG 665 -1.698 15.422 1.192 867 HB3 ARG 665 HB1 ARG 665 -1.505 13.678 1.130 868 HG2 ARG 665 HG2 ARG 665 -3.032 13.560 -0.742 869 HG3 ARG 665 HG1 ARG 665 -3.303 15.299 -0.648 870 HD2 ARG 665 HD2 ARG 665 -0.973 15.722 -1.149 871 HD3 ARG 665 HD1 ARG 665 -0.634 13.995 -1.158 872 HE ARG 665 HE ARG 665 -2.561 14.275 -3.052 873 HH11 ARG 665 HH11 ARG 665 0.525 15.822 -2.490 874 HH12 ARG 665 HH12 ARG 665 0.828 16.115 -4.174 875 HH21 ARG 665 HH21 ARG 665 -2.163 14.652 -5.269 876 HH22 ARG 665 HH22 ARG 665 -0.707 15.461 -5.755 877 H THR 666 HN THR 666 -3.067 11.815 2.376 878 HA THR 666 HA THR 666 -4.844 10.815 0.435 879 HB THR 666 HB THR 666 -3.969 9.343 2.930 880 HG1 THR 666 HG1 THR 666 -2.479 8.845 0.721 881 HG21 THR 666 HG21 THR 666 -5.701 8.234 1.508 882 HG22 THR 666 HG22 THR 666 -4.185 7.336 1.571 883 HG23 THR 666 HG23 THR 666 -4.579 8.297 0.149 884 H SER 667 HN SER 667 -5.292 11.474 3.918 885 HA SER 667 HA SER 667 -8.025 10.652 3.886 886 HB2 SER 667 HB2 SER 667 -8.082 11.762 6.118 887 HB3 SER 667 HB1 SER 667 -6.831 10.541 5.964 888 HG SER 667 HG SER 667 -5.310 12.085 5.924 889 H GLN 668 HN GLN 668 -6.351 13.747 3.547 890 HA GLN 668 HA GLN 668 -8.523 15.466 3.670 891 HB2 GLN 668 HB2 GLN 668 -5.825 15.525 2.621 892 HB3 GLN 668 HB1 GLN 668 -6.930 16.646 1.846 893 HG2 GLN 668 HG2 GLN 668 -6.408 16.418 4.790 894 HG3 GLN 668 HG1 GLN 668 -5.805 17.635 3.702 895 HE21 GLN 668 HE21 GLN 668 -6.703 19.330 4.822 896 HE22 GLN 668 HE22 GLN 668 -8.405 19.631 4.843 897 H LEU 669 HN LEU 669 -7.121 13.867 0.826 898 HA LEU 669 HA LEU 669 -9.079 15.226 -0.857 899 HB2 LEU 669 HB2 LEU 669 -6.813 13.462 -1.748 900 HB3 LEU 669 HB1 LEU 669 -7.664 14.677 -2.680 901 HG LEU 669 HG LEU 669 -5.780 15.187 -0.380 902 HD11 LEU 669 HD11 LEU 669 -4.390 16.260 -2.086 903 HD12 LEU 669 HD12 LEU 669 -5.520 15.722 -3.329 904 HD13 LEU 669 HD13 LEU 669 -4.617 14.537 -2.380 905 HD21 LEU 669 HD21 LEU 669 -6.050 17.579 -1.008 906 HD22 LEU 669 HD22 LEU 669 -7.485 16.852 -0.289 907 HD23 LEU 669 HD23 LEU 669 -7.405 17.108 -2.035 908 H PHE 670 HN PHE 670 -8.197 12.026 0.200 909 HA PHE 670 HA PHE 670 -10.223 10.861 -1.580 910 HB2 PHE 670 HB2 PHE 670 -8.125 9.357 -0.027 911 HB3 PHE 670 HB1 PHE 670 -9.052 8.793 -1.409 912 HD1 PHE 670 HD1 PHE 670 -8.776 10.774 -3.427 913 HD2 PHE 670 HD2 PHE 670 -5.922 9.531 -0.536 914 HE1 PHE 670 HE1 PHE 670 -6.957 11.516 -4.908 915 HE2 PHE 670 HE2 PHE 670 -4.098 10.270 -2.004 916 HZ PHE 670 HZ PHE 670 -4.614 11.264 -4.195 917 H ASP 671 HN ASP 671 -9.794 11.894 1.510 918 HA ASP 671 HA ASP 671 -10.855 11.653 3.477 919 HB2 ASP 671 HB2 ASP 671 -12.857 10.407 1.636 920 HB3 ASP 671 HB1 ASP 671 -13.115 10.363 3.376 921 H LEU 672 HN LEU 672 -9.063 9.485 2.268 922 HA LEU 672 HA LEU 672 -9.934 7.195 3.857 923 HB2 LEU 672 HB2 LEU 672 -9.358 6.749 1.534 924 HB3 LEU 672 HB1 LEU 672 -7.769 7.457 1.764 925 HG LEU 672 HG LEU 672 -7.273 5.653 3.423 926 HD11 LEU 672 HD11 LEU 672 -8.704 3.741 3.583 927 HD12 LEU 672 HD12 LEU 672 -9.808 4.408 2.380 928 HD13 LEU 672 HD13 LEU 672 -9.650 5.183 3.957 929 HD21 LEU 672 HD21 LEU 672 -6.877 3.920 1.789 930 HD22 LEU 672 HD22 LEU 672 -6.548 5.497 1.070 931 HD23 LEU 672 HD23 LEU 672 -8.046 4.645 0.684 932 HA PRO 673 HA PRO 673 -6.964 8.661 6.873 933 HB2 PRO 673 HB2 PRO 673 -7.634 6.912 8.832 934 HB3 PRO 673 HB1 PRO 673 -8.580 8.358 8.467 935 HG2 PRO 673 HG2 PRO 673 -9.098 5.520 7.745 936 HG3 PRO 673 HG1 PRO 673 -10.245 6.796 8.178 937 HD2 PRO 673 HD2 PRO 673 -9.725 5.950 5.611 938 HD3 PRO 673 HD1 PRO 673 -10.406 7.528 6.024 939 H CYS 674 HN CYS 674 -4.949 8.044 7.405 940 HA CYS 674 HA CYS 674 -4.081 5.298 6.896 941 HB2 CYS 674 HB2 CYS 674 -2.122 6.855 5.648 942 HB3 CYS 674 HB1 CYS 674 -3.336 5.850 4.848 943 HG CYS 674 HG CYS 674 -5.182 7.926 4.534 944 H SER 675 HN SER 675 -2.071 4.791 7.812 945 HA SER 675 HA SER 675 -1.208 6.529 9.968 946 HB2 SER 675 HB2 SER 675 -0.008 3.880 9.140 947 HB3 SER 675 HB1 SER 675 0.063 4.650 10.726 948 HG SER 675 HG SER 675 -2.192 3.485 9.445 949 H LYS 676 HN LYS 676 1.022 7.267 10.133 950 HA LYS 676 HA LYS 676 2.005 8.150 7.598 951 HB2 LYS 676 HB2 LYS 676 2.182 9.606 9.535 952 HB3 LYS 676 HB1 LYS 676 3.182 8.425 10.367 953 HG2 LYS 676 HG2 LYS 676 4.447 10.331 9.413 954 HG3 LYS 676 HG1 LYS 676 4.973 8.756 8.818 955 HD2 LYS 676 HD2 LYS 676 3.718 9.083 6.764 956 HD3 LYS 676 HD1 LYS 676 3.101 10.623 7.362 957 HE2 LYS 676 HE2 LYS 676 4.963 10.920 5.784 958 HE3 LYS 676 HE1 LYS 676 5.344 11.547 7.386 959 HZ1 LYS 676 HZ1 LYS 676 6.201 8.886 6.372 960 HZ2 LYS 676 HZ2 LYS 676 6.649 9.601 7.840 961 HZ3 LYS 676 HZ3 LYS 676 7.169 10.273 6.379 962 H LEU 677 HN LEU 677 2.949 6.758 6.284 963 HA LEU 677 HA LEU 677 4.460 4.505 7.120 964 HB2 LEU 677 HB2 LEU 677 3.412 4.573 4.931 965 HB3 LEU 677 HB1 LEU 677 4.429 5.933 4.470 966 HG LEU 677 HG LEU 677 6.417 4.383 4.902 967 HD11 LEU 677 HD11 LEU 677 4.223 2.329 4.749 968 HD12 LEU 677 HD12 LEU 677 5.251 2.663 6.144 969 HD13 LEU 677 HD13 LEU 677 5.952 1.993 4.670 970 HD21 LEU 677 HD21 LEU 677 6.231 3.376 2.696 971 HD22 LEU 677 HD22 LEU 677 5.732 5.066 2.698 972 HD23 LEU 677 HD23 LEU 677 4.519 3.788 2.659 973 H SER 678 HN SER 678 6.572 4.281 7.538 974 HA SER 678 HA SER 678 8.425 6.450 6.973 975 HB2 SER 678 HB2 SER 678 7.861 5.550 9.809 976 HB3 SER 678 HB1 SER 678 9.100 6.700 9.317 977 HG SER 678 HG SER 678 6.303 6.994 9.363 978 H VAL 679 HN VAL 679 10.633 5.817 8.147 979 HA VAL 679 HA VAL 679 11.526 3.463 6.925 980 HB VAL 679 HB VAL 679 12.827 5.014 9.172 981 HG11 VAL 679 HG11 VAL 679 13.801 2.804 8.947 982 HG12 VAL 679 HG12 VAL 679 14.922 4.026 8.346 983 HG13 VAL 679 HG13 VAL 679 13.995 3.045 7.211 984 HG21 VAL 679 HG21 VAL 679 13.184 5.240 6.184 985 HG22 VAL 679 HG22 VAL 679 14.085 6.139 7.405 986 HG23 VAL 679 HG23 VAL 679 12.351 6.403 7.214 987 H GLY 680 HN GLY 680 11.775 1.418 7.617 988 HA2 GLY 680 HA2 GLY 680 11.927 -0.267 9.324 989 HA3 GLY 680 HA1 GLY 680 11.011 0.784 10.390 990 H ASP 681 HN ASP 681 9.302 1.264 7.800 991 HA ASP 681 HA ASP 681 7.433 -0.853 8.528 992 HB2 ASP 681 HB2 ASP 681 7.061 1.610 6.835 993 HB3 ASP 681 HB1 ASP 681 5.820 0.420 7.112 994 H VAL 682 HN VAL 682 7.988 -2.683 7.495 995 HA VAL 682 HA VAL 682 8.900 -2.712 4.840 996 HB VAL 682 HB VAL 682 9.695 -4.591 5.720 997 HG11 VAL 682 HG11 VAL 682 8.894 -4.164 7.915 998 HG12 VAL 682 HG12 VAL 682 8.715 -5.876 7.534 999 HG13 VAL 682 HG13 VAL 682 7.313 -4.810 7.494 1000 HG21 VAL 682 HG21 VAL 682 6.972 -5.645 5.046 1001 HG22 VAL 682 HG22 VAL 682 8.425 -6.623 5.261 1002 HG23 VAL 682 HG23 VAL 682 8.327 -5.467 3.933 1003 H CYS 683 HN CYS 683 7.812 -2.296 3.131 1004 HA CYS 683 HA CYS 683 4.985 -2.059 3.132 1005 HB2 CYS 683 HB2 CYS 683 6.353 -0.597 1.749 1006 HB3 CYS 683 HB1 CYS 683 6.971 -1.972 0.855 1007 HG CYS 683 HG CYS 683 4.178 -2.557 0.040 1008 H ILE 684 HN ILE 684 3.460 -3.257 2.183 1009 HA ILE 684 HA ILE 684 4.048 -5.985 1.501 1010 HB ILE 684 HB ILE 684 1.527 -4.329 1.476 1011 HG12 ILE 684 HG12 ILE 684 2.270 -6.787 3.048 1012 HG13 ILE 684 HG11 ILE 684 2.422 -5.140 3.651 1013 HG21 ILE 684 HG21 ILE 684 1.853 -7.174 0.550 1014 HG22 ILE 684 HG22 ILE 684 1.277 -5.800 -0.391 1015 HG23 ILE 684 HG23 ILE 684 0.303 -6.431 0.940 1016 HD11 ILE 684 HD11 ILE 684 0.018 -4.840 3.440 1017 HD12 ILE 684 HD12 ILE 684 0.398 -6.222 4.465 1018 HD13 ILE 684 HD13 ILE 684 -0.142 -6.477 2.804 1019 H SER 685 HN SER 685 5.154 -6.154 -0.489 1020 HA SER 685 HA SER 685 3.985 -4.743 -2.758 1021 HB2 SER 685 HB2 SER 685 6.480 -5.109 -2.628 1022 HB3 SER 685 HB1 SER 685 6.180 -6.831 -2.810 1023 HG SER 685 HG SER 685 6.105 -4.820 -4.682 1024 H LEU 686 HN LEU 686 2.224 -5.564 -3.654 1025 HA LEU 686 HA LEU 686 1.746 -8.439 -3.357 1026 HB2 LEU 686 HB2 LEU 686 0.137 -6.369 -2.736 1027 HB3 LEU 686 HB1 LEU 686 -0.350 -6.629 -4.398 1028 HG LEU 686 HG LEU 686 -1.832 -7.806 -2.953 1029 HD11 LEU 686 HD11 LEU 686 -1.280 -8.892 -5.058 1030 HD12 LEU 686 HD12 LEU 686 -1.633 -10.066 -3.792 1031 HD13 LEU 686 HD13 LEU 686 0.037 -9.758 -4.266 1032 HD21 LEU 686 HD21 LEU 686 -0.392 -8.001 -1.013 1033 HD22 LEU 686 HD22 LEU 686 0.586 -9.205 -1.853 1034 HD23 LEU 686 HD23 LEU 686 -1.092 -9.561 -1.444 1035 H THR 687 HN THR 687 2.176 -9.633 -5.093 1036 HA THR 687 HA THR 687 2.235 -8.299 -7.698 1037 HB THR 687 HB THR 687 4.273 -9.527 -7.001 1038 HG1 THR 687 HG1 THR 687 4.607 -10.367 -8.992 1039 HG21 THR 687 HG21 THR 687 2.539 -11.983 -7.214 1040 HG22 THR 687 HG22 THR 687 3.222 -11.322 -5.728 1041 HG23 THR 687 HG23 THR 687 4.287 -11.965 -6.978 1042 H LEU 688 HN LEU 688 0.774 -8.727 -9.219 1043 HA LEU 688 HA LEU 688 -1.278 -10.721 -8.548 1044 HB2 LEU 688 HB2 LEU 688 -1.600 -8.261 -10.264 1045 HB3 LEU 688 HB1 LEU 688 -2.871 -9.342 -9.734 1046 HG LEU 688 HG LEU 688 -1.247 -7.529 -7.944 1047 HD11 LEU 688 HD11 LEU 688 -2.819 -6.323 -9.362 1048 HD12 LEU 688 HD12 LEU 688 -3.319 -6.296 -7.668 1049 HD13 LEU 688 HD13 LEU 688 -4.124 -7.374 -8.812 1050 HD21 LEU 688 HD21 LEU 688 -3.573 -9.334 -7.315 1051 HD22 LEU 688 HD22 LEU 688 -2.850 -8.166 -6.209 1052 HD23 LEU 688 HD23 LEU 688 -1.907 -9.546 -6.776 1053 H LYS 689 HN LYS 689 -0.614 -12.487 -9.645 1054 HA LYS 689 HA LYS 689 0.398 -12.409 -12.286 1055 HB2 LYS 689 HB2 LYS 689 -0.625 -14.617 -10.553 1056 HB3 LYS 689 HB1 LYS 689 -0.058 -14.900 -12.188 1057 HG2 LYS 689 HG2 LYS 689 1.605 -13.584 -10.064 1058 HG3 LYS 689 HG1 LYS 689 1.618 -15.320 -10.369 1059 HD2 LYS 689 HD2 LYS 689 2.132 -13.364 -12.583 1060 HD3 LYS 689 HD1 LYS 689 3.423 -13.829 -11.478 1061 HE2 LYS 689 HE2 LYS 689 3.510 -15.207 -13.458 1062 HE3 LYS 689 HE1 LYS 689 3.049 -16.191 -12.074 1063 HZ1 LYS 689 HZ1 LYS 689 0.794 -16.192 -12.802 1064 HZ2 LYS 689 HZ2 LYS 689 1.754 -16.642 -14.115 1065 HZ3 LYS 689 HZ3 LYS 689 1.119 -15.079 -14.033 Start of MODEL 5 1 H1 VAL 34 HT1 VAL 34 -18.586 -4.844 -5.721 2 H2 VAL 34 HT2 VAL 34 -18.618 -3.245 -5.173 3 H3 VAL 34 HT3 VAL 34 -19.209 -4.489 -4.190 4 HA VAL 34 HA VAL 34 -17.037 -3.736 -3.455 5 HB VAL 34 HB VAL 34 -15.831 -5.938 -3.573 6 HG11 VAL 34 HG11 VAL 34 -17.216 -5.571 -1.719 7 HG12 VAL 34 HG12 VAL 34 -17.598 -7.183 -2.322 8 HG13 VAL 34 HG13 VAL 34 -18.682 -5.835 -2.665 9 HG21 VAL 34 HG21 VAL 34 -18.267 -6.763 -5.143 10 HG22 VAL 34 HG22 VAL 34 -17.037 -7.854 -4.508 11 HG23 VAL 34 HG23 VAL 34 -16.614 -6.678 -5.752 12 H PHE 35 HN PHE 35 -14.790 -3.647 -3.817 13 HA PHE 35 HA PHE 35 -13.982 -3.770 -6.641 14 HB2 PHE 35 HB2 PHE 35 -13.332 -1.773 -4.502 15 HB3 PHE 35 HB1 PHE 35 -12.148 -2.091 -5.767 16 HD1 PHE 35 HD2 PHE 35 -15.845 -1.651 -5.621 17 HD2 PHE 35 HD1 PHE 35 -12.171 -0.533 -7.449 18 HE1 PHE 35 HE2 PHE 35 -17.067 -0.172 -7.150 19 HE2 PHE 35 HE1 PHE 35 -13.389 0.938 -8.997 20 HZ PHE 35 HZ PHE 35 -15.839 1.121 -8.850 21 HA PRO 36 HA PRO 36 -11.279 -7.112 -5.541 22 HB2 PRO 36 HB2 PRO 36 -9.542 -5.721 -7.537 23 HB3 PRO 36 HB1 PRO 36 -9.962 -7.432 -7.416 24 HG2 PRO 36 HG2 PRO 36 -11.129 -5.873 -9.231 25 HG3 PRO 36 HG1 PRO 36 -12.048 -7.128 -8.377 26 HD2 PRO 36 HD2 PRO 36 -12.093 -4.174 -8.026 27 HD3 PRO 36 HD1 PRO 36 -13.391 -5.361 -7.794 28 H TRP 37 HN TRP 37 -9.879 -7.259 -3.935 29 HA TRP 37 HA TRP 37 -9.400 -5.166 -2.313 30 HB2 TRP 37 HB2 TRP 37 -7.627 -6.624 -1.213 31 HB3 TRP 37 HB1 TRP 37 -9.251 -7.276 -1.363 32 HD1 TRP 37 HD1 TRP 37 -9.578 -9.084 -3.470 33 HE1 TRP 37 HE1 TRP 37 -7.935 -10.878 -4.307 34 HE3 TRP 37 HE3 TRP 37 -5.269 -7.224 -1.458 35 HZ2 TRP 37 HZ2 TRP 37 -5.185 -11.440 -4.113 36 HZ3 TRP 37 HZ3 TRP 37 -3.176 -8.460 -1.819 37 HH2 TRP 37 HH2 TRP 37 -3.138 -10.527 -3.122 38 H HIS 38 HN HIS 38 -7.159 -6.258 -4.850 39 HA HIS 38 HA HIS 38 -5.067 -4.517 -4.059 40 HB2 HIS 38 HB2 HIS 38 -4.151 -4.954 -6.333 41 HB3 HIS 38 HB1 HIS 38 -4.541 -6.412 -5.431 42 HD1 HIS 38 HD1 HIS 38 -5.537 -4.458 -8.463 43 HD2 HIS 38 HD2 HIS 38 -6.624 -7.954 -6.492 44 HE1 HIS 38 HE1 HIS 38 -6.987 -5.729 -10.080 45 HE2 HIS 38 HE2 HIS 38 -7.707 -7.796 -8.832 46 H SER 39 HN SER 39 -6.905 -2.806 -3.755 47 HA SER 39 HA SER 39 -7.001 -1.108 -6.163 48 HB2 SER 39 HB2 SER 39 -9.222 -1.793 -5.576 49 HB3 SER 39 HB1 SER 39 -8.949 -1.451 -3.867 50 HG SER 39 HG SER 39 -9.955 0.330 -4.462 51 H LEU 40 HN LEU 40 -5.916 -1.474 -2.989 52 HA LEU 40 HA LEU 40 -5.191 1.374 -2.747 53 HB2 LEU 40 HB2 LEU 40 -5.394 0.610 -0.162 54 HB3 LEU 40 HB1 LEU 40 -6.681 1.394 -1.058 55 HG LEU 40 HG LEU 40 -6.545 -1.595 -1.095 56 HD11 LEU 40 HD11 LEU 40 -7.534 0.095 1.185 57 HD12 LEU 40 HD12 LEU 40 -6.352 -1.214 1.240 58 HD13 LEU 40 HD13 LEU 40 -8.052 -1.568 0.910 59 HD21 LEU 40 HD21 LEU 40 -8.928 -1.400 -1.318 60 HD22 LEU 40 HD22 LEU 40 -8.157 -0.324 -2.484 61 HD23 LEU 40 HD23 LEU 40 -8.857 0.333 -1.006 62 H VAL 41 HN VAL 41 -4.052 -1.666 -3.157 63 HA VAL 41 HA VAL 41 -1.618 -1.117 -1.641 64 HB VAL 41 HB VAL 41 -2.713 -3.043 -0.690 65 HG11 VAL 41 HG11 VAL 41 -2.683 -4.244 -3.463 66 HG12 VAL 41 HG12 VAL 41 -4.110 -3.691 -2.585 67 HG13 VAL 41 HG13 VAL 41 -3.184 -5.066 -1.985 68 HG21 VAL 41 HG21 VAL 41 -0.329 -3.129 -0.760 69 HG22 VAL 41 HG22 VAL 41 -0.363 -3.758 -2.405 70 HG23 VAL 41 HG23 VAL 41 -0.961 -4.746 -1.073 71 HA PRO 42 HA PRO 42 0.031 -1.360 -5.825 72 HB2 PRO 42 HB2 PRO 42 1.973 0.436 -5.496 73 HB3 PRO 42 HB1 PRO 42 0.283 0.945 -5.605 74 HG2 PRO 42 HG2 PRO 42 2.055 0.758 -3.224 75 HG3 PRO 42 HG1 PRO 42 0.743 1.897 -3.563 76 HD2 PRO 42 HD2 PRO 42 0.605 -0.438 -1.966 77 HD3 PRO 42 HD1 PRO 42 -0.752 0.580 -2.486 78 H PHE 43 HN PHE 43 2.595 -1.327 -6.393 79 HA PHE 43 HA PHE 43 3.907 -3.199 -4.549 80 HB2 PHE 43 HB2 PHE 43 5.153 -4.034 -6.591 81 HB3 PHE 43 HB1 PHE 43 3.443 -4.439 -6.532 82 HD1 PHE 43 HD2 PHE 43 6.008 -2.435 -8.209 83 HD2 PHE 43 HD1 PHE 43 1.888 -3.502 -8.115 84 HE1 PHE 43 HE2 PHE 43 5.710 -1.469 -10.454 85 HE2 PHE 43 HE1 PHE 43 1.585 -2.543 -10.362 86 HZ PHE 43 HZ PHE 43 3.498 -1.522 -11.532 87 H LEU 44 HN LEU 44 6.161 -2.926 -4.226 88 HA LEU 44 HA LEU 44 6.865 -0.120 -4.332 89 HB2 LEU 44 HB2 LEU 44 8.491 -0.552 -2.696 90 HB3 LEU 44 HB1 LEU 44 7.123 -1.542 -2.258 91 HG LEU 44 HG LEU 44 8.811 -2.991 -1.802 92 HD11 LEU 44 HD11 LEU 44 9.279 -4.569 -3.667 93 HD12 LEU 44 HD12 LEU 44 8.363 -3.488 -4.719 94 HD13 LEU 44 HD13 LEU 44 7.575 -4.260 -3.343 95 HD21 LEU 44 HD21 LEU 44 10.424 -1.789 -4.035 96 HD22 LEU 44 HD22 LEU 44 10.958 -3.132 -3.019 97 HD23 LEU 44 HD23 LEU 44 10.642 -1.551 -2.300 98 H ALA 45 HN ALA 45 6.789 -1.449 -6.810 99 HA ALA 45 HA ALA 45 7.906 -1.679 -8.767 100 HB1 ALA 45 HB1 ALA 45 10.390 -0.808 -7.290 101 HB2 ALA 45 HB2 ALA 45 9.257 0.276 -8.097 102 HB3 ALA 45 HB3 ALA 45 10.179 -0.897 -9.040 103 HA PRO 46 HA PRO 46 9.337 -5.865 -8.799 104 HB2 PRO 46 HB2 PRO 46 11.596 -4.888 -10.497 105 HB3 PRO 46 HB1 PRO 46 10.516 -6.265 -10.748 106 HG2 PRO 46 HG2 PRO 46 10.150 -4.028 -12.118 107 HG3 PRO 46 HG1 PRO 46 8.762 -4.925 -11.477 108 HD2 PRO 46 HD2 PRO 46 9.995 -2.392 -10.501 109 HD3 PRO 46 HD1 PRO 46 8.294 -2.894 -10.497 110 H SER 47 HN SER 47 10.190 -6.593 -6.972 111 HA SER 47 HA SER 47 12.324 -5.398 -5.571 112 HB2 SER 47 HB2 SER 47 11.288 -8.230 -5.296 113 HB3 SER 47 HB1 SER 47 12.133 -7.285 -4.071 114 HG SER 47 HG SER 47 10.165 -6.787 -3.485 115 H GLN 48 HN GLN 48 14.319 -5.314 -6.424 116 HA GLN 48 HA GLN 48 15.568 -7.776 -7.293 117 HB2 GLN 48 HB2 GLN 48 16.483 -6.580 -9.328 118 HB3 GLN 48 HB1 GLN 48 14.775 -6.989 -9.378 119 HG2 GLN 48 HG2 GLN 48 14.311 -4.633 -8.614 120 HG3 GLN 48 HG1 GLN 48 16.015 -4.294 -8.909 121 HE21 GLN 48 HE21 GLN 48 13.624 -3.197 -10.165 122 HE22 GLN 48 HE22 GLN 48 13.794 -3.497 -11.859 123 H ALA 567 HT1 ALA 567 -28.368 14.861 0.052 124 HA ALA 567 HA ALA 567 -27.631 12.890 -1.036 125 HB1 ALA 567 HB1 ALA 567 -27.905 13.697 -3.337 126 HB2 ALA 567 HB2 ALA 567 -26.315 12.984 -3.072 127 HB3 ALA 567 HB3 ALA 567 -26.496 14.738 -3.133 128 HA PRO 568 HA PRO 568 -24.085 13.779 1.442 129 HB2 PRO 568 HB2 PRO 568 -23.082 11.288 1.616 130 HB3 PRO 568 HB1 PRO 568 -24.584 11.746 2.428 131 HG2 PRO 568 HG2 PRO 568 -24.195 10.252 -0.133 132 HG3 PRO 568 HG1 PRO 568 -25.351 9.950 1.175 133 HD2 PRO 568 HD2 PRO 568 -25.976 11.253 -1.156 134 HD3 PRO 568 HD1 PRO 568 -26.840 11.496 0.372 135 HA PRO 569 HA PRO 569 -20.725 14.346 -1.400 136 HB2 PRO 569 HB2 PRO 569 -18.647 14.402 0.383 137 HB3 PRO 569 HB1 PRO 569 -19.738 15.761 0.097 138 HG2 PRO 569 HG2 PRO 569 -19.755 13.747 2.303 139 HG3 PRO 569 HG1 PRO 569 -20.073 15.489 2.372 140 HD2 PRO 569 HD2 PRO 569 -22.051 13.643 2.406 141 HD3 PRO 569 HD1 PRO 569 -22.252 15.246 1.671 142 H THR 570 HN THR 570 -21.053 12.219 -2.295 143 HA THR 570 HA THR 570 -19.720 9.944 -1.193 144 HB THR 570 HB THR 570 -20.343 8.992 -3.532 145 HG1 THR 570 HG1 THR 570 -20.755 11.334 -4.215 146 HG21 THR 570 HG21 THR 570 -22.468 9.926 -1.597 147 HG22 THR 570 HG22 THR 570 -21.536 8.433 -1.478 148 HG23 THR 570 HG23 THR 570 -22.671 8.660 -2.808 149 H LEU 571 HN LEU 571 -17.824 9.056 -1.746 150 HA LEU 571 HA LEU 571 -16.070 10.559 -3.533 151 HB2 LEU 571 HB2 LEU 571 -15.532 8.422 -1.480 152 HB3 LEU 571 HB1 LEU 571 -14.310 9.155 -2.473 153 HG LEU 571 HG LEU 571 -16.009 10.878 -0.731 154 HD11 LEU 571 HD11 LEU 571 -15.187 9.042 0.695 155 HD12 LEU 571 HD12 LEU 571 -14.433 10.585 1.087 156 HD13 LEU 571 HD13 LEU 571 -13.543 9.380 0.155 157 HD21 LEU 571 HD21 LEU 571 -13.177 10.976 -1.727 158 HD22 LEU 571 HD22 LEU 571 -13.953 12.213 -0.736 159 HD23 LEU 571 HD23 LEU 571 -14.536 11.889 -2.369 160 HA PRO 572 HA PRO 572 -15.856 7.448 -6.770 161 HB2 PRO 572 HB2 PRO 572 -12.964 7.238 -6.018 162 HB3 PRO 572 HB1 PRO 572 -13.701 7.389 -7.618 163 HG2 PRO 572 HG2 PRO 572 -12.580 9.500 -6.466 164 HG3 PRO 572 HG1 PRO 572 -14.097 9.666 -7.371 165 HD2 PRO 572 HD2 PRO 572 -13.634 9.676 -4.429 166 HD3 PRO 572 HD1 PRO 572 -14.842 10.555 -5.384 167 HA PRO 573 HA PRO 573 -16.414 3.799 -4.563 168 HB2 PRO 573 HB2 PRO 573 -16.615 2.000 -6.507 169 HB3 PRO 573 HB1 PRO 573 -17.746 3.356 -6.386 170 HG2 PRO 573 HG2 PRO 573 -15.338 3.053 -8.143 171 HG3 PRO 573 HG1 PRO 573 -16.950 3.640 -8.549 172 HD2 PRO 573 HD2 PRO 573 -14.839 5.280 -8.018 173 HD3 PRO 573 HD1 PRO 573 -16.533 5.737 -7.761 174 H TYR 574 HN TYR 574 -13.429 4.124 -6.137 175 HA TYR 574 HA TYR 574 -12.456 1.498 -5.919 176 HB2 TYR 574 HB2 TYR 574 -11.264 4.105 -6.513 177 HB3 TYR 574 HB1 TYR 574 -10.165 2.919 -5.819 178 HD1 TYR 574 HD1 TYR 574 -9.694 0.831 -6.962 179 HD2 TYR 574 HD2 TYR 574 -12.147 3.806 -8.739 180 HE1 TYR 574 HE1 TYR 574 -9.423 -0.270 -9.132 181 HE2 TYR 574 HE2 TYR 574 -11.888 2.721 -10.931 182 HH TYR 574 HH TYR 574 -10.259 1.227 -12.055 183 H PHE 575 HN PHE 575 -10.491 3.795 -4.204 184 HA PHE 575 HA PHE 575 -10.639 1.995 -1.868 185 HB2 PHE 575 HB2 PHE 575 -8.339 2.450 -1.431 186 HB3 PHE 575 HB1 PHE 575 -8.449 2.107 -3.156 187 HD1 PHE 575 HD2 PHE 575 -8.477 4.068 -4.765 188 HD2 PHE 575 HD1 PHE 575 -7.473 4.453 -0.649 189 HE1 PHE 575 HE2 PHE 575 -7.411 6.236 -5.228 190 HE2 PHE 575 HE1 PHE 575 -6.412 6.618 -1.104 191 HZ PHE 575 HZ PHE 575 -6.393 7.515 -3.386 192 H MET 576 HN MET 576 -11.805 4.783 -2.850 193 HA MET 576 HA MET 576 -10.983 6.692 -0.936 194 HB2 MET 576 HB2 MET 576 -13.711 6.595 -2.209 195 HB3 MET 576 HB1 MET 576 -12.824 8.009 -1.656 196 HG2 MET 576 HG2 MET 576 -12.070 6.260 -3.982 197 HG3 MET 576 HG1 MET 576 -12.848 7.834 -4.082 198 HE1 MET 576 HE1 MET 576 -9.174 8.372 -5.442 199 HE2 MET 576 HE2 MET 576 -10.888 8.482 -5.839 200 HE3 MET 576 HE3 MET 576 -10.140 6.904 -5.592 201 H LYS 577 HN LYS 577 -12.360 7.572 0.835 202 HA LYS 577 HA LYS 577 -12.771 5.598 2.745 203 HB2 LYS 577 HB2 LYS 577 -12.372 8.024 3.221 204 HB3 LYS 577 HB1 LYS 577 -14.047 8.336 2.784 205 HG2 LYS 577 HG2 LYS 577 -14.800 6.852 4.573 206 HG3 LYS 577 HG1 LYS 577 -13.124 6.534 5.014 207 HD2 LYS 577 HD2 LYS 577 -12.843 8.958 5.464 208 HD3 LYS 577 HD1 LYS 577 -14.568 9.174 5.155 209 HE2 LYS 577 HE2 LYS 577 -15.113 7.681 6.987 210 HE3 LYS 577 HE1 LYS 577 -13.402 7.357 7.261 211 HZ1 LYS 577 HZ1 LYS 577 -14.200 8.960 8.839 212 HZ2 LYS 577 HZ2 LYS 577 -14.773 9.964 7.604 213 HZ3 LYS 577 HZ3 LYS 577 -13.112 9.716 7.789 214 H GLY 578 HN GLY 578 -14.317 4.187 3.091 215 HA2 GLY 578 HA2 GLY 578 -16.602 3.692 3.576 216 HA3 GLY 578 HA1 GLY 578 -17.085 4.879 2.387 217 H SER 579 HN SER 579 -14.734 3.466 0.782 218 HA SER 579 HA SER 579 -16.496 1.925 -0.830 219 HB2 SER 579 HB2 SER 579 -13.475 1.948 -0.866 220 HB3 SER 579 HB1 SER 579 -14.543 1.436 -2.174 221 HG SER 579 HG SER 579 -13.865 3.987 -1.310 222 H ILE 580 HN ILE 580 -16.797 -0.248 -0.978 223 HA ILE 580 HA ILE 580 -15.845 -1.794 1.292 224 HB ILE 580 HB ILE 580 -17.939 -2.389 -0.795 225 HG12 ILE 580 HG12 ILE 580 -18.669 -0.785 0.860 226 HG13 ILE 580 HG11 ILE 580 -19.449 -2.327 1.197 227 HG21 ILE 580 HG21 ILE 580 -16.783 -4.450 -0.196 228 HG22 ILE 580 HG22 ILE 580 -18.429 -4.434 0.439 229 HG23 ILE 580 HG23 ILE 580 -17.066 -4.120 1.514 230 HD11 ILE 580 HD11 ILE 580 -17.095 -1.139 2.652 231 HD12 ILE 580 HD12 ILE 580 -17.753 -2.748 2.949 232 HD13 ILE 580 HD13 ILE 580 -18.741 -1.321 3.256 233 H ILE 581 HN ILE 581 -13.986 -2.690 1.087 234 HA ILE 581 HA ILE 581 -12.959 -3.435 -1.530 235 HB ILE 581 HB ILE 581 -11.558 -3.633 1.134 236 HG12 ILE 581 HG12 ILE 581 -12.301 -1.342 0.893 237 HG13 ILE 581 HG11 ILE 581 -10.572 -1.415 0.610 238 HG21 ILE 581 HG21 ILE 581 -10.544 -3.415 -1.687 239 HG22 ILE 581 HG22 ILE 581 -10.489 -4.843 -0.652 240 HG23 ILE 581 HG23 ILE 581 -9.538 -3.415 -0.240 241 HD11 ILE 581 HD11 ILE 581 -11.049 -1.398 -1.829 242 HD12 ILE 581 HD12 ILE 581 -11.513 0.068 -0.972 243 HD13 ILE 581 HD13 ILE 581 -12.747 -1.103 -1.438 244 H GLN 582 HN GLN 582 -12.918 -5.491 -2.234 245 HA GLN 582 HA GLN 582 -13.732 -7.564 -0.323 246 HB2 GLN 582 HB2 GLN 582 -15.247 -7.372 -2.147 247 HB3 GLN 582 HB1 GLN 582 -13.969 -7.463 -3.320 248 HG2 GLN 582 HG2 GLN 582 -13.472 -9.778 -2.406 249 HG3 GLN 582 HG1 GLN 582 -15.003 -9.647 -1.546 250 HE21 GLN 582 HE21 GLN 582 -15.950 -11.330 -2.658 251 HE22 GLN 582 HE22 GLN 582 -16.407 -11.207 -4.318 252 H LEU 583 HN LEU 583 -12.300 -8.901 0.359 253 HA LEU 583 HA LEU 583 -9.657 -8.978 -0.778 254 HB2 LEU 583 HB2 LEU 583 -10.781 -10.652 1.450 255 HB3 LEU 583 HB1 LEU 583 -9.091 -10.303 1.127 256 HG LEU 583 HG LEU 583 -11.151 -8.283 1.993 257 HD11 LEU 583 HD11 LEU 583 -10.075 -8.332 4.127 258 HD12 LEU 583 HD12 LEU 583 -8.846 -9.450 3.532 259 HD13 LEU 583 HD13 LEU 583 -10.515 -9.988 3.698 260 HD21 LEU 583 HD21 LEU 583 -9.419 -7.322 0.556 261 HD22 LEU 583 HD22 LEU 583 -8.168 -8.034 1.578 262 HD23 LEU 583 HD23 LEU 583 -9.226 -6.783 2.225 263 H ALA 584 HN ALA 584 -8.607 -11.311 -0.858 264 HA ALA 584 HA ALA 584 -9.968 -12.577 -3.012 265 HB1 ALA 584 HB1 ALA 584 -7.649 -13.740 -1.508 266 HB2 ALA 584 HB2 ALA 584 -7.482 -12.491 -2.738 267 HB3 ALA 584 HB3 ALA 584 -8.140 -14.069 -3.167 268 H ASN 585 HN ASN 585 -9.859 -13.095 0.407 269 HA ASN 585 HA ASN 585 -10.942 -15.755 0.310 270 HB2 ASN 585 HB2 ASN 585 -11.021 -15.619 2.722 271 HB3 ASN 585 HB1 ASN 585 -9.484 -14.985 2.166 272 HD21 ASN 585 HD21 ASN 585 -10.586 -14.509 4.680 273 HD22 ASN 585 HD22 ASN 585 -10.921 -12.815 4.820 274 H GLY 586 HN GLY 586 -12.195 -12.636 -0.026 275 HA2 GLY 586 HA2 GLY 586 -14.413 -12.496 -0.950 276 HA3 GLY 586 HA1 GLY 586 -14.900 -13.782 0.137 277 H GLU 587 HN GLU 587 -13.008 -11.799 1.973 278 HA GLU 587 HA GLU 587 -15.192 -10.811 3.436 279 HB2 GLU 587 HB2 GLU 587 -12.297 -10.127 3.505 280 HB3 GLU 587 HB1 GLU 587 -13.457 -9.386 4.590 281 HG2 GLU 587 HG2 GLU 587 -14.113 -11.744 5.209 282 HG3 GLU 587 HG1 GLU 587 -12.630 -12.243 4.391 283 H LEU 588 HN LEU 588 -16.035 -8.873 3.716 284 HA LEU 588 HA LEU 588 -15.480 -6.853 1.638 285 HB2 LEU 588 HB2 LEU 588 -18.173 -7.430 2.863 286 HB3 LEU 588 HB1 LEU 588 -17.824 -6.421 1.470 287 HG LEU 588 HG LEU 588 -17.515 -9.422 1.587 288 HD11 LEU 588 HD11 LEU 588 -19.402 -9.459 0.049 289 HD12 LEU 588 HD12 LEU 588 -19.542 -7.705 0.164 290 HD13 LEU 588 HD13 LEU 588 -19.842 -8.710 1.583 291 HD21 LEU 588 HD21 LEU 588 -15.879 -8.587 0.091 292 HD22 LEU 588 HD22 LEU 588 -16.997 -7.416 -0.593 293 HD23 LEU 588 HD23 LEU 588 -17.227 -9.136 -0.905 294 H LYS 589 HN LYS 589 -14.376 -5.345 2.778 295 HA LYS 589 HA LYS 589 -15.501 -4.454 5.343 296 HB2 LYS 589 HB2 LYS 589 -12.569 -4.987 4.804 297 HB3 LYS 589 HB1 LYS 589 -13.282 -4.478 6.325 298 HG2 LYS 589 HG2 LYS 589 -14.310 -6.554 6.674 299 HG3 LYS 589 HG1 LYS 589 -14.079 -7.042 4.999 300 HD2 LYS 589 HD2 LYS 589 -12.475 -8.273 6.142 301 HD3 LYS 589 HD1 LYS 589 -11.562 -6.896 5.529 302 HE2 LYS 589 HE2 LYS 589 -12.771 -6.795 8.257 303 HE3 LYS 589 HE1 LYS 589 -11.267 -7.673 7.994 304 HZ1 LYS 589 HZ1 LYS 589 -10.848 -5.417 8.695 305 HZ2 LYS 589 HZ2 LYS 589 -11.732 -4.803 7.394 306 HZ3 LYS 589 HZ3 LYS 589 -10.286 -5.653 7.116 307 H LYS 590 HN LYS 590 -14.958 -2.289 5.924 308 HA LYS 590 HA LYS 590 -14.760 -0.462 3.778 309 HB2 LYS 590 HB2 LYS 590 -14.431 -0.083 6.755 310 HB3 LYS 590 HB1 LYS 590 -14.366 1.239 5.606 311 HG2 LYS 590 HG2 LYS 590 -16.721 -0.566 5.633 312 HG3 LYS 590 HG1 LYS 590 -16.562 0.683 6.865 313 HD2 LYS 590 HD2 LYS 590 -16.159 2.272 4.888 314 HD3 LYS 590 HD1 LYS 590 -16.839 0.987 3.892 315 HE2 LYS 590 HE2 LYS 590 -18.157 2.356 6.225 316 HE3 LYS 590 HE1 LYS 590 -18.571 2.555 4.523 317 HZ1 LYS 590 HZ1 LYS 590 -18.852 0.060 6.114 318 HZ2 LYS 590 HZ2 LYS 590 -19.213 0.212 4.468 319 HZ3 LYS 590 HZ3 LYS 590 -20.112 1.069 5.610 320 H VAL 591 HN VAL 591 -13.060 0.909 3.185 321 HA VAL 591 HA VAL 591 -10.652 -0.313 2.725 322 HB VAL 591 HB VAL 591 -10.813 2.666 3.069 323 HG11 VAL 591 HG11 VAL 591 -8.634 1.714 2.538 324 HG12 VAL 591 HG12 VAL 591 -9.252 2.688 1.201 325 HG13 VAL 591 HG13 VAL 591 -9.323 0.930 1.114 326 HG21 VAL 591 HG21 VAL 591 -11.662 2.843 0.797 327 HG22 VAL 591 HG22 VAL 591 -12.810 2.036 1.865 328 HG23 VAL 591 HG23 VAL 591 -11.849 1.090 0.729 329 H GLU 592 HN GLU 592 -11.381 1.988 5.315 330 HA GLU 592 HA GLU 592 -8.683 2.167 6.204 331 HB2 GLU 592 HB2 GLU 592 -9.608 3.524 8.012 332 HB3 GLU 592 HB1 GLU 592 -10.284 3.996 6.457 333 HG2 GLU 592 HG2 GLU 592 -12.285 2.620 6.976 334 HG3 GLU 592 HG1 GLU 592 -11.616 2.334 8.580 335 H ASP 593 HN ASP 593 -11.173 -0.060 6.770 336 HA ASP 593 HA ASP 593 -10.272 -0.736 9.455 337 HB2 ASP 593 HB2 ASP 593 -12.629 -0.634 9.316 338 HB3 ASP 593 HB1 ASP 593 -12.664 -1.460 7.767 339 H LEU 594 HN LEU 594 -9.654 -1.630 6.304 340 HA LEU 594 HA LEU 594 -9.211 -4.386 6.519 341 HB2 LEU 594 HB2 LEU 594 -7.808 -2.336 4.810 342 HB3 LEU 594 HB1 LEU 594 -7.731 -4.072 4.577 343 HG LEU 594 HG LEU 594 -10.351 -2.597 4.493 344 HD11 LEU 594 HD11 LEU 594 -10.110 -2.517 2.076 345 HD12 LEU 594 HD12 LEU 594 -8.464 -3.129 2.214 346 HD13 LEU 594 HD13 LEU 594 -8.878 -1.547 2.880 347 HD21 LEU 594 HD21 LEU 594 -10.459 -5.022 4.712 348 HD22 LEU 594 HD22 LEU 594 -9.397 -5.202 3.318 349 HD23 LEU 594 HD23 LEU 594 -11.009 -4.516 3.111 350 H LYS 595 HN LYS 595 -7.708 -5.506 7.492 351 HA LYS 595 HA LYS 595 -5.404 -4.103 8.666 352 HB2 LYS 595 HB2 LYS 595 -6.629 -6.783 9.343 353 HB3 LYS 595 HB1 LYS 595 -5.193 -6.122 10.109 354 HG2 LYS 595 HG2 LYS 595 -7.915 -4.840 10.172 355 HG3 LYS 595 HG1 LYS 595 -7.235 -5.840 11.457 356 HD2 LYS 595 HD2 LYS 595 -5.411 -4.254 11.748 357 HD3 LYS 595 HD1 LYS 595 -6.036 -3.271 10.423 358 HE2 LYS 595 HE2 LYS 595 -7.513 -3.872 12.982 359 HE3 LYS 595 HE1 LYS 595 -6.633 -2.382 12.648 360 HZ1 LYS 595 HZ1 LYS 595 -8.121 -1.960 10.797 361 HZ2 LYS 595 HZ2 LYS 595 -8.995 -2.128 12.232 362 HZ3 LYS 595 HZ3 LYS 595 -8.965 -3.393 11.110 363 H THR 596 HN THR 596 -3.368 -5.552 8.776 364 HA THR 596 HA THR 596 -2.560 -5.951 6.133 365 HB THR 596 HB THR 596 -1.032 -5.485 8.087 366 HG1 THR 596 HG1 THR 596 0.072 -7.722 6.865 367 HG21 THR 596 HG21 THR 596 -0.091 -7.466 9.236 368 HG22 THR 596 HG22 THR 596 -1.354 -8.451 8.509 369 HG23 THR 596 HG23 THR 596 -1.780 -7.172 9.650 370 H GLU 597 HN GLU 597 -3.591 -8.307 8.580 371 HA GLU 597 HA GLU 597 -2.821 -10.576 7.130 372 HB2 GLU 597 HB2 GLU 597 -4.840 -10.267 9.328 373 HB3 GLU 597 HB1 GLU 597 -4.328 -11.819 8.685 374 HG2 GLU 597 HG2 GLU 597 -2.002 -11.254 9.322 375 HG3 GLU 597 HG1 GLU 597 -2.610 -9.781 10.078 376 H ASP 598 HN ASP 598 -5.672 -8.634 7.056 377 HA ASP 598 HA ASP 598 -7.462 -10.202 5.659 378 HB2 ASP 598 HB2 ASP 598 -6.824 -7.263 5.266 379 HB3 ASP 598 HB1 ASP 598 -8.240 -8.058 4.617 380 H PHE 599 HN PHE 599 -4.899 -8.132 4.415 381 HA PHE 599 HA PHE 599 -5.170 -9.041 1.724 382 HB2 PHE 599 HB2 PHE 599 -3.207 -7.260 3.134 383 HB3 PHE 599 HB1 PHE 599 -2.941 -7.766 1.467 384 HD1 PHE 599 HD2 PHE 599 -5.833 -6.521 3.488 385 HD2 PHE 599 HD1 PHE 599 -3.567 -6.223 -0.100 386 HE1 PHE 599 HE2 PHE 599 -7.335 -4.749 2.691 387 HE2 PHE 599 HE1 PHE 599 -5.071 -4.449 -0.902 388 HZ PHE 599 HZ PHE 599 -6.956 -3.709 0.492 389 H ILE 600 HN ILE 600 -2.986 -9.819 4.425 390 HA ILE 600 HA ILE 600 -1.096 -11.361 3.222 391 HB ILE 600 HB ILE 600 -2.553 -11.766 5.799 392 HG12 ILE 600 HG12 ILE 600 -1.034 -10.424 6.703 393 HG13 ILE 600 HG11 ILE 600 0.275 -11.247 5.932 394 HG21 ILE 600 HG21 ILE 600 -0.179 -13.314 4.790 395 HG22 ILE 600 HG22 ILE 600 -1.791 -13.946 5.127 396 HG23 ILE 600 HG23 ILE 600 -0.784 -13.351 6.446 397 HD11 ILE 600 HD11 ILE 600 -1.351 -9.053 4.739 398 HD12 ILE 600 HD12 ILE 600 0.043 -9.839 3.991 399 HD13 ILE 600 HD13 ILE 600 0.250 -8.873 5.457 400 H GLN 601 HN GLN 601 -4.177 -12.560 4.525 401 HA GLN 601 HA GLN 601 -3.957 -15.164 3.538 402 HB2 GLN 601 HB2 GLN 601 -6.335 -13.510 4.348 403 HB3 GLN 601 HB1 GLN 601 -6.505 -15.168 3.786 404 HG2 GLN 601 HG2 GLN 601 -5.066 -15.932 5.590 405 HG3 GLN 601 HG1 GLN 601 -4.885 -14.269 6.155 406 HE21 GLN 601 HE21 GLN 601 -6.003 -16.632 7.494 407 HE22 GLN 601 HE22 GLN 601 -7.610 -16.185 7.956 408 H SER 602 HN SER 602 -5.389 -12.267 2.119 409 HA SER 602 HA SER 602 -6.766 -13.490 0.052 410 HB2 SER 602 HB2 SER 602 -5.435 -10.778 0.049 411 HB3 SER 602 HB1 SER 602 -6.654 -11.320 -1.113 412 HG SER 602 HG SER 602 -6.952 -10.879 1.676 413 H ALA 603 HN ALA 603 -3.399 -12.293 0.022 414 HA ALA 603 HA ALA 603 -2.972 -13.077 -2.689 415 HB1 ALA 603 HB1 ALA 603 -0.808 -12.664 -0.666 416 HB2 ALA 603 HB2 ALA 603 -1.709 -11.310 -1.350 417 HB3 ALA 603 HB3 ALA 603 -0.763 -12.364 -2.403 418 H GLU 604 HN GLU 604 -2.590 -14.624 0.408 419 HA GLU 604 HA GLU 604 -0.944 -16.760 -0.478 420 HB2 GLU 604 HB2 GLU 604 -2.747 -16.428 1.915 421 HB3 GLU 604 HB1 GLU 604 -1.668 -17.800 1.684 422 HG2 GLU 604 HG2 GLU 604 -0.661 -14.981 1.621 423 HG3 GLU 604 HG1 GLU 604 -0.871 -15.856 3.135 424 H ILE 605 HN ILE 605 -4.425 -16.339 -0.112 425 HA ILE 605 HA ILE 605 -5.100 -19.017 -0.805 426 HB ILE 605 HB ILE 605 -6.815 -16.531 -0.902 427 HG12 ILE 605 HG12 ILE 605 -6.521 -18.607 1.276 428 HG13 ILE 605 HG11 ILE 605 -5.779 -17.016 1.310 429 HG21 ILE 605 HG21 ILE 605 -7.767 -18.352 -2.208 430 HG22 ILE 605 HG22 ILE 605 -8.702 -18.092 -0.736 431 HG23 ILE 605 HG23 ILE 605 -7.581 -19.449 -0.839 432 HD11 ILE 605 HD11 ILE 605 -7.738 -16.987 2.672 433 HD12 ILE 605 HD12 ILE 605 -8.718 -17.636 1.356 434 HD13 ILE 605 HD13 ILE 605 -8.038 -16.015 1.229 435 H SER 606 HN SER 606 -5.156 -15.951 -2.631 436 HA SER 606 HA SER 606 -5.669 -17.440 -5.087 437 HB2 SER 606 HB2 SER 606 -5.438 -14.466 -4.589 438 HB3 SER 606 HB1 SER 606 -5.879 -15.206 -6.127 439 HG SER 606 HG SER 606 -7.606 -16.259 -4.737 440 H ASN 607 HN ASN 607 -3.915 -18.383 -5.899 441 HA ASN 607 HA ASN 607 -1.270 -17.710 -5.296 442 HB2 ASN 607 HB2 ASN 607 -2.469 -19.399 -7.467 443 HB3 ASN 607 HB1 ASN 607 -0.731 -19.217 -7.284 444 HD21 ASN 607 HD21 ASN 607 -0.405 -21.363 -6.821 445 HD22 ASN 607 HD22 ASN 607 -0.892 -22.082 -5.325 446 H ASP 608 HN ASP 608 -3.334 -16.480 -7.812 447 HA ASP 608 HA ASP 608 -1.327 -15.575 -9.592 448 HB2 ASP 608 HB2 ASP 608 -4.078 -14.399 -9.115 449 HB3 ASP 608 HB1 ASP 608 -3.041 -14.071 -10.502 450 H LEU 609 HN LEU 609 -2.434 -14.431 -6.549 451 HA LEU 609 HA LEU 609 -0.909 -11.949 -6.905 452 HB2 LEU 609 HB2 LEU 609 -2.941 -12.643 -4.796 453 HB3 LEU 609 HB1 LEU 609 -2.137 -11.102 -4.986 454 HG LEU 609 HG LEU 609 -4.209 -10.720 -5.885 455 HD11 LEU 609 HD11 LEU 609 -2.579 -11.562 -8.250 456 HD12 LEU 609 HD12 LEU 609 -2.491 -10.007 -7.426 457 HD13 LEU 609 HD13 LEU 609 -3.962 -10.469 -8.279 458 HD21 LEU 609 HD21 LEU 609 -5.397 -12.231 -7.414 459 HD22 LEU 609 HD22 LEU 609 -5.100 -12.936 -5.826 460 HD23 LEU 609 HD23 LEU 609 -4.103 -13.409 -7.201 461 H LYS 610 HN LYS 610 0.489 -11.299 -5.126 462 HA LYS 610 HA LYS 610 0.946 -13.236 -3.031 463 HB2 LYS 610 HB2 LYS 610 3.376 -13.406 -3.473 464 HB3 LYS 610 HB1 LYS 610 2.383 -14.155 -4.712 465 HG2 LYS 610 HG2 LYS 610 2.717 -12.217 -6.152 466 HG3 LYS 610 HG1 LYS 610 3.727 -11.471 -4.909 467 HD2 LYS 610 HD2 LYS 610 5.305 -13.314 -5.058 468 HD3 LYS 610 HD1 LYS 610 4.280 -14.120 -6.244 469 HE2 LYS 610 HE2 LYS 610 4.589 -12.228 -7.773 470 HE3 LYS 610 HE1 LYS 610 5.641 -11.453 -6.589 471 HZ1 LYS 610 HZ1 LYS 610 7.162 -13.311 -6.774 472 HZ2 LYS 610 HZ2 LYS 610 6.904 -12.607 -8.288 473 HZ3 LYS 610 HZ3 LYS 610 6.148 -14.068 -7.897 474 H ILE 611 HN ILE 611 1.749 -12.407 -1.208 475 HA ILE 611 HA ILE 611 1.980 -9.534 -0.967 476 HB ILE 611 HB ILE 611 2.311 -11.708 1.087 477 HG12 ILE 611 HG12 ILE 611 0.015 -11.257 -0.052 478 HG13 ILE 611 HG11 ILE 611 0.097 -11.446 1.683 479 HG21 ILE 611 HG21 ILE 611 2.008 -8.758 1.529 480 HG22 ILE 611 HG22 ILE 611 3.512 -9.663 1.691 481 HG23 ILE 611 HG23 ILE 611 2.158 -9.995 2.775 482 HD11 ILE 611 HD11 ILE 611 -0.039 -8.830 0.210 483 HD12 ILE 611 HD12 ILE 611 -0.022 -9.032 1.962 484 HD13 ILE 611 HD13 ILE 611 -1.390 -9.631 1.015 485 H ASP 612 HN ASP 612 3.845 -8.458 -0.339 486 HA ASP 612 HA ASP 612 6.331 -10.017 -0.229 487 HB2 ASP 612 HB2 ASP 612 6.186 -8.897 -2.436 488 HB3 ASP 612 HB1 ASP 612 5.993 -7.355 -1.614 489 H SER 613 HN SER 613 7.945 -9.125 1.102 490 HA SER 613 HA SER 613 6.996 -7.034 2.926 491 HB2 SER 613 HB2 SER 613 8.314 -8.344 4.719 492 HB3 SER 613 HB1 SER 613 6.749 -8.988 4.215 493 HG SER 613 HG SER 613 9.227 -9.811 3.099 494 H SER 614 HN SER 614 8.190 -5.350 2.363 495 HA SER 614 HA SER 614 11.114 -5.704 2.254 496 HB2 SER 614 HB2 SER 614 9.380 -4.009 0.447 497 HB3 SER 614 HB1 SER 614 11.139 -3.906 0.509 498 HG SER 614 HG SER 614 9.493 -5.951 -0.496 499 H THR 615 HN THR 615 12.065 -4.608 3.835 500 HA THR 615 HA THR 615 10.610 -2.663 5.377 501 HB THR 615 HB THR 615 13.503 -3.495 5.636 502 HG1 THR 615 HG1 THR 615 12.291 -5.321 5.966 503 HG21 THR 615 HG21 THR 615 12.992 -1.403 6.789 504 HG22 THR 615 HG22 THR 615 13.267 -2.698 7.953 505 HG23 THR 615 HG23 THR 615 11.624 -2.166 7.599 506 H VAL 616 HN VAL 616 10.438 -0.595 4.679 507 HA VAL 616 HA VAL 616 12.301 0.737 3.072 508 HB VAL 616 HB VAL 616 10.222 1.773 3.173 509 HG11 VAL 616 HG11 VAL 616 9.115 2.482 5.251 510 HG12 VAL 616 HG12 VAL 616 10.403 1.708 6.170 511 HG13 VAL 616 HG13 VAL 616 9.342 0.737 5.156 512 HG21 VAL 616 HG21 VAL 616 10.610 3.988 4.306 513 HG22 VAL 616 HG22 VAL 616 11.871 3.481 3.179 514 HG23 VAL 616 HG23 VAL 616 12.122 3.315 4.918 515 H GLU 617 HN GLU 617 14.325 1.179 3.512 516 HA GLU 617 HA GLU 617 15.218 1.415 6.269 517 HB2 GLU 617 HB2 GLU 617 16.748 1.281 3.685 518 HB3 GLU 617 HB1 GLU 617 17.498 1.434 5.262 519 HG2 GLU 617 HG2 GLU 617 16.150 -0.717 5.794 520 HG3 GLU 617 HG1 GLU 617 16.088 -0.884 4.043 521 H ARG 618 HN ARG 618 14.410 3.413 3.609 522 HA ARG 618 HA ARG 618 15.135 5.777 5.061 523 HB2 ARG 618 HB2 ARG 618 17.306 5.076 4.080 524 HB3 ARG 618 HB1 ARG 618 16.592 5.165 2.477 525 HG2 ARG 618 HG2 ARG 618 16.291 7.542 2.696 526 HG3 ARG 618 HG1 ARG 618 16.859 7.492 4.366 527 HD2 ARG 618 HD2 ARG 618 19.048 6.736 3.611 528 HD3 ARG 618 HD1 ARG 618 18.486 6.740 1.941 529 HE ARG 618 HE ARG 618 18.049 9.254 2.496 530 HH11 ARG 618 HH11 ARG 618 20.766 7.306 3.564 531 HH12 ARG 618 HH12 ARG 618 21.872 8.642 3.591 532 HH21 ARG 618 HH21 ARG 618 19.506 11.011 2.550 533 HH22 ARG 618 HH22 ARG 618 21.156 10.749 3.027 534 H ILE 619 HN ILE 619 14.409 7.733 3.944 535 HA ILE 619 HA ILE 619 12.471 7.247 1.809 536 HB ILE 619 HB ILE 619 11.846 8.493 4.490 537 HG12 ILE 619 HG12 ILE 619 10.431 6.371 2.865 538 HG13 ILE 619 HG11 ILE 619 11.563 6.038 4.173 539 HG21 ILE 619 HG21 ILE 619 9.684 9.196 3.548 540 HG22 ILE 619 HG22 ILE 619 10.216 8.687 1.945 541 HG23 ILE 619 HG23 ILE 619 11.029 10.021 2.761 542 HD11 ILE 619 HD11 ILE 619 9.253 5.843 4.906 543 HD12 ILE 619 HD12 ILE 619 8.950 7.513 4.428 544 HD13 ILE 619 HD13 ILE 619 10.074 7.161 5.742 545 H GLU 620 HN GLU 620 12.944 8.576 0.247 546 HA GLU 620 HA GLU 620 14.452 11.011 0.897 547 HB2 GLU 620 HB2 GLU 620 14.502 9.263 -1.555 548 HB3 GLU 620 HB1 GLU 620 15.414 10.755 -1.374 549 HG2 GLU 620 HG2 GLU 620 15.683 8.570 0.628 550 HG3 GLU 620 HG1 GLU 620 16.542 8.474 -0.917 551 H ASP 621 HN ASP 621 13.748 12.944 0.122 552 HA ASP 621 HA ASP 621 11.174 12.938 -1.237 553 HB2 ASP 621 HB2 ASP 621 10.930 15.208 -0.621 554 HB3 ASP 621 HB1 ASP 621 11.665 14.432 0.773 555 H SER 622 HN SER 622 10.913 13.360 -3.314 556 HA SER 622 HA SER 622 13.277 13.954 -4.902 557 HB2 SER 622 HB2 SER 622 10.668 12.586 -5.346 558 HB3 SER 622 HB1 SER 622 11.454 13.328 -6.729 559 HG SER 622 HG SER 622 12.342 11.359 -6.711 560 H HIS 623 HN HIS 623 13.170 15.538 -6.597 561 HA HIS 623 HA HIS 623 11.631 17.866 -5.811 562 HB2 HIS 623 HB2 HIS 623 14.037 17.990 -6.505 563 HB3 HIS 623 HB1 HIS 623 13.522 17.590 -8.137 564 HD1 HIS 623 HD1 HIS 623 12.713 19.486 -9.579 565 HD2 HIS 623 HD2 HIS 623 13.026 20.542 -5.571 566 HE1 HIS 623 HE1 HIS 623 12.323 21.966 -9.501 567 HE2 HIS 623 HE2 HIS 623 12.672 22.605 -7.092 568 H SER 624 HN SER 624 9.745 16.493 -6.328 569 HA SER 624 HA SER 624 8.589 17.429 -8.788 570 HB2 SER 624 HB2 SER 624 8.982 14.483 -8.257 571 HB3 SER 624 HB1 SER 624 7.763 15.089 -9.376 572 HG SER 624 HG SER 624 10.421 15.972 -9.624 573 HA PRO 625 HA PRO 625 5.054 18.091 -6.337 574 HB2 PRO 625 HB2 PRO 625 3.529 16.746 -8.490 575 HB3 PRO 625 HB1 PRO 625 3.260 18.322 -7.746 576 HG2 PRO 625 HG2 PRO 625 4.354 18.108 -10.172 577 HG3 PRO 625 HG1 PRO 625 4.875 19.355 -9.027 578 HD2 PRO 625 HD2 PRO 625 6.262 16.873 -9.877 579 HD3 PRO 625 HD1 PRO 625 6.934 18.419 -9.329 580 H GLY 626 HN GLY 626 4.972 16.905 -4.595 581 HA2 GLY 626 HA2 GLY 626 4.294 15.283 -3.138 582 HA3 GLY 626 HA1 GLY 626 3.133 14.818 -4.369 583 H VAL 627 HN VAL 627 6.640 14.707 -4.798 584 HA VAL 627 HA VAL 627 6.332 11.790 -5.073 585 HB VAL 627 HB VAL 627 8.485 13.509 -6.321 586 HG11 VAL 627 HG11 VAL 627 8.972 11.525 -7.651 587 HG12 VAL 627 HG12 VAL 627 7.710 10.630 -6.807 588 HG13 VAL 627 HG13 VAL 627 9.141 11.173 -5.932 589 HG21 VAL 627 HG21 VAL 627 7.227 13.036 -8.428 590 HG22 VAL 627 HG22 VAL 627 6.388 14.099 -7.296 591 HG23 VAL 627 HG23 VAL 627 5.914 12.403 -7.428 592 H ALA 628 HN ALA 628 7.275 10.519 -3.700 593 HA ALA 628 HA ALA 628 9.844 11.309 -2.530 594 HB1 ALA 628 HB1 ALA 628 7.560 10.088 -0.971 595 HB2 ALA 628 HB2 ALA 628 8.177 11.732 -0.792 596 HB3 ALA 628 HB3 ALA 628 9.197 10.355 -0.363 597 H VAL 629 HN VAL 629 11.300 9.758 -2.653 598 HA VAL 629 HA VAL 629 10.436 7.191 -3.722 599 HB VAL 629 HB VAL 629 12.171 7.731 -5.075 600 HG11 VAL 629 HG11 VAL 629 13.242 9.310 -2.772 601 HG12 VAL 629 HG12 VAL 629 12.647 9.893 -4.323 602 HG13 VAL 629 HG13 VAL 629 14.193 9.040 -4.231 603 HG21 VAL 629 HG21 VAL 629 14.274 6.674 -4.397 604 HG22 VAL 629 HG22 VAL 629 12.886 5.672 -3.970 605 HG23 VAL 629 HG23 VAL 629 13.711 6.618 -2.726 606 H ILE 630 HN ILE 630 10.073 5.615 -2.408 607 HA ILE 630 HA ILE 630 11.225 5.640 0.254 608 HB ILE 630 HB ILE 630 9.434 3.502 -0.862 609 HG12 ILE 630 HG12 ILE 630 8.350 5.674 -1.297 610 HG13 ILE 630 HG11 ILE 630 7.504 4.761 -0.055 611 HG21 ILE 630 HG21 ILE 630 9.860 4.584 1.910 612 HG22 ILE 630 HG22 ILE 630 10.517 3.077 1.273 613 HG23 ILE 630 HG23 ILE 630 8.774 3.266 1.473 614 HD11 ILE 630 HD11 ILE 630 7.645 7.106 0.523 615 HD12 ILE 630 HD12 ILE 630 9.404 7.035 0.417 616 HD13 ILE 630 HD13 ILE 630 8.558 6.119 1.666 617 H GLN 631 HN GLN 631 13.064 4.621 0.686 618 HA GLN 631 HA GLN 631 14.180 2.803 -1.311 619 HB2 GLN 631 HB2 GLN 631 15.533 4.712 -0.514 620 HB3 GLN 631 HB1 GLN 631 15.447 4.078 1.122 621 HG2 GLN 631 HG2 GLN 631 16.710 2.136 0.490 622 HG3 GLN 631 HG1 GLN 631 16.697 2.638 -1.201 623 HE21 GLN 631 HE21 GLN 631 18.047 3.197 1.948 624 HE22 GLN 631 HE22 GLN 631 19.328 4.238 1.437 625 H PHE 632 HN PHE 632 13.815 0.709 -1.044 626 HA PHE 632 HA PHE 632 13.242 -0.300 1.667 627 HB2 PHE 632 HB2 PHE 632 12.514 -1.451 -1.029 628 HB3 PHE 632 HB1 PHE 632 12.109 -2.167 0.523 629 HD1 PHE 632 HD2 PHE 632 10.412 -1.180 1.939 630 HD2 PHE 632 HD1 PHE 632 11.316 0.431 -1.889 631 HE1 PHE 632 HE2 PHE 632 8.287 0.050 1.959 632 HE2 PHE 632 HE1 PHE 632 9.188 1.662 -1.880 633 HZ PHE 632 HZ PHE 632 7.668 1.469 0.046 634 H ALA 633 HN ALA 633 14.209 -2.106 2.455 635 HA ALA 633 HA ALA 633 16.366 -3.312 0.873 636 HB1 ALA 633 HB1 ALA 633 15.711 -3.528 3.806 637 HB2 ALA 633 HB2 ALA 633 17.014 -2.580 3.089 638 HB3 ALA 633 HB3 ALA 633 17.052 -4.343 3.000 639 H VAL 634 HN VAL 634 15.725 -4.992 -0.280 640 HA VAL 634 HA VAL 634 13.347 -6.470 0.498 641 HB VAL 634 HB VAL 634 15.022 -6.464 -2.009 642 HG11 VAL 634 HG11 VAL 634 12.432 -7.948 -1.660 643 HG12 VAL 634 HG12 VAL 634 14.000 -8.720 -1.436 644 HG13 VAL 634 HG13 VAL 634 13.571 -8.035 -3.002 645 HG21 VAL 634 HG21 VAL 634 12.254 -5.471 -1.345 646 HG22 VAL 634 HG22 VAL 634 12.930 -5.523 -2.978 647 HG23 VAL 634 HG23 VAL 634 13.670 -4.497 -1.748 648 H GLY 635 HN GLY 635 13.394 -8.349 1.496 649 HA2 GLY 635 HA2 GLY 635 13.974 -10.511 1.997 650 HA3 GLY 635 HA1 GLY 635 15.210 -10.419 0.758 651 H GLU 636 HN GLU 636 16.477 -11.692 2.254 652 HA GLU 636 HA GLU 636 17.089 -10.709 4.856 653 HB2 GLU 636 HB2 GLU 636 18.322 -12.923 3.241 654 HB3 GLU 636 HB1 GLU 636 18.665 -12.610 4.931 655 HG2 GLU 636 HG2 GLU 636 15.947 -13.276 3.836 656 HG3 GLU 636 HG1 GLU 636 17.049 -14.442 4.559 657 H HIS 637 HN HIS 637 18.755 -10.597 1.729 658 HA HIS 637 HA HIS 637 21.111 -9.507 3.059 659 HB2 HIS 637 HB2 HIS 637 22.149 -9.479 0.791 660 HB3 HIS 637 HB1 HIS 637 21.725 -11.073 1.390 661 HD1 HIS 637 HD1 HIS 637 20.841 -8.545 -1.236 662 HD2 HIS 637 HD2 HIS 637 19.882 -12.451 -0.184 663 HE1 HIS 637 HE1 HIS 637 19.609 -9.493 -3.208 664 HE2 HIS 637 HE2 HIS 637 18.888 -11.791 -2.479 665 H ARG 638 HN ARG 638 18.399 -8.202 2.476 666 HA ARG 638 HA ARG 638 17.625 -6.090 2.291 667 HB2 ARG 638 HB2 ARG 638 20.477 -5.437 3.030 668 HB3 ARG 638 HB1 ARG 638 19.155 -4.281 3.043 669 HG2 ARG 638 HG2 ARG 638 18.004 -5.785 4.701 670 HG3 ARG 638 HG1 ARG 638 19.517 -6.690 4.802 671 HD2 ARG 638 HD2 ARG 638 20.661 -4.541 5.379 672 HD3 ARG 638 HD1 ARG 638 19.071 -3.788 5.474 673 HE ARG 638 HE ARG 638 19.598 -6.136 7.134 674 HH11 ARG 638 HH11 ARG 638 19.016 -2.685 6.898 675 HH12 ARG 638 HH12 ARG 638 18.853 -2.482 8.615 676 HH21 ARG 638 HH21 ARG 638 19.386 -5.850 9.393 677 HH22 ARG 638 HH22 ARG 638 19.071 -4.264 10.026 678 H ALA 639 HN ALA 639 18.162 -7.138 -0.169 679 HA ALA 639 HA ALA 639 19.688 -5.471 -1.851 680 HB1 ALA 639 HB1 ALA 639 18.346 -6.359 -3.678 681 HB2 ALA 639 HB2 ALA 639 17.185 -7.015 -2.523 682 HB3 ALA 639 HB3 ALA 639 18.831 -7.646 -2.574 683 H GLN 640 HN GLN 640 19.395 -3.380 -2.289 684 HA GLN 640 HA GLN 640 17.000 -2.194 -1.172 685 HB2 GLN 640 HB2 GLN 640 19.571 -0.915 -2.084 686 HB3 GLN 640 HB1 GLN 640 18.212 -0.043 -1.383 687 HG2 GLN 640 HG2 GLN 640 18.453 -1.661 0.586 688 HG3 GLN 640 HG1 GLN 640 20.041 -2.019 -0.084 689 HE21 GLN 640 HE21 GLN 640 18.101 0.253 1.586 690 HE22 GLN 640 HE22 GLN 640 19.354 1.392 1.932 691 H VAL 641 HN VAL 641 15.478 -1.211 -2.193 692 HA VAL 641 HA VAL 641 15.794 -0.609 -5.061 693 HB VAL 641 HB VAL 641 13.294 -1.656 -3.705 694 HG11 VAL 641 HG11 VAL 641 12.291 -1.613 -5.945 695 HG12 VAL 641 HG12 VAL 641 13.748 -0.843 -6.575 696 HG13 VAL 641 HG13 VAL 641 12.744 0.002 -5.397 697 HG21 VAL 641 HG21 VAL 641 15.071 -2.908 -5.796 698 HG22 VAL 641 HG22 VAL 641 13.542 -3.574 -5.223 699 HG23 VAL 641 HG23 VAL 641 14.909 -3.424 -4.116 700 H SER 642 HN SER 642 15.698 1.489 -5.366 701 HA SER 642 HA SER 642 14.135 3.146 -3.526 702 HB2 SER 642 HB2 SER 642 16.158 3.956 -5.629 703 HB3 SER 642 HB1 SER 642 15.384 5.035 -4.469 704 HG SER 642 HG SER 642 16.898 2.779 -3.671 705 H VAL 643 HN VAL 643 12.094 3.417 -4.142 706 HA VAL 643 HA VAL 643 11.524 3.673 -7.010 707 HB VAL 643 HB VAL 643 10.633 1.603 -6.181 708 HG11 VAL 643 HG11 VAL 643 9.031 1.487 -4.337 709 HG12 VAL 643 HG12 VAL 643 9.244 3.213 -4.045 710 HG13 VAL 643 HG13 VAL 643 10.595 2.104 -3.802 711 HG21 VAL 643 HG21 VAL 643 9.234 2.764 -7.762 712 HG22 VAL 643 HG22 VAL 643 8.457 3.654 -6.455 713 HG23 VAL 643 HG23 VAL 643 8.236 1.908 -6.585 714 H GLU 644 HN GLU 644 10.714 5.569 -7.635 715 HA GLU 644 HA GLU 644 10.001 7.546 -5.648 716 HB2 GLU 644 HB2 GLU 644 10.193 7.675 -8.657 717 HB3 GLU 644 HB1 GLU 644 9.708 9.038 -7.657 718 HG2 GLU 644 HG2 GLU 644 11.848 8.957 -6.502 719 HG3 GLU 644 HG1 GLU 644 12.342 7.595 -7.505 720 H VAL 645 HN VAL 645 8.067 7.459 -4.786 721 HA VAL 645 HA VAL 645 5.766 6.732 -6.449 722 HB VAL 645 HB VAL 645 6.526 6.199 -3.590 723 HG11 VAL 645 HG11 VAL 645 3.734 5.920 -4.643 724 HG12 VAL 645 HG12 VAL 645 4.299 7.264 -3.651 725 HG13 VAL 645 HG13 VAL 645 4.311 5.621 -3.001 726 HG21 VAL 645 HG21 VAL 645 5.404 4.464 -5.789 727 HG22 VAL 645 HG22 VAL 645 5.811 3.917 -4.163 728 HG23 VAL 645 HG23 VAL 645 7.078 4.506 -5.238 729 H LEU 646 HN LEU 646 3.917 8.080 -6.308 730 HA LEU 646 HA LEU 646 4.274 10.690 -5.216 731 HB2 LEU 646 HB2 LEU 646 1.748 9.323 -6.144 732 HB3 LEU 646 HB1 LEU 646 1.827 10.990 -5.608 733 HG LEU 646 HG LEU 646 2.801 9.766 -8.135 734 HD11 LEU 646 HD11 LEU 646 1.526 12.423 -7.503 735 HD12 LEU 646 HD12 LEU 646 0.650 10.973 -8.007 736 HD13 LEU 646 HD13 LEU 646 1.797 11.739 -9.106 737 HD21 LEU 646 HD21 LEU 646 4.197 11.740 -8.562 738 HD22 LEU 646 HD22 LEU 646 4.816 10.728 -7.255 739 HD23 LEU 646 HD23 LEU 646 3.969 12.231 -6.883 740 H VAL 647 HN VAL 647 3.652 11.480 -3.297 741 HA VAL 647 HA VAL 647 3.626 9.704 -1.131 742 HB VAL 647 HB VAL 647 3.186 11.680 0.273 743 HG11 VAL 647 HG11 VAL 647 5.454 11.158 -0.423 744 HG12 VAL 647 HG12 VAL 647 5.219 12.903 -0.322 745 HG13 VAL 647 HG13 VAL 647 5.235 12.105 -1.895 746 HG21 VAL 647 HG21 VAL 647 1.641 12.888 -1.121 747 HG22 VAL 647 HG22 VAL 647 2.861 13.079 -2.378 748 HG23 VAL 647 HG23 VAL 647 3.054 13.902 -0.828 749 H GLU 648 HN GLU 648 1.046 10.745 -3.077 750 HA GLU 648 HA GLU 648 -0.974 10.417 -1.036 751 HB2 GLU 648 HB2 GLU 648 -2.566 10.789 -2.947 752 HB3 GLU 648 HB1 GLU 648 -1.460 12.106 -2.622 753 HG2 GLU 648 HG2 GLU 648 -0.016 11.107 -4.482 754 HG3 GLU 648 HG1 GLU 648 -1.450 10.172 -4.903 755 H TYR 649 HN TYR 649 0.871 8.261 -2.610 756 HA TYR 649 HA TYR 649 -1.187 6.353 -3.264 757 HB2 TYR 649 HB2 TYR 649 1.780 6.438 -3.419 758 HB3 TYR 649 HB1 TYR 649 1.005 4.862 -3.354 759 HD1 TYR 649 HD1 TYR 649 0.514 8.112 -5.136 760 HD2 TYR 649 HD2 TYR 649 0.578 3.867 -5.382 761 HE1 TYR 649 HE1 TYR 649 0.038 8.250 -7.544 762 HE2 TYR 649 HE2 TYR 649 0.102 3.993 -7.790 763 HH TYR 649 HH TYR 649 0.332 6.877 -9.561 764 HA PRO 650 HA PRO 650 -1.474 4.827 0.942 765 HB2 PRO 650 HB2 PRO 650 -3.108 2.761 -0.390 766 HB3 PRO 650 HB1 PRO 650 -3.543 3.862 0.920 767 HG2 PRO 650 HG2 PRO 650 -4.527 4.180 -1.545 768 HG3 PRO 650 HG1 PRO 650 -4.112 5.572 -0.527 769 HD2 PRO 650 HD2 PRO 650 -2.575 4.353 -2.789 770 HD3 PRO 650 HD1 PRO 650 -2.844 6.066 -2.401 771 H PHE 651 HN PHE 651 -0.420 3.204 2.000 772 HA PHE 651 HA PHE 651 0.701 1.024 0.401 773 HB2 PHE 651 HB2 PHE 651 2.192 3.139 1.802 774 HB3 PHE 651 HB1 PHE 651 2.742 1.503 2.153 775 HD1 PHE 651 HD2 PHE 651 2.120 3.910 -0.589 776 HD2 PHE 651 HD1 PHE 651 4.007 0.290 0.599 777 HE1 PHE 651 HE2 PHE 651 3.373 3.873 -2.705 778 HE2 PHE 651 HE1 PHE 651 5.264 0.243 -1.515 779 HZ PHE 651 HZ PHE 651 4.947 2.038 -3.171 780 H PHE 652 HN PHE 652 -0.272 -0.667 1.240 781 HA PHE 652 HA PHE 652 -0.936 -0.946 3.984 782 HB2 PHE 652 HB2 PHE 652 -1.506 -2.330 1.615 783 HB3 PHE 652 HB1 PHE 652 -0.610 -3.477 2.606 784 HD1 PHE 652 HD1 PHE 652 -1.387 -3.785 5.018 785 HD2 PHE 652 HD2 PHE 652 -3.760 -1.973 1.992 786 HE1 PHE 652 HE1 PHE 652 -3.402 -4.220 6.348 787 HE2 PHE 652 HE2 PHE 652 -5.786 -2.400 3.315 788 HZ PHE 652 HZ PHE 652 -5.609 -3.523 5.499 789 H VAL 653 HN VAL 653 0.292 -1.744 5.652 790 HA VAL 653 HA VAL 653 3.013 -2.531 4.879 791 HB VAL 653 HB VAL 653 2.261 -1.276 7.518 792 HG11 VAL 653 HG11 VAL 653 4.598 -0.862 7.715 793 HG12 VAL 653 HG12 VAL 653 4.888 -1.430 6.073 794 HG13 VAL 653 HG13 VAL 653 4.364 -2.559 7.318 795 HG21 VAL 653 HG21 VAL 653 3.149 0.041 4.963 796 HG22 VAL 653 HG22 VAL 653 3.297 0.802 6.546 797 HG23 VAL 653 HG23 VAL 653 1.698 0.385 5.909 798 H PHE 654 HN PHE 654 3.898 -4.336 5.707 799 HA PHE 654 HA PHE 654 2.057 -6.443 6.133 800 HB2 PHE 654 HB2 PHE 654 4.178 -6.524 4.817 801 HB3 PHE 654 HB1 PHE 654 5.072 -6.472 6.324 802 HD1 PHE 654 HD2 PHE 654 2.345 -8.475 4.739 803 HD2 PHE 654 HD1 PHE 654 5.846 -8.456 7.157 804 HE1 PHE 654 HE2 PHE 654 2.274 -10.932 4.858 805 HE2 PHE 654 HE1 PHE 654 5.784 -10.912 7.276 806 HZ PHE 654 HZ PHE 654 3.994 -12.153 6.127 807 H GLY 655 HN GLY 655 1.172 -5.561 8.259 808 HA2 GLY 655 HA2 GLY 655 0.871 -6.482 10.440 809 HA3 GLY 655 HA1 GLY 655 2.564 -6.956 10.442 810 H GLN 656 HN GLN 656 2.543 -3.964 9.231 811 HA GLN 656 HA GLN 656 3.276 -2.827 11.819 812 HB2 GLN 656 HB2 GLN 656 3.774 -1.873 9.004 813 HB3 GLN 656 HB1 GLN 656 4.287 -0.998 10.430 814 HG2 GLN 656 HG2 GLN 656 6.130 -2.206 9.413 815 HG3 GLN 656 HG1 GLN 656 5.790 -2.810 11.022 816 HE21 GLN 656 HE21 GLN 656 5.530 -3.466 7.621 817 HE22 GLN 656 HE22 GLN 656 5.284 -5.182 7.726 818 H GLY 657 HN GLY 657 1.067 -2.362 9.098 819 HA2 GLY 657 HA2 GLY 657 -1.128 -1.616 10.324 820 HA3 GLY 657 HA1 GLY 657 -0.207 -0.135 10.500 821 H TRP 658 HN TRP 658 -2.622 -0.111 9.263 822 HA TRP 658 HA TRP 658 -2.299 -0.175 6.400 823 HB2 TRP 658 HB2 TRP 658 -4.478 -0.678 7.494 824 HB3 TRP 658 HB1 TRP 658 -4.537 0.958 8.121 825 HD1 TRP 658 HD1 TRP 658 -6.915 1.119 6.872 826 HE1 TRP 658 HE1 TRP 658 -7.515 1.732 4.453 827 HE3 TRP 658 HE3 TRP 658 -2.340 0.415 4.658 828 HZ2 TRP 658 HZ2 TRP 658 -6.246 1.913 1.959 829 HZ3 TRP 658 HZ3 TRP 658 -2.137 0.834 2.248 830 HH2 TRP 658 HH2 TRP 658 -4.047 1.568 0.932 831 H SER 659 HN SER 659 -0.829 1.327 5.631 832 HA SER 659 HA SER 659 -0.951 4.022 6.821 833 HB2 SER 659 HB2 SER 659 1.534 2.561 5.887 834 HB3 SER 659 HB1 SER 659 1.476 4.121 6.707 835 HG SER 659 HG SER 659 0.436 1.750 7.854 836 H SER 660 HN SER 660 0.094 5.705 5.450 837 HA SER 660 HA SER 660 0.388 5.017 2.628 838 HB2 SER 660 HB2 SER 660 -1.318 7.314 3.617 839 HB3 SER 660 HB1 SER 660 -0.842 7.065 1.936 840 HG SER 660 HG SER 660 -2.007 4.884 3.177 841 H CYS 661 HN CYS 661 1.655 6.572 1.449 842 HA CYS 661 HA CYS 661 3.971 7.327 2.820 843 HB2 CYS 661 HB2 CYS 661 2.980 8.381 0.166 844 HB3 CYS 661 HB1 CYS 661 4.645 8.388 0.735 845 HG CYS 661 HG CYS 661 2.870 5.915 -0.667 846 H CYS 662 HN CYS 662 0.988 8.969 2.355 847 HA CYS 662 HA CYS 662 1.812 11.053 4.119 848 HB2 CYS 662 HB2 CYS 662 2.634 12.003 2.031 849 HB3 CYS 662 HB1 CYS 662 1.069 11.754 1.270 850 HG CYS 662 HG CYS 662 2.155 14.387 2.797 851 HA PRO 663 HA PRO 663 -2.508 9.624 4.711 852 HB2 PRO 663 HB2 PRO 663 -1.851 10.859 7.334 853 HB3 PRO 663 HB1 PRO 663 -2.607 9.301 6.979 854 HG2 PRO 663 HG2 PRO 663 -0.084 9.429 7.807 855 HG3 PRO 663 HG1 PRO 663 -0.577 8.264 6.563 856 HD2 PRO 663 HD2 PRO 663 0.882 10.855 6.265 857 HD3 PRO 663 HD1 PRO 663 1.124 9.320 5.408 858 H GLU 664 HN GLU 664 -0.877 12.631 5.403 859 HA GLU 664 HA GLU 664 -3.010 14.354 5.772 860 HB2 GLU 664 HB2 GLU 664 -0.490 14.910 4.195 861 HB3 GLU 664 HB1 GLU 664 -1.531 16.107 4.951 862 HG2 GLU 664 HG2 GLU 664 -0.926 15.328 7.139 863 HG3 GLU 664 HG1 GLU 664 -0.005 13.992 6.449 864 H ARG 665 HN ARG 665 -1.322 13.649 2.713 865 HA ARG 665 HA ARG 665 -3.255 15.040 1.147 866 HB2 ARG 665 HB2 ARG 665 -0.892 14.837 0.479 867 HB3 ARG 665 HB1 ARG 665 -1.099 13.102 0.273 868 HG2 ARG 665 HG2 ARG 665 -2.733 13.508 -1.497 869 HG3 ARG 665 HG1 ARG 665 -2.520 15.246 -1.293 870 HD2 ARG 665 HD2 ARG 665 -0.253 13.389 -1.961 871 HD3 ARG 665 HD1 ARG 665 -1.241 14.169 -3.193 872 HE ARG 665 HE ARG 665 0.078 15.866 -1.213 873 HH11 ARG 665 HH11 ARG 665 -0.051 14.578 -4.474 874 HH12 ARG 665 HH12 ARG 665 0.990 15.812 -5.125 875 HH21 ARG 665 HH21 ARG 665 1.457 17.469 -2.071 876 HH22 ARG 665 HH22 ARG 665 1.847 17.451 -3.761 877 H THR 666 HN THR 666 -2.683 11.580 1.823 878 HA THR 666 HA THR 666 -4.536 10.585 -0.034 879 HB THR 666 HB THR 666 -3.871 9.288 2.619 880 HG1 THR 666 HG1 THR 666 -2.442 8.558 0.362 881 HG21 THR 666 HG21 THR 666 -4.561 8.067 -0.066 882 HG22 THR 666 HG22 THR 666 -5.684 8.228 1.282 883 HG23 THR 666 HG23 THR 666 -4.264 7.195 1.437 884 H SER 667 HN SER 667 -4.961 11.543 3.376 885 HA SER 667 HA SER 667 -7.769 10.970 3.331 886 HB2 SER 667 HB2 SER 667 -6.415 10.912 5.414 887 HB3 SER 667 HB1 SER 667 -6.244 12.656 5.299 888 HG SER 667 HG SER 667 -8.589 12.744 5.363 889 H GLN 668 HN GLN 668 -5.777 13.803 2.708 890 HA GLN 668 HA GLN 668 -7.666 15.815 2.675 891 HB2 GLN 668 HB2 GLN 668 -5.114 15.266 1.283 892 HB3 GLN 668 HB1 GLN 668 -6.115 16.528 0.596 893 HG2 GLN 668 HG2 GLN 668 -6.131 17.680 2.701 894 HG3 GLN 668 HG1 GLN 668 -5.164 16.411 3.438 895 HE21 GLN 668 HE21 GLN 668 -3.501 17.808 3.959 896 HE22 GLN 668 HE22 GLN 668 -2.439 18.476 2.770 897 H LEU 669 HN LEU 669 -6.765 13.620 0.038 898 HA LEU 669 HA LEU 669 -8.750 14.936 -1.657 899 HB2 LEU 669 HB2 LEU 669 -6.781 12.854 -2.535 900 HB3 LEU 669 HB1 LEU 669 -7.556 14.100 -3.493 901 HG LEU 669 HG LEU 669 -5.398 14.516 -1.427 902 HD11 LEU 669 HD11 LEU 669 -4.614 13.531 -3.511 903 HD12 LEU 669 HD12 LEU 669 -4.029 15.182 -3.313 904 HD13 LEU 669 HD13 LEU 669 -5.363 14.846 -4.417 905 HD21 LEU 669 HD21 LEU 669 -6.844 16.417 -1.331 906 HD22 LEU 669 HD22 LEU 669 -6.916 16.516 -3.094 907 HD23 LEU 669 HD23 LEU 669 -5.408 16.872 -2.252 908 H PHE 670 HN PHE 670 -7.928 11.797 -0.333 909 HA PHE 670 HA PHE 670 -10.196 10.600 -1.755 910 HB2 PHE 670 HB2 PHE 670 -8.032 9.136 -0.242 911 HB3 PHE 670 HB1 PHE 670 -9.118 8.490 -1.463 912 HD1 PHE 670 HD2 PHE 670 -8.934 9.969 -3.778 913 HD2 PHE 670 HD1 PHE 670 -5.876 9.380 -0.885 914 HE1 PHE 670 HE2 PHE 670 -7.231 10.442 -5.487 915 HE2 PHE 670 HE1 PHE 670 -4.169 9.852 -2.583 916 HZ PHE 670 HZ PHE 670 -4.841 10.385 -4.890 917 H ASP 671 HN ASP 671 -9.467 11.963 1.139 918 HA ASP 671 HA ASP 671 -10.266 11.940 3.256 919 HB2 ASP 671 HB2 ASP 671 -12.608 10.879 1.719 920 HB3 ASP 671 HB1 ASP 671 -12.684 11.003 3.471 921 H LEU 672 HN LEU 672 -8.781 9.590 2.246 922 HA LEU 672 HA LEU 672 -10.045 7.402 3.716 923 HB2 LEU 672 HB2 LEU 672 -9.454 7.170 1.282 924 HB3 LEU 672 HB1 LEU 672 -7.771 7.278 1.732 925 HG LEU 672 HG LEU 672 -9.222 4.981 1.412 926 HD11 LEU 672 HD11 LEU 672 -6.719 5.364 3.023 927 HD12 LEU 672 HD12 LEU 672 -6.817 5.190 1.271 928 HD13 LEU 672 HD13 LEU 672 -7.272 3.845 2.315 929 HD21 LEU 672 HD21 LEU 672 -10.416 5.330 3.511 930 HD22 LEU 672 HD22 LEU 672 -8.867 5.316 4.364 931 HD23 LEU 672 HD23 LEU 672 -9.423 3.874 3.515 932 HA PRO 673 HA PRO 673 -7.119 8.513 6.873 933 HB2 PRO 673 HB2 PRO 673 -7.926 6.581 8.636 934 HB3 PRO 673 HB1 PRO 673 -8.730 8.139 8.440 935 HG2 PRO 673 HG2 PRO 673 -9.475 5.472 7.351 936 HG3 PRO 673 HG1 PRO 673 -10.520 6.768 7.954 937 HD2 PRO 673 HD2 PRO 673 -10.134 6.274 5.296 938 HD3 PRO 673 HD1 PRO 673 -10.489 7.891 5.947 939 H CYS 674 HN CYS 674 -5.144 7.912 7.178 940 HA CYS 674 HA CYS 674 -4.309 5.128 6.814 941 HB2 CYS 674 HB2 CYS 674 -2.319 6.517 5.503 942 HB3 CYS 674 HB1 CYS 674 -3.637 5.639 4.719 943 HG CYS 674 HG CYS 674 -5.255 7.859 4.358 944 H SER 675 HN SER 675 -2.508 4.559 7.982 945 HA SER 675 HA SER 675 -1.551 6.360 9.995 946 HB2 SER 675 HB2 SER 675 -0.390 3.697 9.132 947 HB3 SER 675 HB1 SER 675 -0.130 4.515 10.672 948 HG SER 675 HG SER 675 -2.520 4.330 10.887 949 H LYS 676 HN LYS 676 0.625 7.167 10.150 950 HA LYS 676 HA LYS 676 1.604 8.088 7.632 951 HB2 LYS 676 HB2 LYS 676 1.745 9.524 9.597 952 HB3 LYS 676 HB1 LYS 676 2.776 8.353 10.407 953 HG2 LYS 676 HG2 LYS 676 4.000 10.299 9.478 954 HG3 LYS 676 HG1 LYS 676 4.558 8.745 8.856 955 HD2 LYS 676 HD2 LYS 676 3.302 9.075 6.809 956 HD3 LYS 676 HD1 LYS 676 2.624 10.574 7.438 957 HE2 LYS 676 HE2 LYS 676 4.470 10.964 5.855 958 HE3 LYS 676 HE1 LYS 676 4.810 11.606 7.459 959 HZ1 LYS 676 HZ1 LYS 676 5.796 8.975 6.492 960 HZ2 LYS 676 HZ2 LYS 676 6.253 9.788 7.907 961 HZ3 LYS 676 HZ3 LYS 676 6.688 10.410 6.398 962 H LEU 677 HN LEU 677 2.574 6.715 6.315 963 HA LEU 677 HA LEU 677 4.138 4.498 7.157 964 HB2 LEU 677 HB2 LEU 677 3.065 4.520 4.979 965 HB3 LEU 677 HB1 LEU 677 4.018 5.918 4.504 966 HG LEU 677 HG LEU 677 6.075 4.507 4.777 967 HD11 LEU 677 HD11 LEU 677 5.800 2.084 4.775 968 HD12 LEU 677 HD12 LEU 677 4.057 2.280 4.962 969 HD13 LEU 677 HD13 LEU 677 5.147 2.805 6.245 970 HD21 LEU 677 HD21 LEU 677 5.760 3.333 2.669 971 HD22 LEU 677 HD22 LEU 677 5.115 4.973 2.610 972 HD23 LEU 677 HD23 LEU 677 4.022 3.601 2.784 973 H SER 678 HN SER 678 6.321 4.298 7.387 974 HA SER 678 HA SER 678 8.074 6.497 6.750 975 HB2 SER 678 HB2 SER 678 7.021 7.141 8.939 976 HB3 SER 678 HB1 SER 678 7.776 5.725 9.657 977 HG SER 678 HG SER 678 8.874 8.144 8.912 978 H VAL 679 HN VAL 679 10.303 6.040 7.621 979 HA VAL 679 HA VAL 679 11.209 3.607 6.637 980 HB VAL 679 HB VAL 679 12.721 5.372 6.588 981 HG11 VAL 679 HG11 VAL 679 12.150 5.786 9.502 982 HG12 VAL 679 HG12 VAL 679 11.813 6.878 8.153 983 HG13 VAL 679 HG13 VAL 679 13.478 6.572 8.651 984 HG21 VAL 679 HG21 VAL 679 13.776 3.232 7.227 985 HG22 VAL 679 HG22 VAL 679 13.672 3.718 8.920 986 HG23 VAL 679 HG23 VAL 679 14.674 4.639 7.795 987 H GLY 680 HN GLY 680 11.683 1.696 7.521 988 HA2 GLY 680 HA2 GLY 680 11.984 0.207 9.380 989 HA3 GLY 680 HA1 GLY 680 11.029 1.306 10.363 990 H ASP 681 HN ASP 681 9.138 1.550 7.937 991 HA ASP 681 HA ASP 681 7.428 -0.600 8.876 992 HB2 ASP 681 HB2 ASP 681 6.930 1.669 6.951 993 HB3 ASP 681 HB1 ASP 681 5.747 0.432 7.286 994 H VAL 682 HN VAL 682 7.570 -2.551 8.023 995 HA VAL 682 HA VAL 682 8.740 -3.059 5.473 996 HB VAL 682 HB VAL 682 7.074 -4.895 7.205 997 HG11 VAL 682 HG11 VAL 682 7.174 -5.691 4.933 998 HG12 VAL 682 HG12 VAL 682 8.164 -6.711 5.979 999 HG13 VAL 682 HG13 VAL 682 8.930 -5.523 4.924 1000 HG21 VAL 682 HG21 VAL 682 9.011 -4.146 8.424 1001 HG22 VAL 682 HG22 VAL 682 10.058 -4.532 7.058 1002 HG23 VAL 682 HG23 VAL 682 9.236 -5.825 7.930 1003 H CYS 683 HN CYS 683 7.704 -2.433 3.654 1004 HA CYS 683 HA CYS 683 4.854 -2.055 3.702 1005 HB2 CYS 683 HB2 CYS 683 6.915 -1.621 1.559 1006 HB3 CYS 683 HB1 CYS 683 5.214 -1.263 1.333 1007 HG CYS 683 HG CYS 683 6.881 0.141 3.949 1008 H ILE 684 HN ILE 684 3.314 -3.134 2.666 1009 HA ILE 684 HA ILE 684 3.904 -5.783 1.693 1010 HB ILE 684 HB ILE 684 1.312 -4.242 1.929 1011 HG12 ILE 684 HG12 ILE 684 2.290 -6.693 3.395 1012 HG13 ILE 684 HG11 ILE 684 2.340 -5.052 4.035 1013 HG21 ILE 684 HG21 ILE 684 1.049 -5.658 0.034 1014 HG22 ILE 684 HG22 ILE 684 0.211 -6.426 1.384 1015 HG23 ILE 684 HG23 ILE 684 1.790 -7.017 0.871 1016 HD11 ILE 684 HD11 ILE 684 -0.081 -4.927 3.924 1017 HD12 ILE 684 HD12 ILE 684 0.443 -6.293 4.909 1018 HD13 ILE 684 HD13 ILE 684 -0.144 -6.561 3.267 1019 H SER 685 HN SER 685 4.861 -5.723 -0.304 1020 HA SER 685 HA SER 685 3.639 -4.044 -2.354 1021 HB2 SER 685 HB2 SER 685 6.068 -4.047 -2.262 1022 HB3 SER 685 HB1 SER 685 6.105 -5.796 -2.422 1023 HG SER 685 HG SER 685 6.024 -5.539 -4.488 1024 H LEU 686 HN LEU 686 2.036 -4.843 -3.527 1025 HA LEU 686 HA LEU 686 1.639 -7.736 -3.494 1026 HB2 LEU 686 HB2 LEU 686 -0.087 -5.705 -2.970 1027 HB3 LEU 686 HB1 LEU 686 -0.422 -5.986 -4.666 1028 HG LEU 686 HG LEU 686 -1.961 -7.221 -3.264 1029 HD11 LEU 686 HD11 LEU 686 0.012 -8.977 -4.691 1030 HD12 LEU 686 HD12 LEU 686 -1.429 -8.225 -5.372 1031 HD13 LEU 686 HD13 LEU 686 -1.585 -9.488 -4.152 1032 HD21 LEU 686 HD21 LEU 686 0.483 -8.580 -2.156 1033 HD22 LEU 686 HD22 LEU 686 -1.183 -9.059 -1.840 1034 HD23 LEU 686 HD23 LEU 686 -0.595 -7.490 -1.287 1035 H THR 687 HN THR 687 2.002 -8.905 -5.240 1036 HA THR 687 HA THR 687 2.459 -7.549 -7.782 1037 HB THR 687 HB THR 687 2.988 -10.409 -6.956 1038 HG1 THR 687 HG1 THR 687 4.337 -8.139 -6.488 1039 HG21 THR 687 HG21 THR 687 2.620 -10.228 -9.340 1040 HG22 THR 687 HG22 THR 687 4.331 -10.509 -9.016 1041 HG23 THR 687 HG23 THR 687 3.765 -8.894 -9.443 1042 H LEU 688 HN LEU 688 0.848 -7.462 -9.186 1043 HA LEU 688 HA LEU 688 -1.389 -9.326 -8.912 1044 HB2 LEU 688 HB2 LEU 688 -1.211 -6.790 -10.552 1045 HB3 LEU 688 HB1 LEU 688 -2.643 -7.768 -10.329 1046 HG LEU 688 HG LEU 688 -2.934 -5.871 -8.965 1047 HD11 LEU 688 HD11 LEU 688 -3.598 -7.895 -7.833 1048 HD12 LEU 688 HD12 LEU 688 -2.959 -6.733 -6.668 1049 HD13 LEU 688 HD13 LEU 688 -1.968 -8.100 -7.192 1050 HD21 LEU 688 HD21 LEU 688 -0.650 -5.051 -8.969 1051 HD22 LEU 688 HD22 LEU 688 -0.176 -6.333 -7.854 1052 HD23 LEU 688 HD23 LEU 688 -1.304 -5.083 -7.331 1053 H LYS 689 HN LYS 689 -0.781 -11.151 -10.002 1054 HA LYS 689 HA LYS 689 0.642 -11.000 -12.483 1055 HB2 LYS 689 HB2 LYS 689 -0.494 -13.270 -10.910 1056 HB3 LYS 689 HB1 LYS 689 0.282 -13.511 -12.459 1057 HG2 LYS 689 HG2 LYS 689 1.579 -12.203 -10.085 1058 HG3 LYS 689 HG1 LYS 689 1.755 -13.907 -10.498 1059 HD2 LYS 689 HD2 LYS 689 2.405 -11.817 -12.534 1060 HD3 LYS 689 HD1 LYS 689 3.555 -12.152 -11.244 1061 HE2 LYS 689 HE2 LYS 689 4.148 -13.472 -13.150 1062 HE3 LYS 689 HE1 LYS 689 3.516 -14.544 -11.908 1063 HZ1 LYS 689 HZ1 LYS 689 2.698 -15.051 -14.153 1064 HZ2 LYS 689 HZ2 LYS 689 1.941 -13.541 -14.212 1065 HZ3 LYS 689 HZ3 LYS 689 1.448 -14.691 -13.074 Start of MODEL 6 1 H1 VAL 34 HT1 VAL 34 -18.033 -4.966 -6.739 2 H2 VAL 34 HT2 VAL 34 -18.229 -3.327 -6.384 3 H3 VAL 34 HT3 VAL 34 -18.823 -4.495 -5.318 4 HA VAL 34 HA VAL 34 -16.799 -3.525 -4.465 5 HB VAL 34 HB VAL 34 -15.388 -5.608 -4.313 6 HG11 VAL 34 HG11 VAL 34 -17.021 -6.884 -3.028 7 HG12 VAL 34 HG12 VAL 34 -18.312 -5.867 -3.674 8 HG13 VAL 34 HG13 VAL 34 -17.056 -5.163 -2.653 9 HG21 VAL 34 HG21 VAL 34 -16.319 -7.685 -5.200 10 HG22 VAL 34 HG22 VAL 34 -15.918 -6.551 -6.490 11 HG23 VAL 34 HG23 VAL 34 -17.598 -6.770 -6.000 12 H PHE 35 HN PHE 35 -14.456 -3.524 -4.615 13 HA PHE 35 HA PHE 35 -13.443 -3.675 -7.368 14 HB2 PHE 35 HB2 PHE 35 -12.844 -1.743 -5.155 15 HB3 PHE 35 HB1 PHE 35 -11.585 -2.126 -6.327 16 HD1 PHE 35 HD2 PHE 35 -15.232 -1.370 -6.412 17 HD2 PHE 35 HD1 PHE 35 -11.378 -0.615 -8.032 18 HE1 PHE 35 HE2 PHE 35 -16.216 0.238 -7.983 19 HE2 PHE 35 HE1 PHE 35 -12.353 0.986 -9.621 20 HZ PHE 35 HZ PHE 35 -14.776 1.416 -9.599 21 HA PRO 36 HA PRO 36 -10.873 -7.057 -6.005 22 HB2 PRO 36 HB2 PRO 36 -8.891 -5.702 -7.779 23 HB3 PRO 36 HB1 PRO 36 -9.390 -7.398 -7.744 24 HG2 PRO 36 HG2 PRO 36 -10.261 -5.755 -9.652 25 HG3 PRO 36 HG1 PRO 36 -11.321 -6.993 -8.955 26 HD2 PRO 36 HD2 PRO 36 -11.298 -4.049 -8.519 27 HD3 PRO 36 HD1 PRO 36 -12.662 -5.183 -8.518 28 H TRP 37 HN TRP 37 -9.521 -7.238 -4.324 29 HA TRP 37 HA TRP 37 -9.159 -5.070 -2.706 30 HB2 TRP 37 HB2 TRP 37 -7.583 -6.559 -1.383 31 HB3 TRP 37 HB1 TRP 37 -9.215 -7.147 -1.662 32 HD1 TRP 37 HD1 TRP 37 -9.436 -9.059 -3.672 33 HE1 TRP 37 HE1 TRP 37 -7.813 -10.961 -4.258 34 HE3 TRP 37 HE3 TRP 37 -5.245 -7.252 -1.384 35 HZ2 TRP 37 HZ2 TRP 37 -5.113 -11.622 -3.775 36 HZ3 TRP 37 HZ3 TRP 37 -3.188 -8.593 -1.481 37 HH2 TRP 37 HH2 TRP 37 -3.124 -10.732 -2.649 38 H HIS 38 HN HIS 38 -6.920 -6.269 -5.161 39 HA HIS 38 HA HIS 38 -4.818 -4.509 -4.360 40 HB2 HIS 38 HB2 HIS 38 -4.311 -6.446 -5.756 41 HB3 HIS 38 HB1 HIS 38 -5.331 -5.807 -7.042 42 HD1 HIS 38 HD1 HIS 38 -2.092 -5.025 -5.235 43 HD2 HIS 38 HD2 HIS 38 -4.073 -4.074 -8.761 44 HE1 HIS 38 HE1 HIS 38 -0.440 -3.725 -6.605 45 HE2 HIS 38 HE2 HIS 38 -1.724 -3.000 -8.647 46 H SER 39 HN SER 39 -5.985 -2.611 -4.000 47 HA SER 39 HA SER 39 -6.324 -1.007 -6.426 48 HB2 SER 39 HB2 SER 39 -8.574 -1.673 -5.806 49 HB3 SER 39 HB1 SER 39 -8.283 -1.252 -4.121 50 HG SER 39 HG SER 39 -9.419 0.412 -5.062 51 H LEU 40 HN LEU 40 -6.650 -0.760 -2.943 52 HA LEU 40 HA LEU 40 -5.205 1.713 -2.724 53 HB2 LEU 40 HB2 LEU 40 -5.402 0.712 -0.182 54 HB3 LEU 40 HB1 LEU 40 -6.599 1.723 -0.972 55 HG LEU 40 HG LEU 40 -6.759 -1.252 -1.306 56 HD11 LEU 40 HD11 LEU 40 -8.306 -1.258 0.656 57 HD12 LEU 40 HD12 LEU 40 -7.643 0.320 1.094 58 HD13 LEU 40 HD13 LEU 40 -6.594 -1.094 1.047 59 HD21 LEU 40 HD21 LEU 40 -9.133 -0.774 -1.530 60 HD22 LEU 40 HD22 LEU 40 -8.207 0.232 -2.646 61 HD23 LEU 40 HD23 LEU 40 -8.848 0.926 -1.158 62 H VAL 41 HN VAL 41 -4.515 -1.705 -2.363 63 HA VAL 41 HA VAL 41 -1.957 -1.261 -1.158 64 HB VAL 41 HB VAL 41 -3.218 -3.287 -0.614 65 HG11 VAL 41 HG11 VAL 41 -3.458 -5.111 -2.229 66 HG12 VAL 41 HG12 VAL 41 -2.805 -4.075 -3.500 67 HG13 VAL 41 HG13 VAL 41 -4.343 -3.672 -2.735 68 HG21 VAL 41 HG21 VAL 41 -1.409 -4.902 -0.928 69 HG22 VAL 41 HG22 VAL 41 -0.823 -3.323 -0.405 70 HG23 VAL 41 HG23 VAL 41 -0.659 -3.811 -2.091 71 HA PRO 42 HA PRO 42 -0.099 -0.879 -5.216 72 HB2 PRO 42 HB2 PRO 42 1.974 0.607 -4.468 73 HB3 PRO 42 HB1 PRO 42 0.344 1.290 -4.475 74 HG2 PRO 42 HG2 PRO 42 2.005 0.368 -2.183 75 HG3 PRO 42 HG1 PRO 42 0.856 1.714 -2.268 76 HD2 PRO 42 HD2 PRO 42 0.362 -0.863 -1.228 77 HD3 PRO 42 HD1 PRO 42 -0.848 0.391 -1.573 78 H PHE 43 HN PHE 43 2.593 -0.826 -5.487 79 HA PHE 43 HA PHE 43 3.786 -2.997 -3.976 80 HB2 PHE 43 HB2 PHE 43 4.576 -4.111 -6.063 81 HB3 PHE 43 HB1 PHE 43 2.829 -4.186 -5.871 82 HD1 PHE 43 HD2 PHE 43 1.366 -2.870 -7.315 83 HD2 PHE 43 HD1 PHE 43 5.586 -2.879 -7.854 84 HE1 PHE 43 HE2 PHE 43 1.080 -1.905 -9.561 85 HE2 PHE 43 HE1 PHE 43 5.308 -1.917 -10.101 86 HZ PHE 43 HZ PHE 43 3.050 -1.427 -10.955 87 H LEU 44 HN LEU 44 6.030 -2.785 -3.840 88 HA LEU 44 HA LEU 44 6.997 -0.194 -4.647 89 HB2 LEU 44 HB2 LEU 44 8.793 -0.490 -3.212 90 HB3 LEU 44 HB1 LEU 44 7.507 -1.340 -2.386 91 HG LEU 44 HG LEU 44 9.365 -2.673 -2.059 92 HD11 LEU 44 HD11 LEU 44 9.144 -4.688 -3.499 93 HD12 LEU 44 HD12 LEU 44 7.970 -3.791 -4.463 94 HD13 LEU 44 HD13 LEU 44 7.648 -4.122 -2.763 95 HD21 LEU 44 HD21 LEU 44 11.009 -3.260 -3.756 96 HD22 LEU 44 HD22 LEU 44 10.891 -1.515 -3.517 97 HD23 LEU 44 HD23 LEU 44 10.144 -2.265 -4.928 98 H ALA 45 HN ALA 45 9.186 -0.074 -5.806 99 HA ALA 45 HA ALA 45 8.802 -0.851 -8.400 100 HB1 ALA 45 HB1 ALA 45 11.441 -0.325 -7.045 101 HB2 ALA 45 HB2 ALA 45 10.382 0.872 -7.794 102 HB3 ALA 45 HB3 ALA 45 11.179 -0.347 -8.788 103 HA PRO 46 HA PRO 46 9.240 -5.230 -8.847 104 HB2 PRO 46 HB2 PRO 46 10.721 -4.285 -11.277 105 HB3 PRO 46 HB1 PRO 46 9.513 -5.568 -11.130 106 HG2 PRO 46 HG2 PRO 46 8.835 -3.180 -12.082 107 HG3 PRO 46 HG1 PRO 46 7.745 -4.073 -11.005 108 HD2 PRO 46 HD2 PRO 46 9.382 -1.665 -10.457 109 HD3 PRO 46 HD1 PRO 46 7.870 -2.201 -9.700 110 H SER 47 HN SER 47 10.644 -6.022 -7.380 111 HA SER 47 HA SER 47 13.382 -5.158 -7.299 112 HB2 SER 47 HB2 SER 47 13.468 -6.771 -5.343 113 HB3 SER 47 HB1 SER 47 12.294 -5.463 -5.201 114 HG SER 47 HG SER 47 10.858 -6.963 -4.956 115 H GLN 48 HN GLN 48 12.231 -8.505 -7.053 116 HA GLN 48 HA GLN 48 14.561 -9.340 -8.554 117 HB2 GLN 48 HB2 GLN 48 13.548 -10.345 -6.310 118 HB3 GLN 48 HB1 GLN 48 12.594 -11.282 -7.447 119 HG2 GLN 48 HG2 GLN 48 15.592 -11.154 -7.437 120 HG3 GLN 48 HG1 GLN 48 14.641 -12.420 -6.667 121 HE21 GLN 48 HE21 GLN 48 13.561 -13.915 -7.947 122 HE22 GLN 48 HE22 GLN 48 13.938 -14.138 -9.620 123 H ALA 567 HT1 ALA 567 -26.799 16.725 -2.388 124 HA ALA 567 HA ALA 567 -25.842 15.362 -0.677 125 HB1 ALA 567 HB1 ALA 567 -27.624 13.186 -1.767 126 HB2 ALA 567 HB2 ALA 567 -27.845 14.013 -0.225 127 HB3 ALA 567 HB3 ALA 567 -26.418 13.010 -0.493 128 HA PRO 568 HA PRO 568 -23.028 14.678 -3.980 129 HB2 PRO 568 HB2 PRO 568 -20.957 13.652 -2.570 130 HB3 PRO 568 HB1 PRO 568 -21.408 15.358 -2.493 131 HG2 PRO 568 HG2 PRO 568 -22.007 13.148 -0.575 132 HG3 PRO 568 HG1 PRO 568 -21.545 14.829 -0.244 133 HD2 PRO 568 HD2 PRO 568 -24.114 13.911 -0.111 134 HD3 PRO 568 HD1 PRO 568 -23.694 15.592 -0.488 135 HA PRO 569 HA PRO 569 -23.295 10.358 -5.040 136 HB2 PRO 569 HB2 PRO 569 -21.597 10.278 -7.107 137 HB3 PRO 569 HB1 PRO 569 -23.122 11.167 -7.208 138 HG2 PRO 569 HG2 PRO 569 -20.355 12.199 -6.730 139 HG3 PRO 569 HG1 PRO 569 -21.641 12.869 -7.748 140 HD2 PRO 569 HD2 PRO 569 -21.045 13.761 -5.212 141 HD3 PRO 569 HD1 PRO 569 -22.625 13.951 -5.994 142 H THR 570 HN THR 570 -21.555 11.042 -2.851 143 HA THR 570 HA THR 570 -19.764 10.468 -1.652 144 HB THR 570 HB THR 570 -19.223 8.016 -1.739 145 HG1 THR 570 HG1 THR 570 -20.329 8.097 -4.074 146 HG21 THR 570 HG21 THR 570 -21.388 7.349 -0.781 147 HG22 THR 570 HG22 THR 570 -22.099 8.836 -1.409 148 HG23 THR 570 HG23 THR 570 -20.841 8.912 -0.176 149 H LEU 571 HN LEU 571 -17.644 8.822 -1.927 150 HA LEU 571 HA LEU 571 -16.069 10.188 -3.954 151 HB2 LEU 571 HB2 LEU 571 -15.322 8.457 -1.611 152 HB3 LEU 571 HB1 LEU 571 -14.167 9.139 -2.716 153 HG LEU 571 HG LEU 571 -16.056 10.812 -1.083 154 HD11 LEU 571 HD11 LEU 571 -14.644 9.506 0.421 155 HD12 LEU 571 HD12 LEU 571 -14.173 11.205 0.423 156 HD13 LEU 571 HD13 LEU 571 -13.211 10.024 -0.465 157 HD21 LEU 571 HD21 LEU 571 -13.523 11.390 -2.586 158 HD22 LEU 571 HD22 LEU 571 -14.412 12.556 -1.608 159 HD23 LEU 571 HD23 LEU 571 -15.150 11.868 -3.056 160 HA PRO 572 HA PRO 572 -15.698 6.870 -6.865 161 HB2 PRO 572 HB2 PRO 572 -12.762 7.153 -6.411 162 HB3 PRO 572 HB1 PRO 572 -13.661 7.072 -7.927 163 HG2 PRO 572 HG2 PRO 572 -12.764 9.404 -7.018 164 HG3 PRO 572 HG1 PRO 572 -14.350 9.279 -7.800 165 HD2 PRO 572 HD2 PRO 572 -13.678 9.610 -4.924 166 HD3 PRO 572 HD1 PRO 572 -15.086 10.195 -5.829 167 HA PRO 573 HA PRO 573 -15.508 3.451 -4.171 168 HB2 PRO 573 HB2 PRO 573 -16.149 1.534 -5.898 169 HB3 PRO 573 HB1 PRO 573 -17.289 2.829 -5.503 170 HG2 PRO 573 HG2 PRO 573 -15.459 2.581 -7.867 171 HG3 PRO 573 HG1 PRO 573 -17.166 3.011 -7.821 172 HD2 PRO 573 HD2 PRO 573 -15.193 4.858 -7.995 173 HD3 PRO 573 HD1 PRO 573 -16.753 5.175 -7.214 174 H TYR 574 HN TYR 574 -13.154 3.995 -6.441 175 HA TYR 574 HA TYR 574 -11.783 1.609 -6.635 176 HB2 TYR 574 HB2 TYR 574 -11.252 3.663 -7.893 177 HB3 TYR 574 HB1 TYR 574 -10.497 4.312 -6.454 178 HD1 TYR 574 HD1 TYR 574 -10.337 1.181 -8.502 179 HD2 TYR 574 HD2 TYR 574 -8.185 4.198 -6.417 180 HE1 TYR 574 HE1 TYR 574 -8.219 0.141 -9.190 181 HE2 TYR 574 HE2 TYR 574 -6.063 3.166 -7.097 182 HH TYR 574 HH TYR 574 -5.874 0.761 -9.503 183 H PHE 575 HN PHE 575 -10.522 4.145 -4.522 184 HA PHE 575 HA PHE 575 -10.036 2.091 -2.486 185 HB2 PHE 575 HB2 PHE 575 -7.762 2.612 -2.302 186 HB3 PHE 575 HB1 PHE 575 -8.020 2.614 -4.039 187 HD1 PHE 575 HD2 PHE 575 -8.849 5.043 -4.914 188 HD2 PHE 575 HD1 PHE 575 -6.473 4.290 -1.468 189 HE1 PHE 575 HE2 PHE 575 -7.992 7.340 -5.012 190 HE2 PHE 575 HE1 PHE 575 -5.619 6.593 -1.552 191 HZ PHE 575 HZ PHE 575 -6.393 8.120 -3.320 192 H MET 576 HN MET 576 -11.523 4.840 -3.194 193 HA MET 576 HA MET 576 -10.533 6.515 -1.045 194 HB2 MET 576 HB2 MET 576 -12.943 6.926 -2.819 195 HB3 MET 576 HB1 MET 576 -12.238 8.118 -1.747 196 HG2 MET 576 HG2 MET 576 -10.086 7.768 -3.061 197 HG3 MET 576 HG1 MET 576 -11.120 6.983 -4.241 198 HE1 MET 576 HE1 MET 576 -10.431 10.379 -5.992 199 HE2 MET 576 HE2 MET 576 -10.530 8.632 -6.211 200 HE3 MET 576 HE3 MET 576 -9.334 9.315 -5.111 201 H LYS 577 HN LYS 577 -12.088 7.490 0.558 202 HA LYS 577 HA LYS 577 -12.767 5.469 2.324 203 HB2 LYS 577 HB2 LYS 577 -12.301 7.852 2.912 204 HB3 LYS 577 HB1 LYS 577 -13.914 8.259 2.342 205 HG2 LYS 577 HG2 LYS 577 -14.850 6.694 4.023 206 HG3 LYS 577 HG1 LYS 577 -13.216 6.445 4.642 207 HD2 LYS 577 HD2 LYS 577 -13.073 8.899 5.052 208 HD3 LYS 577 HD1 LYS 577 -14.773 9.025 4.593 209 HE2 LYS 577 HE2 LYS 577 -15.377 7.507 6.403 210 HE3 LYS 577 HE1 LYS 577 -13.680 7.354 6.852 211 HZ1 LYS 577 HZ1 LYS 577 -15.234 9.883 6.899 212 HZ2 LYS 577 HZ2 LYS 577 -13.630 9.689 7.391 213 HZ3 LYS 577 HZ3 LYS 577 -14.871 8.937 8.255 214 H GLY 578 HN GLY 578 -14.464 4.210 2.633 215 HA2 GLY 578 HA2 GLY 578 -16.789 3.862 2.935 216 HA3 GLY 578 HA1 GLY 578 -17.106 5.094 1.733 217 H SER 579 HN SER 579 -14.834 3.624 0.181 218 HA SER 579 HA SER 579 -16.554 2.139 -1.502 219 HB2 SER 579 HB2 SER 579 -13.537 2.053 -1.368 220 HB3 SER 579 HB1 SER 579 -14.549 1.605 -2.743 221 HG SER 579 HG SER 579 -13.864 4.124 -1.765 222 H ILE 580 HN ILE 580 -16.700 -0.090 -1.842 223 HA ILE 580 HA ILE 580 -15.992 -1.682 0.505 224 HB ILE 580 HB ILE 580 -17.861 -2.267 -1.791 225 HG12 ILE 580 HG12 ILE 580 -18.734 -0.651 -0.177 226 HG13 ILE 580 HG11 ILE 580 -19.598 -2.179 -0.041 227 HG21 ILE 580 HG21 ILE 580 -17.291 -3.973 0.626 228 HG22 ILE 580 HG22 ILE 580 -16.708 -4.298 -1.005 229 HG23 ILE 580 HG23 ILE 580 -18.440 -4.326 -0.666 230 HD11 ILE 580 HD11 ILE 580 -18.169 -2.748 1.904 231 HD12 ILE 580 HD12 ILE 580 -19.179 -1.325 2.150 232 HD13 ILE 580 HD13 ILE 580 -17.460 -1.134 1.804 233 H ILE 581 HN ILE 581 -14.133 -2.657 0.435 234 HA ILE 581 HA ILE 581 -12.947 -3.382 -2.140 235 HB ILE 581 HB ILE 581 -11.655 -3.565 0.580 236 HG12 ILE 581 HG12 ILE 581 -12.397 -1.268 0.287 237 HG13 ILE 581 HG11 ILE 581 -10.653 -1.353 0.124 238 HG21 ILE 581 HG21 ILE 581 -10.530 -3.345 -2.200 239 HG22 ILE 581 HG22 ILE 581 -10.518 -4.777 -1.168 240 HG23 ILE 581 HG23 ILE 581 -9.582 -3.352 -0.715 241 HD11 ILE 581 HD11 ILE 581 -12.671 -1.052 -2.080 242 HD12 ILE 581 HD12 ILE 581 -10.946 -1.327 -2.334 243 HD13 ILE 581 HD13 ILE 581 -11.492 0.136 -1.518 244 H GLN 582 HN GLN 582 -12.698 -5.470 -2.763 245 HA GLN 582 HA GLN 582 -13.764 -7.491 -0.922 246 HB2 GLN 582 HB2 GLN 582 -14.987 -7.349 -2.975 247 HB3 GLN 582 HB1 GLN 582 -13.542 -7.513 -3.922 248 HG2 GLN 582 HG2 GLN 582 -13.214 -9.780 -2.944 249 HG3 GLN 582 HG1 GLN 582 -14.780 -9.611 -2.154 250 HE21 GLN 582 HE21 GLN 582 -15.750 -11.293 -3.237 251 HE22 GLN 582 HE22 GLN 582 -16.116 -11.237 -4.930 252 H LEU 583 HN LEU 583 -12.408 -8.719 0.037 253 HA LEU 583 HA LEU 583 -9.663 -8.919 -0.844 254 HB2 LEU 583 HB2 LEU 583 -11.087 -10.137 1.514 255 HB3 LEU 583 HB1 LEU 583 -9.349 -10.050 1.288 256 HG LEU 583 HG LEU 583 -11.180 -7.671 1.592 257 HD11 LEU 583 HD11 LEU 583 -9.325 -9.044 3.506 258 HD12 LEU 583 HD12 LEU 583 -11.065 -8.804 3.671 259 HD13 LEU 583 HD13 LEU 583 -9.972 -7.420 3.766 260 HD21 LEU 583 HD21 LEU 583 -9.232 -7.206 0.192 261 HD22 LEU 583 HD22 LEU 583 -8.172 -7.850 1.449 262 HD23 LEU 583 HD23 LEU 583 -9.105 -6.387 1.751 263 H ALA 584 HN ALA 584 -8.603 -11.105 -0.819 264 HA ALA 584 HA ALA 584 -9.833 -12.537 -2.927 265 HB1 ALA 584 HB1 ALA 584 -7.897 -13.962 -2.912 266 HB2 ALA 584 HB2 ALA 584 -7.445 -13.394 -1.306 267 HB3 ALA 584 HB3 ALA 584 -7.391 -12.288 -2.681 268 H ASN 585 HN ASN 585 -9.999 -12.892 0.477 269 HA ASN 585 HA ASN 585 -10.775 -15.670 0.395 270 HB2 ASN 585 HB2 ASN 585 -11.062 -15.472 2.790 271 HB3 ASN 585 HB1 ASN 585 -9.536 -14.741 2.327 272 HD21 ASN 585 HD21 ASN 585 -10.979 -14.297 4.713 273 HD22 ASN 585 HD22 ASN 585 -11.397 -12.614 4.763 274 H GLY 586 HN GLY 586 -12.279 -12.754 -0.275 275 HA2 GLY 586 HA2 GLY 586 -14.398 -12.785 -1.302 276 HA3 GLY 586 HA1 GLY 586 -14.816 -14.201 -0.356 277 H GLU 587 HN GLU 587 -13.389 -11.827 1.619 278 HA GLU 587 HA GLU 587 -16.078 -11.119 2.534 279 HB2 GLU 587 HB2 GLU 587 -15.147 -10.516 4.636 280 HB3 GLU 587 HB1 GLU 587 -14.419 -12.045 4.176 281 HG2 GLU 587 HG2 GLU 587 -12.403 -10.936 3.517 282 HG3 GLU 587 HG1 GLU 587 -13.122 -9.361 3.860 283 H LEU 588 HN LEU 588 -16.623 -8.954 3.014 284 HA LEU 588 HA LEU 588 -15.247 -7.068 1.224 285 HB2 LEU 588 HB2 LEU 588 -18.171 -7.057 1.960 286 HB3 LEU 588 HB1 LEU 588 -17.382 -6.104 0.717 287 HG LEU 588 HG LEU 588 -17.777 -9.095 0.670 288 HD11 LEU 588 HD11 LEU 588 -19.285 -8.609 -1.197 289 HD12 LEU 588 HD12 LEU 588 -19.057 -6.882 -0.922 290 HD13 LEU 588 HD13 LEU 588 -19.834 -7.878 0.310 291 HD21 LEU 588 HD21 LEU 588 -16.427 -7.222 -1.264 292 HD22 LEU 588 HD22 LEU 588 -16.961 -8.845 -1.694 293 HD23 LEU 588 HD23 LEU 588 -15.734 -8.622 -0.448 294 H LYS 589 HN LYS 589 -14.509 -5.244 2.136 295 HA LYS 589 HA LYS 589 -15.634 -4.382 4.702 296 HB2 LYS 589 HB2 LYS 589 -12.736 -4.953 4.101 297 HB3 LYS 589 HB1 LYS 589 -13.254 -3.983 5.467 298 HG2 LYS 589 HG2 LYS 589 -14.503 -5.879 6.354 299 HG3 LYS 589 HG1 LYS 589 -14.005 -6.852 4.975 300 HD2 LYS 589 HD2 LYS 589 -12.672 -7.254 7.038 301 HD3 LYS 589 HD1 LYS 589 -11.709 -6.754 5.648 302 HE2 LYS 589 HE2 LYS 589 -11.384 -4.615 6.491 303 HE3 LYS 589 HE1 LYS 589 -12.724 -4.756 7.627 304 HZ1 LYS 589 HZ1 LYS 589 -11.416 -6.358 8.891 305 HZ2 LYS 589 HZ2 LYS 589 -10.603 -4.883 8.756 306 HZ3 LYS 589 HZ3 LYS 589 -10.127 -6.200 7.799 307 H LYS 590 HN LYS 590 -15.166 -2.179 5.244 308 HA LYS 590 HA LYS 590 -14.974 -0.424 2.984 309 HB2 LYS 590 HB2 LYS 590 -15.025 0.139 5.953 310 HB3 LYS 590 HB1 LYS 590 -15.026 1.383 4.717 311 HG2 LYS 590 HG2 LYS 590 -17.111 -0.698 4.562 312 HG3 LYS 590 HG1 LYS 590 -17.242 0.492 5.854 313 HD2 LYS 590 HD2 LYS 590 -17.140 2.284 4.195 314 HD3 LYS 590 HD1 LYS 590 -17.009 1.092 2.902 315 HE2 LYS 590 HE2 LYS 590 -19.182 0.185 3.506 316 HE3 LYS 590 HE1 LYS 590 -19.306 1.331 4.836 317 HZ1 LYS 590 HZ1 LYS 590 -20.562 2.019 2.855 318 HZ2 LYS 590 HZ2 LYS 590 -19.123 2.094 1.967 319 HZ3 LYS 590 HZ3 LYS 590 -19.369 3.139 3.275 320 H VAL 591 HN VAL 591 -13.308 1.006 2.520 321 HA VAL 591 HA VAL 591 -10.844 -0.130 2.313 322 HB VAL 591 HB VAL 591 -11.119 2.853 2.508 323 HG11 VAL 591 HG11 VAL 591 -9.416 1.052 0.804 324 HG12 VAL 591 HG12 VAL 591 -8.878 1.994 2.196 325 HG13 VAL 591 HG13 VAL 591 -9.431 2.813 0.731 326 HG21 VAL 591 HG21 VAL 591 -12.995 2.091 1.182 327 HG22 VAL 591 HG22 VAL 591 -11.919 1.111 0.187 328 HG23 VAL 591 HG23 VAL 591 -11.792 2.870 0.158 329 H GLU 592 HN GLU 592 -11.858 2.150 4.830 330 HA GLU 592 HA GLU 592 -9.230 2.629 5.778 331 HB2 GLU 592 HB2 GLU 592 -10.311 3.846 7.596 332 HB3 GLU 592 HB1 GLU 592 -11.027 4.260 6.044 333 HG2 GLU 592 HG2 GLU 592 -12.886 2.719 6.526 334 HG3 GLU 592 HG1 GLU 592 -12.179 2.396 8.107 335 H ASP 593 HN ASP 593 -11.527 0.149 6.480 336 HA ASP 593 HA ASP 593 -10.309 -0.383 9.091 337 HB2 ASP 593 HB2 ASP 593 -12.748 -0.235 9.042 338 HB3 ASP 593 HB1 ASP 593 -12.823 -1.486 7.807 339 H LEU 594 HN LEU 594 -9.890 -1.311 5.961 340 HA LEU 594 HA LEU 594 -9.408 -4.060 6.151 341 HB2 LEU 594 HB2 LEU 594 -8.123 -1.946 4.434 342 HB3 LEU 594 HB1 LEU 594 -7.896 -3.669 4.215 343 HG LEU 594 HG LEU 594 -10.619 -2.393 4.116 344 HD11 LEU 594 HD11 LEU 594 -9.185 -1.344 2.450 345 HD12 LEU 594 HD12 LEU 594 -10.416 -2.370 1.712 346 HD13 LEU 594 HD13 LEU 594 -8.751 -2.938 1.827 347 HD21 LEU 594 HD21 LEU 594 -11.121 -4.416 2.773 348 HD22 LEU 594 HD22 LEU 594 -10.646 -4.776 4.436 349 HD23 LEU 594 HD23 LEU 594 -9.494 -5.003 3.123 350 H LYS 595 HN LYS 595 -7.953 -5.144 7.219 351 HA LYS 595 HA LYS 595 -5.734 -3.687 8.464 352 HB2 LYS 595 HB2 LYS 595 -6.867 -6.411 9.123 353 HB3 LYS 595 HB1 LYS 595 -5.639 -5.551 10.038 354 HG2 LYS 595 HG2 LYS 595 -8.441 -4.542 9.621 355 HG3 LYS 595 HG1 LYS 595 -7.914 -5.459 11.032 356 HD2 LYS 595 HD2 LYS 595 -6.331 -3.727 11.611 357 HD3 LYS 595 HD1 LYS 595 -6.716 -2.839 10.137 358 HE2 LYS 595 HE2 LYS 595 -7.830 -1.873 12.089 359 HE3 LYS 595 HE1 LYS 595 -8.991 -2.490 10.918 360 HZ1 LYS 595 HZ1 LYS 595 -9.288 -4.449 12.268 361 HZ2 LYS 595 HZ2 LYS 595 -9.572 -3.068 13.202 362 HZ3 LYS 595 HZ3 LYS 595 -8.122 -3.918 13.370 363 H THR 596 HN THR 596 -3.654 -4.921 8.674 364 HA THR 596 HA THR 596 -2.745 -5.636 6.119 365 HB THR 596 HB THR 596 -1.226 -4.755 7.821 366 HG1 THR 596 HG1 THR 596 -0.751 -6.903 6.263 367 HG21 THR 596 HG21 THR 596 -0.455 -6.094 9.668 368 HG22 THR 596 HG22 THR 596 -1.471 -7.443 9.155 369 HG23 THR 596 HG23 THR 596 -2.212 -5.956 9.750 370 H GLU 597 HN GLU 597 -3.815 -7.613 8.842 371 HA GLU 597 HA GLU 597 -2.972 -10.110 7.867 372 HB2 GLU 597 HB2 GLU 597 -5.319 -9.506 9.650 373 HB3 GLU 597 HB1 GLU 597 -4.576 -11.081 9.435 374 HG2 GLU 597 HG2 GLU 597 -2.469 -10.157 10.349 375 HG3 GLU 597 HG1 GLU 597 -3.313 -8.643 10.665 376 H ASP 598 HN ASP 598 -5.717 -8.133 7.118 377 HA ASP 598 HA ASP 598 -7.341 -10.095 5.910 378 HB2 ASP 598 HB2 ASP 598 -7.166 -7.121 5.382 379 HB3 ASP 598 HB1 ASP 598 -8.405 -8.170 4.737 380 H PHE 599 HN PHE 599 -4.973 -7.826 4.575 381 HA PHE 599 HA PHE 599 -5.209 -8.853 1.927 382 HB2 PHE 599 HB2 PHE 599 -3.285 -6.952 3.238 383 HB3 PHE 599 HB1 PHE 599 -3.018 -7.525 1.596 384 HD1 PHE 599 HD2 PHE 599 -5.968 -6.310 3.546 385 HD2 PHE 599 HD1 PHE 599 -3.658 -6.045 -0.014 386 HE1 PHE 599 HE2 PHE 599 -7.523 -4.625 2.662 387 HE2 PHE 599 HE1 PHE 599 -5.214 -4.359 -0.899 388 HZ PHE 599 HZ PHE 599 -7.148 -3.645 0.440 389 H ILE 600 HN ILE 600 -2.961 -9.388 4.619 390 HA ILE 600 HA ILE 600 -1.077 -10.994 3.425 391 HB ILE 600 HB ILE 600 -2.373 -11.154 6.134 392 HG12 ILE 600 HG12 ILE 600 0.367 -10.256 5.235 393 HG13 ILE 600 HG11 ILE 600 -0.983 -9.193 5.587 394 HG21 ILE 600 HG21 ILE 600 -0.063 -12.798 5.111 395 HG22 ILE 600 HG22 ILE 600 -1.626 -13.394 5.685 396 HG23 ILE 600 HG23 ILE 600 -0.500 -12.634 6.813 397 HD11 ILE 600 HD11 ILE 600 0.608 -9.280 7.425 398 HD12 ILE 600 HD12 ILE 600 0.349 -11.020 7.565 399 HD13 ILE 600 HD13 ILE 600 -0.973 -9.901 7.896 400 H GLN 601 HN GLN 601 -4.085 -12.132 4.947 401 HA GLN 601 HA GLN 601 -3.921 -14.787 4.154 402 HB2 GLN 601 HB2 GLN 601 -6.333 -13.044 4.640 403 HB3 GLN 601 HB1 GLN 601 -6.423 -14.783 4.397 404 HG2 GLN 601 HG2 GLN 601 -5.084 -15.161 6.358 405 HG3 GLN 601 HG1 GLN 601 -4.882 -13.424 6.591 406 HE21 GLN 601 HE21 GLN 601 -6.626 -12.195 7.291 407 HE22 GLN 601 HE22 GLN 601 -8.026 -12.907 8.013 408 H SER 602 HN SER 602 -5.453 -12.051 2.504 409 HA SER 602 HA SER 602 -6.740 -13.448 0.502 410 HB2 SER 602 HB2 SER 602 -5.499 -10.694 0.358 411 HB3 SER 602 HB1 SER 602 -6.674 -11.340 -0.796 412 HG SER 602 HG SER 602 -7.051 -10.792 1.967 413 H ALA 603 HN ALA 603 -3.400 -12.205 0.480 414 HA ALA 603 HA ALA 603 -2.938 -13.108 -2.200 415 HB1 ALA 603 HB1 ALA 603 -1.781 -11.184 -0.956 416 HB2 ALA 603 HB2 ALA 603 -0.803 -12.216 -1.997 417 HB3 ALA 603 HB3 ALA 603 -0.775 -12.450 -0.249 418 H GLU 604 HN GLU 604 -2.512 -14.443 0.992 419 HA GLU 604 HA GLU 604 -0.769 -16.567 0.265 420 HB2 GLU 604 HB2 GLU 604 -2.658 -16.180 2.588 421 HB3 GLU 604 HB1 GLU 604 -1.527 -17.524 2.459 422 HG2 GLU 604 HG2 GLU 604 -0.641 -14.664 2.335 423 HG3 GLU 604 HG1 GLU 604 -0.828 -15.528 3.854 424 H ILE 605 HN ILE 605 -4.269 -16.262 0.544 425 HA ILE 605 HA ILE 605 -4.877 -19.002 0.133 426 HB ILE 605 HB ILE 605 -6.631 -16.591 -0.374 427 HG12 ILE 605 HG12 ILE 605 -6.458 -18.261 2.136 428 HG13 ILE 605 HG11 ILE 605 -5.560 -16.766 1.923 429 HG21 ILE 605 HG21 ILE 605 -8.483 -18.144 0.026 430 HG22 ILE 605 HG22 ILE 605 -7.333 -19.470 0.192 431 HG23 ILE 605 HG23 ILE 605 -7.508 -18.644 -1.356 432 HD11 ILE 605 HD11 ILE 605 -7.721 -15.590 1.579 433 HD12 ILE 605 HD12 ILE 605 -7.517 -16.294 3.187 434 HD13 ILE 605 HD13 ILE 605 -8.546 -17.095 1.995 435 H SER 606 HN SER 606 -5.014 -16.187 -2.049 436 HA SER 606 HA SER 606 -5.440 -17.959 -4.322 437 HB2 SER 606 HB2 SER 606 -5.359 -14.941 -4.120 438 HB3 SER 606 HB1 SER 606 -5.753 -15.843 -5.583 439 HG SER 606 HG SER 606 -7.387 -16.858 -3.969 440 H ASN 607 HN ASN 607 -3.735 -18.799 -5.323 441 HA ASN 607 HA ASN 607 -1.087 -18.062 -4.646 442 HB2 ASN 607 HB2 ASN 607 -2.084 -19.863 -6.850 443 HB3 ASN 607 HB1 ASN 607 -0.408 -19.740 -6.335 444 HD21 ASN 607 HD21 ASN 607 -1.175 -19.471 -3.501 445 HD22 ASN 607 HD22 ASN 607 -1.636 -21.059 -2.998 446 H ASP 608 HN ASP 608 -3.196 -17.025 -7.173 447 HA ASP 608 HA ASP 608 -1.236 -16.174 -9.042 448 HB2 ASP 608 HB2 ASP 608 -4.091 -15.308 -8.577 449 HB3 ASP 608 HB1 ASP 608 -3.093 -14.637 -9.862 450 H LEU 609 HN LEU 609 -2.347 -14.905 -6.052 451 HA LEU 609 HA LEU 609 -0.850 -12.425 -6.525 452 HB2 LEU 609 HB2 LEU 609 -2.797 -13.061 -4.318 453 HB3 LEU 609 HB1 LEU 609 -2.031 -11.514 -4.618 454 HG LEU 609 HG LEU 609 -4.097 -11.167 -5.487 455 HD11 LEU 609 HD11 LEU 609 -2.503 -10.647 -7.199 456 HD12 LEU 609 HD12 LEU 609 -4.007 -11.227 -7.913 457 HD13 LEU 609 HD13 LEU 609 -2.607 -12.293 -7.820 458 HD21 LEU 609 HD21 LEU 609 -4.133 -13.986 -6.494 459 HD22 LEU 609 HD22 LEU 609 -5.410 -12.801 -6.771 460 HD23 LEU 609 HD23 LEU 609 -5.039 -13.331 -5.131 461 H LYS 610 HN LYS 610 0.398 -11.651 -4.601 462 HA LYS 610 HA LYS 610 0.806 -13.344 -2.385 463 HB2 LYS 610 HB2 LYS 610 3.255 -13.747 -2.758 464 HB3 LYS 610 HB1 LYS 610 2.171 -14.707 -3.745 465 HG2 LYS 610 HG2 LYS 610 2.549 -12.891 -5.525 466 HG3 LYS 610 HG1 LYS 610 3.943 -12.442 -4.541 467 HD2 LYS 610 HD2 LYS 610 4.833 -13.941 -6.085 468 HD3 LYS 610 HD1 LYS 610 4.563 -14.939 -4.657 469 HE2 LYS 610 HE2 LYS 610 2.665 -14.733 -6.995 470 HE3 LYS 610 HE1 LYS 610 3.852 -16.014 -6.785 471 HZ1 LYS 610 HZ1 LYS 610 1.751 -16.797 -6.032 472 HZ2 LYS 610 HZ2 LYS 610 1.506 -15.444 -5.053 473 HZ3 LYS 610 HZ3 LYS 610 2.714 -16.563 -4.662 474 H ILE 611 HN ILE 611 1.810 -12.384 -0.731 475 HA ILE 611 HA ILE 611 2.135 -9.509 -0.884 476 HB ILE 611 HB ILE 611 2.504 -11.392 1.442 477 HG12 ILE 611 HG12 ILE 611 0.157 -11.050 0.303 478 HG13 ILE 611 HG11 ILE 611 0.302 -11.133 2.044 479 HG21 ILE 611 HG21 ILE 611 2.412 -9.452 2.857 480 HG22 ILE 611 HG22 ILE 611 2.195 -8.416 1.451 481 HG23 ILE 611 HG23 ILE 611 3.715 -9.289 1.672 482 HD11 ILE 611 HD11 ILE 611 -1.219 -9.361 1.264 483 HD12 ILE 611 HD12 ILE 611 0.143 -8.593 0.439 484 HD13 ILE 611 HD13 ILE 611 0.143 -8.729 2.198 485 H ASP 612 HN ASP 612 4.047 -8.437 -0.527 486 HA ASP 612 HA ASP 612 6.468 -10.064 -0.515 487 HB2 ASP 612 HB2 ASP 612 5.893 -7.324 -1.563 488 HB3 ASP 612 HB1 ASP 612 7.532 -7.838 -1.243 489 H SER 613 HN SER 613 8.321 -9.107 0.627 490 HA SER 613 HA SER 613 7.532 -7.386 2.866 491 HB2 SER 613 HB2 SER 613 9.423 -9.729 3.144 492 HB3 SER 613 HB1 SER 613 8.770 -8.718 4.433 493 HG SER 613 HG SER 613 6.688 -9.643 3.164 494 H SER 614 HN SER 614 8.551 -5.547 2.417 495 HA SER 614 HA SER 614 11.445 -5.672 1.919 496 HB2 SER 614 HB2 SER 614 9.578 -3.856 0.372 497 HB3 SER 614 HB1 SER 614 11.313 -4.060 0.134 498 HG SER 614 HG SER 614 10.427 -6.449 -0.082 499 H THR 615 HN THR 615 12.282 -4.702 3.653 500 HA THR 615 HA THR 615 10.795 -2.787 5.199 501 HB THR 615 HB THR 615 13.627 -3.792 5.478 502 HG1 THR 615 HG1 THR 615 12.227 -5.441 5.915 503 HG21 THR 615 HG21 THR 615 11.968 -2.119 7.380 504 HG22 THR 615 HG22 THR 615 13.441 -1.618 6.545 505 HG23 THR 615 HG23 THR 615 13.511 -2.878 7.776 506 H VAL 616 HN VAL 616 10.617 -0.712 4.550 507 HA VAL 616 HA VAL 616 12.466 0.630 2.939 508 HB VAL 616 HB VAL 616 10.355 1.626 3.065 509 HG11 VAL 616 HG11 VAL 616 9.347 2.460 5.146 510 HG12 VAL 616 HG12 VAL 616 10.676 1.736 6.047 511 HG13 VAL 616 HG13 VAL 616 9.564 0.710 5.144 512 HG21 VAL 616 HG21 VAL 616 12.282 3.291 4.671 513 HG22 VAL 616 HG22 VAL 616 10.799 3.907 3.943 514 HG23 VAL 616 HG23 VAL 616 12.092 3.282 2.917 515 H GLU 617 HN GLU 617 14.412 1.280 3.313 516 HA GLU 617 HA GLU 617 15.353 1.472 6.073 517 HB2 GLU 617 HB2 GLU 617 16.885 1.103 3.516 518 HB3 GLU 617 HB1 GLU 617 17.603 1.188 5.117 519 HG2 GLU 617 HG2 GLU 617 15.994 -0.773 5.635 520 HG3 GLU 617 HG1 GLU 617 15.954 -0.964 3.887 521 H ARG 618 HN ARG 618 14.628 3.336 3.311 522 HA ARG 618 HA ARG 618 15.498 5.724 4.656 523 HB2 ARG 618 HB2 ARG 618 17.579 5.020 3.576 524 HB3 ARG 618 HB1 ARG 618 16.765 4.952 2.020 525 HG2 ARG 618 HG2 ARG 618 16.475 7.327 1.993 526 HG3 ARG 618 HG1 ARG 618 17.042 7.464 3.660 527 HD2 ARG 618 HD2 ARG 618 18.678 6.541 1.298 528 HD3 ARG 618 HD1 ARG 618 18.783 8.120 2.079 529 HE ARG 618 HE ARG 618 19.199 6.310 4.090 530 HH11 ARG 618 HH11 ARG 618 20.737 7.032 1.028 531 HH12 ARG 618 HH12 ARG 618 22.293 6.451 1.529 532 HH21 ARG 618 HH21 ARG 618 21.242 5.557 4.757 533 HH22 ARG 618 HH22 ARG 618 22.582 5.621 3.659 534 H ILE 619 HN ILE 619 14.492 7.560 3.889 535 HA ILE 619 HA ILE 619 12.680 7.231 1.599 536 HB ILE 619 HB ILE 619 12.012 8.375 4.312 537 HG12 ILE 619 HG12 ILE 619 10.623 6.308 2.605 538 HG13 ILE 619 HG11 ILE 619 11.747 5.929 3.908 539 HG21 ILE 619 HG21 ILE 619 10.431 8.644 1.747 540 HG22 ILE 619 HG22 ILE 619 11.218 9.952 2.628 541 HG23 ILE 619 HG23 ILE 619 9.860 9.093 3.355 542 HD11 ILE 619 HD11 ILE 619 9.410 5.720 4.594 543 HD12 ILE 619 HD12 ILE 619 9.151 7.423 4.215 544 HD13 ILE 619 HD13 ILE 619 10.257 6.965 5.514 545 H GLU 620 HN GLU 620 12.902 8.780 0.139 546 HA GLU 620 HA GLU 620 14.265 11.254 0.974 547 HB2 GLU 620 HB2 GLU 620 14.642 9.903 -1.695 548 HB3 GLU 620 HB1 GLU 620 15.549 11.255 -1.042 549 HG2 GLU 620 HG2 GLU 620 16.412 9.750 0.730 550 HG3 GLU 620 HG1 GLU 620 15.602 8.407 -0.081 551 H ASP 621 HN ASP 621 13.510 13.139 0.134 552 HA ASP 621 HA ASP 621 10.928 13.054 -1.159 553 HB2 ASP 621 HB2 ASP 621 10.978 15.513 -0.921 554 HB3 ASP 621 HB1 ASP 621 11.299 14.700 0.607 555 H SER 622 HN SER 622 10.489 13.562 -3.244 556 HA SER 622 HA SER 622 12.824 13.901 -4.996 557 HB2 SER 622 HB2 SER 622 11.316 11.908 -5.345 558 HB3 SER 622 HB1 SER 622 10.024 13.029 -5.754 559 HG SER 622 HG SER 622 11.592 12.028 -7.458 560 H HIS 623 HN HIS 623 12.796 15.511 -6.614 561 HA HIS 623 HA HIS 623 11.181 17.824 -5.967 562 HB2 HIS 623 HB2 HIS 623 13.318 17.366 -8.047 563 HB3 HIS 623 HB1 HIS 623 12.446 18.884 -7.867 564 HD1 HIS 623 HD1 HIS 623 15.520 17.415 -6.918 565 HD2 HIS 623 HD2 HIS 623 12.727 19.797 -4.964 566 HE1 HIS 623 HE1 HIS 623 16.739 18.428 -4.969 567 HE2 HIS 623 HE2 HIS 623 15.074 19.987 -3.897 568 H SER 624 HN SER 624 9.338 16.396 -6.427 569 HA SER 624 HA SER 624 8.206 17.030 -9.009 570 HB2 SER 624 HB2 SER 624 8.417 14.154 -8.057 571 HB3 SER 624 HB1 SER 624 7.578 14.701 -9.505 572 HG SER 624 HG SER 624 9.909 15.660 -9.851 573 HA PRO 625 HA PRO 625 4.726 17.937 -6.492 574 HB2 PRO 625 HB2 PRO 625 3.147 16.530 -8.563 575 HB3 PRO 625 HB1 PRO 625 2.911 18.139 -7.879 576 HG2 PRO 625 HG2 PRO 625 3.966 17.832 -10.308 577 HG3 PRO 625 HG1 PRO 625 4.552 19.089 -9.207 578 HD2 PRO 625 HD2 PRO 625 5.821 16.516 -9.987 579 HD3 PRO 625 HD1 PRO 625 6.570 18.061 -9.544 580 H GLY 626 HN GLY 626 4.653 16.825 -4.701 581 HA2 GLY 626 HA2 GLY 626 3.903 15.303 -3.168 582 HA3 GLY 626 HA1 GLY 626 2.767 14.773 -4.394 583 H VAL 627 HN VAL 627 6.265 14.622 -4.814 584 HA VAL 627 HA VAL 627 5.951 11.695 -4.870 585 HB VAL 627 HB VAL 627 8.050 13.328 -6.300 586 HG11 VAL 627 HG11 VAL 627 7.328 10.403 -6.493 587 HG12 VAL 627 HG12 VAL 627 8.793 11.066 -5.773 588 HG13 VAL 627 HG13 VAL 627 8.507 11.239 -7.504 589 HG21 VAL 627 HG21 VAL 627 5.928 13.802 -7.280 590 HG22 VAL 627 HG22 VAL 627 5.479 12.097 -7.255 591 HG23 VAL 627 HG23 VAL 627 6.760 12.658 -8.337 592 H ALA 628 HN ALA 628 7.046 10.462 -3.566 593 HA ALA 628 HA ALA 628 9.623 11.357 -2.499 594 HB1 ALA 628 HB1 ALA 628 8.015 11.773 -0.702 595 HB2 ALA 628 HB2 ALA 628 9.090 10.435 -0.286 596 HB3 ALA 628 HB3 ALA 628 7.440 10.109 -0.822 597 H VAL 629 HN VAL 629 11.113 9.799 -2.580 598 HA VAL 629 HA VAL 629 10.238 7.250 -3.685 599 HB VAL 629 HB VAL 629 11.874 8.055 -5.099 600 HG11 VAL 629 HG11 VAL 629 13.933 9.136 -4.388 601 HG12 VAL 629 HG12 VAL 629 13.469 8.902 -2.702 602 HG13 VAL 629 HG13 VAL 629 12.510 9.958 -3.742 603 HG21 VAL 629 HG21 VAL 629 12.409 5.769 -4.377 604 HG22 VAL 629 HG22 VAL 629 13.459 6.428 -3.120 605 HG23 VAL 629 HG23 VAL 629 13.850 6.686 -4.821 606 H ILE 630 HN ILE 630 10.007 5.618 -2.449 607 HA ILE 630 HA ILE 630 11.233 5.581 0.186 608 HB ILE 630 HB ILE 630 9.366 3.493 -0.887 609 HG12 ILE 630 HG12 ILE 630 8.348 5.741 -1.274 610 HG13 ILE 630 HG11 ILE 630 7.469 4.764 -0.107 611 HG21 ILE 630 HG21 ILE 630 9.890 4.584 1.866 612 HG22 ILE 630 HG22 ILE 630 10.503 3.063 1.219 613 HG23 ILE 630 HG23 ILE 630 8.771 3.280 1.470 614 HD11 ILE 630 HD11 ILE 630 7.605 7.053 0.632 615 HD12 ILE 630 HD12 ILE 630 9.365 7.000 0.524 616 HD13 ILE 630 HD13 ILE 630 8.523 6.001 1.712 617 H GLN 631 HN GLN 631 13.050 4.469 0.535 618 HA GLN 631 HA GLN 631 13.956 2.584 -1.512 619 HB2 GLN 631 HB2 GLN 631 15.477 4.413 -0.873 620 HB3 GLN 631 HB1 GLN 631 15.458 3.839 0.789 621 HG2 GLN 631 HG2 GLN 631 16.562 1.817 0.176 622 HG3 GLN 631 HG1 GLN 631 16.428 2.208 -1.541 623 HE21 GLN 631 HE21 GLN 631 18.113 2.801 1.414 624 HE22 GLN 631 HE22 GLN 631 19.397 3.742 0.740 625 H PHE 632 HN PHE 632 13.447 0.548 -1.186 626 HA PHE 632 HA PHE 632 13.131 -0.439 1.571 627 HB2 PHE 632 HB2 PHE 632 12.078 -1.588 -1.018 628 HB3 PHE 632 HB1 PHE 632 11.792 -2.244 0.585 629 HD1 PHE 632 HD2 PHE 632 10.428 -0.916 2.210 630 HD2 PHE 632 HD1 PHE 632 10.723 0.095 -1.908 631 HE1 PHE 632 HE2 PHE 632 8.364 0.408 2.393 632 HE2 PHE 632 HE1 PHE 632 8.658 1.418 -1.737 633 HZ PHE 632 HZ PHE 632 7.473 1.574 0.416 634 H ALA 633 HN ALA 633 14.241 -2.168 2.292 635 HA ALA 633 HA ALA 633 16.245 -3.387 0.558 636 HB1 ALA 633 HB1 ALA 633 16.986 -4.507 2.626 637 HB2 ALA 633 HB2 ALA 633 15.657 -3.744 3.498 638 HB3 ALA 633 HB3 ALA 633 16.938 -2.753 2.801 639 H VAL 634 HN VAL 634 15.296 -4.814 -0.782 640 HA VAL 634 HA VAL 634 12.961 -6.292 0.069 641 HB VAL 634 HB VAL 634 14.425 -6.344 -2.573 642 HG11 VAL 634 HG11 VAL 634 11.675 -7.348 -1.831 643 HG12 VAL 634 HG12 VAL 634 13.077 -8.351 -2.200 644 HG13 VAL 634 HG13 VAL 634 12.366 -7.333 -3.453 645 HG21 VAL 634 HG21 VAL 634 13.580 -4.132 -2.088 646 HG22 VAL 634 HG22 VAL 634 12.001 -4.795 -1.664 647 HG23 VAL 634 HG23 VAL 634 12.577 -4.883 -3.330 648 H GLY 635 HN GLY 635 12.892 -8.310 0.756 649 HA2 GLY 635 HA2 GLY 635 13.403 -10.548 0.971 650 HA3 GLY 635 HA1 GLY 635 14.730 -10.319 -0.157 651 H GLU 636 HN GLU 636 15.355 -11.956 1.760 652 HA GLU 636 HA GLU 636 16.306 -10.688 4.130 653 HB2 GLU 636 HB2 GLU 636 16.921 -13.391 2.971 654 HB3 GLU 636 HB1 GLU 636 17.446 -12.843 4.549 655 HG2 GLU 636 HG2 GLU 636 14.919 -12.414 4.940 656 HG3 GLU 636 HG1 GLU 636 14.721 -13.556 3.612 657 H HIS 637 HN HIS 637 17.591 -11.233 0.967 658 HA HIS 637 HA HIS 637 20.312 -10.642 1.695 659 HB2 HIS 637 HB2 HIS 637 18.847 -10.835 -0.923 660 HB3 HIS 637 HB1 HIS 637 20.473 -10.168 -0.857 661 HD1 HIS 637 HD1 HIS 637 18.884 -13.206 -1.574 662 HD2 HIS 637 HD2 HIS 637 22.207 -12.184 0.694 663 HE1 HIS 637 HE1 HIS 637 20.247 -15.309 -1.390 664 HE2 HIS 637 HE2 HIS 637 22.136 -14.710 0.168 665 H ARG 638 HN ARG 638 17.503 -8.869 1.495 666 HA ARG 638 HA ARG 638 17.039 -6.668 1.744 667 HB2 ARG 638 HB2 ARG 638 19.787 -6.762 2.997 668 HB3 ARG 638 HB1 ARG 638 18.648 -5.437 3.191 669 HG2 ARG 638 HG2 ARG 638 17.072 -6.907 4.292 670 HG3 ARG 638 HG1 ARG 638 18.139 -8.286 4.024 671 HD2 ARG 638 HD2 ARG 638 19.843 -7.243 5.427 672 HD3 ARG 638 HD1 ARG 638 18.788 -5.853 5.684 673 HE ARG 638 HE ARG 638 17.421 -8.181 6.456 674 HH11 ARG 638 HH11 ARG 638 20.155 -6.247 7.473 675 HH12 ARG 638 HH12 ARG 638 19.965 -6.625 9.154 676 HH21 ARG 638 HH21 ARG 638 17.165 -8.689 8.667 677 HH22 ARG 638 HH22 ARG 638 18.260 -8.014 9.833 678 H ALA 639 HN ALA 639 17.320 -6.724 -0.701 679 HA ALA 639 HA ALA 639 19.556 -5.108 -1.636 680 HB1 ALA 639 HB1 ALA 639 18.704 -5.537 -3.864 681 HB2 ALA 639 HB2 ALA 639 17.274 -6.319 -3.187 682 HB3 ALA 639 HB3 ALA 639 18.868 -7.047 -2.967 683 H GLN 640 HN GLN 640 19.416 -2.997 -1.533 684 HA GLN 640 HA GLN 640 17.062 -1.616 -0.954 685 HB2 GLN 640 HB2 GLN 640 19.785 -0.754 -1.799 686 HB3 GLN 640 HB1 GLN 640 18.501 0.384 -1.400 687 HG2 GLN 640 HG2 GLN 640 19.791 0.049 0.517 688 HG3 GLN 640 HG1 GLN 640 18.264 -0.744 0.787 689 HE21 GLN 640 HE21 GLN 640 19.068 -2.084 2.381 690 HE22 GLN 640 HE22 GLN 640 20.172 -3.377 2.020 691 H VAL 641 HN VAL 641 15.479 -1.260 -2.224 692 HA VAL 641 HA VAL 641 15.979 -0.425 -5.010 693 HB VAL 641 HB VAL 641 13.547 -1.879 -3.938 694 HG11 VAL 641 HG11 VAL 641 14.182 -0.969 -6.742 695 HG12 VAL 641 HG12 VAL 641 12.979 -0.252 -5.672 696 HG13 VAL 641 HG13 VAL 641 12.772 -1.906 -6.249 697 HG21 VAL 641 HG21 VAL 641 15.465 -3.359 -4.191 698 HG22 VAL 641 HG22 VAL 641 15.697 -2.793 -5.845 699 HG23 VAL 641 HG23 VAL 641 14.247 -3.702 -5.419 700 H SER 642 HN SER 642 15.478 1.632 -5.350 701 HA SER 642 HA SER 642 13.746 2.974 -3.403 702 HB2 SER 642 HB2 SER 642 14.854 5.067 -4.385 703 HB3 SER 642 HB1 SER 642 15.876 3.999 -3.424 704 HG SER 642 HG SER 642 16.832 3.247 -5.248 705 H VAL 643 HN VAL 643 11.739 3.412 -4.006 706 HA VAL 643 HA VAL 643 11.178 3.717 -6.872 707 HB VAL 643 HB VAL 643 10.229 1.669 -6.037 708 HG11 VAL 643 HG11 VAL 643 8.854 3.335 -3.938 709 HG12 VAL 643 HG12 VAL 643 10.148 2.167 -3.667 710 HG13 VAL 643 HG13 VAL 643 8.570 1.620 -4.234 711 HG21 VAL 643 HG21 VAL 643 8.914 2.867 -7.663 712 HG22 VAL 643 HG22 VAL 643 8.122 3.780 -6.380 713 HG23 VAL 643 HG23 VAL 643 7.857 2.041 -6.518 714 H GLU 644 HN GLU 644 10.485 5.672 -7.470 715 HA GLU 644 HA GLU 644 9.739 7.672 -5.535 716 HB2 GLU 644 HB2 GLU 644 9.788 7.676 -8.557 717 HB3 GLU 644 HB1 GLU 644 9.317 9.069 -7.596 718 HG2 GLU 644 HG2 GLU 644 11.517 9.151 -6.592 719 HG3 GLU 644 HG1 GLU 644 12.002 7.712 -7.489 720 H VAL 645 HN VAL 645 7.780 7.338 -4.578 721 HA VAL 645 HA VAL 645 5.471 6.782 -6.300 722 HB VAL 645 HB VAL 645 5.793 6.392 -3.323 723 HG11 VAL 645 HG11 VAL 645 3.687 5.290 -3.370 724 HG12 VAL 645 HG12 VAL 645 3.599 5.451 -5.121 725 HG13 VAL 645 HG13 VAL 645 3.520 6.890 -4.099 726 HG21 VAL 645 HG21 VAL 645 5.770 4.336 -5.526 727 HG22 VAL 645 HG22 VAL 645 5.841 4.000 -3.797 728 HG23 VAL 645 HG23 VAL 645 7.181 4.827 -4.590 729 H LEU 646 HN LEU 646 3.474 7.926 -5.689 730 HA LEU 646 HA LEU 646 3.972 10.624 -4.850 731 HB2 LEU 646 HB2 LEU 646 1.366 9.237 -5.441 732 HB3 LEU 646 HB1 LEU 646 1.513 10.934 -5.021 733 HG LEU 646 HG LEU 646 2.206 9.539 -7.550 734 HD11 LEU 646 HD11 LEU 646 1.131 11.454 -8.540 735 HD12 LEU 646 HD12 LEU 646 1.065 12.268 -6.977 736 HD13 LEU 646 HD13 LEU 646 0.101 10.813 -7.258 737 HD21 LEU 646 HD21 LEU 646 4.320 10.504 -6.942 738 HD22 LEU 646 HD22 LEU 646 3.543 12.048 -6.587 739 HD23 LEU 646 HD23 LEU 646 3.589 11.445 -8.245 740 H VAL 647 HN VAL 647 3.420 11.553 -2.952 741 HA VAL 647 HA VAL 647 3.489 9.859 -0.673 742 HB VAL 647 HB VAL 647 3.300 11.926 0.650 743 HG11 VAL 647 HG11 VAL 647 5.225 12.083 -1.663 744 HG12 VAL 647 HG12 VAL 647 5.480 11.235 -0.138 745 HG13 VAL 647 HG13 VAL 647 5.360 12.995 -0.159 746 HG21 VAL 647 HG21 VAL 647 2.888 13.219 -2.043 747 HG22 VAL 647 HG22 VAL 647 3.251 14.099 -0.556 748 HG23 VAL 647 HG23 VAL 647 1.752 13.179 -0.693 749 H GLU 648 HN GLU 648 0.936 11.258 -2.495 750 HA GLU 648 HA GLU 648 -1.025 11.088 -0.397 751 HB2 GLU 648 HB2 GLU 648 -2.636 11.652 -2.220 752 HB3 GLU 648 HB1 GLU 648 -1.325 12.808 -2.042 753 HG2 GLU 648 HG2 GLU 648 -0.170 11.563 -3.924 754 HG3 GLU 648 HG1 GLU 648 -1.710 10.748 -4.189 755 H TYR 649 HN TYR 649 0.480 8.894 -2.405 756 HA TYR 649 HA TYR 649 -1.738 7.040 -2.548 757 HB2 TYR 649 HB2 TYR 649 1.052 7.117 -3.609 758 HB3 TYR 649 HB1 TYR 649 0.274 5.554 -3.403 759 HD1 TYR 649 HD2 TYR 649 -0.465 8.918 -4.858 760 HD2 TYR 649 HD1 TYR 649 -0.930 4.702 -5.173 761 HE1 TYR 649 HE2 TYR 649 -1.633 9.213 -7.001 762 HE2 TYR 649 HE1 TYR 649 -2.103 4.985 -7.314 763 HH TYR 649 HH TYR 649 -2.061 7.849 -9.061 764 HA PRO 650 HA PRO 650 -0.594 5.366 1.358 765 HB2 PRO 650 HB2 PRO 650 -2.521 3.471 1.489 766 HB3 PRO 650 HB1 PRO 650 -2.837 5.187 1.732 767 HG2 PRO 650 HG2 PRO 650 -3.492 3.455 -0.554 768 HG3 PRO 650 HG1 PRO 650 -4.266 4.953 -0.015 769 HD2 PRO 650 HD2 PRO 650 -2.417 4.623 -2.128 770 HD3 PRO 650 HD1 PRO 650 -3.072 6.146 -1.506 771 H PHE 651 HN PHE 651 0.087 3.396 2.348 772 HA PHE 651 HA PHE 651 0.901 1.251 0.524 773 HB2 PHE 651 HB2 PHE 651 2.658 3.017 2.116 774 HB3 PHE 651 HB1 PHE 651 3.005 1.296 2.249 775 HD1 PHE 651 HD2 PHE 651 3.538 -0.004 0.203 776 HD2 PHE 651 HD1 PHE 651 3.265 4.242 0.197 777 HE1 PHE 651 HE2 PHE 651 4.817 0.070 -1.897 778 HE2 PHE 651 HE1 PHE 651 4.544 4.322 -1.903 779 HZ PHE 651 HZ PHE 651 5.321 2.234 -2.952 780 H PHE 652 HN PHE 652 -0.133 -0.481 1.294 781 HA PHE 652 HA PHE 652 -0.712 -0.927 4.030 782 HB2 PHE 652 HB2 PHE 652 -1.133 -2.299 1.546 783 HB3 PHE 652 HB1 PHE 652 -0.439 -3.427 2.706 784 HD1 PHE 652 HD2 PHE 652 -1.532 -3.547 5.012 785 HD2 PHE 652 HD1 PHE 652 -3.399 -1.816 1.606 786 HE1 PHE 652 HE2 PHE 652 -3.720 -3.811 6.086 787 HE2 PHE 652 HE1 PHE 652 -5.598 -2.068 2.678 788 HZ PHE 652 HZ PHE 652 -5.761 -3.068 4.923 789 H VAL 653 HN VAL 653 0.537 -1.878 5.626 790 HA VAL 653 HA VAL 653 3.300 -2.452 4.773 791 HB VAL 653 HB VAL 653 2.579 -1.447 7.517 792 HG11 VAL 653 HG11 VAL 653 5.122 -0.804 6.174 793 HG12 VAL 653 HG12 VAL 653 4.878 -2.492 6.605 794 HG13 VAL 653 HG13 VAL 653 4.812 -1.249 7.859 795 HG21 VAL 653 HG21 VAL 653 3.350 0.789 6.702 796 HG22 VAL 653 HG22 VAL 653 1.769 0.272 6.096 797 HG23 VAL 653 HG23 VAL 653 3.194 0.166 5.058 798 H PHE 654 HN PHE 654 4.247 -4.261 5.404 799 HA PHE 654 HA PHE 654 2.689 -6.534 5.748 800 HB2 PHE 654 HB2 PHE 654 4.871 -6.406 4.607 801 HB3 PHE 654 HB1 PHE 654 5.696 -6.229 6.154 802 HD1 PHE 654 HD2 PHE 654 3.247 -8.516 4.479 803 HD2 PHE 654 HD1 PHE 654 6.596 -8.138 7.075 804 HE1 PHE 654 HE2 PHE 654 3.381 -10.965 4.656 805 HE2 PHE 654 HE1 PHE 654 6.734 -10.586 7.259 806 HZ PHE 654 HZ PHE 654 5.124 -12.004 6.048 807 H GLY 655 HN GLY 655 1.455 -6.249 7.715 808 HA2 GLY 655 HA2 GLY 655 1.147 -7.181 9.854 809 HA3 GLY 655 HA1 GLY 655 2.889 -7.323 10.022 810 H GLN 656 HN GLN 656 2.727 -4.370 8.920 811 HA GLN 656 HA GLN 656 2.860 -3.197 11.547 812 HB2 GLN 656 HB2 GLN 656 3.546 -2.247 8.778 813 HB3 GLN 656 HB1 GLN 656 3.532 -1.157 10.142 814 HG2 GLN 656 HG2 GLN 656 5.758 -1.794 9.906 815 HG3 GLN 656 HG1 GLN 656 5.152 -2.782 11.209 816 HE21 GLN 656 HE21 GLN 656 4.410 -3.280 7.919 817 HE22 GLN 656 HE22 GLN 656 5.241 -4.780 7.667 818 H GLY 657 HN GLY 657 0.875 -2.940 8.607 819 HA2 GLY 657 HA2 GLY 657 -1.544 -2.787 9.425 820 HA3 GLY 657 HA1 GLY 657 -1.007 -1.294 10.170 821 H TRP 658 HN TRP 658 -2.565 -0.154 9.034 822 HA TRP 658 HA TRP 658 -2.362 -0.088 6.112 823 HB2 TRP 658 HB2 TRP 658 -4.563 -0.541 7.317 824 HB3 TRP 658 HB1 TRP 658 -4.519 1.124 7.862 825 HD1 TRP 658 HD1 TRP 658 -6.953 1.090 6.562 826 HE1 TRP 658 HE1 TRP 658 -7.509 1.704 4.135 827 HE3 TRP 658 HE3 TRP 658 -2.270 0.666 4.478 828 HZ2 TRP 658 HZ2 TRP 658 -6.177 1.987 1.687 829 HZ3 TRP 658 HZ3 TRP 658 -2.032 1.126 2.078 830 HH2 TRP 658 HH2 TRP 658 -3.937 1.773 0.717 831 H SER 659 HN SER 659 -0.843 1.389 5.516 832 HA SER 659 HA SER 659 -0.791 3.949 6.963 833 HB2 SER 659 HB2 SER 659 1.584 2.324 6.021 834 HB3 SER 659 HB1 SER 659 1.677 3.910 6.786 835 HG SER 659 HG SER 659 1.999 2.224 8.292 836 H SER 660 HN SER 660 0.411 5.652 5.776 837 HA SER 660 HA SER 660 0.628 5.322 2.891 838 HB2 SER 660 HB2 SER 660 -1.620 6.228 3.127 839 HB3 SER 660 HB1 SER 660 -1.033 7.483 4.217 840 HG SER 660 HG SER 660 -1.325 8.203 2.028 841 H CYS 661 HN CYS 661 2.036 6.839 1.938 842 HA CYS 661 HA CYS 661 4.219 7.659 3.496 843 HB2 CYS 661 HB2 CYS 661 3.358 8.684 0.786 844 HB3 CYS 661 HB1 CYS 661 4.972 8.822 1.476 845 HG CYS 661 HG CYS 661 3.726 6.427 -0.354 846 H CYS 662 HN CYS 662 1.186 9.117 2.823 847 HA CYS 662 HA CYS 662 1.795 11.275 4.629 848 HB2 CYS 662 HB2 CYS 662 2.537 12.228 2.479 849 HB3 CYS 662 HB1 CYS 662 0.953 11.896 1.787 850 HG CYS 662 HG CYS 662 1.189 13.880 4.541 851 HA PRO 663 HA PRO 663 -2.403 9.439 5.101 852 HB2 PRO 663 HB2 PRO 663 -1.864 10.537 7.806 853 HB3 PRO 663 HB1 PRO 663 -2.491 8.953 7.338 854 HG2 PRO 663 HG2 PRO 663 0.006 9.205 8.214 855 HG3 PRO 663 HG1 PRO 663 -0.371 8.114 6.866 856 HD2 PRO 663 HD2 PRO 663 0.832 10.856 6.807 857 HD3 PRO 663 HD1 PRO 663 1.277 9.416 5.864 858 H GLU 664 HN GLU 664 -0.963 12.469 5.986 859 HA GLU 664 HA GLU 664 -3.130 14.102 6.453 860 HB2 GLU 664 HB2 GLU 664 -0.702 14.792 4.776 861 HB3 GLU 664 HB1 GLU 664 -1.773 15.940 5.556 862 HG2 GLU 664 HG2 GLU 664 0.218 15.804 6.822 863 HG3 GLU 664 HG1 GLU 664 -1.060 15.023 7.747 864 H ARG 665 HN ARG 665 -1.481 13.823 3.342 865 HA ARG 665 HA ARG 665 -3.524 15.076 1.873 866 HB2 ARG 665 HB2 ARG 665 -0.915 14.234 1.398 867 HB3 ARG 665 HB1 ARG 665 -1.883 13.289 0.274 868 HG2 ARG 665 HG2 ARG 665 -2.705 15.191 -0.801 869 HG3 ARG 665 HG1 ARG 665 -2.197 16.257 0.510 870 HD2 ARG 665 HD2 ARG 665 -0.355 14.729 -1.324 871 HD3 ARG 665 HD1 ARG 665 -0.731 16.447 -1.450 872 HE ARG 665 HE ARG 665 0.253 15.788 1.137 873 HH11 ARG 665 HH11 ARG 665 1.270 16.395 -2.154 874 HH12 ARG 665 HH12 ARG 665 2.864 16.906 -1.702 875 HH21 ARG 665 HH21 ARG 665 2.355 16.441 1.740 876 HH22 ARG 665 HH22 ARG 665 3.484 16.926 0.516 877 H THR 666 HN THR 666 -2.821 11.607 2.377 878 HA THR 666 HA THR 666 -4.674 10.625 0.521 879 HB THR 666 HB THR 666 -3.891 9.285 3.121 880 HG1 THR 666 HG1 THR 666 -2.632 9.126 0.559 881 HG21 THR 666 HG21 THR 666 -4.311 7.200 1.923 882 HG22 THR 666 HG22 THR 666 -4.745 8.096 0.468 883 HG23 THR 666 HG23 THR 666 -5.760 8.205 1.905 884 H SER 667 HN SER 667 -5.086 11.478 3.957 885 HA SER 667 HA SER 667 -7.881 10.804 3.904 886 HB2 SER 667 HB2 SER 667 -6.499 10.645 5.963 887 HB3 SER 667 HB1 SER 667 -6.376 12.397 5.963 888 HG SER 667 HG SER 667 -8.596 12.535 6.265 889 H GLN 668 HN GLN 668 -5.956 13.683 3.410 890 HA GLN 668 HA GLN 668 -7.913 15.663 3.544 891 HB2 GLN 668 HB2 GLN 668 -5.333 15.308 2.104 892 HB3 GLN 668 HB1 GLN 668 -6.348 16.659 1.651 893 HG2 GLN 668 HG2 GLN 668 -6.268 17.524 3.854 894 HG3 GLN 668 HG1 GLN 668 -5.401 16.115 4.443 895 HE21 GLN 668 HE21 GLN 668 -3.671 17.338 5.170 896 HE22 GLN 668 HE22 GLN 668 -2.535 18.063 4.085 897 H LEU 669 HN LEU 669 -6.829 13.743 0.768 898 HA LEU 669 HA LEU 669 -8.732 15.179 -0.921 899 HB2 LEU 669 HB2 LEU 669 -6.665 13.211 -1.842 900 HB3 LEU 669 HB1 LEU 669 -7.402 14.519 -2.742 901 HG LEU 669 HG LEU 669 -5.402 14.794 -0.504 902 HD11 LEU 669 HD11 LEU 669 -3.980 15.755 -2.296 903 HD12 LEU 669 HD12 LEU 669 -5.192 15.241 -3.470 904 HD13 LEU 669 HD13 LEU 669 -4.339 14.041 -2.496 905 HD21 LEU 669 HD21 LEU 669 -6.869 16.656 -0.329 906 HD22 LEU 669 HD22 LEU 669 -6.870 16.897 -2.080 907 HD23 LEU 669 HD23 LEU 669 -5.408 17.214 -1.147 908 H PHE 670 HN PHE 670 -7.990 11.979 0.237 909 HA PHE 670 HA PHE 670 -10.167 10.871 -1.398 910 HB2 PHE 670 HB2 PHE 670 -7.964 9.346 0.007 911 HB3 PHE 670 HB1 PHE 670 -9.064 8.737 -1.220 912 HD1 PHE 670 HD1 PHE 670 -9.003 10.380 -3.428 913 HD2 PHE 670 HD2 PHE 670 -5.825 9.657 -0.698 914 HE1 PHE 670 HE1 PHE 670 -7.375 10.997 -5.167 915 HE2 PHE 670 HE2 PHE 670 -4.190 10.273 -2.427 916 HZ PHE 670 HZ PHE 670 -4.963 10.947 -4.667 917 H ASP 671 HN ASP 671 -9.680 12.076 1.557 918 HA ASP 671 HA ASP 671 -10.610 11.909 3.614 919 HB2 ASP 671 HB2 ASP 671 -12.695 10.807 1.810 920 HB3 ASP 671 HB1 ASP 671 -12.906 10.534 3.535 921 H LEU 672 HN LEU 672 -8.830 9.710 2.591 922 HA LEU 672 HA LEU 672 -9.889 7.433 4.097 923 HB2 LEU 672 HB2 LEU 672 -9.345 7.018 1.751 924 HB3 LEU 672 HB1 LEU 672 -7.699 7.555 2.016 925 HG LEU 672 HG LEU 672 -7.485 5.648 3.683 926 HD11 LEU 672 HD11 LEU 672 -9.995 4.687 2.315 927 HD12 LEU 672 HD12 LEU 672 -9.927 5.325 3.959 928 HD13 LEU 672 HD13 LEU 672 -9.063 3.842 3.554 929 HD21 LEU 672 HD21 LEU 672 -8.017 4.958 0.796 930 HD22 LEU 672 HD22 LEU 672 -7.100 3.981 1.943 931 HD23 LEU 672 HD23 LEU 672 -6.497 5.565 1.455 932 HA PRO 673 HA PRO 673 -6.862 8.599 7.147 933 HB2 PRO 673 HB2 PRO 673 -7.546 6.744 9.005 934 HB3 PRO 673 HB1 PRO 673 -8.471 8.221 8.733 935 HG2 PRO 673 HG2 PRO 673 -9.043 5.440 7.866 936 HG3 PRO 673 HG1 PRO 673 -10.166 6.720 8.350 937 HD2 PRO 673 HD2 PRO 673 -9.623 5.972 5.744 938 HD3 PRO 673 HD1 PRO 673 -10.317 7.527 6.224 939 H CYS 674 HN CYS 674 -4.874 7.928 7.662 940 HA CYS 674 HA CYS 674 -4.050 5.180 7.124 941 HB2 CYS 674 HB2 CYS 674 -3.088 7.618 5.657 942 HB3 CYS 674 HB1 CYS 674 -2.052 6.204 5.787 943 HG CYS 674 HG CYS 674 -5.103 5.394 4.754 944 H SER 675 HN SER 675 -2.118 4.597 8.114 945 HA SER 675 HA SER 675 -1.168 6.339 10.245 946 HB2 SER 675 HB2 SER 675 -0.176 3.586 9.440 947 HB3 SER 675 HB1 SER 675 0.119 4.413 10.970 948 HG SER 675 HG SER 675 -2.276 3.279 9.990 949 H LYS 676 HN LYS 676 1.178 6.900 10.362 950 HA LYS 676 HA LYS 676 2.026 7.772 7.783 951 HB2 LYS 676 HB2 LYS 676 2.512 9.156 9.716 952 HB3 LYS 676 HB1 LYS 676 3.490 7.875 10.422 953 HG2 LYS 676 HG2 LYS 676 4.915 9.551 9.431 954 HG3 LYS 676 HG1 LYS 676 5.041 8.048 8.525 955 HD2 LYS 676 HD2 LYS 676 4.888 9.677 6.858 956 HD3 LYS 676 HD1 LYS 676 3.244 9.057 6.987 957 HE2 LYS 676 HE2 LYS 676 2.530 10.926 8.215 958 HE3 LYS 676 HE1 LYS 676 4.183 11.452 8.518 959 HZ1 LYS 676 HZ1 LYS 676 4.403 12.293 6.413 960 HZ2 LYS 676 HZ2 LYS 676 2.757 12.609 6.689 961 HZ3 LYS 676 HZ3 LYS 676 3.226 11.280 5.749 962 H LEU 677 HN LEU 677 2.804 6.438 6.342 963 HA LEU 677 HA LEU 677 4.441 4.176 7.017 964 HB2 LEU 677 HB2 LEU 677 2.942 4.180 5.047 965 HB3 LEU 677 HB1 LEU 677 3.876 5.478 4.341 966 HG LEU 677 HG LEU 677 4.235 3.070 3.484 967 HD11 LEU 677 HD11 LEU 677 6.609 4.739 4.291 968 HD12 LEU 677 HD12 LEU 677 5.646 4.936 2.826 969 HD13 LEU 677 HD13 LEU 677 6.603 3.474 3.062 970 HD21 LEU 677 HD21 LEU 677 4.452 2.048 5.704 971 HD22 LEU 677 HD22 LEU 677 5.942 2.954 5.962 972 HD23 LEU 677 HD23 LEU 677 5.857 1.742 4.683 973 H SER 678 HN SER 678 6.427 4.489 7.732 974 HA SER 678 HA SER 678 8.117 6.376 6.276 975 HB2 SER 678 HB2 SER 678 7.362 7.483 8.366 976 HB3 SER 678 HB1 SER 678 8.080 6.179 9.299 977 HG SER 678 HG SER 678 9.429 8.062 9.073 978 H VAL 679 HN VAL 679 10.434 6.061 7.457 979 HA VAL 679 HA VAL 679 11.312 3.623 6.393 980 HB VAL 679 HB VAL 679 12.770 5.456 6.294 981 HG11 VAL 679 HG11 VAL 679 11.947 6.838 8.030 982 HG12 VAL 679 HG12 VAL 679 13.670 6.583 8.314 983 HG13 VAL 679 HG13 VAL 679 12.480 5.700 9.272 984 HG21 VAL 679 HG21 VAL 679 14.815 4.678 7.325 985 HG22 VAL 679 HG22 VAL 679 13.890 3.311 6.701 986 HG23 VAL 679 HG23 VAL 679 13.893 3.656 8.430 987 H GLY 680 HN GLY 680 12.022 1.757 7.317 988 HA2 GLY 680 HA2 GLY 680 12.460 0.292 9.128 989 HA3 GLY 680 HA1 GLY 680 11.556 1.360 10.181 990 H ASP 681 HN ASP 681 9.658 1.193 7.540 991 HA ASP 681 HA ASP 681 8.122 -1.016 8.724 992 HB2 ASP 681 HB2 ASP 681 7.189 1.288 6.985 993 HB3 ASP 681 HB1 ASP 681 6.179 -0.039 7.502 994 H VAL 682 HN VAL 682 8.033 -2.902 7.676 995 HA VAL 682 HA VAL 682 9.028 -3.159 5.035 996 HB VAL 682 HB VAL 682 9.430 -5.071 6.282 997 HG11 VAL 682 HG11 VAL 682 8.081 -4.734 8.130 998 HG12 VAL 682 HG12 VAL 682 7.655 -6.313 7.464 999 HG13 VAL 682 HG13 VAL 682 6.628 -4.917 7.165 1000 HG21 VAL 682 HG21 VAL 682 7.953 -6.887 5.349 1001 HG22 VAL 682 HG22 VAL 682 8.824 -5.879 4.200 1002 HG23 VAL 682 HG23 VAL 682 7.110 -5.591 4.496 1003 H CYS 683 HN CYS 683 7.996 -2.575 3.237 1004 HA CYS 683 HA CYS 683 5.231 -1.949 3.239 1005 HB2 CYS 683 HB2 CYS 683 5.445 -1.577 0.849 1006 HB3 CYS 683 HB1 CYS 683 6.833 -0.893 1.657 1007 HG CYS 683 HG CYS 683 7.235 -4.039 0.568 1008 H ILE 684 HN ILE 684 3.479 -3.070 2.613 1009 HA ILE 684 HA ILE 684 3.763 -5.801 1.729 1010 HB ILE 684 HB ILE 684 1.373 -4.011 2.156 1011 HG12 ILE 684 HG12 ILE 684 2.169 -6.623 3.426 1012 HG13 ILE 684 HG11 ILE 684 2.482 -5.040 4.124 1013 HG21 ILE 684 HG21 ILE 684 0.828 -5.315 0.218 1014 HG22 ILE 684 HG22 ILE 684 -0.044 -5.976 1.603 1015 HG23 ILE 684 HG23 ILE 684 1.397 -6.789 0.996 1016 HD11 ILE 684 HD11 ILE 684 0.527 -6.118 5.119 1017 HD12 ILE 684 HD12 ILE 684 -0.246 -6.171 3.531 1018 HD13 ILE 684 HD13 ILE 684 0.109 -4.618 4.290 1019 H SER 685 HN SER 685 4.714 -5.772 -0.274 1020 HA SER 685 HA SER 685 3.451 -4.172 -2.355 1021 HB2 SER 685 HB2 SER 685 5.746 -4.039 -2.698 1022 HB3 SER 685 HB1 SER 685 6.031 -5.683 -2.150 1023 HG SER 685 HG SER 685 5.514 -6.455 -4.088 1024 H LEU 686 HN LEU 686 1.815 -5.002 -3.439 1025 HA LEU 686 HA LEU 686 1.424 -7.899 -3.347 1026 HB2 LEU 686 HB2 LEU 686 -0.292 -5.898 -2.759 1027 HB3 LEU 686 HB1 LEU 686 -0.658 -6.123 -4.458 1028 HG LEU 686 HG LEU 686 -2.167 -7.394 -3.039 1029 HD11 LEU 686 HD11 LEU 686 -1.875 -9.612 -4.044 1030 HD12 LEU 686 HD12 LEU 686 -0.272 -9.129 -4.599 1031 HD13 LEU 686 HD13 LEU 686 -1.705 -8.310 -5.221 1032 HD21 LEU 686 HD21 LEU 686 0.309 -8.812 -2.105 1033 HD22 LEU 686 HD22 LEU 686 -1.344 -9.291 -1.739 1034 HD23 LEU 686 HD23 LEU 686 -0.719 -7.752 -1.144 1035 H THR 687 HN THR 687 1.997 -9.019 -5.083 1036 HA THR 687 HA THR 687 2.159 -7.571 -7.620 1037 HB THR 687 HB THR 687 4.205 -8.737 -6.947 1038 HG1 THR 687 HG1 THR 687 3.570 -8.564 -9.214 1039 HG21 THR 687 HG21 THR 687 3.245 -10.581 -5.686 1040 HG22 THR 687 HG22 THR 687 4.311 -11.182 -6.955 1041 HG23 THR 687 HG23 THR 687 2.562 -11.253 -7.167 1042 H LEU 688 HN LEU 688 0.772 -7.872 -9.158 1043 HA LEU 688 HA LEU 688 -1.282 -9.938 -8.850 1044 HB2 LEU 688 HB2 LEU 688 -1.152 -7.219 -10.017 1045 HB3 LEU 688 HB1 LEU 688 -2.134 -8.367 -10.899 1046 HG LEU 688 HG LEU 688 -3.312 -6.866 -9.207 1047 HD11 LEU 688 HD11 LEU 688 -4.456 -8.706 -10.172 1048 HD12 LEU 688 HD12 LEU 688 -4.770 -8.741 -8.436 1049 HD13 LEU 688 HD13 LEU 688 -3.601 -9.854 -9.145 1050 HD21 LEU 688 HD21 LEU 688 -1.776 -7.030 -7.348 1051 HD22 LEU 688 HD22 LEU 688 -1.992 -8.776 -7.276 1052 HD23 LEU 688 HD23 LEU 688 -3.338 -7.705 -6.878 1053 H LYS 689 HN LYS 689 -0.642 -11.775 -9.852 1054 HA LYS 689 HA LYS 689 0.992 -11.794 -12.169 1055 HB2 LYS 689 HB2 LYS 689 -0.569 -13.900 -10.706 1056 HB3 LYS 689 HB1 LYS 689 0.340 -14.251 -12.161 1057 HG2 LYS 689 HG2 LYS 689 1.493 -13.066 -9.661 1058 HG3 LYS 689 HG1 LYS 689 1.583 -14.772 -10.103 1059 HD2 LYS 689 HD2 LYS 689 2.718 -12.487 -11.716 1060 HD3 LYS 689 HD1 LYS 689 3.644 -13.524 -10.641 1061 HE2 LYS 689 HE2 LYS 689 2.907 -15.475 -12.020 1062 HE3 LYS 689 HE1 LYS 689 2.192 -14.330 -13.151 1063 HZ1 LYS 689 HZ1 LYS 689 4.365 -14.960 -13.904 1064 HZ2 LYS 689 HZ2 LYS 689 5.060 -14.530 -12.427 1065 HZ3 LYS 689 HZ3 LYS 689 4.409 -13.337 -13.428 Start of MODEL 7 1 H1 VAL 34 HT1 VAL 34 -18.538 -3.376 -6.432 2 H2 VAL 34 HT2 VAL 34 -17.857 -1.861 -6.122 3 H3 VAL 34 HT3 VAL 34 -18.896 -2.566 -4.992 4 HA VAL 34 HA VAL 34 -16.588 -2.722 -4.311 5 HB VAL 34 HB VAL 34 -18.085 -4.412 -3.502 6 HG11 VAL 34 HG11 VAL 34 -17.511 -5.946 -6.028 7 HG12 VAL 34 HG12 VAL 34 -19.039 -5.173 -5.604 8 HG13 VAL 34 HG13 VAL 34 -18.449 -6.541 -4.659 9 HG21 VAL 34 HG21 VAL 34 -15.758 -4.737 -2.939 10 HG22 VAL 34 HG22 VAL 34 -15.517 -5.678 -4.412 11 HG23 VAL 34 HG23 VAL 34 -16.570 -6.290 -3.137 12 H PHE 35 HN PHE 35 -14.559 -3.668 -4.604 13 HA PHE 35 HA PHE 35 -13.878 -4.404 -7.363 14 HB2 PHE 35 HB2 PHE 35 -12.547 -2.211 -5.755 15 HB3 PHE 35 HB1 PHE 35 -11.888 -2.881 -7.243 16 HD1 PHE 35 HD1 PHE 35 -13.021 -2.492 -9.385 17 HD2 PHE 35 HD2 PHE 35 -14.368 -0.674 -5.784 18 HE1 PHE 35 HE1 PHE 35 -14.357 -0.893 -10.693 19 HE2 PHE 35 HE2 PHE 35 -15.705 0.913 -7.080 20 HZ PHE 35 HZ PHE 35 -15.703 0.813 -9.539 21 HA PRO 36 HA PRO 36 -11.149 -7.453 -5.566 22 HB2 PRO 36 HB2 PRO 36 -9.151 -6.437 -7.530 23 HB3 PRO 36 HB1 PRO 36 -9.704 -8.091 -7.244 24 HG2 PRO 36 HG2 PRO 36 -10.523 -6.733 -9.385 25 HG3 PRO 36 HG1 PRO 36 -11.628 -7.806 -8.507 26 HD2 PRO 36 HD2 PRO 36 -11.460 -4.827 -8.485 27 HD3 PRO 36 HD1 PRO 36 -12.886 -5.880 -8.392 28 H TRP 37 HN TRP 37 -9.442 -7.509 -4.115 29 HA TRP 37 HA TRP 37 -9.208 -5.186 -2.644 30 HB2 TRP 37 HB2 TRP 37 -7.482 -6.465 -1.300 31 HB3 TRP 37 HB1 TRP 37 -9.087 -7.160 -1.440 32 HD1 TRP 37 HD1 TRP 37 -9.231 -9.138 -3.508 33 HE1 TRP 37 HE1 TRP 37 -7.566 -11.040 -3.913 34 HE3 TRP 37 HE3 TRP 37 -5.186 -7.197 -1.060 35 HZ2 TRP 37 HZ2 TRP 37 -4.896 -11.658 -3.251 36 HZ3 TRP 37 HZ3 TRP 37 -3.113 -8.526 -0.998 37 HH2 TRP 37 HH2 TRP 37 -2.983 -10.708 -2.067 38 H HIS 38 HN HIS 38 -7.112 -6.259 -5.220 39 HA HIS 38 HA HIS 38 -5.050 -4.415 -4.537 40 HB2 HIS 38 HB2 HIS 38 -4.512 -6.212 -6.062 41 HB3 HIS 38 HB1 HIS 38 -5.773 -5.707 -7.178 42 HD1 HIS 38 HD1 HIS 38 -2.595 -4.142 -5.714 43 HD2 HIS 38 HD2 HIS 38 -4.800 -4.272 -9.237 44 HE1 HIS 38 HE1 HIS 38 -1.283 -2.801 -7.384 45 HE2 HIS 38 HE2 HIS 38 -2.576 -2.987 -9.536 46 H SER 39 HN SER 39 -6.574 -2.720 -3.930 47 HA SER 39 HA SER 39 -7.238 -1.015 -6.233 48 HB2 SER 39 HB2 SER 39 -9.297 -1.967 -5.302 49 HB3 SER 39 HB1 SER 39 -8.847 -1.411 -3.692 50 HG SER 39 HG SER 39 -10.169 0.144 -4.401 51 H LEU 40 HN LEU 40 -5.863 -1.392 -3.131 52 HA LEU 40 HA LEU 40 -5.068 1.441 -2.997 53 HB2 LEU 40 HB2 LEU 40 -5.423 0.712 -0.365 54 HB3 LEU 40 HB1 LEU 40 -6.507 1.719 -1.308 55 HG LEU 40 HG LEU 40 -6.938 -1.194 -1.562 56 HD11 LEU 40 HD11 LEU 40 -7.493 0.297 0.986 57 HD12 LEU 40 HD12 LEU 40 -6.491 -1.139 0.782 58 HD13 LEU 40 HD13 LEU 40 -8.239 -1.239 0.547 59 HD21 LEU 40 HD21 LEU 40 -8.380 0.421 -2.680 60 HD22 LEU 40 HD22 LEU 40 -8.760 1.171 -1.130 61 HD23 LEU 40 HD23 LEU 40 -9.281 -0.479 -1.459 62 H VAL 41 HN VAL 41 -3.924 -1.431 -3.508 63 HA VAL 41 HA VAL 41 -1.671 -1.168 -1.672 64 HB VAL 41 HB VAL 41 -2.905 -3.102 -0.973 65 HG11 VAL 41 HG11 VAL 41 -2.773 -4.075 -3.831 66 HG12 VAL 41 HG12 VAL 41 -4.216 -3.516 -2.985 67 HG13 VAL 41 HG13 VAL 41 -3.402 -4.988 -2.458 68 HG21 VAL 41 HG21 VAL 41 -0.517 -3.319 -0.922 69 HG22 VAL 41 HG22 VAL 41 -0.505 -3.874 -2.595 70 HG23 VAL 41 HG23 VAL 41 -1.241 -4.871 -1.340 71 HA PRO 42 HA PRO 42 0.062 -0.844 -5.879 72 HB2 PRO 42 HB2 PRO 42 1.981 0.977 -4.707 73 HB3 PRO 42 HB1 PRO 42 0.726 1.321 -5.897 74 HG2 PRO 42 HG2 PRO 42 0.682 2.272 -3.337 75 HG3 PRO 42 HG1 PRO 42 -0.774 1.998 -4.310 76 HD2 PRO 42 HD2 PRO 42 0.426 0.282 -2.169 77 HD3 PRO 42 HD1 PRO 42 -1.281 0.661 -2.488 78 H PHE 43 HN PHE 43 2.555 -0.787 -6.426 79 HA PHE 43 HA PHE 43 3.915 -2.651 -4.610 80 HB2 PHE 43 HB2 PHE 43 5.055 -3.561 -6.689 81 HB3 PHE 43 HB1 PHE 43 3.353 -3.961 -6.504 82 HD1 PHE 43 HD1 PHE 43 5.795 -2.007 -8.414 83 HD2 PHE 43 HD2 PHE 43 1.702 -3.102 -8.013 84 HE1 PHE 43 HE1 PHE 43 5.342 -1.124 -10.664 85 HE2 PHE 43 HE2 PHE 43 1.241 -2.220 -10.263 86 HZ PHE 43 HZ PHE 43 3.062 -1.228 -11.592 87 H LEU 44 HN LEU 44 6.006 -2.312 -4.170 88 HA LEU 44 HA LEU 44 6.976 0.358 -4.540 89 HB2 LEU 44 HB2 LEU 44 8.678 -0.227 -2.965 90 HB3 LEU 44 HB1 LEU 44 7.155 -0.870 -2.400 91 HG LEU 44 HG LEU 44 8.417 -2.663 -1.894 92 HD11 LEU 44 HD11 LEU 44 7.020 -3.626 -3.586 93 HD12 LEU 44 HD12 LEU 44 8.609 -4.387 -3.618 94 HD13 LEU 44 HD13 LEU 44 8.178 -3.189 -4.840 95 HD21 LEU 44 HD21 LEU 44 10.513 -1.631 -2.302 96 HD22 LEU 44 HD22 LEU 44 10.344 -1.856 -4.042 97 HD23 LEU 44 HD23 LEU 44 10.541 -3.258 -2.984 98 H ALA 45 HN ALA 45 6.806 -0.752 -7.014 99 HA ALA 45 HA ALA 45 7.903 -1.143 -8.961 100 HB1 ALA 45 HB1 ALA 45 9.617 0.453 -8.213 101 HB2 ALA 45 HB2 ALA 45 10.314 -0.876 -9.138 102 HB3 ALA 45 HB3 ALA 45 10.462 -0.853 -7.381 103 HA PRO 46 HA PRO 46 8.349 -5.502 -9.040 104 HB2 PRO 46 HB2 PRO 46 10.650 -5.270 -10.899 105 HB3 PRO 46 HB1 PRO 46 9.111 -6.114 -11.106 106 HG2 PRO 46 HG2 PRO 46 9.594 -3.831 -12.390 107 HG3 PRO 46 HG1 PRO 46 7.986 -4.185 -11.730 108 HD2 PRO 46 HD2 PRO 46 10.129 -2.397 -10.649 109 HD3 PRO 46 HD1 PRO 46 8.370 -2.148 -10.697 110 H SER 47 HN SER 47 9.091 -5.966 -6.994 111 HA SER 47 HA SER 47 11.636 -5.679 -5.957 112 HB2 SER 47 HB2 SER 47 9.768 -7.989 -5.382 113 HB3 SER 47 HB1 SER 47 10.985 -7.308 -4.305 114 HG SER 47 HG SER 47 9.150 -6.379 -3.643 115 H GLN 48 HN GLN 48 13.315 -7.248 -5.592 116 HA GLN 48 HA GLN 48 13.875 -8.839 -7.916 117 HB2 GLN 48 HB2 GLN 48 15.458 -8.304 -5.403 118 HB3 GLN 48 HB1 GLN 48 16.044 -9.285 -6.740 119 HG2 GLN 48 HG2 GLN 48 15.268 -6.382 -6.929 120 HG3 GLN 48 HG1 GLN 48 16.917 -6.994 -6.794 121 HE21 GLN 48 HE21 GLN 48 15.630 -5.426 -8.916 122 HE22 GLN 48 HE22 GLN 48 15.839 -6.345 -10.365 123 H ALA 567 HT1 ALA 567 -28.225 12.609 3.044 124 HA ALA 567 HA ALA 567 -27.070 10.619 2.368 125 HB1 ALA 567 HB1 ALA 567 -27.834 11.439 -0.431 126 HB2 ALA 567 HB2 ALA 567 -28.534 10.089 0.461 127 HB3 ALA 567 HB3 ALA 567 -26.825 10.067 0.025 128 HA PRO 568 HA PRO 568 -23.829 13.612 2.123 129 HB2 PRO 568 HB2 PRO 568 -21.722 11.978 2.427 130 HB3 PRO 568 HB1 PRO 568 -22.851 12.292 3.750 131 HG2 PRO 568 HG2 PRO 568 -22.678 9.932 1.926 132 HG3 PRO 568 HG1 PRO 568 -22.985 9.978 3.671 133 HD2 PRO 568 HD2 PRO 568 -24.944 9.701 1.758 134 HD3 PRO 568 HD1 PRO 568 -25.221 10.359 3.380 135 HA PRO 569 HA PRO 569 -22.180 14.128 -1.959 136 HB2 PRO 569 HB2 PRO 569 -19.508 13.990 -0.627 137 HB3 PRO 569 HB1 PRO 569 -20.103 15.147 -1.819 138 HG2 PRO 569 HG2 PRO 569 -19.991 15.801 0.757 139 HG3 PRO 569 HG1 PRO 569 -21.349 16.323 -0.257 140 HD2 PRO 569 HD2 PRO 569 -21.260 14.241 1.857 141 HD3 PRO 569 HD1 PRO 569 -22.617 15.241 1.307 142 H THR 570 HN THR 570 -20.146 11.961 -0.006 143 HA THR 570 HA THR 570 -19.427 9.835 -0.317 144 HB THR 570 HB THR 570 -21.071 9.606 -2.777 145 HG1 THR 570 HG1 THR 570 -22.368 10.367 -0.960 146 HG21 THR 570 HG21 THR 570 -20.183 7.583 -0.742 147 HG22 THR 570 HG22 THR 570 -19.533 7.776 -2.369 148 HG23 THR 570 HG23 THR 570 -21.197 7.239 -2.141 149 H LEU 571 HN LEU 571 -17.917 8.678 -1.523 150 HA LEU 571 HA LEU 571 -16.549 10.299 -3.553 151 HB2 LEU 571 HB2 LEU 571 -15.460 8.557 -1.353 152 HB3 LEU 571 HB1 LEU 571 -14.484 9.191 -2.653 153 HG LEU 571 HG LEU 571 -15.735 11.438 -1.649 154 HD11 LEU 571 HD11 LEU 571 -15.322 11.366 0.761 155 HD12 LEU 571 HD12 LEU 571 -14.920 9.653 0.635 156 HD13 LEU 571 HD13 LEU 571 -16.555 10.205 0.271 157 HD21 LEU 571 HD21 LEU 571 -13.452 11.305 -2.410 158 HD22 LEU 571 HD22 LEU 571 -13.021 10.296 -1.030 159 HD23 LEU 571 HD23 LEU 571 -13.502 11.974 -0.779 160 HA PRO 572 HA PRO 572 -16.324 6.941 -6.511 161 HB2 PRO 572 HB2 PRO 572 -13.388 6.943 -5.933 162 HB3 PRO 572 HB1 PRO 572 -14.224 6.883 -7.485 163 HG2 PRO 572 HG2 PRO 572 -13.166 9.161 -6.616 164 HG3 PRO 572 HG1 PRO 572 -14.721 9.145 -7.464 165 HD2 PRO 572 HD2 PRO 572 -14.142 9.565 -4.590 166 HD3 PRO 572 HD1 PRO 572 -15.484 10.176 -5.570 167 HA PRO 573 HA PRO 573 -16.521 3.461 -3.864 168 HB2 PRO 573 HB2 PRO 573 -17.168 1.602 -5.647 169 HB3 PRO 573 HB1 PRO 573 -18.245 2.968 -5.324 170 HG2 PRO 573 HG2 PRO 573 -16.284 2.607 -7.567 171 HG3 PRO 573 HG1 PRO 573 -17.954 3.155 -7.625 172 HD2 PRO 573 HD2 PRO 573 -15.836 4.847 -7.650 173 HD3 PRO 573 HD1 PRO 573 -17.426 5.281 -6.995 174 H TYR 574 HN TYR 574 -13.983 3.864 -5.956 175 HA TYR 574 HA TYR 574 -12.943 1.230 -5.989 176 HB2 TYR 574 HB2 TYR 574 -12.498 2.937 -7.701 177 HB3 TYR 574 HB1 TYR 574 -11.453 3.763 -6.563 178 HD1 TYR 574 HD1 TYR 574 -11.917 0.317 -7.934 179 HD2 TYR 574 HD2 TYR 574 -9.194 3.395 -6.844 180 HE1 TYR 574 HE1 TYR 574 -10.048 -1.061 -8.736 181 HE2 TYR 574 HE2 TYR 574 -7.317 2.024 -7.637 182 HH TYR 574 HH TYR 574 -7.795 -0.857 -9.471 183 H PHE 575 HN PHE 575 -10.960 3.889 -4.739 184 HA PHE 575 HA PHE 575 -10.328 2.100 -2.478 185 HB2 PHE 575 HB2 PHE 575 -8.067 2.617 -2.638 186 HB3 PHE 575 HB1 PHE 575 -8.545 2.550 -4.329 187 HD1 PHE 575 HD2 PHE 575 -9.175 4.801 -5.435 188 HD2 PHE 575 HD1 PHE 575 -6.985 4.452 -1.804 189 HE1 PHE 575 HE2 PHE 575 -8.330 7.090 -5.728 190 HE2 PHE 575 HE1 PHE 575 -6.142 6.740 -2.088 191 HZ PHE 575 HZ PHE 575 -6.826 8.062 -4.039 192 H MET 576 HN MET 576 -11.911 4.797 -3.222 193 HA MET 576 HA MET 576 -10.846 6.707 -1.372 194 HB2 MET 576 HB2 MET 576 -13.630 6.579 -2.540 195 HB3 MET 576 HB1 MET 576 -12.886 7.976 -1.777 196 HG2 MET 576 HG2 MET 576 -11.852 6.667 -4.275 197 HG3 MET 576 HG1 MET 576 -12.940 8.050 -4.255 198 HE1 MET 576 HE1 MET 576 -9.629 9.719 -5.399 199 HE2 MET 576 HE2 MET 576 -11.362 9.578 -5.685 200 HE3 MET 576 HE3 MET 576 -10.321 8.169 -5.879 201 H LYS 577 HN LYS 577 -12.419 7.636 0.384 202 HA LYS 577 HA LYS 577 -12.576 5.721 2.411 203 HB2 LYS 577 HB2 LYS 577 -12.416 8.097 2.909 204 HB3 LYS 577 HB1 LYS 577 -13.993 8.382 2.186 205 HG2 LYS 577 HG2 LYS 577 -15.017 6.964 3.925 206 HG3 LYS 577 HG1 LYS 577 -13.432 6.785 4.677 207 HD2 LYS 577 HD2 LYS 577 -13.315 9.136 5.134 208 HD3 LYS 577 HD1 LYS 577 -14.780 9.438 4.197 209 HE2 LYS 577 HE2 LYS 577 -15.278 9.473 6.569 210 HE3 LYS 577 HE1 LYS 577 -16.069 8.102 5.797 211 HZ1 LYS 577 HZ1 LYS 577 -15.099 7.421 7.868 212 HZ2 LYS 577 HZ2 LYS 577 -13.587 8.019 7.423 213 HZ3 LYS 577 HZ3 LYS 577 -14.238 6.684 6.609 214 H GLY 578 HN GLY 578 -14.056 4.314 3.067 215 HA2 GLY 578 HA2 GLY 578 -16.181 3.509 3.559 216 HA3 GLY 578 HA1 GLY 578 -16.869 4.735 2.514 217 H SER 579 HN SER 579 -14.577 3.474 0.636 218 HA SER 579 HA SER 579 -16.367 2.037 -0.991 219 HB2 SER 579 HB2 SER 579 -13.350 1.927 -1.031 220 HB3 SER 579 HB1 SER 579 -14.438 1.521 -2.358 221 HG SER 579 HG SER 579 -13.651 3.997 -1.381 222 H ILE 580 HN ILE 580 -16.582 -0.148 -1.407 223 HA ILE 580 HA ILE 580 -15.808 -1.888 0.796 224 HB ILE 580 HB ILE 580 -17.735 -2.303 -1.488 225 HG12 ILE 580 HG12 ILE 580 -18.552 -0.767 0.213 226 HG13 ILE 580 HG11 ILE 580 -19.422 -2.293 0.324 227 HG21 ILE 580 HG21 ILE 580 -18.359 -4.398 -0.401 228 HG22 ILE 580 HG22 ILE 580 -17.086 -4.160 0.795 229 HG23 ILE 580 HG23 ILE 580 -16.668 -4.414 -0.898 230 HD11 ILE 580 HD11 ILE 580 -17.213 -1.335 2.129 231 HD12 ILE 580 HD12 ILE 580 -17.933 -2.944 2.197 232 HD13 ILE 580 HD13 ILE 580 -18.921 -1.521 2.531 233 H ILE 581 HN ILE 581 -14.060 -3.016 0.658 234 HA ILE 581 HA ILE 581 -12.870 -3.564 -1.971 235 HB ILE 581 HB ILE 581 -11.526 -3.755 0.723 236 HG12 ILE 581 HG12 ILE 581 -12.299 -1.480 0.507 237 HG13 ILE 581 HG11 ILE 581 -10.566 -1.513 0.236 238 HG21 ILE 581 HG21 ILE 581 -9.479 -3.492 -0.588 239 HG22 ILE 581 HG22 ILE 581 -10.441 -3.470 -2.065 240 HG23 ILE 581 HG23 ILE 581 -10.398 -4.921 -1.060 241 HD11 ILE 581 HD11 ILE 581 -12.723 -1.248 -1.836 242 HD12 ILE 581 HD12 ILE 581 -11.008 -1.454 -2.197 243 HD13 ILE 581 HD13 ILE 581 -11.559 -0.024 -1.327 244 H GLN 582 HN GLN 582 -12.752 -5.631 -2.684 245 HA GLN 582 HA GLN 582 -13.653 -7.714 -0.828 246 HB2 GLN 582 HB2 GLN 582 -14.891 -7.445 -2.948 247 HB3 GLN 582 HB1 GLN 582 -13.435 -7.834 -3.831 248 HG2 GLN 582 HG2 GLN 582 -13.401 -10.060 -2.963 249 HG3 GLN 582 HG1 GLN 582 -14.713 -9.694 -1.846 250 HE21 GLN 582 HE21 GLN 582 -16.047 -11.295 -2.639 251 HE22 GLN 582 HE22 GLN 582 -16.795 -11.200 -4.192 252 H LEU 583 HN LEU 583 -12.256 -8.983 0.046 253 HA LEU 583 HA LEU 583 -9.509 -8.976 -0.853 254 HB2 LEU 583 HB2 LEU 583 -10.788 -10.472 1.426 255 HB3 LEU 583 HB1 LEU 583 -9.069 -10.236 1.174 256 HG LEU 583 HG LEU 583 -11.044 -8.018 1.703 257 HD11 LEU 583 HD11 LEU 583 -10.766 -9.534 3.626 258 HD12 LEU 583 HD12 LEU 583 -10.098 -7.923 3.933 259 HD13 LEU 583 HD13 LEU 583 -9.023 -9.275 3.548 260 HD21 LEU 583 HD21 LEU 583 -8.029 -8.042 1.544 261 HD22 LEU 583 HD22 LEU 583 -9.013 -6.667 2.037 262 HD23 LEU 583 HD23 LEU 583 -9.132 -7.290 0.391 263 H ALA 584 HN ALA 584 -8.334 -11.240 -0.755 264 HA ALA 584 HA ALA 584 -9.390 -12.673 -2.953 265 HB1 ALA 584 HB1 ALA 584 -6.975 -12.568 -2.467 266 HB2 ALA 584 HB2 ALA 584 -7.547 -14.223 -2.667 267 HB3 ALA 584 HB3 ALA 584 -7.229 -13.589 -1.051 268 H ASN 585 HN ASN 585 -9.568 -13.123 0.496 269 HA ASN 585 HA ASN 585 -10.649 -15.769 0.376 270 HB2 ASN 585 HB2 ASN 585 -11.001 -15.526 2.767 271 HB3 ASN 585 HB1 ASN 585 -9.406 -14.928 2.343 272 HD21 ASN 585 HD21 ASN 585 -10.732 -14.307 4.704 273 HD22 ASN 585 HD22 ASN 585 -11.076 -12.611 4.719 274 H GLY 586 HN GLY 586 -11.896 -12.735 -0.331 275 HA2 GLY 586 HA2 GLY 586 -13.994 -12.620 -1.440 276 HA3 GLY 586 HA1 GLY 586 -14.577 -13.916 -0.416 277 H GLU 587 HN GLU 587 -12.912 -11.788 1.527 278 HA GLU 587 HA GLU 587 -15.267 -10.869 2.780 279 HB2 GLU 587 HB2 GLU 587 -12.417 -10.050 3.081 280 HB3 GLU 587 HB1 GLU 587 -13.703 -9.340 4.038 281 HG2 GLU 587 HG2 GLU 587 -14.281 -11.746 4.638 282 HG3 GLU 587 HG1 GLU 587 -12.665 -12.124 4.032 283 H LEU 588 HN LEU 588 -16.124 -8.920 2.998 284 HA LEU 588 HA LEU 588 -15.403 -6.932 0.950 285 HB2 LEU 588 HB2 LEU 588 -18.147 -7.504 2.073 286 HB3 LEU 588 HB1 LEU 588 -17.755 -6.361 0.796 287 HG LEU 588 HG LEU 588 -17.370 -9.352 0.615 288 HD11 LEU 588 HD11 LEU 588 -19.268 -9.321 -0.907 289 HD12 LEU 588 HD12 LEU 588 -19.467 -7.587 -0.653 290 HD13 LEU 588 HD13 LEU 588 -19.735 -8.709 0.678 291 HD21 LEU 588 HD21 LEU 588 -15.767 -8.170 -0.753 292 HD22 LEU 588 HD22 LEU 588 -17.040 -7.139 -1.412 293 HD23 LEU 588 HD23 LEU 588 -17.018 -8.858 -1.794 294 H LYS 589 HN LYS 589 -14.177 -5.637 2.146 295 HA LYS 589 HA LYS 589 -15.123 -4.838 4.820 296 HB2 LYS 589 HB2 LYS 589 -12.969 -6.292 4.368 297 HB3 LYS 589 HB1 LYS 589 -12.297 -4.725 4.007 298 HG2 LYS 589 HG2 LYS 589 -12.587 -3.951 6.189 299 HG3 LYS 589 HG1 LYS 589 -13.653 -5.283 6.608 300 HD2 LYS 589 HD2 LYS 589 -10.743 -5.607 5.880 301 HD3 LYS 589 HD1 LYS 589 -11.335 -5.483 7.533 302 HE2 LYS 589 HE2 LYS 589 -12.254 -7.560 5.571 303 HE3 LYS 589 HE1 LYS 589 -10.910 -7.808 6.683 304 HZ1 LYS 589 HZ1 LYS 589 -13.715 -7.215 7.457 305 HZ2 LYS 589 HZ2 LYS 589 -12.425 -7.453 8.527 306 HZ3 LYS 589 HZ3 LYS 589 -12.960 -8.730 7.548 307 H LYS 590 HN LYS 590 -14.468 -2.682 5.508 308 HA LYS 590 HA LYS 590 -14.684 -0.773 3.346 309 HB2 LYS 590 HB2 LYS 590 -14.549 -0.461 6.343 310 HB3 LYS 590 HB1 LYS 590 -14.609 0.903 5.240 311 HG2 LYS 590 HG2 LYS 590 -16.680 -1.188 4.984 312 HG3 LYS 590 HG1 LYS 590 -16.767 -0.095 6.361 313 HD2 LYS 590 HD2 LYS 590 -16.698 1.814 4.817 314 HD3 LYS 590 HD1 LYS 590 -16.659 0.698 3.451 315 HE2 LYS 590 HE2 LYS 590 -18.814 -0.222 4.170 316 HE3 LYS 590 HE1 LYS 590 -18.848 0.928 5.502 317 HZ1 LYS 590 HZ1 LYS 590 -20.167 1.616 3.543 318 HZ2 LYS 590 HZ2 LYS 590 -18.740 1.714 2.641 319 HZ3 LYS 590 HZ3 LYS 590 -18.974 2.733 3.973 320 H VAL 591 HN VAL 591 -13.119 0.628 2.664 321 HA VAL 591 HA VAL 591 -10.562 -0.260 2.392 322 HB VAL 591 HB VAL 591 -10.984 2.694 2.650 323 HG11 VAL 591 HG11 VAL 591 -9.373 0.963 0.797 324 HG12 VAL 591 HG12 VAL 591 -8.772 1.981 2.110 325 HG13 VAL 591 HG13 VAL 591 -9.495 2.719 0.676 326 HG21 VAL 591 HG21 VAL 591 -11.908 2.804 0.426 327 HG22 VAL 591 HG22 VAL 591 -12.957 1.864 1.487 328 HG23 VAL 591 HG23 VAL 591 -11.920 1.041 0.319 329 H GLU 592 HN GLU 592 -11.712 2.002 4.817 330 HA GLU 592 HA GLU 592 -9.135 2.628 5.813 331 HB2 GLU 592 HB2 GLU 592 -10.466 3.808 7.603 332 HB3 GLU 592 HB1 GLU 592 -10.835 4.286 5.951 333 HG2 GLU 592 HG2 GLU 592 -12.800 2.795 5.989 334 HG3 GLU 592 HG1 GLU 592 -12.444 2.408 7.671 335 H ASP 593 HN ASP 593 -11.305 0.045 6.481 336 HA ASP 593 HA ASP 593 -10.101 -0.325 9.140 337 HB2 ASP 593 HB2 ASP 593 -12.604 -0.019 8.989 338 HB3 ASP 593 HB1 ASP 593 -12.666 -1.572 8.163 339 H LEU 594 HN LEU 594 -9.933 -1.494 6.038 340 HA LEU 594 HA LEU 594 -9.355 -4.173 6.303 341 HB2 LEU 594 HB2 LEU 594 -7.899 -2.068 4.703 342 HB3 LEU 594 HB1 LEU 594 -7.687 -3.795 4.495 343 HG LEU 594 HG LEU 594 -10.391 -2.532 4.165 344 HD11 LEU 594 HD11 LEU 594 -9.926 -2.378 1.780 345 HD12 LEU 594 HD12 LEU 594 -8.250 -2.837 2.073 346 HD13 LEU 594 HD13 LEU 594 -8.874 -1.315 2.711 347 HD21 LEU 594 HD21 LEU 594 -10.656 -4.465 2.632 348 HD22 LEU 594 HD22 LEU 594 -10.371 -4.920 4.305 349 HD23 LEU 594 HD23 LEU 594 -9.066 -5.029 3.137 350 H LYS 595 HN LYS 595 -7.873 -5.287 7.398 351 HA LYS 595 HA LYS 595 -5.695 -3.802 8.699 352 HB2 LYS 595 HB2 LYS 595 -6.544 -6.634 9.279 353 HB3 LYS 595 HB1 LYS 595 -5.548 -5.584 10.277 354 HG2 LYS 595 HG2 LYS 595 -8.464 -5.185 9.670 355 HG3 LYS 595 HG1 LYS 595 -7.800 -5.819 11.177 356 HD2 LYS 595 HD2 LYS 595 -6.707 -3.712 11.623 357 HD3 LYS 595 HD1 LYS 595 -7.212 -3.082 10.052 358 HE2 LYS 595 HE2 LYS 595 -9.587 -3.445 10.789 359 HE3 LYS 595 HE1 LYS 595 -8.959 -3.794 12.398 360 HZ1 LYS 595 HZ1 LYS 595 -8.373 -1.271 10.972 361 HZ2 LYS 595 HZ2 LYS 595 -8.154 -1.613 12.615 362 HZ3 LYS 595 HZ3 LYS 595 -9.718 -1.454 11.982 363 H THR 596 HN THR 596 -3.530 -4.870 8.762 364 HA THR 596 HA THR 596 -2.699 -5.471 6.151 365 HB THR 596 HB THR 596 -1.139 -4.562 7.798 366 HG1 THR 596 HG1 THR 596 -0.649 -6.679 6.181 367 HG21 THR 596 HG21 THR 596 -1.945 -5.875 9.746 368 HG22 THR 596 HG22 THR 596 -0.193 -5.912 9.556 369 HG23 THR 596 HG23 THR 596 -1.165 -7.299 9.061 370 H GLU 597 HN GLU 597 -3.582 -7.541 8.828 371 HA GLU 597 HA GLU 597 -2.606 -9.962 7.798 372 HB2 GLU 597 HB2 GLU 597 -4.890 -9.472 9.684 373 HB3 GLU 597 HB1 GLU 597 -4.110 -11.023 9.418 374 HG2 GLU 597 HG2 GLU 597 -2.012 -10.113 10.268 375 HG3 GLU 597 HG1 GLU 597 -2.796 -8.554 10.529 376 H ASP 598 HN ASP 598 -5.498 -8.146 7.177 377 HA ASP 598 HA ASP 598 -7.030 -10.220 6.018 378 HB2 ASP 598 HB2 ASP 598 -7.135 -7.229 5.594 379 HB3 ASP 598 HB1 ASP 598 -8.320 -8.357 4.963 380 H PHE 599 HN PHE 599 -4.833 -7.804 4.652 381 HA PHE 599 HA PHE 599 -5.051 -8.793 1.985 382 HB2 PHE 599 HB2 PHE 599 -3.175 -6.900 3.361 383 HB3 PHE 599 HB1 PHE 599 -2.796 -7.496 1.751 384 HD1 PHE 599 HD2 PHE 599 -5.929 -6.324 3.418 385 HD2 PHE 599 HD1 PHE 599 -3.248 -5.949 0.137 386 HE1 PHE 599 HE2 PHE 599 -7.398 -4.633 2.410 387 HE2 PHE 599 HE1 PHE 599 -4.722 -4.261 -0.878 388 HZ PHE 599 HZ PHE 599 -6.801 -3.601 0.260 389 H ILE 600 HN ILE 600 -2.755 -9.270 4.639 390 HA ILE 600 HA ILE 600 -0.900 -10.907 3.445 391 HB ILE 600 HB ILE 600 -2.085 -10.901 6.202 392 HG12 ILE 600 HG12 ILE 600 0.626 -10.100 5.147 393 HG13 ILE 600 HG11 ILE 600 -0.703 -9.000 5.466 394 HG21 ILE 600 HG21 ILE 600 0.143 -12.656 5.200 395 HG22 ILE 600 HG22 ILE 600 -1.396 -13.169 5.908 396 HG23 ILE 600 HG23 ILE 600 -0.190 -12.346 6.903 397 HD11 ILE 600 HD11 ILE 600 -0.623 -9.534 7.816 398 HD12 ILE 600 HD12 ILE 600 0.952 -8.980 7.251 399 HD13 ILE 600 HD13 ILE 600 0.667 -10.699 7.526 400 H GLN 601 HN GLN 601 -3.829 -12.001 5.149 401 HA GLN 601 HA GLN 601 -3.609 -14.691 4.546 402 HB2 GLN 601 HB2 GLN 601 -5.952 -12.929 5.178 403 HB3 GLN 601 HB1 GLN 601 -6.178 -14.638 4.822 404 HG2 GLN 601 HG2 GLN 601 -4.755 -15.256 6.638 405 HG3 GLN 601 HG1 GLN 601 -4.361 -13.571 6.960 406 HE21 GLN 601 HE21 GLN 601 -6.840 -16.014 7.153 407 HE22 GLN 601 HE22 GLN 601 -7.853 -15.174 8.272 408 H SER 602 HN SER 602 -5.312 -12.150 2.775 409 HA SER 602 HA SER 602 -6.524 -13.694 0.837 410 HB2 SER 602 HB2 SER 602 -5.352 -10.915 0.624 411 HB3 SER 602 HB1 SER 602 -6.419 -11.637 -0.583 412 HG SER 602 HG SER 602 -6.994 -10.921 2.097 413 H ALA 603 HN ALA 603 -3.233 -12.353 0.820 414 HA ALA 603 HA ALA 603 -2.657 -13.433 -1.781 415 HB1 ALA 603 HB1 ALA 603 -0.576 -12.411 -1.588 416 HB2 ALA 603 HB2 ALA 603 -0.629 -12.445 0.171 417 HB3 ALA 603 HB3 ALA 603 -1.676 -11.340 -0.721 418 H GLU 604 HN GLU 604 -2.380 -14.561 1.475 419 HA GLU 604 HA GLU 604 -0.392 -16.556 0.932 420 HB2 GLU 604 HB2 GLU 604 -2.332 -16.243 3.224 421 HB3 GLU 604 HB1 GLU 604 -1.042 -17.441 3.162 422 HG2 GLU 604 HG2 GLU 604 0.571 -15.554 2.935 423 HG3 GLU 604 HG1 GLU 604 -0.767 -14.444 3.234 424 H ILE 605 HN ILE 605 -3.867 -16.415 1.176 425 HA ILE 605 HA ILE 605 -4.455 -19.102 0.585 426 HB ILE 605 HB ILE 605 -6.035 -16.586 -0.011 427 HG12 ILE 605 HG12 ILE 605 -6.241 -18.449 2.353 428 HG13 ILE 605 HG11 ILE 605 -5.260 -16.996 2.362 429 HG21 ILE 605 HG21 ILE 605 -6.890 -18.500 -1.262 430 HG22 ILE 605 HG22 ILE 605 -8.008 -18.027 0.018 431 HG23 ILE 605 HG23 ILE 605 -6.973 -19.441 0.228 432 HD11 ILE 605 HD11 ILE 605 -7.267 -16.455 3.446 433 HD12 ILE 605 HD12 ILE 605 -8.244 -17.207 2.179 434 HD13 ILE 605 HD13 ILE 605 -7.362 -15.716 1.843 435 H SER 606 HN SER 606 -3.477 -16.382 -1.319 436 HA SER 606 HA SER 606 -2.529 -16.230 -3.356 437 HB2 SER 606 HB2 SER 606 -2.128 -19.189 -2.902 438 HB3 SER 606 HB1 SER 606 -1.325 -18.252 -4.159 439 HG SER 606 HG SER 606 -0.954 -16.921 -1.930 440 H ASN 607 HN ASN 607 -4.666 -15.709 -4.216 441 HA ASN 607 HA ASN 607 -5.521 -17.714 -6.186 442 HB2 ASN 607 HB2 ASN 607 -7.279 -16.649 -4.717 443 HB3 ASN 607 HB1 ASN 607 -6.897 -15.109 -5.475 444 HD21 ASN 607 HD21 ASN 607 -7.001 -18.240 -7.087 445 HD22 ASN 607 HD22 ASN 607 -8.359 -17.874 -8.094 446 H ASP 608 HN ASP 608 -3.292 -17.122 -7.050 447 HA ASP 608 HA ASP 608 -1.935 -16.124 -8.584 448 HB2 ASP 608 HB2 ASP 608 -4.508 -14.795 -9.467 449 HB3 ASP 608 HB1 ASP 608 -2.978 -14.639 -10.322 450 H LEU 609 HN LEU 609 -2.103 -15.104 -6.005 451 HA LEU 609 HA LEU 609 -1.450 -12.286 -6.332 452 HB2 LEU 609 HB2 LEU 609 -3.618 -13.236 -4.444 453 HB3 LEU 609 HB1 LEU 609 -3.043 -11.588 -4.606 454 HG LEU 609 HG LEU 609 -4.261 -13.015 -6.952 455 HD11 LEU 609 HD11 LEU 609 -5.802 -11.401 -4.933 456 HD12 LEU 609 HD12 LEU 609 -5.837 -13.161 -5.043 457 HD13 LEU 609 HD13 LEU 609 -6.430 -12.182 -6.384 458 HD21 LEU 609 HD21 LEU 609 -3.074 -10.937 -7.371 459 HD22 LEU 609 HD22 LEU 609 -4.065 -10.115 -6.166 460 HD23 LEU 609 HD23 LEU 609 -4.805 -10.738 -7.641 461 H LYS 610 HN LYS 610 0.232 -11.769 -4.983 462 HA LYS 610 HA LYS 610 0.686 -13.417 -2.593 463 HB2 LYS 610 HB2 LYS 610 2.683 -12.966 -4.807 464 HB3 LYS 610 HB1 LYS 610 3.130 -13.540 -3.206 465 HG2 LYS 610 HG2 LYS 610 1.715 -15.505 -3.509 466 HG3 LYS 610 HG1 LYS 610 1.250 -14.926 -5.109 467 HD2 LYS 610 HD2 LYS 610 4.075 -15.565 -4.262 468 HD3 LYS 610 HD1 LYS 610 3.022 -16.657 -5.162 469 HE2 LYS 610 HE2 LYS 610 2.849 -14.918 -6.939 470 HE3 LYS 610 HE1 LYS 610 4.036 -13.962 -6.057 471 HZ1 LYS 610 HZ1 LYS 610 5.631 -15.742 -6.318 472 HZ2 LYS 610 HZ2 LYS 610 5.050 -15.258 -7.832 473 HZ3 LYS 610 HZ3 LYS 610 4.490 -16.690 -7.132 474 H ILE 611 HN ILE 611 1.754 -12.416 -0.915 475 HA ILE 611 HA ILE 611 2.012 -9.524 -0.998 476 HB ILE 611 HB ILE 611 2.563 -11.496 1.228 477 HG12 ILE 611 HG12 ILE 611 0.132 -10.816 0.256 478 HG13 ILE 611 HG11 ILE 611 0.414 -11.304 1.917 479 HG21 ILE 611 HG21 ILE 611 3.902 -9.499 1.515 480 HG22 ILE 611 HG22 ILE 611 2.632 -9.591 2.738 481 HG23 ILE 611 HG23 ILE 611 2.456 -8.499 1.367 482 HD11 ILE 611 HD11 ILE 611 0.546 -8.924 2.551 483 HD12 ILE 611 HD12 ILE 611 -1.006 -9.349 1.817 484 HD13 ILE 611 HD13 ILE 611 0.210 -8.484 0.876 485 H ASP 612 HN ASP 612 3.954 -8.414 -0.578 486 HA ASP 612 HA ASP 612 6.424 -9.994 -0.803 487 HB2 ASP 612 HB2 ASP 612 5.927 -8.589 -2.847 488 HB3 ASP 612 HB1 ASP 612 6.080 -7.165 -1.821 489 H SER 613 HN SER 613 8.181 -9.266 0.446 490 HA SER 613 HA SER 613 7.393 -7.423 2.591 491 HB2 SER 613 HB2 SER 613 8.971 -8.797 4.055 492 HB3 SER 613 HB1 SER 613 7.450 -9.560 3.593 493 HG SER 613 HG SER 613 8.944 -11.080 3.182 494 H SER 614 HN SER 614 8.342 -5.585 2.034 495 HA SER 614 HA SER 614 11.266 -5.617 1.651 496 HB2 SER 614 HB2 SER 614 9.222 -4.013 0.103 497 HB3 SER 614 HB1 SER 614 10.961 -3.734 0.030 498 HG SER 614 HG SER 614 9.450 -5.881 -0.963 499 H THR 615 HN THR 615 12.162 -4.586 3.333 500 HA THR 615 HA THR 615 10.568 -2.720 4.901 501 HB THR 615 HB THR 615 13.300 -3.894 5.418 502 HG1 THR 615 HG1 THR 615 11.642 -5.417 5.638 503 HG21 THR 615 HG21 THR 615 13.044 -2.980 7.705 504 HG22 THR 615 HG22 THR 615 11.577 -2.146 7.195 505 HG23 THR 615 HG23 THR 615 13.132 -1.710 6.486 506 H VAL 616 HN VAL 616 10.596 -0.632 4.458 507 HA VAL 616 HA VAL 616 12.534 0.678 2.912 508 HB VAL 616 HB VAL 616 10.473 1.763 3.047 509 HG11 VAL 616 HG11 VAL 616 9.475 2.493 5.207 510 HG12 VAL 616 HG12 VAL 616 10.704 1.535 6.025 511 HG13 VAL 616 HG13 VAL 616 9.531 0.747 4.976 512 HG21 VAL 616 HG21 VAL 616 12.352 3.245 4.877 513 HG22 VAL 616 HG22 VAL 616 10.931 3.949 4.106 514 HG23 VAL 616 HG23 VAL 616 12.277 3.372 3.118 515 H GLU 617 HN GLU 617 14.527 1.184 3.363 516 HA GLU 617 HA GLU 617 15.377 1.364 6.157 517 HB2 GLU 617 HB2 GLU 617 17.017 1.088 3.651 518 HB3 GLU 617 HB1 GLU 617 17.670 1.156 5.279 519 HG2 GLU 617 HG2 GLU 617 16.092 -0.873 5.674 520 HG3 GLU 617 HG1 GLU 617 16.156 -1.017 3.923 521 H ARG 618 HN ARG 618 14.714 3.267 3.401 522 HA ARG 618 HA ARG 618 15.572 5.649 4.785 523 HB2 ARG 618 HB2 ARG 618 17.646 4.943 3.720 524 HB3 ARG 618 HB1 ARG 618 16.844 4.858 2.159 525 HG2 ARG 618 HG2 ARG 618 16.468 7.280 2.233 526 HG3 ARG 618 HG1 ARG 618 17.297 7.351 3.790 527 HD2 ARG 618 HD2 ARG 618 18.507 6.426 1.186 528 HD3 ARG 618 HD1 ARG 618 18.778 7.992 1.947 529 HE ARG 618 HE ARG 618 19.572 6.396 3.895 530 HH11 ARG 618 HH11 ARG 618 20.242 6.202 0.462 531 HH12 ARG 618 HH12 ARG 618 21.770 5.407 0.679 532 HH21 ARG 618 HH21 ARG 618 21.588 5.352 4.177 533 HH22 ARG 618 HH22 ARG 618 22.528 4.920 2.785 534 H ILE 619 HN ILE 619 14.682 7.543 3.933 535 HA ILE 619 HA ILE 619 12.802 7.281 1.703 536 HB ILE 619 HB ILE 619 12.137 8.286 4.475 537 HG12 ILE 619 HG12 ILE 619 10.747 6.300 2.674 538 HG13 ILE 619 HG11 ILE 619 11.857 5.868 3.972 539 HG21 ILE 619 HG21 ILE 619 9.984 9.051 3.567 540 HG22 ILE 619 HG22 ILE 619 10.548 8.685 1.937 541 HG23 ILE 619 HG23 ILE 619 11.340 9.946 2.881 542 HD11 ILE 619 HD11 ILE 619 10.336 6.885 5.595 543 HD12 ILE 619 HD12 ILE 619 9.542 5.614 4.663 544 HD13 ILE 619 HD13 ILE 619 9.230 7.309 4.287 545 H GLU 620 HN GLU 620 12.912 8.984 0.366 546 HA GLU 620 HA GLU 620 14.207 11.438 1.350 547 HB2 GLU 620 HB2 GLU 620 14.875 10.164 -1.301 548 HB3 GLU 620 HB1 GLU 620 15.664 11.538 -0.543 549 HG2 GLU 620 HG2 GLU 620 16.524 10.095 1.213 550 HG3 GLU 620 HG1 GLU 620 15.708 8.707 0.486 551 H ASP 621 HN ASP 621 13.333 13.296 0.589 552 HA ASP 621 HA ASP 621 11.055 13.189 -1.168 553 HB2 ASP 621 HB2 ASP 621 12.569 15.455 0.126 554 HB3 ASP 621 HB1 ASP 621 11.297 15.749 -1.056 555 H SER 622 HN SER 622 10.985 13.670 -3.318 556 HA SER 622 HA SER 622 13.618 13.652 -4.595 557 HB2 SER 622 HB2 SER 622 11.859 11.873 -5.091 558 HB3 SER 622 HB1 SER 622 10.966 13.133 -5.940 559 HG SER 622 HG SER 622 12.459 11.776 -7.235 560 H HIS 623 HN HIS 623 11.976 16.036 -3.540 561 HA HIS 623 HA HIS 623 11.846 18.247 -4.034 562 HB2 HIS 623 HB2 HIS 623 13.287 17.504 -6.589 563 HB3 HIS 623 HB1 HIS 623 12.971 19.150 -6.057 564 HD1 HIS 623 HD1 HIS 623 14.812 20.201 -4.767 565 HD2 HIS 623 HD2 HIS 623 14.985 16.051 -4.616 566 HE1 HIS 623 HE1 HIS 623 16.914 19.658 -3.507 567 HE2 HIS 623 HE2 HIS 623 16.977 17.148 -3.382 568 H SER 624 HN SER 624 11.043 16.154 -6.748 569 HA SER 624 HA SER 624 9.180 17.722 -8.064 570 HB2 SER 624 HB2 SER 624 9.240 14.726 -7.658 571 HB3 SER 624 HB1 SER 624 8.277 15.555 -8.877 572 HG SER 624 HG SER 624 10.029 15.235 -10.029 573 HA PRO 625 HA PRO 625 5.690 18.474 -5.537 574 HB2 PRO 625 HB2 PRO 625 4.088 17.402 -7.777 575 HB3 PRO 625 HB1 PRO 625 3.934 18.936 -6.924 576 HG2 PRO 625 HG2 PRO 625 5.022 18.814 -9.363 577 HG3 PRO 625 HG1 PRO 625 5.629 19.935 -8.132 578 HD2 PRO 625 HD2 PRO 625 6.825 17.417 -9.151 579 HD3 PRO 625 HD1 PRO 625 7.613 18.868 -8.507 580 H GLY 626 HN GLY 626 5.460 17.191 -3.894 581 HA2 GLY 626 HA2 GLY 626 4.669 15.510 -2.570 582 HA3 GLY 626 HA1 GLY 626 3.516 15.193 -3.855 583 H VAL 627 HN VAL 627 7.003 14.938 -4.294 584 HA VAL 627 HA VAL 627 6.577 12.050 -4.673 585 HB VAL 627 HB VAL 627 8.779 13.725 -5.889 586 HG11 VAL 627 HG11 VAL 627 7.889 10.884 -6.395 587 HG12 VAL 627 HG12 VAL 627 9.385 11.386 -5.608 588 HG13 VAL 627 HG13 VAL 627 9.119 11.747 -7.313 589 HG21 VAL 627 HG21 VAL 627 6.171 12.752 -7.024 590 HG22 VAL 627 HG22 VAL 627 7.500 13.386 -8.000 591 HG23 VAL 627 HG23 VAL 627 6.691 14.426 -6.824 592 H ALA 628 HN ALA 628 7.488 10.720 -3.335 593 HA ALA 628 HA ALA 628 10.080 11.404 -2.157 594 HB1 ALA 628 HB1 ALA 628 8.414 11.904 -0.435 595 HB2 ALA 628 HB2 ALA 628 9.392 10.504 0.011 596 HB3 ALA 628 HB3 ALA 628 7.752 10.277 -0.598 597 H VAL 629 HN VAL 629 11.474 9.796 -2.295 598 HA VAL 629 HA VAL 629 10.505 7.295 -3.425 599 HB VAL 629 HB VAL 629 12.263 7.955 -4.757 600 HG11 VAL 629 HG11 VAL 629 12.889 9.879 -3.395 601 HG12 VAL 629 HG12 VAL 629 14.303 9.009 -3.992 602 HG13 VAL 629 HG13 VAL 629 13.791 8.817 -2.313 603 HG21 VAL 629 HG21 VAL 629 13.641 6.315 -2.629 604 HG22 VAL 629 HG22 VAL 629 14.199 6.537 -4.287 605 HG23 VAL 629 HG23 VAL 629 12.692 5.675 -3.974 606 H ILE 630 HN ILE 630 10.090 5.689 -2.181 607 HA ILE 630 HA ILE 630 11.303 5.510 0.450 608 HB ILE 630 HB ILE 630 9.455 3.454 -0.701 609 HG12 ILE 630 HG12 ILE 630 8.456 5.714 -1.109 610 HG13 ILE 630 HG11 ILE 630 7.533 4.712 -0.000 611 HG21 ILE 630 HG21 ILE 630 10.531 3.031 1.436 612 HG22 ILE 630 HG22 ILE 630 8.792 3.242 1.638 613 HG23 ILE 630 HG23 ILE 630 9.896 4.549 2.065 614 HD11 ILE 630 HD11 ILE 630 9.372 6.957 0.739 615 HD12 ILE 630 HD12 ILE 630 8.521 5.915 1.884 616 HD13 ILE 630 HD13 ILE 630 7.610 6.969 0.800 617 H GLN 631 HN GLN 631 13.278 4.604 0.537 618 HA GLN 631 HA GLN 631 14.074 2.674 -1.487 619 HB2 GLN 631 HB2 GLN 631 15.676 4.408 -0.915 620 HB3 GLN 631 HB1 GLN 631 15.615 3.946 0.781 621 HG2 GLN 631 HG2 GLN 631 16.682 1.867 0.332 622 HG3 GLN 631 HG1 GLN 631 16.550 2.113 -1.409 623 HE21 GLN 631 HE21 GLN 631 18.239 2.983 1.498 624 HE22 GLN 631 HE22 GLN 631 19.561 3.784 0.726 625 H PHE 632 HN PHE 632 13.548 0.641 -1.205 626 HA PHE 632 HA PHE 632 13.193 -0.395 1.525 627 HB2 PHE 632 HB2 PHE 632 12.189 -1.452 -1.116 628 HB3 PHE 632 HB1 PHE 632 11.916 -2.210 0.443 629 HD1 PHE 632 HD2 PHE 632 10.426 -1.169 2.080 630 HD2 PHE 632 HD1 PHE 632 10.903 0.411 -1.837 631 HE1 PHE 632 HE2 PHE 632 8.334 0.092 2.340 632 HE2 PHE 632 HE1 PHE 632 8.807 1.672 -1.588 633 HZ PHE 632 HZ PHE 632 7.518 1.510 0.502 634 H ALA 633 HN ALA 633 14.300 -2.087 2.274 635 HA ALA 633 HA ALA 633 16.258 -3.398 0.555 636 HB1 ALA 633 HB1 ALA 633 17.044 -4.463 2.598 637 HB2 ALA 633 HB2 ALA 633 15.682 -3.783 3.494 638 HB3 ALA 633 HB3 ALA 633 16.920 -2.717 2.829 639 H VAL 634 HN VAL 634 15.263 -4.798 -0.758 640 HA VAL 634 HA VAL 634 12.845 -6.136 -0.035 641 HB VAL 634 HB VAL 634 14.642 -6.442 -2.442 642 HG11 VAL 634 HG11 VAL 634 13.308 -8.482 -2.022 643 HG12 VAL 634 HG12 VAL 634 12.840 -7.650 -3.504 644 HG13 VAL 634 HG13 VAL 634 11.843 -7.499 -2.057 645 HG21 VAL 634 HG21 VAL 634 12.810 -5.171 -3.552 646 HG22 VAL 634 HG22 VAL 634 13.661 -4.256 -2.306 647 HG23 VAL 634 HG23 VAL 634 12.071 -4.943 -1.964 648 H GLY 635 HN GLY 635 12.653 -7.908 1.092 649 HA2 GLY 635 HA2 GLY 635 12.934 -10.086 1.750 650 HA3 GLY 635 HA1 GLY 635 14.144 -10.258 0.492 651 H GLU 636 HN GLU 636 14.942 -11.643 2.405 652 HA GLU 636 HA GLU 636 16.180 -10.336 4.582 653 HB2 GLU 636 HB2 GLU 636 15.432 -12.712 4.545 654 HB3 GLU 636 HB1 GLU 636 16.743 -13.057 3.431 655 HG2 GLU 636 HG2 GLU 636 18.337 -12.285 5.130 656 HG3 GLU 636 HG1 GLU 636 16.990 -12.081 6.245 657 H HIS 637 HN HIS 637 17.044 -10.863 1.298 658 HA HIS 637 HA HIS 637 19.885 -10.619 1.663 659 HB2 HIS 637 HB2 HIS 637 18.944 -11.804 -0.280 660 HB3 HIS 637 HB1 HIS 637 18.186 -10.318 -0.828 661 HD1 HIS 637 HD1 HIS 637 21.551 -11.979 -0.543 662 HD2 HIS 637 HD2 HIS 637 19.835 -8.596 -2.243 663 HE1 HIS 637 HE1 HIS 637 23.300 -11.032 -2.080 664 HE2 HIS 637 HE2 HIS 637 22.203 -9.048 -3.175 665 H ARG 638 HN ARG 638 17.231 -8.530 1.546 666 HA ARG 638 HA ARG 638 16.990 -6.325 1.930 667 HB2 ARG 638 HB2 ARG 638 19.904 -6.437 2.691 668 HB3 ARG 638 HB1 ARG 638 18.788 -5.160 3.113 669 HG2 ARG 638 HG2 ARG 638 17.498 -6.663 4.471 670 HG3 ARG 638 HG1 ARG 638 18.523 -8.018 3.988 671 HD2 ARG 638 HD2 ARG 638 19.117 -7.138 6.195 672 HD3 ARG 638 HD1 ARG 638 20.437 -6.985 5.041 673 HE ARG 638 HE ARG 638 18.752 -4.652 5.310 674 HH11 ARG 638 HH11 ARG 638 21.627 -6.314 6.407 675 HH12 ARG 638 HH12 ARG 638 22.371 -4.876 7.031 676 HH21 ARG 638 HH21 ARG 638 19.725 -2.753 6.120 677 HH22 ARG 638 HH22 ARG 638 21.300 -2.854 6.855 678 H ALA 639 HN ALA 639 17.596 -7.074 -0.755 679 HA ALA 639 HA ALA 639 19.467 -5.279 -1.915 680 HB1 ALA 639 HB1 ALA 639 17.054 -6.579 -3.177 681 HB2 ALA 639 HB2 ALA 639 18.679 -7.259 -3.116 682 HB3 ALA 639 HB3 ALA 639 18.374 -5.788 -4.038 683 H GLN 640 HN GLN 640 19.296 -3.150 -2.132 684 HA GLN 640 HA GLN 640 16.857 -1.929 -1.201 685 HB2 GLN 640 HB2 GLN 640 19.564 -0.796 -1.840 686 HB3 GLN 640 HB1 GLN 640 18.193 0.205 -1.377 687 HG2 GLN 640 HG2 GLN 640 17.997 -1.151 0.695 688 HG3 GLN 640 HG1 GLN 640 19.501 -1.954 0.250 689 HE21 GLN 640 HE21 GLN 640 18.911 -0.368 2.591 690 HE22 GLN 640 HE22 GLN 640 20.050 0.943 2.576 691 H VAL 641 HN VAL 641 15.312 -1.376 -2.401 692 HA VAL 641 HA VAL 641 15.799 -0.611 -5.205 693 HB VAL 641 HB VAL 641 13.274 -1.669 -3.909 694 HG11 VAL 641 HG11 VAL 641 12.316 -1.646 -6.175 695 HG12 VAL 641 HG12 VAL 641 13.757 -0.815 -6.763 696 HG13 VAL 641 HG13 VAL 641 12.697 -0.024 -5.597 697 HG21 VAL 641 HG21 VAL 641 15.118 -2.863 -5.974 698 HG22 VAL 641 HG22 VAL 641 13.590 -3.566 -5.445 699 HG23 VAL 641 HG23 VAL 641 14.925 -3.399 -4.304 700 H SER 642 HN SER 642 15.755 1.478 -5.532 701 HA SER 642 HA SER 642 14.362 3.230 -3.668 702 HB2 SER 642 HB2 SER 642 16.168 3.896 -6.008 703 HB3 SER 642 HB1 SER 642 15.577 5.034 -4.799 704 HG SER 642 HG SER 642 17.134 4.433 -3.536 705 H VAL 643 HN VAL 643 12.225 3.386 -4.113 706 HA VAL 643 HA VAL 643 11.459 3.735 -6.920 707 HB VAL 643 HB VAL 643 10.574 1.689 -5.983 708 HG11 VAL 643 HG11 VAL 643 10.619 2.233 -3.626 709 HG12 VAL 643 HG12 VAL 643 9.010 1.687 -4.096 710 HG13 VAL 643 HG13 VAL 643 9.321 3.405 -3.848 711 HG21 VAL 643 HG21 VAL 643 9.171 2.833 -7.561 712 HG22 VAL 643 HG22 VAL 643 8.457 3.797 -6.271 713 HG23 VAL 643 HG23 VAL 643 8.179 2.056 -6.330 714 H GLU 644 HN GLU 644 10.737 5.669 -7.469 715 HA GLU 644 HA GLU 644 10.239 7.679 -5.435 716 HB2 GLU 644 HB2 GLU 644 10.386 7.797 -8.448 717 HB3 GLU 644 HB1 GLU 644 10.004 9.191 -7.449 718 HG2 GLU 644 HG2 GLU 644 12.152 9.056 -6.367 719 HG3 GLU 644 HG1 GLU 644 12.542 7.585 -7.255 720 H VAL 645 HN VAL 645 8.259 7.598 -4.536 721 HA VAL 645 HA VAL 645 5.941 7.095 -6.249 722 HB VAL 645 HB VAL 645 6.542 6.502 -3.355 723 HG11 VAL 645 HG11 VAL 645 3.901 6.172 -4.732 724 HG12 VAL 645 HG12 VAL 645 4.305 7.453 -3.591 725 HG13 VAL 645 HG13 VAL 645 4.295 5.771 -3.061 726 HG21 VAL 645 HG21 VAL 645 7.345 4.863 -4.957 727 HG22 VAL 645 HG22 VAL 645 5.738 4.745 -5.671 728 HG23 VAL 645 HG23 VAL 645 6.010 4.198 -4.017 729 H LEU 646 HN LEU 646 4.041 8.396 -5.862 730 HA LEU 646 HA LEU 646 4.545 11.014 -4.792 731 HB2 LEU 646 HB2 LEU 646 1.972 9.750 -5.727 732 HB3 LEU 646 HB1 LEU 646 2.095 11.396 -5.139 733 HG LEU 646 HG LEU 646 2.958 10.235 -7.719 734 HD11 LEU 646 HD11 LEU 646 0.920 11.625 -7.444 735 HD12 LEU 646 HD12 LEU 646 2.083 12.298 -8.586 736 HD13 LEU 646 HD13 LEU 646 1.957 12.972 -6.961 737 HD21 LEU 646 HD21 LEU 646 5.068 10.990 -6.852 738 HD22 LEU 646 HD22 LEU 646 4.355 12.540 -6.406 739 HD23 LEU 646 HD23 LEU 646 4.505 12.094 -8.107 740 H VAL 647 HN VAL 647 3.847 11.846 -2.878 741 HA VAL 647 HA VAL 647 3.807 10.046 -0.714 742 HB VAL 647 HB VAL 647 3.430 12.021 0.712 743 HG11 VAL 647 HG11 VAL 647 5.685 11.461 0.015 744 HG12 VAL 647 HG12 VAL 647 5.489 13.212 0.104 745 HG13 VAL 647 HG13 VAL 647 5.484 12.402 -1.463 746 HG21 VAL 647 HG21 VAL 647 1.913 13.287 -0.652 747 HG22 VAL 647 HG22 VAL 647 3.122 13.452 -1.923 748 HG23 VAL 647 HG23 VAL 647 3.359 14.257 -0.370 749 H GLU 648 HN GLU 648 1.253 11.075 -2.683 750 HA GLU 648 HA GLU 648 -0.777 10.894 -0.630 751 HB2 GLU 648 HB2 GLU 648 -2.364 11.237 -2.516 752 HB3 GLU 648 HB1 GLU 648 -1.160 12.505 -2.362 753 HG2 GLU 648 HG2 GLU 648 0.112 11.546 -4.190 754 HG3 GLU 648 HG1 GLU 648 -1.060 10.236 -4.334 755 H TYR 649 HN TYR 649 1.001 8.653 -2.259 756 HA TYR 649 HA TYR 649 -1.110 6.760 -2.758 757 HB2 TYR 649 HB2 TYR 649 1.873 6.753 -3.046 758 HB3 TYR 649 HB1 TYR 649 0.985 5.237 -3.074 759 HD1 TYR 649 HD2 TYR 649 0.759 8.630 -4.623 760 HD2 TYR 649 HD1 TYR 649 0.372 4.430 -5.141 761 HE1 TYR 649 HE2 TYR 649 0.240 8.979 -7.000 762 HE2 TYR 649 HE1 TYR 649 -0.151 4.765 -7.518 763 HH TYR 649 HH TYR 649 0.320 7.752 -9.097 764 HA PRO 650 HA PRO 650 -0.730 5.068 1.355 765 HB2 PRO 650 HB2 PRO 650 -2.937 3.493 1.193 766 HB3 PRO 650 HB1 PRO 650 -3.000 5.218 1.543 767 HG2 PRO 650 HG2 PRO 650 -3.785 3.780 -0.882 768 HG3 PRO 650 HG1 PRO 650 -4.236 5.403 -0.342 769 HD2 PRO 650 HD2 PRO 650 -2.274 4.655 -2.289 770 HD3 PRO 650 HD1 PRO 650 -2.740 6.284 -1.778 771 H PHE 651 HN PHE 651 0.127 3.224 2.141 772 HA PHE 651 HA PHE 651 0.414 0.949 0.312 773 HB2 PHE 651 HB2 PHE 651 2.575 2.261 1.963 774 HB3 PHE 651 HB1 PHE 651 2.730 0.641 1.296 775 HD1 PHE 651 HD1 PHE 651 2.537 4.208 0.514 776 HD2 PHE 651 HD2 PHE 651 3.100 0.290 -1.040 777 HE1 PHE 651 HE1 PHE 651 3.345 5.165 -1.593 778 HE2 PHE 651 HE2 PHE 651 3.915 1.241 -3.157 779 HZ PHE 651 HZ PHE 651 4.037 3.683 -3.437 780 H PHE 652 HN PHE 652 -0.449 -0.765 1.204 781 HA PHE 652 HA PHE 652 -0.950 -1.057 3.969 782 HB2 PHE 652 HB2 PHE 652 -1.458 -2.537 1.572 783 HB3 PHE 652 HB1 PHE 652 -0.729 -3.620 2.756 784 HD1 PHE 652 HD2 PHE 652 -1.731 -3.733 5.046 785 HD2 PHE 652 HD1 PHE 652 -3.697 -1.901 1.755 786 HE1 PHE 652 HE2 PHE 652 -3.863 -3.895 6.239 787 HE2 PHE 652 HE1 PHE 652 -5.841 -2.049 2.948 788 HZ PHE 652 HZ PHE 652 -5.925 -3.046 5.199 789 H VAL 653 HN VAL 653 0.338 -1.947 5.578 790 HA VAL 653 HA VAL 653 3.077 -2.508 4.661 791 HB VAL 653 HB VAL 653 2.499 -1.571 7.443 792 HG11 VAL 653 HG11 VAL 653 4.744 -2.432 6.290 793 HG12 VAL 653 HG12 VAL 653 4.720 -1.209 7.558 794 HG13 VAL 653 HG13 VAL 653 4.838 -0.723 5.863 795 HG21 VAL 653 HG21 VAL 653 1.474 0.200 6.304 796 HG22 VAL 653 HG22 VAL 653 2.658 0.149 4.997 797 HG23 VAL 653 HG23 VAL 653 3.138 0.743 6.594 798 H PHE 654 HN PHE 654 4.021 -4.320 5.205 799 HA PHE 654 HA PHE 654 2.526 -6.599 5.742 800 HB2 PHE 654 HB2 PHE 654 4.626 -6.429 4.418 801 HB3 PHE 654 HB1 PHE 654 5.558 -6.276 5.908 802 HD1 PHE 654 HD1 PHE 654 2.807 -8.534 4.713 803 HD2 PHE 654 HD2 PHE 654 6.704 -8.195 6.389 804 HE1 PHE 654 HE1 PHE 654 2.963 -10.985 4.835 805 HE2 PHE 654 HE2 PHE 654 6.866 -10.646 6.515 806 HZ PHE 654 HZ PHE 654 4.995 -12.044 5.739 807 H GLY 655 HN GLY 655 1.480 -6.192 7.818 808 HA2 GLY 655 HA2 GLY 655 1.368 -7.136 9.979 809 HA3 GLY 655 HA1 GLY 655 3.121 -7.250 10.002 810 H GLN 656 HN GLN 656 2.844 -4.321 8.892 811 HA GLN 656 HA GLN 656 3.130 -3.111 11.485 812 HB2 GLN 656 HB2 GLN 656 3.572 -2.154 8.673 813 HB3 GLN 656 HB1 GLN 656 3.682 -1.083 10.041 814 HG2 GLN 656 HG2 GLN 656 5.878 -1.707 9.537 815 HG3 GLN 656 HG1 GLN 656 5.448 -2.668 10.933 816 HE21 GLN 656 HE21 GLN 656 4.408 -3.201 7.671 817 HE22 GLN 656 HE22 GLN 656 5.210 -4.714 7.390 818 H GLY 657 HN GLY 657 1.066 -2.637 8.578 819 HA2 GLY 657 HA2 GLY 657 -1.343 -2.499 9.680 820 HA3 GLY 657 HA1 GLY 657 -0.709 -0.934 10.150 821 H TRP 658 HN TRP 658 -2.279 0.154 9.004 822 HA TRP 658 HA TRP 658 -2.221 -0.101 6.068 823 HB2 TRP 658 HB2 TRP 658 -4.386 -0.677 7.215 824 HB3 TRP 658 HB1 TRP 658 -4.430 0.958 7.847 825 HD1 TRP 658 HD1 TRP 658 -6.844 1.049 6.649 826 HE1 TRP 658 HE1 TRP 658 -7.500 1.717 4.263 827 HE3 TRP 658 HE3 TRP 658 -2.278 0.568 4.353 828 HZ2 TRP 658 HZ2 TRP 658 -6.274 2.013 1.757 829 HZ3 TRP 658 HZ3 TRP 658 -2.128 1.069 1.953 830 HH2 TRP 658 HH2 TRP 658 -4.080 1.779 0.686 831 H SER 659 HN SER 659 -0.749 1.467 5.439 832 HA SER 659 HA SER 659 -0.957 4.099 6.750 833 HB2 SER 659 HB2 SER 659 1.599 2.604 6.100 834 HB3 SER 659 HB1 SER 659 1.492 4.190 6.861 835 HG SER 659 HG SER 659 1.718 2.147 8.215 836 H SER 660 HN SER 660 0.238 5.844 5.565 837 HA SER 660 HA SER 660 0.816 5.280 2.761 838 HB2 SER 660 HB2 SER 660 -0.462 7.168 1.935 839 HB3 SER 660 HB1 SER 660 -1.542 6.109 2.842 840 HG SER 660 HG SER 660 -1.645 8.460 3.255 841 H CYS 661 HN CYS 661 2.097 6.947 1.742 842 HA CYS 661 HA CYS 661 4.249 7.719 3.373 843 HB2 CYS 661 HB2 CYS 661 3.504 8.704 0.616 844 HB3 CYS 661 HB1 CYS 661 5.083 8.883 1.375 845 HG CYS 661 HG CYS 661 5.326 5.986 1.578 846 H CYS 662 HN CYS 662 1.271 9.246 2.713 847 HA CYS 662 HA CYS 662 1.881 11.276 4.625 848 HB2 CYS 662 HB2 CYS 662 2.721 12.348 2.556 849 HB3 CYS 662 HB1 CYS 662 1.140 12.127 1.813 850 HG CYS 662 HG CYS 662 1.830 14.122 4.507 851 HA PRO 663 HA PRO 663 -2.318 9.453 4.941 852 HB2 PRO 663 HB2 PRO 663 -1.942 10.768 7.583 853 HB3 PRO 663 HB1 PRO 663 -2.568 9.161 7.201 854 HG2 PRO 663 HG2 PRO 663 -0.110 9.462 8.171 855 HG3 PRO 663 HG1 PRO 663 -0.446 8.260 6.913 856 HD2 PRO 663 HD2 PRO 663 0.880 10.925 6.687 857 HD3 PRO 663 HD1 PRO 663 1.223 9.415 5.818 858 H GLU 664 HN GLU 664 -1.154 12.632 5.904 859 HA GLU 664 HA GLU 664 -3.492 14.030 6.126 860 HB2 GLU 664 HB2 GLU 664 -1.332 14.952 6.700 861 HB3 GLU 664 HB1 GLU 664 -0.808 14.861 5.024 862 HG2 GLU 664 HG2 GLU 664 -2.489 16.478 4.405 863 HG3 GLU 664 HG1 GLU 664 -3.028 16.565 6.077 864 H ARG 665 HN ARG 665 -1.525 13.499 3.205 865 HA ARG 665 HA ARG 665 -3.314 14.998 1.542 866 HB2 ARG 665 HB2 ARG 665 -0.852 14.785 1.161 867 HB3 ARG 665 HB1 ARG 665 -1.100 13.102 0.728 868 HG2 ARG 665 HG2 ARG 665 -2.346 13.705 -1.210 869 HG3 ARG 665 HG1 ARG 665 -2.389 15.401 -0.722 870 HD2 ARG 665 HD2 ARG 665 -0.014 15.599 -1.002 871 HD3 ARG 665 HD1 ARG 665 0.139 13.874 -1.307 872 HE ARG 665 HE ARG 665 -1.333 14.411 -3.346 873 HH11 ARG 665 HH11 ARG 665 1.062 16.595 -1.986 874 HH12 ARG 665 HH12 ARG 665 1.408 17.352 -3.509 875 HH21 ARG 665 HH21 ARG 665 -0.858 15.397 -5.335 876 HH22 ARG 665 HH22 ARG 665 0.320 16.674 -5.408 877 H THR 666 HN THR 666 -2.753 11.528 2.136 878 HA THR 666 HA THR 666 -4.494 10.567 0.145 879 HB THR 666 HB THR 666 -4.091 9.195 2.803 880 HG1 THR 666 HG1 THR 666 -2.340 8.965 0.574 881 HG21 THR 666 HG21 THR 666 -4.368 8.108 -0.012 882 HG22 THR 666 HG22 THR 666 -5.665 8.172 1.177 883 HG23 THR 666 HG23 THR 666 -4.254 7.157 1.470 884 H SER 667 HN SER 667 -5.067 11.349 3.579 885 HA SER 667 HA SER 667 -7.846 10.862 3.500 886 HB2 SER 667 HB2 SER 667 -6.144 12.535 5.349 887 HB3 SER 667 HB1 SER 667 -7.833 12.146 5.632 888 HG SER 667 HG SER 667 -6.541 9.894 5.061 889 H GLN 668 HN GLN 668 -5.889 13.764 2.981 890 HA GLN 668 HA GLN 668 -7.871 15.687 2.906 891 HB2 GLN 668 HB2 GLN 668 -5.177 15.389 1.844 892 HB3 GLN 668 HB1 GLN 668 -6.170 16.598 1.051 893 HG2 GLN 668 HG2 GLN 668 -5.618 16.414 3.993 894 HG3 GLN 668 HG1 GLN 668 -4.902 17.516 2.853 895 HE21 GLN 668 HE21 GLN 668 -5.596 19.297 4.029 896 HE22 GLN 668 HE22 GLN 668 -7.248 19.806 4.018 897 H LEU 669 HN LEU 669 -6.602 13.756 0.202 898 HA LEU 669 HA LEU 669 -8.454 15.107 -1.588 899 HB2 LEU 669 HB2 LEU 669 -6.428 13.027 -2.349 900 HB3 LEU 669 HB1 LEU 669 -7.140 14.268 -3.358 901 HG LEU 669 HG LEU 669 -5.116 14.668 -1.160 902 HD11 LEU 669 HD11 LEU 669 -4.945 15.080 -4.138 903 HD12 LEU 669 HD12 LEU 669 -4.187 13.781 -3.215 904 HD13 LEU 669 HD13 LEU 669 -3.679 15.451 -2.968 905 HD21 LEU 669 HD21 LEU 669 -5.118 17.045 -1.834 906 HD22 LEU 669 HD22 LEU 669 -6.636 16.535 -1.099 907 HD23 LEU 669 HD23 LEU 669 -6.526 16.730 -2.851 908 H PHE 670 HN PHE 670 -7.820 11.899 -0.301 909 HA PHE 670 HA PHE 670 -9.957 10.800 -1.997 910 HB2 PHE 670 HB2 PHE 670 -7.881 9.236 -0.463 911 HB3 PHE 670 HB1 PHE 670 -8.889 8.671 -1.780 912 HD1 PHE 670 HD1 PHE 670 -8.603 10.508 -3.900 913 HD2 PHE 670 HD2 PHE 670 -5.683 9.330 -1.043 914 HE1 PHE 670 HE1 PHE 670 -6.818 11.092 -5.489 915 HE2 PHE 670 HE2 PHE 670 -3.893 9.912 -2.623 916 HZ PHE 670 HZ PHE 670 -4.459 10.797 -4.849 917 H ASP 671 HN ASP 671 -9.530 11.957 1.028 918 HA ASP 671 HA ASP 671 -10.626 11.836 3.001 919 HB2 ASP 671 HB2 ASP 671 -12.584 10.720 1.096 920 HB3 ASP 671 HB1 ASP 671 -12.863 10.329 2.788 921 H LEU 672 HN LEU 672 -8.994 9.419 1.796 922 HA LEU 672 HA LEU 672 -9.896 7.316 3.575 923 HB2 LEU 672 HB2 LEU 672 -9.281 6.679 1.330 924 HB3 LEU 672 HB1 LEU 672 -7.698 7.412 1.504 925 HG LEU 672 HG LEU 672 -7.233 5.734 3.330 926 HD11 LEU 672 HD11 LEU 672 -8.637 3.799 3.524 927 HD12 LEU 672 HD12 LEU 672 -9.707 4.394 2.253 928 HD13 LEU 672 HD13 LEU 672 -9.614 5.241 3.797 929 HD21 LEU 672 HD21 LEU 672 -7.864 4.572 0.620 930 HD22 LEU 672 HD22 LEU 672 -6.737 3.923 1.814 931 HD23 LEU 672 HD23 LEU 672 -6.398 5.466 1.030 932 HA PRO 673 HA PRO 673 -6.904 8.778 6.573 933 HB2 PRO 673 HB2 PRO 673 -7.728 7.204 8.613 934 HB3 PRO 673 HB1 PRO 673 -8.582 8.672 8.135 935 HG2 PRO 673 HG2 PRO 673 -9.261 5.826 7.610 936 HG3 PRO 673 HG1 PRO 673 -10.332 7.209 7.883 937 HD2 PRO 673 HD2 PRO 673 -9.727 6.095 5.415 938 HD3 PRO 673 HD1 PRO 673 -10.407 7.707 5.667 939 H CYS 674 HN CYS 674 -4.895 8.081 7.012 940 HA CYS 674 HA CYS 674 -4.317 5.201 6.795 941 HB2 CYS 674 HB2 CYS 674 -2.567 7.324 5.524 942 HB3 CYS 674 HB1 CYS 674 -2.465 5.577 5.334 943 HG CYS 674 HG CYS 674 -5.368 5.974 4.301 944 H SER 675 HN SER 675 -2.490 4.504 7.921 945 HA SER 675 HA SER 675 -1.567 6.174 10.078 946 HB2 SER 675 HB2 SER 675 -0.600 3.447 9.174 947 HB3 SER 675 HB1 SER 675 -0.264 4.211 10.728 948 HG SER 675 HG SER 675 -2.936 3.874 9.945 949 H LYS 676 HN LYS 676 0.863 6.498 10.366 950 HA LYS 676 HA LYS 676 1.797 7.735 7.964 951 HB2 LYS 676 HB2 LYS 676 2.194 8.801 10.128 952 HB3 LYS 676 HB1 LYS 676 3.189 7.439 10.627 953 HG2 LYS 676 HG2 LYS 676 4.553 9.327 9.914 954 HG3 LYS 676 HG1 LYS 676 4.778 7.926 8.853 955 HD2 LYS 676 HD2 LYS 676 3.208 8.921 7.234 956 HD3 LYS 676 HD1 LYS 676 3.023 10.321 8.289 957 HE2 LYS 676 HE2 LYS 676 5.628 9.423 7.063 958 HE3 LYS 676 HE1 LYS 676 4.607 10.708 6.425 959 HZ1 LYS 676 HZ1 LYS 676 5.907 10.702 9.096 960 HZ2 LYS 676 HZ2 LYS 676 4.927 11.936 8.483 961 HZ3 LYS 676 HZ3 LYS 676 6.413 11.596 7.753 962 H LEU 677 HN LEU 677 2.803 6.749 6.408 963 HA LEU 677 HA LEU 677 4.248 4.274 6.834 964 HB2 LEU 677 HB2 LEU 677 2.795 4.796 4.823 965 HB3 LEU 677 HB1 LEU 677 4.017 5.933 4.315 966 HG LEU 677 HG LEU 677 4.061 3.763 3.114 967 HD11 LEU 677 HD11 LEU 677 6.542 4.379 4.700 968 HD12 LEU 677 HD12 LEU 677 6.059 5.137 3.183 969 HD13 LEU 677 HD13 LEU 677 6.471 3.423 3.220 970 HD21 LEU 677 HD21 LEU 677 4.903 1.788 4.226 971 HD22 LEU 677 HD22 LEU 677 3.416 2.346 4.992 972 HD23 LEU 677 HD23 LEU 677 4.974 2.658 5.757 973 H SER 678 HN SER 678 6.265 4.382 7.629 974 HA SER 678 HA SER 678 8.143 6.288 6.523 975 HB2 SER 678 HB2 SER 678 7.512 6.222 9.478 976 HB3 SER 678 HB1 SER 678 8.855 7.096 8.750 977 HG SER 678 HG SER 678 6.607 7.715 7.450 978 H VAL 679 HN VAL 679 10.334 5.906 7.200 979 HA VAL 679 HA VAL 679 11.140 3.422 6.517 980 HB VAL 679 HB VAL 679 12.663 5.211 6.340 981 HG11 VAL 679 HG11 VAL 679 13.659 6.316 8.327 982 HG12 VAL 679 HG12 VAL 679 12.473 5.480 9.332 983 HG13 VAL 679 HG13 VAL 679 11.939 6.637 8.111 984 HG21 VAL 679 HG21 VAL 679 14.662 4.262 7.139 985 HG22 VAL 679 HG22 VAL 679 13.552 2.908 6.889 986 HG23 VAL 679 HG23 VAL 679 13.845 3.518 8.517 987 H GLY 680 HN GLY 680 11.823 1.588 7.451 988 HA2 GLY 680 HA2 GLY 680 12.190 0.132 9.300 989 HA3 GLY 680 HA1 GLY 680 11.259 1.221 10.307 990 H ASP 681 HN ASP 681 9.529 1.141 7.573 991 HA ASP 681 HA ASP 681 7.849 -1.029 8.596 992 HB2 ASP 681 HB2 ASP 681 6.104 -0.205 7.157 993 HB3 ASP 681 HB1 ASP 681 6.724 1.155 8.038 994 H VAL 682 HN VAL 682 7.550 -2.952 7.468 995 HA VAL 682 HA VAL 682 8.796 -3.093 4.878 996 HB VAL 682 HB VAL 682 9.311 -5.041 6.001 997 HG11 VAL 682 HG11 VAL 682 6.536 -5.177 6.944 998 HG12 VAL 682 HG12 VAL 682 7.979 -4.876 7.891 999 HG13 VAL 682 HG13 VAL 682 7.713 -6.461 7.159 1000 HG21 VAL 682 HG21 VAL 682 7.981 -6.871 4.959 1001 HG22 VAL 682 HG22 VAL 682 8.657 -5.678 3.855 1002 HG23 VAL 682 HG23 VAL 682 6.949 -5.607 4.287 1003 H CYS 683 HN CYS 683 7.635 -2.248 3.265 1004 HA CYS 683 HA CYS 683 4.809 -2.025 3.463 1005 HB2 CYS 683 HB2 CYS 683 6.800 -1.360 1.353 1006 HB3 CYS 683 HB1 CYS 683 5.100 -1.355 0.947 1007 HG CYS 683 HG CYS 683 6.361 0.486 3.544 1008 H ILE 684 HN ILE 684 3.242 -3.051 2.462 1009 HA ILE 684 HA ILE 684 3.758 -5.699 1.431 1010 HB ILE 684 HB ILE 684 1.203 -4.156 1.921 1011 HG12 ILE 684 HG12 ILE 684 2.257 -6.673 3.205 1012 HG13 ILE 684 HG11 ILE 684 2.411 -5.063 3.893 1013 HG21 ILE 684 HG21 ILE 684 0.802 -5.510 -0.011 1014 HG22 ILE 684 HG22 ILE 684 0.013 -6.268 1.373 1015 HG23 ILE 684 HG23 ILE 684 1.536 -6.913 0.761 1016 HD11 ILE 684 HD11 ILE 684 -0.196 -6.440 3.292 1017 HD12 ILE 684 HD12 ILE 684 0.015 -4.869 4.068 1018 HD13 ILE 684 HD13 ILE 684 0.565 -6.333 4.882 1019 H SER 685 HN SER 685 4.610 -5.528 -0.620 1020 HA SER 685 HA SER 685 2.962 -4.061 -2.537 1021 HB2 SER 685 HB2 SER 685 5.778 -5.149 -2.756 1022 HB3 SER 685 HB1 SER 685 4.876 -4.470 -4.120 1023 HG SER 685 HG SER 685 4.831 -2.916 -1.859 1024 H LEU 686 HN LEU 686 1.566 -5.124 -3.715 1025 HA LEU 686 HA LEU 686 1.443 -7.991 -3.260 1026 HB2 LEU 686 HB2 LEU 686 -0.418 -6.006 -3.071 1027 HB3 LEU 686 HB1 LEU 686 -0.763 -6.648 -4.663 1028 HG LEU 686 HG LEU 686 -2.150 -7.629 -2.859 1029 HD11 LEU 686 HD11 LEU 686 -1.903 -9.936 -3.551 1030 HD12 LEU 686 HD12 LEU 686 -0.322 -9.570 -4.245 1031 HD13 LEU 686 HD13 LEU 686 -1.776 -8.842 -4.928 1032 HD21 LEU 686 HD21 LEU 686 -1.186 -9.213 -1.296 1033 HD22 LEU 686 HD22 LEU 686 -0.448 -7.624 -1.084 1034 HD23 LEU 686 HD23 LEU 686 0.423 -8.894 -1.937 1035 H THR 687 HN THR 687 1.525 -9.472 -4.832 1036 HA THR 687 HA THR 687 2.278 -8.549 -7.502 1037 HB THR 687 HB THR 687 2.377 -11.347 -6.350 1038 HG1 THR 687 HG1 THR 687 3.818 -9.277 -5.633 1039 HG21 THR 687 HG21 THR 687 3.987 -11.758 -8.152 1040 HG22 THR 687 HG22 THR 687 3.761 -10.107 -8.731 1041 HG23 THR 687 HG23 THR 687 2.423 -11.255 -8.792 1042 H LEU 688 HN LEU 688 0.761 -8.507 -9.021 1043 HA LEU 688 HA LEU 688 -1.674 -10.086 -8.612 1044 HB2 LEU 688 HB2 LEU 688 -1.295 -7.729 -10.463 1045 HB3 LEU 688 HB1 LEU 688 -2.804 -8.524 -10.084 1046 HG LEU 688 HG LEU 688 -2.829 -6.474 -8.922 1047 HD11 LEU 688 HD11 LEU 688 -3.675 -8.249 -7.553 1048 HD12 LEU 688 HD12 LEU 688 -2.800 -7.101 -6.535 1049 HD13 LEU 688 HD13 LEU 688 -2.050 -8.637 -6.983 1050 HD21 LEU 688 HD21 LEU 688 -0.100 -7.128 -7.850 1051 HD22 LEU 688 HD22 LEU 688 -1.058 -5.702 -7.449 1052 HD23 LEU 688 HD23 LEU 688 -0.465 -5.935 -9.095 1053 H LYS 689 HN LYS 689 -1.229 -12.018 -9.576 1054 HA LYS 689 HA LYS 689 0.273 -12.169 -11.997 1055 HB2 LYS 689 HB2 LYS 689 -1.126 -14.161 -10.288 1056 HB3 LYS 689 HB1 LYS 689 -0.493 -14.628 -11.854 1057 HG2 LYS 689 HG2 LYS 689 1.088 -13.427 -9.597 1058 HG3 LYS 689 HG1 LYS 689 1.072 -15.131 -10.050 1059 HD2 LYS 689 HD2 LYS 689 2.013 -12.846 -11.785 1060 HD3 LYS 689 HD1 LYS 689 3.049 -13.977 -10.921 1061 HE2 LYS 689 HE2 LYS 689 2.223 -15.817 -12.243 1062 HE3 LYS 689 HE1 LYS 689 1.052 -14.765 -13.034 1063 HZ1 LYS 689 HZ1 LYS 689 2.883 -13.508 -13.985 1064 HZ2 LYS 689 HZ2 LYS 689 2.968 -15.135 -14.436 1065 HZ3 LYS 689 HZ3 LYS 689 4.001 -14.535 -13.242 Start of MODEL 8 1 H1 VAL 34 HT1 VAL 34 -18.074 -4.467 -7.195 2 H2 VAL 34 HT2 VAL 34 -17.698 -2.828 -7.350 3 H3 VAL 34 HT3 VAL 34 -18.685 -3.348 -6.085 4 HA VAL 34 HA VAL 34 -16.470 -2.870 -5.282 5 HB VAL 34 HB VAL 34 -16.909 -5.853 -5.338 6 HG11 VAL 34 HG11 VAL 34 -14.832 -5.293 -4.330 7 HG12 VAL 34 HG12 VAL 34 -15.964 -5.752 -3.059 8 HG13 VAL 34 HG13 VAL 34 -15.596 -4.050 -3.340 9 HG21 VAL 34 HG21 VAL 34 -19.018 -4.796 -4.799 10 HG22 VAL 34 HG22 VAL 34 -18.229 -3.819 -3.562 11 HG23 VAL 34 HG23 VAL 34 -18.336 -5.568 -3.368 12 H PHE 35 HN PHE 35 -14.270 -3.331 -5.310 13 HA PHE 35 HA PHE 35 -13.275 -4.206 -7.934 14 HB2 PHE 35 HB2 PHE 35 -12.076 -2.352 -5.867 15 HB3 PHE 35 HB1 PHE 35 -11.234 -2.882 -7.317 16 HD1 PHE 35 HD1 PHE 35 -13.891 -0.774 -5.983 17 HD2 PHE 35 HD2 PHE 35 -11.849 -2.042 -9.485 18 HE1 PHE 35 HE1 PHE 35 -14.855 1.103 -7.221 19 HE2 PHE 35 HE2 PHE 35 -12.819 -0.160 -10.739 20 HZ PHE 35 HZ PHE 35 -14.327 1.419 -9.603 21 HA PRO 36 HA PRO 36 -10.781 -7.460 -6.032 22 HB2 PRO 36 HB2 PRO 36 -8.526 -6.300 -7.582 23 HB3 PRO 36 HB1 PRO 36 -9.128 -7.959 -7.554 24 HG2 PRO 36 HG2 PRO 36 -9.582 -6.370 -9.649 25 HG3 PRO 36 HG1 PRO 36 -10.809 -7.519 -9.081 26 HD2 PRO 36 HD2 PRO 36 -10.659 -4.559 -8.698 27 HD3 PRO 36 HD1 PRO 36 -12.074 -5.591 -8.983 28 H TRP 37 HN TRP 37 -9.388 -7.535 -4.298 29 HA TRP 37 HA TRP 37 -9.283 -5.259 -2.741 30 HB2 TRP 37 HB2 TRP 37 -7.687 -6.657 -1.295 31 HB3 TRP 37 HB1 TRP 37 -9.321 -7.241 -1.565 32 HD1 TRP 37 HD1 TRP 37 -9.478 -9.186 -3.646 33 HE1 TRP 37 HE1 TRP 37 -7.883 -11.159 -4.037 34 HE3 TRP 37 HE3 TRP 37 -5.435 -7.485 -1.030 35 HZ2 TRP 37 HZ2 TRP 37 -5.286 -11.910 -3.306 36 HZ3 TRP 37 HZ3 TRP 37 -3.438 -8.910 -0.923 37 HH2 TRP 37 HH2 TRP 37 -3.363 -11.071 -2.039 38 H HIS 38 HN HIS 38 -7.106 -6.131 -5.225 39 HA HIS 38 HA HIS 38 -4.914 -4.567 -4.208 40 HB2 HIS 38 HB2 HIS 38 -4.719 -6.485 -5.879 41 HB3 HIS 38 HB1 HIS 38 -5.362 -5.377 -7.082 42 HD1 HIS 38 HD1 HIS 38 -3.744 -3.698 -8.103 43 HD2 HIS 38 HD2 HIS 38 -2.104 -5.848 -4.947 44 HE1 HIS 38 HE1 HIS 38 -1.272 -3.231 -8.175 45 HE2 HIS 38 HE2 HIS 38 -0.287 -4.739 -6.410 46 H SER 39 HN SER 39 -6.980 -3.011 -3.854 47 HA SER 39 HA SER 39 -7.118 -1.134 -6.121 48 HB2 SER 39 HB2 SER 39 -9.302 -1.973 -5.528 49 HB3 SER 39 HB1 SER 39 -9.015 -1.674 -3.818 50 HG SER 39 HG SER 39 -8.777 0.635 -4.605 51 H LEU 40 HN LEU 40 -5.660 -1.640 -3.218 52 HA LEU 40 HA LEU 40 -5.036 1.181 -2.807 53 HB2 LEU 40 HB2 LEU 40 -5.357 0.376 -0.216 54 HB3 LEU 40 HB1 LEU 40 -6.497 1.345 -1.125 55 HG LEU 40 HG LEU 40 -6.767 -1.621 -1.288 56 HD11 LEU 40 HD11 LEU 40 -6.500 -1.351 1.070 57 HD12 LEU 40 HD12 LEU 40 -8.224 -1.538 0.730 58 HD13 LEU 40 HD13 LEU 40 -7.558 0.059 1.077 59 HD21 LEU 40 HD21 LEU 40 -9.118 -1.068 -1.454 60 HD22 LEU 40 HD22 LEU 40 -8.204 -0.096 -2.608 61 HD23 LEU 40 HD23 LEU 40 -8.776 0.622 -1.103 62 H VAL 41 HN VAL 41 -4.381 -2.225 -2.255 63 HA VAL 41 HA VAL 41 -1.831 -1.750 -1.053 64 HB VAL 41 HB VAL 41 -3.012 -3.803 -0.518 65 HG11 VAL 41 HG11 VAL 41 -3.251 -5.608 -2.203 66 HG12 VAL 41 HG12 VAL 41 -2.778 -4.459 -3.456 67 HG13 VAL 41 HG13 VAL 41 -4.257 -4.199 -2.530 68 HG21 VAL 41 HG21 VAL 41 -1.215 -5.417 -0.975 69 HG22 VAL 41 HG22 VAL 41 -0.619 -3.858 -0.404 70 HG23 VAL 41 HG23 VAL 41 -0.516 -4.270 -2.115 71 HA PRO 42 HA PRO 42 0.033 -1.171 -5.071 72 HB2 PRO 42 HB2 PRO 42 2.175 0.138 -4.251 73 HB3 PRO 42 HB1 PRO 42 0.570 0.850 -4.036 74 HG2 PRO 42 HG2 PRO 42 2.334 -0.486 -2.032 75 HG3 PRO 42 HG1 PRO 42 1.283 0.928 -1.837 76 HD2 PRO 42 HD2 PRO 42 0.657 -1.727 -1.140 77 HD3 PRO 42 HD1 PRO 42 -0.480 -0.369 -1.251 78 H PHE 43 HN PHE 43 2.472 -1.286 -5.781 79 HA PHE 43 HA PHE 43 3.921 -3.477 -4.481 80 HB2 PHE 43 HB2 PHE 43 2.757 -4.290 -6.577 81 HB3 PHE 43 HB1 PHE 43 3.727 -3.138 -7.485 82 HD1 PHE 43 HD1 PHE 43 3.934 -6.105 -5.285 83 HD2 PHE 43 HD2 PHE 43 5.906 -3.673 -8.166 84 HE1 PHE 43 HE1 PHE 43 5.731 -7.775 -5.460 85 HE2 PHE 43 HE2 PHE 43 7.706 -5.340 -8.345 86 HZ PHE 43 HZ PHE 43 7.620 -7.393 -6.991 87 H LEU 44 HN LEU 44 5.940 -2.787 -3.951 88 HA LEU 44 HA LEU 44 6.399 -0.081 -4.112 89 HB2 LEU 44 HB2 LEU 44 8.425 -0.382 -2.936 90 HB3 LEU 44 HB1 LEU 44 7.262 -1.521 -2.312 91 HG LEU 44 HG LEU 44 9.336 -2.622 -2.312 92 HD11 LEU 44 HD11 LEU 44 7.765 -4.178 -3.053 93 HD12 LEU 44 HD12 LEU 44 9.175 -4.387 -4.094 94 HD13 LEU 44 HD13 LEU 44 7.760 -3.523 -4.686 95 HD21 LEU 44 HD21 LEU 44 9.771 -1.803 -5.158 96 HD22 LEU 44 HD22 LEU 44 10.864 -2.759 -4.158 97 HD23 LEU 44 HD23 LEU 44 10.542 -1.072 -3.751 98 H ALA 45 HN ALA 45 7.701 -2.507 -6.117 99 HA ALA 45 HA ALA 45 8.076 -1.137 -8.422 100 HB1 ALA 45 HB1 ALA 45 10.438 -0.494 -8.463 101 HB2 ALA 45 HB2 ALA 45 10.605 -0.968 -6.774 102 HB3 ALA 45 HB3 ALA 45 9.576 0.395 -7.208 103 HA PRO 46 HA PRO 46 9.518 -5.219 -9.648 104 HB2 PRO 46 HB2 PRO 46 11.236 -4.428 -11.686 105 HB3 PRO 46 HB1 PRO 46 9.505 -4.722 -11.877 106 HG2 PRO 46 HG2 PRO 46 10.964 -2.141 -11.529 107 HG3 PRO 46 HG1 PRO 46 9.556 -2.510 -12.543 108 HD2 PRO 46 HD2 PRO 46 9.303 -1.192 -10.220 109 HD3 PRO 46 HD1 PRO 46 8.076 -2.357 -10.764 110 H SER 47 HN SER 47 10.757 -5.860 -7.933 111 HA SER 47 HA SER 47 12.996 -4.394 -7.022 112 HB2 SER 47 HB2 SER 47 12.356 -7.248 -6.276 113 HB3 SER 47 HB1 SER 47 13.133 -6.008 -5.287 114 HG SER 47 HG SER 47 10.774 -5.066 -6.043 115 H GLN 48 HN GLN 48 15.037 -4.468 -7.640 116 HA GLN 48 HA GLN 48 15.838 -6.168 -9.780 117 HB2 GLN 48 HB2 GLN 48 16.548 -3.811 -9.620 118 HB3 GLN 48 HB1 GLN 48 17.445 -4.193 -8.157 119 HG2 GLN 48 HG2 GLN 48 18.873 -5.709 -9.431 120 HG3 GLN 48 HG1 GLN 48 17.979 -5.312 -10.897 121 HE21 GLN 48 HE21 GLN 48 18.743 -2.984 -8.415 122 HE22 GLN 48 HE22 GLN 48 19.867 -2.066 -9.352 123 H ALA 567 HT1 ALA 567 -25.029 5.326 5.869 124 HA ALA 567 HA ALA 567 -23.286 6.951 5.848 125 HB1 ALA 567 HB1 ALA 567 -21.415 4.588 5.811 126 HB2 ALA 567 HB2 ALA 567 -21.681 5.655 7.188 127 HB3 ALA 567 HB3 ALA 567 -20.959 6.288 5.709 128 HA PRO 568 HA PRO 568 -23.877 6.267 1.518 129 HB2 PRO 568 HB2 PRO 568 -23.102 8.682 0.629 130 HB3 PRO 568 HB1 PRO 568 -24.597 8.463 1.544 131 HG2 PRO 568 HG2 PRO 568 -21.955 9.508 2.450 132 HG3 PRO 568 HG1 PRO 568 -23.585 10.045 2.888 133 HD2 PRO 568 HD2 PRO 568 -21.993 8.395 4.435 134 HD3 PRO 568 HD1 PRO 568 -23.757 8.511 4.562 135 HA PRO 569 HA PRO 569 -19.916 5.224 -0.206 136 HB2 PRO 569 HB2 PRO 569 -20.454 5.319 -2.850 137 HB3 PRO 569 HB1 PRO 569 -21.119 4.062 -1.801 138 HG2 PRO 569 HG2 PRO 569 -22.415 6.555 -2.829 139 HG3 PRO 569 HG1 PRO 569 -23.084 4.918 -2.693 140 HD2 PRO 569 HD2 PRO 569 -23.588 6.904 -0.892 141 HD3 PRO 569 HD1 PRO 569 -23.597 5.180 -0.475 142 H THR 570 HN THR 570 -19.346 7.465 0.723 143 HA THR 570 HA THR 570 -19.184 9.744 -0.893 144 HB THR 570 HB THR 570 -17.378 10.438 0.756 145 HG1 THR 570 HG1 THR 570 -16.948 8.062 1.224 146 HG21 THR 570 HG21 THR 570 -18.972 10.643 2.628 147 HG22 THR 570 HG22 THR 570 -20.042 9.503 1.815 148 HG23 THR 570 HG23 THR 570 -19.696 11.067 1.079 149 H LEU 571 HN LEU 571 -17.584 10.559 -2.170 150 HA LEU 571 HA LEU 571 -16.053 10.569 -3.766 151 HB2 LEU 571 HB2 LEU 571 -14.649 8.925 -1.704 152 HB3 LEU 571 HB1 LEU 571 -13.897 9.604 -3.116 153 HG LEU 571 HG LEU 571 -15.101 11.785 -1.931 154 HD11 LEU 571 HD11 LEU 571 -14.371 11.743 0.384 155 HD12 LEU 571 HD12 LEU 571 -13.807 10.084 0.193 156 HD13 LEU 571 HD13 LEU 571 -15.526 10.448 0.077 157 HD21 LEU 571 HD21 LEU 571 -12.943 11.762 -3.021 158 HD22 LEU 571 HD22 LEU 571 -12.269 10.790 -1.713 159 HD23 LEU 571 HD23 LEU 571 -12.800 12.443 -1.401 160 HA PRO 572 HA PRO 572 -16.086 7.118 -6.627 161 HB2 PRO 572 HB2 PRO 572 -13.110 7.242 -6.381 162 HB3 PRO 572 HB1 PRO 572 -14.107 7.070 -7.829 163 HG2 PRO 572 HG2 PRO 572 -13.072 9.430 -7.207 164 HG3 PRO 572 HG1 PRO 572 -14.730 9.309 -7.828 165 HD2 PRO 572 HD2 PRO 572 -13.780 9.858 -5.067 166 HD3 PRO 572 HD1 PRO 572 -15.256 10.407 -5.883 167 HA PRO 573 HA PRO 573 -15.872 3.582 -4.096 168 HB2 PRO 573 HB2 PRO 573 -16.209 1.658 -5.902 169 HB3 PRO 573 HB1 PRO 573 -17.460 2.876 -5.617 170 HG2 PRO 573 HG2 PRO 573 -15.377 2.798 -7.778 171 HG3 PRO 573 HG1 PRO 573 -17.106 3.098 -7.911 172 HD2 PRO 573 HD2 PRO 573 -15.283 5.087 -7.861 173 HD3 PRO 573 HD1 PRO 573 -16.923 5.269 -7.214 174 H TYR 574 HN TYR 574 -13.337 4.277 -6.125 175 HA TYR 574 HA TYR 574 -11.861 1.829 -5.564 176 HB2 TYR 574 HB2 TYR 574 -11.759 2.862 -7.779 177 HB3 TYR 574 HB1 TYR 574 -11.032 4.294 -7.074 178 HD1 TYR 574 HD1 TYR 574 -10.504 0.728 -7.838 179 HD2 TYR 574 HD2 TYR 574 -8.694 4.388 -6.648 180 HE1 TYR 574 HE1 TYR 574 -8.282 -0.248 -8.237 181 HE2 TYR 574 HE2 TYR 574 -6.467 3.419 -7.035 182 HH TYR 574 HH TYR 574 -5.441 1.143 -7.106 183 H PHE 575 HN PHE 575 -11.203 1.691 -3.568 184 HA PHE 575 HA PHE 575 -10.190 1.937 -1.619 185 HB2 PHE 575 HB2 PHE 575 -8.013 2.567 -1.564 186 HB3 PHE 575 HB1 PHE 575 -8.234 2.290 -3.288 187 HD1 PHE 575 HD2 PHE 575 -7.786 4.810 -0.660 188 HD2 PHE 575 HD1 PHE 575 -8.019 4.112 -4.847 189 HE1 PHE 575 HE2 PHE 575 -6.900 7.061 -1.076 190 HE2 PHE 575 HE1 PHE 575 -7.124 6.364 -5.274 191 HZ PHE 575 HZ PHE 575 -6.576 7.846 -3.382 192 H MET 576 HN MET 576 -11.684 4.735 -2.808 193 HA MET 576 HA MET 576 -10.801 6.461 -0.707 194 HB2 MET 576 HB2 MET 576 -13.195 6.794 -2.521 195 HB3 MET 576 HB1 MET 576 -12.414 8.045 -1.570 196 HG2 MET 576 HG2 MET 576 -10.322 7.611 -2.830 197 HG3 MET 576 HG1 MET 576 -11.258 6.547 -3.860 198 HE1 MET 576 HE1 MET 576 -9.611 8.670 -5.257 199 HE2 MET 576 HE2 MET 576 -10.791 9.379 -6.361 200 HE3 MET 576 HE3 MET 576 -10.784 7.640 -6.077 201 H LYS 577 HN LYS 577 -12.577 7.580 0.695 202 HA LYS 577 HA LYS 577 -13.048 5.657 2.654 203 HB2 LYS 577 HB2 LYS 577 -12.742 8.086 3.071 204 HB3 LYS 577 HB1 LYS 577 -14.342 8.385 2.408 205 HG2 LYS 577 HG2 LYS 577 -15.290 6.953 4.206 206 HG3 LYS 577 HG1 LYS 577 -13.673 6.844 4.908 207 HD2 LYS 577 HD2 LYS 577 -13.620 9.283 5.142 208 HD3 LYS 577 HD1 LYS 577 -15.238 9.387 4.448 209 HE2 LYS 577 HE2 LYS 577 -16.129 8.089 6.308 210 HE3 LYS 577 HE1 LYS 577 -14.513 7.938 6.993 211 HZ1 LYS 577 HZ1 LYS 577 -15.804 9.693 8.062 212 HZ2 LYS 577 HZ2 LYS 577 -15.960 10.500 6.584 213 HZ3 LYS 577 HZ3 LYS 577 -14.437 10.321 7.292 214 H GLY 578 HN GLY 578 -14.513 4.145 2.820 215 HA2 GLY 578 HA2 GLY 578 -16.757 3.490 3.214 216 HA3 GLY 578 HA1 GLY 578 -17.294 4.748 2.120 217 H SER 579 HN SER 579 -14.861 3.548 0.458 218 HA SER 579 HA SER 579 -16.445 2.075 -1.342 219 HB2 SER 579 HB2 SER 579 -13.434 2.077 -1.065 220 HB3 SER 579 HB1 SER 579 -14.352 1.594 -2.491 221 HG SER 579 HG SER 579 -13.866 4.139 -1.446 222 H ILE 580 HN ILE 580 -16.795 -0.051 -1.604 223 HA ILE 580 HA ILE 580 -16.014 -1.832 0.537 224 HB ILE 580 HB ILE 580 -17.810 -2.155 -1.856 225 HG12 ILE 580 HG12 ILE 580 -18.739 -0.937 0.041 226 HG13 ILE 580 HG11 ILE 580 -19.532 -2.500 -0.125 227 HG21 ILE 580 HG21 ILE 580 -16.826 -4.285 -1.726 228 HG22 ILE 580 HG22 ILE 580 -18.352 -4.425 -0.850 229 HG23 ILE 580 HG23 ILE 580 -16.837 -4.268 0.039 230 HD11 ILE 580 HD11 ILE 580 -18.029 -3.365 1.666 231 HD12 ILE 580 HD12 ILE 580 -19.143 -2.103 2.186 232 HD13 ILE 580 HD13 ILE 580 -17.448 -1.714 1.898 233 H ILE 581 HN ILE 581 -14.285 -3.047 0.497 234 HA ILE 581 HA ILE 581 -12.941 -3.530 -2.079 235 HB ILE 581 HB ILE 581 -11.677 -3.791 0.646 236 HG12 ILE 581 HG12 ILE 581 -12.487 -1.500 0.464 237 HG13 ILE 581 HG11 ILE 581 -10.738 -1.536 0.347 238 HG21 ILE 581 HG21 ILE 581 -10.535 -3.384 -2.106 239 HG22 ILE 581 HG22 ILE 581 -10.505 -4.876 -1.163 240 HG23 ILE 581 HG23 ILE 581 -9.601 -3.464 -0.614 241 HD11 ILE 581 HD11 ILE 581 -12.704 -1.135 -1.888 242 HD12 ILE 581 HD12 ILE 581 -10.969 -1.363 -2.117 243 HD13 ILE 581 HD13 ILE 581 -11.563 0.034 -1.222 244 H GLN 582 HN GLN 582 -12.887 -5.592 -2.800 245 HA GLN 582 HA GLN 582 -13.876 -7.668 -0.984 246 HB2 GLN 582 HB2 GLN 582 -15.007 -7.448 -3.141 247 HB3 GLN 582 HB1 GLN 582 -13.496 -7.731 -3.974 248 HG2 GLN 582 HG2 GLN 582 -13.379 -9.956 -2.901 249 HG3 GLN 582 HG1 GLN 582 -14.979 -9.680 -2.228 250 HE21 GLN 582 HE21 GLN 582 -16.758 -9.659 -3.602 251 HE22 GLN 582 HE22 GLN 582 -16.687 -10.304 -5.206 252 H LEU 583 HN LEU 583 -12.557 -9.033 -0.071 253 HA LEU 583 HA LEU 583 -9.794 -9.140 -0.911 254 HB2 LEU 583 HB2 LEU 583 -11.225 -10.548 1.330 255 HB3 LEU 583 HB1 LEU 583 -9.488 -10.495 1.099 256 HG LEU 583 HG LEU 583 -11.256 -8.115 1.648 257 HD11 LEU 583 HD11 LEU 583 -9.292 -9.564 3.404 258 HD12 LEU 583 HD12 LEU 583 -11.048 -9.577 3.566 259 HD13 LEU 583 HD13 LEU 583 -10.152 -8.081 3.817 260 HD21 LEU 583 HD21 LEU 583 -9.143 -6.895 1.894 261 HD22 LEU 583 HD22 LEU 583 -9.350 -7.528 0.259 262 HD23 LEU 583 HD23 LEU 583 -8.258 -8.334 1.387 263 H ALA 584 HN ALA 584 -8.744 -11.424 -0.863 264 HA ALA 584 HA ALA 584 -9.741 -12.722 -3.149 265 HB1 ALA 584 HB1 ALA 584 -7.972 -14.350 -2.834 266 HB2 ALA 584 HB2 ALA 584 -7.727 -13.799 -1.176 267 HB3 ALA 584 HB3 ALA 584 -7.359 -12.724 -2.526 268 H ASN 585 HN ASN 585 -10.071 -13.379 0.268 269 HA ASN 585 HA ASN 585 -11.109 -16.003 -0.007 270 HB2 ASN 585 HB2 ASN 585 -11.665 -15.845 2.342 271 HB3 ASN 585 HB1 ASN 585 -10.057 -15.196 2.066 272 HD21 ASN 585 HD21 ASN 585 -11.619 -14.721 4.318 273 HD22 ASN 585 HD22 ASN 585 -11.986 -13.024 4.384 274 H GLY 586 HN GLY 586 -12.449 -12.925 -0.581 275 HA2 GLY 586 HA2 GLY 586 -14.430 -12.809 -1.882 276 HA3 GLY 586 HA1 GLY 586 -15.008 -14.259 -1.086 277 H GLU 587 HN GLU 587 -13.672 -11.956 1.073 278 HA GLU 587 HA GLU 587 -16.416 -11.275 1.866 279 HB2 GLU 587 HB2 GLU 587 -15.621 -10.833 4.064 280 HB3 GLU 587 HB1 GLU 587 -14.916 -12.359 3.559 281 HG2 GLU 587 HG2 GLU 587 -12.810 -11.328 3.155 282 HG3 GLU 587 HG1 GLU 587 -13.482 -9.726 3.465 283 H LEU 588 HN LEU 588 -16.889 -9.126 2.567 284 HA LEU 588 HA LEU 588 -15.407 -7.152 0.963 285 HB2 LEU 588 HB2 LEU 588 -18.320 -7.104 1.748 286 HB3 LEU 588 HB1 LEU 588 -17.514 -6.006 0.647 287 HG LEU 588 HG LEU 588 -17.926 -8.956 0.151 288 HD11 LEU 588 HD11 LEU 588 -19.576 -8.226 -1.501 289 HD12 LEU 588 HD12 LEU 588 -19.344 -6.554 -0.995 290 HD13 LEU 588 HD13 LEU 588 -20.028 -7.728 0.128 291 HD21 LEU 588 HD21 LEU 588 -17.225 -8.386 -2.150 292 HD22 LEU 588 HD22 LEU 588 -15.941 -8.135 -0.969 293 HD23 LEU 588 HD23 LEU 588 -16.838 -6.756 -1.603 294 H LYS 589 HN LYS 589 -14.355 -5.677 2.147 295 HA LYS 589 HA LYS 589 -15.527 -4.856 4.720 296 HB2 LYS 589 HB2 LYS 589 -12.560 -5.115 4.186 297 HB3 LYS 589 HB1 LYS 589 -13.347 -4.792 5.717 298 HG2 LYS 589 HG2 LYS 589 -14.295 -7.008 5.759 299 HG3 LYS 589 HG1 LYS 589 -13.629 -7.351 4.166 300 HD2 LYS 589 HD2 LYS 589 -12.162 -8.405 5.651 301 HD3 LYS 589 HD1 LYS 589 -11.344 -6.904 5.227 302 HE2 LYS 589 HE2 LYS 589 -13.098 -6.810 7.601 303 HE3 LYS 589 HE1 LYS 589 -11.637 -7.785 7.749 304 HZ1 LYS 589 HZ1 LYS 589 -10.306 -5.903 7.173 305 HZ2 LYS 589 HZ2 LYS 589 -11.333 -5.475 8.455 306 HZ3 LYS 589 HZ3 LYS 589 -11.682 -4.949 6.889 307 H LYS 590 HN LYS 590 -15.233 -2.676 5.285 308 HA LYS 590 HA LYS 590 -15.019 -0.859 3.100 309 HB2 LYS 590 HB2 LYS 590 -15.162 -0.421 6.085 310 HB3 LYS 590 HB1 LYS 590 -15.142 0.887 4.913 311 HG2 LYS 590 HG2 LYS 590 -17.170 -1.223 4.548 312 HG3 LYS 590 HG1 LYS 590 -17.382 -0.118 5.904 313 HD2 LYS 590 HD2 LYS 590 -17.317 1.777 4.409 314 HD3 LYS 590 HD1 LYS 590 -16.963 0.729 3.037 315 HE2 LYS 590 HE2 LYS 590 -19.104 -0.338 3.240 316 HE3 LYS 590 HE1 LYS 590 -19.451 0.551 4.719 317 HZ1 LYS 590 HZ1 LYS 590 -19.006 1.847 2.085 318 HZ2 LYS 590 HZ2 LYS 590 -19.573 2.576 3.505 319 HZ3 LYS 590 HZ3 LYS 590 -20.535 1.452 2.691 320 H VAL 591 HN VAL 591 -13.371 0.526 2.546 321 HA VAL 591 HA VAL 591 -10.789 -0.346 2.602 322 HB VAL 591 HB VAL 591 -11.223 2.597 2.786 323 HG11 VAL 591 HG11 VAL 591 -9.439 0.851 1.117 324 HG12 VAL 591 HG12 VAL 591 -8.981 1.834 2.512 325 HG13 VAL 591 HG13 VAL 591 -9.512 2.612 1.017 326 HG21 VAL 591 HG21 VAL 591 -12.160 0.851 0.541 327 HG22 VAL 591 HG22 VAL 591 -11.736 2.548 0.311 328 HG23 VAL 591 HG23 VAL 591 -13.040 2.112 1.414 329 H GLU 592 HN GLU 592 -12.291 1.904 4.785 330 HA GLU 592 HA GLU 592 -9.985 2.929 5.961 331 HB2 GLU 592 HB2 GLU 592 -11.624 3.860 7.626 332 HB3 GLU 592 HB1 GLU 592 -12.008 4.189 5.940 333 HG2 GLU 592 HG2 GLU 592 -13.485 2.078 6.103 334 HG3 GLU 592 HG1 GLU 592 -13.337 2.303 7.843 335 H ASP 593 HN ASP 593 -11.477 -0.082 6.545 336 HA ASP 593 HA ASP 593 -10.156 -0.210 9.172 337 HB2 ASP 593 HB2 ASP 593 -12.638 -0.020 9.367 338 HB3 ASP 593 HB1 ASP 593 -12.791 -1.523 8.469 339 H LEU 594 HN LEU 594 -9.954 -1.316 6.149 340 HA LEU 594 HA LEU 594 -9.537 -4.049 6.357 341 HB2 LEU 594 HB2 LEU 594 -8.190 -1.948 4.681 342 HB3 LEU 594 HB1 LEU 594 -7.894 -3.665 4.489 343 HG LEU 594 HG LEU 594 -10.648 -2.477 4.271 344 HD11 LEU 594 HD11 LEU 594 -10.357 -2.501 1.879 345 HD12 LEU 594 HD12 LEU 594 -8.692 -3.043 2.062 346 HD13 LEU 594 HD13 LEU 594 -9.165 -1.439 2.626 347 HD21 LEU 594 HD21 LEU 594 -9.422 -5.068 3.352 348 HD22 LEU 594 HD22 LEU 594 -11.069 -4.541 3.011 349 HD23 LEU 594 HD23 LEU 594 -10.571 -4.858 4.675 350 H LYS 595 HN LYS 595 -8.108 -5.231 7.351 351 HA LYS 595 HA LYS 595 -5.828 -3.917 8.642 352 HB2 LYS 595 HB2 LYS 595 -7.149 -6.588 9.166 353 HB3 LYS 595 HB1 LYS 595 -5.746 -5.981 10.032 354 HG2 LYS 595 HG2 LYS 595 -8.425 -4.617 9.963 355 HG3 LYS 595 HG1 LYS 595 -7.872 -5.684 11.256 356 HD2 LYS 595 HD2 LYS 595 -6.023 -4.180 11.737 357 HD3 LYS 595 HD1 LYS 595 -6.496 -3.138 10.395 358 HE2 LYS 595 HE2 LYS 595 -8.224 -3.738 12.791 359 HE3 LYS 595 HE1 LYS 595 -7.220 -2.299 12.619 360 HZ1 LYS 595 HZ1 LYS 595 -8.496 -1.631 10.722 361 HZ2 LYS 595 HZ2 LYS 595 -9.560 -1.934 11.998 362 HZ3 LYS 595 HZ3 LYS 595 -9.397 -3.060 10.748 363 H THR 596 HN THR 596 -3.770 -5.221 8.701 364 HA THR 596 HA THR 596 -3.074 -5.800 6.013 365 HB THR 596 HB THR 596 -1.428 -4.818 7.512 366 HG1 THR 596 HG1 THR 596 0.164 -6.781 7.165 367 HG21 THR 596 HG21 THR 596 -0.323 -6.218 9.223 368 HG22 THR 596 HG22 THR 596 -1.550 -7.459 8.966 369 HG23 THR 596 HG23 THR 596 -2.008 -5.878 9.602 370 H GLU 597 HN GLU 597 -3.771 -7.792 8.820 371 HA GLU 597 HA GLU 597 -2.984 -10.279 7.861 372 HB2 GLU 597 HB2 GLU 597 -5.321 -9.583 9.619 373 HB3 GLU 597 HB1 GLU 597 -4.680 -11.203 9.405 374 HG2 GLU 597 HG2 GLU 597 -2.690 -10.681 10.521 375 HG3 GLU 597 HG1 GLU 597 -2.981 -8.947 10.401 376 H ASP 598 HN ASP 598 -5.723 -8.316 7.066 377 HA ASP 598 HA ASP 598 -7.371 -10.289 5.899 378 HB2 ASP 598 HB2 ASP 598 -7.179 -7.323 5.348 379 HB3 ASP 598 HB1 ASP 598 -8.448 -8.364 4.728 380 H PHE 599 HN PHE 599 -5.010 -8.032 4.506 381 HA PHE 599 HA PHE 599 -5.275 -9.082 1.863 382 HB2 PHE 599 HB2 PHE 599 -3.232 -7.246 3.114 383 HB3 PHE 599 HB1 PHE 599 -3.141 -7.769 1.439 384 HD1 PHE 599 HD2 PHE 599 -5.940 -6.581 3.620 385 HD2 PHE 599 HD1 PHE 599 -3.759 -6.119 -0.001 386 HE1 PHE 599 HE2 PHE 599 -7.480 -4.798 2.922 387 HE2 PHE 599 HE1 PHE 599 -5.300 -4.338 -0.704 388 HZ PHE 599 HZ PHE 599 -7.163 -3.674 0.757 389 H ILE 600 HN ILE 600 -2.980 -9.524 4.525 390 HA ILE 600 HA ILE 600 -1.155 -11.215 3.357 391 HB ILE 600 HB ILE 600 -2.362 -11.201 6.114 392 HG12 ILE 600 HG12 ILE 600 0.321 -10.333 5.031 393 HG13 ILE 600 HG11 ILE 600 -1.019 -9.272 5.416 394 HG21 ILE 600 HG21 ILE 600 -1.637 -13.464 5.787 395 HG22 ILE 600 HG22 ILE 600 -0.457 -12.637 6.812 396 HG23 ILE 600 HG23 ILE 600 -0.100 -12.916 5.108 397 HD11 ILE 600 HD11 ILE 600 0.704 -9.251 7.143 398 HD12 ILE 600 HD12 ILE 600 0.453 -10.981 7.400 399 HD13 ILE 600 HD13 ILE 600 -0.845 -9.839 7.751 400 H GLN 601 HN GLN 601 -4.137 -12.247 5.040 401 HA GLN 601 HA GLN 601 -3.987 -14.936 4.369 402 HB2 GLN 601 HB2 GLN 601 -6.332 -13.151 4.954 403 HB3 GLN 601 HB1 GLN 601 -6.531 -14.868 4.620 404 HG2 GLN 601 HG2 GLN 601 -5.061 -15.395 6.479 405 HG3 GLN 601 HG1 GLN 601 -4.888 -13.676 6.835 406 HE21 GLN 601 HE21 GLN 601 -6.670 -12.534 7.634 407 HE22 GLN 601 HE22 GLN 601 -8.010 -13.342 8.368 408 H SER 602 HN SER 602 -5.586 -12.291 2.642 409 HA SER 602 HA SER 602 -6.781 -13.832 0.657 410 HB2 SER 602 HB2 SER 602 -5.758 -10.991 0.514 411 HB3 SER 602 HB1 SER 602 -6.857 -11.730 -0.653 412 HG SER 602 HG SER 602 -7.310 -11.089 2.063 413 H ALA 603 HN ALA 603 -3.529 -12.429 0.787 414 HA ALA 603 HA ALA 603 -2.865 -13.263 -1.881 415 HB1 ALA 603 HB1 ALA 603 -0.617 -12.490 -1.327 416 HB2 ALA 603 HB2 ALA 603 -1.108 -12.306 0.358 417 HB3 ALA 603 HB3 ALA 603 -1.838 -11.295 -0.886 418 H GLU 604 HN GLU 604 -2.682 -14.669 1.276 419 HA GLU 604 HA GLU 604 -0.790 -16.699 0.551 420 HB2 GLU 604 HB2 GLU 604 -2.631 -16.389 2.921 421 HB3 GLU 604 HB1 GLU 604 -1.401 -17.645 2.770 422 HG2 GLU 604 HG2 GLU 604 -0.725 -14.732 2.546 423 HG3 GLU 604 HG1 GLU 604 -0.831 -15.548 4.104 424 H ILE 605 HN ILE 605 -4.298 -16.637 1.158 425 HA ILE 605 HA ILE 605 -4.915 -19.240 0.310 426 HB ILE 605 HB ILE 605 -6.584 -16.741 -0.107 427 HG12 ILE 605 HG12 ILE 605 -6.744 -18.611 2.256 428 HG13 ILE 605 HG11 ILE 605 -5.702 -17.196 2.264 429 HG21 ILE 605 HG21 ILE 605 -8.496 -18.270 -0.008 430 HG22 ILE 605 HG22 ILE 605 -7.392 -19.637 0.147 431 HG23 ILE 605 HG23 ILE 605 -7.407 -18.679 -1.334 432 HD11 ILE 605 HD11 ILE 605 -7.725 -15.802 1.822 433 HD12 ILE 605 HD12 ILE 605 -7.713 -16.626 3.384 434 HD13 ILE 605 HD13 ILE 605 -8.704 -17.253 2.057 435 H SER 606 HN SER 606 -5.108 -16.194 -1.498 436 HA SER 606 HA SER 606 -4.380 -15.576 -3.529 437 HB2 SER 606 HB2 SER 606 -2.289 -16.521 -2.491 438 HB3 SER 606 HB1 SER 606 -2.587 -17.996 -3.409 439 HG SER 606 HG SER 606 -1.263 -15.956 -4.249 440 H ASN 607 HN ASN 607 -3.377 -16.827 -5.608 441 HA ASN 607 HA ASN 607 -4.483 -18.904 -6.919 442 HB2 ASN 607 HB2 ASN 607 -6.729 -17.782 -6.432 443 HB3 ASN 607 HB1 ASN 607 -6.203 -16.466 -7.475 444 HD21 ASN 607 HD21 ASN 607 -6.113 -16.777 -9.698 445 HD22 ASN 607 HD22 ASN 607 -6.797 -18.176 -10.461 446 H ASP 608 HN ASP 608 -3.863 -15.479 -6.950 447 HA ASP 608 HA ASP 608 -1.897 -15.788 -9.092 448 HB2 ASP 608 HB2 ASP 608 -3.965 -13.575 -9.126 449 HB3 ASP 608 HB1 ASP 608 -2.719 -13.872 -10.329 450 H LEU 609 HN LEU 609 -2.359 -14.896 -6.021 451 HA LEU 609 HA LEU 609 -1.037 -12.279 -6.249 452 HB2 LEU 609 HB2 LEU 609 -2.697 -13.292 -3.961 453 HB3 LEU 609 HB1 LEU 609 -2.079 -11.671 -4.179 454 HG LEU 609 HG LEU 609 -4.276 -11.446 -4.751 455 HD11 LEU 609 HD11 LEU 609 -2.976 -12.064 -7.366 456 HD12 LEU 609 HD12 LEU 609 -2.893 -10.536 -6.493 457 HD13 LEU 609 HD13 LEU 609 -4.435 -11.102 -7.132 458 HD21 LEU 609 HD21 LEU 609 -4.960 -13.746 -4.643 459 HD22 LEU 609 HD22 LEU 609 -4.166 -14.075 -6.181 460 HD23 LEU 609 HD23 LEU 609 -5.572 -13.014 -6.128 461 H LYS 610 HN LYS 610 0.557 -11.682 -4.765 462 HA LYS 610 HA LYS 610 1.454 -13.589 -2.764 463 HB2 LYS 610 HB2 LYS 610 3.267 -12.594 -4.967 464 HB3 LYS 610 HB1 LYS 610 3.847 -13.350 -3.492 465 HG2 LYS 610 HG2 LYS 610 2.391 -15.344 -4.170 466 HG3 LYS 610 HG1 LYS 610 2.315 -14.577 -5.757 467 HD2 LYS 610 HD2 LYS 610 4.824 -15.394 -4.291 468 HD3 LYS 610 HD1 LYS 610 4.108 -16.230 -5.668 469 HE2 LYS 610 HE2 LYS 610 4.502 -14.289 -7.078 470 HE3 LYS 610 HE1 LYS 610 5.145 -13.398 -5.699 471 HZ1 LYS 610 HZ1 LYS 610 6.320 -15.860 -6.873 472 HZ2 LYS 610 HZ2 LYS 610 6.929 -15.027 -5.531 473 HZ3 LYS 610 HZ3 LYS 610 6.925 -14.290 -7.053 474 H ILE 611 HN ILE 611 1.990 -12.539 -0.934 475 HA ILE 611 HA ILE 611 2.267 -9.672 -0.840 476 HB ILE 611 HB ILE 611 2.828 -11.752 1.287 477 HG12 ILE 611 HG12 ILE 611 0.419 -11.379 0.355 478 HG13 ILE 611 HG11 ILE 611 0.669 -11.535 2.079 479 HG21 ILE 611 HG21 ILE 611 2.518 -8.785 1.603 480 HG22 ILE 611 HG22 ILE 611 4.032 -9.685 1.713 481 HG23 ILE 611 HG23 ILE 611 2.753 -9.950 2.903 482 HD11 ILE 611 HD11 ILE 611 -0.915 -9.759 1.575 483 HD12 ILE 611 HD12 ILE 611 0.286 -8.961 0.558 484 HD13 ILE 611 HD13 ILE 611 0.553 -9.090 2.296 485 H ASP 612 HN ASP 612 4.180 -8.547 -0.305 486 HA ASP 612 HA ASP 612 6.687 -10.070 -0.479 487 HB2 ASP 612 HB2 ASP 612 6.416 -8.787 -2.552 488 HB3 ASP 612 HB1 ASP 612 6.140 -7.325 -1.619 489 H SER 613 HN SER 613 8.421 -9.222 0.755 490 HA SER 613 HA SER 613 7.594 -7.328 2.847 491 HB2 SER 613 HB2 SER 613 9.544 -9.614 3.197 492 HB3 SER 613 HB1 SER 613 8.960 -8.522 4.451 493 HG SER 613 HG SER 613 6.916 -9.704 3.118 494 H SER 614 HN SER 614 8.486 -5.494 2.197 495 HA SER 614 HA SER 614 11.380 -5.483 1.688 496 HB2 SER 614 HB2 SER 614 10.614 -3.450 0.106 497 HB3 SER 614 HB1 SER 614 10.712 -5.107 -0.468 498 HG SER 614 HG SER 614 8.585 -5.284 -0.473 499 H THR 615 HN THR 615 12.204 -4.543 3.445 500 HA THR 615 HA THR 615 10.689 -2.615 4.971 501 HB THR 615 HB THR 615 13.485 -3.664 5.419 502 HG1 THR 615 HG1 THR 615 12.027 -5.326 5.697 503 HG21 THR 615 HG21 THR 615 13.189 -2.799 7.719 504 HG22 THR 615 HG22 THR 615 11.661 -2.065 7.232 505 HG23 THR 615 HG23 THR 615 13.174 -1.512 6.514 506 H VAL 616 HN VAL 616 10.596 -0.574 4.267 507 HA VAL 616 HA VAL 616 12.514 0.781 2.798 508 HB VAL 616 HB VAL 616 10.469 1.865 2.918 509 HG11 VAL 616 HG11 VAL 616 9.365 2.523 5.027 510 HG12 VAL 616 HG12 VAL 616 10.610 1.647 5.910 511 HG13 VAL 616 HG13 VAL 616 9.519 0.778 4.837 512 HG21 VAL 616 HG21 VAL 616 10.909 4.020 4.154 513 HG22 VAL 616 HG22 VAL 616 12.156 3.528 3.007 514 HG23 VAL 616 HG23 VAL 616 12.401 3.277 4.736 515 H GLU 617 HN GLU 617 14.550 1.038 3.261 516 HA GLU 617 HA GLU 617 15.476 1.222 5.995 517 HB2 GLU 617 HB2 GLU 617 16.924 1.135 3.360 518 HB3 GLU 617 HB1 GLU 617 17.721 1.167 4.926 519 HG2 GLU 617 HG2 GLU 617 15.707 -0.941 4.317 520 HG3 GLU 617 HG1 GLU 617 17.347 -1.080 3.703 521 H ARG 618 HN ARG 618 14.687 3.329 3.397 522 HA ARG 618 HA ARG 618 15.478 5.628 4.921 523 HB2 ARG 618 HB2 ARG 618 17.644 4.959 3.980 524 HB3 ARG 618 HB1 ARG 618 16.961 4.994 2.363 525 HG2 ARG 618 HG2 ARG 618 16.610 7.398 2.550 526 HG3 ARG 618 HG1 ARG 618 17.266 7.370 4.190 527 HD2 ARG 618 HD2 ARG 618 19.407 6.623 3.353 528 HD3 ARG 618 HD1 ARG 618 18.763 6.515 1.717 529 HE ARG 618 HE ARG 618 18.323 9.101 2.355 530 HH11 ARG 618 HH11 ARG 618 21.177 7.081 2.615 531 HH12 ARG 618 HH12 ARG 618 22.276 8.375 2.269 532 HH21 ARG 618 HH21 ARG 618 19.767 10.800 1.907 533 HH22 ARG 618 HH22 ARG 618 21.475 10.495 1.870 534 H ILE 619 HN ILE 619 14.630 7.552 4.091 535 HA ILE 619 HA ILE 619 12.917 7.290 1.716 536 HB ILE 619 HB ILE 619 12.188 8.451 4.405 537 HG12 ILE 619 HG12 ILE 619 10.787 6.440 2.641 538 HG13 ILE 619 HG11 ILE 619 11.862 6.013 3.972 539 HG21 ILE 619 HG21 ILE 619 10.102 9.254 3.383 540 HG22 ILE 619 HG22 ILE 619 10.704 8.786 1.792 541 HG23 ILE 619 HG23 ILE 619 11.512 10.062 2.700 542 HD11 ILE 619 HD11 ILE 619 10.357 7.081 5.545 543 HD12 ILE 619 HD12 ILE 619 9.499 5.874 4.586 544 HD13 ILE 619 HD13 ILE 619 9.306 7.589 4.222 545 H GLU 620 HN GLU 620 13.088 8.928 0.301 546 HA GLU 620 HA GLU 620 14.707 11.239 1.127 547 HB2 GLU 620 HB2 GLU 620 14.973 9.551 -1.342 548 HB3 GLU 620 HB1 GLU 620 15.700 11.144 -1.193 549 HG2 GLU 620 HG2 GLU 620 16.187 8.875 0.690 550 HG3 GLU 620 HG1 GLU 620 17.216 9.252 -0.694 551 H ASP 621 HN ASP 621 14.277 13.193 0.152 552 HA ASP 621 HA ASP 621 11.693 13.565 -1.048 553 HB2 ASP 621 HB2 ASP 621 12.248 15.920 -1.080 554 HB3 ASP 621 HB1 ASP 621 12.781 15.255 0.460 555 H SER 622 HN SER 622 11.247 14.075 -3.188 556 HA SER 622 HA SER 622 13.463 13.608 -5.063 557 HB2 SER 622 HB2 SER 622 11.555 12.096 -5.314 558 HB3 SER 622 HB1 SER 622 10.467 13.470 -5.482 559 HG SER 622 HG SER 622 12.046 12.257 -7.345 560 H HIS 623 HN HIS 623 11.794 16.061 -3.642 561 HA HIS 623 HA HIS 623 11.362 18.240 -4.061 562 HB2 HIS 623 HB2 HIS 623 13.937 17.667 -5.254 563 HB3 HIS 623 HB1 HIS 623 13.122 18.989 -6.085 564 HD1 HIS 623 HD1 HIS 623 14.247 18.001 -2.594 565 HD2 HIS 623 HD2 HIS 623 13.181 21.387 -4.776 566 HE1 HIS 623 HE1 HIS 623 14.735 19.962 -1.098 567 HE2 HIS 623 HE2 HIS 623 13.989 21.987 -2.391 568 H SER 624 HN SER 624 10.030 16.213 -5.611 569 HA SER 624 HA SER 624 9.104 17.866 -7.862 570 HB2 SER 624 HB2 SER 624 8.944 14.850 -7.592 571 HB3 SER 624 HB1 SER 624 8.471 15.802 -8.993 572 HG SER 624 HG SER 624 11.112 15.712 -7.941 573 HA PRO 625 HA PRO 625 5.252 18.495 -5.913 574 HB2 PRO 625 HB2 PRO 625 3.962 17.190 -8.228 575 HB3 PRO 625 HB1 PRO 625 3.624 18.760 -7.501 576 HG2 PRO 625 HG2 PRO 625 4.989 18.520 -9.811 577 HG3 PRO 625 HG1 PRO 625 5.329 19.803 -8.638 578 HD2 PRO 625 HD2 PRO 625 6.922 17.409 -9.312 579 HD3 PRO 625 HD1 PRO 625 7.433 18.946 -8.596 580 H GLY 626 HN GLY 626 4.990 17.305 -4.227 581 HA2 GLY 626 HA2 GLY 626 4.355 15.616 -2.836 582 HA3 GLY 626 HA1 GLY 626 3.193 15.212 -4.088 583 H VAL 627 HN VAL 627 6.733 15.046 -4.398 584 HA VAL 627 HA VAL 627 6.388 12.132 -4.752 585 HB VAL 627 HB VAL 627 8.486 13.837 -6.089 586 HG11 VAL 627 HG11 VAL 627 7.683 10.958 -6.493 587 HG12 VAL 627 HG12 VAL 627 9.180 11.536 -5.757 588 HG13 VAL 627 HG13 VAL 627 8.862 11.838 -7.466 589 HG21 VAL 627 HG21 VAL 627 6.362 14.445 -6.997 590 HG22 VAL 627 HG22 VAL 627 5.888 12.753 -7.138 591 HG23 VAL 627 HG23 VAL 627 7.177 13.395 -8.159 592 H ALA 628 HN ALA 628 7.441 10.856 -3.451 593 HA ALA 628 HA ALA 628 10.068 11.664 -2.433 594 HB1 ALA 628 HB1 ALA 628 7.898 10.425 -0.732 595 HB2 ALA 628 HB2 ALA 628 8.485 12.083 -0.607 596 HB3 ALA 628 HB3 ALA 628 9.558 10.735 -0.222 597 H VAL 629 HN VAL 629 11.518 10.004 -2.305 598 HA VAL 629 HA VAL 629 10.622 7.505 -3.527 599 HB VAL 629 HB VAL 629 12.389 8.062 -4.835 600 HG11 VAL 629 HG11 VAL 629 14.416 9.261 -3.992 601 HG12 VAL 629 HG12 VAL 629 13.595 9.396 -2.437 602 HG13 VAL 629 HG13 VAL 629 12.898 10.156 -3.864 603 HG21 VAL 629 HG21 VAL 629 12.987 5.915 -3.828 604 HG22 VAL 629 HG22 VAL 629 13.842 6.758 -2.529 605 HG23 VAL 629 HG23 VAL 629 14.425 6.871 -4.190 606 H ILE 630 HN ILE 630 10.334 5.821 -2.366 607 HA ILE 630 HA ILE 630 11.420 5.693 0.333 608 HB ILE 630 HB ILE 630 9.551 3.698 -0.915 609 HG12 ILE 630 HG12 ILE 630 8.557 5.940 -1.218 610 HG13 ILE 630 HG11 ILE 630 7.659 4.968 -0.059 611 HG21 ILE 630 HG21 ILE 630 10.003 4.594 1.918 612 HG22 ILE 630 HG22 ILE 630 10.605 3.106 1.190 613 HG23 ILE 630 HG23 ILE 630 8.870 3.346 1.398 614 HD11 ILE 630 HD11 ILE 630 8.728 6.164 1.771 615 HD12 ILE 630 HD12 ILE 630 7.865 7.260 0.690 616 HD13 ILE 630 HD13 ILE 630 9.623 7.139 0.605 617 H GLN 631 HN GLN 631 13.382 4.741 0.488 618 HA GLN 631 HA GLN 631 14.207 2.838 -1.549 619 HB2 GLN 631 HB2 GLN 631 15.805 4.556 -0.847 620 HB3 GLN 631 HB1 GLN 631 15.726 3.967 0.810 621 HG2 GLN 631 HG2 GLN 631 16.796 1.944 0.245 622 HG3 GLN 631 HG1 GLN 631 16.600 2.240 -1.482 623 HE21 GLN 631 HE21 GLN 631 17.584 4.729 0.749 624 HE22 GLN 631 HE22 GLN 631 19.213 4.865 0.186 625 H PHE 632 HN PHE 632 13.561 0.852 -1.341 626 HA PHE 632 HA PHE 632 13.019 -0.261 1.317 627 HB2 PHE 632 HB2 PHE 632 12.231 -1.180 -1.447 628 HB3 PHE 632 HB1 PHE 632 11.857 -2.054 0.028 629 HD1 PHE 632 HD2 PHE 632 10.367 -0.965 1.730 630 HD2 PHE 632 HD1 PHE 632 10.877 0.558 -2.205 631 HE1 PHE 632 HE2 PHE 632 8.265 0.288 1.948 632 HE2 PHE 632 HE1 PHE 632 8.772 1.813 -1.997 633 HZ PHE 632 HZ PHE 632 7.462 1.677 0.082 634 H ALA 633 HN ALA 633 14.062 -1.969 2.128 635 HA ALA 633 HA ALA 633 16.067 -3.333 0.494 636 HB1 ALA 633 HB1 ALA 633 15.432 -3.477 3.440 637 HB2 ALA 633 HB2 ALA 633 16.807 -2.664 2.694 638 HB3 ALA 633 HB3 ALA 633 16.687 -4.421 2.640 639 H VAL 634 HN VAL 634 15.029 -4.731 -0.801 640 HA VAL 634 HA VAL 634 12.581 -5.998 0.035 641 HB VAL 634 HB VAL 634 14.139 -6.377 -2.522 642 HG11 VAL 634 HG11 VAL 634 11.264 -6.987 -1.838 643 HG12 VAL 634 HG12 VAL 634 12.546 -8.168 -2.105 644 HG13 VAL 634 HG13 VAL 634 11.996 -7.149 -3.434 645 HG21 VAL 634 HG21 VAL 634 13.572 -4.047 -2.264 646 HG22 VAL 634 HG22 VAL 634 11.908 -4.461 -1.855 647 HG23 VAL 634 HG23 VAL 634 12.519 -4.766 -3.482 648 H GLY 635 HN GLY 635 12.396 -7.908 0.958 649 HA2 GLY 635 HA2 GLY 635 12.686 -10.200 1.174 650 HA3 GLY 635 HA1 GLY 635 14.089 -10.099 0.125 651 H GLU 636 HN GLU 636 14.738 -11.690 1.858 652 HA GLU 636 HA GLU 636 15.482 -10.609 4.409 653 HB2 GLU 636 HB2 GLU 636 16.161 -13.235 3.104 654 HB3 GLU 636 HB1 GLU 636 16.468 -12.829 4.782 655 HG2 GLU 636 HG2 GLU 636 13.751 -12.972 3.498 656 HG3 GLU 636 HG1 GLU 636 14.475 -14.227 4.503 657 H HIS 637 HN HIS 637 16.925 -10.955 1.301 658 HA HIS 637 HA HIS 637 19.644 -10.683 2.233 659 HB2 HIS 637 HB2 HIS 637 18.387 -10.680 -0.506 660 HB3 HIS 637 HB1 HIS 637 20.088 -10.304 -0.269 661 HD1 HIS 637 HD1 HIS 637 21.557 -12.253 -0.589 662 HD2 HIS 637 HD2 HIS 637 17.794 -13.378 0.780 663 HE1 HIS 637 HE1 HIS 637 21.604 -14.763 -0.465 664 HE2 HIS 637 HE2 HIS 637 19.266 -15.424 0.197 665 H ARG 638 HN ARG 638 17.067 -8.640 1.822 666 HA ARG 638 HA ARG 638 16.763 -6.415 1.994 667 HB2 ARG 638 HB2 ARG 638 19.630 -6.486 2.933 668 HB3 ARG 638 HB1 ARG 638 18.597 -5.068 3.021 669 HG2 ARG 638 HG2 ARG 638 17.033 -6.379 4.450 670 HG3 ARG 638 HG1 ARG 638 18.224 -7.684 4.461 671 HD2 ARG 638 HD2 ARG 638 19.877 -6.119 5.411 672 HD3 ARG 638 HD1 ARG 638 18.635 -4.869 5.462 673 HE ARG 638 HE ARG 638 18.263 -7.388 6.931 674 HH11 ARG 638 HH11 ARG 638 18.548 -3.895 6.900 675 HH12 ARG 638 HH12 ARG 638 18.131 -3.726 8.574 676 HH21 ARG 638 HH21 ARG 638 17.724 -7.159 9.142 677 HH22 ARG 638 HH22 ARG 638 17.672 -5.575 9.847 678 H ALA 639 HN ALA 639 17.169 -7.192 -0.574 679 HA ALA 639 HA ALA 639 19.190 -5.646 -1.876 680 HB1 ALA 639 HB1 ALA 639 16.657 -6.815 -3.021 681 HB2 ALA 639 HB2 ALA 639 18.213 -7.639 -2.921 682 HB3 ALA 639 HB3 ALA 639 18.036 -6.207 -3.937 683 H GLN 640 HN GLN 640 19.181 -3.511 -2.084 684 HA GLN 640 HA GLN 640 16.806 -2.106 -1.236 685 HB2 GLN 640 HB2 GLN 640 19.613 -1.163 -1.767 686 HB3 GLN 640 HB1 GLN 640 18.300 -0.081 -1.323 687 HG2 GLN 640 HG2 GLN 640 17.968 -1.423 0.737 688 HG3 GLN 640 HG1 GLN 640 19.400 -2.354 0.309 689 HE21 GLN 640 HE21 GLN 640 18.890 -0.701 2.638 690 HE22 GLN 640 HE22 GLN 640 20.145 0.488 2.658 691 H VAL 641 HN VAL 641 15.464 -1.033 -2.389 692 HA VAL 641 HA VAL 641 16.102 -0.326 -5.175 693 HB VAL 641 HB VAL 641 13.520 -1.555 -4.179 694 HG11 VAL 641 HG11 VAL 641 14.232 -0.559 -6.936 695 HG12 VAL 641 HG12 VAL 641 13.061 0.165 -5.834 696 HG13 VAL 641 HG13 VAL 641 12.762 -1.436 -6.508 697 HG21 VAL 641 HG21 VAL 641 15.542 -2.607 -6.155 698 HG22 VAL 641 HG22 VAL 641 14.036 -3.395 -5.686 699 HG23 VAL 641 HG23 VAL 641 15.325 -3.180 -4.502 700 H SER 642 HN SER 642 15.848 1.777 -5.487 701 HA SER 642 HA SER 642 14.233 3.323 -3.604 702 HB2 SER 642 HB2 SER 642 16.161 4.259 -5.747 703 HB3 SER 642 HB1 SER 642 15.381 5.281 -4.541 704 HG SER 642 HG SER 642 16.906 3.059 -3.735 705 H VAL 643 HN VAL 643 12.220 3.879 -4.127 706 HA VAL 643 HA VAL 643 11.534 4.138 -6.967 707 HB VAL 643 HB VAL 643 10.585 2.081 -6.212 708 HG11 VAL 643 HG11 VAL 643 9.395 3.617 -3.906 709 HG12 VAL 643 HG12 VAL 643 10.708 2.444 -3.810 710 HG13 VAL 643 HG13 VAL 643 9.092 1.919 -4.280 711 HG21 VAL 643 HG21 VAL 643 8.144 2.558 -6.376 712 HG22 VAL 643 HG22 VAL 643 9.129 3.300 -7.644 713 HG23 VAL 643 HG23 VAL 643 8.543 4.277 -6.299 714 H GLU 644 HN GLU 644 10.783 6.070 -7.497 715 HA GLU 644 HA GLU 644 10.066 7.986 -5.416 716 HB2 GLU 644 HB2 GLU 644 10.372 8.304 -8.408 717 HB3 GLU 644 HB1 GLU 644 10.043 9.613 -7.284 718 HG2 GLU 644 HG2 GLU 644 12.176 9.314 -6.231 719 HG3 GLU 644 HG1 GLU 644 12.503 7.884 -7.211 720 H VAL 645 HN VAL 645 7.978 7.672 -4.736 721 HA VAL 645 HA VAL 645 5.898 7.529 -6.805 722 HB VAL 645 HB VAL 645 5.633 6.681 -3.917 723 HG11 VAL 645 HG11 VAL 645 3.926 6.127 -6.310 724 HG12 VAL 645 HG12 VAL 645 3.605 7.339 -5.065 725 HG13 VAL 645 HG13 VAL 645 3.615 5.620 -4.651 726 HG21 VAL 645 HG21 VAL 645 7.267 5.231 -4.968 727 HG22 VAL 645 HG22 VAL 645 6.186 4.967 -6.336 728 HG23 VAL 645 HG23 VAL 645 5.750 4.362 -4.739 729 H LEU 646 HN LEU 646 3.895 8.707 -6.296 730 HA LEU 646 HA LEU 646 4.289 11.185 -5.026 731 HB2 LEU 646 HB2 LEU 646 1.720 9.793 -5.753 732 HB3 LEU 646 HB1 LEU 646 1.800 11.415 -5.096 733 HG LEU 646 HG LEU 646 2.477 10.440 -7.812 734 HD11 LEU 646 HD11 LEU 646 1.362 12.469 -8.476 735 HD12 LEU 646 HD12 LEU 646 1.315 13.028 -6.805 736 HD13 LEU 646 HD13 LEU 646 0.367 11.619 -7.292 737 HD21 LEU 646 HD21 LEU 646 3.799 12.819 -6.538 738 HD22 LEU 646 HD22 LEU 646 3.825 12.431 -8.258 739 HD23 LEU 646 HD23 LEU 646 4.594 11.347 -7.098 740 H VAL 647 HN VAL 647 3.775 11.883 -3.029 741 HA VAL 647 HA VAL 647 4.006 9.993 -0.942 742 HB VAL 647 HB VAL 647 3.769 11.902 0.575 743 HG11 VAL 647 HG11 VAL 647 5.929 11.472 -0.455 744 HG12 VAL 647 HG12 VAL 647 5.680 13.203 -0.231 745 HG13 VAL 647 HG13 VAL 647 5.491 12.485 -1.830 746 HG21 VAL 647 HG21 VAL 647 3.488 14.184 -0.420 747 HG22 VAL 647 HG22 VAL 647 2.042 13.179 -0.477 748 HG23 VAL 647 HG23 VAL 647 3.016 13.405 -1.933 749 H GLU 648 HN GLU 648 1.307 11.169 -2.617 750 HA GLU 648 HA GLU 648 -0.593 10.751 -0.476 751 HB2 GLU 648 HB2 GLU 648 -2.263 11.242 -2.311 752 HB3 GLU 648 HB1 GLU 648 -1.120 12.529 -1.955 753 HG2 GLU 648 HG2 GLU 648 0.236 11.820 -3.883 754 HG3 GLU 648 HG1 GLU 648 -0.979 10.600 -4.259 755 H TYR 649 HN TYR 649 1.099 8.749 -2.451 756 HA TYR 649 HA TYR 649 -1.021 6.924 -3.158 757 HB2 TYR 649 HB2 TYR 649 1.097 7.334 -4.510 758 HB3 TYR 649 HB1 TYR 649 1.960 6.408 -3.286 759 HD1 TYR 649 HD2 TYR 649 -1.186 6.025 -5.291 760 HD2 TYR 649 HD1 TYR 649 2.404 4.232 -3.881 761 HE1 TYR 649 HE2 TYR 649 -1.748 3.958 -6.499 762 HE2 TYR 649 HE1 TYR 649 1.857 2.169 -5.091 763 HH TYR 649 HH TYR 649 -0.764 1.998 -7.359 764 HA PRO 650 HA PRO 650 -0.957 5.064 0.864 765 HB2 PRO 650 HB2 PRO 650 -2.716 3.079 0.351 766 HB3 PRO 650 HB1 PRO 650 -3.211 4.760 0.559 767 HG2 PRO 650 HG2 PRO 650 -2.771 3.213 -1.967 768 HG3 PRO 650 HG1 PRO 650 -4.098 4.315 -1.548 769 HD2 PRO 650 HD2 PRO 650 -2.017 5.081 -3.092 770 HD3 PRO 650 HD1 PRO 650 -2.840 6.195 -1.983 771 H PHE 651 HN PHE 651 -0.094 3.302 1.903 772 HA PHE 651 HA PHE 651 0.996 1.125 0.281 773 HB2 PHE 651 HB2 PHE 651 2.544 3.025 1.996 774 HB3 PHE 651 HB1 PHE 651 3.061 1.345 1.915 775 HD1 PHE 651 HD1 PHE 651 2.580 4.438 -0.025 776 HD2 PHE 651 HD2 PHE 651 4.110 0.468 -0.027 777 HE1 PHE 651 HE1 PHE 651 3.784 4.906 -2.118 778 HE2 PHE 651 HE2 PHE 651 5.319 0.930 -2.119 779 HZ PHE 651 HZ PHE 651 5.154 3.151 -3.168 780 H PHE 652 HN PHE 652 -0.137 -0.526 1.090 781 HA PHE 652 HA PHE 652 -0.780 -0.875 3.833 782 HB2 PHE 652 HB2 PHE 652 -1.287 -2.243 1.399 783 HB3 PHE 652 HB1 PHE 652 -0.503 -3.397 2.473 784 HD1 PHE 652 HD1 PHE 652 -1.462 -3.689 4.800 785 HD2 PHE 652 HD2 PHE 652 -3.549 -1.742 1.647 786 HE1 PHE 652 HE1 PHE 652 -3.578 -4.038 5.989 787 HE2 PHE 652 HE2 PHE 652 -5.672 -2.091 2.837 788 HZ PHE 652 HZ PHE 652 -5.690 -3.237 5.014 789 H VAL 653 HN VAL 653 0.494 -1.681 5.482 790 HA VAL 653 HA VAL 653 3.169 -2.533 4.618 791 HB VAL 653 HB VAL 653 2.707 -1.530 7.388 792 HG11 VAL 653 HG11 VAL 653 4.841 -2.541 6.205 793 HG12 VAL 653 HG12 VAL 653 4.968 -1.252 7.400 794 HG13 VAL 653 HG13 VAL 653 5.034 -0.872 5.677 795 HG21 VAL 653 HG21 VAL 653 3.391 0.758 6.524 796 HG22 VAL 653 HG22 VAL 653 1.716 0.270 6.221 797 HG23 VAL 653 HG23 VAL 653 2.911 0.181 4.924 798 H PHE 654 HN PHE 654 4.117 -4.324 5.487 799 HA PHE 654 HA PHE 654 2.536 -6.519 5.472 800 HB2 PHE 654 HB2 PHE 654 4.898 -6.584 5.034 801 HB3 PHE 654 HB1 PHE 654 5.271 -6.246 6.715 802 HD1 PHE 654 HD2 PHE 654 3.592 -8.725 4.522 803 HD2 PHE 654 HD1 PHE 654 5.622 -8.014 8.192 804 HE1 PHE 654 HE2 PHE 654 3.651 -11.146 4.953 805 HE2 PHE 654 HE1 PHE 654 5.687 -10.435 8.629 806 HZ PHE 654 HZ PHE 654 4.702 -12.003 7.008 807 H GLY 655 HN GLY 655 3.912 -5.264 8.539 808 HA2 GLY 655 HA2 GLY 655 1.510 -6.334 9.855 809 HA3 GLY 655 HA1 GLY 655 3.093 -6.778 10.486 810 H GLN 656 HN GLN 656 2.637 -3.720 9.043 811 HA GLN 656 HA GLN 656 3.333 -2.512 11.621 812 HB2 GLN 656 HB2 GLN 656 3.849 -1.568 8.800 813 HB3 GLN 656 HB1 GLN 656 4.303 -0.671 10.230 814 HG2 GLN 656 HG2 GLN 656 6.211 -1.793 9.272 815 HG3 GLN 656 HG1 GLN 656 5.847 -2.436 10.856 816 HE21 GLN 656 HE21 GLN 656 5.614 -3.023 7.456 817 HE22 GLN 656 HE22 GLN 656 5.513 -4.749 7.514 818 H GLY 657 HN GLY 657 1.098 -2.346 8.905 819 HA2 GLY 657 HA2 GLY 657 -1.140 -1.658 10.048 820 HA3 GLY 657 HA1 GLY 657 -0.305 -0.123 10.204 821 H TRP 658 HN TRP 658 -2.475 0.228 9.011 822 HA TRP 658 HA TRP 658 -2.232 -0.038 6.115 823 HB2 TRP 658 HB2 TRP 658 -4.403 -0.467 7.297 824 HB3 TRP 658 HB1 TRP 658 -4.416 1.205 7.822 825 HD1 TRP 658 HD1 TRP 658 -6.871 1.116 6.591 826 HE1 TRP 658 HE1 TRP 658 -7.509 1.678 4.172 827 HE3 TRP 658 HE3 TRP 658 -2.246 0.725 4.391 828 HZ2 TRP 658 HZ2 TRP 658 -6.248 1.931 1.677 829 HZ3 TRP 658 HZ3 TRP 658 -2.071 1.144 1.977 830 HH2 TRP 658 HH2 TRP 658 -4.031 1.734 0.651 831 H SER 659 HN SER 659 -0.638 1.413 5.451 832 HA SER 659 HA SER 659 -0.708 4.085 6.685 833 HB2 SER 659 HB2 SER 659 1.720 2.473 5.878 834 HB3 SER 659 HB1 SER 659 1.741 4.073 6.623 835 HG SER 659 HG SER 659 2.037 2.451 8.185 836 H SER 660 HN SER 660 0.475 5.769 5.464 837 HA SER 660 HA SER 660 0.909 5.246 2.627 838 HB2 SER 660 HB2 SER 660 -0.806 7.539 3.620 839 HB3 SER 660 HB1 SER 660 -0.299 7.285 1.950 840 HG SER 660 HG SER 660 -1.516 5.107 3.105 841 H CYS 661 HN CYS 661 2.348 6.772 1.651 842 HA CYS 661 HA CYS 661 4.521 7.468 3.247 843 HB2 CYS 661 HB2 CYS 661 3.745 8.600 0.552 844 HB3 CYS 661 HB1 CYS 661 5.342 8.707 1.279 845 HG CYS 661 HG CYS 661 4.124 6.360 -0.622 846 H CYS 662 HN CYS 662 1.633 9.191 2.531 847 HA CYS 662 HA CYS 662 2.316 11.188 4.472 848 HB2 CYS 662 HB2 CYS 662 1.980 11.857 1.567 849 HB3 CYS 662 HB1 CYS 662 1.504 13.018 2.798 850 HG CYS 662 HG CYS 662 4.588 11.734 3.173 851 HA PRO 663 HA PRO 663 -1.931 9.566 4.902 852 HB2 PRO 663 HB2 PRO 663 -1.402 10.933 7.498 853 HB3 PRO 663 HB1 PRO 663 -2.121 9.349 7.184 854 HG2 PRO 663 HG2 PRO 663 0.373 9.513 8.053 855 HG3 PRO 663 HG1 PRO 663 -0.057 8.349 6.785 856 HD2 PRO 663 HD2 PRO 663 1.338 10.983 6.541 857 HD3 PRO 663 HD1 PRO 663 1.653 9.456 5.691 858 H GLU 664 HN GLU 664 -0.561 12.722 5.400 859 HA GLU 664 HA GLU 664 -2.777 14.284 5.873 860 HB2 GLU 664 HB2 GLU 664 -0.484 14.992 4.034 861 HB3 GLU 664 HB1 GLU 664 -1.543 16.119 4.870 862 HG2 GLU 664 HG2 GLU 664 -0.679 15.207 7.025 863 HG3 GLU 664 HG1 GLU 664 0.492 14.276 6.093 864 H ARG 665 HN ARG 665 -1.357 13.644 2.658 865 HA ARG 665 HA ARG 665 -3.525 14.796 1.263 866 HB2 ARG 665 HB2 ARG 665 -1.167 13.137 0.503 867 HB3 ARG 665 HB1 ARG 665 -2.475 13.320 -0.662 868 HG2 ARG 665 HG2 ARG 665 -2.242 15.747 -0.535 869 HG3 ARG 665 HG1 ARG 665 -0.921 15.554 0.613 870 HD2 ARG 665 HD2 ARG 665 0.239 14.162 -1.144 871 HD3 ARG 665 HD1 ARG 665 -1.009 14.700 -2.267 872 HE ARG 665 HE ARG 665 0.596 16.691 -0.832 873 HH11 ARG 665 HH11 ARG 665 -0.340 15.145 -3.847 874 HH12 ARG 665 HH12 ARG 665 0.448 16.340 -4.829 875 HH21 ARG 665 HH21 ARG 665 1.633 18.234 -2.127 876 HH22 ARG 665 HH22 ARG 665 1.583 18.091 -3.855 877 H THR 666 HN THR 666 -2.746 11.344 1.903 878 HA THR 666 HA THR 666 -4.768 10.323 0.271 879 HB THR 666 HB THR 666 -3.854 8.962 2.803 880 HG1 THR 666 HG1 THR 666 -2.515 8.666 0.331 881 HG21 THR 666 HG21 THR 666 -4.674 7.906 0.084 882 HG22 THR 666 HG22 THR 666 -5.641 7.842 1.557 883 HG23 THR 666 HG23 THR 666 -4.142 6.920 1.447 884 H SER 667 HN SER 667 -4.856 11.251 3.697 885 HA SER 667 HA SER 667 -7.628 10.628 3.986 886 HB2 SER 667 HB2 SER 667 -5.655 12.140 5.691 887 HB3 SER 667 HB1 SER 667 -7.330 11.887 6.153 888 HG SER 667 HG SER 667 -6.287 9.558 5.375 889 H GLN 668 HN GLN 668 -5.786 13.585 3.313 890 HA GLN 668 HA GLN 668 -7.888 15.420 3.529 891 HB2 GLN 668 HB2 GLN 668 -5.220 15.334 2.374 892 HB3 GLN 668 HB1 GLN 668 -6.303 16.527 1.672 893 HG2 GLN 668 HG2 GLN 668 -5.628 16.216 4.573 894 HG3 GLN 668 HG1 GLN 668 -5.086 17.452 3.479 895 HE21 GLN 668 HE21 GLN 668 -6.439 19.106 2.904 896 HE22 GLN 668 HE22 GLN 668 -7.926 19.391 3.726 897 H LEU 669 HN LEU 669 -6.629 13.712 0.695 898 HA LEU 669 HA LEU 669 -8.442 15.172 -1.030 899 HB2 LEU 669 HB2 LEU 669 -6.535 13.007 -1.864 900 HB3 LEU 669 HB1 LEU 669 -7.156 14.335 -2.821 901 HG LEU 669 HG LEU 669 -5.160 14.538 -0.568 902 HD11 LEU 669 HD11 LEU 669 -3.582 15.186 -2.276 903 HD12 LEU 669 HD12 LEU 669 -4.824 15.021 -3.519 904 HD13 LEU 669 HD13 LEU 669 -4.260 13.598 -2.642 905 HD21 LEU 669 HD21 LEU 669 -4.963 16.910 -1.244 906 HD22 LEU 669 HD22 LEU 669 -6.524 16.507 -0.533 907 HD23 LEU 669 HD23 LEU 669 -6.375 16.697 -2.283 908 H PHE 670 HN PHE 670 -8.012 11.936 0.207 909 HA PHE 670 HA PHE 670 -10.289 11.028 -1.418 910 HB2 PHE 670 HB2 PHE 670 -8.116 9.346 -0.156 911 HB3 PHE 670 HB1 PHE 670 -9.364 8.781 -1.253 912 HD1 PHE 670 HD2 PHE 670 -9.403 9.963 -3.598 913 HD2 PHE 670 HD1 PHE 670 -6.060 9.917 -0.977 914 HE1 PHE 670 HE2 PHE 670 -7.911 10.446 -5.496 915 HE2 PHE 670 HE1 PHE 670 -4.560 10.404 -2.864 916 HZ PHE 670 HZ PHE 670 -5.486 10.668 -5.130 917 H ASP 671 HN ASP 671 -9.664 12.101 1.568 918 HA ASP 671 HA ASP 671 -10.473 11.840 3.671 919 HB2 ASP 671 HB2 ASP 671 -12.743 11.072 1.925 920 HB3 ASP 671 HB1 ASP 671 -12.875 10.637 3.624 921 H LEU 672 HN LEU 672 -8.852 9.691 2.526 922 HA LEU 672 HA LEU 672 -10.026 7.342 3.801 923 HB2 LEU 672 HB2 LEU 672 -9.478 7.458 1.297 924 HB3 LEU 672 HB1 LEU 672 -7.811 7.325 1.774 925 HG LEU 672 HG LEU 672 -8.994 5.237 1.014 926 HD11 LEU 672 HD11 LEU 672 -7.722 3.836 2.316 927 HD12 LEU 672 HD12 LEU 672 -7.809 4.917 3.713 928 HD13 LEU 672 HD13 LEU 672 -6.853 5.373 2.303 929 HD21 LEU 672 HD21 LEU 672 -10.097 4.089 3.102 930 HD22 LEU 672 HD22 LEU 672 -11.025 5.027 1.940 931 HD23 LEU 672 HD23 LEU 672 -10.543 5.752 3.462 932 HA PRO 673 HA PRO 673 -7.103 7.963 6.975 933 HB2 PRO 673 HB2 PRO 673 -7.478 5.673 8.347 934 HB3 PRO 673 HB1 PRO 673 -8.694 6.955 8.298 935 HG2 PRO 673 HG2 PRO 673 -8.560 4.411 6.729 936 HG3 PRO 673 HG1 PRO 673 -9.957 5.169 7.515 937 HD2 PRO 673 HD2 PRO 673 -9.440 5.380 4.834 938 HD3 PRO 673 HD1 PRO 673 -10.302 6.627 5.772 939 H CYS 674 HN CYS 674 -5.022 7.563 7.407 940 HA CYS 674 HA CYS 674 -3.758 5.110 6.530 941 HB2 CYS 674 HB2 CYS 674 -2.024 6.852 5.363 942 HB3 CYS 674 HB1 CYS 674 -3.317 6.016 4.499 943 HG CYS 674 HG CYS 674 -5.061 8.096 4.428 944 H SER 675 HN SER 675 -2.254 4.558 7.937 945 HA SER 675 HA SER 675 -1.287 6.384 9.929 946 HB2 SER 675 HB2 SER 675 -0.338 3.587 9.246 947 HB3 SER 675 HB1 SER 675 -0.019 4.466 10.743 948 HG SER 675 HG SER 675 -2.649 4.456 10.331 949 H LYS 676 HN LYS 676 1.114 6.735 10.219 950 HA LYS 676 HA LYS 676 2.099 7.784 7.756 951 HB2 LYS 676 HB2 LYS 676 2.498 8.966 9.858 952 HB3 LYS 676 HB1 LYS 676 3.466 7.618 10.443 953 HG2 LYS 676 HG2 LYS 676 4.846 9.478 9.625 954 HG3 LYS 676 HG1 LYS 676 5.111 7.987 8.707 955 HD2 LYS 676 HD2 LYS 676 3.723 8.791 6.910 956 HD3 LYS 676 HD1 LYS 676 3.264 10.215 7.840 957 HE2 LYS 676 HE2 LYS 676 6.071 9.572 6.949 958 HE3 LYS 676 HE1 LYS 676 4.978 10.669 6.107 959 HZ1 LYS 676 HZ1 LYS 676 4.886 12.012 8.151 960 HZ2 LYS 676 HZ2 LYS 676 6.444 11.921 7.498 961 HZ3 LYS 676 HZ3 LYS 676 6.044 10.999 8.857 962 H LEU 677 HN LEU 677 2.923 6.555 6.255 963 HA LEU 677 HA LEU 677 4.495 4.208 6.840 964 HB2 LEU 677 HB2 LEU 677 3.037 4.392 4.825 965 HB3 LEU 677 HB1 LEU 677 4.055 5.680 4.229 966 HG LEU 677 HG LEU 677 4.362 3.377 3.195 967 HD11 LEU 677 HD11 LEU 677 6.781 3.590 3.017 968 HD12 LEU 677 HD12 LEU 677 6.788 4.712 4.377 969 HD13 LEU 677 HD13 LEU 677 5.987 5.158 2.871 970 HD21 LEU 677 HD21 LEU 677 5.750 2.862 5.813 971 HD22 LEU 677 HD22 LEU 677 5.793 1.816 4.393 972 HD23 LEU 677 HD23 LEU 677 4.273 2.085 5.248 973 H SER 678 HN SER 678 6.491 4.431 7.586 974 HA SER 678 HA SER 678 8.229 6.379 6.272 975 HB2 SER 678 HB2 SER 678 7.925 6.120 9.268 976 HB3 SER 678 HB1 SER 678 9.191 7.050 8.466 977 HG SER 678 HG SER 678 6.817 7.716 7.435 978 H VAL 679 HN VAL 679 10.560 6.038 7.283 979 HA VAL 679 HA VAL 679 11.461 3.580 6.405 980 HB VAL 679 HB VAL 679 12.977 5.362 6.412 981 HG11 VAL 679 HG11 VAL 679 12.428 5.666 9.351 982 HG12 VAL 679 HG12 VAL 679 12.025 6.793 8.050 983 HG13 VAL 679 HG13 VAL 679 13.712 6.513 8.486 984 HG21 VAL 679 HG21 VAL 679 14.895 4.548 7.628 985 HG22 VAL 679 HG22 VAL 679 13.985 3.189 6.971 986 HG23 VAL 679 HG23 VAL 679 13.856 3.592 8.682 987 H GLY 680 HN GLY 680 11.825 1.653 7.311 988 HA2 GLY 680 HA2 GLY 680 12.121 0.226 9.252 989 HA3 GLY 680 HA1 GLY 680 11.069 1.314 10.139 990 H ASP 681 HN ASP 681 9.339 1.436 7.608 991 HA ASP 681 HA ASP 681 7.658 -0.762 8.509 992 HB2 ASP 681 HB2 ASP 681 7.107 1.513 6.603 993 HB3 ASP 681 HB1 ASP 681 5.956 0.261 6.973 994 H VAL 682 HN VAL 682 8.148 -2.693 7.616 995 HA VAL 682 HA VAL 682 8.981 -2.930 4.918 996 HB VAL 682 HB VAL 682 9.793 -4.699 6.124 997 HG11 VAL 682 HG11 VAL 682 7.109 -5.082 7.370 998 HG12 VAL 682 HG12 VAL 682 8.520 -4.345 8.122 999 HG13 VAL 682 HG13 VAL 682 8.543 -6.056 7.691 1000 HG21 VAL 682 HG21 VAL 682 8.692 -6.754 5.384 1001 HG22 VAL 682 HG22 VAL 682 8.818 -5.565 4.087 1002 HG23 VAL 682 HG23 VAL 682 7.278 -5.810 4.913 1003 H CYS 683 HN CYS 683 7.770 -2.471 3.284 1004 HA CYS 683 HA CYS 683 4.943 -2.224 3.617 1005 HB2 CYS 683 HB2 CYS 683 6.825 -1.692 1.343 1006 HB3 CYS 683 HB1 CYS 683 5.090 -1.516 1.150 1007 HG CYS 683 HG CYS 683 6.842 0.158 3.565 1008 H ILE 684 HN ILE 684 3.328 -3.287 2.630 1009 HA ILE 684 HA ILE 684 3.882 -5.926 1.631 1010 HB ILE 684 HB ILE 684 1.306 -4.379 1.960 1011 HG12 ILE 684 HG12 ILE 684 2.290 -6.887 3.312 1012 HG13 ILE 684 HG11 ILE 684 2.421 -5.273 4.006 1013 HG21 ILE 684 HG21 ILE 684 0.148 -6.480 1.354 1014 HG22 ILE 684 HG22 ILE 684 1.702 -7.166 0.882 1015 HG23 ILE 684 HG23 ILE 684 1.052 -5.777 0.014 1016 HD11 ILE 684 HD11 ILE 684 0.514 -6.484 4.905 1017 HD12 ILE 684 HD12 ILE 684 -0.141 -6.677 3.278 1018 HD13 ILE 684 HD13 ILE 684 -0.002 -5.069 3.989 1019 H SER 685 HN SER 685 4.887 -5.723 -0.335 1020 HA SER 685 HA SER 685 3.494 -4.182 -2.385 1021 HB2 SER 685 HB2 SER 685 6.109 -5.706 -2.553 1022 HB3 SER 685 HB1 SER 685 5.511 -4.528 -3.724 1023 HG SER 685 HG SER 685 6.682 -4.134 -1.242 1024 H LEU 686 HN LEU 686 1.963 -5.214 -3.504 1025 HA LEU 686 HA LEU 686 2.022 -8.141 -3.412 1026 HB2 LEU 686 HB2 LEU 686 0.162 -6.363 -2.399 1027 HB3 LEU 686 HB1 LEU 686 -0.569 -6.925 -3.892 1028 HG LEU 686 HG LEU 686 0.558 -8.914 -1.978 1029 HD11 LEU 686 HD11 LEU 686 -2.182 -7.705 -1.782 1030 HD12 LEU 686 HD12 LEU 686 -0.855 -7.405 -0.660 1031 HD13 LEU 686 HD13 LEU 686 -1.534 -9.029 -0.805 1032 HD21 LEU 686 HD21 LEU 686 -1.194 -10.303 -2.935 1033 HD22 LEU 686 HD22 LEU 686 -0.168 -9.618 -4.199 1034 HD23 LEU 686 HD23 LEU 686 -1.764 -8.935 -3.889 1035 H THR 687 HN THR 687 1.981 -9.222 -5.213 1036 HA THR 687 HA THR 687 1.869 -7.676 -7.689 1037 HB THR 687 HB THR 687 3.933 -8.941 -7.274 1038 HG1 THR 687 HG1 THR 687 4.037 -9.282 -9.354 1039 HG21 THR 687 HG21 THR 687 2.170 -11.387 -7.399 1040 HG22 THR 687 HG22 THR 687 3.029 -10.793 -5.979 1041 HG23 THR 687 HG23 THR 687 3.933 -11.392 -7.369 1042 H LEU 688 HN LEU 688 0.339 -7.948 -9.136 1043 HA LEU 688 HA LEU 688 -1.601 -10.115 -8.823 1044 HB2 LEU 688 HB2 LEU 688 -1.607 -7.418 -10.052 1045 HB3 LEU 688 HB1 LEU 688 -2.521 -8.641 -10.906 1046 HG LEU 688 HG LEU 688 -3.810 -7.188 -9.278 1047 HD11 LEU 688 HD11 LEU 688 -4.725 -9.238 -10.165 1048 HD12 LEU 688 HD12 LEU 688 -5.166 -9.066 -8.466 1049 HD13 LEU 688 HD13 LEU 688 -3.881 -10.178 -8.935 1050 HD21 LEU 688 HD21 LEU 688 -2.305 -8.866 -7.272 1051 HD22 LEU 688 HD22 LEU 688 -3.747 -7.919 -6.904 1052 HD23 LEU 688 HD23 LEU 688 -2.269 -7.110 -7.427 1053 H LYS 689 HN LYS 689 -0.757 -11.912 -9.721 1054 HA LYS 689 HA LYS 689 1.031 -11.988 -11.866 1055 HB2 LYS 689 HB2 LYS 689 -0.726 -14.027 -10.597 1056 HB3 LYS 689 HB1 LYS 689 0.233 -14.432 -12.006 1057 HG2 LYS 689 HG2 LYS 689 1.314 -13.334 -9.425 1058 HG3 LYS 689 HG1 LYS 689 1.341 -15.033 -9.898 1059 HD2 LYS 689 HD2 LYS 689 2.710 -12.752 -11.324 1060 HD3 LYS 689 HD1 LYS 689 3.491 -13.980 -10.336 1061 HE2 LYS 689 HE2 LYS 689 2.693 -15.708 -11.906 1062 HE3 LYS 689 HE1 LYS 689 1.995 -14.440 -12.912 1063 HZ1 LYS 689 HZ1 LYS 689 4.868 -14.826 -12.293 1064 HZ2 LYS 689 HZ2 LYS 689 4.244 -13.510 -13.150 1065 HZ3 LYS 689 HZ3 LYS 689 4.114 -15.071 -13.787 Start of MODEL 9 1 H1 VAL 34 HT1 VAL 34 -19.551 -4.753 -5.078 2 H2 VAL 34 HT2 VAL 34 -18.779 -5.992 -5.927 3 H3 VAL 34 HT3 VAL 34 -18.758 -4.417 -6.530 4 HA VAL 34 HA VAL 34 -17.413 -3.660 -4.722 5 HB VAL 34 HB VAL 34 -17.327 -6.526 -3.786 6 HG11 VAL 34 HG11 VAL 34 -16.234 -5.566 -1.817 7 HG12 VAL 34 HG12 VAL 34 -16.277 -3.982 -2.590 8 HG13 VAL 34 HG13 VAL 34 -15.325 -5.286 -3.299 9 HG21 VAL 34 HG21 VAL 34 -19.554 -5.642 -3.386 10 HG22 VAL 34 HG22 VAL 34 -18.862 -4.212 -2.621 11 HG23 VAL 34 HG23 VAL 34 -18.669 -5.795 -1.868 12 H PHE 35 HN PHE 35 -15.106 -3.880 -4.733 13 HA PHE 35 HA PHE 35 -14.396 -4.830 -7.417 14 HB2 PHE 35 HB2 PHE 35 -13.041 -2.668 -5.798 15 HB3 PHE 35 HB1 PHE 35 -12.844 -2.999 -7.515 16 HD1 PHE 35 HD2 PHE 35 -15.959 -3.438 -7.861 17 HD2 PHE 35 HD1 PHE 35 -13.550 -0.340 -6.209 18 HE1 PHE 35 HE2 PHE 35 -17.714 -1.802 -8.387 19 HE2 PHE 35 HE1 PHE 35 -15.308 1.291 -6.721 20 HZ PHE 35 HZ PHE 35 -17.392 0.569 -7.815 21 HA PRO 36 HA PRO 36 -11.145 -7.560 -6.051 22 HB2 PRO 36 HB2 PRO 36 -9.427 -6.010 -7.934 23 HB3 PRO 36 HB1 PRO 36 -9.666 -7.756 -7.810 24 HG2 PRO 36 HG2 PRO 36 -10.810 -6.370 -9.770 25 HG3 PRO 36 HG1 PRO 36 -11.671 -7.698 -8.971 26 HD2 PRO 36 HD2 PRO 36 -12.024 -4.752 -8.666 27 HD3 PRO 36 HD1 PRO 36 -13.237 -6.047 -8.614 28 H TRP 37 HN TRP 37 -9.680 -7.478 -4.449 29 HA TRP 37 HA TRP 37 -9.552 -5.157 -2.957 30 HB2 TRP 37 HB2 TRP 37 -7.816 -6.444 -1.588 31 HB3 TRP 37 HB1 TRP 37 -9.433 -7.111 -1.736 32 HD1 TRP 37 HD1 TRP 37 -9.611 -9.110 -3.777 33 HE1 TRP 37 HE1 TRP 37 -7.964 -11.036 -4.177 34 HE3 TRP 37 HE3 TRP 37 -5.520 -7.186 -1.394 35 HZ2 TRP 37 HZ2 TRP 37 -5.305 -11.672 -3.543 36 HZ3 TRP 37 HZ3 TRP 37 -3.462 -8.533 -1.332 37 HH2 TRP 37 HH2 TRP 37 -3.362 -10.732 -2.388 38 H HIS 38 HN HIS 38 -7.316 -6.233 -5.432 39 HA HIS 38 HA HIS 38 -5.274 -4.388 -4.737 40 HB2 HIS 38 HB2 HIS 38 -4.812 -6.237 -6.254 41 HB3 HIS 38 HB1 HIS 38 -5.985 -5.625 -7.408 42 HD1 HIS 38 HD1 HIS 38 -2.719 -4.443 -5.814 43 HD2 HIS 38 HD2 HIS 38 -4.877 -4.101 -9.348 44 HE1 HIS 38 HE1 HIS 38 -1.250 -3.146 -7.379 45 HE2 HIS 38 HE2 HIS 38 -2.637 -2.819 -9.455 46 H SER 39 HN SER 39 -6.734 -2.632 -4.160 47 HA SER 39 HA SER 39 -7.194 -0.876 -6.467 48 HB2 SER 39 HB2 SER 39 -9.365 -1.817 -5.791 49 HB3 SER 39 HB1 SER 39 -9.089 -1.298 -4.131 50 HG SER 39 HG SER 39 -8.974 0.894 -5.056 51 H LEU 40 HN LEU 40 -5.641 -1.411 -3.646 52 HA LEU 40 HA LEU 40 -5.078 1.390 -3.070 53 HB2 LEU 40 HB2 LEU 40 -5.454 0.597 -0.526 54 HB3 LEU 40 HB1 LEU 40 -6.676 1.424 -1.472 55 HG LEU 40 HG LEU 40 -6.682 -1.534 -1.662 56 HD11 LEU 40 HD11 LEU 40 -6.337 -1.412 0.677 57 HD12 LEU 40 HD12 LEU 40 -8.075 -1.633 0.432 58 HD13 LEU 40 HD13 LEU 40 -7.431 -0.039 0.832 59 HD21 LEU 40 HD21 LEU 40 -8.297 -0.043 -2.828 60 HD22 LEU 40 HD22 LEU 40 -8.889 0.477 -1.249 61 HD23 LEU 40 HD23 LEU 40 -9.059 -1.206 -1.743 62 H VAL 41 HN VAL 41 -4.508 -2.042 -2.526 63 HA VAL 41 HA VAL 41 -2.044 -1.671 -1.151 64 HB VAL 41 HB VAL 41 -3.405 -3.665 -0.773 65 HG11 VAL 41 HG11 VAL 41 -4.345 -3.986 -2.989 66 HG12 VAL 41 HG12 VAL 41 -3.537 -5.456 -2.447 67 HG13 VAL 41 HG13 VAL 41 -2.755 -4.404 -3.628 68 HG21 VAL 41 HG21 VAL 41 -1.608 -5.343 -1.001 69 HG22 VAL 41 HG22 VAL 41 -1.077 -3.816 -0.300 70 HG23 VAL 41 HG23 VAL 41 -0.712 -4.185 -1.983 71 HA PRO 42 HA PRO 42 0.128 -1.039 -4.995 72 HB2 PRO 42 HB2 PRO 42 2.299 0.094 -3.979 73 HB3 PRO 42 HB1 PRO 42 0.736 0.921 -3.903 74 HG2 PRO 42 HG2 PRO 42 2.193 -0.581 -1.769 75 HG3 PRO 42 HG1 PRO 42 1.277 0.931 -1.648 76 HD2 PRO 42 HD2 PRO 42 0.314 -1.601 -0.991 77 HD3 PRO 42 HD1 PRO 42 -0.685 -0.170 -1.314 78 H PHE 43 HN PHE 43 2.523 -1.327 -5.616 79 HA PHE 43 HA PHE 43 3.814 -3.618 -4.340 80 HB2 PHE 43 HB2 PHE 43 2.584 -4.558 -6.244 81 HB3 PHE 43 HB1 PHE 43 3.273 -3.346 -7.314 82 HD1 PHE 43 HD1 PHE 43 4.200 -6.193 -5.114 83 HD2 PHE 43 HD2 PHE 43 5.253 -3.768 -8.449 84 HE1 PHE 43 HE1 PHE 43 6.066 -7.712 -5.624 85 HE2 PHE 43 HE2 PHE 43 7.124 -5.280 -8.963 86 HZ PHE 43 HZ PHE 43 7.531 -7.255 -7.551 87 H LEU 44 HN LEU 44 5.743 -2.808 -3.727 88 HA LEU 44 HA LEU 44 6.736 -0.393 -4.800 89 HB2 LEU 44 HB2 LEU 44 8.400 -0.475 -3.204 90 HB3 LEU 44 HB1 LEU 44 7.123 -1.388 -2.441 91 HG LEU 44 HG LEU 44 9.018 -2.571 -1.888 92 HD11 LEU 44 HD11 LEU 44 7.489 -4.167 -2.749 93 HD12 LEU 44 HD12 LEU 44 9.115 -4.636 -3.243 94 HD13 LEU 44 HD13 LEU 44 8.027 -3.871 -4.402 95 HD21 LEU 44 HD21 LEU 44 10.886 -3.041 -3.365 96 HD22 LEU 44 HD22 LEU 44 10.578 -1.307 -3.237 97 HD23 LEU 44 HD23 LEU 44 10.063 -2.194 -4.673 98 H ALA 45 HN ALA 45 8.888 -0.132 -5.866 99 HA ALA 45 HA ALA 45 8.838 -1.264 -8.365 100 HB1 ALA 45 HB1 ALA 45 10.062 0.769 -7.861 101 HB2 ALA 45 HB2 ALA 45 11.109 -0.396 -8.671 102 HB3 ALA 45 HB3 ALA 45 11.243 -0.152 -6.930 103 HA PRO 46 HA PRO 46 10.068 -5.460 -8.300 104 HB2 PRO 46 HB2 PRO 46 11.954 -5.238 -10.419 105 HB3 PRO 46 HB1 PRO 46 10.272 -5.761 -10.527 106 HG2 PRO 46 HG2 PRO 46 11.466 -3.100 -11.066 107 HG3 PRO 46 HG1 PRO 46 10.038 -3.862 -11.789 108 HD2 PRO 46 HD2 PRO 46 9.805 -1.866 -10.024 109 HD3 PRO 46 HD1 PRO 46 8.660 -3.226 -10.025 110 H SER 47 HN SER 47 11.438 -6.506 -7.043 111 HA SER 47 HA SER 47 13.534 -5.168 -5.744 112 HB2 SER 47 HB2 SER 47 14.015 -7.602 -4.931 113 HB3 SER 47 HB1 SER 47 12.523 -6.795 -4.448 114 HG SER 47 HG SER 47 11.686 -8.578 -5.234 115 H GLN 48 HN GLN 48 15.200 -4.517 -6.921 116 HA GLN 48 HA GLN 48 16.688 -6.527 -8.419 117 HB2 GLN 48 HB2 GLN 48 17.500 -4.553 -9.818 118 HB3 GLN 48 HB1 GLN 48 15.837 -5.068 -10.056 119 HG2 GLN 48 HG2 GLN 48 15.132 -3.242 -8.504 120 HG3 GLN 48 HG1 GLN 48 16.801 -2.679 -8.505 121 HE21 GLN 48 HE21 GLN 48 14.367 -1.352 -9.408 122 HE22 GLN 48 HE22 GLN 48 14.632 -0.935 -11.065 123 H ALA 567 HT1 ALA 567 -30.438 7.237 -2.760 124 HA ALA 567 HA ALA 567 -28.965 7.844 -0.273 125 HB1 ALA 567 HB1 ALA 567 -28.869 5.389 -2.017 126 HB2 ALA 567 HB2 ALA 567 -29.670 5.498 -0.449 127 HB3 ALA 567 HB3 ALA 567 -27.920 5.682 -0.558 128 HA PRO 568 HA PRO 568 -26.128 9.546 -3.237 129 HB2 PRO 568 HB2 PRO 568 -24.242 10.358 -1.491 130 HB3 PRO 568 HB1 PRO 568 -25.772 11.205 -1.703 131 HG2 PRO 568 HG2 PRO 568 -24.874 9.446 0.502 132 HG3 PRO 568 HG1 PRO 568 -26.025 10.791 0.535 133 HD2 PRO 568 HD2 PRO 568 -26.638 8.036 0.468 134 HD3 PRO 568 HD1 PRO 568 -27.769 9.379 0.244 135 HA PRO 569 HA PRO 569 -23.243 6.209 -3.718 136 HB2 PRO 569 HB2 PRO 569 -21.885 7.149 -5.826 137 HB3 PRO 569 HB1 PRO 569 -23.572 6.641 -5.970 138 HG2 PRO 569 HG2 PRO 569 -22.439 9.400 -5.718 139 HG3 PRO 569 HG1 PRO 569 -23.738 8.817 -6.775 140 HD2 PRO 569 HD2 PRO 569 -24.165 10.131 -4.394 141 HD3 PRO 569 HD1 PRO 569 -25.318 9.001 -5.128 142 H THR 570 HN THR 570 -22.595 9.005 -2.263 143 HA THR 570 HA THR 570 -20.890 10.109 -1.332 144 HB THR 570 HB THR 570 -19.161 8.617 -0.280 145 HG1 THR 570 HG1 THR 570 -19.945 6.884 -2.058 146 HG21 THR 570 HG21 THR 570 -22.056 7.934 0.184 147 HG22 THR 570 HG22 THR 570 -21.185 9.295 0.892 148 HG23 THR 570 HG23 THR 570 -20.738 7.642 1.319 149 H LEU 571 HN LEU 571 -18.134 9.632 -1.235 150 HA LEU 571 HA LEU 571 -17.249 10.570 -3.732 151 HB2 LEU 571 HB2 LEU 571 -15.116 10.676 -2.800 152 HB3 LEU 571 HB1 LEU 571 -16.190 10.954 -1.457 153 HG LEU 571 HG LEU 571 -14.658 8.429 -2.058 154 HD11 LEU 571 HD11 LEU 571 -13.580 8.926 0.083 155 HD12 LEU 571 HD12 LEU 571 -14.518 10.415 0.203 156 HD13 LEU 571 HD13 LEU 571 -13.334 10.221 -1.090 157 HD21 LEU 571 HD21 LEU 571 -16.503 8.942 0.259 158 HD22 LEU 571 HD22 LEU 571 -15.642 7.450 -0.126 159 HD23 LEU 571 HD23 LEU 571 -16.948 8.016 -1.173 160 HA PRO 572 HA PRO 572 -16.346 7.257 -6.462 161 HB2 PRO 572 HB2 PRO 572 -13.454 7.510 -5.743 162 HB3 PRO 572 HB1 PRO 572 -14.202 7.322 -7.330 163 HG2 PRO 572 HG2 PRO 572 -13.407 9.714 -6.509 164 HG3 PRO 572 HG1 PRO 572 -14.920 9.522 -7.411 165 HD2 PRO 572 HD2 PRO 572 -14.496 10.093 -4.537 166 HD3 PRO 572 HD1 PRO 572 -15.855 10.534 -5.583 167 HA PRO 573 HA PRO 573 -16.397 3.767 -3.853 168 HB2 PRO 573 HB2 PRO 573 -16.888 1.890 -5.669 169 HB3 PRO 573 HB1 PRO 573 -18.052 3.179 -5.344 170 HG2 PRO 573 HG2 PRO 573 -16.056 2.957 -7.568 171 HG3 PRO 573 HG1 PRO 573 -17.755 3.431 -7.633 172 HD2 PRO 573 HD2 PRO 573 -15.691 5.220 -7.598 173 HD3 PRO 573 HD1 PRO 573 -17.320 5.578 -6.995 174 H TYR 574 HN TYR 574 -13.867 4.196 -6.100 175 HA TYR 574 HA TYR 574 -12.531 1.731 -5.299 176 HB2 TYR 574 HB2 TYR 574 -11.854 3.867 -7.272 177 HB3 TYR 574 HB1 TYR 574 -10.626 2.755 -6.713 178 HD1 TYR 574 HD1 TYR 574 -10.745 0.388 -7.243 179 HD2 TYR 574 HD2 TYR 574 -13.585 3.138 -8.805 180 HE1 TYR 574 HE1 TYR 574 -11.404 -1.270 -8.927 181 HE2 TYR 574 HE2 TYR 574 -14.260 1.487 -10.496 182 HH TYR 574 HH TYR 574 -13.157 -0.520 -11.643 183 H PHE 575 HN PHE 575 -11.632 1.714 -3.405 184 HA PHE 575 HA PHE 575 -10.074 1.952 -1.840 185 HB2 PHE 575 HB2 PHE 575 -7.998 2.375 -2.548 186 HB3 PHE 575 HB1 PHE 575 -8.766 2.423 -4.122 187 HD1 PHE 575 HD1 PHE 575 -7.187 4.369 -1.473 188 HD2 PHE 575 HD2 PHE 575 -8.982 4.523 -5.327 189 HE1 PHE 575 HE1 PHE 575 -6.250 6.614 -1.815 190 HE2 PHE 575 HE2 PHE 575 -8.051 6.772 -5.673 191 HZ PHE 575 HZ PHE 575 -6.687 7.822 -3.912 192 H MET 576 HN MET 576 -11.662 4.847 -2.807 193 HA MET 576 HA MET 576 -10.449 6.514 -0.831 194 HB2 MET 576 HB2 MET 576 -13.088 6.896 -2.251 195 HB3 MET 576 HB1 MET 576 -12.181 8.126 -1.398 196 HG2 MET 576 HG2 MET 576 -10.292 7.616 -3.025 197 HG3 MET 576 HG1 MET 576 -11.523 6.779 -3.952 198 HE1 MET 576 HE1 MET 576 -11.314 8.265 -6.149 199 HE2 MET 576 HE2 MET 576 -9.884 8.867 -5.314 200 HE3 MET 576 HE3 MET 576 -11.019 10.001 -6.050 201 H LYS 577 HN LYS 577 -12.023 7.652 0.821 202 HA LYS 577 HA LYS 577 -12.303 5.911 2.897 203 HB2 LYS 577 HB2 LYS 577 -12.391 8.369 3.114 204 HB3 LYS 577 HB1 LYS 577 -14.037 8.347 2.489 205 HG2 LYS 577 HG2 LYS 577 -14.678 6.892 4.401 206 HG3 LYS 577 HG1 LYS 577 -13.052 7.110 5.050 207 HD2 LYS 577 HD2 LYS 577 -13.441 9.550 5.099 208 HD3 LYS 577 HD1 LYS 577 -15.092 9.267 4.540 209 HE2 LYS 577 HE2 LYS 577 -14.999 9.578 6.967 210 HE3 LYS 577 HE1 LYS 577 -15.569 7.969 6.534 211 HZ1 LYS 577 HZ1 LYS 577 -13.415 7.059 7.038 212 HZ2 LYS 577 HZ2 LYS 577 -13.951 7.969 8.363 213 HZ3 LYS 577 HZ3 LYS 577 -12.783 8.607 7.328 214 H GLY 578 HN GLY 578 -13.596 4.351 3.489 215 HA2 GLY 578 HA2 GLY 578 -15.494 3.139 3.882 216 HA3 GLY 578 HA1 GLY 578 -16.424 4.497 3.287 217 H SER 579 HN SER 579 -14.157 3.491 0.986 218 HA SER 579 HA SER 579 -16.117 2.303 -0.691 219 HB2 SER 579 HB2 SER 579 -13.094 2.247 -0.882 220 HB3 SER 579 HB1 SER 579 -14.200 1.748 -2.163 221 HG SER 579 HG SER 579 -13.663 4.314 -1.155 222 H ILE 580 HN ILE 580 -16.754 0.241 -0.851 223 HA ILE 580 HA ILE 580 -15.799 -1.643 1.101 224 HB ILE 580 HB ILE 580 -17.896 -1.897 -1.064 225 HG12 ILE 580 HG12 ILE 580 -18.436 -0.347 0.794 226 HG13 ILE 580 HG11 ILE 580 -19.499 -1.749 0.760 227 HG21 ILE 580 HG21 ILE 580 -17.069 -3.864 1.060 228 HG22 ILE 580 HG22 ILE 580 -17.055 -4.094 -0.692 229 HG23 ILE 580 HG23 ILE 580 -18.588 -3.960 0.169 230 HD11 ILE 580 HD11 ILE 580 -17.099 -1.552 2.561 231 HD12 ILE 580 HD12 ILE 580 -18.421 -2.715 2.639 232 HD13 ILE 580 HD13 ILE 580 -18.710 -1.017 3.036 233 H ILE 581 HN ILE 581 -14.223 -3.014 0.809 234 HA ILE 581 HA ILE 581 -13.227 -3.499 -1.918 235 HB ILE 581 HB ILE 581 -11.639 -3.939 0.600 236 HG12 ILE 581 HG12 ILE 581 -12.376 -1.599 0.651 237 HG13 ILE 581 HG11 ILE 581 -10.654 -1.712 0.347 238 HG21 ILE 581 HG21 ILE 581 -10.909 -3.419 -2.265 239 HG22 ILE 581 HG22 ILE 581 -10.756 -4.940 -1.384 240 HG23 ILE 581 HG23 ILE 581 -9.751 -3.557 -0.942 241 HD11 ILE 581 HD11 ILE 581 -11.086 -1.333 -2.041 242 HD12 ILE 581 HD12 ILE 581 -11.597 0.003 -1.011 243 HD13 ILE 581 HD13 ILE 581 -12.797 -1.112 -1.668 244 H GLN 582 HN GLN 582 -13.081 -5.577 -2.640 245 HA GLN 582 HA GLN 582 -13.962 -7.679 -0.784 246 HB2 GLN 582 HB2 GLN 582 -15.329 -7.358 -2.798 247 HB3 GLN 582 HB1 GLN 582 -13.936 -7.667 -3.797 248 HG2 GLN 582 HG2 GLN 582 -13.779 -9.927 -2.811 249 HG3 GLN 582 HG1 GLN 582 -15.280 -9.624 -1.953 250 HE21 GLN 582 HE21 GLN 582 -16.404 -11.252 -3.001 251 HE22 GLN 582 HE22 GLN 582 -16.840 -11.164 -4.670 252 H LEU 583 HN LEU 583 -12.497 -8.985 -0.030 253 HA LEU 583 HA LEU 583 -9.838 -8.991 -1.127 254 HB2 LEU 583 HB2 LEU 583 -11.053 -10.478 1.184 255 HB3 LEU 583 HB1 LEU 583 -9.346 -10.424 0.813 256 HG LEU 583 HG LEU 583 -11.064 -8.073 1.595 257 HD11 LEU 583 HD11 LEU 583 -8.852 -9.450 3.098 258 HD12 LEU 583 HD12 LEU 583 -10.579 -9.684 3.388 259 HD13 LEU 583 HD13 LEU 583 -9.852 -8.100 3.655 260 HD21 LEU 583 HD21 LEU 583 -9.395 -7.250 0.125 261 HD22 LEU 583 HD22 LEU 583 -8.154 -8.272 0.851 262 HD23 LEU 583 HD23 LEU 583 -8.823 -6.919 1.766 263 H ALA 584 HN ALA 584 -8.794 -11.422 -0.916 264 HA ALA 584 HA ALA 584 -9.802 -12.643 -3.274 265 HB1 ALA 584 HB1 ALA 584 -7.417 -12.659 -2.725 266 HB2 ALA 584 HB2 ALA 584 -8.040 -14.285 -3.005 267 HB3 ALA 584 HB3 ALA 584 -7.744 -13.726 -1.359 268 H ASN 585 HN ASN 585 -10.048 -13.390 0.148 269 HA ASN 585 HA ASN 585 -11.289 -15.924 -0.201 270 HB2 ASN 585 HB2 ASN 585 -10.127 -15.346 1.852 271 HB3 ASN 585 HB1 ASN 585 -11.298 -14.085 2.135 272 HD21 ASN 585 HD21 ASN 585 -12.004 -14.866 4.045 273 HD22 ASN 585 HD22 ASN 585 -12.924 -16.320 4.184 274 H GLY 586 HN GLY 586 -12.356 -12.625 -0.098 275 HA2 GLY 586 HA2 GLY 586 -14.192 -12.042 -1.450 276 HA3 GLY 586 HA1 GLY 586 -14.965 -13.571 -1.062 277 H GLU 587 HN GLU 587 -13.508 -12.013 1.574 278 HA GLU 587 HA GLU 587 -16.044 -11.232 2.693 279 HB2 GLU 587 HB2 GLU 587 -14.609 -10.265 4.488 280 HB3 GLU 587 HB1 GLU 587 -14.273 -11.958 4.180 281 HG2 GLU 587 HG2 GLU 587 -12.733 -9.898 2.757 282 HG3 GLU 587 HG1 GLU 587 -12.381 -10.272 4.415 283 H LEU 588 HN LEU 588 -16.368 -8.992 3.424 284 HA LEU 588 HA LEU 588 -15.383 -7.044 1.462 285 HB2 LEU 588 HB2 LEU 588 -18.214 -7.205 2.491 286 HB3 LEU 588 HB1 LEU 588 -17.602 -6.137 1.241 287 HG LEU 588 HG LEU 588 -17.728 -9.143 1.001 288 HD11 LEU 588 HD11 LEU 588 -19.953 -8.200 1.140 289 HD12 LEU 588 HD12 LEU 588 -19.613 -8.750 -0.501 290 HD13 LEU 588 HD13 LEU 588 -19.556 -7.029 -0.118 291 HD21 LEU 588 HD21 LEU 588 -17.181 -7.008 -1.055 292 HD22 LEU 588 HD22 LEU 588 -17.283 -8.738 -1.361 293 HD23 LEU 588 HD23 LEU 588 -15.981 -8.095 -0.361 294 H LYS 589 HN LYS 589 -14.407 -5.422 2.437 295 HA LYS 589 HA LYS 589 -15.389 -4.441 5.023 296 HB2 LYS 589 HB2 LYS 589 -12.524 -4.962 4.314 297 HB3 LYS 589 HB1 LYS 589 -13.072 -4.190 5.778 298 HG2 LYS 589 HG2 LYS 589 -14.017 -6.193 6.593 299 HG3 LYS 589 HG1 LYS 589 -13.842 -6.987 5.030 300 HD2 LYS 589 HD2 LYS 589 -12.139 -7.744 6.614 301 HD3 LYS 589 HD1 LYS 589 -11.419 -6.907 5.238 302 HE2 LYS 589 HE2 LYS 589 -10.298 -6.118 7.161 303 HE3 LYS 589 HE1 LYS 589 -11.397 -4.836 6.657 304 HZ1 LYS 589 HZ1 LYS 589 -11.590 -5.026 8.985 305 HZ2 LYS 589 HZ2 LYS 589 -11.728 -6.711 8.922 306 HZ3 LYS 589 HZ3 LYS 589 -12.988 -5.739 8.348 307 H LYS 590 HN LYS 590 -14.932 -2.205 5.387 308 HA LYS 590 HA LYS 590 -14.450 -0.691 2.989 309 HB2 LYS 590 HB2 LYS 590 -15.123 0.071 5.814 310 HB3 LYS 590 HB1 LYS 590 -14.631 1.283 4.633 311 HG2 LYS 590 HG2 LYS 590 -16.444 0.546 3.156 312 HG3 LYS 590 HG1 LYS 590 -16.947 -0.608 4.376 313 HD2 LYS 590 HD2 LYS 590 -17.562 1.101 5.863 314 HD3 LYS 590 HD1 LYS 590 -16.809 2.344 4.888 315 HE2 LYS 590 HE2 LYS 590 -18.452 1.870 3.105 316 HE3 LYS 590 HE1 LYS 590 -19.222 0.692 4.164 317 HZ1 LYS 590 HZ1 LYS 590 -19.765 2.438 5.705 318 HZ2 LYS 590 HZ2 LYS 590 -20.342 2.857 4.174 319 HZ3 LYS 590 HZ3 LYS 590 -18.941 3.582 4.775 320 H VAL 591 HN VAL 591 -12.840 0.894 2.768 321 HA VAL 591 HA VAL 591 -10.371 -0.222 2.662 322 HB VAL 591 HB VAL 591 -10.474 2.720 3.105 323 HG11 VAL 591 HG11 VAL 591 -8.359 1.730 2.588 324 HG12 VAL 591 HG12 VAL 591 -8.906 2.692 1.212 325 HG13 VAL 591 HG13 VAL 591 -9.036 0.936 1.165 326 HG21 VAL 591 HG21 VAL 591 -12.488 2.261 1.821 327 HG22 VAL 591 HG22 VAL 591 -11.531 1.379 0.630 328 HG23 VAL 591 HG23 VAL 591 -11.276 3.112 0.866 329 H GLU 592 HN GLU 592 -11.505 1.973 5.197 330 HA GLU 592 HA GLU 592 -8.883 2.357 6.221 331 HB2 GLU 592 HB2 GLU 592 -10.092 3.634 8.026 332 HB3 GLU 592 HB1 GLU 592 -10.372 4.183 6.380 333 HG2 GLU 592 HG2 GLU 592 -12.514 2.980 6.360 334 HG3 GLU 592 HG1 GLU 592 -12.236 2.494 8.033 335 H ASP 593 HN ASP 593 -11.132 -0.108 6.683 336 HA ASP 593 HA ASP 593 -10.095 -0.679 9.374 337 HB2 ASP 593 HB2 ASP 593 -12.574 -0.469 9.114 338 HB3 ASP 593 HB1 ASP 593 -12.543 -1.840 8.013 339 H LEU 594 HN LEU 594 -9.536 -1.468 6.245 340 HA LEU 594 HA LEU 594 -9.140 -4.253 6.363 341 HB2 LEU 594 HB2 LEU 594 -7.767 -2.135 4.710 342 HB3 LEU 594 HB1 LEU 594 -7.623 -3.861 4.442 343 HG LEU 594 HG LEU 594 -10.280 -2.452 4.358 344 HD11 LEU 594 HD11 LEU 594 -8.418 -3.017 2.066 345 HD12 LEU 594 HD12 LEU 594 -8.772 -1.425 2.732 346 HD13 LEU 594 HD13 LEU 594 -10.048 -2.360 1.956 347 HD21 LEU 594 HD21 LEU 594 -9.294 -5.054 3.208 348 HD22 LEU 594 HD22 LEU 594 -10.917 -4.393 3.025 349 HD23 LEU 594 HD23 LEU 594 -10.335 -4.874 4.620 350 H LYS 595 HN LYS 595 -7.657 -5.384 7.393 351 HA LYS 595 HA LYS 595 -5.362 -3.952 8.525 352 HB2 LYS 595 HB2 LYS 595 -6.505 -6.633 9.316 353 HB3 LYS 595 HB1 LYS 595 -5.181 -5.800 10.116 354 HG2 LYS 595 HG2 LYS 595 -8.021 -4.816 9.935 355 HG3 LYS 595 HG1 LYS 595 -7.275 -5.570 11.346 356 HD2 LYS 595 HD2 LYS 595 -5.672 -3.740 11.486 357 HD3 LYS 595 HD1 LYS 595 -6.379 -2.999 10.050 358 HE2 LYS 595 HE2 LYS 595 -8.512 -2.763 11.231 359 HE3 LYS 595 HE1 LYS 595 -7.790 -3.483 12.669 360 HZ1 LYS 595 HZ1 LYS 595 -6.915 -0.957 11.381 361 HZ2 LYS 595 HZ2 LYS 595 -6.234 -1.643 12.768 362 HZ3 LYS 595 HZ3 LYS 595 -7.825 -1.073 12.803 363 H THR 596 HN THR 596 -3.335 -5.300 8.690 364 HA THR 596 HA THR 596 -2.468 -5.935 6.123 365 HB THR 596 HB THR 596 -0.944 -5.282 7.940 366 HG1 THR 596 HG1 THR 596 -0.550 -7.387 6.245 367 HG21 THR 596 HG21 THR 596 -1.952 -6.542 9.765 368 HG22 THR 596 HG22 THR 596 -0.243 -6.933 9.605 369 HG23 THR 596 HG23 THR 596 -1.460 -8.054 9.002 370 H GLU 597 HN GLU 597 -3.680 -8.022 8.700 371 HA GLU 597 HA GLU 597 -2.923 -10.494 7.634 372 HB2 GLU 597 HB2 GLU 597 -5.247 -9.807 9.409 373 HB3 GLU 597 HB1 GLU 597 -4.684 -11.437 9.093 374 HG2 GLU 597 HG2 GLU 597 -2.535 -10.888 10.109 375 HG3 GLU 597 HG1 GLU 597 -3.110 -9.252 10.429 376 H ASP 598 HN ASP 598 -5.617 -8.411 6.945 377 HA ASP 598 HA ASP 598 -7.301 -10.300 5.714 378 HB2 ASP 598 HB2 ASP 598 -7.072 -7.316 5.297 379 HB3 ASP 598 HB1 ASP 598 -8.344 -8.312 4.624 380 H PHE 599 HN PHE 599 -4.920 -8.045 4.366 381 HA PHE 599 HA PHE 599 -5.223 -9.048 1.710 382 HB2 PHE 599 HB2 PHE 599 -3.216 -7.203 2.989 383 HB3 PHE 599 HB1 PHE 599 -3.055 -7.736 1.319 384 HD1 PHE 599 HD2 PHE 599 -5.831 -6.478 3.487 385 HD2 PHE 599 HD1 PHE 599 -3.788 -6.234 -0.234 386 HE1 PHE 599 HE2 PHE 599 -7.402 -4.745 2.738 387 HE2 PHE 599 HE1 PHE 599 -5.363 -4.503 -0.988 388 HZ PHE 599 HZ PHE 599 -7.172 -3.756 0.499 389 H ILE 600 HN ILE 600 -2.953 -9.617 4.364 390 HA ILE 600 HA ILE 600 -1.155 -11.307 3.132 391 HB ILE 600 HB ILE 600 -2.348 -11.388 5.894 392 HG12 ILE 600 HG12 ILE 600 0.369 -10.529 4.891 393 HG13 ILE 600 HG11 ILE 600 -0.960 -9.443 5.252 394 HG21 ILE 600 HG21 ILE 600 -0.075 -13.049 4.813 395 HG22 ILE 600 HG22 ILE 600 -1.626 -13.639 5.422 396 HG23 ILE 600 HG23 ILE 600 -0.474 -12.877 6.521 397 HD11 ILE 600 HD11 ILE 600 -0.895 -10.105 7.579 398 HD12 ILE 600 HD12 ILE 600 0.673 -9.497 7.049 399 HD13 ILE 600 HD13 ILE 600 0.414 -11.232 7.234 400 H GLN 601 HN GLN 601 -4.168 -12.277 4.783 401 HA GLN 601 HA GLN 601 -4.056 -14.963 4.048 402 HB2 GLN 601 HB2 GLN 601 -6.356 -13.181 4.800 403 HB3 GLN 601 HB1 GLN 601 -6.589 -14.882 4.412 404 HG2 GLN 601 HG2 GLN 601 -5.014 -15.484 6.168 405 HG3 GLN 601 HG1 GLN 601 -4.836 -13.783 6.593 406 HE21 GLN 601 HE21 GLN 601 -6.850 -16.581 6.734 407 HE22 GLN 601 HE22 GLN 601 -8.023 -15.941 7.834 408 H SER 602 HN SER 602 -5.661 -12.233 2.423 409 HA SER 602 HA SER 602 -6.951 -13.628 0.428 410 HB2 SER 602 HB2 SER 602 -5.584 -10.940 0.213 411 HB3 SER 602 HB1 SER 602 -6.784 -11.567 -0.924 412 HG SER 602 HG SER 602 -7.115 -10.796 1.775 413 H ALA 603 HN ALA 603 -3.549 -12.574 0.461 414 HA ALA 603 HA ALA 603 -3.065 -13.584 -2.186 415 HB1 ALA 603 HB1 ALA 603 -1.816 -11.678 -1.287 416 HB2 ALA 603 HB2 ALA 603 -0.747 -12.993 -1.775 417 HB3 ALA 603 HB3 ALA 603 -1.104 -12.737 -0.067 418 H GLU 604 HN GLU 604 -2.763 -14.802 1.070 419 HA GLU 604 HA GLU 604 -1.053 -16.995 0.442 420 HB2 GLU 604 HB2 GLU 604 -2.837 -16.413 2.795 421 HB3 GLU 604 HB1 GLU 604 -1.726 -17.775 2.717 422 HG2 GLU 604 HG2 GLU 604 -0.811 -14.949 2.312 423 HG3 GLU 604 HG1 GLU 604 -0.937 -15.678 3.911 424 H ILE 605 HN ILE 605 -4.532 -16.598 0.772 425 HA ILE 605 HA ILE 605 -5.251 -19.304 0.427 426 HB ILE 605 HB ILE 605 -6.841 -16.828 -0.297 427 HG12 ILE 605 HG12 ILE 605 -6.902 -18.436 2.261 428 HG13 ILE 605 HG11 ILE 605 -5.929 -16.988 2.062 429 HG21 ILE 605 HG21 ILE 605 -7.766 -18.877 -1.271 430 HG22 ILE 605 HG22 ILE 605 -8.808 -18.242 0.002 431 HG23 ILE 605 HG23 ILE 605 -7.770 -19.631 0.321 432 HD11 ILE 605 HD11 ILE 605 -7.921 -16.409 3.219 433 HD12 ILE 605 HD12 ILE 605 -8.929 -17.179 1.985 434 HD13 ILE 605 HD13 ILE 605 -8.013 -15.723 1.593 435 H SER 606 HN SER 606 -4.157 -16.875 -1.691 436 HA SER 606 HA SER 606 -3.139 -16.990 -3.670 437 HB2 SER 606 HB2 SER 606 -2.419 -19.108 -4.587 438 HB3 SER 606 HB1 SER 606 -2.212 -19.114 -2.839 439 HG SER 606 HG SER 606 -4.515 -20.120 -3.046 440 H ASN 607 HN ASN 607 -3.372 -17.222 -5.894 441 HA ASN 607 HA ASN 607 -5.362 -18.434 -7.346 442 HB2 ASN 607 HB2 ASN 607 -6.747 -16.658 -5.938 443 HB3 ASN 607 HB1 ASN 607 -6.130 -15.538 -7.148 444 HD21 ASN 607 HD21 ASN 607 -6.748 -15.833 -9.346 445 HD22 ASN 607 HD22 ASN 607 -8.156 -16.752 -9.749 446 H ASP 608 HN ASP 608 -4.329 -15.052 -7.287 447 HA ASP 608 HA ASP 608 -2.334 -15.573 -9.383 448 HB2 ASP 608 HB2 ASP 608 -4.326 -13.288 -9.419 449 HB3 ASP 608 HB1 ASP 608 -2.986 -13.486 -10.538 450 H LEU 609 HN LEU 609 -2.857 -14.624 -6.349 451 HA LEU 609 HA LEU 609 -1.226 -12.193 -6.472 452 HB2 LEU 609 HB2 LEU 609 -3.089 -13.062 -4.280 453 HB3 LEU 609 HB1 LEU 609 -2.271 -11.521 -4.418 454 HG LEU 609 HG LEU 609 -4.377 -10.987 -5.080 455 HD11 LEU 609 HD11 LEU 609 -4.417 -10.616 -7.457 456 HD12 LEU 609 HD12 LEU 609 -3.114 -11.786 -7.668 457 HD13 LEU 609 HD13 LEU 609 -2.820 -10.287 -6.787 458 HD21 LEU 609 HD21 LEU 609 -5.317 -13.219 -4.997 459 HD22 LEU 609 HD22 LEU 609 -4.608 -13.578 -6.570 460 HD23 LEU 609 HD23 LEU 609 -5.866 -12.351 -6.431 461 H LYS 610 HN LYS 610 0.329 -11.811 -4.870 462 HA LYS 610 HA LYS 610 0.819 -13.752 -2.802 463 HB2 LYS 610 HB2 LYS 610 3.211 -14.074 -3.422 464 HB3 LYS 610 HB1 LYS 610 2.085 -14.801 -4.560 465 HG2 LYS 610 HG2 LYS 610 2.390 -12.907 -6.070 466 HG3 LYS 610 HG1 LYS 610 3.532 -12.187 -4.934 467 HD2 LYS 610 HD2 LYS 610 4.765 -13.305 -6.668 468 HD3 LYS 610 HD1 LYS 610 4.950 -14.213 -5.167 469 HE2 LYS 610 HE2 LYS 610 3.283 -15.815 -5.900 470 HE3 LYS 610 HE1 LYS 610 2.997 -14.880 -7.367 471 HZ1 LYS 610 HZ1 LYS 610 5.562 -16.186 -6.638 472 HZ2 LYS 610 HZ2 LYS 610 5.256 -15.326 -8.060 473 HZ3 LYS 610 HZ3 LYS 610 4.445 -16.780 -7.762 474 H ILE 611 HN ILE 611 1.837 -12.862 -1.058 475 HA ILE 611 HA ILE 611 2.030 -9.970 -1.000 476 HB ILE 611 HB ILE 611 2.412 -12.047 1.161 477 HG12 ILE 611 HG12 ILE 611 0.089 -11.398 0.029 478 HG13 ILE 611 HG11 ILE 611 0.214 -11.806 1.732 479 HG21 ILE 611 HG21 ILE 611 2.322 -9.065 1.428 480 HG22 ILE 611 HG22 ILE 611 3.707 -10.108 1.737 481 HG23 ILE 611 HG23 ILE 611 2.278 -10.205 2.768 482 HD11 ILE 611 HD11 ILE 611 -1.187 -9.852 1.392 483 HD12 ILE 611 HD12 ILE 611 0.131 -9.031 0.555 484 HD13 ILE 611 HD13 ILE 611 0.277 -9.409 2.272 485 H ASP 612 HN ASP 612 3.871 -8.832 -0.328 486 HA ASP 612 HA ASP 612 6.429 -10.275 -0.331 487 HB2 ASP 612 HB2 ASP 612 6.178 -9.126 -2.511 488 HB3 ASP 612 HB1 ASP 612 5.906 -7.605 -1.660 489 H SER 613 HN SER 613 8.105 -9.155 0.876 490 HA SER 613 HA SER 613 7.093 -7.139 2.740 491 HB2 SER 613 HB2 SER 613 8.402 -8.444 4.550 492 HB3 SER 613 HB1 SER 613 6.829 -9.072 4.047 493 HG SER 613 HG SER 613 9.412 -10.006 3.369 494 H SER 614 HN SER 614 8.324 -5.438 2.315 495 HA SER 614 HA SER 614 11.247 -5.794 2.270 496 HB2 SER 614 HB2 SER 614 9.650 -3.998 0.425 497 HB3 SER 614 HB1 SER 614 11.408 -4.126 0.475 498 HG SER 614 HG SER 614 9.505 -5.953 -0.488 499 H THR 615 HN THR 615 12.217 -4.565 3.784 500 HA THR 615 HA THR 615 10.636 -2.652 5.281 501 HB THR 615 HB THR 615 13.553 -3.337 5.681 502 HG1 THR 615 HG1 THR 615 11.840 -5.108 5.807 503 HG21 THR 615 HG21 THR 615 12.818 -1.301 6.822 504 HG22 THR 615 HG22 THR 615 13.137 -2.587 7.984 505 HG23 THR 615 HG23 THR 615 11.477 -2.183 7.553 506 H VAL 616 HN VAL 616 10.499 -0.565 4.695 507 HA VAL 616 HA VAL 616 12.322 0.726 2.988 508 HB VAL 616 HB VAL 616 10.237 1.742 3.077 509 HG11 VAL 616 HG11 VAL 616 9.131 2.502 5.122 510 HG12 VAL 616 HG12 VAL 616 10.446 1.811 6.069 511 HG13 VAL 616 HG13 VAL 616 9.403 0.759 5.114 512 HG21 VAL 616 HG21 VAL 616 10.607 4.001 4.075 513 HG22 VAL 616 HG22 VAL 616 11.915 3.446 3.024 514 HG23 VAL 616 HG23 VAL 616 12.100 3.377 4.778 515 H GLU 617 HN GLU 617 14.300 1.340 3.349 516 HA GLU 617 HA GLU 617 15.257 1.602 6.093 517 HB2 GLU 617 HB2 GLU 617 16.782 1.395 3.511 518 HB3 GLU 617 HB1 GLU 617 17.516 1.517 5.099 519 HG2 GLU 617 HG2 GLU 617 16.098 -0.590 5.607 520 HG3 GLU 617 HG1 GLU 617 16.034 -0.749 3.857 521 H ARG 618 HN ARG 618 14.409 3.521 3.374 522 HA ARG 618 HA ARG 618 15.129 5.897 4.827 523 HB2 ARG 618 HB2 ARG 618 17.244 5.177 3.637 524 HB3 ARG 618 HB1 ARG 618 16.409 5.503 2.124 525 HG2 ARG 618 HG2 ARG 618 16.041 7.842 2.951 526 HG3 ARG 618 HG1 ARG 618 17.125 7.459 4.289 527 HD2 ARG 618 HD2 ARG 618 17.775 7.418 1.349 528 HD3 ARG 618 HD1 ARG 618 18.359 8.569 2.548 529 HE ARG 618 HE ARG 618 19.302 6.336 3.580 530 HH11 ARG 618 HH11 ARG 618 19.199 7.340 0.225 531 HH12 ARG 618 HH12 ARG 618 20.671 6.520 -0.199 532 HH21 ARG 618 HH21 ARG 618 21.234 5.235 3.017 533 HH22 ARG 618 HH22 ARG 618 21.829 5.328 1.391 534 H ILE 619 HN ILE 619 14.365 7.848 3.779 535 HA ILE 619 HA ILE 619 12.455 7.486 1.603 536 HB ILE 619 HB ILE 619 11.755 8.573 4.338 537 HG12 ILE 619 HG12 ILE 619 10.374 6.511 2.616 538 HG13 ILE 619 HG11 ILE 619 11.540 6.119 3.876 539 HG21 ILE 619 HG21 ILE 619 10.164 8.824 1.781 540 HG22 ILE 619 HG22 ILE 619 10.948 10.146 2.647 541 HG23 ILE 619 HG23 ILE 619 9.604 9.276 3.391 542 HD11 ILE 619 HD11 ILE 619 8.928 7.561 4.293 543 HD12 ILE 619 HD12 ILE 619 10.078 7.097 5.549 544 HD13 ILE 619 HD13 ILE 619 9.229 5.855 4.627 545 H GLU 620 HN GLU 620 12.884 9.009 0.160 546 HA GLU 620 HA GLU 620 14.151 11.490 1.125 547 HB2 GLU 620 HB2 GLU 620 14.861 10.044 -1.426 548 HB3 GLU 620 HB1 GLU 620 15.668 11.448 -0.741 549 HG2 GLU 620 HG2 GLU 620 16.364 10.105 1.177 550 HG3 GLU 620 HG1 GLU 620 15.566 8.695 0.477 551 H ASP 621 HN ASP 621 13.418 13.352 0.320 552 HA ASP 621 HA ASP 621 11.108 13.337 -1.391 553 HB2 ASP 621 HB2 ASP 621 10.897 15.016 0.152 554 HB3 ASP 621 HB1 ASP 621 12.612 15.410 0.141 555 H SER 622 HN SER 622 10.952 13.978 -3.466 556 HA SER 622 HA SER 622 13.513 14.034 -4.907 557 HB2 SER 622 HB2 SER 622 11.693 12.232 -5.318 558 HB3 SER 622 HB1 SER 622 10.833 13.507 -6.176 559 HG SER 622 HG SER 622 12.253 12.133 -7.486 560 H HIS 623 HN HIS 623 11.462 16.191 -3.720 561 HA HIS 623 HA HIS 623 11.182 18.416 -4.048 562 HB2 HIS 623 HB2 HIS 623 12.964 17.967 -6.442 563 HB3 HIS 623 HB1 HIS 623 12.312 19.545 -6.016 564 HD1 HIS 623 HD1 HIS 623 14.021 20.892 -4.863 565 HD2 HIS 623 HD2 HIS 623 14.324 16.865 -3.873 566 HE1 HIS 623 HE1 HIS 623 15.946 20.732 -3.252 567 HE2 HIS 623 HE2 HIS 623 16.098 18.291 -2.648 568 H SER 624 HN SER 624 10.734 16.413 -6.898 569 HA SER 624 HA SER 624 8.797 17.830 -8.265 570 HB2 SER 624 HB2 SER 624 8.910 14.841 -7.793 571 HB3 SER 624 HB1 SER 624 8.066 15.647 -9.112 572 HG SER 624 HG SER 624 10.048 14.952 -9.866 573 HA PRO 625 HA PRO 625 5.348 18.486 -5.680 574 HB2 PRO 625 HB2 PRO 625 3.708 17.342 -7.858 575 HB3 PRO 625 HB1 PRO 625 3.535 18.883 -7.020 576 HG2 PRO 625 HG2 PRO 625 4.555 18.746 -9.496 577 HG3 PRO 625 HG1 PRO 625 5.139 19.922 -8.306 578 HD2 PRO 625 HD2 PRO 625 6.436 17.456 -9.316 579 HD3 PRO 625 HD1 PRO 625 7.166 18.941 -8.681 580 H GLY 626 HN GLY 626 5.273 17.220 -4.028 581 HA2 GLY 626 HA2 GLY 626 4.625 15.528 -2.639 582 HA3 GLY 626 HA1 GLY 626 3.383 15.183 -3.829 583 H VAL 627 HN VAL 627 6.876 14.974 -4.384 584 HA VAL 627 HA VAL 627 6.447 12.094 -4.845 585 HB VAL 627 HB VAL 627 8.552 13.854 -6.110 586 HG11 VAL 627 HG11 VAL 627 7.777 10.986 -6.654 587 HG12 VAL 627 HG12 VAL 627 9.263 11.525 -5.874 588 HG13 VAL 627 HG13 VAL 627 8.959 11.924 -7.565 589 HG21 VAL 627 HG21 VAL 627 6.416 14.475 -6.967 590 HG22 VAL 627 HG22 VAL 627 5.936 12.786 -7.137 591 HG23 VAL 627 HG23 VAL 627 7.198 13.455 -8.179 592 H ALA 628 HN ALA 628 7.383 10.745 -3.542 593 HA ALA 628 HA ALA 628 9.995 11.435 -2.391 594 HB1 ALA 628 HB1 ALA 628 8.266 11.768 -0.663 595 HB2 ALA 628 HB2 ALA 628 9.365 10.449 -0.264 596 HB3 ALA 628 HB3 ALA 628 7.749 10.097 -0.878 597 H VAL 629 HN VAL 629 11.446 9.878 -2.569 598 HA VAL 629 HA VAL 629 10.581 7.342 -3.706 599 HB VAL 629 HB VAL 629 12.367 7.998 -4.983 600 HG11 VAL 629 HG11 VAL 629 13.739 9.020 -2.512 601 HG12 VAL 629 HG12 VAL 629 12.848 9.995 -3.682 602 HG13 VAL 629 HG13 VAL 629 14.329 9.167 -4.170 603 HG21 VAL 629 HG21 VAL 629 12.856 5.771 -4.082 604 HG22 VAL 629 HG22 VAL 629 13.734 6.510 -2.740 605 HG23 VAL 629 HG23 VAL 629 14.336 6.682 -4.389 606 H ILE 630 HN ILE 630 10.239 5.692 -2.499 607 HA ILE 630 HA ILE 630 11.211 5.674 0.242 608 HB ILE 630 HB ILE 630 9.397 3.621 -0.991 609 HG12 ILE 630 HG12 ILE 630 8.425 5.848 -1.439 610 HG13 ILE 630 HG11 ILE 630 7.474 4.938 -0.274 611 HG21 ILE 630 HG21 ILE 630 8.624 3.382 1.314 612 HG22 ILE 630 HG22 ILE 630 9.742 4.651 1.813 613 HG23 ILE 630 HG23 ILE 630 10.366 3.128 1.183 614 HD11 ILE 630 HD11 ILE 630 7.666 7.266 0.364 615 HD12 ILE 630 HD12 ILE 630 9.424 7.128 0.371 616 HD13 ILE 630 HD13 ILE 630 8.463 6.220 1.539 617 H GLN 631 HN GLN 631 13.166 4.797 0.498 618 HA GLN 631 HA GLN 631 14.191 2.873 -1.407 619 HB2 GLN 631 HB2 GLN 631 15.656 4.643 -0.517 620 HB3 GLN 631 HB1 GLN 631 15.438 4.002 1.106 621 HG2 GLN 631 HG2 GLN 631 16.496 1.904 0.410 622 HG3 GLN 631 HG1 GLN 631 16.746 2.580 -1.201 623 HE21 GLN 631 HE21 GLN 631 17.739 2.637 2.119 624 HE22 GLN 631 HE22 GLN 631 19.171 3.574 1.893 625 H PHE 632 HN PHE 632 13.605 0.832 -1.226 626 HA PHE 632 HA PHE 632 12.998 -0.257 1.434 627 HB2 PHE 632 HB2 PHE 632 12.190 -1.140 -1.332 628 HB3 PHE 632 HB1 PHE 632 11.919 -2.122 0.101 629 HD1 PHE 632 HD1 PHE 632 10.557 -1.042 2.000 630 HD2 PHE 632 HD2 PHE 632 10.607 0.404 -1.999 631 HE1 PHE 632 HE1 PHE 632 8.408 0.088 2.389 632 HE2 PHE 632 HE2 PHE 632 8.458 1.539 -1.620 633 HZ PHE 632 HZ PHE 632 7.355 1.382 0.576 634 H ALA 633 HN ALA 633 13.927 -2.095 2.188 635 HA ALA 633 HA ALA 633 16.158 -3.214 0.630 636 HB1 ALA 633 HB1 ALA 633 16.914 -2.383 2.734 637 HB2 ALA 633 HB2 ALA 633 16.876 -4.145 2.846 638 HB3 ALA 633 HB3 ALA 633 15.595 -3.186 3.587 639 H VAL 634 HN VAL 634 15.384 -4.870 -0.518 640 HA VAL 634 HA VAL 634 13.289 -6.565 0.601 641 HB VAL 634 HB VAL 634 14.551 -6.765 -2.133 642 HG11 VAL 634 HG11 VAL 634 12.470 -7.898 -2.720 643 HG12 VAL 634 HG12 VAL 634 11.895 -7.714 -1.064 644 HG13 VAL 634 HG13 VAL 634 13.298 -8.728 -1.403 645 HG21 VAL 634 HG21 VAL 634 12.157 -5.151 -1.260 646 HG22 VAL 634 HG22 VAL 634 12.620 -5.448 -2.936 647 HG23 VAL 634 HG23 VAL 634 13.685 -4.522 -1.879 648 H GLY 635 HN GLY 635 13.892 -8.243 1.797 649 HA2 GLY 635 HA2 GLY 635 14.739 -10.489 1.784 650 HA3 GLY 635 HA1 GLY 635 16.078 -9.937 0.792 651 H GLU 636 HN GLU 636 16.873 -11.394 2.787 652 HA GLU 636 HA GLU 636 17.288 -9.929 5.208 653 HB2 GLU 636 HB2 GLU 636 18.515 -12.482 4.195 654 HB3 GLU 636 HB1 GLU 636 18.783 -11.824 5.798 655 HG2 GLU 636 HG2 GLU 636 16.315 -11.943 6.161 656 HG3 GLU 636 HG1 GLU 636 16.203 -12.825 4.638 657 H HIS 637 HN HIS 637 19.111 -10.524 2.275 658 HA HIS 637 HA HIS 637 21.494 -9.261 3.283 659 HB2 HIS 637 HB2 HIS 637 21.468 -10.993 1.436 660 HB3 HIS 637 HB1 HIS 637 20.780 -9.760 0.388 661 HD1 HIS 637 HD1 HIS 637 22.577 -9.034 -1.144 662 HD2 HIS 637 HD2 HIS 637 23.963 -9.535 2.743 663 HE1 HIS 637 HE1 HIS 637 24.986 -8.309 -1.185 664 HE2 HIS 637 HE2 HIS 637 25.834 -8.720 1.153 665 H ARG 638 HN ARG 638 18.522 -8.315 2.036 666 HA ARG 638 HA ARG 638 17.498 -6.317 1.993 667 HB2 ARG 638 HB2 ARG 638 20.100 -5.344 3.154 668 HB3 ARG 638 HB1 ARG 638 18.683 -4.330 2.959 669 HG2 ARG 638 HG2 ARG 638 17.422 -5.924 4.389 670 HG3 ARG 638 HG1 ARG 638 18.931 -6.793 4.668 671 HD2 ARG 638 HD2 ARG 638 19.905 -4.749 5.625 672 HD3 ARG 638 HD1 ARG 638 18.367 -3.918 5.383 673 HE ARG 638 HE ARG 638 18.467 -6.345 7.032 674 HH11 ARG 638 HH11 ARG 638 17.952 -2.878 6.775 675 HH12 ARG 638 HH12 ARG 638 17.211 -2.760 8.343 676 HH21 ARG 638 HH21 ARG 638 17.484 -6.177 9.082 677 HH22 ARG 638 HH22 ARG 638 16.936 -4.631 9.647 678 H ALA 639 HN ALA 639 17.739 -6.847 -0.363 679 HA ALA 639 HA ALA 639 19.484 -5.249 -1.947 680 HB1 ALA 639 HB1 ALA 639 16.827 -6.466 -2.686 681 HB2 ALA 639 HB2 ALA 639 18.402 -7.244 -2.852 682 HB3 ALA 639 HB3 ALA 639 18.020 -5.811 -3.809 683 H GLN 640 HN GLN 640 19.431 -3.121 -2.081 684 HA GLN 640 HA GLN 640 17.114 -1.706 -1.080 685 HB2 GLN 640 HB2 GLN 640 19.863 -0.780 -1.888 686 HB3 GLN 640 HB1 GLN 640 18.578 0.333 -1.432 687 HG2 GLN 640 HG2 GLN 640 18.403 -0.859 0.736 688 HG3 GLN 640 HG1 GLN 640 19.818 -1.805 0.279 689 HE21 GLN 640 HE21 GLN 640 19.468 -0.007 2.521 690 HE22 GLN 640 HE22 GLN 640 20.695 1.208 2.352 691 H VAL 641 HN VAL 641 15.599 -0.899 -2.242 692 HA VAL 641 HA VAL 641 16.104 -0.336 -5.094 693 HB VAL 641 HB VAL 641 13.519 -1.354 -3.890 694 HG11 VAL 641 HG11 VAL 641 14.266 -0.781 -6.754 695 HG12 VAL 641 HG12 VAL 641 13.131 0.139 -5.767 696 HG13 VAL 641 HG13 VAL 641 12.761 -1.526 -6.215 697 HG21 VAL 641 HG21 VAL 641 15.216 -3.101 -3.978 698 HG22 VAL 641 HG22 VAL 641 15.501 -2.747 -5.683 699 HG23 VAL 641 HG23 VAL 641 13.945 -3.392 -5.165 700 H SER 642 HN SER 642 15.673 1.674 -5.711 701 HA SER 642 HA SER 642 14.347 3.435 -3.775 702 HB2 SER 642 HB2 SER 642 15.487 5.233 -5.247 703 HB3 SER 642 HB1 SER 642 16.507 4.260 -4.189 704 HG SER 642 HG SER 642 17.276 3.168 -5.893 705 H VAL 643 HN VAL 643 12.215 3.527 -4.235 706 HA VAL 643 HA VAL 643 11.442 3.905 -7.040 707 HB VAL 643 HB VAL 643 10.559 1.836 -6.218 708 HG11 VAL 643 HG11 VAL 643 10.706 2.229 -3.828 709 HG12 VAL 643 HG12 VAL 643 9.084 1.692 -4.266 710 HG13 VAL 643 HG13 VAL 643 9.387 3.395 -3.920 711 HG21 VAL 643 HG21 VAL 643 9.076 3.069 -7.651 712 HG22 VAL 643 HG22 VAL 643 8.437 3.961 -6.273 713 HG23 VAL 643 HG23 VAL 643 8.135 2.230 -6.418 714 H GLU 644 HN GLU 644 10.659 5.830 -7.557 715 HA GLU 644 HA GLU 644 10.018 7.773 -5.500 716 HB2 GLU 644 HB2 GLU 644 10.108 7.925 -8.512 717 HB3 GLU 644 HB1 GLU 644 9.642 9.276 -7.490 718 HG2 GLU 644 HG2 GLU 644 11.805 9.314 -6.460 719 HG3 GLU 644 HG1 GLU 644 12.286 7.855 -7.328 720 H VAL 645 HN VAL 645 8.037 7.886 -4.663 721 HA VAL 645 HA VAL 645 5.727 7.207 -6.343 722 HB VAL 645 HB VAL 645 6.496 6.407 -3.565 723 HG11 VAL 645 HG11 VAL 645 4.272 5.951 -2.915 724 HG12 VAL 645 HG12 VAL 645 3.655 6.439 -4.493 725 HG13 VAL 645 HG13 VAL 645 4.368 7.641 -3.414 726 HG21 VAL 645 HG21 VAL 645 6.824 4.835 -5.398 727 HG22 VAL 645 HG22 VAL 645 5.114 4.955 -5.815 728 HG23 VAL 645 HG23 VAL 645 5.600 4.246 -4.275 729 H LEU 646 HN LEU 646 3.868 8.547 -6.030 730 HA LEU 646 HA LEU 646 4.328 11.118 -4.894 731 HB2 LEU 646 HB2 LEU 646 1.740 9.818 -5.736 732 HB3 LEU 646 HB1 LEU 646 1.872 11.469 -5.159 733 HG LEU 646 HG LEU 646 2.672 10.304 -7.769 734 HD11 LEU 646 HD11 LEU 646 1.560 12.985 -6.961 735 HD12 LEU 646 HD12 LEU 646 0.597 11.599 -7.487 736 HD13 LEU 646 HD13 LEU 646 1.724 12.367 -8.607 737 HD21 LEU 646 HD21 LEU 646 4.781 11.142 -6.984 738 HD22 LEU 646 HD22 LEU 646 4.030 12.664 -6.503 739 HD23 LEU 646 HD23 LEU 646 4.132 12.230 -8.211 740 H VAL 647 HN VAL 647 3.707 11.909 -2.944 741 HA VAL 647 HA VAL 647 3.761 10.074 -0.819 742 HB VAL 647 HB VAL 647 3.481 11.971 0.664 743 HG11 VAL 647 HG11 VAL 647 5.404 13.290 -0.071 744 HG12 VAL 647 HG12 VAL 647 5.269 12.585 -1.683 745 HG13 VAL 647 HG13 VAL 647 5.669 11.561 -0.303 746 HG21 VAL 647 HG21 VAL 647 1.783 13.257 -0.366 747 HG22 VAL 647 HG22 VAL 647 2.719 13.440 -1.853 748 HG23 VAL 647 HG23 VAL 647 3.233 14.265 -0.379 749 H GLU 648 HN GLU 648 1.122 10.960 -2.705 750 HA GLU 648 HA GLU 648 -0.790 10.599 -0.536 751 HB2 GLU 648 HB2 GLU 648 -2.492 11.002 -2.404 752 HB3 GLU 648 HB1 GLU 648 -1.487 12.353 -1.917 753 HG2 GLU 648 HG2 GLU 648 -1.598 12.432 -4.258 754 HG3 GLU 648 HG1 GLU 648 0.000 11.805 -3.876 755 H TYR 649 HN TYR 649 0.993 8.638 -2.402 756 HA TYR 649 HA TYR 649 -1.047 6.701 -3.094 757 HB2 TYR 649 HB2 TYR 649 1.059 7.220 -4.452 758 HB3 TYR 649 HB1 TYR 649 1.941 6.321 -3.223 759 HD1 TYR 649 HD1 TYR 649 -1.331 5.671 -4.902 760 HD2 TYR 649 HD2 TYR 649 2.637 4.329 -4.166 761 HE1 TYR 649 HE1 TYR 649 -1.810 3.598 -6.126 762 HE2 TYR 649 HE2 TYR 649 2.166 2.248 -5.388 763 HH TYR 649 HH TYR 649 -0.709 1.833 -7.262 764 HA PRO 650 HA PRO 650 -0.774 5.021 1.047 765 HB2 PRO 650 HB2 PRO 650 -2.606 2.976 0.009 766 HB3 PRO 650 HB1 PRO 650 -2.846 4.139 1.313 767 HG2 PRO 650 HG2 PRO 650 -4.122 4.361 -1.042 768 HG3 PRO 650 HG1 PRO 650 -3.607 5.781 -0.111 769 HD2 PRO 650 HD2 PRO 650 -2.332 4.521 -2.506 770 HD3 PRO 650 HD1 PRO 650 -2.558 6.240 -2.120 771 H PHE 651 HN PHE 651 0.058 3.211 2.058 772 HA PHE 651 HA PHE 651 1.065 1.037 0.380 773 HB2 PHE 651 HB2 PHE 651 2.682 2.952 1.956 774 HB3 PHE 651 HB1 PHE 651 3.118 1.255 2.136 775 HD1 PHE 651 HD1 PHE 651 2.786 4.021 -0.283 776 HD2 PHE 651 HD2 PHE 651 4.223 0.079 0.419 777 HE1 PHE 651 HE1 PHE 651 4.071 4.117 -2.379 778 HE2 PHE 651 HE2 PHE 651 5.512 0.170 -1.674 779 HZ PHE 651 HZ PHE 651 5.438 2.192 -3.076 780 H PHE 652 HN PHE 652 -0.024 -0.639 1.171 781 HA PHE 652 HA PHE 652 -0.719 -0.973 3.900 782 HB2 PHE 652 HB2 PHE 652 -1.267 -2.298 1.485 783 HB3 PHE 652 HB1 PHE 652 -0.422 -3.481 2.477 784 HD1 PHE 652 HD2 PHE 652 -1.267 -3.660 4.946 785 HD2 PHE 652 HD1 PHE 652 -3.537 -2.068 1.723 786 HE1 PHE 652 HE2 PHE 652 -3.330 -4.091 6.196 787 HE2 PHE 652 HE1 PHE 652 -5.610 -2.485 2.975 788 HZ PHE 652 HZ PHE 652 -5.509 -3.497 5.215 789 H VAL 653 HN VAL 653 0.448 -1.909 5.562 790 HA VAL 653 HA VAL 653 3.194 -2.662 4.819 791 HB VAL 653 HB VAL 653 2.594 -1.520 7.520 792 HG11 VAL 653 HG11 VAL 653 4.826 -2.527 6.473 793 HG12 VAL 653 HG12 VAL 653 4.830 -1.223 7.656 794 HG13 VAL 653 HG13 VAL 653 4.991 -0.858 5.935 795 HG21 VAL 653 HG21 VAL 653 2.883 0.050 4.977 796 HG22 VAL 653 HG22 VAL 653 3.312 0.719 6.552 797 HG23 VAL 653 HG23 VAL 653 1.645 0.206 6.229 798 H PHE 654 HN PHE 654 3.957 -4.528 5.471 799 HA PHE 654 HA PHE 654 2.191 -6.608 6.167 800 HB2 PHE 654 HB2 PHE 654 4.235 -6.738 4.735 801 HB3 PHE 654 HB1 PHE 654 5.207 -6.628 6.186 802 HD1 PHE 654 HD1 PHE 654 2.558 -8.711 4.613 803 HD2 PHE 654 HD2 PHE 654 5.839 -8.534 7.315 804 HE1 PHE 654 HE1 PHE 654 2.476 -11.158 4.872 805 HE2 PHE 654 HE2 PHE 654 5.761 -10.975 7.579 806 HZ PHE 654 HZ PHE 654 4.079 -12.289 6.356 807 H GLY 655 HN GLY 655 1.309 -6.233 8.270 808 HA2 GLY 655 HA2 GLY 655 1.320 -6.934 10.518 809 HA3 GLY 655 HA1 GLY 655 3.056 -7.169 10.407 810 H GLN 656 HN GLN 656 2.630 -4.276 9.088 811 HA GLN 656 HA GLN 656 3.269 -2.938 11.605 812 HB2 GLN 656 HB2 GLN 656 3.799 -2.228 8.737 813 HB3 GLN 656 HB1 GLN 656 4.054 -1.076 10.028 814 HG2 GLN 656 HG2 GLN 656 6.155 -1.933 9.676 815 HG3 GLN 656 HG1 GLN 656 5.577 -2.869 11.033 816 HE21 GLN 656 HE21 GLN 656 4.560 -3.364 7.768 817 HE22 GLN 656 HE22 GLN 656 5.295 -4.915 7.526 818 H GLY 657 HN GLY 657 1.110 -2.590 8.756 819 HA2 GLY 657 HA2 GLY 657 -1.193 -2.032 9.950 820 HA3 GLY 657 HA1 GLY 657 -0.366 -0.505 10.185 821 H TRP 658 HN TRP 658 -2.455 0.037 9.002 822 HA TRP 658 HA TRP 658 -2.214 -0.184 6.090 823 HB2 TRP 658 HB2 TRP 658 -4.403 -0.705 7.167 824 HB3 TRP 658 HB1 TRP 658 -4.449 0.919 7.823 825 HD1 TRP 658 HD1 TRP 658 -6.803 1.200 6.621 826 HE1 TRP 658 HE1 TRP 658 -7.433 1.844 4.222 827 HE3 TRP 658 HE3 TRP 658 -2.302 0.335 4.298 828 HZ2 TRP 658 HZ2 TRP 658 -6.219 1.984 1.699 829 HZ3 TRP 658 HZ3 TRP 658 -2.151 0.755 1.878 830 HH2 TRP 658 HH2 TRP 658 -4.063 1.563 0.614 831 H SER 659 HN SER 659 -0.656 1.310 5.487 832 HA SER 659 HA SER 659 -0.862 3.987 6.698 833 HB2 SER 659 HB2 SER 659 1.649 2.441 6.001 834 HB3 SER 659 HB1 SER 659 1.607 4.077 6.657 835 HG SER 659 HG SER 659 1.660 1.857 8.018 836 H SER 660 HN SER 660 0.345 5.671 5.465 837 HA SER 660 HA SER 660 0.700 5.146 2.622 838 HB2 SER 660 HB2 SER 660 -1.583 6.039 2.773 839 HB3 SER 660 HB1 SER 660 -0.995 7.413 3.708 840 HG SER 660 HG SER 660 -1.210 8.022 1.557 841 H CYS 661 HN CYS 661 2.007 6.761 1.582 842 HA CYS 661 HA CYS 661 4.281 7.451 3.044 843 HB2 CYS 661 HB2 CYS 661 3.319 8.713 0.471 844 HB3 CYS 661 HB1 CYS 661 4.977 8.669 1.059 845 HG CYS 661 HG CYS 661 3.207 6.315 -0.553 846 H CYS 662 HN CYS 662 1.288 9.082 2.610 847 HA CYS 662 HA CYS 662 1.950 11.067 4.548 848 HB2 CYS 662 HB2 CYS 662 1.691 11.851 1.656 849 HB3 CYS 662 HB1 CYS 662 1.208 12.969 2.921 850 HG CYS 662 HG CYS 662 4.276 11.639 3.266 851 HA PRO 663 HA PRO 663 -2.337 9.460 4.697 852 HB2 PRO 663 HB2 PRO 663 -2.010 10.665 7.391 853 HB3 PRO 663 HB1 PRO 663 -2.624 9.072 6.937 854 HG2 PRO 663 HG2 PRO 663 -0.199 9.352 8.006 855 HG3 PRO 663 HG1 PRO 663 -0.505 8.171 6.719 856 HD2 PRO 663 HD2 PRO 663 0.844 10.827 6.573 857 HD3 PRO 663 HD1 PRO 663 1.214 9.321 5.709 858 H GLU 664 HN GLU 664 -0.982 12.509 5.686 859 HA GLU 664 HA GLU 664 -3.200 14.097 6.013 860 HB2 GLU 664 HB2 GLU 664 -0.654 14.914 4.604 861 HB3 GLU 664 HB1 GLU 664 -1.759 15.960 5.486 862 HG2 GLU 664 HG2 GLU 664 -1.157 14.950 7.568 863 HG3 GLU 664 HG1 GLU 664 -0.198 13.721 6.746 864 H ARG 665 HN ARG 665 -1.428 13.438 2.988 865 HA ARG 665 HA ARG 665 -3.297 14.990 1.453 866 HB2 ARG 665 HB2 ARG 665 -0.777 14.626 0.981 867 HB3 ARG 665 HB1 ARG 665 -1.284 13.101 0.263 868 HG2 ARG 665 HG2 ARG 665 -2.672 14.246 -1.316 869 HG3 ARG 665 HG1 ARG 665 -2.323 15.797 -0.556 870 HD2 ARG 665 HD2 ARG 665 0.018 15.595 -1.172 871 HD3 ARG 665 HD1 ARG 665 -0.286 14.008 -1.879 872 HE ARG 665 HE ARG 665 -1.899 16.135 -2.971 873 HH11 ARG 665 HH11 ARG 665 1.170 14.468 -3.228 874 HH12 ARG 665 HH12 ARG 665 1.357 14.814 -4.917 875 HH21 ARG 665 HH21 ARG 665 -1.660 16.584 -5.177 876 HH22 ARG 665 HH22 ARG 665 -0.255 16.023 -6.026 877 H THR 666 HN THR 666 -2.650 11.510 1.906 878 HA THR 666 HA THR 666 -4.459 10.553 -0.004 879 HB THR 666 HB THR 666 -3.788 9.226 2.636 880 HG1 THR 666 HG1 THR 666 -2.438 8.883 0.149 881 HG21 THR 666 HG21 THR 666 -4.225 7.135 1.501 882 HG22 THR 666 HG22 THR 666 -4.494 7.969 -0.030 883 HG23 THR 666 HG23 THR 666 -5.633 8.177 1.299 884 H SER 667 HN SER 667 -4.958 11.487 3.384 885 HA SER 667 HA SER 667 -7.761 10.863 3.307 886 HB2 SER 667 HB2 SER 667 -6.303 10.812 5.376 887 HB3 SER 667 HB1 SER 667 -6.357 12.569 5.340 888 HG SER 667 HG SER 667 -8.140 10.908 6.362 889 H GLN 668 HN GLN 668 -5.785 13.724 2.767 890 HA GLN 668 HA GLN 668 -7.785 15.675 2.778 891 HB2 GLN 668 HB2 GLN 668 -5.102 15.385 1.690 892 HB3 GLN 668 HB1 GLN 668 -6.110 16.583 0.899 893 HG2 GLN 668 HG2 GLN 668 -5.607 16.422 3.842 894 HG3 GLN 668 HG1 GLN 668 -4.802 17.475 2.718 895 HE21 GLN 668 HE21 GLN 668 -7.175 18.032 1.180 896 HE22 GLN 668 HE22 GLN 668 -8.140 19.068 2.161 897 H LEU 669 HN LEU 669 -6.512 13.728 0.112 898 HA LEU 669 HA LEU 669 -8.267 15.066 -1.765 899 HB2 LEU 669 HB2 LEU 669 -6.458 12.773 -2.424 900 HB3 LEU 669 HB1 LEU 669 -6.982 14.085 -3.456 901 HG LEU 669 HG LEU 669 -4.995 14.269 -1.201 902 HD11 LEU 669 HD11 LEU 669 -3.409 14.810 -3.013 903 HD12 LEU 669 HD12 LEU 669 -4.673 14.442 -4.189 904 HD13 LEU 669 HD13 LEU 669 -4.063 13.176 -3.122 905 HD21 LEU 669 HD21 LEU 669 -6.208 16.330 -1.266 906 HD22 LEU 669 HD22 LEU 669 -6.054 16.419 -3.023 907 HD23 LEU 669 HD23 LEU 669 -4.625 16.586 -2.001 908 H PHE 670 HN PHE 670 -7.849 11.902 -0.315 909 HA PHE 670 HA PHE 670 -10.115 10.889 -1.898 910 HB2 PHE 670 HB2 PHE 670 -7.914 9.295 -0.573 911 HB3 PHE 670 HB1 PHE 670 -9.116 8.692 -1.704 912 HD1 PHE 670 HD1 PHE 670 -9.143 10.060 -4.007 913 HD2 PHE 670 HD2 PHE 670 -5.821 9.714 -1.378 914 HE1 PHE 670 HE1 PHE 670 -7.624 10.570 -5.873 915 HE2 PHE 670 HE2 PHE 670 -4.294 10.224 -3.236 916 HZ PHE 670 HZ PHE 670 -5.193 10.652 -5.486 917 H ASP 671 HN ASP 671 -9.501 12.093 1.021 918 HA ASP 671 HA ASP 671 -10.356 11.960 3.109 919 HB2 ASP 671 HB2 ASP 671 -12.584 10.748 1.503 920 HB3 ASP 671 HB1 ASP 671 -12.706 10.897 3.252 921 H LEU 672 HN LEU 672 -8.725 9.681 2.028 922 HA LEU 672 HA LEU 672 -9.838 7.405 3.489 923 HB2 LEU 672 HB2 LEU 672 -8.978 7.389 1.034 924 HB3 LEU 672 HB1 LEU 672 -7.395 7.340 1.752 925 HG LEU 672 HG LEU 672 -9.371 5.231 1.402 926 HD11 LEU 672 HD11 LEU 672 -6.401 5.244 1.878 927 HD12 LEU 672 HD12 LEU 672 -7.221 5.177 0.317 928 HD13 LEU 672 HD13 LEU 672 -7.351 3.826 1.441 929 HD21 LEU 672 HD21 LEU 672 -9.777 5.096 3.641 930 HD22 LEU 672 HD22 LEU 672 -8.135 5.576 4.084 931 HD23 LEU 672 HD23 LEU 672 -8.441 3.967 3.424 932 HA PRO 673 HA PRO 673 -6.994 8.639 6.707 933 HB2 PRO 673 HB2 PRO 673 -7.798 6.757 8.498 934 HB3 PRO 673 HB1 PRO 673 -8.679 8.262 8.207 935 HG2 PRO 673 HG2 PRO 673 -9.225 5.515 7.185 936 HG3 PRO 673 HG1 PRO 673 -10.367 6.755 7.733 937 HD2 PRO 673 HD2 PRO 673 -9.863 6.230 5.090 938 HD3 PRO 673 HD1 PRO 673 -10.367 7.823 5.696 939 H CYS 674 HN CYS 674 -4.993 8.038 7.078 940 HA CYS 674 HA CYS 674 -4.166 5.255 6.659 941 HB2 CYS 674 HB2 CYS 674 -3.119 7.683 5.222 942 HB3 CYS 674 HB1 CYS 674 -2.165 6.213 5.340 943 HG CYS 674 HG CYS 674 -5.317 5.886 4.172 944 H SER 675 HN SER 675 -2.301 4.660 7.737 945 HA SER 675 HA SER 675 -1.407 6.389 9.890 946 HB2 SER 675 HB2 SER 675 -0.362 3.661 9.071 947 HB3 SER 675 HB1 SER 675 -0.110 4.469 10.616 948 HG SER 675 HG SER 675 -2.714 4.360 10.229 949 H LYS 676 HN LYS 676 0.988 6.856 10.108 950 HA LYS 676 HA LYS 676 1.906 7.812 7.564 951 HB2 LYS 676 HB2 LYS 676 2.264 9.176 9.559 952 HB3 LYS 676 HB1 LYS 676 3.278 7.916 10.253 953 HG2 LYS 676 HG2 LYS 676 4.583 9.766 9.275 954 HG3 LYS 676 HG1 LYS 676 4.924 8.204 8.513 955 HD2 LYS 676 HD2 LYS 676 3.405 8.787 6.673 956 HD3 LYS 676 HD1 LYS 676 3.086 10.346 7.428 957 HE2 LYS 676 HE2 LYS 676 5.825 9.422 6.587 958 HE3 LYS 676 HE1 LYS 676 4.760 10.372 5.556 959 HZ1 LYS 676 HZ1 LYS 676 4.761 12.107 7.263 960 HZ2 LYS 676 HZ2 LYS 676 6.313 11.798 6.677 961 HZ3 LYS 676 HZ3 LYS 676 5.850 11.204 8.189 962 H LEU 677 HN LEU 677 2.834 6.558 6.152 963 HA LEU 677 HA LEU 677 4.354 4.231 6.912 964 HB2 LEU 677 HB2 LEU 677 2.943 4.278 4.878 965 HB3 LEU 677 HB1 LEU 677 3.946 5.539 4.205 966 HG LEU 677 HG LEU 677 4.266 3.145 3.349 967 HD11 LEU 677 HD11 LEU 677 5.825 4.938 2.824 968 HD12 LEU 677 HD12 LEU 677 6.674 3.415 3.091 969 HD13 LEU 677 HD13 LEU 677 6.674 4.656 4.344 970 HD21 LEU 677 HD21 LEU 677 4.271 2.069 5.545 971 HD22 LEU 677 HD22 LEU 677 5.778 2.896 5.938 972 HD23 LEU 677 HD23 LEU 677 5.735 1.715 4.629 973 H SER 678 HN SER 678 6.268 4.546 7.793 974 HA SER 678 HA SER 678 8.067 6.507 6.549 975 HB2 SER 678 HB2 SER 678 7.693 6.001 9.509 976 HB3 SER 678 HB1 SER 678 8.989 6.980 8.820 977 HG SER 678 HG SER 678 7.331 8.304 7.884 978 H VAL 679 HN VAL 679 10.380 6.124 7.361 979 HA VAL 679 HA VAL 679 11.273 3.655 6.493 980 HB VAL 679 HB VAL 679 12.775 5.439 6.349 981 HG11 VAL 679 HG11 VAL 679 12.341 5.898 9.285 982 HG12 VAL 679 HG12 VAL 679 11.878 6.950 7.942 983 HG13 VAL 679 HG13 VAL 679 13.582 6.708 8.328 984 HG21 VAL 679 HG21 VAL 679 14.761 4.729 7.537 985 HG22 VAL 679 HG22 VAL 679 13.856 3.322 6.977 986 HG23 VAL 679 HG23 VAL 679 13.778 3.802 8.673 987 H GLY 680 HN GLY 680 11.731 1.776 7.434 988 HA2 GLY 680 HA2 GLY 680 12.200 0.438 9.407 989 HA3 GLY 680 HA1 GLY 680 11.161 1.520 10.317 990 H ASP 681 HN ASP 681 9.347 1.433 7.787 991 HA ASP 681 HA ASP 681 7.804 -0.802 8.837 992 HB2 ASP 681 HB2 ASP 681 7.070 1.394 6.884 993 HB3 ASP 681 HB1 ASP 681 6.020 0.054 7.262 994 H VAL 682 HN VAL 682 7.040 -2.519 7.591 995 HA VAL 682 HA VAL 682 8.719 -3.105 5.270 996 HB VAL 682 HB VAL 682 7.084 -4.963 7.006 997 HG11 VAL 682 HG11 VAL 682 7.196 -5.783 4.725 998 HG12 VAL 682 HG12 VAL 682 8.169 -6.784 5.802 999 HG13 VAL 682 HG13 VAL 682 8.952 -5.616 4.738 1000 HG21 VAL 682 HG21 VAL 682 10.055 -4.520 6.814 1001 HG22 VAL 682 HG22 VAL 682 9.291 -5.840 7.698 1002 HG23 VAL 682 HG23 VAL 682 9.012 -4.168 8.194 1003 H CYS 683 HN CYS 683 7.739 -2.603 3.346 1004 HA CYS 683 HA CYS 683 4.964 -2.140 3.162 1005 HB2 CYS 683 HB2 CYS 683 5.330 -2.025 0.721 1006 HB3 CYS 683 HB1 CYS 683 6.469 -1.039 1.605 1007 HG CYS 683 HG CYS 683 7.007 -3.853 -0.198 1008 H ILE 684 HN ILE 684 3.306 -3.341 2.473 1009 HA ILE 684 HA ILE 684 3.753 -6.118 1.723 1010 HB ILE 684 HB ILE 684 1.224 -4.461 1.924 1011 HG12 ILE 684 HG12 ILE 684 2.170 -6.790 3.593 1012 HG13 ILE 684 HG11 ILE 684 2.298 -5.100 4.066 1013 HG21 ILE 684 HG21 ILE 684 0.949 -6.086 0.160 1014 HG22 ILE 684 HG22 ILE 684 -0.000 -6.568 1.567 1015 HG23 ILE 684 HG23 ILE 684 1.528 -7.371 1.216 1016 HD11 ILE 684 HD11 ILE 684 0.395 -6.155 5.130 1017 HD12 ILE 684 HD12 ILE 684 -0.256 -6.601 3.551 1018 HD13 ILE 684 HD13 ILE 684 -0.128 -4.902 4.004 1019 H SER 685 HN SER 685 4.750 -6.068 -0.252 1020 HA SER 685 HA SER 685 3.586 -4.451 -2.364 1021 HB2 SER 685 HB2 SER 685 5.661 -6.401 -3.097 1022 HB3 SER 685 HB1 SER 685 5.634 -4.651 -3.347 1023 HG SER 685 HG SER 685 7.096 -5.934 -1.616 1024 H LEU 686 HN LEU 686 1.871 -5.236 -3.425 1025 HA LEU 686 HA LEU 686 1.359 -8.099 -3.226 1026 HB2 LEU 686 HB2 LEU 686 -0.261 -5.964 -2.806 1027 HB3 LEU 686 HB1 LEU 686 -0.650 -6.345 -4.471 1028 HG LEU 686 HG LEU 686 -2.191 -7.408 -2.900 1029 HD11 LEU 686 HD11 LEU 686 -0.410 -9.349 -4.348 1030 HD12 LEU 686 HD12 LEU 686 -1.808 -8.503 -5.015 1031 HD13 LEU 686 HD13 LEU 686 -2.028 -9.701 -3.739 1032 HD21 LEU 686 HD21 LEU 686 -0.648 -7.671 -1.018 1033 HD22 LEU 686 HD22 LEU 686 0.210 -8.930 -1.908 1034 HD23 LEU 686 HD23 LEU 686 -1.463 -9.183 -1.419 1035 H THR 687 HN THR 687 1.600 -9.405 -4.887 1036 HA THR 687 HA THR 687 2.273 -8.220 -7.465 1037 HB THR 687 HB THR 687 2.571 -11.051 -6.459 1038 HG1 THR 687 HG1 THR 687 3.921 -9.166 -5.608 1039 HG21 THR 687 HG21 THR 687 4.015 -11.368 -8.417 1040 HG22 THR 687 HG22 THR 687 3.607 -9.743 -8.968 1041 HG23 THR 687 HG23 THR 687 2.358 -10.984 -8.877 1042 H LEU 688 HN LEU 688 0.740 -8.046 -8.900 1043 HA LEU 688 HA LEU 688 -1.567 -9.846 -8.868 1044 HB2 LEU 688 HB2 LEU 688 -1.025 -7.095 -9.818 1045 HB3 LEU 688 HB1 LEU 688 -2.070 -8.047 -10.846 1046 HG LEU 688 HG LEU 688 -3.252 -6.568 -9.213 1047 HD11 LEU 688 HD11 LEU 688 -3.739 -9.529 -9.016 1048 HD12 LEU 688 HD12 LEU 688 -4.405 -8.419 -10.213 1049 HD13 LEU 688 HD13 LEU 688 -4.880 -8.279 -8.521 1050 HD21 LEU 688 HD21 LEU 688 -3.440 -7.385 -6.875 1051 HD22 LEU 688 HD22 LEU 688 -1.843 -6.748 -7.280 1052 HD23 LEU 688 HD23 LEU 688 -2.098 -8.491 -7.198 1053 H LYS 689 HN LYS 689 -1.089 -11.682 -9.954 1054 HA LYS 689 HA LYS 689 0.685 -11.709 -12.184 1055 HB2 LYS 689 HB2 LYS 689 -1.036 -13.755 -10.878 1056 HB3 LYS 689 HB1 LYS 689 -0.239 -14.120 -12.392 1057 HG2 LYS 689 HG2 LYS 689 1.111 -13.261 -9.843 1058 HG3 LYS 689 HG1 LYS 689 1.050 -14.908 -10.472 1059 HD2 LYS 689 HD2 LYS 689 2.320 -12.561 -11.890 1060 HD3 LYS 689 HD1 LYS 689 3.196 -13.742 -10.925 1061 HE2 LYS 689 HE2 LYS 689 1.528 -14.436 -13.335 1062 HE3 LYS 689 HE1 LYS 689 3.266 -14.157 -13.384 1063 HZ1 LYS 689 HZ1 LYS 689 1.887 -16.272 -11.822 1064 HZ2 LYS 689 HZ2 LYS 689 3.553 -15.991 -11.822 1065 HZ3 LYS 689 HZ3 LYS 689 2.781 -16.502 -13.238 Start of MODEL 10 1 H1 VAL 34 HT1 VAL 34 -18.231 -4.760 -6.323 2 H2 VAL 34 HT2 VAL 34 -18.300 -3.094 -6.082 3 H3 VAL 34 HT3 VAL 34 -18.877 -4.137 -4.889 4 HA VAL 34 HA VAL 34 -16.743 -3.250 -4.258 5 HB VAL 34 HB VAL 34 -15.458 -5.396 -4.036 6 HG11 VAL 34 HG11 VAL 34 -17.099 -6.487 -2.595 7 HG12 VAL 34 HG12 VAL 34 -18.352 -5.423 -3.240 8 HG13 VAL 34 HG13 VAL 34 -16.997 -4.749 -2.329 9 HG21 VAL 34 HG21 VAL 34 -16.161 -6.454 -6.112 10 HG22 VAL 34 HG22 VAL 34 -17.820 -6.539 -5.518 11 HG23 VAL 34 HG23 VAL 34 -16.550 -7.469 -4.723 12 H PHE 35 HN PHE 35 -14.538 -3.069 -4.597 13 HA PHE 35 HA PHE 35 -13.626 -3.440 -7.368 14 HB2 PHE 35 HB2 PHE 35 -12.753 -1.556 -5.172 15 HB3 PHE 35 HB1 PHE 35 -11.714 -1.896 -6.551 16 HD1 PHE 35 HD2 PHE 35 -15.399 -1.475 -6.468 17 HD2 PHE 35 HD1 PHE 35 -11.659 0.132 -7.719 18 HE1 PHE 35 HE2 PHE 35 -16.578 0.225 -7.782 19 HE2 PHE 35 HE1 PHE 35 -12.840 1.822 -9.058 20 HZ PHE 35 HZ PHE 35 -15.300 1.872 -9.093 21 HA PRO 36 HA PRO 36 -11.054 -6.861 -6.101 22 HB2 PRO 36 HB2 PRO 36 -9.055 -5.526 -7.873 23 HB3 PRO 36 HB1 PRO 36 -9.594 -7.210 -7.860 24 HG2 PRO 36 HG2 PRO 36 -10.447 -5.531 -9.740 25 HG3 PRO 36 HG1 PRO 36 -11.539 -6.736 -9.032 26 HD2 PRO 36 HD2 PRO 36 -11.394 -3.797 -8.555 27 HD3 PRO 36 HD1 PRO 36 -12.807 -4.871 -8.579 28 H TRP 37 HN TRP 37 -9.684 -7.095 -4.408 29 HA TRP 37 HA TRP 37 -9.393 -4.935 -2.779 30 HB2 TRP 37 HB2 TRP 37 -7.892 -6.371 -1.375 31 HB3 TRP 37 HB1 TRP 37 -9.469 -7.031 -1.769 32 HD1 TRP 37 HD1 TRP 37 -9.453 -9.002 -3.749 33 HE1 TRP 37 HE1 TRP 37 -7.699 -10.829 -4.145 34 HE3 TRP 37 HE3 TRP 37 -5.514 -6.885 -1.274 35 HZ2 TRP 37 HZ2 TRP 37 -5.023 -11.324 -3.462 36 HZ3 TRP 37 HZ3 TRP 37 -3.380 -8.112 -1.209 37 HH2 TRP 37 HH2 TRP 37 -3.150 -10.284 -2.284 38 H HIS 38 HN HIS 38 -7.002 -6.091 -5.106 39 HA HIS 38 HA HIS 38 -5.017 -4.216 -4.238 40 HB2 HIS 38 HB2 HIS 38 -4.372 -6.157 -5.593 41 HB3 HIS 38 HB1 HIS 38 -5.371 -5.580 -6.922 42 HD1 HIS 38 HD1 HIS 38 -4.344 -3.885 -8.495 43 HD2 HIS 38 HD2 HIS 38 -2.002 -4.600 -5.143 44 HE1 HIS 38 HE1 HIS 38 -2.161 -2.726 -8.938 45 HE2 HIS 38 HE2 HIS 38 -0.876 -2.950 -6.788 46 H SER 39 HN SER 39 -6.512 -2.445 -3.952 47 HA SER 39 HA SER 39 -6.974 -0.953 -6.445 48 HB2 SER 39 HB2 SER 39 -9.103 -1.868 -5.731 49 HB3 SER 39 HB1 SER 39 -8.847 -1.304 -4.082 50 HG SER 39 HG SER 39 -10.035 0.292 -4.844 51 H LEU 40 HN LEU 40 -5.540 -1.125 -3.483 52 HA LEU 40 HA LEU 40 -5.319 1.796 -3.164 53 HB2 LEU 40 HB2 LEU 40 -5.063 0.634 -0.618 54 HB3 LEU 40 HB1 LEU 40 -6.354 1.664 -1.198 55 HG LEU 40 HG LEU 40 -6.477 -1.283 -1.730 56 HD11 LEU 40 HD11 LEU 40 -7.247 0.096 0.829 57 HD12 LEU 40 HD12 LEU 40 -6.058 -1.192 0.632 58 HD13 LEU 40 HD13 LEU 40 -7.774 -1.521 0.364 59 HD21 LEU 40 HD21 LEU 40 -8.865 -0.876 -1.684 60 HD22 LEU 40 HD22 LEU 40 -8.085 0.236 -2.810 61 HD23 LEU 40 HD23 LEU 40 -8.594 0.802 -1.219 62 H VAL 41 HN VAL 41 -3.964 -1.396 -2.413 63 HA VAL 41 HA VAL 41 -1.556 -0.474 -1.315 64 HB VAL 41 HB VAL 41 -2.418 -2.674 -0.803 65 HG11 VAL 41 HG11 VAL 41 -2.382 -4.515 -2.408 66 HG12 VAL 41 HG12 VAL 41 -1.853 -3.407 -3.674 67 HG13 VAL 41 HG13 VAL 41 -3.451 -3.221 -2.955 68 HG21 VAL 41 HG21 VAL 41 -0.375 -3.978 -1.085 69 HG22 VAL 41 HG22 VAL 41 -0.042 -2.319 -0.591 70 HG23 VAL 41 HG23 VAL 41 0.199 -2.803 -2.268 71 HA PRO 42 HA PRO 42 0.426 0.543 -5.225 72 HB2 PRO 42 HB2 PRO 42 2.679 1.401 -3.595 73 HB3 PRO 42 HB1 PRO 42 1.607 2.376 -4.602 74 HG2 PRO 42 HG2 PRO 42 1.610 2.510 -1.892 75 HG3 PRO 42 HG1 PRO 42 0.164 2.811 -2.872 76 HD2 PRO 42 HD2 PRO 42 0.953 0.342 -1.370 77 HD3 PRO 42 HD1 PRO 42 -0.638 1.125 -1.505 78 H PHE 43 HN PHE 43 1.728 -0.682 -6.442 79 HA PHE 43 HA PHE 43 2.934 -2.996 -5.224 80 HB2 PHE 43 HB2 PHE 43 1.732 -3.205 -7.355 81 HB3 PHE 43 HB1 PHE 43 2.873 -2.101 -8.115 82 HD1 PHE 43 HD2 PHE 43 3.169 -5.146 -5.959 83 HD2 PHE 43 HD1 PHE 43 4.296 -3.161 -9.553 84 HE1 PHE 43 HE2 PHE 43 4.611 -7.045 -6.556 85 HE2 PHE 43 HE1 PHE 43 5.735 -5.061 -10.155 86 HZ PHE 43 HZ PHE 43 5.893 -7.007 -8.657 87 H LEU 44 HN LEU 44 4.792 -2.722 -4.213 88 HA LEU 44 HA LEU 44 6.795 -0.859 -4.667 89 HB2 LEU 44 HB2 LEU 44 7.024 -2.069 -2.667 90 HB3 LEU 44 HB1 LEU 44 6.729 -3.602 -3.480 91 HG LEU 44 HG LEU 44 8.983 -3.250 -4.639 92 HD11 LEU 44 HD11 LEU 44 9.314 -1.309 -2.365 93 HD12 LEU 44 HD12 LEU 44 9.271 -0.904 -4.081 94 HD13 LEU 44 HD13 LEU 44 10.591 -1.881 -3.438 95 HD21 LEU 44 HD21 LEU 44 8.906 -3.734 -1.673 96 HD22 LEU 44 HD22 LEU 44 10.179 -4.238 -2.782 97 HD23 LEU 44 HD23 LEU 44 8.562 -4.927 -2.926 98 H ALA 45 HN ALA 45 8.754 -0.958 -5.811 99 HA ALA 45 HA ALA 45 8.513 -2.137 -8.406 100 HB1 ALA 45 HB1 ALA 45 10.808 -0.629 -7.156 101 HB2 ALA 45 HB2 ALA 45 9.504 0.074 -8.111 102 HB3 ALA 45 HB3 ALA 45 10.649 -1.035 -8.864 103 HA PRO 46 HA PRO 46 10.187 -6.107 -7.255 104 HB2 PRO 46 HB2 PRO 46 10.776 -6.181 -10.172 105 HB3 PRO 46 HB1 PRO 46 9.932 -7.361 -9.165 106 HG2 PRO 46 HG2 PRO 46 8.583 -5.773 -10.822 107 HG3 PRO 46 HG1 PRO 46 7.940 -6.185 -9.223 108 HD2 PRO 46 HD2 PRO 46 9.196 -3.648 -10.163 109 HD3 PRO 46 HD1 PRO 46 7.868 -3.895 -9.012 110 H SER 47 HN SER 47 12.119 -6.362 -6.381 111 HA SER 47 HA SER 47 14.463 -5.058 -7.464 112 HB2 SER 47 HB2 SER 47 14.046 -5.230 -4.994 113 HB3 SER 47 HB1 SER 47 14.249 -6.975 -5.125 114 HG SER 47 HG SER 47 16.152 -4.927 -5.408 115 H GLN 48 HN GLN 48 13.130 -8.271 -7.086 116 HA GLN 48 HA GLN 48 15.370 -9.437 -8.533 117 HB2 GLN 48 HB2 GLN 48 13.133 -10.756 -6.993 118 HB3 GLN 48 HB1 GLN 48 14.496 -11.589 -7.727 119 HG2 GLN 48 HG2 GLN 48 16.022 -10.610 -6.196 120 HG3 GLN 48 HG1 GLN 48 14.797 -9.493 -5.594 121 HE21 GLN 48 HE21 GLN 48 13.211 -10.237 -4.212 122 HE22 GLN 48 HE22 GLN 48 13.335 -11.756 -3.394 123 H ALA 567 HT1 ALA 567 -19.100 18.572 -7.175 124 HA ALA 567 HA ALA 567 -18.800 16.196 -6.961 125 HB1 ALA 567 HB1 ALA 567 -18.958 17.616 -4.304 126 HB2 ALA 567 HB2 ALA 567 -17.615 17.713 -5.443 127 HB3 ALA 567 HB3 ALA 567 -18.001 16.178 -4.664 128 HA PRO 568 HA PRO 568 -22.375 13.910 -5.648 129 HB2 PRO 568 HB2 PRO 568 -21.262 11.461 -5.486 130 HB3 PRO 568 HB1 PRO 568 -21.548 12.253 -7.040 131 HG2 PRO 568 HG2 PRO 568 -19.015 12.007 -5.474 132 HG3 PRO 568 HG1 PRO 568 -19.271 11.859 -7.220 133 HD2 PRO 568 HD2 PRO 568 -18.306 14.117 -5.998 134 HD3 PRO 568 HD1 PRO 568 -19.170 14.123 -7.546 135 HA PRO 569 HA PRO 569 -22.048 13.687 -1.232 136 HB2 PRO 569 HB2 PRO 569 -24.102 12.016 -0.666 137 HB3 PRO 569 HB1 PRO 569 -24.352 13.679 -1.210 138 HG2 PRO 569 HG2 PRO 569 -24.473 11.133 -2.782 139 HG3 PRO 569 HG1 PRO 569 -25.569 12.526 -2.826 140 HD2 PRO 569 HD2 PRO 569 -23.634 12.132 -4.680 141 HD3 PRO 569 HD1 PRO 569 -24.160 13.750 -4.178 142 H THR 570 HN THR 570 -21.370 11.141 -3.258 143 HA THR 570 HA THR 570 -20.477 9.421 -1.047 144 HB THR 570 HB THR 570 -20.533 7.579 -2.790 145 HG1 THR 570 HG1 THR 570 -20.654 8.853 -4.662 146 HG21 THR 570 HG21 THR 570 -22.262 7.740 -1.086 147 HG22 THR 570 HG22 THR 570 -22.975 7.257 -2.624 148 HG23 THR 570 HG23 THR 570 -23.141 8.919 -2.059 149 H LEU 571 HN LEU 571 -18.348 8.972 -0.937 150 HA LEU 571 HA LEU 571 -16.488 10.199 -2.705 151 HB2 LEU 571 HB2 LEU 571 -16.222 8.205 -0.479 152 HB3 LEU 571 HB1 LEU 571 -14.848 8.766 -1.390 153 HG LEU 571 HG LEU 571 -16.683 10.654 0.052 154 HD11 LEU 571 HD11 LEU 571 -14.173 9.339 1.082 155 HD12 LEU 571 HD12 LEU 571 -15.807 9.079 1.693 156 HD13 LEU 571 HD13 LEU 571 -15.041 10.657 1.869 157 HD21 LEU 571 HD21 LEU 571 -15.298 11.620 -1.650 158 HD22 LEU 571 HD22 LEU 571 -13.880 10.802 -1.003 159 HD23 LEU 571 HD23 LEU 571 -14.667 12.072 -0.067 160 HA PRO 572 HA PRO 572 -16.038 7.318 -6.008 161 HB2 PRO 572 HB2 PRO 572 -13.113 7.495 -5.455 162 HB3 PRO 572 HB1 PRO 572 -13.987 7.706 -6.976 163 HG2 PRO 572 HG2 PRO 572 -13.060 9.813 -5.647 164 HG3 PRO 572 HG1 PRO 572 -14.634 9.870 -6.461 165 HD2 PRO 572 HD2 PRO 572 -14.009 9.618 -3.557 166 HD3 PRO 572 HD1 PRO 572 -15.354 10.454 -4.355 167 HA PRO 573 HA PRO 573 -15.891 3.533 -3.856 168 HB2 PRO 573 HB2 PRO 573 -16.503 1.888 -5.835 169 HB3 PRO 573 HB1 PRO 573 -17.632 3.156 -5.332 170 HG2 PRO 573 HG2 PRO 573 -15.690 3.161 -7.616 171 HG3 PRO 573 HG1 PRO 573 -17.392 3.615 -7.603 172 HD2 PRO 573 HD2 PRO 573 -15.375 5.426 -7.435 173 HD3 PRO 573 HD1 PRO 573 -16.979 5.684 -6.725 174 H TYR 574 HN TYR 574 -13.423 4.353 -5.949 175 HA TYR 574 HA TYR 574 -12.160 1.884 -6.352 176 HB2 TYR 574 HB2 TYR 574 -11.521 4.553 -6.923 177 HB3 TYR 574 HB1 TYR 574 -10.175 3.895 -6.018 178 HD1 TYR 574 HD1 TYR 574 -9.331 1.550 -6.803 179 HD2 TYR 574 HD2 TYR 574 -11.533 4.247 -9.243 180 HE1 TYR 574 HE1 TYR 574 -8.456 0.432 -8.803 181 HE2 TYR 574 HE2 TYR 574 -10.665 3.135 -11.259 182 HH TYR 574 HH TYR 574 -9.084 0.133 -11.173 183 H PHE 575 HN PHE 575 -10.540 4.240 -4.319 184 HA PHE 575 HA PHE 575 -10.246 2.152 -2.275 185 HB2 PHE 575 HB2 PHE 575 -7.933 2.608 -2.033 186 HB3 PHE 575 HB1 PHE 575 -8.196 2.462 -3.764 187 HD1 PHE 575 HD1 PHE 575 -8.295 4.541 -5.155 188 HD2 PHE 575 HD2 PHE 575 -7.106 4.565 -1.072 189 HE1 PHE 575 HE1 PHE 575 -7.277 6.760 -5.464 190 HE2 PHE 575 HE2 PHE 575 -6.090 6.779 -1.373 191 HZ PHE 575 HZ PHE 575 -6.190 7.881 -3.562 192 H MET 576 HN MET 576 -11.509 5.012 -2.986 193 HA MET 576 HA MET 576 -10.619 6.680 -0.860 194 HB2 MET 576 HB2 MET 576 -13.183 6.777 -2.457 195 HB3 MET 576 HB1 MET 576 -12.597 8.056 -1.405 196 HG2 MET 576 HG2 MET 576 -12.095 8.634 -3.655 197 HG3 MET 576 HG1 MET 576 -10.587 8.252 -2.839 198 HE1 MET 576 HE1 MET 576 -9.414 8.134 -5.252 199 HE2 MET 576 HE2 MET 576 -10.960 8.484 -6.028 200 HE3 MET 576 HE3 MET 576 -9.995 7.109 -6.565 201 H LYS 577 HN LYS 577 -12.166 7.500 0.851 202 HA LYS 577 HA LYS 577 -12.611 5.373 2.613 203 HB2 LYS 577 HB2 LYS 577 -12.145 7.733 3.282 204 HB3 LYS 577 HB1 LYS 577 -13.776 8.159 2.785 205 HG2 LYS 577 HG2 LYS 577 -14.678 6.600 4.460 206 HG3 LYS 577 HG1 LYS 577 -13.033 6.248 4.989 207 HD2 LYS 577 HD2 LYS 577 -12.725 8.603 5.590 208 HD3 LYS 577 HD1 LYS 577 -14.373 8.950 5.059 209 HE2 LYS 577 HE2 LYS 577 -15.267 7.487 6.768 210 HE3 LYS 577 HE1 LYS 577 -13.639 7.019 7.255 211 HZ1 LYS 577 HZ1 LYS 577 -14.596 8.685 8.732 212 HZ2 LYS 577 HZ2 LYS 577 -14.759 9.761 7.441 213 HZ3 LYS 577 HZ3 LYS 577 -13.222 9.284 7.952 214 H GLY 578 HN GLY 578 -14.175 3.934 2.673 215 HA2 GLY 578 HA2 GLY 578 -16.517 3.546 3.165 216 HA3 GLY 578 HA1 GLY 578 -16.912 4.787 1.999 217 H SER 579 HN SER 579 -14.651 3.509 0.318 218 HA SER 579 HA SER 579 -16.266 1.939 -1.353 219 HB2 SER 579 HB2 SER 579 -13.254 1.809 -1.151 220 HB3 SER 579 HB1 SER 579 -14.252 1.444 -2.558 221 HG SER 579 HG SER 579 -13.555 3.920 -1.454 222 H ILE 580 HN ILE 580 -16.541 -0.269 -1.556 223 HA ILE 580 HA ILE 580 -15.752 -1.805 0.797 224 HB ILE 580 HB ILE 580 -17.710 -2.474 -1.403 225 HG12 ILE 580 HG12 ILE 580 -18.501 -0.738 0.128 226 HG13 ILE 580 HG11 ILE 580 -19.382 -2.237 0.399 227 HG21 ILE 580 HG21 ILE 580 -18.279 -4.439 -0.106 228 HG22 ILE 580 HG22 ILE 580 -17.076 -4.014 1.110 229 HG23 ILE 580 HG23 ILE 580 -16.562 -4.467 -0.515 230 HD11 ILE 580 HD11 ILE 580 -18.846 -1.210 2.504 231 HD12 ILE 580 HD12 ILE 580 -17.138 -1.147 2.080 232 HD13 ILE 580 HD13 ILE 580 -17.927 -2.704 2.331 233 H ILE 581 HN ILE 581 -13.885 -2.715 0.679 234 HA ILE 581 HA ILE 581 -12.742 -3.454 -1.892 235 HB ILE 581 HB ILE 581 -11.468 -3.599 0.843 236 HG12 ILE 581 HG12 ILE 581 -12.218 -1.320 0.455 237 HG13 ILE 581 HG11 ILE 581 -10.470 -1.401 0.327 238 HG21 ILE 581 HG21 ILE 581 -10.264 -3.379 -1.897 239 HG22 ILE 581 HG22 ILE 581 -10.361 -4.858 -0.937 240 HG23 ILE 581 HG23 ILE 581 -9.384 -3.500 -0.374 241 HD11 ILE 581 HD11 ILE 581 -11.261 0.020 -1.391 242 HD12 ILE 581 HD12 ILE 581 -12.463 -1.162 -1.908 243 HD13 ILE 581 HD13 ILE 581 -10.743 -1.486 -2.150 244 H GLN 582 HN GLN 582 -12.900 -5.494 -2.622 245 HA GLN 582 HA GLN 582 -13.653 -7.567 -0.690 246 HB2 GLN 582 HB2 GLN 582 -15.163 -7.273 -2.576 247 HB3 GLN 582 HB1 GLN 582 -13.869 -7.600 -3.696 248 HG2 GLN 582 HG2 GLN 582 -13.613 -9.854 -2.693 249 HG3 GLN 582 HG1 GLN 582 -15.010 -9.521 -1.677 250 HE21 GLN 582 HE21 GLN 582 -16.272 -11.128 -2.487 251 HE22 GLN 582 HE22 GLN 582 -16.896 -11.132 -4.098 252 H LEU 583 HN LEU 583 -12.332 -9.089 -0.143 253 HA LEU 583 HA LEU 583 -9.653 -9.055 -1.236 254 HB2 LEU 583 HB2 LEU 583 -10.800 -10.734 0.979 255 HB3 LEU 583 HB1 LEU 583 -9.105 -10.459 0.647 256 HG LEU 583 HG LEU 583 -11.063 -8.341 1.514 257 HD11 LEU 583 HD11 LEU 583 -9.954 -8.449 3.648 258 HD12 LEU 583 HD12 LEU 583 -8.872 -9.711 3.054 259 HD13 LEU 583 HD13 LEU 583 -10.598 -10.035 3.226 260 HD21 LEU 583 HD21 LEU 583 -9.027 -6.982 1.858 261 HD22 LEU 583 HD22 LEU 583 -9.283 -7.398 0.159 262 HD23 LEU 583 HD23 LEU 583 -8.070 -8.261 1.111 263 H ALA 584 HN ALA 584 -8.553 -11.325 -1.377 264 HA ALA 584 HA ALA 584 -9.673 -12.616 -3.591 265 HB1 ALA 584 HB1 ALA 584 -7.891 -14.248 -3.384 266 HB2 ALA 584 HB2 ALA 584 -7.565 -13.722 -1.732 267 HB3 ALA 584 HB3 ALA 584 -7.261 -12.629 -3.083 268 H ASN 585 HN ASN 585 -9.871 -13.309 -0.163 269 HA ASN 585 HA ASN 585 -10.991 -15.917 -0.462 270 HB2 ASN 585 HB2 ASN 585 -11.334 -15.858 1.929 271 HB3 ASN 585 HB1 ASN 585 -9.744 -15.217 1.559 272 HD21 ASN 585 HD21 ASN 585 -11.188 -14.828 3.943 273 HD22 ASN 585 HD22 ASN 585 -11.477 -13.124 4.109 274 H GLY 586 HN GLY 586 -12.221 -12.759 -0.754 275 HA2 GLY 586 HA2 GLY 586 -14.290 -12.425 -1.841 276 HA3 GLY 586 HA1 GLY 586 -14.866 -13.934 -1.163 277 H GLU 587 HN GLU 587 -13.302 -11.925 1.149 278 HA GLU 587 HA GLU 587 -15.953 -11.286 2.222 279 HB2 GLU 587 HB2 GLU 587 -14.904 -10.865 4.333 280 HB3 GLU 587 HB1 GLU 587 -14.294 -12.388 3.707 281 HG2 GLU 587 HG2 GLU 587 -12.241 -11.379 3.067 282 HG3 GLU 587 HG1 GLU 587 -12.839 -9.775 3.498 283 H LEU 588 HN LEU 588 -16.334 -9.158 3.148 284 HA LEU 588 HA LEU 588 -15.203 -7.105 1.367 285 HB2 LEU 588 HB2 LEU 588 -17.964 -7.198 2.571 286 HB3 LEU 588 HB1 LEU 588 -17.371 -6.045 1.390 287 HG LEU 588 HG LEU 588 -17.814 -8.992 0.939 288 HD11 LEU 588 HD11 LEU 588 -19.859 -7.677 1.048 289 HD12 LEU 588 HD12 LEU 588 -19.550 -8.256 -0.588 290 HD13 LEU 588 HD13 LEU 588 -19.222 -6.575 -0.170 291 HD21 LEU 588 HD21 LEU 588 -16.692 -6.851 -0.844 292 HD22 LEU 588 HD22 LEU 588 -17.288 -8.401 -1.435 293 HD23 LEU 588 HD23 LEU 588 -15.912 -8.346 -0.332 294 H LYS 589 HN LYS 589 -14.157 -5.501 2.330 295 HA LYS 589 HA LYS 589 -14.930 -4.713 5.048 296 HB2 LYS 589 HB2 LYS 589 -12.066 -4.990 4.113 297 HB3 LYS 589 HB1 LYS 589 -12.624 -4.620 5.730 298 HG2 LYS 589 HG2 LYS 589 -13.458 -6.820 6.044 299 HG3 LYS 589 HG1 LYS 589 -13.226 -7.213 4.343 300 HD2 LYS 589 HD2 LYS 589 -11.429 -8.256 5.389 301 HD3 LYS 589 HD1 LYS 589 -10.733 -6.748 4.798 302 HE2 LYS 589 HE2 LYS 589 -11.851 -6.822 7.550 303 HE3 LYS 589 HE1 LYS 589 -10.300 -7.598 7.251 304 HZ1 LYS 589 HZ1 LYS 589 -10.063 -5.296 7.966 305 HZ2 LYS 589 HZ2 LYS 589 -10.944 -4.773 6.622 306 HZ3 LYS 589 HZ3 LYS 589 -9.440 -5.530 6.405 307 H LYS 590 HN LYS 590 -14.761 -2.525 5.464 308 HA LYS 590 HA LYS 590 -14.704 -0.731 3.267 309 HB2 LYS 590 HB2 LYS 590 -14.609 -0.334 6.254 310 HB3 LYS 590 HB1 LYS 590 -14.513 1.017 5.139 311 HG2 LYS 590 HG2 LYS 590 -16.760 -0.893 4.859 312 HG3 LYS 590 HG1 LYS 590 -16.789 0.261 6.192 313 HD2 LYS 590 HD2 LYS 590 -16.257 2.009 4.375 314 HD3 LYS 590 HD1 LYS 590 -16.799 0.776 3.238 315 HE2 LYS 590 HE2 LYS 590 -18.398 1.801 5.571 316 HE3 LYS 590 HE1 LYS 590 -18.579 2.367 3.915 317 HZ1 LYS 590 HZ1 LYS 590 -18.956 -0.465 4.720 318 HZ2 LYS 590 HZ2 LYS 590 -19.367 0.250 3.242 319 HZ3 LYS 590 HZ3 LYS 590 -20.217 0.656 4.642 320 H VAL 591 HN VAL 591 -13.067 0.585 2.497 321 HA VAL 591 HA VAL 591 -10.483 -0.310 2.428 322 HB VAL 591 HB VAL 591 -10.900 2.649 2.500 323 HG11 VAL 591 HG11 VAL 591 -9.201 0.815 0.830 324 HG12 VAL 591 HG12 VAL 591 -8.673 1.858 2.156 325 HG13 VAL 591 HG13 VAL 591 -9.272 2.571 0.655 326 HG21 VAL 591 HG21 VAL 591 -11.825 0.839 0.288 327 HG22 VAL 591 HG22 VAL 591 -11.605 2.585 0.139 328 HG23 VAL 591 HG23 VAL 591 -12.803 1.942 1.260 329 H GLU 592 HN GLU 592 -11.844 2.075 4.578 330 HA GLU 592 HA GLU 592 -9.439 2.959 5.708 331 HB2 GLU 592 HB2 GLU 592 -10.967 4.044 7.370 332 HB3 GLU 592 HB1 GLU 592 -11.387 4.363 5.690 333 HG2 GLU 592 HG2 GLU 592 -13.075 2.541 5.837 334 HG3 GLU 592 HG1 GLU 592 -12.721 2.416 7.556 335 H ASP 593 HN ASP 593 -11.307 0.149 6.332 336 HA ASP 593 HA ASP 593 -10.158 -0.048 9.034 337 HB2 ASP 593 HB2 ASP 593 -12.706 0.002 8.765 338 HB3 ASP 593 HB1 ASP 593 -12.549 -1.610 8.073 339 H LEU 594 HN LEU 594 -9.588 -1.128 6.018 340 HA LEU 594 HA LEU 594 -9.121 -3.856 6.343 341 HB2 LEU 594 HB2 LEU 594 -7.663 -1.815 4.665 342 HB3 LEU 594 HB1 LEU 594 -7.442 -3.548 4.531 343 HG LEU 594 HG LEU 594 -10.133 -2.261 4.130 344 HD11 LEU 594 HD11 LEU 594 -9.659 -2.390 1.724 345 HD12 LEU 594 HD12 LEU 594 -7.987 -2.803 2.097 346 HD13 LEU 594 HD13 LEU 594 -8.632 -1.228 2.563 347 HD21 LEU 594 HD21 LEU 594 -8.961 -4.879 3.191 348 HD22 LEU 594 HD22 LEU 594 -10.596 -4.297 2.868 349 HD23 LEU 594 HD23 LEU 594 -10.102 -4.683 4.521 350 H LYS 595 HN LYS 595 -7.297 -4.982 6.881 351 HA LYS 595 HA LYS 595 -5.271 -3.593 8.514 352 HB2 LYS 595 HB2 LYS 595 -6.926 -5.944 9.474 353 HB3 LYS 595 HB1 LYS 595 -5.577 -5.230 10.337 354 HG2 LYS 595 HG2 LYS 595 -8.112 -3.754 9.670 355 HG3 LYS 595 HG1 LYS 595 -7.825 -4.594 11.193 356 HD2 LYS 595 HD2 LYS 595 -5.806 -3.158 11.514 357 HD3 LYS 595 HD1 LYS 595 -6.290 -2.251 10.081 358 HE2 LYS 595 HE2 LYS 595 -7.922 -2.577 12.599 359 HE3 LYS 595 HE1 LYS 595 -7.005 -1.143 12.149 360 HZ1 LYS 595 HZ1 LYS 595 -9.280 -2.271 10.612 361 HZ2 LYS 595 HZ2 LYS 595 -8.420 -0.863 10.232 362 HZ3 LYS 595 HZ3 LYS 595 -9.361 -0.925 11.634 363 H THR 596 HN THR 596 -3.279 -4.803 8.577 364 HA THR 596 HA THR 596 -2.633 -5.613 6.054 365 HB THR 596 HB THR 596 -1.004 -4.919 7.789 366 HG1 THR 596 HG1 THR 596 -0.685 -6.870 5.926 367 HG21 THR 596 HG21 THR 596 -0.061 -6.687 9.241 368 HG22 THR 596 HG22 THR 596 -1.373 -7.751 8.746 369 HG23 THR 596 HG23 THR 596 -1.724 -6.275 9.642 370 H GLU 597 HN GLU 597 -3.801 -7.724 8.596 371 HA GLU 597 HA GLU 597 -2.942 -10.164 7.528 372 HB2 GLU 597 HB2 GLU 597 -5.299 -9.572 9.294 373 HB3 GLU 597 HB1 GLU 597 -4.641 -11.173 8.994 374 HG2 GLU 597 HG2 GLU 597 -2.515 -10.486 9.972 375 HG3 GLU 597 HG1 GLU 597 -3.169 -8.877 10.267 376 H ASP 598 HN ASP 598 -5.657 -8.128 6.631 377 HA ASP 598 HA ASP 598 -7.177 -10.155 5.343 378 HB2 ASP 598 HB2 ASP 598 -8.079 -8.136 3.961 379 HB3 ASP 598 HB1 ASP 598 -8.490 -8.273 5.634 380 H PHE 599 HN PHE 599 -4.998 -7.720 4.026 381 HA PHE 599 HA PHE 599 -4.966 -8.771 1.409 382 HB2 PHE 599 HB2 PHE 599 -3.110 -6.933 2.890 383 HB3 PHE 599 HB1 PHE 599 -2.696 -7.515 1.285 384 HD1 PHE 599 HD1 PHE 599 -6.078 -6.640 2.529 385 HD2 PHE 599 HD2 PHE 599 -2.818 -5.559 0.019 386 HE1 PHE 599 HE1 PHE 599 -7.457 -4.882 1.506 387 HE2 PHE 599 HE2 PHE 599 -4.194 -3.798 -1.008 388 HZ PHE 599 HZ PHE 599 -6.514 -3.457 -0.266 389 H ILE 600 HN ILE 600 -2.939 -9.396 4.238 390 HA ILE 600 HA ILE 600 -1.084 -11.095 3.084 391 HB ILE 600 HB ILE 600 -2.357 -11.061 5.796 392 HG12 ILE 600 HG12 ILE 600 0.395 -10.314 4.807 393 HG13 ILE 600 HG11 ILE 600 -0.905 -9.191 5.147 394 HG21 ILE 600 HG21 ILE 600 -0.149 -12.867 4.818 395 HG22 ILE 600 HG22 ILE 600 -1.714 -13.348 5.483 396 HG23 ILE 600 HG23 ILE 600 -0.510 -12.578 6.520 397 HD11 ILE 600 HD11 ILE 600 0.731 -9.248 6.945 398 HD12 ILE 600 HD12 ILE 600 0.421 -10.971 7.169 399 HD13 ILE 600 HD13 ILE 600 -0.856 -9.796 7.484 400 H GLN 601 HN GLN 601 -4.164 -12.032 4.644 401 HA GLN 601 HA GLN 601 -3.967 -14.744 4.039 402 HB2 GLN 601 HB2 GLN 601 -6.294 -12.961 4.661 403 HB3 GLN 601 HB1 GLN 601 -6.557 -14.643 4.213 404 HG2 GLN 601 HG2 GLN 601 -5.056 -15.316 6.039 405 HG3 GLN 601 HG1 GLN 601 -4.947 -13.627 6.537 406 HE21 GLN 601 HE21 GLN 601 -5.960 -15.930 7.993 407 HE22 GLN 601 HE22 GLN 601 -7.594 -15.552 8.414 408 H SER 602 HN SER 602 -5.661 -12.176 2.270 409 HA SER 602 HA SER 602 -6.879 -13.761 0.350 410 HB2 SER 602 HB2 SER 602 -6.756 -11.668 -1.093 411 HB3 SER 602 HB1 SER 602 -7.499 -11.490 0.485 412 HG SER 602 HG SER 602 -5.788 -10.403 1.221 413 H ALA 603 HN ALA 603 -3.727 -12.180 0.191 414 HA ALA 603 HA ALA 603 -2.983 -13.236 -2.316 415 HB1 ALA 603 HB1 ALA 603 -1.854 -11.310 -1.442 416 HB2 ALA 603 HB2 ALA 603 -0.677 -12.605 -1.652 417 HB3 ALA 603 HB3 ALA 603 -1.298 -12.228 -0.045 418 H GLU 604 HN GLU 604 -2.522 -14.432 0.976 419 HA GLU 604 HA GLU 604 -0.705 -16.502 0.294 420 HB2 GLU 604 HB2 GLU 604 -2.515 -16.178 2.685 421 HB3 GLU 604 HB1 GLU 604 -1.316 -17.455 2.527 422 HG2 GLU 604 HG2 GLU 604 0.371 -15.561 2.184 423 HG3 GLU 604 HG1 GLU 604 -0.898 -14.505 2.793 424 H ILE 605 HN ILE 605 -4.188 -16.353 0.568 425 HA ILE 605 HA ILE 605 -4.762 -19.079 0.098 426 HB ILE 605 HB ILE 605 -6.430 -16.639 -0.574 427 HG12 ILE 605 HG12 ILE 605 -6.510 -18.364 1.900 428 HG13 ILE 605 HG11 ILE 605 -5.587 -16.872 1.801 429 HG21 ILE 605 HG21 ILE 605 -8.351 -18.145 -0.380 430 HG22 ILE 605 HG22 ILE 605 -7.258 -19.506 -0.120 431 HG23 ILE 605 HG23 ILE 605 -7.262 -18.662 -1.668 432 HD11 ILE 605 HD11 ILE 605 -7.638 -16.417 2.904 433 HD12 ILE 605 HD12 ILE 605 -8.571 -17.184 1.610 434 HD13 ILE 605 HD13 ILE 605 -7.706 -15.677 1.301 435 H SER 606 HN SER 606 -3.491 -16.659 -1.915 436 HA SER 606 HA SER 606 -2.481 -16.860 -3.925 437 HB2 SER 606 HB2 SER 606 -2.985 -19.806 -3.475 438 HB3 SER 606 HB1 SER 606 -1.889 -19.132 -4.678 439 HG SER 606 HG SER 606 -1.671 -18.573 -1.905 440 H ASN 607 HN ASN 607 -4.490 -15.776 -4.672 441 HA ASN 607 HA ASN 607 -5.757 -17.429 -6.752 442 HB2 ASN 607 HB2 ASN 607 -7.215 -16.242 -4.974 443 HB3 ASN 607 HB1 ASN 607 -6.787 -14.753 -5.808 444 HD21 ASN 607 HD21 ASN 607 -8.487 -17.776 -6.027 445 HD22 ASN 607 HD22 ASN 607 -9.448 -17.362 -7.404 446 H ASP 608 HN ASP 608 -3.293 -16.801 -7.296 447 HA ASP 608 HA ASP 608 -1.938 -15.908 -8.893 448 HB2 ASP 608 HB2 ASP 608 -4.325 -14.196 -9.589 449 HB3 ASP 608 HB1 ASP 608 -2.772 -14.063 -10.400 450 H LEU 609 HN LEU 609 -2.802 -14.601 -6.107 451 HA LEU 609 HA LEU 609 -1.187 -12.180 -6.497 452 HB2 LEU 609 HB2 LEU 609 -2.878 -12.844 -4.109 453 HB3 LEU 609 HB1 LEU 609 -2.131 -11.309 -4.487 454 HG LEU 609 HG LEU 609 -4.259 -10.859 -5.057 455 HD11 LEU 609 HD11 LEU 609 -2.992 -10.460 -7.044 456 HD12 LEU 609 HD12 LEU 609 -4.625 -10.986 -7.455 457 HD13 LEU 609 HD13 LEU 609 -3.276 -12.115 -7.582 458 HD21 LEU 609 HD21 LEU 609 -4.683 -13.649 -6.062 459 HD22 LEU 609 HD22 LEU 609 -5.913 -12.403 -5.853 460 HD23 LEU 609 HD23 LEU 609 -5.098 -13.081 -4.446 461 H LYS 610 HN LYS 610 0.351 -11.619 -4.850 462 HA LYS 610 HA LYS 610 1.118 -13.641 -2.907 463 HB2 LYS 610 HB2 LYS 610 2.983 -12.627 -5.056 464 HB3 LYS 610 HB1 LYS 610 3.551 -13.383 -3.576 465 HG2 LYS 610 HG2 LYS 610 2.345 -15.433 -4.182 466 HG3 LYS 610 HG1 LYS 610 1.822 -14.664 -5.681 467 HD2 LYS 610 HD2 LYS 610 4.679 -15.195 -4.867 468 HD3 LYS 610 HD1 LYS 610 3.753 -16.116 -6.052 469 HE2 LYS 610 HE2 LYS 610 3.501 -14.027 -7.380 470 HE3 LYS 610 HE1 LYS 610 4.570 -13.222 -6.235 471 HZ1 LYS 610 HZ1 LYS 610 6.321 -14.763 -6.818 472 HZ2 LYS 610 HZ2 LYS 610 5.753 -13.979 -8.202 473 HZ3 LYS 610 HZ3 LYS 610 5.294 -15.574 -7.889 474 H ILE 611 HN ILE 611 1.952 -12.745 -1.070 475 HA ILE 611 HA ILE 611 2.178 -9.845 -0.906 476 HB ILE 611 HB ILE 611 2.402 -12.000 1.178 477 HG12 ILE 611 HG12 ILE 611 0.159 -11.190 0.048 478 HG13 ILE 611 HG11 ILE 611 0.235 -11.569 1.756 479 HG21 ILE 611 HG21 ILE 611 2.496 -9.034 1.604 480 HG22 ILE 611 HG22 ILE 611 3.844 -10.150 1.800 481 HG23 ILE 611 HG23 ILE 611 2.446 -10.258 2.870 482 HD11 ILE 611 HD11 ILE 611 0.442 -9.187 2.274 483 HD12 ILE 611 HD12 ILE 611 -1.017 -9.512 1.334 484 HD13 ILE 611 HD13 ILE 611 0.402 -8.814 0.552 485 H ASP 612 HN ASP 612 4.064 -8.791 -0.370 486 HA ASP 612 HA ASP 612 6.533 -10.390 -0.205 487 HB2 ASP 612 HB2 ASP 612 6.312 -9.297 -2.457 488 HB3 ASP 612 HB1 ASP 612 6.313 -7.743 -1.625 489 H SER 613 HN SER 613 8.179 -9.494 1.064 490 HA SER 613 HA SER 613 7.281 -7.354 2.869 491 HB2 SER 613 HB2 SER 613 9.233 -9.602 3.414 492 HB3 SER 613 HB1 SER 613 8.758 -8.359 4.564 493 HG SER 613 HG SER 613 7.466 -10.064 5.000 494 H SER 614 HN SER 614 8.312 -5.477 2.600 495 HA SER 614 HA SER 614 11.171 -5.546 1.945 496 HB2 SER 614 HB2 SER 614 10.794 -3.650 0.345 497 HB3 SER 614 HB1 SER 614 10.078 -5.175 -0.167 498 HG SER 614 HG SER 614 8.073 -4.386 0.724 499 H THR 615 HN THR 615 12.032 -4.717 3.768 500 HA THR 615 HA THR 615 10.680 -2.734 5.343 501 HB THR 615 HB THR 615 13.485 -3.827 5.580 502 HG1 THR 615 HG1 THR 615 11.469 -4.474 7.400 503 HG21 THR 615 HG21 THR 615 11.852 -2.182 7.527 504 HG22 THR 615 HG22 THR 615 13.314 -1.665 6.686 505 HG23 THR 615 HG23 THR 615 13.398 -2.952 7.889 506 H VAL 616 HN VAL 616 10.568 -0.672 4.684 507 HA VAL 616 HA VAL 616 12.405 0.619 3.027 508 HB VAL 616 HB VAL 616 10.348 1.683 3.169 509 HG11 VAL 616 HG11 VAL 616 9.306 2.440 5.263 510 HG12 VAL 616 HG12 VAL 616 10.607 1.665 6.161 511 HG13 VAL 616 HG13 VAL 616 9.506 0.690 5.193 512 HG21 VAL 616 HG21 VAL 616 10.796 3.916 4.237 513 HG22 VAL 616 HG22 VAL 616 12.030 3.364 3.102 514 HG23 VAL 616 HG23 VAL 616 12.311 3.236 4.839 515 H GLU 617 HN GLU 617 14.430 1.057 3.375 516 HA GLU 617 HA GLU 617 15.477 1.337 6.066 517 HB2 GLU 617 HB2 GLU 617 16.847 1.278 3.388 518 HB3 GLU 617 HB1 GLU 617 17.660 1.268 4.946 519 HG2 GLU 617 HG2 GLU 617 15.665 -0.831 4.236 520 HG3 GLU 617 HG1 GLU 617 17.336 -0.942 3.700 521 H ARG 618 HN ARG 618 14.493 3.318 3.441 522 HA ARG 618 HA ARG 618 15.370 5.697 4.773 523 HB2 ARG 618 HB2 ARG 618 17.480 5.218 3.809 524 HB3 ARG 618 HB1 ARG 618 16.761 4.758 2.274 525 HG2 ARG 618 HG2 ARG 618 16.187 7.040 1.806 526 HG3 ARG 618 HG1 ARG 618 16.738 7.545 3.401 527 HD2 ARG 618 HD2 ARG 618 18.518 6.259 1.339 528 HD3 ARG 618 HD1 ARG 618 18.356 8.003 1.550 529 HE ARG 618 HE ARG 618 19.672 6.130 3.351 530 HH11 ARG 618 HH11 ARG 618 18.564 9.395 2.722 531 HH12 ARG 618 HH12 ARG 618 19.532 10.097 3.982 532 HH21 ARG 618 HH21 ARG 618 20.936 7.052 5.012 533 HH22 ARG 618 HH22 ARG 618 20.874 8.762 5.291 534 H ILE 619 HN ILE 619 14.422 7.561 3.968 535 HA ILE 619 HA ILE 619 12.540 7.206 1.741 536 HB ILE 619 HB ILE 619 11.971 8.438 4.438 537 HG12 ILE 619 HG12 ILE 619 10.521 6.331 2.832 538 HG13 ILE 619 HG11 ILE 619 11.674 5.984 4.116 539 HG21 ILE 619 HG21 ILE 619 9.807 9.161 3.530 540 HG22 ILE 619 HG22 ILE 619 10.305 8.637 1.921 541 HG23 ILE 619 HG23 ILE 619 11.148 9.967 2.716 542 HD11 ILE 619 HD11 ILE 619 9.082 7.485 4.437 543 HD12 ILE 619 HD12 ILE 619 10.221 7.087 5.724 544 HD13 ILE 619 HD13 ILE 619 9.363 5.801 4.876 545 H GLU 620 HN GLU 620 12.889 8.618 0.206 546 HA GLU 620 HA GLU 620 14.434 11.031 0.867 547 HB2 GLU 620 HB2 GLU 620 14.480 9.380 -1.653 548 HB3 GLU 620 HB1 GLU 620 15.421 10.837 -1.372 549 HG2 GLU 620 HG2 GLU 620 15.615 8.515 0.474 550 HG3 GLU 620 HG1 GLU 620 16.512 8.524 -1.045 551 H ASP 621 HN ASP 621 13.756 12.971 0.036 552 HA ASP 621 HA ASP 621 11.077 13.016 -1.074 553 HB2 ASP 621 HB2 ASP 621 11.375 14.576 0.649 554 HB3 ASP 621 HB1 ASP 621 12.902 15.156 0.001 555 H SER 622 HN SER 622 10.485 13.882 -2.982 556 HA SER 622 HA SER 622 12.634 14.293 -4.958 557 HB2 SER 622 HB2 SER 622 11.361 12.157 -5.248 558 HB3 SER 622 HB1 SER 622 9.888 13.101 -5.437 559 HG SER 622 HG SER 622 11.243 12.379 -7.390 560 H HIS 623 HN HIS 623 12.357 15.962 -6.448 561 HA HIS 623 HA HIS 623 10.750 18.154 -5.555 562 HB2 HIS 623 HB2 HIS 623 12.984 18.459 -6.601 563 HB3 HIS 623 HB1 HIS 623 12.320 17.893 -8.129 564 HD1 HIS 623 HD1 HIS 623 11.510 19.683 -9.644 565 HD2 HIS 623 HD2 HIS 623 11.558 20.905 -5.670 566 HE1 HIS 623 HE1 HIS 623 10.808 22.094 -9.672 567 HE2 HIS 623 HE2 HIS 623 10.971 22.848 -7.274 568 H SER 624 HN SER 624 10.247 15.554 -7.694 569 HA SER 624 HA SER 624 8.200 16.598 -9.295 570 HB2 SER 624 HB2 SER 624 8.499 13.801 -8.172 571 HB3 SER 624 HB1 SER 624 7.491 14.259 -9.542 572 HG SER 624 HG SER 624 10.213 14.926 -9.605 573 HA PRO 625 HA PRO 625 5.163 17.808 -6.436 574 HB2 PRO 625 HB2 PRO 625 3.062 16.871 -8.181 575 HB3 PRO 625 HB1 PRO 625 3.473 18.511 -7.701 576 HG2 PRO 625 HG2 PRO 625 3.913 17.460 -10.203 577 HG3 PRO 625 HG1 PRO 625 4.770 18.848 -9.521 578 HD2 PRO 625 HD2 PRO 625 5.717 16.100 -9.969 579 HD3 PRO 625 HD1 PRO 625 6.638 17.598 -9.767 580 H GLY 626 HN GLY 626 4.986 16.718 -4.638 581 HA2 GLY 626 HA2 GLY 626 4.100 15.272 -3.104 582 HA3 GLY 626 HA1 GLY 626 2.894 14.855 -4.311 583 H VAL 627 HN VAL 627 6.376 14.456 -4.676 584 HA VAL 627 HA VAL 627 5.886 11.557 -4.846 585 HB VAL 627 HB VAL 627 8.030 13.150 -6.265 586 HG11 VAL 627 HG11 VAL 627 8.735 10.873 -5.784 587 HG12 VAL 627 HG12 VAL 627 8.432 11.077 -7.509 588 HG13 VAL 627 HG13 VAL 627 7.250 10.245 -6.500 589 HG21 VAL 627 HG21 VAL 627 5.451 11.969 -7.266 590 HG22 VAL 627 HG22 VAL 627 6.733 12.588 -8.305 591 HG23 VAL 627 HG23 VAL 627 5.888 13.676 -7.203 592 H ALA 628 HN ALA 628 7.012 10.233 -3.604 593 HA ALA 628 HA ALA 628 9.542 11.167 -2.445 594 HB1 ALA 628 HB1 ALA 628 7.431 9.655 -0.900 595 HB2 ALA 628 HB2 ALA 628 7.808 11.366 -0.698 596 HB3 ALA 628 HB3 ALA 628 9.018 10.143 -0.303 597 H VAL 629 HN VAL 629 11.118 9.720 -2.587 598 HA VAL 629 HA VAL 629 10.427 7.122 -3.715 599 HB VAL 629 HB VAL 629 12.098 7.763 -5.090 600 HG11 VAL 629 HG11 VAL 629 13.150 9.432 -2.833 601 HG12 VAL 629 HG12 VAL 629 12.340 9.973 -4.301 602 HG13 VAL 629 HG13 VAL 629 13.965 9.285 -4.389 603 HG21 VAL 629 HG21 VAL 629 13.010 5.800 -3.971 604 HG22 VAL 629 HG22 VAL 629 13.771 6.833 -2.756 605 HG23 VAL 629 HG23 VAL 629 14.296 6.913 -4.437 606 H ILE 630 HN ILE 630 10.200 5.521 -2.440 607 HA ILE 630 HA ILE 630 11.392 5.578 0.214 608 HB ILE 630 HB ILE 630 9.515 3.476 -0.821 609 HG12 ILE 630 HG12 ILE 630 8.489 5.700 -1.227 610 HG13 ILE 630 HG11 ILE 630 7.635 4.765 -0.007 611 HG21 ILE 630 HG21 ILE 630 10.656 3.044 1.278 612 HG22 ILE 630 HG22 ILE 630 8.929 3.290 1.543 613 HG23 ILE 630 HG23 ILE 630 10.072 4.578 1.920 614 HD11 ILE 630 HD11 ILE 630 8.720 6.052 1.745 615 HD12 ILE 630 HD12 ILE 630 7.816 7.086 0.638 616 HD13 ILE 630 HD13 ILE 630 9.573 6.991 0.519 617 H GLN 631 HN GLN 631 13.277 4.571 0.494 618 HA GLN 631 HA GLN 631 14.158 2.610 -1.471 619 HB2 GLN 631 HB2 GLN 631 15.721 4.386 -0.818 620 HB3 GLN 631 HB1 GLN 631 15.623 3.862 0.859 621 HG2 GLN 631 HG2 GLN 631 16.591 1.701 0.226 622 HG3 GLN 631 HG1 GLN 631 16.722 2.261 -1.440 623 HE21 GLN 631 HE21 GLN 631 17.943 2.570 1.789 624 HE22 GLN 631 HE22 GLN 631 19.383 3.433 1.384 625 H PHE 632 HN PHE 632 13.613 0.588 -1.151 626 HA PHE 632 HA PHE 632 13.183 -0.378 1.597 627 HB2 PHE 632 HB2 PHE 632 12.262 -1.560 -1.024 628 HB3 PHE 632 HB1 PHE 632 11.892 -2.184 0.574 629 HD1 PHE 632 HD2 PHE 632 10.354 -0.988 2.041 630 HD2 PHE 632 HD1 PHE 632 11.090 0.284 -1.944 631 HE1 PHE 632 HE2 PHE 632 8.299 0.352 2.093 632 HE2 PHE 632 HE1 PHE 632 9.032 1.628 -1.905 633 HZ PHE 632 HZ PHE 632 7.629 1.659 0.116 634 H ALA 633 HN ALA 633 14.174 -2.180 2.354 635 HA ALA 633 HA ALA 633 16.219 -3.424 0.658 636 HB1 ALA 633 HB1 ALA 633 17.006 -2.694 2.820 637 HB2 ALA 633 HB2 ALA 633 16.987 -4.457 2.781 638 HB3 ALA 633 HB3 ALA 633 15.715 -3.578 3.629 639 H VAL 634 HN VAL 634 15.179 -4.871 -0.597 640 HA VAL 634 HA VAL 634 12.921 -6.377 0.397 641 HB VAL 634 HB VAL 634 14.317 -6.562 -2.277 642 HG11 VAL 634 HG11 VAL 634 12.231 -7.577 -3.048 643 HG12 VAL 634 HG12 VAL 634 11.589 -7.504 -1.407 644 HG13 VAL 634 HG13 VAL 634 12.979 -8.530 -1.767 645 HG21 VAL 634 HG21 VAL 634 13.482 -4.311 -1.895 646 HG22 VAL 634 HG22 VAL 634 11.898 -4.955 -1.466 647 HG23 VAL 634 HG23 VAL 634 12.505 -5.133 -3.112 648 H GLY 635 HN GLY 635 13.009 -8.317 1.286 649 HA2 GLY 635 HA2 GLY 635 13.604 -10.545 1.526 650 HA3 GLY 635 HA1 GLY 635 14.900 -10.297 0.368 651 H GLU 636 HN GLU 636 15.556 -11.827 2.401 652 HA GLU 636 HA GLU 636 16.603 -10.381 4.631 653 HB2 GLU 636 HB2 GLU 636 17.091 -13.180 3.647 654 HB3 GLU 636 HB1 GLU 636 17.759 -12.540 5.137 655 HG2 GLU 636 HG2 GLU 636 15.491 -12.157 5.979 656 HG3 GLU 636 HG1 GLU 636 14.836 -12.838 4.491 657 H HIS 637 HN HIS 637 17.618 -10.850 1.444 658 HA HIS 637 HA HIS 637 20.436 -10.484 1.956 659 HB2 HIS 637 HB2 HIS 637 19.551 -11.690 -0.062 660 HB3 HIS 637 HB1 HIS 637 18.937 -10.153 -0.653 661 HD1 HIS 637 HD1 HIS 637 20.410 -9.298 -2.435 662 HD2 HIS 637 HD2 HIS 637 22.565 -11.228 0.549 663 HE1 HIS 637 HE1 HIS 637 22.818 -9.138 -3.130 664 HE2 HIS 637 HE2 HIS 637 24.089 -10.422 -1.378 665 H ARG 638 HN ARG 638 17.676 -8.606 1.827 666 HA ARG 638 HA ARG 638 17.223 -6.418 2.058 667 HB2 ARG 638 HB2 ARG 638 20.137 -6.224 2.827 668 HB3 ARG 638 HB1 ARG 638 18.920 -4.993 3.121 669 HG2 ARG 638 HG2 ARG 638 17.706 -6.560 4.562 670 HG3 ARG 638 HG1 ARG 638 18.961 -7.769 4.280 671 HD2 ARG 638 HD2 ARG 638 19.226 -5.115 5.671 672 HD3 ARG 638 HD1 ARG 638 19.447 -6.724 6.352 673 HE ARG 638 HE ARG 638 21.334 -6.740 4.499 674 HH11 ARG 638 HH11 ARG 638 20.482 -4.266 6.823 675 HH12 ARG 638 HH12 ARG 638 22.078 -3.596 6.883 676 HH21 ARG 638 HH21 ARG 638 23.423 -5.855 4.553 677 HH22 ARG 638 HH22 ARG 638 23.756 -4.491 5.572 678 H ALA 639 HN ALA 639 17.492 -7.070 -0.517 679 HA ALA 639 HA ALA 639 19.346 -5.401 -1.913 680 HB1 ALA 639 HB1 ALA 639 16.805 -6.684 -2.905 681 HB2 ALA 639 HB2 ALA 639 18.408 -7.419 -2.929 682 HB3 ALA 639 HB3 ALA 639 18.082 -5.986 -3.903 683 H GLN 640 HN GLN 640 19.214 -3.271 -2.157 684 HA GLN 640 HA GLN 640 16.819 -1.991 -1.147 685 HB2 GLN 640 HB2 GLN 640 19.568 -0.921 -1.740 686 HB3 GLN 640 HB1 GLN 640 18.226 0.096 -1.227 687 HG2 GLN 640 HG2 GLN 640 18.003 -1.343 0.794 688 HG3 GLN 640 HG1 GLN 640 19.478 -2.170 0.304 689 HE21 GLN 640 HE21 GLN 640 18.917 -0.653 2.704 690 HE22 GLN 640 HE22 GLN 640 20.106 0.601 2.761 691 H VAL 641 HN VAL 641 15.373 -1.014 -2.243 692 HA VAL 641 HA VAL 641 15.816 -0.421 -5.100 693 HB VAL 641 HB VAL 641 13.217 -1.221 -3.771 694 HG11 VAL 641 HG11 VAL 641 12.359 -1.413 -6.058 695 HG12 VAL 641 HG12 VAL 641 13.897 -0.810 -6.680 696 HG13 VAL 641 HG13 VAL 641 12.878 0.232 -5.686 697 HG21 VAL 641 HG21 VAL 641 13.431 -3.328 -4.995 698 HG22 VAL 641 HG22 VAL 641 14.744 -3.105 -3.839 699 HG23 VAL 641 HG23 VAL 641 15.027 -2.835 -5.558 700 H SER 642 HN SER 642 15.360 1.616 -5.744 701 HA SER 642 HA SER 642 14.086 3.400 -3.779 702 HB2 SER 642 HB2 SER 642 15.992 4.067 -6.038 703 HB3 SER 642 HB1 SER 642 15.273 5.237 -4.933 704 HG SER 642 HG SER 642 16.860 4.815 -3.645 705 H VAL 643 HN VAL 643 11.964 3.479 -4.289 706 HA VAL 643 HA VAL 643 11.262 3.854 -7.112 707 HB VAL 643 HB VAL 643 10.448 1.727 -6.343 708 HG11 VAL 643 HG11 VAL 643 10.447 2.109 -3.948 709 HG12 VAL 643 HG12 VAL 643 8.871 1.516 -4.473 710 HG13 VAL 643 HG13 VAL 643 9.092 3.227 -4.106 711 HG21 VAL 643 HG21 VAL 643 8.248 3.763 -6.510 712 HG22 VAL 643 HG22 VAL 643 8.027 2.022 -6.681 713 HG23 VAL 643 HG23 VAL 643 9.003 2.908 -7.853 714 H GLU 644 HN GLU 644 10.377 5.720 -7.633 715 HA GLU 644 HA GLU 644 9.582 7.595 -5.557 716 HB2 GLU 644 HB2 GLU 644 9.953 7.854 -8.540 717 HB3 GLU 644 HB1 GLU 644 9.319 9.154 -7.543 718 HG2 GLU 644 HG2 GLU 644 11.377 9.155 -6.238 719 HG3 GLU 644 HG1 GLU 644 12.020 7.866 -7.255 720 H VAL 645 HN VAL 645 7.566 7.204 -4.805 721 HA VAL 645 HA VAL 645 5.390 6.928 -6.754 722 HB VAL 645 HB VAL 645 5.523 6.024 -3.870 723 HG11 VAL 645 HG11 VAL 645 3.340 5.560 -5.862 724 HG12 VAL 645 HG12 VAL 645 3.329 6.839 -4.646 725 HG13 VAL 645 HG13 VAL 645 3.346 5.141 -4.147 726 HG21 VAL 645 HG21 VAL 645 5.361 3.748 -4.822 727 HG22 VAL 645 HG22 VAL 645 6.843 4.579 -5.292 728 HG23 VAL 645 HG23 VAL 645 5.509 4.439 -6.438 729 H LEU 646 HN LEU 646 3.416 8.103 -6.231 730 HA LEU 646 HA LEU 646 3.829 10.629 -5.057 731 HB2 LEU 646 HB2 LEU 646 1.249 9.240 -5.731 732 HB3 LEU 646 HB1 LEU 646 1.345 10.885 -5.136 733 HG LEU 646 HG LEU 646 1.952 9.798 -7.814 734 HD11 LEU 646 HD11 LEU 646 0.955 12.482 -6.882 735 HD12 LEU 646 HD12 LEU 646 -0.078 11.110 -7.294 736 HD13 LEU 646 HD13 LEU 646 0.931 11.861 -8.533 737 HD21 LEU 646 HD21 LEU 646 4.130 10.608 -7.190 738 HD22 LEU 646 HD22 LEU 646 3.434 12.138 -6.655 739 HD23 LEU 646 HD23 LEU 646 3.392 11.698 -8.363 740 H VAL 647 HN VAL 647 3.343 11.417 -3.101 741 HA VAL 647 HA VAL 647 3.591 9.637 -0.929 742 HB VAL 647 HB VAL 647 3.276 11.659 0.487 743 HG11 VAL 647 HG11 VAL 647 5.479 11.060 -0.351 744 HG12 VAL 647 HG12 VAL 647 5.292 12.813 -0.288 745 HG13 VAL 647 HG13 VAL 647 5.175 11.968 -1.832 746 HG21 VAL 647 HG21 VAL 647 1.665 12.851 -0.902 747 HG22 VAL 647 HG22 VAL 647 2.877 13.043 -2.169 748 HG23 VAL 647 HG23 VAL 647 3.090 13.850 -0.615 749 H GLU 648 HN GLU 648 0.834 10.655 -2.616 750 HA GLU 648 HA GLU 648 -0.982 10.440 -0.372 751 HB2 GLU 648 HB2 GLU 648 -2.733 10.864 -2.088 752 HB3 GLU 648 HB1 GLU 648 -1.486 12.102 -2.038 753 HG2 GLU 648 HG2 GLU 648 -0.389 10.977 -3.967 754 HG3 GLU 648 HG1 GLU 648 -1.780 9.898 -4.058 755 H TYR 649 HN TYR 649 0.629 8.232 -2.164 756 HA TYR 649 HA TYR 649 -1.474 6.331 -2.578 757 HB2 TYR 649 HB2 TYR 649 1.479 6.369 -2.938 758 HB3 TYR 649 HB1 TYR 649 0.690 4.807 -2.771 759 HD1 TYR 649 HD1 TYR 649 0.268 7.998 -4.661 760 HD2 TYR 649 HD2 TYR 649 -0.030 3.759 -4.696 761 HE1 TYR 649 HE1 TYR 649 -0.337 8.068 -7.044 762 HE2 TYR 649 HE2 TYR 649 -0.637 3.813 -7.075 763 HH TYR 649 HH TYR 649 -1.617 5.393 -8.688 764 HA PRO 650 HA PRO 650 -1.284 4.914 1.639 765 HB2 PRO 650 HB2 PRO 650 -3.392 3.074 1.094 766 HB3 PRO 650 HB1 PRO 650 -3.494 4.625 1.917 767 HG2 PRO 650 HG2 PRO 650 -4.616 4.040 -0.549 768 HG3 PRO 650 HG1 PRO 650 -4.309 5.667 0.080 769 HD2 PRO 650 HD2 PRO 650 -2.745 4.062 -1.877 770 HD3 PRO 650 HD1 PRO 650 -3.004 5.816 -1.796 771 H PHE 651 HN PHE 651 0.438 3.680 1.992 772 HA PHE 651 HA PHE 651 0.864 1.226 0.500 773 HB2 PHE 651 HB2 PHE 651 2.540 2.798 2.444 774 HB3 PHE 651 HB1 PHE 651 2.991 1.171 1.953 775 HD1 PHE 651 HD1 PHE 651 2.365 4.596 0.698 776 HD2 PHE 651 HD2 PHE 651 4.065 0.776 -0.090 777 HE1 PHE 651 HE1 PHE 651 3.489 5.510 -1.291 778 HE2 PHE 651 HE2 PHE 651 5.192 1.682 -2.080 779 HZ PHE 651 HZ PHE 651 4.904 4.053 -2.682 780 H PHE 652 HN PHE 652 0.003 -0.603 1.201 781 HA PHE 652 HA PHE 652 -0.757 -1.020 3.925 782 HB2 PHE 652 HB2 PHE 652 -1.236 -2.330 1.460 783 HB3 PHE 652 HB1 PHE 652 -0.438 -3.499 2.505 784 HD1 PHE 652 HD1 PHE 652 -1.368 -3.583 4.958 785 HD2 PHE 652 HD2 PHE 652 -3.527 -2.130 1.595 786 HE1 PHE 652 HE1 PHE 652 -3.478 -3.962 6.153 787 HE2 PHE 652 HE2 PHE 652 -5.644 -2.508 2.789 788 HZ PHE 652 HZ PHE 652 -5.617 -3.423 5.073 789 H VAL 653 HN VAL 653 0.545 -1.631 5.547 790 HA VAL 653 HA VAL 653 3.242 -2.482 4.758 791 HB VAL 653 HB VAL 653 2.694 -1.352 7.467 792 HG11 VAL 653 HG11 VAL 653 4.918 -1.217 7.588 793 HG12 VAL 653 HG12 VAL 653 5.047 -0.524 5.968 794 HG13 VAL 653 HG13 VAL 653 4.922 -2.272 6.175 795 HG21 VAL 653 HG21 VAL 653 3.320 0.902 6.533 796 HG22 VAL 653 HG22 VAL 653 1.678 0.347 6.175 797 HG23 VAL 653 HG23 VAL 653 2.933 0.250 4.937 798 H PHE 654 HN PHE 654 4.108 -4.265 5.538 799 HA PHE 654 HA PHE 654 2.451 -6.409 6.230 800 HB2 PHE 654 HB2 PHE 654 4.593 -6.477 4.943 801 HB3 PHE 654 HB1 PHE 654 5.487 -6.254 6.444 802 HD1 PHE 654 HD1 PHE 654 3.040 -8.508 4.767 803 HD2 PHE 654 HD2 PHE 654 6.070 -8.108 7.726 804 HE1 PHE 654 HE1 PHE 654 3.009 -10.941 5.123 805 HE2 PHE 654 HE2 PHE 654 6.046 -10.540 8.087 806 HZ PHE 654 HZ PHE 654 4.512 -11.960 6.783 807 H GLY 655 HN GLY 655 1.405 -5.733 8.237 808 HA2 GLY 655 HA2 GLY 655 1.263 -6.514 10.489 809 HA3 GLY 655 HA1 GLY 655 3.014 -6.559 10.552 810 H GLN 656 HN GLN 656 3.229 -3.894 9.358 811 HA GLN 656 HA GLN 656 3.285 -2.429 11.786 812 HB2 GLN 656 HB2 GLN 656 3.744 -1.561 8.936 813 HB3 GLN 656 HB1 GLN 656 4.021 -0.524 10.319 814 HG2 GLN 656 HG2 GLN 656 6.113 -1.381 9.682 815 HG3 GLN 656 HG1 GLN 656 5.646 -2.219 11.143 816 HE21 GLN 656 HE21 GLN 656 4.442 -2.849 7.944 817 HE22 GLN 656 HE22 GLN 656 5.110 -4.444 7.736 818 H GLY 657 HN GLY 657 1.147 -2.370 8.945 819 HA2 GLY 657 HA2 GLY 657 -1.212 -2.067 9.955 820 HA3 GLY 657 HA1 GLY 657 -0.579 -0.497 10.411 821 H TRP 658 HN TRP 658 -2.367 0.319 9.223 822 HA TRP 658 HA TRP 658 -2.190 0.134 6.308 823 HB2 TRP 658 HB2 TRP 658 -4.349 -0.341 7.551 824 HB3 TRP 658 HB1 TRP 658 -4.378 1.353 8.007 825 HD1 TRP 658 HD1 TRP 658 -6.773 1.416 6.789 826 HE1 TRP 658 HE1 TRP 658 -7.411 1.776 4.332 827 HE3 TRP 658 HE3 TRP 658 -2.244 0.424 4.577 828 HZ2 TRP 658 HZ2 TRP 658 -6.189 1.671 1.813 829 HZ3 TRP 658 HZ3 TRP 658 -2.089 0.580 2.138 830 HH2 TRP 658 HH2 TRP 658 -4.013 1.191 0.789 831 H SER 659 HN SER 659 -0.722 1.647 5.605 832 HA SER 659 HA SER 659 -0.727 4.248 6.979 833 HB2 SER 659 HB2 SER 659 1.680 2.606 6.158 834 HB3 SER 659 HB1 SER 659 1.741 4.208 6.892 835 HG SER 659 HG SER 659 1.957 2.276 8.316 836 H SER 660 HN SER 660 0.458 5.956 5.805 837 HA SER 660 HA SER 660 0.873 5.530 2.947 838 HB2 SER 660 HB2 SER 660 -0.828 7.793 4.029 839 HB3 SER 660 HB1 SER 660 -0.399 7.532 2.337 840 HG SER 660 HG SER 660 -1.527 5.329 3.468 841 H CYS 661 HN CYS 661 2.262 7.110 2.002 842 HA CYS 661 HA CYS 661 4.312 8.006 3.761 843 HB2 CYS 661 HB2 CYS 661 3.848 8.639 0.839 844 HB3 CYS 661 HB1 CYS 661 5.337 8.946 1.725 845 HG CYS 661 HG CYS 661 5.907 6.761 0.204 846 H CYS 662 HN CYS 662 1.351 9.275 2.959 847 HA CYS 662 HA CYS 662 1.905 11.683 4.382 848 HB2 CYS 662 HB2 CYS 662 2.603 12.403 2.147 849 HB3 CYS 662 HB1 CYS 662 1.068 11.870 1.477 850 HG CYS 662 HG CYS 662 1.851 14.802 2.565 851 HA PRO 663 HA PRO 663 -2.252 9.789 5.104 852 HB2 PRO 663 HB2 PRO 663 -1.663 11.135 7.688 853 HB3 PRO 663 HB1 PRO 663 -2.301 9.516 7.380 854 HG2 PRO 663 HG2 PRO 663 0.218 9.847 8.172 855 HG3 PRO 663 HG1 PRO 663 -0.203 8.621 6.961 856 HD2 PRO 663 HD2 PRO 663 1.052 11.312 6.580 857 HD3 PRO 663 HD1 PRO 663 1.406 9.777 5.760 858 H GLU 664 HN GLU 664 -0.816 12.920 5.596 859 HA GLU 664 HA GLU 664 -3.040 14.519 5.976 860 HB2 GLU 664 HB2 GLU 664 -0.652 15.168 4.233 861 HB3 GLU 664 HB1 GLU 664 -1.737 16.325 4.992 862 HG2 GLU 664 HG2 GLU 664 -0.985 15.536 7.200 863 HG3 GLU 664 HG1 GLU 664 0.153 14.453 6.401 864 H ARG 665 HN ARG 665 -1.476 13.773 2.845 865 HA ARG 665 HA ARG 665 -3.543 14.918 1.295 866 HB2 ARG 665 HB2 ARG 665 -1.112 13.333 0.755 867 HB3 ARG 665 HB1 ARG 665 -2.384 13.191 -0.451 868 HG2 ARG 665 HG2 ARG 665 -2.422 15.682 -0.587 869 HG3 ARG 665 HG1 ARG 665 -1.000 15.699 0.452 870 HD2 ARG 665 HD2 ARG 665 0.219 14.358 -1.187 871 HD3 ARG 665 HD1 ARG 665 -1.205 14.325 -2.225 872 HE ARG 665 HE ARG 665 0.239 16.804 -1.533 873 HH11 ARG 665 HH11 ARG 665 -1.376 14.743 -3.887 874 HH12 ARG 665 HH12 ARG 665 -1.256 15.921 -5.158 875 HH21 ARG 665 HH21 ARG 665 0.394 18.324 -3.225 876 HH22 ARG 665 HH22 ARG 665 -0.243 17.936 -4.791 877 H THR 666 HN THR 666 -2.844 11.483 2.052 878 HA THR 666 HA THR 666 -4.821 10.428 0.388 879 HB THR 666 HB THR 666 -3.956 9.171 2.994 880 HG1 THR 666 HG1 THR 666 -2.603 8.586 0.624 881 HG21 THR 666 HG21 THR 666 -4.281 7.070 1.762 882 HG22 THR 666 HG22 THR 666 -4.758 7.976 0.327 883 HG23 THR 666 HG23 THR 666 -5.764 8.025 1.774 884 H SER 667 HN SER 667 -5.032 11.452 3.790 885 HA SER 667 HA SER 667 -7.808 10.814 3.993 886 HB2 SER 667 HB2 SER 667 -5.938 12.432 5.717 887 HB3 SER 667 HB1 SER 667 -7.608 12.090 6.134 888 HG SER 667 HG SER 667 -6.481 9.796 5.451 889 H GLN 668 HN GLN 668 -5.960 13.755 3.302 890 HA GLN 668 HA GLN 668 -8.047 15.602 3.335 891 HB2 GLN 668 HB2 GLN 668 -5.324 15.415 2.244 892 HB3 GLN 668 HB1 GLN 668 -6.363 16.562 1.421 893 HG2 GLN 668 HG2 GLN 668 -6.817 17.655 3.511 894 HG3 GLN 668 HG1 GLN 668 -5.815 16.507 4.365 895 HE21 GLN 668 HE21 GLN 668 -5.853 19.213 2.225 896 HE22 GLN 668 HE22 GLN 668 -4.174 19.578 2.360 897 H LEU 669 HN LEU 669 -6.729 13.722 0.625 898 HA LEU 669 HA LEU 669 -8.581 15.070 -1.176 899 HB2 LEU 669 HB2 LEU 669 -6.508 13.047 -1.965 900 HB3 LEU 669 HB1 LEU 669 -7.198 14.336 -2.930 901 HG LEU 669 HG LEU 669 -5.262 14.659 -0.639 902 HD11 LEU 669 HD11 LEU 669 -4.249 13.800 -2.687 903 HD12 LEU 669 HD12 LEU 669 -3.710 15.441 -2.330 904 HD13 LEU 669 HD13 LEU 669 -4.917 15.163 -3.588 905 HD21 LEU 669 HD21 LEU 669 -5.224 17.050 -1.292 906 HD22 LEU 669 HD22 LEU 669 -6.764 16.530 -0.609 907 HD23 LEU 669 HD23 LEU 669 -6.600 16.745 -2.356 908 H PHE 670 HN PHE 670 -7.870 11.865 0.049 909 HA PHE 670 HA PHE 670 -10.081 10.786 -1.558 910 HB2 PHE 670 HB2 PHE 670 -7.722 9.349 -0.319 911 HB3 PHE 670 HB1 PHE 670 -8.969 8.595 -1.302 912 HD1 PHE 670 HD1 PHE 670 -9.314 9.730 -3.668 913 HD2 PHE 670 HD2 PHE 670 -5.774 10.016 -1.327 914 HE1 PHE 670 HE1 PHE 670 -8.027 10.285 -5.690 915 HE2 PHE 670 HE2 PHE 670 -4.479 10.572 -3.343 916 HZ PHE 670 HZ PHE 670 -5.607 10.710 -5.527 917 H ASP 671 HN ASP 671 -9.484 11.916 1.405 918 HA ASP 671 HA ASP 671 -10.450 11.798 3.440 919 HB2 ASP 671 HB2 ASP 671 -12.558 10.537 1.735 920 HB3 ASP 671 HB1 ASP 671 -12.750 10.571 3.482 921 H LEU 672 HN LEU 672 -8.866 9.384 2.265 922 HA LEU 672 HA LEU 672 -9.896 7.244 3.935 923 HB2 LEU 672 HB2 LEU 672 -9.232 6.716 1.661 924 HB3 LEU 672 HB1 LEU 672 -7.615 7.324 1.953 925 HG LEU 672 HG LEU 672 -7.413 5.513 3.735 926 HD11 LEU 672 HD11 LEU 672 -8.923 3.659 3.638 927 HD12 LEU 672 HD12 LEU 672 -9.803 4.381 2.290 928 HD13 LEU 672 HD13 LEU 672 -9.866 5.128 3.888 929 HD21 LEU 672 HD21 LEU 672 -6.328 5.366 1.544 930 HD22 LEU 672 HD22 LEU 672 -7.790 4.643 0.872 931 HD23 LEU 672 HD23 LEU 672 -6.871 3.786 2.111 932 HA PRO 673 HA PRO 673 -7.084 8.509 7.156 933 HB2 PRO 673 HB2 PRO 673 -7.757 6.588 8.950 934 HB3 PRO 673 HB1 PRO 673 -8.746 8.021 8.654 935 HG2 PRO 673 HG2 PRO 673 -9.106 5.231 7.676 936 HG3 PRO 673 HG1 PRO 673 -10.327 6.411 8.185 937 HD2 PRO 673 HD2 PRO 673 -9.725 5.838 5.573 938 HD3 PRO 673 HD1 PRO 673 -10.427 7.369 6.109 939 H CYS 674 HN CYS 674 -5.044 7.991 7.589 940 HA CYS 674 HA CYS 674 -4.073 5.277 7.113 941 HB2 CYS 674 HB2 CYS 674 -2.186 6.705 5.758 942 HB3 CYS 674 HB1 CYS 674 -3.555 5.890 4.996 943 HG CYS 674 HG CYS 674 -5.109 8.105 4.684 944 H SER 675 HN SER 675 -2.337 4.740 8.304 945 HA SER 675 HA SER 675 -1.311 6.592 10.260 946 HB2 SER 675 HB2 SER 675 -0.392 3.789 9.562 947 HB3 SER 675 HB1 SER 675 0.007 4.683 11.031 948 HG SER 675 HG SER 675 -2.694 4.254 10.352 949 H LYS 676 HN LYS 676 1.120 6.961 10.434 950 HA LYS 676 HA LYS 676 1.997 7.869 7.860 951 HB2 LYS 676 HB2 LYS 676 2.461 9.229 9.832 952 HB3 LYS 676 HB1 LYS 676 3.450 7.936 10.506 953 HG2 LYS 676 HG2 LYS 676 4.807 9.711 9.479 954 HG3 LYS 676 HG1 LYS 676 5.036 8.144 8.684 955 HD2 LYS 676 HD2 LYS 676 3.497 8.814 6.911 956 HD3 LYS 676 HD1 LYS 676 3.230 10.363 7.707 957 HE2 LYS 676 HE2 LYS 676 5.906 9.397 6.717 958 HE3 LYS 676 HE1 LYS 676 4.827 10.440 5.794 959 HZ1 LYS 676 HZ1 LYS 676 6.125 11.072 8.387 960 HZ2 LYS 676 HZ2 LYS 676 4.966 12.053 7.644 961 HZ3 LYS 676 HZ3 LYS 676 6.449 11.779 6.888 962 H LEU 677 HN LEU 677 2.930 6.646 6.422 963 HA LEU 677 HA LEU 677 4.437 4.291 7.111 964 HB2 LEU 677 HB2 LEU 677 3.088 4.447 5.037 965 HB3 LEU 677 HB1 LEU 677 4.123 5.732 4.463 966 HG LEU 677 HG LEU 677 4.470 3.390 3.494 967 HD11 LEU 677 HD11 LEU 677 6.893 3.645 3.367 968 HD12 LEU 677 HD12 LEU 677 6.841 4.816 4.684 969 HD13 LEU 677 HD13 LEU 677 6.070 5.188 3.143 970 HD21 LEU 677 HD21 LEU 677 5.862 1.874 4.761 971 HD22 LEU 677 HD22 LEU 677 4.360 2.200 5.628 972 HD23 LEU 677 HD23 LEU 677 5.857 2.982 6.131 973 H SER 678 HN SER 678 6.438 4.405 7.859 974 HA SER 678 HA SER 678 8.245 6.428 6.742 975 HB2 SER 678 HB2 SER 678 8.067 5.777 9.691 976 HB3 SER 678 HB1 SER 678 9.130 6.963 8.934 977 HG SER 678 HG SER 678 6.741 7.590 8.128 978 H VAL 679 HN VAL 679 10.549 5.963 7.491 979 HA VAL 679 HA VAL 679 11.365 3.503 6.547 980 HB VAL 679 HB VAL 679 12.894 5.255 6.422 981 HG11 VAL 679 HG11 VAL 679 13.766 6.446 8.440 982 HG12 VAL 679 HG12 VAL 679 12.484 5.668 9.369 983 HG13 VAL 679 HG13 VAL 679 12.078 6.761 8.042 984 HG21 VAL 679 HG21 VAL 679 13.955 3.608 8.709 985 HG22 VAL 679 HG22 VAL 679 14.891 4.473 7.484 986 HG23 VAL 679 HG23 VAL 679 13.917 3.075 7.028 987 H GLY 680 HN GLY 680 11.943 1.600 7.452 988 HA2 GLY 680 HA2 GLY 680 12.340 0.161 9.349 989 HA3 GLY 680 HA1 GLY 680 11.329 1.227 10.311 990 H ASP 681 HN ASP 681 9.567 1.209 7.700 991 HA ASP 681 HA ASP 681 7.906 -0.943 8.777 992 HB2 ASP 681 HB2 ASP 681 7.154 1.300 6.867 993 HB3 ASP 681 HB1 ASP 681 6.063 0.122 7.550 994 H VAL 682 HN VAL 682 7.895 -2.868 7.777 995 HA VAL 682 HA VAL 682 8.932 -3.172 5.150 996 HB VAL 682 HB VAL 682 9.302 -5.070 6.443 997 HG11 VAL 682 HG11 VAL 682 7.532 -6.282 7.628 998 HG12 VAL 682 HG12 VAL 682 6.467 -4.930 7.251 999 HG13 VAL 682 HG13 VAL 682 7.889 -4.673 8.248 1000 HG21 VAL 682 HG21 VAL 682 8.726 -5.909 4.364 1001 HG22 VAL 682 HG22 VAL 682 7.013 -5.579 4.617 1002 HG23 VAL 682 HG23 VAL 682 7.801 -6.879 5.508 1003 H CYS 683 HN CYS 683 7.861 -2.403 3.426 1004 HA CYS 683 HA CYS 683 5.003 -2.185 3.461 1005 HB2 CYS 683 HB2 CYS 683 7.049 -1.611 1.326 1006 HB3 CYS 683 HB1 CYS 683 5.328 -1.494 1.014 1007 HG CYS 683 HG CYS 683 6.603 1.050 1.541 1008 H ILE 684 HN ILE 684 3.529 -3.295 2.404 1009 HA ILE 684 HA ILE 684 4.199 -5.986 1.646 1010 HB ILE 684 HB ILE 684 1.586 -4.472 1.752 1011 HG12 ILE 684 HG12 ILE 684 2.553 -6.816 3.390 1012 HG13 ILE 684 HG11 ILE 684 2.642 -5.137 3.913 1013 HG21 ILE 684 HG21 ILE 684 1.362 -6.024 -0.044 1014 HG22 ILE 684 HG22 ILE 684 0.496 -6.676 1.348 1015 HG23 ILE 684 HG23 ILE 684 2.079 -7.318 0.913 1016 HD11 ILE 684 HD11 ILE 684 0.139 -6.688 3.298 1017 HD12 ILE 684 HD12 ILE 684 0.195 -4.983 3.745 1018 HD13 ILE 684 HD13 ILE 684 0.722 -6.215 4.895 1019 H SER 685 HN SER 685 5.095 -6.150 -0.429 1020 HA SER 685 HA SER 685 3.894 -4.558 -2.553 1021 HB2 SER 685 HB2 SER 685 6.410 -5.183 -2.411 1022 HB3 SER 685 HB1 SER 685 5.897 -6.755 -3.012 1023 HG SER 685 HG SER 685 6.353 -5.585 -4.799 1024 H LEU 686 HN LEU 686 2.115 -5.234 -3.504 1025 HA LEU 686 HA LEU 686 1.439 -8.076 -3.319 1026 HB2 LEU 686 HB2 LEU 686 0.001 -5.953 -2.519 1027 HB3 LEU 686 HB1 LEU 686 -0.530 -6.019 -4.186 1028 HG LEU 686 HG LEU 686 -2.064 -7.167 -2.677 1029 HD11 LEU 686 HD11 LEU 686 -1.938 -7.939 -4.969 1030 HD12 LEU 686 HD12 LEU 686 -2.236 -9.286 -3.867 1031 HD13 LEU 686 HD13 LEU 686 -0.624 -9.035 -4.540 1032 HD21 LEU 686 HD21 LEU 686 -1.442 -9.197 -1.544 1033 HD22 LEU 686 HD22 LEU 686 -0.400 -7.876 -1.020 1034 HD23 LEU 686 HD23 LEU 686 0.200 -9.074 -2.167 1035 H THR 687 HN THR 687 1.694 -9.215 -5.141 1036 HA THR 687 HA THR 687 1.860 -7.716 -7.651 1037 HB THR 687 HB THR 687 3.903 -8.913 -7.116 1038 HG1 THR 687 HG1 THR 687 2.685 -9.035 -9.377 1039 HG21 THR 687 HG21 THR 687 2.213 -11.411 -7.117 1040 HG22 THR 687 HG22 THR 687 3.005 -10.683 -5.719 1041 HG23 THR 687 HG23 THR 687 3.974 -11.361 -7.027 1042 H LEU 688 HN LEU 688 0.262 -7.815 -8.972 1043 HA LEU 688 HA LEU 688 -1.729 -9.933 -8.832 1044 HB2 LEU 688 HB2 LEU 688 -1.516 -7.255 -10.153 1045 HB3 LEU 688 HB1 LEU 688 -2.643 -8.423 -10.804 1046 HG LEU 688 HG LEU 688 -3.521 -6.664 -9.144 1047 HD11 LEU 688 HD11 LEU 688 -4.076 -9.597 -8.776 1048 HD12 LEU 688 HD12 LEU 688 -4.873 -8.493 -9.895 1049 HD13 LEU 688 HD13 LEU 688 -5.092 -8.298 -8.157 1050 HD21 LEU 688 HD21 LEU 688 -3.420 -7.374 -6.765 1051 HD22 LEU 688 HD22 LEU 688 -1.866 -6.834 -7.399 1052 HD23 LEU 688 HD23 LEU 688 -2.186 -8.557 -7.206 1053 H LYS 689 HN LYS 689 -0.989 -11.764 -9.785 1054 HA LYS 689 HA LYS 689 0.888 -11.806 -11.883 1055 HB2 LYS 689 HB2 LYS 689 -0.860 -13.847 -10.570 1056 HB3 LYS 689 HB1 LYS 689 0.098 -14.272 -11.970 1057 HG2 LYS 689 HG2 LYS 689 1.196 -13.096 -9.435 1058 HG3 LYS 689 HG1 LYS 689 1.195 -14.816 -9.830 1059 HD2 LYS 689 HD2 LYS 689 2.553 -12.659 -11.447 1060 HD3 LYS 689 HD1 LYS 689 3.359 -13.722 -10.298 1061 HE2 LYS 689 HE2 LYS 689 2.666 -15.663 -11.629 1062 HE3 LYS 689 HE1 LYS 689 1.894 -14.584 -12.789 1063 HZ1 LYS 689 HZ1 LYS 689 4.057 -13.597 -13.239 1064 HZ2 LYS 689 HZ2 LYS 689 4.068 -15.257 -13.549 1065 HZ3 LYS 689 HZ3 LYS 689 4.790 -14.660 -12.144 Start of MODEL 11 1 H1 VAL 34 HT1 VAL 34 -18.712 -4.842 -5.713 2 H2 VAL 34 HT2 VAL 34 -18.504 -3.293 -6.350 3 H3 VAL 34 HT3 VAL 34 -19.423 -3.512 -4.951 4 HA VAL 34 HA VAL 34 -17.245 -2.614 -4.438 5 HB VAL 34 HB VAL 34 -16.653 -4.086 -2.670 6 HG11 VAL 34 HG11 VAL 34 -19.603 -4.424 -3.167 7 HG12 VAL 34 HG12 VAL 34 -18.844 -2.980 -2.505 8 HG13 VAL 34 HG13 VAL 34 -18.779 -4.497 -1.610 9 HG21 VAL 34 HG21 VAL 34 -16.415 -6.161 -3.907 10 HG22 VAL 34 HG22 VAL 34 -18.166 -6.258 -4.104 11 HG23 VAL 34 HG23 VAL 34 -17.452 -6.382 -2.497 12 H PHE 35 HN PHE 35 -14.971 -2.928 -4.358 13 HA PHE 35 HA PHE 35 -14.143 -3.944 -6.957 14 HB2 PHE 35 HB2 PHE 35 -12.919 -1.983 -5.022 15 HB3 PHE 35 HB1 PHE 35 -12.068 -2.554 -6.453 16 HD1 PHE 35 HD1 PHE 35 -15.577 -1.483 -5.827 17 HD2 PHE 35 HD2 PHE 35 -12.008 -0.903 -8.049 18 HE1 PHE 35 HE1 PHE 35 -16.703 0.235 -7.169 19 HE2 PHE 35 HE2 PHE 35 -13.124 0.813 -9.411 20 HZ PHE 35 HZ PHE 35 -15.477 1.384 -8.974 21 HA PRO 36 HA PRO 36 -11.714 -7.384 -5.408 22 HB2 PRO 36 HB2 PRO 36 -9.871 -6.474 -7.569 23 HB3 PRO 36 HB1 PRO 36 -10.507 -8.091 -7.241 24 HG2 PRO 36 HG2 PRO 36 -11.461 -6.633 -9.257 25 HG3 PRO 36 HG1 PRO 36 -12.531 -7.651 -8.275 26 HD2 PRO 36 HD2 PRO 36 -12.176 -4.690 -8.244 27 HD3 PRO 36 HD1 PRO 36 -13.636 -5.658 -7.975 28 H TRP 37 HN TRP 37 -10.051 -7.528 -4.007 29 HA TRP 37 HA TRP 37 -9.525 -5.278 -2.565 30 HB2 TRP 37 HB2 TRP 37 -7.799 -6.655 -1.358 31 HB3 TRP 37 HB1 TRP 37 -9.410 -7.346 -1.473 32 HD1 TRP 37 HD1 TRP 37 -9.698 -9.324 -3.403 33 HE1 TRP 37 HE1 TRP 37 -8.014 -11.140 -4.099 34 HE3 TRP 37 HE3 TRP 37 -5.422 -7.194 -1.601 35 HZ2 TRP 37 HZ2 TRP 37 -5.250 -11.609 -3.893 36 HZ3 TRP 37 HZ3 TRP 37 -3.293 -8.394 -1.892 37 HH2 TRP 37 HH2 TRP 37 -3.216 -10.561 -3.016 38 H HIS 38 HN HIS 38 -7.406 -6.659 -5.073 39 HA HIS 38 HA HIS 38 -5.277 -4.895 -4.538 40 HB2 HIS 38 HB2 HIS 38 -4.459 -5.462 -6.792 41 HB3 HIS 38 HB1 HIS 38 -4.891 -6.883 -5.856 42 HD1 HIS 38 HD1 HIS 38 -5.395 -5.310 -9.079 43 HD2 HIS 38 HD2 HIS 38 -7.477 -8.022 -6.715 44 HE1 HIS 38 HE1 HIS 38 -6.985 -6.476 -10.634 45 HE2 HIS 38 HE2 HIS 38 -8.128 -8.215 -9.215 46 H SER 39 HN SER 39 -6.166 -2.887 -4.186 47 HA SER 39 HA SER 39 -6.740 -1.341 -6.593 48 HB2 SER 39 HB2 SER 39 -8.951 -2.000 -5.863 49 HB3 SER 39 HB1 SER 39 -8.580 -1.583 -4.193 50 HG SER 39 HG SER 39 -9.739 0.103 -5.019 51 H LEU 40 HN LEU 40 -6.723 -1.163 -3.089 52 HA LEU 40 HA LEU 40 -5.360 1.410 -3.025 53 HB2 LEU 40 HB2 LEU 40 -5.529 0.575 -0.441 54 HB3 LEU 40 HB1 LEU 40 -6.768 1.489 -1.278 55 HG LEU 40 HG LEU 40 -6.842 -1.508 -1.400 56 HD11 LEU 40 HD11 LEU 40 -7.734 0.211 0.896 57 HD12 LEU 40 HD12 LEU 40 -6.626 -1.161 0.935 58 HD13 LEU 40 HD13 LEU 40 -8.342 -1.416 0.597 59 HD21 LEU 40 HD21 LEU 40 -8.369 -0.085 -2.783 60 HD22 LEU 40 HD22 LEU 40 -9.049 0.553 -1.285 61 HD23 LEU 40 HD23 LEU 40 -9.205 -1.161 -1.663 62 H VAL 41 HN VAL 41 -4.688 -1.986 -2.621 63 HA VAL 41 HA VAL 41 -2.163 -1.595 -1.344 64 HB VAL 41 HB VAL 41 -3.433 -3.615 -0.876 65 HG11 VAL 41 HG11 VAL 41 -3.726 -5.377 -2.554 66 HG12 VAL 41 HG12 VAL 41 -3.059 -4.310 -3.790 67 HG13 VAL 41 HG13 VAL 41 -4.582 -3.900 -2.999 68 HG21 VAL 41 HG21 VAL 41 -1.666 -5.267 -1.258 69 HG22 VAL 41 HG22 VAL 41 -1.039 -3.723 -0.681 70 HG23 VAL 41 HG23 VAL 41 -0.894 -4.153 -2.383 71 HA PRO 42 HA PRO 42 -0.133 -1.181 -5.326 72 HB2 PRO 42 HB2 PRO 42 1.814 0.406 -4.527 73 HB3 PRO 42 HB1 PRO 42 0.149 1.005 -4.503 74 HG2 PRO 42 HG2 PRO 42 1.852 0.048 -2.245 75 HG3 PRO 42 HG1 PRO 42 0.689 1.384 -2.284 76 HD2 PRO 42 HD2 PRO 42 0.211 -1.235 -1.341 77 HD3 PRO 42 HD1 PRO 42 -1.010 0.016 -1.652 78 H PHE 43 HN PHE 43 2.489 -1.095 -5.606 79 HA PHE 43 HA PHE 43 3.829 -2.988 -3.870 80 HB2 PHE 43 HB2 PHE 43 4.761 -4.176 -5.935 81 HB3 PHE 43 HB1 PHE 43 3.103 -4.550 -5.489 82 HD1 PHE 43 HD1 PHE 43 1.250 -3.813 -6.852 83 HD2 PHE 43 HD2 PHE 43 5.272 -2.966 -7.957 84 HE1 PHE 43 HE1 PHE 43 0.503 -3.248 -9.129 85 HE2 PHE 43 HE2 PHE 43 4.534 -2.400 -10.234 86 HZ PHE 43 HZ PHE 43 2.148 -2.539 -10.823 87 H LEU 44 HN LEU 44 5.879 -2.366 -3.506 88 HA LEU 44 HA LEU 44 6.648 0.152 -4.602 89 HB2 LEU 44 HB2 LEU 44 8.437 0.188 -3.046 90 HB3 LEU 44 HB1 LEU 44 7.046 -0.460 -2.211 91 HG LEU 44 HG LEU 44 8.714 -1.768 -1.379 92 HD11 LEU 44 HD11 LEU 44 7.120 -3.303 -2.196 93 HD12 LEU 44 HD12 LEU 44 8.715 -3.984 -2.529 94 HD13 LEU 44 HD13 LEU 44 7.785 -3.219 -3.830 95 HD21 LEU 44 HD21 LEU 44 10.680 -2.543 -2.578 96 HD22 LEU 44 HD22 LEU 44 10.508 -0.793 -2.718 97 HD23 LEU 44 HD23 LEU 44 10.066 -1.833 -4.070 98 H ALA 45 HN ALA 45 7.080 0.078 -6.666 99 HA ALA 45 HA ALA 45 8.293 -0.128 -8.582 100 HB1 ALA 45 HB1 ALA 45 10.639 -0.481 -8.402 101 HB2 ALA 45 HB2 ALA 45 10.459 -1.350 -6.883 102 HB3 ALA 45 HB3 ALA 45 10.146 0.382 -6.950 103 HA PRO 46 HA PRO 46 8.152 -4.394 -10.223 104 HB2 PRO 46 HB2 PRO 46 11.137 -4.481 -10.384 105 HB3 PRO 46 HB1 PRO 46 9.932 -4.942 -11.593 106 HG2 PRO 46 HG2 PRO 46 11.238 -2.653 -11.838 107 HG3 PRO 46 HG1 PRO 46 9.503 -2.733 -12.195 108 HD2 PRO 46 HD2 PRO 46 10.897 -1.620 -9.806 109 HD3 PRO 46 HD1 PRO 46 9.443 -1.032 -10.635 110 H SER 47 HN SER 47 10.719 -3.753 -7.895 111 HA SER 47 HA SER 47 11.503 -4.805 -6.077 112 HB2 SER 47 HB2 SER 47 9.837 -5.877 -4.590 113 HB3 SER 47 HB1 SER 47 9.339 -4.292 -5.169 114 HG SER 47 HG SER 47 8.369 -5.937 -6.916 115 H GLN 48 HN GLN 48 13.002 -6.121 -6.837 116 HA GLN 48 HA GLN 48 14.147 -8.011 -7.266 117 HB2 GLN 48 HB2 GLN 48 13.133 -8.386 -4.927 118 HB3 GLN 48 HB1 GLN 48 12.052 -9.518 -5.731 119 HG2 GLN 48 HG2 GLN 48 13.961 -10.797 -6.525 120 HG3 GLN 48 HG1 GLN 48 15.056 -9.648 -5.758 121 HE21 GLN 48 HE21 GLN 48 14.782 -12.506 -5.322 122 HE22 GLN 48 HE22 GLN 48 14.418 -12.706 -3.644 123 H ALA 567 HT1 ALA 567 -23.028 -0.094 1.451 124 HA ALA 567 HA ALA 567 -23.434 0.161 -1.468 125 HB1 ALA 567 HB1 ALA 567 -25.455 0.663 -0.191 126 HB2 ALA 567 HB2 ALA 567 -24.777 2.117 -0.920 127 HB3 ALA 567 HB3 ALA 567 -24.550 1.805 0.800 128 HA PRO 568 HA PRO 568 -19.766 2.633 -1.220 129 HB2 PRO 568 HB2 PRO 568 -19.889 3.732 -3.685 130 HB3 PRO 568 HB1 PRO 568 -19.470 2.034 -3.427 131 HG2 PRO 568 HG2 PRO 568 -22.059 3.241 -4.295 132 HG3 PRO 568 HG1 PRO 568 -21.274 1.749 -4.844 133 HD2 PRO 568 HD2 PRO 568 -23.339 1.844 -3.032 134 HD3 PRO 568 HD1 PRO 568 -22.167 0.521 -3.140 135 HA PRO 569 HA PRO 569 -21.247 6.645 -0.083 136 HB2 PRO 569 HB2 PRO 569 -18.927 7.935 0.212 137 HB3 PRO 569 HB1 PRO 569 -19.361 6.589 1.274 138 HG2 PRO 569 HG2 PRO 569 -17.556 6.604 -1.119 139 HG3 PRO 569 HG1 PRO 569 -17.305 5.844 0.464 140 HD2 PRO 569 HD2 PRO 569 -18.194 4.494 -1.748 141 HD3 PRO 569 HD1 PRO 569 -18.565 4.011 -0.082 142 H THR 570 HN THR 570 -20.316 9.101 -0.657 143 HA THR 570 HA THR 570 -20.998 9.464 -3.403 144 HB THR 570 HB THR 570 -19.930 11.548 -1.560 145 HG1 THR 570 HG1 THR 570 -22.674 10.868 -1.901 146 HG21 THR 570 HG21 THR 570 -20.123 12.232 -3.895 147 HG22 THR 570 HG22 THR 570 -21.316 13.069 -2.902 148 HG23 THR 570 HG23 THR 570 -21.808 11.711 -3.912 149 H LEU 571 HN LEU 571 -18.209 9.012 -1.649 150 HA LEU 571 HA LEU 571 -16.336 10.133 -3.508 151 HB2 LEU 571 HB2 LEU 571 -16.026 8.237 -1.187 152 HB3 LEU 571 HB1 LEU 571 -14.691 8.850 -2.115 153 HG LEU 571 HG LEU 571 -16.596 10.651 -0.647 154 HD11 LEU 571 HD11 LEU 571 -15.556 9.131 0.963 155 HD12 LEU 571 HD12 LEU 571 -14.915 10.767 1.121 156 HD13 LEU 571 HD13 LEU 571 -13.966 9.522 0.307 157 HD21 LEU 571 HD21 LEU 571 -14.707 12.204 -0.853 158 HD22 LEU 571 HD22 LEU 571 -15.313 11.662 -2.417 159 HD23 LEU 571 HD23 LEU 571 -13.830 10.976 -1.763 160 HA PRO 572 HA PRO 572 -16.040 6.805 -6.430 161 HB2 PRO 572 HB2 PRO 572 -13.104 6.905 -6.017 162 HB3 PRO 572 HB1 PRO 572 -14.034 7.023 -7.511 163 HG2 PRO 572 HG2 PRO 572 -12.910 9.184 -6.422 164 HG3 PRO 572 HG1 PRO 572 -14.495 9.268 -7.212 165 HD2 PRO 572 HD2 PRO 572 -13.824 9.263 -4.307 166 HD3 PRO 572 HD1 PRO 572 -15.118 10.118 -5.167 167 HA PRO 573 HA PRO 573 -15.868 3.401 -3.666 168 HB2 PRO 573 HB2 PRO 573 -16.685 1.497 -5.331 169 HB3 PRO 573 HB1 PRO 573 -17.749 2.839 -4.884 170 HG2 PRO 573 HG2 PRO 573 -16.083 2.497 -7.353 171 HG3 PRO 573 HG1 PRO 573 -17.762 3.003 -7.205 172 HD2 PRO 573 HD2 PRO 573 -15.711 4.754 -7.516 173 HD3 PRO 573 HD1 PRO 573 -17.218 5.154 -6.670 174 H TYR 574 HN TYR 574 -13.636 3.863 -6.069 175 HA TYR 574 HA TYR 574 -12.408 1.399 -6.367 176 HB2 TYR 574 HB2 TYR 574 -11.919 3.432 -7.699 177 HB3 TYR 574 HB1 TYR 574 -10.952 4.018 -6.362 178 HD1 TYR 574 HD2 TYR 574 -11.279 0.834 -8.284 179 HD2 TYR 574 HD1 TYR 574 -8.668 3.791 -6.716 180 HE1 TYR 574 HE2 TYR 574 -9.358 -0.385 -9.209 181 HE2 TYR 574 HE1 TYR 574 -6.735 2.585 -7.635 182 HH TYR 574 HH TYR 574 -6.130 0.347 -8.357 183 H PHE 575 HN PHE 575 -10.911 3.926 -4.381 184 HA PHE 575 HA PHE 575 -10.512 1.926 -2.290 185 HB2 PHE 575 HB2 PHE 575 -8.209 2.214 -2.167 186 HB3 PHE 575 HB1 PHE 575 -8.489 2.167 -3.895 187 HD1 PHE 575 HD1 PHE 575 -8.763 4.460 -5.054 188 HD2 PHE 575 HD2 PHE 575 -6.991 3.929 -1.233 189 HE1 PHE 575 HE1 PHE 575 -7.624 6.620 -5.290 190 HE2 PHE 575 HE2 PHE 575 -5.853 6.097 -1.454 191 HZ PHE 575 HZ PHE 575 -6.186 7.446 -3.485 192 H MET 576 HN MET 576 -11.673 4.801 -3.167 193 HA MET 576 HA MET 576 -10.648 6.544 -1.169 194 HB2 MET 576 HB2 MET 576 -13.225 6.673 -2.737 195 HB3 MET 576 HB1 MET 576 -12.602 7.972 -1.729 196 HG2 MET 576 HG2 MET 576 -12.075 8.431 -4.007 197 HG3 MET 576 HG1 MET 576 -10.586 8.062 -3.153 198 HE1 MET 576 HE1 MET 576 -10.793 8.155 -6.329 199 HE2 MET 576 HE2 MET 576 -9.858 6.720 -6.748 200 HE3 MET 576 HE3 MET 576 -9.316 7.775 -5.441 201 H LYS 577 HN LYS 577 -12.049 7.559 0.509 202 HA LYS 577 HA LYS 577 -12.443 5.733 2.537 203 HB2 LYS 577 HB2 LYS 577 -12.057 8.153 2.841 204 HB3 LYS 577 HB1 LYS 577 -13.679 8.475 2.253 205 HG2 LYS 577 HG2 LYS 577 -14.506 7.057 4.182 206 HG3 LYS 577 HG1 LYS 577 -12.864 7.160 4.820 207 HD2 LYS 577 HD2 LYS 577 -13.021 9.620 4.739 208 HD3 LYS 577 HD1 LYS 577 -14.687 9.475 4.180 209 HE2 LYS 577 HE2 LYS 577 -15.257 8.293 6.259 210 HE3 LYS 577 HE1 LYS 577 -13.597 8.502 6.814 211 HZ1 LYS 577 HZ1 LYS 577 -13.919 10.908 6.668 212 HZ2 LYS 577 HZ2 LYS 577 -14.992 10.192 7.758 213 HZ3 LYS 577 HZ3 LYS 577 -15.536 10.669 6.229 214 H GLY 578 HN GLY 578 -13.996 4.330 3.039 215 HA2 GLY 578 HA2 GLY 578 -16.209 3.832 3.673 216 HA3 GLY 578 HA1 GLY 578 -16.785 5.088 2.599 217 H SER 579 HN SER 579 -14.694 3.588 0.705 218 HA SER 579 HA SER 579 -16.656 2.146 -0.735 219 HB2 SER 579 HB2 SER 579 -13.651 2.002 -1.007 220 HB3 SER 579 HB1 SER 579 -14.844 1.553 -2.226 221 HG SER 579 HG SER 579 -14.009 4.079 -1.381 222 H ILE 580 HN ILE 580 -16.879 -0.107 -1.026 223 HA ILE 580 HA ILE 580 -15.846 -1.676 1.208 224 HB ILE 580 HB ILE 580 -17.907 -2.405 -0.871 225 HG12 ILE 580 HG12 ILE 580 -18.738 -0.721 0.675 226 HG13 ILE 580 HG11 ILE 580 -19.491 -2.281 1.001 227 HG21 ILE 580 HG21 ILE 580 -18.340 -4.359 0.543 228 HG22 ILE 580 HG22 ILE 580 -16.988 -3.898 1.578 229 HG23 ILE 580 HG23 ILE 580 -16.698 -4.360 -0.100 230 HD11 ILE 580 HD11 ILE 580 -18.928 -1.158 3.071 231 HD12 ILE 580 HD12 ILE 580 -17.243 -1.023 2.569 232 HD13 ILE 580 HD13 ILE 580 -17.946 -2.611 2.883 233 H ILE 581 HN ILE 581 -14.204 -2.979 0.979 234 HA ILE 581 HA ILE 581 -13.241 -3.531 -1.744 235 HB ILE 581 HB ILE 581 -11.641 -3.710 0.805 236 HG12 ILE 581 HG12 ILE 581 -12.450 -1.419 0.576 237 HG13 ILE 581 HG11 ILE 581 -10.727 -1.491 0.255 238 HG21 ILE 581 HG21 ILE 581 -10.871 -3.508 -2.092 239 HG22 ILE 581 HG22 ILE 581 -10.713 -4.921 -1.046 240 HG23 ILE 581 HG23 ILE 581 -9.742 -3.481 -0.738 241 HD11 ILE 581 HD11 ILE 581 -11.218 -1.444 -2.156 242 HD12 ILE 581 HD12 ILE 581 -11.763 -0.007 -1.293 243 HD13 ILE 581 HD13 ILE 581 -12.930 -1.241 -1.772 244 H GLN 582 HN GLN 582 -13.395 -5.571 -2.452 245 HA GLN 582 HA GLN 582 -14.089 -7.652 -0.525 246 HB2 GLN 582 HB2 GLN 582 -15.367 -7.364 -2.649 247 HB3 GLN 582 HB1 GLN 582 -13.945 -7.879 -3.522 248 HG2 GLN 582 HG2 GLN 582 -13.985 -10.022 -2.349 249 HG3 GLN 582 HG1 GLN 582 -15.437 -9.524 -1.489 250 HE21 GLN 582 HE21 GLN 582 -14.111 -10.687 -4.429 251 HE22 GLN 582 HE22 GLN 582 -15.604 -10.964 -5.256 252 H LEU 583 HN LEU 583 -12.676 -8.969 0.279 253 HA LEU 583 HA LEU 583 -9.995 -9.071 -0.788 254 HB2 LEU 583 HB2 LEU 583 -11.222 -10.457 1.582 255 HB3 LEU 583 HB1 LEU 583 -9.511 -10.362 1.219 256 HG LEU 583 HG LEU 583 -11.293 -8.012 1.855 257 HD11 LEU 583 HD11 LEU 583 -10.964 -9.371 3.800 258 HD12 LEU 583 HD12 LEU 583 -9.964 -7.924 3.937 259 HD13 LEU 583 HD13 LEU 583 -9.230 -9.468 3.481 260 HD21 LEU 583 HD21 LEU 583 -8.349 -8.223 1.245 261 HD22 LEU 583 HD22 LEU 583 -9.076 -6.826 2.034 262 HD23 LEU 583 HD23 LEU 583 -9.565 -7.267 0.398 263 H ALA 584 HN ALA 584 -8.921 -11.357 -0.755 264 HA ALA 584 HA ALA 584 -9.946 -12.694 -2.966 265 HB1 ALA 584 HB1 ALA 584 -8.100 -13.895 -0.927 266 HB2 ALA 584 HB2 ALA 584 -7.595 -12.772 -2.187 267 HB3 ALA 584 HB3 ALA 584 -8.261 -14.346 -2.621 268 H ASN 585 HN ASN 585 -10.264 -13.481 0.461 269 HA ASN 585 HA ASN 585 -11.465 -16.013 0.066 270 HB2 ASN 585 HB2 ASN 585 -12.025 -15.911 2.444 271 HB3 ASN 585 HB1 ASN 585 -10.362 -15.423 2.165 272 HD21 ASN 585 HD21 ASN 585 -11.921 -14.867 4.444 273 HD22 ASN 585 HD22 ASN 585 -12.063 -13.144 4.572 274 H GLY 586 HN GLY 586 -12.683 -12.835 -0.259 275 HA2 GLY 586 HA2 GLY 586 -14.743 -12.527 -1.418 276 HA3 GLY 586 HA1 GLY 586 -15.353 -13.987 -0.656 277 H GLU 587 HN GLU 587 -13.666 -11.930 1.487 278 HA GLU 587 HA GLU 587 -16.249 -11.209 2.660 279 HB2 GLU 587 HB2 GLU 587 -15.144 -10.867 4.727 280 HB3 GLU 587 HB1 GLU 587 -14.483 -12.346 4.056 281 HG2 GLU 587 HG2 GLU 587 -12.474 -11.270 3.437 282 HG3 GLU 587 HG1 GLU 587 -13.135 -9.679 3.821 283 H LEU 588 HN LEU 588 -16.631 -9.086 3.435 284 HA LEU 588 HA LEU 588 -15.347 -7.084 1.704 285 HB2 LEU 588 HB2 LEU 588 -18.162 -7.097 2.793 286 HB3 LEU 588 HB1 LEU 588 -17.486 -5.934 1.672 287 HG LEU 588 HG LEU 588 -17.900 -8.866 1.080 288 HD11 LEU 588 HD11 LEU 588 -20.016 -7.675 1.299 289 HD12 LEU 588 HD12 LEU 588 -19.702 -8.096 -0.384 290 HD13 LEU 588 HD13 LEU 588 -19.451 -6.441 0.172 291 HD21 LEU 588 HD21 LEU 588 -16.053 -8.000 -0.182 292 HD22 LEU 588 HD22 LEU 588 -16.969 -6.564 -0.626 293 HD23 LEU 588 HD23 LEU 588 -17.444 -8.141 -1.255 294 H LYS 589 HN LYS 589 -14.507 -5.298 2.644 295 HA LYS 589 HA LYS 589 -15.353 -4.592 5.360 296 HB2 LYS 589 HB2 LYS 589 -12.479 -4.502 4.452 297 HB3 LYS 589 HB1 LYS 589 -13.102 -4.192 6.054 298 HG2 LYS 589 HG2 LYS 589 -13.753 -6.579 6.212 299 HG3 LYS 589 HG1 LYS 589 -12.968 -6.845 4.652 300 HD2 LYS 589 HD2 LYS 589 -11.119 -7.248 5.858 301 HD3 LYS 589 HD1 LYS 589 -11.044 -5.498 6.059 302 HE2 LYS 589 HE2 LYS 589 -12.648 -5.960 8.064 303 HE3 LYS 589 HE1 LYS 589 -11.978 -7.587 7.945 304 HZ1 LYS 589 HZ1 LYS 589 -10.687 -6.359 9.494 305 HZ2 LYS 589 HZ2 LYS 589 -10.474 -5.077 8.412 306 HZ3 LYS 589 HZ3 LYS 589 -9.742 -6.578 8.101 307 H LYS 590 HN LYS 590 -14.737 -2.354 5.914 308 HA LYS 590 HA LYS 590 -14.949 -0.514 3.715 309 HB2 LYS 590 HB2 LYS 590 -14.496 -0.175 6.678 310 HB3 LYS 590 HB1 LYS 590 -14.432 1.182 5.570 311 HG2 LYS 590 HG2 LYS 590 -16.820 -0.581 5.582 312 HG3 LYS 590 HG1 LYS 590 -16.616 0.625 6.853 313 HD2 LYS 590 HD2 LYS 590 -16.219 2.285 4.962 314 HD3 LYS 590 HD1 LYS 590 -16.864 1.046 3.889 315 HE2 LYS 590 HE2 LYS 590 -18.273 2.198 6.285 316 HE3 LYS 590 HE1 LYS 590 -18.578 2.656 4.610 317 HZ1 LYS 590 HZ1 LYS 590 -18.990 -0.042 5.783 318 HZ2 LYS 590 HZ2 LYS 590 -19.262 0.375 4.166 319 HZ3 LYS 590 HZ3 LYS 590 -20.205 1.065 5.384 320 H VAL 591 HN VAL 591 -13.297 0.907 2.983 321 HA VAL 591 HA VAL 591 -10.854 -0.255 2.462 322 HB VAL 591 HB VAL 591 -11.120 2.729 2.736 323 HG11 VAL 591 HG11 VAL 591 -9.551 0.981 0.853 324 HG12 VAL 591 HG12 VAL 591 -8.910 1.869 2.238 325 HG13 VAL 591 HG13 VAL 591 -9.565 2.745 0.851 326 HG21 VAL 591 HG21 VAL 591 -13.096 1.909 1.543 327 HG22 VAL 591 HG22 VAL 591 -12.048 1.071 0.399 328 HG23 VAL 591 HG23 VAL 591 -12.023 2.834 0.496 329 H GLU 592 HN GLU 592 -11.651 2.097 4.947 330 HA GLU 592 HA GLU 592 -9.023 2.462 5.900 331 HB2 GLU 592 HB2 GLU 592 -10.189 3.554 7.832 332 HB3 GLU 592 HB1 GLU 592 -10.630 4.174 6.246 333 HG2 GLU 592 HG2 GLU 592 -12.297 1.992 7.327 334 HG3 GLU 592 HG1 GLU 592 -12.406 3.549 8.126 335 H ASP 593 HN ASP 593 -11.452 0.102 6.615 336 HA ASP 593 HA ASP 593 -10.173 -0.589 9.155 337 HB2 ASP 593 HB2 ASP 593 -12.647 -0.224 9.038 338 HB3 ASP 593 HB1 ASP 593 -12.762 -1.634 7.992 339 H LEU 594 HN LEU 594 -9.756 -1.432 6.037 340 HA LEU 594 HA LEU 594 -9.429 -4.213 6.166 341 HB2 LEU 594 HB2 LEU 594 -8.062 -2.098 4.517 342 HB3 LEU 594 HB1 LEU 594 -7.811 -3.818 4.287 343 HG LEU 594 HG LEU 594 -10.549 -2.588 4.129 344 HD11 LEU 594 HD11 LEU 594 -8.572 -3.006 1.907 345 HD12 LEU 594 HD12 LEU 594 -9.125 -1.451 2.531 346 HD13 LEU 594 HD13 LEU 594 -10.259 -2.533 1.721 347 HD21 LEU 594 HD21 LEU 594 -10.399 -5.010 4.410 348 HD22 LEU 594 HD22 LEU 594 -9.359 -5.110 2.996 349 HD23 LEU 594 HD23 LEU 594 -11.033 -4.579 2.823 350 H LYS 595 HN LYS 595 -7.939 -5.427 7.066 351 HA LYS 595 HA LYS 595 -5.711 -4.093 8.422 352 HB2 LYS 595 HB2 LYS 595 -6.981 -6.797 8.880 353 HB3 LYS 595 HB1 LYS 595 -5.582 -6.196 9.758 354 HG2 LYS 595 HG2 LYS 595 -8.333 -4.973 9.747 355 HG3 LYS 595 HG1 LYS 595 -7.606 -5.904 11.059 356 HD2 LYS 595 HD2 LYS 595 -5.876 -4.218 11.332 357 HD3 LYS 595 HD1 LYS 595 -6.528 -3.304 9.971 358 HE2 LYS 595 HE2 LYS 595 -8.650 -3.056 11.222 359 HE3 LYS 595 HE1 LYS 595 -7.891 -3.858 12.597 360 HZ1 LYS 595 HZ1 LYS 595 -6.252 -2.082 12.673 361 HZ2 LYS 595 HZ2 LYS 595 -7.818 -1.468 12.839 362 HZ3 LYS 595 HZ3 LYS 595 -6.999 -1.307 11.366 363 H THR 596 HN THR 596 -3.633 -5.244 8.456 364 HA THR 596 HA THR 596 -2.873 -5.838 5.792 365 HB THR 596 HB THR 596 -1.325 -4.753 7.344 366 HG1 THR 596 HG1 THR 596 0.295 -6.798 7.002 367 HG21 THR 596 HG21 THR 596 -0.221 -5.995 9.107 368 HG22 THR 596 HG22 THR 596 -1.182 -7.424 8.734 369 HG23 THR 596 HG23 THR 596 -1.959 -5.981 9.384 370 H GLU 597 HN GLU 597 -3.584 -7.794 8.612 371 HA GLU 597 HA GLU 597 -2.694 -10.280 7.677 372 HB2 GLU 597 HB2 GLU 597 -5.060 -9.713 9.450 373 HB3 GLU 597 HB1 GLU 597 -4.229 -11.254 9.301 374 HG2 GLU 597 HG2 GLU 597 -2.202 -10.235 10.218 375 HG3 GLU 597 HG1 GLU 597 -3.055 -8.702 10.385 376 H ASP 598 HN ASP 598 -5.496 -8.395 6.943 377 HA ASP 598 HA ASP 598 -7.057 -10.445 5.782 378 HB2 ASP 598 HB2 ASP 598 -7.092 -7.449 5.358 379 HB3 ASP 598 HB1 ASP 598 -8.267 -8.553 4.675 380 H PHE 599 HN PHE 599 -4.818 -8.049 4.421 381 HA PHE 599 HA PHE 599 -5.112 -9.064 1.775 382 HB2 PHE 599 HB2 PHE 599 -3.145 -7.133 2.997 383 HB3 PHE 599 HB1 PHE 599 -2.986 -7.695 1.339 384 HD1 PHE 599 HD2 PHE 599 -5.820 -6.523 3.478 385 HD2 PHE 599 HD1 PHE 599 -3.736 -6.213 -0.215 386 HE1 PHE 599 HE2 PHE 599 -7.453 -4.862 2.696 387 HE2 PHE 599 HE1 PHE 599 -5.373 -4.554 -1.003 388 HZ PHE 599 HZ PHE 599 -7.235 -3.875 0.453 389 H ILE 600 HN ILE 600 -2.771 -9.559 4.391 390 HA ILE 600 HA ILE 600 -0.972 -11.222 3.159 391 HB ILE 600 HB ILE 600 -2.194 -11.361 5.904 392 HG12 ILE 600 HG12 ILE 600 0.522 -10.475 4.919 393 HG13 ILE 600 HG11 ILE 600 -0.809 -9.407 5.323 394 HG21 ILE 600 HG21 ILE 600 -0.326 -12.865 6.521 395 HG22 ILE 600 HG22 ILE 600 0.083 -13.008 4.811 396 HG23 ILE 600 HG23 ILE 600 -1.473 -13.603 5.401 397 HD11 ILE 600 HD11 ILE 600 0.583 -11.248 7.243 398 HD12 ILE 600 HD12 ILE 600 -0.718 -10.121 7.627 399 HD13 ILE 600 HD13 ILE 600 0.850 -9.511 7.098 400 H GLN 601 HN GLN 601 -3.982 -12.252 4.754 401 HA GLN 601 HA GLN 601 -3.944 -14.890 3.865 402 HB2 GLN 601 HB2 GLN 601 -6.256 -13.098 4.586 403 HB3 GLN 601 HB1 GLN 601 -6.436 -14.811 4.236 404 HG2 GLN 601 HG2 GLN 601 -4.928 -15.337 6.080 405 HG3 GLN 601 HG1 GLN 601 -4.786 -13.617 6.444 406 HE21 GLN 601 HE21 GLN 601 -6.558 -12.518 7.286 407 HE22 GLN 601 HE22 GLN 601 -7.892 -13.346 8.010 408 H SER 602 HN SER 602 -5.459 -12.027 2.369 409 HA SER 602 HA SER 602 -6.915 -13.344 0.429 410 HB2 SER 602 HB2 SER 602 -6.915 -11.260 -0.848 411 HB3 SER 602 HB1 SER 602 -7.121 -10.934 0.864 412 HG SER 602 HG SER 602 -4.688 -10.686 0.772 413 H ALA 603 HN ALA 603 -3.601 -12.109 0.134 414 HA ALA 603 HA ALA 603 -3.137 -13.043 -2.472 415 HB1 ALA 603 HB1 ALA 603 -1.179 -12.608 -0.219 416 HB2 ALA 603 HB2 ALA 603 -1.675 -11.415 -1.422 417 HB3 ALA 603 HB3 ALA 603 -0.743 -12.830 -1.913 418 H GLU 604 HN GLU 604 -2.615 -14.558 0.677 419 HA GLU 604 HA GLU 604 -1.226 -16.826 -0.236 420 HB2 GLU 604 HB2 GLU 604 -2.876 -16.349 2.247 421 HB3 GLU 604 HB1 GLU 604 -1.828 -17.746 2.002 422 HG2 GLU 604 HG2 GLU 604 -0.848 -14.914 1.856 423 HG3 GLU 604 HG1 GLU 604 -0.883 -15.842 3.350 424 H ILE 605 HN ILE 605 -4.642 -16.226 0.332 425 HA ILE 605 HA ILE 605 -5.522 -18.891 -0.115 426 HB ILE 605 HB ILE 605 -7.088 -16.310 -0.332 427 HG12 ILE 605 HG12 ILE 605 -6.758 -18.163 2.036 428 HG13 ILE 605 HG11 ILE 605 -5.941 -16.618 1.852 429 HG21 ILE 605 HG21 ILE 605 -9.047 -17.716 0.152 430 HG22 ILE 605 HG22 ILE 605 -8.019 -19.148 0.084 431 HG23 ILE 605 HG23 ILE 605 -8.260 -18.167 -1.362 432 HD11 ILE 605 HD11 ILE 605 -7.832 -16.400 3.332 433 HD12 ILE 605 HD12 ILE 605 -8.914 -17.042 2.089 434 HD13 ILE 605 HD13 ILE 605 -8.117 -15.487 1.848 435 H SER 606 HN SER 606 -4.664 -16.284 -2.206 436 HA SER 606 HA SER 606 -6.202 -17.344 -4.438 437 HB2 SER 606 HB2 SER 606 -4.392 -14.933 -4.344 438 HB3 SER 606 HB1 SER 606 -5.518 -15.350 -5.634 439 HG SER 606 HG SER 606 -6.099 -14.561 -2.976 440 H ASN 607 HN ASN 607 -2.875 -17.039 -3.380 441 HA ASN 607 HA ASN 607 -0.988 -18.151 -3.992 442 HB2 ASN 607 HB2 ASN 607 -2.393 -20.142 -4.390 443 HB3 ASN 607 HB1 ASN 607 -2.710 -19.585 -6.029 444 HD21 ASN 607 HD21 ASN 607 -1.077 -19.715 -7.573 445 HD22 ASN 607 HD22 ASN 607 0.341 -20.673 -7.329 446 H ASP 608 HN ASP 608 -2.964 -17.196 -6.793 447 HA ASP 608 HA ASP 608 -0.780 -16.492 -8.474 448 HB2 ASP 608 HB2 ASP 608 -3.643 -15.499 -8.501 449 HB3 ASP 608 HB1 ASP 608 -2.477 -15.269 -9.800 450 H LEU 609 HN LEU 609 -2.599 -14.785 -6.026 451 HA LEU 609 HA LEU 609 -0.973 -12.410 -6.403 452 HB2 LEU 609 HB2 LEU 609 -3.172 -13.076 -4.457 453 HB3 LEU 609 HB1 LEU 609 -2.303 -11.557 -4.469 454 HG LEU 609 HG LEU 609 -4.174 -10.994 -5.635 455 HD11 LEU 609 HD11 LEU 609 -3.650 -10.759 -7.954 456 HD12 LEU 609 HD12 LEU 609 -2.475 -12.071 -7.853 457 HD13 LEU 609 HD13 LEU 609 -2.182 -10.558 -6.996 458 HD21 LEU 609 HD21 LEU 609 -5.362 -12.417 -7.209 459 HD22 LEU 609 HD22 LEU 609 -5.215 -13.166 -5.619 460 HD23 LEU 609 HD23 LEU 609 -4.172 -13.691 -6.941 461 H LYS 610 HN LYS 610 0.686 -11.840 -5.063 462 HA LYS 610 HA LYS 610 1.233 -13.600 -2.782 463 HB2 LYS 610 HB2 LYS 610 3.225 -12.831 -4.917 464 HB3 LYS 610 HB1 LYS 610 3.635 -13.646 -3.415 465 HG2 LYS 610 HG2 LYS 610 2.250 -15.552 -4.070 466 HG3 LYS 610 HG1 LYS 610 1.838 -14.732 -5.577 467 HD2 LYS 610 HD2 LYS 610 4.620 -15.522 -4.717 468 HD3 LYS 610 HD1 LYS 610 3.622 -16.397 -5.879 469 HE2 LYS 610 HE2 LYS 610 3.612 -14.468 -7.355 470 HE3 LYS 610 HE1 LYS 610 4.540 -13.541 -6.179 471 HZ1 LYS 610 HZ1 LYS 610 5.471 -15.973 -7.595 472 HZ2 LYS 610 HZ2 LYS 610 6.357 -15.122 -6.438 473 HZ3 LYS 610 HZ3 LYS 610 5.965 -14.388 -7.908 474 H ILE 611 HN ILE 611 1.869 -12.595 -1.021 475 HA ILE 611 HA ILE 611 2.197 -9.724 -0.968 476 HB ILE 611 HB ILE 611 2.516 -11.782 1.218 477 HG12 ILE 611 HG12 ILE 611 0.218 -11.412 0.057 478 HG13 ILE 611 HG11 ILE 611 0.293 -11.495 1.806 479 HG21 ILE 611 HG21 ILE 611 2.156 -8.827 1.506 480 HG22 ILE 611 HG22 ILE 611 3.699 -9.669 1.650 481 HG23 ILE 611 HG23 ILE 611 2.397 -9.999 2.798 482 HD11 ILE 611 HD11 ILE 611 0.181 -9.057 1.927 483 HD12 ILE 611 HD12 ILE 611 -1.194 -9.712 1.028 484 HD13 ILE 611 HD13 ILE 611 0.155 -8.970 0.163 485 H ASP 612 HN ASP 612 4.108 -8.656 -0.430 486 HA ASP 612 HA ASP 612 6.533 -10.317 -0.273 487 HB2 ASP 612 HB2 ASP 612 6.079 -8.771 -2.413 488 HB3 ASP 612 HB1 ASP 612 6.795 -7.553 -1.353 489 H SER 613 HN SER 613 8.400 -9.045 0.690 490 HA SER 613 HA SER 613 7.438 -7.262 2.817 491 HB2 SER 613 HB2 SER 613 9.484 -9.446 3.247 492 HB3 SER 613 HB1 SER 613 8.753 -8.411 4.469 493 HG SER 613 HG SER 613 6.743 -9.534 3.262 494 H SER 614 HN SER 614 8.331 -5.385 2.268 495 HA SER 614 HA SER 614 11.216 -5.342 1.658 496 HB2 SER 614 HB2 SER 614 9.146 -3.485 0.472 497 HB3 SER 614 HB1 SER 614 10.844 -3.632 0.014 498 HG SER 614 HG SER 614 9.699 -6.034 -0.162 499 H THR 615 HN THR 615 12.127 -4.508 3.468 500 HA THR 615 HA THR 615 10.680 -2.660 5.148 501 HB THR 615 HB THR 615 13.524 -3.625 5.425 502 HG1 THR 615 HG1 THR 615 12.218 -4.883 7.168 503 HG21 THR 615 HG21 THR 615 13.098 -1.603 6.715 504 HG22 THR 615 HG22 THR 615 13.224 -2.989 7.799 505 HG23 THR 615 HG23 THR 615 11.640 -2.319 7.406 506 H VAL 616 HN VAL 616 10.522 -0.584 4.468 507 HA VAL 616 HA VAL 616 12.410 0.796 2.975 508 HB VAL 616 HB VAL 616 10.359 1.853 3.081 509 HG11 VAL 616 HG11 VAL 616 10.486 1.684 6.075 510 HG12 VAL 616 HG12 VAL 616 9.425 0.770 5.012 511 HG13 VAL 616 HG13 VAL 616 9.231 2.514 5.166 512 HG21 VAL 616 HG21 VAL 616 12.293 3.299 4.869 513 HG22 VAL 616 HG22 VAL 616 10.782 4.025 4.317 514 HG23 VAL 616 HG23 VAL 616 12.010 3.541 3.143 515 H GLU 617 HN GLU 617 14.414 1.112 3.405 516 HA GLU 617 HA GLU 617 15.380 1.242 6.132 517 HB2 GLU 617 HB2 GLU 617 16.791 1.142 3.477 518 HB3 GLU 617 HB1 GLU 617 17.603 1.135 5.033 519 HG2 GLU 617 HG2 GLU 617 15.536 -0.923 4.459 520 HG3 GLU 617 HG1 GLU 617 17.141 -1.086 3.756 521 H ARG 618 HN ARG 618 14.576 3.359 3.552 522 HA ARG 618 HA ARG 618 15.554 5.648 4.991 523 HB2 ARG 618 HB2 ARG 618 17.609 4.829 3.917 524 HB3 ARG 618 HB1 ARG 618 16.828 4.916 2.348 525 HG2 ARG 618 HG2 ARG 618 16.634 7.339 2.574 526 HG3 ARG 618 HG1 ARG 618 17.410 7.250 4.158 527 HD2 ARG 618 HD2 ARG 618 18.642 6.421 1.531 528 HD3 ARG 618 HD1 ARG 618 19.002 7.902 2.419 529 HE ARG 618 HE ARG 618 19.455 5.748 4.136 530 HH11 ARG 618 HH11 ARG 618 20.777 7.048 1.165 531 HH12 ARG 618 HH12 ARG 618 22.380 6.467 1.478 532 HH21 ARG 618 HH21 ARG 618 21.568 4.984 4.550 533 HH22 ARG 618 HH22 ARG 618 22.828 5.286 3.399 534 H ILE 619 HN ILE 619 14.658 7.560 4.269 535 HA ILE 619 HA ILE 619 12.897 7.413 1.920 536 HB ILE 619 HB ILE 619 12.237 8.534 4.646 537 HG12 ILE 619 HG12 ILE 619 10.781 6.573 2.872 538 HG13 ILE 619 HG11 ILE 619 11.841 6.114 4.201 539 HG21 ILE 619 HG21 ILE 619 11.563 10.192 2.997 540 HG22 ILE 619 HG22 ILE 619 10.142 9.380 3.655 541 HG23 ILE 619 HG23 ILE 619 10.738 8.953 2.050 542 HD11 ILE 619 HD11 ILE 619 9.494 6.011 4.836 543 HD12 ILE 619 HD12 ILE 619 9.300 7.717 4.436 544 HD13 ILE 619 HD13 ILE 619 10.349 7.237 5.771 545 H GLU 620 HN GLU 620 13.109 9.045 0.538 546 HA GLU 620 HA GLU 620 14.518 11.476 1.430 547 HB2 GLU 620 HB2 GLU 620 14.902 10.275 -1.302 548 HB3 GLU 620 HB1 GLU 620 15.859 11.518 -0.516 549 HG2 GLU 620 HG2 GLU 620 16.647 9.832 1.102 550 HG3 GLU 620 HG1 GLU 620 15.759 8.604 0.197 551 H ASP 621 HN ASP 621 13.829 13.397 0.452 552 HA ASP 621 HA ASP 621 11.309 13.213 -0.997 553 HB2 ASP 621 HB2 ASP 621 11.017 15.535 -0.614 554 HB3 ASP 621 HB1 ASP 621 11.693 14.901 0.880 555 H SER 622 HN SER 622 11.041 13.848 -3.111 556 HA SER 622 HA SER 622 13.501 13.715 -4.645 557 HB2 SER 622 HB2 SER 622 10.714 12.916 -5.009 558 HB3 SER 622 HB1 SER 622 11.439 13.610 -6.453 559 HG SER 622 HG SER 622 12.176 11.623 -6.663 560 H HIS 623 HN HIS 623 11.916 16.170 -3.347 561 HA HIS 623 HA HIS 623 11.655 18.386 -3.762 562 HB2 HIS 623 HB2 HIS 623 13.838 17.781 -5.755 563 HB3 HIS 623 HB1 HIS 623 13.261 19.410 -5.427 564 HD1 HIS 623 HD1 HIS 623 14.246 20.591 -3.440 565 HD2 HIS 623 HD2 HIS 623 15.119 16.527 -3.486 566 HE1 HIS 623 HE1 HIS 623 15.905 20.233 -1.585 567 HE2 HIS 623 HE2 HIS 623 16.271 17.742 -1.518 568 H SER 624 HN SER 624 10.041 16.454 -5.203 569 HA SER 624 HA SER 624 9.126 18.175 -7.407 570 HB2 SER 624 HB2 SER 624 8.960 15.152 -7.243 571 HB3 SER 624 HB1 SER 624 8.362 16.147 -8.565 572 HG SER 624 HG SER 624 10.591 15.089 -8.648 573 HA PRO 625 HA PRO 625 5.344 18.827 -5.321 574 HB2 PRO 625 HB2 PRO 625 3.999 17.760 -7.731 575 HB3 PRO 625 HB1 PRO 625 3.710 19.270 -6.869 576 HG2 PRO 625 HG2 PRO 625 5.052 19.228 -9.188 577 HG3 PRO 625 HG1 PRO 625 5.479 20.348 -7.883 578 HD2 PRO 625 HD2 PRO 625 6.897 17.923 -8.823 579 HD3 PRO 625 HD1 PRO 625 7.533 19.368 -8.018 580 H GLY 626 HN GLY 626 5.055 17.515 -3.732 581 HA2 GLY 626 HA2 GLY 626 4.305 15.769 -2.477 582 HA3 GLY 626 HA1 GLY 626 3.182 15.464 -3.790 583 H VAL 627 HN VAL 627 6.716 15.261 -4.094 584 HA VAL 627 HA VAL 627 6.333 12.367 -4.548 585 HB VAL 627 HB VAL 627 8.524 14.048 -5.769 586 HG11 VAL 627 HG11 VAL 627 9.058 11.679 -5.544 587 HG12 VAL 627 HG12 VAL 627 8.829 12.112 -7.237 588 HG13 VAL 627 HG13 VAL 627 7.559 11.251 -6.368 589 HG21 VAL 627 HG21 VAL 627 6.426 14.815 -6.661 590 HG22 VAL 627 HG22 VAL 627 5.889 13.155 -6.925 591 HG23 VAL 627 HG23 VAL 627 7.224 13.813 -7.877 592 H ALA 628 HN ALA 628 7.374 10.999 -3.324 593 HA ALA 628 HA ALA 628 9.967 11.752 -2.186 594 HB1 ALA 628 HB1 ALA 628 9.402 10.700 -0.039 595 HB2 ALA 628 HB2 ALA 628 7.749 10.439 -0.604 596 HB3 ALA 628 HB3 ALA 628 8.353 12.080 -0.375 597 H VAL 629 HN VAL 629 11.428 10.136 -2.259 598 HA VAL 629 HA VAL 629 10.514 7.639 -3.468 599 HB VAL 629 HB VAL 629 12.198 8.297 -4.850 600 HG11 VAL 629 HG11 VAL 629 12.721 10.341 -3.711 601 HG12 VAL 629 HG12 VAL 629 14.218 9.500 -4.138 602 HG13 VAL 629 HG13 VAL 629 13.626 9.458 -2.477 603 HG21 VAL 629 HG21 VAL 629 13.771 6.880 -2.699 604 HG22 VAL 629 HG22 VAL 629 14.253 7.062 -4.386 605 HG23 VAL 629 HG23 VAL 629 12.831 6.103 -3.974 606 H ILE 630 HN ILE 630 10.204 6.010 -2.236 607 HA ILE 630 HA ILE 630 11.398 5.923 0.418 608 HB ILE 630 HB ILE 630 9.368 3.988 -0.650 609 HG12 ILE 630 HG12 ILE 630 8.527 6.288 -1.063 610 HG13 ILE 630 HG11 ILE 630 7.577 5.421 0.136 611 HG21 ILE 630 HG21 ILE 630 9.938 5.036 2.110 612 HG22 ILE 630 HG22 ILE 630 10.469 3.485 1.469 613 HG23 ILE 630 HG23 ILE 630 8.750 3.805 1.693 614 HD11 ILE 630 HD11 ILE 630 8.725 6.621 1.914 615 HD12 ILE 630 HD12 ILE 630 7.932 7.726 0.791 616 HD13 ILE 630 HD13 ILE 630 9.678 7.489 0.712 617 H GLN 631 HN GLN 631 13.216 4.771 0.661 618 HA GLN 631 HA GLN 631 13.950 2.840 -1.401 619 HB2 GLN 631 HB2 GLN 631 15.593 4.539 -0.789 620 HB3 GLN 631 HB1 GLN 631 15.541 4.010 0.886 621 HG2 GLN 631 HG2 GLN 631 16.558 1.932 0.343 622 HG3 GLN 631 HG1 GLN 631 16.403 2.243 -1.387 623 HE21 GLN 631 HE21 GLN 631 18.778 1.690 0.256 624 HE22 GLN 631 HE22 GLN 631 19.849 3.022 -0.006 625 H PHE 632 HN PHE 632 13.315 0.840 -1.122 626 HA PHE 632 HA PHE 632 12.971 -0.208 1.610 627 HB2 PHE 632 HB2 PHE 632 11.774 -1.161 -0.992 628 HB3 PHE 632 HB1 PHE 632 11.515 -1.912 0.570 629 HD1 PHE 632 HD2 PHE 632 10.094 -0.856 2.235 630 HD2 PHE 632 HD1 PHE 632 10.638 0.854 -1.619 631 HE1 PHE 632 HE2 PHE 632 8.085 0.520 2.567 632 HE2 PHE 632 HE1 PHE 632 8.623 2.224 -1.299 633 HZ PHE 632 HZ PHE 632 7.342 2.059 0.796 634 H ALA 633 HN ALA 633 13.919 -2.062 2.254 635 HA ALA 633 HA ALA 633 15.770 -3.409 0.448 636 HB1 ALA 633 HB1 ALA 633 16.556 -2.942 2.691 637 HB2 ALA 633 HB2 ALA 633 16.394 -4.686 2.469 638 HB3 ALA 633 HB3 ALA 633 15.175 -3.793 3.380 639 H VAL 634 HN VAL 634 14.725 -4.719 -0.918 640 HA VAL 634 HA VAL 634 12.215 -5.946 -0.165 641 HB VAL 634 HB VAL 634 13.720 -6.054 -2.781 642 HG11 VAL 634 HG11 VAL 634 11.589 -6.756 -3.750 643 HG12 VAL 634 HG12 VAL 634 10.854 -6.755 -2.147 644 HG13 VAL 634 HG13 VAL 634 12.139 -7.901 -2.527 645 HG21 VAL 634 HG21 VAL 634 13.126 -3.779 -2.225 646 HG22 VAL 634 HG22 VAL 634 11.468 -4.269 -1.878 647 HG23 VAL 634 HG23 VAL 634 12.088 -4.362 -3.527 648 H GLY 635 HN GLY 635 12.000 -7.936 0.577 649 HA2 GLY 635 HA2 GLY 635 12.067 -10.235 0.352 650 HA3 GLY 635 HA1 GLY 635 13.388 -10.066 -0.788 651 H GLU 636 HN GLU 636 14.167 -11.940 0.341 652 HA GLU 636 HA GLU 636 14.868 -11.928 3.066 653 HB2 GLU 636 HB2 GLU 636 14.381 -13.952 1.836 654 HB3 GLU 636 HB1 GLU 636 15.717 -13.638 0.745 655 HG2 GLU 636 HG2 GLU 636 17.272 -13.883 2.605 656 HG3 GLU 636 HG1 GLU 636 15.917 -14.260 3.662 657 H HIS 637 HN HIS 637 16.577 -11.116 0.109 658 HA HIS 637 HA HIS 637 19.126 -10.997 1.513 659 HB2 HIS 637 HB2 HIS 637 18.468 -10.513 -1.399 660 HB3 HIS 637 HB1 HIS 637 20.089 -10.527 -0.714 661 HD1 HIS 637 HD1 HIS 637 17.708 -12.666 -2.340 662 HD2 HIS 637 HD2 HIS 637 20.701 -13.178 0.498 663 HE1 HIS 637 HE1 HIS 637 18.185 -15.136 -2.297 664 HE2 HIS 637 HE2 HIS 637 20.094 -15.401 -0.674 665 H ARG 638 HN ARG 638 16.597 -9.060 1.346 666 HA ARG 638 HA ARG 638 16.179 -6.861 1.662 667 HB2 ARG 638 HB2 ARG 638 18.971 -7.075 2.751 668 HB3 ARG 638 HB1 ARG 638 18.072 -5.571 2.808 669 HG2 ARG 638 HG2 ARG 638 16.296 -6.762 4.084 670 HG3 ARG 638 HG1 ARG 638 17.359 -8.171 4.139 671 HD2 ARG 638 HD2 ARG 638 19.051 -6.890 5.303 672 HD3 ARG 638 HD1 ARG 638 18.071 -5.433 5.170 673 HE ARG 638 HE ARG 638 16.723 -7.560 6.537 674 HH11 ARG 638 HH11 ARG 638 18.981 -4.904 6.896 675 HH12 ARG 638 HH12 ARG 638 18.709 -4.736 8.601 676 HH21 ARG 638 HH21 ARG 638 16.352 -7.327 8.780 677 HH22 ARG 638 HH22 ARG 638 17.202 -6.102 9.670 678 H ALA 639 HN ALA 639 16.644 -7.329 -0.933 679 HA ALA 639 HA ALA 639 18.747 -5.759 -2.050 680 HB1 ALA 639 HB1 ALA 639 16.209 -6.745 -3.348 681 HB2 ALA 639 HB2 ALA 639 17.744 -7.612 -3.289 682 HB3 ALA 639 HB3 ALA 639 17.621 -6.096 -4.181 683 H GLN 640 HN GLN 640 18.832 -3.629 -2.031 684 HA GLN 640 HA GLN 640 16.493 -2.186 -1.172 685 HB2 GLN 640 HB2 GLN 640 19.322 -1.272 -1.641 686 HB3 GLN 640 HB1 GLN 640 18.030 -0.233 -1.045 687 HG2 GLN 640 HG2 GLN 640 17.720 -1.864 0.826 688 HG3 GLN 640 HG1 GLN 640 19.199 -2.654 0.290 689 HE21 GLN 640 HE21 GLN 640 17.825 0.066 1.866 690 HE22 GLN 640 HE22 GLN 640 19.310 0.777 2.391 691 H VAL 641 HN VAL 641 15.191 -1.072 -2.293 692 HA VAL 641 HA VAL 641 15.903 -0.282 -5.044 693 HB VAL 641 HB VAL 641 13.228 -1.328 -4.080 694 HG11 VAL 641 HG11 VAL 641 14.065 -0.383 -6.818 695 HG12 VAL 641 HG12 VAL 641 12.942 0.432 -5.731 696 HG13 VAL 641 HG13 VAL 641 12.523 -1.136 -6.417 697 HG21 VAL 641 HG21 VAL 641 13.631 -3.186 -5.628 698 HG22 VAL 641 HG22 VAL 641 14.870 -3.105 -4.375 699 HG23 VAL 641 HG23 VAL 641 15.222 -2.524 -6.002 700 H SER 642 HN SER 642 15.689 1.825 -5.402 701 HA SER 642 HA SER 642 14.220 3.446 -3.464 702 HB2 SER 642 HB2 SER 642 15.399 5.333 -4.787 703 HB3 SER 642 HB1 SER 642 16.399 4.294 -3.769 704 HG SER 642 HG SER 642 17.017 4.748 -6.107 705 H VAL 643 HN VAL 643 12.119 3.708 -3.972 706 HA VAL 643 HA VAL 643 11.452 4.024 -6.806 707 HB VAL 643 HB VAL 643 10.505 2.003 -5.900 708 HG11 VAL 643 HG11 VAL 643 10.488 2.536 -3.542 709 HG12 VAL 643 HG12 VAL 643 8.880 2.029 -4.059 710 HG13 VAL 643 HG13 VAL 643 9.224 3.739 -3.798 711 HG21 VAL 643 HG21 VAL 643 8.442 4.151 -6.256 712 HG22 VAL 643 HG22 VAL 643 8.116 2.418 -6.306 713 HG23 VAL 643 HG23 VAL 643 9.163 3.157 -7.519 714 H GLU 644 HN GLU 644 10.781 5.954 -7.411 715 HA GLU 644 HA GLU 644 10.060 7.975 -5.461 716 HB2 GLU 644 HB2 GLU 644 10.293 8.044 -8.477 717 HB3 GLU 644 HB1 GLU 644 9.835 9.433 -7.503 718 HG2 GLU 644 HG2 GLU 644 11.979 9.361 -6.368 719 HG3 GLU 644 HG1 GLU 644 12.445 7.945 -7.309 720 H VAL 645 HN VAL 645 8.035 8.187 -4.762 721 HA VAL 645 HA VAL 645 5.825 7.753 -6.653 722 HB VAL 645 HB VAL 645 4.470 6.760 -4.811 723 HG11 VAL 645 HG11 VAL 645 5.504 5.322 -6.484 724 HG12 VAL 645 HG12 VAL 645 5.462 4.529 -4.911 725 HG13 VAL 645 HG13 VAL 645 6.967 5.223 -5.508 726 HG21 VAL 645 HG21 VAL 645 7.116 6.623 -3.366 727 HG22 VAL 645 HG22 VAL 645 5.621 5.852 -2.840 728 HG23 VAL 645 HG23 VAL 645 5.728 7.611 -2.909 729 H LEU 646 HN LEU 646 3.834 8.886 -6.010 730 HA LEU 646 HA LEU 646 4.354 11.416 -4.802 731 HB2 LEU 646 HB2 LEU 646 1.738 10.109 -5.550 732 HB3 LEU 646 HB1 LEU 646 1.875 11.732 -4.904 733 HG LEU 646 HG LEU 646 2.514 10.711 -7.612 734 HD11 LEU 646 HD11 LEU 646 0.489 12.044 -7.087 735 HD12 LEU 646 HD12 LEU 646 1.535 12.806 -8.286 736 HD13 LEU 646 HD13 LEU 646 1.538 13.387 -6.618 737 HD21 LEU 646 HD21 LEU 646 4.689 11.478 -6.904 738 HD22 LEU 646 HD22 LEU 646 3.992 12.995 -6.336 739 HD23 LEU 646 HD23 LEU 646 3.990 12.614 -8.060 740 H VAL 647 HN VAL 647 3.676 12.154 -2.801 741 HA VAL 647 HA VAL 647 3.872 10.227 -0.729 742 HB VAL 647 HB VAL 647 3.637 12.082 0.824 743 HG11 VAL 647 HG11 VAL 647 5.802 11.733 -0.198 744 HG12 VAL 647 HG12 VAL 647 5.518 13.455 0.059 745 HG13 VAL 647 HG13 VAL 647 5.353 12.766 -1.557 746 HG21 VAL 647 HG21 VAL 647 1.913 13.400 -0.091 747 HG22 VAL 647 HG22 VAL 647 2.779 13.617 -1.615 748 HG23 VAL 647 HG23 VAL 647 3.362 14.405 -0.148 749 H GLU 648 HN GLU 648 1.242 11.123 -2.559 750 HA GLU 648 HA GLU 648 -0.672 10.679 -0.413 751 HB2 GLU 648 HB2 GLU 648 -2.379 11.081 -2.276 752 HB3 GLU 648 HB1 GLU 648 -1.412 12.444 -1.750 753 HG2 GLU 648 HG2 GLU 648 -1.390 12.689 -4.027 754 HG3 GLU 648 HG1 GLU 648 0.111 11.819 -3.750 755 H TYR 649 HN TYR 649 1.181 8.789 -2.244 756 HA TYR 649 HA TYR 649 -0.641 6.751 -3.040 757 HB2 TYR 649 HB2 TYR 649 2.288 7.083 -2.917 758 HB3 TYR 649 HB1 TYR 649 1.717 5.433 -2.715 759 HD1 TYR 649 HD1 TYR 649 0.238 4.441 -4.506 760 HD2 TYR 649 HD2 TYR 649 2.388 8.067 -5.054 761 HE1 TYR 649 HE1 TYR 649 0.015 4.196 -6.940 762 HE2 TYR 649 HE2 TYR 649 2.171 7.834 -7.494 763 HH TYR 649 HH TYR 649 1.788 6.111 -9.154 764 HA PRO 650 HA PRO 650 -1.080 4.975 1.056 765 HB2 PRO 650 HB2 PRO 650 -2.973 3.197 0.414 766 HB3 PRO 650 HB1 PRO 650 -3.345 4.916 0.549 767 HG2 PRO 650 HG2 PRO 650 -2.847 3.270 -1.901 768 HG3 PRO 650 HG1 PRO 650 -4.094 4.498 -1.613 769 HD2 PRO 650 HD2 PRO 650 -1.772 4.990 -2.974 770 HD3 PRO 650 HD1 PRO 650 -2.672 6.225 -2.075 771 H PHE 651 HN PHE 651 -0.100 3.237 1.975 772 HA PHE 651 HA PHE 651 0.829 1.082 0.217 773 HB2 PHE 651 HB2 PHE 651 2.497 2.825 2.002 774 HB3 PHE 651 HB1 PHE 651 2.980 1.159 1.704 775 HD1 PHE 651 HD1 PHE 651 2.581 4.483 0.239 776 HD2 PHE 651 HD2 PHE 651 3.737 0.452 -0.470 777 HE1 PHE 651 HE1 PHE 651 3.664 5.166 -1.862 778 HE2 PHE 651 HE2 PHE 651 4.824 1.127 -2.571 779 HZ PHE 651 HZ PHE 651 4.787 3.486 -3.269 780 H PHE 652 HN PHE 652 -0.027 -0.713 0.972 781 HA PHE 652 HA PHE 652 -0.737 -1.099 3.705 782 HB2 PHE 652 HB2 PHE 652 -1.177 -2.453 1.235 783 HB3 PHE 652 HB1 PHE 652 -0.457 -3.602 2.357 784 HD1 PHE 652 HD2 PHE 652 -1.509 -3.824 4.654 785 HD2 PHE 652 HD1 PHE 652 -3.436 -1.921 1.378 786 HE1 PHE 652 HE2 PHE 652 -3.675 -4.103 5.771 787 HE2 PHE 652 HE1 PHE 652 -5.609 -2.188 2.496 788 HZ PHE 652 HZ PHE 652 -5.731 -3.281 4.699 789 H VAL 653 HN VAL 653 0.551 -1.765 5.337 790 HA VAL 653 HA VAL 653 3.249 -2.607 4.544 791 HB VAL 653 HB VAL 653 2.717 -1.651 7.310 792 HG11 VAL 653 HG11 VAL 653 4.995 -0.743 5.684 793 HG12 VAL 653 HG12 VAL 653 4.913 -2.471 6.004 794 HG13 VAL 653 HG13 VAL 653 4.955 -1.330 7.347 795 HG21 VAL 653 HG21 VAL 653 3.263 0.693 6.501 796 HG22 VAL 653 HG22 VAL 653 1.617 0.115 6.195 797 HG23 VAL 653 HG23 VAL 653 2.805 0.128 4.890 798 H PHE 654 HN PHE 654 4.125 -4.438 5.310 799 HA PHE 654 HA PHE 654 2.579 -6.633 5.336 800 HB2 PHE 654 HB2 PHE 654 4.918 -6.739 4.903 801 HB3 PHE 654 HB1 PHE 654 5.314 -6.283 6.551 802 HD1 PHE 654 HD2 PHE 654 3.617 -8.936 4.572 803 HD2 PHE 654 HD1 PHE 654 5.750 -7.948 8.121 804 HE1 PHE 654 HE2 PHE 654 3.721 -11.320 5.167 805 HE2 PHE 654 HE1 PHE 654 5.858 -10.332 8.721 806 HZ PHE 654 HZ PHE 654 4.842 -12.021 7.246 807 H GLY 655 HN GLY 655 3.799 -5.210 8.382 808 HA2 GLY 655 HA2 GLY 655 1.481 -6.400 9.719 809 HA3 GLY 655 HA1 GLY 655 3.075 -6.815 10.335 810 H GLN 656 HN GLN 656 2.542 -3.745 8.929 811 HA GLN 656 HA GLN 656 3.211 -2.568 11.532 812 HB2 GLN 656 HB2 GLN 656 3.763 -1.570 8.734 813 HB3 GLN 656 HB1 GLN 656 4.198 -0.706 10.188 814 HG2 GLN 656 HG2 GLN 656 6.107 -1.824 9.179 815 HG3 GLN 656 HG1 GLN 656 5.770 -2.433 10.783 816 HE21 GLN 656 HE21 GLN 656 5.374 -3.105 7.393 817 HE22 GLN 656 HE22 GLN 656 5.344 -4.830 7.501 818 H GLY 657 HN GLY 657 1.022 -2.418 8.791 819 HA2 GLY 657 HA2 GLY 657 -1.250 -1.808 9.886 820 HA3 GLY 657 HA1 GLY 657 -0.463 -0.258 10.109 821 H TRP 658 HN TRP 658 -2.621 0.058 8.872 822 HA TRP 658 HA TRP 658 -2.295 -0.108 5.981 823 HB2 TRP 658 HB2 TRP 658 -4.490 -0.618 7.066 824 HB3 TRP 658 HB1 TRP 658 -4.549 1.027 7.663 825 HD1 TRP 658 HD1 TRP 658 -6.923 1.142 6.403 826 HE1 TRP 658 HE1 TRP 658 -7.518 1.738 3.982 827 HE3 TRP 658 HE3 TRP 658 -2.322 0.473 4.211 828 HZ2 TRP 658 HZ2 TRP 658 -6.241 1.915 1.493 829 HZ3 TRP 658 HZ3 TRP 658 -2.126 0.877 1.794 830 HH2 TRP 658 HH2 TRP 658 -4.041 1.582 0.469 831 H SER 659 HN SER 659 -0.806 1.390 5.309 832 HA SER 659 HA SER 659 -0.880 4.038 6.599 833 HB2 SER 659 HB2 SER 659 1.558 2.420 5.810 834 HB3 SER 659 HB1 SER 659 1.586 4.011 6.569 835 HG SER 659 HG SER 659 1.858 2.300 8.082 836 H SER 660 HN SER 660 0.293 5.735 5.366 837 HA SER 660 HA SER 660 0.845 5.121 2.578 838 HB2 SER 660 HB2 SER 660 -0.331 7.071 1.733 839 HB3 SER 660 HB1 SER 660 -1.466 6.065 2.629 840 HG SER 660 HG SER 660 -1.470 8.419 3.042 841 H CYS 661 HN CYS 661 2.184 6.865 1.563 842 HA CYS 661 HA CYS 661 4.392 7.453 3.156 843 HB2 CYS 661 HB2 CYS 661 3.499 8.894 0.652 844 HB3 CYS 661 HB1 CYS 661 5.124 8.914 1.329 845 HG CYS 661 HG CYS 661 3.907 6.881 -0.867 846 H CYS 662 HN CYS 662 1.420 9.154 2.711 847 HA CYS 662 HA CYS 662 2.065 11.028 4.766 848 HB2 CYS 662 HB2 CYS 662 1.819 11.940 1.904 849 HB3 CYS 662 HB1 CYS 662 1.434 13.021 3.236 850 HG CYS 662 HG CYS 662 4.402 11.542 3.577 851 HA PRO 663 HA PRO 663 -2.226 9.464 4.861 852 HB2 PRO 663 HB2 PRO 663 -1.873 10.687 7.550 853 HB3 PRO 663 HB1 PRO 663 -2.559 9.120 7.104 854 HG2 PRO 663 HG2 PRO 663 -0.121 9.281 8.153 855 HG3 PRO 663 HG1 PRO 663 -0.478 8.131 6.852 856 HD2 PRO 663 HD2 PRO 663 0.983 10.729 6.742 857 HD3 PRO 663 HD1 PRO 663 1.277 9.226 5.845 858 H GLU 664 HN GLU 664 -0.884 12.548 5.782 859 HA GLU 664 HA GLU 664 -3.121 14.119 6.062 860 HB2 GLU 664 HB2 GLU 664 -0.566 14.882 4.640 861 HB3 GLU 664 HB1 GLU 664 -1.725 15.991 5.360 862 HG2 GLU 664 HG2 GLU 664 -0.075 13.962 6.840 863 HG3 GLU 664 HG1 GLU 664 0.238 15.694 6.768 864 H ARG 665 HN ARG 665 -1.338 13.426 3.065 865 HA ARG 665 HA ARG 665 -3.164 14.932 1.448 866 HB2 ARG 665 HB2 ARG 665 -0.580 14.230 1.163 867 HB3 ARG 665 HB1 ARG 665 -1.325 12.962 0.202 868 HG2 ARG 665 HG2 ARG 665 -2.317 14.547 -1.266 869 HG3 ARG 665 HG1 ARG 665 -1.838 15.892 -0.225 870 HD2 ARG 665 HD2 ARG 665 0.515 15.362 -0.632 871 HD3 ARG 665 HD1 ARG 665 0.038 14.024 -1.672 872 HE ARG 665 HE ARG 665 -0.978 15.753 -3.150 873 HH11 ARG 665 HH11 ARG 665 1.554 16.666 -0.900 874 HH12 ARG 665 HH12 ARG 665 2.132 17.967 -1.885 875 HH21 ARG 665 HH21 ARG 665 -0.210 17.473 -4.444 876 HH22 ARG 665 HH22 ARG 665 1.135 18.427 -3.896 877 H THR 666 HN THR 666 -2.603 11.458 2.047 878 HA THR 666 HA THR 666 -4.393 10.475 0.123 879 HB THR 666 HB THR 666 -3.856 9.168 2.798 880 HG1 THR 666 HG1 THR 666 -2.301 8.799 0.445 881 HG21 THR 666 HG21 THR 666 -4.384 7.965 0.065 882 HG22 THR 666 HG22 THR 666 -5.578 8.106 1.354 883 HG23 THR 666 HG23 THR 666 -4.161 7.080 1.576 884 H SER 667 HN SER 667 -4.900 11.444 3.498 885 HA SER 667 HA SER 667 -7.712 10.868 3.407 886 HB2 SER 667 HB2 SER 667 -6.351 10.745 5.494 887 HB3 SER 667 HB1 SER 667 -6.207 12.496 5.441 888 HG SER 667 HG SER 667 -8.352 12.709 5.823 889 H GLN 668 HN GLN 668 -5.695 13.704 2.868 890 HA GLN 668 HA GLN 668 -7.694 15.652 2.833 891 HB2 GLN 668 HB2 GLN 668 -4.998 15.343 1.739 892 HB3 GLN 668 HB1 GLN 668 -5.998 16.605 1.042 893 HG2 GLN 668 HG2 GLN 668 -5.291 16.248 3.931 894 HG3 GLN 668 HG1 GLN 668 -4.733 17.470 2.822 895 HE21 GLN 668 HE21 GLN 668 -7.390 16.383 4.739 896 HE22 GLN 668 HE22 GLN 668 -8.331 17.831 4.626 897 H LEU 669 HN LEU 669 -6.381 13.673 0.205 898 HA LEU 669 HA LEU 669 -8.124 15.018 -1.691 899 HB2 LEU 669 HB2 LEU 669 -6.159 12.839 -2.327 900 HB3 LEU 669 HB1 LEU 669 -6.752 14.113 -3.373 901 HG LEU 669 HG LEU 669 -4.865 14.457 -1.046 902 HD11 LEU 669 HD11 LEU 669 -4.468 14.528 -4.020 903 HD12 LEU 669 HD12 LEU 669 -3.692 13.471 -2.837 904 HD13 LEU 669 HD13 LEU 669 -3.307 15.191 -2.871 905 HD21 LEU 669 HD21 LEU 669 -5.978 16.514 -2.949 906 HD22 LEU 669 HD22 LEU 669 -4.663 16.791 -1.804 907 HD23 LEU 669 HD23 LEU 669 -6.277 16.405 -1.212 908 H PHE 670 HN PHE 670 -7.616 11.799 -0.351 909 HA PHE 670 HA PHE 670 -9.894 10.810 -1.928 910 HB2 PHE 670 HB2 PHE 670 -7.765 9.223 -0.476 911 HB3 PHE 670 HB1 PHE 670 -9.004 8.571 -1.539 912 HD1 PHE 670 HD2 PHE 670 -9.004 9.492 -3.975 913 HD2 PHE 670 HD1 PHE 670 -5.689 9.746 -1.320 914 HE1 PHE 670 HE2 PHE 670 -7.494 9.791 -5.894 915 HE2 PHE 670 HE1 PHE 670 -4.172 10.053 -3.233 916 HZ PHE 670 HZ PHE 670 -5.076 10.073 -5.526 917 H ASP 671 HN ASP 671 -9.256 12.074 0.982 918 HA ASP 671 HA ASP 671 -10.268 12.150 2.995 919 HB2 ASP 671 HB2 ASP 671 -12.433 10.915 1.331 920 HB3 ASP 671 HB1 ASP 671 -12.660 11.143 3.062 921 H LEU 672 HN LEU 672 -8.698 9.709 2.112 922 HA LEU 672 HA LEU 672 -9.955 7.637 3.748 923 HB2 LEU 672 HB2 LEU 672 -9.366 7.000 1.474 924 HB3 LEU 672 HB1 LEU 672 -7.701 7.482 1.739 925 HG LEU 672 HG LEU 672 -7.619 5.705 3.560 926 HD11 LEU 672 HD11 LEU 672 -9.268 3.978 3.545 927 HD12 LEU 672 HD12 LEU 672 -10.105 4.718 2.182 928 HD13 LEU 672 HD13 LEU 672 -10.096 5.522 3.749 929 HD21 LEU 672 HD21 LEU 672 -7.249 3.894 1.975 930 HD22 LEU 672 HD22 LEU 672 -6.575 5.408 1.370 931 HD23 LEU 672 HD23 LEU 672 -8.099 4.801 0.723 932 HA PRO 673 HA PRO 673 -6.964 8.692 6.867 933 HB2 PRO 673 HB2 PRO 673 -7.679 6.743 8.645 934 HB3 PRO 673 HB1 PRO 673 -8.528 8.281 8.478 935 HG2 PRO 673 HG2 PRO 673 -9.269 5.587 7.477 936 HG3 PRO 673 HG1 PRO 673 -10.310 6.910 8.029 937 HD2 PRO 673 HD2 PRO 673 -9.865 6.251 5.396 938 HD3 PRO 673 HD1 PRO 673 -10.407 7.839 5.949 939 H CYS 674 HN CYS 674 -4.948 8.062 7.157 940 HA CYS 674 HA CYS 674 -4.180 5.283 6.622 941 HB2 CYS 674 HB2 CYS 674 -3.184 7.745 5.231 942 HB3 CYS 674 HB1 CYS 674 -2.143 6.333 5.356 943 HG CYS 674 HG CYS 674 -5.224 5.666 4.218 944 H SER 675 HN SER 675 -2.280 4.634 7.591 945 HA SER 675 HA SER 675 -1.378 6.235 9.842 946 HB2 SER 675 HB2 SER 675 -0.494 3.478 8.932 947 HB3 SER 675 HB1 SER 675 -0.151 4.228 10.492 948 HG SER 675 HG SER 675 -2.448 2.994 9.584 949 H LYS 676 HN LYS 676 1.036 6.515 10.127 950 HA LYS 676 HA LYS 676 2.016 7.634 7.674 951 HB2 LYS 676 HB2 LYS 676 2.348 8.832 9.774 952 HB3 LYS 676 HB1 LYS 676 3.319 7.502 10.392 953 HG2 LYS 676 HG2 LYS 676 4.665 9.412 9.591 954 HG3 LYS 676 HG1 LYS 676 5.025 7.899 8.749 955 HD2 LYS 676 HD2 LYS 676 3.686 8.590 6.857 956 HD3 LYS 676 HD1 LYS 676 3.180 10.048 7.704 957 HE2 LYS 676 HE2 LYS 676 4.914 10.607 6.125 958 HE3 LYS 676 HE1 LYS 676 5.533 10.796 7.762 959 HZ1 LYS 676 HZ1 LYS 676 7.156 9.702 6.398 960 HZ2 LYS 676 HZ2 LYS 676 6.050 8.511 5.935 961 HZ3 LYS 676 HZ3 LYS 676 6.581 8.595 7.543 962 H LEU 677 HN LEU 677 2.833 6.372 6.189 963 HA LEU 677 HA LEU 677 4.427 4.055 6.781 964 HB2 LEU 677 HB2 LEU 677 3.003 4.294 4.739 965 HB3 LEU 677 HB1 LEU 677 4.061 5.562 4.173 966 HG LEU 677 HG LEU 677 4.354 3.292 3.107 967 HD11 LEU 677 HD11 LEU 677 6.798 3.381 3.084 968 HD12 LEU 677 HD12 LEU 677 6.766 4.497 4.449 969 HD13 LEU 677 HD13 LEU 677 6.077 4.980 2.900 970 HD21 LEU 677 HD21 LEU 677 4.092 1.960 5.129 971 HD22 LEU 677 HD22 LEU 677 5.596 2.627 5.764 972 HD23 LEU 677 HD23 LEU 677 5.621 1.617 4.318 973 H SER 678 HN SER 678 6.320 4.389 7.744 974 HA SER 678 HA SER 678 8.091 6.453 6.609 975 HB2 SER 678 HB2 SER 678 7.746 5.778 9.541 976 HB3 SER 678 HB1 SER 678 8.977 6.861 8.893 977 HG SER 678 HG SER 678 6.903 7.785 9.718 978 H VAL 679 HN VAL 679 10.412 6.063 7.507 979 HA VAL 679 HA VAL 679 11.355 3.650 6.523 980 HB VAL 679 HB VAL 679 12.827 5.485 6.555 981 HG11 VAL 679 HG11 VAL 679 12.343 5.654 9.515 982 HG12 VAL 679 HG12 VAL 679 11.922 6.837 8.272 983 HG13 VAL 679 HG13 VAL 679 13.615 6.540 8.672 984 HG21 VAL 679 HG21 VAL 679 13.818 3.629 8.713 985 HG22 VAL 679 HG22 VAL 679 14.804 4.663 7.675 986 HG23 VAL 679 HG23 VAL 679 13.905 3.315 6.980 987 H GLY 680 HN GLY 680 11.758 1.706 7.375 988 HA2 GLY 680 HA2 GLY 680 12.070 0.212 9.250 989 HA3 GLY 680 HA1 GLY 680 11.048 1.271 10.200 990 H ASP 681 HN ASP 681 9.230 1.475 7.725 991 HA ASP 681 HA ASP 681 7.583 -0.750 8.619 992 HB2 ASP 681 HB2 ASP 681 6.944 1.547 6.763 993 HB3 ASP 681 HB1 ASP 681 5.809 0.312 7.230 994 H VAL 682 HN VAL 682 7.958 -2.657 7.664 995 HA VAL 682 HA VAL 682 8.951 -2.840 5.022 996 HB VAL 682 HB VAL 682 9.736 -4.595 6.242 997 HG11 VAL 682 HG11 VAL 682 8.400 -4.291 8.188 998 HG12 VAL 682 HG12 VAL 682 8.418 -5.996 7.737 999 HG13 VAL 682 HG13 VAL 682 7.008 -5.001 7.380 1000 HG21 VAL 682 HG21 VAL 682 7.305 -5.784 4.937 1001 HG22 VAL 682 HG22 VAL 682 8.735 -6.676 5.458 1002 HG23 VAL 682 HG23 VAL 682 8.861 -5.486 4.164 1003 H CYS 683 HN CYS 683 7.860 -2.406 3.303 1004 HA CYS 683 HA CYS 683 5.038 -2.201 3.260 1005 HB2 CYS 683 HB2 CYS 683 6.450 -0.771 1.855 1006 HB3 CYS 683 HB1 CYS 683 7.022 -2.175 0.975 1007 HG CYS 683 HG CYS 683 4.134 -2.669 0.281 1008 H ILE 684 HN ILE 684 3.514 -3.399 2.320 1009 HA ILE 684 HA ILE 684 4.095 -6.116 1.549 1010 HB ILE 684 HB ILE 684 1.572 -4.463 1.663 1011 HG12 ILE 684 HG12 ILE 684 2.355 -6.978 3.125 1012 HG13 ILE 684 HG11 ILE 684 2.531 -5.354 3.780 1013 HG21 ILE 684 HG21 ILE 684 0.351 -6.588 1.103 1014 HG22 ILE 684 HG22 ILE 684 1.901 -7.239 0.560 1015 HG23 ILE 684 HG23 ILE 684 1.213 -5.827 -0.235 1016 HD11 ILE 684 HD11 ILE 684 0.124 -5.037 3.652 1017 HD12 ILE 684 HD12 ILE 684 0.525 -6.456 4.620 1018 HD13 ILE 684 HD13 ILE 684 -0.064 -6.651 2.968 1019 H SER 685 HN SER 685 5.074 -6.283 -0.472 1020 HA SER 685 HA SER 685 4.028 -4.629 -2.639 1021 HB2 SER 685 HB2 SER 685 6.521 -5.146 -2.390 1022 HB3 SER 685 HB1 SER 685 6.130 -6.786 -2.888 1023 HG SER 685 HG SER 685 6.773 -5.463 -4.654 1024 H LEU 686 HN LEU 686 2.317 -5.317 -3.734 1025 HA LEU 686 HA LEU 686 1.665 -8.163 -3.584 1026 HB2 LEU 686 HB2 LEU 686 0.133 -5.996 -3.032 1027 HB3 LEU 686 HB1 LEU 686 -0.286 -6.260 -4.712 1028 HG LEU 686 HG LEU 686 -1.874 -7.356 -3.278 1029 HD11 LEU 686 HD11 LEU 686 -1.676 -9.679 -4.091 1030 HD12 LEU 686 HD12 LEU 686 -0.057 -9.297 -4.675 1031 HD13 LEU 686 HD13 LEU 686 -1.457 -8.471 -5.354 1032 HD21 LEU 686 HD21 LEU 686 -0.480 -7.651 -1.316 1033 HD22 LEU 686 HD22 LEU 686 0.460 -8.882 -2.161 1034 HD23 LEU 686 HD23 LEU 686 -1.238 -9.171 -1.787 1035 H THR 687 HN THR 687 2.074 -9.357 -5.321 1036 HA THR 687 HA THR 687 2.241 -8.017 -7.915 1037 HB THR 687 HB THR 687 4.199 -9.369 -7.275 1038 HG1 THR 687 HG1 THR 687 4.407 -9.815 -9.318 1039 HG21 THR 687 HG21 THR 687 4.047 -11.815 -7.228 1040 HG22 THR 687 HG22 THR 687 2.293 -11.705 -7.373 1041 HG23 THR 687 HG23 THR 687 3.100 -11.078 -5.936 1042 H LEU 688 HN LEU 688 0.659 -8.203 -9.320 1043 HA LEU 688 HA LEU 688 -1.521 -10.047 -8.704 1044 HB2 LEU 688 HB2 LEU 688 -1.446 -7.761 -10.682 1045 HB3 LEU 688 HB1 LEU 688 -2.853 -8.715 -10.281 1046 HG LEU 688 HG LEU 688 -3.111 -6.625 -9.201 1047 HD11 LEU 688 HD11 LEU 688 -3.110 -7.166 -6.803 1048 HD12 LEU 688 HD12 LEU 688 -2.167 -8.616 -7.157 1049 HD13 LEU 688 HD13 LEU 688 -3.800 -8.450 -7.799 1050 HD21 LEU 688 HD21 LEU 688 -0.828 -5.827 -9.328 1051 HD22 LEU 688 HD22 LEU 688 -0.343 -6.961 -8.069 1052 HD23 LEU 688 HD23 LEU 688 -1.458 -5.648 -7.691 1053 H LYS 689 HN LYS 689 -0.876 -12.033 -9.555 1054 HA LYS 689 HA LYS 689 0.220 -12.162 -12.208 1055 HB2 LYS 689 HB2 LYS 689 -0.469 -14.173 -10.124 1056 HB3 LYS 689 HB1 LYS 689 -0.046 -14.666 -11.748 1057 HG2 LYS 689 HG2 LYS 689 1.631 -13.140 -9.800 1058 HG3 LYS 689 HG1 LYS 689 1.896 -14.786 -10.374 1059 HD2 LYS 689 HD2 LYS 689 3.333 -13.766 -11.790 1060 HD3 LYS 689 HD1 LYS 689 1.872 -13.431 -12.716 1061 HE2 LYS 689 HE2 LYS 689 1.690 -11.244 -11.739 1062 HE3 LYS 689 HE1 LYS 689 3.002 -11.590 -10.625 1063 HZ1 LYS 689 HZ1 LYS 689 4.520 -11.704 -12.498 1064 HZ2 LYS 689 HZ2 LYS 689 3.722 -10.215 -12.484 1065 HZ3 LYS 689 HZ3 LYS 689 3.251 -11.414 -13.578 Start of MODEL 12 1 H1 VAL 34 HT1 VAL 34 -19.084 -4.259 -4.537 2 H2 VAL 34 HT2 VAL 34 -18.404 -4.724 -6.012 3 H3 VAL 34 HT3 VAL 34 -18.515 -3.086 -5.613 4 HA VAL 34 HA VAL 34 -16.966 -3.374 -3.800 5 HB VAL 34 HB VAL 34 -15.695 -5.467 -3.606 6 HG11 VAL 34 HG11 VAL 34 -17.524 -5.141 -2.079 7 HG12 VAL 34 HG12 VAL 34 -17.399 -6.842 -2.530 8 HG13 VAL 34 HG13 VAL 34 -18.657 -5.830 -3.244 9 HG21 VAL 34 HG21 VAL 34 -15.987 -6.323 -5.847 10 HG22 VAL 34 HG22 VAL 34 -17.707 -6.567 -5.553 11 HG23 VAL 34 HG23 VAL 34 -16.519 -7.519 -4.665 12 H PHE 35 HN PHE 35 -14.607 -3.610 -4.112 13 HA PHE 35 HA PHE 35 -13.803 -3.779 -6.935 14 HB2 PHE 35 HB2 PHE 35 -12.951 -1.852 -4.800 15 HB3 PHE 35 HB1 PHE 35 -11.809 -2.305 -6.060 16 HD1 PHE 35 HD2 PHE 35 -15.416 -1.390 -5.902 17 HD2 PHE 35 HD1 PHE 35 -11.648 -0.784 -7.763 18 HE1 PHE 35 HE2 PHE 35 -16.434 0.259 -7.406 19 HE2 PHE 35 HE1 PHE 35 -12.655 0.863 -9.287 20 HZ PHE 35 HZ PHE 35 -15.054 1.386 -9.111 21 HA PRO 36 HA PRO 36 -11.293 -7.275 -5.722 22 HB2 PRO 36 HB2 PRO 36 -9.401 -5.982 -7.642 23 HB3 PRO 36 HB1 PRO 36 -9.929 -7.665 -7.552 24 HG2 PRO 36 HG2 PRO 36 -10.900 -6.019 -9.409 25 HG3 PRO 36 HG1 PRO 36 -11.928 -7.237 -8.633 26 HD2 PRO 36 HD2 PRO 36 -11.859 -4.294 -8.242 27 HD3 PRO 36 HD1 PRO 36 -13.216 -5.426 -8.089 28 H TRP 37 HN TRP 37 -9.929 -7.449 -4.038 29 HA TRP 37 HA TRP 37 -9.460 -5.259 -2.505 30 HB2 TRP 37 HB2 TRP 37 -7.928 -6.681 -1.135 31 HB3 TRP 37 HB1 TRP 37 -9.512 -7.363 -1.459 32 HD1 TRP 37 HD1 TRP 37 -9.562 -9.368 -3.382 33 HE1 TRP 37 HE1 TRP 37 -7.810 -11.188 -3.844 34 HE3 TRP 37 HE3 TRP 37 -5.515 -7.182 -1.155 35 HZ2 TRP 37 HZ2 TRP 37 -5.081 -11.646 -3.305 36 HZ3 TRP 37 HZ3 TRP 37 -3.365 -8.388 -1.190 37 HH2 TRP 37 HH2 TRP 37 -3.164 -10.570 -2.239 38 H HIS 38 HN HIS 38 -7.211 -6.630 -4.865 39 HA HIS 38 HA HIS 38 -5.077 -4.898 -4.180 40 HB2 HIS 38 HB2 HIS 38 -4.177 -5.462 -6.425 41 HB3 HIS 38 HB1 HIS 38 -4.599 -6.871 -5.466 42 HD1 HIS 38 HD1 HIS 38 -5.130 -5.344 -8.734 43 HD2 HIS 38 HD2 HIS 38 -7.104 -8.113 -6.341 44 HE1 HIS 38 HE1 HIS 38 -6.674 -6.596 -10.275 45 HE2 HIS 38 HE2 HIS 38 -7.735 -8.368 -8.835 46 H SER 39 HN SER 39 -6.415 -2.995 -3.861 47 HA SER 39 HA SER 39 -6.770 -1.476 -6.352 48 HB2 SER 39 HB2 SER 39 -8.966 -2.240 -5.587 49 HB3 SER 39 HB1 SER 39 -8.660 -1.581 -3.982 50 HG SER 39 HG SER 39 -9.761 0.015 -4.908 51 H LEU 40 HN LEU 40 -6.004 -1.543 -2.968 52 HA LEU 40 HA LEU 40 -5.149 1.291 -3.025 53 HB2 LEU 40 HB2 LEU 40 -5.390 0.518 -0.361 54 HB3 LEU 40 HB1 LEU 40 -6.487 1.545 -1.264 55 HG LEU 40 HG LEU 40 -6.876 -1.410 -1.440 56 HD11 LEU 40 HD11 LEU 40 -7.662 0.298 0.904 57 HD12 LEU 40 HD12 LEU 40 -6.648 -1.145 0.918 58 HD13 LEU 40 HD13 LEU 40 -8.367 -1.276 0.539 59 HD21 LEU 40 HD21 LEU 40 -8.220 0.138 -2.811 60 HD22 LEU 40 HD22 LEU 40 -8.793 0.918 -1.338 61 HD23 LEU 40 HD23 LEU 40 -9.204 -0.764 -1.660 62 H VAL 41 HN VAL 41 -3.850 -1.546 -3.475 63 HA VAL 41 HA VAL 41 -1.669 -1.203 -1.566 64 HB VAL 41 HB VAL 41 -2.724 -3.328 -1.246 65 HG11 VAL 41 HG11 VAL 41 -3.832 -3.549 -3.421 66 HG12 VAL 41 HG12 VAL 41 -2.945 -5.012 -2.994 67 HG13 VAL 41 HG13 VAL 41 -2.277 -3.892 -4.180 68 HG21 VAL 41 HG21 VAL 41 -0.173 -3.686 -2.785 69 HG22 VAL 41 HG22 VAL 41 -0.860 -4.831 -1.632 70 HG23 VAL 41 HG23 VAL 41 -0.301 -3.253 -1.082 71 HA PRO 42 HA PRO 42 0.441 -0.220 -5.450 72 HB2 PRO 42 HB2 PRO 42 2.109 1.593 -4.029 73 HB3 PRO 42 HB1 PRO 42 0.761 1.992 -5.092 74 HG2 PRO 42 HG2 PRO 42 0.836 2.421 -2.344 75 HG3 PRO 42 HG1 PRO 42 -0.623 2.406 -3.348 76 HD2 PRO 42 HD2 PRO 42 0.495 0.263 -1.596 77 HD3 PRO 42 HD1 PRO 42 -1.198 0.683 -1.936 78 H PHE 43 HN PHE 43 1.510 -2.174 -5.605 79 HA PHE 43 HA PHE 43 3.521 -3.116 -3.921 80 HB2 PHE 43 HB2 PHE 43 4.342 -4.244 -6.136 81 HB3 PHE 43 HB1 PHE 43 2.796 -4.710 -5.443 82 HD1 PHE 43 HD1 PHE 43 4.457 -2.974 -8.199 83 HD2 PHE 43 HD2 PHE 43 0.721 -4.112 -6.508 84 HE1 PHE 43 HE1 PHE 43 3.338 -2.446 -10.326 85 HE2 PHE 43 HE2 PHE 43 -0.404 -3.583 -8.632 86 HZ PHE 43 HZ PHE 43 0.905 -2.749 -10.542 87 H LEU 44 HN LEU 44 5.467 -2.361 -3.469 88 HA LEU 44 HA LEU 44 6.314 0.067 -4.633 89 HB2 LEU 44 HB2 LEU 44 8.063 0.121 -3.059 90 HB3 LEU 44 HB1 LEU 44 6.698 -0.592 -2.235 91 HG LEU 44 HG LEU 44 8.456 -1.833 -1.442 92 HD11 LEU 44 HD11 LEU 44 6.840 -3.393 -2.185 93 HD12 LEU 44 HD12 LEU 44 8.428 -4.058 -2.574 94 HD13 LEU 44 HD13 LEU 44 7.442 -3.311 -3.842 95 HD21 LEU 44 HD21 LEU 44 9.686 -1.897 -4.194 96 HD22 LEU 44 HD22 LEU 44 10.376 -2.595 -2.729 97 HD23 LEU 44 HD23 LEU 44 10.178 -0.846 -2.866 98 H ALA 45 HN ALA 45 7.083 0.241 -6.536 99 HA ALA 45 HA ALA 45 8.341 -0.001 -8.426 100 HB1 ALA 45 HB1 ALA 45 10.141 0.298 -6.758 101 HB2 ALA 45 HB2 ALA 45 10.639 -0.725 -8.102 102 HB3 ALA 45 HB3 ALA 45 10.219 -1.451 -6.553 103 HA PRO 46 HA PRO 46 7.957 -4.387 -9.797 104 HB2 PRO 46 HB2 PRO 46 10.708 -4.754 -10.703 105 HB3 PRO 46 HB1 PRO 46 9.224 -4.681 -11.658 106 HG2 PRO 46 HG2 PRO 46 11.091 -2.727 -11.734 107 HG3 PRO 46 HG1 PRO 46 9.360 -2.400 -11.937 108 HD2 PRO 46 HD2 PRO 46 11.076 -2.067 -9.502 109 HD3 PRO 46 HD1 PRO 46 9.842 -0.972 -10.167 110 H SER 47 HN SER 47 9.280 -3.623 -7.135 111 HA SER 47 HA SER 47 10.207 -4.563 -5.317 112 HB2 SER 47 HB2 SER 47 8.496 -6.287 -5.620 113 HB3 SER 47 HB1 SER 47 9.560 -7.173 -6.711 114 HG SER 47 HG SER 47 9.857 -6.723 -3.933 115 H GLN 48 HN GLN 48 11.374 -7.198 -7.368 116 HA GLN 48 HA GLN 48 14.037 -6.049 -7.147 117 HB2 GLN 48 HB2 GLN 48 13.674 -7.907 -5.519 118 HB3 GLN 48 HB1 GLN 48 13.363 -8.980 -6.878 119 HG2 GLN 48 HG2 GLN 48 15.597 -8.620 -7.709 120 HG3 GLN 48 HG1 GLN 48 15.918 -7.480 -6.406 121 HE21 GLN 48 HE21 GLN 48 15.494 -10.820 -7.250 122 HE22 GLN 48 HE22 GLN 48 16.109 -11.483 -5.777 123 H ALA 567 HT1 ALA 567 -29.599 14.771 -2.459 124 HA ALA 567 HA ALA 567 -28.211 12.954 -1.695 125 HB1 ALA 567 HB1 ALA 567 -27.225 14.241 -4.237 126 HB2 ALA 567 HB2 ALA 567 -28.656 13.221 -4.084 127 HB3 ALA 567 HB3 ALA 567 -27.055 12.542 -3.796 128 HA PRO 568 HA PRO 568 -24.432 14.172 0.248 129 HB2 PRO 568 HB2 PRO 568 -23.421 11.732 0.771 130 HB3 PRO 568 HB1 PRO 568 -24.841 12.356 1.619 131 HG2 PRO 568 HG2 PRO 568 -24.692 10.430 -0.666 132 HG3 PRO 568 HG1 PRO 568 -25.721 10.379 0.776 133 HD2 PRO 568 HD2 PRO 568 -26.575 11.260 -1.670 134 HD3 PRO 568 HD1 PRO 568 -27.271 11.800 -0.133 135 HA PRO 569 HA PRO 569 -21.293 14.067 -2.888 136 HB2 PRO 569 HB2 PRO 569 -19.096 14.587 -1.389 137 HB3 PRO 569 HB1 PRO 569 -20.310 15.817 -1.760 138 HG2 PRO 569 HG2 PRO 569 -19.952 14.194 0.728 139 HG3 PRO 569 HG1 PRO 569 -20.338 15.917 0.561 140 HD2 PRO 569 HD2 PRO 569 -22.211 14.018 1.103 141 HD3 PRO 569 HD1 PRO 569 -22.573 15.507 0.209 142 H THR 570 HN THR 570 -21.618 11.767 -3.250 143 HA THR 570 HA THR 570 -20.296 9.785 -1.746 144 HB THR 570 HB THR 570 -20.716 8.360 -3.822 145 HG1 THR 570 HG1 THR 570 -21.206 9.463 -5.547 146 HG21 THR 570 HG21 THR 570 -23.143 8.283 -3.414 147 HG22 THR 570 HG22 THR 570 -23.031 9.802 -2.525 148 HG23 THR 570 HG23 THR 570 -22.224 8.360 -1.910 149 H LEU 571 HN LEU 571 -18.277 9.080 -1.775 150 HA LEU 571 HA LEU 571 -16.338 10.230 -3.538 151 HB2 LEU 571 HB2 LEU 571 -16.184 8.157 -1.360 152 HB3 LEU 571 HB1 LEU 571 -14.810 8.829 -2.185 153 HG LEU 571 HG LEU 571 -16.734 10.427 -0.515 154 HD11 LEU 571 HD11 LEU 571 -15.487 8.876 0.862 155 HD12 LEU 571 HD12 LEU 571 -14.893 10.519 1.109 156 HD13 LEU 571 HD13 LEU 571 -13.976 9.389 0.111 157 HD21 LEU 571 HD21 LEU 571 -14.099 11.141 -1.799 158 HD22 LEU 571 HD22 LEU 571 -14.987 12.163 -0.670 159 HD23 LEU 571 HD23 LEU 571 -15.687 11.767 -2.238 160 HA PRO 572 HA PRO 572 -16.022 6.832 -6.399 161 HB2 PRO 572 HB2 PRO 572 -13.101 6.830 -6.170 162 HB3 PRO 572 HB1 PRO 572 -14.112 7.238 -7.557 163 HG2 PRO 572 HG2 PRO 572 -12.723 9.107 -6.194 164 HG3 PRO 572 HG1 PRO 572 -14.290 9.449 -6.949 165 HD2 PRO 572 HD2 PRO 572 -13.651 8.901 -4.075 166 HD3 PRO 572 HD1 PRO 572 -14.775 10.082 -4.770 167 HA PRO 573 HA PRO 573 -15.684 3.357 -3.739 168 HB2 PRO 573 HB2 PRO 573 -16.383 1.457 -5.458 169 HB3 PRO 573 HB1 PRO 573 -17.521 2.732 -4.995 170 HG2 PRO 573 HG2 PRO 573 -15.819 2.523 -7.453 171 HG3 PRO 573 HG1 PRO 573 -17.519 2.959 -7.306 172 HD2 PRO 573 HD2 PRO 573 -15.516 4.788 -7.556 173 HD3 PRO 573 HD1 PRO 573 -17.062 5.120 -6.750 174 H TYR 574 HN TYR 574 -13.452 3.981 -6.115 175 HA TYR 574 HA TYR 574 -12.134 1.564 -6.471 176 HB2 TYR 574 HB2 TYR 574 -11.750 3.531 -7.839 177 HB3 TYR 574 HB1 TYR 574 -10.924 4.309 -6.509 178 HD1 TYR 574 HD1 TYR 574 -10.659 0.859 -7.920 179 HD2 TYR 574 HD2 TYR 574 -8.710 4.551 -7.137 180 HE1 TYR 574 HE1 TYR 574 -8.544 -0.094 -8.736 181 HE2 TYR 574 HE2 TYR 574 -6.587 3.610 -7.935 182 HH TYR 574 HH TYR 574 -6.382 0.777 -9.705 183 H PHE 575 HN PHE 575 -10.448 4.074 -4.624 184 HA PHE 575 HA PHE 575 -10.018 2.055 -2.536 185 HB2 PHE 575 HB2 PHE 575 -7.722 2.516 -2.390 186 HB3 PHE 575 HB1 PHE 575 -8.016 2.441 -4.118 187 HD1 PHE 575 HD2 PHE 575 -8.147 4.546 -5.416 188 HD2 PHE 575 HD1 PHE 575 -6.931 4.471 -1.350 189 HE1 PHE 575 HE2 PHE 575 -7.181 6.790 -5.672 190 HE2 PHE 575 HE1 PHE 575 -5.964 6.716 -1.592 191 HZ PHE 575 HZ PHE 575 -6.106 7.879 -3.750 192 H MET 576 HN MET 576 -11.380 4.858 -3.286 193 HA MET 576 HA MET 576 -10.430 6.586 -1.230 194 HB2 MET 576 HB2 MET 576 -12.990 6.715 -2.825 195 HB3 MET 576 HB1 MET 576 -12.333 8.015 -1.840 196 HG2 MET 576 HG2 MET 576 -11.789 8.484 -4.093 197 HG3 MET 576 HG1 MET 576 -10.307 7.992 -3.293 198 HE1 MET 576 HE1 MET 576 -10.705 8.181 -6.470 199 HE2 MET 576 HE2 MET 576 -9.879 6.712 -6.990 200 HE3 MET 576 HE3 MET 576 -9.185 7.707 -5.708 201 H LYS 577 HN LYS 577 -11.970 7.538 0.420 202 HA LYS 577 HA LYS 577 -12.319 5.646 2.388 203 HB2 LYS 577 HB2 LYS 577 -12.130 8.042 2.828 204 HB3 LYS 577 HB1 LYS 577 -13.727 8.304 2.133 205 HG2 LYS 577 HG2 LYS 577 -14.712 6.924 3.901 206 HG3 LYS 577 HG1 LYS 577 -13.111 6.704 4.608 207 HD2 LYS 577 HD2 LYS 577 -12.949 9.151 4.909 208 HD3 LYS 577 HD1 LYS 577 -14.595 9.310 4.286 209 HE2 LYS 577 HE2 LYS 577 -14.583 9.341 6.721 210 HE3 LYS 577 HE1 LYS 577 -15.421 7.914 6.114 211 HZ1 LYS 577 HZ1 LYS 577 -12.635 7.996 7.139 212 HZ2 LYS 577 HZ2 LYS 577 -13.403 6.617 6.522 213 HZ3 LYS 577 HZ3 LYS 577 -13.969 7.345 7.942 214 H GLY 578 HN GLY 578 -13.860 4.307 3.074 215 HA2 GLY 578 HA2 GLY 578 -16.015 3.639 3.595 216 HA3 GLY 578 HA1 GLY 578 -16.641 4.899 2.553 217 H SER 579 HN SER 579 -14.508 3.426 0.617 218 HA SER 579 HA SER 579 -16.488 2.077 -0.885 219 HB2 SER 579 HB2 SER 579 -13.489 1.758 -1.082 220 HB3 SER 579 HB1 SER 579 -14.675 1.412 -2.340 221 HG SER 579 HG SER 579 -13.603 3.817 -1.522 222 H ILE 580 HN ILE 580 -16.793 -0.150 -1.253 223 HA ILE 580 HA ILE 580 -16.011 -1.788 1.035 224 HB ILE 580 HB ILE 580 -18.092 -2.275 -1.098 225 HG12 ILE 580 HG12 ILE 580 -18.742 -0.559 0.500 226 HG13 ILE 580 HG11 ILE 580 -19.667 -2.024 0.807 227 HG21 ILE 580 HG21 ILE 580 -17.029 -4.362 -0.327 228 HG22 ILE 580 HG22 ILE 580 -18.725 -4.251 0.142 229 HG23 ILE 580 HG23 ILE 580 -17.459 -3.945 1.330 230 HD11 ILE 580 HD11 ILE 580 -18.981 -1.064 2.893 231 HD12 ILE 580 HD12 ILE 580 -17.297 -1.021 2.372 232 HD13 ILE 580 HD13 ILE 580 -18.097 -2.570 2.643 233 H ILE 581 HN ILE 581 -14.151 -2.701 0.788 234 HA ILE 581 HA ILE 581 -13.223 -3.546 -1.849 235 HB ILE 581 HB ILE 581 -11.714 -3.631 0.763 236 HG12 ILE 581 HG12 ILE 581 -12.514 -1.344 0.371 237 HG13 ILE 581 HG11 ILE 581 -10.772 -1.445 0.196 238 HG21 ILE 581 HG21 ILE 581 -10.806 -3.542 -2.100 239 HG22 ILE 581 HG22 ILE 581 -10.729 -4.930 -1.012 240 HG23 ILE 581 HG23 ILE 581 -9.747 -3.500 -0.692 241 HD11 ILE 581 HD11 ILE 581 -11.680 -0.020 -1.493 242 HD12 ILE 581 HD12 ILE 581 -12.793 -1.283 -2.023 243 HD13 ILE 581 HD13 ILE 581 -11.053 -1.486 -2.243 244 H GLN 582 HN GLN 582 -12.911 -5.679 -2.393 245 HA GLN 582 HA GLN 582 -13.815 -7.641 -0.392 246 HB2 GLN 582 HB2 GLN 582 -15.330 -7.503 -2.249 247 HB3 GLN 582 HB1 GLN 582 -14.043 -7.735 -3.395 248 HG2 GLN 582 HG2 GLN 582 -13.634 -9.982 -2.398 249 HG3 GLN 582 HG1 GLN 582 -15.060 -9.740 -1.400 250 HE21 GLN 582 HE21 GLN 582 -14.431 -11.733 -3.480 251 HE22 GLN 582 HE22 GLN 582 -15.723 -11.634 -4.624 252 H LEU 583 HN LEU 583 -12.457 -9.107 0.270 253 HA LEU 583 HA LEU 583 -9.783 -9.179 -0.852 254 HB2 LEU 583 HB2 LEU 583 -10.857 -10.780 1.455 255 HB3 LEU 583 HB1 LEU 583 -9.182 -10.419 1.093 256 HG LEU 583 HG LEU 583 -11.241 -8.382 1.923 257 HD11 LEU 583 HD11 LEU 583 -8.951 -9.523 3.508 258 HD12 LEU 583 HD12 LEU 583 -10.628 -10.056 3.669 259 HD13 LEU 583 HD13 LEU 583 -10.186 -8.391 4.070 260 HD21 LEU 583 HD21 LEU 583 -9.312 -6.889 2.152 261 HD22 LEU 583 HD22 LEU 583 -9.490 -7.454 0.490 262 HD23 LEU 583 HD23 LEU 583 -8.254 -8.158 1.533 263 H ALA 584 HN ALA 584 -8.704 -11.454 -0.935 264 HA ALA 584 HA ALA 584 -9.890 -12.878 -3.016 265 HB1 ALA 584 HB1 ALA 584 -7.484 -12.935 -2.564 266 HB2 ALA 584 HB2 ALA 584 -8.159 -14.557 -2.698 267 HB3 ALA 584 HB3 ALA 584 -7.779 -13.889 -1.111 268 H ASN 585 HN ASN 585 -9.964 -13.447 0.461 269 HA ASN 585 HA ASN 585 -11.280 -15.972 0.277 270 HB2 ASN 585 HB2 ASN 585 -11.541 -15.803 2.694 271 HB3 ASN 585 HB1 ASN 585 -9.905 -15.386 2.220 272 HD21 ASN 585 HD21 ASN 585 -11.178 -14.743 4.653 273 HD22 ASN 585 HD22 ASN 585 -11.246 -13.016 4.766 274 H GLY 586 HN GLY 586 -12.309 -12.806 -0.178 275 HA2 GLY 586 HA2 GLY 586 -14.440 -12.391 -1.120 276 HA3 GLY 586 HA1 GLY 586 -15.077 -13.753 -0.223 277 H GLU 587 HN GLU 587 -13.122 -11.732 1.703 278 HA GLU 587 HA GLU 587 -15.387 -10.883 3.202 279 HB2 GLU 587 HB2 GLU 587 -12.490 -10.218 3.443 280 HB3 GLU 587 HB1 GLU 587 -13.709 -9.571 4.527 281 HG2 GLU 587 HG2 GLU 587 -14.381 -12.014 4.839 282 HG3 GLU 587 HG1 GLU 587 -12.781 -12.368 4.175 283 H LEU 588 HN LEU 588 -16.171 -8.913 3.577 284 HA LEU 588 HA LEU 588 -15.547 -6.881 1.532 285 HB2 LEU 588 HB2 LEU 588 -18.227 -7.395 2.814 286 HB3 LEU 588 HB1 LEU 588 -17.882 -6.315 1.472 287 HG LEU 588 HG LEU 588 -17.629 -9.323 1.399 288 HD11 LEU 588 HD11 LEU 588 -19.689 -7.494 0.175 289 HD12 LEU 588 HD12 LEU 588 -19.945 -8.590 1.533 290 HD13 LEU 588 HD13 LEU 588 -19.577 -9.238 -0.065 291 HD21 LEU 588 HD21 LEU 588 -17.387 -8.919 -1.059 292 HD22 LEU 588 HD22 LEU 588 -16.028 -8.350 -0.088 293 HD23 LEU 588 HD23 LEU 588 -17.218 -7.202 -0.698 294 H LYS 589 HN LYS 589 -14.430 -5.346 2.548 295 HA LYS 589 HA LYS 589 -15.361 -4.448 5.182 296 HB2 LYS 589 HB2 LYS 589 -12.477 -4.974 4.438 297 HB3 LYS 589 HB1 LYS 589 -13.074 -4.437 5.996 298 HG2 LYS 589 HG2 LYS 589 -14.191 -6.526 6.360 299 HG3 LYS 589 HG1 LYS 589 -13.803 -7.062 4.729 300 HD2 LYS 589 HD2 LYS 589 -12.263 -8.164 6.107 301 HD3 LYS 589 HD1 LYS 589 -11.359 -6.821 5.411 302 HE2 LYS 589 HE2 LYS 589 -12.720 -6.463 8.040 303 HE3 LYS 589 HE1 LYS 589 -11.208 -7.365 7.963 304 HZ1 LYS 589 HZ1 LYS 589 -10.072 -5.498 7.144 305 HZ2 LYS 589 HZ2 LYS 589 -11.010 -4.926 8.438 306 HZ3 LYS 589 HZ3 LYS 589 -11.503 -4.641 6.847 307 H LYS 590 HN LYS 590 -14.740 -2.310 5.741 308 HA LYS 590 HA LYS 590 -14.785 -0.484 3.558 309 HB2 LYS 590 HB2 LYS 590 -14.352 -0.071 6.519 310 HB3 LYS 590 HB1 LYS 590 -14.477 1.241 5.358 311 HG2 LYS 590 HG2 LYS 590 -16.639 -0.784 5.500 312 HG3 LYS 590 HG1 LYS 590 -16.553 0.478 6.727 313 HD2 LYS 590 HD2 LYS 590 -16.592 2.170 4.965 314 HD3 LYS 590 HD1 LYS 590 -16.694 0.904 3.743 315 HE2 LYS 590 HE2 LYS 590 -18.815 0.165 4.661 316 HE3 LYS 590 HE1 LYS 590 -18.701 1.372 5.940 317 HZ1 LYS 590 HZ1 LYS 590 -18.819 3.108 4.283 318 HZ2 LYS 590 HZ2 LYS 590 -20.156 2.087 4.140 319 HZ3 LYS 590 HZ3 LYS 590 -18.881 1.971 3.035 320 H VAL 591 HN VAL 591 -13.177 1.006 2.926 321 HA VAL 591 HA VAL 591 -10.762 -0.190 2.335 322 HB VAL 591 HB VAL 591 -11.031 2.796 2.566 323 HG11 VAL 591 HG11 VAL 591 -9.509 2.783 0.655 324 HG12 VAL 591 HG12 VAL 591 -9.483 1.021 0.691 325 HG13 VAL 591 HG13 VAL 591 -8.820 1.940 2.044 326 HG21 VAL 591 HG21 VAL 591 -11.991 1.059 0.306 327 HG22 VAL 591 HG22 VAL 591 -11.947 2.824 0.326 328 HG23 VAL 591 HG23 VAL 591 -13.012 1.956 1.431 329 H GLU 592 HN GLU 592 -11.411 2.247 4.825 330 HA GLU 592 HA GLU 592 -8.695 2.434 5.657 331 HB2 GLU 592 HB2 GLU 592 -9.680 3.723 7.579 332 HB3 GLU 592 HB1 GLU 592 -10.056 4.338 5.975 333 HG2 GLU 592 HG2 GLU 592 -11.968 2.429 7.164 334 HG3 GLU 592 HG1 GLU 592 -11.879 4.032 7.871 335 H ASP 593 HN ASP 593 -11.334 0.417 6.512 336 HA ASP 593 HA ASP 593 -10.290 -0.323 9.094 337 HB2 ASP 593 HB2 ASP 593 -12.701 -0.255 8.775 338 HB3 ASP 593 HB1 ASP 593 -12.595 -1.390 7.437 339 H LEU 594 HN LEU 594 -9.861 -1.348 5.871 340 HA LEU 594 HA LEU 594 -9.253 -4.047 6.166 341 HB2 LEU 594 HB2 LEU 594 -8.014 -2.003 4.329 342 HB3 LEU 594 HB1 LEU 594 -7.826 -3.739 4.166 343 HG LEU 594 HG LEU 594 -10.541 -2.446 4.109 344 HD11 LEU 594 HD11 LEU 594 -10.384 -2.425 1.699 345 HD12 LEU 594 HD12 LEU 594 -8.715 -2.982 1.781 346 HD13 LEU 594 HD13 LEU 594 -9.146 -1.390 2.408 347 HD21 LEU 594 HD21 LEU 594 -10.427 -4.877 4.432 348 HD22 LEU 594 HD22 LEU 594 -9.468 -5.014 2.957 349 HD23 LEU 594 HD23 LEU 594 -11.137 -4.451 2.872 350 H LYS 595 HN LYS 595 -7.807 -5.013 7.334 351 HA LYS 595 HA LYS 595 -5.508 -3.509 8.340 352 HB2 LYS 595 HB2 LYS 595 -6.705 -6.160 9.167 353 HB3 LYS 595 HB1 LYS 595 -5.245 -5.479 9.868 354 HG2 LYS 595 HG2 LYS 595 -7.919 -4.106 9.910 355 HG3 LYS 595 HG1 LYS 595 -7.310 -5.127 11.212 356 HD2 LYS 595 HD2 LYS 595 -5.408 -3.646 11.517 357 HD3 LYS 595 HD1 LYS 595 -5.943 -2.648 10.166 358 HE2 LYS 595 HE2 LYS 595 -7.526 -3.120 12.687 359 HE3 LYS 595 HE1 LYS 595 -6.519 -1.704 12.385 360 HZ1 LYS 595 HZ1 LYS 595 -7.907 -1.104 10.547 361 HZ2 LYS 595 HZ2 LYS 595 -8.890 -1.341 11.901 362 HZ3 LYS 595 HZ3 LYS 595 -8.818 -2.521 10.694 363 H THR 596 HN THR 596 -3.428 -4.820 8.487 364 HA THR 596 HA THR 596 -2.661 -5.498 5.876 365 HB THR 596 HB THR 596 -1.030 -4.672 7.451 366 HG1 THR 596 HG1 THR 596 -0.703 -6.897 5.976 367 HG21 THR 596 HG21 THR 596 -0.244 -6.007 9.318 368 HG22 THR 596 HG22 THR 596 -1.413 -7.269 8.925 369 HG23 THR 596 HG23 THR 596 -1.970 -5.688 9.476 370 H GLU 597 HN GLU 597 -3.662 -7.468 8.615 371 HA GLU 597 HA GLU 597 -2.961 -9.980 7.619 372 HB2 GLU 597 HB2 GLU 597 -5.143 -9.135 9.494 373 HB3 GLU 597 HB1 GLU 597 -4.786 -10.817 9.141 374 HG2 GLU 597 HG2 GLU 597 -2.559 -10.570 10.029 375 HG3 GLU 597 HG1 GLU 597 -2.824 -8.847 10.289 376 H ASP 598 HN ASP 598 -5.644 -7.895 6.872 377 HA ASP 598 HA ASP 598 -7.337 -9.766 5.638 378 HB2 ASP 598 HB2 ASP 598 -6.942 -6.811 5.167 379 HB3 ASP 598 HB1 ASP 598 -8.155 -7.748 4.310 380 H PHE 599 HN PHE 599 -4.832 -7.664 4.292 381 HA PHE 599 HA PHE 599 -5.082 -8.759 1.670 382 HB2 PHE 599 HB2 PHE 599 -3.123 -6.875 2.957 383 HB3 PHE 599 HB1 PHE 599 -2.832 -7.512 1.343 384 HD1 PHE 599 HD2 PHE 599 -5.986 -6.398 2.993 385 HD2 PHE 599 HD1 PHE 599 -3.185 -5.791 -0.153 386 HE1 PHE 599 HE2 PHE 599 -7.456 -4.686 2.020 387 HE2 PHE 599 HE1 PHE 599 -4.657 -4.078 -1.133 388 HZ PHE 599 HZ PHE 599 -6.793 -3.525 -0.046 389 H ILE 600 HN ILE 600 -2.962 -9.304 4.439 390 HA ILE 600 HA ILE 600 -1.173 -11.085 3.297 391 HB ILE 600 HB ILE 600 -2.378 -10.961 6.047 392 HG12 ILE 600 HG12 ILE 600 0.366 -10.253 4.999 393 HG13 ILE 600 HG11 ILE 600 -0.929 -9.108 5.294 394 HG21 ILE 600 HG21 ILE 600 -0.160 -12.759 5.083 395 HG22 ILE 600 HG22 ILE 600 -1.729 -13.258 5.726 396 HG23 ILE 600 HG23 ILE 600 -0.553 -12.465 6.777 397 HD11 ILE 600 HD11 ILE 600 0.393 -10.815 7.382 398 HD12 ILE 600 HD12 ILE 600 -0.876 -9.621 7.656 399 HD13 ILE 600 HD13 ILE 600 0.712 -9.104 7.088 400 H GLN 601 HN GLN 601 -4.248 -11.883 4.945 401 HA GLN 601 HA GLN 601 -4.127 -14.627 4.487 402 HB2 GLN 601 HB2 GLN 601 -6.420 -12.769 5.011 403 HB3 GLN 601 HB1 GLN 601 -6.694 -14.482 4.713 404 HG2 GLN 601 HG2 GLN 601 -5.137 -14.994 6.553 405 HG3 GLN 601 HG1 GLN 601 -5.041 -13.266 6.905 406 HE21 GLN 601 HE21 GLN 601 -6.820 -12.229 7.786 407 HE22 GLN 601 HE22 GLN 601 -8.128 -13.094 8.509 408 H SER 602 HN SER 602 -5.760 -12.128 2.569 409 HA SER 602 HA SER 602 -7.030 -13.786 0.757 410 HB2 SER 602 HB2 SER 602 -6.764 -11.776 -0.826 411 HB3 SER 602 HB1 SER 602 -7.588 -11.517 0.699 412 HG SER 602 HG SER 602 -5.934 -10.394 1.463 413 H ALA 603 HN ALA 603 -3.827 -12.318 0.456 414 HA ALA 603 HA ALA 603 -3.134 -13.601 -1.968 415 HB1 ALA 603 HB1 ALA 603 -1.278 -12.585 0.164 416 HB2 ALA 603 HB2 ALA 603 -2.021 -11.583 -1.083 417 HB3 ALA 603 HB3 ALA 603 -0.888 -12.856 -1.534 418 H GLU 604 HN GLU 604 -2.795 -14.572 1.399 419 HA GLU 604 HA GLU 604 -0.959 -16.704 0.946 420 HB2 GLU 604 HB2 GLU 604 -2.863 -16.085 3.198 421 HB3 GLU 604 HB1 GLU 604 -1.737 -17.432 3.233 422 HG2 GLU 604 HG2 GLU 604 -0.780 -14.650 2.727 423 HG3 GLU 604 HG1 GLU 604 -1.092 -15.217 4.363 424 H ILE 605 HN ILE 605 -4.429 -16.429 1.035 425 HA ILE 605 HA ILE 605 -5.023 -19.201 0.769 426 HB ILE 605 HB ILE 605 -6.695 -16.784 0.026 427 HG12 ILE 605 HG12 ILE 605 -6.644 -18.369 2.598 428 HG13 ILE 605 HG11 ILE 605 -5.787 -16.858 2.368 429 HG21 ILE 605 HG21 ILE 605 -8.621 -18.242 0.320 430 HG22 ILE 605 HG22 ILE 605 -7.557 -19.601 0.689 431 HG23 ILE 605 HG23 ILE 605 -7.550 -18.889 -0.924 432 HD11 ILE 605 HD11 ILE 605 -8.762 -17.278 2.359 433 HD12 ILE 605 HD12 ILE 605 -7.970 -15.768 1.911 434 HD13 ILE 605 HD13 ILE 605 -7.787 -16.402 3.550 435 H SER 606 HN SER 606 -3.747 -16.879 -1.292 436 HA SER 606 HA SER 606 -2.860 -16.987 -3.347 437 HB2 SER 606 HB2 SER 606 -2.061 -19.214 -4.093 438 HB3 SER 606 HB1 SER 606 -1.659 -18.853 -2.419 439 HG SER 606 HG SER 606 -4.033 -20.083 -2.495 440 H ASN 607 HN ASN 607 -4.528 -16.063 -4.472 441 HA ASN 607 HA ASN 607 -5.757 -17.936 -6.371 442 HB2 ASN 607 HB2 ASN 607 -7.426 -16.868 -4.763 443 HB3 ASN 607 HB1 ASN 607 -7.033 -15.329 -5.521 444 HD21 ASN 607 HD21 ASN 607 -7.774 -14.900 -7.584 445 HD22 ASN 607 HD22 ASN 607 -8.937 -15.896 -8.386 446 H ASP 608 HN ASP 608 -3.477 -17.333 -7.156 447 HA ASP 608 HA ASP 608 -2.133 -16.308 -8.685 448 HB2 ASP 608 HB2 ASP 608 -4.683 -14.895 -9.502 449 HB3 ASP 608 HB1 ASP 608 -3.168 -14.819 -10.392 450 H LEU 609 HN LEU 609 -2.277 -15.340 -6.068 451 HA LEU 609 HA LEU 609 -1.577 -12.525 -6.375 452 HB2 LEU 609 HB2 LEU 609 -3.656 -13.466 -4.386 453 HB3 LEU 609 HB1 LEU 609 -3.083 -11.823 -4.587 454 HG LEU 609 HG LEU 609 -4.378 -13.220 -6.897 455 HD11 LEU 609 HD11 LEU 609 -5.833 -13.401 -4.807 456 HD12 LEU 609 HD12 LEU 609 -6.543 -12.667 -6.242 457 HD13 LEU 609 HD13 LEU 609 -5.987 -11.645 -4.919 458 HD21 LEU 609 HD21 LEU 609 -3.286 -11.103 -7.297 459 HD22 LEU 609 HD22 LEU 609 -4.217 -10.353 -6.001 460 HD23 LEU 609 HD23 LEU 609 -5.032 -10.927 -7.454 461 H LYS 610 HN LYS 610 0.057 -11.945 -4.977 462 HA LYS 610 HA LYS 610 0.696 -13.762 -2.757 463 HB2 LYS 610 HB2 LYS 610 2.762 -12.846 -4.761 464 HB3 LYS 610 HB1 LYS 610 3.028 -13.901 -3.387 465 HG2 LYS 610 HG2 LYS 610 1.739 -15.652 -4.414 466 HG3 LYS 610 HG1 LYS 610 1.293 -14.586 -5.750 467 HD2 LYS 610 HD2 LYS 610 3.702 -14.372 -6.311 468 HD3 LYS 610 HD1 LYS 610 4.063 -15.556 -5.055 469 HE2 LYS 610 HE2 LYS 610 2.743 -17.226 -6.221 470 HE3 LYS 610 HE1 LYS 610 2.295 -16.040 -7.449 471 HZ1 LYS 610 HZ1 LYS 610 4.571 -15.886 -8.137 472 HZ2 LYS 610 HZ2 LYS 610 4.121 -17.515 -8.139 473 HZ3 LYS 610 HZ3 LYS 610 5.079 -16.907 -6.888 474 H ILE 611 HN ILE 611 1.563 -12.788 -1.000 475 HA ILE 611 HA ILE 611 1.891 -9.904 -0.960 476 HB ILE 611 HB ILE 611 2.228 -11.982 1.192 477 HG12 ILE 611 HG12 ILE 611 -0.087 -11.268 0.153 478 HG13 ILE 611 HG11 ILE 611 0.087 -11.550 1.873 479 HG21 ILE 611 HG21 ILE 611 2.301 -8.994 1.458 480 HG22 ILE 611 HG22 ILE 611 3.663 -10.094 1.663 481 HG23 ILE 611 HG23 ILE 611 2.307 -10.145 2.791 482 HD11 ILE 611 HD11 ILE 611 0.295 -9.134 2.232 483 HD12 ILE 611 HD12 ILE 611 -1.224 -9.560 1.437 484 HD13 ILE 611 HD13 ILE 611 0.105 -8.875 0.497 485 H ASP 612 HN ASP 612 3.833 -8.869 -0.487 486 HA ASP 612 HA ASP 612 6.275 -10.516 -0.537 487 HB2 ASP 612 HB2 ASP 612 5.649 -8.911 -2.600 488 HB3 ASP 612 HB1 ASP 612 6.430 -7.720 -1.551 489 H SER 613 HN SER 613 8.175 -9.252 0.378 490 HA SER 613 HA SER 613 7.291 -7.408 2.475 491 HB2 SER 613 HB2 SER 613 8.900 -8.544 4.057 492 HB3 SER 613 HB1 SER 613 7.477 -9.495 3.633 493 HG SER 613 HG SER 613 9.519 -9.923 1.898 494 H SER 614 HN SER 614 8.269 -5.565 2.124 495 HA SER 614 HA SER 614 11.145 -5.579 1.519 496 HB2 SER 614 HB2 SER 614 9.125 -3.794 0.129 497 HB3 SER 614 HB1 SER 614 10.861 -3.854 -0.175 498 HG SER 614 HG SER 614 9.852 -6.320 -0.404 499 H THR 615 HN THR 615 11.966 -4.709 3.330 500 HA THR 615 HA THR 615 10.450 -2.827 4.906 501 HB THR 615 HB THR 615 13.234 -3.898 5.345 502 HG1 THR 615 HG1 THR 615 12.007 -5.646 5.629 503 HG21 THR 615 HG21 THR 615 12.880 -3.202 7.681 504 HG22 THR 615 HG22 THR 615 11.337 -2.480 7.227 505 HG23 THR 615 HG23 THR 615 12.841 -1.827 6.576 506 H VAL 616 HN VAL 616 10.411 -0.727 4.433 507 HA VAL 616 HA VAL 616 12.322 0.659 2.946 508 HB VAL 616 HB VAL 616 10.267 1.735 3.117 509 HG11 VAL 616 HG11 VAL 616 9.186 2.340 5.239 510 HG12 VAL 616 HG12 VAL 616 10.452 1.468 6.097 511 HG13 VAL 616 HG13 VAL 616 9.361 0.600 5.023 512 HG21 VAL 616 HG21 VAL 616 11.915 3.431 3.222 513 HG22 VAL 616 HG22 VAL 616 12.213 3.127 4.932 514 HG23 VAL 616 HG23 VAL 616 10.690 3.862 4.424 515 H GLU 617 HN GLU 617 14.287 1.287 3.377 516 HA GLU 617 HA GLU 617 15.211 1.282 6.158 517 HB2 GLU 617 HB2 GLU 617 16.813 1.100 3.617 518 HB3 GLU 617 HB1 GLU 617 17.479 1.056 5.240 519 HG2 GLU 617 HG2 GLU 617 15.820 -0.954 5.504 520 HG3 GLU 617 HG1 GLU 617 15.946 -1.007 3.752 521 H ARG 618 HN ARG 618 14.492 3.325 3.527 522 HA ARG 618 HA ARG 618 15.356 5.633 5.023 523 HB2 ARG 618 HB2 ARG 618 17.429 5.029 3.875 524 HB3 ARG 618 HB1 ARG 618 16.595 5.026 2.330 525 HG2 ARG 618 HG2 ARG 618 16.160 7.439 2.590 526 HG3 ARG 618 HG1 ARG 618 17.067 7.416 4.104 527 HD2 ARG 618 HD2 ARG 618 18.147 6.707 1.378 528 HD3 ARG 618 HD1 ARG 618 18.450 8.208 2.251 529 HE ARG 618 HE ARG 618 19.349 6.468 4.017 530 HH11 ARG 618 HH11 ARG 618 19.836 6.545 0.553 531 HH12 ARG 618 HH12 ARG 618 21.377 5.756 0.628 532 HH21 ARG 618 HH21 ARG 618 21.364 5.434 4.123 533 HH22 ARG 618 HH22 ARG 618 22.250 5.115 2.665 534 H ILE 619 HN ILE 619 14.548 7.628 4.116 535 HA ILE 619 HA ILE 619 12.564 7.384 1.993 536 HB ILE 619 HB ILE 619 11.950 8.306 4.809 537 HG12 ILE 619 HG12 ILE 619 10.526 6.377 2.972 538 HG13 ILE 619 HG11 ILE 619 11.663 5.903 4.227 539 HG21 ILE 619 HG21 ILE 619 10.321 8.796 2.304 540 HG22 ILE 619 HG22 ILE 619 11.115 10.020 3.295 541 HG23 ILE 619 HG23 ILE 619 9.770 9.089 3.953 542 HD11 ILE 619 HD11 ILE 619 10.185 6.840 5.922 543 HD12 ILE 619 HD12 ILE 619 9.355 5.627 4.947 544 HD13 ILE 619 HD13 ILE 619 9.054 7.341 4.664 545 H GLU 620 HN GLU 620 12.774 9.037 0.651 546 HA GLU 620 HA GLU 620 13.989 11.516 1.680 547 HB2 GLU 620 HB2 GLU 620 14.531 10.341 -1.043 548 HB3 GLU 620 HB1 GLU 620 15.295 11.744 -0.322 549 HG2 GLU 620 HG2 GLU 620 16.371 10.340 1.330 550 HG3 GLU 620 HG1 GLU 620 15.560 8.915 0.668 551 H ASP 621 HN ASP 621 13.105 13.385 0.974 552 HA ASP 621 HA ASP 621 10.693 13.200 -0.629 553 HB2 ASP 621 HB2 ASP 621 10.376 15.573 -0.054 554 HB3 ASP 621 HB1 ASP 621 10.640 14.598 1.386 555 H SER 622 HN SER 622 10.565 13.746 -2.710 556 HA SER 622 HA SER 622 13.002 14.662 -4.021 557 HB2 SER 622 HB2 SER 622 10.653 13.002 -4.780 558 HB3 SER 622 HB1 SER 622 11.428 13.933 -6.052 559 HG SER 622 HG SER 622 12.622 12.154 -6.075 560 H HIS 623 HN HIS 623 12.925 16.333 -5.575 561 HA HIS 623 HA HIS 623 11.223 18.521 -4.884 562 HB2 HIS 623 HB2 HIS 623 13.571 18.811 -5.634 563 HB3 HIS 623 HB1 HIS 623 13.115 18.230 -7.230 564 HD1 HIS 623 HD1 HIS 623 12.429 21.139 -4.893 565 HD2 HIS 623 HD2 HIS 623 12.180 20.160 -8.927 566 HE1 HIS 623 HE1 HIS 623 11.867 23.284 -6.077 567 HE2 HIS 623 HE2 HIS 623 11.889 22.699 -8.523 568 H SER 624 HN SER 624 11.017 15.945 -7.119 569 HA SER 624 HA SER 624 9.074 16.941 -8.864 570 HB2 SER 624 HB2 SER 624 9.246 14.155 -7.684 571 HB3 SER 624 HB1 SER 624 8.447 14.609 -9.188 572 HG SER 624 HG SER 624 10.849 15.506 -9.471 573 HA PRO 625 HA PRO 625 5.957 18.086 -6.101 574 HB2 PRO 625 HB2 PRO 625 3.780 18.120 -7.634 575 HB3 PRO 625 HB1 PRO 625 5.126 19.254 -7.854 576 HG2 PRO 625 HG2 PRO 625 4.628 16.660 -9.238 577 HG3 PRO 625 HG1 PRO 625 4.922 18.240 -9.988 578 HD2 PRO 625 HD2 PRO 625 6.899 16.471 -9.719 579 HD3 PRO 625 HD1 PRO 625 7.193 18.196 -9.396 580 H GLY 626 HN GLY 626 5.245 17.081 -4.465 581 HA2 GLY 626 HA2 GLY 626 4.073 15.618 -3.153 582 HA3 GLY 626 HA1 GLY 626 3.137 15.194 -4.579 583 H VAL 627 HN VAL 627 6.620 14.891 -4.450 584 HA VAL 627 HA VAL 627 6.251 11.978 -4.659 585 HB VAL 627 HB VAL 627 8.494 13.631 -5.831 586 HG11 VAL 627 HG11 VAL 627 7.832 10.704 -6.156 587 HG12 VAL 627 HG12 VAL 627 9.191 11.366 -5.248 588 HG13 VAL 627 HG13 VAL 627 9.116 11.575 -6.997 589 HG21 VAL 627 HG21 VAL 627 6.464 14.089 -7.018 590 HG22 VAL 627 HG22 VAL 627 6.081 12.372 -7.111 591 HG23 VAL 627 HG23 VAL 627 7.459 13.016 -8.004 592 H ALA 628 HN ALA 628 7.124 10.746 -3.184 593 HA ALA 628 HA ALA 628 9.661 11.576 -1.966 594 HB1 ALA 628 HB1 ALA 628 7.947 11.866 -0.243 595 HB2 ALA 628 HB2 ALA 628 9.022 10.520 0.153 596 HB3 ALA 628 HB3 ALA 628 7.409 10.204 -0.491 597 H VAL 629 HN VAL 629 11.172 10.106 -2.189 598 HA VAL 629 HA VAL 629 10.424 7.582 -3.419 599 HB VAL 629 HB VAL 629 12.154 8.400 -4.676 600 HG11 VAL 629 HG11 VAL 629 13.429 9.408 -2.148 601 HG12 VAL 629 HG12 VAL 629 12.571 10.370 -3.361 602 HG13 VAL 629 HG13 VAL 629 14.105 9.589 -3.768 603 HG21 VAL 629 HG21 VAL 629 12.762 6.151 -3.884 604 HG22 VAL 629 HG22 VAL 629 13.648 6.875 -2.538 605 HG23 VAL 629 HG23 VAL 629 14.187 7.146 -4.195 606 H ILE 630 HN ILE 630 9.992 5.974 -2.168 607 HA ILE 630 HA ILE 630 11.169 5.818 0.485 608 HB ILE 630 HB ILE 630 9.274 3.816 -0.703 609 HG12 ILE 630 HG12 ILE 630 8.290 6.044 -1.055 610 HG13 ILE 630 HG11 ILE 630 7.405 5.134 0.163 611 HG21 ILE 630 HG21 ILE 630 9.747 4.773 2.108 612 HG22 ILE 630 HG22 ILE 630 10.358 3.274 1.414 613 HG23 ILE 630 HG23 ILE 630 8.623 3.508 1.622 614 HD11 ILE 630 HD11 ILE 630 7.660 7.447 0.820 615 HD12 ILE 630 HD12 ILE 630 9.413 7.306 0.686 616 HD13 ILE 630 HD13 ILE 630 8.545 6.388 1.918 617 H GLN 631 HN GLN 631 13.009 4.756 0.784 618 HA GLN 631 HA GLN 631 13.995 2.984 -1.313 619 HB2 GLN 631 HB2 GLN 631 15.451 4.776 -0.447 620 HB3 GLN 631 HB1 GLN 631 15.356 4.069 1.157 621 HG2 GLN 631 HG2 GLN 631 16.500 2.087 0.395 622 HG3 GLN 631 HG1 GLN 631 16.523 2.707 -1.256 623 HE21 GLN 631 HE21 GLN 631 18.727 1.939 0.477 624 HE22 GLN 631 HE22 GLN 631 19.745 3.334 0.598 625 H PHE 632 HN PHE 632 13.688 0.870 -1.158 626 HA PHE 632 HA PHE 632 13.106 -0.266 1.498 627 HB2 PHE 632 HB2 PHE 632 12.208 -1.164 -1.241 628 HB3 PHE 632 HB1 PHE 632 11.895 -2.046 0.247 629 HD1 PHE 632 HD1 PHE 632 10.352 -1.137 1.920 630 HD2 PHE 632 HD2 PHE 632 10.937 0.756 -1.841 631 HE1 PHE 632 HE1 PHE 632 8.253 0.104 2.223 632 HE2 PHE 632 HE2 PHE 632 8.838 2.000 -1.548 633 HZ PHE 632 HZ PHE 632 7.491 1.675 0.489 634 H ALA 633 HN ALA 633 14.003 -2.154 2.144 635 HA ALA 633 HA ALA 633 16.146 -3.307 0.516 636 HB1 ALA 633 HB1 ALA 633 16.724 -4.536 2.574 637 HB2 ALA 633 HB2 ALA 633 15.361 -3.772 3.394 638 HB3 ALA 633 HB3 ALA 633 16.711 -2.790 2.825 639 H VAL 634 HN VAL 634 15.190 -4.608 -0.955 640 HA VAL 634 HA VAL 634 12.863 -6.189 -0.258 641 HB VAL 634 HB VAL 634 14.398 -5.981 -2.850 642 HG11 VAL 634 HG11 VAL 634 12.420 -7.022 -3.872 643 HG12 VAL 634 HG12 VAL 634 11.723 -7.248 -2.268 644 HG13 VAL 634 HG13 VAL 634 13.206 -8.093 -2.712 645 HG21 VAL 634 HG21 VAL 634 13.364 -3.875 -2.222 646 HG22 VAL 634 HG22 VAL 634 11.820 -4.689 -1.969 647 HG23 VAL 634 HG23 VAL 634 12.511 -4.592 -3.588 648 H GLY 635 HN GLY 635 12.875 -8.259 0.311 649 HA2 GLY 635 HA2 GLY 635 13.472 -10.497 0.247 650 HA3 GLY 635 HA1 GLY 635 14.853 -10.071 -0.750 651 H GLU 636 HN GLU 636 15.589 -11.841 0.850 652 HA GLU 636 HA GLU 636 16.138 -11.007 3.532 653 HB2 GLU 636 HB2 GLU 636 17.179 -13.368 1.983 654 HB3 GLU 636 HB1 GLU 636 17.299 -13.147 3.719 655 HG2 GLU 636 HG2 GLU 636 14.762 -13.465 2.137 656 HG3 GLU 636 HG1 GLU 636 15.510 -14.679 3.173 657 H HIS 637 HN HIS 637 17.755 -10.771 0.508 658 HA HIS 637 HA HIS 637 20.371 -10.361 1.690 659 HB2 HIS 637 HB2 HIS 637 19.395 -10.102 -1.159 660 HB3 HIS 637 HB1 HIS 637 21.060 -9.822 -0.663 661 HD1 HIS 637 HD1 HIS 637 19.161 -12.313 -2.199 662 HD2 HIS 637 HD2 HIS 637 21.936 -12.357 0.893 663 HE1 HIS 637 HE1 HIS 637 19.984 -14.682 -2.064 664 HE2 HIS 637 HE2 HIS 637 21.519 -14.719 -0.070 665 H ARG 638 HN ARG 638 17.651 -8.565 1.405 666 HA ARG 638 HA ARG 638 17.118 -6.388 1.656 667 HB2 ARG 638 HB2 ARG 638 20.000 -6.151 2.533 668 HB3 ARG 638 HB1 ARG 638 18.793 -4.889 2.720 669 HG2 ARG 638 HG2 ARG 638 17.471 -6.412 4.139 670 HG3 ARG 638 HG1 ARG 638 18.758 -7.611 4.002 671 HD2 ARG 638 HD2 ARG 638 20.325 -6.007 5.011 672 HD3 ARG 638 HD1 ARG 638 19.008 -4.850 5.186 673 HE ARG 638 HE ARG 638 18.885 -7.484 6.494 674 HH11 ARG 638 HH11 ARG 638 18.816 -3.984 6.661 675 HH12 ARG 638 HH12 ARG 638 18.427 -3.950 8.351 676 HH21 ARG 638 HH21 ARG 638 18.370 -7.436 8.722 677 HH22 ARG 638 HH22 ARG 638 18.171 -5.909 9.522 678 H ALA 639 HN ALA 639 17.374 -6.962 -0.885 679 HA ALA 639 HA ALA 639 19.330 -5.467 -2.312 680 HB1 ALA 639 HB1 ALA 639 16.643 -6.480 -3.244 681 HB2 ALA 639 HB2 ALA 639 18.163 -7.369 -3.322 682 HB3 ALA 639 HB3 ALA 639 17.951 -5.902 -4.278 683 H GLN 640 HN GLN 640 19.414 -3.356 -2.615 684 HA GLN 640 HA GLN 640 17.439 -1.699 -1.415 685 HB2 GLN 640 HB2 GLN 640 19.999 -1.186 -2.824 686 HB3 GLN 640 HB1 GLN 640 18.874 0.141 -2.565 687 HG2 GLN 640 HG2 GLN 640 20.437 -1.428 -0.591 688 HG3 GLN 640 HG1 GLN 640 20.151 0.296 -0.729 689 HE21 GLN 640 HE21 GLN 640 18.922 -2.684 0.493 690 HE22 GLN 640 HE22 GLN 640 17.704 -1.974 1.492 691 H VAL 641 HN VAL 641 16.185 -0.177 -2.288 692 HA VAL 641 HA VAL 641 15.757 -0.070 -5.159 693 HB VAL 641 HB VAL 641 13.593 -1.029 -3.269 694 HG11 VAL 641 HG11 VAL 641 12.680 0.654 -4.773 695 HG12 VAL 641 HG12 VAL 641 12.083 -0.949 -5.203 696 HG13 VAL 641 HG13 VAL 641 13.358 -0.196 -6.161 697 HG21 VAL 641 HG21 VAL 641 15.039 -2.807 -4.079 698 HG22 VAL 641 HG22 VAL 641 14.792 -2.273 -5.740 699 HG23 VAL 641 HG23 VAL 641 13.441 -2.931 -4.817 700 H SER 642 HN SER 642 15.769 2.052 -5.492 701 HA SER 642 HA SER 642 14.391 3.779 -3.561 702 HB2 SER 642 HB2 SER 642 15.610 5.637 -4.712 703 HB3 SER 642 HB1 SER 642 16.685 4.449 -3.980 704 HG SER 642 HG SER 642 16.185 5.005 -6.668 705 H VAL 643 HN VAL 643 12.288 3.879 -4.108 706 HA VAL 643 HA VAL 643 11.653 4.260 -6.942 707 HB VAL 643 HB VAL 643 10.803 2.155 -6.128 708 HG11 VAL 643 HG11 VAL 643 9.370 3.734 -3.999 709 HG12 VAL 643 HG12 VAL 643 10.707 2.611 -3.748 710 HG13 VAL 643 HG13 VAL 643 9.150 2.016 -4.325 711 HG21 VAL 643 HG21 VAL 643 8.687 4.240 -6.505 712 HG22 VAL 643 HG22 VAL 643 8.373 2.506 -6.522 713 HG23 VAL 643 HG23 VAL 643 9.432 3.226 -7.735 714 H GLU 644 HN GLU 644 10.856 6.160 -7.485 715 HA GLU 644 HA GLU 644 10.143 8.076 -5.424 716 HB2 GLU 644 HB2 GLU 644 10.429 8.322 -8.424 717 HB3 GLU 644 HB1 GLU 644 10.004 9.661 -7.366 718 HG2 GLU 644 HG2 GLU 644 12.107 9.574 -6.273 719 HG3 GLU 644 HG1 GLU 644 12.523 8.053 -7.056 720 H VAL 645 HN VAL 645 8.141 7.826 -4.643 721 HA VAL 645 HA VAL 645 5.946 7.291 -6.508 722 HB VAL 645 HB VAL 645 6.534 6.400 -3.702 723 HG11 VAL 645 HG11 VAL 645 4.291 7.405 -3.766 724 HG12 VAL 645 HG12 VAL 645 4.296 5.680 -3.384 725 HG13 VAL 645 HG13 VAL 645 3.839 6.225 -4.998 726 HG21 VAL 645 HG21 VAL 645 5.974 4.199 -4.610 727 HG22 VAL 645 HG22 VAL 645 7.247 4.974 -5.545 728 HG23 VAL 645 HG23 VAL 645 5.599 4.934 -6.167 729 H LEU 646 HN LEU 646 3.978 8.455 -6.152 730 HA LEU 646 HA LEU 646 4.286 11.021 -4.974 731 HB2 LEU 646 HB2 LEU 646 1.767 9.640 -5.877 732 HB3 LEU 646 HB1 LEU 646 1.835 11.291 -5.297 733 HG LEU 646 HG LEU 646 2.669 10.164 -7.896 734 HD11 LEU 646 HD11 LEU 646 1.661 12.889 -7.106 735 HD12 LEU 646 HD12 LEU 646 0.621 11.530 -7.544 736 HD13 LEU 646 HD13 LEU 646 1.734 12.208 -8.733 737 HD21 LEU 646 HD21 LEU 646 4.069 12.492 -6.620 738 HD22 LEU 646 HD22 LEU 646 4.184 12.035 -8.321 739 HD23 LEU 646 HD23 LEU 646 4.789 10.947 -7.072 740 H VAL 647 HN VAL 647 3.581 11.800 -3.070 741 HA VAL 647 HA VAL 647 3.659 9.981 -0.917 742 HB VAL 647 HB VAL 647 3.229 11.965 0.513 743 HG11 VAL 647 HG11 VAL 647 5.304 12.316 -1.644 744 HG12 VAL 647 HG12 VAL 647 5.491 11.395 -0.153 745 HG13 VAL 647 HG13 VAL 647 5.296 13.145 -0.088 746 HG21 VAL 647 HG21 VAL 647 3.159 14.187 -0.574 747 HG22 VAL 647 HG22 VAL 647 1.734 13.212 -0.924 748 HG23 VAL 647 HG23 VAL 647 2.999 13.390 -2.141 749 H GLU 648 HN GLU 648 1.070 10.727 -2.876 750 HA GLU 648 HA GLU 648 -0.945 10.542 -0.801 751 HB2 GLU 648 HB2 GLU 648 -2.544 10.580 -2.760 752 HB3 GLU 648 HB1 GLU 648 -1.547 12.010 -2.550 753 HG2 GLU 648 HG2 GLU 648 -0.086 11.301 -4.324 754 HG3 GLU 648 HG1 GLU 648 -0.979 9.789 -4.499 755 H TYR 649 HN TYR 649 0.930 8.354 -2.540 756 HA TYR 649 HA TYR 649 -1.033 6.303 -2.857 757 HB2 TYR 649 HB2 TYR 649 1.962 6.396 -3.082 758 HB3 TYR 649 HB1 TYR 649 1.094 4.870 -3.125 759 HD1 TYR 649 HD1 TYR 649 -0.440 4.354 -4.983 760 HD2 TYR 649 HD2 TYR 649 1.868 7.923 -4.931 761 HE1 TYR 649 HE1 TYR 649 -0.883 4.669 -7.383 762 HE2 TYR 649 HE2 TYR 649 1.429 8.248 -7.327 763 HH TYR 649 HH TYR 649 -0.942 6.605 -9.006 764 HA PRO 650 HA PRO 650 -0.663 5.063 1.426 765 HB2 PRO 650 HB2 PRO 650 -2.959 3.448 1.203 766 HB3 PRO 650 HB1 PRO 650 -2.883 5.094 1.817 767 HG2 PRO 650 HG2 PRO 650 -4.160 4.245 -0.534 768 HG3 PRO 650 HG1 PRO 650 -3.834 5.917 -0.056 769 HD2 PRO 650 HD2 PRO 650 -2.374 4.173 -1.957 770 HD3 PRO 650 HD1 PRO 650 -2.570 5.937 -1.956 771 H PHE 651 HN PHE 651 0.858 3.589 1.817 772 HA PHE 651 HA PHE 651 0.931 1.129 0.267 773 HB2 PHE 651 HB2 PHE 651 2.891 2.420 2.154 774 HB3 PHE 651 HB1 PHE 651 3.119 0.791 1.526 775 HD1 PHE 651 HD1 PHE 651 2.944 4.353 0.635 776 HD2 PHE 651 HD2 PHE 651 3.822 0.415 -0.704 777 HE1 PHE 651 HE1 PHE 651 3.993 5.278 -1.387 778 HE2 PHE 651 HE2 PHE 651 4.875 1.331 -2.728 779 HZ PHE 651 HZ PHE 651 4.960 3.765 -3.069 780 H PHE 652 HN PHE 652 0.159 -0.706 0.999 781 HA PHE 652 HA PHE 652 -0.723 -1.019 3.699 782 HB2 PHE 652 HB2 PHE 652 -1.145 -2.362 1.240 783 HB3 PHE 652 HB1 PHE 652 -0.459 -3.541 2.356 784 HD1 PHE 652 HD2 PHE 652 -1.513 -3.650 4.699 785 HD2 PHE 652 HD1 PHE 652 -3.405 -1.883 1.327 786 HE1 PHE 652 HE2 PHE 652 -3.687 -3.872 5.812 787 HE2 PHE 652 HE1 PHE 652 -5.588 -2.095 2.438 788 HZ PHE 652 HZ PHE 652 -5.733 -3.090 4.685 789 H VAL 653 HN VAL 653 0.332 -1.982 5.381 790 HA VAL 653 HA VAL 653 3.171 -2.494 4.815 791 HB VAL 653 HB VAL 653 2.072 -1.459 7.429 792 HG11 VAL 653 HG11 VAL 653 4.326 -0.747 7.820 793 HG12 VAL 653 HG12 VAL 653 4.817 -1.305 6.218 794 HG13 VAL 653 HG13 VAL 653 4.318 -2.469 7.449 795 HG21 VAL 653 HG21 VAL 653 1.500 0.302 6.051 796 HG22 VAL 653 HG22 VAL 653 2.836 -0.003 4.943 797 HG23 VAL 653 HG23 VAL 653 3.156 0.723 6.520 798 H PHE 654 HN PHE 654 3.976 -4.364 5.264 799 HA PHE 654 HA PHE 654 2.435 -6.626 5.678 800 HB2 PHE 654 HB2 PHE 654 4.602 -6.466 4.484 801 HB3 PHE 654 HB1 PHE 654 5.446 -6.348 6.020 802 HD1 PHE 654 HD1 PHE 654 2.822 -8.570 4.522 803 HD2 PHE 654 HD2 PHE 654 6.474 -8.271 6.683 804 HE1 PHE 654 HE1 PHE 654 2.948 -11.024 4.645 805 HE2 PHE 654 HE2 PHE 654 6.606 -10.723 6.809 806 HZ PHE 654 HZ PHE 654 4.841 -12.102 5.789 807 H GLY 655 HN GLY 655 1.266 -6.493 7.660 808 HA2 GLY 655 HA2 GLY 655 1.018 -7.412 9.793 809 HA3 GLY 655 HA1 GLY 655 2.758 -7.635 9.870 810 H GLN 656 HN GLN 656 1.885 -4.527 8.901 811 HA GLN 656 HA GLN 656 2.409 -3.536 11.624 812 HB2 GLN 656 HB2 GLN 656 3.201 -2.412 8.953 813 HB3 GLN 656 HB1 GLN 656 3.249 -1.447 10.415 814 HG2 GLN 656 HG2 GLN 656 5.282 -2.217 10.783 815 HG3 GLN 656 HG1 GLN 656 4.589 -3.807 11.002 816 HE21 GLN 656 HE21 GLN 656 3.742 -4.030 8.275 817 HE22 GLN 656 HE22 GLN 656 5.144 -4.341 7.297 818 H GLY 657 HN GLY 657 0.608 -2.829 8.613 819 HA2 GLY 657 HA2 GLY 657 -1.845 -2.508 9.566 820 HA3 GLY 657 HA1 GLY 657 -1.110 -1.013 10.113 821 H TRP 658 HN TRP 658 -2.458 0.256 8.914 822 HA TRP 658 HA TRP 658 -2.319 0.023 5.983 823 HB2 TRP 658 HB2 TRP 658 -4.543 -0.408 7.142 824 HB3 TRP 658 HB1 TRP 658 -4.533 1.266 7.653 825 HD1 TRP 658 HD1 TRP 658 -6.923 1.245 6.341 826 HE1 TRP 658 HE1 TRP 658 -7.466 1.774 3.893 827 HE3 TRP 658 HE3 TRP 658 -2.253 0.652 4.295 828 HZ2 TRP 658 HZ2 TRP 658 -6.122 1.937 1.438 829 HZ3 TRP 658 HZ3 TRP 658 -1.993 1.014 1.884 830 HH2 TRP 658 HH2 TRP 658 -3.882 1.647 0.490 831 H SER 659 HN SER 659 -0.925 1.595 5.210 832 HA SER 659 HA SER 659 -0.824 4.140 6.682 833 HB2 SER 659 HB2 SER 659 1.567 2.462 5.880 834 HB3 SER 659 HB1 SER 659 1.644 4.053 6.630 835 HG SER 659 HG SER 659 1.775 2.009 7.985 836 H SER 660 HN SER 660 0.501 5.805 5.548 837 HA SER 660 HA SER 660 0.838 5.464 2.674 838 HB2 SER 660 HB2 SER 660 -1.444 6.347 2.860 839 HB3 SER 660 HB1 SER 660 -0.871 7.648 3.902 840 HG SER 660 HG SER 660 -1.149 8.289 1.701 841 H CYS 661 HN CYS 661 2.207 7.060 1.736 842 HA CYS 661 HA CYS 661 4.359 7.870 3.387 843 HB2 CYS 661 HB2 CYS 661 3.633 8.715 0.576 844 HB3 CYS 661 HB1 CYS 661 5.185 9.011 1.350 845 HG CYS 661 HG CYS 661 4.965 6.784 -0.618 846 H CYS 662 HN CYS 662 1.375 9.289 2.589 847 HA CYS 662 HA CYS 662 1.872 11.431 4.420 848 HB2 CYS 662 HB2 CYS 662 2.726 12.462 2.360 849 HB3 CYS 662 HB1 CYS 662 1.215 12.090 1.536 850 HG CYS 662 HG CYS 662 2.005 14.699 3.393 851 HA PRO 663 HA PRO 663 -2.250 9.396 4.695 852 HB2 PRO 663 HB2 PRO 663 -1.930 10.793 7.308 853 HB3 PRO 663 HB1 PRO 663 -2.526 9.165 6.964 854 HG2 PRO 663 HG2 PRO 663 -0.080 9.528 7.942 855 HG3 PRO 663 HG1 PRO 663 -0.384 8.299 6.700 856 HD2 PRO 663 HD2 PRO 663 0.897 10.981 6.442 857 HD3 PRO 663 HD1 PRO 663 1.266 9.467 5.594 858 H GLU 664 HN GLU 664 -1.207 12.618 5.627 859 HA GLU 664 HA GLU 664 -3.636 13.926 5.824 860 HB2 GLU 664 HB2 GLU 664 -1.056 15.016 4.688 861 HB3 GLU 664 HB1 GLU 664 -2.394 15.970 5.318 862 HG2 GLU 664 HG2 GLU 664 -2.023 15.159 7.528 863 HG3 GLU 664 HG1 GLU 664 -0.835 13.991 6.950 864 H ARG 665 HN ARG 665 -1.561 13.578 2.952 865 HA ARG 665 HA ARG 665 -3.353 14.939 1.229 866 HB2 ARG 665 HB2 ARG 665 -0.949 14.718 0.763 867 HB3 ARG 665 HB1 ARG 665 -1.151 12.986 0.535 868 HG2 ARG 665 HG2 ARG 665 -2.497 13.337 -1.414 869 HG3 ARG 665 HG1 ARG 665 -2.520 15.079 -1.138 870 HD2 ARG 665 HD2 ARG 665 -0.167 15.241 -1.559 871 HD3 ARG 665 HD1 ARG 665 -0.012 13.486 -1.621 872 HE ARG 665 HE ARG 665 -1.576 13.704 -3.639 873 HH11 ARG 665 HH11 ARG 665 0.811 16.120 -2.745 874 HH12 ARG 665 HH12 ARG 665 1.043 16.661 -4.376 875 HH21 ARG 665 HH21 ARG 665 -1.246 14.380 -5.757 876 HH22 ARG 665 HH22 ARG 665 -0.127 15.669 -6.099 877 H THR 666 HN THR 666 -2.867 11.468 1.910 878 HA THR 666 HA THR 666 -4.650 10.519 -0.042 879 HB THR 666 HB THR 666 -4.176 9.179 2.625 880 HG1 THR 666 HG1 THR 666 -2.591 8.768 0.304 881 HG21 THR 666 HG21 THR 666 -5.895 8.184 1.125 882 HG22 THR 666 HG22 THR 666 -4.515 7.117 1.372 883 HG23 THR 666 HG23 THR 666 -4.671 8.022 -0.133 884 H SER 667 HN SER 667 -5.205 11.444 3.366 885 HA SER 667 HA SER 667 -8.000 10.917 3.254 886 HB2 SER 667 HB2 SER 667 -7.991 12.266 5.394 887 HB3 SER 667 HB1 SER 667 -6.973 10.834 5.393 888 HG SER 667 HG SER 667 -5.206 12.071 5.331 889 H GLN 668 HN GLN 668 -5.996 13.737 2.696 890 HA GLN 668 HA GLN 668 -7.868 15.764 2.629 891 HB2 GLN 668 HB2 GLN 668 -5.235 15.236 1.412 892 HB3 GLN 668 HB1 GLN 668 -6.182 16.483 0.634 893 HG2 GLN 668 HG2 GLN 668 -6.394 17.619 2.779 894 HG3 GLN 668 HG1 GLN 668 -5.366 16.404 3.516 895 HE21 GLN 668 HE21 GLN 668 -5.516 19.119 1.414 896 HE22 GLN 668 HE22 GLN 668 -3.813 19.378 1.313 897 H LEU 669 HN LEU 669 -6.829 13.664 -0.034 898 HA LEU 669 HA LEU 669 -8.705 15.038 -1.801 899 HB2 LEU 669 HB2 LEU 669 -6.722 12.936 -2.608 900 HB3 LEU 669 HB1 LEU 669 -7.424 14.205 -3.588 901 HG LEU 669 HG LEU 669 -5.373 14.552 -1.408 902 HD11 LEU 669 HD11 LEU 669 -4.437 13.624 -3.433 903 HD12 LEU 669 HD12 LEU 669 -3.923 15.300 -3.240 904 HD13 LEU 669 HD13 LEU 669 -5.195 14.896 -4.394 905 HD21 LEU 669 HD21 LEU 669 -6.775 16.611 -3.100 906 HD22 LEU 669 HD22 LEU 669 -5.319 16.923 -2.157 907 HD23 LEU 669 HD23 LEU 669 -6.812 16.460 -1.339 908 H PHE 670 HN PHE 670 -8.030 11.891 -0.456 909 HA PHE 670 HA PHE 670 -10.238 10.736 -2.017 910 HB2 PHE 670 HB2 PHE 670 -7.898 9.342 -0.694 911 HB3 PHE 670 HB1 PHE 670 -9.094 8.587 -1.742 912 HD1 PHE 670 HD2 PHE 670 -9.308 9.660 -4.132 913 HD2 PHE 670 HD1 PHE 670 -5.917 10.077 -1.594 914 HE1 PHE 670 HE2 PHE 670 -7.921 10.227 -6.084 915 HE2 PHE 670 HE1 PHE 670 -4.527 10.652 -3.540 916 HZ PHE 670 HZ PHE 670 -5.527 10.725 -5.787 917 H ASP 671 HN ASP 671 -9.623 11.958 0.926 918 HA ASP 671 HA ASP 671 -10.585 11.883 2.966 919 HB2 ASP 671 HB2 ASP 671 -12.648 10.541 1.286 920 HB3 ASP 671 HB1 ASP 671 -12.827 10.486 3.035 921 H LEU 672 HN LEU 672 -8.967 9.452 1.781 922 HA LEU 672 HA LEU 672 -9.818 7.385 3.636 923 HB2 LEU 672 HB2 LEU 672 -9.323 6.721 1.359 924 HB3 LEU 672 HB1 LEU 672 -7.707 7.391 1.476 925 HG LEU 672 HG LEU 672 -7.271 5.716 3.323 926 HD11 LEU 672 HD11 LEU 672 -8.735 3.810 3.508 927 HD12 LEU 672 HD12 LEU 672 -9.809 4.470 2.273 928 HD13 LEU 672 HD13 LEU 672 -9.647 5.285 3.831 929 HD21 LEU 672 HD21 LEU 672 -6.888 3.867 1.785 930 HD22 LEU 672 HD22 LEU 672 -6.433 5.404 1.050 931 HD23 LEU 672 HD23 LEU 672 -7.948 4.623 0.596 932 HA PRO 673 HA PRO 673 -6.682 8.916 6.427 933 HB2 PRO 673 HB2 PRO 673 -7.496 7.544 8.598 934 HB3 PRO 673 HB1 PRO 673 -8.352 8.971 8.005 935 HG2 PRO 673 HG2 PRO 673 -9.049 6.093 7.732 936 HG3 PRO 673 HG1 PRO 673 -10.113 7.496 7.918 937 HD2 PRO 673 HD2 PRO 673 -9.541 6.192 5.527 938 HD3 PRO 673 HD1 PRO 673 -10.242 7.810 5.671 939 H CYS 674 HN CYS 674 -4.705 8.200 6.883 940 HA CYS 674 HA CYS 674 -4.171 5.302 6.843 941 HB2 CYS 674 HB2 CYS 674 -2.430 7.360 5.458 942 HB3 CYS 674 HB1 CYS 674 -2.278 5.608 5.391 943 HG CYS 674 HG CYS 674 -5.156 6.985 4.245 944 H SER 675 HN SER 675 -2.355 4.645 8.039 945 HA SER 675 HA SER 675 -1.318 6.488 10.005 946 HB2 SER 675 HB2 SER 675 -0.491 3.648 9.334 947 HB3 SER 675 HB1 SER 675 0.019 4.557 10.757 948 HG SER 675 HG SER 675 -2.567 3.604 10.102 949 H LYS 676 HN LYS 676 1.117 6.800 10.171 950 HA LYS 676 HA LYS 676 2.010 7.703 7.604 951 HB2 LYS 676 HB2 LYS 676 2.550 9.017 9.578 952 HB3 LYS 676 HB1 LYS 676 3.444 7.665 10.262 953 HG2 LYS 676 HG2 LYS 676 4.937 9.341 9.292 954 HG3 LYS 676 HG1 LYS 676 5.066 7.786 8.455 955 HD2 LYS 676 HD2 LYS 676 3.590 8.621 6.684 956 HD3 LYS 676 HD1 LYS 676 3.450 10.166 7.523 957 HE2 LYS 676 HE2 LYS 676 6.027 8.989 6.494 958 HE3 LYS 676 HE1 LYS 676 5.074 10.213 5.659 959 HZ1 LYS 676 HZ1 LYS 676 5.404 11.700 7.533 960 HZ2 LYS 676 HZ2 LYS 676 6.888 11.203 6.892 961 HZ3 LYS 676 HZ3 LYS 676 6.324 10.527 8.333 962 H LEU 677 HN LEU 677 2.897 6.460 6.137 963 HA LEU 677 HA LEU 677 4.219 4.000 6.767 964 HB2 LEU 677 HB2 LEU 677 3.013 4.344 4.641 965 HB3 LEU 677 HB1 LEU 677 4.144 5.596 4.187 966 HG LEU 677 HG LEU 677 4.405 3.283 3.116 967 HD11 LEU 677 HD11 LEU 677 6.107 4.997 2.908 968 HD12 LEU 677 HD12 LEU 677 6.843 3.407 3.114 969 HD13 LEU 677 HD13 LEU 677 6.786 4.534 4.469 970 HD21 LEU 677 HD21 LEU 677 5.653 1.629 4.361 971 HD22 LEU 677 HD22 LEU 677 4.138 1.997 5.188 972 HD23 LEU 677 HD23 LEU 677 5.655 2.669 5.784 973 H SER 678 HN SER 678 6.132 4.007 7.740 974 HA SER 678 HA SER 678 8.020 6.175 7.120 975 HB2 SER 678 HB2 SER 678 8.710 6.005 9.546 976 HB3 SER 678 HB1 SER 678 7.100 6.656 9.270 977 HG SER 678 HG SER 678 7.042 3.950 9.512 978 H VAL 679 HN VAL 679 10.246 5.715 7.708 979 HA VAL 679 HA VAL 679 11.208 3.358 6.608 980 HB VAL 679 HB VAL 679 12.627 5.235 6.617 981 HG11 VAL 679 HG11 VAL 679 13.508 6.238 8.726 982 HG12 VAL 679 HG12 VAL 679 12.293 5.304 9.600 983 HG13 VAL 679 HG13 VAL 679 11.795 6.515 8.416 984 HG21 VAL 679 HG21 VAL 679 14.681 4.432 7.630 985 HG22 VAL 679 HG22 VAL 679 13.790 3.099 6.892 986 HG23 VAL 679 HG23 VAL 679 13.761 3.315 8.643 987 H GLY 680 HN GLY 680 11.748 1.417 7.392 988 HA2 GLY 680 HA2 GLY 680 12.172 -0.109 9.210 989 HA3 GLY 680 HA1 GLY 680 11.166 0.904 10.231 990 H ASP 681 HN ASP 681 9.254 1.132 7.825 991 HA ASP 681 HA ASP 681 7.690 -1.175 8.664 992 HB2 ASP 681 HB2 ASP 681 6.984 1.210 6.944 993 HB3 ASP 681 HB1 ASP 681 5.901 -0.119 7.233 994 H VAL 682 HN VAL 682 7.723 -3.054 7.603 995 HA VAL 682 HA VAL 682 8.770 -3.243 4.965 996 HB VAL 682 HB VAL 682 9.175 -5.190 6.142 997 HG11 VAL 682 HG11 VAL 682 7.454 -6.518 7.267 998 HG12 VAL 682 HG12 VAL 682 6.349 -5.175 6.999 999 HG13 VAL 682 HG13 VAL 682 7.778 -4.944 7.988 1000 HG21 VAL 682 HG21 VAL 682 6.831 -5.701 4.372 1001 HG22 VAL 682 HG22 VAL 682 7.826 -6.977 5.072 1002 HG23 VAL 682 HG23 VAL 682 8.545 -5.808 3.965 1003 H CYS 683 HN CYS 683 7.781 -2.686 3.176 1004 HA CYS 683 HA CYS 683 4.953 -2.228 3.133 1005 HB2 CYS 683 HB2 CYS 683 6.382 -0.796 1.799 1006 HB3 CYS 683 HB1 CYS 683 7.006 -2.178 0.916 1007 HG CYS 683 HG CYS 683 4.073 -2.620 0.176 1008 H ILE 684 HN ILE 684 3.398 -3.353 2.166 1009 HA ILE 684 HA ILE 684 3.919 -6.107 1.461 1010 HB ILE 684 HB ILE 684 1.395 -4.454 1.601 1011 HG12 ILE 684 HG12 ILE 684 2.293 -6.847 3.205 1012 HG13 ILE 684 HG11 ILE 684 2.443 -5.177 3.734 1013 HG21 ILE 684 HG21 ILE 684 1.691 -7.329 0.760 1014 HG22 ILE 684 HG22 ILE 684 1.077 -5.992 -0.211 1015 HG23 ILE 684 HG23 ILE 684 0.161 -6.563 1.184 1016 HD11 ILE 684 HD11 ILE 684 0.516 -6.264 4.743 1017 HD12 ILE 684 HD12 ILE 684 -0.138 -6.605 3.138 1018 HD13 ILE 684 HD13 ILE 684 0.026 -4.938 3.688 1019 H SER 685 HN SER 685 4.827 -6.330 -0.571 1020 HA SER 685 HA SER 685 3.683 -4.771 -2.758 1021 HB2 SER 685 HB2 SER 685 6.201 -5.254 -2.529 1022 HB3 SER 685 HB1 SER 685 5.809 -6.893 -3.034 1023 HG SER 685 HG SER 685 5.595 -6.226 -5.005 1024 H LEU 686 HN LEU 686 1.975 -5.528 -3.788 1025 HA LEU 686 HA LEU 686 1.347 -8.373 -3.538 1026 HB2 LEU 686 HB2 LEU 686 -0.167 -6.142 -3.025 1027 HB3 LEU 686 HB1 LEU 686 -0.680 -6.557 -4.646 1028 HG LEU 686 HG LEU 686 -2.158 -7.512 -2.969 1029 HD11 LEU 686 HD11 LEU 686 -2.138 -9.832 -3.712 1030 HD12 LEU 686 HD12 LEU 686 -0.519 -9.604 -4.379 1031 HD13 LEU 686 HD13 LEU 686 -1.884 -8.718 -5.056 1032 HD21 LEU 686 HD21 LEU 686 -1.389 -9.264 -1.460 1033 HD22 LEU 686 HD22 LEU 686 -0.566 -7.736 -1.146 1034 HD23 LEU 686 HD23 LEU 686 0.265 -9.023 -2.018 1035 H THR 687 HN THR 687 1.688 -9.590 -5.288 1036 HA THR 687 HA THR 687 1.883 -8.253 -7.882 1037 HB THR 687 HB THR 687 3.788 -9.672 -7.323 1038 HG1 THR 687 HG1 THR 687 2.919 -9.588 -9.541 1039 HG21 THR 687 HG21 THR 687 3.530 -12.111 -7.127 1040 HG22 THR 687 HG22 THR 687 1.779 -11.916 -7.163 1041 HG23 THR 687 HG23 THR 687 2.713 -11.246 -5.826 1042 H LEU 688 HN LEU 688 0.418 -8.527 -9.421 1043 HA LEU 688 HA LEU 688 -1.865 -10.249 -8.779 1044 HB2 LEU 688 HB2 LEU 688 -1.763 -7.965 -10.755 1045 HB3 LEU 688 HB1 LEU 688 -3.188 -8.852 -10.263 1046 HG LEU 688 HG LEU 688 -3.343 -6.802 -9.142 1047 HD11 LEU 688 HD11 LEU 688 -3.824 -8.628 -7.640 1048 HD12 LEU 688 HD12 LEU 688 -3.057 -7.309 -6.754 1049 HD13 LEU 688 HD13 LEU 688 -2.120 -8.743 -7.191 1050 HD21 LEU 688 HD21 LEU 688 -0.466 -7.102 -8.323 1051 HD22 LEU 688 HD22 LEU 688 -1.537 -5.777 -7.868 1052 HD23 LEU 688 HD23 LEU 688 -1.085 -6.006 -9.558 1053 H LYS 689 HN LYS 689 -1.370 -12.185 -9.654 1054 HA LYS 689 HA LYS 689 0.167 -12.411 -12.034 1055 HB2 LYS 689 HB2 LYS 689 -1.225 -14.458 -10.365 1056 HB3 LYS 689 HB1 LYS 689 -0.182 -14.842 -11.719 1057 HG2 LYS 689 HG2 LYS 689 0.618 -13.338 -9.252 1058 HG3 LYS 689 HG1 LYS 689 0.999 -15.025 -9.593 1059 HD2 LYS 689 HD2 LYS 689 1.889 -12.654 -11.236 1060 HD3 LYS 689 HD1 LYS 689 2.883 -13.500 -10.060 1061 HE2 LYS 689 HE2 LYS 689 2.572 -15.581 -11.395 1062 HE3 LYS 689 HE1 LYS 689 1.740 -14.615 -12.612 1063 HZ1 LYS 689 HZ1 LYS 689 3.751 -13.302 -12.886 1064 HZ2 LYS 689 HZ2 LYS 689 4.057 -14.936 -13.185 1065 HZ3 LYS 689 HZ3 LYS 689 4.549 -14.238 -11.727 Start of MODEL 13 1 H1 VAL 34 HT1 VAL 34 -17.909 -1.493 -5.706 2 H2 VAL 34 HT2 VAL 34 -19.021 -2.375 -4.790 3 H3 VAL 34 HT3 VAL 34 -18.547 -2.936 -6.310 4 HA VAL 34 HA VAL 34 -16.755 -2.625 -3.988 5 HB VAL 34 HB VAL 34 -18.250 -4.397 -3.501 6 HG11 VAL 34 HG11 VAL 34 -17.637 -5.515 -6.228 7 HG12 VAL 34 HG12 VAL 34 -19.171 -4.821 -5.705 8 HG13 VAL 34 HG13 VAL 34 -18.594 -6.326 -4.988 9 HG21 VAL 34 HG21 VAL 34 -15.988 -4.857 -2.898 10 HG22 VAL 34 HG22 VAL 34 -15.642 -5.475 -4.514 11 HG23 VAL 34 HG23 VAL 34 -16.745 -6.351 -3.454 12 H PHE 35 HN PHE 35 -14.689 -3.292 -4.298 13 HA PHE 35 HA PHE 35 -13.845 -3.664 -7.095 14 HB2 PHE 35 HB2 PHE 35 -12.927 -1.570 -5.156 15 HB3 PHE 35 HB1 PHE 35 -11.823 -2.163 -6.392 16 HD1 PHE 35 HD2 PHE 35 -15.393 -1.114 -6.231 17 HD2 PHE 35 HD1 PHE 35 -11.668 -0.828 -8.244 18 HE1 PHE 35 HE2 PHE 35 -16.398 0.439 -7.841 19 HE2 PHE 35 HE1 PHE 35 -12.660 0.725 -9.873 20 HZ PHE 35 HZ PHE 35 -15.032 1.362 -9.675 21 HA PRO 36 HA PRO 36 -11.225 -6.958 -5.590 22 HB2 PRO 36 HB2 PRO 36 -9.322 -5.889 -7.616 23 HB3 PRO 36 HB1 PRO 36 -9.921 -7.537 -7.394 24 HG2 PRO 36 HG2 PRO 36 -10.822 -6.021 -9.388 25 HG3 PRO 36 HG1 PRO 36 -11.911 -7.105 -8.501 26 HD2 PRO 36 HD2 PRO 36 -11.614 -4.140 -8.306 27 HD3 PRO 36 HD1 PRO 36 -13.076 -5.139 -8.195 28 H TRP 37 HN TRP 37 -9.487 -7.147 -4.201 29 HA TRP 37 HA TRP 37 -9.156 -4.871 -2.668 30 HB2 TRP 37 HB2 TRP 37 -7.558 -6.233 -1.305 31 HB3 TRP 37 HB1 TRP 37 -9.153 -6.920 -1.550 32 HD1 TRP 37 HD1 TRP 37 -9.235 -8.922 -3.536 33 HE1 TRP 37 HE1 TRP 37 -7.522 -10.797 -3.923 34 HE3 TRP 37 HE3 TRP 37 -5.207 -6.840 -1.183 35 HZ2 TRP 37 HZ2 TRP 37 -4.826 -11.333 -3.296 36 HZ3 TRP 37 HZ3 TRP 37 -3.097 -8.103 -1.131 37 HH2 TRP 37 HH2 TRP 37 -2.919 -10.308 -2.159 38 H HIS 38 HN HIS 38 -7.033 -6.014 -5.234 39 HA HIS 38 HA HIS 38 -4.851 -4.406 -4.407 40 HB2 HIS 38 HB2 HIS 38 -3.879 -4.831 -6.569 41 HB3 HIS 38 HB1 HIS 38 -4.643 -6.307 -6.004 42 HD1 HIS 38 HD1 HIS 38 -4.367 -4.206 -8.909 43 HD2 HIS 38 HD2 HIS 38 -7.331 -6.649 -7.321 44 HE1 HIS 38 HE1 HIS 38 -5.921 -4.713 -10.815 45 HE2 HIS 38 HE2 HIS 38 -7.789 -6.056 -9.792 46 H SER 39 HN SER 39 -6.455 -2.614 -3.864 47 HA SER 39 HA SER 39 -6.788 -0.827 -6.186 48 HB2 SER 39 HB2 SER 39 -8.941 -1.659 -5.383 49 HB3 SER 39 HB1 SER 39 -8.554 -1.145 -3.742 50 HG SER 39 HG SER 39 -9.807 0.444 -4.610 51 H LEU 40 HN LEU 40 -5.815 -1.187 -2.880 52 HA LEU 40 HA LEU 40 -4.972 1.642 -2.763 53 HB2 LEU 40 HB2 LEU 40 -5.309 0.804 -0.141 54 HB3 LEU 40 HB1 LEU 40 -6.383 1.853 -1.051 55 HG LEU 40 HG LEU 40 -6.775 -1.084 -1.351 56 HD11 LEU 40 HD11 LEU 40 -7.581 0.479 1.089 57 HD12 LEU 40 HD12 LEU 40 -6.517 -0.927 1.028 58 HD13 LEU 40 HD13 LEU 40 -8.232 -1.099 0.639 59 HD21 LEU 40 HD21 LEU 40 -8.669 1.253 -1.110 60 HD22 LEU 40 HD22 LEU 40 -9.111 -0.409 -1.495 61 HD23 LEU 40 HD23 LEU 40 -8.125 0.525 -2.621 62 H VAL 41 HN VAL 41 -3.724 -1.216 -3.284 63 HA VAL 41 HA VAL 41 -1.565 -0.944 -1.339 64 HB VAL 41 HB VAL 41 -2.582 -3.110 -1.165 65 HG11 VAL 41 HG11 VAL 41 -3.625 -3.196 -3.400 66 HG12 VAL 41 HG12 VAL 41 -2.770 -4.683 -2.992 67 HG13 VAL 41 HG13 VAL 41 -2.042 -3.525 -4.106 68 HG21 VAL 41 HG21 VAL 41 -0.168 -2.996 -0.950 69 HG22 VAL 41 HG22 VAL 41 0.001 -3.311 -2.676 70 HG23 VAL 41 HG23 VAL 41 -0.680 -4.546 -1.616 71 HA PRO 42 HA PRO 42 0.667 0.537 -4.934 72 HB2 PRO 42 HB2 PRO 42 2.856 1.370 -3.582 73 HB3 PRO 42 HB1 PRO 42 1.349 2.295 -3.606 74 HG2 PRO 42 HG2 PRO 42 2.424 0.472 -1.495 75 HG3 PRO 42 HG1 PRO 42 1.606 2.035 -1.318 76 HD2 PRO 42 HD2 PRO 42 0.361 -0.366 -0.958 77 HD3 PRO 42 HD1 PRO 42 -0.479 1.104 -1.488 78 H PHE 43 HN PHE 43 2.152 -0.437 -6.219 79 HA PHE 43 HA PHE 43 3.081 -3.017 -5.275 80 HB2 PHE 43 HB2 PHE 43 3.213 -1.816 -8.047 81 HB3 PHE 43 HB1 PHE 43 3.563 -3.490 -7.623 82 HD1 PHE 43 HD2 PHE 43 1.464 -4.357 -5.938 83 HD2 PHE 43 HD1 PHE 43 1.258 -1.670 -9.234 84 HE1 PHE 43 HE2 PHE 43 -0.909 -4.920 -6.245 85 HE2 PHE 43 HE1 PHE 43 -1.115 -2.231 -9.544 86 HZ PHE 43 HZ PHE 43 -2.203 -3.857 -8.049 87 H LEU 44 HN LEU 44 4.814 -2.684 -3.999 88 HA LEU 44 HA LEU 44 7.042 -1.096 -4.477 89 HB2 LEU 44 HB2 LEU 44 6.763 -2.158 -2.342 90 HB3 LEU 44 HB1 LEU 44 6.678 -3.744 -3.076 91 HG LEU 44 HG LEU 44 8.800 -3.004 -1.746 92 HD11 LEU 44 HD11 LEU 44 10.198 -4.471 -3.137 93 HD12 LEU 44 HD12 LEU 44 8.964 -4.425 -4.397 94 HD13 LEU 44 HD13 LEU 44 8.598 -5.151 -2.829 95 HD21 LEU 44 HD21 LEU 44 9.220 -0.946 -2.979 96 HD22 LEU 44 HD22 LEU 44 9.419 -1.872 -4.468 97 HD23 LEU 44 HD23 LEU 44 10.564 -2.076 -3.144 98 H ALA 45 HN ALA 45 8.481 -1.091 -6.035 99 HA ALA 45 HA ALA 45 8.418 -2.758 -8.262 100 HB1 ALA 45 HB1 ALA 45 9.339 -0.499 -8.307 101 HB2 ALA 45 HB2 ALA 45 10.514 -1.668 -8.912 102 HB3 ALA 45 HB3 ALA 45 10.677 -1.015 -7.282 103 HA PRO 46 HA PRO 46 10.283 -6.536 -6.971 104 HB2 PRO 46 HB2 PRO 46 11.464 -6.477 -9.708 105 HB3 PRO 46 HB1 PRO 46 10.559 -7.762 -8.900 106 HG2 PRO 46 HG2 PRO 46 9.393 -6.272 -10.760 107 HG3 PRO 46 HG1 PRO 46 8.507 -6.747 -9.298 108 HD2 PRO 46 HD2 PRO 46 9.724 -4.114 -10.011 109 HD3 PRO 46 HD1 PRO 46 8.222 -4.467 -9.134 110 H SER 47 HN SER 47 12.104 -7.068 -5.981 111 HA SER 47 HA SER 47 14.198 -5.207 -5.722 112 HB2 SER 47 HB2 SER 47 15.251 -7.040 -4.357 113 HB3 SER 47 HB1 SER 47 13.601 -6.620 -3.882 114 HG SER 47 HG SER 47 14.170 -8.731 -5.685 115 H GLN 48 HN GLN 48 16.128 -5.031 -6.649 116 HA GLN 48 HA GLN 48 17.876 -5.302 -8.051 117 HB2 GLN 48 HB2 GLN 48 17.162 -8.233 -7.876 118 HB3 GLN 48 HB1 GLN 48 18.635 -7.597 -8.590 119 HG2 GLN 48 HG2 GLN 48 19.277 -6.659 -6.426 120 HG3 GLN 48 HG1 GLN 48 17.802 -7.310 -5.713 121 HE21 GLN 48 HE21 GLN 48 19.702 -8.988 -8.121 122 HE22 GLN 48 HE22 GLN 48 20.264 -10.245 -7.077 123 H ALA 567 HT1 ALA 567 -28.838 13.065 -0.908 124 HA ALA 567 HA ALA 567 -28.055 10.217 -1.022 125 HB1 ALA 567 HB1 ALA 567 -27.744 12.402 -3.073 126 HB2 ALA 567 HB2 ALA 567 -28.861 11.042 -3.168 127 HB3 ALA 567 HB3 ALA 567 -27.122 10.758 -3.207 128 HA PRO 568 HA PRO 568 -24.449 11.714 1.009 129 HB2 PRO 568 HB2 PRO 568 -22.922 9.506 0.766 130 HB3 PRO 568 HB1 PRO 568 -24.310 9.581 1.853 131 HG2 PRO 568 HG2 PRO 568 -24.082 8.327 -0.846 132 HG3 PRO 568 HG1 PRO 568 -24.935 7.745 0.593 133 HD2 PRO 568 HD2 PRO 568 -26.148 9.003 -1.527 134 HD3 PRO 568 HD1 PRO 568 -26.803 8.971 0.117 135 HA PRO 569 HA PRO 569 -21.710 13.035 -2.259 136 HB2 PRO 569 HB2 PRO 569 -19.767 14.104 -0.737 137 HB3 PRO 569 HB1 PRO 569 -21.351 14.871 -0.894 138 HG2 PRO 569 HG2 PRO 569 -20.285 13.160 1.318 139 HG3 PRO 569 HG1 PRO 569 -21.233 14.654 1.419 140 HD2 PRO 569 HD2 PRO 569 -22.313 12.157 1.697 141 HD3 PRO 569 HD1 PRO 569 -23.222 13.557 1.094 142 H THR 570 HN THR 570 -21.503 10.532 -2.431 143 HA THR 570 HA THR 570 -19.359 9.222 -1.132 144 HB THR 570 HB THR 570 -19.765 7.452 -2.913 145 HG1 THR 570 HG1 THR 570 -21.015 9.443 -4.090 146 HG21 THR 570 HG21 THR 570 -22.065 8.420 -1.214 147 HG22 THR 570 HG22 THR 570 -20.784 7.313 -0.718 148 HG23 THR 570 HG23 THR 570 -21.953 6.821 -1.943 149 H LEU 571 HN LEU 571 -17.299 9.135 -1.579 150 HA LEU 571 HA LEU 571 -16.189 10.330 -3.947 151 HB2 LEU 571 HB2 LEU 571 -14.992 8.858 -1.611 152 HB3 LEU 571 HB1 LEU 571 -14.041 9.477 -2.929 153 HG LEU 571 HG LEU 571 -15.812 11.287 -1.329 154 HD11 LEU 571 HD11 LEU 571 -13.872 11.804 0.065 155 HD12 LEU 571 HD12 LEU 571 -12.957 10.519 -0.724 156 HD13 LEU 571 HD13 LEU 571 -14.365 10.123 0.263 157 HD21 LEU 571 HD21 LEU 571 -14.952 12.109 -3.424 158 HD22 LEU 571 HD22 LEU 571 -13.322 11.627 -2.965 159 HD23 LEU 571 HD23 LEU 571 -14.138 12.923 -2.088 160 HA PRO 572 HA PRO 572 -15.850 6.986 -6.804 161 HB2 PRO 572 HB2 PRO 572 -12.902 7.188 -6.330 162 HB3 PRO 572 HB1 PRO 572 -13.780 7.013 -7.849 163 HG2 PRO 572 HG2 PRO 572 -12.882 9.395 -7.094 164 HG3 PRO 572 HG1 PRO 572 -14.465 9.225 -7.877 165 HD2 PRO 572 HD2 PRO 572 -13.811 9.802 -5.047 166 HD3 PRO 572 HD1 PRO 572 -15.252 10.239 -5.984 167 HA PRO 573 HA PRO 573 -15.864 3.551 -4.132 168 HB2 PRO 573 HB2 PRO 573 -16.534 1.671 -5.894 169 HB3 PRO 573 HB1 PRO 573 -17.634 3.006 -5.520 170 HG2 PRO 573 HG2 PRO 573 -15.737 2.717 -7.828 171 HG3 PRO 573 HG1 PRO 573 -17.436 3.189 -7.836 172 HD2 PRO 573 HD2 PRO 573 -15.434 4.999 -7.933 173 HD3 PRO 573 HD1 PRO 573 -16.993 5.333 -7.157 174 H TYR 574 HN TYR 574 -13.441 4.037 -6.328 175 HA TYR 574 HA TYR 574 -12.173 1.560 -6.436 176 HB2 TYR 574 HB2 TYR 574 -11.602 3.472 -7.876 177 HB3 TYR 574 HB1 TYR 574 -10.825 4.239 -6.506 178 HD1 TYR 574 HD1 TYR 574 -10.743 0.929 -8.247 179 HD2 TYR 574 HD2 TYR 574 -8.516 4.081 -6.466 180 HE1 TYR 574 HE1 TYR 574 -8.653 -0.224 -8.834 181 HE2 TYR 574 HE2 TYR 574 -6.422 2.939 -7.045 182 HH TYR 574 HH TYR 574 -5.647 0.649 -7.532 183 H PHE 575 HN PHE 575 -10.658 4.174 -4.604 184 HA PHE 575 HA PHE 575 -10.148 2.211 -2.468 185 HB2 PHE 575 HB2 PHE 575 -7.883 2.764 -2.386 186 HB3 PHE 575 HB1 PHE 575 -8.202 2.769 -4.116 187 HD1 PHE 575 HD1 PHE 575 -9.013 5.155 -5.017 188 HD2 PHE 575 HD2 PHE 575 -6.681 4.489 -1.523 189 HE1 PHE 575 HE1 PHE 575 -8.192 7.465 -5.131 190 HE2 PHE 575 HE2 PHE 575 -5.856 6.802 -1.632 191 HZ PHE 575 HZ PHE 575 -6.625 8.290 -3.427 192 H MET 576 HN MET 576 -11.709 4.933 -3.186 193 HA MET 576 HA MET 576 -10.663 6.649 -1.100 194 HB2 MET 576 HB2 MET 576 -13.114 7.034 -2.827 195 HB3 MET 576 HB1 MET 576 -12.408 8.240 -1.770 196 HG2 MET 576 HG2 MET 576 -10.263 7.860 -3.132 197 HG3 MET 576 HG1 MET 576 -11.354 7.135 -4.300 198 HE1 MET 576 HE1 MET 576 -10.797 8.798 -6.243 199 HE2 MET 576 HE2 MET 576 -9.548 9.457 -5.189 200 HE3 MET 576 HE3 MET 576 -10.668 10.541 -6.013 201 H LYS 577 HN LYS 577 -12.209 7.659 0.507 202 HA LYS 577 HA LYS 577 -12.574 5.827 2.463 203 HB2 LYS 577 HB2 LYS 577 -12.576 8.242 2.847 204 HB3 LYS 577 HB1 LYS 577 -14.185 8.356 2.145 205 HG2 LYS 577 HG2 LYS 577 -15.018 6.854 3.938 206 HG3 LYS 577 HG1 LYS 577 -13.417 6.917 4.675 207 HD2 LYS 577 HD2 LYS 577 -13.631 9.362 4.870 208 HD3 LYS 577 HD1 LYS 577 -15.257 9.253 4.188 209 HE2 LYS 577 HE2 LYS 577 -15.975 7.892 6.063 210 HE3 LYS 577 HE1 LYS 577 -14.340 7.908 6.725 211 HZ1 LYS 577 HZ1 LYS 577 -16.100 10.272 6.369 212 HZ2 LYS 577 HZ2 LYS 577 -14.517 10.311 6.967 213 HZ3 LYS 577 HZ3 LYS 577 -15.727 9.519 7.840 214 H GLY 578 HN GLY 578 -13.829 4.183 2.811 215 HA2 GLY 578 HA2 GLY 578 -15.810 3.120 3.304 216 HA3 GLY 578 HA1 GLY 578 -16.688 4.465 2.611 217 H SER 579 HN SER 579 -14.417 3.460 0.366 218 HA SER 579 HA SER 579 -16.385 2.205 -1.248 219 HB2 SER 579 HB2 SER 579 -14.637 1.851 -2.860 220 HB3 SER 579 HB1 SER 579 -14.397 3.441 -2.146 221 HG SER 579 HG SER 579 -12.746 1.319 -2.177 222 H ILE 580 HN ILE 580 -16.703 0.020 -1.693 223 HA ILE 580 HA ILE 580 -15.937 -1.623 0.564 224 HB ILE 580 HB ILE 580 -17.825 -2.234 -1.708 225 HG12 ILE 580 HG12 ILE 580 -18.683 -0.405 -0.415 226 HG13 ILE 580 HG11 ILE 580 -19.562 -1.850 0.071 227 HG21 ILE 580 HG21 ILE 580 -16.917 -4.257 -0.707 228 HG22 ILE 580 HG22 ILE 580 -18.616 -4.057 -0.277 229 HG23 ILE 580 HG23 ILE 580 -17.358 -3.676 0.897 230 HD11 ILE 580 HD11 ILE 580 -19.029 -0.499 2.005 231 HD12 ILE 580 HD12 ILE 580 -17.316 -0.522 1.588 232 HD13 ILE 580 HD13 ILE 580 -18.125 -2.014 2.070 233 H ILE 581 HN ILE 581 -14.142 -2.662 0.514 234 HA ILE 581 HA ILE 581 -12.917 -3.365 -2.045 235 HB ILE 581 HB ILE 581 -11.677 -3.551 0.699 236 HG12 ILE 581 HG12 ILE 581 -12.434 -1.261 0.364 237 HG13 ILE 581 HG11 ILE 581 -10.685 -1.334 0.260 238 HG21 ILE 581 HG21 ILE 581 -10.522 -4.768 -1.054 239 HG22 ILE 581 HG22 ILE 581 -9.579 -3.371 -0.533 240 HG23 ILE 581 HG23 ILE 581 -10.478 -3.312 -2.049 241 HD11 ILE 581 HD11 ILE 581 -10.886 -1.315 -2.201 242 HD12 ILE 581 HD12 ILE 581 -11.492 0.140 -1.411 243 HD13 ILE 581 HD13 ILE 581 -12.626 -1.072 -2.014 244 H GLN 582 HN GLN 582 -12.679 -5.413 -2.715 245 HA GLN 582 HA GLN 582 -13.707 -7.530 -0.952 246 HB2 GLN 582 HB2 GLN 582 -14.870 -7.152 -3.104 247 HB3 GLN 582 HB1 GLN 582 -13.393 -7.547 -3.946 248 HG2 GLN 582 HG2 GLN 582 -13.432 -9.794 -3.093 249 HG3 GLN 582 HG1 GLN 582 -14.838 -9.429 -2.100 250 HE21 GLN 582 HE21 GLN 582 -14.500 -11.437 -4.181 251 HE22 GLN 582 HE22 GLN 582 -15.726 -11.121 -5.355 252 H LEU 583 HN LEU 583 -12.326 -8.848 -0.097 253 HA LEU 583 HA LEU 583 -9.583 -8.887 -0.965 254 HB2 LEU 583 HB2 LEU 583 -10.991 -10.440 1.196 255 HB3 LEU 583 HB1 LEU 583 -9.255 -10.326 0.985 256 HG LEU 583 HG LEU 583 -11.101 -8.033 1.647 257 HD11 LEU 583 HD11 LEU 583 -10.084 -8.075 3.830 258 HD12 LEU 583 HD12 LEU 583 -9.035 -9.412 3.348 259 HD13 LEU 583 HD13 LEU 583 -10.781 -9.656 3.469 260 HD21 LEU 583 HD21 LEU 583 -9.255 -7.244 0.307 261 HD22 LEU 583 HD22 LEU 583 -8.103 -8.135 1.302 262 HD23 LEU 583 HD23 LEU 583 -8.988 -6.774 1.986 263 H ALA 584 HN ALA 584 -8.524 -11.249 -0.908 264 HA ALA 584 HA ALA 584 -9.496 -12.437 -3.300 265 HB1 ALA 584 HB1 ALA 584 -7.697 -14.040 -3.070 266 HB2 ALA 584 HB2 ALA 584 -7.435 -13.545 -1.397 267 HB3 ALA 584 HB3 ALA 584 -7.111 -12.416 -2.714 268 H ASN 585 HN ASN 585 -9.920 -13.154 0.074 269 HA ASN 585 HA ASN 585 -10.972 -15.784 -0.334 270 HB2 ASN 585 HB2 ASN 585 -11.533 -15.722 2.029 271 HB3 ASN 585 HB1 ASN 585 -9.901 -15.124 1.787 272 HD21 ASN 585 HD21 ASN 585 -11.520 -14.685 4.051 273 HD22 ASN 585 HD22 ASN 585 -11.783 -12.976 4.182 274 H GLY 586 HN GLY 586 -12.163 -12.644 -0.748 275 HA2 GLY 586 HA2 GLY 586 -14.129 -12.369 -2.055 276 HA3 GLY 586 HA1 GLY 586 -14.795 -13.808 -1.304 277 H GLU 587 HN GLU 587 -13.392 -11.933 1.101 278 HA GLU 587 HA GLU 587 -16.063 -11.185 1.954 279 HB2 GLU 587 HB2 GLU 587 -15.172 -10.831 4.118 280 HB3 GLU 587 HB1 GLU 587 -14.403 -12.278 3.501 281 HG2 GLU 587 HG2 GLU 587 -12.394 -11.098 3.037 282 HG3 GLU 587 HG1 GLU 587 -13.141 -9.564 3.486 283 H LEU 588 HN LEU 588 -16.605 -9.082 2.685 284 HA LEU 588 HA LEU 588 -15.275 -7.036 1.043 285 HB2 LEU 588 HB2 LEU 588 -18.157 -7.168 1.927 286 HB3 LEU 588 HB1 LEU 588 -17.455 -5.977 0.848 287 HG LEU 588 HG LEU 588 -17.685 -8.930 0.260 288 HD11 LEU 588 HD11 LEU 588 -19.856 -7.832 0.270 289 HD12 LEU 588 HD12 LEU 588 -19.372 -8.253 -1.372 290 HD13 LEU 588 HD13 LEU 588 -19.244 -6.585 -0.815 291 HD21 LEU 588 HD21 LEU 588 -16.738 -6.620 -1.427 292 HD22 LEU 588 HD22 LEU 588 -17.004 -8.262 -2.009 293 HD23 LEU 588 HD23 LEU 588 -15.749 -7.944 -0.811 294 H LYS 589 HN LYS 589 -14.278 -5.486 2.128 295 HA LYS 589 HA LYS 589 -15.307 -4.716 4.769 296 HB2 LYS 589 HB2 LYS 589 -12.394 -5.147 4.088 297 HB3 LYS 589 HB1 LYS 589 -13.027 -4.594 5.625 298 HG2 LYS 589 HG2 LYS 589 -14.139 -6.716 5.970 299 HG3 LYS 589 HG1 LYS 589 -13.592 -7.274 4.390 300 HD2 LYS 589 HD2 LYS 589 -12.107 -8.244 5.927 301 HD3 LYS 589 HD1 LYS 589 -11.229 -6.877 5.246 302 HE2 LYS 589 HE2 LYS 589 -12.797 -6.483 7.748 303 HE3 LYS 589 HE1 LYS 589 -11.254 -7.333 7.829 304 HZ1 LYS 589 HZ1 LYS 589 -11.549 -4.667 6.580 305 HZ2 LYS 589 HZ2 LYS 589 -10.118 -5.462 7.020 306 HZ3 LYS 589 HZ3 LYS 589 -11.170 -4.873 8.215 307 H LYS 590 HN LYS 590 -14.647 -2.596 5.454 308 HA LYS 590 HA LYS 590 -14.709 -0.698 3.313 309 HB2 LYS 590 HB2 LYS 590 -14.536 -0.417 6.311 310 HB3 LYS 590 HB1 LYS 590 -14.614 0.957 5.215 311 HG2 LYS 590 HG2 LYS 590 -16.684 -1.157 4.984 312 HG3 LYS 590 HG1 LYS 590 -16.773 -0.021 6.330 313 HD2 LYS 590 HD2 LYS 590 -16.397 0.940 3.521 314 HD3 LYS 590 HD1 LYS 590 -18.002 0.569 4.138 315 HE2 LYS 590 HE2 LYS 590 -16.056 2.536 5.313 316 HE3 LYS 590 HE1 LYS 590 -17.504 2.924 4.387 317 HZ1 LYS 590 HZ1 LYS 590 -17.794 3.120 6.818 318 HZ2 LYS 590 HZ2 LYS 590 -17.527 1.457 6.969 319 HZ3 LYS 590 HZ3 LYS 590 -18.868 2.023 6.109 320 H VAL 591 HN VAL 591 -13.152 0.883 2.823 321 HA VAL 591 HA VAL 591 -10.628 -0.091 2.361 322 HB VAL 591 HB VAL 591 -10.997 2.846 2.803 323 HG11 VAL 591 HG11 VAL 591 -8.809 2.116 2.154 324 HG12 VAL 591 HG12 VAL 591 -9.558 2.982 0.806 325 HG13 VAL 591 HG13 VAL 591 -9.474 1.220 0.784 326 HG21 VAL 591 HG21 VAL 591 -12.074 1.299 0.461 327 HG22 VAL 591 HG22 VAL 591 -11.956 3.056 0.566 328 HG23 VAL 591 HG23 VAL 591 -13.015 2.177 1.667 329 H GLU 592 HN GLU 592 -11.641 2.103 4.939 330 HA GLU 592 HA GLU 592 -9.003 2.551 5.896 331 HB2 GLU 592 HB2 GLU 592 -10.180 3.675 7.793 332 HB3 GLU 592 HB1 GLU 592 -10.639 4.259 6.199 333 HG2 GLU 592 HG2 GLU 592 -12.266 2.083 7.358 334 HG3 GLU 592 HG1 GLU 592 -12.404 3.672 8.083 335 H ASP 593 HN ASP 593 -11.423 0.211 6.559 336 HA ASP 593 HA ASP 593 -10.301 -0.503 9.143 337 HB2 ASP 593 HB2 ASP 593 -12.751 -0.432 8.852 338 HB3 ASP 593 HB1 ASP 593 -12.641 -1.672 7.610 339 H LEU 594 HN LEU 594 -9.805 -1.344 5.926 340 HA LEU 594 HA LEU 594 -9.180 -4.059 6.107 341 HB2 LEU 594 HB2 LEU 594 -7.948 -1.899 4.406 342 HB3 LEU 594 HB1 LEU 594 -7.684 -3.618 4.177 343 HG LEU 594 HG LEU 594 -10.434 -2.406 4.077 344 HD11 LEU 594 HD11 LEU 594 -9.060 -1.285 2.432 345 HD12 LEU 594 HD12 LEU 594 -10.193 -2.395 1.658 346 HD13 LEU 594 HD13 LEU 594 -8.497 -2.843 1.823 347 HD21 LEU 594 HD21 LEU 594 -10.304 -4.824 4.378 348 HD22 LEU 594 HD22 LEU 594 -9.256 -4.944 2.964 349 HD23 LEU 594 HD23 LEU 594 -10.926 -4.412 2.779 350 H LYS 595 HN LYS 595 -7.746 -5.058 7.257 351 HA LYS 595 HA LYS 595 -5.459 -3.565 8.326 352 HB2 LYS 595 HB2 LYS 595 -6.639 -6.224 9.161 353 HB3 LYS 595 HB1 LYS 595 -5.244 -5.462 9.912 354 HG2 LYS 595 HG2 LYS 595 -8.041 -4.348 9.845 355 HG3 LYS 595 HG1 LYS 595 -7.261 -5.117 11.228 356 HD2 LYS 595 HD2 LYS 595 -5.588 -3.358 11.294 357 HD3 LYS 595 HD1 LYS 595 -6.288 -2.612 9.860 358 HE2 LYS 595 HE2 LYS 595 -7.031 -1.404 11.792 359 HE3 LYS 595 HE1 LYS 595 -8.399 -2.290 11.123 360 HZ1 LYS 595 HZ1 LYS 595 -8.334 -2.473 13.519 361 HZ2 LYS 595 HZ2 LYS 595 -6.773 -3.118 13.464 362 HZ3 LYS 595 HZ3 LYS 595 -8.067 -3.987 12.817 363 H THR 596 HN THR 596 -3.376 -4.786 8.425 364 HA THR 596 HA THR 596 -2.599 -5.542 5.856 365 HB THR 596 HB THR 596 -0.999 -4.724 7.493 366 HG1 THR 596 HG1 THR 596 -0.637 -7.095 6.114 367 HG21 THR 596 HG21 THR 596 -0.281 -5.979 9.367 368 HG22 THR 596 HG22 THR 596 -1.204 -7.392 8.859 369 HG23 THR 596 HG23 THR 596 -2.041 -5.948 9.427 370 H GLU 597 HN GLU 597 -3.736 -7.486 8.552 371 HA GLU 597 HA GLU 597 -2.975 -10.007 7.580 372 HB2 GLU 597 HB2 GLU 597 -5.311 -9.328 9.349 373 HB3 GLU 597 HB1 GLU 597 -4.588 -10.918 9.163 374 HG2 GLU 597 HG2 GLU 597 -2.437 -9.887 9.993 375 HG3 GLU 597 HG1 GLU 597 -3.393 -8.473 10.427 376 H ASP 598 HN ASP 598 -5.672 -7.945 6.859 377 HA ASP 598 HA ASP 598 -7.375 -9.785 5.600 378 HB2 ASP 598 HB2 ASP 598 -6.924 -6.836 5.138 379 HB3 ASP 598 HB1 ASP 598 -8.143 -7.750 4.264 380 H PHE 599 HN PHE 599 -4.843 -7.695 4.290 381 HA PHE 599 HA PHE 599 -5.067 -8.758 1.658 382 HB2 PHE 599 HB2 PHE 599 -3.053 -6.951 2.990 383 HB3 PHE 599 HB1 PHE 599 -2.800 -7.558 1.358 384 HD1 PHE 599 HD2 PHE 599 -5.960 -6.444 2.987 385 HD2 PHE 599 HD1 PHE 599 -3.035 -5.714 -0.018 386 HE1 PHE 599 HE2 PHE 599 -7.363 -4.650 2.062 387 HE2 PHE 599 HE1 PHE 599 -4.439 -3.921 -0.950 388 HZ PHE 599 HZ PHE 599 -6.605 -3.387 0.090 389 H ILE 600 HN ILE 600 -2.947 -9.358 4.432 390 HA ILE 600 HA ILE 600 -1.113 -11.080 3.296 391 HB ILE 600 HB ILE 600 -2.385 -11.084 6.021 392 HG12 ILE 600 HG12 ILE 600 0.376 -10.300 5.078 393 HG13 ILE 600 HG11 ILE 600 -0.944 -9.182 5.369 394 HG21 ILE 600 HG21 ILE 600 -1.685 -13.360 5.604 395 HG22 ILE 600 HG22 ILE 600 -0.573 -12.597 6.743 396 HG23 ILE 600 HG23 ILE 600 -0.103 -12.801 5.057 397 HD11 ILE 600 HD11 ILE 600 0.629 -9.223 7.222 398 HD12 ILE 600 HD12 ILE 600 0.329 -10.949 7.438 399 HD13 ILE 600 HD13 ILE 600 -0.967 -9.787 7.712 400 H GLN 601 HN GLN 601 -4.185 -12.044 4.873 401 HA GLN 601 HA GLN 601 -3.969 -14.746 4.182 402 HB2 GLN 601 HB2 GLN 601 -6.293 -13.011 4.930 403 HB3 GLN 601 HB1 GLN 601 -6.569 -14.663 4.388 404 HG2 GLN 601 HG2 GLN 601 -4.975 -15.412 6.144 405 HG3 GLN 601 HG1 GLN 601 -4.959 -13.758 6.757 406 HE21 GLN 601 HE21 GLN 601 -6.804 -16.675 6.404 407 HE22 GLN 601 HE22 GLN 601 -8.066 -16.248 7.507 408 H SER 602 HN SER 602 -5.506 -12.062 2.485 409 HA SER 602 HA SER 602 -6.829 -13.465 0.514 410 HB2 SER 602 HB2 SER 602 -5.454 -10.781 0.356 411 HB3 SER 602 HB1 SER 602 -6.565 -11.399 -0.870 412 HG SER 602 HG SER 602 -7.093 -10.680 1.814 413 H ALA 603 HN ALA 603 -3.454 -12.325 0.457 414 HA ALA 603 HA ALA 603 -2.995 -13.386 -2.159 415 HB1 ALA 603 HB1 ALA 603 -0.784 -12.749 -0.275 416 HB2 ALA 603 HB2 ALA 603 -1.799 -11.450 -0.901 417 HB3 ALA 603 HB3 ALA 603 -0.894 -12.474 -2.014 418 H GLU 604 HN GLU 604 -2.563 -14.534 1.115 419 HA GLU 604 HA GLU 604 -0.765 -16.656 0.520 420 HB2 GLU 604 HB2 GLU 604 -2.606 -16.136 2.849 421 HB3 GLU 604 HB1 GLU 604 -1.460 -17.469 2.793 422 HG2 GLU 604 HG2 GLU 604 -0.576 -14.643 2.383 423 HG3 GLU 604 HG1 GLU 604 -0.790 -15.311 3.996 424 H ILE 605 HN ILE 605 -4.249 -16.384 0.752 425 HA ILE 605 HA ILE 605 -4.885 -19.116 0.503 426 HB ILE 605 HB ILE 605 -6.512 -16.709 -0.358 427 HG12 ILE 605 HG12 ILE 605 -6.570 -18.247 2.244 428 HG13 ILE 605 HG11 ILE 605 -5.697 -16.743 2.020 429 HG21 ILE 605 HG21 ILE 605 -7.357 -18.815 -1.299 430 HG22 ILE 605 HG22 ILE 605 -8.457 -18.155 -0.090 431 HG23 ILE 605 HG23 ILE 605 -7.407 -19.513 0.320 432 HD11 ILE 605 HD11 ILE 605 -7.840 -15.639 1.476 433 HD12 ILE 605 HD12 ILE 605 -7.755 -16.288 3.118 434 HD13 ILE 605 HD13 ILE 605 -8.670 -17.147 1.871 435 H SER 606 HN SER 606 -3.714 -16.811 -1.722 436 HA SER 606 HA SER 606 -2.700 -17.112 -3.714 437 HB2 SER 606 HB2 SER 606 -3.496 -20.021 -3.514 438 HB3 SER 606 HB1 SER 606 -2.228 -19.336 -4.532 439 HG SER 606 HG SER 606 -2.172 -18.952 -1.736 440 H ASN 607 HN ASN 607 -3.775 -15.995 -5.156 441 HA ASN 607 HA ASN 607 -5.692 -17.315 -6.865 442 HB2 ASN 607 HB2 ASN 607 -7.036 -16.368 -4.926 443 HB3 ASN 607 HB1 ASN 607 -6.527 -14.769 -5.445 444 HD21 ASN 607 HD21 ASN 607 -8.423 -17.580 -6.266 445 HD22 ASN 607 HD22 ASN 607 -9.410 -16.807 -7.457 446 H ASP 608 HN ASP 608 -3.260 -16.674 -7.566 447 HA ASP 608 HA ASP 608 -1.950 -15.553 -9.047 448 HB2 ASP 608 HB2 ASP 608 -4.553 -14.180 -9.743 449 HB3 ASP 608 HB1 ASP 608 -3.046 -13.898 -10.606 450 H LEU 609 HN LEU 609 -2.059 -14.779 -6.388 451 HA LEU 609 HA LEU 609 -1.268 -11.984 -6.446 452 HB2 LEU 609 HB2 LEU 609 -3.523 -12.959 -4.669 453 HB3 LEU 609 HB1 LEU 609 -2.840 -11.346 -4.674 454 HG LEU 609 HG LEU 609 -4.098 -12.444 -7.164 455 HD11 LEU 609 HD11 LEU 609 -6.240 -11.607 -6.535 456 HD12 LEU 609 HD12 LEU 609 -5.613 -10.992 -5.008 457 HD13 LEU 609 HD13 LEU 609 -5.709 -12.731 -5.284 458 HD21 LEU 609 HD21 LEU 609 -3.768 -9.674 -6.031 459 HD22 LEU 609 HD22 LEU 609 -4.535 -10.073 -7.568 460 HD23 LEU 609 HD23 LEU 609 -2.818 -10.397 -7.330 461 H LYS 610 HN LYS 610 0.434 -11.736 -5.013 462 HA LYS 610 HA LYS 610 0.540 -13.509 -2.685 463 HB2 LYS 610 HB2 LYS 610 2.913 -14.023 -3.048 464 HB3 LYS 610 HB1 LYS 610 1.899 -14.652 -4.335 465 HG2 LYS 610 HG2 LYS 610 2.603 -12.977 -5.836 466 HG3 LYS 610 HG1 LYS 610 3.402 -12.067 -4.551 467 HD2 LYS 610 HD2 LYS 610 4.980 -13.917 -4.239 468 HD3 LYS 610 HD1 LYS 610 4.182 -14.810 -5.536 469 HE2 LYS 610 HE2 LYS 610 4.809 -13.145 -7.141 470 HE3 LYS 610 HE1 LYS 610 5.451 -12.103 -5.872 471 HZ1 LYS 610 HZ1 LYS 610 7.168 -13.696 -5.427 472 HZ2 LYS 610 HZ2 LYS 610 7.182 -13.335 -7.077 473 HZ3 LYS 610 HZ3 LYS 610 6.516 -14.791 -6.538 474 H ILE 611 HN ILE 611 1.712 -12.767 -0.934 475 HA ILE 611 HA ILE 611 2.140 -9.882 -0.804 476 HB ILE 611 HB ILE 611 2.253 -12.020 1.323 477 HG12 ILE 611 HG12 ILE 611 0.030 -11.210 0.140 478 HG13 ILE 611 HG11 ILE 611 0.073 -11.586 1.851 479 HG21 ILE 611 HG21 ILE 611 2.296 -10.262 2.971 480 HG22 ILE 611 HG22 ILE 611 2.312 -9.050 1.696 481 HG23 ILE 611 HG23 ILE 611 3.687 -10.134 1.894 482 HD11 ILE 611 HD11 ILE 611 0.316 -9.191 2.337 483 HD12 ILE 611 HD12 ILE 611 -1.155 -9.542 1.428 484 HD13 ILE 611 HD13 ILE 611 0.245 -8.848 0.608 485 H ASP 612 HN ASP 612 4.087 -8.955 -0.216 486 HA ASP 612 HA ASP 612 6.442 -10.707 0.008 487 HB2 ASP 612 HB2 ASP 612 6.083 -9.353 -2.255 488 HB3 ASP 612 HB1 ASP 612 6.745 -8.037 -1.278 489 H SER 613 HN SER 613 8.345 -9.420 0.929 490 HA SER 613 HA SER 613 7.398 -7.435 2.874 491 HB2 SER 613 HB2 SER 613 8.875 -8.518 4.582 492 HB3 SER 613 HB1 SER 613 7.528 -9.537 4.073 493 HG SER 613 HG SER 613 9.102 -10.934 3.791 494 H SER 614 HN SER 614 8.499 -5.596 2.569 495 HA SER 614 HA SER 614 11.395 -5.769 2.188 496 HB2 SER 614 HB2 SER 614 9.688 -3.946 0.481 497 HB3 SER 614 HB1 SER 614 11.417 -4.230 0.348 498 HG SER 614 HG SER 614 10.172 -6.575 0.204 499 H THR 615 HN THR 615 12.329 -4.591 3.716 500 HA THR 615 HA THR 615 10.779 -2.722 5.273 501 HB THR 615 HB THR 615 13.653 -3.598 5.543 502 HG1 THR 615 HG1 THR 615 12.659 -4.768 7.375 503 HG21 THR 615 HG21 THR 615 13.345 -1.430 6.587 504 HG22 THR 615 HG22 THR 615 13.480 -2.670 7.836 505 HG23 THR 615 HG23 THR 615 11.900 -2.003 7.424 506 H VAL 616 HN VAL 616 10.579 -0.631 4.739 507 HA VAL 616 HA VAL 616 12.266 0.746 2.986 508 HB VAL 616 HB VAL 616 10.188 1.731 3.242 509 HG11 VAL 616 HG11 VAL 616 9.217 2.426 5.397 510 HG12 VAL 616 HG12 VAL 616 10.571 1.656 6.215 511 HG13 VAL 616 HG13 VAL 616 9.452 0.684 5.267 512 HG21 VAL 616 HG21 VAL 616 11.737 3.504 3.122 513 HG22 VAL 616 HG22 VAL 616 12.194 3.313 4.814 514 HG23 VAL 616 HG23 VAL 616 10.601 3.953 4.400 515 H GLU 617 HN GLU 617 14.291 1.202 3.235 516 HA GLU 617 HA GLU 617 15.484 1.531 5.852 517 HB2 GLU 617 HB2 GLU 617 16.675 1.519 3.089 518 HB3 GLU 617 HB1 GLU 617 17.591 1.537 4.591 519 HG2 GLU 617 HG2 GLU 617 15.619 -0.622 3.984 520 HG3 GLU 617 HG1 GLU 617 17.273 -0.689 3.390 521 H ARG 618 HN ARG 618 14.325 3.466 3.251 522 HA ARG 618 HA ARG 618 15.136 5.885 4.584 523 HB2 ARG 618 HB2 ARG 618 17.191 5.193 3.369 524 HB3 ARG 618 HB1 ARG 618 16.297 5.263 1.861 525 HG2 ARG 618 HG2 ARG 618 15.928 7.668 2.218 526 HG3 ARG 618 HG1 ARG 618 16.888 7.574 3.696 527 HD2 ARG 618 HD2 ARG 618 17.854 6.938 0.908 528 HD3 ARG 618 HD1 ARG 618 18.222 8.399 1.823 529 HE ARG 618 HE ARG 618 19.088 6.417 3.453 530 HH11 ARG 618 HH11 ARG 618 19.690 7.188 0.091 531 HH12 ARG 618 HH12 ARG 618 21.281 6.496 0.084 532 HH21 ARG 618 HH21 ARG 618 21.190 5.526 3.454 533 HH22 ARG 618 HH22 ARG 618 22.140 5.560 2.002 534 H ILE 619 HN ILE 619 14.082 7.722 3.790 535 HA ILE 619 HA ILE 619 12.159 7.327 1.607 536 HB ILE 619 HB ILE 619 11.530 8.418 4.358 537 HG12 ILE 619 HG12 ILE 619 10.193 6.246 2.745 538 HG13 ILE 619 HG11 ILE 619 11.435 5.946 3.954 539 HG21 ILE 619 HG21 ILE 619 9.819 8.510 1.867 540 HG22 ILE 619 HG22 ILE 619 10.563 9.897 2.661 541 HG23 ILE 619 HG23 ILE 619 9.304 8.979 3.488 542 HD11 ILE 619 HD11 ILE 619 10.003 6.886 5.675 543 HD12 ILE 619 HD12 ILE 619 9.186 5.573 4.825 544 HD13 ILE 619 HD13 ILE 619 8.771 7.249 4.465 545 H GLU 620 HN GLU 620 12.721 8.774 0.135 546 HA GLU 620 HA GLU 620 13.823 11.330 1.078 547 HB2 GLU 620 HB2 GLU 620 14.375 9.883 -1.503 548 HB3 GLU 620 HB1 GLU 620 15.039 11.447 -1.051 549 HG2 GLU 620 HG2 GLU 620 15.409 9.032 0.659 550 HG3 GLU 620 HG1 GLU 620 16.486 9.375 -0.698 551 H ASP 621 HN ASP 621 12.894 13.178 0.468 552 HA ASP 621 HA ASP 621 10.429 13.084 -1.023 553 HB2 ASP 621 HB2 ASP 621 11.948 15.283 0.359 554 HB3 ASP 621 HB1 ASP 621 10.572 15.642 -0.679 555 H SER 622 HN SER 622 10.192 13.406 -3.110 556 HA SER 622 HA SER 622 12.502 14.333 -4.657 557 HB2 SER 622 HB2 SER 622 11.410 12.108 -5.176 558 HB3 SER 622 HB1 SER 622 9.973 13.003 -5.654 559 HG SER 622 HG SER 622 11.827 12.359 -7.240 560 H HIS 623 HN HIS 623 12.338 16.105 -6.018 561 HA HIS 623 HA HIS 623 10.465 18.101 -5.239 562 HB2 HIS 623 HB2 HIS 623 12.829 18.517 -6.037 563 HB3 HIS 623 HB1 HIS 623 12.262 18.172 -7.668 564 HD1 HIS 623 HD1 HIS 623 11.648 20.628 -4.846 565 HD2 HIS 623 HD2 HIS 623 11.169 20.318 -8.966 566 HE1 HIS 623 HE1 HIS 623 10.889 22.897 -5.614 567 HE2 HIS 623 HE2 HIS 623 10.706 22.720 -8.120 568 H SER 624 HN SER 624 10.406 15.635 -7.581 569 HA SER 624 HA SER 624 8.465 16.555 -9.341 570 HB2 SER 624 HB2 SER 624 8.705 13.775 -8.167 571 HB3 SER 624 HB1 SER 624 7.954 14.207 -9.701 572 HG SER 624 HG SER 624 10.378 15.200 -9.776 573 HA PRO 625 HA PRO 625 5.163 17.713 -6.757 574 HB2 PRO 625 HB2 PRO 625 3.344 16.616 -8.754 575 HB3 PRO 625 HB1 PRO 625 3.469 18.250 -8.118 576 HG2 PRO 625 HG2 PRO 625 4.323 17.578 -10.597 577 HG3 PRO 625 HG1 PRO 625 5.059 18.870 -9.634 578 HD2 PRO 625 HD2 PRO 625 6.087 16.168 -10.262 579 HD3 PRO 625 HD1 PRO 625 6.966 17.655 -9.870 580 H GLY 626 HN GLY 626 4.950 16.609 -4.974 581 HA2 GLY 626 HA2 GLY 626 3.985 15.175 -3.479 582 HA3 GLY 626 HA1 GLY 626 2.883 14.695 -4.757 583 H VAL 627 HN VAL 627 6.392 14.388 -4.915 584 HA VAL 627 HA VAL 627 5.972 11.477 -5.077 585 HB VAL 627 HB VAL 627 8.151 13.113 -6.377 586 HG11 VAL 627 HG11 VAL 627 8.899 10.864 -5.825 587 HG12 VAL 627 HG12 VAL 627 8.700 11.047 -7.568 588 HG13 VAL 627 HG13 VAL 627 7.484 10.184 -6.626 589 HG21 VAL 627 HG21 VAL 627 6.088 13.570 -7.472 590 HG22 VAL 627 HG22 VAL 627 5.651 11.863 -7.474 591 HG23 VAL 627 HG23 VAL 627 6.983 12.432 -8.483 592 H ALA 628 HN ALA 628 7.038 10.167 -3.766 593 HA ALA 628 HA ALA 628 9.535 11.062 -2.533 594 HB1 ALA 628 HB1 ALA 628 8.874 10.156 -0.356 595 HB2 ALA 628 HB2 ALA 628 7.260 9.815 -0.984 596 HB3 ALA 628 HB3 ALA 628 7.819 11.483 -0.844 597 H VAL 629 HN VAL 629 11.041 9.538 -2.582 598 HA VAL 629 HA VAL 629 10.270 6.938 -3.646 599 HB VAL 629 HB VAL 629 12.026 7.662 -4.948 600 HG11 VAL 629 HG11 VAL 629 13.979 8.855 -4.122 601 HG12 VAL 629 HG12 VAL 629 13.368 8.708 -2.475 602 HG13 VAL 629 HG13 VAL 629 12.480 9.665 -3.661 603 HG21 VAL 629 HG21 VAL 629 12.581 5.445 -4.104 604 HG22 VAL 629 HG22 VAL 629 13.397 6.163 -2.713 605 HG23 VAL 629 HG23 VAL 629 14.049 6.398 -4.335 606 H ILE 630 HN ILE 630 9.919 5.369 -2.348 607 HA ILE 630 HA ILE 630 11.094 5.358 0.308 608 HB ILE 630 HB ILE 630 9.232 3.266 -0.765 609 HG12 ILE 630 HG12 ILE 630 8.192 5.463 -1.212 610 HG13 ILE 630 HG11 ILE 630 7.336 4.563 0.033 611 HG21 ILE 630 HG21 ILE 630 10.363 2.885 1.365 612 HG22 ILE 630 HG22 ILE 630 8.620 3.059 1.577 613 HG23 ILE 630 HG23 ILE 630 9.698 4.395 1.982 614 HD11 ILE 630 HD11 ILE 630 8.404 5.900 1.750 615 HD12 ILE 630 HD12 ILE 630 7.525 6.912 0.603 616 HD13 ILE 630 HD13 ILE 630 9.284 6.796 0.511 617 H GLN 631 HN GLN 631 13.080 4.515 0.381 618 HA GLN 631 HA GLN 631 13.876 2.531 -1.595 619 HB2 GLN 631 HB2 GLN 631 15.365 4.435 -1.115 620 HB3 GLN 631 HB1 GLN 631 15.487 3.912 0.558 621 HG2 GLN 631 HG2 GLN 631 16.616 1.902 -0.088 622 HG3 GLN 631 HG1 GLN 631 16.365 2.268 -1.798 623 HE21 GLN 631 HE21 GLN 631 17.617 3.847 -2.783 624 HE22 GLN 631 HE22 GLN 631 19.055 4.474 -2.053 625 H PHE 632 HN PHE 632 13.512 0.477 -1.179 626 HA PHE 632 HA PHE 632 13.267 -0.406 1.621 627 HB2 PHE 632 HB2 PHE 632 12.308 -1.749 -0.912 628 HB3 PHE 632 HB1 PHE 632 12.025 -2.315 0.726 629 HD1 PHE 632 HD2 PHE 632 10.496 -1.104 2.202 630 HD2 PHE 632 HD1 PHE 632 10.988 -0.042 -1.881 631 HE1 PHE 632 HE2 PHE 632 8.372 0.125 2.269 632 HE2 PHE 632 HE1 PHE 632 8.859 1.188 -1.826 633 HZ PHE 632 HZ PHE 632 7.545 1.268 0.254 634 H ALA 633 HN ALA 633 14.277 -2.240 2.355 635 HA ALA 633 HA ALA 633 16.276 -3.478 0.592 636 HB1 ALA 633 HB1 ALA 633 17.147 -2.658 2.722 637 HB2 ALA 633 HB2 ALA 633 17.239 -4.418 2.641 638 HB3 ALA 633 HB3 ALA 633 15.970 -3.640 3.590 639 H VAL 634 HN VAL 634 15.356 -5.086 -0.500 640 HA VAL 634 HA VAL 634 13.035 -6.444 0.608 641 HB VAL 634 HB VAL 634 14.284 -6.799 -2.111 642 HG11 VAL 634 HG11 VAL 634 12.775 -8.589 -1.467 643 HG12 VAL 634 HG12 VAL 634 12.062 -7.609 -2.748 644 HG13 VAL 634 HG13 VAL 634 11.518 -7.413 -1.083 645 HG21 VAL 634 HG21 VAL 634 12.643 -5.196 -2.946 646 HG22 VAL 634 HG22 VAL 634 13.703 -4.447 -1.753 647 HG23 VAL 634 HG23 VAL 634 12.066 -4.921 -1.306 648 H GLY 635 HN GLY 635 13.128 -8.352 1.559 649 HA2 GLY 635 HA2 GLY 635 13.567 -10.602 1.777 650 HA3 GLY 635 HA1 GLY 635 14.639 -10.489 0.393 651 H GLU 636 HN GLU 636 15.685 -12.086 1.950 652 HA GLU 636 HA GLU 636 17.074 -11.051 4.208 653 HB2 GLU 636 HB2 GLU 636 17.434 -13.602 2.650 654 HB3 GLU 636 HB1 GLU 636 18.283 -13.230 4.137 655 HG2 GLU 636 HG2 GLU 636 16.530 -14.615 4.788 656 HG3 GLU 636 HG1 GLU 636 15.989 -12.992 5.204 657 H HIS 637 HN HIS 637 17.652 -11.148 0.830 658 HA HIS 637 HA HIS 637 20.505 -10.746 1.053 659 HB2 HIS 637 HB2 HIS 637 19.422 -11.931 -0.885 660 HB3 HIS 637 HB1 HIS 637 18.745 -10.386 -1.381 661 HD1 HIS 637 HD1 HIS 637 20.015 -9.801 -3.451 662 HD2 HIS 637 HD2 HIS 637 22.497 -11.136 -0.391 663 HE1 HIS 637 HE1 HIS 637 22.362 -9.491 -4.296 664 HE2 HIS 637 HE2 HIS 637 23.838 -10.140 -2.361 665 H ARG 638 HN ARG 638 17.951 -8.936 1.729 666 HA ARG 638 HA ARG 638 17.403 -6.753 1.905 667 HB2 ARG 638 HB2 ARG 638 19.200 -5.405 3.002 668 HB3 ARG 638 HB1 ARG 638 18.837 -6.948 3.755 669 HG2 ARG 638 HG2 ARG 638 20.812 -7.923 2.964 670 HG3 ARG 638 HG1 ARG 638 21.080 -6.612 1.821 671 HD2 ARG 638 HD2 ARG 638 21.441 -5.070 3.703 672 HD3 ARG 638 HD1 ARG 638 21.194 -6.406 4.827 673 HE ARG 638 HE ARG 638 23.221 -7.150 3.068 674 HH11 ARG 638 HH11 ARG 638 22.657 -4.766 5.566 675 HH12 ARG 638 HH12 ARG 638 24.327 -4.647 6.009 676 HH21 ARG 638 HH21 ARG 638 25.419 -6.992 3.633 677 HH22 ARG 638 HH22 ARG 638 25.905 -5.923 4.909 678 H ALA 639 HN ALA 639 17.624 -7.174 -0.661 679 HA ALA 639 HA ALA 639 19.467 -5.434 -1.985 680 HB1 ALA 639 HB1 ALA 639 18.194 -5.980 -4.001 681 HB2 ALA 639 HB2 ALA 639 16.961 -6.761 -3.011 682 HB3 ALA 639 HB3 ALA 639 18.590 -7.432 -3.080 683 H GLN 640 HN GLN 640 19.267 -3.310 -2.303 684 HA GLN 640 HA GLN 640 16.872 -2.085 -1.223 685 HB2 GLN 640 HB2 GLN 640 19.542 -0.896 -1.943 686 HB3 GLN 640 HB1 GLN 640 18.187 0.027 -1.301 687 HG2 GLN 640 HG2 GLN 640 18.195 -1.601 0.636 688 HG3 GLN 640 HG1 GLN 640 19.764 -2.136 0.043 689 HE21 GLN 640 HE21 GLN 640 18.005 0.378 1.607 690 HE22 GLN 640 HE22 GLN 640 19.372 1.342 2.044 691 H VAL 641 HN VAL 641 15.352 -1.251 -2.316 692 HA VAL 641 HA VAL 641 15.719 -0.771 -5.205 693 HB VAL 641 HB VAL 641 13.170 -1.417 -3.707 694 HG11 VAL 641 HG11 VAL 641 12.743 -0.000 -5.635 695 HG12 VAL 641 HG12 VAL 641 12.163 -1.639 -5.934 696 HG13 VAL 641 HG13 VAL 641 13.673 -1.091 -6.663 697 HG21 VAL 641 HG21 VAL 641 14.796 -3.115 -5.589 698 HG22 VAL 641 HG22 VAL 641 13.249 -3.561 -4.866 699 HG23 VAL 641 HG23 VAL 641 14.669 -3.335 -3.844 700 H SER 642 HN SER 642 15.371 1.207 -5.976 701 HA SER 642 HA SER 642 14.311 3.240 -4.135 702 HB2 SER 642 HB2 SER 642 15.948 3.654 -6.651 703 HB3 SER 642 HB1 SER 642 15.527 4.874 -5.449 704 HG SER 642 HG SER 642 17.257 2.643 -5.142 705 H VAL 643 HN VAL 643 12.152 3.414 -4.476 706 HA VAL 643 HA VAL 643 11.258 3.720 -7.252 707 HB VAL 643 HB VAL 643 10.475 1.586 -6.536 708 HG11 VAL 643 HG11 VAL 643 9.151 1.245 -4.503 709 HG12 VAL 643 HG12 VAL 643 9.395 2.935 -4.064 710 HG13 VAL 643 HG13 VAL 643 10.772 1.835 -4.133 711 HG21 VAL 643 HG21 VAL 643 8.272 3.614 -6.295 712 HG22 VAL 643 HG22 VAL 643 8.028 1.885 -6.547 713 HG23 VAL 643 HG23 VAL 643 8.846 2.852 -7.776 714 H GLU 644 HN GLU 644 10.395 5.637 -7.648 715 HA GLU 644 HA GLU 644 9.685 7.411 -5.450 716 HB2 GLU 644 HB2 GLU 644 9.959 7.833 -8.429 717 HB3 GLU 644 HB1 GLU 644 9.427 9.089 -7.323 718 HG2 GLU 644 HG2 GLU 644 11.531 9.004 -6.154 719 HG3 GLU 644 HG1 GLU 644 12.071 7.664 -7.162 720 H VAL 645 HN VAL 645 7.664 6.966 -4.681 721 HA VAL 645 HA VAL 645 5.470 6.619 -6.583 722 HB VAL 645 HB VAL 645 5.706 5.976 -3.635 723 HG11 VAL 645 HG11 VAL 645 3.483 6.785 -4.337 724 HG12 VAL 645 HG12 VAL 645 3.503 5.138 -3.695 725 HG13 VAL 645 HG13 VAL 645 3.387 5.406 -5.434 726 HG21 VAL 645 HG21 VAL 645 6.899 4.386 -5.000 727 HG22 VAL 645 HG22 VAL 645 5.511 4.212 -6.072 728 HG23 VAL 645 HG23 VAL 645 5.415 3.637 -4.408 729 H LEU 646 HN LEU 646 3.511 7.870 -6.208 730 HA LEU 646 HA LEU 646 3.989 10.474 -5.173 731 HB2 LEU 646 HB2 LEU 646 1.367 9.188 -5.914 732 HB3 LEU 646 HB1 LEU 646 1.558 10.865 -5.450 733 HG LEU 646 HG LEU 646 2.323 9.504 -7.973 734 HD11 LEU 646 HD11 LEU 646 0.237 10.821 -7.757 735 HD12 LEU 646 HD12 LEU 646 1.341 11.459 -8.975 736 HD13 LEU 646 HD13 LEU 646 1.219 12.246 -7.401 737 HD21 LEU 646 HD21 LEU 646 3.754 11.420 -8.558 738 HD22 LEU 646 HD22 LEU 646 4.423 10.395 -7.288 739 HD23 LEU 646 HD23 LEU 646 3.678 11.941 -6.873 740 H VAL 647 HN VAL 647 3.376 11.373 -3.298 741 HA VAL 647 HA VAL 647 3.279 9.663 -1.031 742 HB VAL 647 HB VAL 647 3.035 11.731 0.287 743 HG11 VAL 647 HG11 VAL 647 5.154 12.764 -0.377 744 HG12 VAL 647 HG12 VAL 647 5.092 11.893 -1.908 745 HG13 VAL 647 HG13 VAL 647 5.248 11.004 -0.393 746 HG21 VAL 647 HG21 VAL 647 1.575 12.986 -1.196 747 HG22 VAL 647 HG22 VAL 647 2.851 13.078 -2.411 748 HG23 VAL 647 HG23 VAL 647 3.041 13.911 -0.866 749 H GLU 648 HN GLU 648 0.897 10.514 -3.137 750 HA GLU 648 HA GLU 648 -1.313 10.829 -1.344 751 HB2 GLU 648 HB2 GLU 648 -1.487 9.919 -4.202 752 HB3 GLU 648 HB1 GLU 648 -2.673 10.820 -3.276 753 HG2 GLU 648 HG2 GLU 648 -1.122 12.744 -3.254 754 HG3 GLU 648 HG1 GLU 648 -0.040 11.831 -4.305 755 H TYR 649 HN TYR 649 0.468 8.207 -2.676 756 HA TYR 649 HA TYR 649 -1.664 6.300 -2.517 757 HB2 TYR 649 HB2 TYR 649 1.253 6.127 -3.237 758 HB3 TYR 649 HB1 TYR 649 0.246 4.696 -3.069 759 HD1 TYR 649 HD1 TYR 649 -1.734 4.396 -4.556 760 HD2 TYR 649 HD2 TYR 649 1.102 7.502 -5.157 761 HE1 TYR 649 HE1 TYR 649 -2.584 4.718 -6.838 762 HE2 TYR 649 HE2 TYR 649 0.259 7.839 -7.442 763 HH TYR 649 HH TYR 649 -2.664 6.531 -8.525 764 HA PRO 650 HA PRO 650 -0.743 5.265 1.692 765 HB2 PRO 650 HB2 PRO 650 -2.864 3.540 1.934 766 HB3 PRO 650 HB1 PRO 650 -2.964 5.279 2.162 767 HG2 PRO 650 HG2 PRO 650 -3.986 3.640 -0.015 768 HG3 PRO 650 HG1 PRO 650 -4.406 5.297 0.434 769 HD2 PRO 650 HD2 PRO 650 -2.719 4.416 -1.684 770 HD3 PRO 650 HD1 PRO 650 -3.117 6.079 -1.230 771 H PHE 651 HN PHE 651 0.690 3.805 2.308 772 HA PHE 651 HA PHE 651 1.110 1.437 0.669 773 HB2 PHE 651 HB2 PHE 651 2.771 2.883 2.712 774 HB3 PHE 651 HB1 PHE 651 3.180 1.245 2.217 775 HD1 PHE 651 HD1 PHE 651 2.260 4.488 0.596 776 HD2 PHE 651 HD2 PHE 651 4.768 1.051 0.594 777 HE1 PHE 651 HE1 PHE 651 3.474 5.380 -1.349 778 HE2 PHE 651 HE2 PHE 651 5.990 1.938 -1.348 779 HZ PHE 651 HZ PHE 651 5.342 4.104 -2.322 780 H PHE 652 HN PHE 652 0.181 -0.395 1.241 781 HA PHE 652 HA PHE 652 -0.665 -0.940 3.918 782 HB2 PHE 652 HB2 PHE 652 -1.103 -2.101 1.361 783 HB3 PHE 652 HB1 PHE 652 -0.411 -3.350 2.390 784 HD1 PHE 652 HD2 PHE 652 -1.454 -3.611 4.727 785 HD2 PHE 652 HD1 PHE 652 -3.372 -1.654 1.478 786 HE1 PHE 652 HE2 PHE 652 -3.622 -3.927 5.829 787 HE2 PHE 652 HE1 PHE 652 -5.552 -1.961 2.578 788 HZ PHE 652 HZ PHE 652 -5.678 -3.099 4.757 789 H VAL 653 HN VAL 653 0.599 -1.646 5.528 790 HA VAL 653 HA VAL 653 3.298 -2.462 4.733 791 HB VAL 653 HB VAL 653 2.679 -1.504 7.490 792 HG11 VAL 653 HG11 VAL 653 4.900 -1.382 7.670 793 HG12 VAL 653 HG12 VAL 653 5.070 -0.603 6.100 794 HG13 VAL 653 HG13 VAL 653 4.936 -2.358 6.204 795 HG21 VAL 653 HG21 VAL 653 2.992 0.239 5.062 796 HG22 VAL 653 HG22 VAL 653 3.330 0.802 6.699 797 HG23 VAL 653 HG23 VAL 653 1.699 0.270 6.264 798 H PHE 654 HN PHE 654 4.227 -4.234 5.494 799 HA PHE 654 HA PHE 654 2.624 -6.486 5.918 800 HB2 PHE 654 HB2 PHE 654 4.800 -6.420 4.732 801 HB3 PHE 654 HB1 PHE 654 5.652 -6.189 6.263 802 HD1 PHE 654 HD1 PHE 654 3.144 -8.524 4.723 803 HD2 PHE 654 HD2 PHE 654 6.566 -8.067 7.213 804 HE1 PHE 654 HE1 PHE 654 3.280 -10.968 4.982 805 HE2 PHE 654 HE2 PHE 654 6.706 -10.507 7.474 806 HZ PHE 654 HZ PHE 654 5.061 -11.962 6.358 807 H GLY 655 HN GLY 655 1.491 -5.731 7.963 808 HA2 GLY 655 HA2 GLY 655 1.190 -6.699 10.127 809 HA3 GLY 655 HA1 GLY 655 2.926 -6.914 10.237 810 H GLN 656 HN GLN 656 2.637 -3.911 9.061 811 HA GLN 656 HA GLN 656 3.126 -2.806 11.719 812 HB2 GLN 656 HB2 GLN 656 3.630 -1.643 8.979 813 HB3 GLN 656 HB1 GLN 656 3.989 -0.806 10.467 814 HG2 GLN 656 HG2 GLN 656 5.967 -1.793 9.423 815 HG3 GLN 656 HG1 GLN 656 5.667 -2.427 11.030 816 HE21 GLN 656 HE21 GLN 656 5.354 -3.072 7.643 817 HE22 GLN 656 HE22 GLN 656 5.325 -4.801 7.727 818 H GLY 657 HN GLY 657 0.978 -2.385 8.932 819 HA2 GLY 657 HA2 GLY 657 -1.333 -1.886 10.070 820 HA3 GLY 657 HA1 GLY 657 -0.533 -0.364 10.417 821 H TRP 658 HN TRP 658 -2.610 0.176 9.196 822 HA TRP 658 HA TRP 658 -2.284 0.121 6.298 823 HB2 TRP 658 HB2 TRP 658 -4.490 -0.404 7.415 824 HB3 TRP 658 HB1 TRP 658 -4.555 1.259 7.963 825 HD1 TRP 658 HD1 TRP 658 -6.927 1.240 6.646 826 HE1 TRP 658 HE1 TRP 658 -7.469 1.793 4.202 827 HE3 TRP 658 HE3 TRP 658 -2.242 0.731 4.602 828 HZ2 TRP 658 HZ2 TRP 658 -6.122 2.007 1.757 829 HZ3 TRP 658 HZ3 TRP 658 -1.984 1.130 2.195 830 HH2 TRP 658 HH2 TRP 658 -3.876 1.762 0.813 831 H SER 659 HN SER 659 -0.769 1.628 5.708 832 HA SER 659 HA SER 659 -0.829 4.233 7.087 833 HB2 SER 659 HB2 SER 659 1.590 2.584 6.297 834 HB3 SER 659 HB1 SER 659 1.652 4.194 7.011 835 HG SER 659 HG SER 659 1.833 2.229 8.440 836 H SER 660 HN SER 660 0.441 5.933 5.927 837 HA SER 660 HA SER 660 0.734 5.552 3.044 838 HB2 SER 660 HB2 SER 660 -1.517 6.471 3.235 839 HB3 SER 660 HB1 SER 660 -0.936 7.747 4.303 840 HG SER 660 HG SER 660 -1.217 8.397 2.075 841 H CYS 661 HN CYS 661 2.126 7.073 2.058 842 HA CYS 661 HA CYS 661 4.252 8.005 3.699 843 HB2 CYS 661 HB2 CYS 661 3.594 8.533 0.796 844 HB3 CYS 661 HB1 CYS 661 5.099 9.012 1.575 845 HG CYS 661 HG CYS 661 4.976 6.518 -0.119 846 H CYS 662 HN CYS 662 1.248 9.278 2.847 847 HA CYS 662 HA CYS 662 1.803 11.633 4.385 848 HB2 CYS 662 HB2 CYS 662 2.472 12.342 2.095 849 HB3 CYS 662 HB1 CYS 662 0.851 11.957 1.529 850 HG CYS 662 HG CYS 662 1.761 14.464 3.665 851 HA PRO 663 HA PRO 663 -2.309 9.592 5.039 852 HB2 PRO 663 HB2 PRO 663 -1.761 10.877 7.662 853 HB3 PRO 663 HB1 PRO 663 -2.361 9.254 7.306 854 HG2 PRO 663 HG2 PRO 663 0.150 9.635 8.116 855 HG3 PRO 663 HG1 PRO 663 -0.238 8.418 6.885 856 HD2 PRO 663 HD2 PRO 663 0.982 11.126 6.561 857 HD3 PRO 663 HD1 PRO 663 1.324 9.620 5.684 858 H GLU 664 HN GLU 664 -0.993 12.719 5.854 859 HA GLU 664 HA GLU 664 -3.248 14.239 6.255 860 HB2 GLU 664 HB2 GLU 664 -0.755 14.995 4.727 861 HB3 GLU 664 HB1 GLU 664 -1.920 16.128 5.400 862 HG2 GLU 664 HG2 GLU 664 -0.270 14.186 7.001 863 HG3 GLU 664 HG1 GLU 664 0.097 15.896 6.783 864 H ARG 665 HN ARG 665 -1.543 13.873 3.144 865 HA ARG 665 HA ARG 665 -3.580 15.167 1.662 866 HB2 ARG 665 HB2 ARG 665 -1.209 15.047 0.967 867 HB3 ARG 665 HB1 ARG 665 -1.388 13.323 0.687 868 HG2 ARG 665 HG2 ARG 665 -2.889 13.703 -1.117 869 HG3 ARG 665 HG1 ARG 665 -2.966 15.430 -0.750 870 HD2 ARG 665 HD2 ARG 665 -0.620 15.676 -1.298 871 HD3 ARG 665 HD1 ARG 665 -0.476 13.944 -1.580 872 HE ARG 665 HE ARG 665 -2.146 14.336 -3.435 873 HH11 ARG 665 HH11 ARG 665 0.055 16.848 -2.369 874 HH12 ARG 665 HH12 ARG 665 0.103 17.631 -3.916 875 HH21 ARG 665 HH21 ARG 665 -2.068 15.336 -5.457 876 HH22 ARG 665 HH22 ARG 665 -1.117 16.774 -5.679 877 H THR 666 HN THR 666 -2.857 11.724 2.243 878 HA THR 666 HA THR 666 -4.735 10.710 0.414 879 HB THR 666 HB THR 666 -3.965 9.348 3.000 880 HG1 THR 666 HG1 THR 666 -2.602 9.082 0.513 881 HG21 THR 666 HG21 THR 666 -4.730 8.252 0.281 882 HG22 THR 666 HG22 THR 666 -5.767 8.270 1.706 883 HG23 THR 666 HG23 THR 666 -4.299 7.293 1.696 884 H SER 667 HN SER 667 -5.079 11.551 3.868 885 HA SER 667 HA SER 667 -7.853 10.895 3.933 886 HB2 SER 667 HB2 SER 667 -6.094 12.492 5.795 887 HB3 SER 667 HB1 SER 667 -7.760 12.059 6.134 888 HG SER 667 HG SER 667 -6.528 9.850 5.384 889 H GLN 668 HN GLN 668 -6.000 13.868 3.475 890 HA GLN 668 HA GLN 668 -7.979 15.777 3.598 891 HB2 GLN 668 HB2 GLN 668 -5.414 15.497 2.209 892 HB3 GLN 668 HB1 GLN 668 -6.461 16.812 1.707 893 HG2 GLN 668 HG2 GLN 668 -5.401 16.268 4.456 894 HG3 GLN 668 HG1 GLN 668 -5.010 17.578 3.375 895 HE21 GLN 668 HE21 GLN 668 -7.332 16.323 5.584 896 HE22 GLN 668 HE22 GLN 668 -8.298 17.753 5.698 897 H LEU 669 HN LEU 669 -6.941 13.926 0.755 898 HA LEU 669 HA LEU 669 -8.917 15.349 -0.852 899 HB2 LEU 669 HB2 LEU 669 -6.959 13.328 -1.890 900 HB3 LEU 669 HB1 LEU 669 -7.693 14.679 -2.734 901 HG LEU 669 HG LEU 669 -5.579 14.872 -0.590 902 HD11 LEU 669 HD11 LEU 669 -4.737 14.002 -2.704 903 HD12 LEU 669 HD12 LEU 669 -4.117 15.619 -2.373 904 HD13 LEU 669 HD13 LEU 669 -5.414 15.394 -3.550 905 HD21 LEU 669 HD21 LEU 669 -6.867 17.047 -2.235 906 HD22 LEU 669 HD22 LEU 669 -5.500 17.254 -1.137 907 HD23 LEU 669 HD23 LEU 669 -7.076 16.785 -0.502 908 H PHE 670 HN PHE 670 -8.061 12.078 0.132 909 HA PHE 670 HA PHE 670 -10.305 11.014 -1.427 910 HB2 PHE 670 HB2 PHE 670 -8.105 9.460 -0.057 911 HB3 PHE 670 HB1 PHE 670 -9.200 8.884 -1.306 912 HD1 PHE 670 HD1 PHE 670 -9.114 10.559 -3.486 913 HD2 PHE 670 HD2 PHE 670 -5.972 9.809 -0.724 914 HE1 PHE 670 HE1 PHE 670 -7.463 11.228 -5.187 915 HE2 PHE 670 HE2 PHE 670 -4.319 10.477 -2.409 916 HZ PHE 670 HZ PHE 670 -5.061 11.189 -4.649 917 H ASP 671 HN ASP 671 -9.742 12.123 1.568 918 HA ASP 671 HA ASP 671 -10.668 11.923 3.615 919 HB2 ASP 671 HB2 ASP 671 -12.809 10.829 1.844 920 HB3 ASP 671 HB1 ASP 671 -13.002 10.710 3.588 921 H LEU 672 HN LEU 672 -9.020 9.650 2.435 922 HA LEU 672 HA LEU 672 -9.999 7.432 4.065 923 HB2 LEU 672 HB2 LEU 672 -9.496 6.848 1.785 924 HB3 LEU 672 HB1 LEU 672 -7.894 7.555 1.901 925 HG LEU 672 HG LEU 672 -7.385 5.825 3.678 926 HD11 LEU 672 HD11 LEU 672 -9.943 4.608 2.651 927 HD12 LEU 672 HD12 LEU 672 -9.683 5.279 4.264 928 HD13 LEU 672 HD13 LEU 672 -8.794 3.842 3.752 929 HD21 LEU 672 HD21 LEU 672 -6.973 4.036 2.081 930 HD22 LEU 672 HD22 LEU 672 -6.571 5.608 1.386 931 HD23 LEU 672 HD23 LEU 672 -8.069 4.798 0.927 932 HA PRO 673 HA PRO 673 -6.975 8.666 7.204 933 HB2 PRO 673 HB2 PRO 673 -8.089 6.115 8.256 934 HB3 PRO 673 HB1 PRO 673 -7.826 7.647 9.098 935 HG2 PRO 673 HG2 PRO 673 -10.261 6.985 8.420 936 HG3 PRO 673 HG1 PRO 673 -9.698 8.619 8.018 937 HD2 PRO 673 HD2 PRO 673 -9.815 6.204 6.254 938 HD3 PRO 673 HD1 PRO 673 -10.428 7.828 5.959 939 H CYS 674 HN CYS 674 -4.909 8.055 7.503 940 HA CYS 674 HA CYS 674 -4.160 5.257 7.185 941 HB2 CYS 674 HB2 CYS 674 -2.570 7.401 5.764 942 HB3 CYS 674 HB1 CYS 674 -2.392 5.661 5.655 943 HG CYS 674 HG CYS 674 -5.365 5.989 4.687 944 H SER 675 HN SER 675 -2.409 4.688 8.430 945 HA SER 675 HA SER 675 -1.414 6.560 10.370 946 HB2 SER 675 HB2 SER 675 -0.380 3.796 9.674 947 HB3 SER 675 HB1 SER 675 -0.076 4.688 11.165 948 HG SER 675 HG SER 675 -1.742 3.125 11.406 949 H LYS 676 HN LYS 676 0.996 7.032 10.534 950 HA LYS 676 HA LYS 676 1.865 7.905 7.948 951 HB2 LYS 676 HB2 LYS 676 2.305 9.315 9.883 952 HB3 LYS 676 HB1 LYS 676 3.300 8.051 10.600 953 HG2 LYS 676 HG2 LYS 676 4.665 9.795 9.554 954 HG3 LYS 676 HG1 LYS 676 4.892 8.220 8.770 955 HD2 LYS 676 HD2 LYS 676 3.393 8.879 6.970 956 HD3 LYS 676 HD1 LYS 676 3.070 10.419 7.765 957 HE2 LYS 676 HE2 LYS 676 5.799 9.533 6.845 958 HE3 LYS 676 HE1 LYS 676 4.711 10.529 5.878 959 HZ1 LYS 676 HZ1 LYS 676 4.752 12.196 7.629 960 HZ2 LYS 676 HZ2 LYS 676 6.312 11.879 7.061 961 HZ3 LYS 676 HZ3 LYS 676 5.811 11.242 8.544 962 H LEU 677 HN LEU 677 2.785 6.631 6.537 963 HA LEU 677 HA LEU 677 4.281 4.307 7.289 964 HB2 LEU 677 HB2 LEU 677 3.003 4.392 5.189 965 HB3 LEU 677 HB1 LEU 677 4.004 5.703 4.612 966 HG LEU 677 HG LEU 677 4.441 3.348 3.700 967 HD11 LEU 677 HD11 LEU 677 5.968 5.195 3.307 968 HD12 LEU 677 HD12 LEU 677 6.851 3.692 3.577 969 HD13 LEU 677 HD13 LEU 677 6.745 4.896 4.863 970 HD21 LEU 677 HD21 LEU 677 5.860 1.904 5.004 971 HD22 LEU 677 HD22 LEU 677 4.358 2.218 5.876 972 HD23 LEU 677 HD23 LEU 677 5.839 3.051 6.344 973 H SER 678 HN SER 678 6.331 4.309 7.913 974 HA SER 678 HA SER 678 8.103 6.459 7.007 975 HB2 SER 678 HB2 SER 678 7.888 5.559 9.888 976 HB3 SER 678 HB1 SER 678 8.935 6.830 9.255 977 HG SER 678 HG SER 678 6.480 7.395 8.483 978 H VAL 679 HN VAL 679 10.384 6.014 7.509 979 HA VAL 679 HA VAL 679 11.242 3.575 6.545 980 HB VAL 679 HB VAL 679 12.689 5.394 6.321 981 HG11 VAL 679 HG11 VAL 679 13.643 6.620 8.274 982 HG12 VAL 679 HG12 VAL 679 12.463 5.788 9.290 983 HG13 VAL 679 HG13 VAL 679 11.918 6.865 7.999 984 HG21 VAL 679 HG21 VAL 679 14.777 4.687 7.268 985 HG22 VAL 679 HG22 VAL 679 13.833 3.260 6.840 986 HG23 VAL 679 HG23 VAL 679 13.942 3.770 8.524 987 H GLY 680 HN GLY 680 11.918 1.700 7.439 988 HA2 GLY 680 HA2 GLY 680 12.436 0.322 9.367 989 HA3 GLY 680 HA1 GLY 680 11.371 1.347 10.314 990 H ASP 681 HN ASP 681 9.467 1.308 7.906 991 HA ASP 681 HA ASP 681 8.003 -0.982 8.960 992 HB2 ASP 681 HB2 ASP 681 7.099 1.235 7.094 993 HB3 ASP 681 HB1 ASP 681 6.084 -0.045 7.701 994 H VAL 682 HN VAL 682 8.090 -2.920 7.952 995 HA VAL 682 HA VAL 682 9.058 -3.168 5.302 996 HB VAL 682 HB VAL 682 9.535 -5.084 6.443 997 HG11 VAL 682 HG11 VAL 682 6.826 -5.077 7.619 998 HG12 VAL 682 HG12 VAL 682 8.332 -4.665 8.422 999 HG13 VAL 682 HG13 VAL 682 8.039 -6.321 7.888 1000 HG21 VAL 682 HG21 VAL 682 7.032 -5.657 4.949 1001 HG22 VAL 682 HG22 VAL 682 8.022 -6.925 5.670 1002 HG23 VAL 682 HG23 VAL 682 8.700 -5.880 4.423 1003 H CYS 683 HN CYS 683 7.946 -2.522 3.563 1004 HA CYS 683 HA CYS 683 5.072 -2.348 3.719 1005 HB2 CYS 683 HB2 CYS 683 7.033 -1.624 1.547 1006 HB3 CYS 683 HB1 CYS 683 5.293 -1.462 1.352 1007 HG CYS 683 HG CYS 683 7.003 0.086 3.880 1008 H ILE 684 HN ILE 684 3.599 -3.362 2.439 1009 HA ILE 684 HA ILE 684 4.266 -6.079 1.723 1010 HB ILE 684 HB ILE 684 1.683 -4.498 1.666 1011 HG12 ILE 684 HG12 ILE 684 2.468 -6.834 3.408 1012 HG13 ILE 684 HG11 ILE 684 2.623 -5.150 3.900 1013 HG21 ILE 684 HG21 ILE 684 0.565 -6.699 1.278 1014 HG22 ILE 684 HG22 ILE 684 2.157 -7.363 0.900 1015 HG23 ILE 684 HG23 ILE 684 1.482 -6.075 -0.093 1016 HD11 ILE 684 HD11 ILE 684 0.179 -4.887 3.580 1017 HD12 ILE 684 HD12 ILE 684 0.605 -6.066 4.825 1018 HD13 ILE 684 HD13 ILE 684 0.077 -6.615 3.233 1019 H SER 685 HN SER 685 5.225 -6.353 -0.273 1020 HA SER 685 HA SER 685 4.214 -4.804 -2.520 1021 HB2 SER 685 HB2 SER 685 6.673 -5.482 -2.290 1022 HB3 SER 685 HB1 SER 685 6.150 -7.115 -2.682 1023 HG SER 685 HG SER 685 6.830 -5.428 -4.421 1024 H LEU 686 HN LEU 686 2.435 -5.439 -3.513 1025 HA LEU 686 HA LEU 686 1.613 -8.223 -3.243 1026 HB2 LEU 686 HB2 LEU 686 0.217 -5.888 -2.923 1027 HB3 LEU 686 HB1 LEU 686 -0.202 -6.329 -4.566 1028 HG LEU 686 HG LEU 686 -1.839 -7.140 -2.946 1029 HD11 LEU 686 HD11 LEU 686 -1.553 -8.381 -5.003 1030 HD12 LEU 686 HD12 LEU 686 -1.915 -9.473 -3.665 1031 HD13 LEU 686 HD13 LEU 686 -0.261 -9.333 -4.269 1032 HD21 LEU 686 HD21 LEU 686 -1.256 -8.933 -1.390 1033 HD22 LEU 686 HD22 LEU 686 -0.381 -7.445 -1.034 1034 HD23 LEU 686 HD23 LEU 686 0.438 -8.775 -1.849 1035 H THR 687 HN THR 687 1.741 -9.563 -4.946 1036 HA THR 687 HA THR 687 2.534 -8.393 -7.500 1037 HB THR 687 HB THR 687 2.538 -11.287 -6.648 1038 HG1 THR 687 HG1 THR 687 4.454 -9.222 -6.447 1039 HG21 THR 687 HG21 THR 687 2.460 -10.977 -9.069 1040 HG22 THR 687 HG22 THR 687 4.025 -11.611 -8.561 1041 HG23 THR 687 HG23 THR 687 3.859 -9.907 -8.980 1042 H LEU 688 HN LEU 688 1.006 -8.020 -8.907 1043 HA LEU 688 HA LEU 688 -1.437 -9.614 -8.940 1044 HB2 LEU 688 HB2 LEU 688 -0.615 -6.945 -9.876 1045 HB3 LEU 688 HB1 LEU 688 -1.632 -7.813 -11.004 1046 HG LEU 688 HG LEU 688 -2.877 -6.268 -9.514 1047 HD11 LEU 688 HD11 LEU 688 -4.014 -8.124 -10.553 1048 HD12 LEU 688 HD12 LEU 688 -4.648 -7.860 -8.927 1049 HD13 LEU 688 HD13 LEU 688 -3.533 -9.191 -9.235 1050 HD21 LEU 688 HD21 LEU 688 -2.030 -8.184 -7.339 1051 HD22 LEU 688 HD22 LEU 688 -3.273 -6.940 -7.170 1052 HD23 LEU 688 HD23 LEU 688 -1.594 -6.478 -7.469 1053 H LYS 689 HN LYS 689 -0.993 -11.531 -9.893 1054 HA LYS 689 HA LYS 689 0.919 -11.835 -11.965 1055 HB2 LYS 689 HB2 LYS 689 -1.137 -13.670 -10.803 1056 HB3 LYS 689 HB1 LYS 689 -0.091 -14.153 -12.118 1057 HG2 LYS 689 HG2 LYS 689 0.980 -13.119 -9.540 1058 HG3 LYS 689 HG1 LYS 689 0.630 -14.828 -9.819 1059 HD2 LYS 689 HD2 LYS 689 2.122 -14.792 -11.775 1060 HD3 LYS 689 HD1 LYS 689 2.501 -13.102 -11.436 1061 HE2 LYS 689 HE2 LYS 689 3.282 -13.806 -9.205 1062 HE3 LYS 689 HE1 LYS 689 3.067 -15.481 -9.693 1063 HZ1 LYS 689 HZ1 LYS 689 4.674 -15.134 -11.466 1064 HZ2 LYS 689 HZ2 LYS 689 5.364 -14.777 -9.964 1065 HZ3 LYS 689 HZ3 LYS 689 4.885 -13.523 -10.995 Start of MODEL 14 1 H1 VAL 34 HT1 VAL 34 -19.152 -3.017 -5.492 2 H2 VAL 34 HT2 VAL 34 -18.549 -3.785 -6.874 3 H3 VAL 34 HT3 VAL 34 -18.128 -2.184 -6.548 4 HA VAL 34 HA VAL 34 -16.915 -2.825 -4.604 5 HB VAL 34 HB VAL 34 -18.353 -4.758 -4.058 6 HG11 VAL 34 HG11 VAL 34 -16.832 -6.168 -6.234 7 HG12 VAL 34 HG12 VAL 34 -18.552 -5.780 -6.242 8 HG13 VAL 34 HG13 VAL 34 -17.917 -6.944 -5.080 9 HG21 VAL 34 HG21 VAL 34 -16.623 -6.191 -3.142 10 HG22 VAL 34 HG22 VAL 34 -16.231 -4.486 -2.926 11 HG23 VAL 34 HG23 VAL 34 -15.432 -5.423 -4.189 12 H PHE 35 HN PHE 35 -14.757 -3.799 -4.687 13 HA PHE 35 HA PHE 35 -13.774 -4.204 -7.425 14 HB2 PHE 35 HB2 PHE 35 -12.749 -2.168 -5.445 15 HB3 PHE 35 HB1 PHE 35 -11.807 -2.715 -6.827 16 HD1 PHE 35 HD2 PHE 35 -12.492 -2.154 -9.096 17 HD2 PHE 35 HD1 PHE 35 -14.592 -0.692 -5.701 18 HE1 PHE 35 HE2 PHE 35 -13.577 -0.453 -10.505 19 HE2 PHE 35 HE1 PHE 35 -15.671 1.005 -7.096 20 HZ PHE 35 HZ PHE 35 -15.175 1.130 -9.502 21 HA PRO 36 HA PRO 36 -11.153 -7.377 -5.644 22 HB2 PRO 36 HB2 PRO 36 -9.241 -6.297 -7.663 23 HB3 PRO 36 HB1 PRO 36 -9.727 -7.969 -7.363 24 HG2 PRO 36 HG2 PRO 36 -10.679 -6.672 -9.463 25 HG3 PRO 36 HG1 PRO 36 -11.741 -7.720 -8.504 26 HD2 PRO 36 HD2 PRO 36 -11.531 -4.734 -8.520 27 HD3 PRO 36 HD1 PRO 36 -12.974 -5.764 -8.407 28 H TRP 37 HN TRP 37 -9.528 -7.395 -4.153 29 HA TRP 37 HA TRP 37 -9.344 -5.058 -2.708 30 HB2 TRP 37 HB2 TRP 37 -7.688 -6.366 -1.287 31 HB3 TRP 37 HB1 TRP 37 -9.304 -7.026 -1.491 32 HD1 TRP 37 HD1 TRP 37 -9.463 -9.062 -3.444 33 HE1 TRP 37 HE1 TRP 37 -7.791 -10.956 -3.870 34 HE3 TRP 37 HE3 TRP 37 -5.358 -7.026 -1.189 35 HZ2 TRP 37 HZ2 TRP 37 -5.105 -11.526 -3.293 36 HZ3 TRP 37 HZ3 TRP 37 -3.269 -8.321 -1.178 37 HH2 TRP 37 HH2 TRP 37 -3.154 -10.524 -2.216 38 H HIS 38 HN HIS 38 -7.099 -6.124 -5.184 39 HA HIS 38 HA HIS 38 -4.986 -4.458 -4.263 40 HB2 HIS 38 HB2 HIS 38 -3.898 -4.881 -6.365 41 HB3 HIS 38 HB1 HIS 38 -4.659 -6.371 -5.833 42 HD1 HIS 38 HD1 HIS 38 -4.112 -4.554 -8.789 43 HD2 HIS 38 HD2 HIS 38 -7.413 -6.528 -7.220 44 HE1 HIS 38 HE1 HIS 38 -5.618 -5.013 -10.747 45 HE2 HIS 38 HE2 HIS 38 -7.666 -6.094 -9.757 46 H SER 39 HN SER 39 -6.928 -2.810 -3.896 47 HA SER 39 HA SER 39 -7.232 -1.085 -6.267 48 HB2 SER 39 HB2 SER 39 -9.353 -1.947 -5.480 49 HB3 SER 39 HB1 SER 39 -8.987 -1.470 -3.826 50 HG SER 39 HG SER 39 -8.908 0.750 -4.749 51 H LEU 40 HN LEU 40 -5.838 -1.324 -3.206 52 HA LEU 40 HA LEU 40 -5.401 1.592 -3.048 53 HB2 LEU 40 HB2 LEU 40 -5.320 0.507 -0.433 54 HB3 LEU 40 HB1 LEU 40 -6.461 1.662 -1.098 55 HG LEU 40 HG LEU 40 -6.929 -1.247 -1.608 56 HD11 LEU 40 HD11 LEU 40 -7.538 0.192 0.961 57 HD12 LEU 40 HD12 LEU 40 -6.535 -1.243 0.751 58 HD13 LEU 40 HD13 LEU 40 -8.277 -1.334 0.472 59 HD21 LEU 40 HD21 LEU 40 -8.746 1.123 -1.166 60 HD22 LEU 40 HD22 LEU 40 -9.274 -0.517 -1.531 61 HD23 LEU 40 HD23 LEU 40 -8.349 0.395 -2.724 62 H VAL 41 HN VAL 41 -4.194 -1.648 -2.704 63 HA VAL 41 HA VAL 41 -1.761 -0.901 -1.414 64 HB VAL 41 HB VAL 41 -2.707 -3.094 -1.009 65 HG11 VAL 41 HG11 VAL 41 -2.185 -3.701 -3.921 66 HG12 VAL 41 HG12 VAL 41 -3.770 -3.460 -3.188 67 HG13 VAL 41 HG13 VAL 41 -2.778 -4.835 -2.706 68 HG21 VAL 41 HG21 VAL 41 -0.304 -2.808 -0.833 69 HG22 VAL 41 HG22 VAL 41 -0.122 -3.271 -2.524 70 HG23 VAL 41 HG23 VAL 41 -0.720 -4.440 -1.348 71 HA PRO 42 HA PRO 42 0.261 -0.088 -5.336 72 HB2 PRO 42 HB2 PRO 42 2.191 1.513 -4.273 73 HB3 PRO 42 HB1 PRO 42 0.561 2.075 -4.646 74 HG2 PRO 42 HG2 PRO 42 1.813 1.670 -2.052 75 HG3 PRO 42 HG1 PRO 42 0.293 2.488 -2.441 76 HD2 PRO 42 HD2 PRO 42 0.724 -0.217 -1.434 77 HD3 PRO 42 HD1 PRO 42 -0.788 0.705 -1.565 78 H PHE 43 HN PHE 43 1.492 -1.648 -6.153 79 HA PHE 43 HA PHE 43 3.363 -3.155 -4.605 80 HB2 PHE 43 HB2 PHE 43 2.181 -4.137 -6.524 81 HB3 PHE 43 HB1 PHE 43 2.955 -2.985 -7.604 82 HD1 PHE 43 HD1 PHE 43 3.795 -5.658 -5.146 83 HD2 PHE 43 HD2 PHE 43 4.871 -3.609 -8.716 84 HE1 PHE 43 HE1 PHE 43 5.631 -7.254 -5.504 85 HE2 PHE 43 HE2 PHE 43 6.709 -5.201 -9.080 86 HZ PHE 43 HZ PHE 43 7.090 -7.028 -7.474 87 H LEU 44 HN LEU 44 5.289 -2.384 -3.973 88 HA LEU 44 HA LEU 44 6.433 -0.049 -5.060 89 HB2 LEU 44 HB2 LEU 44 8.075 -0.228 -3.453 90 HB3 LEU 44 HB1 LEU 44 6.770 -1.115 -2.700 91 HG LEU 44 HG LEU 44 8.667 -2.336 -2.189 92 HD11 LEU 44 HD11 LEU 44 8.579 -4.434 -3.461 93 HD12 LEU 44 HD12 LEU 44 7.537 -3.638 -4.642 94 HD13 LEU 44 HD13 LEU 44 6.994 -3.836 -2.975 95 HD21 LEU 44 HD21 LEU 44 9.627 -2.037 -5.023 96 HD22 LEU 44 HD22 LEU 44 10.450 -2.930 -3.743 97 HD23 LEU 44 HD23 LEU 44 10.246 -1.182 -3.609 98 H ALA 45 HN ALA 45 8.555 0.090 -6.165 99 HA ALA 45 HA ALA 45 8.428 -0.993 -8.665 100 HB1 ALA 45 HB1 ALA 45 10.755 -0.329 -8.966 101 HB2 ALA 45 HB2 ALA 45 10.941 -0.174 -7.220 102 HB3 ALA 45 HB3 ALA 45 9.843 0.899 -8.091 103 HA PRO 46 HA PRO 46 8.950 -5.369 -8.500 104 HB2 PRO 46 HB2 PRO 46 10.620 -4.663 -10.890 105 HB3 PRO 46 HB1 PRO 46 9.454 -5.978 -10.691 106 HG2 PRO 46 HG2 PRO 46 8.799 -3.704 -11.956 107 HG3 PRO 46 HG1 PRO 46 7.633 -4.587 -10.958 108 HD2 PRO 46 HD2 PRO 46 8.930 -2.000 -10.461 109 HD3 PRO 46 HD1 PRO 46 7.480 -2.693 -9.713 110 H SER 47 HN SER 47 10.206 -5.981 -6.866 111 HA SER 47 HA SER 47 12.748 -5.053 -6.255 112 HB2 SER 47 HB2 SER 47 11.629 -7.742 -5.464 113 HB3 SER 47 HB1 SER 47 12.764 -6.735 -4.567 114 HG SER 47 HG SER 47 10.983 -6.091 -3.620 115 H GLN 48 HN GLN 48 14.683 -5.469 -7.045 116 HA GLN 48 HA GLN 48 15.121 -7.079 -9.287 117 HB2 GLN 48 HB2 GLN 48 17.075 -5.903 -7.307 118 HB3 GLN 48 HB1 GLN 48 17.565 -6.727 -8.777 119 HG2 GLN 48 HG2 GLN 48 17.669 -4.474 -9.316 120 HG3 GLN 48 HG1 GLN 48 16.144 -5.012 -10.011 121 HE21 GLN 48 HE21 GLN 48 14.216 -4.254 -9.157 122 HE22 GLN 48 HE22 GLN 48 14.157 -2.915 -8.061 123 H ALA 567 HT1 ALA 567 -19.353 18.521 -4.942 124 HA ALA 567 HA ALA 567 -17.598 16.163 -5.256 125 HB1 ALA 567 HB1 ALA 567 -18.496 17.581 -2.750 126 HB2 ALA 567 HB2 ALA 567 -16.874 17.641 -3.440 127 HB3 ALA 567 HB3 ALA 567 -17.515 16.116 -2.826 128 HA PRO 568 HA PRO 568 -21.518 14.089 -5.119 129 HB2 PRO 568 HB2 PRO 568 -20.622 11.554 -5.059 130 HB3 PRO 568 HB1 PRO 568 -20.491 12.557 -6.509 131 HG2 PRO 568 HG2 PRO 568 -18.403 11.832 -4.508 132 HG3 PRO 568 HG1 PRO 568 -18.259 12.028 -6.263 133 HD2 PRO 568 HD2 PRO 568 -17.524 13.924 -4.369 134 HD3 PRO 568 HD1 PRO 568 -17.848 14.259 -6.079 135 HA PRO 569 HA PRO 569 -22.603 13.309 -0.898 136 HB2 PRO 569 HB2 PRO 569 -23.936 10.861 -1.196 137 HB3 PRO 569 HB1 PRO 569 -24.663 12.466 -1.313 138 HG2 PRO 569 HG2 PRO 569 -23.741 10.641 -3.478 139 HG3 PRO 569 HG1 PRO 569 -25.129 11.740 -3.451 140 HD2 PRO 569 HD2 PRO 569 -22.911 12.343 -4.815 141 HD3 PRO 569 HD1 PRO 569 -23.819 13.598 -3.944 142 H THR 570 HN THR 570 -21.949 10.145 -2.393 143 HA THR 570 HA THR 570 -20.048 9.557 -0.236 144 HB THR 570 HB THR 570 -20.147 7.210 -1.210 145 HG1 THR 570 HG1 THR 570 -21.206 7.018 -3.019 146 HG21 THR 570 HG21 THR 570 -22.719 8.392 -0.155 147 HG22 THR 570 HG22 THR 570 -21.366 7.815 0.818 148 HG23 THR 570 HG23 THR 570 -22.298 6.680 -0.158 149 H LEU 571 HN LEU 571 -17.951 8.693 -0.833 150 HA LEU 571 HA LEU 571 -16.870 10.048 -3.113 151 HB2 LEU 571 HB2 LEU 571 -15.604 8.185 -1.107 152 HB3 LEU 571 HB1 LEU 571 -14.731 9.005 -2.376 153 HG LEU 571 HG LEU 571 -15.730 11.164 -1.258 154 HD11 LEU 571 HD11 LEU 571 -15.884 10.906 1.176 155 HD12 LEU 571 HD12 LEU 571 -15.759 9.157 0.978 156 HD13 LEU 571 HD13 LEU 571 -17.147 10.025 0.320 157 HD21 LEU 571 HD21 LEU 571 -13.475 9.625 0.014 158 HD22 LEU 571 HD22 LEU 571 -13.720 11.373 0.052 159 HD23 LEU 571 HD23 LEU 571 -13.345 10.567 -1.471 160 HA PRO 572 HA PRO 572 -16.737 6.898 -6.282 161 HB2 PRO 572 HB2 PRO 572 -13.769 7.039 -5.912 162 HB3 PRO 572 HB1 PRO 572 -14.711 7.032 -7.404 163 HG2 PRO 572 HG2 PRO 572 -13.705 9.300 -6.444 164 HG3 PRO 572 HG1 PRO 572 -15.306 9.257 -7.201 165 HD2 PRO 572 HD2 PRO 572 -14.575 9.536 -4.349 166 HD3 PRO 572 HD1 PRO 572 -16.013 10.114 -5.206 167 HA PRO 573 HA PRO 573 -16.542 3.279 -3.819 168 HB2 PRO 573 HB2 PRO 573 -16.935 1.417 -5.713 169 HB3 PRO 573 HB1 PRO 573 -18.202 2.550 -5.229 170 HG2 PRO 573 HG2 PRO 573 -16.360 2.684 -7.589 171 HG3 PRO 573 HG1 PRO 573 -18.099 2.963 -7.512 172 HD2 PRO 573 HD2 PRO 573 -16.311 4.981 -7.536 173 HD3 PRO 573 HD1 PRO 573 -17.863 5.086 -6.686 174 H TYR 574 HN TYR 574 -14.186 4.019 -6.089 175 HA TYR 574 HA TYR 574 -12.585 1.651 -5.499 176 HB2 TYR 574 HB2 TYR 574 -12.757 2.541 -7.808 177 HB3 TYR 574 HB1 TYR 574 -11.911 3.982 -7.282 178 HD1 TYR 574 HD2 TYR 574 -11.622 0.429 -8.080 179 HD2 TYR 574 HD1 TYR 574 -9.512 3.909 -6.843 180 HE1 TYR 574 HE2 TYR 574 -9.492 -0.685 -8.596 181 HE2 TYR 574 HE1 TYR 574 -7.378 2.806 -7.359 182 HH TYR 574 HH TYR 574 -7.203 -0.117 -9.122 183 H PHE 575 HN PHE 575 -11.869 1.846 -3.449 184 HA PHE 575 HA PHE 575 -10.303 2.192 -1.904 185 HB2 PHE 575 HB2 PHE 575 -8.249 2.510 -2.658 186 HB3 PHE 575 HB1 PHE 575 -8.983 2.709 -4.243 187 HD1 PHE 575 HD1 PHE 575 -9.193 4.948 -5.215 188 HD2 PHE 575 HD2 PHE 575 -7.302 4.319 -1.460 189 HE1 PHE 575 HE1 PHE 575 -8.162 7.171 -5.367 190 HE2 PHE 575 HE2 PHE 575 -6.275 6.545 -1.600 191 HZ PHE 575 HZ PHE 575 -6.713 7.975 -3.552 192 H MET 576 HN MET 576 -11.925 4.985 -3.106 193 HA MET 576 HA MET 576 -11.063 6.872 -1.198 194 HB2 MET 576 HB2 MET 576 -13.808 6.600 -2.434 195 HB3 MET 576 HB1 MET 576 -13.165 8.041 -1.655 196 HG2 MET 576 HG2 MET 576 -11.983 6.772 -4.117 197 HG3 MET 576 HG1 MET 576 -13.152 8.087 -4.144 198 HE1 MET 576 HE1 MET 576 -11.439 9.436 -5.683 199 HE2 MET 576 HE2 MET 576 -10.279 8.113 -5.572 200 HE3 MET 576 HE3 MET 576 -9.768 9.764 -5.224 201 H LYS 577 HN LYS 577 -12.444 7.698 0.640 202 HA LYS 577 HA LYS 577 -12.774 5.667 2.535 203 HB2 LYS 577 HB2 LYS 577 -12.346 8.044 3.098 204 HB3 LYS 577 HB1 LYS 577 -13.993 8.431 2.611 205 HG2 LYS 577 HG2 LYS 577 -14.856 6.951 4.359 206 HG3 LYS 577 HG1 LYS 577 -13.205 6.576 4.853 207 HD2 LYS 577 HD2 LYS 577 -12.843 8.943 5.387 208 HD3 LYS 577 HD1 LYS 577 -14.507 9.295 4.915 209 HE2 LYS 577 HE2 LYS 577 -15.341 7.858 6.679 210 HE3 LYS 577 HE1 LYS 577 -13.695 7.403 7.118 211 HZ1 LYS 577 HZ1 LYS 577 -13.252 9.645 7.786 212 HZ2 LYS 577 HZ2 LYS 577 -14.648 9.118 8.575 213 HZ3 LYS 577 HZ3 LYS 577 -14.768 10.167 7.254 214 H GLY 578 HN GLY 578 -14.322 4.260 2.867 215 HA2 GLY 578 HA2 GLY 578 -16.597 3.752 3.368 216 HA3 GLY 578 HA1 GLY 578 -17.093 4.973 2.213 217 H SER 579 HN SER 579 -14.713 3.574 0.618 218 HA SER 579 HA SER 579 -16.405 2.077 -1.091 219 HB2 SER 579 HB2 SER 579 -13.385 2.050 -0.939 220 HB3 SER 579 HB1 SER 579 -14.371 1.544 -2.311 221 HG SER 579 HG SER 579 -13.708 4.084 -1.425 222 H ILE 580 HN ILE 580 -16.792 -0.063 -1.241 223 HA ILE 580 HA ILE 580 -15.868 -1.740 0.945 224 HB ILE 580 HB ILE 580 -17.936 -2.194 -1.204 225 HG12 ILE 580 HG12 ILE 580 -18.631 -0.647 0.542 226 HG13 ILE 580 HG11 ILE 580 -19.500 -2.167 0.715 227 HG21 ILE 580 HG21 ILE 580 -16.840 -4.303 -0.686 228 HG22 ILE 580 HG22 ILE 580 -18.489 -4.280 -0.061 229 HG23 ILE 580 HG23 ILE 580 -17.128 -4.042 1.034 230 HD11 ILE 580 HD11 ILE 580 -17.899 -2.818 2.490 231 HD12 ILE 580 HD12 ILE 580 -18.849 -1.384 2.877 232 HD13 ILE 580 HD13 ILE 580 -17.171 -1.216 2.365 233 H ILE 581 HN ILE 581 -14.113 -2.859 0.737 234 HA ILE 581 HA ILE 581 -13.057 -3.424 -1.940 235 HB ILE 581 HB ILE 581 -11.611 -3.650 0.699 236 HG12 ILE 581 HG12 ILE 581 -12.407 -1.361 0.468 237 HG13 ILE 581 HG11 ILE 581 -10.669 -1.417 0.233 238 HG21 ILE 581 HG21 ILE 581 -10.558 -4.825 -1.115 239 HG22 ILE 581 HG22 ILE 581 -9.614 -3.392 -0.703 240 HG23 ILE 581 HG23 ILE 581 -10.645 -3.387 -2.133 241 HD11 ILE 581 HD11 ILE 581 -11.627 0.085 -1.342 242 HD12 ILE 581 HD12 ILE 581 -12.773 -1.138 -1.891 243 HD13 ILE 581 HD13 ILE 581 -11.047 -1.340 -2.203 244 H GLN 582 HN GLN 582 -12.921 -5.474 -2.680 245 HA GLN 582 HA GLN 582 -13.833 -7.605 -0.888 246 HB2 GLN 582 HB2 GLN 582 -15.041 -7.303 -2.994 247 HB3 GLN 582 HB1 GLN 582 -13.568 -7.578 -3.888 248 HG2 GLN 582 HG2 GLN 582 -13.443 -9.854 -2.974 249 HG3 GLN 582 HG1 GLN 582 -14.956 -9.573 -2.117 250 HE21 GLN 582 HE21 GLN 582 -15.996 -11.236 -3.185 251 HE22 GLN 582 HE22 GLN 582 -16.466 -11.125 -4.843 252 H LEU 583 HN LEU 583 -12.355 -8.784 0.057 253 HA LEU 583 HA LEU 583 -9.674 -8.998 -0.978 254 HB2 LEU 583 HB2 LEU 583 -10.901 -10.567 1.281 255 HB3 LEU 583 HB1 LEU 583 -9.196 -10.282 0.985 256 HG LEU 583 HG LEU 583 -11.193 -8.161 1.761 257 HD11 LEU 583 HD11 LEU 583 -10.161 -8.218 3.929 258 HD12 LEU 583 HD12 LEU 583 -8.998 -9.429 3.385 259 HD13 LEU 583 HD13 LEU 583 -10.709 -9.848 3.520 260 HD21 LEU 583 HD21 LEU 583 -9.389 -7.270 0.396 261 HD22 LEU 583 HD22 LEU 583 -8.194 -8.073 1.415 262 HD23 LEU 583 HD23 LEU 583 -9.182 -6.772 2.076 263 H ALA 584 HN ALA 584 -8.670 -11.267 -1.075 264 HA ALA 584 HA ALA 584 -9.916 -12.614 -3.198 265 HB1 ALA 584 HB1 ALA 584 -7.486 -12.599 -2.899 266 HB2 ALA 584 HB2 ALA 584 -8.112 -14.242 -3.043 267 HB3 ALA 584 HB3 ALA 584 -7.658 -13.608 -1.462 268 H ASN 585 HN ASN 585 -10.094 -13.050 0.236 269 HA ASN 585 HA ASN 585 -11.139 -15.729 0.079 270 HB2 ASN 585 HB2 ASN 585 -11.368 -15.586 2.489 271 HB3 ASN 585 HB1 ASN 585 -9.785 -14.997 2.014 272 HD21 ASN 585 HD21 ASN 585 -11.073 -14.489 4.461 273 HD22 ASN 585 HD22 ASN 585 -11.335 -12.779 4.578 274 H GLY 586 HN GLY 586 -12.391 -12.627 -0.338 275 HA2 GLY 586 HA2 GLY 586 -14.593 -12.528 -1.330 276 HA3 GLY 586 HA1 GLY 586 -15.101 -13.768 -0.198 277 H GLU 587 HN GLU 587 -13.220 -11.689 1.550 278 HA GLU 587 HA GLU 587 -15.439 -10.603 2.906 279 HB2 GLU 587 HB2 GLU 587 -12.530 -9.972 3.064 280 HB3 GLU 587 HB1 GLU 587 -13.724 -9.197 4.089 281 HG2 GLU 587 HG2 GLU 587 -14.433 -11.518 4.736 282 HG3 GLU 587 HG1 GLU 587 -12.944 -12.069 3.966 283 H LEU 588 HN LEU 588 -16.183 -8.614 3.116 284 HA LEU 588 HA LEU 588 -15.478 -6.683 1.009 285 HB2 LEU 588 HB2 LEU 588 -18.255 -7.267 2.046 286 HB3 LEU 588 HB1 LEU 588 -17.830 -6.165 0.749 287 HG LEU 588 HG LEU 588 -17.436 -9.158 0.665 288 HD11 LEU 588 HD11 LEU 588 -19.798 -8.573 0.659 289 HD12 LEU 588 HD12 LEU 588 -19.294 -9.148 -0.929 290 HD13 LEU 588 HD13 LEU 588 -19.528 -7.422 -0.649 291 HD21 LEU 588 HD21 LEU 588 -15.819 -8.000 -0.707 292 HD22 LEU 588 HD22 LEU 588 -17.091 -7.019 -1.433 293 HD23 LEU 588 HD23 LEU 588 -17.033 -8.754 -1.739 294 H LYS 589 HN LYS 589 -14.322 -5.321 2.286 295 HA LYS 589 HA LYS 589 -15.559 -4.413 4.800 296 HB2 LYS 589 HB2 LYS 589 -12.628 -4.898 4.273 297 HB3 LYS 589 HB1 LYS 589 -13.340 -4.393 5.795 298 HG2 LYS 589 HG2 LYS 589 -14.446 -6.490 6.061 299 HG3 LYS 589 HG1 LYS 589 -13.995 -6.991 4.434 300 HD2 LYS 589 HD2 LYS 589 -12.527 -8.132 5.879 301 HD3 LYS 589 HD1 LYS 589 -11.582 -6.809 5.199 302 HE2 LYS 589 HE2 LYS 589 -13.002 -6.429 7.798 303 HE3 LYS 589 HE1 LYS 589 -11.493 -7.337 7.753 304 HZ1 LYS 589 HZ1 LYS 589 -11.379 -4.845 8.195 305 HZ2 LYS 589 HZ2 LYS 589 -11.686 -4.656 6.542 306 HZ3 LYS 589 HZ3 LYS 589 -10.306 -5.499 7.055 307 H LYS 590 HN LYS 590 -14.941 -2.291 5.512 308 HA LYS 590 HA LYS 590 -14.789 -0.377 3.406 309 HB2 LYS 590 HB2 LYS 590 -14.588 -0.089 6.406 310 HB3 LYS 590 HB1 LYS 590 -14.572 1.273 5.298 311 HG2 LYS 590 HG2 LYS 590 -16.804 -0.684 5.193 312 HG3 LYS 590 HG1 LYS 590 -16.778 0.545 6.455 313 HD2 LYS 590 HD2 LYS 590 -16.678 2.288 4.765 314 HD3 LYS 590 HD1 LYS 590 -16.646 1.076 3.485 315 HE2 LYS 590 HE2 LYS 590 -18.843 0.273 4.210 316 HE3 LYS 590 HE1 LYS 590 -18.871 1.503 5.470 317 HZ1 LYS 590 HZ1 LYS 590 -18.725 2.074 2.558 318 HZ2 LYS 590 HZ2 LYS 590 -18.891 3.209 3.803 319 HZ3 LYS 590 HZ3 LYS 590 -20.143 2.123 3.479 320 H VAL 591 HN VAL 591 -13.122 1.053 2.916 321 HA VAL 591 HA VAL 591 -10.711 -0.181 2.451 322 HB VAL 591 HB VAL 591 -10.898 2.805 2.731 323 HG11 VAL 591 HG11 VAL 591 -9.319 2.771 0.861 324 HG12 VAL 591 HG12 VAL 591 -9.343 1.009 0.883 325 HG13 VAL 591 HG13 VAL 591 -8.702 1.898 2.264 326 HG21 VAL 591 HG21 VAL 591 -11.727 2.894 0.439 327 HG22 VAL 591 HG22 VAL 591 -12.871 2.089 1.513 328 HG23 VAL 591 HG23 VAL 591 -11.867 1.135 0.420 329 H GLU 592 HN GLU 592 -11.445 2.153 5.025 330 HA GLU 592 HA GLU 592 -8.730 2.350 5.887 331 HB2 GLU 592 HB2 GLU 592 -9.611 3.748 7.679 332 HB3 GLU 592 HB1 GLU 592 -10.331 4.197 6.138 333 HG2 GLU 592 HG2 GLU 592 -12.337 2.911 6.713 334 HG3 GLU 592 HG1 GLU 592 -11.616 2.505 8.269 335 H ASP 593 HN ASP 593 -11.252 0.158 6.551 336 HA ASP 593 HA ASP 593 -10.200 -0.534 9.183 337 HB2 ASP 593 HB2 ASP 593 -12.601 -0.328 9.072 338 HB3 ASP 593 HB1 ASP 593 -12.681 -1.396 7.676 339 H LEU 594 HN LEU 594 -9.808 -1.426 5.988 340 HA LEU 594 HA LEU 594 -9.334 -4.169 6.150 341 HB2 LEU 594 HB2 LEU 594 -7.987 -2.049 4.486 342 HB3 LEU 594 HB1 LEU 594 -7.777 -3.774 4.245 343 HG LEU 594 HG LEU 594 -10.480 -2.465 4.114 344 HD11 LEU 594 HD11 LEU 594 -9.035 -1.397 2.484 345 HD12 LEU 594 HD12 LEU 594 -10.207 -2.455 1.698 346 HD13 LEU 594 HD13 LEU 594 -8.534 -2.977 1.880 347 HD21 LEU 594 HD21 LEU 594 -9.369 -5.051 3.047 348 HD22 LEU 594 HD22 LEU 594 -11.010 -4.461 2.803 349 HD23 LEU 594 HD23 LEU 594 -10.455 -4.876 4.425 350 H LYS 595 HN LYS 595 -8.012 -5.210 7.415 351 HA LYS 595 HA LYS 595 -5.730 -3.842 8.597 352 HB2 LYS 595 HB2 LYS 595 -6.847 -6.616 9.042 353 HB3 LYS 595 HB1 LYS 595 -5.490 -5.926 9.922 354 HG2 LYS 595 HG2 LYS 595 -8.280 -4.801 9.925 355 HG3 LYS 595 HG1 LYS 595 -7.605 -5.842 11.180 356 HD2 LYS 595 HD2 LYS 595 -5.846 -4.168 11.592 357 HD3 LYS 595 HD1 LYS 595 -6.574 -3.124 10.369 358 HE2 LYS 595 HE2 LYS 595 -7.229 -2.462 12.632 359 HE3 LYS 595 HE1 LYS 595 -8.615 -2.982 11.677 360 HZ1 LYS 595 HZ1 LYS 595 -8.526 -5.129 12.779 361 HZ2 LYS 595 HZ2 LYS 595 -8.685 -3.887 13.914 362 HZ3 LYS 595 HZ3 LYS 595 -7.186 -4.635 13.686 363 H THR 596 HN THR 596 -3.614 -4.970 8.577 364 HA THR 596 HA THR 596 -2.883 -5.558 5.939 365 HB THR 596 HB THR 596 -1.301 -4.685 7.613 366 HG1 THR 596 HG1 THR 596 0.195 -6.766 7.042 367 HG21 THR 596 HG21 THR 596 -2.049 -6.163 9.489 368 HG22 THR 596 HG22 THR 596 -0.303 -6.101 9.266 369 HG23 THR 596 HG23 THR 596 -1.214 -7.499 8.691 370 H GLU 597 HN GLU 597 -3.640 -7.657 8.684 371 HA GLU 597 HA GLU 597 -2.870 -10.094 7.602 372 HB2 GLU 597 HB2 GLU 597 -5.135 -9.490 9.485 373 HB3 GLU 597 HB1 GLU 597 -4.547 -11.105 9.137 374 HG2 GLU 597 HG2 GLU 597 -2.306 -10.370 9.970 375 HG3 GLU 597 HG1 GLU 597 -3.067 -8.867 10.493 376 H ASP 598 HN ASP 598 -5.642 -8.132 6.946 377 HA ASP 598 HA ASP 598 -7.300 -10.025 5.692 378 HB2 ASP 598 HB2 ASP 598 -6.997 -7.047 5.263 379 HB3 ASP 598 HB1 ASP 598 -8.229 -8.008 4.463 380 H PHE 599 HN PHE 599 -4.760 -7.907 4.476 381 HA PHE 599 HA PHE 599 -4.979 -8.874 1.794 382 HB2 PHE 599 HB2 PHE 599 -3.059 -7.030 3.177 383 HB3 PHE 599 HB1 PHE 599 -2.696 -7.652 1.572 384 HD1 PHE 599 HD2 PHE 599 -5.916 -6.546 3.095 385 HD2 PHE 599 HD1 PHE 599 -2.993 -5.940 0.062 386 HE1 PHE 599 HE2 PHE 599 -7.352 -4.842 2.057 387 HE2 PHE 599 HE1 PHE 599 -4.431 -4.238 -0.985 388 HZ PHE 599 HZ PHE 599 -6.613 -3.687 0.014 389 H ILE 600 HN ILE 600 -2.797 -9.525 4.552 390 HA ILE 600 HA ILE 600 -1.037 -11.268 3.468 391 HB ILE 600 HB ILE 600 -2.507 -11.218 6.053 392 HG12 ILE 600 HG12 ILE 600 -0.593 -10.364 6.913 393 HG13 ILE 600 HG11 ILE 600 0.432 -11.033 5.695 394 HG21 ILE 600 HG21 ILE 600 -0.945 -12.954 6.890 395 HG22 ILE 600 HG22 ILE 600 -0.440 -13.248 5.225 396 HG23 ILE 600 HG23 ILE 600 -2.109 -13.557 5.710 397 HD11 ILE 600 HD11 ILE 600 0.481 -8.682 5.520 398 HD12 ILE 600 HD12 ILE 600 -1.282 -8.599 5.549 399 HD13 ILE 600 HD13 ILE 600 -0.456 -9.299 4.154 400 H GLN 601 HN GLN 601 -4.168 -12.168 4.870 401 HA GLN 601 HA GLN 601 -4.090 -14.858 4.180 402 HB2 GLN 601 HB2 GLN 601 -6.279 -12.981 4.933 403 HB3 GLN 601 HB1 GLN 601 -6.702 -14.581 4.335 404 HG2 GLN 601 HG2 GLN 601 -5.367 -15.607 6.060 405 HG3 GLN 601 HG1 GLN 601 -4.878 -14.021 6.659 406 HE21 GLN 601 HE21 GLN 601 -5.728 -14.395 8.690 407 HE22 GLN 601 HE22 GLN 601 -7.430 -14.435 8.992 408 H SER 602 HN SER 602 -5.627 -12.185 2.418 409 HA SER 602 HA SER 602 -6.844 -13.763 0.456 410 HB2 SER 602 HB2 SER 602 -6.792 -11.617 -0.903 411 HB3 SER 602 HB1 SER 602 -7.528 -11.515 0.684 412 HG SER 602 HG SER 602 -5.909 -10.344 1.424 413 H ALA 603 HN ALA 603 -3.705 -12.149 0.462 414 HA ALA 603 HA ALA 603 -2.899 -13.072 -2.098 415 HB1 ALA 603 HB1 ALA 603 -1.728 -11.225 -1.349 416 HB2 ALA 603 HB2 ALA 603 -0.567 -12.531 -1.120 417 HB3 ALA 603 HB3 ALA 603 -1.488 -11.911 0.251 418 H GLU 604 HN GLU 604 -2.712 -14.484 1.105 419 HA GLU 604 HA GLU 604 -0.851 -16.537 0.423 420 HB2 GLU 604 HB2 GLU 604 -2.863 -16.348 2.667 421 HB3 GLU 604 HB1 GLU 604 -1.662 -17.627 2.518 422 HG2 GLU 604 HG2 GLU 604 0.083 -15.832 2.539 423 HG3 GLU 604 HG1 GLU 604 -1.194 -14.693 2.958 424 H ILE 605 HN ILE 605 -4.366 -16.428 0.752 425 HA ILE 605 HA ILE 605 -4.971 -19.001 -0.159 426 HB ILE 605 HB ILE 605 -6.527 -16.425 -0.518 427 HG12 ILE 605 HG12 ILE 605 -6.814 -18.540 1.619 428 HG13 ILE 605 HG11 ILE 605 -5.819 -17.107 1.819 429 HG21 ILE 605 HG21 ILE 605 -7.493 -19.281 -0.607 430 HG22 ILE 605 HG22 ILE 605 -7.346 -18.201 -1.993 431 HG23 ILE 605 HG23 ILE 605 -8.506 -17.841 -0.713 432 HD11 ILE 605 HD11 ILE 605 -7.861 -15.737 1.419 433 HD12 ILE 605 HD12 ILE 605 -7.884 -16.709 2.891 434 HD13 ILE 605 HD13 ILE 605 -8.798 -17.233 1.471 435 H SER 606 HN SER 606 -4.432 -15.971 -1.881 436 HA SER 606 HA SER 606 -3.344 -15.562 -3.805 437 HB2 SER 606 HB2 SER 606 -1.809 -17.316 -2.852 438 HB3 SER 606 HB1 SER 606 -2.629 -18.491 -3.881 439 HG SER 606 HG SER 606 -0.991 -16.314 -4.597 440 H ASN 607 HN ASN 607 -5.294 -15.094 -4.900 441 HA ASN 607 HA ASN 607 -5.892 -17.046 -7.004 442 HB2 ASN 607 HB2 ASN 607 -7.799 -15.819 -5.860 443 HB3 ASN 607 HB1 ASN 607 -7.185 -14.335 -6.585 444 HD21 ASN 607 HD21 ASN 607 -9.047 -14.012 -7.795 445 HD22 ASN 607 HD22 ASN 607 -9.438 -14.986 -9.170 446 H ASP 608 HN ASP 608 -3.475 -16.552 -7.353 447 HA ASP 608 HA ASP 608 -1.885 -15.813 -8.802 448 HB2 ASP 608 HB2 ASP 608 -4.157 -14.170 -9.883 449 HB3 ASP 608 HB1 ASP 608 -2.512 -13.911 -10.440 450 H LEU 609 HN LEU 609 -2.780 -14.521 -6.151 451 HA LEU 609 HA LEU 609 -1.148 -12.089 -6.390 452 HB2 LEU 609 HB2 LEU 609 -2.970 -12.886 -4.133 453 HB3 LEU 609 HB1 LEU 609 -2.141 -11.358 -4.319 454 HG LEU 609 HG LEU 609 -4.224 -10.784 -4.960 455 HD11 LEU 609 HD11 LEU 609 -3.083 -11.764 -7.543 456 HD12 LEU 609 HD12 LEU 609 -2.754 -10.213 -6.775 457 HD13 LEU 609 HD13 LEU 609 -4.375 -10.576 -7.368 458 HD21 LEU 609 HD21 LEU 609 -5.819 -12.162 -6.143 459 HD22 LEU 609 HD22 LEU 609 -5.212 -12.983 -4.706 460 HD23 LEU 609 HD23 LEU 609 -4.609 -13.433 -6.301 461 H LYS 610 HN LYS 610 0.389 -11.633 -4.675 462 HA LYS 610 HA LYS 610 0.756 -13.555 -2.565 463 HB2 LYS 610 HB2 LYS 610 3.116 -14.029 -3.005 464 HB3 LYS 610 HB1 LYS 610 2.097 -14.618 -4.304 465 HG2 LYS 610 HG2 LYS 610 2.758 -12.809 -5.718 466 HG3 LYS 610 HG1 LYS 610 3.655 -12.048 -4.399 467 HD2 LYS 610 HD2 LYS 610 5.167 -13.949 -4.306 468 HD3 LYS 610 HD1 LYS 610 4.241 -14.770 -5.561 469 HE2 LYS 610 HE2 LYS 610 6.201 -13.801 -6.543 470 HE3 LYS 610 HE1 LYS 610 4.778 -12.931 -7.108 471 HZ1 LYS 610 HZ1 LYS 610 6.522 -12.006 -4.893 472 HZ2 LYS 610 HZ2 LYS 610 5.256 -11.145 -5.616 473 HZ3 LYS 610 HZ3 LYS 610 6.661 -11.481 -6.494 474 H ILE 611 HN ILE 611 1.754 -12.702 -0.774 475 HA ILE 611 HA ILE 611 2.161 -9.840 -0.684 476 HB ILE 611 HB ILE 611 2.530 -11.944 1.438 477 HG12 ILE 611 HG12 ILE 611 0.183 -11.391 0.473 478 HG13 ILE 611 HG11 ILE 611 0.399 -11.495 2.204 479 HG21 ILE 611 HG21 ILE 611 3.907 -10.018 1.933 480 HG22 ILE 611 HG22 ILE 611 2.554 -10.126 3.061 481 HG23 ILE 611 HG23 ILE 611 2.510 -8.958 1.742 482 HD11 ILE 611 HD11 ILE 611 -1.002 -9.606 1.617 483 HD12 ILE 611 HD12 ILE 611 0.279 -8.968 0.586 484 HD13 ILE 611 HD13 ILE 611 0.515 -9.052 2.329 485 H ASP 612 HN ASP 612 4.110 -8.817 -0.197 486 HA ASP 612 HA ASP 612 6.525 -10.486 -0.049 487 HB2 ASP 612 HB2 ASP 612 6.224 -9.315 -2.316 488 HB3 ASP 612 HB1 ASP 612 6.517 -7.805 -1.439 489 H SER 613 HN SER 613 8.236 -9.563 1.167 490 HA SER 613 HA SER 613 7.350 -7.430 2.983 491 HB2 SER 613 HB2 SER 613 9.085 -8.615 4.556 492 HB3 SER 613 HB1 SER 613 7.465 -9.290 4.369 493 HG SER 613 HG SER 613 9.914 -10.266 3.506 494 H SER 614 HN SER 614 8.300 -5.647 2.211 495 HA SER 614 HA SER 614 11.226 -5.718 1.871 496 HB2 SER 614 HB2 SER 614 9.212 -4.133 0.254 497 HB3 SER 614 HB1 SER 614 10.961 -3.947 0.138 498 HG SER 614 HG SER 614 9.548 -6.373 -0.340 499 H THR 615 HN THR 615 12.074 -4.694 3.568 500 HA THR 615 HA THR 615 10.580 -2.750 5.067 501 HB THR 615 HB THR 615 13.501 -3.413 5.413 502 HG1 THR 615 HG1 THR 615 12.783 -5.367 5.827 503 HG21 THR 615 HG21 THR 615 11.392 -2.482 7.374 504 HG22 THR 615 HG22 THR 615 12.638 -1.464 6.656 505 HG23 THR 615 HG23 THR 615 13.093 -2.780 7.735 506 H VAL 616 HN VAL 616 10.402 -0.684 4.387 507 HA VAL 616 HA VAL 616 12.258 0.661 2.780 508 HB VAL 616 HB VAL 616 10.162 1.682 2.893 509 HG11 VAL 616 HG11 VAL 616 9.325 0.676 4.917 510 HG12 VAL 616 HG12 VAL 616 9.090 2.423 4.974 511 HG13 VAL 616 HG13 VAL 616 10.399 1.680 5.886 512 HG21 VAL 616 HG21 VAL 616 11.846 3.372 2.856 513 HG22 VAL 616 HG22 VAL 616 12.075 3.250 4.600 514 HG23 VAL 616 HG23 VAL 616 10.575 3.915 3.955 515 H GLU 617 HN GLU 617 14.260 1.177 3.216 516 HA GLU 617 HA GLU 617 15.136 1.379 5.990 517 HB2 GLU 617 HB2 GLU 617 16.702 1.185 3.433 518 HB3 GLU 617 HB1 GLU 617 17.422 1.305 5.031 519 HG2 GLU 617 HG2 GLU 617 15.964 -0.785 5.522 520 HG3 GLU 617 HG1 GLU 617 15.952 -0.950 3.770 521 H ARG 618 HN ARG 618 14.409 3.359 3.295 522 HA ARG 618 HA ARG 618 15.129 5.709 4.783 523 HB2 ARG 618 HB2 ARG 618 17.294 5.041 3.795 524 HB3 ARG 618 HB1 ARG 618 16.578 5.117 2.193 525 HG2 ARG 618 HG2 ARG 618 16.237 7.497 2.420 526 HG3 ARG 618 HG1 ARG 618 16.837 7.446 4.079 527 HD2 ARG 618 HD2 ARG 618 19.016 6.731 3.295 528 HD3 ARG 618 HD1 ARG 618 18.427 6.689 1.635 529 HE ARG 618 HE ARG 618 18.000 9.258 2.650 530 HH11 ARG 618 HH11 ARG 618 20.682 7.152 1.855 531 HH12 ARG 618 HH12 ARG 618 21.732 8.451 1.393 532 HH21 ARG 618 HH21 ARG 618 19.379 10.975 2.038 533 HH22 ARG 618 HH22 ARG 618 20.991 10.627 1.499 534 H ILE 619 HN ILE 619 14.347 7.653 3.802 535 HA ILE 619 HA ILE 619 12.552 7.329 1.512 536 HB ILE 619 HB ILE 619 11.753 8.408 4.223 537 HG12 ILE 619 HG12 ILE 619 10.432 6.341 2.462 538 HG13 ILE 619 HG11 ILE 619 11.563 5.950 3.755 539 HG21 ILE 619 HG21 ILE 619 10.991 9.978 2.518 540 HG22 ILE 619 HG22 ILE 619 9.626 9.086 3.189 541 HG23 ILE 619 HG23 ILE 619 10.266 8.655 1.603 542 HD11 ILE 619 HD11 ILE 619 8.945 7.394 4.100 543 HD12 ILE 619 HD12 ILE 619 10.061 6.922 5.387 544 HD13 ILE 619 HD13 ILE 619 9.232 5.686 4.437 545 H GLU 620 HN GLU 620 12.913 8.921 0.118 546 HA GLU 620 HA GLU 620 14.154 11.384 1.161 547 HB2 GLU 620 HB2 GLU 620 14.836 10.061 -1.462 548 HB3 GLU 620 HB1 GLU 620 15.624 11.455 -0.741 549 HG2 GLU 620 HG2 GLU 620 16.443 10.078 1.080 550 HG3 GLU 620 HG1 GLU 620 15.612 8.671 0.410 551 H ASP 621 HN ASP 621 13.352 13.258 0.456 552 HA ASP 621 HA ASP 621 10.909 13.187 -1.065 553 HB2 ASP 621 HB2 ASP 621 10.727 15.553 -0.550 554 HB3 ASP 621 HB1 ASP 621 11.172 14.673 0.906 555 H SER 622 HN SER 622 10.610 13.725 -3.129 556 HA SER 622 HA SER 622 12.977 14.464 -4.698 557 HB2 SER 622 HB2 SER 622 11.681 12.405 -5.313 558 HB3 SER 622 HB1 SER 622 10.292 13.433 -5.654 559 HG SER 622 HG SER 622 12.119 12.758 -7.337 560 H HIS 623 HN HIS 623 12.628 16.012 -6.475 561 HA HIS 623 HA HIS 623 11.367 18.371 -5.415 562 HB2 HIS 623 HB2 HIS 623 13.585 18.392 -6.560 563 HB3 HIS 623 HB1 HIS 623 12.776 17.989 -8.068 564 HD1 HIS 623 HD1 HIS 623 12.888 20.773 -5.495 565 HD2 HIS 623 HD2 HIS 623 11.869 20.144 -9.474 566 HE1 HIS 623 HE1 HIS 623 12.417 23.051 -6.439 567 HE2 HIS 623 HE2 HIS 623 11.958 22.660 -8.884 568 H SER 624 HN SER 624 10.390 15.856 -7.429 569 HA SER 624 HA SER 624 8.486 17.288 -9.001 570 HB2 SER 624 HB2 SER 624 8.799 14.353 -8.354 571 HB3 SER 624 HB1 SER 624 7.607 14.988 -9.485 572 HG SER 624 HG SER 624 10.336 14.668 -9.767 573 HA PRO 625 HA PRO 625 5.260 18.152 -6.190 574 HB2 PRO 625 HB2 PRO 625 3.423 17.029 -8.200 575 HB3 PRO 625 HB1 PRO 625 3.418 18.620 -7.443 576 HG2 PRO 625 HG2 PRO 625 4.233 18.267 -9.975 577 HG3 PRO 625 HG1 PRO 625 4.971 19.474 -8.910 578 HD2 PRO 625 HD2 PRO 625 6.039 16.865 -9.833 579 HD3 PRO 625 HD1 PRO 625 6.897 18.349 -9.388 580 H GLY 626 HN GLY 626 5.178 16.937 -4.481 581 HA2 GLY 626 HA2 GLY 626 4.360 15.381 -3.018 582 HA3 GLY 626 HA1 GLY 626 3.199 14.942 -4.261 583 H VAL 627 HN VAL 627 6.663 14.773 -4.759 584 HA VAL 627 HA VAL 627 6.344 11.857 -4.962 585 HB VAL 627 HB VAL 627 8.383 13.607 -6.351 586 HG11 VAL 627 HG11 VAL 627 7.787 10.662 -6.651 587 HG12 VAL 627 HG12 VAL 627 9.230 11.355 -5.912 588 HG13 VAL 627 HG13 VAL 627 8.922 11.588 -7.632 589 HG21 VAL 627 HG21 VAL 627 5.848 12.307 -7.306 590 HG22 VAL 627 HG22 VAL 627 7.087 12.949 -8.389 591 HG23 VAL 627 HG23 VAL 627 6.235 14.030 -7.281 592 H ALA 628 HN ALA 628 7.437 10.587 -3.688 593 HA ALA 628 HA ALA 628 10.002 11.454 -2.587 594 HB1 ALA 628 HB1 ALA 628 9.428 10.599 -0.364 595 HB2 ALA 628 HB2 ALA 628 7.783 10.269 -0.911 596 HB3 ALA 628 HB3 ALA 628 8.367 11.930 -0.825 597 H VAL 629 HN VAL 629 11.467 9.872 -2.626 598 HA VAL 629 HA VAL 629 10.609 7.345 -3.775 599 HB VAL 629 HB VAL 629 12.419 8.067 -5.008 600 HG11 VAL 629 HG11 VAL 629 12.939 9.972 -3.583 601 HG12 VAL 629 HG12 VAL 629 14.401 9.129 -4.100 602 HG13 VAL 629 HG13 VAL 629 13.783 8.903 -2.464 603 HG21 VAL 629 HG21 VAL 629 13.709 6.408 -2.839 604 HG22 VAL 629 HG22 VAL 629 14.343 6.658 -4.465 605 HG23 VAL 629 HG23 VAL 629 12.832 5.776 -4.234 606 H ILE 630 HN ILE 630 10.184 5.714 -2.568 607 HA ILE 630 HA ILE 630 11.236 5.559 0.132 608 HB ILE 630 HB ILE 630 9.470 3.513 -1.178 609 HG12 ILE 630 HG12 ILE 630 8.421 5.714 -1.542 610 HG13 ILE 630 HG11 ILE 630 7.515 4.742 -0.392 611 HG21 ILE 630 HG21 ILE 630 8.688 3.213 1.138 612 HG22 ILE 630 HG22 ILE 630 9.849 4.436 1.658 613 HG23 ILE 630 HG23 ILE 630 10.418 2.922 0.956 614 HD11 ILE 630 HD11 ILE 630 9.405 6.968 0.294 615 HD12 ILE 630 HD12 ILE 630 8.487 5.998 1.446 616 HD13 ILE 630 HD13 ILE 630 7.644 7.055 0.312 617 H GLN 631 HN GLN 631 13.168 4.634 0.410 618 HA GLN 631 HA GLN 631 14.183 2.783 -1.600 619 HB2 GLN 631 HB2 GLN 631 15.645 4.604 -0.826 620 HB3 GLN 631 HB1 GLN 631 15.538 3.992 0.818 621 HG2 GLN 631 HG2 GLN 631 16.694 1.979 0.202 622 HG3 GLN 631 HG1 GLN 631 16.687 2.453 -1.498 623 HE21 GLN 631 HE21 GLN 631 18.907 2.416 -1.690 624 HE22 GLN 631 HE22 GLN 631 19.934 3.584 -0.933 625 H PHE 632 HN PHE 632 13.744 0.725 -1.381 626 HA PHE 632 HA PHE 632 13.147 -0.354 1.285 627 HB2 PHE 632 HB2 PHE 632 12.568 -1.485 -1.458 628 HB3 PHE 632 HB1 PHE 632 12.089 -2.215 0.067 629 HD1 PHE 632 HD1 PHE 632 10.339 -1.197 1.429 630 HD2 PHE 632 HD2 PHE 632 11.372 0.345 -2.395 631 HE1 PHE 632 HE1 PHE 632 8.217 0.036 1.354 632 HE2 PHE 632 HE2 PHE 632 9.249 1.584 -2.476 633 HZ PHE 632 HZ PHE 632 7.666 1.429 -0.598 634 H ALA 633 HN ALA 633 14.152 -2.113 2.100 635 HA ALA 633 HA ALA 633 16.294 -3.346 0.507 636 HB1 ALA 633 HB1 ALA 633 15.767 -3.432 3.476 637 HB2 ALA 633 HB2 ALA 633 17.024 -2.498 2.666 638 HB3 ALA 633 HB3 ALA 633 17.086 -4.262 2.650 639 H VAL 634 HN VAL 634 15.366 -4.933 -0.652 640 HA VAL 634 HA VAL 634 13.021 -6.287 0.361 641 HB VAL 634 HB VAL 634 14.494 -6.713 -2.238 642 HG11 VAL 634 HG11 VAL 634 12.406 -7.738 -2.993 643 HG12 VAL 634 HG12 VAL 634 11.705 -7.495 -1.395 644 HG13 VAL 634 HG13 VAL 634 13.068 -8.594 -1.602 645 HG21 VAL 634 HG21 VAL 634 12.744 -5.281 -3.217 646 HG22 VAL 634 HG22 VAL 634 13.734 -4.416 -2.044 647 HG23 VAL 634 HG23 VAL 634 12.118 -4.966 -1.599 648 H GLY 635 HN GLY 635 12.982 -8.162 1.362 649 HA2 GLY 635 HA2 GLY 635 13.445 -10.377 1.801 650 HA3 GLY 635 HA1 GLY 635 14.707 -10.316 0.584 651 H GLU 636 HN GLU 636 15.719 -11.719 2.271 652 HA GLU 636 HA GLU 636 16.642 -10.452 4.675 653 HB2 GLU 636 HB2 GLU 636 17.190 -13.109 3.398 654 HB3 GLU 636 HB1 GLU 636 18.055 -12.578 4.827 655 HG2 GLU 636 HG2 GLU 636 16.242 -14.016 5.462 656 HG3 GLU 636 HG1 GLU 636 15.921 -12.379 6.024 657 H HIS 637 HN HIS 637 17.780 -10.806 1.442 658 HA HIS 637 HA HIS 637 20.539 -10.271 2.074 659 HB2 HIS 637 HB2 HIS 637 19.077 -10.218 -0.574 660 HB3 HIS 637 HB1 HIS 637 20.814 -10.011 -0.389 661 HD1 HIS 637 HD1 HIS 637 18.457 -12.505 -1.221 662 HD2 HIS 637 HD2 HIS 637 21.915 -12.445 1.087 663 HE1 HIS 637 HE1 HIS 637 19.182 -14.905 -1.027 664 HE2 HIS 637 HE2 HIS 637 21.333 -14.836 0.283 665 H ARG 638 HN ARG 638 17.747 -8.468 1.849 666 HA ARG 638 HA ARG 638 17.247 -6.280 2.005 667 HB2 ARG 638 HB2 ARG 638 20.124 -6.131 2.900 668 HB3 ARG 638 HB1 ARG 638 19.012 -4.774 2.971 669 HG2 ARG 638 HG2 ARG 638 17.571 -6.036 4.479 670 HG3 ARG 638 HG1 ARG 638 18.686 -7.404 4.398 671 HD2 ARG 638 HD2 ARG 638 19.269 -4.652 5.480 672 HD3 ARG 638 HD1 ARG 638 19.099 -6.139 6.405 673 HE ARG 638 HE ARG 638 21.110 -6.680 4.654 674 HH11 ARG 638 HH11 ARG 638 20.551 -4.215 7.075 675 HH12 ARG 638 HH12 ARG 638 22.236 -3.959 7.381 676 HH21 ARG 638 HH21 ARG 638 23.321 -6.356 5.063 677 HH22 ARG 638 HH22 ARG 638 23.815 -5.191 6.253 678 H ALA 639 HN ALA 639 17.652 -7.063 -0.538 679 HA ALA 639 HA ALA 639 19.465 -5.501 -2.033 680 HB1 ALA 639 HB1 ALA 639 16.809 -6.650 -2.892 681 HB2 ALA 639 HB2 ALA 639 18.360 -7.486 -2.953 682 HB3 ALA 639 HB3 ALA 639 18.082 -6.067 -3.963 683 H GLN 640 HN GLN 640 19.445 -3.403 -2.474 684 HA GLN 640 HA GLN 640 17.296 -1.851 -1.326 685 HB2 GLN 640 HB2 GLN 640 19.933 -0.990 -2.508 686 HB3 GLN 640 HB1 GLN 640 18.769 0.092 -1.748 687 HG2 GLN 640 HG2 GLN 640 18.944 -1.399 0.283 688 HG3 GLN 640 HG1 GLN 640 20.370 -2.099 -0.482 689 HE21 GLN 640 HE21 GLN 640 19.052 0.609 1.149 690 HE22 GLN 640 HE22 GLN 640 20.516 1.511 1.298 691 H VAL 641 HN VAL 641 15.698 -1.091 -2.348 692 HA VAL 641 HA VAL 641 15.891 -0.613 -5.258 693 HB VAL 641 HB VAL 641 13.444 -1.510 -3.715 694 HG11 VAL 641 HG11 VAL 641 12.362 -1.661 -5.905 695 HG12 VAL 641 HG12 VAL 641 13.811 -1.007 -6.668 696 HG13 VAL 641 HG13 VAL 641 12.874 -0.010 -5.555 697 HG21 VAL 641 HG21 VAL 641 15.133 -2.977 -5.736 698 HG22 VAL 641 HG22 VAL 641 13.635 -3.574 -5.019 699 HG23 VAL 641 HG23 VAL 641 15.057 -3.312 -4.007 700 H SER 642 HN SER 642 15.723 1.438 -5.760 701 HA SER 642 HA SER 642 14.396 3.265 -3.880 702 HB2 SER 642 HB2 SER 642 15.704 5.031 -5.164 703 HB3 SER 642 HB1 SER 642 16.670 3.905 -4.211 704 HG SER 642 HG SER 642 16.143 3.185 -6.850 705 H VAL 643 HN VAL 643 12.336 3.651 -4.453 706 HA VAL 643 HA VAL 643 11.781 4.119 -7.295 707 HB VAL 643 HB VAL 643 10.837 1.993 -6.759 708 HG11 VAL 643 HG11 VAL 643 10.824 2.152 -4.331 709 HG12 VAL 643 HG12 VAL 643 9.244 1.650 -4.932 710 HG13 VAL 643 HG13 VAL 643 9.497 3.312 -4.402 711 HG21 VAL 643 HG21 VAL 643 8.738 4.138 -6.752 712 HG22 VAL 643 HG22 VAL 643 8.419 2.430 -7.055 713 HG23 VAL 643 HG23 VAL 643 9.446 3.347 -8.159 714 H GLU 644 HN GLU 644 11.050 6.094 -7.691 715 HA GLU 644 HA GLU 644 10.209 7.843 -5.565 716 HB2 GLU 644 HB2 GLU 644 10.339 8.207 -8.563 717 HB3 GLU 644 HB1 GLU 644 9.829 9.470 -7.450 718 HG2 GLU 644 HG2 GLU 644 12.001 9.384 -6.351 719 HG3 GLU 644 HG1 GLU 644 12.520 8.123 -7.467 720 H VAL 645 HN VAL 645 8.224 7.757 -4.742 721 HA VAL 645 HA VAL 645 5.975 7.020 -6.471 722 HB VAL 645 HB VAL 645 6.627 6.343 -3.604 723 HG11 VAL 645 HG11 VAL 645 4.444 5.432 -3.334 724 HG12 VAL 645 HG12 VAL 645 4.018 5.856 -4.992 725 HG13 VAL 645 HG13 VAL 645 4.320 7.129 -3.806 726 HG21 VAL 645 HG21 VAL 645 6.283 4.037 -4.364 727 HG22 VAL 645 HG22 VAL 645 7.547 4.844 -5.287 728 HG23 VAL 645 HG23 VAL 645 5.945 4.626 -5.990 729 H LEU 646 HN LEU 646 3.961 8.145 -5.990 730 HA LEU 646 HA LEU 646 4.318 10.771 -4.938 731 HB2 LEU 646 HB2 LEU 646 1.773 9.332 -5.673 732 HB3 LEU 646 HB1 LEU 646 1.843 10.995 -5.134 733 HG LEU 646 HG LEU 646 2.577 9.822 -7.743 734 HD11 LEU 646 HD11 LEU 646 0.506 11.124 -7.367 735 HD12 LEU 646 HD12 LEU 646 1.564 11.843 -8.581 736 HD13 LEU 646 HD13 LEU 646 1.502 12.524 -6.955 737 HD21 LEU 646 HD21 LEU 646 4.010 11.727 -8.285 738 HD22 LEU 646 HD22 LEU 646 4.708 10.686 -7.043 739 HD23 LEU 646 HD23 LEU 646 3.962 12.220 -6.591 740 H VAL 647 HN VAL 647 3.714 11.582 -3.006 741 HA VAL 647 HA VAL 647 3.865 9.815 -0.803 742 HB VAL 647 HB VAL 647 3.473 11.822 0.593 743 HG11 VAL 647 HG11 VAL 647 5.462 12.186 -1.644 744 HG12 VAL 647 HG12 VAL 647 5.717 11.276 -0.153 745 HG13 VAL 647 HG13 VAL 647 5.496 13.023 -0.091 746 HG21 VAL 647 HG21 VAL 647 1.894 13.010 -0.799 747 HG22 VAL 647 HG22 VAL 647 3.103 13.193 -2.071 748 HG23 VAL 647 HG23 VAL 647 3.312 14.023 -0.528 749 H GLU 648 HN GLU 648 1.231 10.698 -2.690 750 HA GLU 648 HA GLU 648 -0.735 10.549 -0.572 751 HB2 GLU 648 HB2 GLU 648 -2.369 10.905 -2.372 752 HB3 GLU 648 HB1 GLU 648 -1.095 12.113 -2.401 753 HG2 GLU 648 HG2 GLU 648 0.022 10.779 -4.187 754 HG3 GLU 648 HG1 GLU 648 -1.402 9.745 -4.218 755 H TYR 649 HN TYR 649 1.048 8.280 -2.162 756 HA TYR 649 HA TYR 649 -1.037 6.331 -2.565 757 HB2 TYR 649 HB2 TYR 649 1.921 6.387 -2.906 758 HB3 TYR 649 HB1 TYR 649 1.121 4.831 -2.754 759 HD1 TYR 649 HD1 TYR 649 -0.796 4.324 -4.375 760 HD2 TYR 649 HD2 TYR 649 1.977 7.493 -4.960 761 HE1 TYR 649 HE1 TYR 649 -1.376 4.381 -6.763 762 HE2 TYR 649 HE2 TYR 649 1.404 7.561 -7.350 763 HH TYR 649 HH TYR 649 -1.293 5.875 -8.640 764 HA PRO 650 HA PRO 650 -0.689 4.962 1.680 765 HB2 PRO 650 HB2 PRO 650 -2.972 3.329 1.363 766 HB3 PRO 650 HB1 PRO 650 -2.905 4.938 2.074 767 HG2 PRO 650 HG2 PRO 650 -4.185 4.239 -0.314 768 HG3 PRO 650 HG1 PRO 650 -3.821 5.880 0.235 769 HD2 PRO 650 HD2 PRO 650 -2.392 4.180 -1.733 770 HD3 PRO 650 HD1 PRO 650 -2.574 5.945 -1.678 771 H PHE 651 HN PHE 651 0.847 3.492 2.044 772 HA PHE 651 HA PHE 651 0.928 1.044 0.467 773 HB2 PHE 651 HB2 PHE 651 2.888 2.393 2.300 774 HB3 PHE 651 HB1 PHE 651 3.102 0.711 1.832 775 HD1 PHE 651 HD2 PHE 651 2.952 4.174 0.583 776 HD2 PHE 651 HD1 PHE 651 3.882 0.120 -0.316 777 HE1 PHE 651 HE2 PHE 651 4.057 4.891 -1.491 778 HE2 PHE 651 HE1 PHE 651 4.991 0.830 -2.393 779 HZ PHE 651 HZ PHE 651 5.079 3.217 -2.983 780 H PHE 652 HN PHE 652 0.012 -0.729 1.191 781 HA PHE 652 HA PHE 652 -0.780 -1.112 3.894 782 HB2 PHE 652 HB2 PHE 652 -1.158 -2.448 1.402 783 HB3 PHE 652 HB1 PHE 652 -0.511 -3.618 2.549 784 HD1 PHE 652 HD1 PHE 652 -1.655 -3.769 4.827 785 HD2 PHE 652 HD2 PHE 652 -3.410 -1.902 1.433 786 HE1 PHE 652 HE1 PHE 652 -3.870 -3.987 5.857 787 HE2 PHE 652 HE2 PHE 652 -5.633 -2.118 2.461 788 HZ PHE 652 HZ PHE 652 -5.864 -3.157 4.680 789 H VAL 653 HN VAL 653 0.413 -1.879 5.567 790 HA VAL 653 HA VAL 653 3.157 -2.657 4.864 791 HB VAL 653 HB VAL 653 2.318 -1.446 7.496 792 HG11 VAL 653 HG11 VAL 653 4.661 -0.945 7.699 793 HG12 VAL 653 HG12 VAL 653 4.967 -1.604 6.092 794 HG13 VAL 653 HG13 VAL 653 4.429 -2.663 7.392 795 HG21 VAL 653 HG21 VAL 653 1.759 0.214 5.866 796 HG22 VAL 653 HG22 VAL 653 3.264 -0.069 4.991 797 HG23 VAL 653 HG23 VAL 653 3.307 0.675 6.590 798 H PHE 654 HN PHE 654 3.939 -4.531 5.498 799 HA PHE 654 HA PHE 654 2.379 -6.687 5.533 800 HB2 PHE 654 HB2 PHE 654 4.755 -6.759 5.133 801 HB3 PHE 654 HB1 PHE 654 5.078 -6.477 6.834 802 HD1 PHE 654 HD1 PHE 654 3.711 -8.890 4.412 803 HD2 PHE 654 HD2 PHE 654 5.095 -8.270 8.387 804 HE1 PHE 654 HE1 PHE 654 3.718 -11.321 4.784 805 HE2 PHE 654 HE2 PHE 654 5.104 -10.700 8.766 806 HZ PHE 654 HZ PHE 654 4.415 -12.229 6.963 807 H GLY 655 HN GLY 655 3.771 -5.551 8.634 808 HA2 GLY 655 HA2 GLY 655 1.375 -6.659 9.937 809 HA3 GLY 655 HA1 GLY 655 2.967 -7.112 10.536 810 H GLN 656 HN GLN 656 2.523 -4.026 9.183 811 HA GLN 656 HA GLN 656 3.149 -2.884 11.808 812 HB2 GLN 656 HB2 GLN 656 3.772 -1.873 9.033 813 HB3 GLN 656 HB1 GLN 656 4.194 -1.025 10.500 814 HG2 GLN 656 HG2 GLN 656 6.133 -2.120 9.594 815 HG3 GLN 656 HG1 GLN 656 5.695 -2.860 11.119 816 HE21 GLN 656 HE21 GLN 656 5.772 -3.278 7.667 817 HE22 GLN 656 HE22 GLN 656 5.597 -5.004 7.640 818 H GLY 657 HN GLY 657 1.082 -2.543 8.940 819 HA2 GLY 657 HA2 GLY 657 -1.247 -2.001 9.966 820 HA3 GLY 657 HA1 GLY 657 -0.463 -0.483 10.356 821 H TRP 658 HN TRP 658 -2.651 -0.226 8.994 822 HA TRP 658 HA TRP 658 -2.221 -0.140 6.133 823 HB2 TRP 658 HB2 TRP 658 -4.445 -0.637 7.226 824 HB3 TRP 658 HB1 TRP 658 -4.475 1.012 7.808 825 HD1 TRP 658 HD1 TRP 658 -6.836 1.135 6.532 826 HE1 TRP 658 HE1 TRP 658 -7.407 1.724 4.105 827 HE3 TRP 658 HE3 TRP 658 -2.226 0.431 4.384 828 HZ2 TRP 658 HZ2 TRP 658 -6.110 1.887 1.628 829 HZ3 TRP 658 HZ3 TRP 658 -2.004 0.829 1.969 830 HH2 TRP 658 HH2 TRP 658 -3.900 1.544 0.627 831 H SER 659 HN SER 659 -0.740 1.408 5.488 832 HA SER 659 HA SER 659 -0.798 3.973 6.935 833 HB2 SER 659 HB2 SER 659 1.675 2.467 6.044 834 HB3 SER 659 HB1 SER 659 1.641 3.987 6.939 835 HG SER 659 HG SER 659 0.993 1.390 7.800 836 H SER 660 HN SER 660 0.418 5.717 5.807 837 HA SER 660 HA SER 660 0.699 5.398 2.916 838 HB2 SER 660 HB2 SER 660 -1.550 6.303 3.145 839 HB3 SER 660 HB1 SER 660 -0.963 7.560 4.234 840 HG SER 660 HG SER 660 -1.251 8.250 2.023 841 H CYS 661 HN CYS 661 2.125 6.885 1.975 842 HA CYS 661 HA CYS 661 4.295 7.703 3.579 843 HB2 CYS 661 HB2 CYS 661 3.560 8.622 0.792 844 HB3 CYS 661 HB1 CYS 661 5.147 8.758 1.542 845 HG CYS 661 HG CYS 661 3.751 6.177 -0.027 846 H CYS 662 HN CYS 662 1.313 9.152 2.822 847 HA CYS 662 HA CYS 662 1.885 11.328 4.604 848 HB2 CYS 662 HB2 CYS 662 2.639 12.273 2.450 849 HB3 CYS 662 HB1 CYS 662 1.071 11.906 1.742 850 HG CYS 662 HG CYS 662 1.618 14.139 4.281 851 HA PRO 663 HA PRO 663 -2.285 9.406 5.057 852 HB2 PRO 663 HB2 PRO 663 -1.882 10.694 7.701 853 HB3 PRO 663 HB1 PRO 663 -2.450 9.067 7.312 854 HG2 PRO 663 HG2 PRO 663 0.016 9.477 8.258 855 HG3 PRO 663 HG1 PRO 663 -0.300 8.244 7.025 856 HD2 PRO 663 HD2 PRO 663 0.926 10.953 6.733 857 HD3 PRO 663 HD1 PRO 663 1.316 9.441 5.890 858 H GLU 664 HN GLU 664 -1.012 12.551 5.906 859 HA GLU 664 HA GLU 664 -3.302 14.056 6.178 860 HB2 GLU 664 HB2 GLU 664 -0.769 14.870 4.743 861 HB3 GLU 664 HB1 GLU 664 -1.972 15.960 5.415 862 HG2 GLU 664 HG2 GLU 664 -0.288 14.038 6.992 863 HG3 GLU 664 HG1 GLU 664 0.013 15.766 6.825 864 H ARG 665 HN ARG 665 -1.457 13.503 3.186 865 HA ARG 665 HA ARG 665 -3.335 14.871 1.558 866 HB2 ARG 665 HB2 ARG 665 -0.903 14.596 1.057 867 HB3 ARG 665 HB1 ARG 665 -1.207 12.904 0.698 868 HG2 ARG 665 HG2 ARG 665 -2.472 13.421 -1.206 869 HG3 ARG 665 HG1 ARG 665 -2.637 15.114 -0.736 870 HD2 ARG 665 HD2 ARG 665 -0.055 13.755 -1.502 871 HD3 ARG 665 HD1 ARG 665 -1.007 14.808 -2.550 872 HE ARG 665 HE ARG 665 -0.354 16.100 -0.100 873 HH11 ARG 665 HH11 ARG 665 1.024 15.164 -3.176 874 HH12 ARG 665 HH12 ARG 665 2.147 16.489 -3.216 875 HH21 ARG 665 HH21 ARG 665 1.158 17.813 -0.134 876 HH22 ARG 665 HH22 ARG 665 2.251 17.964 -1.473 877 H THR 666 HN THR 666 -2.771 11.397 2.187 878 HA THR 666 HA THR 666 -4.630 10.451 0.305 879 HB THR 666 HB THR 666 -3.931 9.106 2.923 880 HG1 THR 666 HG1 THR 666 -2.612 8.753 0.422 881 HG21 THR 666 HG21 THR 666 -4.421 7.038 1.765 882 HG22 THR 666 HG22 THR 666 -4.677 7.898 0.249 883 HG23 THR 666 HG23 THR 666 -5.805 8.115 1.584 884 H SER 667 HN SER 667 -5.022 11.407 3.707 885 HA SER 667 HA SER 667 -7.833 10.827 3.704 886 HB2 SER 667 HB2 SER 667 -6.486 10.749 5.767 887 HB3 SER 667 HB1 SER 667 -6.224 12.480 5.636 888 HG SER 667 HG SER 667 -8.869 11.656 5.566 889 H GLN 668 HN GLN 668 -5.848 13.617 2.999 890 HA GLN 668 HA GLN 668 -7.788 15.626 3.089 891 HB2 GLN 668 HB2 GLN 668 -5.167 15.253 1.848 892 HB3 GLN 668 HB1 GLN 668 -6.168 16.540 1.206 893 HG2 GLN 668 HG2 GLN 668 -5.447 16.172 4.090 894 HG3 GLN 668 HG1 GLN 668 -4.692 17.260 2.961 895 HE21 GLN 668 HE21 GLN 668 -5.180 19.041 4.245 896 HE22 GLN 668 HE22 GLN 668 -6.780 19.687 4.335 897 H LEU 669 HN LEU 669 -6.672 13.647 0.369 898 HA LEU 669 HA LEU 669 -8.544 15.021 -1.392 899 HB2 LEU 669 HB2 LEU 669 -6.639 12.868 -2.226 900 HB3 LEU 669 HB1 LEU 669 -7.288 14.186 -3.179 901 HG LEU 669 HG LEU 669 -5.212 14.405 -1.005 902 HD11 LEU 669 HD11 LEU 669 -4.365 13.429 -3.061 903 HD12 LEU 669 HD12 LEU 669 -3.722 15.054 -2.826 904 HD13 LEU 669 HD13 LEU 669 -5.021 14.781 -3.987 905 HD21 LEU 669 HD21 LEU 669 -6.447 16.561 -2.714 906 HD22 LEU 669 HD22 LEU 669 -5.027 16.766 -1.686 907 HD23 LEU 669 HD23 LEU 669 -6.589 16.385 -0.962 908 H PHE 670 HN PHE 670 -7.905 11.856 -0.064 909 HA PHE 670 HA PHE 670 -10.132 10.727 -1.615 910 HB2 PHE 670 HB2 PHE 670 -8.017 9.169 -0.137 911 HB3 PHE 670 HB1 PHE 670 -9.048 8.618 -1.447 912 HD1 PHE 670 HD2 PHE 670 -8.769 10.413 -3.582 913 HD2 PHE 670 HD1 PHE 670 -5.828 9.291 -0.726 914 HE1 PHE 670 HE2 PHE 670 -6.996 11.008 -5.181 915 HE2 PHE 670 HE1 PHE 670 -4.050 9.886 -2.312 916 HZ PHE 670 HZ PHE 670 -4.630 10.746 -4.543 917 H ASP 671 HN ASP 671 -9.487 11.982 1.316 918 HA ASP 671 HA ASP 671 -10.284 11.855 3.418 919 HB2 ASP 671 HB2 ASP 671 -12.560 10.936 1.757 920 HB3 ASP 671 HB1 ASP 671 -12.676 10.659 3.491 921 H LEU 672 HN LEU 672 -8.685 9.609 2.345 922 HA LEU 672 HA LEU 672 -9.734 7.388 3.938 923 HB2 LEU 672 HB2 LEU 672 -9.272 6.837 1.618 924 HB3 LEU 672 HB1 LEU 672 -7.631 7.439 1.763 925 HG LEU 672 HG LEU 672 -7.200 5.636 3.457 926 HD11 LEU 672 HD11 LEU 672 -8.755 3.797 3.636 927 HD12 LEU 672 HD12 LEU 672 -9.864 4.588 2.514 928 HD13 LEU 672 HD13 LEU 672 -9.552 5.302 4.098 929 HD21 LEU 672 HD21 LEU 672 -8.098 4.665 0.739 930 HD22 LEU 672 HD22 LEU 672 -6.980 3.848 1.833 931 HD23 LEU 672 HD23 LEU 672 -6.531 5.390 1.106 932 HA PRO 673 HA PRO 673 -6.573 8.731 6.792 933 HB2 PRO 673 HB2 PRO 673 -7.419 7.254 8.902 934 HB3 PRO 673 HB1 PRO 673 -8.189 8.767 8.414 935 HG2 PRO 673 HG2 PRO 673 -9.089 5.970 8.020 936 HG3 PRO 673 HG1 PRO 673 -10.047 7.444 8.230 937 HD2 PRO 673 HD2 PRO 673 -9.527 6.141 5.815 938 HD3 PRO 673 HD1 PRO 673 -10.157 7.786 5.989 939 H CYS 674 HN CYS 674 -4.628 7.945 7.271 940 HA CYS 674 HA CYS 674 -4.149 5.051 7.144 941 HB2 CYS 674 HB2 CYS 674 -2.477 7.126 5.691 942 HB3 CYS 674 HB1 CYS 674 -2.221 5.384 5.688 943 HG CYS 674 HG CYS 674 -5.179 5.497 4.652 944 H SER 675 HN SER 675 -2.300 4.359 8.279 945 HA SER 675 HA SER 675 -1.285 6.084 10.338 946 HB2 SER 675 HB2 SER 675 -0.205 3.405 9.411 947 HB3 SER 675 HB1 SER 675 0.067 4.174 10.975 948 HG SER 675 HG SER 675 -2.470 4.075 10.881 949 H LYS 676 HN LYS 676 1.097 6.574 10.494 950 HA LYS 676 HA LYS 676 1.941 7.690 8.012 951 HB2 LYS 676 HB2 LYS 676 2.437 8.809 10.145 952 HB3 LYS 676 HB1 LYS 676 3.482 7.469 10.602 953 HG2 LYS 676 HG2 LYS 676 4.752 9.388 9.764 954 HG3 LYS 676 HG1 LYS 676 4.964 7.954 8.749 955 HD2 LYS 676 HD2 LYS 676 3.339 8.825 7.154 956 HD3 LYS 676 HD1 LYS 676 3.064 10.232 8.177 957 HE2 LYS 676 HE2 LYS 676 5.701 9.504 6.910 958 HE3 LYS 676 HE1 LYS 676 4.566 10.688 6.264 959 HZ1 LYS 676 HZ1 LYS 676 5.974 10.847 8.874 960 HZ2 LYS 676 HZ2 LYS 676 4.820 11.957 8.330 961 HZ3 LYS 676 HZ3 LYS 676 6.285 11.787 7.502 962 H LEU 677 HN LEU 677 2.853 6.617 6.445 963 HA LEU 677 HA LEU 677 4.385 4.208 6.934 964 HB2 LEU 677 HB2 LEU 677 2.883 4.441 4.957 965 HB3 LEU 677 HB1 LEU 677 3.895 5.736 4.366 966 HG LEU 677 HG LEU 677 4.172 3.472 3.266 967 HD11 LEU 677 HD11 LEU 677 6.598 3.646 3.078 968 HD12 LEU 677 HD12 LEU 677 6.627 4.737 4.463 969 HD13 LEU 677 HD13 LEU 677 5.822 5.227 2.972 970 HD21 LEU 677 HD21 LEU 677 4.081 2.111 5.274 971 HD22 LEU 677 HD22 LEU 677 5.580 2.842 5.847 972 HD23 LEU 677 HD23 LEU 677 5.584 1.844 4.392 973 H SER 678 HN SER 678 6.421 4.417 7.617 974 HA SER 678 HA SER 678 8.124 6.341 6.244 975 HB2 SER 678 HB2 SER 678 7.956 6.143 9.255 976 HB3 SER 678 HB1 SER 678 9.137 7.094 8.359 977 HG SER 678 HG SER 678 6.707 7.688 7.450 978 H VAL 679 HN VAL 679 10.478 6.016 7.127 979 HA VAL 679 HA VAL 679 11.383 3.550 6.343 980 HB VAL 679 HB VAL 679 12.922 5.284 6.301 981 HG11 VAL 679 HG11 VAL 679 13.587 6.592 8.304 982 HG12 VAL 679 HG12 VAL 679 12.283 5.800 9.191 983 HG13 VAL 679 HG13 VAL 679 11.912 6.824 7.800 984 HG21 VAL 679 HG21 VAL 679 13.751 3.709 8.732 985 HG22 VAL 679 HG22 VAL 679 14.811 4.570 7.610 986 HG23 VAL 679 HG23 VAL 679 13.912 3.154 7.065 987 H GLY 680 HN GLY 680 11.683 1.633 7.246 988 HA2 GLY 680 HA2 GLY 680 12.019 0.214 9.188 989 HA3 GLY 680 HA1 GLY 680 11.018 1.326 10.104 990 H ASP 681 HN ASP 681 9.167 1.493 7.686 991 HA ASP 681 HA ASP 681 7.490 -0.673 8.661 992 HB2 ASP 681 HB2 ASP 681 6.942 1.645 6.817 993 HB3 ASP 681 HB1 ASP 681 5.769 0.385 7.114 994 H VAL 682 HN VAL 682 7.620 -2.605 7.777 995 HA VAL 682 HA VAL 682 8.756 -3.058 5.212 996 HB VAL 682 HB VAL 682 7.156 -4.942 6.947 997 HG11 VAL 682 HG11 VAL 682 8.233 -6.730 5.655 998 HG12 VAL 682 HG12 VAL 682 8.943 -5.514 4.593 999 HG13 VAL 682 HG13 VAL 682 7.191 -5.712 4.660 1000 HG21 VAL 682 HG21 VAL 682 9.331 -5.838 7.627 1001 HG22 VAL 682 HG22 VAL 682 9.144 -4.144 8.081 1002 HG23 VAL 682 HG23 VAL 682 10.135 -4.579 6.689 1003 H CYS 683 HN CYS 683 7.732 -2.416 3.420 1004 HA CYS 683 HA CYS 683 4.877 -2.151 3.379 1005 HB2 CYS 683 HB2 CYS 683 6.918 -1.753 1.188 1006 HB3 CYS 683 HB1 CYS 683 5.218 -1.341 1.052 1007 HG CYS 683 HG CYS 683 6.873 0.018 3.662 1008 H ILE 684 HN ILE 684 3.425 -3.370 2.439 1009 HA ILE 684 HA ILE 684 4.106 -6.051 1.690 1010 HB ILE 684 HB ILE 684 1.512 -4.504 1.752 1011 HG12 ILE 684 HG12 ILE 684 2.365 -6.938 3.309 1012 HG13 ILE 684 HG11 ILE 684 2.535 -5.289 3.906 1013 HG21 ILE 684 HG21 ILE 684 1.931 -7.345 0.848 1014 HG22 ILE 684 HG22 ILE 684 1.303 -6.004 -0.108 1015 HG23 ILE 684 HG23 ILE 684 0.363 -6.642 1.242 1016 HD11 ILE 684 HD11 ILE 684 0.123 -4.994 3.790 1017 HD12 ILE 684 HD12 ILE 684 0.538 -6.381 4.794 1018 HD13 ILE 684 HD13 ILE 684 -0.058 -6.627 3.151 1019 H SER 685 HN SER 685 5.194 -6.111 -0.265 1020 HA SER 685 HA SER 685 4.127 -4.726 -2.550 1021 HB2 SER 685 HB2 SER 685 5.852 -7.077 -2.998 1022 HB3 SER 685 HB1 SER 685 6.027 -5.427 -3.588 1023 HG SER 685 HG SER 685 7.593 -6.316 -1.917 1024 H LEU 686 HN LEU 686 2.246 -5.380 -3.433 1025 HA LEU 686 HA LEU 686 1.516 -8.191 -3.134 1026 HB2 LEU 686 HB2 LEU 686 0.077 -6.025 -2.503 1027 HB3 LEU 686 HB1 LEU 686 -0.392 -6.166 -4.185 1028 HG LEU 686 HG LEU 686 -1.985 -7.234 -2.658 1029 HD11 LEU 686 HD11 LEU 686 -2.166 -9.372 -3.813 1030 HD12 LEU 686 HD12 LEU 686 -0.528 -9.170 -4.440 1031 HD13 LEU 686 HD13 LEU 686 -1.804 -8.057 -4.932 1032 HD21 LEU 686 HD21 LEU 686 0.236 -9.171 -2.036 1033 HD22 LEU 686 HD22 LEU 686 -1.420 -9.237 -1.438 1034 HD23 LEU 686 HD23 LEU 686 -0.355 -7.922 -0.943 1035 H THR 687 HN THR 687 1.714 -9.462 -4.841 1036 HA THR 687 HA THR 687 2.371 -8.207 -7.388 1037 HB THR 687 HB THR 687 2.657 -11.090 -6.542 1038 HG1 THR 687 HG1 THR 687 4.222 -8.834 -6.093 1039 HG21 THR 687 HG21 THR 687 3.921 -9.556 -8.805 1040 HG22 THR 687 HG22 THR 687 2.606 -10.721 -8.962 1041 HG23 THR 687 HG23 THR 687 4.195 -11.252 -8.414 1042 H LEU 688 HN LEU 688 0.848 -8.026 -8.842 1043 HA LEU 688 HA LEU 688 -1.424 -9.863 -8.862 1044 HB2 LEU 688 HB2 LEU 688 -0.887 -7.124 -9.847 1045 HB3 LEU 688 HB1 LEU 688 -1.899 -8.109 -10.879 1046 HG LEU 688 HG LEU 688 -3.170 -6.630 -9.348 1047 HD11 LEU 688 HD11 LEU 688 -4.251 -8.565 -10.237 1048 HD12 LEU 688 HD12 LEU 688 -4.732 -8.372 -8.551 1049 HD13 LEU 688 HD13 LEU 688 -3.539 -9.592 -8.995 1050 HD21 LEU 688 HD21 LEU 688 -3.360 -7.268 -6.963 1051 HD22 LEU 688 HD22 LEU 688 -1.764 -6.640 -7.386 1052 HD23 LEU 688 HD23 LEU 688 -1.999 -8.375 -7.182 1053 H LYS 689 HN LYS 689 -0.652 -11.718 -9.804 1054 HA LYS 689 HA LYS 689 1.039 -11.905 -12.014 1055 HB2 LYS 689 HB2 LYS 689 -0.723 -13.646 -10.463 1056 HB3 LYS 689 HB1 LYS 689 -0.502 -14.170 -12.127 1057 HG2 LYS 689 HG2 LYS 689 1.061 -15.251 -10.731 1058 HG3 LYS 689 HG1 LYS 689 1.935 -14.065 -11.701 1059 HD2 LYS 689 HD2 LYS 689 2.119 -12.578 -9.890 1060 HD3 LYS 689 HD1 LYS 689 0.927 -13.472 -8.943 1061 HE2 LYS 689 HE2 LYS 689 3.121 -13.911 -8.119 1062 HE3 LYS 689 HE1 LYS 689 2.466 -15.371 -8.837 1063 HZ1 LYS 689 HZ1 LYS 689 4.801 -14.978 -9.438 1064 HZ2 LYS 689 HZ2 LYS 689 4.361 -13.533 -10.200 1065 HZ3 LYS 689 HZ3 LYS 689 3.786 -15.009 -10.789 Start of MODEL 15 1 H1 VAL 34 HT1 VAL 34 -19.240 -4.375 -4.260 2 H2 VAL 34 HT2 VAL 34 -18.659 -5.078 -5.684 3 H3 VAL 34 HT3 VAL 34 -18.665 -3.399 -5.514 4 HA VAL 34 HA VAL 34 -17.056 -3.521 -3.744 5 HB VAL 34 HB VAL 34 -15.831 -5.726 -3.489 6 HG11 VAL 34 HG11 VAL 34 -17.295 -6.567 -1.802 7 HG12 VAL 34 HG12 VAL 34 -18.649 -5.653 -2.466 8 HG13 VAL 34 HG13 VAL 34 -17.272 -4.807 -1.758 9 HG21 VAL 34 HG21 VAL 34 -16.775 -6.865 -5.426 10 HG22 VAL 34 HG22 VAL 34 -18.375 -6.812 -4.684 11 HG23 VAL 34 HG23 VAL 34 -17.091 -7.765 -3.943 12 H PHE 35 HN PHE 35 -14.776 -3.707 -4.128 13 HA PHE 35 HA PHE 35 -14.073 -4.173 -6.946 14 HB2 PHE 35 HB2 PHE 35 -13.198 -2.050 -5.017 15 HB3 PHE 35 HB1 PHE 35 -12.093 -2.574 -6.286 16 HD1 PHE 35 HD2 PHE 35 -15.739 -1.824 -6.092 17 HD2 PHE 35 HD1 PHE 35 -12.038 -1.142 -8.063 18 HE1 PHE 35 HE2 PHE 35 -16.871 -0.342 -7.684 19 HE2 PHE 35 HE1 PHE 35 -13.159 0.338 -9.671 20 HZ PHE 35 HZ PHE 35 -15.582 0.741 -9.486 21 HA PRO 36 HA PRO 36 -11.313 -7.391 -5.601 22 HB2 PRO 36 HB2 PRO 36 -9.491 -6.139 -7.605 23 HB3 PRO 36 HB1 PRO 36 -9.961 -7.831 -7.418 24 HG2 PRO 36 HG2 PRO 36 -11.003 -6.345 -9.361 25 HG3 PRO 36 HG1 PRO 36 -11.996 -7.524 -8.483 26 HD2 PRO 36 HD2 PRO 36 -11.934 -4.551 -8.253 27 HD3 PRO 36 HD1 PRO 36 -13.301 -5.672 -8.090 28 H TRP 37 HN TRP 37 -9.887 -7.435 -3.986 29 HA TRP 37 HA TRP 37 -9.498 -5.208 -2.490 30 HB2 TRP 37 HB2 TRP 37 -7.774 -6.573 -1.227 31 HB3 TRP 37 HB1 TRP 37 -9.381 -7.264 -1.403 32 HD1 TRP 37 HD1 TRP 37 -9.614 -9.231 -3.318 33 HE1 TRP 37 HE1 TRP 37 -7.918 -11.030 -4.013 34 HE3 TRP 37 HE3 TRP 37 -5.377 -7.065 -1.489 35 HZ2 TRP 37 HZ2 TRP 37 -5.151 -11.470 -3.787 36 HZ3 TRP 37 HZ3 TRP 37 -3.238 -8.245 -1.778 37 HH2 TRP 37 HH2 TRP 37 -3.131 -10.409 -2.899 38 H HIS 38 HN HIS 38 -7.231 -6.453 -4.919 39 HA HIS 38 HA HIS 38 -5.135 -4.690 -4.249 40 HB2 HIS 38 HB2 HIS 38 -4.315 -5.142 -6.570 41 HB3 HIS 38 HB1 HIS 38 -4.635 -6.584 -5.618 42 HD1 HIS 38 HD1 HIS 38 -5.599 -4.850 -8.743 43 HD2 HIS 38 HD2 HIS 38 -6.919 -8.081 -6.476 44 HE1 HIS 38 HE1 HIS 38 -7.132 -6.155 -10.249 45 HE2 HIS 38 HE2 HIS 38 -7.859 -8.145 -8.887 46 H SER 39 HN SER 39 -6.290 -2.752 -3.828 47 HA SER 39 HA SER 39 -6.829 -1.170 -6.242 48 HB2 SER 39 HB2 SER 39 -8.993 -1.912 -5.423 49 HB3 SER 39 HB1 SER 39 -8.590 -1.412 -3.784 50 HG SER 39 HG SER 39 -9.839 0.193 -4.655 51 H LEU 40 HN LEU 40 -6.379 -1.151 -2.759 52 HA LEU 40 HA LEU 40 -5.368 1.606 -2.795 53 HB2 LEU 40 HB2 LEU 40 -5.420 0.727 -0.162 54 HB3 LEU 40 HB1 LEU 40 -6.626 1.720 -0.960 55 HG LEU 40 HG LEU 40 -6.831 -1.273 -1.123 56 HD11 LEU 40 HD11 LEU 40 -7.822 0.447 1.137 57 HD12 LEU 40 HD12 LEU 40 -6.598 -0.818 1.238 58 HD13 LEU 40 HD13 LEU 40 -8.271 -1.236 0.855 59 HD21 LEU 40 HD21 LEU 40 -9.191 -0.793 -1.384 60 HD22 LEU 40 HD22 LEU 40 -8.269 0.161 -2.547 61 HD23 LEU 40 HD23 LEU 40 -8.907 0.921 -1.091 62 H VAL 41 HN VAL 41 -4.195 -1.484 -3.018 63 HA VAL 41 HA VAL 41 -1.831 -1.065 -1.416 64 HB VAL 41 HB VAL 41 -2.870 -3.275 -1.385 65 HG11 VAL 41 HG11 VAL 41 -3.844 -3.303 -3.621 66 HG12 VAL 41 HG12 VAL 41 -2.852 -4.737 -3.347 67 HG13 VAL 41 HG13 VAL 41 -2.234 -3.411 -4.332 68 HG21 VAL 41 HG21 VAL 41 -0.896 -4.614 -1.854 69 HG22 VAL 41 HG22 VAL 41 -0.479 -3.104 -1.045 70 HG23 VAL 41 HG23 VAL 41 -0.212 -3.278 -2.778 71 HA PRO 42 HA PRO 42 0.305 0.478 -5.028 72 HB2 PRO 42 HB2 PRO 42 2.609 1.112 -3.839 73 HB3 PRO 42 HB1 PRO 42 1.135 2.033 -3.504 74 HG2 PRO 42 HG2 PRO 42 2.415 -0.144 -1.892 75 HG3 PRO 42 HG1 PRO 42 1.744 1.403 -1.346 76 HD2 PRO 42 HD2 PRO 42 0.390 -0.979 -1.212 77 HD3 PRO 42 HD1 PRO 42 -0.406 0.603 -1.332 78 H PHE 43 HN PHE 43 2.056 -0.175 -6.359 79 HA PHE 43 HA PHE 43 2.908 -2.916 -5.799 80 HB2 PHE 43 HB2 PHE 43 2.896 -1.393 -8.412 81 HB3 PHE 43 HB1 PHE 43 3.381 -3.076 -8.210 82 HD1 PHE 43 HD1 PHE 43 1.498 -4.439 -6.749 83 HD2 PHE 43 HD2 PHE 43 0.810 -1.117 -9.323 84 HE1 PHE 43 HE1 PHE 43 -0.835 -5.151 -7.041 85 HE2 PHE 43 HE2 PHE 43 -1.528 -1.827 -9.615 86 HZ PHE 43 HZ PHE 43 -2.352 -3.846 -8.472 87 H LEU 44 HN LEU 44 4.435 -2.025 -4.258 88 HA LEU 44 HA LEU 44 6.709 -0.566 -4.838 89 HB2 LEU 44 HB2 LEU 44 6.271 -1.217 -2.578 90 HB3 LEU 44 HB1 LEU 44 6.195 -2.903 -3.012 91 HG LEU 44 HG LEU 44 8.221 -1.992 -1.667 92 HD11 LEU 44 HD11 LEU 44 8.523 -3.853 -4.012 93 HD12 LEU 44 HD12 LEU 44 8.078 -4.280 -2.358 94 HD13 LEU 44 HD13 LEU 44 9.699 -3.679 -2.709 95 HD21 LEU 44 HD21 LEU 44 8.849 -0.178 -3.129 96 HD22 LEU 44 HD22 LEU 44 9.062 -1.299 -4.474 97 HD23 LEU 44 HD23 LEU 44 10.137 -1.385 -3.078 98 H ALA 45 HN ALA 45 8.268 -0.847 -6.290 99 HA ALA 45 HA ALA 45 8.588 -2.941 -8.050 100 HB1 ALA 45 HB1 ALA 45 9.688 -0.846 -8.438 101 HB2 ALA 45 HB2 ALA 45 10.937 -2.086 -8.311 102 HB3 ALA 45 HB3 ALA 45 10.628 -1.000 -6.955 103 HA PRO 46 HA PRO 46 9.739 -5.866 -4.851 104 HB2 PRO 46 HB2 PRO 46 9.279 -8.120 -6.234 105 HB3 PRO 46 HB1 PRO 46 7.960 -7.097 -5.655 106 HG2 PRO 46 HG2 PRO 46 9.159 -7.277 -8.389 107 HG3 PRO 46 HG1 PRO 46 7.453 -7.155 -7.921 108 HD2 PRO 46 HD2 PRO 46 8.962 -5.031 -8.778 109 HD3 PRO 46 HD1 PRO 46 7.551 -4.878 -7.713 110 H SER 47 HN SER 47 11.896 -4.681 -5.810 111 HA SER 47 HA SER 47 14.097 -4.851 -6.245 112 HB2 SER 47 HB2 SER 47 15.262 -6.721 -5.281 113 HB3 SER 47 HB1 SER 47 13.872 -6.346 -4.258 114 HG SER 47 HG SER 47 12.882 -8.074 -5.814 115 H GLN 48 HN GLN 48 15.793 -6.633 -7.363 116 HA GLN 48 HA GLN 48 14.525 -7.570 -9.789 117 HB2 GLN 48 HB2 GLN 48 15.289 -5.261 -10.211 118 HB3 GLN 48 HB1 GLN 48 16.915 -5.730 -9.733 119 HG2 GLN 48 HG2 GLN 48 16.880 -5.732 -12.077 120 HG3 GLN 48 HG1 GLN 48 16.861 -7.417 -11.562 121 HE21 GLN 48 HE21 GLN 48 15.958 -8.135 -13.477 122 HE22 GLN 48 HE22 GLN 48 14.309 -7.826 -13.900 123 H ALA 567 HT1 ALA 567 -22.318 17.273 -6.212 124 HA ALA 567 HA ALA 567 -21.275 15.110 -6.484 125 HB1 ALA 567 HB1 ALA 567 -21.906 15.807 -3.619 126 HB2 ALA 567 HB2 ALA 567 -20.643 16.544 -4.605 127 HB3 ALA 567 HB3 ALA 567 -20.546 14.835 -4.181 128 HA PRO 568 HA PRO 568 -23.998 11.647 -6.037 129 HB2 PRO 568 HB2 PRO 568 -22.177 9.675 -6.354 130 HB3 PRO 568 HB1 PRO 568 -22.720 10.683 -7.698 131 HG2 PRO 568 HG2 PRO 568 -20.202 10.838 -6.107 132 HG3 PRO 568 HG1 PRO 568 -20.448 11.078 -7.845 133 HD2 PRO 568 HD2 PRO 568 -20.185 13.118 -6.024 134 HD3 PRO 568 HD1 PRO 568 -21.024 13.274 -7.575 135 HA PRO 569 HA PRO 569 -23.682 10.369 -1.835 136 HB2 PRO 569 HB2 PRO 569 -24.935 7.966 -1.883 137 HB3 PRO 569 HB1 PRO 569 -25.800 9.498 -2.048 138 HG2 PRO 569 HG2 PRO 569 -24.996 7.536 -4.145 139 HG3 PRO 569 HG1 PRO 569 -26.478 8.500 -4.014 140 HD2 PRO 569 HD2 PRO 569 -24.367 9.126 -5.649 141 HD3 PRO 569 HD1 PRO 569 -25.524 10.314 -5.025 142 H THR 570 HN THR 570 -22.009 9.658 -0.766 143 HA THR 570 HA THR 570 -20.192 8.470 -0.098 144 HB THR 570 HB THR 570 -20.860 6.281 -1.996 145 HG1 THR 570 HG1 THR 570 -21.893 5.903 0.486 146 HG21 THR 570 HG21 THR 570 -19.967 4.867 -0.159 147 HG22 THR 570 HG22 THR 570 -19.576 6.342 0.727 148 HG23 THR 570 HG23 THR 570 -18.782 5.999 -0.811 149 H LEU 571 HN LEU 571 -18.062 7.808 -0.871 150 HA LEU 571 HA LEU 571 -17.303 9.378 -3.145 151 HB2 LEU 571 HB2 LEU 571 -15.815 7.809 -1.063 152 HB3 LEU 571 HB1 LEU 571 -15.023 8.650 -2.356 153 HG LEU 571 HG LEU 571 -16.785 9.994 -0.325 154 HD11 LEU 571 HD11 LEU 571 -14.714 10.812 0.668 155 HD12 LEU 571 HD12 LEU 571 -13.779 9.836 -0.465 156 HD13 LEU 571 HD13 LEU 571 -14.805 9.053 0.735 157 HD21 LEU 571 HD21 LEU 571 -14.890 11.071 -2.406 158 HD22 LEU 571 HD22 LEU 571 -15.722 12.039 -1.190 159 HD23 LEU 571 HD23 LEU 571 -16.649 11.192 -2.429 160 HA PRO 572 HA PRO 572 -16.571 6.330 -6.258 161 HB2 PRO 572 HB2 PRO 572 -13.625 6.662 -5.953 162 HB3 PRO 572 HB1 PRO 572 -14.627 6.743 -7.402 163 HG2 PRO 572 HG2 PRO 572 -13.687 8.964 -6.283 164 HG3 PRO 572 HG1 PRO 572 -15.315 8.907 -6.985 165 HD2 PRO 572 HD2 PRO 572 -14.481 8.876 -4.129 166 HD3 PRO 572 HD1 PRO 572 -15.913 9.591 -4.876 167 HA PRO 573 HA PRO 573 -16.104 2.698 -3.921 168 HB2 PRO 573 HB2 PRO 573 -16.610 0.890 -5.796 169 HB3 PRO 573 HB1 PRO 573 -17.832 2.079 -5.323 170 HG2 PRO 573 HG2 PRO 573 -15.964 2.128 -7.668 171 HG3 PRO 573 HG1 PRO 573 -17.697 2.440 -7.621 172 HD2 PRO 573 HD2 PRO 573 -15.850 4.418 -7.619 173 HD3 PRO 573 HD1 PRO 573 -17.435 4.573 -6.846 174 H TYR 574 HN TYR 574 -13.758 3.528 -6.182 175 HA TYR 574 HA TYR 574 -12.304 1.145 -6.355 176 HB2 TYR 574 HB2 TYR 574 -11.921 3.120 -7.785 177 HB3 TYR 574 HB1 TYR 574 -11.116 3.893 -6.438 178 HD1 TYR 574 HD2 TYR 574 -10.973 0.635 -8.274 179 HD2 TYR 574 HD1 TYR 574 -8.808 3.821 -6.479 180 HE1 TYR 574 HE2 TYR 574 -8.859 -0.421 -8.957 181 HE2 TYR 574 HE1 TYR 574 -6.692 2.781 -7.155 182 HH TYR 574 HH TYR 574 -5.851 0.544 -7.723 183 H PHE 575 HN PHE 575 -10.897 3.853 -4.575 184 HA PHE 575 HA PHE 575 -10.409 1.996 -2.356 185 HB2 PHE 575 HB2 PHE 575 -8.137 2.474 -2.267 186 HB3 PHE 575 HB1 PHE 575 -8.425 2.401 -3.997 187 HD1 PHE 575 HD2 PHE 575 -9.188 4.799 -4.984 188 HD2 PHE 575 HD1 PHE 575 -6.818 4.155 -1.514 189 HE1 PHE 575 HE2 PHE 575 -8.259 7.059 -5.208 190 HE2 PHE 575 HE1 PHE 575 -5.892 6.423 -1.725 191 HZ PHE 575 HZ PHE 575 -6.625 7.874 -3.569 192 H MET 576 HN MET 576 -11.850 4.694 -3.305 193 HA MET 576 HA MET 576 -11.018 6.643 -1.381 194 HB2 MET 576 HB2 MET 576 -13.681 6.433 -2.809 195 HB3 MET 576 HB1 MET 576 -13.038 7.865 -2.015 196 HG2 MET 576 HG2 MET 576 -11.721 6.515 -4.356 197 HG3 MET 576 HG1 MET 576 -12.859 7.849 -4.501 198 HE1 MET 576 HE1 MET 576 -11.219 9.368 -5.833 199 HE2 MET 576 HE2 MET 576 -10.086 8.018 -5.851 200 HE3 MET 576 HE3 MET 576 -9.535 9.624 -5.380 201 H LYS 577 HN LYS 577 -12.451 7.487 0.362 202 HA LYS 577 HA LYS 577 -12.884 5.472 2.258 203 HB2 LYS 577 HB2 LYS 577 -12.388 7.913 2.692 204 HB3 LYS 577 HB1 LYS 577 -14.081 8.237 2.355 205 HG2 LYS 577 HG2 LYS 577 -14.663 6.636 4.193 206 HG3 LYS 577 HG1 LYS 577 -12.942 6.590 4.597 207 HD2 LYS 577 HD2 LYS 577 -12.994 9.056 4.872 208 HD3 LYS 577 HD1 LYS 577 -14.737 9.014 4.593 209 HE2 LYS 577 HE2 LYS 577 -15.021 7.589 6.553 210 HE3 LYS 577 HE1 LYS 577 -13.279 7.605 6.826 211 HZ1 LYS 577 HZ1 LYS 577 -13.384 9.987 7.172 212 HZ2 LYS 577 HZ2 LYS 577 -14.427 9.197 8.244 213 HZ3 LYS 577 HZ3 LYS 577 -15.049 9.988 6.885 214 H GLY 578 HN GLY 578 -14.503 4.134 2.582 215 HA2 GLY 578 HA2 GLY 578 -16.778 3.599 2.958 216 HA3 GLY 578 HA1 GLY 578 -17.245 4.934 1.949 217 H SER 579 HN SER 579 -14.819 3.418 0.334 218 HA SER 579 HA SER 579 -16.604 1.888 -1.321 219 HB2 SER 579 HB2 SER 579 -14.625 1.330 -2.622 220 HB3 SER 579 HB1 SER 579 -14.603 3.046 -2.250 221 HG SER 579 HG SER 579 -12.944 2.787 -0.959 222 H ILE 580 HN ILE 580 -16.623 -0.413 -1.488 223 HA ILE 580 HA ILE 580 -15.706 -1.643 1.007 224 HB ILE 580 HB ILE 580 -17.881 -2.529 -0.882 225 HG12 ILE 580 HG12 ILE 580 -18.601 -0.685 0.483 226 HG13 ILE 580 HG11 ILE 580 -19.302 -2.148 1.164 227 HG21 ILE 580 HG21 ILE 580 -16.679 -4.452 0.022 228 HG22 ILE 580 HG22 ILE 580 -18.304 -4.337 0.699 229 HG23 ILE 580 HG23 ILE 580 -16.914 -3.834 1.658 230 HD11 ILE 580 HD11 ILE 580 -18.544 -0.797 2.967 231 HD12 ILE 580 HD12 ILE 580 -16.963 -0.569 2.223 232 HD13 ILE 580 HD13 ILE 580 -17.431 -2.160 2.834 233 H ILE 581 HN ILE 581 -13.994 -2.780 0.929 234 HA ILE 581 HA ILE 581 -12.918 -3.580 -1.656 235 HB ILE 581 HB ILE 581 -11.560 -3.681 1.038 236 HG12 ILE 581 HG12 ILE 581 -12.256 -1.401 0.697 237 HG13 ILE 581 HG11 ILE 581 -10.532 -1.501 0.392 238 HG21 ILE 581 HG21 ILE 581 -10.486 -4.984 -0.698 239 HG22 ILE 581 HG22 ILE 581 -9.512 -3.571 -0.283 240 HG23 ILE 581 HG23 ILE 581 -10.473 -3.577 -1.761 241 HD11 ILE 581 HD11 ILE 581 -11.021 -1.569 -2.032 242 HD12 ILE 581 HD12 ILE 581 -11.525 -0.079 -1.236 243 HD13 ILE 581 HD13 ILE 581 -12.725 -1.303 -1.653 244 H GLN 582 HN GLN 582 -12.909 -5.633 -2.311 245 HA GLN 582 HA GLN 582 -13.805 -7.659 -0.390 246 HB2 GLN 582 HB2 GLN 582 -15.286 -7.484 -2.216 247 HB3 GLN 582 HB1 GLN 582 -14.004 -7.508 -3.385 248 HG2 GLN 582 HG2 GLN 582 -13.483 -9.856 -2.623 249 HG3 GLN 582 HG1 GLN 582 -14.966 -9.782 -1.673 250 HE21 GLN 582 HE21 GLN 582 -15.944 -11.434 -2.805 251 HE22 GLN 582 HE22 GLN 582 -16.493 -11.252 -4.434 252 H LEU 583 HN LEU 583 -12.372 -8.979 0.379 253 HA LEU 583 HA LEU 583 -9.727 -9.146 -0.764 254 HB2 LEU 583 HB2 LEU 583 -10.903 -10.637 1.575 255 HB3 LEU 583 HB1 LEU 583 -9.200 -10.432 1.214 256 HG LEU 583 HG LEU 583 -11.098 -8.210 1.961 257 HD11 LEU 583 HD11 LEU 583 -8.885 -9.466 3.566 258 HD12 LEU 583 HD12 LEU 583 -10.604 -9.814 3.777 259 HD13 LEU 583 HD13 LEU 583 -9.990 -8.188 4.086 260 HD21 LEU 583 HD21 LEU 583 -9.053 -6.853 2.136 261 HD22 LEU 583 HD22 LEU 583 -9.318 -7.432 0.491 262 HD23 LEU 583 HD23 LEU 583 -8.110 -8.208 1.518 263 H ALA 584 HN ALA 584 -8.683 -11.359 -0.938 264 HA ALA 584 HA ALA 584 -10.009 -12.685 -3.043 265 HB1 ALA 584 HB1 ALA 584 -8.089 -14.117 -3.178 266 HB2 ALA 584 HB2 ALA 584 -7.579 -13.664 -1.552 267 HB3 ALA 584 HB3 ALA 584 -7.545 -12.472 -2.853 268 H ASN 585 HN ASN 585 -10.088 -13.187 0.341 269 HA ASN 585 HA ASN 585 -10.911 -15.951 0.159 270 HB2 ASN 585 HB2 ASN 585 -11.195 -15.819 2.579 271 HB3 ASN 585 HB1 ASN 585 -9.630 -15.180 2.115 272 HD21 ASN 585 HD21 ASN 585 -11.130 -14.725 4.523 273 HD22 ASN 585 HD22 ASN 585 -11.373 -13.012 4.627 274 H GLY 586 HN GLY 586 -12.337 -12.980 -0.352 275 HA2 GLY 586 HA2 GLY 586 -14.487 -12.820 -1.281 276 HA3 GLY 586 HA1 GLY 586 -14.937 -14.295 -0.446 277 H GLU 587 HN GLU 587 -13.339 -12.045 1.594 278 HA GLU 587 HA GLU 587 -15.955 -11.411 2.750 279 HB2 GLU 587 HB2 GLU 587 -14.880 -10.958 4.809 280 HB3 GLU 587 HB1 GLU 587 -14.149 -12.425 4.186 281 HG2 GLU 587 HG2 GLU 587 -12.211 -11.240 3.489 282 HG3 GLU 587 HG1 GLU 587 -12.940 -9.696 3.942 283 H LEU 588 HN LEU 588 -16.486 -9.278 3.379 284 HA LEU 588 HA LEU 588 -15.269 -7.295 1.575 285 HB2 LEU 588 HB2 LEU 588 -18.099 -7.254 2.596 286 HB3 LEU 588 HB1 LEU 588 -17.424 -6.354 1.253 287 HG LEU 588 HG LEU 588 -17.971 -9.319 1.343 288 HD11 LEU 588 HD11 LEU 588 -19.952 -7.949 1.050 289 HD12 LEU 588 HD12 LEU 588 -19.563 -8.818 -0.435 290 HD13 LEU 588 HD13 LEU 588 -19.185 -7.101 -0.293 291 HD21 LEU 588 HD21 LEU 588 -17.344 -9.046 -1.161 292 HD22 LEU 588 HD22 LEU 588 -16.072 -9.233 0.045 293 HD23 LEU 588 HD23 LEU 588 -16.444 -7.637 -0.594 294 H LYS 589 HN LYS 589 -14.427 -5.511 2.516 295 HA LYS 589 HA LYS 589 -15.356 -4.742 5.180 296 HB2 LYS 589 HB2 LYS 589 -12.447 -5.112 4.475 297 HB3 LYS 589 HB1 LYS 589 -13.087 -4.583 6.010 298 HG2 LYS 589 HG2 LYS 589 -14.074 -6.710 6.425 299 HG3 LYS 589 HG1 LYS 589 -13.674 -7.265 4.801 300 HD2 LYS 589 HD2 LYS 589 -12.055 -8.254 6.158 301 HD3 LYS 589 HD1 LYS 589 -11.235 -6.853 5.471 302 HE2 LYS 589 HE2 LYS 589 -12.625 -6.574 8.089 303 HE3 LYS 589 HE1 LYS 589 -11.074 -7.406 8.028 304 HZ1 LYS 589 HZ1 LYS 589 -11.577 -4.651 7.050 305 HZ2 LYS 589 HZ2 LYS 589 -10.084 -5.460 7.043 306 HZ3 LYS 589 HZ3 LYS 589 -10.823 -5.049 8.511 307 H LYS 590 HN LYS 590 -14.595 -2.647 5.849 308 HA LYS 590 HA LYS 590 -14.739 -0.752 3.703 309 HB2 LYS 590 HB2 LYS 590 -14.953 -0.744 6.636 310 HB3 LYS 590 HB1 LYS 590 -14.308 0.730 5.935 311 HG2 LYS 590 HG2 LYS 590 -16.868 -0.530 4.994 312 HG3 LYS 590 HG1 LYS 590 -16.803 0.650 6.301 313 HD2 LYS 590 HD2 LYS 590 -16.066 1.043 3.404 314 HD3 LYS 590 HD1 LYS 590 -17.301 1.893 4.331 315 HE2 LYS 590 HE2 LYS 590 -14.324 2.079 4.681 316 HE3 LYS 590 HE1 LYS 590 -15.390 3.315 4.039 317 HZ1 LYS 590 HZ1 LYS 590 -14.771 3.712 6.366 318 HZ2 LYS 590 HZ2 LYS 590 -15.518 2.257 6.807 319 HZ3 LYS 590 HZ3 LYS 590 -16.447 3.522 6.176 320 H VAL 591 HN VAL 591 -13.236 0.848 3.223 321 HA VAL 591 HA VAL 591 -10.794 -0.182 2.546 322 HB VAL 591 HB VAL 591 -11.088 2.768 2.918 323 HG11 VAL 591 HG11 VAL 591 -8.999 1.958 2.037 324 HG12 VAL 591 HG12 VAL 591 -9.887 2.813 0.772 325 HG13 VAL 591 HG13 VAL 591 -9.845 1.049 0.784 326 HG21 VAL 591 HG21 VAL 591 -12.304 2.852 0.755 327 HG22 VAL 591 HG22 VAL 591 -13.232 2.134 2.071 328 HG23 VAL 591 HG23 VAL 591 -12.495 1.100 0.847 329 H GLU 592 HN GLU 592 -11.441 2.019 5.279 330 HA GLU 592 HA GLU 592 -8.604 2.301 5.758 331 HB2 GLU 592 HB2 GLU 592 -9.192 3.894 7.445 332 HB3 GLU 592 HB1 GLU 592 -10.179 4.197 6.023 333 HG2 GLU 592 HG2 GLU 592 -11.180 2.556 8.315 334 HG3 GLU 592 HG1 GLU 592 -11.295 4.303 8.292 335 H ASP 593 HN ASP 593 -11.292 0.558 7.054 336 HA ASP 593 HA ASP 593 -9.894 -0.201 9.462 337 HB2 ASP 593 HB2 ASP 593 -12.371 0.206 9.344 338 HB3 ASP 593 HB1 ASP 593 -12.513 -1.274 8.406 339 H LEU 594 HN LEU 594 -9.799 -1.264 6.296 340 HA LEU 594 HA LEU 594 -9.322 -3.987 6.539 341 HB2 LEU 594 HB2 LEU 594 -7.984 -1.931 4.785 342 HB3 LEU 594 HB1 LEU 594 -7.776 -3.660 4.603 343 HG LEU 594 HG LEU 594 -10.483 -2.359 4.428 344 HD11 LEU 594 HD11 LEU 594 -9.045 -1.322 2.782 345 HD12 LEU 594 HD12 LEU 594 -10.199 -2.410 2.011 346 HD13 LEU 594 HD13 LEU 594 -8.521 -2.909 2.217 347 HD21 LEU 594 HD21 LEU 594 -11.031 -4.369 3.177 348 HD22 LEU 594 HD22 LEU 594 -10.424 -4.778 4.784 349 HD23 LEU 594 HD23 LEU 594 -9.379 -4.953 3.372 350 H LYS 595 HN LYS 595 -7.706 -5.154 7.314 351 HA LYS 595 HA LYS 595 -5.433 -3.717 8.505 352 HB2 LYS 595 HB2 LYS 595 -6.573 -6.435 9.165 353 HB3 LYS 595 HB1 LYS 595 -5.123 -5.760 9.894 354 HG2 LYS 595 HG2 LYS 595 -7.903 -4.620 10.099 355 HG3 LYS 595 HG1 LYS 595 -7.036 -5.497 11.361 356 HD2 LYS 595 HD2 LYS 595 -5.341 -3.756 11.435 357 HD3 LYS 595 HD1 LYS 595 -6.147 -2.894 10.125 358 HE2 LYS 595 HE2 LYS 595 -8.151 -2.679 11.570 359 HE3 LYS 595 HE1 LYS 595 -7.234 -3.415 12.885 360 HZ1 LYS 595 HZ1 LYS 595 -6.528 -0.891 11.494 361 HZ2 LYS 595 HZ2 LYS 595 -5.661 -1.590 12.765 362 HZ3 LYS 595 HZ3 LYS 595 -7.226 -1.004 13.031 363 H THR 596 HN THR 596 -3.347 -4.946 8.481 364 HA THR 596 HA THR 596 -2.634 -5.481 5.829 365 HB THR 596 HB THR 596 -1.051 -4.713 7.574 366 HG1 THR 596 HG1 THR 596 0.231 -5.435 6.068 367 HG21 THR 596 HG21 THR 596 -0.165 -6.136 9.212 368 HG22 THR 596 HG22 THR 596 -0.885 -7.566 8.474 369 HG23 THR 596 HG23 THR 596 -1.909 -6.383 9.296 370 H GLU 597 HN GLU 597 -3.417 -7.657 8.506 371 HA GLU 597 HA GLU 597 -2.637 -10.052 7.325 372 HB2 GLU 597 HB2 GLU 597 -4.785 -9.519 9.358 373 HB3 GLU 597 HB1 GLU 597 -4.204 -11.120 8.939 374 HG2 GLU 597 HG2 GLU 597 -1.933 -10.415 9.644 375 HG3 GLU 597 HG1 GLU 597 -2.627 -8.891 10.194 376 H ASP 598 HN ASP 598 -5.493 -8.150 6.931 377 HA ASP 598 HA ASP 598 -7.222 -9.926 5.680 378 HB2 ASP 598 HB2 ASP 598 -6.747 -7.010 5.030 379 HB3 ASP 598 HB1 ASP 598 -8.157 -7.934 4.552 380 H PHE 599 HN PHE 599 -4.709 -7.870 4.324 381 HA PHE 599 HA PHE 599 -4.990 -8.903 1.680 382 HB2 PHE 599 HB2 PHE 599 -3.031 -7.039 2.995 383 HB3 PHE 599 HB1 PHE 599 -2.734 -7.653 1.372 384 HD1 PHE 599 HD2 PHE 599 -5.761 -6.380 3.163 385 HD2 PHE 599 HD1 PHE 599 -3.210 -6.093 -0.230 386 HE1 PHE 599 HE2 PHE 599 -7.224 -4.647 2.215 387 HE2 PHE 599 HE1 PHE 599 -4.672 -4.360 -1.186 388 HZ PHE 599 HZ PHE 599 -6.682 -3.634 0.038 389 H ILE 600 HN ILE 600 -2.806 -9.513 4.423 390 HA ILE 600 HA ILE 600 -0.951 -11.177 3.346 391 HB ILE 600 HB ILE 600 -2.454 -11.338 5.926 392 HG12 ILE 600 HG12 ILE 600 -0.837 -10.072 6.784 393 HG13 ILE 600 HG11 ILE 600 0.420 -10.905 5.946 394 HG21 ILE 600 HG21 ILE 600 -0.132 -13.058 5.071 395 HG22 ILE 600 HG22 ILE 600 -1.772 -13.600 5.431 396 HG23 ILE 600 HG23 ILE 600 -0.758 -12.945 6.716 397 HD11 ILE 600 HD11 ILE 600 -1.274 -8.734 4.806 398 HD12 ILE 600 HD12 ILE 600 0.109 -9.506 4.025 399 HD13 ILE 600 HD13 ILE 600 0.342 -8.520 5.473 400 H GLN 601 HN GLN 601 -4.083 -12.172 4.675 401 HA GLN 601 HA GLN 601 -3.920 -14.860 3.954 402 HB2 GLN 601 HB2 GLN 601 -6.275 -13.063 4.497 403 HB3 GLN 601 HB1 GLN 601 -6.475 -14.768 4.126 404 HG2 GLN 601 HG2 GLN 601 -5.153 -15.371 6.054 405 HG3 GLN 601 HG1 GLN 601 -4.876 -13.669 6.424 406 HE21 GLN 601 HE21 GLN 601 -5.834 -13.857 8.447 407 HE22 GLN 601 HE22 GLN 601 -7.545 -14.015 8.642 408 H SER 602 HN SER 602 -5.467 -12.158 2.237 409 HA SER 602 HA SER 602 -6.802 -13.615 0.315 410 HB2 SER 602 HB2 SER 602 -6.753 -11.561 -1.058 411 HB3 SER 602 HB1 SER 602 -7.132 -11.231 0.623 412 HG SER 602 HG SER 602 -4.725 -10.857 0.773 413 H ALA 603 HN ALA 603 -3.507 -12.333 0.127 414 HA ALA 603 HA ALA 603 -2.990 -13.423 -2.455 415 HB1 ALA 603 HB1 ALA 603 -0.970 -12.581 -0.401 416 HB2 ALA 603 HB2 ALA 603 -1.824 -11.456 -1.460 417 HB3 ALA 603 HB3 ALA 603 -0.749 -12.673 -2.148 418 H GLU 604 HN GLU 604 -2.397 -14.542 0.839 419 HA GLU 604 HA GLU 604 -0.619 -16.648 0.157 420 HB2 GLU 604 HB2 GLU 604 -2.336 -16.174 2.584 421 HB3 GLU 604 HB1 GLU 604 -1.149 -17.466 2.460 422 HG2 GLU 604 HG2 GLU 604 -0.389 -14.619 1.988 423 HG3 GLU 604 HG1 GLU 604 -0.499 -15.276 3.613 424 H ILE 605 HN ILE 605 -4.097 -16.481 0.633 425 HA ILE 605 HA ILE 605 -4.724 -19.193 0.418 426 HB ILE 605 HB ILE 605 -6.318 -16.782 -0.479 427 HG12 ILE 605 HG12 ILE 605 -6.451 -18.381 2.079 428 HG13 ILE 605 HG11 ILE 605 -5.571 -16.872 1.909 429 HG21 ILE 605 HG21 ILE 605 -7.265 -19.591 0.081 430 HG22 ILE 605 HG22 ILE 605 -7.184 -18.826 -1.506 431 HG23 ILE 605 HG23 ILE 605 -8.295 -18.206 -0.284 432 HD11 ILE 605 HD11 ILE 605 -7.688 -15.745 1.352 433 HD12 ILE 605 HD12 ILE 605 -7.672 -16.459 2.967 434 HD13 ILE 605 HD13 ILE 605 -8.539 -17.263 1.653 435 H SER 606 HN SER 606 -3.854 -16.830 -1.960 436 HA SER 606 HA SER 606 -2.757 -17.126 -3.908 437 HB2 SER 606 HB2 SER 606 -3.172 -20.076 -3.418 438 HB3 SER 606 HB1 SER 606 -2.146 -19.388 -4.676 439 HG SER 606 HG SER 606 -1.838 -18.836 -1.905 440 H ASN 607 HN ASN 607 -3.069 -17.543 -6.099 441 HA ASN 607 HA ASN 607 -5.143 -18.791 -7.396 442 HB2 ASN 607 HB2 ASN 607 -6.641 -17.220 -6.128 443 HB3 ASN 607 HB1 ASN 607 -5.813 -15.871 -6.897 444 HD21 ASN 607 HD21 ASN 607 -7.648 -15.121 -7.914 445 HD22 ASN 607 HD22 ASN 607 -8.390 -15.955 -9.236 446 H ASP 608 HN ASP 608 -3.908 -15.499 -7.382 447 HA ASP 608 HA ASP 608 -1.987 -15.983 -9.490 448 HB2 ASP 608 HB2 ASP 608 -4.420 -14.234 -9.884 449 HB3 ASP 608 HB1 ASP 608 -2.926 -13.925 -10.755 450 H LEU 609 HN LEU 609 -1.778 -15.360 -6.761 451 HA LEU 609 HA LEU 609 -1.117 -12.497 -6.701 452 HB2 LEU 609 HB2 LEU 609 -2.682 -13.821 -4.497 453 HB3 LEU 609 HB1 LEU 609 -2.456 -12.110 -4.798 454 HG LEU 609 HG LEU 609 -3.851 -13.571 -6.940 455 HD11 LEU 609 HD11 LEU 609 -4.883 -14.733 -5.158 456 HD12 LEU 609 HD12 LEU 609 -6.005 -13.469 -5.659 457 HD13 LEU 609 HD13 LEU 609 -5.041 -13.267 -4.197 458 HD21 LEU 609 HD21 LEU 609 -4.322 -10.985 -5.471 459 HD22 LEU 609 HD22 LEU 609 -5.287 -11.565 -6.826 460 HD23 LEU 609 HD23 LEU 609 -3.582 -11.187 -7.057 461 H LYS 610 HN LYS 610 0.321 -11.912 -4.944 462 HA LYS 610 HA LYS 610 0.870 -13.724 -2.833 463 HB2 LYS 610 HB2 LYS 610 3.311 -13.981 -3.258 464 HB3 LYS 610 HB1 LYS 610 2.289 -14.865 -4.376 465 HG2 LYS 610 HG2 LYS 610 2.602 -13.016 -6.012 466 HG3 LYS 610 HG1 LYS 610 3.760 -12.297 -4.892 467 HD2 LYS 610 HD2 LYS 610 5.097 -13.500 -6.378 468 HD3 LYS 610 HD1 LYS 610 4.957 -14.567 -4.981 469 HE2 LYS 610 HE2 LYS 610 3.275 -14.763 -7.480 470 HE3 LYS 610 HE1 LYS 610 4.704 -15.735 -7.155 471 HZ1 LYS 610 HZ1 LYS 610 2.834 -17.025 -6.584 472 HZ2 LYS 610 HZ2 LYS 610 2.120 -15.775 -5.707 473 HZ3 LYS 610 HZ3 LYS 610 3.513 -16.534 -5.115 474 H ILE 611 HN ILE 611 1.766 -12.758 -1.097 475 HA ILE 611 HA ILE 611 2.065 -9.876 -1.141 476 HB ILE 611 HB ILE 611 2.265 -11.889 1.087 477 HG12 ILE 611 HG12 ILE 611 0.017 -11.178 -0.103 478 HG13 ILE 611 HG11 ILE 611 0.091 -11.412 1.630 479 HG21 ILE 611 HG21 ILE 611 2.317 -8.901 1.323 480 HG22 ILE 611 HG22 ILE 611 3.698 -9.972 1.554 481 HG23 ILE 611 HG23 ILE 611 2.320 -10.055 2.654 482 HD11 ILE 611 HD11 ILE 611 -1.170 -9.426 1.063 483 HD12 ILE 611 HD12 ILE 611 0.217 -8.780 0.181 484 HD13 ILE 611 HD13 ILE 611 0.305 -8.990 1.931 485 H ASP 612 HN ASP 612 3.957 -8.790 -0.531 486 HA ASP 612 HA ASP 612 6.433 -10.382 -0.539 487 HB2 ASP 612 HB2 ASP 612 5.870 -8.944 -2.665 488 HB3 ASP 612 HB1 ASP 612 6.363 -7.596 -1.643 489 H SER 613 HN SER 613 8.244 -9.273 0.533 490 HA SER 613 HA SER 613 7.373 -7.273 2.489 491 HB2 SER 613 HB2 SER 613 8.870 -8.448 4.169 492 HB3 SER 613 HB1 SER 613 7.392 -9.308 3.736 493 HG SER 613 HG SER 613 8.525 -10.821 2.761 494 H SER 614 HN SER 614 8.461 -5.493 2.026 495 HA SER 614 HA SER 614 11.379 -5.686 1.743 496 HB2 SER 614 HB2 SER 614 9.718 -3.778 0.090 497 HB3 SER 614 HB1 SER 614 11.430 -4.128 -0.062 498 HG SER 614 HG SER 614 9.782 -6.328 -0.270 499 H THR 615 HN THR 615 12.295 -4.555 3.355 500 HA THR 615 HA THR 615 10.629 -2.782 4.933 501 HB THR 615 HB THR 615 13.450 -3.712 5.447 502 HG1 THR 615 HG1 THR 615 11.980 -5.445 5.499 503 HG21 THR 615 HG21 THR 615 12.969 -3.006 7.779 504 HG22 THR 615 HG22 THR 615 11.444 -2.311 7.228 505 HG23 THR 615 HG23 THR 615 12.975 -1.657 6.644 506 H VAL 616 HN VAL 616 10.515 -0.671 4.449 507 HA VAL 616 HA VAL 616 12.374 0.767 2.978 508 HB VAL 616 HB VAL 616 10.313 1.810 3.174 509 HG11 VAL 616 HG11 VAL 616 9.226 2.404 5.288 510 HG12 VAL 616 HG12 VAL 616 10.520 1.592 6.160 511 HG13 VAL 616 HG13 VAL 616 9.453 0.665 5.114 512 HG21 VAL 616 HG21 VAL 616 11.933 3.516 3.230 513 HG22 VAL 616 HG22 VAL 616 12.312 3.206 4.923 514 HG23 VAL 616 HG23 VAL 616 10.767 3.947 4.486 515 H GLU 617 HN GLU 617 14.407 0.961 3.404 516 HA GLU 617 HA GLU 617 15.417 1.150 6.104 517 HB2 GLU 617 HB2 GLU 617 16.774 1.107 3.420 518 HB3 GLU 617 HB1 GLU 617 17.613 1.093 4.966 519 HG2 GLU 617 HG2 GLU 617 15.588 -0.989 4.266 520 HG3 GLU 617 HG1 GLU 617 17.266 -1.122 3.757 521 H ARG 618 HN ARG 618 14.533 3.227 3.524 522 HA ARG 618 HA ARG 618 15.345 5.544 5.001 523 HB2 ARG 618 HB2 ARG 618 17.476 4.848 3.929 524 HB3 ARG 618 HB1 ARG 618 16.706 4.993 2.355 525 HG2 ARG 618 HG2 ARG 618 16.340 7.387 2.781 526 HG3 ARG 618 HG1 ARG 618 17.179 7.219 4.324 527 HD2 ARG 618 HD2 ARG 618 19.163 6.381 3.046 528 HD3 ARG 618 HD1 ARG 618 18.313 6.815 1.564 529 HE ARG 618 HE ARG 618 18.612 8.930 3.531 530 HH11 ARG 618 HH11 ARG 618 19.818 7.431 0.611 531 HH12 ARG 618 HH12 ARG 618 20.744 8.812 0.128 532 HH21 ARG 618 HH21 ARG 618 19.847 10.751 2.910 533 HH22 ARG 618 HH22 ARG 618 20.768 10.701 1.443 534 H ILE 619 HN ILE 619 14.419 7.429 4.213 535 HA ILE 619 HA ILE 619 12.666 7.158 1.870 536 HB ILE 619 HB ILE 619 12.016 8.379 4.554 537 HG12 ILE 619 HG12 ILE 619 10.525 6.332 2.916 538 HG13 ILE 619 HG11 ILE 619 11.706 5.909 4.154 539 HG21 ILE 619 HG21 ILE 619 11.267 9.938 2.848 540 HG22 ILE 619 HG22 ILE 619 9.878 9.110 3.550 541 HG23 ILE 619 HG23 ILE 619 10.479 8.633 1.962 542 HD11 ILE 619 HD11 ILE 619 9.171 7.476 4.603 543 HD12 ILE 619 HD12 ILE 619 10.333 6.991 5.841 544 HD13 ILE 619 HD13 ILE 619 9.409 5.767 4.970 545 H GLU 620 HN GLU 620 13.039 8.673 0.385 546 HA GLU 620 HA GLU 620 14.516 11.075 1.248 547 HB2 GLU 620 HB2 GLU 620 14.699 9.796 -1.477 548 HB3 GLU 620 HB1 GLU 620 15.684 11.102 -0.841 549 HG2 GLU 620 HG2 GLU 620 16.520 9.464 0.883 550 HG3 GLU 620 HG1 GLU 620 15.714 8.208 -0.060 551 H ASP 621 HN ASP 621 13.681 12.984 0.725 552 HA ASP 621 HA ASP 621 11.165 13.052 -0.697 553 HB2 ASP 621 HB2 ASP 621 11.063 15.398 -0.101 554 HB3 ASP 621 HB1 ASP 621 11.528 14.466 1.315 555 H SER 622 HN SER 622 10.918 13.499 -2.771 556 HA SER 622 HA SER 622 13.254 14.259 -4.316 557 HB2 SER 622 HB2 SER 622 10.646 12.917 -4.867 558 HB3 SER 622 HB1 SER 622 11.476 13.722 -6.189 559 HG SER 622 HG SER 622 13.135 12.163 -4.680 560 H HIS 623 HN HIS 623 13.278 16.068 -5.655 561 HA HIS 623 HA HIS 623 11.646 18.253 -4.708 562 HB2 HIS 623 HB2 HIS 623 14.156 18.299 -5.350 563 HB3 HIS 623 HB1 HIS 623 13.563 18.429 -7.001 564 HD1 HIS 623 HD1 HIS 623 13.804 20.325 -3.795 565 HD2 HIS 623 HD2 HIS 623 12.388 20.894 -7.659 566 HE1 HIS 623 HE1 HIS 623 13.342 22.786 -3.990 567 HE2 HIS 623 HE2 HIS 623 12.535 23.119 -6.350 568 H SER 624 HN SER 624 9.877 16.812 -5.565 569 HA SER 624 HA SER 624 8.876 17.993 -8.027 570 HB2 SER 624 HB2 SER 624 8.973 15.006 -7.521 571 HB3 SER 624 HB1 SER 624 8.148 15.780 -8.870 572 HG SER 624 HG SER 624 10.802 16.485 -8.556 573 HA PRO 625 HA PRO 625 5.232 18.652 -5.703 574 HB2 PRO 625 HB2 PRO 625 3.759 17.393 -7.938 575 HB3 PRO 625 HB1 PRO 625 3.494 18.956 -7.166 576 HG2 PRO 625 HG2 PRO 625 4.667 18.757 -9.570 577 HG3 PRO 625 HG1 PRO 625 5.143 19.994 -8.393 578 HD2 PRO 625 HD2 PRO 625 6.575 17.541 -9.236 579 HD3 PRO 625 HD1 PRO 625 7.214 19.066 -8.599 580 H GLY 626 HN GLY 626 5.095 17.419 -4.011 581 HA2 GLY 626 HA2 GLY 626 4.438 15.734 -2.620 582 HA3 GLY 626 HA1 GLY 626 3.235 15.366 -3.844 583 H VAL 627 HN VAL 627 6.744 15.148 -4.300 584 HA VAL 627 HA VAL 627 6.316 12.260 -4.696 585 HB VAL 627 HB VAL 627 8.523 13.944 -5.885 586 HG11 VAL 627 HG11 VAL 627 8.925 11.986 -7.302 587 HG12 VAL 627 HG12 VAL 627 7.669 11.100 -6.439 588 HG13 VAL 627 HG13 VAL 627 9.137 11.595 -5.596 589 HG21 VAL 627 HG21 VAL 627 7.270 13.628 -8.003 590 HG22 VAL 627 HG22 VAL 627 6.408 14.610 -6.815 591 HG23 VAL 627 HG23 VAL 627 5.948 12.925 -7.066 592 H ALA 628 HN ALA 628 7.325 10.837 -3.512 593 HA ALA 628 HA ALA 628 9.888 11.506 -2.275 594 HB1 ALA 628 HB1 ALA 628 8.244 11.868 -0.500 595 HB2 ALA 628 HB2 ALA 628 9.243 10.451 -0.155 596 HB3 ALA 628 HB3 ALA 628 7.596 10.248 -0.763 597 H VAL 629 HN VAL 629 11.302 9.874 -2.397 598 HA VAL 629 HA VAL 629 10.314 7.375 -3.553 599 HB VAL 629 HB VAL 629 11.928 8.027 -5.031 600 HG11 VAL 629 HG11 VAL 629 12.540 10.063 -3.889 601 HG12 VAL 629 HG12 VAL 629 13.991 9.212 -4.435 602 HG13 VAL 629 HG13 VAL 629 13.518 9.146 -2.738 603 HG21 VAL 629 HG21 VAL 629 12.568 5.817 -4.198 604 HG22 VAL 629 HG22 VAL 629 13.573 6.572 -2.956 605 HG23 VAL 629 HG23 VAL 629 13.990 6.755 -4.660 606 H ILE 630 HN ILE 630 10.201 5.665 -2.369 607 HA ILE 630 HA ILE 630 11.424 5.680 0.275 608 HB ILE 630 HB ILE 630 9.519 3.606 -0.760 609 HG12 ILE 630 HG12 ILE 630 8.514 5.854 -1.121 610 HG13 ILE 630 HG11 ILE 630 7.653 4.892 0.069 611 HG21 ILE 630 HG21 ILE 630 10.134 4.662 1.985 612 HG22 ILE 630 HG22 ILE 630 10.677 3.127 1.310 613 HG23 ILE 630 HG23 ILE 630 8.961 3.402 1.614 614 HD11 ILE 630 HD11 ILE 630 9.598 7.096 0.666 615 HD12 ILE 630 HD12 ILE 630 8.727 6.131 1.859 616 HD13 ILE 630 HD13 ILE 630 7.841 7.199 0.770 617 H GLN 631 HN GLN 631 13.215 4.523 0.648 618 HA GLN 631 HA GLN 631 14.103 2.623 -1.389 619 HB2 GLN 631 HB2 GLN 631 15.667 4.385 -0.631 620 HB3 GLN 631 HB1 GLN 631 15.579 3.740 1.002 621 HG2 GLN 631 HG2 GLN 631 16.592 1.675 0.286 622 HG3 GLN 631 HG1 GLN 631 16.589 2.222 -1.391 623 HE21 GLN 631 HE21 GLN 631 18.802 2.086 -1.624 624 HE22 GLN 631 HE22 GLN 631 19.895 3.173 -0.839 625 H PHE 632 HN PHE 632 13.481 0.612 -1.127 626 HA PHE 632 HA PHE 632 13.016 -0.435 1.592 627 HB2 PHE 632 HB2 PHE 632 11.969 -1.388 -1.078 628 HB3 PHE 632 HB1 PHE 632 11.649 -2.167 0.461 629 HD1 PHE 632 HD1 PHE 632 10.245 -1.032 2.141 630 HD2 PHE 632 HD2 PHE 632 10.747 0.493 -1.793 631 HE1 PHE 632 HE1 PHE 632 8.212 0.320 2.410 632 HE2 PHE 632 HE2 PHE 632 8.715 1.850 -1.533 633 HZ PHE 632 HZ PHE 632 7.443 1.763 0.573 634 H ALA 633 HN ALA 633 14.199 -2.078 2.335 635 HA ALA 633 HA ALA 633 16.044 -3.480 0.584 636 HB1 ALA 633 HB1 ALA 633 16.714 -4.647 2.653 637 HB2 ALA 633 HB2 ALA 633 15.458 -3.771 3.530 638 HB3 ALA 633 HB3 ALA 633 16.808 -2.893 2.810 639 H VAL 634 HN VAL 634 14.966 -4.814 -0.750 640 HA VAL 634 HA VAL 634 12.504 -6.064 0.032 641 HB VAL 634 HB VAL 634 14.135 -6.418 -2.474 642 HG11 VAL 634 HG11 VAL 634 12.051 -7.267 -3.460 643 HG12 VAL 634 HG12 VAL 634 11.264 -7.140 -1.886 644 HG13 VAL 634 HG13 VAL 634 12.595 -8.273 -2.117 645 HG21 VAL 634 HG21 VAL 634 13.452 -4.106 -2.176 646 HG22 VAL 634 HG22 VAL 634 11.787 -4.617 -1.893 647 HG23 VAL 634 HG23 VAL 634 12.524 -4.848 -3.479 648 H GLY 635 HN GLY 635 12.217 -7.989 0.870 649 HA2 GLY 635 HA2 GLY 635 12.444 -10.264 1.134 650 HA3 GLY 635 HA1 GLY 635 13.824 -10.221 0.051 651 H GLU 636 HN GLU 636 14.195 -11.871 1.905 652 HA GLU 636 HA GLU 636 15.189 -10.873 4.371 653 HB2 GLU 636 HB2 GLU 636 15.541 -13.525 2.990 654 HB3 GLU 636 HB1 GLU 636 16.005 -13.195 4.652 655 HG2 GLU 636 HG2 GLU 636 13.836 -13.098 5.388 656 HG3 GLU 636 HG1 GLU 636 13.206 -12.651 3.805 657 H HIS 637 HN HIS 637 16.479 -11.258 1.206 658 HA HIS 637 HA HIS 637 19.241 -11.132 2.048 659 HB2 HIS 637 HB2 HIS 637 17.994 -10.880 -0.695 660 HB3 HIS 637 HB1 HIS 637 19.724 -10.881 -0.388 661 HD1 HIS 637 HD1 HIS 637 17.672 -13.054 -1.890 662 HD2 HIS 637 HD2 HIS 637 19.914 -13.470 1.585 663 HE1 HIS 637 HE1 HIS 637 18.013 -15.526 -1.597 664 HE2 HIS 637 HE2 HIS 637 19.207 -15.758 0.612 665 H ARG 638 HN ARG 638 16.726 -8.983 1.664 666 HA ARG 638 HA ARG 638 16.500 -6.765 1.929 667 HB2 ARG 638 HB2 ARG 638 19.221 -7.148 3.147 668 HB3 ARG 638 HB1 ARG 638 18.401 -5.596 3.149 669 HG2 ARG 638 HG2 ARG 638 16.538 -6.596 4.374 670 HG3 ARG 638 HG1 ARG 638 17.380 -8.148 4.371 671 HD2 ARG 638 HD2 ARG 638 18.366 -5.594 5.632 672 HD3 ARG 638 HD1 ARG 638 17.693 -6.979 6.481 673 HE ARG 638 HE ARG 638 19.767 -8.019 5.065 674 HH11 ARG 638 HH11 ARG 638 19.437 -5.443 7.406 675 HH12 ARG 638 HH12 ARG 638 21.053 -5.614 8.012 676 HH21 ARG 638 HH21 ARG 638 21.895 -8.245 5.852 677 HH22 ARG 638 HH22 ARG 638 22.453 -7.214 7.129 678 H ALA 639 HN ALA 639 17.090 -7.367 -0.653 679 HA ALA 639 HA ALA 639 19.188 -5.673 -1.658 680 HB1 ALA 639 HB1 ALA 639 18.269 -6.175 -3.860 681 HB2 ALA 639 HB2 ALA 639 16.859 -6.926 -3.113 682 HB3 ALA 639 HB3 ALA 639 18.454 -7.648 -2.908 683 H GLN 640 HN GLN 640 19.062 -3.519 -1.908 684 HA GLN 640 HA GLN 640 16.600 -2.289 -1.045 685 HB2 GLN 640 HB2 GLN 640 19.306 -1.097 -1.614 686 HB3 GLN 640 HB1 GLN 640 17.921 -0.178 -1.039 687 HG2 GLN 640 HG2 GLN 640 17.838 -1.762 0.917 688 HG3 GLN 640 HG1 GLN 640 19.403 -2.365 0.381 689 HE21 GLN 640 HE21 GLN 640 17.690 0.233 1.846 690 HE22 GLN 640 HE22 GLN 640 19.074 1.150 2.326 691 H VAL 641 HN VAL 641 15.259 -1.095 -2.109 692 HA VAL 641 HA VAL 641 15.721 -0.528 -4.962 693 HB VAL 641 HB VAL 641 13.219 -1.592 -3.638 694 HG11 VAL 641 HG11 VAL 641 12.634 0.165 -5.242 695 HG12 VAL 641 HG12 VAL 641 12.116 -1.427 -5.793 696 HG13 VAL 641 HG13 VAL 641 13.552 -0.675 -6.492 697 HG21 VAL 641 HG21 VAL 641 13.448 -3.437 -5.188 698 HG22 VAL 641 HG22 VAL 641 14.904 -3.270 -4.204 699 HG23 VAL 641 HG23 VAL 641 14.897 -2.704 -5.876 700 H SER 642 HN SER 642 15.483 1.552 -5.431 701 HA SER 642 HA SER 642 14.038 3.261 -3.533 702 HB2 SER 642 HB2 SER 642 15.992 3.980 -5.733 703 HB3 SER 642 HB1 SER 642 15.221 5.130 -4.641 704 HG SER 642 HG SER 642 16.726 2.950 -3.660 705 H VAL 643 HN VAL 643 11.948 3.472 -4.064 706 HA VAL 643 HA VAL 643 11.265 3.683 -6.910 707 HB VAL 643 HB VAL 643 10.313 1.691 -5.950 708 HG11 VAL 643 HG11 VAL 643 8.736 1.767 -4.064 709 HG12 VAL 643 HG12 VAL 643 9.098 3.479 -3.848 710 HG13 VAL 643 HG13 VAL 643 10.360 2.272 -3.600 711 HG21 VAL 643 HG21 VAL 643 8.254 3.849 -6.289 712 HG22 VAL 643 HG22 VAL 643 7.914 2.120 -6.302 713 HG23 VAL 643 HG23 VAL 643 8.936 2.829 -7.552 714 H GLU 644 HN GLU 644 10.512 5.556 -7.586 715 HA GLU 644 HA GLU 644 9.950 7.675 -5.673 716 HB2 GLU 644 HB2 GLU 644 10.156 7.667 -8.694 717 HB3 GLU 644 HB1 GLU 644 9.882 9.103 -7.717 718 HG2 GLU 644 HG2 GLU 644 12.021 8.962 -6.733 719 HG3 GLU 644 HG1 GLU 644 12.284 7.336 -7.365 720 H VAL 645 HN VAL 645 7.922 7.839 -4.911 721 HA VAL 645 HA VAL 645 5.706 7.533 -6.829 722 HB VAL 645 HB VAL 645 4.295 6.598 -5.038 723 HG11 VAL 645 HG11 VAL 645 6.814 5.014 -5.514 724 HG12 VAL 645 HG12 VAL 645 5.415 5.082 -6.585 725 HG13 VAL 645 HG13 VAL 645 5.265 4.358 -4.984 726 HG21 VAL 645 HG21 VAL 645 6.844 6.464 -3.430 727 HG22 VAL 645 HG22 VAL 645 5.278 5.806 -2.956 728 HG23 VAL 645 HG23 VAL 645 5.488 7.548 -3.121 729 H LEU 646 HN LEU 646 3.700 8.661 -6.103 730 HA LEU 646 HA LEU 646 4.318 11.231 -4.963 731 HB2 LEU 646 HB2 LEU 646 1.674 10.021 -5.768 732 HB3 LEU 646 HB1 LEU 646 1.873 11.657 -5.177 733 HG LEU 646 HG LEU 646 2.630 10.490 -7.808 734 HD11 LEU 646 HD11 LEU 646 0.533 11.758 -7.492 735 HD12 LEU 646 HD12 LEU 646 1.631 12.519 -8.644 736 HD13 LEU 646 HD13 LEU 646 1.492 13.161 -7.007 737 HD21 LEU 646 HD21 LEU 646 3.959 12.867 -6.542 738 HD22 LEU 646 HD22 LEU 646 4.062 12.438 -8.248 739 HD23 LEU 646 HD23 LEU 646 4.729 11.356 -7.027 740 H VAL 647 HN VAL 647 3.575 12.032 -3.017 741 HA VAL 647 HA VAL 647 3.680 10.155 -0.898 742 HB VAL 647 HB VAL 647 3.441 12.059 0.600 743 HG11 VAL 647 HG11 VAL 647 5.385 13.354 -0.139 744 HG12 VAL 647 HG12 VAL 647 5.240 12.644 -1.747 745 HG13 VAL 647 HG13 VAL 647 5.628 11.621 -0.363 746 HG21 VAL 647 HG21 VAL 647 2.743 13.574 -1.907 747 HG22 VAL 647 HG22 VAL 647 3.228 14.353 -0.401 748 HG23 VAL 647 HG23 VAL 647 1.764 13.371 -0.451 749 H GLU 648 HN GLU 648 1.095 11.331 -2.741 750 HA GLU 648 HA GLU 648 -0.954 11.073 -0.756 751 HB2 GLU 648 HB2 GLU 648 -2.510 11.279 -2.647 752 HB3 GLU 648 HB1 GLU 648 -1.276 12.529 -2.689 753 HG2 GLU 648 HG2 GLU 648 -0.042 11.203 -4.366 754 HG3 GLU 648 HG1 GLU 648 -1.359 10.033 -4.368 755 H TYR 649 HN TYR 649 0.864 8.885 -2.594 756 HA TYR 649 HA TYR 649 -1.087 6.858 -2.985 757 HB2 TYR 649 HB2 TYR 649 1.879 7.056 -3.223 758 HB3 TYR 649 HB1 TYR 649 1.151 5.460 -3.165 759 HD1 TYR 649 HD1 TYR 649 0.591 8.715 -4.908 760 HD2 TYR 649 HD2 TYR 649 0.668 4.474 -5.190 761 HE1 TYR 649 HE1 TYR 649 0.091 8.875 -7.311 762 HE2 TYR 649 HE2 TYR 649 0.168 4.618 -7.592 763 HH TYR 649 HH TYR 649 0.462 7.404 -9.375 764 HA PRO 650 HA PRO 650 -0.953 5.290 1.191 765 HB2 PRO 650 HB2 PRO 650 -2.848 3.418 0.875 766 HB3 PRO 650 HB1 PRO 650 -3.251 5.133 0.973 767 HG2 PRO 650 HG2 PRO 650 -3.006 3.377 -1.439 768 HG3 PRO 650 HG1 PRO 650 -4.241 4.592 -1.060 769 HD2 PRO 650 HD2 PRO 650 -2.125 5.065 -2.720 770 HD3 PRO 650 HD1 PRO 650 -2.928 6.325 -1.763 771 H PHE 651 HN PHE 651 -0.049 3.514 2.171 772 HA PHE 651 HA PHE 651 0.994 1.401 0.420 773 HB2 PHE 651 HB2 PHE 651 2.501 3.196 2.278 774 HB3 PHE 651 HB1 PHE 651 3.044 1.534 2.081 775 HD1 PHE 651 HD1 PHE 651 2.164 4.558 0.085 776 HD2 PHE 651 HD2 PHE 651 4.484 1.003 0.370 777 HE1 PHE 651 HE1 PHE 651 3.377 5.189 -1.959 778 HE2 PHE 651 HE2 PHE 651 5.702 1.628 -1.673 779 HZ PHE 651 HZ PHE 651 5.149 3.722 -2.841 780 H PHE 652 HN PHE 652 -0.086 -0.332 1.092 781 HA PHE 652 HA PHE 652 -0.781 -0.833 3.805 782 HB2 PHE 652 HB2 PHE 652 -1.319 -2.029 1.292 783 HB3 PHE 652 HB1 PHE 652 -0.560 -3.266 2.286 784 HD1 PHE 652 HD1 PHE 652 -1.494 -3.552 4.668 785 HD2 PHE 652 HD2 PHE 652 -3.583 -1.617 1.510 786 HE1 PHE 652 HE1 PHE 652 -3.612 -3.922 5.851 787 HE2 PHE 652 HE2 PHE 652 -5.711 -1.982 2.690 788 HZ PHE 652 HZ PHE 652 -5.726 -3.133 4.867 789 H VAL 653 HN VAL 653 0.521 -1.573 5.399 790 HA VAL 653 HA VAL 653 3.189 -2.422 4.533 791 HB VAL 653 HB VAL 653 2.647 -1.564 7.344 792 HG11 VAL 653 HG11 VAL 653 4.821 -2.527 6.221 793 HG12 VAL 653 HG12 VAL 653 4.911 -1.258 7.436 794 HG13 VAL 653 HG13 VAL 653 5.033 -0.850 5.726 795 HG21 VAL 653 HG21 VAL 653 3.359 0.762 6.596 796 HG22 VAL 653 HG22 VAL 653 1.693 0.289 6.239 797 HG23 VAL 653 HG23 VAL 653 2.912 0.254 4.964 798 H PHE 654 HN PHE 654 4.175 -4.211 5.386 799 HA PHE 654 HA PHE 654 2.382 -6.412 5.660 800 HB2 PHE 654 HB2 PHE 654 4.477 -6.386 4.314 801 HB3 PHE 654 HB1 PHE 654 5.407 -6.342 5.799 802 HD1 PHE 654 HD1 PHE 654 2.471 -8.377 4.690 803 HD2 PHE 654 HD2 PHE 654 6.482 -8.331 6.110 804 HE1 PHE 654 HE1 PHE 654 2.469 -10.836 4.766 805 HE2 PHE 654 HE2 PHE 654 6.487 -10.789 6.187 806 HZ PHE 654 HZ PHE 654 4.480 -12.044 5.515 807 H GLY 655 HN GLY 655 1.462 -5.799 7.822 808 HA2 GLY 655 HA2 GLY 655 1.330 -6.839 9.973 809 HA3 GLY 655 HA1 GLY 655 3.069 -7.061 9.936 810 H GLN 656 HN GLN 656 2.699 -4.067 8.836 811 HA GLN 656 HA GLN 656 3.309 -2.955 11.473 812 HB2 GLN 656 HB2 GLN 656 3.813 -1.878 8.702 813 HB3 GLN 656 HB1 GLN 656 4.238 -1.022 10.165 814 HG2 GLN 656 HG2 GLN 656 6.167 -2.083 9.162 815 HG3 GLN 656 HG1 GLN 656 5.821 -2.759 10.738 816 HE21 GLN 656 HE21 GLN 656 5.587 -3.285 7.327 817 HE22 GLN 656 HE22 GLN 656 5.499 -5.017 7.349 818 H GLY 657 HN GLY 657 1.124 -2.550 8.718 819 HA2 GLY 657 HA2 GLY 657 -1.156 -2.016 9.840 820 HA3 GLY 657 HA1 GLY 657 -0.345 -0.515 10.238 821 H TRP 658 HN TRP 658 -2.274 0.278 9.086 822 HA TRP 658 HA TRP 658 -2.087 0.171 6.162 823 HB2 TRP 658 HB2 TRP 658 -4.247 -0.325 7.389 824 HB3 TRP 658 HB1 TRP 658 -4.264 1.348 7.909 825 HD1 TRP 658 HD1 TRP 658 -6.704 1.281 6.701 826 HE1 TRP 658 HE1 TRP 658 -7.366 1.806 4.282 827 HE3 TRP 658 HE3 TRP 658 -2.115 0.807 4.443 828 HZ2 TRP 658 HZ2 TRP 658 -6.142 2.010 1.773 829 HZ3 TRP 658 HZ3 TRP 658 -1.977 1.183 2.019 830 HH2 TRP 658 HH2 TRP 658 -3.945 1.773 0.718 831 H SER 659 HN SER 659 -0.640 1.692 5.472 832 HA SER 659 HA SER 659 -0.669 4.319 6.805 833 HB2 SER 659 HB2 SER 659 1.779 2.742 5.964 834 HB3 SER 659 HB1 SER 659 1.784 4.318 6.755 835 HG SER 659 HG SER 659 0.347 2.354 8.059 836 H SER 660 HN SER 660 0.464 6.027 5.522 837 HA SER 660 HA SER 660 0.952 5.378 2.725 838 HB2 SER 660 HB2 SER 660 -0.248 7.313 1.884 839 HB3 SER 660 HB1 SER 660 -1.361 6.314 2.819 840 HG SER 660 HG SER 660 -1.420 8.635 3.231 841 H CYS 661 HN CYS 661 2.193 7.181 1.654 842 HA CYS 661 HA CYS 661 4.412 7.861 3.257 843 HB2 CYS 661 HB2 CYS 661 3.579 8.979 0.577 844 HB3 CYS 661 HB1 CYS 661 5.175 9.144 1.300 845 HG CYS 661 HG CYS 661 4.048 6.771 -0.622 846 H CYS 662 HN CYS 662 1.409 9.415 2.666 847 HA CYS 662 HA CYS 662 2.040 11.492 4.532 848 HB2 CYS 662 HB2 CYS 662 1.617 12.125 1.621 849 HB3 CYS 662 HB1 CYS 662 1.194 13.294 2.863 850 HG CYS 662 HG CYS 662 4.284 12.065 3.188 851 HA PRO 663 HA PRO 663 -2.152 9.689 4.943 852 HB2 PRO 663 HB2 PRO 663 -1.712 11.065 7.546 853 HB3 PRO 663 HB1 PRO 663 -2.367 9.457 7.215 854 HG2 PRO 663 HG2 PRO 663 0.114 9.739 8.114 855 HG3 PRO 663 HG1 PRO 663 -0.268 8.531 6.872 856 HD2 PRO 663 HD2 PRO 663 1.076 11.181 6.591 857 HD3 PRO 663 HD1 PRO 663 1.391 9.657 5.736 858 H GLU 664 HN GLU 664 -0.999 12.922 5.766 859 HA GLU 664 HA GLU 664 -3.433 14.232 6.061 860 HB2 GLU 664 HB2 GLU 664 -1.162 15.522 4.579 861 HB3 GLU 664 HB1 GLU 664 -2.297 16.252 5.705 862 HG2 GLU 664 HG2 GLU 664 -0.477 16.175 7.034 863 HG3 GLU 664 HG1 GLU 664 -1.131 14.575 7.377 864 H ARG 665 HN ARG 665 -1.477 13.852 3.139 865 HA ARG 665 HA ARG 665 -3.349 15.132 1.438 866 HB2 ARG 665 HB2 ARG 665 -0.857 14.807 1.034 867 HB3 ARG 665 HB1 ARG 665 -1.243 13.161 0.559 868 HG2 ARG 665 HG2 ARG 665 -2.527 13.901 -1.285 869 HG3 ARG 665 HG1 ARG 665 -2.456 15.576 -0.738 870 HD2 ARG 665 HD2 ARG 665 -0.094 13.919 -1.614 871 HD3 ARG 665 HD1 ARG 665 -0.912 15.131 -2.597 872 HE ARG 665 HE ARG 665 0.161 16.021 -0.041 873 HH11 ARG 665 HH11 ARG 665 0.588 15.796 -3.509 874 HH12 ARG 665 HH12 ARG 665 1.750 17.084 -3.573 875 HH21 ARG 665 HH21 ARG 665 1.699 17.692 -0.114 876 HH22 ARG 665 HH22 ARG 665 2.379 18.168 -1.637 877 H THR 666 HN THR 666 -2.758 11.694 2.192 878 HA THR 666 HA THR 666 -4.532 10.639 0.288 879 HB THR 666 HB THR 666 -4.066 9.383 2.996 880 HG1 THR 666 HG1 THR 666 -2.369 9.073 0.729 881 HG21 THR 666 HG21 THR 666 -4.422 8.171 0.238 882 HG22 THR 666 HG22 THR 666 -5.679 8.272 1.469 883 HG23 THR 666 HG23 THR 666 -4.248 7.282 1.752 884 H SER 667 HN SER 667 -5.106 11.552 3.710 885 HA SER 667 HA SER 667 -7.876 10.970 3.612 886 HB2 SER 667 HB2 SER 667 -7.928 12.311 5.732 887 HB3 SER 667 HB1 SER 667 -6.786 10.977 5.740 888 HG SER 667 HG SER 667 -5.131 12.365 5.636 889 H GLN 668 HN GLN 668 -5.981 13.902 3.095 890 HA GLN 668 HA GLN 668 -7.967 15.798 2.907 891 HB2 GLN 668 HB2 GLN 668 -5.249 15.427 1.830 892 HB3 GLN 668 HB1 GLN 668 -6.230 16.627 1.012 893 HG2 GLN 668 HG2 GLN 668 -6.615 17.735 3.124 894 HG3 GLN 668 HG1 GLN 668 -5.614 16.549 3.947 895 HE21 GLN 668 HE21 GLN 668 -4.153 18.082 4.658 896 HE22 GLN 668 HE22 GLN 668 -3.040 18.870 3.590 897 H LEU 669 HN LEU 669 -6.706 13.715 0.320 898 HA LEU 669 HA LEU 669 -8.476 15.076 -1.556 899 HB2 LEU 669 HB2 LEU 669 -6.432 12.987 -2.232 900 HB3 LEU 669 HB1 LEU 669 -7.089 14.238 -3.263 901 HG LEU 669 HG LEU 669 -5.189 14.636 -0.956 902 HD11 LEU 669 HD11 LEU 669 -4.793 14.978 -3.920 903 HD12 LEU 669 HD12 LEU 669 -4.142 13.675 -2.922 904 HD13 LEU 669 HD13 LEU 669 -3.607 15.334 -2.661 905 HD21 LEU 669 HD21 LEU 669 -5.099 16.999 -1.752 906 HD22 LEU 669 HD22 LEU 669 -6.627 16.538 -1.004 907 HD23 LEU 669 HD23 LEU 669 -6.503 16.658 -2.764 908 H PHE 670 HN PHE 670 -7.914 11.901 -0.192 909 HA PHE 670 HA PHE 670 -10.051 10.800 -1.886 910 HB2 PHE 670 HB2 PHE 670 -8.087 9.194 -0.254 911 HB3 PHE 670 HB1 PHE 670 -9.049 8.661 -1.618 912 HD1 PHE 670 HD1 PHE 670 -8.604 10.348 -3.768 913 HD2 PHE 670 HD2 PHE 670 -5.852 9.319 -0.697 914 HE1 PHE 670 HE1 PHE 670 -6.733 10.862 -5.280 915 HE2 PHE 670 HE2 PHE 670 -3.973 9.831 -2.199 916 HZ PHE 670 HZ PHE 670 -4.414 10.605 -4.495 917 H ASP 671 HN ASP 671 -9.581 12.067 1.079 918 HA ASP 671 HA ASP 671 -10.678 12.085 3.051 919 HB2 ASP 671 HB2 ASP 671 -12.681 10.755 1.293 920 HB3 ASP 671 HB1 ASP 671 -12.952 10.731 3.031 921 H LEU 672 HN LEU 672 -9.135 9.542 1.925 922 HA LEU 672 HA LEU 672 -10.121 7.562 3.797 923 HB2 LEU 672 HB2 LEU 672 -9.624 6.846 1.528 924 HB3 LEU 672 HB1 LEU 672 -7.960 7.384 1.699 925 HG LEU 672 HG LEU 672 -7.860 5.753 3.692 926 HD11 LEU 672 HD11 LEU 672 -10.269 4.659 2.265 927 HD12 LEU 672 HD12 LEU 672 -10.250 5.385 3.871 928 HD13 LEU 672 HD13 LEU 672 -9.390 3.873 3.577 929 HD21 LEU 672 HD21 LEU 672 -6.668 5.400 1.580 930 HD22 LEU 672 HD22 LEU 672 -8.113 4.667 0.884 931 HD23 LEU 672 HD23 LEU 672 -7.286 3.882 2.230 932 HA PRO 673 HA PRO 673 -7.082 8.667 6.887 933 HB2 PRO 673 HB2 PRO 673 -7.830 5.996 7.922 934 HB3 PRO 673 HB1 PRO 673 -7.841 7.563 8.733 935 HG2 PRO 673 HG2 PRO 673 -10.125 6.414 7.998 936 HG3 PRO 673 HG1 PRO 673 -9.897 8.163 7.803 937 HD2 PRO 673 HD2 PRO 673 -9.688 5.994 5.740 938 HD3 PRO 673 HD1 PRO 673 -10.468 7.575 5.621 939 H CYS 674 HN CYS 674 -5.030 8.153 7.303 940 HA CYS 674 HA CYS 674 -3.989 5.515 6.660 941 HB2 CYS 674 HB2 CYS 674 -3.171 8.036 5.273 942 HB3 CYS 674 HB1 CYS 674 -2.039 6.709 5.439 943 HG CYS 674 HG CYS 674 -5.006 5.757 4.247 944 H SER 675 HN SER 675 -2.191 4.989 7.750 945 HA SER 675 HA SER 675 -1.344 6.701 9.932 946 HB2 SER 675 HB2 SER 675 -0.270 3.975 9.164 947 HB3 SER 675 HB1 SER 675 -0.139 4.774 10.730 948 HG SER 675 HG SER 675 -2.345 3.512 9.540 949 H LYS 676 HN LYS 676 0.962 7.235 10.223 950 HA LYS 676 HA LYS 676 2.009 8.181 7.728 951 HB2 LYS 676 HB2 LYS 676 2.104 9.572 9.752 952 HB3 LYS 676 HB1 LYS 676 3.176 8.402 10.505 953 HG2 LYS 676 HG2 LYS 676 4.312 10.418 9.567 954 HG3 LYS 676 HG1 LYS 676 4.920 8.877 8.957 955 HD2 LYS 676 HD2 LYS 676 3.623 9.137 6.922 956 HD3 LYS 676 HD1 LYS 676 2.914 10.629 7.539 957 HE2 LYS 676 HE2 LYS 676 5.863 10.228 7.093 958 HE3 LYS 676 HE1 LYS 676 4.781 10.945 5.902 959 HZ1 LYS 676 HZ1 LYS 676 5.273 12.001 8.632 960 HZ2 LYS 676 HZ2 LYS 676 4.260 12.694 7.470 961 HZ3 LYS 676 HZ3 LYS 676 5.927 12.626 7.205 962 H LEU 677 HN LEU 677 2.957 6.787 6.428 963 HA LEU 677 HA LEU 677 4.454 4.530 7.278 964 HB2 LEU 677 HB2 LEU 677 3.415 4.657 5.065 965 HB3 LEU 677 HB1 LEU 677 4.503 5.967 4.633 966 HG LEU 677 HG LEU 677 6.408 4.343 5.081 967 HD11 LEU 677 HD11 LEU 677 4.134 2.373 4.957 968 HD12 LEU 677 HD12 LEU 677 5.177 2.688 6.345 969 HD13 LEU 677 HD13 LEU 677 5.849 1.965 4.882 970 HD21 LEU 677 HD21 LEU 677 4.499 3.784 2.833 971 HD22 LEU 677 HD22 LEU 677 6.201 3.327 2.882 972 HD23 LEU 677 HD23 LEU 677 5.744 5.029 2.863 973 H SER 678 HN SER 678 6.564 4.299 7.684 974 HA SER 678 HA SER 678 8.402 6.490 7.160 975 HB2 SER 678 HB2 SER 678 7.893 5.461 9.964 976 HB3 SER 678 HB1 SER 678 9.107 6.648 9.503 977 HG SER 678 HG SER 678 6.313 6.974 9.124 978 H VAL 679 HN VAL 679 10.631 5.905 7.638 979 HA VAL 679 HA VAL 679 11.400 3.457 6.658 980 HB VAL 679 HB VAL 679 12.994 5.132 6.573 981 HG11 VAL 679 HG11 VAL 679 12.209 6.681 8.154 982 HG12 VAL 679 HG12 VAL 679 13.870 6.297 8.615 983 HG13 VAL 679 HG13 VAL 679 12.522 5.581 9.500 984 HG21 VAL 679 HG21 VAL 679 13.950 3.443 8.878 985 HG22 VAL 679 HG22 VAL 679 14.950 4.312 7.710 986 HG23 VAL 679 HG23 VAL 679 13.966 2.946 7.186 987 H GLY 680 HN GLY 680 11.763 1.489 7.463 988 HA2 GLY 680 HA2 GLY 680 12.089 -0.044 9.308 989 HA3 GLY 680 HA1 GLY 680 11.165 1.056 10.314 990 H ASP 681 HN ASP 681 9.343 1.316 7.784 991 HA ASP 681 HA ASP 681 7.604 -0.868 8.657 992 HB2 ASP 681 HB2 ASP 681 6.995 1.542 6.936 993 HB3 ASP 681 HB1 ASP 681 5.835 0.322 7.392 994 H VAL 682 HN VAL 682 8.085 -2.704 7.572 995 HA VAL 682 HA VAL 682 8.904 -2.687 4.869 996 HB VAL 682 HB VAL 682 9.804 -4.515 5.855 997 HG11 VAL 682 HG11 VAL 682 7.247 -4.952 7.331 998 HG12 VAL 682 HG12 VAL 682 8.759 -4.313 7.971 999 HG13 VAL 682 HG13 VAL 682 8.666 -5.994 7.439 1000 HG21 VAL 682 HG21 VAL 682 7.231 -5.616 4.768 1001 HG22 VAL 682 HG22 VAL 682 8.645 -6.587 5.176 1002 HG23 VAL 682 HG23 VAL 682 8.744 -5.383 3.893 1003 H CYS 683 HN CYS 683 7.673 -2.214 3.229 1004 HA CYS 683 HA CYS 683 4.827 -2.201 3.546 1005 HB2 CYS 683 HB2 CYS 683 6.640 -1.365 1.292 1006 HB3 CYS 683 HB1 CYS 683 4.887 -1.251 1.195 1007 HG CYS 683 HG CYS 683 6.505 0.220 3.799 1008 H ILE 684 HN ILE 684 3.312 -3.204 2.293 1009 HA ILE 684 HA ILE 684 3.994 -5.862 1.414 1010 HB ILE 684 HB ILE 684 1.385 -4.333 1.475 1011 HG12 ILE 684 HG12 ILE 684 2.263 -6.727 3.093 1012 HG13 ILE 684 HG11 ILE 684 2.351 -5.062 3.662 1013 HG21 ILE 684 HG21 ILE 684 1.893 -7.169 0.604 1014 HG22 ILE 684 HG22 ILE 684 1.257 -5.848 -0.374 1015 HG23 ILE 684 HG23 ILE 684 0.299 -6.502 0.954 1016 HD11 ILE 684 HD11 ILE 684 -0.159 -6.531 2.885 1017 HD12 ILE 684 HD12 ILE 684 -0.071 -4.862 3.449 1018 HD13 ILE 684 HD13 ILE 684 0.380 -6.183 4.529 1019 H SER 685 HN SER 685 4.935 -5.985 -0.602 1020 HA SER 685 HA SER 685 3.727 -4.433 -2.757 1021 HB2 SER 685 HB2 SER 685 6.222 -4.762 -2.705 1022 HB3 SER 685 HB1 SER 685 5.947 -6.479 -2.967 1023 HG SER 685 HG SER 685 6.238 -4.771 -4.829 1024 H LEU 686 HN LEU 686 2.003 -5.237 -3.771 1025 HA LEU 686 HA LEU 686 1.449 -8.073 -3.451 1026 HB2 LEU 686 HB2 LEU 686 -0.172 -5.905 -3.277 1027 HB3 LEU 686 HB1 LEU 686 -0.431 -6.360 -4.949 1028 HG LEU 686 HG LEU 686 -2.117 -7.333 -3.478 1029 HD11 LEU 686 HD11 LEU 686 -1.897 -9.674 -4.170 1030 HD12 LEU 686 HD12 LEU 686 -0.226 -9.365 -4.644 1031 HD13 LEU 686 HD13 LEU 686 -1.546 -8.552 -5.486 1032 HD21 LEU 686 HD21 LEU 686 -0.837 -7.502 -1.437 1033 HD22 LEU 686 HD22 LEU 686 0.219 -8.709 -2.165 1034 HD23 LEU 686 HD23 LEU 686 -1.476 -9.086 -1.873 1035 H THR 687 HN THR 687 2.058 -9.429 -4.968 1036 HA THR 687 HA THR 687 2.602 -8.402 -7.643 1037 HB THR 687 HB THR 687 3.276 -11.063 -6.375 1038 HG1 THR 687 HG1 THR 687 4.565 -8.593 -6.498 1039 HG21 THR 687 HG21 THR 687 3.058 -11.243 -8.787 1040 HG22 THR 687 HG22 THR 687 4.752 -11.369 -8.309 1041 HG23 THR 687 HG23 THR 687 4.140 -9.868 -9.004 1042 H LEU 688 HN LEU 688 1.092 -8.615 -9.119 1043 HA LEU 688 HA LEU 688 -0.938 -10.710 -8.778 1044 HB2 LEU 688 HB2 LEU 688 -1.106 -7.856 -9.567 1045 HB3 LEU 688 HB1 LEU 688 -2.174 -8.970 -10.401 1046 HG LEU 688 HG LEU 688 -2.240 -9.391 -7.530 1047 HD11 LEU 688 HD11 LEU 688 -1.780 -7.059 -7.292 1048 HD12 LEU 688 HD12 LEU 688 -3.516 -7.295 -7.042 1049 HD13 LEU 688 HD13 LEU 688 -2.917 -6.650 -8.575 1050 HD21 LEU 688 HD21 LEU 688 -4.321 -8.640 -9.575 1051 HD22 LEU 688 HD22 LEU 688 -4.645 -9.208 -7.936 1052 HD23 LEU 688 HD23 LEU 688 -3.865 -10.278 -9.103 1053 H LYS 689 HN LYS 689 -0.995 -12.220 -10.236 1054 HA LYS 689 HA LYS 689 0.686 -12.110 -12.546 1055 HB2 LYS 689 HB2 LYS 689 -1.095 -14.147 -11.303 1056 HB3 LYS 689 HB1 LYS 689 -0.432 -14.412 -12.897 1057 HG2 LYS 689 HG2 LYS 689 1.083 -13.970 -10.352 1058 HG3 LYS 689 HG1 LYS 689 0.949 -15.480 -11.251 1059 HD2 LYS 689 HD2 LYS 689 2.932 -14.837 -12.115 1060 HD3 LYS 689 HD1 LYS 689 1.937 -13.827 -13.160 1061 HE2 LYS 689 HE2 LYS 689 2.337 -11.909 -11.862 1062 HE3 LYS 689 HE1 LYS 689 2.921 -12.855 -10.500 1063 HZ1 LYS 689 HZ1 LYS 689 4.301 -12.552 -13.114 1064 HZ2 LYS 689 HZ2 LYS 689 4.876 -13.440 -11.794 1065 HZ3 LYS 689 HZ3 LYS 689 4.729 -11.761 -11.683
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