NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
5427 | 1hej | 4900 | cing | recoord | 1-original | 11 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 THR 557 H1 THR 557 2.771 17.032 -13.633 2 H2 THR 557 H2 THR 557 3.732 15.982 -14.563 3 H3 THR 557 H3 THR 557 2.716 15.357 -13.357 4 HA THR 557 HA THR 557 4.998 15.363 -12.595 5 HB THR 557 HB THR 557 5.073 18.326 -12.489 6 HG1 THR 557 HG1 THR 557 6.028 18.110 -14.724 7 1HG2 THR 557 1HG2 THR 557 6.915 16.004 -12.695 8 2HG2 THR 557 2HG2 THR 557 7.458 17.509 -13.434 9 3HG2 THR 557 3HG2 THR 557 7.052 17.466 -11.719 10 H GLY 558 H GLY 558 3.220 14.686 -11.042 11 1HA GLY 558 1HA GLY 558 1.736 16.317 -9.367 12 2HA GLY 558 2HA GLY 558 3.353 16.356 -8.662 13 H SER 559 H SER 559 4.284 13.843 -8.881 14 HA SER 559 HA SER 559 2.220 11.896 -8.108 15 1HB SER 559 1HB SER 559 3.978 10.274 -8.157 16 2HB SER 559 2HB SER 559 4.280 11.353 -9.515 17 HG SER 559 HG SER 559 5.799 12.438 -8.239 18 H CYS 560 H CYS 560 2.730 10.541 -6.063 19 HA CYS 560 HA CYS 560 3.059 12.449 -3.841 20 1HB CYS 560 1HB CYS 560 1.507 11.138 -2.874 21 2HB CYS 560 2HB CYS 560 1.524 10.087 -4.280 22 H SER 561 H SER 561 4.482 11.855 -1.992 23 HA SER 561 HA SER 561 6.976 10.550 -2.998 24 1HB SER 561 1HB SER 561 7.986 11.793 -0.969 25 2HB SER 561 2HB SER 561 7.530 12.759 -2.369 26 HG SER 561 HG SER 561 5.929 13.615 -1.262 27 H VAL 562 H VAL 562 7.207 8.514 -2.231 28 HA VAL 562 HA VAL 562 6.840 7.971 0.619 29 HB VAL 562 HB VAL 562 4.541 7.741 -0.041 30 1HG1 VAL 562 1HG1 VAL 562 5.636 6.064 -2.317 31 2HG1 VAL 562 2HG1 VAL 562 3.923 6.189 -1.918 32 3HG1 VAL 562 3HG1 VAL 562 4.810 7.617 -2.449 33 1HG2 VAL 562 1HG2 VAL 562 5.439 5.954 1.423 34 2HG2 VAL 562 2HG2 VAL 562 4.150 5.349 0.382 35 3HG2 VAL 562 3HG2 VAL 562 5.834 4.995 -0.004 36 H SER 563 H SER 563 7.522 5.731 1.153 37 HA SER 563 HA SER 563 8.967 4.304 -1.008 38 1HB SER 563 1HB SER 563 10.809 4.150 1.008 39 2HB SER 563 2HB SER 563 10.904 5.293 -0.329 40 HG SER 563 HG SER 563 10.309 6.870 0.969 41 H ALA 564 H ALA 564 9.029 2.077 -0.636 42 HA ALA 564 HA ALA 564 7.546 1.160 1.779 43 1HB ALA 564 1HB ALA 564 6.634 0.444 -0.392 44 2HB ALA 564 2HB ALA 564 8.183 -0.289 -0.810 45 3HB ALA 564 3HB ALA 564 7.226 -0.946 0.518 46 H VAL 565 H VAL 565 8.731 0.304 3.405 47 HA VAL 565 HA VAL 565 11.357 -0.967 2.723 48 HB VAL 565 HB VAL 565 10.889 0.038 5.478 49 1HG1 VAL 565 1HG1 VAL 565 13.056 -0.819 3.837 50 2HG1 VAL 565 2HG1 VAL 565 13.351 0.862 4.281 51 3HG1 VAL 565 3HG1 VAL 565 13.097 -0.352 5.536 52 1HG2 VAL 565 1HG2 VAL 565 10.895 1.752 3.064 53 2HG2 VAL 565 2HG2 VAL 565 10.171 2.031 4.651 54 3HG2 VAL 565 3HG2 VAL 565 11.901 2.288 4.411 55 H ARG 566 H ARG 566 11.839 -2.908 4.027 56 HA ARG 566 HA ARG 566 9.605 -4.546 4.610 57 1HB ARG 566 1HB ARG 566 11.127 -6.098 5.412 58 2HB ARG 566 2HB ARG 566 12.255 -5.043 4.566 59 1HG ARG 566 1HG ARG 566 12.742 -3.847 6.647 60 2HG ARG 566 2HG ARG 566 11.549 -4.827 7.504 61 1HD ARG 566 1HD ARG 566 13.705 -6.250 6.002 62 2HD ARG 566 2HD ARG 566 14.141 -5.469 7.521 63 HE ARG 566 HE ARG 566 12.422 -6.891 8.627 64 1HH1 ARG 566 1HH1 ARG 566 10.795 -7.764 6.343 65 2HH1 ARG 566 2HH1 ARG 566 11.407 -9.348 6.001 66 1HH2 ARG 566 1HH2 ARG 566 14.343 -8.886 7.789 67 2HH2 ARG 566 2HH2 ARG 566 13.416 -9.982 6.821 68 H GLY 567 H GLY 567 8.406 -4.803 6.566 69 1HA GLY 567 1HA GLY 567 7.306 -3.194 8.144 70 2HA GLY 567 2HA GLY 567 8.928 -2.645 8.567 71 H GLU 568 H GLU 568 6.733 -3.908 10.232 72 HA GLU 568 HA GLU 568 8.480 -5.867 11.590 73 1HB GLU 568 1HB GLU 568 5.931 -4.434 12.330 74 2HB GLU 568 2HB GLU 568 6.514 -5.800 13.280 75 1HG GLU 568 1HG GLU 568 8.739 -4.091 12.800 76 2HG GLU 568 2HG GLU 568 7.406 -3.077 13.355 77 H GLU 569 H GLU 569 8.288 -7.987 11.064 78 HA GLU 569 HA GLU 569 5.648 -8.942 10.037 79 1HB GLU 569 1HB GLU 569 6.872 -10.719 8.912 80 2HB GLU 569 2HB GLU 569 7.613 -9.172 8.498 81 1HG GLU 569 1HG GLU 569 8.864 -10.049 10.884 82 2HG GLU 569 2HG GLU 569 8.813 -11.441 9.800 83 H TRP 570 H TRP 570 5.495 -11.481 10.517 84 HA TRP 570 HA TRP 570 6.352 -11.957 13.336 85 1HB TRP 570 1HB TRP 570 3.589 -12.374 12.161 86 2HB TRP 570 2HB TRP 570 4.098 -13.015 13.723 87 HD1 TRP 570 HD1 TRP 570 4.797 -11.197 15.615 88 HE1 TRP 570 HE1 TRP 570 3.958 -8.788 15.995 89 HE3 TRP 570 HE3 TRP 570 2.723 -10.254 11.044 90 HZ2 TRP 570 HZ2 TRP 570 2.588 -6.734 14.551 91 HZ3 TRP 570 HZ3 TRP 570 1.659 -8.065 10.573 92 HH2 TRP 570 HH2 TRP 570 1.589 -6.305 12.319 93 H ALA 571 H ALA 571 4.184 -14.065 11.569 94 HA ALA 571 HA ALA 571 6.455 -15.870 10.902 95 1HB ALA 571 1HB ALA 571 4.560 -17.656 11.739 96 2HB ALA 571 2HB ALA 571 4.308 -16.331 12.877 97 3HB ALA 571 3HB ALA 571 5.896 -17.089 12.743 98 H ASP 572 H ASP 572 2.917 -16.319 10.870 99 HA ASP 572 HA ASP 572 3.049 -17.228 8.092 100 1HB ASP 572 1HB ASP 572 0.858 -16.923 10.136 101 2HB ASP 572 2HB ASP 572 0.461 -17.224 8.443 102 H ARG 573 H ARG 573 2.618 -14.221 9.679 103 HA ARG 573 HA ARG 573 1.789 -13.015 7.077 104 1HB ARG 573 1HB ARG 573 0.803 -11.336 9.138 105 2HB ARG 573 2HB ARG 573 -0.138 -12.273 7.980 106 1HG ARG 573 1HG ARG 573 0.181 -14.265 9.563 107 2HG ARG 573 2HG ARG 573 0.752 -13.094 10.751 108 1HD ARG 573 1HD ARG 573 -1.518 -11.858 9.940 109 2HD ARG 573 2HD ARG 573 -1.988 -13.540 9.700 110 HE ARG 573 HE ARG 573 -0.848 -12.707 12.324 111 1HH1 ARG 573 1HH1 ARG 573 -1.693 -15.280 12.708 112 2HH1 ARG 573 2HH1 ARG 573 -3.398 -15.225 13.003 113 1HH2 ARG 573 1HH2 ARG 573 -3.791 -12.041 11.688 114 2HH2 ARG 573 2HH2 ARG 573 -4.587 -13.391 12.426 115 H PHE 574 H PHE 574 2.538 -10.792 6.809 116 HA PHE 574 HA PHE 574 4.673 -9.983 8.729 117 1HB PHE 574 1HB PHE 574 6.141 -9.393 6.845 118 2HB PHE 574 2HB PHE 574 5.730 -11.108 6.789 119 HD1 PHE 574 HD1 PHE 574 4.889 -7.772 5.369 120 HD2 PHE 574 HD2 PHE 574 4.506 -12.032 4.963 121 HE1 PHE 574 HE1 PHE 574 3.931 -7.470 3.101 122 HE2 PHE 574 HE2 PHE 574 3.548 -11.730 2.696 123 HZ PHE 574 HZ PHE 574 3.260 -9.449 1.766 124 H ASN 575 H ASN 575 5.046 -7.688 8.784 125 HA ASN 575 HA ASN 575 2.919 -6.086 7.416 126 1HB ASN 575 1HB ASN 575 2.935 -6.453 10.060 127 2HB ASN 575 2HB ASN 575 4.117 -5.146 9.989 128 2HD2 ASN 575 2HD2 ASN 575 0.952 -5.507 10.591 129 1HD2 ASN 575 1HD2 ASN 575 0.324 -4.103 9.874 130 H VAL 576 H VAL 576 3.746 -4.552 6.077 131 HA VAL 576 HA VAL 576 6.637 -3.888 6.343 132 HB VAL 576 HB VAL 576 5.001 -2.927 4.034 133 1HG1 VAL 576 1HG1 VAL 576 7.808 -3.720 4.657 134 2HG1 VAL 576 2HG1 VAL 576 7.244 -3.975 3.005 135 3HG1 VAL 576 3HG1 VAL 576 7.209 -2.359 3.709 136 1HG2 VAL 576 1HG2 VAL 576 5.830 -5.813 4.478 137 2HG2 VAL 576 2HG2 VAL 576 4.186 -5.212 4.267 138 3HG2 VAL 576 3HG2 VAL 576 5.325 -5.154 2.922 139 H THR 577 H THR 577 7.270 -1.606 6.120 140 HA THR 577 HA THR 577 5.132 0.238 7.117 141 HB THR 577 HB THR 577 8.118 0.268 7.664 142 HG1 THR 577 HG1 THR 577 6.692 -1.253 8.791 143 1HG2 THR 577 1HG2 THR 577 7.041 2.535 7.425 144 2HG2 THR 577 2HG2 THR 577 5.968 2.100 8.756 145 3HG2 THR 577 3HG2 THR 577 7.708 2.216 9.027 146 H TYR 578 H TYR 578 4.695 1.952 5.809 147 HA TYR 578 HA TYR 578 6.681 2.579 3.658 148 1HB TYR 578 1HB TYR 578 3.701 3.120 3.589 149 2HB TYR 578 2HB TYR 578 4.840 3.232 2.248 150 HD1 TYR 578 HD1 TYR 578 3.104 0.898 4.548 151 HD2 TYR 578 HD2 TYR 578 5.581 1.275 1.057 152 HE1 TYR 578 HE1 TYR 578 2.726 -1.497 4.020 153 HE2 TYR 578 HE2 TYR 578 5.203 -1.119 0.531 154 HH TYR 578 HH TYR 578 4.587 -3.216 1.853 155 H SER 579 H SER 579 7.592 4.571 3.812 156 HA SER 579 HA SER 579 6.396 6.524 5.702 157 1HB SER 579 1HB SER 579 9.101 6.369 4.352 158 2HB SER 579 2HB SER 579 8.591 7.737 5.335 159 HG SER 579 HG SER 579 8.479 6.424 7.096 160 H VAL 580 H VAL 580 5.681 8.554 5.026 161 HA VAL 580 HA VAL 580 5.790 9.079 2.083 162 HB VAL 580 HB VAL 580 3.460 9.407 3.992 163 1HG1 VAL 580 1HG1 VAL 580 3.676 11.378 2.496 164 2HG1 VAL 580 2HG1 VAL 580 3.691 10.294 1.102 165 3HG1 VAL 580 3HG1 VAL 580 2.250 10.411 2.117 166 1HG2 VAL 580 1HG2 VAL 580 4.247 7.518 1.872 167 2HG2 VAL 580 2HG2 VAL 580 3.114 7.304 3.207 168 3HG2 VAL 580 3HG2 VAL 580 2.595 8.121 1.732 169 H SER 581 H SER 581 5.569 11.418 1.550 170 HA SER 581 HA SER 581 6.726 13.098 3.736 171 1HB SER 581 1HB SER 581 7.635 12.635 1.125 172 2HB SER 581 2HB SER 581 6.910 14.239 1.066 173 HG SER 581 HG SER 581 8.581 14.927 2.119 174 H GLY 582 H GLY 582 4.137 12.807 1.406 175 1HA GLY 582 1HA GLY 582 2.518 14.487 0.789 176 2HA GLY 582 2HA GLY 582 3.164 15.531 2.055 177 H SER 583 H SER 583 1.492 12.392 1.655 178 HA SER 583 HA SER 583 0.066 11.265 3.169 179 1HB SER 583 1HB SER 583 1.566 12.830 4.890 180 2HB SER 583 2HB SER 583 -0.080 13.364 5.212 181 HG SER 583 HG SER 583 -0.632 11.336 5.785 182 H SER 584 H SER 584 -0.521 14.760 3.717 183 HA SER 584 HA SER 584 -3.281 14.754 3.794 184 1HB SER 584 1HB SER 584 -1.889 16.828 2.117 185 2HB SER 584 2HB SER 584 -3.225 17.034 3.247 186 HG SER 584 HG SER 584 -1.420 17.755 4.284 187 H SER 585 H SER 585 -1.239 14.270 0.980 188 HA SER 585 HA SER 585 -3.702 14.049 -0.700 189 1HB SER 585 1HB SER 585 -2.151 15.686 -1.598 190 2HB SER 585 2HB SER 585 -0.810 14.550 -1.466 191 HG SER 585 HG SER 585 -1.808 14.737 -3.594 192 H TRP 586 H TRP 586 -3.719 11.876 0.597 193 HA TRP 586 HA TRP 586 -1.808 9.861 -0.283 194 1HB TRP 586 1HB TRP 586 -4.198 9.923 1.481 195 2HB TRP 586 2HB TRP 586 -3.805 8.374 0.737 196 HD1 TRP 586 HD1 TRP 586 -2.763 10.657 3.500 197 HE1 TRP 586 HE1 TRP 586 -0.669 9.711 4.658 198 HE3 TRP 586 HE3 TRP 586 -1.469 6.999 0.188 199 HZ2 TRP 586 HZ2 TRP 586 1.278 7.695 4.264 200 HZ3 TRP 586 HZ3 TRP 586 0.517 5.574 0.610 201 HH2 TRP 586 HH2 TRP 586 1.893 5.917 2.641 202 H VAL 587 H VAL 587 -1.887 8.768 -2.128 203 HA VAL 587 HA VAL 587 -4.411 7.923 -3.318 204 HB VAL 587 HB VAL 587 -4.058 10.317 -4.112 205 1HG1 VAL 587 1HG1 VAL 587 -1.557 10.065 -4.285 206 2HG1 VAL 587 2HG1 VAL 587 -1.814 9.039 -5.698 207 3HG1 VAL 587 3HG1 VAL 587 -2.311 10.731 -5.734 208 1HG2 VAL 587 1HG2 VAL 587 -4.896 7.998 -5.463 209 2HG2 VAL 587 2HG2 VAL 587 -5.268 9.666 -5.907 210 3HG2 VAL 587 3HG2 VAL 587 -3.873 8.855 -6.618 211 H VAL 588 H VAL 588 -1.936 6.758 -2.257 212 HA VAL 588 HA VAL 588 -0.361 5.822 -4.533 213 HB VAL 588 HB VAL 588 0.651 5.962 -2.278 214 1HG1 VAL 588 1HG1 VAL 588 -1.540 3.960 -1.670 215 2HG1 VAL 588 2HG1 VAL 588 -0.136 4.180 -0.624 216 3HG1 VAL 588 3HG1 VAL 588 -1.256 5.516 -0.889 217 1HG2 VAL 588 1HG2 VAL 588 0.719 3.725 -4.050 218 2HG2 VAL 588 2HG2 VAL 588 1.960 4.217 -2.894 219 3HG2 VAL 588 3HG2 VAL 588 0.706 3.077 -2.406 220 H THR 589 H THR 589 -0.418 3.729 -5.396 221 HA THR 589 HA THR 589 -2.903 2.213 -4.762 222 HB THR 589 HB THR 589 -1.279 2.338 -7.321 223 HG1 THR 589 HG1 THR 589 -2.670 4.022 -7.212 224 1HG2 THR 589 1HG2 THR 589 -2.819 0.185 -6.289 225 2HG2 THR 589 2HG2 THR 589 -3.756 0.919 -7.590 226 3HG2 THR 589 3HG2 THR 589 -2.119 0.338 -7.899 227 H LEU 590 H LEU 590 -2.445 0.486 -3.499 228 HA LEU 590 HA LEU 590 0.260 -0.608 -3.358 229 1HB LEU 590 1HB LEU 590 -2.351 -1.147 -1.980 230 2HB LEU 590 2HB LEU 590 -1.064 -2.350 -1.881 231 HG LEU 590 HG LEU 590 -1.073 -0.626 -0.013 232 1HD1 LEU 590 1HD1 LEU 590 1.120 -1.573 -1.671 233 2HD1 LEU 590 2HD1 LEU 590 1.518 -0.034 -0.907 234 3HD1 LEU 590 3HD1 LEU 590 1.038 -1.412 0.083 235 1HD2 LEU 590 1HD2 LEU 590 -1.562 1.200 -1.887 236 2HD2 LEU 590 2HD2 LEU 590 -0.631 1.610 -0.446 237 3HD2 LEU 590 3HD2 LEU 590 0.198 1.260 -1.962 238 H GLY 591 H GLY 591 1.020 -2.235 -4.612 239 1HA GLY 591 1HA GLY 591 0.692 -3.520 -6.690 240 2HA GLY 591 2HA GLY 591 -0.975 -3.806 -6.190 241 H LEU 592 H LEU 592 -1.355 -5.366 -4.490 242 HA LEU 592 HA LEU 592 0.731 -6.797 -3.164 243 1HB LEU 592 1HB LEU 592 -2.061 -7.790 -3.781 244 2HB LEU 592 2HB LEU 592 -1.024 -8.260 -2.444 245 HG LEU 592 HG LEU 592 -2.321 -5.567 -2.882 246 1HD1 LEU 592 1HD1 LEU 592 -2.753 -7.909 -1.101 247 2HD1 LEU 592 2HD1 LEU 592 -2.908 -6.321 -0.352 248 3HD1 LEU 592 3HD1 LEU 592 -3.918 -6.746 -1.734 249 1HD2 LEU 592 1HD2 LEU 592 0.085 -6.358 -1.364 250 2HD2 LEU 592 2HD2 LEU 592 -0.432 -4.759 -1.895 251 3HD2 LEU 592 3HD2 LEU 592 -1.104 -5.458 -0.422 252 H ASN 593 H ASN 593 0.244 -9.477 -3.573 253 HA ASN 593 HA ASN 593 1.106 -9.836 -6.414 254 1HB ASN 593 1HB ASN 593 1.597 -11.919 -4.315 255 2HB ASN 593 2HB ASN 593 2.560 -11.517 -5.737 256 2HD2 ASN 593 2HD2 ASN 593 3.139 -11.571 -2.651 257 1HD2 ASN 593 1HD2 ASN 593 3.921 -10.088 -2.388 258 H GLY 594 H GLY 594 -1.654 -9.700 -5.772 259 1HA GLY 594 1HA GLY 594 -2.771 -11.847 -7.115 260 2HA GLY 594 2HA GLY 594 -3.653 -10.949 -5.880 261 H GLY 595 H GLY 595 -3.016 -11.639 -3.549 262 1HA GLY 595 1HA GLY 595 -1.919 -14.251 -3.085 263 2HA GLY 595 2HA GLY 595 -3.681 -14.349 -3.142 264 H GLN 596 H GLN 596 -1.515 -11.814 -1.849 265 HA GLN 596 HA GLN 596 -2.242 -12.469 0.910 266 1HB GLN 596 1HB GLN 596 -0.905 -9.909 0.053 267 2HB GLN 596 2HB GLN 596 -0.685 -10.826 1.545 268 1HG GLN 596 1HG GLN 596 1.081 -11.846 0.599 269 2HG GLN 596 2HG GLN 596 -0.022 -12.590 -0.559 270 2HE2 GLN 596 2HE2 GLN 596 1.264 -9.237 -0.110 271 1HE2 GLN 596 1HE2 GLN 596 1.732 -9.049 -1.730 272 H SER 597 H SER 597 -3.070 -10.582 2.326 273 HA SER 597 HA SER 597 -4.877 -8.725 0.911 274 1HB SER 597 1HB SER 597 -6.020 -10.577 3.007 275 2HB SER 597 2HB SER 597 -6.891 -9.509 1.910 276 HG SER 597 HG SER 597 -6.281 -10.826 0.204 277 H VAL 598 H VAL 598 -5.475 -6.946 2.236 278 HA VAL 598 HA VAL 598 -3.659 -6.354 4.399 279 HB VAL 598 HB VAL 598 -6.219 -4.967 3.543 280 1HG1 VAL 598 1HG1 VAL 598 -4.464 -4.576 5.809 281 2HG1 VAL 598 2HG1 VAL 598 -4.401 -3.173 4.744 282 3HG1 VAL 598 3HG1 VAL 598 -5.946 -3.716 5.396 283 1HG2 VAL 598 1HG2 VAL 598 -3.403 -4.947 2.602 284 2HG2 VAL 598 2HG2 VAL 598 -4.885 -4.569 1.724 285 3HG2 VAL 598 3HG2 VAL 598 -4.158 -3.363 2.785 286 H GLN 599 H GLN 599 -3.837 -7.316 6.366 287 HA GLN 599 HA GLN 599 -6.472 -8.257 7.310 288 1HB GLN 599 1HB GLN 599 -4.322 -9.602 7.551 289 2HB GLN 599 2HB GLN 599 -3.821 -8.422 8.762 290 1HG GLN 599 1HG GLN 599 -6.536 -9.307 9.264 291 2HG GLN 599 2HG GLN 599 -5.435 -10.683 9.188 292 2HE2 GLN 599 2HE2 GLN 599 -6.584 -9.963 11.675 293 1HE2 GLN 599 1HE2 GLN 599 -5.374 -9.329 12.682 294 H SER 600 H SER 600 -4.183 -5.678 7.918 295 HA SER 600 HA SER 600 -6.148 -4.176 9.418 296 1HB SER 600 1HB SER 600 -4.376 -5.936 10.891 297 2HB SER 600 2HB SER 600 -4.086 -4.255 11.328 298 HG SER 600 HG SER 600 -6.135 -5.846 11.990 299 H SER 601 H SER 601 -5.110 -2.088 10.257 300 HA SER 601 HA SER 601 -2.480 -1.379 9.231 301 1HB SER 601 1HB SER 601 -3.052 -0.054 7.405 302 2HB SER 601 2HB SER 601 -4.226 -1.356 7.246 303 HG SER 601 HG SER 601 -4.558 1.289 8.078 304 H TRP 602 H TRP 602 -2.010 0.958 9.706 305 HA TRP 602 HA TRP 602 -3.924 2.358 11.443 306 1HB TRP 602 1HB TRP 602 -2.278 2.484 13.336 307 2HB TRP 602 2HB TRP 602 -2.914 0.861 13.068 308 HD1 TRP 602 HD1 TRP 602 0.216 2.987 12.396 309 HE1 TRP 602 HE1 TRP 602 2.215 1.414 12.054 310 HE3 TRP 602 HE3 TRP 602 -2.190 -1.516 12.476 311 HZ2 TRP 602 HZ2 TRP 602 2.738 -1.394 11.841 312 HZ3 TRP 602 HZ3 TRP 602 -0.916 -3.624 12.201 313 HH2 TRP 602 HH2 TRP 602 1.543 -3.569 11.884 314 H ASN 603 H ASN 603 -3.154 4.549 11.960 315 HA ASN 603 HA ASN 603 -1.916 6.512 11.535 316 1HB ASN 603 1HB ASN 603 -0.020 4.450 11.180 317 2HB ASN 603 2HB ASN 603 0.111 5.478 9.752 318 2HD2 ASN 603 2HD2 ASN 603 0.220 5.555 13.328 319 1HD2 ASN 603 1HD2 ASN 603 1.099 7.003 13.428 320 H ALA 604 H ALA 604 -3.883 5.027 9.654 321 HA ALA 604 HA ALA 604 -4.312 6.981 7.744 322 1HB ALA 604 1HB ALA 604 -2.064 5.168 7.004 323 2HB ALA 604 2HB ALA 604 -2.335 6.856 6.570 324 3HB ALA 604 3HB ALA 604 -3.215 5.578 5.732 325 H ALA 605 H ALA 605 -5.818 6.276 6.042 326 HA ALA 605 HA ALA 605 -7.155 3.725 6.799 327 1HB ALA 605 1HB ALA 605 -9.153 4.665 6.102 328 2HB ALA 605 2HB ALA 605 -8.290 6.124 6.586 329 3HB ALA 605 3HB ALA 605 -8.374 5.673 4.884 330 H LEU 606 H LEU 606 -7.841 2.262 5.095 331 HA LEU 606 HA LEU 606 -6.225 2.558 2.593 332 1HB LEU 606 1HB LEU 606 -6.448 0.370 4.508 333 2HB LEU 606 2HB LEU 606 -6.845 -0.150 2.869 334 HG LEU 606 HG LEU 606 -4.738 0.770 2.030 335 1HD1 LEU 606 1HD1 LEU 606 -4.773 2.575 3.930 336 2HD1 LEU 606 2HD1 LEU 606 -3.893 1.361 4.861 337 3HD1 LEU 606 3HD1 LEU 606 -3.216 1.976 3.352 338 1HD2 LEU 606 1HD2 LEU 606 -4.827 -1.553 3.047 339 2HD2 LEU 606 2HD2 LEU 606 -3.224 -0.815 3.057 340 3HD2 LEU 606 3HD2 LEU 606 -4.186 -0.854 4.535 341 H THR 607 H THR 607 -7.222 1.402 0.695 342 HA THR 607 HA THR 607 -10.202 1.293 0.898 343 HB THR 607 HB THR 607 -8.796 2.360 -1.548 344 HG1 THR 607 HG1 THR 607 -9.073 4.415 -0.694 345 1HG2 THR 607 1HG2 THR 607 -11.552 2.053 -0.551 346 2HG2 THR 607 2HG2 THR 607 -11.205 3.634 -1.252 347 3HG2 THR 607 3HG2 THR 607 -10.960 2.173 -2.208 348 H GLY 608 H GLY 608 -10.217 -0.987 0.853 349 1HA GLY 608 1HA GLY 608 -9.054 -2.235 -1.604 350 2HA GLY 608 2HA GLY 608 -10.678 -2.639 -1.046 351 H SER 609 H SER 609 -9.149 -4.786 -1.236 352 HA SER 609 HA SER 609 -7.521 -5.285 1.128 353 1HB SER 609 1HB SER 609 -10.339 -6.359 0.950 354 2HB SER 609 2HB SER 609 -9.099 -7.147 1.923 355 HG SER 609 HG SER 609 -8.798 -5.042 2.924 356 H SER 610 H SER 610 -7.442 -5.582 -1.836 357 HA SER 610 HA SER 610 -5.933 -7.880 -2.140 358 1HB SER 610 1HB SER 610 -7.948 -9.237 -3.355 359 2HB SER 610 2HB SER 610 -7.460 -9.519 -1.688 360 HG SER 610 HG SER 610 -9.526 -7.814 -2.634 361 H GLY 611 H GLY 611 -4.898 -6.923 -3.850 362 1HA GLY 611 1HA GLY 611 -6.577 -6.243 -6.233 363 2HA GLY 611 2HA GLY 611 -4.946 -6.905 -6.351 364 H THR 612 H THR 612 -6.827 -4.041 -5.517 365 HA THR 612 HA THR 612 -4.292 -2.452 -5.551 366 HB THR 612 HB THR 612 -6.920 -1.869 -6.940 367 HG1 THR 612 HG1 THR 612 -5.824 -2.543 -8.574 368 1HG2 THR 612 1HG2 THR 612 -4.670 -0.069 -6.113 369 2HG2 THR 612 2HG2 THR 612 -5.503 0.242 -7.637 370 3HG2 THR 612 3HG2 THR 612 -6.405 0.246 -6.122 371 H VAL 613 H VAL 613 -4.148 -1.888 -3.398 372 HA VAL 613 HA VAL 613 -6.606 -0.840 -2.080 373 HB VAL 613 HB VAL 613 -4.146 -2.255 -1.145 374 1HG1 VAL 613 1HG1 VAL 613 -4.029 -0.115 0.060 375 2HG1 VAL 613 2HG1 VAL 613 -5.699 -0.315 0.588 376 3HG1 VAL 613 3HG1 VAL 613 -4.454 -1.432 1.152 377 1HG2 VAL 613 1HG2 VAL 613 -7.104 -2.279 -0.538 378 2HG2 VAL 613 2HG2 VAL 613 -6.120 -3.567 -1.235 379 3HG2 VAL 613 3HG2 VAL 613 -5.946 -3.146 0.469 380 H THR 614 H THR 614 -6.699 1.361 -2.354 381 HA THR 614 HA THR 614 -4.176 2.891 -2.489 382 HB THR 614 HB THR 614 -6.845 4.226 -2.631 383 HG1 THR 614 HG1 THR 614 -7.293 3.389 -4.557 384 1HG2 THR 614 1HG2 THR 614 -4.511 5.305 -2.896 385 2HG2 THR 614 2HG2 THR 614 -4.466 4.501 -4.464 386 3HG2 THR 614 3HG2 THR 614 -5.725 5.686 -4.119 387 H ALA 615 H ALA 615 -3.611 4.503 -0.991 388 HA ALA 615 HA ALA 615 -4.761 4.144 1.689 389 1HB ALA 615 1HB ALA 615 -3.015 6.382 1.681 390 2HB ALA 615 2HB ALA 615 -2.671 4.754 2.265 391 3HB ALA 615 3HB ALA 615 -2.307 5.184 0.595 392 H ARG 616 H ARG 616 -5.345 6.172 2.977 393 HA ARG 616 HA ARG 616 -6.513 8.331 1.314 394 1HB ARG 616 1HB ARG 616 -8.043 6.215 2.624 395 2HB ARG 616 2HB ARG 616 -8.524 7.821 3.172 396 1HG ARG 616 1HG ARG 616 -9.131 8.516 1.015 397 2HG ARG 616 2HG ARG 616 -8.154 7.271 0.236 398 1HD ARG 616 1HD ARG 616 -10.182 6.233 0.007 399 2HD ARG 616 2HD ARG 616 -9.841 5.701 1.654 400 HE ARG 616 HE ARG 616 -11.126 8.011 2.168 401 1HH1 ARG 616 1HH1 ARG 616 -11.947 5.051 0.759 402 2HH1 ARG 616 2HH1 ARG 616 -13.564 5.509 0.343 403 1HH2 ARG 616 1HH2 ARG 616 -13.138 8.831 1.244 404 2HH2 ARG 616 2HH2 ARG 616 -14.239 7.649 0.617 405 HA PRO 617 HA PRO 617 -5.224 10.734 4.759 406 1HB PRO 617 1HB PRO 617 -6.796 12.947 4.328 407 2HB PRO 617 2HB PRO 617 -5.363 12.562 3.359 408 1HG PRO 617 1HG PRO 617 -8.245 12.293 2.636 409 2HG PRO 617 2HG PRO 617 -6.842 12.534 1.583 410 1HD PRO 617 1HD PRO 617 -8.181 10.080 2.020 411 2HD PRO 617 2HD PRO 617 -6.595 10.281 1.246 412 H ASN 618 H ASN 618 -5.845 10.840 6.907 413 HA ASN 618 HA ASN 618 -8.685 11.157 7.620 414 1HB ASN 618 1HB ASN 618 -7.168 8.741 8.638 415 2HB ASN 618 2HB ASN 618 -8.883 9.106 8.843 416 2HD2 ASN 618 2HD2 ASN 618 -10.320 8.608 7.091 417 1HD2 ASN 618 1HD2 ASN 618 -9.809 7.803 5.687 418 H GLY 619 H GLY 619 -6.033 12.536 8.006 419 1HA GLY 619 1HA GLY 619 -5.423 12.232 10.850 420 2HA GLY 619 2HA GLY 619 -6.331 13.697 10.477 421 H SER 620 H SER 620 -3.259 12.063 10.139 422 HA SER 620 HA SER 620 -1.996 13.842 8.304 423 1HB SER 620 1HB SER 620 -2.138 14.732 11.155 424 2HB SER 620 2HB SER 620 -0.628 14.991 10.285 425 HG SER 620 HG SER 620 -1.583 16.428 9.058 426 H GLY 621 H GLY 621 -1.712 11.195 8.480 427 1HA GLY 621 1HA GLY 621 -0.267 9.509 9.670 428 2HA GLY 621 2HA GLY 621 0.925 10.799 9.840 429 H ASN 622 H ASN 622 2.546 10.657 8.373 430 HA ASN 622 HA ASN 622 1.921 10.027 5.560 431 1HB ASN 622 1HB ASN 622 4.617 10.629 6.813 432 2HB ASN 622 2HB ASN 622 4.201 10.696 5.100 433 2HD2 ASN 622 2HD2 ASN 622 4.195 12.885 4.549 434 1HD2 ASN 622 1HD2 ASN 622 3.408 14.102 5.431 435 H SER 623 H SER 623 3.229 8.466 8.374 436 HA SER 623 HA SER 623 4.167 6.187 6.690 437 1HB SER 623 1HB SER 623 4.780 6.973 9.550 438 2HB SER 623 2HB SER 623 5.268 5.433 8.847 439 HG SER 623 HG SER 623 5.879 7.968 7.725 440 H PHE 624 H PHE 624 2.800 4.479 6.575 441 HA PHE 624 HA PHE 624 1.015 3.958 8.914 442 1HB PHE 624 1HB PHE 624 -0.826 3.455 7.448 443 2HB PHE 624 2HB PHE 624 -0.190 5.024 6.954 444 HD1 PHE 624 HD1 PHE 624 1.694 4.965 5.111 445 HD2 PHE 624 HD2 PHE 624 -1.093 1.779 5.843 446 HE1 PHE 624 HE1 PHE 624 2.105 4.079 2.829 447 HE2 PHE 624 HE2 PHE 624 -0.682 0.895 3.562 448 HZ PHE 624 HZ PHE 624 0.918 2.044 2.057 449 H GLY 625 H GLY 625 0.754 1.775 9.431 450 1HA GLY 625 1HA GLY 625 1.950 -0.329 9.629 451 2HA GLY 625 2HA GLY 625 2.593 -0.079 8.004 452 H VAL 626 H VAL 626 1.824 -2.086 7.199 453 HA VAL 626 HA VAL 626 -1.121 -2.515 7.281 454 HB VAL 626 HB VAL 626 0.517 -2.639 4.732 455 1HG1 VAL 626 1HG1 VAL 626 -1.450 -4.141 4.832 456 2HG1 VAL 626 2HG1 VAL 626 -2.470 -2.765 5.251 457 3HG1 VAL 626 3HG1 VAL 626 -1.696 -2.838 3.668 458 1HG2 VAL 626 1HG2 VAL 626 -0.859 -0.418 6.096 459 2HG2 VAL 626 2HG2 VAL 626 0.348 -0.372 4.812 460 3HG2 VAL 626 3HG2 VAL 626 -1.349 -0.639 4.417 461 H THR 627 H THR 627 -1.620 -4.649 7.570 462 HA THR 627 HA THR 627 0.613 -6.571 7.723 463 HB THR 627 HB THR 627 -2.339 -6.940 8.323 464 HG1 THR 627 HG1 THR 627 -1.508 -6.805 10.507 465 1HG2 THR 627 1HG2 THR 627 0.096 -8.670 8.584 466 2HG2 THR 627 2HG2 THR 627 -1.200 -8.826 9.771 467 3HG2 THR 627 3HG2 THR 627 -1.531 -9.105 8.062 468 H PHE 628 H PHE 628 0.657 -8.532 6.489 469 HA PHE 628 HA PHE 628 -1.239 -8.655 4.192 470 1HB PHE 628 1HB PHE 628 1.781 -8.883 4.001 471 2HB PHE 628 2HB PHE 628 0.651 -9.152 2.673 472 HD1 PHE 628 HD1 PHE 628 -0.925 -7.239 2.018 473 HD2 PHE 628 HD2 PHE 628 2.519 -6.699 4.529 474 HE1 PHE 628 HE1 PHE 628 -0.962 -4.803 1.546 475 HE2 PHE 628 HE2 PHE 628 2.481 -4.263 4.057 476 HZ PHE 628 HZ PHE 628 0.741 -3.316 2.566 477 H TYR 629 H TYR 629 -2.083 -10.673 4.058 478 HA TYR 629 HA TYR 629 -1.085 -12.821 5.734 479 1HB TYR 629 1HB TYR 629 -3.316 -12.471 3.775 480 2HB TYR 629 2HB TYR 629 -2.810 -14.116 4.162 481 HD1 TYR 629 HD1 TYR 629 -2.593 -14.731 6.671 482 HD2 TYR 629 HD2 TYR 629 -4.735 -11.296 5.236 483 HE1 TYR 629 HE1 TYR 629 -3.836 -14.612 8.814 484 HE2 TYR 629 HE2 TYR 629 -5.978 -11.176 7.379 485 HH TYR 629 HH TYR 629 -5.485 -13.615 9.927 486 H LYS 630 H LYS 630 0.160 -14.587 5.131 487 HA LYS 630 HA LYS 630 1.475 -14.394 2.481 488 1HB LYS 630 1HB LYS 630 2.119 -16.310 4.735 489 2HB LYS 630 2HB LYS 630 3.154 -15.854 3.381 490 1HG LYS 630 1HG LYS 630 3.415 -13.622 4.215 491 2HG LYS 630 2HG LYS 630 2.145 -13.856 5.417 492 1HD LYS 630 1HD LYS 630 4.056 -14.168 6.714 493 2HD LYS 630 2HD LYS 630 3.690 -15.827 6.237 494 1HE LYS 630 1HE LYS 630 5.262 -14.637 4.166 495 2HE LYS 630 2HE LYS 630 6.062 -14.329 5.707 496 1HZ LYS 630 1HZ LYS 630 5.373 -16.863 6.035 497 2HZ LYS 630 2HZ LYS 630 5.555 -16.851 4.349 498 3HZ LYS 630 3HZ LYS 630 6.853 -16.393 5.344 499 H ASN 631 H ASN 631 0.361 -17.157 4.475 500 HA ASN 631 HA ASN 631 -0.490 -19.236 3.750 501 1HB ASN 631 1HB ASN 631 -2.119 -17.465 1.909 502 2HB ASN 631 2HB ASN 631 -2.582 -19.031 2.577 503 2HD2 ASN 631 2HD2 ASN 631 -4.347 -16.997 3.110 504 1HD2 ASN 631 1HD2 ASN 631 -4.211 -16.477 4.720 505 H GLY 632 H GLY 632 1.875 -18.260 2.291 506 1HA GLY 632 1HA GLY 632 1.360 -19.613 -0.329 507 2HA GLY 632 2HA GLY 632 2.871 -19.785 0.566 508 H SER 633 H SER 633 2.223 -16.707 1.161 509 HA SER 633 HA SER 633 3.328 -15.705 -1.430 510 1HB SER 633 1HB SER 633 2.172 -13.906 0.678 511 2HB SER 633 2HB SER 633 2.248 -13.668 -1.065 512 HG SER 633 HG SER 633 0.315 -14.477 -1.092 513 H SER 634 H SER 634 5.492 -15.376 -1.318 514 HA SER 634 HA SER 634 6.655 -14.565 1.314 515 1HB SER 634 1HB SER 634 8.073 -15.816 -1.053 516 2HB SER 634 2HB SER 634 8.752 -15.522 0.545 517 HG SER 634 HG SER 634 7.138 -16.956 1.365 518 H ALA 635 H ALA 635 5.730 -13.294 -1.606 519 HA ALA 635 HA ALA 635 8.039 -11.484 -1.922 520 1HB ALA 635 1HB ALA 635 5.442 -11.199 -3.411 521 2HB ALA 635 2HB ALA 635 7.080 -10.841 -3.958 522 3HB ALA 635 3HB ALA 635 6.545 -12.515 -3.814 523 H THR 636 H THR 636 8.037 -9.338 -1.304 524 HA THR 636 HA THR 636 5.868 -8.494 0.509 525 HB THR 636 HB THR 636 8.298 -6.860 -0.218 526 HG1 THR 636 HG1 THR 636 8.380 -8.573 1.963 527 1HG2 THR 636 1HG2 THR 636 6.571 -7.150 2.253 528 2HG2 THR 636 2HG2 THR 636 8.041 -6.178 2.184 529 3HG2 THR 636 3HG2 THR 636 6.657 -5.755 1.177 530 HA PRO 637 HA PRO 637 3.980 -6.020 -2.630 531 1HB PRO 637 1HB PRO 637 2.387 -4.515 -0.969 532 2HB PRO 637 2HB PRO 637 2.029 -6.193 -1.414 533 1HG PRO 637 1HG PRO 637 3.080 -5.116 1.164 534 2HG PRO 637 2HG PRO 637 2.127 -6.579 0.863 535 1HD PRO 637 1HD PRO 637 4.912 -6.494 1.320 536 2HD PRO 637 2HD PRO 637 4.008 -7.876 0.665 537 H GLY 638 H GLY 638 3.652 -3.592 -3.094 538 1HA GLY 638 1HA GLY 638 5.771 -2.045 -3.368 539 2HA GLY 638 2HA GLY 638 5.587 -1.878 -1.623 540 H ALA 639 H ALA 639 5.157 0.391 -1.866 541 HA ALA 639 HA ALA 639 2.342 0.951 -2.615 542 1HB ALA 639 1HB ALA 639 4.040 1.845 -0.534 543 2HB ALA 639 2HB ALA 639 3.756 3.239 -1.575 544 3HB ALA 639 3HB ALA 639 2.391 2.372 -0.872 545 H THR 640 H THR 640 1.836 2.197 -4.361 546 HA THR 640 HA THR 640 4.080 3.075 -6.099 547 HB THR 640 HB THR 640 1.252 3.332 -6.906 548 HG1 THR 640 HG1 THR 640 1.507 0.998 -7.527 549 1HG2 THR 640 1HG2 THR 640 3.806 2.406 -8.233 550 2HG2 THR 640 2HG2 THR 640 2.238 2.425 -9.040 551 3HG2 THR 640 3HG2 THR 640 2.966 3.935 -8.493 552 H CYS 641 H CYS 641 4.317 5.179 -6.755 553 HA CYS 641 HA CYS 641 2.324 7.224 -6.190 554 1HB CYS 641 1HB CYS 641 4.699 6.871 -4.429 555 2HB CYS 641 2HB CYS 641 4.283 8.522 -4.885 556 H ALA 642 H ALA 642 2.877 6.964 -8.614 557 HA ALA 642 HA ALA 642 4.851 9.070 -9.295 558 1HB ALA 642 1HB ALA 642 5.000 6.919 -11.230 559 2HB ALA 642 2HB ALA 642 5.428 6.332 -9.623 560 3HB ALA 642 3HB ALA 642 6.305 7.689 -10.327 561 H THR 643 H THR 643 4.559 9.751 -11.625 562 HA THR 643 HA THR 643 1.695 9.415 -12.398 563 HB THR 643 HB THR 643 1.886 11.561 -13.533 564 HG1 THR 643 HG1 THR 643 3.850 11.929 -14.196 565 1HG2 THR 643 1HG2 THR 643 2.809 11.390 -10.674 566 2HG2 THR 643 2HG2 THR 643 2.623 12.959 -11.459 567 3HG2 THR 643 3HG2 THR 643 1.235 11.883 -11.301 568 H GLY 644 H GLY 644 1.667 7.793 -13.876 569 1HA GLY 644 1HA GLY 644 3.804 7.193 -15.694 570 2HA GLY 644 2HA GLY 644 2.567 8.144 -16.517 No H/Q in entry = 570 Start of MODEL 2 1 H1 THR 557 H1 THR 557 10.795 9.530 -9.684 2 H2 THR 557 H2 THR 557 11.412 9.265 -11.246 3 H3 THR 557 H3 THR 557 12.469 9.391 -9.922 4 HA THR 557 HA THR 557 12.029 11.683 -9.645 5 HB THR 557 HB THR 557 12.304 10.997 -12.589 6 HG1 THR 557 HG1 THR 557 13.962 10.085 -11.500 7 1HG2 THR 557 1HG2 THR 557 12.028 13.512 -11.270 8 2HG2 THR 557 2HG2 THR 557 13.701 13.363 -11.809 9 3HG2 THR 557 3HG2 THR 557 12.383 13.206 -12.970 10 H GLY 558 H GLY 558 10.656 13.482 -9.977 11 1HA GLY 558 1HA GLY 558 8.590 13.742 -11.858 12 2HA GLY 558 2HA GLY 558 8.550 14.488 -10.260 13 H SER 559 H SER 559 7.900 12.918 -8.449 14 HA SER 559 HA SER 559 5.365 11.722 -9.114 15 1HB SER 559 1HB SER 559 6.511 9.416 -8.109 16 2HB SER 559 2HB SER 559 6.124 9.703 -9.803 17 HG SER 559 HG SER 559 8.331 9.099 -9.433 18 H CYS 560 H CYS 560 4.518 10.474 -7.108 19 HA CYS 560 HA CYS 560 4.775 12.147 -4.822 20 1HB CYS 560 1HB CYS 560 2.859 11.026 -4.430 21 2HB CYS 560 2HB CYS 560 3.286 9.779 -5.590 22 H SER 561 H SER 561 5.509 11.247 -2.611 23 HA SER 561 HA SER 561 8.124 9.842 -3.001 24 1HB SER 561 1HB SER 561 7.321 11.869 -0.891 25 2HB SER 561 2HB SER 561 8.877 11.047 -0.963 26 HG SER 561 HG SER 561 8.519 13.248 -2.025 27 H VAL 562 H VAL 562 8.259 7.871 -2.030 28 HA VAL 562 HA VAL 562 6.669 7.386 0.430 29 HB VAL 562 HB VAL 562 5.647 5.398 -0.410 30 1HG1 VAL 562 1HG1 VAL 562 4.944 7.816 -1.311 31 2HG1 VAL 562 2HG1 VAL 562 5.382 7.087 -2.861 32 3HG1 VAL 562 3HG1 VAL 562 4.129 6.351 -1.858 33 1HG2 VAL 562 1HG2 VAL 562 7.671 4.656 -1.706 34 2HG2 VAL 562 2HG2 VAL 562 6.160 4.448 -2.591 35 3HG2 VAL 562 3HG2 VAL 562 7.225 5.801 -2.971 36 H SER 563 H SER 563 7.233 5.028 1.200 37 HA SER 563 HA SER 563 9.957 4.160 0.520 38 1HB SER 563 1HB SER 563 9.306 5.058 3.343 39 2HB SER 563 2HB SER 563 10.844 4.417 2.771 40 HG SER 563 HG SER 563 10.880 6.686 2.830 41 H ALA 564 H ALA 564 10.146 1.953 0.915 42 HA ALA 564 HA ALA 564 7.878 0.713 2.421 43 1HB ALA 564 1HB ALA 564 7.819 0.270 -0.030 44 2HB ALA 564 2HB ALA 564 9.411 -0.480 0.092 45 3HB ALA 564 3HB ALA 564 8.028 -1.203 0.917 46 H VAL 565 H VAL 565 9.046 0.619 4.395 47 HA VAL 565 HA VAL 565 11.673 -0.671 4.499 48 HB VAL 565 HB VAL 565 9.901 -0.344 6.897 49 1HG1 VAL 565 1HG1 VAL 565 12.850 -0.174 6.266 50 2HG1 VAL 565 2HG1 VAL 565 12.198 0.458 7.777 51 3HG1 VAL 565 3HG1 VAL 565 12.031 -1.255 7.393 52 1HG2 VAL 565 1HG2 VAL 565 10.839 1.789 5.070 53 2HG2 VAL 565 2HG2 VAL 565 9.532 1.820 6.253 54 3HG2 VAL 565 3HG2 VAL 565 11.199 2.061 6.775 55 H ARG 566 H ARG 566 12.028 -2.764 5.535 56 HA ARG 566 HA ARG 566 9.860 -4.662 4.963 57 1HB ARG 566 1HB ARG 566 12.707 -4.962 5.950 58 2HB ARG 566 2HB ARG 566 11.600 -6.332 5.845 59 1HG ARG 566 1HG ARG 566 11.322 -5.019 3.390 60 2HG ARG 566 2HG ARG 566 13.055 -4.983 3.718 61 1HD ARG 566 1HD ARG 566 11.395 -7.498 3.985 62 2HD ARG 566 2HD ARG 566 12.218 -7.053 2.491 63 HE ARG 566 HE ARG 566 13.517 -8.419 4.488 64 1HH1 ARG 566 1HH1 ARG 566 14.671 -6.777 2.053 65 2HH1 ARG 566 2HH1 ARG 566 15.955 -5.944 2.864 66 1HH2 ARG 566 1HH2 ARG 566 14.782 -6.681 6.042 67 2HH2 ARG 566 2HH2 ARG 566 16.018 -5.889 5.123 68 H GLY 567 H GLY 567 8.617 -3.346 6.719 69 1HA GLY 567 1HA GLY 567 7.515 -3.460 8.751 70 2HA GLY 567 2HA GLY 567 9.138 -3.516 9.457 71 H GLU 568 H GLU 568 8.041 -5.046 11.032 72 HA GLU 568 HA GLU 568 8.819 -7.677 10.772 73 1HB GLU 568 1HB GLU 568 6.417 -6.521 12.196 74 2HB GLU 568 2HB GLU 568 6.848 -8.227 12.324 75 1HG GLU 568 1HG GLU 568 8.428 -7.741 13.847 76 2HG GLU 568 2HG GLU 568 9.211 -6.642 12.710 77 H GLU 569 H GLU 569 7.762 -9.648 10.115 78 HA GLU 569 HA GLU 569 5.206 -9.529 8.718 79 1HB GLU 569 1HB GLU 569 7.265 -10.606 6.899 80 2HB GLU 569 2HB GLU 569 5.861 -9.600 6.539 81 1HG GLU 569 1HG GLU 569 7.017 -7.603 7.186 82 2HG GLU 569 2HG GLU 569 8.348 -8.522 7.888 83 H TRP 570 H TRP 570 4.536 -11.214 10.015 84 HA TRP 570 HA TRP 570 6.025 -13.502 10.748 85 1HB TRP 570 1HB TRP 570 3.038 -13.398 10.248 86 2HB TRP 570 2HB TRP 570 3.894 -14.516 11.307 87 HD1 TRP 570 HD1 TRP 570 4.648 -13.668 13.655 88 HE1 TRP 570 HE1 TRP 570 4.124 -11.546 15.020 89 HE3 TRP 570 HE3 TRP 570 2.544 -10.759 10.006 90 HZ2 TRP 570 HZ2 TRP 570 2.967 -8.964 14.625 91 HZ3 TRP 570 HZ3 TRP 570 1.738 -8.478 10.540 92 HH2 TRP 570 HH2 TRP 570 1.948 -7.577 12.839 93 H ALA 571 H ALA 571 5.538 -15.781 9.943 94 HA ALA 571 HA ALA 571 6.108 -15.952 7.126 95 1HB ALA 571 1HB ALA 571 5.722 -17.827 9.372 96 2HB ALA 571 2HB ALA 571 5.243 -18.469 7.801 97 3HB ALA 571 3HB ALA 571 6.887 -17.882 8.048 98 H ASP 572 H ASP 572 3.170 -15.905 8.990 99 HA ASP 572 HA ASP 572 1.620 -16.540 6.512 100 1HB ASP 572 1HB ASP 572 0.577 -16.635 9.351 101 2HB ASP 572 2HB ASP 572 -0.168 -17.314 7.903 102 H ARG 573 H ARG 573 2.582 -14.041 8.542 103 HA ARG 573 HA ARG 573 0.361 -12.329 7.519 104 1HB ARG 573 1HB ARG 573 1.351 -12.618 10.344 105 2HB ARG 573 2HB ARG 573 0.735 -11.060 9.794 106 1HG ARG 573 1HG ARG 573 -1.185 -12.716 8.836 107 2HG ARG 573 2HG ARG 573 -0.705 -13.584 10.293 108 1HD ARG 573 1HD ARG 573 -0.823 -11.007 11.213 109 2HD ARG 573 2HD ARG 573 -2.120 -11.010 10.019 110 HE ARG 573 HE ARG 573 -3.356 -12.346 11.506 111 1HH1 ARG 573 1HH1 ARG 573 -0.033 -12.249 12.371 112 2HH1 ARG 573 2HH1 ARG 573 -0.182 -13.430 13.629 113 1HH2 ARG 573 1HH2 ARG 573 -3.541 -14.039 13.021 114 2HH2 ARG 573 2HH2 ARG 573 -2.168 -14.444 13.997 115 H PHE 574 H PHE 574 1.002 -9.983 7.555 116 HA PHE 574 HA PHE 574 3.951 -9.661 7.339 117 1HB PHE 574 1HB PHE 574 1.978 -9.430 5.293 118 2HB PHE 574 2HB PHE 574 2.638 -7.827 5.606 119 HD1 PHE 574 HD1 PHE 574 3.618 -11.351 4.936 120 HD2 PHE 574 HD2 PHE 574 4.744 -7.222 4.802 121 HE1 PHE 574 HE1 PHE 574 5.668 -11.949 3.651 122 HE2 PHE 574 HE2 PHE 574 6.786 -7.799 3.531 123 HZ PHE 574 HZ PHE 574 7.246 -10.165 2.945 124 H ASN 575 H ASN 575 4.646 -7.360 7.522 125 HA ASN 575 HA ASN 575 2.768 -5.444 8.715 126 1HB ASN 575 1HB ASN 575 3.853 -7.125 10.508 127 2HB ASN 575 2HB ASN 575 5.170 -5.955 10.389 128 2HD2 ASN 575 2HD2 ASN 575 1.618 -5.415 10.189 129 1HD2 ASN 575 1HD2 ASN 575 1.563 -4.316 11.480 130 H VAL 576 H VAL 576 3.786 -4.729 6.525 131 HA VAL 576 HA VAL 576 6.553 -3.794 6.682 132 HB VAL 576 HB VAL 576 4.555 -2.845 4.654 133 1HG1 VAL 576 1HG1 VAL 576 6.943 -1.973 4.816 134 2HG1 VAL 576 2HG1 VAL 576 7.458 -3.588 4.325 135 3HG1 VAL 576 3HG1 VAL 576 6.457 -2.615 3.246 136 1HG2 VAL 576 1HG2 VAL 576 5.998 -5.511 4.736 137 2HG2 VAL 576 2HG2 VAL 576 4.250 -5.260 4.733 138 3HG2 VAL 576 3HG2 VAL 576 5.200 -4.862 3.303 139 H THR 577 H THR 577 7.181 -1.600 6.683 140 HA THR 577 HA THR 577 5.168 0.237 7.917 141 HB THR 577 HB THR 577 8.192 0.231 8.187 142 HG1 THR 577 HG1 THR 577 7.840 -0.650 10.118 143 1HG2 THR 577 1HG2 THR 577 6.350 2.343 8.476 144 2HG2 THR 577 2HG2 THR 577 6.737 1.818 10.114 145 3HG2 THR 577 3HG2 THR 577 8.028 2.312 9.020 146 H TYR 578 H TYR 578 4.423 1.109 5.922 147 HA TYR 578 HA TYR 578 6.384 2.229 4.034 148 1HB TYR 578 1HB TYR 578 3.356 2.431 4.029 149 2HB TYR 578 2HB TYR 578 4.433 2.808 2.684 150 HD1 TYR 578 HD1 TYR 578 6.067 0.890 1.947 151 HD2 TYR 578 HD2 TYR 578 2.475 0.267 4.218 152 HE1 TYR 578 HE1 TYR 578 6.047 -1.492 1.260 153 HE2 TYR 578 HE2 TYR 578 2.452 -2.115 3.527 154 HH TYR 578 HH TYR 578 5.144 -3.594 1.928 155 H SER 579 H SER 579 6.560 4.493 3.575 156 HA SER 579 HA SER 579 5.254 6.317 5.535 157 1HB SER 579 1HB SER 579 8.198 5.952 5.050 158 2HB SER 579 2HB SER 579 7.578 7.527 5.538 159 HG SER 579 HG SER 579 6.753 5.227 6.917 160 H VAL 580 H VAL 580 4.483 8.131 4.562 161 HA VAL 580 HA VAL 580 5.304 8.631 1.737 162 HB VAL 580 HB VAL 580 2.761 9.015 3.282 163 1HG1 VAL 580 1HG1 VAL 580 3.364 11.271 2.330 164 2HG1 VAL 580 2HG1 VAL 580 3.387 10.528 0.729 165 3HG1 VAL 580 3HG1 VAL 580 1.886 10.581 1.658 166 1HG2 VAL 580 1HG2 VAL 580 3.537 8.009 0.536 167 2HG2 VAL 580 2HG2 VAL 580 2.947 7.057 1.900 168 3HG2 VAL 580 3HG2 VAL 580 1.865 8.177 1.071 169 H SER 581 H SER 581 5.648 10.878 1.100 170 HA SER 581 HA SER 581 5.832 12.919 3.197 171 1HB SER 581 1HB SER 581 8.185 11.401 2.278 172 2HB SER 581 2HB SER 581 8.378 13.150 2.197 173 HG SER 581 HG SER 581 8.756 12.951 4.259 174 H GLY 582 H GLY 582 4.189 13.369 1.284 175 1HA GLY 582 1HA GLY 582 5.417 14.378 -1.172 176 2HA GLY 582 2HA GLY 582 4.866 15.652 -0.083 177 H SER 583 H SER 583 3.184 12.591 -0.174 178 HA SER 583 HA SER 583 1.155 13.607 -2.060 179 1HB SER 583 1HB SER 583 1.794 10.999 -0.789 180 2HB SER 583 2HB SER 583 0.095 11.296 -1.148 181 HG SER 583 HG SER 583 0.703 10.663 -3.073 182 H SER 584 H SER 584 0.421 15.417 -0.719 183 HA SER 584 HA SER 584 -0.465 15.392 1.905 184 1HB SER 584 1HB SER 584 -2.476 16.825 0.759 185 2HB SER 584 2HB SER 584 -0.862 17.470 1.043 186 HG SER 584 HG SER 584 -2.123 16.814 -1.298 187 H SER 585 H SER 585 -2.887 15.024 -0.692 188 HA SER 585 HA SER 585 -4.577 13.436 1.096 189 1HB SER 585 1HB SER 585 -5.444 15.082 -0.639 190 2HB SER 585 2HB SER 585 -4.958 13.921 -1.871 191 HG SER 585 HG SER 585 -6.951 13.260 -1.461 192 H TRP 586 H TRP 586 -4.625 11.222 1.170 193 HA TRP 586 HA TRP 586 -2.642 9.715 -0.273 194 1HB TRP 586 1HB TRP 586 -4.753 9.105 1.710 195 2HB TRP 586 2HB TRP 586 -4.261 7.772 0.664 196 HD1 TRP 586 HD1 TRP 586 -3.029 9.969 3.491 197 HE1 TRP 586 HE1 TRP 586 -0.724 9.106 4.268 198 HE3 TRP 586 HE3 TRP 586 -2.043 6.570 -0.190 199 HZ2 TRP 586 HZ2 TRP 586 1.253 7.243 3.463 200 HZ3 TRP 586 HZ3 TRP 586 0.062 5.260 -0.159 201 HH2 TRP 586 HH2 TRP 586 1.713 5.593 1.661 202 H VAL 587 H VAL 587 -2.744 8.706 -2.132 203 HA VAL 587 HA VAL 587 -5.231 7.727 -3.303 204 HB VAL 587 HB VAL 587 -3.691 9.647 -5.032 205 1HG1 VAL 587 1HG1 VAL 587 -6.002 7.994 -5.251 206 2HG1 VAL 587 2HG1 VAL 587 -6.545 9.671 -5.328 207 3HG1 VAL 587 3HG1 VAL 587 -5.332 9.084 -6.465 208 1HG2 VAL 587 1HG2 VAL 587 -4.272 10.903 -2.962 209 2HG2 VAL 587 2HG2 VAL 587 -5.188 11.474 -4.356 210 3HG2 VAL 587 3HG2 VAL 587 -5.958 10.425 -3.166 211 H VAL 588 H VAL 588 -2.614 6.815 -2.349 212 HA VAL 588 HA VAL 588 -0.993 6.143 -4.674 213 HB VAL 588 HB VAL 588 -0.929 5.596 -1.738 214 1HG1 VAL 588 1HG1 VAL 588 0.596 3.924 -3.774 215 2HG1 VAL 588 2HG1 VAL 588 0.887 3.923 -2.033 216 3HG1 VAL 588 3HG1 VAL 588 -0.652 3.336 -2.675 217 1HG2 VAL 588 1HG2 VAL 588 0.756 6.825 -3.855 218 2HG2 VAL 588 2HG2 VAL 588 0.452 7.363 -2.204 219 3HG2 VAL 588 3HG2 VAL 588 1.605 6.065 -2.509 220 H THR 589 H THR 589 -0.489 3.865 -5.170 221 HA THR 589 HA THR 589 -2.941 2.179 -4.984 222 HB THR 589 HB THR 589 -1.391 1.037 -6.964 223 HG1 THR 589 HG1 THR 589 -0.466 2.618 -8.104 224 1HG2 THR 589 1HG2 THR 589 -3.511 3.186 -7.243 225 2HG2 THR 589 2HG2 THR 589 -3.017 2.072 -8.518 226 3HG2 THR 589 3HG2 THR 589 -3.809 1.457 -7.067 227 H LEU 590 H LEU 590 -2.552 -0.158 -4.679 228 HA LEU 590 HA LEU 590 0.061 -0.672 -3.310 229 1HB LEU 590 1HB LEU 590 -2.752 -1.285 -2.511 230 2HB LEU 590 2HB LEU 590 -1.506 -2.461 -2.094 231 HG LEU 590 HG LEU 590 -0.258 -0.163 -1.363 232 1HD1 LEU 590 1HD1 LEU 590 -2.749 0.784 -1.939 233 2HD1 LEU 590 2HD1 LEU 590 -2.934 0.400 -0.228 234 3HD1 LEU 590 3HD1 LEU 590 -1.673 1.518 -0.749 235 1HD2 LEU 590 1HD2 LEU 590 -1.201 -2.422 -0.128 236 2HD2 LEU 590 2HD2 LEU 590 -0.369 -1.111 0.707 237 3HD2 LEU 590 3HD2 LEU 590 -2.131 -1.166 0.689 238 H GLY 591 H GLY 591 1.180 -2.434 -4.040 239 1HA GLY 591 1HA GLY 591 1.483 -3.836 -6.074 240 2HA GLY 591 2HA GLY 591 -0.237 -4.217 -5.983 241 H LEU 592 H LEU 592 -0.929 -5.461 -4.015 242 HA LEU 592 HA LEU 592 0.862 -6.693 -2.216 243 1HB LEU 592 1HB LEU 592 -1.631 -8.040 -3.249 244 2HB LEU 592 2HB LEU 592 -0.942 -8.089 -1.635 245 HG LEU 592 HG LEU 592 -2.418 -5.816 -2.951 246 1HD1 LEU 592 1HD1 LEU 592 -2.705 -7.336 -0.345 247 2HD1 LEU 592 2HD1 LEU 592 -3.668 -5.923 -0.779 248 3HD1 LEU 592 3HD1 LEU 592 -3.791 -7.401 -1.733 249 1HD2 LEU 592 1HD2 LEU 592 -0.630 -5.747 -0.498 250 2HD2 LEU 592 2HD2 LEU 592 -0.422 -4.815 -1.981 251 3HD2 LEU 592 3HD2 LEU 592 -1.786 -4.480 -0.914 252 H ASN 593 H ASN 593 1.966 -8.684 -2.296 253 HA ASN 593 HA ASN 593 2.253 -9.830 -5.040 254 1HB ASN 593 1HB ASN 593 4.113 -9.775 -2.652 255 2HB ASN 593 2HB ASN 593 4.404 -10.796 -4.061 256 2HD2 ASN 593 2HD2 ASN 593 5.825 -8.256 -3.001 257 1HD2 ASN 593 1HD2 ASN 593 5.897 -7.240 -4.358 258 H GLY 594 H GLY 594 1.277 -11.768 -5.338 259 1HA GLY 594 1HA GLY 594 1.345 -13.782 -3.181 260 2HA GLY 594 2HA GLY 594 0.832 -14.065 -4.844 261 H GLY 595 H GLY 595 -0.985 -11.762 -4.892 262 1HA GLY 595 1HA GLY 595 -3.405 -12.950 -4.144 263 2HA GLY 595 2HA GLY 595 -3.190 -11.204 -4.293 264 H GLN 596 H GLN 596 -1.403 -10.707 -2.217 265 HA GLN 596 HA GLN 596 -2.295 -11.965 0.252 266 1HB GLN 596 1HB GLN 596 -0.679 -9.440 -0.222 267 2HB GLN 596 2HB GLN 596 -0.902 -10.222 1.343 268 1HG GLN 596 1HG GLN 596 0.247 -12.205 0.605 269 2HG GLN 596 2HG GLN 596 0.279 -11.630 -1.062 270 2HE2 GLN 596 2HE2 GLN 596 1.698 -11.133 2.159 271 1HE2 GLN 596 1HE2 GLN 596 3.009 -10.197 1.624 272 H SER 597 H SER 597 -3.426 -10.799 1.982 273 HA SER 597 HA SER 597 -5.270 -8.707 0.895 274 1HB SER 597 1HB SER 597 -5.979 -10.359 3.292 275 2HB SER 597 2HB SER 597 -7.036 -9.634 2.085 276 HG SER 597 HG SER 597 -6.409 -12.075 2.122 277 H VAL 598 H VAL 598 -6.153 -7.266 2.725 278 HA VAL 598 HA VAL 598 -3.844 -6.434 4.399 279 HB VAL 598 HB VAL 598 -6.452 -5.008 3.789 280 1HG1 VAL 598 1HG1 VAL 598 -4.181 -4.469 5.601 281 2HG1 VAL 598 2HG1 VAL 598 -4.642 -3.113 4.571 282 3HG1 VAL 598 3HG1 VAL 598 -5.831 -3.847 5.647 283 1HG2 VAL 598 1HG2 VAL 598 -3.676 -4.877 2.604 284 2HG2 VAL 598 2HG2 VAL 598 -5.213 -5.082 1.765 285 3HG2 VAL 598 3HG2 VAL 598 -4.797 -3.523 2.477 286 H GLN 599 H GLN 599 -3.833 -7.021 6.509 287 HA GLN 599 HA GLN 599 -6.270 -8.133 7.724 288 1HB GLN 599 1HB GLN 599 -4.016 -9.164 8.085 289 2HB GLN 599 2HB GLN 599 -3.529 -7.707 8.953 290 1HG GLN 599 1HG GLN 599 -5.958 -8.389 10.130 291 2HG GLN 599 2HG GLN 599 -5.166 -9.945 9.870 292 2HE2 GLN 599 2HE2 GLN 599 -5.389 -7.435 12.085 293 1HE2 GLN 599 1HE2 GLN 599 -3.914 -7.662 12.894 294 H SER 600 H SER 600 -3.998 -5.465 8.466 295 HA SER 600 HA SER 600 -6.177 -3.748 9.324 296 1HB SER 600 1HB SER 600 -4.565 -5.260 11.335 297 2HB SER 600 2HB SER 600 -4.957 -3.580 11.694 298 HG SER 600 HG SER 600 -6.982 -4.118 11.944 299 H SER 601 H SER 601 -5.392 -1.584 9.822 300 HA SER 601 HA SER 601 -2.490 -1.113 9.484 301 1HB SER 601 1HB SER 601 -2.705 0.309 7.593 302 2HB SER 601 2HB SER 601 -3.672 -1.109 7.197 303 HG SER 601 HG SER 601 -4.429 1.493 7.675 304 H TRP 602 H TRP 602 -1.880 1.063 10.154 305 HA TRP 602 HA TRP 602 -4.034 2.596 11.531 306 1HB TRP 602 1HB TRP 602 -2.721 2.810 13.542 307 2HB TRP 602 2HB TRP 602 -2.806 1.091 13.156 308 HD1 TRP 602 HD1 TRP 602 -0.409 4.064 13.117 309 HE1 TRP 602 HE1 TRP 602 1.993 3.190 12.881 310 HE3 TRP 602 HE3 TRP 602 -1.353 -0.886 12.289 311 HZ2 TRP 602 HZ2 TRP 602 3.351 0.715 12.403 312 HZ3 TRP 602 HZ3 TRP 602 0.516 -2.478 11.947 313 HH2 TRP 602 HH2 TRP 602 2.864 -1.685 12.002 314 H ASN 603 H ASN 603 -3.490 4.857 11.830 315 HA ASN 603 HA ASN 603 -2.363 6.869 11.329 316 1HB ASN 603 1HB ASN 603 -0.296 5.017 11.454 317 2HB ASN 603 2HB ASN 603 -0.120 5.715 9.843 318 2HD2 ASN 603 2HD2 ASN 603 -1.224 8.349 10.562 319 1HD2 ASN 603 1HD2 ASN 603 -0.068 9.110 11.546 320 H ALA 604 H ALA 604 -4.214 5.387 9.539 321 HA ALA 604 HA ALA 604 -4.354 7.058 7.339 322 1HB ALA 604 1HB ALA 604 -2.126 5.200 7.092 323 2HB ALA 604 2HB ALA 604 -2.547 6.577 6.074 324 3HB ALA 604 3HB ALA 604 -3.279 5.002 5.772 325 H ALA 605 H ALA 605 -6.075 6.447 5.967 326 HA ALA 605 HA ALA 605 -7.640 4.144 6.924 327 1HB ALA 605 1HB ALA 605 -9.302 5.575 6.403 328 2HB ALA 605 2HB ALA 605 -8.929 5.292 4.702 329 3HB ALA 605 3HB ALA 605 -8.182 6.642 5.556 330 H LEU 606 H LEU 606 -8.642 2.675 5.225 331 HA LEU 606 HA LEU 606 -6.659 2.127 3.053 332 1HB LEU 606 1HB LEU 606 -8.217 0.218 4.810 333 2HB LEU 606 2HB LEU 606 -7.425 -0.293 3.319 334 HG LEU 606 HG LEU 606 -6.110 0.929 5.764 335 1HD1 LEU 606 1HD1 LEU 606 -5.993 -1.780 4.410 336 2HD1 LEU 606 2HD1 LEU 606 -4.784 -1.250 5.578 337 3HD1 LEU 606 3HD1 LEU 606 -6.469 -1.422 6.070 338 1HD2 LEU 606 1HD2 LEU 606 -5.175 0.586 2.934 339 2HD2 LEU 606 2HD2 LEU 606 -4.817 1.878 4.080 340 3HD2 LEU 606 3HD2 LEU 606 -4.017 0.313 4.236 341 H THR 607 H THR 607 -7.566 1.266 1.070 342 HA THR 607 HA THR 607 -10.525 1.581 0.820 343 HB THR 607 HB THR 607 -8.467 2.637 -1.145 344 HG1 THR 607 HG1 THR 607 -9.261 4.653 -0.445 345 1HG2 THR 607 1HG2 THR 607 -10.934 1.751 -1.764 346 2HG2 THR 607 2HG2 THR 607 -11.343 3.387 -1.246 347 3HG2 THR 607 3HG2 THR 607 -10.196 3.139 -2.563 348 H GLY 608 H GLY 608 -10.244 -0.849 0.999 349 1HA GLY 608 1HA GLY 608 -9.236 -2.060 -1.532 350 2HA GLY 608 2HA GLY 608 -10.876 -2.420 -0.991 351 H SER 609 H SER 609 -8.883 -4.423 -1.308 352 HA SER 609 HA SER 609 -7.514 -5.079 1.112 353 1HB SER 609 1HB SER 609 -9.088 -6.905 1.882 354 2HB SER 609 2HB SER 609 -9.677 -5.269 2.157 355 HG SER 609 HG SER 609 -10.509 -7.208 0.323 356 H SER 610 H SER 610 -7.173 -5.263 -1.770 357 HA SER 610 HA SER 610 -5.807 -7.662 -2.067 358 1HB SER 610 1HB SER 610 -8.710 -8.029 -2.252 359 2HB SER 610 2HB SER 610 -7.848 -8.628 -3.666 360 HG SER 610 HG SER 610 -7.430 -10.275 -2.428 361 H GLY 611 H GLY 611 -4.872 -7.794 -4.140 362 1HA GLY 611 1HA GLY 611 -5.991 -6.504 -6.464 363 2HA GLY 611 2HA GLY 611 -4.336 -7.095 -6.319 364 H THR 612 H THR 612 -5.620 -4.450 -7.278 365 HA THR 612 HA THR 612 -3.530 -2.734 -6.159 366 HB THR 612 HB THR 612 -5.791 -1.787 -7.915 367 HG1 THR 612 HG1 THR 612 -3.557 -3.382 -8.571 368 1HG2 THR 612 1HG2 THR 612 -3.779 -0.406 -6.839 369 2HG2 THR 612 2HG2 THR 612 -2.915 -1.053 -8.235 370 3HG2 THR 612 3HG2 THR 612 -4.359 -0.067 -8.470 371 H VAL 613 H VAL 613 -3.895 -2.020 -4.091 372 HA VAL 613 HA VAL 613 -6.644 -1.141 -3.375 373 HB VAL 613 HB VAL 613 -4.289 -2.210 -1.876 374 1HG1 VAL 613 1HG1 VAL 613 -4.653 0.021 -0.867 375 2HG1 VAL 613 2HG1 VAL 613 -6.349 -0.387 -0.605 376 3HG1 VAL 613 3HG1 VAL 613 -5.084 -1.281 0.241 377 1HG2 VAL 613 1HG2 VAL 613 -6.553 -3.356 -2.545 378 2HG2 VAL 613 2HG2 VAL 613 -5.889 -3.632 -0.935 379 3HG2 VAL 613 3HG2 VAL 613 -7.199 -2.471 -1.162 380 H THR 614 H THR 614 -6.847 0.947 -2.245 381 HA THR 614 HA THR 614 -4.625 2.825 -2.937 382 HB THR 614 HB THR 614 -7.466 3.764 -2.729 383 HG1 THR 614 HG1 THR 614 -6.503 3.017 -5.221 384 1HG2 THR 614 1HG2 THR 614 -5.455 5.290 -2.986 385 2HG2 THR 614 2HG2 THR 614 -5.215 4.580 -4.582 386 3HG2 THR 614 3HG2 THR 614 -6.693 5.476 -4.228 387 H ALA 615 H ALA 615 -3.976 4.235 -1.321 388 HA ALA 615 HA ALA 615 -5.083 3.702 1.372 389 1HB ALA 615 1HB ALA 615 -2.556 4.706 0.287 390 2HB ALA 615 2HB ALA 615 -3.129 5.657 1.659 391 3HB ALA 615 3HB ALA 615 -2.878 3.919 1.832 392 H ARG 616 H ARG 616 -5.677 5.527 2.793 393 HA ARG 616 HA ARG 616 -6.584 7.942 1.289 394 1HB ARG 616 1HB ARG 616 -8.191 6.431 3.374 395 2HB ARG 616 2HB ARG 616 -8.692 7.913 2.558 396 1HG ARG 616 1HG ARG 616 -8.483 6.695 0.367 397 2HG ARG 616 2HG ARG 616 -8.191 5.213 1.278 398 1HD ARG 616 1HD ARG 616 -10.389 4.953 1.701 399 2HD ARG 616 2HD ARG 616 -10.526 6.610 2.291 400 HE ARG 616 HE ARG 616 -10.443 6.256 -0.644 401 1HH1 ARG 616 1HH1 ARG 616 -11.511 8.559 1.198 402 2HH1 ARG 616 2HH1 ARG 616 -13.206 8.431 0.865 403 1HH2 ARG 616 1HH2 ARG 616 -12.946 5.313 -0.630 404 2HH2 ARG 616 2HH2 ARG 616 -14.018 6.593 -0.170 405 HA PRO 617 HA PRO 617 -4.784 10.112 4.656 406 1HB PRO 617 1HB PRO 617 -6.174 12.473 4.419 407 2HB PRO 617 2HB PRO 617 -4.873 11.987 3.317 408 1HG PRO 617 1HG PRO 617 -7.820 12.005 2.851 409 2HG PRO 617 2HG PRO 617 -6.498 12.150 1.681 410 1HD PRO 617 1HD PRO 617 -8.018 9.816 2.180 411 2HD PRO 617 2HD PRO 617 -6.493 9.894 1.273 412 H ASN 618 H ASN 618 -5.214 9.955 6.828 413 HA ASN 618 HA ASN 618 -8.074 10.134 7.696 414 1HB ASN 618 1HB ASN 618 -7.572 8.559 9.456 415 2HB ASN 618 2HB ASN 618 -6.965 7.873 7.948 416 2HD2 ASN 618 2HD2 ASN 618 -6.056 7.902 11.015 417 1HD2 ASN 618 1HD2 ASN 618 -4.379 8.124 10.877 418 H GLY 619 H GLY 619 -5.600 12.079 7.523 419 1HA GLY 619 1HA GLY 619 -6.341 13.736 9.715 420 2HA GLY 619 2HA GLY 619 -4.857 13.916 8.778 421 H SER 620 H SER 620 -3.106 12.256 9.362 422 HA SER 620 HA SER 620 -2.827 12.234 12.290 423 1HB SER 620 1HB SER 620 -2.845 9.670 10.671 424 2HB SER 620 2HB SER 620 -2.307 9.791 12.343 425 HG SER 620 HG SER 620 -4.420 10.615 12.827 426 H GLY 621 H GLY 621 -1.477 11.258 9.144 427 1HA GLY 621 1HA GLY 621 1.256 11.177 10.120 428 2HA GLY 621 2HA GLY 621 0.897 12.694 9.294 429 H ASN 622 H ASN 622 2.803 11.025 8.200 430 HA ASN 622 HA ASN 622 1.392 10.035 5.761 431 1HB ASN 622 1HB ASN 622 4.309 10.806 6.078 432 2HB ASN 622 2HB ASN 622 3.477 10.430 4.569 433 2HD2 ASN 622 2HD2 ASN 622 1.506 11.924 4.099 434 1HD2 ASN 622 1HD2 ASN 622 1.664 13.558 4.532 435 H SER 623 H SER 623 3.391 9.095 8.428 436 HA SER 623 HA SER 623 4.319 6.613 7.176 437 1HB SER 623 1HB SER 623 5.295 6.125 9.350 438 2HB SER 623 2HB SER 623 5.623 7.809 8.951 439 HG SER 623 HG SER 623 4.805 7.428 11.115 440 H PHE 624 H PHE 624 3.047 4.839 6.993 441 HA PHE 624 HA PHE 624 1.013 4.331 9.110 442 1HB PHE 624 1HB PHE 624 -0.623 3.673 7.361 443 2HB PHE 624 2HB PHE 624 -0.186 5.377 7.242 444 HD1 PHE 624 HD1 PHE 624 2.006 5.814 5.739 445 HD2 PHE 624 HD2 PHE 624 -0.621 2.434 5.391 446 HE1 PHE 624 HE1 PHE 624 2.775 5.456 3.408 447 HE2 PHE 624 HE2 PHE 624 0.147 2.077 3.060 448 HZ PHE 624 HZ PHE 624 1.846 3.588 2.070 449 H GLY 625 H GLY 625 0.733 2.140 9.572 450 1HA GLY 625 1HA GLY 625 2.028 0.070 9.820 451 2HA GLY 625 2HA GLY 625 2.629 0.305 8.177 452 H VAL 626 H VAL 626 1.846 -1.567 7.204 453 HA VAL 626 HA VAL 626 -1.075 -2.116 7.473 454 HB VAL 626 HB VAL 626 0.520 -1.867 4.911 455 1HG1 VAL 626 1HG1 VAL 626 -2.120 -3.195 5.504 456 2HG1 VAL 626 2HG1 VAL 626 -1.805 -2.490 3.919 457 3HG1 VAL 626 3HG1 VAL 626 -0.781 -3.792 4.523 458 1HG2 VAL 626 1HG2 VAL 626 -1.228 -0.133 6.383 459 2HG2 VAL 626 2HG2 VAL 626 -0.429 0.175 4.842 460 3HG2 VAL 626 3HG2 VAL 626 -2.024 -0.577 4.874 461 H THR 627 H THR 627 -1.515 -4.265 7.732 462 HA THR 627 HA THR 627 0.779 -6.144 7.621 463 HB THR 627 HB THR 627 -2.011 -6.410 8.780 464 HG1 THR 627 HG1 THR 627 -1.071 -5.612 10.456 465 1HG2 THR 627 1HG2 THR 627 -0.131 -8.426 7.975 466 2HG2 THR 627 2HG2 THR 627 -0.253 -8.422 9.734 467 3HG2 THR 627 3HG2 THR 627 -1.702 -8.634 8.750 468 H PHE 628 H PHE 628 0.737 -8.005 6.300 469 HA PHE 628 HA PHE 628 -1.536 -8.144 4.359 470 1HB PHE 628 1HB PHE 628 1.400 -8.602 3.748 471 2HB PHE 628 2HB PHE 628 0.071 -8.746 2.599 472 HD1 PHE 628 HD1 PHE 628 -1.271 -6.724 1.980 473 HD2 PHE 628 HD2 PHE 628 2.290 -6.465 4.366 474 HE1 PHE 628 HE1 PHE 628 -1.138 -4.291 1.516 475 HE2 PHE 628 HE2 PHE 628 2.423 -4.032 3.904 476 HZ PHE 628 HZ PHE 628 0.710 -2.946 2.478 477 H TYR 629 H TYR 629 -2.203 -10.238 3.795 478 HA TYR 629 HA TYR 629 -1.160 -12.385 5.566 479 1HB TYR 629 1HB TYR 629 -3.721 -11.897 4.098 480 2HB TYR 629 2HB TYR 629 -3.251 -13.567 4.413 481 HD1 TYR 629 HD1 TYR 629 -2.318 -13.969 6.902 482 HD2 TYR 629 HD2 TYR 629 -4.986 -10.815 5.724 483 HE1 TYR 629 HE1 TYR 629 -3.089 -13.746 9.248 484 HE2 TYR 629 HE2 TYR 629 -5.758 -10.593 8.071 485 HH TYR 629 HH TYR 629 -5.433 -12.804 10.328 486 H LYS 630 H LYS 630 -0.086 -14.153 4.740 487 HA LYS 630 HA LYS 630 -0.067 -14.534 1.788 488 1HB LYS 630 1HB LYS 630 2.425 -14.895 1.916 489 2HB LYS 630 2HB LYS 630 1.927 -13.228 2.208 490 1HG LYS 630 1HG LYS 630 2.021 -13.652 4.656 491 2HG LYS 630 2HG LYS 630 2.592 -15.289 4.331 492 1HD LYS 630 1HD LYS 630 4.566 -14.388 3.174 493 2HD LYS 630 2HD LYS 630 3.992 -12.745 3.458 494 1HE LYS 630 1HE LYS 630 4.461 -12.825 5.726 495 2HE LYS 630 2HE LYS 630 4.280 -14.577 5.808 496 1HZ LYS 630 1HZ LYS 630 6.350 -14.300 4.120 497 2HZ LYS 630 2HZ LYS 630 6.607 -12.993 5.176 498 3HZ LYS 630 3HZ LYS 630 6.501 -14.570 5.790 499 H ASN 631 H ASN 631 0.818 -15.819 4.984 500 HA ASN 631 HA ASN 631 0.581 -18.015 5.801 501 1HB ASN 631 1HB ASN 631 -0.442 -18.843 3.085 502 2HB ASN 631 2HB ASN 631 -0.810 -19.549 4.659 503 2HD2 ASN 631 2HD2 ASN 631 -2.564 -18.171 2.483 504 1HD2 ASN 631 1HD2 ASN 631 -3.471 -17.042 3.368 505 H GLY 632 H GLY 632 2.590 -16.962 3.427 506 1HA GLY 632 1HA GLY 632 3.815 -19.580 2.811 507 2HA GLY 632 2HA GLY 632 4.776 -18.481 3.799 508 H SER 633 H SER 633 5.216 -16.307 2.835 509 HA SER 633 HA SER 633 5.586 -16.570 -0.108 510 1HB SER 633 1HB SER 633 4.415 -14.169 1.324 511 2HB SER 633 2HB SER 633 4.952 -14.155 -0.354 512 HG SER 633 HG SER 633 3.389 -15.644 -0.850 513 H SER 634 H SER 634 7.460 -15.493 -0.882 514 HA SER 634 HA SER 634 9.289 -14.539 1.281 515 1HB SER 634 1HB SER 634 9.732 -16.591 -0.443 516 2HB SER 634 2HB SER 634 10.410 -15.255 -1.369 517 HG SER 634 HG SER 634 11.404 -14.747 0.837 518 H ALA 635 H ALA 635 7.427 -13.481 -1.309 519 HA ALA 635 HA ALA 635 9.276 -11.334 -2.132 520 1HB ALA 635 1HB ALA 635 6.373 -11.616 -2.922 521 2HB ALA 635 2HB ALA 635 7.664 -10.793 -3.796 522 3HB ALA 635 3HB ALA 635 7.647 -12.554 -3.701 523 H THR 636 H THR 636 9.174 -9.257 -1.357 524 HA THR 636 HA THR 636 7.291 -8.740 0.856 525 HB THR 636 HB THR 636 9.639 -7.173 -0.243 526 HG1 THR 636 HG1 THR 636 9.192 -8.979 1.820 527 1HG2 THR 636 1HG2 THR 636 7.764 -5.753 0.713 528 2HG2 THR 636 2HG2 THR 636 8.035 -6.573 2.250 529 3HG2 THR 636 3HG2 THR 636 9.317 -5.597 1.534 530 HA PRO 637 HA PRO 637 4.647 -6.365 -1.788 531 1HB PRO 637 1HB PRO 637 3.114 -5.254 0.206 532 2HB PRO 637 2HB PRO 637 2.939 -6.932 -0.341 533 1HG PRO 637 1HG PRO 637 4.151 -5.899 2.173 534 2HG PRO 637 2HG PRO 637 3.437 -7.485 1.842 535 1HD PRO 637 1HD PRO 637 6.213 -6.875 1.939 536 2HD PRO 637 2HD PRO 637 5.485 -8.391 1.361 537 H GLY 638 H GLY 638 3.920 -3.965 -1.941 538 1HA GLY 638 1HA GLY 638 6.046 -2.209 -2.075 539 2HA GLY 638 2HA GLY 638 5.467 -2.019 -0.423 540 H ALA 639 H ALA 639 4.894 0.187 -0.993 541 HA ALA 639 HA ALA 639 2.153 0.401 -2.002 542 1HB ALA 639 1HB ALA 639 3.580 1.799 -0.130 543 2HB ALA 639 2HB ALA 639 2.108 2.393 -0.899 544 3HB ALA 639 3HB ALA 639 3.686 2.879 -1.521 545 H THR 640 H THR 640 1.864 2.479 -3.502 546 HA THR 640 HA THR 640 3.902 2.301 -5.679 547 HB THR 640 HB THR 640 1.075 2.762 -6.386 548 HG1 THR 640 HG1 THR 640 2.159 0.204 -5.815 549 1HG2 THR 640 1HG2 THR 640 3.513 1.509 -7.605 550 2HG2 THR 640 2HG2 THR 640 1.917 1.155 -8.264 551 3HG2 THR 640 3HG2 THR 640 2.508 2.815 -8.231 552 H CYS 641 H CYS 641 4.383 4.144 -6.694 553 HA CYS 641 HA CYS 641 2.784 6.570 -6.544 554 1HB CYS 641 1HB CYS 641 5.123 6.163 -4.753 555 2HB CYS 641 2HB CYS 641 5.027 7.725 -5.559 556 H ALA 642 H ALA 642 3.154 5.771 -8.872 557 HA ALA 642 HA ALA 642 5.553 7.183 -9.942 558 1HB ALA 642 1HB ALA 642 4.868 4.895 -11.580 559 2HB ALA 642 2HB ALA 642 6.421 5.312 -10.852 560 3HB ALA 642 3HB ALA 642 5.238 4.382 -9.932 561 H THR 643 H THR 643 5.265 7.545 -12.377 562 HA THR 643 HA THR 643 2.371 8.032 -12.950 563 HB THR 643 HB THR 643 3.024 9.958 -14.251 564 HG1 THR 643 HG1 THR 643 5.534 8.813 -13.916 565 1HG2 THR 643 1HG2 THR 643 4.291 9.767 -11.519 566 2HG2 THR 643 2HG2 THR 643 4.286 11.272 -12.438 567 3HG2 THR 643 3HG2 THR 643 2.762 10.525 -11.961 568 H GLY 644 H GLY 644 1.799 6.375 -14.269 569 1HA GLY 644 1HA GLY 644 1.798 4.937 -16.126 570 2HA GLY 644 2HA GLY 644 3.560 5.024 -16.080 No H/Q in entry = 570 Start of MODEL 3 1 H1 THR 557 H1 THR 557 11.179 13.576 -15.561 2 H2 THR 557 H2 THR 557 11.431 15.093 -14.844 3 H3 THR 557 H3 THR 557 12.748 14.222 -15.470 4 HA THR 557 HA THR 557 12.536 12.545 -13.798 5 HB THR 557 HB THR 557 12.301 14.652 -11.878 6 HG1 THR 557 HG1 THR 557 13.725 16.136 -12.884 7 1HG2 THR 557 1HG2 THR 557 13.889 12.697 -11.938 8 2HG2 THR 557 2HG2 THR 557 14.783 13.538 -13.206 9 3HG2 THR 557 3HG2 THR 557 14.662 14.243 -11.595 10 H GLY 558 H GLY 558 11.476 13.058 -11.206 11 1HA GLY 558 1HA GLY 558 8.581 12.577 -11.759 12 2HA GLY 558 2HA GLY 558 9.062 13.682 -10.470 13 H SER 559 H SER 559 9.181 12.764 -8.482 14 HA SER 559 HA SER 559 9.192 9.813 -8.279 15 1HB SER 559 1HB SER 559 11.288 11.590 -7.002 16 2HB SER 559 2HB SER 559 11.017 9.909 -6.551 17 HG SER 559 HG SER 559 12.141 11.006 -8.844 18 H CYS 560 H CYS 560 8.621 9.113 -6.053 19 HA CYS 560 HA CYS 560 7.076 11.241 -4.624 20 1HB CYS 560 1HB CYS 560 5.487 9.552 -3.974 21 2HB CYS 560 2HB CYS 560 5.748 9.369 -5.708 22 H SER 561 H SER 561 6.929 10.906 -2.235 23 HA SER 561 HA SER 561 9.494 9.817 -1.215 24 1HB SER 561 1HB SER 561 7.557 11.873 -0.293 25 2HB SER 561 2HB SER 561 8.461 11.000 0.936 26 HG SER 561 HG SER 561 9.510 12.459 -1.265 27 H VAL 562 H VAL 562 7.331 8.226 -2.019 28 HA VAL 562 HA VAL 562 6.224 7.093 0.490 29 HB VAL 562 HB VAL 562 5.672 6.000 -2.258 30 1HG1 VAL 562 1HG1 VAL 562 4.730 5.547 0.385 31 2HG1 VAL 562 2HG1 VAL 562 3.409 6.286 -0.520 32 3HG1 VAL 562 3HG1 VAL 562 4.160 4.804 -1.108 33 1HG2 VAL 562 1HG2 VAL 562 5.192 8.711 -1.417 34 2HG2 VAL 562 2HG2 VAL 562 4.753 7.942 -2.943 35 3HG2 VAL 562 3HG2 VAL 562 3.649 7.871 -1.570 36 H SER 563 H SER 563 7.387 5.505 1.462 37 HA SER 563 HA SER 563 9.023 3.714 -0.291 38 1HB SER 563 1HB SER 563 9.854 3.999 2.530 39 2HB SER 563 2HB SER 563 10.836 3.940 1.069 40 HG SER 563 HG SER 563 10.746 6.048 0.930 41 H ALA 564 H ALA 564 9.442 1.546 0.805 42 HA ALA 564 HA ALA 564 7.161 0.765 2.567 43 1HB ALA 564 1HB ALA 564 6.707 0.103 0.200 44 2HB ALA 564 2HB ALA 564 8.191 -0.849 0.214 45 3HB ALA 564 3HB ALA 564 6.855 -1.285 1.279 46 H VAL 565 H VAL 565 8.545 0.650 4.384 47 HA VAL 565 HA VAL 565 11.037 -0.877 4.273 48 HB VAL 565 HB VAL 565 9.637 -0.202 6.838 49 1HG1 VAL 565 1HG1 VAL 565 12.509 -0.152 5.857 50 2HG1 VAL 565 2HG1 VAL 565 12.005 0.341 7.473 51 3HG1 VAL 565 3HG1 VAL 565 11.790 -1.330 6.955 52 1HG2 VAL 565 1HG2 VAL 565 10.680 1.707 4.772 53 2HG2 VAL 565 2HG2 VAL 565 9.297 1.881 5.853 54 3HG2 VAL 565 3HG2 VAL 565 10.936 2.086 6.476 55 H ARG 566 H ARG 566 11.363 -2.806 5.688 56 HA ARG 566 HA ARG 566 9.110 -4.676 5.409 57 1HB ARG 566 1HB ARG 566 11.935 -5.005 6.469 58 2HB ARG 566 2HB ARG 566 10.764 -6.321 6.376 59 1HG ARG 566 1HG ARG 566 10.629 -5.210 3.849 60 2HG ARG 566 2HG ARG 566 12.344 -5.079 4.240 61 1HD ARG 566 1HD ARG 566 12.656 -7.323 4.134 62 2HD ARG 566 2HD ARG 566 11.158 -7.660 5.001 63 HE ARG 566 HE ARG 566 10.147 -8.020 2.911 64 1HH1 ARG 566 1HH1 ARG 566 10.526 -5.202 1.960 65 2HH1 ARG 566 2HH1 ARG 566 11.482 -5.427 0.533 66 1HH2 ARG 566 1HH2 ARG 566 12.414 -8.665 1.348 67 2HH2 ARG 566 2HH2 ARG 566 12.550 -7.389 0.186 68 H GLY 567 H GLY 567 8.055 -3.001 6.982 69 1HA GLY 567 1HA GLY 567 6.857 -2.967 9.001 70 2HA GLY 567 2HA GLY 567 8.466 -2.603 9.627 71 H GLU 568 H GLU 568 7.848 -3.758 11.592 72 HA GLU 568 HA GLU 568 8.907 -6.253 11.987 73 1HB GLU 568 1HB GLU 568 6.602 -4.852 13.297 74 2HB GLU 568 2HB GLU 568 6.979 -6.509 13.769 75 1HG GLU 568 1HG GLU 568 9.340 -5.808 14.191 76 2HG GLU 568 2HG GLU 568 8.876 -4.144 13.835 77 H GLU 569 H GLU 569 7.921 -8.411 12.250 78 HA GLU 569 HA GLU 569 5.427 -8.885 10.727 79 1HB GLU 569 1HB GLU 569 7.782 -10.610 10.047 80 2HB GLU 569 2HB GLU 569 6.362 -10.225 9.075 81 1HG GLU 569 1HG GLU 569 8.055 -8.971 8.037 82 2HG GLU 569 2HG GLU 569 7.293 -7.790 9.103 83 H TRP 570 H TRP 570 5.623 -11.686 10.629 84 HA TRP 570 HA TRP 570 6.201 -12.511 13.426 85 1HB TRP 570 1HB TRP 570 3.530 -12.711 12.023 86 2HB TRP 570 2HB TRP 570 3.950 -13.746 13.388 87 HD1 TRP 570 HD1 TRP 570 4.398 -12.549 15.751 88 HE1 TRP 570 HE1 TRP 570 3.549 -10.306 16.698 89 HE3 TRP 570 HE3 TRP 570 2.862 -10.293 11.433 90 HZ2 TRP 570 HZ2 TRP 570 2.374 -7.877 15.749 91 HZ3 TRP 570 HZ3 TRP 570 1.882 -8.017 11.484 92 HH2 TRP 570 HH2 TRP 570 1.637 -6.807 13.635 93 H ALA 571 H ALA 571 4.226 -14.480 11.331 94 HA ALA 571 HA ALA 571 6.616 -16.018 10.452 95 1HB ALA 571 1HB ALA 571 4.902 -18.044 11.038 96 2HB ALA 571 2HB ALA 571 4.482 -16.900 12.312 97 3HB ALA 571 3HB ALA 571 6.143 -17.471 12.154 98 H ASP 572 H ASP 572 3.091 -16.611 10.353 99 HA ASP 572 HA ASP 572 3.257 -17.205 7.493 100 1HB ASP 572 1HB ASP 572 0.867 -17.671 7.665 101 2HB ASP 572 2HB ASP 572 1.695 -18.411 9.036 102 H ARG 573 H ARG 573 2.066 -14.579 9.541 103 HA ARG 573 HA ARG 573 1.484 -13.008 7.074 104 1HB ARG 573 1HB ARG 573 -0.043 -11.692 8.352 105 2HB ARG 573 2HB ARG 573 -0.374 -13.371 8.783 106 1HG ARG 573 1HG ARG 573 0.994 -13.164 10.783 107 2HG ARG 573 2HG ARG 573 1.443 -11.521 10.334 108 1HD ARG 573 1HD ARG 573 -0.799 -10.727 10.636 109 2HD ARG 573 2HD ARG 573 -1.431 -12.369 10.759 110 HE ARG 573 HE ARG 573 0.518 -11.896 12.825 111 1HH1 ARG 573 1HH1 ARG 573 -2.405 -13.066 12.799 112 2HH1 ARG 573 2HH1 ARG 573 -3.137 -12.017 13.967 113 1HH2 ARG 573 1HH2 ARG 573 -0.546 -9.714 13.916 114 2HH2 ARG 573 2HH2 ARG 573 -2.085 -10.119 14.599 115 H PHE 574 H PHE 574 2.355 -10.866 6.934 116 HA PHE 574 HA PHE 574 4.451 -10.242 8.970 117 1HB PHE 574 1HB PHE 574 5.990 -9.581 7.241 118 2HB PHE 574 2HB PHE 574 5.400 -11.188 6.816 119 HD1 PHE 574 HD1 PHE 574 3.240 -11.249 5.306 120 HD2 PHE 574 HD2 PHE 574 5.874 -7.872 5.651 121 HE1 PHE 574 HE1 PHE 574 2.397 -10.370 3.147 122 HE2 PHE 574 HE2 PHE 574 5.031 -6.995 3.491 123 HZ PHE 574 HZ PHE 574 3.292 -8.243 2.238 124 H ASN 575 H ASN 575 4.888 -7.960 9.210 125 HA ASN 575 HA ASN 575 2.605 -6.262 8.300 126 1HB ASN 575 1HB ASN 575 3.351 -6.666 10.838 127 2HB ASN 575 2HB ASN 575 4.474 -5.363 10.447 128 2HD2 ASN 575 2HD2 ASN 575 2.843 -4.393 12.233 129 1HD2 ASN 575 1HD2 ASN 575 1.525 -3.538 11.591 130 H VAL 576 H VAL 576 3.327 -3.857 8.093 131 HA VAL 576 HA VAL 576 6.099 -3.553 7.119 132 HB VAL 576 HB VAL 576 3.879 -2.696 5.287 133 1HG1 VAL 576 1HG1 VAL 576 6.254 -1.903 5.021 134 2HG1 VAL 576 2HG1 VAL 576 6.720 -3.580 4.741 135 3HG1 VAL 576 3HG1 VAL 576 5.623 -2.771 3.622 136 1HG2 VAL 576 1HG2 VAL 576 3.646 -5.163 5.791 137 2HG2 VAL 576 2HG2 VAL 576 4.001 -4.802 4.101 138 3HG2 VAL 576 3HG2 VAL 576 5.282 -5.380 5.166 139 H THR 577 H THR 577 6.646 -1.292 6.788 140 HA THR 577 HA THR 577 4.715 0.613 8.040 141 HB THR 577 HB THR 577 7.718 0.618 8.465 142 HG1 THR 577 HG1 THR 577 7.375 -0.550 10.183 143 1HG2 THR 577 1HG2 THR 577 5.786 2.624 8.769 144 2HG2 THR 577 2HG2 THR 577 6.060 2.009 10.400 145 3HG2 THR 577 3HG2 THR 577 7.413 2.620 9.449 146 H TYR 578 H TYR 578 4.122 1.533 6.042 147 HA TYR 578 HA TYR 578 6.157 2.370 4.119 148 1HB TYR 578 1HB TYR 578 3.193 3.000 4.266 149 2HB TYR 578 2HB TYR 578 4.241 3.338 2.889 150 HD1 TYR 578 HD1 TYR 578 5.195 1.500 1.545 151 HD2 TYR 578 HD2 TYR 578 2.473 0.740 4.780 152 HE1 TYR 578 HE1 TYR 578 4.846 -0.810 0.710 153 HE2 TYR 578 HE2 TYR 578 2.125 -1.569 3.945 154 HH TYR 578 HH TYR 578 4.133 -3.016 1.656 155 H SER 579 H SER 579 7.014 4.422 3.898 156 HA SER 579 HA SER 579 6.049 6.482 5.844 157 1HB SER 579 1HB SER 579 8.865 6.339 4.766 158 2HB SER 579 2HB SER 579 8.278 7.212 6.179 159 HG SER 579 HG SER 579 9.295 5.312 6.828 160 H VAL 580 H VAL 580 5.169 8.206 4.840 161 HA VAL 580 HA VAL 580 5.979 8.775 2.025 162 HB VAL 580 HB VAL 580 3.421 9.090 3.560 163 1HG1 VAL 580 1HG1 VAL 580 3.994 11.362 2.634 164 2HG1 VAL 580 2HG1 VAL 580 4.033 10.637 1.027 165 3HG1 VAL 580 3HG1 VAL 580 2.529 10.658 1.949 166 1HG2 VAL 580 1HG2 VAL 580 4.309 8.023 0.884 167 2HG2 VAL 580 2HG2 VAL 580 3.521 7.162 2.206 168 3HG2 VAL 580 3HG2 VAL 580 2.606 8.317 1.237 169 H SER 581 H SER 581 6.682 10.860 1.493 170 HA SER 581 HA SER 581 6.537 13.020 3.475 171 1HB SER 581 1HB SER 581 9.324 12.563 2.626 172 2HB SER 581 2HB SER 581 8.692 13.033 4.200 173 HG SER 581 HG SER 581 8.783 10.445 3.042 174 H GLY 582 H GLY 582 5.352 13.163 1.106 175 1HA GLY 582 1HA GLY 582 7.089 14.127 -1.021 176 2HA GLY 582 2HA GLY 582 6.268 15.438 -0.171 177 H SER 583 H SER 583 4.807 12.272 -0.545 178 HA SER 583 HA SER 583 3.391 12.650 -2.963 179 1HB SER 583 1HB SER 583 2.250 11.244 -0.543 180 2HB SER 583 2HB SER 583 1.951 10.889 -2.243 181 HG SER 583 HG SER 583 4.231 10.385 -2.373 182 H SER 584 H SER 584 2.420 13.481 0.374 183 HA SER 584 HA SER 584 0.977 15.198 1.100 184 1HB SER 584 1HB SER 584 1.756 16.024 -1.516 185 2HB SER 584 2HB SER 584 0.016 16.263 -1.381 186 HG SER 584 HG SER 584 0.994 18.068 -0.552 187 H SER 585 H SER 585 -0.565 14.622 -2.047 188 HA SER 585 HA SER 585 -3.056 13.891 -0.702 189 1HB SER 585 1HB SER 585 -2.392 14.971 -3.190 190 2HB SER 585 2HB SER 585 -2.972 13.351 -3.565 191 HG SER 585 HG SER 585 -4.798 13.877 -2.182 192 H TRP 586 H TRP 586 -3.370 11.848 0.040 193 HA TRP 586 HA TRP 586 -1.701 9.641 -0.772 194 1HB TRP 586 1HB TRP 586 -4.043 10.004 1.019 195 2HB TRP 586 2HB TRP 586 -3.757 8.376 0.403 196 HD1 TRP 586 HD1 TRP 586 -2.680 10.651 3.086 197 HE1 TRP 586 HE1 TRP 586 -0.559 9.733 4.236 198 HE3 TRP 586 HE3 TRP 586 -1.311 7.061 -0.266 199 HZ2 TRP 586 HZ2 TRP 586 1.429 7.762 3.814 200 HZ3 TRP 586 HZ3 TRP 586 0.703 5.669 0.135 201 HH2 TRP 586 HH2 TRP 586 2.075 6.013 2.169 202 H VAL 587 H VAL 587 -1.875 8.509 -2.585 203 HA VAL 587 HA VAL 587 -4.458 7.637 -3.607 204 HB VAL 587 HB VAL 587 -4.240 9.940 -4.533 205 1HG1 VAL 587 1HG1 VAL 587 -1.645 8.776 -5.489 206 2HG1 VAL 587 2HG1 VAL 587 -2.443 10.021 -6.449 207 3HG1 VAL 587 3HG1 VAL 587 -1.964 10.362 -4.786 208 1HG2 VAL 587 1HG2 VAL 587 -5.000 7.627 -5.807 209 2HG2 VAL 587 2HG2 VAL 587 -5.225 9.248 -6.468 210 3HG2 VAL 587 3HG2 VAL 587 -3.823 8.290 -6.943 211 H VAL 588 H VAL 588 -1.921 6.485 -2.643 212 HA VAL 588 HA VAL 588 -0.518 5.440 -4.984 213 HB VAL 588 HB VAL 588 0.752 5.623 -2.923 214 1HG1 VAL 588 1HG1 VAL 588 -1.569 4.033 -1.827 215 2HG1 VAL 588 2HG1 VAL 588 -0.013 4.070 -0.997 216 3HG1 VAL 588 3HG1 VAL 588 -0.916 5.563 -1.243 217 1HG2 VAL 588 1HG2 VAL 588 0.608 3.313 -4.452 218 2HG2 VAL 588 2HG2 VAL 588 1.814 3.610 -3.194 219 3HG2 VAL 588 3HG2 VAL 588 0.353 2.694 -2.816 220 H THR 589 H THR 589 -0.610 3.305 -5.722 221 HA THR 589 HA THR 589 -3.046 1.819 -4.866 222 HB THR 589 HB THR 589 -2.396 0.692 -7.267 223 HG1 THR 589 HG1 THR 589 -1.731 2.304 -8.629 224 1HG2 THR 589 1HG2 THR 589 -4.538 1.916 -6.275 225 2HG2 THR 589 2HG2 THR 589 -3.991 3.218 -7.331 226 3HG2 THR 589 3HG2 THR 589 -4.372 1.634 -8.008 227 H LEU 590 H LEU 590 -2.513 0.111 -3.615 228 HA LEU 590 HA LEU 590 0.206 -0.973 -3.639 229 1HB LEU 590 1HB LEU 590 -2.285 -1.478 -2.034 230 2HB LEU 590 2HB LEU 590 -0.952 -2.631 -1.969 231 HG LEU 590 HG LEU 590 0.531 -0.528 -1.549 232 1HD1 LEU 590 1HD1 LEU 590 -2.261 0.480 -0.969 233 2HD1 LEU 590 2HD1 LEU 590 -0.827 1.201 -0.239 234 3HD1 LEU 590 3HD1 LEU 590 -1.031 1.224 -1.991 235 1HD2 LEU 590 1HD2 LEU 590 -0.155 -2.388 0.084 236 2HD2 LEU 590 2HD2 LEU 590 0.300 -0.845 0.806 237 3HD2 LEU 590 3HD2 LEU 590 -1.402 -1.279 0.654 238 H GLY 591 H GLY 591 0.858 -2.714 -4.812 239 1HA GLY 591 1HA GLY 591 0.465 -4.149 -6.744 240 2HA GLY 591 2HA GLY 591 -1.236 -4.241 -6.286 241 H LEU 592 H LEU 592 -1.825 -5.660 -4.540 242 HA LEU 592 HA LEU 592 0.172 -7.222 -3.134 243 1HB LEU 592 1HB LEU 592 -2.806 -7.089 -3.265 244 2HB LEU 592 2HB LEU 592 -2.083 -8.579 -2.670 245 HG LEU 592 HG LEU 592 -0.812 -7.323 -0.989 246 1HD1 LEU 592 1HD1 LEU 592 -0.572 -5.249 -2.359 247 2HD1 LEU 592 2HD1 LEU 592 -2.274 -4.892 -2.065 248 3HD1 LEU 592 3HD1 LEU 592 -1.133 -4.917 -0.721 249 1HD2 LEU 592 1HD2 LEU 592 -3.787 -6.779 -1.124 250 2HD2 LEU 592 2HD2 LEU 592 -2.960 -8.054 -0.228 251 3HD2 LEU 592 3HD2 LEU 592 -2.814 -6.375 0.290 252 H ASN 593 H ASN 593 1.203 -8.966 -3.983 253 HA ASN 593 HA ASN 593 -0.101 -10.379 -6.273 254 1HB ASN 593 1HB ASN 593 2.838 -10.428 -5.544 255 2HB ASN 593 2HB ASN 593 2.094 -10.966 -7.050 256 2HD2 ASN 593 2HD2 ASN 593 3.542 -8.272 -5.491 257 1HD2 ASN 593 1HD2 ASN 593 3.121 -7.093 -6.636 258 H GLY 594 H GLY 594 -0.426 -12.588 -6.108 259 1HA GLY 594 1HA GLY 594 0.777 -14.029 -3.808 260 2HA GLY 594 2HA GLY 594 -0.004 -14.786 -5.197 261 H GLY 595 H GLY 595 -2.325 -12.949 -5.064 262 1HA GLY 595 1HA GLY 595 -4.045 -14.490 -3.412 263 2HA GLY 595 2HA GLY 595 -4.438 -12.891 -4.046 264 H GLN 596 H GLN 596 -1.871 -11.932 -2.616 265 HA GLN 596 HA GLN 596 -2.030 -12.280 0.163 266 1HB GLN 596 1HB GLN 596 -1.440 -9.643 -1.208 267 2HB GLN 596 2HB GLN 596 -0.862 -10.177 0.371 268 1HG GLN 596 1HG GLN 596 -0.200 -12.133 -1.658 269 2HG GLN 596 2HG GLN 596 0.419 -10.544 -2.109 270 2HE2 GLN 596 2HE2 GLN 596 2.132 -9.640 -0.833 271 1HE2 GLN 596 1HE2 GLN 596 2.877 -10.485 0.435 272 H SER 597 H SER 597 -3.042 -10.938 1.824 273 HA SER 597 HA SER 597 -5.363 -9.320 0.914 274 1HB SER 597 1HB SER 597 -5.974 -11.016 3.231 275 2HB SER 597 2HB SER 597 -6.945 -10.680 1.800 276 HG SER 597 HG SER 597 -5.749 -12.892 2.316 277 H VAL 598 H VAL 598 -6.095 -7.813 2.549 278 HA VAL 598 HA VAL 598 -3.934 -6.961 4.333 279 HB VAL 598 HB VAL 598 -6.729 -5.844 3.953 280 1HG1 VAL 598 1HG1 VAL 598 -4.246 -4.695 5.265 281 2HG1 VAL 598 2HG1 VAL 598 -5.744 -3.807 4.982 282 3HG1 VAL 598 3HG1 VAL 598 -5.726 -5.178 6.092 283 1HG2 VAL 598 1HG2 VAL 598 -4.851 -5.929 2.037 284 2HG2 VAL 598 2HG2 VAL 598 -5.902 -4.528 2.248 285 3HG2 VAL 598 3HG2 VAL 598 -4.268 -4.513 2.913 286 H GLN 599 H GLN 599 -3.941 -7.107 6.576 287 HA GLN 599 HA GLN 599 -6.143 -8.750 7.751 288 1HB GLN 599 1HB GLN 599 -3.957 -9.825 7.914 289 2HB GLN 599 2HB GLN 599 -3.270 -8.375 8.646 290 1HG GLN 599 1HG GLN 599 -5.150 -8.670 10.428 291 2HG GLN 599 2HG GLN 599 -5.240 -10.323 9.821 292 2HE2 GLN 599 2HE2 GLN 599 -2.630 -7.989 10.740 293 1HE2 GLN 599 1HE2 GLN 599 -1.706 -9.139 11.581 294 H SER 600 H SER 600 -4.035 -5.943 8.351 295 HA SER 600 HA SER 600 -6.157 -4.486 9.655 296 1HB SER 600 1HB SER 600 -4.359 -4.539 11.795 297 2HB SER 600 2HB SER 600 -5.942 -5.308 11.743 298 HG SER 600 HG SER 600 -4.599 -6.964 12.119 299 H SER 601 H SER 601 -5.378 -2.335 10.379 300 HA SER 601 HA SER 601 -2.606 -1.598 9.795 301 1HB SER 601 1HB SER 601 -4.609 -0.096 8.164 302 2HB SER 601 2HB SER 601 -2.903 -0.397 7.843 303 HG SER 601 HG SER 601 -4.563 -1.606 6.576 304 H TRP 602 H TRP 602 -2.277 0.778 10.229 305 HA TRP 602 HA TRP 602 -4.466 2.137 11.654 306 1HB TRP 602 1HB TRP 602 -3.291 2.338 13.757 307 2HB TRP 602 2HB TRP 602 -3.368 0.625 13.348 308 HD1 TRP 602 HD1 TRP 602 -0.968 3.342 14.144 309 HE1 TRP 602 HE1 TRP 602 1.445 2.522 13.838 310 HE3 TRP 602 HE3 TRP 602 -1.838 -1.052 11.692 311 HZ2 TRP 602 HZ2 TRP 602 2.838 0.292 12.702 312 HZ3 TRP 602 HZ3 TRP 602 0.051 -2.504 11.010 313 HH2 TRP 602 HH2 TRP 602 2.386 -1.837 11.512 314 H ASN 603 H ASN 603 -3.619 4.346 12.464 315 HA ASN 603 HA ASN 603 -2.395 6.329 12.088 316 1HB ASN 603 1HB ASN 603 -0.506 4.363 11.652 317 2HB ASN 603 2HB ASN 603 -0.521 5.227 10.114 318 2HD2 ASN 603 2HD2 ASN 603 1.707 5.359 11.964 319 1HD2 ASN 603 1HD2 ASN 603 1.816 6.957 12.525 320 H ALA 604 H ALA 604 -4.377 4.812 10.137 321 HA ALA 604 HA ALA 604 -5.028 6.908 8.442 322 1HB ALA 604 1HB ALA 604 -2.605 5.497 7.555 323 2HB ALA 604 2HB ALA 604 -3.231 7.071 7.064 324 3HB ALA 604 3HB ALA 604 -3.853 5.601 6.314 325 H ALA 605 H ALA 605 -6.219 6.060 6.370 326 HA ALA 605 HA ALA 605 -7.394 3.380 7.006 327 1HB ALA 605 1HB ALA 605 -8.847 5.491 7.395 328 2HB ALA 605 2HB ALA 605 -8.911 5.599 5.636 329 3HB ALA 605 3HB ALA 605 -9.551 4.174 6.455 330 H LEU 606 H LEU 606 -7.633 1.973 5.264 331 HA LEU 606 HA LEU 606 -6.631 2.993 2.637 332 1HB LEU 606 1HB LEU 606 -6.350 0.319 4.005 333 2HB LEU 606 2HB LEU 606 -6.147 0.477 2.259 334 HG LEU 606 HG LEU 606 -4.531 2.437 2.862 335 1HD1 LEU 606 1HD1 LEU 606 -5.275 2.278 5.326 336 2HD1 LEU 606 2HD1 LEU 606 -4.270 0.830 5.413 337 3HD1 LEU 606 3HD1 LEU 606 -3.541 2.389 5.025 338 1HD2 LEU 606 1HD2 LEU 606 -4.000 -0.519 3.175 339 2HD2 LEU 606 2HD2 LEU 606 -3.564 0.543 1.837 340 3HD2 LEU 606 3HD2 LEU 606 -2.694 0.649 3.366 341 H THR 607 H THR 607 -7.593 1.868 0.720 342 HA THR 607 HA THR 607 -10.426 1.070 1.265 343 HB THR 607 HB THR 607 -9.343 2.513 -1.175 344 HG1 THR 607 HG1 THR 607 -9.411 4.040 0.322 345 1HG2 THR 607 1HG2 THR 607 -12.159 1.811 -0.304 346 2HG2 THR 607 2HG2 THR 607 -11.748 2.801 -1.705 347 3HG2 THR 607 3HG2 THR 607 -11.286 1.099 -1.660 348 H GLY 608 H GLY 608 -10.417 -1.134 1.018 349 1HA GLY 608 1HA GLY 608 -8.935 -2.259 -1.321 350 2HA GLY 608 2HA GLY 608 -10.604 -2.730 -1.002 351 H SER 609 H SER 609 -10.111 -4.927 -0.588 352 HA SER 609 HA SER 609 -8.538 -5.390 1.916 353 1HB SER 609 1HB SER 609 -10.013 -7.515 2.025 354 2HB SER 609 2HB SER 609 -10.769 -5.977 2.427 355 HG SER 609 HG SER 609 -12.102 -6.959 0.974 356 H SER 610 H SER 610 -8.545 -5.864 -1.402 357 HA SER 610 HA SER 610 -6.237 -7.576 -1.327 358 1HB SER 610 1HB SER 610 -7.984 -9.265 -0.773 359 2HB SER 610 2HB SER 610 -8.808 -8.875 -2.279 360 HG SER 610 HG SER 610 -7.511 -10.303 -3.107 361 H GLY 611 H GLY 611 -5.128 -6.965 -3.117 362 1HA GLY 611 1HA GLY 611 -6.701 -6.250 -5.560 363 2HA GLY 611 2HA GLY 611 -5.070 -6.921 -5.605 364 H THR 612 H THR 612 -6.665 -4.126 -6.091 365 HA THR 612 HA THR 612 -4.239 -2.528 -5.555 366 HB THR 612 HB THR 612 -6.827 -1.784 -6.953 367 HG1 THR 612 HG1 THR 612 -5.928 -2.575 -8.673 368 1HG2 THR 612 1HG2 THR 612 -4.149 -0.380 -6.747 369 2HG2 THR 612 2HG2 THR 612 -5.453 0.108 -7.830 370 3HG2 THR 612 3HG2 THR 612 -5.682 0.182 -6.083 371 H VAL 613 H VAL 613 -4.140 -1.819 -3.455 372 HA VAL 613 HA VAL 613 -6.644 -0.838 -2.187 373 HB VAL 613 HB VAL 613 -4.076 -2.008 -1.208 374 1HG1 VAL 613 1HG1 VAL 613 -5.732 -0.037 0.389 375 2HG1 VAL 613 2HG1 VAL 613 -4.479 -1.082 1.062 376 3HG1 VAL 613 3HG1 VAL 613 -4.054 0.166 -0.110 377 1HG2 VAL 613 1HG2 VAL 613 -7.017 -2.204 -0.543 378 2HG2 VAL 613 2HG2 VAL 613 -5.959 -3.456 -1.195 379 3HG2 VAL 613 3HG2 VAL 613 -5.781 -2.935 0.481 380 H THR 614 H THR 614 -6.932 1.343 -2.305 381 HA THR 614 HA THR 614 -4.608 3.077 -2.845 382 HB THR 614 HB THR 614 -7.473 3.970 -2.511 383 HG1 THR 614 HG1 THR 614 -7.909 2.955 -4.275 384 1HG2 THR 614 1HG2 THR 614 -4.989 5.243 -3.142 385 2HG2 THR 614 2HG2 THR 614 -6.016 5.297 -4.576 386 3HG2 THR 614 3HG2 THR 614 -6.595 5.967 -3.050 387 H ALA 615 H ALA 615 -3.747 4.513 -1.359 388 HA ALA 615 HA ALA 615 -4.517 4.132 1.444 389 1HB ALA 615 1HB ALA 615 -2.770 6.272 1.434 390 2HB ALA 615 2HB ALA 615 -2.291 4.577 1.548 391 3HB ALA 615 3HB ALA 615 -2.293 5.386 -0.017 392 H ARG 616 H ARG 616 -5.491 5.698 2.783 393 HA ARG 616 HA ARG 616 -6.547 8.121 1.394 394 1HB ARG 616 1HB ARG 616 -8.057 5.894 2.288 395 2HB ARG 616 2HB ARG 616 -8.380 7.207 3.419 396 1HG ARG 616 1HG ARG 616 -8.516 8.580 1.098 397 2HG ARG 616 2HG ARG 616 -9.034 6.994 0.528 398 1HD ARG 616 1HD ARG 616 -10.537 7.077 2.717 399 2HD ARG 616 2HD ARG 616 -10.344 8.817 2.505 400 HE ARG 616 HE ARG 616 -11.977 7.090 0.857 401 1HH1 ARG 616 1HH1 ARG 616 -11.474 10.245 1.492 402 2HH1 ARG 616 2HH1 ARG 616 -11.538 10.817 -0.142 403 1HH2 ARG 616 1HH2 ARG 616 -11.395 7.645 -1.536 404 2HH2 ARG 616 2HH2 ARG 616 -11.494 9.345 -1.857 405 HA PRO 617 HA PRO 617 -4.978 10.118 5.004 406 1HB PRO 617 1HB PRO 617 -6.215 12.543 4.624 407 2HB PRO 617 2HB PRO 617 -4.799 12.013 3.700 408 1HG PRO 617 1HG PRO 617 -7.648 12.176 2.836 409 2HG PRO 617 2HG PRO 617 -6.172 12.272 1.861 410 1HD PRO 617 1HD PRO 617 -7.853 10.008 2.106 411 2HD PRO 617 2HD PRO 617 -6.219 10.028 1.411 412 H ASN 618 H ASN 618 -5.743 10.889 7.086 413 HA ASN 618 HA ASN 618 -8.672 10.853 7.544 414 1HB ASN 618 1HB ASN 618 -8.567 9.220 9.296 415 2HB ASN 618 2HB ASN 618 -7.715 8.517 7.919 416 2HD2 ASN 618 2HD2 ASN 618 -7.415 8.558 11.129 417 1HD2 ASN 618 1HD2 ASN 618 -5.731 8.670 11.305 418 H GLY 619 H GLY 619 -6.600 12.931 7.573 419 1HA GLY 619 1HA GLY 619 -6.870 13.747 10.435 420 2HA GLY 619 2HA GLY 619 -6.823 14.880 9.084 421 H SER 620 H SER 620 -4.686 14.287 7.642 422 HA SER 620 HA SER 620 -2.356 14.600 7.605 423 1HB SER 620 1HB SER 620 -3.220 15.703 10.125 424 2HB SER 620 2HB SER 620 -1.674 14.888 10.338 425 HG SER 620 HG SER 620 -1.208 16.088 8.222 426 H GLY 621 H GLY 621 -1.097 12.835 7.281 427 1HA GLY 621 1HA GLY 621 -1.504 10.383 8.776 428 2HA GLY 621 2HA GLY 621 0.012 11.171 9.214 429 H ASN 622 H ASN 622 1.732 11.071 7.761 430 HA ASN 622 HA ASN 622 1.212 9.962 5.053 431 1HB ASN 622 1HB ASN 622 3.781 11.076 6.221 432 2HB ASN 622 2HB ASN 622 3.483 10.685 4.528 433 2HD2 ASN 622 2HD2 ASN 622 1.932 12.068 3.338 434 1HD2 ASN 622 1HD2 ASN 622 1.555 13.621 3.909 435 H SER 623 H SER 623 1.862 8.767 8.063 436 HA SER 623 HA SER 623 3.484 6.515 6.943 437 1HB SER 623 1HB SER 623 3.485 7.859 9.625 438 2HB SER 623 2HB SER 623 3.916 6.155 9.524 439 HG SER 623 HG SER 623 5.684 7.707 9.278 440 H PHE 624 H PHE 624 2.436 4.586 6.865 441 HA PHE 624 HA PHE 624 0.279 4.047 8.834 442 1HB PHE 624 1HB PHE 624 -1.324 3.435 7.164 443 2HB PHE 624 2HB PHE 624 -0.698 5.012 6.683 444 HD1 PHE 624 HD1 PHE 624 -0.438 1.356 6.061 445 HD2 PHE 624 HD2 PHE 624 0.535 5.298 4.655 446 HE1 PHE 624 HE1 PHE 624 0.302 0.401 3.896 447 HE2 PHE 624 HE2 PHE 624 1.275 4.339 2.487 448 HZ PHE 624 HZ PHE 624 1.158 1.892 2.110 449 H GLY 625 H GLY 625 0.131 1.866 9.378 450 1HA GLY 625 1HA GLY 625 1.609 -0.080 9.747 451 2HA GLY 625 2HA GLY 625 2.155 0.092 8.079 452 H VAL 626 H VAL 626 1.495 -1.924 7.303 453 HA VAL 626 HA VAL 626 -1.350 -2.698 7.703 454 HB VAL 626 HB VAL 626 -0.086 -2.799 4.963 455 1HG1 VAL 626 1HG1 VAL 626 -2.892 -2.956 6.084 456 2HG1 VAL 626 2HG1 VAL 626 -2.574 -2.709 4.367 457 3HG1 VAL 626 3HG1 VAL 626 -2.023 -4.183 5.163 458 1HG2 VAL 626 1HG2 VAL 626 -1.694 -0.553 6.219 459 2HG2 VAL 626 2HG2 VAL 626 -0.047 -0.453 5.598 460 3HG2 VAL 626 3HG2 VAL 626 -1.393 -0.703 4.488 461 H THR 627 H THR 627 -1.721 -4.987 7.246 462 HA THR 627 HA THR 627 0.810 -6.584 7.238 463 HB THR 627 HB THR 627 -1.785 -7.144 8.707 464 HG1 THR 627 HG1 THR 627 -0.325 -5.576 9.611 465 1HG2 THR 627 1HG2 THR 627 0.275 -8.909 7.766 466 2HG2 THR 627 2HG2 THR 627 0.331 -8.847 9.529 467 3HG2 THR 627 3HG2 THR 627 -1.163 -9.302 8.709 468 H PHE 628 H PHE 628 0.852 -8.365 5.861 469 HA PHE 628 HA PHE 628 -1.653 -8.954 4.344 470 1HB PHE 628 1HB PHE 628 1.094 -8.883 3.076 471 2HB PHE 628 2HB PHE 628 -0.468 -8.997 2.266 472 HD1 PHE 628 HD1 PHE 628 1.826 -6.766 4.114 473 HD2 PHE 628 HD2 PHE 628 -1.873 -7.048 1.949 474 HE1 PHE 628 HE1 PHE 628 1.704 -4.292 4.000 475 HE2 PHE 628 HE2 PHE 628 -1.996 -4.574 1.835 476 HZ PHE 628 HZ PHE 628 -0.207 -3.196 2.860 477 H TYR 629 H TYR 629 -1.973 -11.140 3.916 478 HA TYR 629 HA TYR 629 -0.215 -13.004 5.367 479 1HB TYR 629 1HB TYR 629 -2.820 -13.369 3.863 480 2HB TYR 629 2HB TYR 629 -1.948 -14.697 4.633 481 HD1 TYR 629 HD1 TYR 629 -1.190 -14.182 7.151 482 HD2 TYR 629 HD2 TYR 629 -4.463 -12.288 5.112 483 HE1 TYR 629 HE1 TYR 629 -2.208 -13.589 9.333 484 HE2 TYR 629 HE2 TYR 629 -5.479 -11.695 7.295 485 HH TYR 629 HH TYR 629 -4.067 -12.821 10.345 486 H LYS 630 H LYS 630 1.426 -14.068 4.372 487 HA LYS 630 HA LYS 630 1.249 -14.445 1.410 488 1HB LYS 630 1HB LYS 630 3.865 -14.338 1.624 489 2HB LYS 630 2HB LYS 630 2.938 -12.837 1.579 490 1HG LYS 630 1HG LYS 630 3.261 -12.406 3.827 491 2HG LYS 630 2HG LYS 630 3.406 -14.115 4.241 492 1HD LYS 630 1HD LYS 630 5.604 -13.203 4.462 493 2HD LYS 630 2HD LYS 630 5.607 -14.104 2.944 494 1HE LYS 630 1HE LYS 630 4.701 -11.420 2.447 495 2HE LYS 630 2HE LYS 630 6.227 -11.362 3.326 496 1HZ LYS 630 1HZ LYS 630 6.465 -13.370 1.430 497 2HZ LYS 630 2HZ LYS 630 5.768 -12.045 0.628 498 3HZ LYS 630 3HZ LYS 630 7.245 -11.861 1.441 499 H ASN 631 H ASN 631 2.376 -15.703 4.514 500 HA ASN 631 HA ASN 631 2.804 -17.917 5.169 501 1HB ASN 631 1HB ASN 631 1.731 -18.727 2.455 502 2HB ASN 631 2HB ASN 631 1.770 -19.691 3.932 503 2HD2 ASN 631 2HD2 ASN 631 -0.646 -18.949 2.361 504 1HD2 ASN 631 1HD2 ASN 631 -1.640 -18.067 3.416 505 H GLY 632 H GLY 632 4.657 -16.240 3.421 506 1HA GLY 632 1HA GLY 632 6.738 -18.218 3.146 507 2HA GLY 632 2HA GLY 632 6.834 -16.546 2.590 508 H SER 633 H SER 633 4.454 -16.738 0.897 509 HA SER 633 HA SER 633 5.723 -18.127 -1.387 510 1HB SER 633 1HB SER 633 3.149 -18.928 -0.101 511 2HB SER 633 2HB SER 633 3.228 -18.964 -1.861 512 HG SER 633 HG SER 633 5.394 -20.075 -1.288 513 H SER 634 H SER 634 5.392 -15.343 -0.824 514 HA SER 634 HA SER 634 3.919 -14.568 -3.241 515 1HB SER 634 1HB SER 634 3.052 -13.646 -0.490 516 2HB SER 634 2HB SER 634 2.567 -12.849 -1.983 517 HG SER 634 HG SER 634 1.953 -15.430 -1.033 518 H ALA 635 H ALA 635 4.309 -12.254 -3.756 519 HA ALA 635 HA ALA 635 6.997 -11.451 -2.827 520 1HB ALA 635 1HB ALA 635 5.241 -10.808 -5.146 521 2HB ALA 635 2HB ALA 635 6.976 -11.117 -5.102 522 3HB ALA 635 3HB ALA 635 6.349 -9.544 -4.613 523 H THR 636 H THR 636 7.324 -9.065 -2.348 524 HA THR 636 HA THR 636 5.445 -8.240 -0.288 525 HB THR 636 HB THR 636 7.620 -6.484 -1.412 526 HG1 THR 636 HG1 THR 636 9.095 -7.634 -0.202 527 1HG2 THR 636 1HG2 THR 636 6.335 -6.936 1.283 528 2HG2 THR 636 2HG2 THR 636 7.849 -6.048 1.106 529 3HG2 THR 636 3HG2 THR 636 6.381 -5.452 0.333 530 HA PRO 637 HA PRO 637 2.920 -5.774 -2.947 531 1HB PRO 637 1HB PRO 637 1.624 -4.360 -0.976 532 2HB PRO 637 2HB PRO 637 1.245 -6.041 -1.386 533 1HG PRO 637 1HG PRO 637 2.728 -4.971 0.971 534 2HG PRO 637 2HG PRO 637 1.790 -6.467 0.820 535 1HD PRO 637 1HD PRO 637 4.607 -6.271 0.740 536 2HD PRO 637 2HD PRO 637 3.647 -7.682 0.246 537 H GLY 638 H GLY 638 4.433 -4.367 -3.966 538 1HA GLY 638 1HA GLY 638 5.674 -2.397 -4.309 539 2HA GLY 638 2HA GLY 638 5.742 -2.204 -2.556 540 H ALA 639 H ALA 639 5.268 0.064 -2.753 541 HA ALA 639 HA ALA 639 2.376 0.595 -3.219 542 1HB ALA 639 1HB ALA 639 4.090 1.339 -1.152 543 2HB ALA 639 2HB ALA 639 3.927 2.804 -2.121 544 3HB ALA 639 3HB ALA 639 2.492 2.014 -1.471 545 H THR 640 H THR 640 1.742 1.885 -4.879 546 HA THR 640 HA THR 640 3.858 2.968 -6.662 547 HB THR 640 HB THR 640 0.986 3.082 -7.345 548 HG1 THR 640 HG1 THR 640 1.113 0.861 -7.978 549 1HG2 THR 640 1HG2 THR 640 3.608 2.696 -8.734 550 2HG2 THR 640 2HG2 THR 640 2.138 2.116 -9.516 551 3HG2 THR 640 3HG2 THR 640 2.304 3.823 -9.105 552 H CYS 641 H CYS 641 3.887 5.131 -7.298 553 HA CYS 641 HA CYS 641 2.056 6.953 -5.789 554 1HB CYS 641 1HB CYS 641 4.697 7.963 -6.760 555 2HB CYS 641 2HB CYS 641 3.782 8.418 -5.324 556 H ALA 642 H ALA 642 0.545 7.129 -7.496 557 HA ALA 642 HA ALA 642 1.600 8.238 -10.063 558 1HB ALA 642 1HB ALA 642 -0.363 6.254 -9.487 559 2HB ALA 642 2HB ALA 642 0.127 6.866 -11.066 560 3HB ALA 642 3HB ALA 642 -1.199 7.637 -10.194 561 H THR 643 H THR 643 0.386 10.039 -11.016 562 HA THR 643 HA THR 643 -0.958 11.697 -8.921 563 HB THR 643 HB THR 643 -0.171 13.663 -10.094 564 HG1 THR 643 HG1 THR 643 0.812 13.539 -12.020 565 1HG2 THR 643 1HG2 THR 643 1.918 11.540 -9.593 566 2HG2 THR 643 2HG2 THR 643 2.350 13.199 -10.006 567 3HG2 THR 643 3HG2 THR 643 1.438 12.866 -8.534 568 H GLY 644 H GLY 644 -3.104 11.421 -9.280 569 1HA GLY 644 1HA GLY 644 -4.286 12.445 -11.718 570 2HA GLY 644 2HA GLY 644 -5.168 11.705 -10.380 No H/Q in entry = 570 Start of MODEL 4 1 H1 THR 557 H1 THR 557 -2.236 15.744 -10.245 2 H2 THR 557 H2 THR 557 -2.739 15.813 -8.623 3 H3 THR 557 H3 THR 557 -3.644 16.595 -9.831 4 HA THR 557 HA THR 557 -2.245 18.353 -9.978 5 HB THR 557 HB THR 557 -1.282 18.817 -7.674 6 HG1 THR 557 HG1 THR 557 -2.314 17.041 -6.227 7 1HG2 THR 557 1HG2 THR 557 -4.001 18.478 -8.519 8 2HG2 THR 557 2HG2 THR 557 -3.876 18.025 -6.819 9 3HG2 THR 557 3HG2 THR 557 -3.351 19.624 -7.347 10 H GLY 558 H GLY 558 -0.444 15.590 -8.613 11 1HA GLY 558 1HA GLY 558 2.172 16.493 -8.850 12 2HA GLY 558 2HA GLY 558 1.736 16.000 -10.488 13 H SER 559 H SER 559 3.698 14.764 -8.646 14 HA SER 559 HA SER 559 2.470 12.040 -8.525 15 1HB SER 559 1HB SER 559 4.612 11.120 -9.027 16 2HB SER 559 2HB SER 559 4.414 12.472 -10.138 17 HG SER 559 HG SER 559 6.459 12.255 -8.839 18 H CYS 560 H CYS 560 3.313 10.645 -6.750 19 HA CYS 560 HA CYS 560 3.918 12.298 -4.342 20 1HB CYS 560 1HB CYS 560 2.011 11.253 -3.667 21 2HB CYS 560 2HB CYS 560 2.173 9.959 -4.842 22 H SER 561 H SER 561 5.264 11.128 -2.690 23 HA SER 561 HA SER 561 7.285 9.330 -3.967 24 1HB SER 561 1HB SER 561 8.853 10.702 -2.256 25 2HB SER 561 2HB SER 561 8.614 11.204 -3.927 26 HG SER 561 HG SER 561 8.222 12.922 -2.497 27 H VAL 562 H VAL 562 7.700 7.541 -2.716 28 HA VAL 562 HA VAL 562 7.374 7.693 0.210 29 HB VAL 562 HB VAL 562 5.827 5.532 -1.171 30 1HG1 VAL 562 1HG1 VAL 562 5.565 7.045 1.434 31 2HG1 VAL 562 2HG1 VAL 562 4.432 5.810 0.888 32 3HG1 VAL 562 3HG1 VAL 562 6.108 5.382 1.229 33 1HG2 VAL 562 1HG2 VAL 562 5.087 7.626 -2.251 34 2HG2 VAL 562 2HG2 VAL 562 3.831 6.980 -1.190 35 3HG2 VAL 562 3HG2 VAL 562 4.816 8.343 -0.660 36 H SER 563 H SER 563 8.181 5.745 1.279 37 HA SER 563 HA SER 563 9.867 4.026 -0.497 38 1HB SER 563 1HB SER 563 10.611 5.260 2.170 39 2HB SER 563 2HB SER 563 11.559 4.015 1.362 40 HG SER 563 HG SER 563 12.127 6.312 0.969 41 H ALA 564 H ALA 564 9.776 1.837 -0.011 42 HA ALA 564 HA ALA 564 7.846 1.064 2.106 43 1HB ALA 564 1HB ALA 564 7.580 0.135 -0.192 44 2HB ALA 564 2HB ALA 564 9.154 -0.645 -0.031 45 3HB ALA 564 3HB ALA 564 7.821 -1.124 1.020 46 H VAL 565 H VAL 565 8.508 0.146 3.985 47 HA VAL 565 HA VAL 565 11.364 -0.736 4.172 48 HB VAL 565 HB VAL 565 9.754 0.066 6.571 49 1HG1 VAL 565 1HG1 VAL 565 12.479 -0.610 5.931 50 2HG1 VAL 565 2HG1 VAL 565 12.425 1.037 6.561 51 3HG1 VAL 565 3HG1 VAL 565 11.768 -0.294 7.514 52 1HG2 VAL 565 1HG2 VAL 565 10.731 1.833 4.374 53 2HG2 VAL 565 2HG2 VAL 565 9.371 2.059 5.475 54 3HG2 VAL 565 3HG2 VAL 565 11.013 2.383 6.027 55 H ARG 566 H ARG 566 11.696 -2.497 5.815 56 HA ARG 566 HA ARG 566 9.587 -4.531 5.543 57 1HB ARG 566 1HB ARG 566 12.393 -4.505 6.655 58 2HB ARG 566 2HB ARG 566 11.313 -5.863 6.978 59 1HG ARG 566 1HG ARG 566 11.178 -5.166 4.184 60 2HG ARG 566 2HG ARG 566 12.861 -5.420 4.650 61 1HD ARG 566 1HD ARG 566 11.461 -7.476 5.935 62 2HD ARG 566 2HD ARG 566 10.727 -7.373 4.335 63 HE ARG 566 HE ARG 566 13.227 -7.450 3.536 64 1HH1 ARG 566 1HH1 ARG 566 14.456 -7.963 6.151 65 2HH1 ARG 566 2HH1 ARG 566 14.478 -9.693 6.248 66 1HH2 ARG 566 1HH2 ARG 566 12.144 -10.129 3.721 67 2HH2 ARG 566 2HH2 ARG 566 13.170 -10.919 4.872 68 H GLY 567 H GLY 567 8.291 -2.808 6.855 69 1HA GLY 567 1HA GLY 567 6.952 -2.609 8.763 70 2HA GLY 567 2HA GLY 567 8.497 -2.184 9.504 71 H GLU 568 H GLU 568 7.414 -3.241 11.430 72 HA GLU 568 HA GLU 568 8.555 -5.615 12.209 73 1HB GLU 568 1HB GLU 568 5.925 -4.355 12.929 74 2HB GLU 568 2HB GLU 568 6.354 -5.926 13.606 75 1HG GLU 568 1HG GLU 568 8.670 -4.639 14.058 76 2HG GLU 568 2HG GLU 568 7.578 -3.254 14.094 77 H GLU 569 H GLU 569 7.551 -7.811 12.511 78 HA GLU 569 HA GLU 569 5.460 -8.586 10.601 79 1HB GLU 569 1HB GLU 569 6.873 -10.204 9.403 80 2HB GLU 569 2HB GLU 569 7.501 -8.569 9.191 81 1HG GLU 569 1HG GLU 569 9.409 -9.024 10.338 82 2HG GLU 569 2HG GLU 569 8.559 -9.970 11.559 83 H TRP 570 H TRP 570 5.996 -11.364 10.637 84 HA TRP 570 HA TRP 570 6.390 -12.124 13.458 85 1HB TRP 570 1HB TRP 570 3.749 -12.544 12.027 86 2HB TRP 570 2HB TRP 570 4.179 -13.266 13.578 87 HD1 TRP 570 HD1 TRP 570 4.430 -11.635 15.676 88 HE1 TRP 570 HE1 TRP 570 3.484 -9.280 16.134 89 HE3 TRP 570 HE3 TRP 570 3.095 -10.286 10.935 90 HZ2 TRP 570 HZ2 TRP 570 2.316 -7.111 14.679 91 HZ3 TRP 570 HZ3 TRP 570 2.069 -8.073 10.499 92 HH2 TRP 570 HH2 TRP 570 1.679 -6.485 12.364 93 H ALA 571 H ALA 571 4.440 -14.187 11.458 94 HA ALA 571 HA ALA 571 6.839 -15.659 10.507 95 1HB ALA 571 1HB ALA 571 5.287 -17.739 11.300 96 2HB ALA 571 2HB ALA 571 4.877 -16.557 12.543 97 3HB ALA 571 3HB ALA 571 6.557 -17.044 12.309 98 H ASP 572 H ASP 572 3.320 -16.296 10.682 99 HA ASP 572 HA ASP 572 3.308 -17.135 7.880 100 1HB ASP 572 1HB ASP 572 0.811 -16.600 9.464 101 2HB ASP 572 2HB ASP 572 1.122 -17.861 8.271 102 H ARG 573 H ARG 573 2.870 -14.192 9.599 103 HA ARG 573 HA ARG 573 1.970 -12.899 7.068 104 1HB ARG 573 1HB ARG 573 0.928 -11.351 9.199 105 2HB ARG 573 2HB ARG 573 0.019 -12.277 8.007 106 1HG ARG 573 1HG ARG 573 0.285 -14.303 9.462 107 2HG ARG 573 2HG ARG 573 1.039 -13.276 10.682 108 1HD ARG 573 1HD ARG 573 -0.962 -11.991 10.968 109 2HD ARG 573 2HD ARG 573 -1.704 -12.710 9.539 110 HE ARG 573 HE ARG 573 -2.051 -14.752 10.796 111 1HH1 ARG 573 1HH1 ARG 573 0.029 -15.178 12.629 112 2HH1 ARG 573 2HH1 ARG 573 -0.538 -14.554 14.142 113 1HH2 ARG 573 1HH2 ARG 573 -3.056 -12.646 12.714 114 2HH2 ARG 573 2HH2 ARG 573 -2.285 -13.120 14.190 115 H PHE 574 H PHE 574 2.911 -10.862 6.698 116 HA PHE 574 HA PHE 574 4.932 -10.006 8.734 117 1HB PHE 574 1HB PHE 574 6.319 -9.223 6.821 118 2HB PHE 574 2HB PHE 574 6.046 -10.965 6.771 119 HD1 PHE 574 HD1 PHE 574 4.928 -7.707 5.368 120 HD2 PHE 574 HD2 PHE 574 4.837 -11.984 4.983 121 HE1 PHE 574 HE1 PHE 574 3.895 -7.483 3.126 122 HE2 PHE 574 HE2 PHE 574 3.803 -11.760 2.740 123 HZ PHE 574 HZ PHE 574 3.332 -9.509 1.811 124 H ASN 575 H ASN 575 5.236 -7.710 8.921 125 HA ASN 575 HA ASN 575 2.966 -6.129 7.785 126 1HB ASN 575 1HB ASN 575 3.400 -6.490 10.400 127 2HB ASN 575 2HB ASN 575 4.510 -5.144 10.143 128 2HD2 ASN 575 2HD2 ASN 575 1.099 -6.079 10.113 129 1HD2 ASN 575 1HD2 ASN 575 0.485 -4.504 9.968 130 H VAL 576 H VAL 576 3.452 -3.985 7.041 131 HA VAL 576 HA VAL 576 6.365 -3.449 6.625 132 HB VAL 576 HB VAL 576 4.281 -2.685 4.597 133 1HG1 VAL 576 1HG1 VAL 576 6.685 -1.796 4.623 134 2HG1 VAL 576 2HG1 VAL 576 7.174 -3.437 4.199 135 3HG1 VAL 576 3HG1 VAL 576 6.127 -2.521 3.116 136 1HG2 VAL 576 1HG2 VAL 576 4.167 -5.170 5.065 137 2HG2 VAL 576 2HG2 VAL 576 4.639 -4.764 3.414 138 3HG2 VAL 576 3HG2 VAL 576 5.862 -5.270 4.582 139 H THR 577 H THR 577 6.857 -1.168 6.390 140 HA THR 577 HA THR 577 4.733 0.645 7.449 141 HB THR 577 HB THR 577 7.652 0.480 8.245 142 HG1 THR 577 HG1 THR 577 5.228 0.402 9.715 143 1HG2 THR 577 1HG2 THR 577 5.609 2.666 8.644 144 2HG2 THR 577 2HG2 THR 577 6.988 2.469 9.727 145 3HG2 THR 577 3HG2 THR 577 7.251 2.808 8.016 146 H TYR 578 H TYR 578 4.265 1.824 5.623 147 HA TYR 578 HA TYR 578 6.469 2.685 3.846 148 1HB TYR 578 1HB TYR 578 3.491 3.218 3.618 149 2HB TYR 578 2HB TYR 578 4.701 3.459 2.358 150 HD1 TYR 578 HD1 TYR 578 6.042 1.418 1.564 151 HD2 TYR 578 HD2 TYR 578 2.457 1.112 3.910 152 HE1 TYR 578 HE1 TYR 578 5.783 -0.946 0.860 153 HE2 TYR 578 HE2 TYR 578 2.197 -1.252 3.206 154 HH TYR 578 HH TYR 578 4.579 -3.063 1.930 155 H SER 579 H SER 579 7.009 4.883 3.523 156 HA SER 579 HA SER 579 5.802 6.793 5.486 157 1HB SER 579 1HB SER 579 8.651 7.065 4.589 158 2HB SER 579 2HB SER 579 7.895 7.622 6.080 159 HG SER 579 HG SER 579 9.303 5.675 6.161 160 H VAL 580 H VAL 580 4.706 8.307 4.347 161 HA VAL 580 HA VAL 580 5.421 8.887 1.552 162 HB VAL 580 HB VAL 580 3.192 9.735 3.400 163 1HG1 VAL 580 1HG1 VAL 580 3.905 11.738 2.114 164 2HG1 VAL 580 2HG1 VAL 580 3.723 10.823 0.617 165 3HG1 VAL 580 3HG1 VAL 580 2.312 11.169 1.617 166 1HG2 VAL 580 1HG2 VAL 580 3.580 7.944 1.076 167 2HG2 VAL 580 2HG2 VAL 580 2.425 7.831 2.404 168 3HG2 VAL 580 3HG2 VAL 580 2.101 8.904 1.043 169 H SER 581 H SER 581 5.749 11.154 0.845 170 HA SER 581 HA SER 581 6.989 12.855 2.967 171 1HB SER 581 1HB SER 581 8.651 13.547 1.167 172 2HB SER 581 2HB SER 581 8.837 11.901 1.765 173 HG SER 581 HG SER 581 8.853 11.786 -0.442 174 H GLY 582 H GLY 582 4.542 13.545 2.590 175 1HA GLY 582 1HA GLY 582 3.884 15.034 0.225 176 2HA GLY 582 2HA GLY 582 4.509 16.126 1.463 177 H SER 583 H SER 583 2.732 13.191 2.235 178 HA SER 583 HA SER 583 0.606 12.881 3.167 179 1HB SER 583 1HB SER 583 0.014 14.833 4.809 180 2HB SER 583 2HB SER 583 1.411 13.816 5.153 181 HG SER 583 HG SER 583 1.358 16.420 4.822 182 H SER 584 H SER 584 -0.224 16.203 3.487 183 HA SER 584 HA SER 584 -2.083 17.310 2.538 184 1HB SER 584 1HB SER 584 -0.287 16.615 0.209 185 2HB SER 584 2HB SER 584 -1.709 17.638 0.027 186 HG SER 584 HG SER 584 -0.784 18.936 1.750 187 H SER 585 H SER 585 -1.767 15.422 -0.381 188 HA SER 585 HA SER 585 -4.068 13.709 0.386 189 1HB SER 585 1HB SER 585 -4.009 15.427 -2.112 190 2HB SER 585 2HB SER 585 -5.276 14.284 -1.672 191 HG SER 585 HG SER 585 -6.103 15.938 -0.672 192 H TRP 586 H TRP 586 -1.895 12.407 0.336 193 HA TRP 586 HA TRP 586 -1.071 11.684 -2.399 194 1HB TRP 586 1HB TRP 586 0.600 10.286 -1.353 195 2HB TRP 586 2HB TRP 586 0.605 11.857 -0.552 196 HD1 TRP 586 HD1 TRP 586 -0.415 11.995 1.907 197 HE1 TRP 586 HE1 TRP 586 -0.803 10.192 3.699 198 HE3 TRP 586 HE3 TRP 586 -0.043 7.781 -0.961 199 HZ2 TRP 586 HZ2 TRP 586 -0.949 7.372 3.907 200 HZ3 TRP 586 HZ3 TRP 586 -0.317 5.543 0.074 201 HH2 TRP 586 HH2 TRP 586 -0.768 5.330 2.501 202 H VAL 587 H VAL 587 -2.326 10.321 -3.469 203 HA VAL 587 HA VAL 587 -3.737 8.159 -1.986 204 HB VAL 587 HB VAL 587 -5.339 9.414 -3.161 205 1HG1 VAL 587 1HG1 VAL 587 -3.214 9.621 -5.278 206 2HG1 VAL 587 2HG1 VAL 587 -4.903 9.957 -5.657 207 3HG1 VAL 587 3HG1 VAL 587 -4.067 10.916 -4.435 208 1HG2 VAL 587 1HG2 VAL 587 -4.756 6.813 -4.034 209 2HG2 VAL 587 2HG2 VAL 587 -6.276 7.678 -4.261 210 3HG2 VAL 587 3HG2 VAL 587 -5.036 7.732 -5.513 211 H VAL 588 H VAL 588 -2.105 6.593 -1.940 212 HA VAL 588 HA VAL 588 -0.504 5.995 -4.300 213 HB VAL 588 HB VAL 588 -0.792 4.745 -1.570 214 1HG1 VAL 588 1HG1 VAL 588 0.777 3.669 -3.944 215 2HG1 VAL 588 2HG1 VAL 588 1.012 3.141 -2.275 216 3HG1 VAL 588 3HG1 VAL 588 -0.532 2.857 -3.085 217 1HG2 VAL 588 1HG2 VAL 588 0.733 6.817 -2.502 218 2HG2 VAL 588 2HG2 VAL 588 1.164 5.813 -1.118 219 3HG2 VAL 588 3HG2 VAL 588 1.834 5.454 -2.708 220 H THR 589 H THR 589 -0.422 3.876 -5.247 221 HA THR 589 HA THR 589 -3.053 2.468 -5.256 222 HB THR 589 HB THR 589 -1.686 1.890 -7.672 223 HG1 THR 589 HG1 THR 589 -0.777 3.684 -8.223 224 1HG2 THR 589 1HG2 THR 589 -4.229 2.498 -6.843 225 2HG2 THR 589 2HG2 THR 589 -3.809 3.929 -7.785 226 3HG2 THR 589 3HG2 THR 589 -3.740 2.331 -8.529 227 H LEU 590 H LEU 590 -2.583 0.711 -3.964 228 HA LEU 590 HA LEU 590 0.067 -0.504 -3.972 229 1HB LEU 590 1HB LEU 590 -2.512 -0.959 -2.540 230 2HB LEU 590 2HB LEU 590 -1.366 -2.299 -2.611 231 HG LEU 590 HG LEU 590 0.111 0.063 -2.007 232 1HD1 LEU 590 1HD1 LEU 590 -2.566 -0.088 -0.753 233 2HD1 LEU 590 2HD1 LEU 590 -1.225 0.165 0.365 234 3HD1 LEU 590 3HD1 LEU 590 -1.496 1.298 -0.959 235 1HD2 LEU 590 1HD2 LEU 590 -0.540 -2.572 -0.781 236 2HD2 LEU 590 2HD2 LEU 590 1.032 -1.848 -1.117 237 3HD2 LEU 590 3HD2 LEU 590 0.112 -1.339 0.298 238 H GLY 591 H GLY 591 0.721 -2.324 -5.050 239 1HA GLY 591 1HA GLY 591 0.245 -3.336 -7.347 240 2HA GLY 591 2HA GLY 591 -1.345 -3.736 -6.695 241 H LEU 592 H LEU 592 -1.355 -5.235 -4.794 242 HA LEU 592 HA LEU 592 0.944 -6.674 -3.948 243 1HB LEU 592 1HB LEU 592 -1.790 -7.923 -4.023 244 2HB LEU 592 2HB LEU 592 -0.549 -8.038 -2.787 245 HG LEU 592 HG LEU 592 -2.416 -5.743 -3.341 246 1HD1 LEU 592 1HD1 LEU 592 -2.275 -7.845 -1.440 247 2HD1 LEU 592 2HD1 LEU 592 -1.887 -6.354 -0.581 248 3HD1 LEU 592 3HD1 LEU 592 -3.406 -6.492 -1.466 249 1HD2 LEU 592 1HD2 LEU 592 0.339 -5.709 -2.186 250 2HD2 LEU 592 2HD2 LEU 592 -0.523 -4.447 -3.068 251 3HD2 LEU 592 3HD2 LEU 592 -0.890 -4.744 -1.369 252 H ASN 593 H ASN 593 0.430 -9.358 -4.290 253 HA ASN 593 HA ASN 593 0.953 -9.676 -7.202 254 1HB ASN 593 1HB ASN 593 1.381 -11.681 -4.969 255 2HB ASN 593 2HB ASN 593 1.987 -11.793 -6.622 256 2HD2 ASN 593 2HD2 ASN 593 3.734 -11.792 -4.309 257 1HD2 ASN 593 1HD2 ASN 593 4.671 -10.377 -4.371 258 H GLY 594 H GLY 594 -1.764 -9.346 -6.041 259 1HA GLY 594 1HA GLY 594 -3.140 -11.325 -7.554 260 2HA GLY 594 2HA GLY 594 -3.888 -10.298 -6.331 261 H GLY 595 H GLY 595 -1.804 -11.428 -4.366 262 1HA GLY 595 1HA GLY 595 -1.574 -13.929 -3.692 263 2HA GLY 595 2HA GLY 595 -3.336 -13.922 -3.776 264 H GLN 596 H GLN 596 -0.705 -11.998 -2.279 265 HA GLN 596 HA GLN 596 -1.504 -12.403 0.394 266 1HB GLN 596 1HB GLN 596 -0.258 -9.875 -0.725 267 2HB GLN 596 2HB GLN 596 -0.167 -10.447 0.941 268 1HG GLN 596 1HG GLN 596 1.540 -11.844 0.461 269 2HG GLN 596 2HG GLN 596 0.703 -12.487 -0.953 270 2HE2 GLN 596 2HE2 GLN 596 0.492 -10.336 -2.655 271 1HE2 GLN 596 1HE2 GLN 596 2.023 -9.708 -3.032 272 H SER 597 H SER 597 -2.514 -10.735 1.862 273 HA SER 597 HA SER 597 -4.412 -8.897 0.529 274 1HB SER 597 1HB SER 597 -6.281 -9.861 1.980 275 2HB SER 597 2HB SER 597 -5.776 -10.856 0.618 276 HG SER 597 HG SER 597 -5.180 -12.321 1.991 277 H VAL 598 H VAL 598 -5.286 -7.316 2.028 278 HA VAL 598 HA VAL 598 -3.462 -6.798 4.277 279 HB VAL 598 HB VAL 598 -5.789 -5.242 3.113 280 1HG1 VAL 598 1HG1 VAL 598 -4.068 -4.778 5.535 281 2HG1 VAL 598 2HG1 VAL 598 -4.675 -3.403 4.614 282 3HG1 VAL 598 3HG1 VAL 598 -5.805 -4.541 5.346 283 1HG2 VAL 598 1HG2 VAL 598 -2.781 -4.828 3.092 284 2HG2 VAL 598 2HG2 VAL 598 -3.776 -5.294 1.713 285 3HG2 VAL 598 3HG2 VAL 598 -3.958 -3.694 2.430 286 H GLN 599 H GLN 599 -4.001 -7.013 6.433 287 HA GLN 599 HA GLN 599 -6.689 -8.185 7.002 288 1HB GLN 599 1HB GLN 599 -4.778 -9.613 7.616 289 2HB GLN 599 2HB GLN 599 -4.119 -8.313 8.611 290 1HG GLN 599 1HG GLN 599 -6.939 -9.133 9.131 291 2HG GLN 599 2HG GLN 599 -5.666 -10.239 9.649 292 2HE2 GLN 599 2HE2 GLN 599 -7.516 -8.286 11.204 293 1HE2 GLN 599 1HE2 GLN 599 -6.438 -7.413 12.181 294 H SER 600 H SER 600 -4.333 -5.777 8.147 295 HA SER 600 HA SER 600 -6.471 -4.033 9.055 296 1HB SER 600 1HB SER 600 -5.726 -4.032 11.460 297 2HB SER 600 2HB SER 600 -6.507 -5.529 10.961 298 HG SER 600 HG SER 600 -3.702 -5.116 10.889 299 H SER 601 H SER 601 -5.652 -1.930 9.592 300 HA SER 601 HA SER 601 -2.712 -1.557 9.460 301 1HB SER 601 1HB SER 601 -4.703 -0.351 7.528 302 2HB SER 601 2HB SER 601 -3.095 0.322 7.778 303 HG SER 601 HG SER 601 -3.853 -2.192 6.743 304 H TRP 602 H TRP 602 -2.039 0.454 10.392 305 HA TRP 602 HA TRP 602 -4.217 2.007 11.726 306 1HB TRP 602 1HB TRP 602 -2.765 2.208 13.718 307 2HB TRP 602 2HB TRP 602 -3.151 0.521 13.377 308 HD1 TRP 602 HD1 TRP 602 -0.282 2.984 13.461 309 HE1 TRP 602 HE1 TRP 602 1.926 1.735 13.071 310 HE3 TRP 602 HE3 TRP 602 -2.092 -1.606 12.143 311 HZ2 TRP 602 HZ2 TRP 602 2.822 -0.873 12.300 312 HZ3 TRP 602 HZ3 TRP 602 -0.538 -3.455 11.587 313 HH2 TRP 602 HH2 TRP 602 1.914 -3.094 11.664 314 H ASN 603 H ASN 603 -3.602 4.245 12.209 315 HA ASN 603 HA ASN 603 -2.444 6.263 11.805 316 1HB ASN 603 1HB ASN 603 -0.423 4.306 11.647 317 2HB ASN 603 2HB ASN 603 -0.259 5.273 10.181 318 2HD2 ASN 603 2HD2 ASN 603 -0.778 7.825 10.868 319 1HD2 ASN 603 1HD2 ASN 603 0.188 8.353 12.162 320 H ALA 604 H ALA 604 -4.223 4.650 9.866 321 HA ALA 604 HA ALA 604 -4.615 6.520 7.865 322 1HB ALA 604 1HB ALA 604 -2.262 4.771 7.314 323 2HB ALA 604 2HB ALA 604 -2.566 6.436 6.817 324 3HB ALA 604 3HB ALA 604 -3.351 5.104 5.968 325 H ALA 605 H ALA 605 -6.028 5.712 6.143 326 HA ALA 605 HA ALA 605 -7.085 2.979 6.753 327 1HB ALA 605 1HB ALA 605 -8.520 5.146 7.161 328 2HB ALA 605 2HB ALA 605 -8.733 5.103 5.410 329 3HB ALA 605 3HB ALA 605 -9.262 3.741 6.397 330 H LEU 606 H LEU 606 -7.226 1.557 5.051 331 HA LEU 606 HA LEU 606 -6.284 2.553 2.406 332 1HB LEU 606 1HB LEU 606 -6.365 -0.197 3.665 333 2HB LEU 606 2HB LEU 606 -6.023 0.047 1.952 334 HG LEU 606 HG LEU 606 -3.943 -0.100 3.316 335 1HD1 LEU 606 1HD1 LEU 606 -4.228 1.375 1.210 336 2HD1 LEU 606 2HD1 LEU 606 -4.279 2.738 2.329 337 3HD1 LEU 606 3HD1 LEU 606 -2.844 1.716 2.251 338 1HD2 LEU 606 1HD2 LEU 606 -5.089 1.036 5.330 339 2HD2 LEU 606 2HD2 LEU 606 -3.428 1.520 4.988 340 3HD2 LEU 606 3HD2 LEU 606 -4.766 2.560 4.503 341 H THR 607 H THR 607 -7.336 1.317 0.499 342 HA THR 607 HA THR 607 -10.264 1.003 1.033 343 HB THR 607 HB THR 607 -9.143 2.006 -1.583 344 HG1 THR 607 HG1 THR 607 -10.137 3.696 0.431 345 1HG2 THR 607 1HG2 THR 607 -11.595 1.148 -1.050 346 2HG2 THR 607 2HG2 THR 607 -11.771 2.767 -0.375 347 3HG2 THR 607 3HG2 THR 607 -11.336 2.562 -2.071 348 H GLY 608 H GLY 608 -10.930 -1.032 0.569 349 1HA GLY 608 1HA GLY 608 -9.680 -2.451 -1.731 350 2HA GLY 608 2HA GLY 608 -11.234 -2.861 -1.003 351 H SER 609 H SER 609 -7.891 -2.444 0.232 352 HA SER 609 HA SER 609 -6.683 -3.777 1.745 353 1HB SER 609 1HB SER 609 -9.208 -5.348 2.250 354 2HB SER 609 2HB SER 609 -7.863 -5.052 3.349 355 HG SER 609 HG SER 609 -9.083 -3.464 4.006 356 H SER 610 H SER 610 -7.298 -4.517 -1.142 357 HA SER 610 HA SER 610 -5.902 -7.037 -1.151 358 1HB SER 610 1HB SER 610 -7.836 -8.293 -2.294 359 2HB SER 610 2HB SER 610 -7.943 -8.091 -0.547 360 HG SER 610 HG SER 610 -9.503 -6.637 -0.797 361 H GLY 611 H GLY 611 -5.268 -7.617 -3.299 362 1HA GLY 611 1HA GLY 611 -6.328 -6.610 -5.705 363 2HA GLY 611 2HA GLY 611 -4.642 -7.087 -5.499 364 H THR 612 H THR 612 -6.554 -4.534 -6.351 365 HA THR 612 HA THR 612 -4.332 -2.639 -5.982 366 HB THR 612 HB THR 612 -7.026 -2.352 -7.347 367 HG1 THR 612 HG1 THR 612 -4.406 -2.952 -8.177 368 1HG2 THR 612 1HG2 THR 612 -5.081 -0.384 -6.522 369 2HG2 THR 612 2HG2 THR 612 -5.174 -0.441 -8.283 370 3HG2 THR 612 3HG2 THR 612 -6.628 -0.139 -7.332 371 H VAL 613 H VAL 613 -4.230 -1.731 -3.962 372 HA VAL 613 HA VAL 613 -6.775 -0.977 -2.629 373 HB VAL 613 HB VAL 613 -4.020 -1.697 -1.720 374 1HG1 VAL 613 1HG1 VAL 613 -4.347 0.599 -0.845 375 2HG1 VAL 613 2HG1 VAL 613 -5.861 0.084 -0.103 376 3HG1 VAL 613 3HG1 VAL 613 -4.332 -0.606 0.442 377 1HG2 VAL 613 1HG2 VAL 613 -6.810 -2.492 -1.299 378 2HG2 VAL 613 2HG2 VAL 613 -5.332 -3.433 -1.097 379 3HG2 VAL 613 3HG2 VAL 613 -5.891 -2.379 0.202 380 H THR 614 H THR 614 -6.714 1.189 -1.487 381 HA THR 614 HA THR 614 -5.008 3.157 -2.956 382 HB THR 614 HB THR 614 -7.885 3.674 -2.177 383 HG1 THR 614 HG1 THR 614 -8.318 2.357 -3.749 384 1HG2 THR 614 1HG2 THR 614 -6.175 5.542 -2.641 385 2HG2 THR 614 2HG2 THR 614 -6.221 4.995 -4.317 386 3HG2 THR 614 3HG2 THR 614 -7.688 5.596 -3.544 387 H ALA 615 H ALA 615 -4.343 4.959 -1.704 388 HA ALA 615 HA ALA 615 -4.357 4.505 1.188 389 1HB ALA 615 1HB ALA 615 -2.869 6.408 1.309 390 2HB ALA 615 2HB ALA 615 -3.309 6.915 -0.322 391 3HB ALA 615 3HB ALA 615 -2.382 5.434 -0.079 392 H ARG 616 H ARG 616 -5.130 6.132 2.734 393 HA ARG 616 HA ARG 616 -6.940 8.227 1.789 394 1HB ARG 616 1HB ARG 616 -8.149 5.855 1.842 395 2HB ARG 616 2HB ARG 616 -8.259 6.213 3.566 396 1HG ARG 616 1HG ARG 616 -8.957 8.497 1.860 397 2HG ARG 616 2HG ARG 616 -10.027 7.112 1.645 398 1HD ARG 616 1HD ARG 616 -9.649 7.279 4.411 399 2HD ARG 616 2HD ARG 616 -9.834 8.953 3.889 400 HE ARG 616 HE ARG 616 -11.831 6.899 3.054 401 1HH1 ARG 616 1HH1 ARG 616 -11.223 10.163 3.290 402 2HH1 ARG 616 2HH1 ARG 616 -12.706 10.576 4.085 403 1HH2 ARG 616 1HH2 ARG 616 -13.631 7.281 4.644 404 2HH2 ARG 616 2HH2 ARG 616 -14.069 8.944 4.851 405 HA PRO 617 HA PRO 617 -4.987 9.007 5.860 406 1HB PRO 617 1HB PRO 617 -4.093 11.516 5.176 407 2HB PRO 617 2HB PRO 617 -3.170 10.033 4.881 408 1HG PRO 617 1HG PRO 617 -4.665 11.729 2.937 409 2HG PRO 617 2HG PRO 617 -3.272 10.670 2.662 410 1HD PRO 617 1HD PRO 617 -5.965 10.061 2.038 411 2HD PRO 617 2HD PRO 617 -4.617 8.906 2.082 412 H ASN 618 H ASN 618 -5.974 10.185 7.531 413 HA ASN 618 HA ASN 618 -8.277 11.911 6.721 414 1HB ASN 618 1HB ASN 618 -9.252 11.350 8.918 415 2HB ASN 618 2HB ASN 618 -8.914 9.888 7.991 416 2HD2 ASN 618 2HD2 ASN 618 -9.058 9.349 10.617 417 1HD2 ASN 618 1HD2 ASN 618 -7.527 9.204 11.335 418 H GLY 619 H GLY 619 -5.225 11.866 8.281 419 1HA GLY 619 1HA GLY 619 -5.094 13.612 10.304 420 2HA GLY 619 2HA GLY 619 -5.577 14.712 9.013 421 H SER 620 H SER 620 -4.124 13.798 6.868 422 HA SER 620 HA SER 620 -1.989 13.992 5.913 423 1HB SER 620 1HB SER 620 -0.603 14.971 8.293 424 2HB SER 620 2HB SER 620 -0.823 15.748 6.726 425 HG SER 620 HG SER 620 -2.691 16.609 7.403 426 H GLY 621 H GLY 621 -2.701 11.512 7.071 427 1HA GLY 621 1HA GLY 621 -1.777 9.581 8.095 428 2HA GLY 621 2HA GLY 621 -0.461 10.578 8.715 429 H ASN 622 H ASN 622 1.486 10.209 7.770 430 HA ASN 622 HA ASN 622 1.524 9.305 4.923 431 1HB ASN 622 1HB ASN 622 3.595 10.678 6.654 432 2HB ASN 622 2HB ASN 622 3.976 9.985 5.078 433 2HD2 ASN 622 2HD2 ASN 622 4.429 12.572 4.953 434 1HD2 ASN 622 1HD2 ASN 622 3.148 13.461 4.286 435 H SER 623 H SER 623 2.922 8.646 8.132 436 HA SER 623 HA SER 623 4.088 6.122 7.119 437 1HB SER 623 1HB SER 623 4.135 7.225 9.940 438 2HB SER 623 2HB SER 623 5.162 5.956 9.279 439 HG SER 623 HG SER 623 6.441 7.559 8.810 440 H PHE 624 H PHE 624 2.827 4.330 7.115 441 HA PHE 624 HA PHE 624 1.006 3.876 9.417 442 1HB PHE 624 1HB PHE 624 -0.803 3.156 7.843 443 2HB PHE 624 2HB PHE 624 -0.437 4.878 7.731 444 HD1 PHE 624 HD1 PHE 624 1.048 5.714 5.874 445 HD2 PHE 624 HD2 PHE 624 -0.463 1.693 5.988 446 HE1 PHE 624 HE1 PHE 624 1.569 5.449 3.464 447 HE2 PHE 624 HE2 PHE 624 0.059 1.429 3.577 448 HZ PHE 624 HZ PHE 624 1.075 3.307 2.316 449 H GLY 625 H GLY 625 0.528 1.621 9.739 450 1HA GLY 625 1HA GLY 625 1.852 -0.451 9.948 451 2HA GLY 625 2HA GLY 625 2.436 -0.178 8.306 452 H VAL 626 H VAL 626 1.613 -1.903 7.173 453 HA VAL 626 HA VAL 626 -1.309 -2.466 7.474 454 HB VAL 626 HB VAL 626 0.265 -2.546 4.883 455 1HG1 VAL 626 1HG1 VAL 626 -2.532 -3.181 5.714 456 2HG1 VAL 626 2HG1 VAL 626 -2.303 -2.409 4.145 457 3HG1 VAL 626 3HG1 VAL 626 -1.522 -3.952 4.490 458 1HG2 VAL 626 1HG2 VAL 626 -0.213 -0.245 6.059 459 2HG2 VAL 626 2HG2 VAL 626 -0.574 -0.429 4.343 460 3HG2 VAL 626 3HG2 VAL 626 -1.872 -0.533 5.533 461 H THR 627 H THR 627 -1.798 -4.617 7.720 462 HA THR 627 HA THR 627 0.419 -6.509 7.963 463 HB THR 627 HB THR 627 -2.581 -6.866 8.235 464 HG1 THR 627 HG1 THR 627 -2.241 -6.288 10.216 465 1HG2 THR 627 1HG2 THR 627 -0.268 -8.757 8.696 466 2HG2 THR 627 2HG2 THR 627 -1.858 -9.003 9.416 467 3HG2 THR 627 3HG2 THR 627 -1.674 -9.003 7.663 468 H PHE 628 H PHE 628 0.430 -8.590 6.778 469 HA PHE 628 HA PHE 628 -1.097 -8.657 4.250 470 1HB PHE 628 1HB PHE 628 1.922 -8.460 4.386 471 2HB PHE 628 2HB PHE 628 1.056 -9.024 2.958 472 HD1 PHE 628 HD1 PHE 628 -0.667 -7.495 1.881 473 HD2 PHE 628 HD2 PHE 628 2.103 -6.141 4.872 474 HE1 PHE 628 HE1 PHE 628 -1.076 -5.147 1.197 475 HE2 PHE 628 HE2 PHE 628 1.694 -3.792 4.186 476 HZ PHE 628 HZ PHE 628 0.105 -3.295 2.349 477 H TYR 629 H TYR 629 -1.860 -10.715 4.217 478 HA TYR 629 HA TYR 629 -0.671 -12.841 5.770 479 1HB TYR 629 1HB TYR 629 -2.835 -12.740 3.666 480 2HB TYR 629 2HB TYR 629 -2.291 -14.272 4.350 481 HD1 TYR 629 HD1 TYR 629 -2.253 -14.466 6.937 482 HD2 TYR 629 HD2 TYR 629 -4.432 -11.441 4.802 483 HE1 TYR 629 HE1 TYR 629 -3.678 -14.084 8.931 484 HE2 TYR 629 HE2 TYR 629 -5.856 -11.059 6.796 485 HH TYR 629 HH TYR 629 -6.563 -12.504 8.852 486 H LYS 630 H LYS 630 0.750 -14.448 5.106 487 HA LYS 630 HA LYS 630 1.957 -14.060 2.423 488 1HB LYS 630 1HB LYS 630 3.840 -14.265 3.660 489 2HB LYS 630 2HB LYS 630 2.935 -14.828 5.060 490 1HG LYS 630 1HG LYS 630 3.077 -17.089 4.385 491 2HG LYS 630 2HG LYS 630 3.527 -16.659 2.734 492 1HD LYS 630 1HD LYS 630 5.697 -16.789 3.312 493 2HD LYS 630 2HD LYS 630 5.450 -15.473 4.461 494 1HE LYS 630 1HE LYS 630 5.873 -16.956 6.107 495 2HE LYS 630 2HE LYS 630 4.336 -17.722 5.708 496 1HZ LYS 630 1HZ LYS 630 6.635 -18.385 4.037 497 2HZ LYS 630 2HZ LYS 630 6.619 -19.020 5.613 498 3HZ LYS 630 3HZ LYS 630 5.344 -19.365 4.549 499 H ASN 631 H ASN 631 1.183 -16.897 4.488 500 HA ASN 631 HA ASN 631 0.603 -19.085 3.805 501 1HB ASN 631 1HB ASN 631 -1.273 -17.281 2.258 502 2HB ASN 631 2HB ASN 631 -1.450 -19.035 2.294 503 2HD2 ASN 631 2HD2 ASN 631 -0.848 -16.422 4.727 504 1HD2 ASN 631 1HD2 ASN 631 -1.966 -17.022 5.855 505 H GLY 632 H GLY 632 2.915 -18.539 2.540 506 1HA GLY 632 1HA GLY 632 2.723 -20.061 0.098 507 2HA GLY 632 2HA GLY 632 4.177 -19.255 0.692 508 H SER 633 H SER 633 3.167 -16.602 0.795 509 HA SER 633 HA SER 633 2.035 -15.924 -1.815 510 1HB SER 633 1HB SER 633 2.198 -13.623 -1.061 511 2HB SER 633 2HB SER 633 1.589 -14.600 0.271 512 HG SER 633 HG SER 633 4.252 -13.710 -0.160 513 H SER 634 H SER 634 3.736 -13.513 -2.122 514 HA SER 634 HA SER 634 6.317 -14.771 -2.932 515 1HB SER 634 1HB SER 634 5.282 -12.731 -4.790 516 2HB SER 634 2HB SER 634 6.057 -14.274 -5.134 517 HG SER 634 HG SER 634 4.120 -14.961 -5.539 518 H ALA 635 H ALA 635 7.028 -12.218 -4.300 519 HA ALA 635 HA ALA 635 8.422 -10.908 -2.264 520 1HB ALA 635 1HB ALA 635 8.946 -10.398 -4.552 521 2HB ALA 635 2HB ALA 635 8.386 -8.896 -3.817 522 3HB ALA 635 3HB ALA 635 7.307 -9.822 -4.860 523 H THR 636 H THR 636 7.914 -9.341 -0.761 524 HA THR 636 HA THR 636 5.370 -9.025 0.265 525 HB THR 636 HB THR 636 6.604 -6.524 0.663 526 HG1 THR 636 HG1 THR 636 8.523 -8.570 0.905 527 1HG2 THR 636 1HG2 THR 636 5.924 -8.930 2.127 528 2HG2 THR 636 2HG2 THR 636 7.445 -8.255 2.709 529 3HG2 THR 636 3HG2 THR 636 5.987 -7.263 2.696 530 HA PRO 637 HA PRO 637 3.189 -6.178 -2.278 531 1HB PRO 637 1HB PRO 637 2.086 -4.438 -0.457 532 2HB PRO 637 2HB PRO 637 1.525 -6.104 -0.681 533 1HG PRO 637 1HG PRO 637 3.151 -4.953 1.538 534 2HG PRO 637 2HG PRO 637 2.070 -6.357 1.550 535 1HD PRO 637 1HD PRO 637 4.897 -6.439 1.420 536 2HD PRO 637 2HD PRO 637 3.797 -7.798 1.107 537 H GLY 638 H GLY 638 2.922 -3.731 -2.800 538 1HA GLY 638 1HA GLY 638 5.134 -2.442 -3.584 539 2HA GLY 638 2HA GLY 638 5.191 -2.079 -1.860 540 H ALA 639 H ALA 639 4.609 0.042 -1.727 541 HA ALA 639 HA ALA 639 1.902 0.788 -2.658 542 1HB ALA 639 1HB ALA 639 3.781 1.731 -0.596 543 2HB ALA 639 2HB ALA 639 2.018 1.793 -0.624 544 3HB ALA 639 3HB ALA 639 2.958 3.028 -1.462 545 H THR 640 H THR 640 1.584 2.056 -4.423 546 HA THR 640 HA THR 640 3.969 2.911 -5.940 547 HB THR 640 HB THR 640 1.148 3.266 -6.824 548 HG1 THR 640 HG1 THR 640 2.490 0.930 -7.482 549 1HG2 THR 640 1HG2 THR 640 3.030 4.193 -8.165 550 2HG2 THR 640 2HG2 THR 640 3.686 2.562 -8.313 551 3HG2 THR 640 3HG2 THR 640 2.126 2.954 -9.036 552 H CYS 641 H CYS 641 4.269 4.964 -6.714 553 HA CYS 641 HA CYS 641 2.532 7.202 -6.066 554 1HB CYS 641 1HB CYS 641 4.903 6.598 -4.384 555 2HB CYS 641 2HB CYS 641 4.725 8.276 -4.881 556 H ALA 642 H ALA 642 2.912 6.901 -8.504 557 HA ALA 642 HA ALA 642 4.937 8.862 -9.335 558 1HB ALA 642 1HB ALA 642 5.159 6.558 -11.082 559 2HB ALA 642 2HB ALA 642 5.588 6.127 -9.425 560 3HB ALA 642 3HB ALA 642 6.435 7.441 -10.242 561 H THR 643 H THR 643 4.667 9.369 -11.703 562 HA THR 643 HA THR 643 1.851 8.820 -12.545 563 HB THR 643 HB THR 643 1.862 10.961 -13.673 564 HG1 THR 643 HG1 THR 643 3.884 11.265 -14.360 565 1HG2 THR 643 1HG2 THR 643 2.899 11.023 -10.835 566 2HG2 THR 643 2HG2 THR 643 2.346 12.472 -11.675 567 3HG2 THR 643 3HG2 THR 643 1.227 11.142 -11.378 568 H GLY 644 H GLY 644 2.016 7.194 -14.006 569 1HA GLY 644 1HA GLY 644 3.662 5.985 -15.556 570 2HA GLY 644 2HA GLY 644 3.943 7.577 -16.261 No H/Q in entry = 570 Start of MODEL 5 1 H1 THR 557 H1 THR 557 0.255 16.221 -12.635 2 H2 THR 557 H2 THR 557 0.166 15.395 -14.114 3 H3 THR 557 H3 THR 557 -0.275 14.608 -12.675 4 HA THR 557 HA THR 557 1.842 13.781 -13.159 5 HB THR 557 HB THR 557 3.640 15.813 -13.365 6 HG1 THR 557 HG1 THR 557 2.749 17.421 -14.593 7 1HG2 THR 557 1HG2 THR 557 2.257 13.984 -15.178 8 2HG2 THR 557 2HG2 THR 557 2.827 15.440 -15.995 9 3HG2 THR 557 3HG2 THR 557 3.965 14.421 -15.113 10 H GLY 558 H GLY 558 0.557 14.226 -10.767 11 1HA GLY 558 1HA GLY 558 0.961 15.327 -8.581 12 2HA GLY 558 2HA GLY 558 2.660 15.463 -9.038 13 H SER 559 H SER 559 4.004 13.838 -8.374 14 HA SER 559 HA SER 559 2.921 11.136 -7.882 15 1HB SER 559 1HB SER 559 5.712 11.616 -7.124 16 2HB SER 559 2HB SER 559 5.041 10.426 -8.236 17 HG SER 559 HG SER 559 6.266 12.735 -8.783 18 H CYS 560 H CYS 560 3.681 10.048 -5.777 19 HA CYS 560 HA CYS 560 3.448 12.005 -3.525 20 1HB CYS 560 1HB CYS 560 2.540 9.747 -2.373 21 2HB CYS 560 2HB CYS 560 1.475 10.873 -3.209 22 H SER 561 H SER 561 4.960 11.810 -1.886 23 HA SER 561 HA SER 561 7.262 10.091 -2.384 24 1HB SER 561 1HB SER 561 6.532 11.946 -0.102 25 2HB SER 561 2HB SER 561 8.031 11.021 -0.150 26 HG SER 561 HG SER 561 8.454 12.046 -2.180 27 H VAL 562 H VAL 562 7.317 7.984 -1.777 28 HA VAL 562 HA VAL 562 5.912 7.217 0.732 29 HB VAL 562 HB VAL 562 5.429 5.017 -0.768 30 1HG1 VAL 562 1HG1 VAL 562 3.782 7.518 -0.391 31 2HG1 VAL 562 2HG1 VAL 562 3.117 6.047 -1.104 32 3HG1 VAL 562 3HG1 VAL 562 3.732 6.025 0.549 33 1HG2 VAL 562 1HG2 VAL 562 6.339 6.139 -2.809 34 2HG2 VAL 562 2HG2 VAL 562 4.640 5.697 -2.981 35 3HG2 VAL 562 3HG2 VAL 562 5.087 7.373 -2.657 36 H SER 563 H SER 563 6.473 4.801 1.195 37 HA SER 563 HA SER 563 9.077 3.898 0.219 38 1HB SER 563 1HB SER 563 8.761 5.219 2.896 39 2HB SER 563 2HB SER 563 9.887 3.873 2.733 40 HG SER 563 HG SER 563 10.750 6.036 2.308 41 H ALA 564 H ALA 564 9.596 1.744 1.136 42 HA ALA 564 HA ALA 564 7.357 0.496 2.645 43 1HB ALA 564 1HB ALA 564 6.812 -0.018 0.354 44 2HB ALA 564 2HB ALA 564 8.478 -0.484 0.008 45 3HB ALA 564 3HB ALA 564 7.487 -1.481 1.073 46 H VAL 565 H VAL 565 8.905 0.495 4.406 47 HA VAL 565 HA VAL 565 11.426 -0.959 4.111 48 HB VAL 565 HB VAL 565 10.159 -0.391 6.769 49 1HG1 VAL 565 1HG1 VAL 565 12.916 -0.534 5.574 50 2HG1 VAL 565 2HG1 VAL 565 12.656 0.389 7.055 51 3HG1 VAL 565 3HG1 VAL 565 12.284 -1.336 7.013 52 1HG2 VAL 565 1HG2 VAL 565 10.968 1.594 4.683 53 2HG2 VAL 565 2HG2 VAL 565 9.720 1.720 5.924 54 3HG2 VAL 565 3HG2 VAL 565 11.416 1.940 6.354 55 H ARG 566 H ARG 566 11.854 -2.880 5.592 56 HA ARG 566 HA ARG 566 9.668 -4.825 5.288 57 1HB ARG 566 1HB ARG 566 12.573 -4.938 6.000 58 2HB ARG 566 2HB ARG 566 11.538 -6.256 6.552 59 1HG ARG 566 1HG ARG 566 11.595 -7.156 4.494 60 2HG ARG 566 2HG ARG 566 10.846 -5.697 3.844 61 1HD ARG 566 1HD ARG 566 13.668 -5.283 4.445 62 2HD ARG 566 2HD ARG 566 13.430 -6.602 3.299 63 HE ARG 566 HE ARG 566 12.554 -3.786 2.867 64 1HH1 ARG 566 1HH1 ARG 566 11.040 -6.213 1.603 65 2HH1 ARG 566 2HH1 ARG 566 11.737 -6.199 0.018 66 1HH2 ARG 566 1HH2 ARG 566 14.355 -4.100 0.899 67 2HH2 ARG 566 2HH2 ARG 566 13.614 -5.003 -0.381 68 H GLY 567 H GLY 567 8.559 -3.190 6.871 69 1HA GLY 567 1HA GLY 567 7.363 -3.185 8.886 70 2HA GLY 567 2HA GLY 567 8.969 -2.833 9.533 71 H GLU 568 H GLU 568 8.413 -4.048 11.469 72 HA GLU 568 HA GLU 568 9.423 -6.613 11.682 73 1HB GLU 568 1HB GLU 568 7.398 -5.082 13.257 74 2HB GLU 568 2HB GLU 568 7.585 -6.801 13.608 75 1HG GLU 568 1HG GLU 568 9.854 -6.553 14.212 76 2HG GLU 568 2HG GLU 568 9.985 -4.986 13.414 77 H GLU 569 H GLU 569 8.122 -8.670 12.216 78 HA GLU 569 HA GLU 569 5.658 -8.902 10.567 79 1HB GLU 569 1HB GLU 569 7.879 -10.942 10.358 80 2HB GLU 569 2HB GLU 569 6.472 -10.749 9.312 81 1HG GLU 569 1HG GLU 569 7.339 -8.603 8.500 82 2HG GLU 569 2HG GLU 569 8.724 -8.736 9.583 83 H TRP 570 H TRP 570 5.356 -11.683 10.824 84 HA TRP 570 HA TRP 570 5.543 -12.203 13.745 85 1HB TRP 570 1HB TRP 570 2.987 -12.377 12.120 86 2HB TRP 570 2HB TRP 570 3.167 -12.933 13.784 87 HD1 TRP 570 HD1 TRP 570 3.849 -11.004 15.618 88 HE1 TRP 570 HE1 TRP 570 3.166 -8.518 15.701 89 HE3 TRP 570 HE3 TRP 570 2.377 -10.333 10.774 90 HZ2 TRP 570 HZ2 TRP 570 2.132 -6.512 13.943 91 HZ3 TRP 570 HZ3 TRP 570 1.548 -8.128 10.006 92 HH2 TRP 570 HH2 TRP 570 1.424 -6.219 11.582 93 H ALA 571 H ALA 571 3.424 -14.161 11.814 94 HA ALA 571 HA ALA 571 5.596 -16.096 11.232 95 1HB ALA 571 1HB ALA 571 3.695 -17.795 12.164 96 2HB ALA 571 2HB ALA 571 3.421 -16.412 13.224 97 3HB ALA 571 3HB ALA 571 5.010 -17.175 13.164 98 H ASP 572 H ASP 572 2.020 -16.236 11.257 99 HA ASP 572 HA ASP 572 2.024 -17.371 8.561 100 1HB ASP 572 1HB ASP 572 -0.349 -16.398 10.178 101 2HB ASP 572 2HB ASP 572 -0.368 -17.543 8.836 102 H ARG 573 H ARG 573 2.095 -14.233 9.846 103 HA ARG 573 HA ARG 573 1.452 -13.129 7.168 104 1HB ARG 573 1HB ARG 573 0.399 -11.287 9.075 105 2HB ARG 573 2HB ARG 573 -0.475 -12.162 7.821 106 1HG ARG 573 1HG ARG 573 -0.973 -13.972 9.288 107 2HG ARG 573 2HG ARG 573 0.204 -13.426 10.482 108 1HD ARG 573 1HD ARG 573 -2.029 -11.581 9.717 109 2HD ARG 573 2HD ARG 573 -2.371 -12.916 10.817 110 HE ARG 573 HE ARG 573 -0.093 -11.121 11.462 111 1HH1 ARG 573 1HH1 ARG 573 -1.859 -13.282 13.028 112 2HH1 ARG 573 2HH1 ARG 573 -2.575 -12.226 14.198 113 1HH2 ARG 573 1HH2 ARG 573 -1.623 -9.325 12.553 114 2HH2 ARG 573 2HH2 ARG 573 -2.442 -9.984 13.929 115 H PHE 574 H PHE 574 2.617 -11.224 6.710 116 HA PHE 574 HA PHE 574 4.663 -10.513 8.772 117 1HB PHE 574 1HB PHE 574 6.100 -9.828 6.924 118 2HB PHE 574 2HB PHE 574 5.534 -11.473 6.631 119 HD1 PHE 574 HD1 PHE 574 3.785 -11.927 4.950 120 HD2 PHE 574 HD2 PHE 574 5.348 -7.972 5.557 121 HE1 PHE 574 HE1 PHE 574 2.793 -11.204 2.795 122 HE2 PHE 574 HE2 PHE 574 4.354 -7.249 3.403 123 HZ PHE 574 HZ PHE 574 3.077 -8.864 2.022 124 H ASN 575 H ASN 575 5.282 -8.205 8.849 125 HA ASN 575 HA ASN 575 2.995 -6.441 8.057 126 1HB ASN 575 1HB ASN 575 3.717 -6.901 10.592 127 2HB ASN 575 2HB ASN 575 4.886 -5.632 10.221 128 2HD2 ASN 575 2HD2 ASN 575 3.236 -4.679 12.031 129 1HD2 ASN 575 1HD2 ASN 575 1.971 -3.749 11.386 130 H VAL 576 H VAL 576 3.753 -4.077 7.844 131 HA VAL 576 HA VAL 576 6.549 -3.783 6.945 132 HB VAL 576 HB VAL 576 4.365 -2.947 5.056 133 1HG1 VAL 576 1HG1 VAL 576 6.748 -2.109 4.879 134 2HG1 VAL 576 2HG1 VAL 576 7.227 -3.772 4.544 135 3HG1 VAL 576 3HG1 VAL 576 6.138 -2.929 3.442 136 1HG2 VAL 576 1HG2 VAL 576 4.174 -5.420 5.526 137 2HG2 VAL 576 2HG2 VAL 576 4.588 -5.042 3.854 138 3HG2 VAL 576 3HG2 VAL 576 5.840 -5.594 4.968 139 H THR 577 H THR 577 7.104 -1.522 6.652 140 HA THR 577 HA THR 577 5.157 0.343 7.944 141 HB THR 577 HB THR 577 8.167 0.183 8.241 142 HG1 THR 577 HG1 THR 577 7.320 -1.058 9.759 143 1HG2 THR 577 1HG2 THR 577 6.454 2.487 8.298 144 2HG2 THR 577 2HG2 THR 577 7.049 2.172 9.928 145 3HG2 THR 577 3HG2 THR 577 8.188 2.400 8.600 146 H TYR 578 H TYR 578 4.390 1.460 6.170 147 HA TYR 578 HA TYR 578 6.263 2.289 4.045 148 1HB TYR 578 1HB TYR 578 3.278 2.705 4.389 149 2HB TYR 578 2HB TYR 578 4.202 3.220 2.978 150 HD1 TYR 578 HD1 TYR 578 2.914 0.324 4.861 151 HD2 TYR 578 HD2 TYR 578 5.106 1.598 1.393 152 HE1 TYR 578 HE1 TYR 578 2.715 -1.953 3.898 153 HE2 TYR 578 HE2 TYR 578 4.908 -0.677 0.432 154 HH TYR 578 HH TYR 578 4.574 -3.055 1.391 155 H SER 579 H SER 579 7.099 4.335 3.871 156 HA SER 579 HA SER 579 6.146 6.349 5.869 157 1HB SER 579 1HB SER 579 8.866 5.685 4.792 158 2HB SER 579 2HB SER 579 8.532 7.330 5.324 159 HG SER 579 HG SER 579 9.110 5.221 6.804 160 H VAL 580 H VAL 580 5.820 8.484 5.147 161 HA VAL 580 HA VAL 580 5.980 8.908 2.193 162 HB VAL 580 HB VAL 580 3.724 9.537 4.105 163 1HG1 VAL 580 1HG1 VAL 580 4.296 11.501 2.612 164 2HG1 VAL 580 2HG1 VAL 580 3.950 10.461 1.231 165 3HG1 VAL 580 3HG1 VAL 580 2.673 10.848 2.386 166 1HG2 VAL 580 1HG2 VAL 580 4.235 7.688 1.852 167 2HG2 VAL 580 2HG2 VAL 580 3.170 7.501 3.245 168 3HG2 VAL 580 3HG2 VAL 580 2.649 8.462 1.860 169 H SER 581 H SER 581 6.238 11.176 1.578 170 HA SER 581 HA SER 581 7.585 12.743 3.729 171 1HB SER 581 1HB SER 581 7.679 13.236 0.743 172 2HB SER 581 2HB SER 581 8.735 13.922 1.972 173 HG SER 581 HG SER 581 8.506 11.132 1.666 174 H GLY 582 H GLY 582 4.830 12.763 3.883 175 1HA GLY 582 1HA GLY 582 4.205 15.539 3.796 176 2HA GLY 582 2HA GLY 582 3.017 14.247 3.988 177 H SER 583 H SER 583 3.341 12.886 1.569 178 HA SER 583 HA SER 583 3.552 14.266 -0.819 179 1HB SER 583 1HB SER 583 1.417 12.777 -1.447 180 2HB SER 583 2HB SER 583 3.005 12.059 -1.194 181 HG SER 583 HG SER 583 0.977 12.375 0.774 182 H SER 584 H SER 584 1.029 14.592 1.590 183 HA SER 584 HA SER 584 -0.549 16.335 1.812 184 1HB SER 584 1HB SER 584 1.275 17.599 0.390 185 2HB SER 584 2HB SER 584 0.130 17.363 -0.927 186 HG SER 584 HG SER 584 -0.397 19.273 0.058 187 H SER 585 H SER 585 -0.452 13.928 -0.473 188 HA SER 585 HA SER 585 -3.350 14.013 -0.830 189 1HB SER 585 1HB SER 585 -1.563 14.207 -3.274 190 2HB SER 585 2HB SER 585 -3.320 14.080 -3.272 191 HG SER 585 HG SER 585 -1.860 16.262 -3.146 192 H TRP 586 H TRP 586 -3.390 11.932 0.068 193 HA TRP 586 HA TRP 586 -1.579 9.842 -0.741 194 1HB TRP 586 1HB TRP 586 -4.023 10.029 0.936 195 2HB TRP 586 2HB TRP 586 -3.636 8.440 0.275 196 HD1 TRP 586 HD1 TRP 586 -2.684 10.780 3.003 197 HE1 TRP 586 HE1 TRP 586 -0.619 9.861 4.254 198 HE3 TRP 586 HE3 TRP 586 -1.252 7.081 -0.202 199 HZ2 TRP 586 HZ2 TRP 586 1.351 7.850 3.953 200 HZ3 TRP 586 HZ3 TRP 586 0.722 5.672 0.306 201 HH2 TRP 586 HH2 TRP 586 2.030 6.052 2.378 202 H VAL 587 H VAL 587 -1.618 8.680 -2.551 203 HA VAL 587 HA VAL 587 -4.123 7.822 -3.778 204 HB VAL 587 HB VAL 587 -2.260 9.562 -5.417 205 1HG1 VAL 587 1HG1 VAL 587 -4.520 7.791 -5.970 206 2HG1 VAL 587 2HG1 VAL 587 -4.781 9.422 -6.589 207 3HG1 VAL 587 3HG1 VAL 587 -3.358 8.506 -7.089 208 1HG2 VAL 587 1HG2 VAL 587 -4.937 10.214 -4.142 209 2HG2 VAL 587 2HG2 VAL 587 -3.387 10.968 -3.767 210 3HG2 VAL 587 3HG2 VAL 587 -4.132 11.222 -5.344 211 H VAL 588 H VAL 588 -1.676 6.648 -2.614 212 HA VAL 588 HA VAL 588 -0.098 5.596 -4.842 213 HB VAL 588 HB VAL 588 0.954 5.779 -2.631 214 1HG1 VAL 588 1HG1 VAL 588 -1.370 4.001 -1.863 215 2HG1 VAL 588 2HG1 VAL 588 0.079 4.128 -0.863 216 3HG1 VAL 588 3HG1 VAL 588 -0.913 5.554 -1.163 217 1HG2 VAL 588 1HG2 VAL 588 0.937 3.478 -4.267 218 2HG2 VAL 588 2HG2 VAL 588 2.142 3.886 -3.042 219 3HG2 VAL 588 3HG2 VAL 588 0.764 2.868 -2.620 220 H THR 589 H THR 589 -0.186 3.488 -5.635 221 HA THR 589 HA THR 589 -2.692 2.024 -4.957 222 HB THR 589 HB THR 589 -1.055 1.822 -7.505 223 HG1 THR 589 HG1 THR 589 -2.056 3.578 -8.013 224 1HG2 THR 589 1HG2 THR 589 -3.248 0.295 -6.365 225 2HG2 THR 589 2HG2 THR 589 -3.697 0.997 -7.921 226 3HG2 THR 589 3HG2 THR 589 -2.278 -0.044 -7.799 227 H LEU 590 H LEU 590 -2.276 0.298 -3.676 228 HA LEU 590 HA LEU 590 0.418 -0.817 -3.486 229 1HB LEU 590 1HB LEU 590 -2.218 -1.338 -2.138 230 2HB LEU 590 2HB LEU 590 -0.912 -2.514 -1.983 231 HG LEU 590 HG LEU 590 0.251 0.037 -1.574 232 1HD1 LEU 590 1HD1 LEU 590 -2.300 0.541 -1.140 233 2HD1 LEU 590 2HD1 LEU 590 -2.004 -0.306 0.379 234 3HD1 LEU 590 3HD1 LEU 590 -1.083 1.146 -0.016 235 1HD2 LEU 590 1HD2 LEU 590 0.067 -2.532 -0.343 236 2HD2 LEU 590 2HD2 LEU 590 1.252 -1.265 -0.031 237 3HD2 LEU 590 3HD2 LEU 590 -0.243 -1.322 0.901 238 H GLY 591 H GLY 591 1.175 -2.500 -4.668 239 1HA GLY 591 1HA GLY 591 0.883 -3.831 -6.721 240 2HA GLY 591 2HA GLY 591 -0.807 -4.064 -6.269 241 H LEU 592 H LEU 592 -1.200 -5.401 -4.301 242 HA LEU 592 HA LEU 592 0.878 -6.921 -3.061 243 1HB LEU 592 1HB LEU 592 -1.913 -7.990 -3.272 244 2HB LEU 592 2HB LEU 592 -0.822 -7.969 -1.895 245 HG LEU 592 HG LEU 592 -2.489 -5.710 -2.981 246 1HD1 LEU 592 1HD1 LEU 592 -3.205 -7.394 -1.133 247 2HD1 LEU 592 2HD1 LEU 592 -2.061 -6.523 -0.111 248 3HD1 LEU 592 3HD1 LEU 592 -3.430 -5.672 -0.825 249 1HD2 LEU 592 1HD2 LEU 592 0.122 -5.614 -1.537 250 2HD2 LEU 592 2HD2 LEU 592 -0.574 -4.459 -2.672 251 3HD2 LEU 592 3HD2 LEU 592 -1.134 -4.499 -1.000 252 H ASN 593 H ASN 593 0.322 -9.550 -3.191 253 HA ASN 593 HA ASN 593 1.062 -10.216 -5.975 254 1HB ASN 593 1HB ASN 593 0.910 -12.019 -3.541 255 2HB ASN 593 2HB ASN 593 1.686 -12.392 -5.081 256 2HD2 ASN 593 2HD2 ASN 593 3.655 -12.669 -3.548 257 1HD2 ASN 593 1HD2 ASN 593 4.567 -11.280 -3.206 258 H GLY 594 H GLY 594 0.080 -12.840 -6.116 259 1HA GLY 594 1HA GLY 594 -1.888 -13.683 -7.196 260 2HA GLY 594 2HA GLY 594 -2.780 -12.278 -6.611 261 H GLY 595 H GLY 595 -2.982 -12.233 -4.111 262 1HA GLY 595 1HA GLY 595 -3.015 -14.912 -2.870 263 2HA GLY 595 2HA GLY 595 -4.585 -14.129 -3.067 264 H GLN 596 H GLN 596 -1.666 -12.286 -2.449 265 HA GLN 596 HA GLN 596 -1.811 -12.190 0.399 266 1HB GLN 596 1HB GLN 596 -0.622 -10.416 -1.714 267 2HB GLN 596 2HB GLN 596 -0.676 -9.855 -0.043 268 1HG GLN 596 1HG GLN 596 0.336 -12.193 0.523 269 2HG GLN 596 2HG GLN 596 0.774 -12.232 -1.186 270 2HE2 GLN 596 2HE2 GLN 596 1.120 -9.232 -1.259 271 1HE2 GLN 596 1HE2 GLN 596 2.594 -8.937 -0.471 272 H SER 597 H SER 597 -3.124 -11.028 1.758 273 HA SER 597 HA SER 597 -4.911 -8.975 0.520 274 1HB SER 597 1HB SER 597 -6.430 -9.925 2.570 275 2HB SER 597 2HB SER 597 -6.558 -10.504 0.912 276 HG SER 597 HG SER 597 -6.259 -12.188 2.478 277 H VAL 598 H VAL 598 -5.744 -7.399 2.158 278 HA VAL 598 HA VAL 598 -3.582 -6.676 4.019 279 HB VAL 598 HB VAL 598 -6.169 -5.313 3.227 280 1HG1 VAL 598 1HG1 VAL 598 -3.996 -4.407 5.140 281 2HG1 VAL 598 2HG1 VAL 598 -5.287 -3.374 4.528 282 3HG1 VAL 598 3HG1 VAL 598 -5.675 -4.755 5.553 283 1HG2 VAL 598 1HG2 VAL 598 -4.355 -5.325 1.542 284 2HG2 VAL 598 2HG2 VAL 598 -4.625 -3.700 2.174 285 3HG2 VAL 598 3HG2 VAL 598 -3.248 -4.647 2.736 286 H GLN 599 H GLN 599 -3.620 -7.200 6.151 287 HA GLN 599 HA GLN 599 -6.067 -8.437 7.257 288 1HB GLN 599 1HB GLN 599 -3.997 -9.610 7.701 289 2HB GLN 599 2HB GLN 599 -3.251 -8.145 8.340 290 1HG GLN 599 1HG GLN 599 -5.806 -9.042 9.596 291 2HG GLN 599 2HG GLN 599 -4.353 -9.979 9.950 292 2HE2 GLN 599 2HE2 GLN 599 -5.735 -8.319 11.914 293 1HE2 GLN 599 1HE2 GLN 599 -4.664 -7.082 12.370 294 H SER 600 H SER 600 -3.891 -5.694 7.947 295 HA SER 600 HA SER 600 -6.111 -4.161 9.045 296 1HB SER 600 1HB SER 600 -5.430 -4.044 11.316 297 2HB SER 600 2HB SER 600 -5.352 -5.758 10.918 298 HG SER 600 HG SER 600 -3.451 -5.096 11.953 299 H SER 601 H SER 601 -5.225 -1.997 9.918 300 HA SER 601 HA SER 601 -2.532 -1.249 9.073 301 1HB SER 601 1HB SER 601 -3.636 0.599 7.541 302 2HB SER 601 2HB SER 601 -3.316 -1.008 6.895 303 HG SER 601 HG SER 601 -5.690 0.262 7.397 304 H TRP 602 H TRP 602 -2.181 1.144 9.503 305 HA TRP 602 HA TRP 602 -4.213 2.495 11.126 306 1HB TRP 602 1HB TRP 602 -2.973 2.547 13.188 307 2HB TRP 602 2HB TRP 602 -3.077 0.856 12.695 308 HD1 TRP 602 HD1 TRP 602 -0.622 3.782 12.882 309 HE1 TRP 602 HE1 TRP 602 1.770 2.870 12.693 310 HE3 TRP 602 HE3 TRP 602 -1.632 -1.108 11.815 311 HZ2 TRP 602 HZ2 TRP 602 3.095 0.388 12.159 312 HZ3 TRP 602 HZ3 TRP 602 0.216 -2.724 11.471 313 HH2 TRP 602 HH2 TRP 602 2.575 -1.983 11.641 314 H ASN 603 H ASN 603 -3.505 4.699 11.710 315 HA ASN 603 HA ASN 603 -2.282 6.685 11.361 316 1HB ASN 603 1HB ASN 603 -0.333 4.647 11.090 317 2HB ASN 603 2HB ASN 603 -0.128 5.723 9.707 318 2HD2 ASN 603 2HD2 ASN 603 -0.711 8.223 10.708 319 1HD2 ASN 603 1HD2 ASN 603 0.324 8.614 11.996 320 H ALA 604 H ALA 604 -4.153 5.255 9.395 321 HA ALA 604 HA ALA 604 -4.431 7.199 7.445 322 1HB ALA 604 1HB ALA 604 -2.315 5.180 6.720 323 2HB ALA 604 2HB ALA 604 -3.288 5.947 5.464 324 3HB ALA 604 3HB ALA 604 -2.282 6.933 6.526 325 H ALA 605 H ALA 605 -5.626 6.331 5.435 326 HA ALA 605 HA ALA 605 -7.183 3.914 6.252 327 1HB ALA 605 1HB ALA 605 -8.989 5.216 5.919 328 2HB ALA 605 2HB ALA 605 -8.558 5.310 4.212 329 3HB ALA 605 3HB ALA 605 -7.973 6.535 5.338 330 H LEU 606 H LEU 606 -8.174 2.795 4.210 331 HA LEU 606 HA LEU 606 -6.429 2.931 1.835 332 1HB LEU 606 1HB LEU 606 -5.781 0.592 1.929 333 2HB LEU 606 2HB LEU 606 -5.287 1.369 3.433 334 HG LEU 606 HG LEU 606 -7.780 0.581 4.133 335 1HD1 LEU 606 1HD1 LEU 606 -8.029 -0.508 1.849 336 2HD1 LEU 606 2HD1 LEU 606 -6.769 -1.642 2.335 337 3HD1 LEU 606 3HD1 LEU 606 -8.294 -1.588 3.218 338 1HD2 LEU 606 1HD2 LEU 606 -5.212 -1.038 4.203 339 2HD2 LEU 606 2HD2 LEU 606 -5.799 0.075 5.439 340 3HD2 LEU 606 3HD2 LEU 606 -6.648 -1.443 5.143 341 H THR 607 H THR 607 -7.361 1.771 0.016 342 HA THR 607 HA THR 607 -10.240 1.068 0.436 343 HB THR 607 HB THR 607 -9.106 2.114 -2.159 344 HG1 THR 607 HG1 THR 607 -10.013 4.148 -1.387 345 1HG2 THR 607 1HG2 THR 607 -11.774 1.521 -0.994 346 2HG2 THR 607 2HG2 THR 607 -11.662 2.959 -2.008 347 3HG2 THR 607 3HG2 THR 607 -11.217 1.381 -2.661 348 H GLY 608 H GLY 608 -10.331 -1.133 0.322 349 1HA GLY 608 1HA GLY 608 -8.839 -2.450 -1.914 350 2HA GLY 608 2HA GLY 608 -10.430 -2.982 -1.369 351 H SER 609 H SER 609 -8.789 -4.999 -1.306 352 HA SER 609 HA SER 609 -7.221 -5.103 1.181 353 1HB SER 609 1HB SER 609 -9.385 -7.163 0.921 354 2HB SER 609 2HB SER 609 -8.543 -6.608 2.365 355 HG SER 609 HG SER 609 -9.740 -4.761 2.346 356 H SER 610 H SER 610 -7.068 -5.590 -1.854 357 HA SER 610 HA SER 610 -5.061 -7.491 -1.964 358 1HB SER 610 1HB SER 610 -6.459 -9.494 -2.877 359 2HB SER 610 2HB SER 610 -6.355 -9.268 -1.132 360 HG SER 610 HG SER 610 -8.417 -8.886 -1.101 361 H GLY 611 H GLY 611 -4.212 -6.864 -3.883 362 1HA GLY 611 1HA GLY 611 -6.079 -6.559 -6.201 363 2HA GLY 611 2HA GLY 611 -4.408 -7.102 -6.357 364 H THR 612 H THR 612 -6.499 -4.354 -6.113 365 HA THR 612 HA THR 612 -4.104 -2.561 -6.213 366 HB THR 612 HB THR 612 -6.728 -2.295 -7.715 367 HG1 THR 612 HG1 THR 612 -4.117 -2.544 -8.753 368 1HG2 THR 612 1HG2 THR 612 -4.967 -0.290 -6.836 369 2HG2 THR 612 2HG2 THR 612 -4.581 -0.535 -8.538 370 3HG2 THR 612 3HG2 THR 612 -6.229 -0.129 -8.056 371 H VAL 613 H VAL 613 -4.136 -1.734 -4.130 372 HA VAL 613 HA VAL 613 -6.731 -0.686 -3.112 373 HB VAL 613 HB VAL 613 -4.257 -1.800 -1.860 374 1HG1 VAL 613 1HG1 VAL 613 -4.379 0.513 -0.970 375 2HG1 VAL 613 2HG1 VAL 613 -6.033 0.204 -0.444 376 3HG1 VAL 613 3HG1 VAL 613 -4.697 -0.699 0.271 377 1HG2 VAL 613 1HG2 VAL 613 -6.516 -2.964 -2.124 378 2HG2 VAL 613 2HG2 VAL 613 -5.841 -2.956 -0.494 379 3HG2 VAL 613 3HG2 VAL 613 -7.132 -1.832 -0.920 380 H THR 614 H THR 614 -6.514 1.440 -1.885 381 HA THR 614 HA THR 614 -4.299 3.135 -2.916 382 HB THR 614 HB THR 614 -7.181 4.049 -2.979 383 HG1 THR 614 HG1 THR 614 -7.231 3.478 -5.079 384 1HG2 THR 614 1HG2 THR 614 -4.568 5.252 -3.460 385 2HG2 THR 614 2HG2 THR 614 -5.640 5.424 -4.850 386 3HG2 THR 614 3HG2 THR 614 -6.139 6.029 -3.270 387 H ALA 615 H ALA 615 -3.580 4.623 -1.407 388 HA ALA 615 HA ALA 615 -4.689 4.395 1.300 389 1HB ALA 615 1HB ALA 615 -2.860 6.551 1.222 390 2HB ALA 615 2HB ALA 615 -2.553 4.912 1.795 391 3HB ALA 615 3HB ALA 615 -2.226 5.332 0.115 392 H ARG 616 H ARG 616 -5.986 5.878 2.335 393 HA ARG 616 HA ARG 616 -6.842 8.239 0.716 394 1HB ARG 616 1HB ARG 616 -8.530 6.378 1.325 395 2HB ARG 616 2HB ARG 616 -8.428 7.006 2.969 396 1HG ARG 616 1HG ARG 616 -9.116 9.226 2.194 397 2HG ARG 616 2HG ARG 616 -9.154 8.650 0.527 398 1HD ARG 616 1HD ARG 616 -11.414 8.705 1.638 399 2HD ARG 616 2HD ARG 616 -10.955 7.115 1.029 400 HE ARG 616 HE ARG 616 -10.122 7.343 3.755 401 1HH1 ARG 616 1HH1 ARG 616 -12.512 6.205 1.645 402 2HH1 ARG 616 2HH1 ARG 616 -13.649 5.804 2.890 403 1HH2 ARG 616 1HH2 ARG 616 -11.762 7.214 5.435 404 2HH2 ARG 616 2HH2 ARG 616 -13.225 6.376 5.035 405 HA PRO 617 HA PRO 617 -5.150 10.677 3.997 406 1HB PRO 617 1HB PRO 617 -6.276 13.071 3.248 407 2HB PRO 617 2HB PRO 617 -4.880 12.348 2.431 408 1HG PRO 617 1HG PRO 617 -7.716 12.501 1.519 409 2HG PRO 617 2HG PRO 617 -6.232 12.395 0.557 410 1HD PRO 617 1HD PRO 617 -8.004 10.261 1.103 411 2HD PRO 617 2HD PRO 617 -6.360 10.111 0.445 412 H ASN 618 H ASN 618 -5.861 11.224 6.062 413 HA ASN 618 HA ASN 618 -8.823 11.347 6.469 414 1HB ASN 618 1HB ASN 618 -6.680 10.443 8.418 415 2HB ASN 618 2HB ASN 618 -8.418 10.450 8.720 416 2HD2 ASN 618 2HD2 ASN 618 -9.699 9.187 6.867 417 1HD2 ASN 618 1HD2 ASN 618 -9.014 7.706 6.401 418 H GLY 619 H GLY 619 -5.922 13.098 6.645 419 1HA GLY 619 1HA GLY 619 -7.101 15.001 8.624 420 2HA GLY 619 2HA GLY 619 -6.477 15.581 7.080 421 H SER 620 H SER 620 -4.582 13.007 7.996 422 HA SER 620 HA SER 620 -2.202 14.405 8.325 423 1HB SER 620 1HB SER 620 -3.893 14.513 10.729 424 2HB SER 620 2HB SER 620 -2.266 13.918 11.038 425 HG SER 620 HG SER 620 -3.069 16.414 10.595 426 H GLY 621 H GLY 621 -0.692 12.831 8.072 427 1HA GLY 621 1HA GLY 621 -1.440 10.040 8.702 428 2HA GLY 621 2HA GLY 621 0.002 10.671 9.499 429 H ASN 622 H ASN 622 1.881 10.360 8.403 430 HA ASN 622 HA ASN 622 1.722 10.037 5.432 431 1HB ASN 622 1HB ASN 622 3.967 11.096 7.174 432 2HB ASN 622 2HB ASN 622 4.130 10.767 5.449 433 2HD2 ASN 622 2HD2 ASN 622 1.655 11.709 4.475 434 1HD2 ASN 622 1HD2 ASN 622 1.541 13.379 4.755 435 H SER 623 H SER 623 2.593 8.569 8.421 436 HA SER 623 HA SER 623 3.951 6.359 6.929 437 1HB SER 623 1HB SER 623 4.253 7.139 9.847 438 2HB SER 623 2HB SER 623 5.088 5.810 9.045 439 HG SER 623 HG SER 623 5.216 8.449 8.051 440 H PHE 624 H PHE 624 2.476 4.748 6.647 441 HA PHE 624 HA PHE 624 0.710 4.088 8.971 442 1HB PHE 624 1HB PHE 624 -1.061 3.518 7.463 443 2HB PHE 624 2HB PHE 624 -0.452 5.086 6.932 444 HD1 PHE 624 HD1 PHE 624 1.081 5.235 4.962 445 HD2 PHE 624 HD2 PHE 624 -0.826 1.558 6.101 446 HE1 PHE 624 HE1 PHE 624 1.584 4.279 2.726 447 HE2 PHE 624 HE2 PHE 624 -0.321 0.604 3.868 448 HZ PHE 624 HZ PHE 624 0.884 1.965 2.182 449 H GLY 625 H GLY 625 0.540 1.902 9.498 450 1HA GLY 625 1HA GLY 625 1.879 -0.125 9.749 451 2HA GLY 625 2HA GLY 625 2.484 0.118 8.110 452 H VAL 626 H VAL 626 1.799 -2.058 7.553 453 HA VAL 626 HA VAL 626 -1.099 -2.628 7.667 454 HB VAL 626 HB VAL 626 0.418 -2.495 5.042 455 1HG1 VAL 626 1HG1 VAL 626 -1.303 -4.303 5.219 456 2HG1 VAL 626 2HG1 VAL 626 -2.506 -3.073 5.605 457 3HG1 VAL 626 3HG1 VAL 626 -1.719 -3.072 4.026 458 1HG2 VAL 626 1HG2 VAL 626 -1.535 -0.669 6.420 459 2HG2 VAL 626 2HG2 VAL 626 -0.069 -0.258 5.529 460 3HG2 VAL 626 3HG2 VAL 626 -1.521 -0.756 4.659 461 H THR 627 H THR 627 -1.508 -4.839 7.661 462 HA THR 627 HA THR 627 0.907 -6.584 7.647 463 HB THR 627 HB THR 627 -1.869 -6.958 8.803 464 HG1 THR 627 HG1 THR 627 -0.352 -7.256 10.687 465 1HG2 THR 627 1HG2 THR 627 0.451 -8.887 8.573 466 2HG2 THR 627 2HG2 THR 627 -0.882 -9.108 9.707 467 3HG2 THR 627 3HG2 THR 627 -1.192 -9.108 7.971 468 H PHE 628 H PHE 628 0.523 -8.825 6.703 469 HA PHE 628 HA PHE 628 -1.508 -8.852 4.537 470 1HB PHE 628 1HB PHE 628 1.460 -9.300 4.090 471 2HB PHE 628 2HB PHE 628 0.201 -9.544 2.880 472 HD1 PHE 628 HD1 PHE 628 -1.130 -7.612 2.040 473 HD2 PHE 628 HD2 PHE 628 2.212 -7.092 4.689 474 HE1 PHE 628 HE1 PHE 628 -1.047 -5.201 1.464 475 HE2 PHE 628 HE2 PHE 628 2.294 -4.681 4.114 476 HZ PHE 628 HZ PHE 628 0.665 -3.735 2.501 477 H TYR 629 H TYR 629 -2.493 -10.809 4.553 478 HA TYR 629 HA TYR 629 -1.389 -12.985 6.173 479 1HB TYR 629 1HB TYR 629 -3.947 -12.454 4.718 480 2HB TYR 629 2HB TYR 629 -3.522 -14.133 5.049 481 HD1 TYR 629 HD1 TYR 629 -2.676 -14.615 7.513 482 HD2 TYR 629 HD2 TYR 629 -5.065 -11.236 6.364 483 HE1 TYR 629 HE1 TYR 629 -3.420 -14.342 9.863 484 HE2 TYR 629 HE2 TYR 629 -5.809 -10.963 8.714 485 HH TYR 629 HH TYR 629 -4.562 -11.775 11.141 486 H LYS 630 H LYS 630 -0.147 -14.621 5.382 487 HA LYS 630 HA LYS 630 -0.489 -15.940 2.926 488 1HB LYS 630 1HB LYS 630 0.589 -14.749 1.327 489 2HB LYS 630 2HB LYS 630 0.462 -13.388 2.434 490 1HG LYS 630 1HG LYS 630 2.754 -13.435 1.915 491 2HG LYS 630 2HG LYS 630 2.682 -14.304 3.449 492 1HD LYS 630 1HD LYS 630 3.882 -15.860 2.266 493 2HD LYS 630 2HD LYS 630 2.270 -16.368 1.766 494 1HE LYS 630 1HE LYS 630 3.129 -14.196 0.090 495 2HE LYS 630 2HE LYS 630 4.376 -15.441 0.107 496 1HZ LYS 630 1HZ LYS 630 1.603 -16.316 -0.153 497 2HZ LYS 630 2HZ LYS 630 2.310 -15.561 -1.502 498 3HZ LYS 630 3HZ LYS 630 3.012 -16.961 -0.843 499 H ASN 631 H ASN 631 1.706 -14.880 5.447 500 HA ASN 631 HA ASN 631 3.083 -16.253 6.794 501 1HB ASN 631 1HB ASN 631 2.868 -18.461 4.756 502 2HB ASN 631 2HB ASN 631 3.177 -18.585 6.488 503 2HD2 ASN 631 2HD2 ASN 631 0.794 -19.216 4.309 504 1HD2 ASN 631 1HD2 ASN 631 -0.574 -18.945 5.276 505 H GLY 632 H GLY 632 4.012 -14.429 4.810 506 1HA GLY 632 1HA GLY 632 6.730 -14.806 4.744 507 2HA GLY 632 2HA GLY 632 5.887 -13.953 3.452 508 H SER 633 H SER 633 5.569 -15.014 1.477 509 HA SER 633 HA SER 633 7.270 -17.365 1.029 510 1HB SER 633 1HB SER 633 4.260 -17.481 0.793 511 2HB SER 633 2HB SER 633 5.304 -18.571 -0.113 512 HG SER 633 HG SER 633 5.725 -19.619 1.666 513 H SER 634 H SER 634 7.469 -14.734 0.061 514 HA SER 634 HA SER 634 7.858 -15.077 -2.691 515 1HB SER 634 1HB SER 634 5.112 -14.962 -2.156 516 2HB SER 634 2HB SER 634 5.515 -13.346 -2.729 517 HG SER 634 HG SER 634 5.196 -15.532 -4.155 518 H ALA 635 H ALA 635 6.926 -12.420 -3.534 519 HA ALA 635 HA ALA 635 9.001 -10.847 -2.139 520 1HB ALA 635 1HB ALA 635 7.302 -10.242 -4.576 521 2HB ALA 635 2HB ALA 635 8.992 -10.750 -4.572 522 3HB ALA 635 3HB ALA 635 8.545 -9.168 -3.933 523 H THR 636 H THR 636 8.526 -9.285 -0.666 524 HA THR 636 HA THR 636 6.015 -9.007 0.530 525 HB THR 636 HB THR 636 7.320 -6.497 0.774 526 HG1 THR 636 HG1 THR 636 9.409 -7.050 1.063 527 1HG2 THR 636 1HG2 THR 636 6.166 -8.256 2.421 528 2HG2 THR 636 2HG2 THR 636 7.848 -8.707 2.703 529 3HG2 THR 636 3HG2 THR 636 7.316 -7.054 3.007 530 HA PRO 637 HA PRO 637 3.747 -6.189 -1.972 531 1HB PRO 637 1HB PRO 637 2.782 -4.355 -0.165 532 2HB PRO 637 2HB PRO 637 2.180 -6.017 -0.287 533 1HG PRO 637 1HG PRO 637 3.942 -4.808 1.790 534 2HG PRO 637 2HG PRO 637 2.851 -6.198 1.915 535 1HD PRO 637 1HD PRO 637 5.669 -6.310 1.624 536 2HD PRO 637 2HD PRO 637 4.541 -7.673 1.448 537 H GLY 638 H GLY 638 3.504 -3.778 -2.607 538 1HA GLY 638 1HA GLY 638 5.687 -2.553 -3.553 539 2HA GLY 638 2HA GLY 638 5.833 -2.113 -1.853 540 H ALA 639 H ALA 639 5.359 0.071 -1.960 541 HA ALA 639 HA ALA 639 2.567 0.767 -2.667 542 1HB ALA 639 1HB ALA 639 3.732 1.492 -0.487 543 2HB ALA 639 2HB ALA 639 4.639 2.624 -1.491 544 3HB ALA 639 3HB ALA 639 2.882 2.744 -1.393 545 H THR 640 H THR 640 2.081 1.910 -4.483 546 HA THR 640 HA THR 640 4.335 2.685 -6.256 547 HB THR 640 HB THR 640 1.509 2.936 -7.075 548 HG1 THR 640 HG1 THR 640 1.482 0.672 -7.498 549 1HG2 THR 640 1HG2 THR 640 3.417 3.456 -8.585 550 2HG2 THR 640 2HG2 THR 640 3.952 1.782 -8.439 551 3HG2 THR 640 3HG2 THR 640 2.406 2.151 -9.205 552 H CYS 641 H CYS 641 4.594 4.742 -7.016 553 HA CYS 641 HA CYS 641 2.658 6.862 -6.536 554 1HB CYS 641 1HB CYS 641 5.029 6.518 -4.768 555 2HB CYS 641 2HB CYS 641 4.667 8.157 -5.300 556 H ALA 642 H ALA 642 2.921 6.989 -8.856 557 HA ALA 642 HA ALA 642 5.102 8.779 -9.644 558 1HB ALA 642 1HB ALA 642 5.133 6.728 -11.627 559 2HB ALA 642 2HB ALA 642 5.367 5.956 -10.057 560 3HB ALA 642 3HB ALA 642 6.457 7.242 -10.577 561 H THR 643 H THR 643 4.700 9.718 -11.764 562 HA THR 643 HA THR 643 1.888 9.279 -12.681 563 HB THR 643 HB THR 643 1.845 11.594 -13.386 564 HG1 THR 643 HG1 THR 643 4.407 11.960 -12.288 565 1HG2 THR 643 1HG2 THR 643 2.917 11.160 -10.593 566 2HG2 THR 643 2HG2 THR 643 2.298 12.715 -11.147 567 3HG2 THR 643 3HG2 THR 643 1.232 11.310 -11.089 568 H GLY 644 H GLY 644 2.070 7.968 -14.431 569 1HA GLY 644 1HA GLY 644 4.323 8.279 -16.308 570 2HA GLY 644 2HA GLY 644 2.727 8.653 -16.957 No H/Q in entry = 570
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